NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
542219 | 2lgy | 17828 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 8.507 -0.104 -0.838 2 H2 MET 1 HT2 MET 1 6.842 0.181 -0.876 3 H3 MET 1 HT3 MET 1 7.910 1.474 -1.032 4 HA MET 1 HA MET 1 7.580 1.227 -3.216 5 HB2 MET 1 HB2 MET 1 9.341 -1.093 -2.460 6 HB3 MET 1 HB1 MET 1 8.797 -0.961 -4.131 7 HG2 MET 1 HG2 MET 1 10.137 1.335 -2.662 8 HG3 MET 1 HG1 MET 1 11.027 0.145 -3.590 9 HE1 MET 1 HE1 MET 1 11.794 2.564 -4.517 10 HE2 MET 1 HE2 MET 1 10.453 3.553 -3.961 11 HE3 MET 1 HE3 MET 1 10.847 3.513 -5.672 12 HA PRO 2 HA PRO 2 3.863 -0.982 -4.242 13 HB2 PRO 2 HB2 PRO 2 5.264 -2.016 -6.660 14 HB3 PRO 2 HB1 PRO 2 3.709 -1.188 -6.511 15 HG2 PRO 2 HG2 PRO 2 5.772 0.108 -7.426 16 HG3 PRO 2 HG1 PRO 2 4.667 0.912 -6.294 17 HD2 PRO 2 HD2 PRO 2 7.423 -0.133 -5.772 18 HD3 PRO 2 HD1 PRO 2 6.575 1.267 -5.074 19 H THR 3 HN THR 3 6.817 -2.834 -4.998 20 HA THR 3 HA THR 3 5.546 -5.351 -4.343 21 HB THR 3 HB THR 3 8.505 -4.814 -4.693 22 HG1 THR 3 HG1 THR 3 8.161 -4.683 -6.781 23 HG21 THR 3 HG21 THR 3 6.789 -7.297 -5.065 24 HG22 THR 3 HG22 THR 3 7.941 -7.002 -3.760 25 HG23 THR 3 HG23 THR 3 8.514 -7.186 -5.407 26 H GLN 4 HN GLN 4 5.379 -6.102 -2.320 27 HA GLN 4 HA GLN 4 6.429 -4.586 -0.128 28 HB2 GLN 4 HB2 GLN 4 4.936 -7.225 -0.204 29 HB3 GLN 4 HB1 GLN 4 5.320 -6.331 1.252 30 HG2 GLN 4 HG2 GLN 4 3.111 -5.644 0.748 31 HG3 GLN 4 HG1 GLN 4 4.109 -4.320 0.180 32 HE21 GLN 4 HE21 GLN 4 2.077 -3.960 -1.222 33 HE22 GLN 4 HE22 GLN 4 1.993 -4.774 -2.705 34 H ASP 5 HN ASP 5 7.284 -6.116 1.745 35 HA ASP 5 HA ASP 5 9.796 -7.226 0.777 36 HB2 ASP 5 HB2 ASP 5 8.690 -6.577 3.507 37 HB3 ASP 5 HB1 ASP 5 10.066 -7.645 3.332 38 H ILE 6 HN ILE 6 10.415 -9.304 2.139 39 HA ILE 6 HA ILE 6 8.137 -11.162 2.036 40 HB ILE 6 HB ILE 6 9.624 -12.892 1.211 41 HG12 ILE 6 HG12 ILE 6 11.751 -10.740 0.924 42 HG13 ILE 6 HG11 ILE 6 11.752 -11.907 2.245 43 HG21 ILE 6 HG21 ILE 6 10.237 -11.734 -1.056 44 HG22 ILE 6 HG22 ILE 6 9.517 -10.302 -0.349 45 HG23 ILE 6 HG23 ILE 6 8.540 -11.755 -0.578 46 HD11 ILE 6 HD11 ILE 6 11.692 -12.692 -0.673 47 HD12 ILE 6 HD12 ILE 6 11.967 -13.744 0.713 48 HD13 ILE 6 HD13 ILE 6 13.183 -12.542 0.256 49 H ARG 7 HN ARG 7 8.347 -12.956 3.481 50 HA ARG 7 HA ARG 7 9.881 -12.163 5.863 51 HB2 ARG 7 HB2 ARG 7 7.664 -14.182 5.969 52 HB3 ARG 7 HB1 ARG 7 8.264 -13.074 7.209 53 HG2 ARG 7 HG2 ARG 7 7.427 -11.259 5.346 54 HG3 ARG 7 HG1 ARG 7 6.294 -12.567 5.037 55 HD2 ARG 7 HD2 ARG 7 5.161 -11.440 6.689 56 HD3 ARG 7 HD1 ARG 7 6.027 -12.603 7.645 57 HE ARG 7 HE ARG 7 7.654 -10.903 8.242 58 HH11 ARG 7 HH21 ARG 7 4.842 -9.734 6.461 59 HH12 ARG 7 HH22 ARG 7 5.057 -8.123 6.932 60 HH21 ARG 7 HH11 ARG 7 7.965 -8.719 8.788 61 HH22 ARG 7 HH12 ARG 7 6.863 -7.512 8.274 62 H LEU 8 HN LEU 8 11.551 -13.287 6.402 63 HA LEU 8 HA LEU 8 11.965 -15.967 5.229 64 HB2 LEU 8 HB2 LEU 8 13.644 -14.452 4.467 65 HB3 LEU 8 HB1 LEU 8 13.850 -13.784 6.083 66 HG LEU 8 HG LEU 8 14.717 -16.009 6.866 67 HD11 LEU 8 HD11 LEU 8 13.945 -16.752 4.109 68 HD12 LEU 8 HD12 LEU 8 14.066 -17.728 5.569 69 HD13 LEU 8 HD13 LEU 8 15.509 -17.362 4.646 70 HD21 LEU 8 HD21 LEU 8 16.152 -14.089 5.850 71 HD22 LEU 8 HD22 LEU 8 16.314 -15.160 4.452 72 HD23 LEU 8 HD23 LEU 8 16.885 -15.681 6.033 73 H TRP 9 HN TRP 9 12.129 -17.652 6.562 74 HA TRP 9 HA TRP 9 12.075 -17.154 9.468 75 HB2 TRP 9 HB2 TRP 9 12.064 -19.868 8.173 76 HB3 TRP 9 HB1 TRP 9 11.452 -19.389 9.745 77 HD1 TRP 9 HD1 TRP 9 9.867 -16.776 8.510 78 HE1 TRP 9 HE1 TRP 9 7.606 -17.263 7.325 79 HE3 TRP 9 HE3 TRP 9 10.488 -21.698 7.485 80 HZ2 TRP 9 HZ2 TRP 9 6.274 -19.494 6.092 81 HZ3 TRP 9 HZ3 TRP 9 8.810 -22.976 6.331 82 HH2 TRP 9 HH2 TRP 9 6.635 -21.871 5.610 83 H VAL 10 HN VAL 10 13.830 -17.519 10.716 84 HA VAL 10 HA VAL 10 16.079 -18.916 9.439 85 HB VAL 10 HB VAL 10 16.306 -16.556 11.303 86 HG11 VAL 10 HG11 VAL 10 18.721 -16.668 10.553 87 HG12 VAL 10 HG12 VAL 10 18.359 -18.235 9.852 88 HG13 VAL 10 HG13 VAL 10 18.209 -17.996 11.589 89 HG21 VAL 10 HG21 VAL 10 17.276 -15.478 9.190 90 HG22 VAL 10 HG22 VAL 10 15.532 -15.730 9.181 91 HG23 VAL 10 HG23 VAL 10 16.580 -16.823 8.290 92 H SER 11 HN SER 11 16.860 -20.540 10.512 93 HA SER 11 HA SER 11 15.863 -21.134 13.209 94 HB2 SER 11 HB2 SER 11 17.754 -22.801 11.576 95 HB3 SER 11 HB1 SER 11 16.714 -23.300 12.896 96 HG SER 11 HG SER 11 15.989 -22.509 10.239 97 H VAL 12 HN VAL 12 17.069 -20.612 14.948 98 HA VAL 12 HA VAL 12 19.863 -19.851 14.479 99 HB VAL 12 HB VAL 12 18.098 -19.233 16.822 100 HG11 VAL 12 HG11 VAL 12 20.588 -19.084 17.176 101 HG12 VAL 12 HG12 VAL 12 19.783 -17.531 17.330 102 HG13 VAL 12 HG13 VAL 12 20.666 -17.917 15.856 103 HG21 VAL 12 HG21 VAL 12 17.707 -17.038 15.800 104 HG22 VAL 12 HG22 VAL 12 17.219 -18.274 14.654 105 HG23 VAL 12 HG23 VAL 12 18.757 -17.443 14.446 106 H GLU 13 HN GLU 13 21.362 -21.202 15.124 107 HA GLU 13 HA GLU 13 20.778 -23.153 17.278 108 HB2 GLU 13 HB2 GLU 13 22.443 -23.382 14.771 109 HB3 GLU 13 HB1 GLU 13 22.659 -24.458 16.146 110 HG2 GLU 13 HG2 GLU 13 19.857 -24.084 15.179 111 HG3 GLU 13 HG1 GLU 13 20.958 -25.060 14.195 112 H ASP 14 HN ASP 14 22.058 -23.081 19.013 113 HA ASP 14 HA ASP 14 24.335 -21.197 18.955 114 HB2 ASP 14 HB2 ASP 14 22.380 -20.861 20.480 115 HB3 ASP 14 HB1 ASP 14 22.954 -22.273 21.392 116 H ALA 15 HN ALA 15 26.177 -21.677 20.048 117 HA ALA 15 HA ALA 15 27.278 -24.336 19.902 118 HB1 ALA 15 HB1 ALA 15 29.100 -23.323 21.340 119 HB2 ALA 15 HB2 ALA 15 28.182 -21.821 21.342 120 HB3 ALA 15 HB3 ALA 15 28.816 -22.464 19.827 121 H GLN 16 HN GLN 16 25.707 -22.354 22.270 122 HA GLN 16 HA GLN 16 26.180 -24.043 24.547 123 HB2 GLN 16 HB2 GLN 16 24.482 -21.625 24.020 124 HB3 GLN 16 HB1 GLN 16 24.310 -22.530 25.514 125 HG2 GLN 16 HG2 GLN 16 26.267 -21.777 26.358 126 HG3 GLN 16 HG1 GLN 16 27.140 -22.060 24.861 127 HE21 GLN 16 HE21 GLN 16 25.688 -20.312 23.110 128 HE22 GLN 16 HE22 GLN 16 25.929 -18.736 23.614 129 H MET 17 HN MET 17 24.672 -24.935 21.996 130 HA MET 17 HA MET 17 23.309 -26.593 21.518 131 HB2 MET 17 HB2 MET 17 23.582 -27.187 24.471 132 HB3 MET 17 HB1 MET 17 22.734 -28.239 23.351 133 HG2 MET 17 HG2 MET 17 24.748 -28.437 21.952 134 HG3 MET 17 HG1 MET 17 25.615 -27.366 23.050 135 HE1 MET 17 HE1 MET 17 26.965 -29.543 22.345 136 HE2 MET 17 HE2 MET 17 25.943 -30.972 22.252 137 HE3 MET 17 HE3 MET 17 27.163 -30.876 23.497 138 H HIS 18 HN HIS 18 21.987 -24.100 21.900 139 HA HIS 18 HA HIS 18 19.322 -25.228 22.354 140 HB2 HIS 18 HB2 HIS 18 18.537 -22.865 23.028 141 HB3 HIS 18 HB1 HIS 18 19.406 -23.792 24.243 142 HD1 HIS 18 HD1 HIS 18 21.125 -22.407 25.403 143 HD2 HIS 18 HD2 HIS 18 20.588 -21.203 21.447 144 HE1 HIS 18 HE1 HIS 18 22.719 -20.485 25.016 145 HE2 HIS 18 HE2 HIS 18 22.435 -19.766 22.590 146 H THR 19 HN THR 19 17.728 -24.643 20.948 147 HA THR 19 HA THR 19 18.706 -23.315 18.489 148 HB THR 19 HB THR 19 16.563 -25.430 18.640 149 HG1 THR 19 HG1 THR 19 19.302 -25.797 17.929 150 HG21 THR 19 HG21 THR 19 18.248 -24.277 16.401 151 HG22 THR 19 HG22 THR 19 16.520 -24.123 16.629 152 HG23 THR 19 HG23 THR 19 17.208 -25.691 16.222 153 H VAL 20 HN VAL 20 17.492 -21.611 17.779 154 HA VAL 20 HA VAL 20 14.687 -21.461 18.624 155 HB VAL 20 HB VAL 20 15.003 -18.892 18.823 156 HG11 VAL 20 HG11 VAL 20 15.886 -20.933 20.877 157 HG12 VAL 20 HG12 VAL 20 14.341 -20.097 20.750 158 HG13 VAL 20 HG13 VAL 20 15.775 -19.218 21.242 159 HG21 VAL 20 HG21 VAL 20 17.190 -18.346 18.293 160 HG22 VAL 20 HG22 VAL 20 17.859 -19.884 18.858 161 HG23 VAL 20 HG23 VAL 20 17.404 -18.643 20.004 162 H THR 21 HN THR 21 13.359 -20.043 17.315 163 HA THR 21 HA THR 21 14.332 -19.987 14.516 164 HB THR 21 HB THR 21 11.472 -20.381 15.419 165 HG1 THR 21 HG1 THR 21 13.603 -22.233 15.159 166 HG21 THR 21 HG21 THR 21 11.118 -21.126 13.156 167 HG22 THR 21 HG22 THR 21 12.832 -21.070 12.792 168 HG23 THR 21 HG23 THR 21 11.939 -19.580 13.080 169 H ILE 22 HN ILE 22 14.143 -18.029 13.479 170 HA ILE 22 HA ILE 22 12.343 -16.040 14.695 171 HB ILE 22 HB ILE 22 13.967 -14.275 14.245 172 HG12 ILE 22 HG12 ILE 22 15.870 -16.526 13.470 173 HG13 ILE 22 HG11 ILE 22 15.085 -15.410 12.343 174 HG21 ILE 22 HG21 ILE 22 15.419 -14.714 16.062 175 HG22 ILE 22 HG22 ILE 22 15.415 -16.445 15.766 176 HG23 ILE 22 HG23 ILE 22 13.979 -15.663 16.427 177 HD11 ILE 22 HD11 ILE 22 16.234 -13.536 13.184 178 HD12 ILE 22 HD12 ILE 22 17.472 -14.786 13.085 179 HD13 ILE 22 HD13 ILE 22 16.753 -14.379 14.639 180 H TRP 23 HN TRP 23 11.547 -14.461 13.273 181 HA TRP 23 HA TRP 23 11.493 -15.299 10.437 182 HB2 TRP 23 HB2 TRP 23 9.354 -13.884 12.061 183 HB3 TRP 23 HB1 TRP 23 9.233 -14.287 10.354 184 HD1 TRP 23 HD1 TRP 23 8.319 -16.624 9.779 185 HE1 TRP 23 HE1 TRP 23 7.863 -18.790 11.087 186 HE3 TRP 23 HE3 TRP 23 10.242 -15.336 14.334 187 HZ2 TRP 23 HZ2 TRP 23 8.248 -19.839 13.721 188 HZ3 TRP 23 HZ3 TRP 23 10.174 -16.938 16.209 189 HH2 TRP 23 HH2 TRP 23 9.177 -19.184 15.897 190 H LEU 24 HN LEU 24 12.405 -13.877 9.081 191 HA LEU 24 HA LEU 24 12.820 -11.109 10.046 192 HB2 LEU 24 HB2 LEU 24 14.427 -12.568 7.926 193 HB3 LEU 24 HB1 LEU 24 14.756 -11.010 8.635 194 HG LEU 24 HG LEU 24 14.670 -13.590 10.236 195 HD11 LEU 24 HD11 LEU 24 16.589 -13.341 8.593 196 HD12 LEU 24 HD12 LEU 24 17.026 -13.510 10.298 197 HD13 LEU 24 HD13 LEU 24 17.083 -11.922 9.533 198 HD21 LEU 24 HD21 LEU 24 15.164 -10.688 10.916 199 HD22 LEU 24 HD22 LEU 24 15.989 -11.956 11.800 200 HD23 LEU 24 HD23 LEU 24 14.226 -11.906 11.795 201 H THR 25 HN THR 25 12.106 -9.436 8.862 202 HA THR 25 HA THR 25 10.623 -10.042 6.383 203 HB THR 25 HB THR 25 10.579 -7.460 7.939 204 HG1 THR 25 HG1 THR 25 10.001 -9.488 9.144 205 HG21 THR 25 HG21 THR 25 8.486 -7.110 6.807 206 HG22 THR 25 HG22 THR 25 8.478 -8.759 6.168 207 HG23 THR 25 HG23 THR 25 9.661 -7.595 5.600 208 H VAL 26 HN VAL 26 11.771 -9.704 4.565 209 HA VAL 26 HA VAL 26 13.373 -7.275 4.289 210 HB VAL 26 HB VAL 26 15.335 -8.578 3.446 211 HG11 VAL 26 HG11 VAL 26 15.179 -7.668 5.782 212 HG12 VAL 26 HG12 VAL 26 16.232 -9.072 5.586 213 HG13 VAL 26 HG13 VAL 26 14.628 -9.271 6.289 214 HG21 VAL 26 HG21 VAL 26 15.424 -10.975 4.327 215 HG22 VAL 26 HG22 VAL 26 14.408 -10.711 2.909 216 HG23 VAL 26 HG23 VAL 26 13.672 -10.891 4.502 217 H ARG 27 HN ARG 27 14.588 -7.738 1.971 218 HA ARG 27 HA ARG 27 12.539 -8.755 0.156 219 HB2 ARG 27 HB2 ARG 27 13.323 -7.055 -1.523 220 HB3 ARG 27 HB1 ARG 27 12.462 -6.363 -0.157 221 HG2 ARG 27 HG2 ARG 27 15.475 -6.593 -0.084 222 HG3 ARG 27 HG1 ARG 27 14.723 -5.275 -0.956 223 HD2 ARG 27 HD2 ARG 27 14.593 -5.830 2.024 224 HD3 ARG 27 HD1 ARG 27 15.070 -4.367 1.208 225 HE ARG 27 HE ARG 27 12.375 -5.209 1.861 226 HH11 ARG 27 HH21 ARG 27 14.372 -3.212 -0.178 227 HH12 ARG 27 HH22 ARG 27 13.147 -2.071 -0.539 228 HH21 ARG 27 HH11 ARG 27 10.729 -3.711 1.401 229 HH22 ARG 27 HH12 ARG 27 11.039 -2.356 0.374 230 HA PRO 28 HA PRO 28 15.646 -11.526 -1.302 231 HB2 PRO 28 HB2 PRO 28 14.845 -10.751 -4.061 232 HB3 PRO 28 HB1 PRO 28 14.907 -12.353 -3.295 233 HG2 PRO 28 HG2 PRO 28 12.599 -11.170 -3.732 234 HG3 PRO 28 HG1 PRO 28 12.882 -12.078 -2.230 235 HD2 PRO 28 HD2 PRO 28 12.835 -9.119 -2.662 236 HD3 PRO 28 HD1 PRO 28 12.236 -10.084 -1.282 237 H ASP 29 HN ASP 29 15.461 -8.268 -2.454 238 HA ASP 29 HA ASP 29 17.870 -8.032 -3.931 239 HB2 ASP 29 HB2 ASP 29 16.275 -5.977 -2.396 240 HB3 ASP 29 HB1 ASP 29 17.626 -5.613 -3.440 241 H MET 30 HN MET 30 17.123 -8.222 -0.572 242 HA MET 30 HA MET 30 19.429 -6.837 0.347 243 HB2 MET 30 HB2 MET 30 17.463 -8.643 1.711 244 HB3 MET 30 HB1 MET 30 18.920 -8.106 2.538 245 HG2 MET 30 HG2 MET 30 18.325 -5.775 2.116 246 HG3 MET 30 HG1 MET 30 16.888 -6.279 1.251 247 HE1 MET 30 HE1 MET 30 19.002 -6.809 4.133 248 HE2 MET 30 HE2 MET 30 18.037 -7.901 5.122 249 HE3 MET 30 HE3 MET 30 18.058 -6.189 5.495 250 H THR 31 HN THR 31 20.932 -8.066 1.861 251 HA THR 31 HA THR 31 21.742 -10.624 0.643 252 HB THR 31 HB THR 31 23.268 -8.971 -0.226 253 HG1 THR 31 HG1 THR 31 24.294 -10.835 0.434 254 HG21 THR 31 HG21 THR 31 23.012 -7.924 2.496 255 HG22 THR 31 HG22 THR 31 23.343 -7.059 0.986 256 HG23 THR 31 HG23 THR 31 24.648 -7.875 1.852 257 H VAL 32 HN VAL 32 23.314 -11.763 2.025 258 HA VAL 32 HA VAL 32 22.169 -12.222 4.554 259 HB VAL 32 HB VAL 32 24.896 -13.041 3.525 260 HG11 VAL 32 HG11 VAL 32 24.805 -14.783 5.228 261 HG12 VAL 32 HG12 VAL 32 23.224 -14.204 5.772 262 HG13 VAL 32 HG13 VAL 32 24.652 -13.198 5.982 263 HG21 VAL 32 HG21 VAL 32 23.789 -15.150 2.923 264 HG22 VAL 32 HG22 VAL 32 22.996 -13.791 2.112 265 HG23 VAL 32 HG23 VAL 32 22.247 -14.532 3.525 266 H ALA 33 HN ALA 33 25.101 -10.530 3.497 267 HA ALA 33 HA ALA 33 26.090 -9.854 6.009 268 HB1 ALA 33 HB1 ALA 33 27.201 -7.950 4.916 269 HB2 ALA 33 HB2 ALA 33 26.191 -8.160 3.491 270 HB3 ALA 33 HB3 ALA 33 27.348 -9.409 3.948 271 H SER 34 HN SER 34 23.795 -8.047 4.051 272 HA SER 34 HA SER 34 23.319 -5.986 5.976 273 HB2 SER 34 HB2 SER 34 21.350 -6.987 3.915 274 HB3 SER 34 HB1 SER 34 21.447 -5.399 4.653 275 HG SER 34 HG SER 34 23.651 -5.334 3.672 276 H LEU 35 HN LEU 35 21.710 -9.037 5.196 277 HA LEU 35 HA LEU 35 19.588 -8.839 7.015 278 HB2 LEU 35 HB2 LEU 35 19.563 -10.395 5.130 279 HB3 LEU 35 HB1 LEU 35 20.912 -11.274 5.838 280 HG LEU 35 HG LEU 35 19.561 -11.922 7.768 281 HD11 LEU 35 HD11 LEU 35 17.723 -9.877 6.636 282 HD12 LEU 35 HD12 LEU 35 18.023 -10.364 8.304 283 HD13 LEU 35 HD13 LEU 35 16.961 -11.331 7.294 284 HD21 LEU 35 HD21 LEU 35 17.982 -12.350 5.222 285 HD22 LEU 35 HD22 LEU 35 18.005 -13.387 6.653 286 HD23 LEU 35 HD23 LEU 35 19.442 -13.257 5.642 287 H LYS 36 HN LYS 36 22.814 -10.321 7.317 288 HA LYS 36 HA LYS 36 22.584 -11.590 9.751 289 HB2 LYS 36 HB2 LYS 36 24.427 -11.658 8.052 290 HB3 LYS 36 HB1 LYS 36 24.909 -10.051 8.599 291 HG2 LYS 36 HG2 LYS 36 24.896 -11.252 10.973 292 HG3 LYS 36 HG1 LYS 36 25.171 -12.696 10.009 293 HD2 LYS 36 HD2 LYS 36 26.760 -10.181 10.098 294 HD3 LYS 36 HD1 LYS 36 27.372 -11.795 10.542 295 HE2 LYS 36 HE2 LYS 36 26.840 -10.547 7.837 296 HE3 LYS 36 HE1 LYS 36 28.296 -11.331 8.396 297 HZ1 LYS 36 HZ1 LYS 36 25.784 -12.918 8.072 298 HZ2 LYS 36 HZ2 LYS 36 27.418 -13.431 8.054 299 HZ3 LYS 36 HZ3 LYS 36 26.806 -12.545 6.776 300 H ASP 37 HN ASP 37 23.429 -8.308 8.830 301 HA ASP 37 HA ASP 37 24.078 -7.309 11.375 302 HB2 ASP 37 HB2 ASP 37 24.660 -6.234 9.205 303 HB3 ASP 37 HB1 ASP 37 22.980 -5.764 9.045 304 H MET 38 HN MET 38 20.963 -7.096 9.577 305 HA MET 38 HA MET 38 19.674 -5.601 11.599 306 HB2 MET 38 HB2 MET 38 17.741 -7.398 10.455 307 HB3 MET 38 HB1 MET 38 17.904 -5.669 10.297 308 HG2 MET 38 HG2 MET 38 19.506 -5.912 8.477 309 HG3 MET 38 HG1 MET 38 19.430 -7.663 8.615 310 HE1 MET 38 HE1 MET 38 17.191 -8.732 9.085 311 HE2 MET 38 HE2 MET 38 16.000 -8.768 7.818 312 HE3 MET 38 HE3 MET 38 15.771 -7.687 9.187 313 H VAL 39 HN VAL 39 20.090 -9.028 11.162 314 HA VAL 39 HA VAL 39 18.498 -9.851 13.335 315 HB VAL 39 HB VAL 39 20.969 -11.130 12.102 316 HG11 VAL 39 HG11 VAL 39 18.929 -12.668 13.681 317 HG12 VAL 39 HG12 VAL 39 20.222 -11.849 14.553 318 HG13 VAL 39 HG13 VAL 39 20.600 -13.054 13.324 319 HG21 VAL 39 HG21 VAL 39 18.090 -11.025 11.411 320 HG22 VAL 39 HG22 VAL 39 18.756 -12.650 11.451 321 HG23 VAL 39 HG23 VAL 39 19.476 -11.433 10.406 322 H PHE 40 HN PHE 40 21.858 -8.815 13.064 323 HA PHE 40 HA PHE 40 22.518 -9.139 15.807 324 HB2 PHE 40 HB2 PHE 40 24.322 -8.840 14.256 325 HB3 PHE 40 HB1 PHE 40 23.640 -7.336 13.655 326 HD1 PHE 40 HD2 PHE 40 24.609 -8.831 16.973 327 HD2 PHE 40 HD1 PHE 40 24.588 -5.374 14.429 328 HE1 PHE 40 HE2 PHE 40 25.858 -7.561 18.685 329 HE2 PHE 40 HE1 PHE 40 25.825 -4.105 16.141 330 HZ PHE 40 HZ PHE 40 26.467 -5.196 18.278 331 H LEU 41 HN LEU 41 21.278 -6.441 13.882 332 HA LEU 41 HA LEU 41 21.136 -4.524 15.961 333 HB2 LEU 41 HB2 LEU 41 19.240 -4.845 13.613 334 HB3 LEU 41 HB1 LEU 41 19.450 -3.414 14.607 335 HG LEU 41 HG LEU 41 21.543 -4.698 12.895 336 HD11 LEU 41 HD11 LEU 41 20.074 -3.628 11.408 337 HD12 LEU 41 HD12 LEU 41 21.336 -2.435 11.663 338 HD13 LEU 41 HD13 LEU 41 19.794 -2.283 12.513 339 HD21 LEU 41 HD21 LEU 41 21.634 -2.475 14.900 340 HD22 LEU 41 HD22 LEU 41 22.616 -2.338 13.422 341 HD23 LEU 41 HD23 LEU 41 22.812 -3.732 14.487 342 H ASP 42 HN ASP 42 18.900 -6.829 14.701 343 HA ASP 42 HA ASP 42 16.724 -6.092 16.433 344 HB2 ASP 42 HB2 ASP 42 16.590 -7.299 14.083 345 HB3 ASP 42 HB1 ASP 42 16.770 -8.741 15.047 346 H TYR 43 HN TYR 43 18.887 -8.906 16.433 347 HA TYR 43 HA TYR 43 17.739 -9.713 19.050 348 HB2 TYR 43 HB2 TYR 43 19.307 -11.395 17.074 349 HB3 TYR 43 HB1 TYR 43 18.520 -11.925 18.552 350 HD1 TYR 43 HD2 TYR 43 16.033 -11.826 18.791 351 HD2 TYR 43 HD1 TYR 43 18.028 -11.017 15.078 352 HE1 TYR 43 HE2 TYR 43 13.905 -12.098 17.592 353 HE2 TYR 43 HE1 TYR 43 15.899 -11.289 13.868 354 HH TYR 43 HH TYR 43 13.395 -10.945 14.660 355 H GLY 44 HN GLY 44 20.441 -8.113 17.908 356 HA2 GLY 44 HA2 GLY 44 22.451 -7.615 18.941 357 HA3 GLY 44 HA1 GLY 44 21.838 -8.423 20.374 358 H PHE 45 HN PHE 45 21.844 -10.024 17.315 359 HA PHE 45 HA PHE 45 23.447 -12.190 18.350 360 HB2 PHE 45 HB2 PHE 45 22.032 -11.660 15.746 361 HB3 PHE 45 HB1 PHE 45 23.141 -13.006 15.917 362 HD1 PHE 45 HD1 PHE 45 21.538 -12.222 19.070 363 HD2 PHE 45 HD2 PHE 45 20.963 -14.316 15.339 364 HE1 PHE 45 HE1 PHE 45 19.780 -13.593 20.100 365 HE2 PHE 45 HE2 PHE 45 19.201 -15.681 16.397 366 HZ PHE 45 HZ PHE 45 18.608 -15.320 18.779 367 HA PRO 46 HA PRO 46 27.162 -9.727 17.215 368 HB2 PRO 46 HB2 PRO 46 28.637 -12.154 17.614 369 HB3 PRO 46 HB1 PRO 46 28.630 -10.696 18.624 370 HG2 PRO 46 HG2 PRO 46 27.152 -13.220 18.981 371 HG3 PRO 46 HG1 PRO 46 27.531 -11.954 20.160 372 HD2 PRO 46 HD2 PRO 46 25.041 -12.332 19.334 373 HD3 PRO 46 HD1 PRO 46 25.688 -10.712 19.679 374 HA PRO 47 HA PRO 47 26.934 -11.279 12.934 375 HB2 PRO 47 HB2 PRO 47 28.894 -9.613 11.947 376 HB3 PRO 47 HB1 PRO 47 27.191 -9.136 12.154 377 HG2 PRO 47 HG2 PRO 47 29.531 -8.606 13.938 378 HG3 PRO 47 HG1 PRO 47 28.193 -7.535 13.473 379 HD2 PRO 47 HD2 PRO 47 28.193 -8.684 15.859 380 HD3 PRO 47 HD1 PRO 47 26.680 -8.523 14.943 381 H VAL 48 HN VAL 48 29.848 -10.896 14.826 382 HA VAL 48 HA VAL 48 31.547 -12.529 13.236 383 HB VAL 48 HB VAL 48 32.638 -11.138 14.834 384 HG11 VAL 48 HG11 VAL 48 31.839 -12.193 17.381 385 HG12 VAL 48 HG12 VAL 48 30.377 -11.739 16.511 386 HG13 VAL 48 HG13 VAL 48 31.654 -10.568 16.757 387 HG21 VAL 48 HG21 VAL 48 33.973 -12.697 16.072 388 HG22 VAL 48 HG22 VAL 48 33.523 -13.520 14.587 389 HG23 VAL 48 HG23 VAL 48 32.693 -13.899 16.100 390 H LEU 49 HN LEU 49 29.389 -13.161 15.947 391 HA LEU 49 HA LEU 49 29.972 -15.953 16.093 392 HB2 LEU 49 HB2 LEU 49 27.883 -14.180 17.295 393 HB3 LEU 49 HB1 LEU 49 27.697 -15.914 17.353 394 HG LEU 49 HG LEU 49 30.246 -15.860 18.198 395 HD11 LEU 49 HD11 LEU 49 30.958 -14.018 19.294 396 HD12 LEU 49 HD12 LEU 49 29.362 -13.300 19.434 397 HD13 LEU 49 HD13 LEU 49 30.201 -13.326 17.876 398 HD21 LEU 49 HD21 LEU 49 27.863 -16.414 19.385 399 HD22 LEU 49 HD22 LEU 49 28.322 -14.989 20.290 400 HD23 LEU 49 HD23 LEU 49 29.399 -16.395 20.233 401 H GLN 50 HN GLN 50 27.539 -14.003 14.496 402 HA GLN 50 HA GLN 50 25.760 -16.035 13.882 403 HB2 GLN 50 HB2 GLN 50 26.399 -13.533 12.322 404 HB3 GLN 50 HB1 GLN 50 25.118 -14.636 11.863 405 HG2 GLN 50 HG2 GLN 50 24.110 -14.340 14.139 406 HG3 GLN 50 HG1 GLN 50 25.327 -13.115 14.484 407 HE21 GLN 50 HE21 GLN 50 24.252 -11.103 14.299 408 HE22 GLN 50 HE22 GLN 50 23.269 -10.689 12.971 409 H GLN 51 HN GLN 51 26.164 -17.899 12.977 410 HA GLN 51 HA GLN 51 27.787 -17.968 10.510 411 HB2 GLN 51 HB2 GLN 51 26.975 -20.092 12.459 412 HB3 GLN 51 HB1 GLN 51 27.647 -20.500 10.880 413 HG2 GLN 51 HG2 GLN 51 29.658 -19.066 11.512 414 HG3 GLN 51 HG1 GLN 51 28.971 -18.962 13.134 415 HE21 GLN 51 HE21 GLN 51 29.047 -20.883 14.474 416 HE22 GLN 51 HE22 GLN 51 29.927 -22.259 14.036 417 H TRP 52 HN TRP 52 26.443 -17.624 8.852 418 HA TRP 52 HA TRP 52 23.632 -18.386 9.077 419 HB2 TRP 52 HB2 TRP 52 25.235 -16.559 7.316 420 HB3 TRP 52 HB1 TRP 52 23.685 -17.154 6.747 421 HD1 TRP 52 HD1 TRP 52 25.177 -15.247 9.762 422 HE1 TRP 52 HE1 TRP 52 23.302 -13.729 10.759 423 HE3 TRP 52 HE3 TRP 52 21.236 -16.685 6.870 424 HZ2 TRP 52 HZ2 TRP 52 20.534 -13.220 10.359 425 HZ3 TRP 52 HZ3 TRP 52 18.997 -15.665 7.195 426 HH2 TRP 52 HH2 TRP 52 18.664 -13.931 8.945 427 H VAL 53 HN VAL 53 22.716 -20.041 7.980 428 HA VAL 53 HA VAL 53 24.347 -21.400 5.930 429 HB VAL 53 HB VAL 53 22.677 -22.564 8.155 430 HG11 VAL 53 HG11 VAL 53 23.198 -24.777 7.187 431 HG12 VAL 53 HG12 VAL 53 23.956 -24.009 5.810 432 HG13 VAL 53 HG13 VAL 53 22.215 -23.834 6.069 433 HG21 VAL 53 HG21 VAL 53 25.599 -22.733 7.379 434 HG22 VAL 53 HG22 VAL 53 24.843 -23.786 8.578 435 HG23 VAL 53 HG23 VAL 53 24.916 -22.048 8.861 436 H ILE 54 HN ILE 54 23.425 -21.524 4.067 437 HA ILE 54 HA ILE 54 20.534 -21.772 3.766 438 HB ILE 54 HB ILE 54 22.216 -19.728 2.268 439 HG12 ILE 54 HG12 ILE 54 19.773 -19.311 4.019 440 HG13 ILE 54 HG11 ILE 54 21.419 -19.095 4.617 441 HG21 ILE 54 HG21 ILE 54 19.639 -19.235 1.551 442 HG22 ILE 54 HG22 ILE 54 19.600 -20.984 1.649 443 HG23 ILE 54 HG23 ILE 54 20.766 -20.178 0.599 444 HD11 ILE 54 HD11 ILE 54 20.154 -17.600 2.304 445 HD12 ILE 54 HD12 ILE 54 21.815 -17.387 2.862 446 HD13 ILE 54 HD13 ILE 54 20.463 -16.947 3.911 447 H GLY 55 HN GLY 55 20.080 -23.339 2.250 448 HA2 GLY 55 HA2 GLY 55 21.962 -25.091 1.311 449 HA3 GLY 55 HA1 GLY 55 20.417 -24.822 0.509 450 H GLN 56 HN GLN 56 20.837 -22.107 -0.188 451 HA GLN 56 HA GLN 56 22.770 -22.407 -2.385 452 HB2 GLN 56 HB2 GLN 56 20.729 -20.221 -2.059 453 HB3 GLN 56 HB1 GLN 56 21.574 -20.682 -3.531 454 HG2 GLN 56 HG2 GLN 56 19.550 -22.339 -2.021 455 HG3 GLN 56 HG1 GLN 56 19.302 -21.562 -3.588 456 HE21 GLN 56 HE21 GLN 56 22.110 -22.306 -4.461 457 HE22 GLN 56 HE22 GLN 56 22.033 -23.960 -4.819 458 H ARG 57 HN ARG 57 23.466 -21.772 0.435 459 HA ARG 57 HA ARG 57 24.204 -19.020 0.598 460 HB2 ARG 57 HB2 ARG 57 24.077 -20.495 2.617 461 HB3 ARG 57 HB1 ARG 57 25.527 -21.330 2.044 462 HG2 ARG 57 HG2 ARG 57 26.755 -19.128 2.066 463 HG3 ARG 57 HG1 ARG 57 25.321 -18.381 2.749 464 HD2 ARG 57 HD2 ARG 57 26.793 -18.891 4.567 465 HD3 ARG 57 HD1 ARG 57 25.455 -20.033 4.633 466 HE ARG 57 HE ARG 57 27.566 -21.145 3.092 467 HH11 ARG 57 HH21 ARG 57 26.683 -20.343 6.397 468 HH12 ARG 57 HH22 ARG 57 27.732 -21.503 7.077 469 HH21 ARG 57 HH11 ARG 57 28.945 -22.713 4.048 470 HH22 ARG 57 HH12 ARG 57 29.020 -22.882 5.733 471 H LEU 58 HN LEU 58 26.136 -18.032 0.140 472 HA LEU 58 HA LEU 58 28.282 -19.666 -1.031 473 HB2 LEU 58 HB2 LEU 58 27.221 -18.122 -2.777 474 HB3 LEU 58 HB1 LEU 58 27.756 -16.780 -1.757 475 HG LEU 58 HG LEU 58 30.105 -17.651 -1.896 476 HD11 LEU 58 HD11 LEU 58 30.465 -19.217 -3.883 477 HD12 LEU 58 HD12 LEU 58 28.777 -19.642 -3.735 478 HD13 LEU 58 HD13 LEU 58 29.892 -19.951 -2.395 479 HD21 LEU 58 HD21 LEU 58 28.767 -17.087 -4.560 480 HD22 LEU 58 HD22 LEU 58 30.481 -16.914 -4.194 481 HD23 LEU 58 HD23 LEU 58 29.299 -15.867 -3.396 482 H ALA 59 HN ALA 59 30.359 -19.037 -0.332 483 HA ALA 59 HA ALA 59 30.610 -18.267 2.299 484 HB1 ALA 59 HB1 ALA 59 32.536 -18.031 0.000 485 HB2 ALA 59 HB2 ALA 59 32.508 -19.254 1.272 486 HB3 ALA 59 HB3 ALA 59 32.980 -17.595 1.646 487 H ARG 60 HN ARG 60 30.217 -16.305 -0.547 488 HA ARG 60 HA ARG 60 31.101 -13.873 0.628 489 HB2 ARG 60 HB2 ARG 60 30.958 -14.330 -1.847 490 HB3 ARG 60 HB1 ARG 60 29.207 -14.093 -1.713 491 HG2 ARG 60 HG2 ARG 60 29.560 -11.850 -0.780 492 HG3 ARG 60 HG1 ARG 60 31.305 -12.065 -0.871 493 HD2 ARG 60 HD2 ARG 60 31.068 -12.366 -3.372 494 HD3 ARG 60 HD1 ARG 60 29.379 -11.975 -3.227 495 HE ARG 60 HE ARG 60 29.934 -9.739 -2.712 496 HH11 ARG 60 HH21 ARG 60 32.737 -11.769 -3.133 497 HH12 ARG 60 HH22 ARG 60 33.836 -10.470 -3.227 498 HH21 ARG 60 HH11 ARG 60 31.385 -8.006 -2.800 499 HH22 ARG 60 HH12 ARG 60 33.058 -8.263 -3.038 500 H ASP 61 HN ASP 61 30.156 -12.865 2.152 501 HA ASP 61 HA ASP 61 27.542 -13.299 3.184 502 HB2 ASP 61 HB2 ASP 61 29.723 -12.380 4.321 503 HB3 ASP 61 HB1 ASP 61 29.187 -10.844 3.673 504 H GLN 62 HN GLN 62 28.991 -11.057 0.975 505 HA GLN 62 HA GLN 62 27.026 -9.055 0.981 506 HB2 GLN 62 HB2 GLN 62 29.091 -9.735 -1.097 507 HB3 GLN 62 HB1 GLN 62 28.056 -8.316 -1.189 508 HG2 GLN 62 HG2 GLN 62 28.914 -7.562 1.008 509 HG3 GLN 62 HG1 GLN 62 29.957 -8.975 1.075 510 HE21 GLN 62 HE21 GLN 62 31.570 -6.964 1.167 511 HE22 GLN 62 HE22 GLN 62 32.186 -6.478 -0.339 512 H GLU 63 HN GLU 63 27.101 -12.053 -0.853 513 HA GLU 63 HA GLU 63 25.507 -11.162 -2.964 514 HB2 GLU 63 HB2 GLU 63 25.803 -13.987 -1.916 515 HB3 GLU 63 HB1 GLU 63 24.831 -13.579 -3.331 516 HG2 GLU 63 HG2 GLU 63 26.846 -12.459 -4.306 517 HG3 GLU 63 HG1 GLU 63 27.774 -13.065 -2.940 518 H THR 64 HN THR 64 23.319 -11.323 -3.499 519 HA THR 64 HA THR 64 21.701 -10.417 -1.441 520 HB THR 64 HB THR 64 19.856 -10.838 -3.282 521 HG1 THR 64 HG1 THR 64 21.728 -12.099 -4.415 522 HG21 THR 64 HG21 THR 64 21.270 -8.697 -2.499 523 HG22 THR 64 HG22 THR 64 20.127 -8.688 -3.828 524 HG23 THR 64 HG23 THR 64 21.853 -8.824 -4.169 525 H LEU 65 HN LEU 65 19.607 -11.210 -0.856 526 HA LEU 65 HA LEU 65 19.634 -13.857 0.185 527 HB2 LEU 65 HB2 LEU 65 17.341 -11.899 -0.195 528 HB3 LEU 65 HB1 LEU 65 17.274 -13.379 0.758 529 HG LEU 65 HG LEU 65 19.179 -11.092 1.283 530 HD11 LEU 65 HD11 LEU 65 16.729 -10.635 1.711 531 HD12 LEU 65 HD12 LEU 65 17.777 -10.498 3.121 532 HD13 LEU 65 HD13 LEU 65 16.779 -11.934 2.902 533 HD21 LEU 65 HD21 LEU 65 18.591 -13.692 2.749 534 HD22 LEU 65 HD22 LEU 65 19.436 -12.328 3.472 535 HD23 LEU 65 HD23 LEU 65 20.152 -13.161 2.104 536 H HIS 66 HN HIS 66 18.139 -12.328 -2.623 537 HA HIS 66 HA HIS 66 16.646 -14.535 -3.580 538 HB2 HIS 66 HB2 HIS 66 16.662 -12.049 -4.430 539 HB3 HIS 66 HB1 HIS 66 18.015 -12.562 -5.407 540 HD1 HIS 66 HD1 HIS 66 17.581 -14.508 -7.164 541 HD2 HIS 66 HD2 HIS 66 14.153 -12.944 -5.358 542 HE1 HIS 66 HE1 HIS 66 15.603 -15.309 -8.536 543 HE2 HIS 66 HE2 HIS 66 13.512 -14.353 -7.451 544 H SER 67 HN SER 67 19.994 -13.515 -4.173 545 HA SER 67 HA SER 67 20.649 -15.600 -5.948 546 HB2 SER 67 HB2 SER 67 23.019 -15.030 -4.844 547 HB3 SER 67 HB1 SER 67 22.267 -14.015 -6.069 548 HG SER 67 HG SER 67 22.025 -13.725 -3.216 549 H HIS 68 HN HIS 68 20.110 -15.537 -2.576 550 HA HIS 68 HA HIS 68 21.440 -18.135 -2.254 551 HB2 HIS 68 HB2 HIS 68 20.469 -16.172 -0.175 552 HB3 HIS 68 HB1 HIS 68 21.078 -17.784 0.190 553 HD1 HIS 68 HD1 HIS 68 23.537 -18.162 -1.378 554 HD2 HIS 68 HD2 HIS 68 22.567 -14.399 0.183 555 HE1 HIS 68 HE1 HIS 68 25.700 -16.819 -1.261 556 HE2 HIS 68 HE2 HIS 68 25.125 -14.550 -0.281 557 H GLY 69 HN GLY 69 18.727 -17.288 -3.459 558 HA2 GLY 69 HA2 GLY 69 17.021 -18.774 -3.948 559 HA3 GLY 69 HA1 GLY 69 17.427 -19.713 -2.525 560 H VAL 70 HN VAL 70 17.234 -16.563 -1.462 561 HA VAL 70 HA VAL 70 14.575 -17.046 -0.406 562 HB VAL 70 HB VAL 70 16.224 -14.583 -0.052 563 HG11 VAL 70 HG11 VAL 70 14.053 -15.969 1.550 564 HG12 VAL 70 HG12 VAL 70 14.030 -14.352 0.857 565 HG13 VAL 70 HG13 VAL 70 15.053 -14.694 2.248 566 HG21 VAL 70 HG21 VAL 70 17.728 -16.398 0.524 567 HG22 VAL 70 HG22 VAL 70 16.462 -17.230 1.421 568 HG23 VAL 70 HG23 VAL 70 17.137 -15.717 2.040 569 H ARG 71 HN ARG 71 13.165 -16.807 -2.071 570 HA ARG 71 HA ARG 71 13.388 -14.407 -3.798 571 HB2 ARG 71 HB2 ARG 71 11.879 -16.978 -4.239 572 HB3 ARG 71 HB1 ARG 71 12.050 -15.654 -5.390 573 HG2 ARG 71 HG2 ARG 71 14.485 -15.959 -5.438 574 HG3 ARG 71 HG1 ARG 71 14.373 -17.249 -4.252 575 HD2 ARG 71 HD2 ARG 71 13.052 -17.301 -6.986 576 HD3 ARG 71 HD1 ARG 71 14.542 -18.114 -6.519 577 HE ARG 71 HE ARG 71 12.583 -18.872 -4.677 578 HH11 ARG 71 HH21 ARG 71 13.350 -19.238 -8.061 579 HH12 ARG 71 HH22 ARG 71 12.499 -20.700 -8.263 580 HH21 ARG 71 HH11 ARG 71 11.422 -20.833 -4.930 581 HH22 ARG 71 HH12 ARG 71 11.384 -21.613 -6.457 582 H GLN 72 HN GLN 72 11.495 -15.750 -1.290 583 HA GLN 72 HA GLN 72 9.546 -13.658 -1.427 584 HB2 GLN 72 HB2 GLN 72 7.633 -15.402 -1.649 585 HB3 GLN 72 HB1 GLN 72 8.418 -14.839 -3.115 586 HG2 GLN 72 HG2 GLN 72 9.889 -17.116 -2.046 587 HG3 GLN 72 HG1 GLN 72 8.183 -17.483 -2.147 588 HE21 GLN 72 HE21 GLN 72 9.764 -15.213 -4.391 589 HE22 GLN 72 HE22 GLN 72 9.578 -16.190 -5.758 590 H ASN 73 HN ASN 73 7.634 -14.444 0.076 591 HA ASN 73 HA ASN 73 8.912 -14.966 2.603 592 HB2 ASN 73 HB2 ASN 73 6.903 -14.451 3.642 593 HB3 ASN 73 HB1 ASN 73 6.785 -13.479 2.175 594 HD21 ASN 73 HD21 ASN 73 5.120 -14.056 0.643 595 HD22 ASN 73 HD22 ASN 73 4.009 -15.298 0.937 596 H GLY 74 HN GLY 74 8.323 -16.761 4.023 597 HA2 GLY 74 HA2 GLY 74 7.549 -18.942 4.396 598 HA3 GLY 74 HA1 GLY 74 7.266 -19.161 2.679 599 H ASP 75 HN ASP 75 10.101 -17.619 2.693 600 HA ASP 75 HA ASP 75 11.624 -20.012 2.276 601 HB2 ASP 75 HB2 ASP 75 12.238 -17.070 2.133 602 HB3 ASP 75 HB1 ASP 75 13.515 -18.270 2.012 603 H SER 76 HN SER 76 13.326 -20.717 3.496 604 HA SER 76 HA SER 76 13.377 -19.684 6.262 605 HB2 SER 76 HB2 SER 76 13.748 -22.614 5.712 606 HB3 SER 76 HB1 SER 76 13.135 -21.802 7.136 607 HG SER 76 HG SER 76 11.318 -21.140 5.726 608 H ALA 77 HN ALA 77 15.402 -19.743 7.312 609 HA ALA 77 HA ALA 77 17.726 -20.777 5.809 610 HB1 ALA 77 HB1 ALA 77 19.025 -18.792 6.271 611 HB2 ALA 77 HB2 ALA 77 17.700 -18.077 7.180 612 HB3 ALA 77 HB3 ALA 77 17.550 -18.309 5.432 613 H TYR 78 HN TYR 78 19.713 -20.872 7.255 614 HA TYR 78 HA TYR 78 18.868 -21.514 10.012 615 HB2 TYR 78 HB2 TYR 78 20.794 -22.989 8.216 616 HB3 TYR 78 HB1 TYR 78 20.471 -23.405 9.907 617 HD1 TYR 78 HD2 TYR 78 19.065 -23.250 6.483 618 HD2 TYR 78 HD1 TYR 78 18.321 -24.435 10.551 619 HE1 TYR 78 HE2 TYR 78 17.051 -24.459 5.761 620 HE2 TYR 78 HE1 TYR 78 16.304 -25.642 9.829 621 HH TYR 78 HH TYR 78 15.004 -26.237 8.095 622 H LEU 79 HN LEU 79 20.035 -20.650 11.583 623 HA LEU 79 HA LEU 79 22.573 -19.310 10.907 624 HB2 LEU 79 HB2 LEU 79 20.869 -17.627 11.267 625 HB3 LEU 79 HB1 LEU 79 20.353 -18.408 12.756 626 HG LEU 79 HG LEU 79 22.627 -17.979 13.734 627 HD11 LEU 79 HD11 LEU 79 23.494 -15.880 12.041 628 HD12 LEU 79 HD12 LEU 79 23.196 -17.263 10.995 629 HD13 LEU 79 HD13 LEU 79 24.307 -17.410 12.356 630 HD21 LEU 79 HD21 LEU 79 22.259 -15.636 14.168 631 HD22 LEU 79 HD22 LEU 79 20.676 -16.380 14.044 632 HD23 LEU 79 HD23 LEU 79 21.331 -15.446 12.688 633 H TYR 80 HN TYR 80 24.266 -19.814 12.183 634 HA TYR 80 HA TYR 80 23.678 -21.308 14.653 635 HB2 TYR 80 HB2 TYR 80 24.969 -22.571 12.761 636 HB3 TYR 80 HB1 TYR 80 26.341 -21.605 13.256 637 HD1 TYR 80 HD2 TYR 80 27.052 -21.587 15.720 638 HD2 TYR 80 HD1 TYR 80 24.282 -24.448 14.077 639 HE1 TYR 80 HE2 TYR 80 27.420 -23.055 17.652 640 HE2 TYR 80 HE1 TYR 80 24.650 -25.915 16.026 641 HH TYR 80 HH TYR 80 25.683 -25.072 18.760 642 H LEU 81 HN LEU 81 24.538 -20.596 16.507 643 HA LEU 81 HA LEU 81 26.174 -18.143 16.390 644 HB2 LEU 81 HB2 LEU 81 24.248 -19.027 18.545 645 HB3 LEU 81 HB1 LEU 81 25.197 -17.548 18.561 646 HG LEU 81 HG LEU 81 23.193 -18.290 16.423 647 HD11 LEU 81 HD11 LEU 81 22.048 -17.749 18.519 648 HD12 LEU 81 HD12 LEU 81 21.853 -16.401 17.397 649 HD13 LEU 81 HD13 LEU 81 23.010 -16.283 18.708 650 HD21 LEU 81 HD21 LEU 81 25.176 -16.076 16.720 651 HD22 LEU 81 HD22 LEU 81 23.578 -15.613 16.156 652 HD23 LEU 81 HD23 LEU 81 24.502 -16.829 15.274 653 H LEU 82 HN LEU 82 27.962 -18.042 17.412 654 HA LEU 82 HA LEU 82 29.213 -20.436 18.413 655 HB2 LEU 82 HB2 LEU 82 30.068 -17.657 17.898 656 HB3 LEU 82 HB1 LEU 82 31.068 -18.607 18.990 657 HG LEU 82 HG LEU 82 31.194 -20.384 17.203 658 HD11 LEU 82 HD11 LEU 82 29.702 -18.267 15.656 659 HD12 LEU 82 HD12 LEU 82 29.183 -19.925 15.971 660 HD13 LEU 82 HD13 LEU 82 30.560 -19.603 14.895 661 HD21 LEU 82 HD21 LEU 82 32.800 -19.202 15.841 662 HD22 LEU 82 HD22 LEU 82 32.913 -18.571 17.485 663 HD23 LEU 82 HD23 LEU 82 32.083 -17.641 16.243 664 H SER 83 HN SER 83 30.520 -20.293 20.451 665 HA SER 83 HA SER 83 28.816 -20.073 22.692 666 HB2 SER 83 HB2 SER 83 31.806 -20.002 22.883 667 HB3 SER 83 HB1 SER 83 30.649 -20.793 23.945 668 HG SER 83 HG SER 83 30.757 -22.468 22.715 669 H ALA 84 HN ALA 84 31.154 -17.912 21.288 670 HA ALA 84 HA ALA 84 31.458 -16.002 23.302 671 HB1 ALA 84 HB1 ALA 84 32.909 -15.778 21.478 672 HB2 ALA 84 HB2 ALA 84 31.860 -14.379 21.314 673 HB3 ALA 84 HB3 ALA 84 31.599 -15.807 20.306 674 H ARG 85 HN ARG 85 30.612 -13.506 22.314 675 HA ARG 85 HA ARG 85 27.807 -13.480 21.781 676 HB2 ARG 85 HB2 ARG 85 28.217 -14.074 24.393 677 HB3 ARG 85 HB1 ARG 85 28.379 -12.344 24.482 678 HG2 ARG 85 HG2 ARG 85 26.052 -12.761 24.856 679 HG3 ARG 85 HG1 ARG 85 26.115 -12.155 23.219 680 HD2 ARG 85 HD2 ARG 85 24.766 -14.363 23.819 681 HD3 ARG 85 HD1 ARG 85 25.567 -14.159 22.295 682 HE ARG 85 HE ARG 85 27.359 -15.582 23.028 683 HH11 ARG 85 HH21 ARG 85 24.717 -15.328 25.326 684 HH12 ARG 85 HH22 ARG 85 25.134 -16.747 26.172 685 HH21 ARG 85 HH11 ARG 85 27.932 -17.474 24.179 686 HH22 ARG 85 HH12 ARG 85 26.952 -17.985 25.500 687 H ASN 86 HN ASN 86 27.387 -10.982 23.219 688 HA ASN 86 HA ASN 86 29.372 -9.152 22.128 689 HB2 ASN 86 HB2 ASN 86 27.808 -7.795 20.970 690 HB3 ASN 86 HB1 ASN 86 27.464 -9.430 20.431 691 HD21 ASN 86 HD21 ASN 86 25.517 -7.213 20.452 692 HD22 ASN 86 HD22 ASN 86 24.274 -7.674 21.498 693 H THR 87 HN THR 87 28.132 -6.791 22.777 694 HA THR 87 HA THR 87 27.551 -7.088 25.658 695 HB THR 87 HB THR 87 28.705 -4.742 25.743 696 HG1 THR 87 HG1 THR 87 29.051 -4.374 23.606 697 HG21 THR 87 HG21 THR 87 30.370 -7.232 25.263 698 HG22 THR 87 HG22 THR 87 29.549 -6.856 26.768 699 HG23 THR 87 HG23 THR 87 30.848 -5.819 26.200 700 H SER 88 HN SER 88 25.991 -5.714 26.526 701 HA SER 88 HA SER 88 23.954 -4.912 24.732 702 HB2 SER 88 HB2 SER 88 24.202 -4.061 27.615 703 HB3 SER 88 HB1 SER 88 22.746 -4.239 26.665 704 HG SER 88 HG SER 88 23.955 -6.013 28.154 705 H LEU 89 HN LEU 89 23.308 -2.879 24.084 706 HA LEU 89 HA LEU 89 25.306 -0.900 23.722 707 HB2 LEU 89 HB2 LEU 89 22.284 -0.740 23.458 708 HB3 LEU 89 HB1 LEU 89 23.373 0.523 22.974 709 HG LEU 89 HG LEU 89 23.211 -0.544 20.941 710 HD11 LEU 89 HD11 LEU 89 25.603 -0.711 21.633 711 HD12 LEU 89 HD12 LEU 89 25.108 -1.960 20.507 712 HD13 LEU 89 HD13 LEU 89 25.300 -2.360 22.201 713 HD21 LEU 89 HD21 LEU 89 23.150 -3.322 22.128 714 HD22 LEU 89 HD22 LEU 89 22.510 -2.749 20.592 715 HD23 LEU 89 HD23 LEU 89 21.681 -2.344 22.077 716 H ASN 90 HN ASN 90 22.676 -1.213 25.978 717 HA ASN 90 HA ASN 90 23.648 1.154 27.443 718 HB2 ASN 90 HB2 ASN 90 21.034 -0.352 27.598 719 HB3 ASN 90 HB1 ASN 90 21.511 0.906 28.733 720 HD21 ASN 90 HD21 ASN 90 20.126 0.350 25.614 721 HD22 ASN 90 HD22 ASN 90 20.083 1.963 25.109 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 2.269 -0.030 -0.822 2 H2 MET 1 HT2 MET 1 2.231 -1.714 -1.012 3 H3 MET 1 HT3 MET 1 0.877 -0.789 -1.409 4 HA MET 1 HA MET 1 1.701 -0.081 -3.357 5 HB2 MET 1 HB2 MET 1 4.434 -0.600 -2.132 6 HB3 MET 1 HB1 MET 1 4.221 -0.197 -3.825 7 HG2 MET 1 HG2 MET 1 4.075 1.990 -3.324 8 HG3 MET 1 HG1 MET 1 2.693 1.699 -2.288 9 HE1 MET 1 HE1 MET 1 6.111 3.018 -2.514 10 HE2 MET 1 HE2 MET 1 6.540 1.316 -2.556 11 HE3 MET 1 HE3 MET 1 7.064 2.299 -1.206 12 HA PRO 2 HA PRO 2 1.534 -4.067 -5.323 13 HB2 PRO 2 HB2 PRO 2 3.758 -3.215 -7.118 14 HB3 PRO 2 HB1 PRO 2 2.147 -3.833 -7.527 15 HG2 PRO 2 HG2 PRO 2 2.659 -1.274 -7.815 16 HG3 PRO 2 HG1 PRO 2 1.099 -1.782 -7.131 17 HD2 PRO 2 HD2 PRO 2 3.479 -0.651 -5.731 18 HD3 PRO 2 HD1 PRO 2 1.741 -0.376 -5.429 19 H THR 3 HN THR 3 4.731 -2.755 -4.671 20 HA THR 3 HA THR 3 6.116 -5.259 -4.678 21 HB THR 3 HB THR 3 7.953 -3.827 -3.772 22 HG1 THR 3 HG1 THR 3 6.285 -2.468 -2.730 23 HG21 THR 3 HG21 THR 3 6.908 -2.162 -5.968 24 HG22 THR 3 HG22 THR 3 6.879 -3.887 -6.317 25 HG23 THR 3 HG23 THR 3 8.389 -3.106 -5.883 26 H GLN 4 HN GLN 4 5.839 -6.725 -3.073 27 HA GLN 4 HA GLN 4 5.258 -5.776 -0.351 28 HB2 GLN 4 HB2 GLN 4 5.019 -8.658 -0.752 29 HB3 GLN 4 HB1 GLN 4 3.835 -7.523 -0.126 30 HG2 GLN 4 HG2 GLN 4 2.812 -8.316 -2.060 31 HG3 GLN 4 HG1 GLN 4 3.513 -6.813 -2.634 32 HE21 GLN 4 HE21 GLN 4 3.010 -9.659 -3.882 33 HE22 GLN 4 HE22 GLN 4 4.478 -9.979 -4.673 34 H ASP 5 HN ASP 5 6.301 -6.917 1.382 35 HA ASP 5 HA ASP 5 9.113 -7.504 0.861 36 HB2 ASP 5 HB2 ASP 5 7.465 -7.424 3.413 37 HB3 ASP 5 HB1 ASP 5 9.128 -7.978 3.309 38 H ILE 6 HN ILE 6 9.915 -9.513 2.157 39 HA ILE 6 HA ILE 6 7.954 -11.663 2.012 40 HB ILE 6 HB ILE 6 9.673 -13.214 1.204 41 HG12 ILE 6 HG12 ILE 6 11.395 -10.771 0.723 42 HG13 ILE 6 HG11 ILE 6 11.651 -11.874 2.082 43 HG21 ILE 6 HG21 ILE 6 9.291 -10.737 -0.494 44 HG22 ILE 6 HG22 ILE 6 8.228 -12.147 -0.468 45 HG23 ILE 6 HG23 ILE 6 9.867 -12.277 -1.120 46 HD11 ILE 6 HD11 ILE 6 11.540 -12.816 -0.781 47 HD12 ILE 6 HD12 ILE 6 12.091 -13.685 0.648 48 HD13 ILE 6 HD13 ILE 6 13.051 -12.338 0.010 49 H ARG 7 HN ARG 7 8.350 -13.372 3.536 50 HA ARG 7 HA ARG 7 9.923 -12.389 5.830 51 HB2 ARG 7 HB2 ARG 7 7.560 -14.275 5.917 52 HB3 ARG 7 HB1 ARG 7 8.429 -13.595 7.294 53 HG2 ARG 7 HG2 ARG 7 7.834 -11.274 6.358 54 HG3 ARG 7 HG1 ARG 7 6.735 -12.146 5.278 55 HD2 ARG 7 HD2 ARG 7 6.651 -12.336 8.310 56 HD3 ARG 7 HD1 ARG 7 5.627 -11.278 7.363 57 HE ARG 7 HE ARG 7 5.251 -13.814 6.313 58 HH11 ARG 7 HH21 ARG 7 4.900 -12.155 9.365 59 HH12 ARG 7 HH22 ARG 7 3.634 -13.134 9.949 60 HH21 ARG 7 HH11 ARG 7 3.493 -15.153 7.081 61 HH22 ARG 7 HH12 ARG 7 2.823 -14.876 8.619 62 H LEU 8 HN LEU 8 11.586 -13.457 6.446 63 HA LEU 8 HA LEU 8 12.031 -16.140 5.342 64 HB2 LEU 8 HB2 LEU 8 13.618 -14.244 4.794 65 HB3 LEU 8 HB1 LEU 8 14.102 -14.256 6.487 66 HG LEU 8 HG LEU 8 14.117 -16.821 4.903 67 HD11 LEU 8 HD11 LEU 8 16.414 -14.848 4.935 68 HD12 LEU 8 HD12 LEU 8 15.337 -15.155 3.569 69 HD13 LEU 8 HD13 LEU 8 16.373 -16.446 4.170 70 HD21 LEU 8 HD21 LEU 8 14.727 -16.201 7.551 71 HD22 LEU 8 HD22 LEU 8 16.302 -16.225 6.763 72 HD23 LEU 8 HD23 LEU 8 15.239 -17.635 6.658 73 H TRP 9 HN TRP 9 12.103 -17.787 6.744 74 HA TRP 9 HA TRP 9 12.010 -17.225 9.646 75 HB2 TRP 9 HB2 TRP 9 11.920 -19.994 8.480 76 HB3 TRP 9 HB1 TRP 9 11.164 -19.376 9.938 77 HD1 TRP 9 HD1 TRP 9 9.774 -16.819 8.583 78 HE1 TRP 9 HE1 TRP 9 7.697 -17.204 7.095 79 HE3 TRP 9 HE3 TRP 9 10.464 -21.695 7.429 80 HZ2 TRP 9 HZ2 TRP 9 6.502 -19.343 5.595 81 HZ3 TRP 9 HZ3 TRP 9 8.915 -22.893 5.979 82 HH2 TRP 9 HH2 TRP 9 6.882 -21.696 5.037 83 H VAL 10 HN VAL 10 13.852 -17.350 10.810 84 HA VAL 10 HA VAL 10 16.118 -18.734 9.523 85 HB VAL 10 HB VAL 10 16.463 -16.765 11.745 86 HG11 VAL 10 HG11 VAL 10 18.312 -18.227 10.740 87 HG12 VAL 10 HG12 VAL 10 18.608 -16.480 10.841 88 HG13 VAL 10 HG13 VAL 10 18.167 -17.200 9.313 89 HG21 VAL 10 HG21 VAL 10 14.954 -15.739 9.903 90 HG22 VAL 10 HG22 VAL 10 16.327 -15.969 8.824 91 HG23 VAL 10 HG23 VAL 10 16.479 -14.915 10.225 92 H SER 11 HN SER 11 16.908 -20.457 10.411 93 HA SER 11 HA SER 11 15.925 -21.406 13.011 94 HB2 SER 11 HB2 SER 11 17.964 -22.930 11.459 95 HB3 SER 11 HB1 SER 11 16.526 -23.489 12.281 96 HG SER 11 HG SER 11 16.679 -22.047 9.822 97 H VAL 12 HN VAL 12 17.074 -20.710 14.792 98 HA VAL 12 HA VAL 12 19.901 -20.062 14.378 99 HB VAL 12 HB VAL 12 18.326 -19.371 16.830 100 HG11 VAL 12 HG11 VAL 12 20.407 -17.629 15.547 101 HG12 VAL 12 HG12 VAL 12 20.942 -19.061 16.418 102 HG13 VAL 12 HG13 VAL 12 20.007 -17.829 17.245 103 HG21 VAL 12 HG21 VAL 12 18.353 -17.868 14.179 104 HG22 VAL 12 HG22 VAL 12 17.845 -17.153 15.700 105 HG23 VAL 12 HG23 VAL 12 16.941 -18.498 15.027 106 H GLU 13 HN GLU 13 21.389 -21.363 15.132 107 HA GLU 13 HA GLU 13 20.731 -23.099 17.419 108 HB2 GLU 13 HB2 GLU 13 22.447 -23.729 15.029 109 HB3 GLU 13 HB1 GLU 13 22.664 -24.574 16.548 110 HG2 GLU 13 HG2 GLU 13 20.146 -25.055 16.481 111 HG3 GLU 13 HG1 GLU 13 20.172 -24.495 14.830 112 H ASP 14 HN ASP 14 21.749 -22.642 19.165 113 HA ASP 14 HA ASP 14 24.079 -20.871 19.119 114 HB2 ASP 14 HB2 ASP 14 22.240 -20.514 20.754 115 HB3 ASP 14 HB1 ASP 14 22.675 -22.056 21.503 116 H ALA 15 HN ALA 15 25.990 -21.367 20.076 117 HA ALA 15 HA ALA 15 27.122 -23.931 19.609 118 HB1 ALA 15 HB1 ALA 15 28.744 -22.324 19.721 119 HB2 ALA 15 HB2 ALA 15 28.854 -22.978 21.360 120 HB3 ALA 15 HB3 ALA 15 27.982 -21.475 21.071 121 H GLN 16 HN GLN 16 25.455 -22.522 22.266 122 HA GLN 16 HA GLN 16 26.174 -24.551 24.178 123 HB2 GLN 16 HB2 GLN 16 24.140 -22.316 24.199 124 HB3 GLN 16 HB1 GLN 16 24.291 -23.464 25.519 125 HG2 GLN 16 HG2 GLN 16 26.212 -22.534 26.287 126 HG3 GLN 16 HG1 GLN 16 26.899 -22.430 24.679 127 HE21 GLN 16 HE21 GLN 16 26.875 -20.428 23.650 128 HE22 GLN 16 HE22 GLN 16 26.154 -19.039 24.285 129 H MET 17 HN MET 17 24.654 -24.954 21.468 130 HA MET 17 HA MET 17 23.296 -26.525 20.616 131 HB2 MET 17 HB2 MET 17 23.289 -27.681 23.426 132 HB3 MET 17 HB1 MET 17 22.612 -28.458 22.006 133 HG2 MET 17 HG2 MET 17 24.847 -28.351 20.891 134 HG3 MET 17 HG1 MET 17 25.532 -27.700 22.375 135 HE1 MET 17 HE1 MET 17 25.239 -28.538 24.507 136 HE2 MET 17 HE2 MET 17 25.707 -30.184 24.893 137 HE3 MET 17 HE3 MET 17 24.006 -29.766 24.819 138 H HIS 18 HN HIS 18 22.247 -24.075 21.465 139 HA HIS 18 HA HIS 18 19.512 -24.808 22.322 140 HB2 HIS 18 HB2 HIS 18 20.823 -22.068 22.230 141 HB3 HIS 18 HB1 HIS 18 19.193 -22.413 22.765 142 HD1 HIS 18 HD1 HIS 18 21.377 -21.232 24.679 143 HD2 HIS 18 HD2 HIS 18 20.365 -25.274 24.443 144 HE1 HIS 18 HE1 HIS 18 22.049 -22.293 26.904 145 HE2 HIS 18 HE2 HIS 18 21.432 -24.771 26.742 146 H THR 19 HN THR 19 17.939 -24.790 20.853 147 HA THR 19 HA THR 19 18.533 -23.630 18.205 148 HB THR 19 HB THR 19 16.543 -25.806 18.848 149 HG1 THR 19 HG1 THR 19 18.355 -26.774 19.320 150 HG21 THR 19 HG21 THR 19 16.511 -24.378 16.662 151 HG22 THR 19 HG22 THR 19 16.395 -26.120 16.545 152 HG23 THR 19 HG23 THR 19 17.928 -25.320 16.215 153 H VAL 20 HN VAL 20 17.332 -21.898 17.654 154 HA VAL 20 HA VAL 20 14.525 -21.839 18.436 155 HB VAL 20 HB VAL 20 14.614 -19.410 18.963 156 HG11 VAL 20 HG11 VAL 20 14.556 -20.974 20.798 157 HG12 VAL 20 HG12 VAL 20 15.667 -19.671 21.206 158 HG13 VAL 20 HG13 VAL 20 16.302 -21.232 20.707 159 HG21 VAL 20 HG21 VAL 20 16.859 -18.464 19.563 160 HG22 VAL 20 HG22 VAL 20 16.685 -18.784 17.841 161 HG23 VAL 20 HG23 VAL 20 17.618 -19.894 18.860 162 H THR 21 HN THR 21 13.255 -20.352 17.111 163 HA THR 21 HA THR 21 14.481 -19.997 14.454 164 HB THR 21 HB THR 21 11.530 -20.370 14.994 165 HG1 THR 21 HG1 THR 21 12.474 -22.245 15.646 166 HG21 THR 21 HG21 THR 21 12.525 -19.352 12.805 167 HG22 THR 21 HG22 THR 21 11.325 -20.621 12.668 168 HG23 THR 21 HG23 THR 21 13.033 -21.002 12.459 169 H ILE 22 HN ILE 22 14.270 -17.990 13.519 170 HA ILE 22 HA ILE 22 12.527 -16.044 14.887 171 HB ILE 22 HB ILE 22 14.179 -14.271 14.559 172 HG12 ILE 22 HG12 ILE 22 16.066 -16.477 13.675 173 HG13 ILE 22 HG11 ILE 22 15.284 -15.323 12.579 174 HG21 ILE 22 HG21 ILE 22 15.603 -14.836 16.359 175 HG22 ILE 22 HG22 ILE 22 15.635 -16.539 15.920 176 HG23 ILE 22 HG23 ILE 22 14.179 -15.840 16.631 177 HD11 ILE 22 HD11 ILE 22 16.829 -14.260 14.921 178 HD12 ILE 22 HD12 ILE 22 16.538 -13.534 13.341 179 HD13 ILE 22 HD13 ILE 22 17.712 -14.841 13.509 180 H TRP 23 HN TRP 23 11.716 -14.389 13.541 181 HA TRP 23 HA TRP 23 11.605 -15.193 10.698 182 HB2 TRP 23 HB2 TRP 23 9.521 -13.860 12.445 183 HB3 TRP 23 HB1 TRP 23 9.357 -14.095 10.712 184 HD1 TRP 23 HD1 TRP 23 8.463 -16.354 9.915 185 HE1 TRP 23 HE1 TRP 23 7.988 -18.639 11.032 186 HE3 TRP 23 HE3 TRP 23 10.413 -15.510 14.553 187 HZ2 TRP 23 HZ2 TRP 23 8.357 -19.912 13.534 188 HZ3 TRP 23 HZ3 TRP 23 10.333 -17.271 16.283 189 HH2 TRP 23 HH2 TRP 23 9.301 -19.483 15.770 190 H LEU 24 HN LEU 24 12.383 -13.788 9.271 191 HA LEU 24 HA LEU 24 12.574 -10.939 10.062 192 HB2 LEU 24 HB2 LEU 24 14.435 -12.474 8.240 193 HB3 LEU 24 HB1 LEU 24 14.570 -10.769 8.659 194 HG LEU 24 HG LEU 24 14.720 -13.071 10.646 195 HD11 LEU 24 HD11 LEU 24 17.008 -12.889 10.643 196 HD12 LEU 24 HD12 LEU 24 16.998 -11.216 10.107 197 HD13 LEU 24 HD13 LEU 24 16.689 -12.515 8.951 198 HD21 LEU 24 HD21 LEU 24 14.269 -10.196 10.988 199 HD22 LEU 24 HD22 LEU 24 15.770 -10.688 11.741 200 HD23 LEU 24 HD23 LEU 24 14.264 -11.489 12.185 201 H THR 25 HN THR 25 11.646 -9.477 8.712 202 HA THR 25 HA THR 25 10.505 -10.540 6.232 203 HB THR 25 HB THR 25 9.819 -7.994 7.709 204 HG1 THR 25 HG1 THR 25 9.316 -9.995 8.802 205 HG21 THR 25 HG21 THR 25 7.768 -8.127 6.248 206 HG22 THR 25 HG22 THR 25 8.550 -9.421 5.348 207 HG23 THR 25 HG23 THR 25 9.256 -7.811 5.378 208 H VAL 26 HN VAL 26 11.573 -10.114 4.460 209 HA VAL 26 HA VAL 26 13.079 -7.609 4.164 210 HB VAL 26 HB VAL 26 15.067 -8.867 3.404 211 HG11 VAL 26 HG11 VAL 26 15.876 -9.400 5.539 212 HG12 VAL 26 HG12 VAL 26 14.309 -9.959 6.100 213 HG13 VAL 26 HG13 VAL 26 14.600 -8.236 5.885 214 HG21 VAL 26 HG21 VAL 26 15.065 -11.367 4.066 215 HG22 VAL 26 HG22 VAL 26 14.175 -10.951 2.612 216 HG23 VAL 26 HG23 VAL 26 13.313 -11.249 4.109 217 H ARG 27 HN ARG 27 14.327 -8.146 1.819 218 HA ARG 27 HA ARG 27 12.194 -8.897 -0.056 219 HB2 ARG 27 HB2 ARG 27 13.343 -7.235 -1.624 220 HB3 ARG 27 HB1 ARG 27 12.340 -6.562 -0.359 221 HG2 ARG 27 HG2 ARG 27 15.217 -6.965 0.398 222 HG3 ARG 27 HG1 ARG 27 14.938 -5.774 -0.850 223 HD2 ARG 27 HD2 ARG 27 13.999 -5.753 1.990 224 HD3 ARG 27 HD1 ARG 27 14.801 -4.499 1.075 225 HE ARG 27 HE ARG 27 12.683 -4.239 -0.219 226 HH11 ARG 27 HH21 ARG 27 12.630 -5.605 3.018 227 HH12 ARG 27 HH22 ARG 27 10.940 -5.385 3.207 228 HH21 ARG 27 HH11 ARG 27 10.440 -3.946 0.081 229 HH22 ARG 27 HH12 ARG 27 9.670 -4.460 1.520 230 HA PRO 28 HA PRO 28 15.172 -11.830 -1.761 231 HB2 PRO 28 HB2 PRO 28 14.412 -10.605 -4.373 232 HB3 PRO 28 HB1 PRO 28 14.450 -12.319 -3.930 233 HG2 PRO 28 HG2 PRO 28 12.142 -11.113 -4.113 234 HG3 PRO 28 HG1 PRO 28 12.447 -12.157 -2.715 235 HD2 PRO 28 HD2 PRO 28 12.434 -9.165 -2.825 236 HD3 PRO 28 HD1 PRO 28 11.840 -10.265 -1.551 237 H ASP 29 HN ASP 29 15.071 -8.512 -2.690 238 HA ASP 29 HA ASP 29 17.605 -8.223 -3.946 239 HB2 ASP 29 HB2 ASP 29 15.835 -6.570 -4.239 240 HB3 ASP 29 HB1 ASP 29 15.879 -6.192 -2.523 241 H MET 30 HN MET 30 16.595 -8.412 -0.617 242 HA MET 30 HA MET 30 18.798 -7.033 0.507 243 HB2 MET 30 HB2 MET 30 16.529 -8.502 1.542 244 HB3 MET 30 HB1 MET 30 17.997 -8.981 2.374 245 HG2 MET 30 HG2 MET 30 17.579 -6.063 1.903 246 HG3 MET 30 HG1 MET 30 16.648 -6.835 3.191 247 HE1 MET 30 HE1 MET 30 18.093 -8.843 4.558 248 HE2 MET 30 HE2 MET 30 17.507 -7.423 5.420 249 HE3 MET 30 HE3 MET 30 19.143 -7.995 5.708 250 H THR 31 HN THR 31 20.335 -8.051 1.986 251 HA THR 31 HA THR 31 21.623 -10.350 0.694 252 HB THR 31 HB THR 31 22.564 -7.587 1.211 253 HG1 THR 31 HG1 THR 31 23.226 -9.624 -0.608 254 HG21 THR 31 HG21 THR 31 24.917 -8.293 1.311 255 HG22 THR 31 HG22 THR 31 24.390 -9.979 1.478 256 HG23 THR 31 HG23 THR 31 23.983 -8.779 2.722 257 H VAL 32 HN VAL 32 22.990 -11.650 2.037 258 HA VAL 32 HA VAL 32 21.964 -12.124 4.616 259 HB VAL 32 HB VAL 32 24.512 -13.093 3.278 260 HG11 VAL 32 HG11 VAL 32 23.274 -13.882 5.925 261 HG12 VAL 32 HG12 VAL 32 24.895 -13.244 5.646 262 HG13 VAL 32 HG13 VAL 32 24.471 -14.848 5.063 263 HG21 VAL 32 HG21 VAL 32 23.214 -15.177 3.060 264 HG22 VAL 32 HG22 VAL 32 22.408 -13.846 2.240 265 HG23 VAL 32 HG23 VAL 32 21.818 -14.402 3.814 266 H ALA 33 HN ALA 33 24.945 -10.527 3.574 267 HA ALA 33 HA ALA 33 26.084 -10.025 6.077 268 HB1 ALA 33 HB1 ALA 33 27.044 -7.954 5.001 269 HB2 ALA 33 HB2 ALA 33 26.082 -8.309 3.574 270 HB3 ALA 33 HB3 ALA 33 27.332 -9.442 4.106 271 H SER 34 HN SER 34 23.627 -8.211 4.314 272 HA SER 34 HA SER 34 23.266 -6.122 6.155 273 HB2 SER 34 HB2 SER 34 21.190 -7.373 4.349 274 HB3 SER 34 HB1 SER 34 21.172 -5.752 5.018 275 HG SER 34 HG SER 34 21.958 -5.680 2.940 276 H LEU 35 HN LEU 35 21.793 -9.341 5.830 277 HA LEU 35 HA LEU 35 19.983 -9.130 8.018 278 HB2 LEU 35 HB2 LEU 35 21.276 -11.533 6.715 279 HB3 LEU 35 HB1 LEU 35 20.104 -11.651 8.009 280 HG LEU 35 HG LEU 35 19.542 -10.155 5.426 281 HD11 LEU 35 HD11 LEU 35 19.618 -12.278 4.576 282 HD12 LEU 35 HD12 LEU 35 17.986 -12.340 5.251 283 HD13 LEU 35 HD13 LEU 35 19.334 -13.046 6.134 284 HD21 LEU 35 HD21 LEU 35 18.096 -10.797 7.948 285 HD22 LEU 35 HD22 LEU 35 17.153 -10.943 6.471 286 HD23 LEU 35 HD23 LEU 35 17.909 -9.402 6.892 287 H LYS 36 HN LYS 36 23.295 -10.323 7.718 288 HA LYS 36 HA LYS 36 23.590 -11.247 10.324 289 HB2 LYS 36 HB2 LYS 36 25.113 -11.687 8.436 290 HB3 LYS 36 HB1 LYS 36 25.661 -10.018 8.506 291 HG2 LYS 36 HG2 LYS 36 25.867 -11.031 11.160 292 HG3 LYS 36 HG1 LYS 36 26.544 -12.266 10.107 293 HD2 LYS 36 HD2 LYS 36 27.239 -9.360 9.816 294 HD3 LYS 36 HD1 LYS 36 28.177 -10.402 10.894 295 HE2 LYS 36 HE2 LYS 36 27.743 -10.811 7.909 296 HE3 LYS 36 HE1 LYS 36 29.240 -10.247 8.659 297 HZ1 LYS 36 HZ1 LYS 36 28.679 -12.730 8.039 298 HZ2 LYS 36 HZ2 LYS 36 28.237 -12.798 9.693 299 HZ3 LYS 36 HZ3 LYS 36 29.787 -12.333 9.219 300 H ASP 37 HN ASP 37 24.266 -8.132 8.842 301 HA ASP 37 HA ASP 37 25.216 -6.778 11.130 302 HB2 ASP 37 HB2 ASP 37 25.414 -6.011 8.754 303 HB3 ASP 37 HB1 ASP 37 23.707 -5.585 8.807 304 H MET 38 HN MET 38 21.976 -6.871 9.665 305 HA MET 38 HA MET 38 20.830 -5.259 11.695 306 HB2 MET 38 HB2 MET 38 18.769 -5.450 10.647 307 HB3 MET 38 HB1 MET 38 19.932 -5.479 9.324 308 HG2 MET 38 HG2 MET 38 18.942 -7.361 8.660 309 HG3 MET 38 HG1 MET 38 19.689 -8.140 10.053 310 HE1 MET 38 HE1 MET 38 15.511 -8.469 9.225 311 HE2 MET 38 HE2 MET 38 16.921 -9.470 8.993 312 HE3 MET 38 HE3 MET 38 16.811 -7.918 8.157 313 H VAL 39 HN VAL 39 20.913 -8.781 11.301 314 HA VAL 39 HA VAL 39 19.035 -9.398 13.279 315 HB VAL 39 HB VAL 39 21.534 -10.872 12.437 316 HG11 VAL 39 HG11 VAL 39 20.843 -12.762 13.637 317 HG12 VAL 39 HG12 VAL 39 19.191 -12.210 13.780 318 HG13 VAL 39 HG13 VAL 39 20.442 -11.490 14.787 319 HG21 VAL 39 HG21 VAL 39 18.870 -11.941 11.739 320 HG22 VAL 39 HG22 VAL 39 20.324 -11.760 10.759 321 HG23 VAL 39 HG23 VAL 39 19.252 -10.388 10.983 322 H PHE 40 HN PHE 40 22.430 -8.586 13.448 323 HA PHE 40 HA PHE 40 22.765 -8.969 16.230 324 HB2 PHE 40 HB2 PHE 40 24.727 -8.625 14.869 325 HB3 PHE 40 HB1 PHE 40 24.111 -7.053 14.328 326 HD1 PHE 40 HD2 PHE 40 24.527 -8.778 17.656 327 HD2 PHE 40 HD1 PHE 40 25.199 -5.243 15.326 328 HE1 PHE 40 HE2 PHE 40 25.541 -7.698 19.616 329 HE2 PHE 40 HE1 PHE 40 26.215 -4.139 17.313 330 HZ PHE 40 HZ PHE 40 26.385 -5.377 19.457 331 H LEU 41 HN LEU 41 21.688 -6.194 14.284 332 HA LEU 41 HA LEU 41 21.330 -4.372 16.443 333 HB2 LEU 41 HB2 LEU 41 19.540 -4.538 13.998 334 HB3 LEU 41 HB1 LEU 41 19.877 -3.140 14.993 335 HG LEU 41 HG LEU 41 21.864 -4.590 13.265 336 HD11 LEU 41 HD11 LEU 41 21.820 -2.652 11.841 337 HD12 LEU 41 HD12 LEU 41 20.755 -1.796 12.941 338 HD13 LEU 41 HD13 LEU 41 20.154 -3.185 12.044 339 HD21 LEU 41 HD21 LEU 41 23.125 -2.388 13.790 340 HD22 LEU 41 HD22 LEU 41 23.179 -3.751 14.917 341 HD23 LEU 41 HD23 LEU 41 22.111 -2.359 15.248 342 H ASP 42 HN ASP 42 19.256 -6.653 14.828 343 HA ASP 42 HA ASP 42 16.957 -6.016 16.385 344 HB2 ASP 42 HB2 ASP 42 16.969 -6.993 14.016 345 HB3 ASP 42 HB1 ASP 42 17.205 -8.553 14.793 346 H TYR 43 HN TYR 43 19.122 -8.842 16.501 347 HA TYR 43 HA TYR 43 17.714 -9.703 18.981 348 HB2 TYR 43 HB2 TYR 43 19.412 -11.347 17.087 349 HB3 TYR 43 HB1 TYR 43 18.577 -11.930 18.510 350 HD1 TYR 43 HD2 TYR 43 16.082 -11.920 18.644 351 HD2 TYR 43 HD1 TYR 43 18.186 -10.859 15.055 352 HE1 TYR 43 HE2 TYR 43 13.997 -12.193 17.341 353 HE2 TYR 43 HE1 TYR 43 16.123 -11.125 13.753 354 HH TYR 43 HH TYR 43 13.567 -10.940 14.375 355 H GLY 44 HN GLY 44 20.555 -8.184 18.085 356 HA2 GLY 44 HA2 GLY 44 22.387 -7.614 19.393 357 HA3 GLY 44 HA1 GLY 44 21.693 -8.567 20.699 358 H PHE 45 HN PHE 45 21.873 -10.209 17.742 359 HA PHE 45 HA PHE 45 23.658 -12.211 18.737 360 HB2 PHE 45 HB2 PHE 45 22.432 -11.700 16.019 361 HB3 PHE 45 HB1 PHE 45 23.551 -13.013 16.308 362 HD1 PHE 45 HD1 PHE 45 21.661 -12.317 19.301 363 HD2 PHE 45 HD2 PHE 45 21.436 -14.344 15.493 364 HE1 PHE 45 HE1 PHE 45 19.847 -13.739 20.144 365 HE2 PHE 45 HE2 PHE 45 19.606 -15.755 16.369 366 HZ PHE 45 HZ PHE 45 18.815 -15.454 18.692 367 HA PRO 46 HA PRO 46 27.247 -9.582 17.740 368 HB2 PRO 46 HB2 PRO 46 29.111 -11.593 18.259 369 HB3 PRO 46 HB1 PRO 46 28.503 -10.385 19.402 370 HG2 PRO 46 HG2 PRO 46 27.611 -13.201 19.044 371 HG3 PRO 46 HG1 PRO 46 27.793 -12.295 20.535 372 HD2 PRO 46 HD2 PRO 46 25.372 -12.691 19.541 373 HD3 PRO 46 HD1 PRO 46 25.782 -11.099 20.217 374 HA PRO 47 HA PRO 47 27.504 -10.916 13.499 375 HB2 PRO 47 HB2 PRO 47 29.719 -9.491 12.739 376 HB3 PRO 47 HB1 PRO 47 28.098 -8.784 12.897 377 HG2 PRO 47 HG2 PRO 47 30.378 -8.705 14.822 378 HG3 PRO 47 HG1 PRO 47 29.230 -7.434 14.383 379 HD2 PRO 47 HD2 PRO 47 28.942 -8.766 16.675 380 HD3 PRO 47 HD1 PRO 47 27.513 -8.279 15.736 381 H VAL 48 HN VAL 48 30.364 -11.083 15.526 382 HA VAL 48 HA VAL 48 31.843 -12.786 13.815 383 HB VAL 48 HB VAL 48 33.109 -11.695 15.481 384 HG11 VAL 48 HG11 VAL 48 32.023 -11.040 17.333 385 HG12 VAL 48 HG12 VAL 48 32.343 -12.630 18.002 386 HG13 VAL 48 HG13 VAL 48 30.807 -12.300 17.208 387 HG21 VAL 48 HG21 VAL 48 32.804 -14.495 16.626 388 HG22 VAL 48 HG22 VAL 48 34.246 -13.499 16.596 389 HG23 VAL 48 HG23 VAL 48 33.625 -14.184 15.097 390 H LEU 49 HN LEU 49 29.655 -13.409 16.500 391 HA LEU 49 HA LEU 49 29.908 -16.279 16.440 392 HB2 LEU 49 HB2 LEU 49 27.947 -14.387 17.687 393 HB3 LEU 49 HB1 LEU 49 27.696 -16.113 17.707 394 HG LEU 49 HG LEU 49 30.046 -16.367 18.627 395 HD11 LEU 49 HD11 LEU 49 31.184 -14.391 18.402 396 HD12 LEU 49 HD12 LEU 49 30.561 -14.140 20.032 397 HD13 LEU 49 HD13 LEU 49 29.753 -13.396 18.661 398 HD21 LEU 49 HD21 LEU 49 28.808 -14.944 20.823 399 HD22 LEU 49 HD22 LEU 49 28.993 -16.673 20.569 400 HD23 LEU 49 HD23 LEU 49 27.573 -15.849 19.936 401 H GLN 50 HN GLN 50 27.705 -13.895 15.149 402 HA GLN 50 HA GLN 50 25.725 -15.736 14.379 403 HB2 GLN 50 HB2 GLN 50 25.348 -13.310 14.809 404 HB3 GLN 50 HB1 GLN 50 26.175 -12.954 13.295 405 HG2 GLN 50 HG2 GLN 50 24.499 -14.454 12.119 406 HG3 GLN 50 HG1 GLN 50 23.624 -14.547 13.644 407 HE21 GLN 50 HE21 GLN 50 24.541 -11.578 14.132 408 HE22 GLN 50 HE22 GLN 50 23.446 -10.704 13.186 409 H GLN 51 HN GLN 51 26.176 -17.276 12.938 410 HA GLN 51 HA GLN 51 27.286 -16.400 10.347 411 HB2 GLN 51 HB2 GLN 51 27.444 -19.140 11.627 412 HB3 GLN 51 HB1 GLN 51 27.799 -18.838 9.931 413 HG2 GLN 51 HG2 GLN 51 29.548 -17.205 10.586 414 HG3 GLN 51 HG1 GLN 51 29.210 -17.546 12.286 415 HE21 GLN 51 HE21 GLN 51 31.752 -18.098 11.751 416 HE22 GLN 51 HE22 GLN 51 32.028 -19.743 11.474 417 H TRP 52 HN TRP 52 26.072 -16.515 8.649 418 HA TRP 52 HA TRP 52 23.328 -17.542 8.948 419 HB2 TRP 52 HB2 TRP 52 24.673 -15.492 7.242 420 HB3 TRP 52 HB1 TRP 52 23.309 -16.351 6.547 421 HD1 TRP 52 HD1 TRP 52 24.185 -14.185 9.610 422 HE1 TRP 52 HE1 TRP 52 22.040 -13.085 10.461 423 HE3 TRP 52 HE3 TRP 52 20.836 -16.427 6.507 424 HZ2 TRP 52 HZ2 TRP 52 19.190 -13.158 9.852 425 HZ3 TRP 52 HZ3 TRP 52 18.420 -15.899 6.649 426 HH2 TRP 52 HH2 TRP 52 17.600 -14.268 8.317 427 H VAL 53 HN VAL 53 22.825 -19.468 8.072 428 HA VAL 53 HA VAL 53 24.454 -20.417 5.809 429 HB VAL 53 HB VAL 53 23.553 -21.928 8.260 430 HG11 VAL 53 HG11 VAL 53 24.470 -22.990 5.571 431 HG12 VAL 53 HG12 VAL 53 23.046 -23.456 6.506 432 HG13 VAL 53 HG13 VAL 53 24.652 -23.891 7.070 433 HG21 VAL 53 HG21 VAL 53 25.733 -20.696 8.355 434 HG22 VAL 53 HG22 VAL 53 26.271 -21.601 6.945 435 HG23 VAL 53 HG23 VAL 53 25.944 -22.441 8.452 436 H ILE 54 HN ILE 54 23.357 -21.026 4.096 437 HA ILE 54 HA ILE 54 20.605 -21.929 4.335 438 HB ILE 54 HB ILE 54 21.467 -19.907 2.184 439 HG12 ILE 54 HG12 ILE 54 19.432 -19.576 4.411 440 HG13 ILE 54 HG11 ILE 54 21.074 -18.965 4.568 441 HG21 ILE 54 HG21 ILE 54 19.330 -20.048 1.318 442 HG22 ILE 54 HG22 ILE 54 18.686 -20.849 2.739 443 HG23 ILE 54 HG23 ILE 54 19.721 -21.741 1.629 444 HD11 ILE 54 HD11 ILE 54 18.835 -17.813 3.160 445 HD12 ILE 54 HD12 ILE 54 20.166 -18.070 2.038 446 HD13 ILE 54 HD13 ILE 54 20.411 -17.102 3.494 447 H GLY 55 HN GLY 55 20.273 -23.708 3.023 448 HA2 GLY 55 HA2 GLY 55 22.332 -25.292 2.192 449 HA3 GLY 55 HA1 GLY 55 20.727 -25.370 1.465 450 H GLN 56 HN GLN 56 21.192 -22.467 0.623 451 HA GLN 56 HA GLN 56 22.868 -23.041 -1.735 452 HB2 GLN 56 HB2 GLN 56 21.246 -21.016 -2.596 453 HB3 GLN 56 HB1 GLN 56 21.000 -22.734 -2.902 454 HG2 GLN 56 HG2 GLN 56 19.839 -21.276 -0.491 455 HG3 GLN 56 HG1 GLN 56 19.005 -21.540 -2.019 456 HE21 GLN 56 HE21 GLN 56 19.319 -24.071 -2.738 457 HE22 GLN 56 HE22 GLN 56 18.902 -25.163 -1.513 458 H ARG 57 HN ARG 57 23.632 -21.817 0.845 459 HA ARG 57 HA ARG 57 24.151 -19.042 0.206 460 HB2 ARG 57 HB2 ARG 57 24.737 -20.745 2.557 461 HB3 ARG 57 HB1 ARG 57 25.771 -19.359 2.281 462 HG2 ARG 57 HG2 ARG 57 23.265 -18.217 1.898 463 HG3 ARG 57 HG1 ARG 57 22.954 -19.438 3.124 464 HD2 ARG 57 HD2 ARG 57 23.602 -17.386 4.224 465 HD3 ARG 57 HD1 ARG 57 24.839 -18.640 4.435 466 HE ARG 57 HE ARG 57 25.304 -16.875 2.151 467 HH11 ARG 57 HH21 ARG 57 25.888 -17.458 5.593 468 HH12 ARG 57 HH22 ARG 57 27.247 -16.411 5.571 469 HH21 ARG 57 HH11 ARG 57 27.079 -15.614 2.210 470 HH22 ARG 57 HH12 ARG 57 27.912 -15.359 3.712 471 H LEU 58 HN LEU 58 26.196 -18.043 0.146 472 HA LEU 58 HA LEU 58 28.366 -19.731 -0.918 473 HB2 LEU 58 HB2 LEU 58 27.796 -16.781 -1.370 474 HB3 LEU 58 HB1 LEU 58 29.237 -17.622 -1.900 475 HG LEU 58 HG LEU 58 27.663 -19.259 -3.145 476 HD11 LEU 58 HD11 LEU 58 25.742 -17.108 -2.306 477 HD12 LEU 58 HD12 LEU 58 25.508 -18.861 -2.381 478 HD13 LEU 58 HD13 LEU 58 25.531 -17.912 -3.856 479 HD21 LEU 58 HD21 LEU 58 27.490 -17.727 -5.086 480 HD22 LEU 58 HD22 LEU 58 29.048 -17.518 -4.288 481 HD23 LEU 58 HD23 LEU 58 27.757 -16.356 -4.022 482 H ALA 59 HN ALA 59 30.466 -19.206 -0.063 483 HA ALA 59 HA ALA 59 30.460 -18.692 2.716 484 HB1 ALA 59 HB1 ALA 59 32.247 -20.031 1.623 485 HB2 ALA 59 HB2 ALA 59 32.844 -18.725 2.637 486 HB3 ALA 59 HB3 ALA 59 32.864 -18.533 0.896 487 H ARG 60 HN ARG 60 29.591 -16.486 0.689 488 HA ARG 60 HA ARG 60 30.974 -14.314 2.081 489 HB2 ARG 60 HB2 ARG 60 31.748 -14.451 -0.263 490 HB3 ARG 60 HB1 ARG 60 30.077 -14.407 -0.804 491 HG2 ARG 60 HG2 ARG 60 29.774 -12.175 -0.099 492 HG3 ARG 60 HG1 ARG 60 31.246 -12.176 0.873 493 HD2 ARG 60 HD2 ARG 60 31.627 -10.973 -1.255 494 HD3 ARG 60 HD1 ARG 60 32.610 -12.425 -1.149 495 HE ARG 60 HE ARG 60 30.078 -12.805 -2.528 496 HH11 ARG 60 HH21 ARG 60 33.438 -11.882 -2.785 497 HH12 ARG 60 HH22 ARG 60 33.558 -12.221 -4.455 498 HH21 ARG 60 HH11 ARG 60 30.235 -13.261 -4.760 499 HH22 ARG 60 HH12 ARG 60 31.702 -13.015 -5.600 500 H ASP 61 HN ASP 61 29.641 -13.136 3.190 501 HA ASP 61 HA ASP 61 26.798 -13.706 3.283 502 HB2 ASP 61 HB2 ASP 61 28.431 -11.587 4.710 503 HB3 ASP 61 HB1 ASP 61 26.741 -11.942 5.009 504 H GLN 62 HN GLN 62 28.668 -11.579 1.551 505 HA GLN 62 HA GLN 62 26.876 -9.424 1.319 506 HB2 GLN 62 HB2 GLN 62 29.241 -10.241 -0.381 507 HB3 GLN 62 HB1 GLN 62 28.361 -8.730 -0.568 508 HG2 GLN 62 HG2 GLN 62 28.853 -8.080 1.712 509 HG3 GLN 62 HG1 GLN 62 29.610 -9.626 2.040 510 HE21 GLN 62 HE21 GLN 62 30.286 -6.446 1.022 511 HE22 GLN 62 HE22 GLN 62 31.831 -6.752 0.400 512 H GLU 63 HN GLU 63 26.578 -12.489 -0.019 513 HA GLU 63 HA GLU 63 25.588 -11.841 -2.607 514 HB2 GLU 63 HB2 GLU 63 24.098 -14.121 -1.640 515 HB3 GLU 63 HB1 GLU 63 25.334 -14.071 -2.867 516 HG2 GLU 63 HG2 GLU 63 26.446 -15.394 -1.480 517 HG3 GLU 63 HG1 GLU 63 26.913 -13.954 -0.627 518 H THR 64 HN THR 64 23.331 -11.963 -3.384 519 HA THR 64 HA THR 64 21.566 -10.409 -1.673 520 HB THR 64 HB THR 64 20.418 -11.416 -4.166 521 HG1 THR 64 HG1 THR 64 22.829 -9.914 -4.301 522 HG21 THR 64 HG21 THR 64 20.232 -8.925 -4.573 523 HG22 THR 64 HG22 THR 64 21.037 -8.686 -3.022 524 HG23 THR 64 HG23 THR 64 19.491 -9.520 -3.095 525 H LEU 65 HN LEU 65 19.397 -11.188 -1.135 526 HA LEU 65 HA LEU 65 19.324 -13.915 -0.298 527 HB2 LEU 65 HB2 LEU 65 17.063 -11.933 -0.688 528 HB3 LEU 65 HB1 LEU 65 16.864 -13.507 0.071 529 HG LEU 65 HG LEU 65 18.705 -11.302 1.032 530 HD11 LEU 65 HD11 LEU 65 16.204 -10.985 1.324 531 HD12 LEU 65 HD12 LEU 65 17.163 -10.926 2.802 532 HD13 LEU 65 HD13 LEU 65 16.250 -12.374 2.400 533 HD21 LEU 65 HD21 LEU 65 19.775 -12.970 2.092 534 HD22 LEU 65 HD22 LEU 65 18.537 -14.173 1.684 535 HD23 LEU 65 HD23 LEU 65 18.343 -13.140 3.090 536 H HIS 66 HN HIS 66 18.066 -12.186 -3.052 537 HA HIS 66 HA HIS 66 16.628 -14.186 -4.340 538 HB2 HIS 66 HB2 HIS 66 16.914 -11.740 -5.042 539 HB3 HIS 66 HB1 HIS 66 18.412 -12.243 -5.817 540 HD1 HIS 66 HD1 HIS 66 17.838 -14.757 -7.201 541 HD2 HIS 66 HD2 HIS 66 14.947 -11.744 -6.973 542 HE1 HIS 66 HE1 HIS 66 16.201 -15.156 -9.115 543 HE2 HIS 66 HE2 HIS 66 14.445 -13.321 -8.973 544 H SER 67 HN SER 67 20.102 -13.741 -4.041 545 HA SER 67 HA SER 67 21.003 -15.428 -6.091 546 HB2 SER 67 HB2 SER 67 22.411 -15.380 -3.448 547 HB3 SER 67 HB1 SER 67 23.072 -15.325 -5.073 548 HG SER 67 HG SER 67 22.071 -13.399 -3.410 549 H HIS 68 HN HIS 68 19.743 -16.097 -2.887 550 HA HIS 68 HA HIS 68 20.423 -18.917 -3.096 551 HB2 HIS 68 HB2 HIS 68 18.911 -17.506 -0.883 552 HB3 HIS 68 HB1 HIS 68 19.704 -19.075 -0.813 553 HD1 HIS 68 HD1 HIS 68 22.476 -18.835 -1.598 554 HD2 HIS 68 HD2 HIS 68 20.586 -15.539 0.166 555 HE1 HIS 68 HE1 HIS 68 24.287 -17.276 -0.813 556 HE2 HIS 68 HE2 HIS 68 23.206 -15.300 0.273 557 H GLY 69 HN GLY 69 18.251 -17.213 -4.616 558 HA2 GLY 69 HA2 GLY 69 16.406 -17.931 -5.782 559 HA3 GLY 69 HA1 GLY 69 16.388 -19.411 -4.831 560 H VAL 70 HN VAL 70 16.648 -16.835 -2.744 561 HA VAL 70 HA VAL 70 13.980 -17.172 -1.783 562 HB VAL 70 HB VAL 70 16.080 -15.120 -1.048 563 HG11 VAL 70 HG11 VAL 70 14.192 -14.284 -0.031 564 HG12 VAL 70 HG12 VAL 70 14.698 -15.427 1.199 565 HG13 VAL 70 HG13 VAL 70 13.403 -15.854 0.094 566 HG21 VAL 70 HG21 VAL 70 16.787 -16.639 0.677 567 HG22 VAL 70 HG22 VAL 70 16.738 -17.600 -0.800 568 HG23 VAL 70 HG23 VAL 70 15.431 -17.714 0.378 569 H ARG 71 HN ARG 71 12.758 -16.580 -3.626 570 HA ARG 71 HA ARG 71 12.831 -13.716 -4.418 571 HB2 ARG 71 HB2 ARG 71 11.449 -16.048 -5.769 572 HB3 ARG 71 HB1 ARG 71 11.565 -14.397 -6.370 573 HG2 ARG 71 HG2 ARG 71 14.048 -14.598 -6.380 574 HG3 ARG 71 HG1 ARG 71 13.896 -16.290 -5.918 575 HD2 ARG 71 HD2 ARG 71 12.738 -15.026 -8.429 576 HD3 ARG 71 HD1 ARG 71 14.132 -16.088 -8.383 577 HE ARG 71 HE ARG 71 11.374 -16.862 -8.317 578 HH11 ARG 71 HH21 ARG 71 14.519 -17.720 -7.122 579 HH12 ARG 71 HH22 ARG 71 14.192 -19.392 -7.002 580 HH21 ARG 71 HH11 ARG 71 10.907 -19.075 -8.174 581 HH22 ARG 71 HH12 ARG 71 12.085 -20.189 -7.614 582 H GLN 72 HN GLN 72 11.009 -16.067 -2.698 583 HA GLN 72 HA GLN 72 8.729 -14.222 -2.447 584 HB2 GLN 72 HB2 GLN 72 8.718 -17.202 -2.900 585 HB3 GLN 72 HB1 GLN 72 7.327 -16.323 -2.269 586 HG2 GLN 72 HG2 GLN 72 7.218 -14.969 -4.196 587 HG3 GLN 72 HG1 GLN 72 8.697 -15.634 -4.891 588 HE21 GLN 72 HE21 GLN 72 8.607 -17.876 -5.674 589 HE22 GLN 72 HE22 GLN 72 7.125 -18.638 -5.988 590 H ASN 73 HN ASN 73 7.534 -14.565 -0.532 591 HA ASN 73 HA ASN 73 9.096 -14.963 1.849 592 HB2 ASN 73 HB2 ASN 73 6.880 -14.832 2.973 593 HB3 ASN 73 HB1 ASN 73 7.207 -13.453 1.933 594 HD21 ASN 73 HD21 ASN 73 4.606 -14.939 2.754 595 HD22 ASN 73 HD22 ASN 73 3.810 -15.174 1.272 596 H GLY 74 HN GLY 74 8.536 -16.544 3.498 597 HA2 GLY 74 HA2 GLY 74 7.715 -18.646 4.135 598 HA3 GLY 74 HA1 GLY 74 7.542 -19.132 2.450 599 H ASP 75 HN ASP 75 10.349 -17.457 2.625 600 HA ASP 75 HA ASP 75 12.008 -19.717 2.296 601 HB2 ASP 75 HB2 ASP 75 13.778 -17.755 2.733 602 HB3 ASP 75 HB1 ASP 75 12.973 -17.922 1.195 603 H SER 76 HN SER 76 13.633 -20.489 3.616 604 HA SER 76 HA SER 76 13.435 -19.739 6.440 605 HB2 SER 76 HB2 SER 76 13.896 -22.606 5.609 606 HB3 SER 76 HB1 SER 76 13.299 -21.954 7.124 607 HG SER 76 HG SER 76 11.547 -21.100 5.512 608 H ALA 77 HN ALA 77 15.439 -19.856 7.559 609 HA ALA 77 HA ALA 77 17.824 -20.560 5.967 610 HB1 ALA 77 HB1 ALA 77 17.482 -18.132 5.703 611 HB2 ALA 77 HB2 ALA 77 18.953 -18.489 6.604 612 HB3 ALA 77 HB3 ALA 77 17.511 -17.945 7.455 613 H TYR 78 HN TYR 78 19.850 -20.523 7.307 614 HA TYR 78 HA TYR 78 19.244 -21.555 10.000 615 HB2 TYR 78 HB2 TYR 78 20.384 -22.909 7.883 616 HB3 TYR 78 HB1 TYR 78 21.784 -22.333 8.764 617 HD1 TYR 78 HD1 TYR 78 21.554 -22.533 11.442 618 HD2 TYR 78 HD2 TYR 78 19.465 -24.949 8.554 619 HE1 TYR 78 HE1 TYR 78 21.230 -24.269 13.127 620 HE2 TYR 78 HE2 TYR 78 19.141 -26.690 10.247 621 HH TYR 78 HH TYR 78 20.811 -26.578 13.237 622 H LEU 79 HN LEU 79 20.110 -20.473 11.637 623 HA LEU 79 HA LEU 79 22.267 -18.529 11.099 624 HB2 LEU 79 HB2 LEU 79 19.944 -17.673 11.772 625 HB3 LEU 79 HB1 LEU 79 20.241 -18.389 13.343 626 HG LEU 79 HG LEU 79 20.815 -16.000 13.335 627 HD11 LEU 79 HD11 LEU 79 23.517 -17.249 13.419 628 HD12 LEU 79 HD12 LEU 79 22.283 -17.895 14.513 629 HD13 LEU 79 HD13 LEU 79 22.707 -16.199 14.567 630 HD21 LEU 79 HD21 LEU 79 23.170 -16.406 11.543 631 HD22 LEU 79 HD22 LEU 79 22.153 -14.995 11.791 632 HD23 LEU 79 HD23 LEU 79 21.588 -16.300 10.763 633 H TYR 80 HN TYR 80 24.122 -18.947 12.123 634 HA TYR 80 HA TYR 80 24.046 -20.807 14.403 635 HB2 TYR 80 HB2 TYR 80 25.989 -20.481 12.186 636 HB3 TYR 80 HB1 TYR 80 26.645 -20.882 13.767 637 HD1 TYR 80 HD1 TYR 80 24.256 -21.979 11.131 638 HD2 TYR 80 HD2 TYR 80 26.262 -22.996 14.795 639 HE1 TYR 80 HE1 TYR 80 23.487 -24.316 10.916 640 HE2 TYR 80 HE2 TYR 80 25.520 -25.289 14.599 641 HH TYR 80 HH TYR 80 23.232 -26.308 13.232 642 H LEU 81 HN LEU 81 24.732 -20.295 16.280 643 HA LEU 81 HA LEU 81 26.129 -17.715 16.722 644 HB2 LEU 81 HB2 LEU 81 23.809 -18.954 18.054 645 HB3 LEU 81 HB1 LEU 81 25.100 -18.583 19.175 646 HG LEU 81 HG LEU 81 25.027 -16.266 18.707 647 HD11 LEU 81 HD11 LEU 81 23.369 -15.564 16.752 648 HD12 LEU 81 HD12 LEU 81 23.852 -17.135 16.120 649 HD13 LEU 81 HD13 LEU 81 25.072 -15.899 16.464 650 HD21 LEU 81 HD21 LEU 81 22.670 -15.637 18.973 651 HD22 LEU 81 HD22 LEU 81 23.029 -17.052 19.950 652 HD23 LEU 81 HD23 LEU 81 22.163 -17.231 18.422 653 H LEU 82 HN LEU 82 28.139 -18.634 16.406 654 HA LEU 82 HA LEU 82 28.854 -21.145 17.474 655 HB2 LEU 82 HB2 LEU 82 30.650 -18.952 16.462 656 HB3 LEU 82 HB1 LEU 82 31.125 -20.613 16.776 657 HG LEU 82 HG LEU 82 28.991 -19.756 14.782 658 HD11 LEU 82 HD11 LEU 82 30.681 -20.733 13.148 659 HD12 LEU 82 HD12 LEU 82 31.864 -20.599 14.464 660 HD13 LEU 82 HD13 LEU 82 31.053 -19.164 13.857 661 HD21 LEU 82 HD21 LEU 82 28.322 -21.940 15.392 662 HD22 LEU 82 HD22 LEU 82 29.959 -22.458 15.760 663 HD23 LEU 82 HD23 LEU 82 29.443 -22.278 14.090 664 H SER 83 HN SER 83 30.566 -21.636 18.947 665 HA SER 83 HA SER 83 30.173 -20.575 21.479 666 HB2 SER 83 HB2 SER 83 32.747 -21.889 20.640 667 HB3 SER 83 HB1 SER 83 31.941 -21.959 22.191 668 HG SER 83 HG SER 83 31.460 -23.342 19.817 669 H ALA 84 HN ALA 84 30.422 -18.359 21.656 670 HA ALA 84 HA ALA 84 33.074 -17.310 21.841 671 HB1 ALA 84 HB1 ALA 84 31.728 -17.100 19.285 672 HB2 ALA 84 HB2 ALA 84 33.369 -16.642 19.737 673 HB3 ALA 84 HB3 ALA 84 32.047 -15.514 19.986 674 H ARG 85 HN ARG 85 33.093 -15.080 22.413 675 HA ARG 85 HA ARG 85 30.523 -13.920 23.232 676 HB2 ARG 85 HB2 ARG 85 32.970 -13.507 24.945 677 HB3 ARG 85 HB1 ARG 85 31.285 -13.242 25.351 678 HG2 ARG 85 HG2 ARG 85 32.583 -15.967 24.967 679 HG3 ARG 85 HG1 ARG 85 32.214 -15.221 26.510 680 HD2 ARG 85 HD2 ARG 85 30.277 -16.370 24.487 681 HD3 ARG 85 HD1 ARG 85 30.439 -16.660 26.167 682 HE ARG 85 HE ARG 85 29.517 -14.431 26.633 683 HH11 ARG 85 HH21 ARG 85 29.156 -15.672 23.343 684 HH12 ARG 85 HH22 ARG 85 27.646 -14.926 23.111 685 HH21 ARG 85 HH11 ARG 85 27.482 -13.415 26.239 686 HH22 ARG 85 HH12 ARG 85 26.681 -13.624 24.749 687 H ASN 86 HN ASN 86 30.406 -11.826 22.611 688 HA ASN 86 HA ASN 86 32.758 -10.707 21.260 689 HB2 ASN 86 HB2 ASN 86 30.412 -10.782 20.191 690 HB3 ASN 86 HB1 ASN 86 30.026 -9.438 21.262 691 HD21 ASN 86 HD21 ASN 86 30.637 -7.386 20.513 692 HD22 ASN 86 HD22 ASN 86 31.736 -7.121 19.251 693 H THR 87 HN THR 87 33.994 -9.395 22.441 694 HA THR 87 HA THR 87 33.140 -8.463 24.965 695 HB THR 87 HB THR 87 35.498 -8.954 24.570 696 HG1 THR 87 HG1 THR 87 34.747 -6.318 25.211 697 HG21 THR 87 HG21 THR 87 35.499 -6.573 22.678 698 HG22 THR 87 HG22 THR 87 35.568 -8.260 22.199 699 HG23 THR 87 HG23 THR 87 36.880 -7.570 23.129 700 H SER 88 HN SER 88 31.238 -7.596 23.246 701 HA SER 88 HA SER 88 31.500 -4.879 22.447 702 HB2 SER 88 HB2 SER 88 28.936 -6.238 23.294 703 HB3 SER 88 HB1 SER 88 29.172 -4.975 22.104 704 HG SER 88 HG SER 88 28.969 -6.888 20.981 705 H LEU 89 HN LEU 89 30.636 -3.028 23.592 706 HA LEU 89 HA LEU 89 31.234 -3.056 26.357 707 HB2 LEU 89 HB2 LEU 89 30.189 -1.015 24.443 708 HB3 LEU 89 HB1 LEU 89 29.896 -0.724 26.148 709 HG LEU 89 HG LEU 89 32.326 -1.077 26.616 710 HD11 LEU 89 HD11 LEU 89 33.915 -1.133 24.801 711 HD12 LEU 89 HD12 LEU 89 32.638 -1.010 23.602 712 HD13 LEU 89 HD13 LEU 89 32.797 -2.472 24.577 713 HD21 LEU 89 HD21 LEU 89 31.856 1.197 26.490 714 HD22 LEU 89 HD22 LEU 89 31.315 1.110 24.815 715 HD23 LEU 89 HD23 LEU 89 33.031 1.050 25.191 716 H ASN 90 HN ASN 90 29.708 -5.036 26.474 717 HA ASN 90 HA ASN 90 27.113 -4.131 27.566 718 HB2 ASN 90 HB2 ASN 90 27.721 -6.776 26.204 719 HB3 ASN 90 HB1 ASN 90 26.192 -6.302 26.925 720 HD21 ASN 90 HD21 ASN 90 26.691 -3.425 25.834 721 HD22 ASN 90 HD22 ASN 90 26.269 -3.565 24.199 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 2.193 0.557 0.862 2 H2 MET 1 HT2 MET 1 1.489 -0.821 0.189 3 H3 MET 1 HT3 MET 1 0.984 0.699 -0.314 4 HA MET 1 HA MET 1 2.618 0.900 -1.781 5 HB2 MET 1 HB2 MET 1 4.380 -0.488 0.278 6 HB3 MET 1 HB1 MET 1 4.954 0.102 -1.272 7 HG2 MET 1 HG2 MET 1 5.436 1.917 0.138 8 HG3 MET 1 HG1 MET 1 3.898 2.387 -0.563 9 HE1 MET 1 HE1 MET 1 5.704 2.039 2.923 10 HE2 MET 1 HE2 MET 1 5.684 0.509 2.067 11 HE3 MET 1 HE3 MET 1 4.784 0.668 3.561 12 HA PRO 2 HA PRO 2 1.638 -3.113 -3.618 13 HB2 PRO 2 HB2 PRO 2 2.884 -2.721 -6.007 14 HB3 PRO 2 HB1 PRO 2 1.287 -2.046 -5.611 15 HG2 PRO 2 HG2 PRO 2 3.961 -0.721 -5.533 16 HG3 PRO 2 HG1 PRO 2 2.407 -0.097 -6.125 17 HD2 PRO 2 HD2 PRO 2 3.320 0.641 -3.737 18 HD3 PRO 2 HD1 PRO 2 1.582 0.353 -3.987 19 H THR 3 HN THR 3 4.819 -1.738 -3.305 20 HA THR 3 HA THR 3 6.084 -4.363 -3.653 21 HB THR 3 HB THR 3 7.494 -1.705 -3.330 22 HG1 THR 3 HG1 THR 3 7.264 -1.365 -5.411 23 HG21 THR 3 HG21 THR 3 9.284 -2.910 -4.555 24 HG22 THR 3 HG22 THR 3 8.278 -4.346 -4.600 25 HG23 THR 3 HG23 THR 3 8.859 -3.724 -3.054 26 H GLN 4 HN GLN 4 6.513 -5.459 -1.831 27 HA GLN 4 HA GLN 4 7.086 -3.968 0.644 28 HB2 GLN 4 HB2 GLN 4 5.791 -5.753 1.887 29 HB3 GLN 4 HB1 GLN 4 4.808 -4.629 0.961 30 HG2 GLN 4 HG2 GLN 4 4.124 -6.242 -0.529 31 HG3 GLN 4 HG1 GLN 4 5.666 -7.070 -0.530 32 HE21 GLN 4 HE21 GLN 4 6.151 -8.401 1.538 33 HE22 GLN 4 HE22 GLN 4 4.837 -9.120 2.307 34 H ASP 5 HN ASP 5 8.084 -5.353 2.300 35 HA ASP 5 HA ASP 5 10.236 -6.942 1.201 36 HB2 ASP 5 HB2 ASP 5 9.350 -6.328 4.033 37 HB3 ASP 5 HB1 ASP 5 10.701 -7.381 3.623 38 H ILE 6 HN ILE 6 10.583 -9.173 2.375 39 HA ILE 6 HA ILE 6 7.993 -10.551 2.576 40 HB ILE 6 HB ILE 6 8.941 -12.492 1.479 41 HG12 ILE 6 HG12 ILE 6 11.375 -10.805 0.823 42 HG13 ILE 6 HG11 ILE 6 11.389 -11.968 2.155 43 HG21 ILE 6 HG21 ILE 6 7.840 -11.101 -0.077 44 HG22 ILE 6 HG22 ILE 6 9.419 -11.343 -0.824 45 HG23 ILE 6 HG23 ILE 6 9.076 -9.850 0.032 46 HD11 ILE 6 HD11 ILE 6 10.487 -12.836 -0.564 47 HD12 ILE 6 HD12 ILE 6 11.286 -13.768 0.711 48 HD13 ILE 6 HD13 ILE 6 12.208 -12.606 -0.255 49 H ARG 7 HN ARG 7 8.059 -12.460 3.862 50 HA ARG 7 HA ARG 7 9.715 -12.051 6.232 51 HB2 ARG 7 HB2 ARG 7 7.514 -14.084 5.754 52 HB3 ARG 7 HB1 ARG 7 8.299 -13.705 7.265 53 HG2 ARG 7 HG2 ARG 7 7.487 -11.428 7.255 54 HG3 ARG 7 HG1 ARG 7 6.760 -11.617 5.671 55 HD2 ARG 7 HD2 ARG 7 6.014 -13.252 8.118 56 HD3 ARG 7 HD1 ARG 7 5.115 -11.873 7.501 57 HE ARG 7 HE ARG 7 5.362 -13.590 5.337 58 HH11 ARG 7 HH21 ARG 7 4.015 -13.690 8.538 59 HH12 ARG 7 HH22 ARG 7 2.842 -14.866 8.151 60 HH21 ARG 7 HH11 ARG 7 3.826 -15.145 4.803 61 HH22 ARG 7 HH12 ARG 7 2.714 -15.719 5.980 62 H LEU 8 HN LEU 8 11.478 -13.156 6.667 63 HA LEU 8 HA LEU 8 11.967 -15.719 5.309 64 HB2 LEU 8 HB2 LEU 8 13.627 -14.186 4.547 65 HB3 LEU 8 HB1 LEU 8 13.846 -13.521 6.167 66 HG LEU 8 HG LEU 8 14.738 -15.749 6.914 67 HD11 LEU 8 HD11 LEU 8 13.648 -16.639 4.470 68 HD12 LEU 8 HD12 LEU 8 14.578 -17.557 5.642 69 HD13 LEU 8 HD13 LEU 8 15.398 -16.778 4.298 70 HD21 LEU 8 HD21 LEU 8 16.222 -14.624 4.517 71 HD22 LEU 8 HD22 LEU 8 16.918 -15.492 5.881 72 HD23 LEU 8 HD23 LEU 8 16.233 -13.888 6.122 73 H TRP 9 HN TRP 9 12.205 -17.438 6.630 74 HA TRP 9 HA TRP 9 12.268 -16.969 9.545 75 HB2 TRP 9 HB2 TRP 9 11.975 -19.611 8.114 76 HB3 TRP 9 HB1 TRP 9 11.637 -19.245 9.800 77 HD1 TRP 9 HD1 TRP 9 10.000 -16.544 9.302 78 HE1 TRP 9 HE1 TRP 9 7.602 -16.724 8.347 79 HE3 TRP 9 HE3 TRP 9 10.252 -21.150 7.174 80 HZ2 TRP 9 HZ2 TRP 9 6.012 -18.588 6.870 81 HZ3 TRP 9 HZ3 TRP 9 8.337 -22.107 6.003 82 HH2 TRP 9 HH2 TRP 9 6.183 -20.817 5.840 83 H VAL 10 HN VAL 10 14.031 -17.545 10.727 84 HA VAL 10 HA VAL 10 16.205 -18.870 9.236 85 HB VAL 10 HB VAL 10 16.522 -16.759 11.371 86 HG11 VAL 10 HG11 VAL 10 18.359 -18.424 11.282 87 HG12 VAL 10 HG12 VAL 10 18.882 -16.830 10.752 88 HG13 VAL 10 HG13 VAL 10 18.560 -18.083 9.559 89 HG21 VAL 10 HG21 VAL 10 17.548 -15.557 9.246 90 HG22 VAL 10 HG22 VAL 10 15.810 -15.530 9.517 91 HG23 VAL 10 HG23 VAL 10 16.500 -16.667 8.360 92 H SER 11 HN SER 11 16.841 -20.687 10.075 93 HA SER 11 HA SER 11 15.868 -21.578 12.679 94 HB2 SER 11 HB2 SER 11 17.982 -23.003 11.082 95 HB3 SER 11 HB1 SER 11 16.737 -23.652 12.134 96 HG SER 11 HG SER 11 16.458 -22.496 9.531 97 H VAL 12 HN VAL 12 16.968 -21.058 14.532 98 HA VAL 12 HA VAL 12 19.773 -20.265 14.186 99 HB VAL 12 HB VAL 12 17.638 -19.259 16.048 100 HG11 VAL 12 HG11 VAL 12 19.440 -17.761 16.961 101 HG12 VAL 12 HG12 VAL 12 20.620 -18.707 16.070 102 HG13 VAL 12 HG13 VAL 12 19.692 -19.458 17.370 103 HG21 VAL 12 HG21 VAL 12 18.092 -18.408 13.561 104 HG22 VAL 12 HG22 VAL 12 19.415 -17.541 14.351 105 HG23 VAL 12 HG23 VAL 12 17.757 -17.276 14.870 106 H GLU 13 HN GLU 13 21.253 -21.348 15.297 107 HA GLU 13 HA GLU 13 20.376 -23.081 17.531 108 HB2 GLU 13 HB2 GLU 13 22.180 -23.627 15.264 109 HB3 GLU 13 HB1 GLU 13 22.870 -23.982 16.826 110 HG2 GLU 13 HG2 GLU 13 20.066 -24.932 16.313 111 HG3 GLU 13 HG1 GLU 13 21.399 -25.804 15.579 112 H ASP 14 HN ASP 14 20.921 -22.215 19.373 113 HA ASP 14 HA ASP 14 22.874 -20.144 19.573 114 HB2 ASP 14 HB2 ASP 14 20.915 -20.429 21.147 115 HB3 ASP 14 HB1 ASP 14 21.809 -21.765 21.883 116 H ALA 15 HN ALA 15 24.840 -20.286 20.678 117 HA ALA 15 HA ALA 15 26.494 -22.510 20.071 118 HB1 ALA 15 HB1 ALA 15 27.232 -20.121 20.707 119 HB2 ALA 15 HB2 ALA 15 28.169 -21.510 21.268 120 HB3 ALA 15 HB3 ALA 15 27.088 -20.683 22.389 121 H GLN 16 HN GLN 16 24.299 -21.831 22.550 122 HA GLN 16 HA GLN 16 25.157 -23.726 24.533 123 HB2 GLN 16 HB2 GLN 16 22.346 -22.697 24.002 124 HB3 GLN 16 HB1 GLN 16 22.950 -23.436 25.474 125 HG2 GLN 16 HG2 GLN 16 24.004 -20.840 24.319 126 HG3 GLN 16 HG1 GLN 16 22.857 -20.942 25.640 127 HE21 GLN 16 HE21 GLN 16 26.024 -20.322 25.208 128 HE22 GLN 16 HE22 GLN 16 26.658 -21.049 26.599 129 H MET 17 HN MET 17 24.244 -24.152 21.399 130 HA MET 17 HA MET 17 23.485 -25.799 20.146 131 HB2 MET 17 HB2 MET 17 23.930 -27.496 22.626 132 HB3 MET 17 HB1 MET 17 23.455 -28.140 21.059 133 HG2 MET 17 HG2 MET 17 25.476 -27.182 20.010 134 HG3 MET 17 HG1 MET 17 25.957 -26.494 21.549 135 HE1 MET 17 HE1 MET 17 24.822 -30.700 20.901 136 HE2 MET 17 HE2 MET 17 26.100 -30.442 19.729 137 HE3 MET 17 HE3 MET 17 24.721 -29.369 19.734 138 H HIS 18 HN HIS 18 21.756 -24.110 20.996 139 HA HIS 18 HA HIS 18 19.308 -25.651 21.649 140 HB2 HIS 18 HB2 HIS 18 20.092 -22.821 22.387 141 HB3 HIS 18 HB1 HIS 18 18.435 -23.376 22.416 142 HD1 HIS 18 HD1 HIS 18 21.438 -25.489 23.585 143 HD2 HIS 18 HD2 HIS 18 18.106 -23.528 25.181 144 HE1 HIS 18 HE1 HIS 18 21.288 -26.176 25.990 145 HE2 HIS 18 HE2 HIS 18 19.265 -24.992 26.992 146 H THR 19 HN THR 19 17.990 -25.760 19.898 147 HA THR 19 HA THR 19 18.459 -23.977 17.659 148 HB THR 19 HB THR 19 16.429 -26.214 17.877 149 HG1 THR 19 HG1 THR 19 19.152 -26.287 17.802 150 HG21 THR 19 HG21 THR 19 16.400 -26.162 15.493 151 HG22 THR 19 HG22 THR 19 17.771 -25.043 15.410 152 HG23 THR 19 HG23 THR 19 16.224 -24.507 16.035 153 H VAL 20 HN VAL 20 17.324 -22.159 17.380 154 HA VAL 20 HA VAL 20 14.569 -21.996 18.401 155 HB VAL 20 HB VAL 20 14.953 -19.696 19.137 156 HG11 VAL 20 HG11 VAL 20 17.006 -21.560 20.368 157 HG12 VAL 20 HG12 VAL 20 15.280 -21.656 20.700 158 HG13 VAL 20 HG13 VAL 20 16.194 -20.212 21.151 159 HG21 VAL 20 HG21 VAL 20 17.629 -19.295 19.436 160 HG22 VAL 20 HG22 VAL 20 16.734 -18.704 18.047 161 HG23 VAL 20 HG23 VAL 20 17.637 -20.220 17.939 162 H THR 21 HN THR 21 13.328 -20.264 17.363 163 HA THR 21 HA THR 21 14.142 -19.967 14.538 164 HB THR 21 HB THR 21 11.338 -20.088 15.664 165 HG1 THR 21 HG1 THR 21 11.971 -22.088 15.905 166 HG21 THR 21 HG21 THR 21 11.337 -18.964 13.565 167 HG22 THR 21 HG22 THR 21 10.842 -20.604 13.219 168 HG23 THR 21 HG23 THR 21 12.487 -20.093 12.855 169 H ILE 22 HN ILE 22 14.125 -17.967 13.664 170 HA ILE 22 HA ILE 22 12.776 -15.816 15.143 171 HB ILE 22 HB ILE 22 14.576 -14.264 14.579 172 HG12 ILE 22 HG12 ILE 22 16.083 -16.710 13.552 173 HG13 ILE 22 HG11 ILE 22 15.338 -15.474 12.534 174 HG21 ILE 22 HG21 ILE 22 15.779 -16.693 15.930 175 HG22 ILE 22 HG22 ILE 22 14.631 -15.614 16.725 176 HG23 ILE 22 HG23 ILE 22 16.192 -15.000 16.185 177 HD11 ILE 22 HD11 ILE 22 17.793 -15.100 12.918 178 HD12 ILE 22 HD12 ILE 22 17.440 -14.868 14.625 179 HD13 ILE 22 HD13 ILE 22 16.773 -13.756 13.429 180 H TRP 23 HN TRP 23 12.012 -14.120 13.820 181 HA TRP 23 HA TRP 23 11.592 -14.956 11.021 182 HB2 TRP 23 HB2 TRP 23 9.809 -13.379 12.883 183 HB3 TRP 23 HB1 TRP 23 9.481 -13.607 11.172 184 HD1 TRP 23 HD1 TRP 23 8.352 -15.806 10.466 185 HE1 TRP 23 HE1 TRP 23 7.703 -17.995 11.666 186 HE3 TRP 23 HE3 TRP 23 10.598 -15.040 14.982 187 HZ2 TRP 23 HZ2 TRP 23 8.088 -19.251 14.215 188 HZ3 TRP 23 HZ3 TRP 23 10.439 -16.725 16.764 189 HH2 TRP 23 HH2 TRP 23 9.181 -18.840 16.393 190 H LEU 24 HN LEU 24 12.369 -13.662 9.486 191 HA LEU 24 HA LEU 24 13.082 -10.881 10.224 192 HB2 LEU 24 HB2 LEU 24 14.450 -12.665 8.194 193 HB3 LEU 24 HB1 LEU 24 14.926 -11.040 8.645 194 HG LEU 24 HG LEU 24 14.868 -13.400 10.569 195 HD11 LEU 24 HD11 LEU 24 17.170 -13.564 10.365 196 HD12 LEU 24 HD12 LEU 24 17.336 -11.981 9.614 197 HD13 LEU 24 HD13 LEU 24 16.664 -13.332 8.694 198 HD21 LEU 24 HD21 LEU 24 15.421 -10.461 10.864 199 HD22 LEU 24 HD22 LEU 24 16.432 -11.590 11.747 200 HD23 LEU 24 HD23 LEU 24 14.690 -11.589 12.016 201 H THR 25 HN THR 25 12.309 -9.303 8.849 202 HA THR 25 HA THR 25 10.936 -10.263 6.431 203 HB THR 25 HB THR 25 10.373 -7.595 7.712 204 HG1 THR 25 HG1 THR 25 9.680 -10.128 8.657 205 HG21 THR 25 HG21 THR 25 8.397 -9.287 6.227 206 HG22 THR 25 HG22 THR 25 9.663 -8.488 5.310 207 HG23 THR 25 HG23 THR 25 8.554 -7.533 6.271 208 H VAL 26 HN VAL 26 11.964 -9.788 4.632 209 HA VAL 26 HA VAL 26 13.300 -7.246 4.240 210 HB VAL 26 HB VAL 26 15.381 -8.378 3.413 211 HG11 VAL 26 HG11 VAL 26 16.389 -8.568 5.574 212 HG12 VAL 26 HG12 VAL 26 14.839 -8.943 6.329 213 HG13 VAL 26 HG13 VAL 26 15.145 -7.324 5.705 214 HG21 VAL 26 HG21 VAL 26 14.473 -10.641 3.116 215 HG22 VAL 26 HG22 VAL 26 14.162 -10.775 4.847 216 HG23 VAL 26 HG23 VAL 26 15.817 -10.685 4.251 217 H ARG 27 HN ARG 27 14.216 -7.325 1.914 218 HA ARG 27 HA ARG 27 12.238 -8.667 0.202 219 HB2 ARG 27 HB2 ARG 27 13.233 -7.284 -1.628 220 HB3 ARG 27 HB1 ARG 27 12.448 -6.341 -0.380 221 HG2 ARG 27 HG2 ARG 27 15.434 -6.895 -0.187 222 HG3 ARG 27 HG1 ARG 27 14.851 -5.638 -1.248 223 HD2 ARG 27 HD2 ARG 27 14.898 -5.703 1.724 224 HD3 ARG 27 HD1 ARG 27 15.125 -4.365 0.642 225 HE ARG 27 HE ARG 27 12.718 -5.132 1.932 226 HH11 ARG 27 HH21 ARG 27 13.930 -3.889 -1.103 227 HH12 ARG 27 HH22 ARG 27 12.505 -3.013 -1.492 228 HH21 ARG 27 HH11 ARG 27 10.811 -3.927 1.434 229 HH22 ARG 27 HH12 ARG 27 10.696 -3.037 -0.025 230 HA PRO 28 HA PRO 28 15.202 -11.798 -0.824 231 HB2 PRO 28 HB2 PRO 28 14.746 -12.157 -3.494 232 HB3 PRO 28 HB1 PRO 28 13.694 -12.782 -2.210 233 HG2 PRO 28 HG2 PRO 28 13.334 -10.318 -3.866 234 HG3 PRO 28 HG1 PRO 28 12.141 -11.530 -3.376 235 HD2 PRO 28 HD2 PRO 28 12.300 -9.192 -2.123 236 HD3 PRO 28 HD1 PRO 28 11.921 -10.683 -1.219 237 H ASP 29 HN ASP 29 15.011 -8.813 -2.369 238 HA ASP 29 HA ASP 29 17.399 -8.737 -3.934 239 HB2 ASP 29 HB2 ASP 29 15.382 -7.157 -4.026 240 HB3 ASP 29 HB1 ASP 29 16.061 -6.410 -2.583 241 H MET 30 HN MET 30 16.746 -8.648 -0.511 242 HA MET 30 HA MET 30 18.829 -7.104 0.457 243 HB2 MET 30 HB2 MET 30 17.074 -7.718 1.903 244 HB3 MET 30 HB1 MET 30 17.193 -9.412 1.459 245 HG2 MET 30 HG2 MET 30 18.063 -9.063 3.599 246 HG3 MET 30 HG1 MET 30 19.399 -9.549 2.574 247 HE1 MET 30 HE1 MET 30 17.821 -6.644 4.688 248 HE2 MET 30 HE2 MET 30 19.416 -6.355 5.422 249 HE3 MET 30 HE3 MET 30 18.789 -8.008 5.294 250 H THR 31 HN THR 31 20.662 -7.793 1.533 251 HA THR 31 HA THR 31 22.078 -10.009 0.244 252 HB THR 31 HB THR 31 22.889 -7.266 1.107 253 HG1 THR 31 HG1 THR 31 24.040 -8.730 -0.976 254 HG21 THR 31 HG21 THR 31 24.335 -8.627 2.409 255 HG22 THR 31 HG22 THR 31 25.250 -7.962 1.061 256 HG23 THR 31 HG23 THR 31 24.702 -9.663 1.025 257 H VAL 32 HN VAL 32 23.248 -11.438 1.547 258 HA VAL 32 HA VAL 32 22.156 -11.994 4.053 259 HB VAL 32 HB VAL 32 24.733 -12.919 2.769 260 HG11 VAL 32 HG11 VAL 32 23.558 -13.558 5.472 261 HG12 VAL 32 HG12 VAL 32 25.231 -13.278 5.033 262 HG13 VAL 32 HG13 VAL 32 24.446 -14.794 4.583 263 HG21 VAL 32 HG21 VAL 32 21.917 -13.981 3.067 264 HG22 VAL 32 HG22 VAL 32 23.249 -15.083 2.792 265 HG23 VAL 32 HG23 VAL 32 22.879 -13.834 1.595 266 H ALA 33 HN ALA 33 25.262 -10.406 3.237 267 HA ALA 33 HA ALA 33 26.206 -10.087 5.828 268 HB1 ALA 33 HB1 ALA 33 26.835 -7.684 4.402 269 HB2 ALA 33 HB2 ALA 33 26.880 -9.015 3.254 270 HB3 ALA 33 HB3 ALA 33 27.858 -9.077 4.711 271 H SER 34 HN SER 34 24.041 -7.973 3.977 272 HA SER 34 HA SER 34 23.574 -6.080 6.025 273 HB2 SER 34 HB2 SER 34 21.751 -6.885 3.758 274 HB3 SER 34 HB1 SER 34 21.666 -5.387 4.663 275 HG SER 34 HG SER 34 22.998 -4.713 3.178 276 H LEU 35 HN LEU 35 21.955 -9.058 5.069 277 HA LEU 35 HA LEU 35 19.747 -8.967 6.843 278 HB2 LEU 35 HB2 LEU 35 19.879 -10.502 4.919 279 HB3 LEU 35 HB1 LEU 35 21.233 -11.331 5.681 280 HG LEU 35 HG LEU 35 19.824 -12.068 7.531 281 HD11 LEU 35 HD11 LEU 35 17.997 -10.030 6.440 282 HD12 LEU 35 HD12 LEU 35 18.118 -10.747 8.054 283 HD13 LEU 35 HD13 LEU 35 17.210 -11.574 6.804 284 HD21 LEU 35 HD21 LEU 35 19.875 -13.339 5.328 285 HD22 LEU 35 HD22 LEU 35 18.339 -12.541 4.951 286 HD23 LEU 35 HD23 LEU 35 18.450 -13.625 6.339 287 H LYS 36 HN LYS 36 22.959 -10.321 7.164 288 HA LYS 36 HA LYS 36 22.775 -11.520 9.686 289 HB2 LYS 36 HB2 LYS 36 24.681 -11.903 8.398 290 HB3 LYS 36 HB1 LYS 36 24.981 -10.191 8.140 291 HG2 LYS 36 HG2 LYS 36 24.987 -11.005 11.009 292 HG3 LYS 36 HG1 LYS 36 26.256 -11.726 10.033 293 HD2 LYS 36 HD2 LYS 36 25.692 -8.747 10.201 294 HD3 LYS 36 HD1 LYS 36 27.007 -9.604 10.986 295 HE2 LYS 36 HE2 LYS 36 28.277 -9.538 9.116 296 HE3 LYS 36 HE1 LYS 36 27.015 -10.268 8.155 297 HZ1 LYS 36 HZ1 LYS 36 26.810 -7.353 8.828 298 HZ2 LYS 36 HZ2 LYS 36 26.106 -8.192 7.602 299 HZ3 LYS 36 HZ3 LYS 36 27.774 -7.905 7.575 300 H ASP 37 HN ASP 37 23.564 -8.188 8.748 301 HA ASP 37 HA ASP 37 24.106 -7.267 11.344 302 HB2 ASP 37 HB2 ASP 37 23.541 -5.940 8.747 303 HB3 ASP 37 HB1 ASP 37 23.479 -4.962 10.196 304 H MET 38 HN MET 38 21.042 -7.261 9.548 305 HA MET 38 HA MET 38 19.668 -5.631 11.377 306 HB2 MET 38 HB2 MET 38 18.063 -7.855 10.341 307 HB3 MET 38 HB1 MET 38 17.803 -6.125 10.288 308 HG2 MET 38 HG2 MET 38 19.489 -5.913 8.471 309 HG3 MET 38 HG1 MET 38 19.635 -7.658 8.442 310 HE1 MET 38 HE1 MET 38 17.589 -9.024 8.883 311 HE2 MET 38 HE2 MET 38 16.381 -9.144 7.630 312 HE3 MET 38 HE3 MET 38 16.038 -8.207 9.070 313 H VAL 39 HN VAL 39 20.360 -9.014 11.314 314 HA VAL 39 HA VAL 39 18.755 -9.789 13.460 315 HB VAL 39 HB VAL 39 21.366 -10.983 12.459 316 HG11 VAL 39 HG11 VAL 39 20.567 -11.545 14.954 317 HG12 VAL 39 HG12 VAL 39 21.119 -12.796 13.855 318 HG13 VAL 39 HG13 VAL 39 19.400 -12.548 14.083 319 HG21 VAL 39 HG21 VAL 39 18.441 -11.331 11.877 320 HG22 VAL 39 HG22 VAL 39 19.492 -12.729 11.752 321 HG23 VAL 39 HG23 VAL 39 19.803 -11.293 10.760 322 H PHE 40 HN PHE 40 22.038 -8.476 13.342 323 HA PHE 40 HA PHE 40 22.511 -8.600 16.143 324 HB2 PHE 40 HB2 PHE 40 24.415 -8.149 14.755 325 HB3 PHE 40 HB1 PHE 40 23.605 -6.763 14.008 326 HD1 PHE 40 HD2 PHE 40 24.598 -8.018 17.409 327 HD2 PHE 40 HD1 PHE 40 24.011 -4.622 14.850 328 HE1 PHE 40 HE2 PHE 40 25.436 -6.528 19.200 329 HE2 PHE 40 HE1 PHE 40 24.836 -3.124 16.652 330 HZ PHE 40 HZ PHE 40 25.547 -4.065 18.819 331 H LEU 41 HN LEU 41 21.147 -6.149 13.981 332 HA LEU 41 HA LEU 41 20.694 -4.132 15.917 333 HB2 LEU 41 HB2 LEU 41 18.982 -4.825 13.510 334 HB3 LEU 41 HB1 LEU 41 19.009 -3.292 14.356 335 HG LEU 41 HG LEU 41 21.331 -4.539 12.911 336 HD11 LEU 41 HD11 LEU 41 19.756 -2.064 12.165 337 HD12 LEU 41 HD12 LEU 41 19.499 -3.655 11.439 338 HD13 LEU 41 HD13 LEU 41 21.043 -2.832 11.241 339 HD21 LEU 41 HD21 LEU 41 22.358 -2.270 13.256 340 HD22 LEU 41 HD22 LEU 41 22.166 -3.250 14.705 341 HD23 LEU 41 HD23 LEU 41 21.044 -1.913 14.389 342 H ASP 42 HN ASP 42 18.785 -6.723 14.672 343 HA ASP 42 HA ASP 42 16.423 -6.206 16.212 344 HB2 ASP 42 HB2 ASP 42 16.574 -7.364 13.929 345 HB3 ASP 42 HB1 ASP 42 17.077 -8.785 14.816 346 H TYR 43 HN TYR 43 18.925 -8.751 16.494 347 HA TYR 43 HA TYR 43 17.700 -9.505 19.083 348 HB2 TYR 43 HB2 TYR 43 19.460 -11.203 17.304 349 HB3 TYR 43 HB1 TYR 43 18.606 -11.686 18.766 350 HD1 TYR 43 HD2 TYR 43 16.111 -11.656 18.865 351 HD2 TYR 43 HD1 TYR 43 18.281 -10.987 15.224 352 HE1 TYR 43 HE2 TYR 43 14.041 -12.040 17.557 353 HE2 TYR 43 HE1 TYR 43 16.224 -11.360 13.924 354 HH TYR 43 HH TYR 43 13.852 -11.141 14.325 355 H GLY 44 HN GLY 44 20.367 -7.806 17.972 356 HA2 GLY 44 HA2 GLY 44 22.227 -7.056 19.082 357 HA3 GLY 44 HA1 GLY 44 21.583 -7.806 20.538 358 H PHE 45 HN PHE 45 21.909 -9.773 17.751 359 HA PHE 45 HA PHE 45 23.698 -11.576 19.088 360 HB2 PHE 45 HB2 PHE 45 22.585 -11.513 16.275 361 HB3 PHE 45 HB1 PHE 45 23.719 -12.727 16.818 362 HD1 PHE 45 HD1 PHE 45 21.662 -11.702 19.599 363 HD2 PHE 45 HD2 PHE 45 21.649 -14.207 16.073 364 HE1 PHE 45 HE1 PHE 45 19.844 -13.016 20.540 365 HE2 PHE 45 HE2 PHE 45 19.799 -15.524 17.040 366 HZ PHE 45 HZ PHE 45 18.887 -14.945 19.268 367 HA PRO 46 HA PRO 46 27.358 -9.307 17.690 368 HB2 PRO 46 HB2 PRO 46 29.172 -11.186 18.608 369 HB3 PRO 46 HB1 PRO 46 28.504 -9.870 19.575 370 HG2 PRO 46 HG2 PRO 46 27.646 -12.711 19.460 371 HG3 PRO 46 HG1 PRO 46 27.786 -11.677 20.879 372 HD2 PRO 46 HD2 PRO 46 25.412 -12.211 19.802 373 HD3 PRO 46 HD1 PRO 46 25.740 -10.578 20.427 374 HA PRO 47 HA PRO 47 27.376 -11.497 13.777 375 HB2 PRO 47 HB2 PRO 47 29.636 -10.362 12.688 376 HB3 PRO 47 HB1 PRO 47 28.041 -9.580 12.725 377 HG2 PRO 47 HG2 PRO 47 30.361 -9.186 14.558 378 HG3 PRO 47 HG1 PRO 47 29.254 -7.994 13.855 379 HD2 PRO 47 HD2 PRO 47 28.928 -8.754 16.379 380 HD3 PRO 47 HD1 PRO 47 27.505 -8.489 15.338 381 H VAL 48 HN VAL 48 30.239 -11.359 15.755 382 HA VAL 48 HA VAL 48 31.705 -13.391 14.454 383 HB VAL 48 HB VAL 48 32.925 -12.005 15.928 384 HG11 VAL 48 HG11 VAL 48 30.556 -12.243 17.608 385 HG12 VAL 48 HG12 VAL 48 31.823 -11.033 17.634 386 HG13 VAL 48 HG13 VAL 48 32.024 -12.521 18.541 387 HG21 VAL 48 HG21 VAL 48 33.473 -14.494 16.007 388 HG22 VAL 48 HG22 VAL 48 32.543 -14.580 17.506 389 HG23 VAL 48 HG23 VAL 48 33.987 -13.579 17.421 390 H LEU 49 HN LEU 49 29.382 -13.495 17.117 391 HA LEU 49 HA LEU 49 29.756 -16.288 17.624 392 HB2 LEU 49 HB2 LEU 49 27.646 -14.327 18.499 393 HB3 LEU 49 HB1 LEU 49 27.500 -16.031 18.808 394 HG LEU 49 HG LEU 49 29.774 -16.056 19.818 395 HD11 LEU 49 HD11 LEU 49 30.411 -13.617 20.680 396 HD12 LEU 49 HD12 LEU 49 29.577 -13.124 19.211 397 HD13 LEU 49 HD13 LEU 49 30.960 -14.221 19.127 398 HD21 LEU 49 HD21 LEU 49 28.090 -16.069 21.424 399 HD22 LEU 49 HD22 LEU 49 27.522 -14.441 21.039 400 HD23 LEU 49 HD23 LEU 49 29.043 -14.680 21.904 401 H GLN 50 HN GLN 50 27.426 -14.445 15.726 402 HA GLN 50 HA GLN 50 25.919 -16.844 15.160 403 HB2 GLN 50 HB2 GLN 50 24.493 -15.345 13.740 404 HB3 GLN 50 HB1 GLN 50 24.604 -14.850 15.422 405 HG2 GLN 50 HG2 GLN 50 25.157 -12.809 14.606 406 HG3 GLN 50 HG1 GLN 50 26.737 -13.498 14.263 407 HE21 GLN 50 HE21 GLN 50 27.266 -13.902 12.072 408 HE22 GLN 50 HE22 GLN 50 26.269 -13.471 10.764 409 H GLN 51 HN GLN 51 26.189 -18.199 13.565 410 HA GLN 51 HA GLN 51 27.729 -17.324 11.213 411 HB2 GLN 51 HB2 GLN 51 27.439 -20.112 12.377 412 HB3 GLN 51 HB1 GLN 51 28.330 -19.695 10.917 413 HG2 GLN 51 HG2 GLN 51 28.956 -18.636 13.693 414 HG3 GLN 51 HG1 GLN 51 29.847 -19.906 12.859 415 HE21 GLN 51 HE21 GLN 51 30.186 -16.742 13.579 416 HE22 GLN 51 HE22 GLN 51 31.017 -16.225 12.195 417 H TRP 52 HN TRP 52 26.613 -17.260 9.412 418 HA TRP 52 HA TRP 52 23.883 -18.309 9.319 419 HB2 TRP 52 HB2 TRP 52 25.504 -16.523 7.494 420 HB3 TRP 52 HB1 TRP 52 23.938 -17.181 7.039 421 HD1 TRP 52 HD1 TRP 52 25.538 -14.968 9.753 422 HE1 TRP 52 HE1 TRP 52 23.733 -13.388 10.675 423 HE3 TRP 52 HE3 TRP 52 21.484 -16.765 7.236 424 HZ2 TRP 52 HZ2 TRP 52 20.897 -12.943 10.341 425 HZ3 TRP 52 HZ3 TRP 52 19.246 -15.741 7.553 426 HH2 TRP 52 HH2 TRP 52 18.960 -13.837 9.100 427 H VAL 53 HN VAL 53 23.330 -20.123 8.203 428 HA VAL 53 HA VAL 53 25.417 -21.308 6.475 429 HB VAL 53 HB VAL 53 23.376 -22.756 8.173 430 HG11 VAL 53 HG11 VAL 53 25.568 -23.709 6.314 431 HG12 VAL 53 HG12 VAL 53 23.848 -24.085 6.239 432 HG13 VAL 53 HG13 VAL 53 24.837 -24.731 7.545 433 HG21 VAL 53 HG21 VAL 53 26.328 -22.176 8.550 434 HG22 VAL 53 HG22 VAL 53 25.561 -23.562 9.309 435 HG23 VAL 53 HG23 VAL 53 25.013 -21.937 9.700 436 H ILE 54 HN ILE 54 24.831 -21.402 4.453 437 HA ILE 54 HA ILE 54 22.151 -22.221 3.758 438 HB ILE 54 HB ILE 54 23.431 -19.750 2.549 439 HG12 ILE 54 HG12 ILE 54 20.818 -20.033 4.081 440 HG13 ILE 54 HG11 ILE 54 22.305 -19.419 4.793 441 HG21 ILE 54 HG21 ILE 54 21.427 -19.628 1.157 442 HG22 ILE 54 HG22 ILE 54 20.764 -21.056 1.944 443 HG23 ILE 54 HG23 ILE 54 22.184 -21.203 0.902 444 HD11 ILE 54 HD11 ILE 54 20.617 -17.703 3.890 445 HD12 ILE 54 HD12 ILE 54 21.176 -18.174 2.287 446 HD13 ILE 54 HD13 ILE 54 22.310 -17.488 3.457 447 H GLY 55 HN GLY 55 22.418 -23.889 2.399 448 HA2 GLY 55 HA2 GLY 55 24.938 -24.730 1.503 449 HA3 GLY 55 HA1 GLY 55 23.401 -25.338 0.898 450 H GLN 56 HN GLN 56 22.347 -22.986 -0.127 451 HA GLN 56 HA GLN 56 23.509 -22.928 -2.693 452 HB2 GLN 56 HB2 GLN 56 21.443 -21.132 -1.411 453 HB3 GLN 56 HB1 GLN 56 21.908 -21.021 -3.101 454 HG2 GLN 56 HG2 GLN 56 21.247 -23.354 -3.469 455 HG3 GLN 56 HG1 GLN 56 20.823 -23.523 -1.769 456 HE21 GLN 56 HE21 GLN 56 18.876 -22.426 -1.025 457 HE22 GLN 56 HE22 GLN 56 17.745 -21.802 -2.118 458 H ARG 57 HN ARG 57 23.976 -20.846 0.098 459 HA ARG 57 HA ARG 57 24.928 -18.590 -1.218 460 HB2 ARG 57 HB2 ARG 57 25.126 -19.610 1.546 461 HB3 ARG 57 HB1 ARG 57 26.380 -18.495 1.060 462 HG2 ARG 57 HG2 ARG 57 23.917 -17.416 0.054 463 HG3 ARG 57 HG1 ARG 57 23.662 -17.835 1.738 464 HD2 ARG 57 HD2 ARG 57 26.038 -16.276 0.725 465 HD3 ARG 57 HD1 ARG 57 24.603 -15.536 1.384 466 HE ARG 57 HE ARG 57 25.286 -17.197 3.403 467 HH11 ARG 57 HH21 ARG 57 27.366 -15.149 1.397 468 HH12 ARG 57 HH22 ARG 57 28.360 -14.765 2.750 469 HH21 ARG 57 HH11 ARG 57 26.737 -16.618 5.112 470 HH22 ARG 57 HH12 ARG 57 28.046 -15.557 4.754 471 H LEU 58 HN LEU 58 26.755 -17.793 -1.829 472 HA LEU 58 HA LEU 58 29.044 -19.538 -2.373 473 HB2 LEU 58 HB2 LEU 58 28.546 -16.607 -2.947 474 HB3 LEU 58 HB1 LEU 58 29.918 -17.547 -3.522 475 HG LEU 58 HG LEU 58 27.006 -18.118 -4.212 476 HD11 LEU 58 HD11 LEU 58 29.224 -17.001 -5.942 477 HD12 LEU 58 HD12 LEU 58 27.870 -16.056 -5.288 478 HD13 LEU 58 HD13 LEU 58 27.574 -17.349 -6.440 479 HD21 LEU 58 HD21 LEU 58 29.623 -19.398 -5.100 480 HD22 LEU 58 HD22 LEU 58 28.090 -19.628 -5.925 481 HD23 LEU 58 HD23 LEU 58 28.271 -20.172 -4.267 482 H ALA 59 HN ALA 59 31.162 -18.784 -1.613 483 HA ALA 59 HA ALA 59 31.153 -18.045 1.165 484 HB1 ALA 59 HB1 ALA 59 33.314 -18.391 -0.904 485 HB2 ALA 59 HB2 ALA 59 33.044 -19.301 0.588 486 HB3 ALA 59 HB3 ALA 59 33.672 -17.655 0.656 487 H ARG 60 HN ARG 60 29.631 -16.181 0.019 488 HA ARG 60 HA ARG 60 31.180 -13.751 0.398 489 HB2 ARG 60 HB2 ARG 60 31.328 -14.214 -1.979 490 HB3 ARG 60 HB1 ARG 60 29.572 -14.301 -2.091 491 HG2 ARG 60 HG2 ARG 60 29.337 -11.951 -1.568 492 HG3 ARG 60 HG1 ARG 60 31.044 -11.831 -1.125 493 HD2 ARG 60 HD2 ARG 60 30.296 -11.005 -3.486 494 HD3 ARG 60 HD1 ARG 60 31.777 -11.918 -3.362 495 HE ARG 60 HE ARG 60 29.222 -12.829 -4.482 496 HH11 ARG 60 HH21 ARG 60 32.497 -13.598 -3.480 497 HH12 ARG 60 HH22 ARG 60 32.582 -15.035 -4.394 498 HH21 ARG 60 HH11 ARG 60 29.369 -14.750 -5.721 499 HH22 ARG 60 HH12 ARG 60 30.807 -15.696 -5.680 500 H ASP 61 HN ASP 61 30.136 -12.643 1.824 501 HA ASP 61 HA ASP 61 27.386 -13.153 2.565 502 HB2 ASP 61 HB2 ASP 61 29.342 -11.057 3.511 503 HB3 ASP 61 HB1 ASP 61 27.736 -11.305 4.174 504 H GLN 62 HN GLN 62 28.898 -10.921 0.487 505 HA GLN 62 HA GLN 62 26.899 -8.935 0.589 506 HB2 GLN 62 HB2 GLN 62 28.969 -9.503 -1.539 507 HB3 GLN 62 HB1 GLN 62 27.884 -8.114 -1.568 508 HG2 GLN 62 HG2 GLN 62 28.714 -7.392 0.635 509 HG3 GLN 62 HG1 GLN 62 29.784 -8.773 0.693 510 HE21 GLN 62 HE21 GLN 62 30.324 -5.736 0.487 511 HE22 GLN 62 HE22 GLN 62 31.417 -5.621 -0.806 512 H GLU 63 HN GLU 63 26.996 -11.954 -1.115 513 HA GLU 63 HA GLU 63 25.411 -11.295 -3.283 514 HB2 GLU 63 HB2 GLU 63 24.886 -13.633 -3.577 515 HB3 GLU 63 HB1 GLU 63 26.560 -13.510 -3.065 516 HG2 GLU 63 HG2 GLU 63 25.871 -14.063 -0.749 517 HG3 GLU 63 HG1 GLU 63 24.200 -14.165 -1.282 518 H THR 64 HN THR 64 23.231 -11.710 -3.819 519 HA THR 64 HA THR 64 21.448 -10.503 -1.964 520 HB THR 64 HB THR 64 20.726 -11.905 -4.522 521 HG1 THR 64 HG1 THR 64 22.094 -9.499 -4.028 522 HG21 THR 64 HG21 THR 64 19.319 -10.236 -2.677 523 HG22 THR 64 HG22 THR 64 18.735 -10.917 -4.186 524 HG23 THR 64 HG23 THR 64 19.503 -9.340 -4.176 525 H LEU 65 HN LEU 65 19.548 -11.456 -1.050 526 HA LEU 65 HA LEU 65 19.869 -14.072 0.014 527 HB2 LEU 65 HB2 LEU 65 17.309 -12.483 -0.329 528 HB3 LEU 65 HB1 LEU 65 17.480 -13.916 0.658 529 HG LEU 65 HG LEU 65 18.951 -11.298 1.063 530 HD11 LEU 65 HD11 LEU 65 16.535 -11.277 1.646 531 HD12 LEU 65 HD12 LEU 65 17.592 -11.061 3.052 532 HD13 LEU 65 HD13 LEU 65 16.830 -12.614 2.756 533 HD21 LEU 65 HD21 LEU 65 19.746 -12.313 3.157 534 HD22 LEU 65 HD22 LEU 65 20.335 -13.205 1.772 535 HD23 LEU 65 HD23 LEU 65 18.985 -13.847 2.732 536 H HIS 66 HN HIS 66 18.135 -12.808 -2.728 537 HA HIS 66 HA HIS 66 16.566 -14.876 -3.497 538 HB2 HIS 66 HB2 HIS 66 16.976 -12.607 -4.663 539 HB3 HIS 66 HB1 HIS 66 18.214 -13.460 -5.577 540 HD1 HIS 66 HD1 HIS 66 17.285 -15.808 -6.745 541 HD2 HIS 66 HD2 HIS 66 14.425 -12.934 -5.727 542 HE1 HIS 66 HE1 HIS 66 15.227 -16.310 -8.121 543 HE2 HIS 66 HE2 HIS 66 13.475 -14.567 -7.509 544 H SER 67 HN SER 67 20.100 -14.903 -3.578 545 HA SER 67 HA SER 67 20.438 -16.996 -5.423 546 HB2 SER 67 HB2 SER 67 22.617 -17.360 -4.272 547 HB3 SER 67 HB1 SER 67 22.341 -15.677 -4.665 548 HG SER 67 HG SER 67 23.103 -16.076 -2.544 549 H HIS 68 HN HIS 68 19.634 -16.903 -2.059 550 HA HIS 68 HA HIS 68 19.744 -19.744 -1.590 551 HB2 HIS 68 HB2 HIS 68 19.909 -18.211 0.312 552 HB3 HIS 68 HB1 HIS 68 18.363 -17.494 -0.104 553 HD1 HIS 68 HD1 HIS 68 19.409 -21.172 0.371 554 HD2 HIS 68 HD2 HIS 68 16.545 -18.463 1.770 555 HE1 HIS 68 HE1 HIS 68 17.915 -22.425 1.988 556 HE2 HIS 68 HE2 HIS 68 16.183 -20.756 2.845 557 H GLY 69 HN GLY 69 17.854 -17.874 -3.532 558 HA2 GLY 69 HA2 GLY 69 16.151 -18.643 -4.884 559 HA3 GLY 69 HA1 GLY 69 15.816 -19.935 -3.746 560 H VAL 70 HN VAL 70 16.253 -17.143 -2.040 561 HA VAL 70 HA VAL 70 13.567 -17.013 -1.181 562 HB VAL 70 HB VAL 70 15.818 -15.009 -0.862 563 HG11 VAL 70 HG11 VAL 70 14.450 -14.352 1.183 564 HG12 VAL 70 HG12 VAL 70 13.114 -15.256 0.476 565 HG13 VAL 70 HG13 VAL 70 13.793 -13.862 -0.376 566 HG21 VAL 70 HG21 VAL 70 16.527 -16.226 0.960 567 HG22 VAL 70 HG22 VAL 70 15.792 -17.558 0.072 568 HG23 VAL 70 HG23 VAL 70 14.905 -16.775 1.366 569 H ARG 71 HN ARG 71 11.912 -15.867 -1.938 570 HA ARG 71 HA ARG 71 12.309 -13.469 -3.469 571 HB2 ARG 71 HB2 ARG 71 10.698 -14.353 -5.299 572 HB3 ARG 71 HB1 ARG 71 12.419 -14.719 -5.391 573 HG2 ARG 71 HG2 ARG 71 11.652 -16.879 -3.976 574 HG3 ARG 71 HG1 ARG 71 10.119 -16.547 -4.785 575 HD2 ARG 71 HD2 ARG 71 12.807 -17.017 -6.069 576 HD3 ARG 71 HD1 ARG 71 11.385 -18.051 -6.176 577 HE ARG 71 HE ARG 71 10.604 -15.578 -7.166 578 HH11 ARG 71 HH21 ARG 71 13.019 -18.014 -7.888 579 HH12 ARG 71 HH22 ARG 71 13.102 -17.633 -9.551 580 HH21 ARG 71 HH11 ARG 71 10.726 -15.071 -9.411 581 HH22 ARG 71 HH12 ARG 71 11.791 -15.954 -10.418 582 H GLN 72 HN GLN 72 10.148 -15.824 -2.064 583 HA GLN 72 HA GLN 72 8.222 -13.655 -1.553 584 HB2 GLN 72 HB2 GLN 72 7.683 -16.586 -2.076 585 HB3 GLN 72 HB1 GLN 72 6.498 -15.479 -1.403 586 HG2 GLN 72 HG2 GLN 72 6.661 -14.040 -3.311 587 HG3 GLN 72 HG1 GLN 72 7.919 -15.037 -4.044 588 HE21 GLN 72 HE21 GLN 72 7.276 -17.185 -4.838 589 HE22 GLN 72 HE22 GLN 72 5.646 -17.563 -5.128 590 H ASN 73 HN ASN 73 7.118 -13.818 0.351 591 HA ASN 73 HA ASN 73 8.701 -14.285 2.658 592 HB2 ASN 73 HB2 ASN 73 6.842 -13.647 3.950 593 HB3 ASN 73 HB1 ASN 73 6.555 -12.805 2.423 594 HD21 ASN 73 HD21 ASN 73 5.091 -14.085 0.860 595 HD22 ASN 73 HD22 ASN 73 3.827 -14.983 1.529 596 H GLY 74 HN GLY 74 8.474 -15.885 4.308 597 HA2 GLY 74 HA2 GLY 74 7.714 -17.908 5.162 598 HA3 GLY 74 HA1 GLY 74 7.007 -18.329 3.607 599 H ASP 75 HN ASP 75 10.101 -17.010 3.270 600 HA ASP 75 HA ASP 75 11.168 -19.604 2.603 601 HB2 ASP 75 HB2 ASP 75 11.683 -17.259 1.454 602 HB3 ASP 75 HB1 ASP 75 12.960 -17.224 2.659 603 H SER 76 HN SER 76 13.175 -20.391 3.437 604 HA SER 76 HA SER 76 13.418 -19.735 6.298 605 HB2 SER 76 HB2 SER 76 14.061 -22.374 6.273 606 HB3 SER 76 HB1 SER 76 12.469 -21.719 6.609 607 HG SER 76 HG SER 76 12.480 -23.350 5.019 608 H ALA 77 HN ALA 77 15.424 -19.655 7.178 609 HA ALA 77 HA ALA 77 17.760 -20.440 5.554 610 HB1 ALA 77 HB1 ALA 77 18.319 -18.277 5.312 611 HB2 ALA 77 HB2 ALA 77 18.615 -18.214 7.049 612 HB3 ALA 77 HB3 ALA 77 17.043 -17.755 6.403 613 H TYR 78 HN TYR 78 19.828 -20.408 7.024 614 HA TYR 78 HA TYR 78 19.094 -21.494 9.674 615 HB2 TYR 78 HB2 TYR 78 21.270 -22.625 7.927 616 HB3 TYR 78 HB1 TYR 78 20.548 -23.346 9.352 617 HD1 TYR 78 HD2 TYR 78 18.152 -24.126 9.316 618 HD2 TYR 78 HD1 TYR 78 20.170 -22.788 5.763 619 HE1 TYR 78 HE2 TYR 78 16.384 -25.128 7.939 620 HE2 TYR 78 HE1 TYR 78 18.387 -23.795 4.375 621 HH TYR 78 HH TYR 78 16.702 -25.702 4.679 622 H LEU 79 HN LEU 79 20.245 -20.793 11.349 623 HA LEU 79 HA LEU 79 22.798 -19.408 10.886 624 HB2 LEU 79 HB2 LEU 79 20.857 -17.841 11.138 625 HB3 LEU 79 HB1 LEU 79 20.613 -18.461 12.766 626 HG LEU 79 HG LEU 79 23.304 -17.368 11.885 627 HD11 LEU 79 HD11 LEU 79 22.698 -15.218 12.114 628 HD12 LEU 79 HD12 LEU 79 21.556 -15.548 13.405 629 HD13 LEU 79 HD13 LEU 79 21.084 -15.796 11.734 630 HD21 LEU 79 HD21 LEU 79 22.136 -18.406 14.370 631 HD22 LEU 79 HD22 LEU 79 22.691 -16.757 14.566 632 HD23 LEU 79 HD23 LEU 79 23.808 -17.988 14.000 633 H TYR 80 HN TYR 80 24.363 -19.972 12.352 634 HA TYR 80 HA TYR 80 23.532 -21.541 14.729 635 HB2 TYR 80 HB2 TYR 80 24.729 -22.778 12.708 636 HB3 TYR 80 HB1 TYR 80 26.177 -22.082 13.419 637 HD1 TYR 80 HD2 TYR 80 26.544 -22.413 15.985 638 HD2 TYR 80 HD1 TYR 80 23.759 -24.728 13.655 639 HE1 TYR 80 HE2 TYR 80 26.487 -24.121 17.748 640 HE2 TYR 80 HE1 TYR 80 23.709 -26.441 15.432 641 HH TYR 80 HH TYR 80 24.121 -26.288 17.986 642 H LEU 81 HN LEU 81 24.520 -21.016 16.655 643 HA LEU 81 HA LEU 81 26.267 -18.668 16.552 644 HB2 LEU 81 HB2 LEU 81 24.503 -19.812 18.671 645 HB3 LEU 81 HB1 LEU 81 25.798 -18.705 19.108 646 HG LEU 81 HG LEU 81 24.856 -17.122 17.308 647 HD11 LEU 81 HD11 LEU 81 22.558 -19.078 17.573 648 HD12 LEU 81 HD12 LEU 81 23.443 -18.660 16.118 649 HD13 LEU 81 HD13 LEU 81 22.395 -17.466 16.880 650 HD21 LEU 81 HD21 LEU 81 23.068 -16.285 18.827 651 HD22 LEU 81 HD22 LEU 81 24.561 -16.661 19.696 652 HD23 LEU 81 HD23 LEU 81 23.187 -17.776 19.763 653 H LEU 82 HN LEU 82 28.294 -18.689 17.279 654 HA LEU 82 HA LEU 82 29.494 -21.247 18.078 655 HB2 LEU 82 HB2 LEU 82 30.630 -18.608 17.168 656 HB3 LEU 82 HB1 LEU 82 31.621 -19.746 18.067 657 HG LEU 82 HG LEU 82 31.643 -19.924 15.463 658 HD11 LEU 82 HD11 LEU 82 30.991 -22.481 16.907 659 HD12 LEU 82 HD12 LEU 82 32.511 -21.605 17.183 660 HD13 LEU 82 HD13 LEU 82 32.116 -22.220 15.579 661 HD21 LEU 82 HD21 LEU 82 29.124 -21.544 16.000 662 HD22 LEU 82 HD22 LEU 82 29.870 -21.206 14.456 663 HD23 LEU 82 HD23 LEU 82 29.076 -19.908 15.346 664 H SER 83 HN SER 83 30.518 -21.602 20.022 665 HA SER 83 HA SER 83 29.365 -20.362 22.280 666 HB2 SER 83 HB2 SER 83 31.907 -21.878 22.556 667 HB3 SER 83 HB1 SER 83 30.458 -21.919 23.543 668 HG SER 83 HG SER 83 31.144 -23.281 21.244 669 H ALA 84 HN ALA 84 30.270 -18.266 20.962 670 HA ALA 84 HA ALA 84 32.572 -17.285 22.528 671 HB1 ALA 84 HB1 ALA 84 33.101 -16.075 20.711 672 HB2 ALA 84 HB2 ALA 84 31.570 -15.263 20.826 673 HB3 ALA 84 HB3 ALA 84 31.712 -16.728 19.839 674 H ARG 85 HN ARG 85 32.169 -14.836 23.004 675 HA ARG 85 HA ARG 85 29.481 -14.476 24.077 676 HB2 ARG 85 HB2 ARG 85 32.030 -14.202 25.659 677 HB3 ARG 85 HB1 ARG 85 30.514 -13.444 26.147 678 HG2 ARG 85 HG2 ARG 85 29.374 -15.625 26.134 679 HG3 ARG 85 HG1 ARG 85 30.863 -16.408 25.612 680 HD2 ARG 85 HD2 ARG 85 31.980 -15.721 27.727 681 HD3 ARG 85 HD1 ARG 85 30.524 -14.871 28.204 682 HE ARG 85 HE ARG 85 29.522 -16.874 28.746 683 HH11 ARG 85 HH21 ARG 85 32.424 -17.418 26.906 684 HH12 ARG 85 HH22 ARG 85 32.493 -19.100 27.206 685 HH21 ARG 85 HH11 ARG 85 29.582 -19.122 29.171 686 HH22 ARG 85 HH12 ARG 85 30.831 -20.082 28.515 687 H ASN 86 HN ASN 86 28.928 -12.329 24.515 688 HA ASN 86 HA ASN 86 29.143 -10.586 22.510 689 HB2 ASN 86 HB2 ASN 86 28.696 -8.750 24.118 690 HB3 ASN 86 HB1 ASN 86 27.636 -10.144 24.321 691 HD21 ASN 86 HD21 ASN 86 28.224 -8.166 26.363 692 HD22 ASN 86 HD22 ASN 86 29.021 -8.945 27.646 693 H THR 87 HN THR 87 31.041 -10.264 21.455 694 HA THR 87 HA THR 87 33.518 -9.716 22.705 695 HB THR 87 HB THR 87 34.081 -8.910 20.342 696 HG1 THR 87 HG1 THR 87 32.533 -9.033 18.862 697 HG21 THR 87 HG21 THR 87 33.122 -11.656 21.102 698 HG22 THR 87 HG22 THR 87 34.748 -11.088 20.757 699 HG23 THR 87 HG23 THR 87 33.621 -11.353 19.435 700 H SER 88 HN SER 88 30.866 -7.807 21.565 701 HA SER 88 HA SER 88 32.017 -5.218 21.867 702 HB2 SER 88 HB2 SER 88 29.124 -5.604 22.459 703 HB3 SER 88 HB1 SER 88 29.922 -4.462 21.401 704 HG SER 88 HG SER 88 30.459 -6.435 20.140 705 H LEU 89 HN LEU 89 31.029 -3.765 23.727 706 HA LEU 89 HA LEU 89 32.002 -4.801 26.172 707 HB2 LEU 89 HB2 LEU 89 30.375 -2.374 25.460 708 HB3 LEU 89 HB1 LEU 89 30.627 -2.800 27.146 709 HG LEU 89 HG LEU 89 32.351 -1.205 26.337 710 HD11 LEU 89 HD11 LEU 89 32.737 -3.362 27.943 711 HD12 LEU 89 HD12 LEU 89 33.956 -2.151 27.611 712 HD13 LEU 89 HD13 LEU 89 33.959 -3.657 26.710 713 HD21 LEU 89 HD21 LEU 89 33.405 -3.457 24.599 714 HD22 LEU 89 HD22 LEU 89 33.901 -1.771 24.631 715 HD23 LEU 89 HD23 LEU 89 32.345 -2.203 23.942 716 H ASN 90 HN ASN 90 28.787 -4.457 24.851 717 HA ASN 90 HA ASN 90 27.717 -6.147 27.024 718 HB2 ASN 90 HB2 ASN 90 26.222 -4.225 25.239 719 HB3 ASN 90 HB1 ASN 90 25.542 -5.176 26.548 720 HD21 ASN 90 HD21 ASN 90 27.580 -4.863 28.540 721 HD22 ASN 90 HD22 ASN 90 27.646 -3.234 28.959 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 5.664 0.258 3.476 2 H2 MET 1 HT2 MET 1 5.127 1.234 2.218 3 H3 MET 1 HT3 MET 1 6.125 1.883 3.432 4 HA MET 1 HA MET 1 7.892 1.403 2.213 5 HB2 MET 1 HB2 MET 1 6.794 -1.424 2.467 6 HB3 MET 1 HB1 MET 1 8.338 -1.062 1.728 7 HG2 MET 1 HG2 MET 1 8.530 -1.656 4.162 8 HG3 MET 1 HG1 MET 1 9.206 -0.096 3.774 9 HE1 MET 1 HE1 MET 1 6.922 -1.874 6.324 10 HE2 MET 1 HE2 MET 1 6.142 -2.046 4.752 11 HE3 MET 1 HE3 MET 1 5.363 -1.102 6.008 12 HA PRO 2 HA PRO 2 6.542 1.916 -2.037 13 HB2 PRO 2 HB2 PRO 2 9.156 0.660 -2.725 14 HB3 PRO 2 HB1 PRO 2 8.464 2.199 -3.261 15 HG2 PRO 2 HG2 PRO 2 10.400 2.208 -1.477 16 HG3 PRO 2 HG1 PRO 2 9.032 3.314 -1.279 17 HD2 PRO 2 HD2 PRO 2 9.618 0.786 0.201 18 HD3 PRO 2 HD1 PRO 2 8.895 2.325 0.756 19 H THR 3 HN THR 3 8.260 -1.060 -1.226 20 HA THR 3 HA THR 3 6.273 -2.621 -2.729 21 HB THR 3 HB THR 3 8.267 -4.254 -3.051 22 HG1 THR 3 HG1 THR 3 9.883 -3.395 -1.985 23 HG21 THR 3 HG21 THR 3 7.069 -2.818 -4.798 24 HG22 THR 3 HG22 THR 3 8.715 -3.302 -5.174 25 HG23 THR 3 HG23 THR 3 8.390 -1.668 -4.606 26 H GLN 4 HN GLN 4 5.976 -4.793 -1.846 27 HA GLN 4 HA GLN 4 6.061 -4.650 1.059 28 HB2 GLN 4 HB2 GLN 4 4.924 -6.861 -0.657 29 HB3 GLN 4 HB1 GLN 4 4.622 -6.572 1.042 30 HG2 GLN 4 HG2 GLN 4 3.810 -4.668 -1.198 31 HG3 GLN 4 HG1 GLN 4 2.747 -5.727 -0.293 32 HE21 GLN 4 HE21 GLN 4 3.907 -2.580 -0.348 33 HE22 GLN 4 HE22 GLN 4 3.587 -2.165 1.262 34 H ASP 5 HN ASP 5 7.314 -5.778 2.312 35 HA ASP 5 HA ASP 5 9.620 -7.131 1.241 36 HB2 ASP 5 HB2 ASP 5 8.606 -6.770 4.059 37 HB3 ASP 5 HB1 ASP 5 10.031 -7.717 3.673 38 H ILE 6 HN ILE 6 10.205 -9.275 2.228 39 HA ILE 6 HA ILE 6 7.883 -11.075 2.159 40 HB ILE 6 HB ILE 6 9.277 -12.730 1.033 41 HG12 ILE 6 HG12 ILE 6 11.373 -10.554 0.804 42 HG13 ILE 6 HG11 ILE 6 11.485 -11.871 1.978 43 HG21 ILE 6 HG21 ILE 6 9.625 -11.456 -1.151 44 HG22 ILE 6 HG22 ILE 6 9.209 -9.999 -0.279 45 HG23 ILE 6 HG23 ILE 6 8.009 -11.295 -0.452 46 HD11 ILE 6 HD11 ILE 6 11.130 -12.354 -0.976 47 HD12 ILE 6 HD12 ILE 6 11.587 -13.505 0.276 48 HD13 ILE 6 HD13 ILE 6 12.722 -12.236 -0.213 49 H ARG 7 HN ARG 7 8.197 -13.015 3.369 50 HA ARG 7 HA ARG 7 9.639 -12.432 5.845 51 HB2 ARG 7 HB2 ARG 7 7.405 -14.369 5.216 52 HB3 ARG 7 HB1 ARG 7 8.076 -14.012 6.803 53 HG2 ARG 7 HG2 ARG 7 7.413 -11.682 6.672 54 HG3 ARG 7 HG1 ARG 7 6.926 -11.876 5.004 55 HD2 ARG 7 HD2 ARG 7 4.939 -11.935 6.399 56 HD3 ARG 7 HD1 ARG 7 5.215 -13.497 5.651 57 HE ARG 7 HE ARG 7 6.421 -13.361 8.243 58 HH11 ARG 7 HH21 ARG 7 3.437 -13.734 6.507 59 HH12 ARG 7 HH22 ARG 7 2.651 -14.589 7.765 60 HH21 ARG 7 HH11 ARG 7 5.376 -14.513 9.927 61 HH22 ARG 7 HH12 ARG 7 3.753 -15.045 9.731 62 H LEU 8 HN LEU 8 11.318 -13.584 6.464 63 HA LEU 8 HA LEU 8 11.826 -16.215 5.217 64 HB2 LEU 8 HB2 LEU 8 13.562 -14.641 4.549 65 HB3 LEU 8 HB1 LEU 8 13.770 -14.122 6.212 66 HG LEU 8 HG LEU 8 14.504 -16.440 6.832 67 HD11 LEU 8 HD11 LEU 8 13.850 -18.043 5.442 68 HD12 LEU 8 HD12 LEU 8 15.248 -17.610 4.459 69 HD13 LEU 8 HD13 LEU 8 13.664 -16.967 4.060 70 HD21 LEU 8 HD21 LEU 8 15.970 -14.882 4.697 71 HD22 LEU 8 HD22 LEU 8 16.658 -16.345 5.391 72 HD23 LEU 8 HD23 LEU 8 16.298 -14.966 6.430 73 H TRP 9 HN TRP 9 11.841 -17.885 6.570 74 HA TRP 9 HA TRP 9 11.756 -17.383 9.495 75 HB2 TRP 9 HB2 TRP 9 11.507 -20.088 8.204 76 HB3 TRP 9 HB1 TRP 9 10.882 -19.532 9.745 77 HD1 TRP 9 HD1 TRP 9 9.346 -16.921 8.781 78 HE1 TRP 9 HE1 TRP 9 7.191 -17.193 7.364 79 HE3 TRP 9 HE3 TRP 9 10.071 -21.618 6.955 80 HZ2 TRP 9 HZ2 TRP 9 5.967 -19.133 5.680 81 HZ3 TRP 9 HZ3 TRP 9 8.434 -22.656 5.453 82 HH2 TRP 9 HH2 TRP 9 6.354 -21.407 4.799 83 H VAL 10 HN VAL 10 13.519 -17.884 10.750 84 HA VAL 10 HA VAL 10 15.628 -19.469 9.432 85 HB VAL 10 HB VAL 10 16.090 -17.147 11.287 86 HG11 VAL 10 HG11 VAL 10 17.913 -18.936 9.676 87 HG12 VAL 10 HG12 VAL 10 17.937 -18.646 11.412 88 HG13 VAL 10 HG13 VAL 10 18.426 -17.371 10.296 89 HG21 VAL 10 HG21 VAL 10 15.109 -16.406 9.146 90 HG22 VAL 10 HG22 VAL 10 16.327 -17.310 8.261 91 HG23 VAL 10 HG23 VAL 10 16.797 -15.925 9.271 92 H SER 11 HN SER 11 16.333 -21.164 10.544 93 HA SER 11 HA SER 11 15.370 -21.607 13.279 94 HB2 SER 11 HB2 SER 11 17.132 -23.453 11.654 95 HB3 SER 11 HB1 SER 11 16.117 -23.854 13.019 96 HG SER 11 HG SER 11 15.247 -24.353 10.897 97 H VAL 12 HN VAL 12 16.621 -21.360 15.077 98 HA VAL 12 HA VAL 12 19.461 -20.655 14.631 99 HB VAL 12 HB VAL 12 17.429 -19.539 16.551 100 HG11 VAL 12 HG11 VAL 12 19.567 -19.858 17.756 101 HG12 VAL 12 HG12 VAL 12 19.243 -18.158 17.478 102 HG13 VAL 12 HG13 VAL 12 20.414 -18.992 16.472 103 HG21 VAL 12 HG21 VAL 12 17.904 -18.737 14.008 104 HG22 VAL 12 HG22 VAL 12 19.185 -17.848 14.819 105 HG23 VAL 12 HG23 VAL 12 17.512 -17.607 15.299 106 H GLU 13 HN GLU 13 20.950 -21.696 15.758 107 HA GLU 13 HA GLU 13 20.188 -23.273 18.142 108 HB2 GLU 13 HB2 GLU 13 22.046 -24.154 15.907 109 HB3 GLU 13 HB1 GLU 13 21.818 -24.975 17.429 110 HG2 GLU 13 HG2 GLU 13 19.495 -25.381 17.025 111 HG3 GLU 13 HG1 GLU 13 19.492 -24.424 15.552 112 H ASP 14 HN ASP 14 21.136 -22.135 19.720 113 HA ASP 14 HA ASP 14 23.515 -20.596 19.250 114 HB2 ASP 14 HB2 ASP 14 21.658 -20.008 20.854 115 HB3 ASP 14 HB1 ASP 14 22.364 -21.208 21.955 116 H ALA 15 HN ALA 15 25.475 -20.875 20.091 117 HA ALA 15 HA ALA 15 26.598 -23.504 20.364 118 HB1 ALA 15 HB1 ALA 15 28.152 -21.805 19.730 119 HB2 ALA 15 HB2 ALA 15 28.545 -22.185 21.405 120 HB3 ALA 15 HB3 ALA 15 27.609 -20.741 21.030 121 H GLN 16 HN GLN 16 25.038 -21.288 22.418 122 HA GLN 16 HA GLN 16 25.891 -22.367 24.964 123 HB2 GLN 16 HB2 GLN 16 23.485 -20.637 24.303 124 HB3 GLN 16 HB1 GLN 16 24.175 -20.928 25.894 125 HG2 GLN 16 HG2 GLN 16 25.648 -19.592 23.600 126 HG3 GLN 16 HG1 GLN 16 24.924 -18.754 24.960 127 HE21 GLN 16 HE21 GLN 16 27.881 -19.824 23.931 128 HE22 GLN 16 HE22 GLN 16 28.591 -20.113 25.440 129 H MET 17 HN MET 17 24.301 -23.838 22.605 130 HA MET 17 HA MET 17 22.853 -25.571 22.434 131 HB2 MET 17 HB2 MET 17 23.082 -25.662 25.458 132 HB3 MET 17 HB1 MET 17 22.224 -26.841 24.495 133 HG2 MET 17 HG2 MET 17 25.170 -26.180 24.232 134 HG3 MET 17 HG1 MET 17 24.515 -27.643 24.960 135 HE1 MET 17 HE1 MET 17 22.809 -28.948 23.972 136 HE2 MET 17 HE2 MET 17 23.038 -29.710 22.400 137 HE3 MET 17 HE3 MET 17 21.975 -28.322 22.538 138 H HIS 18 HN HIS 18 21.942 -23.064 22.256 139 HA HIS 18 HA HIS 18 19.284 -23.181 23.537 140 HB2 HIS 18 HB2 HIS 18 20.934 -21.170 23.991 141 HB3 HIS 18 HB1 HIS 18 20.403 -20.636 22.402 142 HD1 HIS 18 HD1 HIS 18 17.998 -19.849 22.139 143 HD2 HIS 18 HD2 HIS 18 18.883 -21.179 25.982 144 HE1 HIS 18 HE1 HIS 18 16.049 -19.152 23.599 145 HE2 HIS 18 HE2 HIS 18 16.575 -19.959 25.956 146 H THR 19 HN THR 19 17.799 -23.845 22.109 147 HA THR 19 HA THR 19 18.217 -23.371 19.252 148 HB THR 19 HB THR 19 16.113 -25.071 20.625 149 HG1 THR 19 HG1 THR 19 18.480 -25.593 20.783 150 HG21 THR 19 HG21 THR 19 15.690 -25.996 18.468 151 HG22 THR 19 HG22 THR 19 17.080 -25.165 17.764 152 HG23 THR 19 HG23 THR 19 15.665 -24.249 18.257 153 H VAL 20 HN VAL 20 17.147 -21.802 18.225 154 HA VAL 20 HA VAL 20 14.674 -20.751 19.425 155 HB VAL 20 HB VAL 20 16.755 -18.890 18.281 156 HG11 VAL 20 HG11 VAL 20 14.348 -18.581 20.089 157 HG12 VAL 20 HG12 VAL 20 14.581 -17.889 18.483 158 HG13 VAL 20 HG13 VAL 20 15.543 -17.319 19.839 159 HG21 VAL 20 HG21 VAL 20 17.908 -19.987 20.088 160 HG22 VAL 20 HG22 VAL 20 16.461 -19.923 21.104 161 HG23 VAL 20 HG23 VAL 20 17.334 -18.433 20.712 162 H THR 21 HN THR 21 13.370 -19.528 17.979 163 HA THR 21 HA THR 21 13.814 -20.108 15.121 164 HB THR 21 HB THR 21 11.188 -19.909 16.616 165 HG1 THR 21 HG1 THR 21 12.134 -21.803 17.119 166 HG21 THR 21 HG21 THR 21 11.620 -20.894 13.798 167 HG22 THR 21 HG22 THR 21 11.275 -19.197 14.146 168 HG23 THR 21 HG23 THR 21 10.114 -20.438 14.578 169 H ILE 22 HN ILE 22 13.978 -18.257 13.926 170 HA ILE 22 HA ILE 22 12.636 -15.868 14.973 171 HB ILE 22 HB ILE 22 14.504 -14.457 14.356 172 HG12 ILE 22 HG12 ILE 22 15.971 -17.039 13.627 173 HG13 ILE 22 HG11 ILE 22 15.341 -15.806 12.503 174 HG21 ILE 22 HG21 ILE 22 15.934 -14.969 16.160 175 HG22 ILE 22 HG22 ILE 22 15.708 -16.703 15.977 176 HG23 ILE 22 HG23 ILE 22 14.403 -15.707 16.624 177 HD11 ILE 22 HD11 ILE 22 17.261 -15.046 14.692 178 HD12 ILE 22 HD12 ILE 22 16.869 -14.179 13.213 179 HD13 ILE 22 HD13 ILE 22 17.843 -15.647 13.141 180 H TRP 23 HN TRP 23 11.952 -14.406 13.421 181 HA TRP 23 HA TRP 23 11.878 -15.458 10.658 182 HB2 TRP 23 HB2 TRP 23 9.619 -13.915 11.928 183 HB3 TRP 23 HB1 TRP 23 9.601 -14.879 10.452 184 HD1 TRP 23 HD1 TRP 23 8.846 -17.357 10.696 185 HE1 TRP 23 HE1 TRP 23 8.374 -18.915 12.664 186 HE3 TRP 23 HE3 TRP 23 10.445 -14.435 14.554 187 HZ2 TRP 23 HZ2 TRP 23 8.624 -18.946 15.508 188 HZ3 TRP 23 HZ3 TRP 23 10.316 -15.252 16.878 189 HH2 TRP 23 HH2 TRP 23 9.404 -17.515 17.360 190 H LEU 24 HN LEU 24 12.455 -14.026 9.156 191 HA LEU 24 HA LEU 24 12.766 -11.199 9.989 192 HB2 LEU 24 HB2 LEU 24 14.285 -12.684 7.824 193 HB3 LEU 24 HB1 LEU 24 14.460 -10.994 8.228 194 HG LEU 24 HG LEU 24 16.261 -12.201 9.297 195 HD11 LEU 24 HD11 LEU 24 14.916 -10.372 10.585 196 HD12 LEU 24 HD12 LEU 24 16.129 -11.350 11.411 197 HD13 LEU 24 HD13 LEU 24 14.421 -11.729 11.607 198 HD21 LEU 24 HD21 LEU 24 14.599 -14.335 9.434 199 HD22 LEU 24 HD22 LEU 24 14.510 -13.757 11.105 200 HD23 LEU 24 HD23 LEU 24 16.073 -14.162 10.391 201 H THR 25 HN THR 25 11.656 -9.694 8.916 202 HA THR 25 HA THR 25 10.289 -10.479 6.416 203 HB THR 25 HB THR 25 9.777 -7.919 7.966 204 HG1 THR 25 HG1 THR 25 8.750 -9.042 9.391 205 HG21 THR 25 HG21 THR 25 9.012 -8.304 5.552 206 HG22 THR 25 HG22 THR 25 7.775 -7.816 6.692 207 HG23 THR 25 HG23 THR 25 7.901 -9.501 6.200 208 H VAL 26 HN VAL 26 11.537 -10.026 4.726 209 HA VAL 26 HA VAL 26 13.013 -7.482 4.584 210 HB VAL 26 HB VAL 26 15.078 -8.665 3.943 211 HG11 VAL 26 HG11 VAL 26 14.012 -9.575 6.631 212 HG12 VAL 26 HG12 VAL 26 14.728 -7.993 6.311 213 HG13 VAL 26 HG13 VAL 26 15.703 -9.446 6.167 214 HG21 VAL 26 HG21 VAL 26 15.084 -11.172 4.664 215 HG22 VAL 26 HG22 VAL 26 14.391 -10.757 3.096 216 HG23 VAL 26 HG23 VAL 26 13.335 -11.080 4.469 217 H ARG 27 HN ARG 27 14.414 -7.883 2.331 218 HA ARG 27 HA ARG 27 12.404 -8.739 0.373 219 HB2 ARG 27 HB2 ARG 27 13.331 -6.955 -1.111 220 HB3 ARG 27 HB1 ARG 27 12.351 -6.388 0.223 221 HG2 ARG 27 HG2 ARG 27 15.204 -6.647 0.946 222 HG3 ARG 27 HG1 ARG 27 14.943 -5.487 -0.333 223 HD2 ARG 27 HD2 ARG 27 12.975 -5.240 1.853 224 HD3 ARG 27 HD1 ARG 27 14.629 -4.992 2.349 225 HE ARG 27 HE ARG 27 14.782 -3.351 0.433 226 HH11 ARG 27 HH21 ARG 27 11.681 -4.013 2.067 227 HH12 ARG 27 HH22 ARG 27 11.094 -2.458 1.664 228 HH21 ARG 27 HH11 ARG 27 13.843 -1.341 -0.050 229 HH22 ARG 27 HH12 ARG 27 12.252 -0.958 0.468 230 HA PRO 28 HA PRO 28 15.435 -11.461 -1.286 231 HB2 PRO 28 HB2 PRO 28 14.738 -10.451 -3.997 232 HB3 PRO 28 HB1 PRO 28 14.677 -12.095 -3.327 233 HG2 PRO 28 HG2 PRO 28 12.480 -10.736 -3.758 234 HG3 PRO 28 HG1 PRO 28 12.634 -11.790 -2.344 235 HD2 PRO 28 HD2 PRO 28 12.750 -8.802 -2.480 236 HD3 PRO 28 HD1 PRO 28 12.083 -9.863 -1.213 237 H ASP 29 HN ASP 29 15.416 -8.082 -2.246 238 HA ASP 29 HA ASP 29 18.014 -8.241 -3.483 239 HB2 ASP 29 HB2 ASP 29 17.731 -5.790 -3.786 240 HB3 ASP 29 HB1 ASP 29 16.542 -6.781 -4.626 241 H MET 30 HN MET 30 17.131 -8.227 -0.390 242 HA MET 30 HA MET 30 19.067 -6.344 0.683 243 HB2 MET 30 HB2 MET 30 17.158 -8.308 1.799 244 HB3 MET 30 HB1 MET 30 18.673 -8.141 2.668 245 HG2 MET 30 HG2 MET 30 18.360 -5.717 2.784 246 HG3 MET 30 HG1 MET 30 16.823 -5.843 1.937 247 HE1 MET 30 HE1 MET 30 18.002 -8.390 5.287 248 HE2 MET 30 HE2 MET 30 18.265 -6.796 5.977 249 HE3 MET 30 HE3 MET 30 19.040 -7.211 4.470 250 H THR 31 HN THR 31 20.898 -6.889 1.759 251 HA THR 31 HA THR 31 22.358 -9.065 0.491 252 HB THR 31 HB THR 31 23.099 -6.481 1.832 253 HG1 THR 31 HG1 THR 31 22.848 -6.258 -0.279 254 HG21 THR 31 HG21 THR 31 25.493 -7.242 1.466 255 HG22 THR 31 HG22 THR 31 24.834 -8.890 1.354 256 HG23 THR 31 HG23 THR 31 24.598 -7.922 2.826 257 H VAL 32 HN VAL 32 23.444 -10.626 1.672 258 HA VAL 32 HA VAL 32 22.203 -11.560 4.017 259 HB VAL 32 HB VAL 32 24.946 -12.188 2.886 260 HG11 VAL 32 HG11 VAL 32 25.230 -13.157 4.924 261 HG12 VAL 32 HG12 VAL 32 24.218 -14.422 4.250 262 HG13 VAL 32 HG13 VAL 32 23.504 -13.185 5.284 263 HG21 VAL 32 HG21 VAL 32 22.831 -12.665 1.481 264 HG22 VAL 32 HG22 VAL 32 22.413 -13.844 2.723 265 HG23 VAL 32 HG23 VAL 32 23.892 -14.034 1.797 266 H ALA 33 HN ALA 33 25.215 -9.741 3.593 267 HA ALA 33 HA ALA 33 26.038 -9.621 6.262 268 HB1 ALA 33 HB1 ALA 33 26.788 -8.339 3.860 269 HB2 ALA 33 HB2 ALA 33 27.591 -8.218 5.420 270 HB3 ALA 33 HB3 ALA 33 26.369 -7.040 4.975 271 H SER 34 HN SER 34 23.756 -7.529 4.504 272 HA SER 34 HA SER 34 23.044 -5.856 6.662 273 HB2 SER 34 HB2 SER 34 21.132 -6.611 4.489 274 HB3 SER 34 HB1 SER 34 21.391 -5.051 5.257 275 HG SER 34 HG SER 34 23.095 -4.710 3.981 276 H LEU 35 HN LEU 35 21.811 -8.918 5.441 277 HA LEU 35 HA LEU 35 19.559 -9.110 7.137 278 HB2 LEU 35 HB2 LEU 35 19.794 -10.556 5.197 279 HB3 LEU 35 HB1 LEU 35 21.245 -11.286 5.878 280 HG LEU 35 HG LEU 35 19.986 -12.190 7.747 281 HD11 LEU 35 HD11 LEU 35 17.802 -10.492 6.587 282 HD12 LEU 35 HD12 LEU 35 18.243 -10.815 8.266 283 HD13 LEU 35 HD13 LEU 35 17.352 -12.025 7.351 284 HD21 LEU 35 HD21 LEU 35 20.027 -13.282 5.354 285 HD22 LEU 35 HD22 LEU 35 18.293 -12.900 5.376 286 HD23 LEU 35 HD23 LEU 35 18.988 -13.938 6.618 287 H LYS 36 HN LYS 36 22.898 -10.206 7.512 288 HA LYS 36 HA LYS 36 22.557 -11.362 10.093 289 HB2 LYS 36 HB2 LYS 36 24.933 -9.949 8.889 290 HB3 LYS 36 HB1 LYS 36 24.967 -10.825 10.420 291 HG2 LYS 36 HG2 LYS 36 24.304 -12.892 9.161 292 HG3 LYS 36 HG1 LYS 36 24.417 -11.974 7.661 293 HD2 LYS 36 HD2 LYS 36 26.791 -11.385 9.077 294 HD3 LYS 36 HD1 LYS 36 26.587 -13.130 9.213 295 HE2 LYS 36 HE2 LYS 36 26.098 -12.039 6.494 296 HE3 LYS 36 HE1 LYS 36 27.716 -11.797 7.126 297 HZ1 LYS 36 HZ1 LYS 36 27.832 -13.766 6.094 298 HZ2 LYS 36 HZ2 LYS 36 26.388 -14.436 6.654 299 HZ3 LYS 36 HZ3 LYS 36 27.744 -14.248 7.677 300 H ASP 37 HN ASP 37 23.298 -8.164 8.880 301 HA ASP 37 HA ASP 37 23.878 -6.893 11.278 302 HB2 ASP 37 HB2 ASP 37 24.296 -5.914 9.033 303 HB3 ASP 37 HB1 ASP 37 22.562 -5.614 8.883 304 H MET 38 HN MET 38 20.732 -7.005 9.614 305 HA MET 38 HA MET 38 19.357 -5.605 11.681 306 HB2 MET 38 HB2 MET 38 17.425 -7.398 10.687 307 HB3 MET 38 HB1 MET 38 17.692 -5.740 10.210 308 HG2 MET 38 HG2 MET 38 19.072 -6.320 8.406 309 HG3 MET 38 HG1 MET 38 19.270 -7.986 8.965 310 HE1 MET 38 HE1 MET 38 15.828 -8.716 9.663 311 HE2 MET 38 HE2 MET 38 17.427 -9.435 9.564 312 HE3 MET 38 HE3 MET 38 16.218 -9.851 8.370 313 H VAL 39 HN VAL 39 20.037 -8.991 11.180 314 HA VAL 39 HA VAL 39 18.658 -9.974 13.435 315 HB VAL 39 HB VAL 39 21.088 -11.043 11.951 316 HG11 VAL 39 HG11 VAL 39 19.327 -12.764 13.660 317 HG12 VAL 39 HG12 VAL 39 20.648 -11.877 14.432 318 HG13 VAL 39 HG13 VAL 39 20.980 -13.015 13.142 319 HG21 VAL 39 HG21 VAL 39 19.574 -11.724 10.425 320 HG22 VAL 39 HG22 VAL 39 18.299 -10.919 11.314 321 HG23 VAL 39 HG23 VAL 39 18.686 -12.600 11.664 322 H PHE 40 HN PHE 40 21.912 -8.697 12.944 323 HA PHE 40 HA PHE 40 22.818 -9.083 15.599 324 HB2 PHE 40 HB2 PHE 40 24.432 -8.567 13.937 325 HB3 PHE 40 HB1 PHE 40 23.604 -7.069 13.491 326 HD1 PHE 40 HD2 PHE 40 25.095 -8.763 16.503 327 HD2 PHE 40 HD1 PHE 40 24.341 -5.057 14.449 328 HE1 PHE 40 HE2 PHE 40 26.378 -7.546 18.229 329 HE2 PHE 40 HE1 PHE 40 25.619 -3.842 16.177 330 HZ PHE 40 HZ PHE 40 26.642 -5.082 18.073 331 H LEU 41 HN LEU 41 21.176 -6.363 14.001 332 HA LEU 41 HA LEU 41 21.091 -4.658 16.276 333 HB2 LEU 41 HB2 LEU 41 18.885 -4.916 14.220 334 HB3 LEU 41 HB1 LEU 41 19.263 -3.529 15.208 335 HG LEU 41 HG LEU 41 21.014 -4.677 13.033 336 HD11 LEU 41 HD11 LEU 41 18.994 -3.516 12.229 337 HD12 LEU 41 HD12 LEU 41 20.506 -2.726 11.798 338 HD13 LEU 41 HD13 LEU 41 19.520 -2.065 13.106 339 HD21 LEU 41 HD21 LEU 41 22.311 -2.588 13.381 340 HD22 LEU 41 HD22 LEU 41 22.424 -3.733 14.706 341 HD23 LEU 41 HD23 LEU 41 21.391 -2.287 14.863 342 H ASP 42 HN ASP 42 18.943 -7.060 14.988 343 HA ASP 42 HA ASP 42 16.895 -6.720 16.929 344 HB2 ASP 42 HB2 ASP 42 16.696 -7.696 14.543 345 HB3 ASP 42 HB1 ASP 42 17.208 -9.201 15.270 346 H TYR 43 HN TYR 43 19.348 -9.269 16.548 347 HA TYR 43 HA TYR 43 18.535 -10.342 19.191 348 HB2 TYR 43 HB2 TYR 43 20.050 -11.753 16.984 349 HB3 TYR 43 HB1 TYR 43 19.401 -12.454 18.459 350 HD1 TYR 43 HD2 TYR 43 16.893 -12.425 18.879 351 HD2 TYR 43 HD1 TYR 43 18.636 -11.387 15.097 352 HE1 TYR 43 HE2 TYR 43 14.690 -12.700 17.779 353 HE2 TYR 43 HE1 TYR 43 16.441 -11.663 14.003 354 HH TYR 43 HH TYR 43 14.022 -11.397 14.975 355 H GLY 44 HN GLY 44 21.029 -8.520 17.792 356 HA2 GLY 44 HA2 GLY 44 23.008 -7.799 18.735 357 HA3 GLY 44 HA1 GLY 44 22.638 -8.780 20.149 358 H PHE 45 HN PHE 45 22.378 -10.541 17.285 359 HA PHE 45 HA PHE 45 24.627 -12.198 17.992 360 HB2 PHE 45 HB2 PHE 45 22.798 -12.303 15.571 361 HB3 PHE 45 HB1 PHE 45 24.009 -13.502 15.981 362 HD1 PHE 45 HD1 PHE 45 22.764 -12.371 19.093 363 HD2 PHE 45 HD2 PHE 45 21.623 -14.783 15.705 364 HE1 PHE 45 HE1 PHE 45 21.131 -13.558 20.479 365 HE2 PHE 45 HE2 PHE 45 19.983 -15.972 17.120 366 HZ PHE 45 HZ PHE 45 19.731 -15.362 19.507 367 HA PRO 46 HA PRO 46 27.268 -9.521 15.429 368 HB2 PRO 46 HB2 PRO 46 29.629 -10.726 15.977 369 HB3 PRO 46 HB1 PRO 46 28.822 -9.619 17.093 370 HG2 PRO 46 HG2 PRO 46 28.769 -12.584 17.073 371 HG3 PRO 46 HG1 PRO 46 29.048 -11.533 18.468 372 HD2 PRO 46 HD2 PRO 46 26.642 -12.618 18.082 373 HD3 PRO 46 HD1 PRO 46 26.776 -10.937 18.641 374 HA PRO 47 HA PRO 47 27.386 -11.956 11.699 375 HB2 PRO 47 HB2 PRO 47 29.608 -10.877 10.474 376 HB3 PRO 47 HB1 PRO 47 28.007 -10.105 10.485 377 HG2 PRO 47 HG2 PRO 47 30.370 -9.575 12.229 378 HG3 PRO 47 HG1 PRO 47 29.246 -8.432 11.479 379 HD2 PRO 47 HD2 PRO 47 28.988 -9.022 14.071 380 HD3 PRO 47 HD1 PRO 47 27.549 -8.827 13.051 381 H VAL 48 HN VAL 48 30.280 -11.663 13.638 382 HA VAL 48 HA VAL 48 31.702 -13.820 12.490 383 HB VAL 48 HB VAL 48 32.996 -12.385 13.819 384 HG11 VAL 48 HG11 VAL 48 30.678 -12.504 15.700 385 HG12 VAL 48 HG12 VAL 48 31.712 -11.156 15.242 386 HG13 VAL 48 HG13 VAL 48 32.281 -12.330 16.420 387 HG21 VAL 48 HG21 VAL 48 33.408 -14.874 14.205 388 HG22 VAL 48 HG22 VAL 48 32.513 -14.708 15.718 389 HG23 VAL 48 HG23 VAL 48 34.002 -13.802 15.466 390 H LEU 49 HN LEU 49 29.424 -13.639 15.190 391 HA LEU 49 HA LEU 49 29.506 -16.486 15.639 392 HB2 LEU 49 HB2 LEU 49 27.821 -14.279 16.786 393 HB3 LEU 49 HB1 LEU 49 27.338 -15.946 16.954 394 HG LEU 49 HG LEU 49 29.805 -16.390 17.728 395 HD11 LEU 49 HD11 LEU 49 30.949 -14.613 18.749 396 HD12 LEU 49 HD12 LEU 49 29.575 -13.548 18.680 397 HD13 LEU 49 HD13 LEU 49 30.455 -13.966 17.191 398 HD21 LEU 49 HD21 LEU 49 27.516 -16.324 19.073 399 HD22 LEU 49 HD22 LEU 49 28.210 -14.857 19.750 400 HD23 LEU 49 HD23 LEU 49 29.064 -16.395 19.907 401 H GLN 50 HN GLN 50 27.452 -14.268 13.867 402 HA GLN 50 HA GLN 50 25.409 -16.165 13.389 403 HB2 GLN 50 HB2 GLN 50 26.142 -13.677 11.846 404 HB3 GLN 50 HB1 GLN 50 24.766 -14.690 11.461 405 HG2 GLN 50 HG2 GLN 50 23.939 -14.344 13.823 406 HG3 GLN 50 HG1 GLN 50 25.225 -13.148 14.028 407 HE21 GLN 50 HE21 GLN 50 24.180 -11.098 13.867 408 HE22 GLN 50 HE22 GLN 50 23.139 -10.692 12.598 409 H GLN 51 HN GLN 51 26.258 -18.118 12.635 410 HA GLN 51 HA GLN 51 27.437 -17.997 9.946 411 HB2 GLN 51 HB2 GLN 51 28.701 -19.352 11.512 412 HB3 GLN 51 HB1 GLN 51 27.275 -20.316 11.900 413 HG2 GLN 51 HG2 GLN 51 27.168 -21.109 9.562 414 HG3 GLN 51 HG1 GLN 51 28.543 -20.091 9.142 415 HE21 GLN 51 HE21 GLN 51 28.299 -23.116 9.099 416 HE22 GLN 51 HE22 GLN 51 29.567 -23.655 10.076 417 H TRP 52 HN TRP 52 25.807 -17.814 8.562 418 HA TRP 52 HA TRP 52 23.232 -19.067 9.089 419 HB2 TRP 52 HB2 TRP 52 24.296 -17.309 6.855 420 HB3 TRP 52 HB1 TRP 52 22.696 -18.032 6.835 421 HD1 TRP 52 HD1 TRP 52 24.791 -15.805 9.265 422 HE1 TRP 52 HE1 TRP 52 23.127 -14.152 10.427 423 HE3 TRP 52 HE3 TRP 52 20.380 -17.376 7.252 424 HZ2 TRP 52 HZ2 TRP 52 20.347 -13.597 10.471 425 HZ3 TRP 52 HZ3 TRP 52 18.261 -16.275 7.853 426 HH2 TRP 52 HH2 TRP 52 18.242 -14.378 9.470 427 H VAL 53 HN VAL 53 22.582 -21.009 8.189 428 HA VAL 53 HA VAL 53 24.549 -22.277 6.384 429 HB VAL 53 HB VAL 53 22.260 -23.756 7.652 430 HG11 VAL 53 HG11 VAL 53 23.693 -24.839 5.953 431 HG12 VAL 53 HG12 VAL 53 23.766 -25.634 7.519 432 HG13 VAL 53 HG13 VAL 53 25.084 -24.587 7.003 433 HG21 VAL 53 HG21 VAL 53 24.889 -23.007 8.998 434 HG22 VAL 53 HG22 VAL 53 23.788 -24.249 9.593 435 HG23 VAL 53 HG23 VAL 53 23.273 -22.568 9.552 436 H ILE 54 HN ILE 54 24.100 -22.292 4.344 437 HA ILE 54 HA ILE 54 21.421 -22.784 3.345 438 HB ILE 54 HB ILE 54 23.068 -20.411 2.544 439 HG12 ILE 54 HG12 ILE 54 21.875 -20.033 4.715 440 HG13 ILE 54 HG11 ILE 54 21.249 -19.012 3.443 441 HG21 ILE 54 HG21 ILE 54 20.425 -21.494 1.596 442 HG22 ILE 54 HG22 ILE 54 21.864 -21.180 0.592 443 HG23 ILE 54 HG23 ILE 54 20.916 -19.838 1.260 444 HD11 ILE 54 HD11 ILE 54 19.212 -19.863 3.657 445 HD12 ILE 54 HD12 ILE 54 19.764 -20.816 5.022 446 HD13 ILE 54 HD13 ILE 54 19.787 -21.506 3.393 447 H GLY 55 HN GLY 55 21.605 -24.128 1.598 448 HA2 GLY 55 HA2 GLY 55 24.075 -25.233 0.862 449 HA3 GLY 55 HA1 GLY 55 22.587 -25.402 -0.070 450 H GLN 56 HN GLN 56 22.118 -22.708 -0.701 451 HA GLN 56 HA GLN 56 23.796 -22.396 -2.970 452 HB2 GLN 56 HB2 GLN 56 21.682 -20.571 -1.807 453 HB3 GLN 56 HB1 GLN 56 22.496 -20.298 -3.347 454 HG2 GLN 56 HG2 GLN 56 21.701 -22.501 -4.166 455 HG3 GLN 56 HG1 GLN 56 20.896 -22.768 -2.629 456 HE21 GLN 56 HE21 GLN 56 20.581 -19.489 -3.222 457 HE22 GLN 56 HE22 GLN 56 19.076 -19.527 -3.996 458 H ARG 57 HN ARG 57 24.109 -21.209 0.238 459 HA ARG 57 HA ARG 57 25.292 -18.726 -0.296 460 HB2 ARG 57 HB2 ARG 57 25.231 -20.484 2.129 461 HB3 ARG 57 HB1 ARG 57 26.286 -19.094 2.109 462 HG2 ARG 57 HG2 ARG 57 23.370 -18.828 1.337 463 HG3 ARG 57 HG1 ARG 57 23.908 -18.693 3.022 464 HD2 ARG 57 HD2 ARG 57 24.867 -17.056 0.694 465 HD3 ARG 57 HD1 ARG 57 23.771 -16.489 1.939 466 HE ARG 57 HE ARG 57 25.824 -17.236 3.446 467 HH11 ARG 57 HH21 ARG 57 25.894 -15.590 0.313 468 HH12 ARG 57 HH22 ARG 57 27.268 -14.663 0.718 469 HH21 ARG 57 HH11 ARG 57 27.699 -15.998 3.912 470 HH22 ARG 57 HH12 ARG 57 28.330 -14.913 2.767 471 H LEU 58 HN LEU 58 27.317 -17.929 -0.230 472 HA LEU 58 HA LEU 58 29.611 -19.777 -0.343 473 HB2 LEU 58 HB2 LEU 58 29.022 -17.449 -2.188 474 HB3 LEU 58 HB1 LEU 58 30.651 -18.010 -1.909 475 HG LEU 58 HG LEU 58 29.657 -20.379 -2.467 476 HD11 LEU 58 HD11 LEU 58 27.900 -20.146 -4.267 477 HD12 LEU 58 HD12 LEU 58 27.712 -18.469 -3.796 478 HD13 LEU 58 HD13 LEU 58 27.304 -19.753 -2.654 479 HD21 LEU 58 HD21 LEU 58 31.372 -19.457 -3.819 480 HD22 LEU 58 HD22 LEU 58 30.322 -18.181 -4.434 481 HD23 LEU 58 HD23 LEU 58 30.071 -19.855 -4.939 482 H ALA 59 HN ALA 59 31.651 -18.635 0.199 483 HA ALA 59 HA ALA 59 31.380 -17.246 2.657 484 HB1 ALA 59 HB1 ALA 59 33.819 -16.983 2.556 485 HB2 ALA 59 HB2 ALA 59 33.815 -17.510 0.874 486 HB3 ALA 59 HB3 ALA 59 33.342 -18.628 2.150 487 H ARG 60 HN ARG 60 29.851 -15.802 0.986 488 HA ARG 60 HA ARG 60 31.274 -13.212 0.951 489 HB2 ARG 60 HB2 ARG 60 30.757 -14.494 -1.403 490 HB3 ARG 60 HB1 ARG 60 29.278 -13.573 -1.209 491 HG2 ARG 60 HG2 ARG 60 30.438 -11.877 -2.140 492 HG3 ARG 60 HG1 ARG 60 31.157 -11.656 -0.551 493 HD2 ARG 60 HD2 ARG 60 32.242 -13.230 -2.879 494 HD3 ARG 60 HD1 ARG 60 32.971 -11.824 -2.097 495 HE ARG 60 HE ARG 60 32.859 -13.609 -0.054 496 HH11 ARG 60 HH21 ARG 60 33.997 -13.865 -3.341 497 HH12 ARG 60 HH22 ARG 60 35.113 -15.117 -2.997 498 HH21 ARG 60 HH11 ARG 60 34.315 -15.217 0.403 499 HH22 ARG 60 HH12 ARG 60 35.326 -15.901 -0.828 500 H ASP 61 HN ASP 61 30.272 -12.183 2.533 501 HA ASP 61 HA ASP 61 27.532 -12.535 3.284 502 HB2 ASP 61 HB2 ASP 61 29.590 -10.432 3.994 503 HB3 ASP 61 HB1 ASP 61 27.975 -10.461 4.665 504 H GLN 62 HN GLN 62 29.140 -10.701 0.938 505 HA GLN 62 HA GLN 62 27.316 -8.560 0.654 506 HB2 GLN 62 HB2 GLN 62 29.363 -9.731 -1.245 507 HB3 GLN 62 HB1 GLN 62 28.431 -8.282 -1.573 508 HG2 GLN 62 HG2 GLN 62 29.284 -7.182 0.399 509 HG3 GLN 62 HG1 GLN 62 30.135 -8.636 0.903 510 HE21 GLN 62 HE21 GLN 62 31.859 -6.626 0.715 511 HE22 GLN 62 HE22 GLN 62 32.730 -6.619 -0.735 512 H GLU 63 HN GLU 63 26.948 -11.841 -0.120 513 HA GLU 63 HA GLU 63 25.484 -11.677 -2.494 514 HB2 GLU 63 HB2 GLU 63 25.212 -13.651 -0.226 515 HB3 GLU 63 HB1 GLU 63 24.337 -13.773 -1.738 516 HG2 GLU 63 HG2 GLU 63 26.497 -13.771 -2.988 517 HG3 GLU 63 HG1 GLU 63 27.337 -13.743 -1.447 518 H THR 64 HN THR 64 23.351 -11.495 -2.956 519 HA THR 64 HA THR 64 21.772 -9.893 -1.182 520 HB THR 64 HB THR 64 20.450 -11.069 -3.535 521 HG1 THR 64 HG1 THR 64 22.762 -9.447 -3.811 522 HG21 THR 64 HG21 THR 64 21.043 -8.265 -2.548 523 HG22 THR 64 HG22 THR 64 19.552 -9.178 -2.397 524 HG23 THR 64 HG23 THR 64 20.083 -8.635 -3.988 525 H LEU 65 HN LEU 65 19.557 -10.604 -0.553 526 HA LEU 65 HA LEU 65 19.604 -13.141 0.689 527 HB2 LEU 65 HB2 LEU 65 17.233 -11.358 0.050 528 HB3 LEU 65 HB1 LEU 65 17.150 -12.783 1.077 529 HG LEU 65 HG LEU 65 18.751 -10.270 1.547 530 HD11 LEU 65 HD11 LEU 65 16.299 -10.305 2.106 531 HD12 LEU 65 HD12 LEU 65 17.366 -9.946 3.455 532 HD13 LEU 65 HD13 LEU 65 16.666 -11.558 3.289 533 HD21 LEU 65 HD21 LEU 65 20.233 -11.622 2.594 534 HD22 LEU 65 HD22 LEU 65 19.120 -13.012 2.655 535 HD23 LEU 65 HD23 LEU 65 19.009 -11.729 3.842 536 H HIS 66 HN HIS 66 18.163 -12.014 -2.299 537 HA HIS 66 HA HIS 66 16.771 -14.281 -3.080 538 HB2 HIS 66 HB2 HIS 66 16.947 -12.047 -4.303 539 HB3 HIS 66 HB1 HIS 66 18.434 -12.667 -5.014 540 HD1 HIS 66 HD1 HIS 66 18.163 -15.062 -6.334 541 HD2 HIS 66 HD2 HIS 66 14.642 -12.933 -5.578 542 HE1 HIS 66 HE1 HIS 66 16.404 -15.998 -7.876 543 HE2 HIS 66 HE2 HIS 66 14.248 -14.699 -7.424 544 H SER 67 HN SER 67 20.227 -13.743 -2.932 545 HA SER 67 HA SER 67 21.118 -15.815 -4.594 546 HB2 SER 67 HB2 SER 67 22.567 -15.178 -2.051 547 HB3 SER 67 HB1 SER 67 23.204 -15.491 -3.648 548 HG SER 67 HG SER 67 22.188 -13.229 -2.483 549 H HIS 68 HN HIS 68 19.779 -15.868 -1.350 550 HA HIS 68 HA HIS 68 20.473 -18.623 -0.816 551 HB2 HIS 68 HB2 HIS 68 20.067 -17.497 1.181 552 HB3 HIS 68 HB1 HIS 68 18.742 -16.554 0.517 553 HD1 HIS 68 HD1 HIS 68 19.281 -20.369 0.865 554 HD2 HIS 68 HD2 HIS 68 16.428 -17.441 1.749 555 HE1 HIS 68 HE1 HIS 68 17.324 -21.548 1.924 556 HE2 HIS 68 HE2 HIS 68 15.553 -19.803 2.397 557 H GLY 69 HN GLY 69 18.304 -17.064 -2.862 558 HA2 GLY 69 HA2 GLY 69 16.977 -18.156 -4.457 559 HA3 GLY 69 HA1 GLY 69 16.905 -19.576 -3.422 560 H VAL 70 HN VAL 70 16.448 -16.775 -1.604 561 HA VAL 70 HA VAL 70 13.656 -17.386 -1.292 562 HB VAL 70 HB VAL 70 14.764 -16.873 0.716 563 HG11 VAL 70 HG11 VAL 70 15.798 -14.406 0.832 564 HG12 VAL 70 HG12 VAL 70 16.041 -14.707 -0.892 565 HG13 VAL 70 HG13 VAL 70 16.753 -15.790 0.304 566 HG21 VAL 70 HG21 VAL 70 12.518 -15.644 0.217 567 HG22 VAL 70 HG22 VAL 70 13.535 -14.202 0.104 568 HG23 VAL 70 HG23 VAL 70 13.465 -15.102 1.607 569 H ARG 71 HN ARG 71 12.933 -16.995 -3.308 570 HA ARG 71 HA ARG 71 13.082 -14.541 -4.764 571 HB2 ARG 71 HB2 ARG 71 11.117 -16.824 -4.850 572 HB3 ARG 71 HB1 ARG 71 11.281 -15.579 -6.082 573 HG2 ARG 71 HG2 ARG 71 13.549 -16.269 -6.569 574 HG3 ARG 71 HG1 ARG 71 13.541 -17.445 -5.258 575 HD2 ARG 71 HD2 ARG 71 11.723 -17.502 -7.695 576 HD3 ARG 71 HD1 ARG 71 13.137 -18.507 -7.386 577 HE ARG 71 HE ARG 71 11.454 -18.783 -5.170 578 HH11 ARG 71 HH21 ARG 71 11.512 -19.517 -8.575 579 HH12 ARG 71 HH22 ARG 71 10.448 -20.858 -8.452 580 HH21 ARG 71 HH11 ARG 71 10.034 -20.576 -4.982 581 HH22 ARG 71 HH12 ARG 71 9.612 -21.465 -6.375 582 H GLN 72 HN GLN 72 10.844 -16.022 -2.530 583 HA GLN 72 HA GLN 72 9.320 -13.522 -2.229 584 HB2 GLN 72 HB2 GLN 72 7.224 -14.859 -2.310 585 HB3 GLN 72 HB1 GLN 72 8.077 -14.814 -3.850 586 HG2 GLN 72 HG2 GLN 72 8.767 -17.081 -2.003 587 HG3 GLN 72 HG1 GLN 72 7.181 -17.122 -2.745 588 HE21 GLN 72 HE21 GLN 72 7.855 -15.924 -5.288 589 HE22 GLN 72 HE22 GLN 72 8.870 -17.012 -6.091 590 H ASN 73 HN ASN 73 7.521 -14.099 -0.461 591 HA ASN 73 HA ASN 73 8.889 -14.597 1.997 592 HB2 ASN 73 HB2 ASN 73 6.594 -14.471 2.929 593 HB3 ASN 73 HB1 ASN 73 6.963 -13.091 1.899 594 HD21 ASN 73 HD21 ASN 73 4.408 -14.903 2.539 595 HD22 ASN 73 HD22 ASN 73 3.729 -15.061 0.990 596 H GLY 74 HN GLY 74 8.318 -16.326 3.482 597 HA2 GLY 74 HA2 GLY 74 7.356 -18.385 4.007 598 HA3 GLY 74 HA1 GLY 74 7.084 -18.719 2.305 599 H ASP 75 HN ASP 75 10.083 -17.520 2.258 600 HA ASP 75 HA ASP 75 11.249 -20.128 2.064 601 HB2 ASP 75 HB2 ASP 75 11.918 -17.941 0.780 602 HB3 ASP 75 HB1 ASP 75 12.955 -17.659 2.177 603 H SER 76 HN SER 76 13.023 -20.853 3.253 604 HA SER 76 HA SER 76 12.944 -19.980 6.086 605 HB2 SER 76 HB2 SER 76 13.385 -22.855 5.367 606 HB3 SER 76 HB1 SER 76 12.661 -22.144 6.805 607 HG SER 76 HG SER 76 11.000 -21.370 5.142 608 H ALA 77 HN ALA 77 14.886 -20.215 7.279 609 HA ALA 77 HA ALA 77 17.301 -21.001 5.789 610 HB1 ALA 77 HB1 ALA 77 16.615 -18.310 6.243 611 HB2 ALA 77 HB2 ALA 77 18.151 -18.947 5.663 612 HB3 ALA 77 HB3 ALA 77 17.909 -18.676 7.388 613 H TYR 78 HN TYR 78 19.249 -21.096 7.256 614 HA TYR 78 HA TYR 78 18.451 -21.997 9.961 615 HB2 TYR 78 HB2 TYR 78 19.399 -23.627 7.912 616 HB3 TYR 78 HB1 TYR 78 20.840 -23.220 8.821 617 HD1 TYR 78 HD1 TYR 78 20.244 -23.174 11.586 618 HD2 TYR 78 HD2 TYR 78 18.444 -25.632 8.541 619 HE1 TYR 78 HE1 TYR 78 19.620 -24.839 13.290 620 HE2 TYR 78 HE2 TYR 78 17.824 -27.285 10.232 621 HH TYR 78 HH TYR 78 18.844 -26.953 13.634 622 H LEU 79 HN LEU 79 19.535 -20.964 11.576 623 HA LEU 79 HA LEU 79 22.012 -19.552 10.836 624 HB2 LEU 79 HB2 LEU 79 20.328 -18.012 11.669 625 HB3 LEU 79 HB1 LEU 79 20.082 -19.014 13.101 626 HG LEU 79 HG LEU 79 22.503 -18.644 13.719 627 HD11 LEU 79 HD11 LEU 79 22.444 -17.257 11.107 628 HD12 LEU 79 HD12 LEU 79 23.788 -18.000 11.982 629 HD13 LEU 79 HD13 LEU 79 23.258 -16.383 12.402 630 HD21 LEU 79 HD21 LEU 79 20.433 -16.490 13.572 631 HD22 LEU 79 HD22 LEU 79 22.066 -15.980 13.937 632 HD23 LEU 79 HD23 LEU 79 21.269 -17.162 14.974 633 H TYR 80 HN TYR 80 23.840 -20.242 11.632 634 HA TYR 80 HA TYR 80 23.855 -22.214 13.830 635 HB2 TYR 80 HB2 TYR 80 24.631 -22.988 11.581 636 HB3 TYR 80 HB1 TYR 80 25.866 -21.742 11.605 637 HD1 TYR 80 HD1 TYR 80 24.621 -24.766 13.399 638 HD2 TYR 80 HD2 TYR 80 27.932 -22.092 12.764 639 HE1 TYR 80 HE1 TYR 80 26.120 -26.304 14.619 640 HE2 TYR 80 HE2 TYR 80 29.405 -23.635 13.986 641 HH TYR 80 HH TYR 80 28.307 -26.073 15.916 642 H LEU 81 HN LEU 81 24.848 -21.550 15.651 643 HA LEU 81 HA LEU 81 26.298 -18.985 15.527 644 HB2 LEU 81 HB2 LEU 81 24.867 -20.271 17.840 645 HB3 LEU 81 HB1 LEU 81 25.740 -18.745 17.922 646 HG LEU 81 HG LEU 81 23.415 -19.309 16.067 647 HD11 LEU 81 HD11 LEU 81 23.604 -17.963 18.771 648 HD12 LEU 81 HD12 LEU 81 22.378 -19.089 18.173 649 HD13 LEU 81 HD13 LEU 81 22.387 -17.432 17.618 650 HD21 LEU 81 HD21 LEU 81 24.529 -17.605 14.966 651 HD22 LEU 81 HD22 LEU 81 25.285 -16.995 16.435 652 HD23 LEU 81 HD23 LEU 81 23.603 -16.622 16.092 653 H LEU 82 HN LEU 82 28.249 -18.806 16.125 654 HA LEU 82 HA LEU 82 29.785 -21.182 16.974 655 HB2 LEU 82 HB2 LEU 82 30.640 -18.414 16.070 656 HB3 LEU 82 HB1 LEU 82 31.738 -19.626 16.695 657 HG LEU 82 HG LEU 82 31.795 -19.800 14.277 658 HD11 LEU 82 HD11 LEU 82 31.208 -22.080 13.934 659 HD12 LEU 82 HD12 LEU 82 30.004 -22.047 15.211 660 HD13 LEU 82 HD13 LEU 82 31.722 -21.934 15.611 661 HD21 LEU 82 HD21 LEU 82 29.315 -18.773 14.204 662 HD22 LEU 82 HD22 LEU 82 28.894 -20.484 14.051 663 HD23 LEU 82 HD23 LEU 82 29.991 -19.737 12.898 664 H SER 83 HN SER 83 30.733 -21.368 18.976 665 HA SER 83 HA SER 83 29.741 -19.746 21.074 666 HB2 SER 83 HB2 SER 83 32.173 -21.131 21.770 667 HB3 SER 83 HB1 SER 83 30.541 -21.435 22.325 668 HG SER 83 HG SER 83 32.036 -22.789 20.566 669 H ALA 84 HN ALA 84 30.257 -17.610 20.871 670 HA ALA 84 HA ALA 84 32.951 -16.760 21.425 671 HB1 ALA 84 HB1 ALA 84 33.483 -16.914 19.193 672 HB2 ALA 84 HB2 ALA 84 32.843 -15.273 19.233 673 HB3 ALA 84 HB3 ALA 84 31.842 -16.600 18.655 674 H ARG 85 HN ARG 85 32.935 -14.201 20.924 675 HA ARG 85 HA ARG 85 30.320 -13.067 21.591 676 HB2 ARG 85 HB2 ARG 85 32.835 -12.454 23.135 677 HB3 ARG 85 HB1 ARG 85 31.267 -11.683 23.364 678 HG2 ARG 85 HG2 ARG 85 30.315 -13.986 23.869 679 HG3 ARG 85 HG1 ARG 85 31.974 -14.583 23.889 680 HD2 ARG 85 HD2 ARG 85 31.548 -14.088 26.136 681 HD3 ARG 85 HD1 ARG 85 32.463 -12.693 25.560 682 HE ARG 85 HE ARG 85 29.501 -12.707 25.653 683 HH11 ARG 85 HH21 ARG 85 32.574 -11.145 26.420 684 HH12 ARG 85 HH22 ARG 85 31.842 -9.800 27.148 685 HH21 ARG 85 HH11 ARG 85 28.548 -10.890 26.620 686 HH22 ARG 85 HH12 ARG 85 29.527 -9.637 27.235 687 H ASN 86 HN ASN 86 30.249 -10.772 21.183 688 HA ASN 86 HA ASN 86 31.961 -9.912 18.986 689 HB2 ASN 86 HB2 ASN 86 29.546 -9.259 19.059 690 HB3 ASN 86 HB1 ASN 86 29.874 -8.336 20.518 691 HD21 ASN 86 HD21 ASN 86 29.324 -6.293 19.384 692 HD22 ASN 86 HD22 ASN 86 30.426 -5.611 18.296 693 H THR 87 HN THR 87 33.276 -7.963 19.104 694 HA THR 87 HA THR 87 34.933 -7.864 21.369 695 HB THR 87 HB THR 87 34.553 -5.537 19.478 696 HG1 THR 87 HG1 THR 87 35.317 -6.681 17.891 697 HG21 THR 87 HG21 THR 87 37.073 -5.529 19.718 698 HG22 THR 87 HG22 THR 87 36.908 -6.765 20.951 699 HG23 THR 87 HG23 THR 87 36.188 -5.170 21.193 700 H SER 88 HN SER 88 34.531 -6.927 23.328 701 HA SER 88 HA SER 88 32.085 -5.502 23.751 702 HB2 SER 88 HB2 SER 88 34.293 -5.533 25.781 703 HB3 SER 88 HB1 SER 88 32.572 -5.600 25.994 704 HG SER 88 HG SER 88 32.595 -7.691 24.978 705 H LEU 89 HN LEU 89 31.784 -3.358 24.033 706 HA LEU 89 HA LEU 89 33.671 -1.504 23.002 707 HB2 LEU 89 HB2 LEU 89 31.151 -1.079 24.633 708 HB3 LEU 89 HB1 LEU 89 32.098 0.223 23.915 709 HG LEU 89 HG LEU 89 30.892 -2.077 22.330 710 HD11 LEU 89 HD11 LEU 89 29.925 0.764 22.692 711 HD12 LEU 89 HD12 LEU 89 29.084 -0.723 23.144 712 HD13 LEU 89 HD13 LEU 89 29.346 -0.340 21.453 713 HD21 LEU 89 HD21 LEU 89 32.569 0.332 21.637 714 HD22 LEU 89 HD22 LEU 89 31.370 -0.235 20.480 715 HD23 LEU 89 HD23 LEU 89 32.651 -1.310 21.004 716 H ASN 90 HN ASN 90 32.776 -2.551 26.184 717 HA ASN 90 HA ASN 90 34.150 -0.654 27.745 718 HB2 ASN 90 HB2 ASN 90 33.520 -3.542 28.392 719 HB3 ASN 90 HB1 ASN 90 34.034 -2.340 29.564 720 HD21 ASN 90 HD21 ASN 90 32.275 -0.388 27.716 721 HD22 ASN 90 HD22 ASN 90 30.721 -0.654 28.349 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 6.021 -7.988 -5.473 2 H2 MET 1 HT2 MET 1 4.470 -7.343 -5.253 3 H3 MET 1 HT3 MET 1 5.620 -7.327 -3.988 4 HA MET 1 HA MET 1 6.530 -6.056 -6.369 5 HB2 MET 1 HB2 MET 1 3.947 -5.269 -5.160 6 HB3 MET 1 HB1 MET 1 5.128 -3.985 -5.125 7 HG2 MET 1 HG2 MET 1 5.313 -5.175 -7.726 8 HG3 MET 1 HG1 MET 1 3.617 -4.909 -7.384 9 HE1 MET 1 HE1 MET 1 2.465 -2.695 -7.055 10 HE2 MET 1 HE2 MET 1 2.846 -3.090 -8.733 11 HE3 MET 1 HE3 MET 1 3.057 -1.443 -8.169 12 HA PRO 2 HA PRO 2 9.456 -4.588 -3.295 13 HB2 PRO 2 HB2 PRO 2 8.989 -1.846 -4.306 14 HB3 PRO 2 HB1 PRO 2 10.509 -2.750 -4.155 15 HG2 PRO 2 HG2 PRO 2 9.456 -2.393 -6.544 16 HG3 PRO 2 HG1 PRO 2 10.151 -3.959 -6.125 17 HD2 PRO 2 HD2 PRO 2 7.254 -3.188 -6.260 18 HD3 PRO 2 HD1 PRO 2 8.055 -4.703 -6.752 19 H THR 3 HN THR 3 6.302 -3.236 -3.666 20 HA THR 3 HA THR 3 6.159 -1.538 -1.445 21 HB THR 3 HB THR 3 3.687 -2.100 -1.591 22 HG1 THR 3 HG1 THR 3 3.630 -4.099 -2.431 23 HG21 THR 3 HG21 THR 3 3.403 -0.953 -3.724 24 HG22 THR 3 HG22 THR 3 5.057 -1.321 -4.192 25 HG23 THR 3 HG23 THR 3 4.737 -0.240 -2.840 26 H GLN 4 HN GLN 4 6.059 -5.037 -1.797 27 HA GLN 4 HA GLN 4 5.855 -5.257 1.138 28 HB2 GLN 4 HB2 GLN 4 4.996 -7.236 -0.969 29 HB3 GLN 4 HB1 GLN 4 5.211 -7.661 0.713 30 HG2 GLN 4 HG2 GLN 4 3.589 -5.927 1.378 31 HG3 GLN 4 HG1 GLN 4 3.295 -5.544 -0.326 32 HE21 GLN 4 HE21 GLN 4 2.120 -7.115 -1.593 33 HE22 GLN 4 HE22 GLN 4 1.307 -8.415 -0.885 34 H ASP 5 HN ASP 5 7.195 -6.642 2.140 35 HA ASP 5 HA ASP 5 9.694 -7.329 0.750 36 HB2 ASP 5 HB2 ASP 5 8.919 -6.844 3.608 37 HB3 ASP 5 HB1 ASP 5 10.279 -7.903 3.284 38 H ILE 6 HN ILE 6 10.494 -9.501 2.260 39 HA ILE 6 HA ILE 6 8.268 -11.411 1.947 40 HB ILE 6 HB ILE 6 9.811 -13.103 1.238 41 HG12 ILE 6 HG12 ILE 6 11.956 -10.972 1.035 42 HG13 ILE 6 HG11 ILE 6 11.877 -12.102 2.401 43 HG21 ILE 6 HG21 ILE 6 10.486 -12.047 -1.019 44 HG22 ILE 6 HG22 ILE 6 9.934 -10.522 -0.348 45 HG23 ILE 6 HG23 ILE 6 8.791 -11.852 -0.557 46 HD11 ILE 6 HD11 ILE 6 12.176 -13.960 0.944 47 HD12 ILE 6 HD12 ILE 6 13.402 -12.765 0.482 48 HD13 ILE 6 HD13 ILE 6 11.936 -12.964 -0.486 49 H ARG 7 HN ARG 7 8.306 -13.196 3.322 50 HA ARG 7 HA ARG 7 9.403 -12.526 5.958 51 HB2 ARG 7 HB2 ARG 7 7.527 -14.795 5.211 52 HB3 ARG 7 HB1 ARG 7 7.838 -14.124 6.803 53 HG2 ARG 7 HG2 ARG 7 6.701 -12.377 4.590 54 HG3 ARG 7 HG1 ARG 7 5.684 -13.352 5.628 55 HD2 ARG 7 HD2 ARG 7 7.725 -11.416 6.749 56 HD3 ARG 7 HD1 ARG 7 6.083 -10.928 6.398 57 HE ARG 7 HE ARG 7 6.994 -12.649 8.542 58 HH11 ARG 7 HH21 ARG 7 4.296 -11.536 6.577 59 HH12 ARG 7 HH22 ARG 7 3.117 -12.008 7.719 60 HH21 ARG 7 HH11 ARG 7 5.329 -13.268 10.069 61 HH22 ARG 7 HH12 ARG 7 3.694 -12.981 9.692 62 H LEU 8 HN LEU 8 11.295 -13.404 6.560 63 HA LEU 8 HA LEU 8 12.109 -15.915 5.297 64 HB2 LEU 8 HB2 LEU 8 13.498 -13.897 4.789 65 HB3 LEU 8 HB1 LEU 8 13.854 -13.747 6.501 66 HG LEU 8 HG LEU 8 15.576 -14.973 4.939 67 HD11 LEU 8 HD11 LEU 8 16.441 -15.281 6.907 68 HD12 LEU 8 HD12 LEU 8 15.539 -16.786 7.067 69 HD13 LEU 8 HD13 LEU 8 14.874 -15.286 7.700 70 HD21 LEU 8 HD21 LEU 8 14.081 -17.467 5.661 71 HD22 LEU 8 HD22 LEU 8 15.199 -17.167 4.353 72 HD23 LEU 8 HD23 LEU 8 13.541 -16.606 4.214 73 H TRP 9 HN TRP 9 12.308 -17.625 6.589 74 HA TRP 9 HA TRP 9 12.082 -17.263 9.511 75 HB2 TRP 9 HB2 TRP 9 12.241 -19.902 8.072 76 HB3 TRP 9 HB1 TRP 9 11.516 -19.533 9.630 77 HD1 TRP 9 HD1 TRP 9 10.042 -16.841 8.252 78 HE1 TRP 9 HE1 TRP 9 7.849 -17.321 6.968 79 HE3 TRP 9 HE3 TRP 9 10.603 -21.816 7.433 80 HZ2 TRP 9 HZ2 TRP 9 6.521 -19.562 5.752 81 HZ3 TRP 9 HZ3 TRP 9 8.937 -23.095 6.230 82 HH2 TRP 9 HH2 TRP 9 6.848 -21.974 5.367 83 H VAL 10 HN VAL 10 13.819 -17.550 10.838 84 HA VAL 10 HA VAL 10 16.237 -18.687 9.588 85 HB VAL 10 HB VAL 10 16.296 -16.991 12.036 86 HG11 VAL 10 HG11 VAL 10 18.370 -18.126 11.427 87 HG12 VAL 10 HG12 VAL 10 18.550 -16.410 11.063 88 HG13 VAL 10 HG13 VAL 10 18.239 -17.538 9.770 89 HG21 VAL 10 HG21 VAL 10 15.028 -15.652 10.384 90 HG22 VAL 10 HG22 VAL 10 16.261 -15.969 9.173 91 HG23 VAL 10 HG23 VAL 10 16.649 -15.009 10.604 92 H SER 11 HN SER 11 16.878 -20.522 10.339 93 HA SER 11 HA SER 11 15.790 -21.614 12.828 94 HB2 SER 11 HB2 SER 11 17.833 -23.072 11.209 95 HB3 SER 11 HB1 SER 11 16.411 -23.690 12.011 96 HG SER 11 HG SER 11 16.431 -22.038 9.676 97 H VAL 12 HN VAL 12 16.928 -20.970 14.656 98 HA VAL 12 HA VAL 12 19.759 -20.259 14.285 99 HB VAL 12 HB VAL 12 17.657 -19.316 16.215 100 HG11 VAL 12 HG11 VAL 12 19.414 -17.674 16.937 101 HG12 VAL 12 HG12 VAL 12 20.607 -18.629 16.063 102 HG13 VAL 12 HG13 VAL 12 19.735 -19.332 17.419 103 HG21 VAL 12 HG21 VAL 12 17.618 -17.299 15.024 104 HG22 VAL 12 HG22 VAL 12 17.778 -18.460 13.709 105 HG23 VAL 12 HG23 VAL 12 19.189 -17.572 14.297 106 H GLU 13 HN GLU 13 21.273 -21.222 15.451 107 HA GLU 13 HA GLU 13 20.488 -22.832 17.800 108 HB2 GLU 13 HB2 GLU 13 22.550 -23.482 15.695 109 HB3 GLU 13 HB1 GLU 13 22.471 -24.290 17.250 110 HG2 GLU 13 HG2 GLU 13 20.241 -25.084 16.821 111 HG3 GLU 13 HG1 GLU 13 20.137 -24.176 15.315 112 H ASP 14 HN ASP 14 21.664 -22.523 19.618 113 HA ASP 14 HA ASP 14 23.541 -20.304 19.509 114 HB2 ASP 14 HB2 ASP 14 23.373 -20.091 21.880 115 HB3 ASP 14 HB1 ASP 14 21.758 -20.403 21.277 116 H ALA 15 HN ALA 15 25.359 -20.627 21.315 117 HA ALA 15 HA ALA 15 27.305 -22.119 20.025 118 HB1 ALA 15 HB1 ALA 15 27.537 -21.583 22.970 119 HB2 ALA 15 HB2 ALA 15 27.567 -20.263 21.801 120 HB3 ALA 15 HB3 ALA 15 28.770 -21.562 21.714 121 H GLN 16 HN GLN 16 25.063 -23.105 22.464 122 HA GLN 16 HA GLN 16 26.373 -25.689 22.874 123 HB2 GLN 16 HB2 GLN 16 23.881 -24.511 24.144 124 HB3 GLN 16 HB1 GLN 16 24.646 -26.033 24.552 125 HG2 GLN 16 HG2 GLN 16 25.653 -24.656 26.153 126 HG3 GLN 16 HG1 GLN 16 26.824 -24.608 24.848 127 HE21 GLN 16 HE21 GLN 16 24.213 -22.826 23.703 128 HE22 GLN 16 HE22 GLN 16 24.729 -21.300 24.219 129 H MET 17 HN MET 17 24.700 -24.448 20.490 130 HA MET 17 HA MET 17 23.562 -25.315 18.782 131 HB2 MET 17 HB2 MET 17 23.963 -27.966 20.212 132 HB3 MET 17 HB1 MET 17 23.219 -27.785 18.633 133 HG2 MET 17 HG2 MET 17 25.225 -26.690 17.760 134 HG3 MET 17 HG1 MET 17 26.025 -26.845 19.318 135 HE1 MET 17 HE1 MET 17 25.313 -29.857 20.374 136 HE2 MET 17 HE2 MET 17 26.706 -28.786 20.435 137 HE3 MET 17 HE3 MET 17 26.887 -30.411 19.796 138 H HIS 18 HN HIS 18 22.338 -24.481 21.455 139 HA HIS 18 HA HIS 18 19.791 -25.872 21.526 140 HB2 HIS 18 HB2 HIS 18 20.983 -24.393 23.413 141 HB3 HIS 18 HB1 HIS 18 20.139 -23.092 22.572 142 HD1 HIS 18 HD1 HIS 18 18.095 -22.592 23.947 143 HD2 HIS 18 HD2 HIS 18 18.703 -26.698 23.472 144 HE1 HIS 18 HE1 HIS 18 16.111 -23.744 25.012 145 HE2 HIS 18 HE2 HIS 18 16.455 -26.247 24.714 146 H THR 19 HN THR 19 18.130 -25.483 20.147 147 HA THR 19 HA THR 19 18.646 -23.374 18.266 148 HB THR 19 HB THR 19 18.402 -25.722 17.456 149 HG1 THR 19 HG1 THR 19 17.944 -23.660 16.307 150 HG21 THR 19 HG21 THR 19 16.440 -26.270 18.981 151 HG22 THR 19 HG22 THR 19 16.209 -26.721 17.302 152 HG23 THR 19 HG23 THR 19 15.445 -25.271 17.932 153 H VAL 20 HN VAL 20 17.340 -21.815 17.639 154 HA VAL 20 HA VAL 20 14.619 -21.630 18.682 155 HB VAL 20 HB VAL 20 14.917 -19.187 19.062 156 HG11 VAL 20 HG11 VAL 20 16.173 -19.365 21.188 157 HG12 VAL 20 HG12 VAL 20 16.778 -20.936 20.693 158 HG13 VAL 20 HG13 VAL 20 15.054 -20.709 20.984 159 HG21 VAL 20 HG21 VAL 20 17.787 -19.870 18.371 160 HG22 VAL 20 HG22 VAL 20 17.414 -18.522 19.433 161 HG23 VAL 20 HG23 VAL 20 16.793 -18.528 17.796 162 H THR 21 HN THR 21 13.327 -20.158 17.321 163 HA THR 21 HA THR 21 14.460 -19.910 14.617 164 HB THR 21 HB THR 21 11.624 -20.637 15.366 165 HG1 THR 21 HG1 THR 21 12.691 -22.439 15.475 166 HG21 THR 21 HG21 THR 21 11.231 -20.821 12.968 167 HG22 THR 21 HG22 THR 21 12.875 -20.301 12.608 168 HG23 THR 21 HG23 THR 21 11.735 -19.189 13.356 169 H ILE 22 HN ILE 22 14.289 -17.945 13.712 170 HA ILE 22 HA ILE 22 12.390 -16.041 14.913 171 HB ILE 22 HB ILE 22 13.984 -14.217 14.627 172 HG12 ILE 22 HG12 ILE 22 16.016 -16.358 13.909 173 HG13 ILE 22 HG11 ILE 22 15.242 -15.289 12.731 174 HG21 ILE 22 HG21 ILE 22 15.600 -14.868 16.391 175 HG22 ILE 22 HG22 ILE 22 15.150 -16.550 16.195 176 HG23 ILE 22 HG23 ILE 22 13.969 -15.382 16.802 177 HD11 ILE 22 HD11 ILE 22 16.365 -13.415 13.468 178 HD12 ILE 22 HD12 ILE 22 17.590 -14.633 13.808 179 HD13 ILE 22 HD13 ILE 22 16.566 -14.033 15.102 180 H TRP 23 HN TRP 23 11.615 -14.436 13.511 181 HA TRP 23 HA TRP 23 11.729 -15.244 10.674 182 HB2 TRP 23 HB2 TRP 23 9.522 -13.932 12.273 183 HB3 TRP 23 HB1 TRP 23 9.509 -14.082 10.523 184 HD1 TRP 23 HD1 TRP 23 8.670 -16.267 9.531 185 HE1 TRP 23 HE1 TRP 23 8.066 -18.587 10.449 186 HE3 TRP 23 HE3 TRP 23 10.205 -15.716 14.356 187 HZ2 TRP 23 HZ2 TRP 23 8.210 -20.037 12.940 188 HZ3 TRP 23 HZ3 TRP 23 9.952 -17.586 15.979 189 HH2 TRP 23 HH2 TRP 23 8.958 -19.727 15.261 190 H LEU 24 HN LEU 24 12.538 -13.849 9.288 191 HA LEU 24 HA LEU 24 12.824 -11.030 10.131 192 HB2 LEU 24 HB2 LEU 24 14.649 -12.591 8.287 193 HB3 LEU 24 HB1 LEU 24 14.818 -10.893 8.720 194 HG LEU 24 HG LEU 24 14.915 -13.211 10.691 195 HD11 LEU 24 HD11 LEU 24 17.230 -12.994 10.733 196 HD12 LEU 24 HD12 LEU 24 17.198 -11.380 10.018 197 HD13 LEU 24 HD13 LEU 24 16.881 -12.790 9.016 198 HD21 LEU 24 HD21 LEU 24 14.167 -11.370 11.956 199 HD22 LEU 24 HD22 LEU 24 15.046 -10.209 10.960 200 HD23 LEU 24 HD23 LEU 24 15.916 -11.236 12.086 201 H THR 25 HN THR 25 12.081 -9.516 8.760 202 HA THR 25 HA THR 25 10.854 -10.524 6.286 203 HB THR 25 HB THR 25 10.144 -7.910 7.609 204 HG1 THR 25 HG1 THR 25 9.841 -9.406 9.200 205 HG21 THR 25 HG21 THR 25 9.180 -8.092 5.477 206 HG22 THR 25 HG22 THR 25 7.893 -8.660 6.520 207 HG23 THR 25 HG23 THR 25 8.876 -9.814 5.628 208 H VAL 26 HN VAL 26 11.977 -10.030 4.525 209 HA VAL 26 HA VAL 26 13.288 -7.427 4.250 210 HB VAL 26 HB VAL 26 15.392 -8.589 3.488 211 HG11 VAL 26 HG11 VAL 26 14.674 -9.130 6.371 212 HG12 VAL 26 HG12 VAL 26 15.106 -7.538 5.748 213 HG13 VAL 26 HG13 VAL 26 16.272 -8.859 5.688 214 HG21 VAL 26 HG21 VAL 26 13.860 -10.980 4.568 215 HG22 VAL 26 HG22 VAL 26 15.616 -10.924 4.632 216 HG23 VAL 26 HG23 VAL 26 14.789 -10.814 3.076 217 H ARG 27 HN ARG 27 14.653 -7.865 1.969 218 HA ARG 27 HA ARG 27 12.649 -8.896 0.079 219 HB2 ARG 27 HB2 ARG 27 13.608 -7.255 -1.561 220 HB3 ARG 27 HB1 ARG 27 12.762 -6.497 -0.226 221 HG2 ARG 27 HG2 ARG 27 15.749 -6.947 -0.021 222 HG3 ARG 27 HG1 ARG 27 15.131 -5.573 -0.930 223 HD2 ARG 27 HD2 ARG 27 14.960 -6.106 2.040 224 HD3 ARG 27 HD1 ARG 27 15.405 -4.649 1.193 225 HE ARG 27 HE ARG 27 12.720 -5.539 1.887 226 HH11 ARG 27 HH21 ARG 27 14.709 -3.373 -0.017 227 HH12 ARG 27 HH22 ARG 27 13.451 -2.247 -0.278 228 HH21 ARG 27 HH11 ARG 27 11.088 -4.054 1.549 229 HH22 ARG 27 HH12 ARG 27 11.355 -2.628 0.612 230 HA PRO 28 HA PRO 28 15.747 -11.908 -1.068 231 HB2 PRO 28 HB2 PRO 28 14.964 -11.311 -3.891 232 HB3 PRO 28 HB1 PRO 28 15.028 -12.865 -3.044 233 HG2 PRO 28 HG2 PRO 28 12.756 -11.797 -3.569 234 HG3 PRO 28 HG1 PRO 28 13.032 -12.535 -1.991 235 HD2 PRO 28 HD2 PRO 28 12.916 -9.585 -2.624 236 HD3 PRO 28 HD1 PRO 28 12.343 -10.459 -1.182 237 H ASP 29 HN ASP 29 15.527 -8.809 -2.481 238 HA ASP 29 HA ASP 29 17.943 -8.652 -3.962 239 HB2 ASP 29 HB2 ASP 29 15.993 -7.067 -4.129 240 HB3 ASP 29 HB1 ASP 29 16.516 -6.362 -2.603 241 H MET 30 HN MET 30 17.162 -8.206 -0.592 242 HA MET 30 HA MET 30 19.377 -6.737 0.264 243 HB2 MET 30 HB2 MET 30 17.442 -8.524 1.590 244 HB3 MET 30 HB1 MET 30 18.997 -8.345 2.401 245 HG2 MET 30 HG2 MET 30 18.774 -5.901 2.339 246 HG3 MET 30 HG1 MET 30 17.228 -6.035 1.527 247 HE1 MET 30 HE1 MET 30 18.644 -6.586 5.614 248 HE2 MET 30 HE2 MET 30 19.430 -7.174 4.159 249 HE3 MET 30 HE3 MET 30 18.413 -8.257 5.093 250 H THR 31 HN THR 31 21.131 -7.283 1.463 251 HA THR 31 HA THR 31 22.647 -9.472 0.298 252 HB THR 31 HB THR 31 23.352 -7.001 1.854 253 HG1 THR 31 HG1 THR 31 23.836 -7.873 -0.832 254 HG21 THR 31 HG21 THR 31 24.951 -8.371 2.634 255 HG22 THR 31 HG22 THR 31 25.740 -7.812 1.147 256 HG23 THR 31 HG23 THR 31 24.957 -9.406 1.205 257 H VAL 32 HN VAL 32 23.617 -11.024 1.651 258 HA VAL 32 HA VAL 32 22.199 -11.806 3.972 259 HB VAL 32 HB VAL 32 25.001 -12.575 3.080 260 HG11 VAL 32 HG11 VAL 32 24.629 -13.157 5.412 261 HG12 VAL 32 HG12 VAL 32 24.607 -14.608 4.417 262 HG13 VAL 32 HG13 VAL 32 23.092 -13.926 5.011 263 HG21 VAL 32 HG21 VAL 32 24.064 -14.055 1.632 264 HG22 VAL 32 HG22 VAL 32 22.695 -12.965 1.661 265 HG23 VAL 32 HG23 VAL 32 22.698 -14.399 2.684 266 H ALA 33 HN ALA 33 25.320 -10.151 3.608 267 HA ALA 33 HA ALA 33 25.917 -9.870 6.330 268 HB1 ALA 33 HB1 ALA 33 27.298 -7.953 5.669 269 HB2 ALA 33 HB2 ALA 33 26.523 -7.903 4.088 270 HB3 ALA 33 HB3 ALA 33 27.518 -9.279 4.542 271 H SER 34 HN SER 34 23.910 -7.870 4.212 272 HA SER 34 HA SER 34 23.210 -5.909 6.148 273 HB2 SER 34 HB2 SER 34 21.517 -6.883 3.828 274 HB3 SER 34 HB1 SER 34 21.390 -5.348 4.661 275 HG SER 34 HG SER 34 23.605 -4.949 3.925 276 H LEU 35 HN LEU 35 21.787 -8.981 5.174 277 HA LEU 35 HA LEU 35 19.572 -8.953 6.965 278 HB2 LEU 35 HB2 LEU 35 19.674 -10.452 5.034 279 HB3 LEU 35 HB1 LEU 35 21.081 -11.266 5.710 280 HG LEU 35 HG LEU 35 19.764 -12.042 7.618 281 HD11 LEU 35 HD11 LEU 35 17.748 -10.173 6.451 282 HD12 LEU 35 HD12 LEU 35 18.063 -10.630 8.139 283 HD13 LEU 35 HD13 LEU 35 17.140 -11.702 7.103 284 HD21 LEU 35 HD21 LEU 35 19.794 -13.433 5.585 285 HD22 LEU 35 HD22 LEU 35 18.339 -12.601 4.995 286 HD23 LEU 35 HD23 LEU 35 18.263 -13.582 6.440 287 H LYS 36 HN LYS 36 22.871 -10.215 7.251 288 HA LYS 36 HA LYS 36 22.689 -11.345 9.804 289 HB2 LYS 36 HB2 LYS 36 24.617 -11.543 8.231 290 HB3 LYS 36 HB1 LYS 36 24.997 -9.856 8.548 291 HG2 LYS 36 HG2 LYS 36 25.102 -10.483 11.046 292 HG3 LYS 36 HG1 LYS 36 25.093 -12.163 10.502 293 HD2 LYS 36 HD2 LYS 36 26.970 -10.201 9.305 294 HD3 LYS 36 HD1 LYS 36 27.395 -10.948 10.854 295 HE2 LYS 36 HE2 LYS 36 27.428 -13.122 9.883 296 HE3 LYS 36 HE1 LYS 36 26.628 -12.591 8.404 297 HZ1 LYS 36 HZ1 LYS 36 28.525 -11.408 7.759 298 HZ2 LYS 36 HZ2 LYS 36 29.148 -12.897 8.294 299 HZ3 LYS 36 HZ3 LYS 36 29.254 -11.509 9.267 300 H ASP 37 HN ASP 37 23.448 -8.109 8.642 301 HA ASP 37 HA ASP 37 24.180 -6.953 11.068 302 HB2 ASP 37 HB2 ASP 37 24.443 -5.977 8.683 303 HB3 ASP 37 HB1 ASP 37 22.797 -5.420 8.876 304 H MET 38 HN MET 38 20.949 -7.058 9.560 305 HA MET 38 HA MET 38 19.673 -5.441 11.499 306 HB2 MET 38 HB2 MET 38 18.007 -7.644 10.518 307 HB3 MET 38 HB1 MET 38 17.775 -5.926 10.486 308 HG2 MET 38 HG2 MET 38 19.344 -5.698 8.602 309 HG3 MET 38 HG1 MET 38 19.507 -7.449 8.562 310 HE1 MET 38 HE1 MET 38 16.311 -8.978 7.757 311 HE2 MET 38 HE2 MET 38 16.033 -8.170 9.290 312 HE3 MET 38 HE3 MET 38 17.598 -8.875 8.964 313 H VAL 39 HN VAL 39 20.292 -8.846 11.320 314 HA VAL 39 HA VAL 39 18.755 -9.696 13.494 315 HB VAL 39 HB VAL 39 21.430 -10.802 12.561 316 HG11 VAL 39 HG11 VAL 39 19.352 -12.547 13.790 317 HG12 VAL 39 HG12 VAL 39 20.256 -11.531 14.905 318 HG13 VAL 39 HG13 VAL 39 21.097 -12.672 13.865 319 HG21 VAL 39 HG21 VAL 39 19.095 -12.333 11.795 320 HG22 VAL 39 HG22 VAL 39 20.330 -11.608 10.767 321 HG23 VAL 39 HG23 VAL 39 18.921 -10.669 11.238 322 H PHE 40 HN PHE 40 22.020 -8.443 13.287 323 HA PHE 40 HA PHE 40 22.685 -8.578 16.037 324 HB2 PHE 40 HB2 PHE 40 24.446 -8.232 14.506 325 HB3 PHE 40 HB1 PHE 40 23.641 -6.844 13.770 326 HD1 PHE 40 HD2 PHE 40 24.633 -7.922 17.255 327 HD2 PHE 40 HD1 PHE 40 24.572 -4.810 14.302 328 HE1 PHE 40 HE2 PHE 40 25.815 -6.410 18.818 329 HE2 PHE 40 HE1 PHE 40 25.753 -3.296 15.878 330 HZ PHE 40 HZ PHE 40 26.374 -4.099 18.127 331 H LEU 41 HN LEU 41 21.211 -6.045 14.039 332 HA LEU 41 HA LEU 41 20.893 -4.119 16.114 333 HB2 LEU 41 HB2 LEU 41 18.996 -4.533 13.795 334 HB3 LEU 41 HB1 LEU 41 19.273 -3.059 14.712 335 HG LEU 41 HG LEU 41 21.291 -4.460 12.986 336 HD11 LEU 41 HD11 LEU 41 19.582 -3.394 11.646 337 HD12 LEU 41 HD12 LEU 41 21.072 -2.410 11.565 338 HD13 LEU 41 HD13 LEU 41 19.733 -1.902 12.575 339 HD21 LEU 41 HD21 LEU 41 22.455 -3.384 14.743 340 HD22 LEU 41 HD22 LEU 41 21.427 -1.945 14.655 341 HD23 LEU 41 HD23 LEU 41 22.576 -2.316 13.349 342 H ASP 42 HN ASP 42 18.872 -6.600 14.781 343 HA ASP 42 HA ASP 42 16.591 -6.002 16.363 344 HB2 ASP 42 HB2 ASP 42 16.656 -7.196 14.090 345 HB3 ASP 42 HB1 ASP 42 17.012 -8.659 14.985 346 H TYR 43 HN TYR 43 18.968 -8.639 16.594 347 HA TYR 43 HA TYR 43 17.788 -9.355 19.219 348 HB2 TYR 43 HB2 TYR 43 19.489 -11.054 17.392 349 HB3 TYR 43 HB1 TYR 43 18.696 -11.553 18.883 350 HD1 TYR 43 HD2 TYR 43 16.185 -11.584 19.058 351 HD2 TYR 43 HD1 TYR 43 18.233 -10.824 15.356 352 HE1 TYR 43 HE2 TYR 43 14.098 -11.994 17.820 353 HE2 TYR 43 HE1 TYR 43 16.154 -11.227 14.123 354 HH TYR 43 HH TYR 43 13.630 -10.930 14.885 355 H GLY 44 HN GLY 44 20.406 -7.641 18.057 356 HA2 GLY 44 HA2 GLY 44 22.344 -6.960 19.115 357 HA3 GLY 44 HA1 GLY 44 21.763 -7.802 20.548 358 H PHE 45 HN PHE 45 21.770 -9.605 17.682 359 HA PHE 45 HA PHE 45 23.542 -11.564 18.740 360 HB2 PHE 45 HB2 PHE 45 22.044 -11.224 16.154 361 HB3 PHE 45 HB1 PHE 45 23.294 -12.436 16.262 362 HD1 PHE 45 HD1 PHE 45 21.533 -11.663 19.402 363 HD2 PHE 45 HD2 PHE 45 21.491 -14.139 15.861 364 HE1 PHE 45 HE1 PHE 45 19.984 -13.210 20.497 365 HE2 PHE 45 HE2 PHE 45 19.925 -15.689 16.991 366 HZ PHE 45 HZ PHE 45 19.169 -15.226 19.311 367 HA PRO 46 HA PRO 46 27.215 -9.312 17.458 368 HB2 PRO 46 HB2 PRO 46 28.965 -11.438 17.784 369 HB3 PRO 46 HB1 PRO 46 28.470 -10.305 19.056 370 HG2 PRO 46 HG2 PRO 46 27.417 -13.033 18.465 371 HG3 PRO 46 HG1 PRO 46 27.714 -12.282 20.035 372 HD2 PRO 46 HD2 PRO 46 25.253 -12.476 19.115 373 HD3 PRO 46 HD1 PRO 46 25.756 -10.997 19.964 374 HA PRO 47 HA PRO 47 26.718 -10.696 13.181 375 HB2 PRO 47 HB2 PRO 47 28.715 -9.130 12.115 376 HB3 PRO 47 HB1 PRO 47 27.045 -8.578 12.413 377 HG2 PRO 47 HG2 PRO 47 29.508 -8.192 14.053 378 HG3 PRO 47 HG1 PRO 47 28.180 -7.061 13.720 379 HD2 PRO 47 HD2 PRO 47 28.325 -8.297 16.069 380 HD3 PRO 47 HD1 PRO 47 26.743 -8.048 15.294 381 H VAL 48 HN VAL 48 29.832 -10.573 14.786 382 HA VAL 48 HA VAL 48 31.334 -12.078 12.940 383 HB VAL 48 HB VAL 48 32.411 -10.733 14.610 384 HG11 VAL 48 HG11 VAL 48 30.540 -11.393 16.369 385 HG12 VAL 48 HG12 VAL 48 32.153 -10.956 16.906 386 HG13 VAL 48 HG13 VAL 48 31.692 -12.657 16.814 387 HG21 VAL 48 HG21 VAL 48 33.467 -12.957 13.783 388 HG22 VAL 48 HG22 VAL 48 33.045 -13.583 15.378 389 HG23 VAL 48 HG23 VAL 48 34.156 -12.236 15.235 390 H LEU 49 HN LEU 49 29.190 -13.063 15.522 391 HA LEU 49 HA LEU 49 30.020 -15.854 15.321 392 HB2 LEU 49 HB2 LEU 49 28.094 -14.351 17.035 393 HB3 LEU 49 HB1 LEU 49 28.053 -16.098 16.969 394 HG LEU 49 HG LEU 49 30.748 -15.739 17.331 395 HD11 LEU 49 HD11 LEU 49 29.896 -13.177 17.685 396 HD12 LEU 49 HD12 LEU 49 31.309 -13.872 18.465 397 HD13 LEU 49 HD13 LEU 49 29.778 -13.797 19.335 398 HD21 LEU 49 HD21 LEU 49 30.374 -16.540 19.534 399 HD22 LEU 49 HD22 LEU 49 28.993 -17.105 18.594 400 HD23 LEU 49 HD23 LEU 49 28.813 -15.715 19.652 401 H GLN 50 HN GLN 50 28.039 -13.935 13.546 402 HA GLN 50 HA GLN 50 25.762 -15.693 13.384 403 HB2 GLN 50 HB2 GLN 50 26.409 -13.412 11.522 404 HB3 GLN 50 HB1 GLN 50 24.821 -14.117 11.845 405 HG2 GLN 50 HG2 GLN 50 26.560 -12.630 13.799 406 HG3 GLN 50 HG1 GLN 50 25.105 -11.981 13.050 407 HE21 GLN 50 HE21 GLN 50 26.119 -13.162 15.893 408 HE22 GLN 50 HE22 GLN 50 24.696 -13.937 16.441 409 H GLN 51 HN GLN 51 26.239 -17.680 12.511 410 HA GLN 51 HA GLN 51 27.451 -17.720 9.829 411 HB2 GLN 51 HB2 GLN 51 27.488 -19.589 12.064 412 HB3 GLN 51 HB1 GLN 51 26.897 -20.362 10.596 413 HG2 GLN 51 HG2 GLN 51 29.428 -18.722 10.713 414 HG3 GLN 51 HG1 GLN 51 29.381 -20.473 10.879 415 HE21 GLN 51 HE21 GLN 51 30.088 -18.277 8.566 416 HE22 GLN 51 HE22 GLN 51 29.511 -19.085 7.197 417 H TRP 52 HN TRP 52 26.067 -17.611 8.199 418 HA TRP 52 HA TRP 52 23.265 -18.389 8.656 419 HB2 TRP 52 HB2 TRP 52 24.651 -16.371 6.946 420 HB3 TRP 52 HB1 TRP 52 23.134 -17.033 6.372 421 HD1 TRP 52 HD1 TRP 52 24.590 -15.148 9.396 422 HE1 TRP 52 HE1 TRP 52 22.648 -13.884 10.553 423 HE3 TRP 52 HE3 TRP 52 20.665 -16.893 6.669 424 HZ2 TRP 52 HZ2 TRP 52 19.797 -13.654 10.331 425 HZ3 TRP 52 HZ3 TRP 52 18.360 -16.145 7.149 426 HH2 TRP 52 HH2 TRP 52 17.933 -14.528 8.984 427 H VAL 53 HN VAL 53 22.391 -20.059 7.589 428 HA VAL 53 HA VAL 53 23.695 -21.072 5.139 429 HB VAL 53 HB VAL 53 22.366 -22.745 7.269 430 HG11 VAL 53 HG11 VAL 53 23.817 -23.539 4.729 431 HG12 VAL 53 HG12 VAL 53 22.078 -23.684 5.011 432 HG13 VAL 53 HG13 VAL 53 23.208 -24.659 5.939 433 HG21 VAL 53 HG21 VAL 53 24.499 -22.059 8.140 434 HG22 VAL 53 HG22 VAL 53 25.297 -22.294 6.584 435 HG23 VAL 53 HG23 VAL 53 24.731 -23.687 7.505 436 H ILE 54 HN ILE 54 22.419 -21.326 3.447 437 HA ILE 54 HA ILE 54 19.537 -21.516 3.747 438 HB ILE 54 HB ILE 54 20.823 -19.361 2.023 439 HG12 ILE 54 HG12 ILE 54 19.077 -19.121 4.492 440 HG13 ILE 54 HG11 ILE 54 20.823 -18.873 4.504 441 HG21 ILE 54 HG21 ILE 54 18.707 -20.346 1.082 442 HG22 ILE 54 HG22 ILE 54 18.512 -18.672 1.580 443 HG23 ILE 54 HG23 ILE 54 17.906 -19.962 2.610 444 HD11 ILE 54 HD11 ILE 54 19.178 -16.820 4.248 445 HD12 ILE 54 HD12 ILE 54 19.173 -17.306 2.554 446 HD13 ILE 54 HD13 ILE 54 20.686 -16.864 3.337 447 H GLY 55 HN GLY 55 18.517 -22.357 1.828 448 HA2 GLY 55 HA2 GLY 55 19.669 -24.559 0.811 449 HA3 GLY 55 HA1 GLY 55 18.415 -23.685 -0.052 450 H GLN 56 HN GLN 56 20.039 -21.295 -0.570 451 HA GLN 56 HA GLN 56 21.972 -22.430 -2.515 452 HB2 GLN 56 HB2 GLN 56 20.237 -19.965 -2.839 453 HB3 GLN 56 HB1 GLN 56 21.443 -20.558 -3.981 454 HG2 GLN 56 HG2 GLN 56 19.105 -22.214 -3.038 455 HG3 GLN 56 HG1 GLN 56 19.091 -21.284 -4.542 456 HE21 GLN 56 HE21 GLN 56 20.350 -24.193 -3.000 457 HE22 GLN 56 HE22 GLN 56 21.119 -24.802 -4.380 458 H ARG 57 HN ARG 57 22.293 -21.518 0.254 459 HA ARG 57 HA ARG 57 23.600 -19.002 0.281 460 HB2 ARG 57 HB2 ARG 57 22.825 -19.913 2.331 461 HB3 ARG 57 HB1 ARG 57 23.848 -21.356 2.165 462 HG2 ARG 57 HG2 ARG 57 25.486 -18.930 1.964 463 HG3 ARG 57 HG1 ARG 57 24.504 -18.890 3.407 464 HD2 ARG 57 HD2 ARG 57 26.789 -20.034 3.591 465 HD3 ARG 57 HD1 ARG 57 25.422 -20.877 4.287 466 HE ARG 57 HE ARG 57 25.976 -21.597 1.511 467 HH11 ARG 57 HH21 ARG 57 26.793 -22.216 4.872 468 HH12 ARG 57 HH22 ARG 57 27.208 -23.829 4.582 469 HH21 ARG 57 HH11 ARG 57 26.578 -23.778 1.164 470 HH22 ARG 57 HH12 ARG 57 27.101 -24.726 2.482 471 H LEU 58 HN LEU 58 25.535 -18.407 -0.285 472 HA LEU 58 HA LEU 58 27.669 -20.411 -0.583 473 HB2 LEU 58 HB2 LEU 58 27.100 -17.932 -2.191 474 HB3 LEU 58 HB1 LEU 58 28.769 -18.433 -1.941 475 HG LEU 58 HG LEU 58 28.155 -20.725 -2.802 476 HD11 LEU 58 HD11 LEU 58 25.511 -19.345 -3.306 477 HD12 LEU 58 HD12 LEU 58 25.816 -20.872 -2.469 478 HD13 LEU 58 HD13 LEU 58 26.030 -20.768 -4.202 479 HD21 LEU 58 HD21 LEU 58 27.877 -19.952 -5.204 480 HD22 LEU 58 HD22 LEU 58 29.236 -19.235 -4.339 481 HD23 LEU 58 HD23 LEU 58 27.758 -18.305 -4.585 482 H ALA 59 HN ALA 59 29.657 -19.826 0.327 483 HA ALA 59 HA ALA 59 29.458 -18.587 2.838 484 HB1 ALA 59 HB1 ALA 59 32.015 -18.677 2.759 485 HB2 ALA 59 HB2 ALA 59 31.821 -19.387 1.161 486 HB3 ALA 59 HB3 ALA 59 31.163 -20.215 2.572 487 H ARG 60 HN ARG 60 28.482 -16.692 1.035 488 HA ARG 60 HA ARG 60 30.483 -14.538 1.299 489 HB2 ARG 60 HB2 ARG 60 29.908 -15.411 -1.114 490 HB3 ARG 60 HB1 ARG 60 28.419 -14.530 -0.876 491 HG2 ARG 60 HG2 ARG 60 29.863 -12.917 -1.885 492 HG3 ARG 60 HG1 ARG 60 29.887 -12.503 -0.174 493 HD2 ARG 60 HD2 ARG 60 32.148 -12.602 -1.346 494 HD3 ARG 60 HD1 ARG 60 32.008 -13.495 0.159 495 HE ARG 60 HE ARG 60 31.436 -15.028 -2.262 496 HH11 ARG 60 HH21 ARG 60 33.869 -13.995 0.060 497 HH12 ARG 60 HH22 ARG 60 34.888 -15.325 -0.209 498 HH21 ARG 60 HH11 ARG 60 32.846 -16.828 -2.619 499 HH22 ARG 60 HH12 ARG 60 34.304 -16.948 -1.741 500 H ASP 61 HN ASP 61 29.820 -13.334 2.880 501 HA ASP 61 HA ASP 61 27.161 -13.027 3.831 502 HB2 ASP 61 HB2 ASP 61 29.607 -12.439 4.840 503 HB3 ASP 61 HB1 ASP 61 29.144 -10.863 4.222 504 H GLN 62 HN GLN 62 29.140 -11.428 1.530 505 HA GLN 62 HA GLN 62 27.719 -9.014 1.184 506 HB2 GLN 62 HB2 GLN 62 29.549 -10.521 -0.694 507 HB3 GLN 62 HB1 GLN 62 29.001 -8.866 -0.912 508 HG2 GLN 62 HG2 GLN 62 30.099 -8.117 1.082 509 HG3 GLN 62 HG1 GLN 62 30.455 -9.757 1.601 510 HE21 GLN 62 HE21 GLN 62 31.836 -7.123 0.131 511 HE22 GLN 62 HE22 GLN 62 33.088 -7.920 -0.704 512 H GLU 63 HN GLU 63 27.159 -12.237 0.027 513 HA GLU 63 HA GLU 63 25.900 -11.558 -2.356 514 HB2 GLU 63 HB2 GLU 63 26.187 -14.051 -0.817 515 HB3 GLU 63 HB1 GLU 63 24.730 -13.961 -1.782 516 HG2 GLU 63 HG2 GLU 63 27.544 -13.452 -2.798 517 HG3 GLU 63 HG1 GLU 63 26.601 -14.912 -3.057 518 H THR 64 HN THR 64 23.850 -11.980 -2.988 519 HA THR 64 HA THR 64 21.935 -10.406 -1.583 520 HB THR 64 HB THR 64 21.232 -12.094 -3.949 521 HG1 THR 64 HG1 THR 64 23.336 -11.319 -4.379 522 HG21 THR 64 HG21 THR 64 19.918 -10.094 -2.647 523 HG22 THR 64 HG22 THR 64 19.681 -10.473 -4.345 524 HG23 THR 64 HG23 THR 64 20.762 -9.170 -3.884 525 H LEU 65 HN LEU 65 19.942 -11.136 -0.693 526 HA LEU 65 HA LEU 65 19.961 -13.680 0.588 527 HB2 LEU 65 HB2 LEU 65 17.603 -11.841 0.034 528 HB3 LEU 65 HB1 LEU 65 17.582 -13.212 1.128 529 HG LEU 65 HG LEU 65 19.308 -10.748 1.385 530 HD11 LEU 65 HD11 LEU 65 17.168 -11.727 3.250 531 HD12 LEU 65 HD12 LEU 65 16.860 -10.566 1.963 532 HD13 LEU 65 HD13 LEU 65 17.986 -10.171 3.259 533 HD21 LEU 65 HD21 LEU 65 19.214 -13.300 3.041 534 HD22 LEU 65 HD22 LEU 65 19.901 -11.765 3.605 535 HD23 LEU 65 HD23 LEU 65 20.614 -12.569 2.234 536 H HIS 66 HN HIS 66 18.490 -12.478 -2.326 537 HA HIS 66 HA HIS 66 17.055 -14.784 -3.103 538 HB2 HIS 66 HB2 HIS 66 16.850 -12.624 -4.284 539 HB3 HIS 66 HB1 HIS 66 18.505 -12.770 -4.849 540 HD1 HIS 66 HD1 HIS 66 18.768 -13.827 -7.069 541 HD2 HIS 66 HD2 HIS 66 15.226 -15.039 -5.220 542 HE1 HIS 66 HE1 HIS 66 17.556 -15.307 -8.733 543 HE2 HIS 66 HE2 HIS 66 15.395 -16.053 -7.620 544 H SER 67 HN SER 67 20.430 -13.798 -3.629 545 HA SER 67 HA SER 67 21.252 -16.007 -5.158 546 HB2 SER 67 HB2 SER 67 22.950 -14.534 -3.129 547 HB3 SER 67 HB1 SER 67 23.481 -15.443 -4.515 548 HG SER 67 HG SER 67 23.459 -13.241 -4.826 549 H HIS 68 HN HIS 68 21.181 -15.445 -1.666 550 HA HIS 68 HA HIS 68 22.314 -17.967 -0.984 551 HB2 HIS 68 HB2 HIS 68 21.039 -15.739 0.501 552 HB3 HIS 68 HB1 HIS 68 20.973 -17.319 1.261 553 HD1 HIS 68 HD1 HIS 68 23.859 -16.238 -0.944 554 HD2 HIS 68 HD2 HIS 68 23.066 -16.842 3.118 555 HE1 HIS 68 HE1 HIS 68 26.077 -16.086 0.252 556 HE2 HIS 68 HE2 HIS 68 25.631 -16.469 2.721 557 H GLY 69 HN GLY 69 19.223 -17.071 -2.034 558 HA2 GLY 69 HA2 GLY 69 17.916 -18.943 -2.856 559 HA3 GLY 69 HA1 GLY 69 18.250 -19.791 -1.348 560 H VAL 70 HN VAL 70 17.684 -16.542 -0.626 561 HA VAL 70 HA VAL 70 15.017 -17.209 0.328 562 HB VAL 70 HB VAL 70 16.246 -14.456 0.359 563 HG11 VAL 70 HG11 VAL 70 13.855 -15.019 1.044 564 HG12 VAL 70 HG12 VAL 70 14.810 -14.091 2.213 565 HG13 VAL 70 HG13 VAL 70 14.549 -15.822 2.447 566 HG21 VAL 70 HG21 VAL 70 18.032 -15.711 1.321 567 HG22 VAL 70 HG22 VAL 70 16.930 -16.854 2.079 568 HG23 VAL 70 HG23 VAL 70 17.075 -15.212 2.715 569 H ARG 71 HN ARG 71 14.020 -17.618 -1.644 570 HA ARG 71 HA ARG 71 13.987 -15.760 -3.836 571 HB2 ARG 71 HB2 ARG 71 12.209 -18.115 -3.179 572 HB3 ARG 71 HB1 ARG 71 12.231 -17.255 -4.723 573 HG2 ARG 71 HG2 ARG 71 14.612 -17.847 -5.030 574 HG3 ARG 71 HG1 ARG 71 14.606 -18.698 -3.491 575 HD2 ARG 71 HD2 ARG 71 12.779 -20.217 -4.397 576 HD3 ARG 71 HD1 ARG 71 12.954 -19.407 -5.929 577 HE ARG 71 HE ARG 71 14.970 -20.518 -6.288 578 HH11 ARG 71 HH21 ARG 71 13.878 -20.839 -3.002 579 HH12 ARG 71 HH22 ARG 71 14.923 -22.116 -2.596 580 HH21 ARG 71 HH11 ARG 71 16.387 -22.257 -5.770 581 HH22 ARG 71 HH12 ARG 71 16.368 -22.966 -4.227 582 H GLN 72 HN GLN 72 11.775 -16.561 -1.232 583 HA GLN 72 HA GLN 72 10.410 -14.023 -1.400 584 HB2 GLN 72 HB2 GLN 72 8.164 -15.242 -1.928 585 HB3 GLN 72 HB1 GLN 72 9.249 -14.870 -3.262 586 HG2 GLN 72 HG2 GLN 72 10.178 -17.356 -2.590 587 HG3 GLN 72 HG1 GLN 72 8.510 -17.462 -2.039 588 HE21 GLN 72 HE21 GLN 72 10.037 -15.926 -4.935 589 HE22 GLN 72 HE22 GLN 72 8.998 -16.679 -6.028 590 H ASN 73 HN ASN 73 8.198 -14.374 -0.094 591 HA ASN 73 HA ASN 73 8.962 -15.097 2.525 592 HB2 ASN 73 HB2 ASN 73 6.847 -14.479 3.207 593 HB3 ASN 73 HB1 ASN 73 6.870 -13.662 1.645 594 HD21 ASN 73 HD21 ASN 73 5.354 -14.375 0.092 595 HD22 ASN 73 HD22 ASN 73 4.274 -15.657 0.328 596 H GLY 74 HN GLY 74 8.526 -16.941 3.753 597 HA2 GLY 74 HA2 GLY 74 7.691 -19.163 4.014 598 HA3 GLY 74 HA1 GLY 74 7.571 -19.336 2.275 599 H ASP 75 HN ASP 75 10.333 -17.847 2.291 600 HA ASP 75 HA ASP 75 11.889 -20.230 2.157 601 HB2 ASP 75 HB2 ASP 75 12.519 -17.328 1.817 602 HB3 ASP 75 HB1 ASP 75 13.827 -18.466 2.037 603 H SER 76 HN SER 76 13.483 -20.901 3.479 604 HA SER 76 HA SER 76 13.441 -19.749 6.206 605 HB2 SER 76 HB2 SER 76 13.820 -22.687 5.721 606 HB3 SER 76 HB1 SER 76 13.211 -21.863 7.140 607 HG SER 76 HG SER 76 11.476 -21.159 5.472 608 H ALA 77 HN ALA 77 15.409 -19.827 7.356 609 HA ALA 77 HA ALA 77 17.789 -20.663 5.812 610 HB1 ALA 77 HB1 ALA 77 18.938 -18.653 6.680 611 HB2 ALA 77 HB2 ALA 77 17.411 -18.114 7.378 612 HB3 ALA 77 HB3 ALA 77 17.577 -18.259 5.622 613 H TYR 78 HN TYR 78 19.746 -20.816 7.229 614 HA TYR 78 HA TYR 78 19.001 -21.631 9.971 615 HB2 TYR 78 HB2 TYR 78 20.037 -23.352 8.029 616 HB3 TYR 78 HB1 TYR 78 21.449 -22.849 8.941 617 HD1 TYR 78 HD1 TYR 78 21.056 -22.692 11.601 618 HD2 TYR 78 HD2 TYR 78 18.855 -25.196 8.883 619 HE1 TYR 78 HE1 TYR 78 20.416 -24.135 13.454 620 HE2 TYR 78 HE2 TYR 78 18.207 -26.655 10.770 621 HH TYR 78 HH TYR 78 19.647 -26.478 13.864 622 H LEU 79 HN LEU 79 19.995 -20.611 11.539 623 HA LEU 79 HA LEU 79 22.419 -19.063 10.907 624 HB2 LEU 79 HB2 LEU 79 20.627 -17.577 11.483 625 HB3 LEU 79 HB1 LEU 79 20.236 -18.535 12.913 626 HG LEU 79 HG LEU 79 22.535 -17.992 13.838 627 HD11 LEU 79 HD11 LEU 79 22.706 -16.576 11.219 628 HD12 LEU 79 HD12 LEU 79 23.940 -17.435 12.148 629 HD13 LEU 79 HD13 LEU 79 23.433 -15.813 12.639 630 HD21 LEU 79 HD21 LEU 79 21.945 -15.374 13.924 631 HD22 LEU 79 HD22 LEU 79 21.041 -16.566 14.843 632 HD23 LEU 79 HD23 LEU 79 20.402 -15.968 13.308 633 H TYR 80 HN TYR 80 24.178 -19.700 11.936 634 HA TYR 80 HA TYR 80 23.925 -21.539 14.235 635 HB2 TYR 80 HB2 TYR 80 24.847 -22.588 12.205 636 HB3 TYR 80 HB1 TYR 80 26.103 -21.358 12.139 637 HD1 TYR 80 HD1 TYR 80 24.718 -24.111 14.258 638 HD2 TYR 80 HD2 TYR 80 28.087 -21.593 13.385 639 HE1 TYR 80 HE1 TYR 80 26.131 -25.488 15.748 640 HE2 TYR 80 HE2 TYR 80 29.501 -22.956 14.866 641 HH TYR 80 HH TYR 80 28.230 -25.082 17.079 642 H LEU 81 HN LEU 81 24.710 -20.784 16.115 643 HA LEU 81 HA LEU 81 26.482 -18.428 16.039 644 HB2 LEU 81 HB2 LEU 81 24.548 -19.277 18.188 645 HB3 LEU 81 HB1 LEU 81 25.563 -17.841 18.240 646 HG LEU 81 HG LEU 81 23.477 -18.412 16.115 647 HD11 LEU 81 HD11 LEU 81 23.452 -16.496 18.470 648 HD12 LEU 81 HD12 LEU 81 22.402 -17.893 18.241 649 HD13 LEU 81 HD13 LEU 81 22.259 -16.502 17.172 650 HD21 LEU 81 HD21 LEU 81 25.385 -16.090 16.584 651 HD22 LEU 81 HD22 LEU 81 23.904 -15.910 15.647 652 HD23 LEU 81 HD23 LEU 81 25.136 -17.036 15.115 653 H LEU 82 HN LEU 82 28.078 -18.215 17.494 654 HA LEU 82 HA LEU 82 29.155 -20.751 18.555 655 HB2 LEU 82 HB2 LEU 82 30.626 -18.259 17.679 656 HB3 LEU 82 HB1 LEU 82 31.401 -19.661 18.407 657 HG LEU 82 HG LEU 82 29.730 -19.742 15.874 658 HD11 LEU 82 HD11 LEU 82 32.047 -18.550 15.833 659 HD12 LEU 82 HD12 LEU 82 31.706 -19.804 14.641 660 HD13 LEU 82 HD13 LEU 82 32.691 -20.182 16.045 661 HD21 LEU 82 HD21 LEU 82 31.200 -21.786 17.528 662 HD22 LEU 82 HD22 LEU 82 31.067 -21.996 15.782 663 HD23 LEU 82 HD23 LEU 82 29.604 -21.895 16.772 664 H SER 83 HN SER 83 30.777 -20.410 20.379 665 HA SER 83 HA SER 83 29.285 -19.343 22.586 666 HB2 SER 83 HB2 SER 83 31.530 -20.225 23.719 667 HB3 SER 83 HB1 SER 83 30.257 -21.309 23.206 668 HG SER 83 HG SER 83 32.118 -22.075 22.282 669 H ALA 84 HN ALA 84 31.483 -17.945 20.483 670 HA ALA 84 HA ALA 84 33.244 -16.498 22.035 671 HB1 ALA 84 HB1 ALA 84 33.770 -15.595 20.081 672 HB2 ALA 84 HB2 ALA 84 32.255 -14.721 20.026 673 HB3 ALA 84 HB3 ALA 84 32.364 -16.353 19.343 674 H ARG 85 HN ARG 85 30.031 -15.378 21.026 675 HA ARG 85 HA ARG 85 29.735 -14.086 23.598 676 HB2 ARG 85 HB2 ARG 85 30.674 -12.323 22.136 677 HB3 ARG 85 HB1 ARG 85 29.350 -12.552 21.004 678 HG2 ARG 85 HG2 ARG 85 28.604 -10.744 22.305 679 HG3 ARG 85 HG1 ARG 85 27.808 -12.096 23.089 680 HD2 ARG 85 HD2 ARG 85 28.818 -10.760 24.810 681 HD3 ARG 85 HD1 ARG 85 29.739 -12.248 24.684 682 HE ARG 85 HE ARG 85 30.719 -10.012 23.080 683 HH11 ARG 85 HH21 ARG 85 30.928 -11.820 26.064 684 HH12 ARG 85 HH22 ARG 85 32.486 -11.209 26.464 685 HH21 ARG 85 HH11 ARG 85 32.796 -9.213 23.635 686 HH22 ARG 85 HH12 ARG 85 33.543 -9.727 25.081 687 H ASN 86 HN ASN 86 27.680 -14.207 24.330 688 HA ASN 86 HA ASN 86 25.522 -14.876 22.431 689 HB2 ASN 86 HB2 ASN 86 26.306 -16.336 24.944 690 HB3 ASN 86 HB1 ASN 86 24.620 -16.273 24.471 691 HD21 ASN 86 HD21 ASN 86 26.877 -16.220 21.771 692 HD22 ASN 86 HD22 ASN 86 26.682 -17.833 21.338 693 H THR 87 HN THR 87 25.258 -12.575 22.558 694 HA THR 87 HA THR 87 24.708 -11.318 25.012 695 HB THR 87 HB THR 87 23.975 -9.467 23.356 696 HG1 THR 87 HG1 THR 87 24.103 -9.991 21.285 697 HG21 THR 87 HG21 THR 87 26.015 -8.854 23.999 698 HG22 THR 87 HG22 THR 87 26.674 -9.692 22.606 699 HG23 THR 87 HG23 THR 87 26.562 -10.511 24.167 700 H SER 88 HN SER 88 22.701 -9.957 25.236 701 HA SER 88 HA SER 88 20.377 -11.644 25.181 702 HB2 SER 88 HB2 SER 88 19.306 -9.557 26.173 703 HB3 SER 88 HB1 SER 88 20.584 -10.294 27.113 704 HG SER 88 HG SER 88 20.593 -7.929 25.526 705 H LEU 89 HN LEU 89 18.314 -10.865 24.281 706 HA LEU 89 HA LEU 89 18.509 -10.287 21.550 707 HB2 LEU 89 HB2 LEU 89 16.217 -10.305 23.500 708 HB3 LEU 89 HB1 LEU 89 15.985 -9.719 21.857 709 HG LEU 89 HG LEU 89 16.974 -11.874 21.005 710 HD11 LEU 89 HD11 LEU 89 16.756 -12.631 23.927 711 HD12 LEU 89 HD12 LEU 89 18.232 -12.597 22.948 712 HD13 LEU 89 HD13 LEU 89 16.978 -13.776 22.612 713 HD21 LEU 89 HD21 LEU 89 14.498 -11.991 22.754 714 HD22 LEU 89 HD22 LEU 89 14.948 -13.235 21.584 715 HD23 LEU 89 HD23 LEU 89 14.567 -11.596 21.031 716 H ASN 90 HN ASN 90 17.869 -8.296 24.336 717 HA ASN 90 HA ASN 90 18.082 -5.869 22.654 718 HB2 ASN 90 HB2 ASN 90 17.033 -4.682 24.581 719 HB3 ASN 90 HB1 ASN 90 15.969 -5.826 23.772 720 HD21 ASN 90 HD21 ASN 90 18.529 -6.952 25.951 721 HD22 ASN 90 HD22 ASN 90 17.490 -7.458 27.198 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 8.451 1.474 -0.618 2 H2 MET 1 HT2 MET 1 8.413 -0.212 -0.463 3 H3 MET 1 HT3 MET 1 7.731 0.746 0.731 4 HA MET 1 HA MET 1 5.960 -0.116 -0.425 5 HB2 MET 1 HB2 MET 1 6.595 2.738 -1.189 6 HB3 MET 1 HB1 MET 1 5.143 1.966 -1.839 7 HG2 MET 1 HG2 MET 1 4.720 3.208 0.238 8 HG3 MET 1 HG1 MET 1 4.388 1.492 0.450 9 HE1 MET 1 HE1 MET 1 4.711 1.661 3.279 10 HE2 MET 1 HE2 MET 1 6.123 0.633 3.453 11 HE3 MET 1 HE3 MET 1 4.970 0.294 2.178 12 HA PRO 2 HA PRO 2 6.965 0.044 -5.289 13 HB2 PRO 2 HB2 PRO 2 9.885 0.603 -4.955 14 HB3 PRO 2 HB1 PRO 2 8.781 1.074 -6.258 15 HG2 PRO 2 HG2 PRO 2 9.518 2.870 -4.505 16 HG3 PRO 2 HG1 PRO 2 7.832 2.799 -5.043 17 HD2 PRO 2 HD2 PRO 2 8.993 1.943 -2.439 18 HD3 PRO 2 HD1 PRO 2 7.416 2.674 -2.848 19 H THR 3 HN THR 3 9.281 -0.811 -2.816 20 HA THR 3 HA THR 3 9.256 -3.619 -3.702 21 HB THR 3 HB THR 3 11.503 -2.228 -2.210 22 HG1 THR 3 HG1 THR 3 11.583 -1.438 -4.217 23 HG21 THR 3 HG21 THR 3 12.504 -4.510 -3.403 24 HG22 THR 3 HG22 THR 3 10.894 -5.026 -2.927 25 HG23 THR 3 HG23 THR 3 11.997 -4.373 -1.730 26 H GLN 4 HN GLN 4 8.441 -4.972 -2.137 27 HA GLN 4 HA GLN 4 8.037 -3.810 0.551 28 HB2 GLN 4 HB2 GLN 4 6.373 -5.863 -0.924 29 HB3 GLN 4 HB1 GLN 4 6.167 -5.427 0.771 30 HG2 GLN 4 HG2 GLN 4 5.788 -3.067 0.123 31 HG3 GLN 4 HG1 GLN 4 5.926 -3.517 -1.574 32 HE21 GLN 4 HE21 GLN 4 3.853 -3.588 -2.445 33 HE22 GLN 4 HE22 GLN 4 2.495 -4.258 -1.699 34 H ASP 5 HN ASP 5 8.220 -5.150 2.335 35 HA ASP 5 HA ASP 5 10.424 -6.972 2.206 36 HB2 ASP 5 HB2 ASP 5 8.581 -6.187 4.469 37 HB3 ASP 5 HB1 ASP 5 9.777 -7.479 4.551 38 H ILE 6 HN ILE 6 10.445 -9.099 2.713 39 HA ILE 6 HA ILE 6 7.917 -10.608 2.710 40 HB ILE 6 HB ILE 6 9.059 -12.395 1.481 41 HG12 ILE 6 HG12 ILE 6 11.381 -10.473 1.127 42 HG13 ILE 6 HG11 ILE 6 11.416 -11.775 2.330 43 HG21 ILE 6 HG21 ILE 6 8.875 -9.637 0.373 44 HG22 ILE 6 HG22 ILE 6 8.016 -11.100 -0.141 45 HG23 ILE 6 HG23 ILE 6 9.692 -10.830 -0.633 46 HD11 ILE 6 HD11 ILE 6 10.869 -12.244 -0.600 47 HD12 ILE 6 HD12 ILE 6 11.345 -13.426 0.631 48 HD13 ILE 6 HD13 ILE 6 12.499 -12.223 0.070 49 H ARG 7 HN ARG 7 8.218 -12.665 3.953 50 HA ARG 7 HA ARG 7 10.113 -12.114 6.132 51 HB2 ARG 7 HB2 ARG 7 7.733 -13.972 6.220 52 HB3 ARG 7 HB1 ARG 7 8.788 -13.542 7.568 53 HG2 ARG 7 HG2 ARG 7 8.207 -11.080 7.038 54 HG3 ARG 7 HG1 ARG 7 6.921 -11.772 6.036 55 HD2 ARG 7 HD2 ARG 7 7.274 -12.337 9.000 56 HD3 ARG 7 HD1 ARG 7 6.163 -11.156 8.337 57 HE ARG 7 HE ARG 7 5.548 -13.558 7.074 58 HH11 ARG 7 HH21 ARG 7 5.714 -12.269 10.312 59 HH12 ARG 7 HH22 ARG 7 4.487 -13.274 10.933 60 HH21 ARG 7 HH11 ARG 7 3.864 -14.937 7.930 61 HH22 ARG 7 HH12 ARG 7 3.453 -14.804 9.580 62 H LEU 8 HN LEU 8 11.748 -13.250 6.587 63 HA LEU 8 HA LEU 8 12.177 -15.819 5.202 64 HB2 LEU 8 HB2 LEU 8 13.783 -14.162 4.470 65 HB3 LEU 8 HB1 LEU 8 14.118 -13.694 6.133 66 HG LEU 8 HG LEU 8 14.989 -16.013 6.573 67 HD11 LEU 8 HD11 LEU 8 13.850 -16.506 3.958 68 HD12 LEU 8 HD12 LEU 8 14.481 -17.610 5.170 69 HD13 LEU 8 HD13 LEU 8 15.572 -16.923 3.982 70 HD21 LEU 8 HD21 LEU 8 17.088 -15.734 5.240 71 HD22 LEU 8 HD22 LEU 8 16.585 -14.252 6.038 72 HD23 LEU 8 HD23 LEU 8 16.302 -14.459 4.309 73 H TRP 9 HN TRP 9 12.423 -17.565 6.454 74 HA TRP 9 HA TRP 9 12.473 -17.217 9.380 75 HB2 TRP 9 HB2 TRP 9 12.435 -19.826 7.863 76 HB3 TRP 9 HB1 TRP 9 11.985 -19.523 9.530 77 HD1 TRP 9 HD1 TRP 9 10.168 -16.937 8.950 78 HE1 TRP 9 HE1 TRP 9 7.831 -17.319 7.882 79 HE3 TRP 9 HE3 TRP 9 10.886 -21.504 6.871 80 HZ2 TRP 9 HZ2 TRP 9 6.475 -19.304 6.363 81 HZ3 TRP 9 HZ3 TRP 9 9.109 -22.627 5.619 82 HH2 TRP 9 HH2 TRP 9 6.863 -21.516 5.353 83 H VAL 10 HN VAL 10 14.321 -17.471 10.492 84 HA VAL 10 HA VAL 10 16.538 -18.829 9.097 85 HB VAL 10 HB VAL 10 16.783 -16.553 11.070 86 HG11 VAL 10 HG11 VAL 10 19.189 -16.627 10.231 87 HG12 VAL 10 HG12 VAL 10 18.818 -18.210 9.565 88 HG13 VAL 10 HG13 VAL 10 18.703 -17.935 11.301 89 HG21 VAL 10 HG21 VAL 10 16.353 -15.270 9.250 90 HG22 VAL 10 HG22 VAL 10 16.467 -16.637 8.145 91 HG23 VAL 10 HG23 VAL 10 17.924 -15.792 8.650 92 H SER 11 HN SER 11 17.253 -20.536 10.025 93 HA SER 11 HA SER 11 16.230 -21.367 12.626 94 HB2 SER 11 HB2 SER 11 18.337 -22.854 11.121 95 HB3 SER 11 HB1 SER 11 16.981 -23.462 12.047 96 HG SER 11 HG SER 11 16.930 -22.192 9.474 97 H VAL 12 HN VAL 12 17.394 -21.055 14.475 98 HA VAL 12 HA VAL 12 20.232 -20.277 14.151 99 HB VAL 12 HB VAL 12 18.175 -19.322 16.145 100 HG11 VAL 12 HG11 VAL 12 20.307 -19.651 17.331 101 HG12 VAL 12 HG12 VAL 12 20.013 -17.940 17.104 102 HG13 VAL 12 HG13 VAL 12 21.166 -18.767 16.074 103 HG21 VAL 12 HG21 VAL 12 18.588 -17.137 15.166 104 HG22 VAL 12 HG22 VAL 12 18.204 -18.258 13.864 105 HG23 VAL 12 HG23 VAL 12 19.875 -17.783 14.152 106 H GLU 13 HN GLU 13 21.638 -21.590 15.148 107 HA GLU 13 HA GLU 13 20.589 -23.300 17.315 108 HB2 GLU 13 HB2 GLU 13 22.905 -23.855 15.451 109 HB3 GLU 13 HB1 GLU 13 22.502 -24.822 16.865 110 HG2 GLU 13 HG2 GLU 13 20.066 -24.764 15.685 111 HG3 GLU 13 HG1 GLU 13 21.077 -24.612 14.260 112 H ASP 14 HN ASP 14 21.073 -22.580 19.179 113 HA ASP 14 HA ASP 14 23.214 -20.699 19.623 114 HB2 ASP 14 HB2 ASP 14 20.995 -20.725 20.846 115 HB3 ASP 14 HB1 ASP 14 21.612 -22.112 21.751 116 H ALA 15 HN ALA 15 24.992 -20.994 20.723 117 HA ALA 15 HA ALA 15 26.430 -23.432 20.594 118 HB1 ALA 15 HB1 ALA 15 28.042 -21.968 21.040 119 HB2 ALA 15 HB2 ALA 15 27.511 -21.985 22.729 120 HB3 ALA 15 HB3 ALA 15 26.877 -20.775 21.613 121 H GLN 16 HN GLN 16 24.115 -22.193 22.749 122 HA GLN 16 HA GLN 16 24.648 -23.856 25.037 123 HB2 GLN 16 HB2 GLN 16 22.010 -22.647 24.144 124 HB3 GLN 16 HB1 GLN 16 22.401 -23.243 25.748 125 HG2 GLN 16 HG2 GLN 16 23.804 -20.925 24.371 126 HG3 GLN 16 HG1 GLN 16 22.609 -20.768 25.644 127 HE21 GLN 16 HE21 GLN 16 25.807 -20.503 25.280 128 HE22 GLN 16 HE22 GLN 16 26.347 -21.105 26.768 129 H MET 17 HN MET 17 23.952 -24.641 21.945 130 HA MET 17 HA MET 17 23.358 -26.518 20.900 131 HB2 MET 17 HB2 MET 17 22.999 -27.703 23.683 132 HB3 MET 17 HB1 MET 17 22.934 -28.598 22.179 133 HG2 MET 17 HG2 MET 17 25.320 -27.021 23.177 134 HG3 MET 17 HG1 MET 17 25.188 -28.777 23.153 135 HE1 MET 17 HE1 MET 17 23.680 -29.261 20.211 136 HE2 MET 17 HE2 MET 17 24.772 -30.145 21.258 137 HE3 MET 17 HE3 MET 17 25.236 -29.839 19.586 138 H HIS 18 HN HIS 18 21.636 -24.416 21.383 139 HA HIS 18 HA HIS 18 18.988 -25.742 21.576 140 HB2 HIS 18 HB2 HIS 18 19.688 -22.818 21.984 141 HB3 HIS 18 HB1 HIS 18 18.072 -23.495 22.030 142 HD1 HIS 18 HD1 HIS 18 18.839 -22.177 24.585 143 HD2 HIS 18 HD2 HIS 18 19.868 -26.155 23.816 144 HE1 HIS 18 HE1 HIS 18 19.299 -23.254 26.824 145 HE2 HIS 18 HE2 HIS 18 19.944 -25.669 26.380 146 H THR 19 HN THR 19 17.959 -25.945 19.669 147 HA THR 19 HA THR 19 18.831 -24.315 17.391 148 HB THR 19 HB THR 19 16.899 -26.645 17.379 149 HG1 THR 19 HG1 THR 19 19.758 -26.734 16.946 150 HG21 THR 19 HG21 THR 19 16.746 -26.148 15.214 151 HG22 THR 19 HG22 THR 19 18.462 -26.458 15.009 152 HG23 THR 19 HG23 THR 19 17.898 -24.832 15.369 153 H VAL 20 HN VAL 20 17.653 -22.596 16.840 154 HA VAL 20 HA VAL 20 14.875 -22.392 17.806 155 HB VAL 20 HB VAL 20 16.832 -20.107 17.663 156 HG11 VAL 20 HG11 VAL 20 14.189 -20.549 19.086 157 HG12 VAL 20 HG12 VAL 20 14.549 -19.363 17.823 158 HG13 VAL 20 HG13 VAL 20 15.263 -19.196 19.415 159 HG21 VAL 20 HG21 VAL 20 17.830 -21.717 19.197 160 HG22 VAL 20 HG22 VAL 20 16.274 -21.983 19.987 161 HG23 VAL 20 HG23 VAL 20 17.087 -20.430 20.145 162 H THR 21 HN THR 21 13.601 -20.792 16.650 163 HA THR 21 HA THR 21 14.445 -20.392 13.832 164 HB THR 21 HB THR 21 11.617 -20.650 14.908 165 HG1 THR 21 HG1 THR 21 12.278 -22.642 14.950 166 HG21 THR 21 HG21 THR 21 11.791 -19.248 12.882 167 HG22 THR 21 HG22 THR 21 10.999 -20.759 12.523 168 HG23 THR 21 HG23 THR 21 12.687 -20.529 12.066 169 H ILE 22 HN ILE 22 14.589 -18.281 13.229 170 HA ILE 22 HA ILE 22 13.119 -16.313 14.867 171 HB ILE 22 HB ILE 22 14.915 -14.709 14.566 172 HG12 ILE 22 HG12 ILE 22 16.482 -16.968 13.258 173 HG13 ILE 22 HG11 ILE 22 15.713 -15.620 12.392 174 HG21 ILE 22 HG21 ILE 22 16.583 -15.712 16.032 175 HG22 ILE 22 HG22 ILE 22 16.040 -17.331 15.604 176 HG23 ILE 22 HG23 ILE 22 14.981 -16.258 16.528 177 HD11 ILE 22 HD11 ILE 22 18.203 -15.342 12.946 178 HD12 ILE 22 HD12 ILE 22 17.697 -15.153 14.623 179 HD13 ILE 22 HD13 ILE 22 17.132 -14.019 13.399 180 H TRP 23 HN TRP 23 12.418 -14.477 13.760 181 HA TRP 23 HA TRP 23 11.863 -15.060 10.924 182 HB2 TRP 23 HB2 TRP 23 10.300 -13.297 12.797 183 HB3 TRP 23 HB1 TRP 23 9.769 -13.947 11.247 184 HD1 TRP 23 HD1 TRP 23 10.542 -15.039 14.859 185 HE1 TRP 23 HE1 TRP 23 9.384 -17.284 15.318 186 HE3 TRP 23 HE3 TRP 23 8.738 -16.078 10.208 187 HZ2 TRP 23 HZ2 TRP 23 7.897 -19.255 13.922 188 HZ3 TRP 23 HZ3 TRP 23 7.435 -18.169 9.804 189 HH2 TRP 23 HH2 TRP 23 7.015 -19.743 11.659 190 H LEU 24 HN LEU 24 12.561 -13.678 9.431 191 HA LEU 24 HA LEU 24 13.329 -10.923 10.232 192 HB2 LEU 24 HB2 LEU 24 14.573 -12.649 8.081 193 HB3 LEU 24 HB1 LEU 24 15.028 -10.989 8.451 194 HG LEU 24 HG LEU 24 15.237 -13.330 10.392 195 HD11 LEU 24 HD11 LEU 24 16.860 -13.151 8.339 196 HD12 LEU 24 HD12 LEU 24 17.519 -13.427 9.948 197 HD13 LEU 24 HD13 LEU 24 17.569 -11.816 9.248 198 HD21 LEU 24 HD21 LEU 24 15.681 -10.366 10.623 199 HD22 LEU 24 HD22 LEU 24 16.809 -11.436 11.438 200 HD23 LEU 24 HD23 LEU 24 15.088 -11.519 11.823 201 H THR 25 HN THR 25 12.459 -9.282 9.001 202 HA THR 25 HA THR 25 10.897 -10.102 6.628 203 HB THR 25 HB THR 25 10.499 -7.396 7.809 204 HG1 THR 25 HG1 THR 25 10.115 -9.736 9.239 205 HG21 THR 25 HG21 THR 25 9.273 -8.946 5.840 206 HG22 THR 25 HG22 THR 25 8.654 -7.464 6.537 207 HG23 THR 25 HG23 THR 25 8.145 -9.008 7.187 208 H VAL 26 HN VAL 26 11.837 -9.576 4.752 209 HA VAL 26 HA VAL 26 13.338 -7.085 4.425 210 HB VAL 26 HB VAL 26 15.304 -8.384 3.500 211 HG11 VAL 26 HG11 VAL 26 16.357 -8.547 5.586 212 HG12 VAL 26 HG12 VAL 26 14.854 -8.941 6.424 213 HG13 VAL 26 HG13 VAL 26 15.134 -7.307 5.832 214 HG21 VAL 26 HG21 VAL 26 15.511 -10.711 4.551 215 HG22 VAL 26 HG22 VAL 26 14.398 -10.575 3.195 216 HG23 VAL 26 HG23 VAL 26 13.774 -10.641 4.840 217 H ARG 27 HN ARG 27 14.466 -7.448 2.055 218 HA ARG 27 HA ARG 27 12.333 -8.525 0.341 219 HB2 ARG 27 HB2 ARG 27 13.609 -6.963 -1.430 220 HB3 ARG 27 HB1 ARG 27 12.290 -6.355 -0.448 221 HG2 ARG 27 HG2 ARG 27 15.126 -6.218 0.557 222 HG3 ARG 27 HG1 ARG 27 14.522 -5.000 -0.558 223 HD2 ARG 27 HD2 ARG 27 12.460 -5.037 1.208 224 HD3 ARG 27 HD1 ARG 27 13.781 -5.504 2.269 225 HE ARG 27 HE ARG 27 14.386 -3.176 0.655 226 HH11 ARG 27 HH21 ARG 27 12.745 -4.331 3.534 227 HH12 ARG 27 HH22 ARG 27 12.997 -2.877 4.404 228 HH21 ARG 27 HH11 ARG 27 14.661 -1.197 1.849 229 HH22 ARG 27 HH12 ARG 27 14.080 -1.104 3.455 230 HA PRO 28 HA PRO 28 15.163 -11.566 -1.172 231 HB2 PRO 28 HB2 PRO 28 14.415 -10.681 -3.922 232 HB3 PRO 28 HB1 PRO 28 14.352 -12.296 -3.187 233 HG2 PRO 28 HG2 PRO 28 12.152 -10.943 -3.587 234 HG3 PRO 28 HG1 PRO 28 12.365 -11.892 -2.109 235 HD2 PRO 28 HD2 PRO 28 12.501 -8.919 -2.447 236 HD3 PRO 28 HD1 PRO 28 11.895 -9.885 -1.081 237 H ASP 29 HN ASP 29 15.178 -8.346 -2.384 238 HA ASP 29 HA ASP 29 17.611 -8.392 -3.868 239 HB2 ASP 29 HB2 ASP 29 15.924 -6.698 -4.316 240 HB3 ASP 29 HB1 ASP 29 16.162 -6.016 -2.699 241 H MET 30 HN MET 30 16.898 -8.053 -0.514 242 HA MET 30 HA MET 30 19.185 -6.614 0.263 243 HB2 MET 30 HB2 MET 30 17.349 -8.469 1.704 244 HB3 MET 30 HB1 MET 30 18.884 -8.054 2.450 245 HG2 MET 30 HG2 MET 30 18.391 -5.665 2.224 246 HG3 MET 30 HG1 MET 30 16.854 -6.019 1.457 247 HE1 MET 30 HE1 MET 30 18.494 -8.022 4.755 248 HE2 MET 30 HE2 MET 30 18.266 -6.570 5.720 249 HE3 MET 30 HE3 MET 30 19.158 -6.468 4.228 250 H THR 31 HN THR 31 21.063 -7.189 1.162 251 HA THR 31 HA THR 31 22.242 -9.585 0.018 252 HB THR 31 HB THR 31 23.155 -6.871 0.775 253 HG1 THR 31 HG1 THR 31 24.193 -8.752 -1.083 254 HG21 THR 31 HG21 THR 31 24.436 -8.111 2.359 255 HG22 THR 31 HG22 THR 31 25.514 -7.647 1.040 256 HG23 THR 31 HG23 THR 31 24.847 -9.301 1.126 257 H VAL 32 HN VAL 32 23.516 -10.983 1.362 258 HA VAL 32 HA VAL 32 22.223 -11.694 3.754 259 HB VAL 32 HB VAL 32 24.999 -12.419 2.750 260 HG11 VAL 32 HG11 VAL 32 25.038 -12.903 5.070 261 HG12 VAL 32 HG12 VAL 32 24.633 -14.425 4.288 262 HG13 VAL 32 HG13 VAL 32 23.368 -13.479 5.071 263 HG21 VAL 32 HG21 VAL 32 23.983 -14.364 1.838 264 HG22 VAL 32 HG22 VAL 32 22.887 -13.061 1.389 265 HG23 VAL 32 HG23 VAL 32 22.493 -14.120 2.739 266 H ALA 33 HN ALA 33 25.228 -9.890 3.234 267 HA ALA 33 HA ALA 33 25.972 -9.458 5.900 268 HB1 ALA 33 HB1 ALA 33 27.402 -7.881 5.091 269 HB2 ALA 33 HB2 ALA 33 26.203 -7.131 4.065 270 HB3 ALA 33 HB3 ALA 33 27.006 -8.602 3.541 271 H SER 34 HN SER 34 23.586 -7.826 3.869 272 HA SER 34 HA SER 34 22.903 -5.747 5.602 273 HB2 SER 34 HB2 SER 34 20.953 -7.116 3.761 274 HB3 SER 34 HB1 SER 34 21.070 -5.417 4.178 275 HG SER 34 HG SER 34 22.814 -5.212 2.883 276 H LEU 35 HN LEU 35 21.762 -9.098 5.363 277 HA LEU 35 HA LEU 35 19.642 -8.919 7.253 278 HB2 LEU 35 HB2 LEU 35 21.333 -11.168 6.258 279 HB3 LEU 35 HB1 LEU 35 20.220 -11.440 7.587 280 HG LEU 35 HG LEU 35 19.479 -10.342 4.865 281 HD11 LEU 35 HD11 LEU 35 18.318 -12.586 4.713 282 HD12 LEU 35 HD12 LEU 35 19.149 -13.039 6.206 283 HD13 LEU 35 HD13 LEU 35 20.087 -12.705 4.753 284 HD21 LEU 35 HD21 LEU 35 17.156 -11.053 5.930 285 HD22 LEU 35 HD22 LEU 35 17.896 -9.489 6.311 286 HD23 LEU 35 HD23 LEU 35 18.040 -10.821 7.448 287 H LYS 36 HN LYS 36 23.030 -9.726 7.580 288 HA LYS 36 HA LYS 36 22.952 -10.506 10.258 289 HB2 LYS 36 HB2 LYS 36 25.091 -9.417 8.500 290 HB3 LYS 36 HB1 LYS 36 25.437 -9.754 10.201 291 HG2 LYS 36 HG2 LYS 36 25.808 -11.905 9.596 292 HG3 LYS 36 HG1 LYS 36 24.078 -12.059 9.339 293 HD2 LYS 36 HD2 LYS 36 24.531 -12.505 7.185 294 HD3 LYS 36 HD1 LYS 36 24.981 -10.820 6.988 295 HE2 LYS 36 HE2 LYS 36 26.893 -13.012 7.870 296 HE3 LYS 36 HE1 LYS 36 26.763 -12.385 6.234 297 HZ1 LYS 36 HZ1 LYS 36 28.364 -11.045 6.967 298 HZ2 LYS 36 HZ2 LYS 36 27.911 -11.134 8.600 299 HZ3 LYS 36 HZ3 LYS 36 27.111 -10.083 7.566 300 H ASP 37 HN ASP 37 23.355 -7.328 8.829 301 HA ASP 37 HA ASP 37 23.868 -5.964 11.255 302 HB2 ASP 37 HB2 ASP 37 24.122 -4.996 8.918 303 HB3 ASP 37 HB1 ASP 37 22.372 -4.838 8.891 304 H MET 38 HN MET 38 20.776 -6.560 9.533 305 HA MET 38 HA MET 38 19.164 -5.320 11.500 306 HB2 MET 38 HB2 MET 38 17.940 -7.707 10.349 307 HB3 MET 38 HB1 MET 38 17.410 -6.045 10.407 308 HG2 MET 38 HG2 MET 38 18.917 -5.462 8.538 309 HG3 MET 38 HG1 MET 38 19.418 -7.149 8.449 310 HE1 MET 38 HE1 MET 38 17.748 -9.008 8.738 311 HE2 MET 38 HE2 MET 38 16.309 -9.179 7.748 312 HE3 MET 38 HE3 MET 38 16.188 -8.401 9.305 313 H VAL 39 HN VAL 39 20.324 -8.575 11.079 314 HA VAL 39 HA VAL 39 18.936 -9.755 13.190 315 HB VAL 39 HB VAL 39 21.722 -10.399 12.171 316 HG11 VAL 39 HG11 VAL 39 20.499 -11.395 14.516 317 HG12 VAL 39 HG12 VAL 39 21.882 -12.069 13.669 318 HG13 VAL 39 HG13 VAL 39 20.273 -12.648 13.300 319 HG21 VAL 39 HG21 VAL 39 19.176 -10.686 10.951 320 HG22 VAL 39 HG22 VAL 39 19.621 -12.298 11.494 321 HG23 VAL 39 HG23 VAL 39 20.695 -11.400 10.429 322 H PHE 40 HN PHE 40 21.970 -7.946 13.125 323 HA PHE 40 HA PHE 40 22.469 -8.138 15.917 324 HB2 PHE 40 HB2 PHE 40 24.261 -7.422 14.429 325 HB3 PHE 40 HB1 PHE 40 23.303 -6.023 13.934 326 HD1 PHE 40 HD2 PHE 40 24.517 -7.691 17.074 327 HD2 PHE 40 HD1 PHE 40 23.628 -4.001 15.048 328 HE1 PHE 40 HE2 PHE 40 25.315 -6.415 19.037 329 HE2 PHE 40 HE1 PHE 40 24.415 -2.740 17.007 330 HZ PHE 40 HZ PHE 40 25.261 -3.946 19.010 331 H LEU 41 HN LEU 41 20.801 -5.791 13.849 332 HA LEU 41 HA LEU 41 20.152 -3.897 15.847 333 HB2 LEU 41 HB2 LEU 41 18.509 -4.674 13.416 334 HB3 LEU 41 HB1 LEU 41 18.333 -3.206 14.351 335 HG LEU 41 HG LEU 41 20.806 -4.045 12.884 336 HD11 LEU 41 HD11 LEU 41 18.925 -1.770 12.199 337 HD12 LEU 41 HD12 LEU 41 18.883 -3.353 11.414 338 HD13 LEU 41 HD13 LEU 41 20.308 -2.334 11.274 339 HD21 LEU 41 HD21 LEU 41 20.150 -1.673 14.615 340 HD22 LEU 41 HD22 LEU 41 21.390 -1.559 13.344 341 HD23 LEU 41 HD23 LEU 41 21.548 -2.751 14.637 342 H ASP 42 HN ASP 42 18.490 -6.618 14.583 343 HA ASP 42 HA ASP 42 16.156 -6.324 16.256 344 HB2 ASP 42 HB2 ASP 42 16.288 -7.450 13.914 345 HB3 ASP 42 HB1 ASP 42 16.812 -8.868 14.797 346 H TYR 43 HN TYR 43 18.822 -8.690 16.230 347 HA TYR 43 HA TYR 43 17.826 -9.699 18.832 348 HB2 TYR 43 HB2 TYR 43 19.676 -11.061 16.873 349 HB3 TYR 43 HB1 TYR 43 18.957 -11.743 18.322 350 HD1 TYR 43 HD2 TYR 43 16.431 -11.918 18.496 351 HD2 TYR 43 HD1 TYR 43 18.450 -10.998 14.826 352 HE1 TYR 43 HE2 TYR 43 14.404 -12.546 17.214 353 HE2 TYR 43 HE1 TYR 43 16.460 -11.616 13.553 354 HH TYR 43 HH TYR 43 13.891 -11.687 14.112 355 H GLY 44 HN GLY 44 20.288 -7.693 17.689 356 HA2 GLY 44 HA2 GLY 44 22.240 -6.948 18.697 357 HA3 GLY 44 HA1 GLY 44 21.713 -7.782 20.152 358 H PHE 45 HN PHE 45 21.871 -9.574 17.225 359 HA PHE 45 HA PHE 45 23.644 -11.453 18.374 360 HB2 PHE 45 HB2 PHE 45 22.254 -11.209 15.746 361 HB3 PHE 45 HB1 PHE 45 23.628 -12.304 15.847 362 HD1 PHE 45 HD1 PHE 45 21.600 -11.680 18.880 363 HD2 PHE 45 HD2 PHE 45 22.142 -14.281 15.481 364 HE1 PHE 45 HE1 PHE 45 20.195 -13.381 19.952 365 HE2 PHE 45 HE2 PHE 45 20.713 -15.983 16.580 366 HZ PHE 45 HZ PHE 45 19.743 -15.533 18.813 367 HA PRO 46 HA PRO 46 27.427 -9.325 17.372 368 HB2 PRO 46 HB2 PRO 46 29.113 -11.454 17.873 369 HB3 PRO 46 HB1 PRO 46 28.427 -10.368 19.105 370 HG2 PRO 46 HG2 PRO 46 27.495 -13.071 18.274 371 HG3 PRO 46 HG1 PRO 46 27.613 -12.385 19.905 372 HD2 PRO 46 HD2 PRO 46 25.289 -12.568 18.638 373 HD3 PRO 46 HD1 PRO 46 25.638 -11.160 19.677 374 HA PRO 47 HA PRO 47 27.799 -10.484 13.041 375 HB2 PRO 47 HB2 PRO 47 30.198 -9.283 12.502 376 HB3 PRO 47 HB1 PRO 47 28.660 -8.410 12.608 377 HG2 PRO 47 HG2 PRO 47 30.797 -8.692 14.670 378 HG3 PRO 47 HG1 PRO 47 29.854 -7.267 14.222 379 HD2 PRO 47 HD2 PRO 47 29.224 -8.623 16.421 380 HD3 PRO 47 HD1 PRO 47 27.934 -7.962 15.401 381 H VAL 48 HN VAL 48 30.544 -10.951 15.183 382 HA VAL 48 HA VAL 48 32.009 -12.697 13.545 383 HB VAL 48 HB VAL 48 33.166 -11.715 15.354 384 HG11 VAL 48 HG11 VAL 48 32.170 -11.286 17.302 385 HG12 VAL 48 HG12 VAL 48 32.005 -12.992 17.673 386 HG13 VAL 48 HG13 VAL 48 30.735 -12.150 16.777 387 HG21 VAL 48 HG21 VAL 48 33.693 -14.168 14.831 388 HG22 VAL 48 HG22 VAL 48 32.719 -14.584 16.242 389 HG23 VAL 48 HG23 VAL 48 34.179 -13.622 16.436 390 H LEU 49 HN LEU 49 29.244 -13.286 15.538 391 HA LEU 49 HA LEU 49 29.597 -16.173 15.496 392 HB2 LEU 49 HB2 LEU 49 27.499 -14.338 16.598 393 HB3 LEU 49 HB1 LEU 49 27.276 -16.078 16.529 394 HG LEU 49 HG LEU 49 29.534 -16.332 17.731 395 HD11 LEU 49 HD11 LEU 49 30.762 -14.542 17.807 396 HD12 LEU 49 HD12 LEU 49 29.742 -14.016 19.150 397 HD13 LEU 49 HD13 LEU 49 29.417 -13.442 17.513 398 HD21 LEU 49 HD21 LEU 49 27.335 -16.574 18.903 399 HD22 LEU 49 HD22 LEU 49 27.361 -14.848 19.267 400 HD23 LEU 49 HD23 LEU 49 28.590 -15.908 19.929 401 H GLN 50 HN GLN 50 28.617 -14.011 13.290 402 HA GLN 50 HA GLN 50 26.207 -14.978 12.293 403 HB2 GLN 50 HB2 GLN 50 26.706 -13.793 10.230 404 HB3 GLN 50 HB1 GLN 50 27.243 -12.823 11.603 405 HG2 GLN 50 HG2 GLN 50 29.560 -14.051 11.193 406 HG3 GLN 50 HG1 GLN 50 28.886 -14.365 9.605 407 HE21 GLN 50 HE21 GLN 50 31.163 -12.613 10.038 408 HE22 GLN 50 HE22 GLN 50 30.680 -11.059 9.577 409 H GLN 51 HN GLN 51 27.397 -17.356 12.838 410 HA GLN 51 HA GLN 51 28.532 -18.530 10.446 411 HB2 GLN 51 HB2 GLN 51 27.508 -19.817 13.004 412 HB3 GLN 51 HB1 GLN 51 28.213 -20.702 11.662 413 HG2 GLN 51 HG2 GLN 51 29.638 -18.461 13.118 414 HG3 GLN 51 HG1 GLN 51 29.848 -20.162 13.500 415 HE21 GLN 51 HE21 GLN 51 31.397 -17.799 11.855 416 HE22 GLN 51 HE22 GLN 51 32.097 -18.701 10.612 417 H TRP 52 HN TRP 52 26.778 -17.584 9.162 418 HA TRP 52 HA TRP 52 24.157 -18.846 9.168 419 HB2 TRP 52 HB2 TRP 52 25.613 -17.016 7.254 420 HB3 TRP 52 HB1 TRP 52 24.087 -17.764 6.816 421 HD1 TRP 52 HD1 TRP 52 25.484 -15.682 9.770 422 HE1 TRP 52 HE1 TRP 52 23.637 -14.052 10.532 423 HE3 TRP 52 HE3 TRP 52 21.728 -17.056 6.598 424 HZ2 TRP 52 HZ2 TRP 52 20.904 -13.404 9.860 425 HZ3 TRP 52 HZ3 TRP 52 19.533 -15.916 6.681 426 HH2 TRP 52 HH2 TRP 52 19.132 -14.093 8.310 427 H VAL 53 HN VAL 53 23.523 -20.603 7.962 428 HA VAL 53 HA VAL 53 25.559 -21.758 6.158 429 HB VAL 53 HB VAL 53 23.592 -23.474 7.652 430 HG11 VAL 53 HG11 VAL 53 24.839 -24.486 5.814 431 HG12 VAL 53 HG12 VAL 53 25.400 -25.136 7.348 432 HG13 VAL 53 HG13 VAL 53 26.364 -23.926 6.507 433 HG21 VAL 53 HG21 VAL 53 26.208 -22.332 8.674 434 HG22 VAL 53 HG22 VAL 53 25.545 -23.845 9.291 435 HG23 VAL 53 HG23 VAL 53 24.642 -22.348 9.484 436 H ILE 54 HN ILE 54 24.873 -21.879 4.142 437 HA ILE 54 HA ILE 54 21.991 -22.180 3.611 438 HB ILE 54 HB ILE 54 23.959 -20.480 2.045 439 HG12 ILE 54 HG12 ILE 54 23.370 -19.452 4.243 440 HG13 ILE 54 HG11 ILE 54 22.692 -18.549 2.895 441 HG21 ILE 54 HG21 ILE 54 20.984 -20.946 1.797 442 HG22 ILE 54 HG22 ILE 54 22.206 -21.379 0.602 443 HG23 ILE 54 HG23 ILE 54 21.847 -19.679 0.938 444 HD11 ILE 54 HD11 ILE 54 21.314 -19.983 5.050 445 HD12 ILE 54 HD12 ILE 54 20.678 -20.380 3.453 446 HD13 ILE 54 HD13 ILE 54 20.732 -18.711 3.986 447 H GLY 55 HN GLY 55 21.632 -24.014 2.505 448 HA2 GLY 55 HA2 GLY 55 23.747 -25.662 1.658 449 HA3 GLY 55 HA1 GLY 55 22.046 -25.931 1.293 450 H GLN 56 HN GLN 56 21.557 -23.540 -0.085 451 HA GLN 56 HA GLN 56 22.183 -24.329 -2.709 452 HB2 GLN 56 HB2 GLN 56 21.260 -21.595 -1.808 453 HB3 GLN 56 HB1 GLN 56 21.086 -22.311 -3.403 454 HG2 GLN 56 HG2 GLN 56 19.082 -23.028 -2.698 455 HG3 GLN 56 HG1 GLN 56 19.953 -24.256 -1.788 456 HE21 GLN 56 HE21 GLN 56 17.714 -21.795 -1.435 457 HE22 GLN 56 HE22 GLN 56 17.894 -21.495 0.214 458 H ARG 57 HN ARG 57 23.594 -21.769 -0.692 459 HA ARG 57 HA ARG 57 25.873 -21.599 -2.509 460 HB2 ARG 57 HB2 ARG 57 24.023 -20.018 -3.269 461 HB3 ARG 57 HB1 ARG 57 24.307 -19.134 -1.774 462 HG2 ARG 57 HG2 ARG 57 26.586 -18.690 -2.369 463 HG3 ARG 57 HG1 ARG 57 26.497 -19.716 -3.808 464 HD2 ARG 57 HD2 ARG 57 24.871 -17.208 -3.304 465 HD3 ARG 57 HD1 ARG 57 26.267 -17.317 -4.360 466 HE ARG 57 HE ARG 57 24.425 -19.310 -5.142 467 HH11 ARG 57 HH21 ARG 57 24.769 -15.829 -5.050 468 HH12 ARG 57 HH22 ARG 57 23.753 -15.567 -6.399 469 HH21 ARG 57 HH11 ARG 57 23.015 -18.946 -6.921 470 HH22 ARG 57 HH12 ARG 57 22.704 -17.363 -7.449 471 H LEU 58 HN LEU 58 27.622 -20.297 -1.602 472 HA LEU 58 HA LEU 58 28.085 -20.888 1.135 473 HB2 LEU 58 HB2 LEU 58 29.787 -18.712 0.461 474 HB3 LEU 58 HB1 LEU 58 30.201 -20.411 0.542 475 HG LEU 58 HG LEU 58 29.269 -20.593 -1.871 476 HD11 LEU 58 HD11 LEU 58 29.871 -17.679 -2.118 477 HD12 LEU 58 HD12 LEU 58 28.302 -18.102 -1.477 478 HD13 LEU 58 HD13 LEU 58 28.792 -18.680 -3.072 479 HD21 LEU 58 HD21 LEU 58 31.819 -19.620 -0.861 480 HD22 LEU 58 HD22 LEU 58 31.489 -18.952 -2.454 481 HD23 LEU 58 HD23 LEU 58 31.494 -20.693 -2.218 482 H ALA 59 HN ALA 59 27.937 -19.675 2.972 483 HA ALA 59 HA ALA 59 25.970 -17.606 3.007 484 HB1 ALA 59 HB1 ALA 59 27.895 -18.382 5.214 485 HB2 ALA 59 HB2 ALA 59 26.332 -19.149 4.921 486 HB3 ALA 59 HB3 ALA 59 26.412 -17.449 5.378 487 H ARG 60 HN ARG 60 27.682 -16.741 1.219 488 HA ARG 60 HA ARG 60 29.712 -15.051 2.272 489 HB2 ARG 60 HB2 ARG 60 29.945 -15.813 -0.006 490 HB3 ARG 60 HB1 ARG 60 28.391 -15.137 -0.446 491 HG2 ARG 60 HG2 ARG 60 29.733 -13.450 -1.223 492 HG3 ARG 60 HG1 ARG 60 29.547 -12.838 0.402 493 HD2 ARG 60 HD2 ARG 60 31.861 -14.450 -0.710 494 HD3 ARG 60 HD1 ARG 60 31.910 -12.790 -0.166 495 HE ARG 60 HE ARG 60 32.006 -15.176 1.474 496 HH11 ARG 60 HH21 ARG 60 31.257 -11.725 1.384 497 HH12 ARG 60 HH22 ARG 60 31.516 -11.553 3.083 498 HH21 ARG 60 HH11 ARG 60 32.326 -14.818 3.752 499 HH22 ARG 60 HH12 ARG 60 32.092 -13.235 4.383 500 H ASP 61 HN ASP 61 29.682 -12.919 2.693 501 HA ASP 61 HA ASP 61 27.417 -11.820 3.877 502 HB2 ASP 61 HB2 ASP 61 29.914 -10.453 2.863 503 HB3 ASP 61 HB1 ASP 61 28.712 -9.689 3.865 504 H GLN 62 HN GLN 62 28.934 -11.085 0.771 505 HA GLN 62 HA GLN 62 27.302 -8.913 0.106 506 HB2 GLN 62 HB2 GLN 62 29.048 -10.709 -1.581 507 HB3 GLN 62 HB1 GLN 62 28.265 -9.252 -2.180 508 HG2 GLN 62 HG2 GLN 62 30.542 -8.778 -1.509 509 HG3 GLN 62 HG1 GLN 62 29.446 -7.903 -0.443 510 HE21 GLN 62 HE21 GLN 62 30.845 -7.872 1.409 511 HE22 GLN 62 HE22 GLN 62 31.378 -9.256 2.208 512 H GLU 63 HN GLU 63 26.919 -12.341 -0.564 513 HA GLU 63 HA GLU 63 25.227 -12.339 -2.728 514 HB2 GLU 63 HB2 GLU 63 25.154 -14.140 -0.304 515 HB3 GLU 63 HB1 GLU 63 24.256 -14.450 -1.784 516 HG2 GLU 63 HG2 GLU 63 27.264 -14.092 -1.665 517 HG3 GLU 63 HG1 GLU 63 26.449 -15.652 -1.717 518 H THR 64 HN THR 64 23.059 -12.304 -3.107 519 HA THR 64 HA THR 64 21.504 -10.611 -1.339 520 HB THR 64 HB THR 64 19.841 -11.350 -3.401 521 HG1 THR 64 HG1 THR 64 21.773 -12.460 -4.234 522 HG21 THR 64 HG21 THR 64 19.796 -9.158 -3.543 523 HG22 THR 64 HG22 THR 64 21.369 -9.110 -4.309 524 HG23 THR 64 HG23 THR 64 21.234 -8.998 -2.554 525 H LEU 65 HN LEU 65 19.348 -11.211 -0.689 526 HA LEU 65 HA LEU 65 19.146 -13.845 0.407 527 HB2 LEU 65 HB2 LEU 65 16.851 -11.942 -0.127 528 HB3 LEU 65 HB1 LEU 65 16.927 -13.220 1.083 529 HG LEU 65 HG LEU 65 18.456 -10.622 1.039 530 HD11 LEU 65 HD11 LEU 65 16.230 -10.538 1.947 531 HD12 LEU 65 HD12 LEU 65 17.446 -10.269 3.194 532 HD13 LEU 65 HD13 LEU 65 16.625 -11.830 3.082 533 HD21 LEU 65 HD21 LEU 65 18.928 -13.070 2.790 534 HD22 LEU 65 HD22 LEU 65 19.579 -11.443 3.096 535 HD23 LEU 65 HD23 LEU 65 20.085 -12.319 1.678 536 H HIS 66 HN HIS 66 17.967 -12.226 -2.423 537 HA HIS 66 HA HIS 66 16.305 -14.164 -3.579 538 HB2 HIS 66 HB2 HIS 66 16.788 -11.755 -4.334 539 HB3 HIS 66 HB1 HIS 66 18.235 -12.393 -5.100 540 HD1 HIS 66 HD1 HIS 66 17.907 -13.225 -7.460 541 HD2 HIS 66 HD2 HIS 66 14.313 -13.134 -5.319 542 HE1 HIS 66 HE1 HIS 66 16.066 -13.762 -9.096 543 HE2 HIS 66 HE2 HIS 66 13.873 -13.714 -7.797 544 H SER 67 HN SER 67 19.827 -13.673 -3.757 545 HA SER 67 HA SER 67 20.351 -15.884 -5.440 546 HB2 SER 67 HB2 SER 67 22.702 -15.501 -4.158 547 HB3 SER 67 HB1 SER 67 22.168 -14.571 -5.552 548 HG SER 67 HG SER 67 21.770 -13.966 -2.786 549 H HIS 68 HN HIS 68 20.109 -15.536 -1.937 550 HA HIS 68 HA HIS 68 21.227 -18.105 -1.334 551 HB2 HIS 68 HB2 HIS 68 21.145 -16.875 0.636 552 HB3 HIS 68 HB1 HIS 68 19.656 -16.062 0.186 553 HD1 HIS 68 HD1 HIS 68 19.830 -19.852 0.171 554 HD2 HIS 68 HD2 HIS 68 18.333 -16.817 2.625 555 HE1 HIS 68 HE1 HIS 68 18.395 -20.970 1.932 556 HE2 HIS 68 HE2 HIS 68 17.422 -19.189 3.378 557 H GLY 69 HN GLY 69 18.112 -16.915 -2.235 558 HA2 GLY 69 HA2 GLY 69 16.843 -18.659 -3.564 559 HA3 GLY 69 HA1 GLY 69 17.014 -19.658 -2.129 560 H VAL 70 HN VAL 70 16.742 -16.452 -1.175 561 HA VAL 70 HA VAL 70 14.036 -16.891 -0.296 562 HB VAL 70 HB VAL 70 15.654 -14.371 0.035 563 HG11 VAL 70 HG11 VAL 70 13.037 -15.026 0.751 564 HG12 VAL 70 HG12 VAL 70 13.990 -13.709 1.421 565 HG13 VAL 70 HG13 VAL 70 13.941 -15.260 2.241 566 HG21 VAL 70 HG21 VAL 70 16.137 -15.523 2.356 567 HG22 VAL 70 HG22 VAL 70 17.134 -15.938 0.958 568 HG23 VAL 70 HG23 VAL 70 15.835 -17.018 1.466 569 H ARG 71 HN ARG 71 12.671 -16.712 -1.995 570 HA ARG 71 HA ARG 71 12.956 -14.400 -3.843 571 HB2 ARG 71 HB2 ARG 71 11.218 -16.790 -4.406 572 HB3 ARG 71 HB1 ARG 71 12.002 -15.697 -5.542 573 HG2 ARG 71 HG2 ARG 71 13.501 -17.630 -3.737 574 HG3 ARG 71 HG1 ARG 71 13.109 -17.967 -5.409 575 HD2 ARG 71 HD2 ARG 71 14.662 -15.468 -4.672 576 HD3 ARG 71 HD1 ARG 71 15.452 -17.023 -4.829 577 HE ARG 71 HE ARG 71 13.761 -16.151 -7.064 578 HH11 ARG 71 HH21 ARG 71 17.035 -16.461 -5.720 579 HH12 ARG 71 HH22 ARG 71 17.754 -16.513 -7.263 580 HH21 ARG 71 HH11 ARG 71 14.815 -16.204 -9.097 581 HH22 ARG 71 HH12 ARG 71 16.506 -16.376 -9.183 582 H GLN 72 HN GLN 72 11.113 -15.617 -1.277 583 HA GLN 72 HA GLN 72 9.315 -13.416 -1.309 584 HB2 GLN 72 HB2 GLN 72 7.222 -14.846 -1.411 585 HB3 GLN 72 HB1 GLN 72 8.020 -14.594 -2.950 586 HG2 GLN 72 HG2 GLN 72 9.219 -16.923 -1.788 587 HG3 GLN 72 HG1 GLN 72 7.480 -17.060 -1.573 588 HE21 GLN 72 HE21 GLN 72 9.191 -15.454 -4.289 589 HE22 GLN 72 HE22 GLN 72 8.560 -16.481 -5.474 590 H ASN 73 HN ASN 73 7.488 -13.969 0.404 591 HA ASN 73 HA ASN 73 8.900 -14.500 2.819 592 HB2 ASN 73 HB2 ASN 73 6.965 -13.941 3.958 593 HB3 ASN 73 HB1 ASN 73 6.648 -13.123 2.424 594 HD21 ASN 73 HD21 ASN 73 5.242 -14.313 0.896 595 HD22 ASN 73 HD22 ASN 73 4.103 -15.431 1.459 596 H GLY 74 HN GLY 74 8.576 -16.256 4.265 597 HA2 GLY 74 HA2 GLY 74 7.872 -18.364 4.822 598 HA3 GLY 74 HA1 GLY 74 7.293 -18.665 3.187 599 H ASP 75 HN ASP 75 10.223 -17.266 2.840 600 HA ASP 75 HA ASP 75 11.544 -19.780 2.287 601 HB2 ASP 75 HB2 ASP 75 12.314 -16.887 1.882 602 HB3 ASP 75 HB1 ASP 75 13.461 -18.193 1.588 603 H SER 76 HN SER 76 13.753 -20.242 3.149 604 HA SER 76 HA SER 76 13.809 -19.444 5.966 605 HB2 SER 76 HB2 SER 76 14.431 -21.881 6.403 606 HB3 SER 76 HB1 SER 76 12.773 -21.510 5.970 607 HG SER 76 HG SER 76 13.398 -23.179 4.645 608 H ALA 77 HN ALA 77 15.865 -20.132 7.107 609 HA ALA 77 HA ALA 77 18.258 -20.565 5.523 610 HB1 ALA 77 HB1 ALA 77 17.717 -17.969 5.757 611 HB2 ALA 77 HB2 ALA 77 19.363 -18.579 5.910 612 HB3 ALA 77 HB3 ALA 77 18.431 -18.203 7.355 613 H TYR 78 HN TYR 78 20.216 -20.797 6.992 614 HA TYR 78 HA TYR 78 19.413 -21.807 9.662 615 HB2 TYR 78 HB2 TYR 78 20.084 -23.456 7.639 616 HB3 TYR 78 HB1 TYR 78 21.693 -23.099 8.247 617 HD1 TYR 78 HD2 TYR 78 18.380 -24.481 9.100 618 HD2 TYR 78 HD1 TYR 78 22.429 -23.912 10.447 619 HE1 TYR 78 HE2 TYR 78 17.985 -26.056 10.946 620 HE2 TYR 78 HE1 TYR 78 22.030 -25.492 12.293 621 HH TYR 78 HH TYR 78 20.531 -26.795 13.337 622 H LEU 79 HN LEU 79 20.499 -20.885 11.294 623 HA LEU 79 HA LEU 79 23.142 -19.702 10.763 624 HB2 LEU 79 HB2 LEU 79 21.543 -17.900 11.023 625 HB3 LEU 79 HB1 LEU 79 20.891 -18.645 12.479 626 HG LEU 79 HG LEU 79 23.130 -18.369 13.595 627 HD11 LEU 79 HD11 LEU 79 23.866 -17.562 10.874 628 HD12 LEU 79 HD12 LEU 79 24.875 -18.106 12.222 629 HD13 LEU 79 HD13 LEU 79 24.394 -16.424 12.110 630 HD21 LEU 79 HD21 LEU 79 21.710 -16.631 14.204 631 HD22 LEU 79 HD22 LEU 79 21.555 -16.025 12.550 632 HD23 LEU 79 HD23 LEU 79 23.033 -15.735 13.465 633 H TYR 80 HN TYR 80 24.730 -20.291 12.083 634 HA TYR 80 HA TYR 80 24.071 -21.902 14.467 635 HB2 TYR 80 HB2 TYR 80 25.488 -23.131 12.963 636 HB3 TYR 80 HB1 TYR 80 26.547 -21.749 12.733 637 HD1 TYR 80 HD2 TYR 80 25.108 -23.147 15.928 638 HD2 TYR 80 HD1 TYR 80 28.632 -22.456 13.557 639 HE1 TYR 80 HE2 TYR 80 26.500 -23.930 17.779 640 HE2 TYR 80 HE1 TYR 80 30.029 -23.246 15.415 641 HH TYR 80 HH TYR 80 29.901 -24.532 17.363 642 H LEU 81 HN LEU 81 24.478 -21.010 16.457 643 HA LEU 81 HA LEU 81 25.903 -18.424 16.430 644 HB2 LEU 81 HB2 LEU 81 23.432 -18.431 16.976 645 HB3 LEU 81 HB1 LEU 81 23.823 -19.403 18.387 646 HG LEU 81 HG LEU 81 25.395 -17.587 19.127 647 HD11 LEU 81 HD11 LEU 81 25.166 -16.580 16.555 648 HD12 LEU 81 HD12 LEU 81 25.676 -15.634 17.946 649 HD13 LEU 81 HD13 LEU 81 24.015 -15.586 17.436 650 HD21 LEU 81 HD21 LEU 81 23.012 -17.830 19.952 651 HD22 LEU 81 HD22 LEU 81 22.546 -16.616 18.754 652 HD23 LEU 81 HD23 LEU 81 23.655 -16.193 20.053 653 H LEU 82 HN LEU 82 27.840 -18.520 17.306 654 HA LEU 82 HA LEU 82 28.736 -20.730 18.885 655 HB2 LEU 82 HB2 LEU 82 30.080 -18.126 18.152 656 HB3 LEU 82 HB1 LEU 82 30.862 -19.411 19.051 657 HG LEU 82 HG LEU 82 29.602 -19.856 16.318 658 HD11 LEU 82 HD11 LEU 82 32.471 -19.235 17.084 659 HD12 LEU 82 HD12 LEU 82 31.433 -18.315 15.991 660 HD13 LEU 82 HD13 LEU 82 31.989 -19.920 15.534 661 HD21 LEU 82 HD21 LEU 82 29.796 -21.895 17.537 662 HD22 LEU 82 HD22 LEU 82 31.404 -21.480 18.149 663 HD23 LEU 82 HD23 LEU 82 31.177 -21.858 16.447 664 H SER 83 HN SER 83 29.586 -20.659 21.019 665 HA SER 83 HA SER 83 28.044 -19.087 22.831 666 HB2 SER 83 HB2 SER 83 30.238 -20.198 24.223 667 HB3 SER 83 HB1 SER 83 28.610 -20.808 24.126 668 HG SER 83 HG SER 83 30.617 -22.052 23.319 669 H ALA 84 HN ALA 84 28.935 -17.216 21.354 670 HA ALA 84 HA ALA 84 31.232 -15.987 22.759 671 HB1 ALA 84 HB1 ALA 84 32.266 -16.243 20.755 672 HB2 ALA 84 HB2 ALA 84 31.378 -14.782 20.360 673 HB3 ALA 84 HB3 ALA 84 30.755 -16.353 19.855 674 H ARG 85 HN ARG 85 31.246 -13.688 22.785 675 HA ARG 85 HA ARG 85 28.652 -12.394 22.298 676 HB2 ARG 85 HB2 ARG 85 29.140 -11.092 24.499 677 HB3 ARG 85 HB1 ARG 85 28.390 -12.675 24.589 678 HG2 ARG 85 HG2 ARG 85 31.372 -12.727 24.610 679 HG3 ARG 85 HG1 ARG 85 30.631 -11.975 26.008 680 HD2 ARG 85 HD2 ARG 85 29.968 -14.749 24.973 681 HD3 ARG 85 HD1 ARG 85 30.930 -14.372 26.388 682 HE ARG 85 HE ARG 85 28.485 -13.055 26.714 683 HH11 ARG 85 HH21 ARG 85 29.706 -16.287 26.406 684 HH12 ARG 85 HH22 ARG 85 28.462 -17.010 27.322 685 HH21 ARG 85 HH11 ARG 85 26.844 -13.969 27.954 686 HH22 ARG 85 HH12 ARG 85 26.812 -15.658 28.269 687 H ASN 86 HN ASN 86 29.086 -10.875 20.896 688 HA ASN 86 HA ASN 86 31.556 -9.273 21.213 689 HB2 ASN 86 HB2 ASN 86 31.487 -10.901 19.217 690 HB3 ASN 86 HB1 ASN 86 30.258 -9.823 18.557 691 HD21 ASN 86 HD21 ASN 86 33.667 -9.844 19.695 692 HD22 ASN 86 HD22 ASN 86 34.111 -8.509 18.762 693 H THR 87 HN THR 87 30.980 -7.322 21.880 694 HA THR 87 HA THR 87 28.336 -6.294 21.312 695 HB THR 87 HB THR 87 28.976 -4.462 22.826 696 HG1 THR 87 HG1 THR 87 31.489 -5.789 22.690 697 HG21 THR 87 HG21 THR 87 28.085 -6.106 24.122 698 HG22 THR 87 HG22 THR 87 29.708 -6.135 24.792 699 HG23 THR 87 HG23 THR 87 29.228 -7.333 23.599 700 H SER 88 HN SER 88 28.162 -3.932 20.637 701 HA SER 88 HA SER 88 29.084 -3.653 18.046 702 HB2 SER 88 HB2 SER 88 28.444 -1.228 19.678 703 HB3 SER 88 HB1 SER 88 27.995 -1.635 18.036 704 HG SER 88 HG SER 88 26.174 -1.976 19.239 705 H LEU 89 HN LEU 89 30.386 -2.629 21.024 706 HA LEU 89 HA LEU 89 32.440 -0.869 20.113 707 HB2 LEU 89 HB2 LEU 89 32.252 -2.531 22.628 708 HB3 LEU 89 HB1 LEU 89 33.507 -1.336 22.330 709 HG LEU 89 HG LEU 89 30.532 -0.683 22.274 710 HD11 LEU 89 HD11 LEU 89 31.278 -1.393 24.533 711 HD12 LEU 89 HD12 LEU 89 30.849 0.307 24.471 712 HD13 LEU 89 HD13 LEU 89 32.544 -0.165 24.485 713 HD21 LEU 89 HD21 LEU 89 31.432 1.660 22.488 714 HD22 LEU 89 HD22 LEU 89 31.927 0.899 20.980 715 HD23 LEU 89 HD23 LEU 89 33.057 1.018 22.320 716 H ASN 90 HN ASN 90 32.247 -4.306 20.471 717 HA ASN 90 HA ASN 90 35.050 -4.843 20.325 718 HB2 ASN 90 HB2 ASN 90 32.717 -6.685 19.814 719 HB3 ASN 90 HB1 ASN 90 34.388 -7.181 20.064 720 HD21 ASN 90 HD21 ASN 90 35.208 -5.603 22.189 721 HD22 ASN 90 HD22 ASN 90 34.257 -5.909 23.551 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 3.579 -2.990 -0.830 2 H2 MET 1 HT2 MET 1 2.483 -2.044 0.051 3 H3 MET 1 HT3 MET 1 2.893 -1.632 -1.534 4 HA MET 1 HA MET 1 1.480 -4.106 -0.718 5 HB2 MET 1 HB2 MET 1 0.488 -1.425 -1.662 6 HB3 MET 1 HB1 MET 1 -0.284 -2.858 -2.356 7 HG2 MET 1 HG2 MET 1 -1.276 -1.865 -0.197 8 HG3 MET 1 HG1 MET 1 -1.039 -3.600 -0.281 9 HE1 MET 1 HE1 MET 1 -0.159 -0.315 1.435 10 HE2 MET 1 HE2 MET 1 0.232 -1.022 2.995 11 HE3 MET 1 HE3 MET 1 -1.286 -1.436 2.218 12 HA PRO 2 HA PRO 2 2.287 -4.443 -5.466 13 HB2 PRO 2 HB2 PRO 2 3.361 -2.251 -6.692 14 HB3 PRO 2 HB1 PRO 2 1.615 -2.557 -6.630 15 HG2 PRO 2 HG2 PRO 2 3.255 -0.744 -4.922 16 HG3 PRO 2 HG1 PRO 2 1.675 -0.466 -5.671 17 HD2 PRO 2 HD2 PRO 2 1.839 -1.073 -3.091 18 HD3 PRO 2 HD1 PRO 2 0.508 -1.712 -4.097 19 H THR 3 HN THR 3 4.078 -2.247 -3.486 20 HA THR 3 HA THR 3 6.673 -3.448 -4.056 21 HB THR 3 HB THR 3 7.328 -1.503 -2.467 22 HG1 THR 3 HG1 THR 3 5.722 0.100 -2.374 23 HG21 THR 3 HG21 THR 3 6.097 -1.041 -5.206 24 HG22 THR 3 HG22 THR 3 7.770 -1.429 -4.858 25 HG23 THR 3 HG23 THR 3 7.114 0.129 -4.374 26 H GLN 4 HN GLN 4 7.490 -4.885 -2.555 27 HA GLN 4 HA GLN 4 6.128 -5.152 0.062 28 HB2 GLN 4 HB2 GLN 4 6.488 -7.331 -1.993 29 HB3 GLN 4 HB1 GLN 4 5.919 -7.566 -0.350 30 HG2 GLN 4 HG2 GLN 4 3.985 -6.120 -0.757 31 HG3 GLN 4 HG1 GLN 4 4.578 -5.771 -2.379 32 HE21 GLN 4 HE21 GLN 4 2.292 -6.702 -2.793 33 HE22 GLN 4 HE22 GLN 4 2.194 -8.378 -3.080 34 H ASP 5 HN ASP 5 7.120 -6.667 1.430 35 HA ASP 5 HA ASP 5 9.955 -7.279 0.931 36 HB2 ASP 5 HB2 ASP 5 8.640 -6.381 3.507 37 HB3 ASP 5 HB1 ASP 5 9.981 -7.527 3.492 38 H ILE 6 HN ILE 6 10.545 -9.375 1.921 39 HA ILE 6 HA ILE 6 8.195 -11.135 2.170 40 HB ILE 6 HB ILE 6 9.433 -12.856 0.996 41 HG12 ILE 6 HG12 ILE 6 11.538 -10.741 0.449 42 HG13 ILE 6 HG11 ILE 6 11.757 -12.001 1.664 43 HG21 ILE 6 HG21 ILE 6 9.126 -10.166 -0.331 44 HG22 ILE 6 HG22 ILE 6 8.085 -11.580 -0.484 45 HG23 ILE 6 HG23 ILE 6 9.666 -11.557 -1.264 46 HD11 ILE 6 HD11 ILE 6 11.143 -12.539 -1.247 47 HD12 ILE 6 HD12 ILE 6 11.583 -13.720 -0.015 48 HD13 ILE 6 HD13 ILE 6 12.773 -12.542 -0.571 49 H ARG 7 HN ARG 7 8.627 -13.089 3.337 50 HA ARG 7 HA ARG 7 10.186 -12.480 5.724 51 HB2 ARG 7 HB2 ARG 7 8.409 -14.887 5.234 52 HB3 ARG 7 HB1 ARG 7 9.100 -14.348 6.746 53 HG2 ARG 7 HG2 ARG 7 7.863 -12.243 6.668 54 HG3 ARG 7 HG1 ARG 7 7.128 -12.680 5.133 55 HD2 ARG 7 HD2 ARG 7 6.808 -14.224 7.735 56 HD3 ARG 7 HD1 ARG 7 5.656 -13.120 7.012 57 HE ARG 7 HE ARG 7 6.182 -15.000 5.029 58 HH11 ARG 7 HH21 ARG 7 4.936 -14.950 8.281 59 HH12 ARG 7 HH22 ARG 7 3.894 -16.285 8.043 60 HH21 ARG 7 HH11 ARG 7 4.847 -16.732 4.699 61 HH22 ARG 7 HH12 ARG 7 3.843 -17.343 5.953 62 H LEU 8 HN LEU 8 12.075 -13.303 6.171 63 HA LEU 8 HA LEU 8 13.009 -15.732 4.783 64 HB2 LEU 8 HB2 LEU 8 14.309 -13.637 4.263 65 HB3 LEU 8 HB1 LEU 8 14.695 -13.502 5.970 66 HG LEU 8 HG LEU 8 16.437 -14.629 4.423 67 HD11 LEU 8 HD11 LEU 8 16.105 -14.756 7.052 68 HD12 LEU 8 HD12 LEU 8 17.325 -15.713 6.208 69 HD13 LEU 8 HD13 LEU 8 15.812 -16.457 6.677 70 HD21 LEU 8 HD21 LEU 8 14.828 -17.147 4.893 71 HD22 LEU 8 HD22 LEU 8 16.121 -16.850 3.751 72 HD23 LEU 8 HD23 LEU 8 14.530 -16.172 3.451 73 H TRP 9 HN TRP 9 13.105 -17.437 6.152 74 HA TRP 9 HA TRP 9 13.012 -16.894 9.035 75 HB2 TRP 9 HB2 TRP 9 12.718 -19.542 7.622 76 HB3 TRP 9 HB1 TRP 9 12.324 -19.190 9.288 77 HD1 TRP 9 HD1 TRP 9 10.835 -16.306 8.466 78 HE1 TRP 9 HE1 TRP 9 8.451 -16.498 7.533 79 HE3 TRP 9 HE3 TRP 9 10.899 -21.153 6.966 80 HZ2 TRP 9 HZ2 TRP 9 6.785 -18.464 6.280 81 HZ3 TRP 9 HZ3 TRP 9 8.977 -22.169 5.912 82 HH2 TRP 9 HH2 TRP 9 6.863 -20.828 5.550 83 H VAL 10 HN VAL 10 14.618 -17.412 10.415 84 HA VAL 10 HA VAL 10 16.906 -18.882 9.279 85 HB VAL 10 HB VAL 10 17.265 -16.803 11.414 86 HG11 VAL 10 HG11 VAL 10 19.527 -16.736 10.520 87 HG12 VAL 10 HG12 VAL 10 19.080 -17.832 9.227 88 HG13 VAL 10 HG13 VAL 10 19.091 -18.403 10.900 89 HG21 VAL 10 HG21 VAL 10 17.718 -15.124 9.707 90 HG22 VAL 10 HG22 VAL 10 16.085 -15.722 9.438 91 HG23 VAL 10 HG23 VAL 10 17.419 -16.287 8.426 92 H SER 11 HN SER 11 17.450 -20.636 10.351 93 HA SER 11 HA SER 11 16.281 -21.165 13.002 94 HB2 SER 11 HB2 SER 11 17.935 -23.050 11.323 95 HB3 SER 11 HB1 SER 11 16.833 -23.454 12.627 96 HG SER 11 HG SER 11 16.369 -23.027 9.979 97 H VAL 12 HN VAL 12 17.473 -20.749 14.775 98 HA VAL 12 HA VAL 12 20.367 -20.351 14.422 99 HB VAL 12 HB VAL 12 18.532 -19.354 16.565 100 HG11 VAL 12 HG11 VAL 12 21.229 -18.360 15.668 101 HG12 VAL 12 HG12 VAL 12 20.983 -19.397 17.076 102 HG13 VAL 12 HG13 VAL 12 20.319 -17.765 17.048 103 HG21 VAL 12 HG21 VAL 12 19.197 -18.198 13.855 104 HG22 VAL 12 HG22 VAL 12 18.854 -17.115 15.204 105 HG23 VAL 12 HG23 VAL 12 17.648 -18.279 14.686 106 H GLU 13 HN GLU 13 21.698 -21.711 15.415 107 HA GLU 13 HA GLU 13 20.797 -23.183 17.822 108 HB2 GLU 13 HB2 GLU 13 22.368 -24.250 15.477 109 HB3 GLU 13 HB1 GLU 13 22.207 -25.089 17.016 110 HG2 GLU 13 HG2 GLU 13 19.809 -25.210 16.780 111 HG3 GLU 13 HG1 GLU 13 19.828 -24.250 15.307 112 H ASP 14 HN ASP 14 22.111 -22.787 19.506 113 HA ASP 14 HA ASP 14 24.783 -21.633 19.007 114 HB2 ASP 14 HB2 ASP 14 24.296 -20.320 20.761 115 HB3 ASP 14 HB1 ASP 14 22.779 -21.169 21.001 116 H ALA 15 HN ALA 15 26.404 -22.246 20.734 117 HA ALA 15 HA ALA 15 27.212 -24.901 20.216 118 HB1 ALA 15 HB1 ALA 15 29.048 -24.488 21.710 119 HB2 ALA 15 HB2 ALA 15 28.206 -23.123 22.434 120 HB3 ALA 15 HB3 ALA 15 28.755 -23.034 20.756 121 H GLN 16 HN GLN 16 25.665 -23.406 23.041 122 HA GLN 16 HA GLN 16 25.737 -25.916 24.491 123 HB2 GLN 16 HB2 GLN 16 23.879 -23.936 25.598 124 HB3 GLN 16 HB1 GLN 16 25.225 -24.747 26.372 125 HG2 GLN 16 HG2 GLN 16 25.280 -22.276 24.653 126 HG3 GLN 16 HG1 GLN 16 25.625 -22.384 26.357 127 HE21 GLN 16 HE21 GLN 16 27.168 -25.065 25.613 128 HE22 GLN 16 HE22 GLN 16 28.668 -24.471 25.101 129 H MET 17 HN MET 17 24.136 -25.154 21.914 130 HA MET 17 HA MET 17 22.349 -26.070 20.864 131 HB2 MET 17 HB2 MET 17 21.820 -27.534 23.479 132 HB3 MET 17 HB1 MET 17 20.880 -27.706 22.015 133 HG2 MET 17 HG2 MET 17 22.826 -28.451 20.756 134 HG3 MET 17 HG1 MET 17 23.858 -28.195 22.166 135 HE1 MET 17 HE1 MET 17 21.055 -29.972 20.492 136 HE2 MET 17 HE2 MET 17 20.118 -29.836 21.976 137 HE3 MET 17 HE3 MET 17 20.689 -31.405 21.463 138 H HIS 18 HN HIS 18 22.337 -23.518 22.442 139 HA HIS 18 HA HIS 18 19.582 -23.183 23.200 140 HB2 HIS 18 HB2 HIS 18 21.827 -21.629 23.542 141 HB3 HIS 18 HB1 HIS 18 21.079 -20.829 22.167 142 HD1 HIS 18 HD1 HIS 18 18.311 -20.387 22.583 143 HD2 HIS 18 HD2 HIS 18 20.793 -20.798 25.924 144 HE1 HIS 18 HE1 HIS 18 17.065 -19.392 24.553 145 HE2 HIS 18 HE2 HIS 18 18.587 -19.616 26.583 146 H THR 19 HN THR 19 18.013 -23.424 21.689 147 HA THR 19 HA THR 19 18.736 -22.852 18.903 148 HB THR 19 HB THR 19 16.720 -24.857 19.916 149 HG1 THR 19 HG1 THR 19 19.018 -25.241 20.503 150 HG21 THR 19 HG21 THR 19 16.284 -24.232 17.637 151 HG22 THR 19 HG22 THR 19 17.095 -25.789 17.599 152 HG23 THR 19 HG23 THR 19 17.991 -24.321 17.220 153 H VAL 20 HN VAL 20 17.604 -21.376 17.853 154 HA VAL 20 HA VAL 20 14.825 -20.899 18.588 155 HB VAL 20 HB VAL 20 15.180 -18.404 18.472 156 HG11 VAL 20 HG11 VAL 20 15.543 -18.251 20.755 157 HG12 VAL 20 HG12 VAL 20 16.786 -19.505 20.754 158 HG13 VAL 20 HG13 VAL 20 15.077 -19.937 20.568 159 HG21 VAL 20 HG21 VAL 20 17.308 -18.083 17.498 160 HG22 VAL 20 HG22 VAL 20 18.067 -19.327 18.512 161 HG23 VAL 20 HG23 VAL 20 17.616 -17.789 19.204 162 H THR 21 HN THR 21 13.608 -19.830 17.029 163 HA THR 21 HA THR 21 14.765 -19.852 14.322 164 HB THR 21 HB THR 21 12.054 -20.666 15.335 165 HG1 THR 21 HG1 THR 21 13.266 -22.389 14.893 166 HG21 THR 21 HG21 THR 21 11.534 -18.954 13.660 167 HG22 THR 21 HG22 THR 21 11.199 -20.532 13.002 168 HG23 THR 21 HG23 THR 21 12.670 -19.675 12.520 169 H ILE 22 HN ILE 22 14.811 -17.911 13.373 170 HA ILE 22 HA ILE 22 12.998 -15.859 14.460 171 HB ILE 22 HB ILE 22 14.720 -14.173 14.103 172 HG12 ILE 22 HG12 ILE 22 16.565 -16.493 13.415 173 HG13 ILE 22 HG11 ILE 22 15.860 -15.364 12.238 174 HG21 ILE 22 HG21 ILE 22 15.845 -16.494 15.717 175 HG22 ILE 22 HG22 ILE 22 14.608 -15.375 16.300 176 HG23 ILE 22 HG23 ILE 22 16.219 -14.785 15.913 177 HD11 ILE 22 HD11 ILE 22 17.457 -14.375 14.602 178 HD12 ILE 22 HD12 ILE 22 17.056 -13.522 13.119 179 HD13 ILE 22 HD13 ILE 22 18.238 -14.830 13.088 180 H TRP 23 HN TRP 23 12.184 -14.448 13.042 181 HA TRP 23 HA TRP 23 12.338 -15.271 10.207 182 HB2 TRP 23 HB2 TRP 23 9.969 -14.161 11.734 183 HB3 TRP 23 HB1 TRP 23 9.968 -14.675 10.055 184 HD1 TRP 23 HD1 TRP 23 11.411 -17.390 10.140 185 HE1 TRP 23 HE1 TRP 23 10.409 -19.407 11.362 186 HE3 TRP 23 HE3 TRP 23 8.355 -14.984 13.368 187 HZ2 TRP 23 HZ2 TRP 23 8.565 -19.933 13.464 188 HZ3 TRP 23 HZ3 TRP 23 6.976 -16.249 14.996 189 HH2 TRP 23 HH2 TRP 23 7.083 -18.736 15.047 190 H LEU 24 HN LEU 24 13.028 -13.759 8.883 191 HA LEU 24 HA LEU 24 13.047 -10.966 9.837 192 HB2 LEU 24 HB2 LEU 24 14.816 -12.331 7.816 193 HB3 LEU 24 HB1 LEU 24 14.963 -10.656 8.361 194 HG LEU 24 HG LEU 24 15.209 -13.095 10.167 195 HD11 LEU 24 HD11 LEU 24 17.093 -12.610 8.466 196 HD12 LEU 24 HD12 LEU 24 17.510 -12.811 10.169 197 HD13 LEU 24 HD13 LEU 24 17.436 -11.197 9.475 198 HD21 LEU 24 HD21 LEU 24 16.192 -11.245 11.698 199 HD22 LEU 24 HD22 LEU 24 14.441 -11.304 11.529 200 HD23 LEU 24 HD23 LEU 24 15.371 -10.106 10.635 201 H THR 25 HN THR 25 12.177 -9.395 8.531 202 HA THR 25 HA THR 25 10.905 -10.374 6.055 203 HB THR 25 HB THR 25 9.960 -7.951 7.596 204 HG1 THR 25 HG1 THR 25 9.257 -9.251 9.070 205 HG21 THR 25 HG21 THR 25 8.649 -9.916 5.689 206 HG22 THR 25 HG22 THR 25 9.111 -8.257 5.324 207 HG23 THR 25 HG23 THR 25 7.825 -8.572 6.479 208 H VAL 26 HN VAL 26 11.915 -9.709 4.304 209 HA VAL 26 HA VAL 26 12.843 -6.956 3.999 210 HB VAL 26 HB VAL 26 15.087 -7.852 3.207 211 HG11 VAL 26 HG11 VAL 26 14.481 -8.277 6.152 212 HG12 VAL 26 HG12 VAL 26 14.722 -6.692 5.413 213 HG13 VAL 26 HG13 VAL 26 16.037 -7.864 5.441 214 HG21 VAL 26 HG21 VAL 26 14.581 -10.176 2.980 215 HG22 VAL 26 HG22 VAL 26 14.040 -10.317 4.658 216 HG23 VAL 26 HG23 VAL 26 15.740 -10.047 4.296 217 H ARG 27 HN ARG 27 13.971 -6.919 1.703 218 HA ARG 27 HA ARG 27 12.156 -8.373 -0.101 219 HB2 ARG 27 HB2 ARG 27 13.138 -6.801 -1.892 220 HB3 ARG 27 HB1 ARG 27 12.038 -6.116 -0.705 221 HG2 ARG 27 HG2 ARG 27 14.699 -5.965 0.390 222 HG3 ARG 27 HG1 ARG 27 14.759 -5.357 -1.248 223 HD2 ARG 27 HD2 ARG 27 12.710 -4.448 0.777 224 HD3 ARG 27 HD1 ARG 27 14.213 -3.621 0.471 225 HE ARG 27 HE ARG 27 13.457 -3.044 -1.716 226 HH11 ARG 27 HH21 ARG 27 10.996 -4.733 0.227 227 HH12 ARG 27 HH22 ARG 27 9.749 -4.257 -0.813 228 HH21 ARG 27 HH11 ARG 27 11.668 -2.430 -3.038 229 HH22 ARG 27 HH12 ARG 27 10.095 -2.954 -2.638 230 HA PRO 28 HA PRO 28 15.269 -11.185 -1.576 231 HB2 PRO 28 HB2 PRO 28 14.501 -10.391 -4.340 232 HB3 PRO 28 HB1 PRO 28 14.508 -11.991 -3.574 233 HG2 PRO 28 HG2 PRO 28 12.239 -10.748 -4.054 234 HG3 PRO 28 HG1 PRO 28 12.468 -11.690 -2.575 235 HD2 PRO 28 HD2 PRO 28 12.460 -8.720 -2.915 236 HD3 PRO 28 HD1 PRO 28 11.854 -9.710 -1.566 237 H ASP 29 HN ASP 29 15.031 -7.931 -2.630 238 HA ASP 29 HA ASP 29 17.477 -7.768 -4.133 239 HB2 ASP 29 HB2 ASP 29 15.597 -5.626 -3.125 240 HB3 ASP 29 HB1 ASP 29 17.004 -5.351 -4.135 241 H MET 30 HN MET 30 16.874 -7.919 -0.868 242 HA MET 30 HA MET 30 19.010 -6.112 -0.054 243 HB2 MET 30 HB2 MET 30 17.149 -7.949 1.400 244 HB3 MET 30 HB1 MET 30 18.647 -7.444 2.165 245 HG2 MET 30 HG2 MET 30 18.086 -5.104 1.849 246 HG3 MET 30 HG1 MET 30 16.605 -5.531 0.989 247 HE1 MET 30 HE1 MET 30 18.728 -5.816 4.018 248 HE2 MET 30 HE2 MET 30 18.087 -7.438 4.301 249 HE3 MET 30 HE3 MET 30 17.660 -6.135 5.394 250 H THR 31 HN THR 31 20.752 -6.786 1.171 251 HA THR 31 HA THR 31 22.063 -9.116 0.006 252 HB THR 31 HB THR 31 22.913 -6.444 0.991 253 HG1 THR 31 HG1 THR 31 24.308 -8.070 -0.838 254 HG21 THR 31 HG21 THR 31 24.029 -7.873 2.578 255 HG22 THR 31 HG22 THR 31 25.210 -7.200 1.447 256 HG23 THR 31 HG23 THR 31 24.644 -8.877 1.266 257 H VAL 32 HN VAL 32 23.046 -10.656 1.352 258 HA VAL 32 HA VAL 32 21.602 -11.339 3.654 259 HB VAL 32 HB VAL 32 24.354 -12.263 2.756 260 HG11 VAL 32 HG11 VAL 32 23.677 -14.299 4.182 261 HG12 VAL 32 HG12 VAL 32 22.551 -13.206 4.989 262 HG13 VAL 32 HG13 VAL 32 24.277 -12.874 5.013 263 HG21 VAL 32 HG21 VAL 32 23.212 -14.108 1.767 264 HG22 VAL 32 HG22 VAL 32 22.361 -12.674 1.215 265 HG23 VAL 32 HG23 VAL 32 21.680 -13.671 2.518 266 H ALA 33 HN ALA 33 24.766 -9.787 3.360 267 HA ALA 33 HA ALA 33 25.411 -9.593 6.071 268 HB1 ALA 33 HB1 ALA 33 26.829 -8.852 4.051 269 HB2 ALA 33 HB2 ALA 33 26.922 -7.881 5.510 270 HB3 ALA 33 HB3 ALA 33 25.949 -7.324 4.152 271 H SER 34 HN SER 34 23.447 -7.411 4.074 272 HA SER 34 HA SER 34 22.803 -5.522 6.056 273 HB2 SER 34 HB2 SER 34 21.017 -6.441 3.779 274 HB3 SER 34 HB1 SER 34 21.009 -4.896 4.592 275 HG SER 34 HG SER 34 22.098 -4.897 2.588 276 H LEU 35 HN LEU 35 21.340 -8.544 5.012 277 HA LEU 35 HA LEU 35 19.135 -8.551 6.794 278 HB2 LEU 35 HB2 LEU 35 19.201 -9.942 4.768 279 HB3 LEU 35 HB1 LEU 35 20.549 -10.857 5.433 280 HG LEU 35 HG LEU 35 19.191 -11.648 7.268 281 HD11 LEU 35 HD11 LEU 35 17.663 -9.984 7.767 282 HD12 LEU 35 HD12 LEU 35 16.616 -11.138 6.939 283 HD13 LEU 35 HD13 LEU 35 17.201 -9.706 6.089 284 HD21 LEU 35 HD21 LEU 35 17.756 -11.931 4.621 285 HD22 LEU 35 HD22 LEU 35 17.625 -13.038 5.998 286 HD23 LEU 35 HD23 LEU 35 19.156 -12.886 5.131 287 H LYS 36 HN LYS 36 22.366 -9.922 6.972 288 HA LYS 36 HA LYS 36 22.170 -11.269 9.446 289 HB2 LYS 36 HB2 LYS 36 24.491 -9.871 8.115 290 HB3 LYS 36 HB1 LYS 36 24.641 -10.840 9.577 291 HG2 LYS 36 HG2 LYS 36 23.857 -12.835 8.377 292 HG3 LYS 36 HG1 LYS 36 23.551 -11.897 6.930 293 HD2 LYS 36 HD2 LYS 36 25.669 -12.891 6.534 294 HD3 LYS 36 HD1 LYS 36 26.052 -11.240 7.017 295 HE2 LYS 36 HE2 LYS 36 26.189 -12.286 9.445 296 HE3 LYS 36 HE1 LYS 36 26.414 -13.799 8.563 297 HZ1 LYS 36 HZ1 LYS 36 28.219 -12.544 7.296 298 HZ2 LYS 36 HZ2 LYS 36 28.545 -12.878 8.936 299 HZ3 LYS 36 HZ3 LYS 36 28.068 -11.354 8.478 300 H ASP 37 HN ASP 37 22.984 -7.970 8.581 301 HA ASP 37 HA ASP 37 23.761 -7.075 11.123 302 HB2 ASP 37 HB2 ASP 37 24.072 -5.860 8.923 303 HB3 ASP 37 HB1 ASP 37 22.391 -5.346 9.080 304 H MET 38 HN MET 38 20.555 -7.051 9.590 305 HA MET 38 HA MET 38 19.237 -5.629 11.628 306 HB2 MET 38 HB2 MET 38 17.674 -7.839 10.510 307 HB3 MET 38 HB1 MET 38 17.325 -6.135 10.621 308 HG2 MET 38 HG2 MET 38 18.982 -5.718 8.757 309 HG3 MET 38 HG1 MET 38 19.056 -7.455 8.535 310 HE1 MET 38 HE1 MET 38 16.871 -8.738 9.060 311 HE2 MET 38 HE2 MET 38 15.726 -8.702 7.742 312 HE3 MET 38 HE3 MET 38 15.353 -7.844 9.223 313 H VAL 39 HN VAL 39 20.005 -8.982 11.257 314 HA VAL 39 HA VAL 39 18.585 -9.947 13.444 315 HB VAL 39 HB VAL 39 21.237 -10.959 12.346 316 HG11 VAL 39 HG11 VAL 39 20.600 -11.824 14.667 317 HG12 VAL 39 HG12 VAL 39 20.772 -13.043 13.410 318 HG13 VAL 39 HG13 VAL 39 19.176 -12.527 13.901 319 HG21 VAL 39 HG21 VAL 39 18.431 -11.109 11.433 320 HG22 VAL 39 HG22 VAL 39 19.255 -12.665 11.502 321 HG23 VAL 39 HG23 VAL 39 19.929 -11.353 10.539 322 H PHE 40 HN PHE 40 21.818 -8.587 13.087 323 HA PHE 40 HA PHE 40 22.612 -8.758 15.815 324 HB2 PHE 40 HB2 PHE 40 24.296 -8.433 14.162 325 HB3 PHE 40 HB1 PHE 40 23.506 -6.984 13.538 326 HD1 PHE 40 HD2 PHE 40 24.746 -8.316 16.854 327 HD2 PHE 40 HD1 PHE 40 24.384 -4.939 14.217 328 HE1 PHE 40 HE2 PHE 40 26.004 -6.930 18.459 329 HE2 PHE 40 HE1 PHE 40 25.639 -3.555 15.827 330 HZ PHE 40 HZ PHE 40 26.459 -4.549 17.956 331 H LEU 41 HN LEU 41 21.033 -6.273 13.851 332 HA LEU 41 HA LEU 41 20.827 -4.269 15.863 333 HB2 LEU 41 HB2 LEU 41 18.834 -4.912 13.667 334 HB3 LEU 41 HB1 LEU 41 18.940 -3.421 14.585 335 HG LEU 41 HG LEU 41 21.097 -4.543 12.830 336 HD11 LEU 41 HD11 LEU 41 19.218 -3.694 11.490 337 HD12 LEU 41 HD12 LEU 41 20.607 -2.626 11.357 338 HD13 LEU 41 HD13 LEU 41 19.260 -2.184 12.403 339 HD21 LEU 41 HD21 LEU 41 21.781 -2.000 13.189 340 HD22 LEU 41 HD22 LEU 41 22.322 -3.321 14.248 341 HD23 LEU 41 HD23 LEU 41 20.973 -2.277 14.745 342 H ASP 42 HN ASP 42 18.751 -6.810 14.822 343 HA ASP 42 HA ASP 42 16.636 -6.216 16.671 344 HB2 ASP 42 HB2 ASP 42 16.514 -7.472 14.356 345 HB3 ASP 42 HB1 ASP 42 16.816 -8.883 15.343 346 H TYR 43 HN TYR 43 19.033 -8.843 16.585 347 HA TYR 43 HA TYR 43 18.108 -9.674 19.277 348 HB2 TYR 43 HB2 TYR 43 19.734 -11.272 17.294 349 HB3 TYR 43 HB1 TYR 43 18.945 -11.832 18.768 350 HD1 TYR 43 HD2 TYR 43 16.434 -11.809 18.944 351 HD2 TYR 43 HD1 TYR 43 18.495 -10.982 15.275 352 HE1 TYR 43 HE2 TYR 43 14.335 -12.141 17.683 353 HE2 TYR 43 HE1 TYR 43 16.399 -11.308 14.015 354 HH TYR 43 HH TYR 43 13.735 -10.986 15.076 355 H GLY 44 HN GLY 44 20.646 -7.968 17.874 356 HA2 GLY 44 HA2 GLY 44 22.640 -7.211 18.826 357 HA3 GLY 44 HA1 GLY 44 22.216 -8.096 20.277 358 H PHE 45 HN PHE 45 22.006 -10.035 17.547 359 HA PHE 45 HA PHE 45 23.854 -11.916 18.390 360 HB2 PHE 45 HB2 PHE 45 22.620 -11.364 15.711 361 HB3 PHE 45 HB1 PHE 45 23.823 -12.637 15.908 362 HD1 PHE 45 HD1 PHE 45 21.826 -12.036 18.902 363 HD2 PHE 45 HD2 PHE 45 21.902 -14.149 15.144 364 HE1 PHE 45 HE1 PHE 45 20.085 -13.579 19.723 365 HE2 PHE 45 HE2 PHE 45 20.156 -15.683 15.987 366 HZ PHE 45 HZ PHE 45 19.247 -15.399 18.274 367 HA PRO 46 HA PRO 46 27.586 -9.479 17.406 368 HB2 PRO 46 HB2 PRO 46 29.330 -11.285 18.519 369 HB3 PRO 46 HB1 PRO 46 28.445 -10.066 19.444 370 HG2 PRO 46 HG2 PRO 46 27.783 -12.942 19.062 371 HG3 PRO 46 HG1 PRO 46 27.721 -11.985 20.540 372 HD2 PRO 46 HD2 PRO 46 25.495 -12.516 19.215 373 HD3 PRO 46 HD1 PRO 46 25.723 -10.921 19.960 374 HA PRO 47 HA PRO 47 28.981 -11.344 13.665 375 HB2 PRO 47 HB2 PRO 47 31.718 -11.233 13.874 376 HB3 PRO 47 HB1 PRO 47 30.699 -9.852 13.402 377 HG2 PRO 47 HG2 PRO 47 31.889 -10.511 16.067 378 HG3 PRO 47 HG1 PRO 47 31.709 -8.940 15.273 379 HD2 PRO 47 HD2 PRO 47 30.040 -9.620 17.226 380 HD3 PRO 47 HD1 PRO 47 29.442 -8.745 15.801 381 H VAL 48 HN VAL 48 30.542 -12.528 16.576 382 HA VAL 48 HA VAL 48 31.522 -14.957 15.484 383 HB VAL 48 HB VAL 48 32.351 -14.166 17.626 384 HG11 VAL 48 HG11 VAL 48 29.917 -13.253 18.222 385 HG12 VAL 48 HG12 VAL 48 31.063 -13.691 19.478 386 HG13 VAL 48 HG13 VAL 48 29.788 -14.808 19.049 387 HG21 VAL 48 HG21 VAL 48 30.809 -16.549 18.545 388 HG22 VAL 48 HG22 VAL 48 32.540 -16.241 18.603 389 HG23 VAL 48 HG23 VAL 48 31.793 -16.762 17.095 390 H LEU 49 HN LEU 49 28.523 -14.064 17.069 391 HA LEU 49 HA LEU 49 27.325 -16.678 16.745 392 HB2 LEU 49 HB2 LEU 49 26.131 -14.017 17.509 393 HB3 LEU 49 HB1 LEU 49 25.226 -15.522 17.497 394 HG LEU 49 HG LEU 49 27.700 -14.980 19.191 395 HD11 LEU 49 HD11 LEU 49 25.476 -15.575 20.800 396 HD12 LEU 49 HD12 LEU 49 24.900 -14.387 19.650 397 HD13 LEU 49 HD13 LEU 49 26.313 -14.040 20.660 398 HD21 LEU 49 HD21 LEU 49 27.574 -17.146 19.987 399 HD22 LEU 49 HD22 LEU 49 26.984 -17.491 18.377 400 HD23 LEU 49 HD23 LEU 49 25.863 -17.281 19.710 401 H GLN 50 HN GLN 50 27.241 -13.645 15.040 402 HA GLN 50 HA GLN 50 25.072 -14.301 13.372 403 HB2 GLN 50 HB2 GLN 50 26.041 -11.968 13.882 404 HB3 GLN 50 HB1 GLN 50 27.221 -12.329 12.628 405 HG2 GLN 50 HG2 GLN 50 25.395 -11.126 11.587 406 HG3 GLN 50 HG1 GLN 50 25.319 -12.805 11.055 407 HE21 GLN 50 HE21 GLN 50 24.128 -11.087 13.992 408 HE22 GLN 50 HE22 GLN 50 22.547 -11.703 13.846 409 H GLN 51 HN GLN 51 26.592 -16.561 13.222 410 HA GLN 51 HA GLN 51 27.926 -16.451 10.595 411 HB2 GLN 51 HB2 GLN 51 27.798 -18.672 12.640 412 HB3 GLN 51 HB1 GLN 51 28.606 -18.789 11.080 413 HG2 GLN 51 HG2 GLN 51 30.015 -16.806 11.722 414 HG3 GLN 51 HG1 GLN 51 29.273 -16.851 13.310 415 HE21 GLN 51 HE21 GLN 51 29.420 -20.018 12.330 416 HE22 GLN 51 HE22 GLN 51 30.908 -20.454 13.016 417 H TRP 52 HN TRP 52 26.594 -16.617 8.954 418 HA TRP 52 HA TRP 52 24.105 -18.135 9.143 419 HB2 TRP 52 HB2 TRP 52 25.250 -16.204 7.132 420 HB3 TRP 52 HB1 TRP 52 23.843 -17.191 6.774 421 HD1 TRP 52 HD1 TRP 52 24.850 -15.154 9.932 422 HE1 TRP 52 HE1 TRP 52 22.811 -13.723 10.621 423 HE3 TRP 52 HE3 TRP 52 21.613 -16.442 6.218 424 HZ2 TRP 52 HZ2 TRP 52 20.145 -13.203 9.673 425 HZ3 TRP 52 HZ3 TRP 52 19.348 -15.471 6.121 426 HH2 TRP 52 HH2 TRP 52 18.608 -13.849 7.850 427 H VAL 53 HN VAL 53 23.635 -19.959 8.023 428 HA VAL 53 HA VAL 53 25.708 -21.034 6.225 429 HB VAL 53 HB VAL 53 24.032 -22.476 8.289 430 HG11 VAL 53 HG11 VAL 53 25.567 -23.513 5.918 431 HG12 VAL 53 HG12 VAL 53 23.996 -24.026 6.542 432 HG13 VAL 53 HG13 VAL 53 25.467 -24.479 7.386 433 HG21 VAL 53 HG21 VAL 53 26.307 -23.225 9.087 434 HG22 VAL 53 HG22 VAL 53 26.049 -21.487 9.235 435 HG23 VAL 53 HG23 VAL 53 27.033 -22.122 7.921 436 H ILE 54 HN ILE 54 24.915 -21.508 4.231 437 HA ILE 54 HA ILE 54 21.988 -21.753 3.924 438 HB ILE 54 HB ILE 54 23.913 -20.445 1.976 439 HG12 ILE 54 HG12 ILE 54 23.485 -19.039 3.982 440 HG13 ILE 54 HG11 ILE 54 22.698 -18.354 2.566 441 HG21 ILE 54 HG21 ILE 54 22.150 -21.445 0.726 442 HG22 ILE 54 HG22 ILE 54 21.708 -19.752 0.879 443 HG23 ILE 54 HG23 ILE 54 20.930 -20.966 1.898 444 HD11 ILE 54 HD11 ILE 54 21.532 -19.369 5.031 445 HD12 ILE 54 HD12 ILE 54 20.759 -20.088 3.631 446 HD13 ILE 54 HD13 ILE 54 20.809 -18.329 3.817 447 H GLY 55 HN GLY 55 21.279 -23.536 2.976 448 HA2 GLY 55 HA2 GLY 55 23.067 -25.637 2.244 449 HA3 GLY 55 HA1 GLY 55 21.316 -25.621 2.066 450 H GLN 56 HN GLN 56 20.933 -23.462 0.427 451 HA GLN 56 HA GLN 56 21.178 -24.648 -2.072 452 HB2 GLN 56 HB2 GLN 56 20.852 -21.663 -1.746 453 HB3 GLN 56 HB1 GLN 56 20.186 -22.718 -2.984 454 HG2 GLN 56 HG2 GLN 56 19.364 -22.585 -0.064 455 HG3 GLN 56 HG1 GLN 56 18.415 -22.166 -1.466 456 HE21 GLN 56 HE21 GLN 56 17.339 -23.842 -2.590 457 HE22 GLN 56 HE22 GLN 56 17.393 -25.470 -2.106 458 H ARG 57 HN ARG 57 23.074 -21.971 -0.726 459 HA ARG 57 HA ARG 57 25.274 -22.582 -2.542 460 HB2 ARG 57 HB2 ARG 57 23.885 -19.909 -2.423 461 HB3 ARG 57 HB1 ARG 57 25.509 -20.088 -3.038 462 HG2 ARG 57 HG2 ARG 57 24.682 -21.697 -4.753 463 HG3 ARG 57 HG1 ARG 57 23.034 -21.454 -4.165 464 HD2 ARG 57 HD2 ARG 57 23.496 -19.989 -6.096 465 HD3 ARG 57 HD1 ARG 57 23.194 -19.047 -4.633 466 HE ARG 57 HE ARG 57 25.983 -19.722 -5.305 467 HH11 ARG 57 HH21 ARG 57 23.445 -17.316 -5.302 468 HH12 ARG 57 HH22 ARG 57 24.563 -15.995 -5.202 469 HH21 ARG 57 HH11 ARG 57 27.405 -17.956 -5.198 470 HH22 ARG 57 HH12 ARG 57 26.797 -16.353 -5.122 471 H LEU 58 HN LEU 58 26.921 -20.531 -2.027 472 HA LEU 58 HA LEU 58 27.842 -21.016 0.634 473 HB2 LEU 58 HB2 LEU 58 28.561 -18.836 -1.337 474 HB3 LEU 58 HB1 LEU 58 29.461 -19.250 0.117 475 HG LEU 58 HG LEU 58 28.962 -21.191 -2.183 476 HD11 LEU 58 HD11 LEU 58 31.539 -19.792 -1.452 477 HD12 LEU 58 HD12 LEU 58 30.470 -19.246 -2.734 478 HD13 LEU 58 HD13 LEU 58 31.226 -20.839 -2.833 479 HD21 LEU 58 HD21 LEU 58 30.683 -21.335 0.322 480 HD22 LEU 58 HD22 LEU 58 30.727 -22.491 -1.015 481 HD23 LEU 58 HD23 LEU 58 29.270 -22.328 -0.060 482 H ALA 59 HN ALA 59 27.383 -19.917 2.431 483 HA ALA 59 HA ALA 59 25.203 -18.062 2.446 484 HB1 ALA 59 HB1 ALA 59 25.727 -17.879 4.892 485 HB2 ALA 59 HB2 ALA 59 27.119 -18.919 4.627 486 HB3 ALA 59 HB3 ALA 59 25.496 -19.536 4.343 487 H ARG 60 HN ARG 60 26.880 -16.927 0.746 488 HA ARG 60 HA ARG 60 28.746 -15.242 2.049 489 HB2 ARG 60 HB2 ARG 60 29.038 -15.890 -0.361 490 HB3 ARG 60 HB1 ARG 60 27.679 -14.827 -0.738 491 HG2 ARG 60 HG2 ARG 60 29.813 -13.645 -1.095 492 HG3 ARG 60 HG1 ARG 60 28.892 -12.888 0.180 493 HD2 ARG 60 HD2 ARG 60 31.499 -13.516 0.439 494 HD3 ARG 60 HD1 ARG 60 30.438 -13.451 1.819 495 HE ARG 60 HE ARG 60 31.133 -15.958 0.355 496 HH11 ARG 60 HH21 ARG 60 30.455 -14.232 3.434 497 HH12 ARG 60 HH22 ARG 60 30.609 -15.675 4.313 498 HH21 ARG 60 HH11 ARG 60 31.320 -17.799 1.694 499 HH22 ARG 60 HH12 ARG 60 31.078 -17.683 3.378 500 H ASP 61 HN ASP 61 28.677 -13.342 2.787 501 HA ASP 61 HA ASP 61 26.295 -12.371 3.824 502 HB2 ASP 61 HB2 ASP 61 28.818 -10.758 3.564 503 HB3 ASP 61 HB1 ASP 61 27.624 -10.742 4.837 504 H GLN 62 HN GLN 62 28.397 -11.133 1.296 505 HA GLN 62 HA GLN 62 26.977 -8.735 0.942 506 HB2 GLN 62 HB2 GLN 62 29.067 -10.035 -0.803 507 HB3 GLN 62 HB1 GLN 62 28.412 -8.422 -1.071 508 HG2 GLN 62 HG2 GLN 62 29.097 -7.697 1.156 509 HG3 GLN 62 HG1 GLN 62 29.674 -9.306 1.543 510 HE21 GLN 62 HE21 GLN 62 31.669 -7.753 1.909 511 HE22 GLN 62 HE22 GLN 62 32.729 -7.597 0.604 512 H GLU 63 HN GLU 63 26.631 -11.797 -0.736 513 HA GLU 63 HA GLU 63 25.300 -10.783 -2.973 514 HB2 GLU 63 HB2 GLU 63 25.229 -13.515 -1.719 515 HB3 GLU 63 HB1 GLU 63 24.192 -13.107 -3.076 516 HG2 GLU 63 HG2 GLU 63 26.347 -12.238 -4.240 517 HG3 GLU 63 HG1 GLU 63 27.214 -13.134 -3.001 518 H THR 64 HN THR 64 23.176 -10.811 -3.629 519 HA THR 64 HA THR 64 21.378 -9.589 -1.887 520 HB THR 64 HB THR 64 20.200 -10.893 -4.248 521 HG1 THR 64 HG1 THR 64 21.466 -9.470 -5.641 522 HG21 THR 64 HG21 THR 64 20.580 -7.977 -3.529 523 HG22 THR 64 HG22 THR 64 19.259 -8.983 -2.949 524 HG23 THR 64 HG23 THR 64 19.419 -8.655 -4.676 525 H LEU 65 HN LEU 65 19.363 -10.465 -1.084 526 HA LEU 65 HA LEU 65 19.587 -13.018 0.085 527 HB2 LEU 65 HB2 LEU 65 17.102 -11.356 -0.373 528 HB3 LEU 65 HB1 LEU 65 17.183 -12.767 0.678 529 HG LEU 65 HG LEU 65 18.800 -10.217 0.996 530 HD11 LEU 65 HD11 LEU 65 16.417 -10.013 1.574 531 HD12 LEU 65 HD12 LEU 65 17.492 -9.803 2.950 532 HD13 LEU 65 HD13 LEU 65 16.626 -11.328 2.729 533 HD21 LEU 65 HD21 LEU 65 18.761 -12.789 2.633 534 HD22 LEU 65 HD22 LEU 65 19.443 -11.250 3.179 535 HD23 LEU 65 HD23 LEU 65 20.142 -12.058 1.797 536 H HIS 66 HN HIS 66 17.936 -11.954 -2.825 537 HA HIS 66 HA HIS 66 16.590 -14.303 -3.472 538 HB2 HIS 66 HB2 HIS 66 16.641 -12.019 -4.722 539 HB3 HIS 66 HB1 HIS 66 17.991 -12.711 -5.615 540 HD1 HIS 66 HD1 HIS 66 17.373 -15.313 -6.542 541 HD2 HIS 66 HD2 HIS 66 14.209 -12.658 -5.903 542 HE1 HIS 66 HE1 HIS 66 15.406 -16.158 -7.914 543 HE2 HIS 66 HE2 HIS 66 13.483 -14.544 -7.522 544 H SER 67 HN SER 67 20.021 -13.605 -3.518 545 HA SER 67 HA SER 67 20.894 -15.675 -5.212 546 HB2 SER 67 HB2 SER 67 22.274 -14.420 -2.801 547 HB3 SER 67 HB1 SER 67 22.991 -15.616 -3.818 548 HG SER 67 HG SER 67 23.579 -13.972 -4.841 549 H HIS 68 HN HIS 68 20.009 -15.655 -1.816 550 HA HIS 68 HA HIS 68 20.733 -18.399 -1.308 551 HB2 HIS 68 HB2 HIS 68 20.538 -17.104 0.654 552 HB3 HIS 68 HB1 HIS 68 19.054 -16.339 0.137 553 HD1 HIS 68 HD1 HIS 68 20.315 -19.162 2.103 554 HD2 HIS 68 HD2 HIS 68 16.732 -18.239 0.175 555 HE1 HIS 68 HE1 HIS 68 18.532 -20.731 3.038 556 HE2 HIS 68 HE2 HIS 68 16.337 -20.126 1.859 557 H GLY 69 HN GLY 69 18.322 -16.876 -3.109 558 HA2 GLY 69 HA2 GLY 69 16.871 -18.052 -4.521 559 HA3 GLY 69 HA1 GLY 69 16.825 -19.386 -3.378 560 H VAL 70 HN VAL 70 16.675 -16.431 -1.734 561 HA VAL 70 HA VAL 70 13.950 -16.889 -0.986 562 HB VAL 70 HB VAL 70 15.412 -14.282 -0.552 563 HG11 VAL 70 HG11 VAL 70 12.910 -15.229 0.195 564 HG12 VAL 70 HG12 VAL 70 13.766 -13.851 0.899 565 HG13 VAL 70 HG13 VAL 70 13.884 -15.433 1.651 566 HG21 VAL 70 HG21 VAL 70 16.370 -15.239 1.504 567 HG22 VAL 70 HG22 VAL 70 16.971 -16.122 0.099 568 HG23 VAL 70 HG23 VAL 70 15.689 -16.812 1.107 569 H ARG 71 HN ARG 71 13.038 -16.935 -3.027 570 HA ARG 71 HA ARG 71 12.930 -14.633 -4.762 571 HB2 ARG 71 HB2 ARG 71 11.213 -17.128 -4.635 572 HB3 ARG 71 HB1 ARG 71 11.195 -15.925 -5.924 573 HG2 ARG 71 HG2 ARG 71 13.092 -16.691 -6.870 574 HG3 ARG 71 HG1 ARG 71 13.923 -16.919 -5.334 575 HD2 ARG 71 HD2 ARG 71 11.759 -18.763 -6.404 576 HD3 ARG 71 HD1 ARG 71 13.483 -19.051 -6.571 577 HE ARG 71 HE ARG 71 13.256 -18.682 -3.906 578 HH11 ARG 71 HH21 ARG 71 11.544 -20.676 -6.224 579 HH12 ARG 71 HH22 ARG 71 11.139 -21.888 -5.097 580 HH21 ARG 71 HH11 ARG 71 12.714 -20.303 -2.392 581 HH22 ARG 71 HH12 ARG 71 11.824 -21.686 -2.871 582 H GLN 72 HN GLN 72 11.006 -16.114 -2.290 583 HA GLN 72 HA GLN 72 9.405 -13.714 -1.900 584 HB2 GLN 72 HB2 GLN 72 7.316 -15.108 -1.950 585 HB3 GLN 72 HB1 GLN 72 8.067 -14.894 -3.520 586 HG2 GLN 72 HG2 GLN 72 9.297 -17.227 -2.455 587 HG3 GLN 72 HG1 GLN 72 7.597 -17.331 -2.025 588 HE21 GLN 72 HE21 GLN 72 8.971 -15.834 -4.986 589 HE22 GLN 72 HE22 GLN 72 8.177 -16.883 -6.048 590 H ASN 73 HN ASN 73 7.846 -14.266 -0.000 591 HA ASN 73 HA ASN 73 9.435 -14.932 2.240 592 HB2 ASN 73 HB2 ASN 73 7.621 -14.391 3.527 593 HB3 ASN 73 HB1 ASN 73 7.024 -13.685 2.018 594 HD21 ASN 73 HD21 ASN 73 5.598 -15.234 0.738 595 HD22 ASN 73 HD22 ASN 73 4.623 -16.328 1.588 596 H GLY 74 HN GLY 74 9.123 -16.717 3.728 597 HA2 GLY 74 HA2 GLY 74 8.315 -18.896 4.214 598 HA3 GLY 74 HA1 GLY 74 8.034 -19.173 2.508 599 H ASP 75 HN ASP 75 10.905 -17.688 2.436 600 HA ASP 75 HA ASP 75 12.282 -20.185 2.166 601 HB2 ASP 75 HB2 ASP 75 12.692 -17.874 0.913 602 HB3 ASP 75 HB1 ASP 75 13.860 -17.669 2.209 603 H SER 76 HN SER 76 14.021 -20.876 3.325 604 HA SER 76 HA SER 76 14.139 -19.810 6.075 605 HB2 SER 76 HB2 SER 76 14.617 -22.436 6.533 606 HB3 SER 76 HB1 SER 76 13.038 -21.694 6.596 607 HG SER 76 HG SER 76 13.286 -23.621 5.233 608 H ALA 77 HN ALA 77 16.152 -19.909 7.134 609 HA ALA 77 HA ALA 77 18.465 -20.981 5.655 610 HB1 ALA 77 HB1 ALA 77 19.756 -18.920 6.370 611 HB2 ALA 77 HB2 ALA 77 18.210 -18.197 6.809 612 HB3 ALA 77 HB3 ALA 77 18.529 -18.636 5.133 613 H TYR 78 HN TYR 78 20.454 -21.046 7.133 614 HA TYR 78 HA TYR 78 19.590 -21.669 9.881 615 HB2 TYR 78 HB2 TYR 78 20.799 -23.406 7.985 616 HB3 TYR 78 HB1 TYR 78 22.004 -23.069 9.216 617 HD1 TYR 78 HD1 TYR 78 21.115 -23.085 11.733 618 HD2 TYR 78 HD2 TYR 78 19.200 -25.096 8.436 619 HE1 TYR 78 HE1 TYR 78 19.950 -24.561 13.308 620 HE2 TYR 78 HE2 TYR 78 18.037 -26.578 10.023 621 HH TYR 78 HH TYR 78 18.888 -26.704 13.378 622 H LEU 79 HN LEU 79 20.609 -20.756 11.507 623 HA LEU 79 HA LEU 79 23.022 -19.170 10.916 624 HB2 LEU 79 HB2 LEU 79 21.033 -17.842 11.617 625 HB3 LEU 79 HB1 LEU 79 20.968 -18.789 13.105 626 HG LEU 79 HG LEU 79 23.293 -18.001 13.632 627 HD11 LEU 79 HD11 LEU 79 23.319 -17.198 10.945 628 HD12 LEU 79 HD12 LEU 79 24.514 -16.839 12.193 629 HD13 LEU 79 HD13 LEU 79 23.216 -15.703 11.878 630 HD21 LEU 79 HD21 LEU 79 21.551 -15.595 13.142 631 HD22 LEU 79 HD22 LEU 79 22.599 -15.957 14.510 632 HD23 LEU 79 HD23 LEU 79 21.066 -16.812 14.329 633 H TYR 80 HN TYR 80 24.840 -19.815 11.909 634 HA TYR 80 HA TYR 80 24.621 -21.954 13.931 635 HB2 TYR 80 HB2 TYR 80 25.929 -22.474 11.912 636 HB3 TYR 80 HB1 TYR 80 26.974 -21.091 12.231 637 HD1 TYR 80 HD1 TYR 80 25.980 -24.463 13.382 638 HD2 TYR 80 HD2 TYR 80 28.598 -21.121 14.037 639 HE1 TYR 80 HE1 TYR 80 27.350 -25.838 14.910 640 HE2 TYR 80 HE2 TYR 80 29.975 -22.509 15.562 641 HH TYR 80 HH TYR 80 30.276 -25.312 15.677 642 H LEU 81 HN LEU 81 24.992 -21.412 16.015 643 HA LEU 81 HA LEU 81 26.517 -18.955 16.509 644 HB2 LEU 81 HB2 LEU 81 24.194 -20.185 17.907 645 HB3 LEU 81 HB1 LEU 81 25.360 -19.284 18.878 646 HG LEU 81 HG LEU 81 25.105 -17.369 17.309 647 HD11 LEU 81 HD11 LEU 81 23.207 -19.266 15.963 648 HD12 LEU 81 HD12 LEU 81 24.503 -18.268 15.291 649 HD13 LEU 81 HD13 LEU 81 23.018 -17.508 15.843 650 HD21 LEU 81 HD21 LEU 81 22.765 -16.774 17.970 651 HD22 LEU 81 HD22 LEU 81 23.728 -17.370 19.318 652 HD23 LEU 81 HD23 LEU 81 22.540 -18.426 18.550 653 H LEU 82 HN LEU 82 28.315 -18.978 17.561 654 HA LEU 82 HA LEU 82 29.522 -21.467 18.428 655 HB2 LEU 82 HB2 LEU 82 30.442 -18.584 18.460 656 HB3 LEU 82 HB1 LEU 82 31.368 -19.842 19.242 657 HG LEU 82 HG LEU 82 32.155 -19.340 16.925 658 HD11 LEU 82 HD11 LEU 82 32.589 -21.524 17.919 659 HD12 LEU 82 HD12 LEU 82 32.332 -21.667 16.185 660 HD13 LEU 82 HD13 LEU 82 31.061 -22.146 17.298 661 HD21 LEU 82 HD21 LEU 82 30.822 -20.088 15.025 662 HD22 LEU 82 HD22 LEU 82 29.933 -18.856 15.909 663 HD23 LEU 82 HD23 LEU 82 29.491 -20.554 16.072 664 H SER 83 HN SER 83 30.666 -21.251 20.698 665 HA SER 83 HA SER 83 28.614 -21.116 22.649 666 HB2 SER 83 HB2 SER 83 31.540 -21.000 23.353 667 HB3 SER 83 HB1 SER 83 30.208 -21.814 24.158 668 HG SER 83 HG SER 83 30.867 -23.476 23.079 669 H ALA 84 HN ALA 84 28.150 -18.846 21.614 670 HA ALA 84 HA ALA 84 29.153 -16.847 23.522 671 HB1 ALA 84 HB1 ALA 84 30.180 -15.671 21.913 672 HB2 ALA 84 HB2 ALA 84 28.642 -15.492 21.088 673 HB3 ALA 84 HB3 ALA 84 29.701 -16.849 20.692 674 H ARG 85 HN ARG 85 27.703 -15.197 23.936 675 HA ARG 85 HA ARG 85 24.980 -15.485 22.910 676 HB2 ARG 85 HB2 ARG 85 25.836 -16.057 25.691 677 HB3 ARG 85 HB1 ARG 85 24.309 -15.196 25.483 678 HG2 ARG 85 HG2 ARG 85 23.362 -16.914 24.187 679 HG3 ARG 85 HG1 ARG 85 24.912 -17.664 23.850 680 HD2 ARG 85 HD2 ARG 85 23.800 -17.468 26.655 681 HD3 ARG 85 HD1 ARG 85 23.409 -18.827 25.622 682 HE ARG 85 HE ARG 85 25.848 -18.404 27.037 683 HH11 ARG 85 HH21 ARG 85 24.580 -19.488 24.019 684 HH12 ARG 85 HH22 ARG 85 25.735 -20.665 23.660 685 HH21 ARG 85 HH11 ARG 85 27.520 -19.967 26.695 686 HH22 ARG 85 HH12 ARG 85 27.510 -20.951 25.294 687 H ASN 86 HN ASN 86 23.571 -13.779 23.353 688 HA ASN 86 HA ASN 86 24.818 -11.248 22.878 689 HB2 ASN 86 HB2 ASN 86 21.895 -11.815 23.414 690 HB3 ASN 86 HB1 ASN 86 22.592 -10.406 22.623 691 HD21 ASN 86 HD21 ASN 86 21.358 -13.538 22.031 692 HD22 ASN 86 HD22 ASN 86 21.911 -13.680 20.428 693 H THR 87 HN THR 87 25.470 -12.313 25.430 694 HA THR 87 HA THR 87 24.987 -10.026 27.060 695 HB THR 87 HB THR 87 23.826 -12.667 28.035 696 HG1 THR 87 HG1 THR 87 22.808 -10.694 26.482 697 HG21 THR 87 HG21 THR 87 23.073 -11.401 29.936 698 HG22 THR 87 HG22 THR 87 23.626 -9.881 29.232 699 HG23 THR 87 HG23 THR 87 24.787 -11.077 29.758 700 H SER 88 HN SER 88 27.253 -10.390 26.350 701 HA SER 88 HA SER 88 28.781 -12.536 27.375 702 HB2 SER 88 HB2 SER 88 29.851 -9.880 26.451 703 HB3 SER 88 HB1 SER 88 30.632 -11.445 26.414 704 HG SER 88 HG SER 88 29.661 -11.858 24.628 705 H LEU 89 HN LEU 89 30.502 -12.458 28.862 706 HA LEU 89 HA LEU 89 30.033 -11.039 31.292 707 HB2 LEU 89 HB2 LEU 89 32.477 -12.542 30.302 708 HB3 LEU 89 HB1 LEU 89 32.289 -11.915 31.933 709 HG LEU 89 HG LEU 89 30.423 -13.927 30.631 710 HD11 LEU 89 HD11 LEU 89 31.784 -14.904 32.963 711 HD12 LEU 89 HD12 LEU 89 32.989 -14.319 31.846 712 HD13 LEU 89 HD13 LEU 89 31.828 -15.548 31.334 713 HD21 LEU 89 HD21 LEU 89 30.481 -12.523 33.307 714 HD22 LEU 89 HD22 LEU 89 29.824 -14.147 33.186 715 HD23 LEU 89 HD23 LEU 89 29.107 -12.843 32.246 716 H ASN 90 HN ASN 90 31.875 -10.541 28.411 717 HA ASN 90 HA ASN 90 33.865 -8.864 28.955 718 HB2 ASN 90 HB2 ASN 90 31.948 -8.146 26.741 719 HB3 ASN 90 HB1 ASN 90 33.683 -7.906 26.786 720 HD21 ASN 90 HD21 ASN 90 33.524 -9.202 24.628 721 HD22 ASN 90 HD22 ASN 90 33.541 -10.892 24.752 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 -1.602 -3.280 3.358 2 H2 MET 1 HT2 MET 1 -0.743 -1.930 3.921 3 H3 MET 1 HT3 MET 1 0.007 -3.453 3.800 4 HA MET 1 HA MET 1 -1.122 -2.254 1.391 5 HB2 MET 1 HB2 MET 1 1.617 -1.720 2.572 6 HB3 MET 1 HB1 MET 1 1.140 -1.289 0.943 7 HG2 MET 1 HG2 MET 1 0.383 0.689 1.768 8 HG3 MET 1 HG1 MET 1 -0.906 -0.186 2.554 9 HE1 MET 1 HE1 MET 1 2.708 0.670 2.569 10 HE2 MET 1 HE2 MET 1 3.055 -0.647 3.683 11 HE3 MET 1 HE3 MET 1 3.164 1.005 4.244 12 HA PRO 2 HA PRO 2 0.347 -6.405 0.232 13 HB2 PRO 2 HB2 PRO 2 0.490 -5.182 -2.482 14 HB3 PRO 2 HB1 PRO 2 -0.334 -6.653 -1.942 15 HG2 PRO 2 HG2 PRO 2 -1.776 -4.526 -2.464 16 HG3 PRO 2 HG1 PRO 2 -2.138 -5.506 -1.034 17 HD2 PRO 2 HD2 PRO 2 -0.671 -2.902 -1.181 18 HD3 PRO 2 HD1 PRO 2 -1.922 -3.423 -0.017 19 H THR 3 HN THR 3 1.837 -3.423 -0.970 20 HA THR 3 HA THR 3 4.268 -4.551 -1.806 21 HB THR 3 HB THR 3 4.770 -1.860 -1.266 22 HG1 THR 3 HG1 THR 3 2.828 -1.084 -0.898 23 HG21 THR 3 HG21 THR 3 3.479 -3.083 -3.733 24 HG22 THR 3 HG22 THR 3 5.199 -3.133 -3.359 25 HG23 THR 3 HG23 THR 3 4.423 -1.598 -3.669 26 H GLN 4 HN GLN 4 4.175 -5.837 0.352 27 HA GLN 4 HA GLN 4 5.674 -4.510 2.513 28 HB2 GLN 4 HB2 GLN 4 4.613 -7.344 2.240 29 HB3 GLN 4 HB1 GLN 4 5.518 -6.750 3.617 30 HG2 GLN 4 HG2 GLN 4 3.770 -5.058 4.056 31 HG3 GLN 4 HG1 GLN 4 2.881 -5.653 2.648 32 HE21 GLN 4 HE21 GLN 4 1.116 -6.801 3.476 33 HE22 GLN 4 HE22 GLN 4 1.224 -7.989 4.682 34 H ASP 5 HN ASP 5 7.561 -5.727 3.304 35 HA ASP 5 HA ASP 5 9.406 -6.605 1.234 36 HB2 ASP 5 HB2 ASP 5 9.456 -6.419 4.253 37 HB3 ASP 5 HB1 ASP 5 10.666 -7.365 3.435 38 H ILE 6 HN ILE 6 10.418 -8.951 2.560 39 HA ILE 6 HA ILE 6 8.031 -10.637 2.749 40 HB ILE 6 HB ILE 6 9.193 -12.459 1.689 41 HG12 ILE 6 HG12 ILE 6 11.377 -10.529 0.888 42 HG13 ILE 6 HG11 ILE 6 11.564 -11.609 2.285 43 HG21 ILE 6 HG21 ILE 6 9.475 -11.338 -0.658 44 HG22 ILE 6 HG22 ILE 6 9.029 -9.859 0.152 45 HG23 ILE 6 HG23 ILE 6 7.892 -11.220 0.118 46 HD11 ILE 6 HD11 ILE 6 11.386 -13.519 0.901 47 HD12 ILE 6 HD12 ILE 6 12.486 -12.415 0.055 48 HD13 ILE 6 HD13 ILE 6 10.810 -12.572 -0.471 49 H ARG 7 HN ARG 7 8.198 -12.392 4.110 50 HA ARG 7 HA ARG 7 10.009 -11.808 6.325 51 HB2 ARG 7 HB2 ARG 7 7.444 -13.420 6.223 52 HB3 ARG 7 HB1 ARG 7 8.421 -13.157 7.661 53 HG2 ARG 7 HG2 ARG 7 8.240 -10.709 7.398 54 HG3 ARG 7 HG1 ARG 7 7.307 -10.992 5.932 55 HD2 ARG 7 HD2 ARG 7 5.465 -12.012 7.204 56 HD3 ARG 7 HD1 ARG 7 6.410 -11.924 8.674 57 HE ARG 7 HE ARG 7 5.845 -9.696 8.887 58 HH11 ARG 7 HH21 ARG 7 5.222 -10.724 5.584 59 HH12 ARG 7 HH22 ARG 7 4.397 -9.287 5.176 60 HH21 ARG 7 HH11 ARG 7 4.710 -7.756 8.258 61 HH22 ARG 7 HH12 ARG 7 4.110 -7.653 6.652 62 H LEU 8 HN LEU 8 11.644 -12.960 6.780 63 HA LEU 8 HA LEU 8 12.006 -15.613 5.568 64 HB2 LEU 8 HB2 LEU 8 13.611 -13.948 4.804 65 HB3 LEU 8 HB1 LEU 8 13.965 -13.494 6.460 66 HG LEU 8 HG LEU 8 14.762 -15.885 6.863 67 HD11 LEU 8 HD11 LEU 8 13.690 -16.240 4.239 68 HD12 LEU 8 HD12 LEU 8 14.424 -17.410 5.342 69 HD13 LEU 8 HD13 LEU 8 15.430 -16.553 4.194 70 HD21 LEU 8 HD21 LEU 8 16.274 -14.451 4.665 71 HD22 LEU 8 HD22 LEU 8 16.932 -15.498 5.927 72 HD23 LEU 8 HD23 LEU 8 16.262 -13.921 6.348 73 H TRP 9 HN TRP 9 12.293 -17.306 6.909 74 HA TRP 9 HA TRP 9 12.523 -16.806 9.824 75 HB2 TRP 9 HB2 TRP 9 12.258 -19.511 8.519 76 HB3 TRP 9 HB1 TRP 9 11.914 -19.066 10.179 77 HD1 TRP 9 HD1 TRP 9 10.061 -16.629 9.829 78 HE1 TRP 9 HE1 TRP 9 7.695 -16.921 8.765 79 HE3 TRP 9 HE3 TRP 9 10.779 -20.956 7.319 80 HZ2 TRP 9 HZ2 TRP 9 6.343 -18.754 7.073 81 HZ3 TRP 9 HZ3 TRP 9 9.011 -21.975 5.981 82 HH2 TRP 9 HH2 TRP 9 6.743 -20.873 5.845 83 H VAL 10 HN VAL 10 14.410 -17.217 10.823 84 HA VAL 10 HA VAL 10 16.468 -18.626 9.249 85 HB VAL 10 HB VAL 10 16.954 -16.484 11.323 86 HG11 VAL 10 HG11 VAL 10 19.273 -16.579 10.402 87 HG12 VAL 10 HG12 VAL 10 18.805 -17.991 9.458 88 HG13 VAL 10 HG13 VAL 10 18.787 -18.063 11.218 89 HG21 VAL 10 HG21 VAL 10 17.488 -15.002 9.520 90 HG22 VAL 10 HG22 VAL 10 15.915 -15.677 9.122 91 HG23 VAL 10 HG23 VAL 10 17.373 -16.286 8.327 92 H SER 11 HN SER 11 17.104 -20.459 10.101 93 HA SER 11 HA SER 11 16.190 -21.229 12.754 94 HB2 SER 11 HB2 SER 11 17.944 -22.810 10.880 95 HB3 SER 11 HB1 SER 11 16.932 -23.427 12.169 96 HG SER 11 HG SER 11 15.654 -23.691 10.486 97 H VAL 12 HN VAL 12 17.387 -20.893 14.521 98 HA VAL 12 HA VAL 12 20.255 -20.337 14.147 99 HB VAL 12 HB VAL 12 18.236 -19.318 16.138 100 HG11 VAL 12 HG11 VAL 12 20.129 -17.983 17.080 101 HG12 VAL 12 HG12 VAL 12 21.245 -18.934 16.108 102 HG13 VAL 12 HG13 VAL 12 20.288 -19.709 17.371 103 HG21 VAL 12 HG21 VAL 12 18.333 -17.316 15.004 104 HG22 VAL 12 HG22 VAL 12 18.729 -18.365 13.654 105 HG23 VAL 12 HG23 VAL 12 20.015 -17.533 14.536 106 H GLU 13 HN GLU 13 21.658 -21.620 15.128 107 HA GLU 13 HA GLU 13 20.695 -23.371 17.297 108 HB2 GLU 13 HB2 GLU 13 22.585 -24.042 15.054 109 HB3 GLU 13 HB1 GLU 13 22.335 -25.075 16.445 110 HG2 GLU 13 HG2 GLU 13 19.899 -25.233 15.919 111 HG3 GLU 13 HG1 GLU 13 20.128 -24.163 14.570 112 H ASP 14 HN ASP 14 21.817 -23.271 19.099 113 HA ASP 14 HA ASP 14 24.170 -21.556 19.281 114 HB2 ASP 14 HB2 ASP 14 22.309 -21.481 20.965 115 HB3 ASP 14 HB1 ASP 14 22.815 -23.090 21.493 116 H ALA 15 HN ALA 15 26.088 -22.252 20.120 117 HA ALA 15 HA ALA 15 27.129 -24.865 19.506 118 HB1 ALA 15 HB1 ALA 15 28.891 -23.370 19.750 119 HB2 ALA 15 HB2 ALA 15 28.852 -24.067 21.369 120 HB3 ALA 15 HB3 ALA 15 28.083 -22.513 21.068 121 H GLN 16 HN GLN 16 25.477 -23.414 22.146 122 HA GLN 16 HA GLN 16 25.851 -25.605 24.008 123 HB2 GLN 16 HB2 GLN 16 23.801 -23.359 24.023 124 HB3 GLN 16 HB1 GLN 16 24.111 -24.481 25.349 125 HG2 GLN 16 HG2 GLN 16 26.150 -22.558 24.176 126 HG3 GLN 16 HG1 GLN 16 25.287 -22.332 25.688 127 HE21 GLN 16 HE21 GLN 16 28.247 -23.301 24.607 128 HE22 GLN 16 HE22 GLN 16 28.664 -24.396 25.815 129 H MET 17 HN MET 17 24.680 -25.859 21.167 130 HA MET 17 HA MET 17 23.122 -27.028 20.055 131 HB2 MET 17 HB2 MET 17 23.171 -28.602 22.623 132 HB3 MET 17 HB1 MET 17 22.299 -29.125 21.183 133 HG2 MET 17 HG2 MET 17 24.404 -29.066 19.886 134 HG3 MET 17 HG1 MET 17 25.271 -28.541 21.319 135 HE1 MET 17 HE1 MET 17 26.288 -31.550 19.944 136 HE2 MET 17 HE2 MET 17 26.830 -31.733 21.601 137 HE3 MET 17 HE3 MET 17 26.834 -30.138 20.869 138 H HIS 18 HN HIS 18 22.220 -24.727 21.198 139 HA HIS 18 HA HIS 18 19.447 -25.382 21.986 140 HB2 HIS 18 HB2 HIS 18 21.128 -22.889 22.412 141 HB3 HIS 18 HB1 HIS 18 19.379 -22.833 22.430 142 HD1 HIS 18 HD1 HIS 18 21.929 -25.282 24.003 143 HD2 HIS 18 HD2 HIS 18 18.501 -23.087 25.008 144 HE1 HIS 18 HE1 HIS 18 21.409 -25.803 26.406 145 HE2 HIS 18 HE2 HIS 18 19.333 -24.494 27.038 146 H THR 19 HN THR 19 17.850 -24.964 20.636 147 HA THR 19 HA THR 19 18.614 -23.944 17.972 148 HB THR 19 HB THR 19 16.302 -25.755 18.672 149 HG1 THR 19 HG1 THR 19 18.236 -26.688 19.308 150 HG21 THR 19 HG21 THR 19 16.476 -24.469 16.416 151 HG22 THR 19 HG22 THR 19 16.196 -26.189 16.356 152 HG23 THR 19 HG23 THR 19 17.812 -25.558 16.055 153 H VAL 20 HN VAL 20 17.643 -22.131 17.257 154 HA VAL 20 HA VAL 20 15.078 -21.320 18.450 155 HB VAL 20 HB VAL 20 17.396 -19.428 17.987 156 HG11 VAL 20 HG11 VAL 20 14.661 -19.137 19.255 157 HG12 VAL 20 HG12 VAL 20 15.322 -18.235 17.883 158 HG13 VAL 20 HG13 VAL 20 15.962 -17.979 19.490 159 HG21 VAL 20 HG21 VAL 20 17.310 -19.374 20.579 160 HG22 VAL 20 HG22 VAL 20 18.126 -20.735 19.818 161 HG23 VAL 20 HG23 VAL 20 16.486 -20.927 20.450 162 H THR 21 HN THR 21 13.906 -19.806 17.204 163 HA THR 21 HA THR 21 14.622 -19.675 14.346 164 HB THR 21 HB THR 21 11.825 -19.914 15.509 165 HG1 THR 21 HG1 THR 21 12.811 -21.907 15.525 166 HG21 THR 21 HG21 THR 21 11.349 -20.226 12.947 167 HG22 THR 21 HG22 THR 21 12.893 -19.425 12.728 168 HG23 THR 21 HG23 THR 21 11.596 -18.608 13.576 169 H ILE 22 HN ILE 22 14.618 -17.654 13.529 170 HA ILE 22 HA ILE 22 13.327 -15.530 15.103 171 HB ILE 22 HB ILE 22 15.146 -14.019 14.507 172 HG12 ILE 22 HG12 ILE 22 16.555 -16.491 13.440 173 HG13 ILE 22 HG11 ILE 22 15.841 -15.218 12.437 174 HG21 ILE 22 HG21 ILE 22 16.336 -16.487 15.796 175 HG22 ILE 22 HG22 ILE 22 15.200 -15.421 16.634 176 HG23 ILE 22 HG23 ILE 22 16.750 -14.800 16.083 177 HD11 ILE 22 HD11 ILE 22 17.314 -13.567 13.690 178 HD12 ILE 22 HD12 ILE 22 18.171 -14.687 12.625 179 HD13 ILE 22 HD13 ILE 22 18.143 -14.965 14.370 180 H TRP 23 HN TRP 23 12.654 -13.699 13.834 181 HA TRP 23 HA TRP 23 11.970 -14.527 11.082 182 HB2 TRP 23 HB2 TRP 23 10.445 -12.930 13.137 183 HB3 TRP 23 HB1 TRP 23 10.024 -12.891 11.434 184 HD1 TRP 23 HD1 TRP 23 8.659 -14.850 10.492 185 HE1 TRP 23 HE1 TRP 23 7.813 -17.099 11.441 186 HE3 TRP 23 HE3 TRP 23 11.114 -14.920 14.968 187 HZ2 TRP 23 HZ2 TRP 23 8.122 -18.696 13.767 188 HZ3 TRP 23 HZ3 TRP 23 10.817 -16.823 16.536 189 HH2 TRP 23 HH2 TRP 23 9.322 -18.710 15.940 190 H LEU 24 HN LEU 24 12.756 -13.401 9.505 191 HA LEU 24 HA LEU 24 13.681 -10.650 10.044 192 HB2 LEU 24 HB2 LEU 24 14.788 -12.822 8.303 193 HB3 LEU 24 HB1 LEU 24 15.167 -11.139 7.995 194 HG LEU 24 HG LEU 24 16.030 -10.879 10.318 195 HD11 LEU 24 HD11 LEU 24 15.037 -13.699 10.538 196 HD12 LEU 24 HD12 LEU 24 14.984 -12.371 11.710 197 HD13 LEU 24 HD13 LEU 24 16.482 -13.230 11.432 198 HD21 LEU 24 HD21 LEU 24 17.175 -12.771 8.350 199 HD22 LEU 24 HD22 LEU 24 17.796 -12.934 9.982 200 HD23 LEU 24 HD23 LEU 24 17.924 -11.386 9.156 201 H THR 25 HN THR 25 12.726 -9.127 8.890 202 HA THR 25 HA THR 25 11.035 -9.937 6.603 203 HB THR 25 HB THR 25 10.823 -7.335 8.130 204 HG1 THR 25 HG1 THR 25 10.561 -9.138 9.535 205 HG21 THR 25 HG21 THR 25 9.666 -8.129 5.772 206 HG22 THR 25 HG22 THR 25 8.969 -6.961 6.881 207 HG23 THR 25 HG23 THR 25 8.447 -8.635 6.939 208 H VAL 26 HN VAL 26 11.979 -9.560 4.709 209 HA VAL 26 HA VAL 26 13.412 -7.057 4.213 210 HB VAL 26 HB VAL 26 15.373 -8.361 3.320 211 HG11 VAL 26 HG11 VAL 26 16.452 -8.520 5.450 212 HG12 VAL 26 HG12 VAL 26 14.909 -8.785 6.264 213 HG13 VAL 26 HG13 VAL 26 15.284 -7.205 5.579 214 HG21 VAL 26 HG21 VAL 26 14.415 -10.568 3.112 215 HG22 VAL 26 HG22 VAL 26 13.963 -10.604 4.815 216 HG23 VAL 26 HG23 VAL 26 15.663 -10.657 4.350 217 H ARG 27 HN ARG 27 14.471 -7.481 1.864 218 HA ARG 27 HA ARG 27 12.361 -8.679 0.202 219 HB2 ARG 27 HB2 ARG 27 13.495 -7.156 -1.633 220 HB3 ARG 27 HB1 ARG 27 12.300 -6.485 -0.543 221 HG2 ARG 27 HG2 ARG 27 15.170 -6.442 0.287 222 HG3 ARG 27 HG1 ARG 27 14.635 -5.267 -0.906 223 HD2 ARG 27 HD2 ARG 27 12.623 -4.976 0.898 224 HD3 ARG 27 HD1 ARG 27 13.909 -5.508 1.972 225 HE ARG 27 HE ARG 27 14.859 -3.442 0.283 226 HH11 ARG 27 HH21 ARG 27 12.689 -4.042 2.969 227 HH12 ARG 27 HH22 ARG 27 12.885 -2.477 3.636 228 HH21 ARG 27 HH11 ARG 27 15.103 -1.328 1.204 229 HH22 ARG 27 HH12 ARG 27 14.250 -0.959 2.647 230 HA PRO 28 HA PRO 28 15.399 -11.622 -1.063 231 HB2 PRO 28 HB2 PRO 28 14.731 -11.957 -3.700 232 HB3 PRO 28 HB1 PRO 28 13.838 -12.666 -2.342 233 HG2 PRO 28 HG2 PRO 28 13.160 -10.211 -3.907 234 HG3 PRO 28 HG1 PRO 28 12.112 -11.504 -3.284 235 HD2 PRO 28 HD2 PRO 28 12.274 -9.146 -2.037 236 HD3 PRO 28 HD1 PRO 28 12.054 -10.651 -1.133 237 H ASP 29 HN ASP 29 15.014 -8.599 -2.484 238 HA ASP 29 HA ASP 29 17.176 -8.393 -4.319 239 HB2 ASP 29 HB2 ASP 29 15.205 -6.822 -3.983 240 HB3 ASP 29 HB1 ASP 29 16.093 -6.167 -2.611 241 H MET 30 HN MET 30 16.870 -8.103 -0.848 242 HA MET 30 HA MET 30 19.270 -6.764 -0.304 243 HB2 MET 30 HB2 MET 30 17.457 -8.495 1.331 244 HB3 MET 30 HB1 MET 30 18.996 -7.970 1.995 245 HG2 MET 30 HG2 MET 30 18.424 -5.651 1.680 246 HG3 MET 30 HG1 MET 30 16.961 -6.056 0.804 247 HE1 MET 30 HE1 MET 30 18.292 -7.944 4.239 248 HE2 MET 30 HE2 MET 30 17.949 -6.542 5.234 249 HE3 MET 30 HE3 MET 30 19.031 -6.375 3.863 250 H THR 31 HN THR 31 20.901 -7.849 1.216 251 HA THR 31 HA THR 31 21.910 -10.292 -0.074 252 HB THR 31 HB THR 31 23.222 -8.233 -0.625 253 HG1 THR 31 HG1 THR 31 24.164 -10.433 -0.253 254 HG21 THR 31 HG21 THR 31 24.565 -7.898 1.865 255 HG22 THR 31 HG22 THR 31 22.842 -7.708 2.159 256 HG23 THR 31 HG23 THR 31 23.642 -6.709 0.963 257 H VAL 32 HN VAL 32 23.233 -11.608 1.314 258 HA VAL 32 HA VAL 32 21.940 -12.137 3.756 259 HB VAL 32 HB VAL 32 24.614 -13.087 2.718 260 HG11 VAL 32 HG11 VAL 32 24.596 -13.363 5.133 261 HG12 VAL 32 HG12 VAL 32 24.310 -14.935 4.397 262 HG13 VAL 32 HG13 VAL 32 22.967 -14.030 5.084 263 HG21 VAL 32 HG21 VAL 32 22.952 -13.914 1.272 264 HG22 VAL 32 HG22 VAL 32 21.781 -14.103 2.594 265 HG23 VAL 32 HG23 VAL 32 23.144 -15.213 2.461 266 H ALA 33 HN ALA 33 25.010 -10.550 3.019 267 HA ALA 33 HA ALA 33 25.903 -10.192 5.631 268 HB1 ALA 33 HB1 ALA 33 27.250 -8.367 4.812 269 HB2 ALA 33 HB2 ALA 33 26.262 -8.200 3.365 270 HB3 ALA 33 HB3 ALA 33 27.231 -9.662 3.625 271 H SER 34 HN SER 34 23.801 -8.031 3.737 272 HA SER 34 HA SER 34 23.358 -6.163 5.853 273 HB2 SER 34 HB2 SER 34 21.421 -6.815 3.614 274 HB3 SER 34 HB1 SER 34 21.480 -5.363 4.589 275 HG SER 34 HG SER 34 22.612 -4.804 2.855 276 H LEU 35 HN LEU 35 21.684 -9.068 4.791 277 HA LEU 35 HA LEU 35 19.511 -8.993 6.579 278 HB2 LEU 35 HB2 LEU 35 19.634 -10.454 4.570 279 HB3 LEU 35 HB1 LEU 35 20.924 -11.361 5.352 280 HG LEU 35 HG LEU 35 19.426 -12.041 7.159 281 HD11 LEU 35 HD11 LEU 35 16.921 -11.498 6.738 282 HD12 LEU 35 HD12 LEU 35 17.536 -10.187 5.733 283 HD13 LEU 35 HD13 LEU 35 17.976 -10.277 7.447 284 HD21 LEU 35 HD21 LEU 35 19.487 -13.172 4.790 285 HD22 LEU 35 HD22 LEU 35 17.862 -12.482 4.643 286 HD23 LEU 35 HD23 LEU 35 18.235 -13.615 5.950 287 H LYS 36 HN LYS 36 22.706 -10.446 6.756 288 HA LYS 36 HA LYS 36 22.584 -11.755 9.219 289 HB2 LYS 36 HB2 LYS 36 24.353 -12.036 7.593 290 HB3 LYS 36 HB1 LYS 36 24.825 -10.353 7.761 291 HG2 LYS 36 HG2 LYS 36 24.962 -11.261 10.386 292 HG3 LYS 36 HG1 LYS 36 25.493 -12.665 9.456 293 HD2 LYS 36 HD2 LYS 36 26.546 -9.906 8.911 294 HD3 LYS 36 HD1 LYS 36 27.315 -10.953 10.089 295 HE2 LYS 36 HE2 LYS 36 27.696 -12.674 8.349 296 HE3 LYS 36 HE1 LYS 36 26.860 -11.687 7.157 297 HZ1 LYS 36 HZ1 LYS 36 29.485 -11.300 8.398 298 HZ2 LYS 36 HZ2 LYS 36 28.642 -9.921 7.890 299 HZ3 LYS 36 HZ3 LYS 36 29.022 -11.145 6.774 300 H ASP 37 HN ASP 37 23.495 -8.490 8.284 301 HA ASP 37 HA ASP 37 24.282 -7.519 10.792 302 HB2 ASP 37 HB2 ASP 37 24.904 -6.387 8.791 303 HB3 ASP 37 HB1 ASP 37 23.234 -6.060 8.362 304 H MET 38 HN MET 38 21.064 -7.423 9.235 305 HA MET 38 HA MET 38 19.865 -5.718 11.112 306 HB2 MET 38 HB2 MET 38 18.114 -7.890 10.264 307 HB3 MET 38 HB1 MET 38 17.910 -6.165 10.174 308 HG2 MET 38 HG2 MET 38 19.447 -6.073 8.248 309 HG3 MET 38 HG1 MET 38 19.538 -7.827 8.259 310 HE1 MET 38 HE1 MET 38 16.123 -9.163 7.747 311 HE2 MET 38 HE2 MET 38 15.958 -8.199 9.197 312 HE3 MET 38 HE3 MET 38 17.433 -9.098 8.927 313 H VAL 39 HN VAL 39 20.323 -9.145 11.104 314 HA VAL 39 HA VAL 39 18.651 -9.834 13.191 315 HB VAL 39 HB VAL 39 21.358 -11.027 12.550 316 HG11 VAL 39 HG11 VAL 39 19.484 -12.888 13.709 317 HG12 VAL 39 HG12 VAL 39 19.734 -11.558 14.825 318 HG13 VAL 39 HG13 VAL 39 21.107 -12.491 14.232 319 HG21 VAL 39 HG21 VAL 39 19.947 -11.267 10.638 320 HG22 VAL 39 HG22 VAL 39 18.529 -11.588 11.632 321 HG23 VAL 39 HG23 VAL 39 19.799 -12.796 11.500 322 H PHE 40 HN PHE 40 21.923 -8.554 13.355 323 HA PHE 40 HA PHE 40 22.116 -8.528 16.205 324 HB2 PHE 40 HB2 PHE 40 24.142 -8.207 14.998 325 HB3 PHE 40 HB1 PHE 40 23.443 -6.874 14.063 326 HD1 PHE 40 HD2 PHE 40 23.915 -7.822 17.695 327 HD2 PHE 40 HD1 PHE 40 24.004 -4.719 14.723 328 HE1 PHE 40 HE2 PHE 40 24.626 -6.199 19.406 329 HE2 PHE 40 HE1 PHE 40 24.705 -3.089 16.444 330 HZ PHE 40 HZ PHE 40 25.024 -3.827 18.794 331 H LEU 41 HN LEU 41 21.031 -6.149 13.805 332 HA LEU 41 HA LEU 41 20.391 -4.084 15.632 333 HB2 LEU 41 HB2 LEU 41 18.949 -4.695 13.045 334 HB3 LEU 41 HB1 LEU 41 19.083 -3.141 13.862 335 HG LEU 41 HG LEU 41 21.380 -4.716 12.691 336 HD11 LEU 41 HD11 LEU 41 19.980 -2.209 11.697 337 HD12 LEU 41 HD12 LEU 41 20.052 -3.787 10.894 338 HD13 LEU 41 HD13 LEU 41 21.503 -2.824 11.065 339 HD21 LEU 41 HD21 LEU 41 22.191 -3.446 14.537 340 HD22 LEU 41 HD22 LEU 41 21.242 -2.023 14.076 341 HD23 LEU 41 HD23 LEU 41 22.613 -2.544 13.087 342 H ASP 42 HN ASP 42 18.560 -6.637 14.191 343 HA ASP 42 HA ASP 42 16.058 -5.935 15.389 344 HB2 ASP 42 HB2 ASP 42 16.428 -7.208 13.196 345 HB3 ASP 42 HB1 ASP 42 16.633 -8.631 14.201 346 H TYR 43 HN TYR 43 18.345 -8.590 16.051 347 HA TYR 43 HA TYR 43 16.759 -9.227 18.476 348 HB2 TYR 43 HB2 TYR 43 18.682 -10.973 16.932 349 HB3 TYR 43 HB1 TYR 43 17.771 -11.433 18.362 350 HD1 TYR 43 HD2 TYR 43 15.267 -11.490 18.305 351 HD2 TYR 43 HD1 TYR 43 17.638 -10.907 14.776 352 HE1 TYR 43 HE2 TYR 43 13.324 -12.078 16.914 353 HE2 TYR 43 HE1 TYR 43 15.755 -11.479 13.374 354 HH TYR 43 HH TYR 43 13.320 -11.674 13.435 355 H GLY 44 HN GLY 44 19.682 -7.758 17.577 356 HA2 GLY 44 HA2 GLY 44 21.470 -7.053 18.876 357 HA3 GLY 44 HA1 GLY 44 20.661 -7.710 20.277 358 H PHE 45 HN PHE 45 20.999 -9.795 17.564 359 HA PHE 45 HA PHE 45 22.318 -11.809 19.005 360 HB2 PHE 45 HB2 PHE 45 21.712 -11.342 16.110 361 HB3 PHE 45 HB1 PHE 45 22.887 -12.575 16.524 362 HD1 PHE 45 HD1 PHE 45 20.164 -11.834 18.927 363 HD2 PHE 45 HD2 PHE 45 21.394 -14.360 15.649 364 HE1 PHE 45 HE1 PHE 45 18.358 -13.423 19.451 365 HE2 PHE 45 HE2 PHE 45 19.575 -15.931 16.196 366 HZ PHE 45 HZ PHE 45 18.054 -15.463 18.101 367 HA PRO 46 HA PRO 46 26.521 -10.442 19.131 368 HB2 PRO 46 HB2 PRO 46 27.707 -12.957 18.888 369 HB3 PRO 46 HB1 PRO 46 27.209 -12.193 20.411 370 HG2 PRO 46 HG2 PRO 46 25.835 -14.256 18.793 371 HG3 PRO 46 HG1 PRO 46 25.875 -14.023 20.548 372 HD2 PRO 46 HD2 PRO 46 23.708 -13.380 19.119 373 HD3 PRO 46 HD1 PRO 46 24.192 -12.404 20.522 374 HA PRO 47 HA PRO 47 26.928 -10.428 14.535 375 HB2 PRO 47 HB2 PRO 47 28.885 -8.493 14.522 376 HB3 PRO 47 HB1 PRO 47 27.146 -8.140 14.539 377 HG2 PRO 47 HG2 PRO 47 29.093 -8.171 16.803 378 HG3 PRO 47 HG1 PRO 47 27.769 -7.045 16.474 379 HD2 PRO 47 HD2 PRO 47 27.474 -8.925 18.321 380 HD3 PRO 47 HD1 PRO 47 26.114 -8.504 17.260 381 H VAL 48 HN VAL 48 29.405 -10.667 16.968 382 HA VAL 48 HA VAL 48 31.496 -11.631 15.311 383 HB VAL 48 HB VAL 48 32.135 -10.761 17.433 384 HG11 VAL 48 HG11 VAL 48 30.884 -10.979 19.267 385 HG12 VAL 48 HG12 VAL 48 31.024 -12.724 19.262 386 HG13 VAL 48 HG13 VAL 48 29.723 -11.927 18.352 387 HG21 VAL 48 HG21 VAL 48 33.340 -12.870 16.636 388 HG22 VAL 48 HG22 VAL 48 32.329 -13.775 17.763 389 HG23 VAL 48 HG23 VAL 48 33.441 -12.552 18.365 390 H LEU 49 HN LEU 49 28.683 -13.129 16.635 391 HA LEU 49 HA LEU 49 29.670 -15.843 16.056 392 HB2 LEU 49 HB2 LEU 49 27.294 -14.722 17.460 393 HB3 LEU 49 HB1 LEU 49 27.335 -16.405 16.977 394 HG LEU 49 HG LEU 49 29.617 -16.592 18.228 395 HD11 LEU 49 HD11 LEU 49 30.510 -14.882 19.258 396 HD12 LEU 49 HD12 LEU 49 29.007 -14.466 20.073 397 HD13 LEU 49 HD13 LEU 49 29.337 -13.852 18.456 398 HD21 LEU 49 HD21 LEU 49 27.458 -15.851 20.173 399 HD22 LEU 49 HD22 LEU 49 28.542 -17.217 20.222 400 HD23 LEU 49 HD23 LEU 49 27.170 -17.222 19.115 401 H GLN 50 HN GLN 50 28.547 -13.491 14.328 402 HA GLN 50 HA GLN 50 26.212 -14.068 13.053 403 HB2 GLN 50 HB2 GLN 50 27.018 -12.803 11.135 404 HB3 GLN 50 HB1 GLN 50 27.468 -12.008 12.638 405 HG2 GLN 50 HG2 GLN 50 29.733 -13.147 12.476 406 HG3 GLN 50 HG1 GLN 50 29.268 -13.747 10.898 407 HE21 GLN 50 HE21 GLN 50 29.496 -10.676 12.683 408 HE22 GLN 50 HE22 GLN 50 29.968 -9.734 11.341 409 H GLN 51 HN GLN 51 27.418 -16.709 13.273 410 HA GLN 51 HA GLN 51 28.268 -17.417 10.613 411 HB2 GLN 51 HB2 GLN 51 27.692 -19.105 13.039 412 HB3 GLN 51 HB1 GLN 51 28.083 -19.803 11.465 413 HG2 GLN 51 HG2 GLN 51 30.189 -18.411 11.447 414 HG3 GLN 51 HG1 GLN 51 29.811 -17.911 13.089 415 HE21 GLN 51 HE21 GLN 51 29.693 -21.099 11.405 416 HE22 GLN 51 HE22 GLN 51 30.614 -21.901 12.576 417 H TRP 52 HN TRP 52 26.923 -17.360 9.035 418 HA TRP 52 HA TRP 52 24.121 -18.252 9.321 419 HB2 TRP 52 HB2 TRP 52 25.617 -16.542 7.334 420 HB3 TRP 52 HB1 TRP 52 24.163 -17.389 6.847 421 HD1 TRP 52 HD1 TRP 52 25.278 -14.998 9.673 422 HE1 TRP 52 HE1 TRP 52 23.285 -13.474 10.256 423 HE3 TRP 52 HE3 TRP 52 21.707 -16.962 6.574 424 HZ2 TRP 52 HZ2 TRP 52 20.541 -13.132 9.506 425 HZ3 TRP 52 HZ3 TRP 52 19.433 -16.011 6.539 426 HH2 TRP 52 HH2 TRP 52 18.850 -14.101 8.001 427 H VAL 53 HN VAL 53 23.478 -20.138 8.248 428 HA VAL 53 HA VAL 53 25.544 -21.428 6.570 429 HB VAL 53 HB VAL 53 23.722 -22.695 8.631 430 HG11 VAL 53 HG11 VAL 53 24.863 -24.835 7.899 431 HG12 VAL 53 HG12 VAL 53 25.423 -23.971 6.478 432 HG13 VAL 53 HG13 VAL 53 23.691 -24.184 6.759 433 HG21 VAL 53 HG21 VAL 53 25.804 -23.421 9.664 434 HG22 VAL 53 HG22 VAL 53 25.881 -21.677 9.446 435 HG23 VAL 53 HG23 VAL 53 26.749 -22.745 8.343 436 H ILE 54 HN ILE 54 24.862 -21.705 4.594 437 HA ILE 54 HA ILE 54 22.192 -22.646 4.047 438 HB ILE 54 HB ILE 54 23.266 -20.108 2.776 439 HG12 ILE 54 HG12 ILE 54 20.700 -20.557 4.349 440 HG13 ILE 54 HG11 ILE 54 22.156 -19.847 5.033 441 HG21 ILE 54 HG21 ILE 54 22.178 -21.320 1.025 442 HG22 ILE 54 HG22 ILE 54 20.971 -20.168 1.601 443 HG23 ILE 54 HG23 ILE 54 20.874 -21.847 2.089 444 HD11 ILE 54 HD11 ILE 54 20.598 -18.744 2.691 445 HD12 ILE 54 HD12 ILE 54 22.079 -18.038 3.355 446 HD13 ILE 54 HD13 ILE 54 20.609 -18.091 4.328 447 H GLY 55 HN GLY 55 22.395 -24.253 2.549 448 HA2 GLY 55 HA2 GLY 55 24.926 -24.991 1.531 449 HA3 GLY 55 HA1 GLY 55 23.387 -25.618 0.938 450 H GLN 56 HN GLN 56 22.180 -23.293 0.115 451 HA GLN 56 HA GLN 56 23.260 -22.794 -2.457 452 HB2 GLN 56 HB2 GLN 56 21.127 -21.378 -0.846 453 HB3 GLN 56 HB1 GLN 56 21.469 -21.083 -2.548 454 HG2 GLN 56 HG2 GLN 56 20.897 -23.290 -3.180 455 HG3 GLN 56 HG1 GLN 56 20.859 -23.861 -1.521 456 HE21 GLN 56 HE21 GLN 56 18.607 -24.502 -2.432 457 HE22 GLN 56 HE22 GLN 56 17.345 -23.384 -2.222 458 H ARG 57 HN ARG 57 24.684 -21.876 0.293 459 HA ARG 57 HA ARG 57 25.563 -19.336 -0.877 460 HB2 ARG 57 HB2 ARG 57 23.879 -19.120 1.097 461 HB3 ARG 57 HB1 ARG 57 25.251 -19.624 2.083 462 HG2 ARG 57 HG2 ARG 57 25.798 -17.433 2.129 463 HG3 ARG 57 HG1 ARG 57 26.442 -17.682 0.521 464 HD2 ARG 57 HD2 ARG 57 23.696 -16.667 1.266 465 HD3 ARG 57 HD1 ARG 57 24.975 -15.810 0.394 466 HE ARG 57 HE ARG 57 24.199 -18.199 -0.996 467 HH11 ARG 57 HH21 ARG 57 23.134 -14.957 -0.270 468 HH12 ARG 57 HH22 ARG 57 22.228 -14.775 -1.713 469 HH21 ARG 57 HH11 ARG 57 23.006 -17.967 -2.940 470 HH22 ARG 57 HH12 ARG 57 22.211 -16.459 -3.245 471 H LEU 58 HN LEU 58 27.627 -18.919 -0.820 472 HA LEU 58 HA LEU 58 29.479 -20.824 0.502 473 HB2 LEU 58 HB2 LEU 58 30.095 -18.798 -1.671 474 HB3 LEU 58 HB1 LEU 58 31.133 -20.079 -1.089 475 HG LEU 58 HG LEU 58 30.330 -21.015 -3.064 476 HD11 LEU 58 HD11 LEU 58 29.116 -22.866 -2.469 477 HD12 LEU 58 HD12 LEU 58 28.009 -21.988 -1.439 478 HD13 LEU 58 HD13 LEU 58 29.651 -22.339 -0.883 479 HD21 LEU 58 HD21 LEU 58 27.435 -20.372 -2.680 480 HD22 LEU 58 HD22 LEU 58 28.390 -20.448 -4.144 481 HD23 LEU 58 HD23 LEU 58 28.493 -19.025 -3.119 482 H ALA 59 HN ALA 59 31.661 -19.303 0.714 483 HA ALA 59 HA ALA 59 31.038 -17.645 2.960 484 HB1 ALA 59 HB1 ALA 59 33.188 -18.854 2.702 485 HB2 ALA 59 HB2 ALA 59 33.418 -17.135 3.013 486 HB3 ALA 59 HB3 ALA 59 33.618 -17.775 1.383 487 H ARG 60 HN ARG 60 29.422 -16.681 1.212 488 HA ARG 60 HA ARG 60 30.495 -14.025 0.526 489 HB2 ARG 60 HB2 ARG 60 30.321 -15.832 -1.469 490 HB3 ARG 60 HB1 ARG 60 28.664 -15.275 -1.478 491 HG2 ARG 60 HG2 ARG 60 29.571 -13.724 -2.901 492 HG3 ARG 60 HG1 ARG 60 29.810 -12.849 -1.394 493 HD2 ARG 60 HD2 ARG 60 31.850 -14.496 -2.928 494 HD3 ARG 60 HD1 ARG 60 31.889 -12.782 -2.582 495 HE ARG 60 HE ARG 60 32.076 -14.835 -0.421 496 HH11 ARG 60 HH21 ARG 60 33.255 -11.881 -1.947 497 HH12 ARG 60 HH22 ARG 60 34.321 -11.540 -0.668 498 HH21 ARG 60 HH11 ARG 60 33.451 -14.355 1.192 499 HH22 ARG 60 HH12 ARG 60 34.469 -12.965 1.166 500 H ASP 61 HN ASP 61 29.308 -13.463 2.461 501 HA ASP 61 HA ASP 61 26.467 -13.708 2.505 502 HB2 ASP 61 HB2 ASP 61 26.562 -12.019 4.355 503 HB3 ASP 61 HB1 ASP 61 27.547 -13.431 4.654 504 H GLN 62 HN GLN 62 28.620 -11.825 0.839 505 HA GLN 62 HA GLN 62 27.185 -9.385 0.525 506 HB2 GLN 62 HB2 GLN 62 29.290 -10.657 -1.256 507 HB3 GLN 62 HB1 GLN 62 28.681 -9.019 -1.403 508 HG2 GLN 62 HG2 GLN 62 29.461 -8.443 0.833 509 HG3 GLN 62 HG1 GLN 62 29.995 -10.093 1.113 510 HE21 GLN 62 HE21 GLN 62 30.479 -7.586 -1.448 511 HE22 GLN 62 HE22 GLN 62 32.144 -7.882 -1.589 512 H GLU 63 HN GLU 63 26.816 -12.524 -0.834 513 HA GLU 63 HA GLU 63 25.607 -11.748 -3.277 514 HB2 GLU 63 HB2 GLU 63 26.490 -13.943 -3.241 515 HB3 GLU 63 HB1 GLU 63 25.648 -14.358 -1.753 516 HG2 GLU 63 HG2 GLU 63 24.560 -15.412 -3.687 517 HG3 GLU 63 HG1 GLU 63 23.483 -14.232 -2.947 518 H THR 64 HN THR 64 23.388 -11.955 -3.911 519 HA THR 64 HA THR 64 21.631 -10.582 -2.223 520 HB THR 64 HB THR 64 20.286 -12.042 -4.319 521 HG1 THR 64 HG1 THR 64 22.382 -12.163 -5.245 522 HG21 THR 64 HG21 THR 64 19.451 -9.953 -3.455 523 HG22 THR 64 HG22 THR 64 19.861 -9.698 -5.122 524 HG23 THR 64 HG23 THR 64 20.935 -9.108 -3.855 525 H LEU 65 HN LEU 65 19.607 -11.295 -1.384 526 HA LEU 65 HA LEU 65 19.583 -13.859 -0.102 527 HB2 LEU 65 HB2 LEU 65 17.375 -11.863 -0.610 528 HB3 LEU 65 HB1 LEU 65 17.204 -13.283 0.429 529 HG LEU 65 HG LEU 65 19.152 -10.981 0.817 530 HD11 LEU 65 HD11 LEU 65 16.731 -10.529 1.310 531 HD12 LEU 65 HD12 LEU 65 17.814 -10.339 2.685 532 HD13 LEU 65 HD13 LEU 65 16.814 -11.776 2.547 533 HD21 LEU 65 HD21 LEU 65 19.561 -12.087 3.020 534 HD22 LEU 65 HD22 LEU 65 20.175 -13.016 1.666 535 HD23 LEU 65 HD23 LEU 65 18.657 -13.493 2.463 536 H HIS 66 HN HIS 66 18.124 -12.514 -2.981 537 HA HIS 66 HA HIS 66 16.272 -14.411 -3.633 538 HB2 HIS 66 HB2 HIS 66 16.734 -12.214 -4.809 539 HB3 HIS 66 HB1 HIS 66 17.997 -13.061 -5.693 540 HD1 HIS 66 HD1 HIS 66 17.274 -14.775 -7.518 541 HD2 HIS 66 HD2 HIS 66 14.060 -13.038 -5.475 542 HE1 HIS 66 HE1 HIS 66 15.182 -15.362 -8.810 543 HE2 HIS 66 HE2 HIS 66 13.219 -14.298 -7.567 544 H SER 67 HN SER 67 19.753 -14.556 -4.393 545 HA SER 67 HA SER 67 19.570 -16.834 -6.025 546 HB2 SER 67 HB2 SER 67 22.022 -17.132 -5.384 547 HB3 SER 67 HB1 SER 67 21.578 -15.641 -6.185 548 HG SER 67 HG SER 67 22.384 -14.712 -4.519 549 H HIS 68 HN HIS 68 19.204 -16.513 -2.643 550 HA HIS 68 HA HIS 68 19.665 -19.356 -2.137 551 HB2 HIS 68 HB2 HIS 68 20.277 -17.986 -0.254 552 HB3 HIS 68 HB1 HIS 68 18.798 -17.050 -0.345 553 HD1 HIS 68 HD1 HIS 68 18.943 -20.863 -0.458 554 HD2 HIS 68 HD2 HIS 68 17.682 -17.818 2.122 555 HE1 HIS 68 HE1 HIS 68 17.763 -21.988 1.481 556 HE2 HIS 68 HE2 HIS 68 16.936 -20.148 3.036 557 H GLY 69 HN GLY 69 17.516 -17.888 -3.896 558 HA2 GLY 69 HA2 GLY 69 15.469 -18.658 -4.695 559 HA3 GLY 69 HA1 GLY 69 15.497 -19.899 -3.443 560 H VAL 70 HN VAL 70 16.169 -16.851 -2.193 561 HA VAL 70 HA VAL 70 13.664 -16.778 -0.808 562 HB VAL 70 HB VAL 70 15.885 -14.725 -0.997 563 HG11 VAL 70 HG11 VAL 70 14.173 -13.448 -0.170 564 HG12 VAL 70 HG12 VAL 70 14.714 -14.166 1.347 565 HG13 VAL 70 HG13 VAL 70 13.307 -14.818 0.521 566 HG21 VAL 70 HG21 VAL 70 15.258 -16.745 1.179 567 HG22 VAL 70 HG22 VAL 70 16.606 -15.611 1.167 568 HG23 VAL 70 HG23 VAL 70 16.552 -16.930 -0.004 569 H ARG 71 HN ARG 71 11.873 -15.847 -1.514 570 HA ARG 71 HA ARG 71 12.023 -13.748 -3.571 571 HB2 ARG 71 HB2 ARG 71 10.582 -16.363 -3.939 572 HB3 ARG 71 HB1 ARG 71 10.314 -14.940 -4.948 573 HG2 ARG 71 HG2 ARG 71 12.706 -14.908 -5.555 574 HG3 ARG 71 HG1 ARG 71 12.986 -16.329 -4.552 575 HD2 ARG 71 HD2 ARG 71 12.733 -16.972 -6.894 576 HD3 ARG 71 HD1 ARG 71 11.440 -17.654 -5.928 577 HE ARG 71 HE ARG 71 10.661 -15.112 -6.988 578 HH11 ARG 71 HH21 ARG 71 11.189 -18.442 -7.922 579 HH12 ARG 71 HH22 ARG 71 10.040 -18.403 -9.188 580 HH21 ARG 71 HH11 ARG 71 9.147 -15.060 -8.634 581 HH22 ARG 71 HH12 ARG 71 8.863 -16.436 -9.612 582 H GLN 72 HN GLN 72 10.116 -15.520 -1.228 583 HA GLN 72 HA GLN 72 8.507 -13.138 -0.847 584 HB2 GLN 72 HB2 GLN 72 6.355 -14.262 -1.068 585 HB3 GLN 72 HB1 GLN 72 7.227 -14.304 -2.594 586 HG2 GLN 72 HG2 GLN 72 7.391 -16.585 -0.607 587 HG3 GLN 72 HG1 GLN 72 6.086 -16.476 -1.773 588 HE21 GLN 72 HE21 GLN 72 7.626 -15.388 -4.004 589 HE22 GLN 72 HE22 GLN 72 8.686 -16.611 -4.495 590 H ASN 73 HN ASN 73 7.026 -13.338 0.973 591 HA ASN 73 HA ASN 73 8.383 -14.007 3.284 592 HB2 ASN 73 HB2 ASN 73 6.430 -13.551 4.487 593 HB3 ASN 73 HB1 ASN 73 6.238 -12.577 3.035 594 HD21 ASN 73 HD21 ASN 73 5.298 -14.295 1.167 595 HD22 ASN 73 HD22 ASN 73 3.848 -15.036 1.646 596 H GLY 74 HN GLY 74 8.620 -15.745 4.525 597 HA2 GLY 74 HA2 GLY 74 7.973 -17.873 5.334 598 HA3 GLY 74 HA1 GLY 74 7.180 -18.239 3.806 599 H ASP 75 HN ASP 75 10.103 -16.677 3.211 600 HA ASP 75 HA ASP 75 11.395 -19.123 2.417 601 HB2 ASP 75 HB2 ASP 75 12.195 -16.213 2.285 602 HB3 ASP 75 HB1 ASP 75 13.358 -17.483 1.971 603 H SER 76 HN SER 76 13.349 -19.917 3.315 604 HA SER 76 HA SER 76 13.655 -19.163 6.153 605 HB2 SER 76 HB2 SER 76 13.821 -22.024 5.222 606 HB3 SER 76 HB1 SER 76 13.480 -21.366 6.815 607 HG SER 76 HG SER 76 11.563 -20.396 5.716 608 H ALA 77 HN ALA 77 15.656 -19.576 7.163 609 HA ALA 77 HA ALA 77 17.935 -20.382 5.509 610 HB1 ALA 77 HB1 ALA 77 19.219 -18.333 6.378 611 HB2 ALA 77 HB2 ALA 77 17.640 -17.654 6.763 612 HB3 ALA 77 HB3 ALA 77 18.045 -18.045 5.093 613 H TYR 78 HN TYR 78 19.995 -20.491 6.859 614 HA TYR 78 HA TYR 78 19.313 -21.400 9.581 615 HB2 TYR 78 HB2 TYR 78 20.377 -22.885 7.423 616 HB3 TYR 78 HB1 TYR 78 21.696 -22.649 8.546 617 HD1 TYR 78 HD2 TYR 78 20.960 -22.865 11.134 618 HD2 TYR 78 HD1 TYR 78 18.990 -24.746 7.807 619 HE1 TYR 78 HE2 TYR 78 20.023 -24.546 12.644 620 HE2 TYR 78 HE1 TYR 78 18.043 -26.433 9.312 621 HH TYR 78 HH TYR 78 19.127 -26.695 12.628 622 H LEU 79 HN LEU 79 20.462 -20.634 11.244 623 HA LEU 79 HA LEU 79 22.993 -19.213 10.727 624 HB2 LEU 79 HB2 LEU 79 21.014 -17.683 11.150 625 HB3 LEU 79 HB1 LEU 79 20.938 -18.351 12.781 626 HG LEU 79 HG LEU 79 23.542 -17.235 11.705 627 HD11 LEU 79 HD11 LEU 79 21.964 -15.469 11.303 628 HD12 LEU 79 HD12 LEU 79 22.937 -15.053 12.715 629 HD13 LEU 79 HD13 LEU 79 21.285 -15.632 12.921 630 HD21 LEU 79 HD21 LEU 79 23.036 -16.599 14.436 631 HD22 LEU 79 HD22 LEU 79 24.204 -17.733 13.806 632 HD23 LEU 79 HD23 LEU 79 22.587 -18.295 14.238 633 H TYR 80 HN TYR 80 24.549 -19.423 12.380 634 HA TYR 80 HA TYR 80 23.923 -21.452 14.451 635 HB2 TYR 80 HB2 TYR 80 25.259 -22.387 12.558 636 HB3 TYR 80 HB1 TYR 80 26.508 -21.196 12.906 637 HD1 TYR 80 HD1 TYR 80 24.530 -23.945 14.469 638 HD2 TYR 80 HD2 TYR 80 28.129 -21.609 14.596 639 HE1 TYR 80 HE1 TYR 80 25.406 -25.413 16.215 640 HE2 TYR 80 HE2 TYR 80 29.022 -23.095 16.359 641 HH TYR 80 HH TYR 80 27.011 -25.634 17.783 642 H LEU 81 HN LEU 81 24.424 -20.851 16.482 643 HA LEU 81 HA LEU 81 26.210 -18.519 16.794 644 HB2 LEU 81 HB2 LEU 81 23.920 -19.374 18.566 645 HB3 LEU 81 HB1 LEU 81 25.017 -18.052 18.914 646 HG LEU 81 HG LEU 81 23.310 -18.239 16.433 647 HD11 LEU 81 HD11 LEU 81 22.058 -17.846 18.640 648 HD12 LEU 81 HD12 LEU 81 21.881 -16.545 17.463 649 HD13 LEU 81 HD13 LEU 81 22.986 -16.357 18.806 650 HD21 LEU 81 HD21 LEU 81 25.206 -16.135 17.513 651 HD22 LEU 81 HD22 LEU 81 23.949 -15.728 16.363 652 HD23 LEU 81 HD23 LEU 81 25.201 -16.874 15.910 653 H LEU 82 HN LEU 82 27.894 -18.703 18.009 654 HA LEU 82 HA LEU 82 28.604 -21.282 19.151 655 HB2 LEU 82 HB2 LEU 82 30.069 -18.633 18.970 656 HB3 LEU 82 HB1 LEU 82 30.688 -19.967 19.924 657 HG LEU 82 HG LEU 82 31.556 -19.785 17.521 658 HD11 LEU 82 HD11 LEU 82 30.256 -22.410 18.289 659 HD12 LEU 82 HD12 LEU 82 31.784 -21.807 18.944 660 HD13 LEU 82 HD13 LEU 82 31.644 -22.171 17.237 661 HD21 LEU 82 HD21 LEU 82 29.386 -19.338 16.398 662 HD22 LEU 82 HD22 LEU 82 28.787 -20.925 16.914 663 HD23 LEU 82 HD23 LEU 82 30.120 -20.814 15.797 664 H SER 83 HN SER 83 29.619 -21.141 21.470 665 HA SER 83 HA SER 83 27.563 -20.154 23.241 666 HB2 SER 83 HB2 SER 83 30.282 -21.226 24.051 667 HB3 SER 83 HB1 SER 83 28.799 -21.157 24.988 668 HG SER 83 HG SER 83 28.164 -22.428 22.809 669 H ALA 84 HN ALA 84 29.884 -18.716 21.536 670 HA ALA 84 HA ALA 84 31.032 -16.837 23.325 671 HB1 ALA 84 HB1 ALA 84 32.136 -16.964 21.258 672 HB2 ALA 84 HB2 ALA 84 31.205 -15.468 21.148 673 HB3 ALA 84 HB3 ALA 84 30.624 -16.912 20.343 674 H ARG 85 HN ARG 85 30.495 -14.597 23.449 675 HA ARG 85 HA ARG 85 27.589 -14.111 23.227 676 HB2 ARG 85 HB2 ARG 85 29.502 -13.337 25.427 677 HB3 ARG 85 HB1 ARG 85 27.826 -12.793 25.324 678 HG2 ARG 85 HG2 ARG 85 27.004 -15.096 25.394 679 HG3 ARG 85 HG1 ARG 85 28.648 -15.719 25.353 680 HD2 ARG 85 HD2 ARG 85 27.798 -15.786 27.603 681 HD3 ARG 85 HD1 ARG 85 29.126 -14.630 27.489 682 HE ARG 85 HE ARG 85 26.660 -13.281 27.092 683 HH11 ARG 85 HH21 ARG 85 28.443 -14.932 29.583 684 HH12 ARG 85 HH22 ARG 85 27.855 -13.952 30.865 685 HH21 ARG 85 HH11 ARG 85 25.853 -11.959 28.809 686 HH22 ARG 85 HH12 ARG 85 26.363 -12.247 30.407 687 H ASN 86 HN ASN 86 27.009 -11.833 23.316 688 HA ASN 86 HA ASN 86 27.923 -10.433 21.112 689 HB2 ASN 86 HB2 ASN 86 26.197 -9.827 23.411 690 HB3 ASN 86 HB1 ASN 86 26.999 -8.424 22.749 691 HD21 ASN 86 HD21 ASN 86 24.453 -10.705 22.183 692 HD22 ASN 86 HD22 ASN 86 23.991 -10.093 20.667 693 H THR 87 HN THR 87 29.380 -8.757 20.738 694 HA THR 87 HA THR 87 31.573 -8.456 22.537 695 HB THR 87 HB THR 87 31.660 -6.349 20.742 696 HG1 THR 87 HG1 THR 87 29.943 -6.830 19.525 697 HG21 THR 87 HG21 THR 87 33.136 -7.827 19.415 698 HG22 THR 87 HG22 THR 87 32.529 -9.231 20.284 699 HG23 THR 87 HG23 THR 87 33.443 -7.993 21.134 700 H SER 88 HN SER 88 30.155 -8.046 24.350 701 HA SER 88 HA SER 88 28.303 -6.051 24.573 702 HB2 SER 88 HB2 SER 88 28.712 -7.898 26.217 703 HB3 SER 88 HB1 SER 88 30.113 -7.031 26.783 704 HG SER 88 HG SER 88 28.912 -5.719 27.808 705 H LEU 89 HN LEU 89 28.296 -3.939 25.130 706 HA LEU 89 HA LEU 89 30.536 -2.333 24.489 707 HB2 LEU 89 HB2 LEU 89 28.006 -1.662 26.024 708 HB3 LEU 89 HB1 LEU 89 29.175 -0.483 25.444 709 HG LEU 89 HG LEU 89 27.736 -2.440 23.618 710 HD11 LEU 89 HD11 LEU 89 27.079 0.373 24.459 711 HD12 LEU 89 HD12 LEU 89 26.008 -1.019 24.260 712 HD13 LEU 89 HD13 LEU 89 26.649 -0.197 22.849 713 HD21 LEU 89 HD21 LEU 89 29.766 -1.766 22.594 714 HD22 LEU 89 HD22 LEU 89 29.620 -0.114 23.183 715 HD23 LEU 89 HD23 LEU 89 28.552 -0.696 21.907 716 H ASN 90 HN ASN 90 29.133 -3.411 27.499 717 HA ASN 90 HA ASN 90 31.655 -2.801 28.891 718 HB2 ASN 90 HB2 ASN 90 28.842 -2.420 29.947 719 HB3 ASN 90 HB1 ASN 90 30.283 -2.416 30.944 720 HD21 ASN 90 HD21 ASN 90 31.326 -1.085 28.083 721 HD22 ASN 90 HD22 ASN 90 31.039 0.541 28.396 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 5.398 -0.995 4.201 2 H2 MET 1 HT2 MET 1 6.708 -1.910 4.747 3 H3 MET 1 HT3 MET 1 5.718 -2.471 3.482 4 HA MET 1 HA MET 1 7.346 0.001 3.325 5 HB2 MET 1 HB2 MET 1 7.877 -2.738 2.099 6 HB3 MET 1 HB1 MET 1 8.861 -1.314 1.849 7 HG2 MET 1 HG2 MET 1 8.729 -3.111 4.189 8 HG3 MET 1 HG1 MET 1 10.079 -2.174 3.569 9 HE1 MET 1 HE1 MET 1 10.506 -2.147 6.101 10 HE2 MET 1 HE2 MET 1 8.962 -2.489 6.867 11 HE3 MET 1 HE3 MET 1 9.792 -0.989 7.227 12 HA PRO 2 HA PRO 2 4.886 1.107 -0.230 13 HB2 PRO 2 HB2 PRO 2 7.351 0.857 -1.901 14 HB3 PRO 2 HB1 PRO 2 6.201 2.202 -1.775 15 HG2 PRO 2 HG2 PRO 2 8.535 2.399 -0.614 16 HG3 PRO 2 HG1 PRO 2 7.080 2.961 0.235 17 HD2 PRO 2 HD2 PRO 2 8.682 0.483 0.724 18 HD3 PRO 2 HD1 PRO 2 7.827 1.533 1.880 19 H THR 3 HN THR 3 7.320 -1.380 -0.848 20 HA THR 3 HA THR 3 5.332 -2.965 -2.344 21 HB THR 3 HB THR 3 7.468 -4.311 -2.952 22 HG1 THR 3 HG1 THR 3 8.812 -3.169 -1.462 23 HG21 THR 3 HG21 THR 3 6.939 -1.530 -4.042 24 HG22 THR 3 HG22 THR 3 6.227 -3.037 -4.595 25 HG23 THR 3 HG23 THR 3 7.940 -2.736 -4.850 26 H GLN 4 HN GLN 4 5.429 -5.344 -1.805 27 HA GLN 4 HA GLN 4 5.401 -5.589 1.058 28 HB2 GLN 4 HB2 GLN 4 5.056 -7.700 -1.059 29 HB3 GLN 4 HB1 GLN 4 4.817 -7.934 0.656 30 HG2 GLN 4 HG2 GLN 4 3.071 -6.106 0.636 31 HG3 GLN 4 HG1 GLN 4 3.205 -6.077 -1.122 32 HE21 GLN 4 HE21 GLN 4 1.444 -7.210 -1.975 33 HE22 GLN 4 HE22 GLN 4 0.877 -8.687 -1.362 34 H ASP 5 HN ASP 5 6.920 -6.303 2.262 35 HA ASP 5 HA ASP 5 9.498 -7.177 1.169 36 HB2 ASP 5 HB2 ASP 5 8.518 -6.480 3.919 37 HB3 ASP 5 HB1 ASP 5 9.879 -7.583 3.759 38 H ILE 6 HN ILE 6 10.406 -9.185 2.425 39 HA ILE 6 HA ILE 6 8.281 -11.228 2.448 40 HB ILE 6 HB ILE 6 9.829 -12.805 1.479 41 HG12 ILE 6 HG12 ILE 6 11.751 -10.507 1.069 42 HG13 ILE 6 HG11 ILE 6 11.942 -11.658 2.388 43 HG21 ILE 6 HG21 ILE 6 9.367 -10.195 0.029 44 HG22 ILE 6 HG22 ILE 6 8.565 -11.740 -0.231 45 HG23 ILE 6 HG23 ILE 6 10.221 -11.498 -0.783 46 HD11 ILE 6 HD11 ILE 6 11.949 -13.489 0.741 47 HD12 ILE 6 HD12 ILE 6 13.293 -12.361 0.493 48 HD13 ILE 6 HD13 ILE 6 11.880 -12.311 -0.565 49 H ARG 7 HN ARG 7 8.634 -12.971 3.818 50 HA ARG 7 HA ARG 7 10.275 -12.283 6.144 51 HB2 ARG 7 HB2 ARG 7 7.984 -14.225 5.839 52 HB3 ARG 7 HB1 ARG 7 8.843 -13.862 7.328 53 HG2 ARG 7 HG2 ARG 7 8.230 -11.496 7.164 54 HG3 ARG 7 HG1 ARG 7 7.388 -11.813 5.655 55 HD2 ARG 7 HD2 ARG 7 5.861 -13.371 6.794 56 HD3 ARG 7 HD1 ARG 7 6.672 -13.044 8.322 57 HE ARG 7 HE ARG 7 5.881 -10.580 7.275 58 HH11 ARG 7 HH21 ARG 7 4.409 -13.554 8.351 59 HH12 ARG 7 HH22 ARG 7 2.949 -12.810 8.837 60 HH21 ARG 7 HH11 ARG 7 3.972 -9.594 7.919 61 HH22 ARG 7 HH12 ARG 7 2.696 -10.518 8.606 62 H LEU 8 HN LEU 8 11.968 -13.431 6.614 63 HA LEU 8 HA LEU 8 12.417 -15.984 5.229 64 HB2 LEU 8 HB2 LEU 8 13.973 -14.086 4.678 65 HB3 LEU 8 HB1 LEU 8 14.470 -14.057 6.363 66 HG LEU 8 HG LEU 8 15.849 -15.390 4.512 67 HD11 LEU 8 HD11 LEU 8 15.418 -16.686 7.176 68 HD12 LEU 8 HD12 LEU 8 16.285 -15.158 6.973 69 HD13 LEU 8 HD13 LEU 8 16.879 -16.627 6.195 70 HD21 LEU 8 HD21 LEU 8 15.242 -17.606 4.135 71 HD22 LEU 8 HD22 LEU 8 13.662 -16.862 4.119 72 HD23 LEU 8 HD23 LEU 8 14.238 -17.704 5.568 73 H TRP 9 HN TRP 9 12.451 -17.751 6.569 74 HA TRP 9 HA TRP 9 12.407 -17.279 9.455 75 HB2 TRP 9 HB2 TRP 9 12.249 -19.930 8.018 76 HB3 TRP 9 HB1 TRP 9 11.767 -19.553 9.670 77 HD1 TRP 9 HD1 TRP 9 10.150 -16.859 8.925 78 HE1 TRP 9 HE1 TRP 9 7.807 -17.144 7.762 79 HE3 TRP 9 HE3 TRP 9 10.643 -21.547 7.060 80 HZ2 TRP 9 HZ2 TRP 9 6.402 -19.087 6.269 81 HZ3 TRP 9 HZ3 TRP 9 8.850 -22.598 5.780 82 HH2 TRP 9 HH2 TRP 9 6.691 -21.365 5.372 83 H VAL 10 HN VAL 10 14.149 -17.611 10.691 84 HA VAL 10 HA VAL 10 16.470 -18.882 9.374 85 HB VAL 10 HB VAL 10 16.559 -16.973 11.682 86 HG11 VAL 10 HG11 VAL 10 18.656 -17.715 9.625 87 HG12 VAL 10 HG12 VAL 10 18.552 -18.419 11.242 88 HG13 VAL 10 HG13 VAL 10 18.885 -16.700 11.041 89 HG21 VAL 10 HG21 VAL 10 15.468 -15.908 9.658 90 HG22 VAL 10 HG22 VAL 10 16.927 -16.308 8.751 91 HG23 VAL 10 HG23 VAL 10 17.015 -15.188 10.107 92 H SER 11 HN SER 11 17.137 -20.706 10.185 93 HA SER 11 HA SER 11 16.105 -21.676 12.747 94 HB2 SER 11 HB2 SER 11 18.065 -23.172 11.054 95 HB3 SER 11 HB1 SER 11 16.728 -23.772 12.023 96 HG SER 11 HG SER 11 16.699 -22.413 9.543 97 H VAL 12 HN VAL 12 17.286 -21.094 14.494 98 HA VAL 12 HA VAL 12 20.109 -20.399 14.053 99 HB VAL 12 HB VAL 12 18.082 -19.404 16.048 100 HG11 VAL 12 HG11 VAL 12 20.174 -17.817 16.557 101 HG12 VAL 12 HG12 VAL 12 21.072 -19.259 16.103 102 HG13 VAL 12 HG13 VAL 12 19.917 -19.319 17.425 103 HG21 VAL 12 HG21 VAL 12 18.473 -18.535 13.507 104 HG22 VAL 12 HG22 VAL 12 19.726 -17.604 14.329 105 HG23 VAL 12 HG23 VAL 12 18.050 -17.447 14.828 106 H GLU 13 HN GLU 13 21.608 -21.495 15.077 107 HA GLU 13 HA GLU 13 20.840 -23.426 17.164 108 HB2 GLU 13 HB2 GLU 13 23.402 -23.051 15.602 109 HB3 GLU 13 HB1 GLU 13 23.281 -24.101 16.986 110 HG2 GLU 13 HG2 GLU 13 21.381 -24.311 14.667 111 HG3 GLU 13 HG1 GLU 13 22.896 -25.245 14.743 112 H ASP 14 HN ASP 14 20.652 -22.509 18.993 113 HA ASP 14 HA ASP 14 21.803 -20.091 19.827 114 HB2 ASP 14 HB2 ASP 14 19.919 -20.717 21.027 115 HB3 ASP 14 HB1 ASP 14 20.523 -22.362 21.222 116 H ALA 15 HN ALA 15 23.391 -19.647 21.265 117 HA ALA 15 HA ALA 15 25.862 -20.902 20.844 118 HB1 ALA 15 HB1 ALA 15 24.916 -19.035 22.990 119 HB2 ALA 15 HB2 ALA 15 25.912 -18.679 21.575 120 HB3 ALA 15 HB3 ALA 15 26.581 -19.622 22.914 121 H GLN 16 HN GLN 16 23.487 -21.363 23.405 122 HA GLN 16 HA GLN 16 25.174 -23.211 24.862 123 HB2 GLN 16 HB2 GLN 16 22.172 -23.013 25.174 124 HB3 GLN 16 HB1 GLN 16 23.376 -23.487 26.357 125 HG2 GLN 16 HG2 GLN 16 22.981 -20.682 25.252 126 HG3 GLN 16 HG1 GLN 16 22.586 -21.229 26.856 127 HE21 GLN 16 HE21 GLN 16 24.844 -19.381 25.468 128 HE22 GLN 16 HE22 GLN 16 26.198 -19.794 26.385 129 H MET 17 HN MET 17 23.827 -23.385 21.937 130 HA MET 17 HA MET 17 23.692 -25.053 20.457 131 HB2 MET 17 HB2 MET 17 24.238 -26.958 22.775 132 HB3 MET 17 HB1 MET 17 24.061 -27.420 21.106 133 HG2 MET 17 HG2 MET 17 25.937 -26.015 20.425 134 HG3 MET 17 HG1 MET 17 26.119 -25.418 22.069 135 HE1 MET 17 HE1 MET 17 27.114 -29.458 20.285 136 HE2 MET 17 HE2 MET 17 26.139 -28.159 19.621 137 HE3 MET 17 HE3 MET 17 25.425 -29.271 20.777 138 H HIS 18 HN HIS 18 21.459 -23.901 21.079 139 HA HIS 18 HA HIS 18 19.461 -26.111 21.172 140 HB2 HIS 18 HB2 HIS 18 18.950 -23.170 21.818 141 HB3 HIS 18 HB1 HIS 18 17.805 -24.475 21.816 142 HD1 HIS 18 HD1 HIS 18 20.735 -23.155 23.790 143 HD2 HIS 18 HD2 HIS 18 17.862 -26.185 24.034 144 HE1 HIS 18 HE1 HIS 18 20.830 -24.090 26.162 145 HE2 HIS 18 HE2 HIS 18 19.082 -25.919 26.311 146 H THR 19 HN THR 19 18.034 -26.195 19.409 147 HA THR 19 HA THR 19 18.692 -24.431 17.169 148 HB THR 19 HB THR 19 16.585 -26.608 17.256 149 HG1 THR 19 HG1 THR 19 19.321 -26.764 16.410 150 HG21 THR 19 HG21 THR 19 17.043 -24.642 15.359 151 HG22 THR 19 HG22 THR 19 16.269 -26.166 15.056 152 HG23 THR 19 HG23 THR 19 17.988 -25.987 14.738 153 H VAL 20 HN VAL 20 17.651 -22.576 16.915 154 HA VAL 20 HA VAL 20 14.931 -22.293 18.036 155 HB VAL 20 HB VAL 20 16.905 -20.029 17.831 156 HG11 VAL 20 HG11 VAL 20 14.516 -19.477 18.225 157 HG12 VAL 20 HG12 VAL 20 15.507 -19.090 19.628 158 HG13 VAL 20 HG13 VAL 20 14.521 -20.540 19.635 159 HG21 VAL 20 HG21 VAL 20 16.598 -22.027 20.102 160 HG22 VAL 20 HG22 VAL 20 17.385 -20.461 20.292 161 HG23 VAL 20 HG23 VAL 20 18.062 -21.659 19.190 162 H THR 21 HN THR 21 13.639 -20.639 16.913 163 HA THR 21 HA THR 21 14.459 -20.289 14.103 164 HB THR 21 HB THR 21 11.668 -20.900 15.090 165 HG1 THR 21 HG1 THR 21 13.722 -22.505 14.853 166 HG21 THR 21 HG21 THR 21 11.807 -19.587 12.967 167 HG22 THR 21 HG22 THR 21 11.175 -21.201 12.716 168 HG23 THR 21 HG23 THR 21 12.840 -20.843 12.285 169 H ILE 22 HN ILE 22 14.351 -18.247 13.393 170 HA ILE 22 HA ILE 22 12.599 -16.358 14.820 171 HB ILE 22 HB ILE 22 14.291 -14.597 14.567 172 HG12 ILE 22 HG12 ILE 22 16.132 -16.841 13.665 173 HG13 ILE 22 HG11 ILE 22 15.442 -15.595 12.608 174 HG21 ILE 22 HG21 ILE 22 15.675 -16.892 15.942 175 HG22 ILE 22 HG22 ILE 22 14.171 -16.240 16.595 176 HG23 ILE 22 HG23 ILE 22 15.584 -15.203 16.421 177 HD11 ILE 22 HD11 ILE 22 16.585 -13.843 13.825 178 HD12 ILE 22 HD12 ILE 22 17.771 -15.061 13.366 179 HD13 ILE 22 HD13 ILE 22 17.169 -14.999 15.023 180 H TRP 23 HN TRP 23 11.917 -14.553 13.567 181 HA TRP 23 HA TRP 23 11.741 -15.218 10.689 182 HB2 TRP 23 HB2 TRP 23 9.802 -13.741 12.483 183 HB3 TRP 23 HB1 TRP 23 9.603 -13.921 10.748 184 HD1 TRP 23 HD1 TRP 23 8.497 -16.092 9.915 185 HE1 TRP 23 HE1 TRP 23 7.756 -18.299 11.010 186 HE3 TRP 23 HE3 TRP 23 10.450 -15.473 14.583 187 HZ2 TRP 23 HZ2 TRP 23 7.961 -19.630 13.523 188 HZ3 TRP 23 HZ3 TRP 23 10.164 -17.222 16.315 189 HH2 TRP 23 HH2 TRP 23 8.916 -19.300 15.792 190 H LEU 24 HN LEU 24 12.703 -13.856 9.334 191 HA LEU 24 HA LEU 24 13.163 -11.062 10.207 192 HB2 LEU 24 HB2 LEU 24 14.719 -12.681 8.189 193 HB3 LEU 24 HB1 LEU 24 15.029 -11.006 8.611 194 HG LEU 24 HG LEU 24 15.161 -13.333 10.570 195 HD11 LEU 24 HD11 LEU 24 16.992 -13.141 8.792 196 HD12 LEU 24 HD12 LEU 24 17.514 -13.145 10.482 197 HD13 LEU 24 HD13 LEU 24 17.450 -11.633 9.590 198 HD21 LEU 24 HD21 LEU 24 14.686 -11.533 11.943 199 HD22 LEU 24 HD22 LEU 24 15.381 -10.346 10.840 200 HD23 LEU 24 HD23 LEU 24 16.430 -11.355 11.830 201 H THR 25 HN THR 25 12.154 -9.545 9.065 202 HA THR 25 HA THR 25 10.843 -10.339 6.549 203 HB THR 25 HB THR 25 10.213 -7.901 8.224 204 HG1 THR 25 HG1 THR 25 9.877 -9.649 9.505 205 HG21 THR 25 HG21 THR 25 7.951 -8.331 7.057 206 HG22 THR 25 HG22 THR 25 8.839 -9.397 5.977 207 HG23 THR 25 HG23 THR 25 9.256 -7.688 6.071 208 H VAL 26 HN VAL 26 11.862 -9.712 4.777 209 HA VAL 26 HA VAL 26 13.113 -7.086 4.564 210 HB VAL 26 HB VAL 26 15.241 -8.196 3.690 211 HG11 VAL 26 HG11 VAL 26 16.240 -8.194 5.790 212 HG12 VAL 26 HG12 VAL 26 14.773 -8.733 6.611 213 HG13 VAL 26 HG13 VAL 26 14.885 -7.087 5.989 214 HG21 VAL 26 HG21 VAL 26 15.629 -10.464 4.821 215 HG22 VAL 26 HG22 VAL 26 14.568 -10.463 3.411 216 HG23 VAL 26 HG23 VAL 26 13.881 -10.555 5.033 217 H ARG 27 HN ARG 27 14.465 -7.428 2.252 218 HA ARG 27 HA ARG 27 12.382 -8.304 0.370 219 HB2 ARG 27 HB2 ARG 27 13.606 -6.731 -1.234 220 HB3 ARG 27 HB1 ARG 27 12.653 -5.974 0.023 221 HG2 ARG 27 HG2 ARG 27 15.613 -6.533 0.471 222 HG3 ARG 27 HG1 ARG 27 15.094 -5.098 -0.376 223 HD2 ARG 27 HD2 ARG 27 14.758 -5.742 2.549 224 HD3 ARG 27 HD1 ARG 27 15.149 -4.258 1.750 225 HE ARG 27 HE ARG 27 12.469 -5.242 2.322 226 HH11 ARG 27 HH21 ARG 27 14.476 -3.079 0.459 227 HH12 ARG 27 HH22 ARG 27 13.215 -1.994 0.075 228 HH21 ARG 27 HH11 ARG 27 10.772 -3.820 1.824 229 HH22 ARG 27 HH12 ARG 27 11.047 -2.429 0.869 230 HA PRO 28 HA PRO 28 15.160 -11.473 -1.182 231 HB2 PRO 28 HB2 PRO 28 14.612 -10.392 -3.905 232 HB3 PRO 28 HB1 PRO 28 14.412 -12.038 -3.278 233 HG2 PRO 28 HG2 PRO 28 12.301 -10.531 -3.708 234 HG3 PRO 28 HG1 PRO 28 12.400 -11.580 -2.276 235 HD2 PRO 28 HD2 PRO 28 12.704 -8.603 -2.438 236 HD3 PRO 28 HD1 PRO 28 11.959 -9.601 -1.165 237 H ASP 29 HN ASP 29 15.354 -8.210 -2.177 238 HA ASP 29 HA ASP 29 17.843 -8.153 -3.551 239 HB2 ASP 29 HB2 ASP 29 15.963 -6.395 -3.595 240 HB3 ASP 29 HB1 ASP 29 16.610 -5.839 -2.063 241 H MET 30 HN MET 30 16.947 -8.164 -0.148 242 HA MET 30 HA MET 30 19.046 -6.887 1.052 243 HB2 MET 30 HB2 MET 30 17.207 -7.510 2.372 244 HB3 MET 30 HB1 MET 30 17.235 -9.163 1.766 245 HG2 MET 30 HG2 MET 30 18.030 -8.989 4.004 246 HG3 MET 30 HG1 MET 30 19.307 -9.607 2.968 247 HE1 MET 30 HE1 MET 30 18.057 -6.645 5.118 248 HE2 MET 30 HE2 MET 30 19.670 -6.426 5.861 249 HE3 MET 30 HE3 MET 30 18.948 -8.046 5.764 250 H THR 31 HN THR 31 20.900 -7.492 1.905 251 HA THR 31 HA THR 31 22.332 -9.675 0.574 252 HB THR 31 HB THR 31 23.133 -7.099 1.903 253 HG1 THR 31 HG1 THR 31 23.473 -8.192 -0.703 254 HG21 THR 31 HG21 THR 31 24.781 -9.512 1.255 255 HG22 THR 31 HG22 THR 31 24.777 -8.450 2.672 256 HG23 THR 31 HG23 THR 31 25.490 -7.883 1.158 257 H VAL 32 HN VAL 32 23.501 -11.191 1.802 258 HA VAL 32 HA VAL 32 22.394 -11.986 4.245 259 HB VAL 32 HB VAL 32 25.099 -12.676 3.072 260 HG11 VAL 32 HG11 VAL 32 24.624 -14.824 4.488 261 HG12 VAL 32 HG12 VAL 32 23.561 -13.771 5.413 262 HG13 VAL 32 HG13 VAL 32 25.269 -13.396 5.280 263 HG21 VAL 32 HG21 VAL 32 22.850 -14.607 2.969 264 HG22 VAL 32 HG22 VAL 32 24.042 -14.178 1.734 265 HG23 VAL 32 HG23 VAL 32 22.631 -13.168 1.972 266 H ALA 33 HN ALA 33 25.454 -10.268 3.608 267 HA ALA 33 HA ALA 33 26.338 -10.078 6.252 268 HB1 ALA 33 HB1 ALA 33 27.896 -8.591 5.498 269 HB2 ALA 33 HB2 ALA 33 26.768 -7.740 4.437 270 HB3 ALA 33 HB3 ALA 33 27.432 -9.305 3.959 271 H SER 34 HN SER 34 24.266 -7.893 4.416 272 HA SER 34 HA SER 34 23.728 -6.036 6.500 273 HB2 SER 34 HB2 SER 34 21.936 -6.808 4.197 274 HB3 SER 34 HB1 SER 34 21.864 -5.331 5.135 275 HG SER 34 HG SER 34 22.918 -5.117 3.149 276 H LEU 35 HN LEU 35 22.272 -9.057 5.458 277 HA LEU 35 HA LEU 35 20.029 -9.016 7.138 278 HB2 LEU 35 HB2 LEU 35 20.241 -10.576 5.234 279 HB3 LEU 35 HB1 LEU 35 21.568 -11.385 6.048 280 HG LEU 35 HG LEU 35 20.109 -12.089 7.877 281 HD11 LEU 35 HD11 LEU 35 18.553 -10.498 8.220 282 HD12 LEU 35 HD12 LEU 35 17.556 -11.649 7.316 283 HD13 LEU 35 HD13 LEU 35 18.214 -10.220 6.511 284 HD21 LEU 35 HD21 LEU 35 18.591 -13.546 6.592 285 HD22 LEU 35 HD22 LEU 35 20.205 -13.512 5.870 286 HD23 LEU 35 HD23 LEU 35 18.878 -12.555 5.166 287 H LYS 36 HN LYS 36 23.303 -10.234 7.655 288 HA LYS 36 HA LYS 36 22.864 -11.308 10.249 289 HB2 LYS 36 HB2 LYS 36 25.279 -10.003 9.036 290 HB3 LYS 36 HB1 LYS 36 25.278 -10.682 10.677 291 HG2 LYS 36 HG2 LYS 36 24.643 -12.889 9.618 292 HG3 LYS 36 HG1 LYS 36 24.853 -12.133 8.038 293 HD2 LYS 36 HD2 LYS 36 27.149 -11.539 8.530 294 HD3 LYS 36 HD1 LYS 36 27.030 -12.178 10.158 295 HE2 LYS 36 HE2 LYS 36 26.413 -14.463 8.926 296 HE3 LYS 36 HE1 LYS 36 27.137 -13.651 7.546 297 HZ1 LYS 36 HZ1 LYS 36 29.029 -14.487 8.391 298 HZ2 LYS 36 HZ2 LYS 36 28.413 -14.648 9.950 299 HZ3 LYS 36 HZ3 LYS 36 28.992 -13.158 9.420 300 H ASP 37 HN ASP 37 23.669 -8.073 9.111 301 HA ASP 37 HA ASP 37 24.093 -6.955 11.627 302 HB2 ASP 37 HB2 ASP 37 23.278 -5.656 9.028 303 HB3 ASP 37 HB1 ASP 37 23.527 -4.739 10.494 304 H MET 38 HN MET 38 21.068 -7.128 9.739 305 HA MET 38 HA MET 38 19.556 -5.615 11.602 306 HB2 MET 38 HB2 MET 38 18.053 -7.840 10.442 307 HB3 MET 38 HB1 MET 38 17.771 -6.122 10.432 308 HG2 MET 38 HG2 MET 38 19.468 -5.810 8.661 309 HG3 MET 38 HG1 MET 38 19.670 -7.552 8.580 310 HE1 MET 38 HE1 MET 38 16.578 -9.150 7.596 311 HE2 MET 38 HE2 MET 38 16.058 -8.305 9.032 312 HE3 MET 38 HE3 MET 38 17.663 -8.983 8.981 313 H VAL 39 HN VAL 39 20.317 -8.999 11.334 314 HA VAL 39 HA VAL 39 18.766 -9.909 13.487 315 HB VAL 39 HB VAL 39 21.413 -10.970 12.421 316 HG11 VAL 39 HG11 VAL 39 19.424 -12.425 14.187 317 HG12 VAL 39 HG12 VAL 39 20.930 -11.716 14.782 318 HG13 VAL 39 HG13 VAL 39 20.971 -13.014 13.602 319 HG21 VAL 39 HG21 VAL 39 19.241 -12.699 11.870 320 HG22 VAL 39 HG22 VAL 39 20.145 -11.721 10.722 321 HG23 VAL 39 HG23 VAL 39 18.679 -11.077 11.453 322 H PHE 40 HN PHE 40 22.006 -8.579 13.244 323 HA PHE 40 HA PHE 40 22.662 -8.760 15.987 324 HB2 PHE 40 HB2 PHE 40 24.380 -8.407 14.314 325 HB3 PHE 40 HB1 PHE 40 23.655 -6.877 13.836 326 HD1 PHE 40 HD2 PHE 40 24.716 -8.543 17.040 327 HD2 PHE 40 HD1 PHE 40 24.680 -4.964 14.678 328 HE1 PHE 40 HE2 PHE 40 26.017 -7.389 18.789 329 HE2 PHE 40 HE1 PHE 40 25.977 -3.798 16.435 330 HZ PHE 40 HZ PHE 40 26.654 -5.009 18.497 331 H LEU 41 HN LEU 41 21.172 -6.253 13.979 332 HA LEU 41 HA LEU 41 20.880 -4.265 16.005 333 HB2 LEU 41 HB2 LEU 41 18.984 -4.857 13.708 334 HB3 LEU 41 HB1 LEU 41 19.049 -3.384 14.659 335 HG LEU 41 HG LEU 41 21.239 -4.480 12.931 336 HD11 LEU 41 HD11 LEU 41 19.548 -2.011 12.479 337 HD12 LEU 41 HD12 LEU 41 19.357 -3.563 11.653 338 HD13 LEU 41 HD13 LEU 41 20.825 -2.634 11.439 339 HD21 LEU 41 HD21 LEU 41 22.479 -3.350 14.401 340 HD22 LEU 41 HD22 LEU 41 21.172 -2.283 14.930 341 HD23 LEU 41 HD23 LEU 41 22.048 -1.960 13.411 342 H ASP 42 HN ASP 42 18.848 -6.790 14.826 343 HA ASP 42 HA ASP 42 16.680 -6.199 16.608 344 HB2 ASP 42 HB2 ASP 42 16.464 -7.252 14.294 345 HB3 ASP 42 HB1 ASP 42 16.875 -8.775 15.084 346 H TYR 43 HN TYR 43 19.011 -8.874 16.541 347 HA TYR 43 HA TYR 43 17.939 -9.774 19.156 348 HB2 TYR 43 HB2 TYR 43 19.608 -11.307 17.156 349 HB3 TYR 43 HB1 TYR 43 18.908 -11.945 18.621 350 HD1 TYR 43 HD2 TYR 43 16.410 -12.129 18.878 351 HD2 TYR 43 HD1 TYR 43 18.260 -10.930 15.195 352 HE1 TYR 43 HE2 TYR 43 14.301 -12.580 17.663 353 HE2 TYR 43 HE1 TYR 43 16.151 -11.389 13.983 354 HH TYR 43 HH TYR 43 13.448 -12.973 15.494 355 H GLY 44 HN GLY 44 20.567 -8.075 17.906 356 HA2 GLY 44 HA2 GLY 44 22.497 -7.348 18.975 357 HA3 GLY 44 HA1 GLY 44 21.954 -8.199 20.403 358 H PHE 45 HN PHE 45 22.009 -10.117 17.593 359 HA PHE 45 HA PHE 45 24.129 -11.767 18.676 360 HB2 PHE 45 HB2 PHE 45 22.494 -12.001 16.142 361 HB3 PHE 45 HB1 PHE 45 23.696 -13.169 16.643 362 HD1 PHE 45 HD1 PHE 45 22.150 -11.810 19.595 363 HD2 PHE 45 HD2 PHE 45 21.490 -14.624 16.381 364 HE1 PHE 45 HE1 PHE 45 20.479 -12.960 20.944 365 HE2 PHE 45 HE2 PHE 45 19.788 -15.780 17.773 366 HZ PHE 45 HZ PHE 45 19.281 -14.958 20.042 367 HA PRO 46 HA PRO 46 27.015 -9.073 16.447 368 HB2 PRO 46 HB2 PRO 46 29.278 -10.596 17.065 369 HB3 PRO 46 HB1 PRO 46 28.613 -9.280 18.038 370 HG2 PRO 46 HG2 PRO 46 28.233 -12.204 18.336 371 HG3 PRO 46 HG1 PRO 46 28.454 -11.011 19.602 372 HD2 PRO 46 HD2 PRO 46 26.056 -12.006 19.097 373 HD3 PRO 46 HD1 PRO 46 26.233 -10.266 19.471 374 HA PRO 47 HA PRO 47 26.776 -11.350 12.623 375 HB2 PRO 47 HB2 PRO 47 28.607 -9.899 11.165 376 HB3 PRO 47 HB1 PRO 47 26.936 -9.389 11.443 377 HG2 PRO 47 HG2 PRO 47 29.419 -8.560 12.865 378 HG3 PRO 47 HG1 PRO 47 28.020 -7.590 12.363 379 HD2 PRO 47 HD2 PRO 47 28.296 -8.315 14.913 380 HD3 PRO 47 HD1 PRO 47 26.687 -8.302 14.147 381 H VAL 48 HN VAL 48 29.861 -10.743 14.145 382 HA VAL 48 HA VAL 48 31.420 -12.610 12.691 383 HB VAL 48 HB VAL 48 32.691 -11.125 13.995 384 HG11 VAL 48 HG11 VAL 48 30.487 -11.390 15.864 385 HG12 VAL 48 HG12 VAL 48 31.682 -10.094 15.722 386 HG13 VAL 48 HG13 VAL 48 32.036 -11.513 16.704 387 HG21 VAL 48 HG21 VAL 48 33.979 -12.521 15.504 388 HG22 VAL 48 HG22 VAL 48 33.409 -13.568 14.217 389 HG23 VAL 48 HG23 VAL 48 32.605 -13.586 15.788 390 H LEU 49 HN LEU 49 29.432 -12.824 15.584 391 HA LEU 49 HA LEU 49 29.937 -15.585 16.072 392 HB2 LEU 49 HB2 LEU 49 27.935 -13.603 17.107 393 HB3 LEU 49 HB1 LEU 49 27.759 -15.306 17.443 394 HG LEU 49 HG LEU 49 30.096 -15.402 18.311 395 HD11 LEU 49 HD11 LEU 49 30.943 -13.002 19.007 396 HD12 LEU 49 HD12 LEU 49 30.065 -12.508 17.564 397 HD13 LEU 49 HD13 LEU 49 31.344 -13.720 17.463 398 HD21 LEU 49 HD21 LEU 49 27.817 -14.482 19.638 399 HD22 LEU 49 HD22 LEU 49 29.040 -13.270 20.043 400 HD23 LEU 49 HD23 LEU 49 29.327 -14.946 20.400 401 H GLN 50 HN GLN 50 27.512 -13.773 14.299 402 HA GLN 50 HA GLN 50 25.715 -15.928 13.909 403 HB2 GLN 50 HB2 GLN 50 26.168 -13.465 12.214 404 HB3 GLN 50 HB1 GLN 50 24.870 -14.616 11.961 405 HG2 GLN 50 HG2 GLN 50 24.029 -14.177 14.248 406 HG3 GLN 50 HG1 GLN 50 25.301 -12.965 14.470 407 HE21 GLN 50 HE21 GLN 50 24.272 -10.940 14.287 408 HE22 GLN 50 HE22 GLN 50 23.221 -10.527 13.021 409 H GLN 51 HN GLN 51 26.335 -17.796 12.992 410 HA GLN 51 HA GLN 51 27.941 -17.688 10.512 411 HB2 GLN 51 HB2 GLN 51 27.198 -20.245 11.876 412 HB3 GLN 51 HB1 GLN 51 28.579 -19.865 10.854 413 HG2 GLN 51 HG2 GLN 51 28.175 -18.908 13.712 414 HG3 GLN 51 HG1 GLN 51 29.330 -20.107 13.181 415 HE21 GLN 51 HE21 GLN 51 29.439 -17.160 14.258 416 HE22 GLN 51 HE22 GLN 51 30.621 -16.427 13.292 417 H TRP 52 HN TRP 52 26.513 -17.367 8.904 418 HA TRP 52 HA TRP 52 23.855 -18.561 9.009 419 HB2 TRP 52 HB2 TRP 52 25.196 -16.529 7.247 420 HB3 TRP 52 HB1 TRP 52 23.764 -17.349 6.679 421 HD1 TRP 52 HD1 TRP 52 24.893 -15.326 9.791 422 HE1 TRP 52 HE1 TRP 52 22.835 -14.032 10.677 423 HE3 TRP 52 HE3 TRP 52 21.325 -17.102 6.619 424 HZ2 TRP 52 HZ2 TRP 52 20.038 -13.814 10.108 425 HZ3 TRP 52 HZ3 TRP 52 18.979 -16.338 6.807 426 HH2 TRP 52 HH2 TRP 52 18.342 -14.689 8.554 427 H VAL 53 HN VAL 53 23.805 -20.659 8.523 428 HA VAL 53 HA VAL 53 25.467 -21.628 6.298 429 HB VAL 53 HB VAL 53 23.808 -23.270 8.214 430 HG11 VAL 53 HG11 VAL 53 26.153 -23.971 6.422 431 HG12 VAL 53 HG12 VAL 53 24.464 -24.391 6.120 432 HG13 VAL 53 HG13 VAL 53 25.307 -25.074 7.494 433 HG21 VAL 53 HG21 VAL 53 25.349 -22.296 9.707 434 HG22 VAL 53 HG22 VAL 53 26.594 -22.151 8.457 435 HG23 VAL 53 HG23 VAL 53 26.234 -23.723 9.161 436 H ILE 54 HN ILE 54 24.548 -21.803 4.410 437 HA ILE 54 HA ILE 54 21.817 -22.731 4.187 438 HB ILE 54 HB ILE 54 22.821 -20.222 2.839 439 HG12 ILE 54 HG12 ILE 54 20.472 -20.579 4.732 440 HG13 ILE 54 HG11 ILE 54 22.049 -19.970 5.235 441 HG21 ILE 54 HG21 ILE 54 21.297 -21.742 1.409 442 HG22 ILE 54 HG22 ILE 54 20.670 -20.120 1.708 443 HG23 ILE 54 HG23 ILE 54 20.065 -21.472 2.639 444 HD11 ILE 54 HD11 ILE 54 21.847 -18.024 3.846 445 HD12 ILE 54 HD12 ILE 54 20.315 -18.199 4.696 446 HD13 ILE 54 HD13 ILE 54 20.447 -18.704 3.011 447 H GLY 55 HN GLY 55 21.799 -24.300 2.640 448 HA2 GLY 55 HA2 GLY 55 24.157 -25.143 1.366 449 HA3 GLY 55 HA1 GLY 55 22.544 -25.658 0.933 450 H GLN 56 HN GLN 56 21.345 -23.386 0.170 451 HA GLN 56 HA GLN 56 22.261 -23.024 -2.497 452 HB2 GLN 56 HB2 GLN 56 20.166 -21.562 -0.894 453 HB3 GLN 56 HB1 GLN 56 20.464 -21.261 -2.606 454 HG2 GLN 56 HG2 GLN 56 20.001 -23.588 -3.148 455 HG3 GLN 56 HG1 GLN 56 19.759 -23.973 -1.442 456 HE21 GLN 56 HE21 GLN 56 17.742 -23.283 -0.445 457 HE22 GLN 56 HE22 GLN 56 16.481 -22.634 -1.376 458 H ARG 57 HN ARG 57 22.643 -21.047 0.386 459 HA ARG 57 HA ARG 57 23.345 -18.683 -0.904 460 HB2 ARG 57 HB2 ARG 57 22.782 -18.737 1.503 461 HB3 ARG 57 HB1 ARG 57 24.338 -19.567 1.805 462 HG2 ARG 57 HG2 ARG 57 25.551 -17.642 0.918 463 HG3 ARG 57 HG1 ARG 57 24.043 -16.820 0.550 464 HD2 ARG 57 HD2 ARG 57 24.993 -15.951 2.629 465 HD3 ARG 57 HD1 ARG 57 23.491 -16.777 2.972 466 HE ARG 57 HE ARG 57 24.710 -18.354 4.195 467 HH11 ARG 57 HH21 ARG 57 26.902 -16.546 2.130 468 HH12 ARG 57 HH22 ARG 57 28.291 -16.965 3.022 469 HH21 ARG 57 HH11 ARG 57 26.603 -18.910 5.398 470 HH22 ARG 57 HH12 ARG 57 28.129 -18.355 4.875 471 H LEU 58 HN LEU 58 25.160 -17.768 -1.622 472 HA LEU 58 HA LEU 58 27.402 -19.396 -2.352 473 HB2 LEU 58 HB2 LEU 58 27.153 -16.374 -2.370 474 HB3 LEU 58 HB1 LEU 58 28.338 -17.330 -3.222 475 HG LEU 58 HG LEU 58 26.713 -16.777 -4.877 476 HD11 LEU 58 HD11 LEU 58 25.954 -19.570 -3.975 477 HD12 LEU 58 HD12 LEU 58 27.431 -19.164 -4.858 478 HD13 LEU 58 HD13 LEU 58 25.866 -18.891 -5.595 479 HD21 LEU 58 HD21 LEU 58 24.910 -16.415 -2.881 480 HD22 LEU 58 HD22 LEU 58 24.374 -17.997 -3.511 481 HD23 LEU 58 HD23 LEU 58 24.502 -16.614 -4.583 482 H ALA 59 HN ALA 59 29.534 -19.108 -1.559 483 HA ALA 59 HA ALA 59 29.787 -19.138 1.192 484 HB1 ALA 59 HB1 ALA 59 31.603 -20.094 0.103 485 HB2 ALA 59 HB2 ALA 59 32.284 -18.549 0.627 486 HB3 ALA 59 HB3 ALA 59 31.754 -18.752 -1.033 487 H ARG 60 HN ARG 60 29.781 -16.411 -0.941 488 HA ARG 60 HA ARG 60 30.925 -14.611 0.987 489 HB2 ARG 60 HB2 ARG 60 30.579 -12.855 -0.692 490 HB3 ARG 60 HB1 ARG 60 31.331 -14.269 -1.405 491 HG2 ARG 60 HG2 ARG 60 28.971 -15.023 -2.087 492 HG3 ARG 60 HG1 ARG 60 28.444 -13.403 -1.639 493 HD2 ARG 60 HD2 ARG 60 30.624 -14.007 -3.660 494 HD3 ARG 60 HD1 ARG 60 28.982 -13.605 -4.104 495 HE ARG 60 HE ARG 60 30.942 -11.785 -2.804 496 HH11 ARG 60 HH21 ARG 60 27.870 -12.244 -4.607 497 HH12 ARG 60 HH22 ARG 60 27.726 -10.576 -4.857 498 HH21 ARG 60 HH11 ARG 60 30.603 -9.592 -3.247 499 HH22 ARG 60 HH12 ARG 60 29.228 -9.060 -4.145 500 H ASP 61 HN ASP 61 29.991 -13.178 2.306 501 HA ASP 61 HA ASP 61 27.245 -13.432 3.130 502 HB2 ASP 61 HB2 ASP 61 27.817 -11.463 4.537 503 HB3 ASP 61 HB1 ASP 61 28.920 -12.801 4.787 504 H GLN 62 HN GLN 62 28.945 -11.802 0.805 505 HA GLN 62 HA GLN 62 27.660 -9.321 0.622 506 HB2 GLN 62 HB2 GLN 62 29.206 -10.958 -1.382 507 HB3 GLN 62 HB1 GLN 62 28.745 -9.269 -1.623 508 HG2 GLN 62 HG2 GLN 62 30.028 -8.554 0.291 509 HG3 GLN 62 HG1 GLN 62 30.364 -10.204 0.784 510 HE21 GLN 62 HE21 GLN 62 32.671 -8.956 0.531 511 HE22 GLN 62 HE22 GLN 62 33.417 -9.209 -0.965 512 H GLU 63 HN GLU 63 26.885 -12.457 -0.687 513 HA GLU 63 HA GLU 63 25.208 -11.630 -2.798 514 HB2 GLU 63 HB2 GLU 63 25.554 -14.221 -1.350 515 HB3 GLU 63 HB1 GLU 63 24.286 -14.043 -2.563 516 HG2 GLU 63 HG2 GLU 63 27.150 -13.284 -3.096 517 HG3 GLU 63 HG1 GLU 63 26.554 -14.898 -3.448 518 H THR 64 HN THR 64 22.969 -11.870 -3.111 519 HA THR 64 HA THR 64 21.475 -10.645 -1.060 520 HB THR 64 HB THR 64 19.573 -11.036 -2.795 521 HG1 THR 64 HG1 THR 64 21.442 -12.503 -3.942 522 HG21 THR 64 HG21 THR 64 19.970 -8.973 -3.478 523 HG22 THR 64 HG22 THR 64 21.605 -9.307 -4.059 524 HG23 THR 64 HG23 THR 64 21.309 -8.984 -2.347 525 H LEU 65 HN LEU 65 19.275 -11.390 -0.494 526 HA LEU 65 HA LEU 65 19.180 -14.080 0.531 527 HB2 LEU 65 HB2 LEU 65 16.835 -12.241 0.014 528 HB3 LEU 65 HB1 LEU 65 16.900 -13.596 1.135 529 HG LEU 65 HG LEU 65 18.437 -11.004 1.316 530 HD11 LEU 65 HD11 LEU 65 16.304 -12.251 3.040 531 HD12 LEU 65 HD12 LEU 65 16.158 -10.802 2.041 532 HD13 LEU 65 HD13 LEU 65 17.203 -10.799 3.468 533 HD21 LEU 65 HD21 LEU 65 19.406 -11.850 3.381 534 HD22 LEU 65 HD22 LEU 65 19.862 -12.909 2.068 535 HD23 LEU 65 HD23 LEU 65 18.579 -13.398 3.200 536 H HIS 66 HN HIS 66 17.971 -12.394 -2.284 537 HA HIS 66 HA HIS 66 16.454 -14.415 -3.485 538 HB2 HIS 66 HB2 HIS 66 16.717 -12.031 -4.321 539 HB3 HIS 66 HB1 HIS 66 18.284 -12.506 -4.964 540 HD1 HIS 66 HD1 HIS 66 18.045 -14.900 -6.534 541 HD2 HIS 66 HD2 HIS 66 14.719 -12.371 -6.196 542 HE1 HIS 66 HE1 HIS 66 16.531 -15.413 -8.484 543 HE2 HIS 66 HE2 HIS 66 14.536 -13.873 -8.321 544 H SER 67 HN SER 67 19.929 -13.859 -3.338 545 HA SER 67 HA SER 67 20.744 -15.829 -5.185 546 HB2 SER 67 HB2 SER 67 22.261 -15.011 -2.685 547 HB3 SER 67 HB1 SER 67 22.866 -15.673 -4.178 548 HG SER 67 HG SER 67 23.164 -13.592 -4.478 549 H HIS 68 HN HIS 68 19.850 -15.986 -1.799 550 HA HIS 68 HA HIS 68 20.482 -18.792 -1.461 551 HB2 HIS 68 HB2 HIS 68 20.365 -17.625 0.597 552 HB3 HIS 68 HB1 HIS 68 18.922 -16.746 0.151 553 HD1 HIS 68 HD1 HIS 68 18.516 -20.348 -0.549 554 HD2 HIS 68 HD2 HIS 68 18.000 -17.859 2.769 555 HE1 HIS 68 HE1 HIS 68 17.181 -21.658 1.155 556 HE2 HIS 68 HE2 HIS 68 16.818 -20.174 3.148 557 H GLY 69 HN GLY 69 18.130 -17.016 -3.106 558 HA2 GLY 69 HA2 GLY 69 16.708 -18.068 -4.677 559 HA3 GLY 69 HA1 GLY 69 16.571 -19.463 -3.614 560 H VAL 70 HN VAL 70 16.475 -16.667 -1.772 561 HA VAL 70 HA VAL 70 13.712 -17.074 -1.172 562 HB VAL 70 HB VAL 70 15.475 -14.809 -0.237 563 HG11 VAL 70 HG11 VAL 70 13.518 -16.066 1.581 564 HG12 VAL 70 HG12 VAL 70 12.805 -15.246 0.194 565 HG13 VAL 70 HG13 VAL 70 13.873 -14.371 1.283 566 HG21 VAL 70 HG21 VAL 70 15.254 -17.666 0.771 567 HG22 VAL 70 HG22 VAL 70 15.938 -16.353 1.730 568 HG23 VAL 70 HG23 VAL 70 16.710 -16.835 0.221 569 H ARG 71 HN ARG 71 12.773 -16.598 -3.206 570 HA ARG 71 HA ARG 71 12.892 -13.939 -4.344 571 HB2 ARG 71 HB2 ARG 71 10.974 -16.230 -4.843 572 HB3 ARG 71 HB1 ARG 71 10.962 -14.680 -5.680 573 HG2 ARG 71 HG2 ARG 71 13.211 -15.031 -6.533 574 HG3 ARG 71 HG1 ARG 71 13.360 -16.529 -5.616 575 HD2 ARG 71 HD2 ARG 71 12.758 -17.048 -7.943 576 HD3 ARG 71 HD1 ARG 71 11.469 -17.475 -6.816 577 HE ARG 71 HE ARG 71 11.313 -14.842 -8.097 578 HH11 ARG 71 HH21 ARG 71 10.221 -18.176 -7.950 579 HH12 ARG 71 HH22 ARG 71 8.771 -17.882 -8.800 580 HH21 ARG 71 HH11 ARG 71 9.369 -14.460 -9.244 581 HH22 ARG 71 HH12 ARG 71 8.266 -15.729 -9.540 582 H GLN 72 HN GLN 72 10.802 -15.730 -2.184 583 HA GLN 72 HA GLN 72 9.366 -13.264 -1.517 584 HB2 GLN 72 HB2 GLN 72 7.221 -14.369 -1.739 585 HB3 GLN 72 HB1 GLN 72 8.080 -14.512 -3.260 586 HG2 GLN 72 HG2 GLN 72 8.914 -16.794 -2.398 587 HG3 GLN 72 HG1 GLN 72 7.682 -16.645 -1.157 588 HE21 GLN 72 HE21 GLN 72 8.223 -17.368 -4.486 589 HE22 GLN 72 HE22 GLN 72 6.601 -17.605 -4.916 590 H ASN 73 HN ASN 73 7.779 -13.768 0.318 591 HA ASN 73 HA ASN 73 9.217 -14.553 2.615 592 HB2 ASN 73 HB2 ASN 73 7.260 -14.163 3.832 593 HB3 ASN 73 HB1 ASN 73 7.064 -13.081 2.452 594 HD21 ASN 73 HD21 ASN 73 5.464 -13.728 0.805 595 HD22 ASN 73 HD22 ASN 73 4.302 -14.910 1.141 596 H GLY 74 HN GLY 74 8.611 -16.309 4.108 597 HA2 GLY 74 HA2 GLY 74 7.745 -18.364 4.580 598 HA3 GLY 74 HA1 GLY 74 7.351 -18.639 2.896 599 H ASP 75 HN ASP 75 10.474 -17.457 2.993 600 HA ASP 75 HA ASP 75 11.495 -20.137 2.562 601 HB2 ASP 75 HB2 ASP 75 12.155 -17.743 1.391 602 HB3 ASP 75 HB1 ASP 75 13.488 -17.999 2.522 603 H SER 76 HN SER 76 13.677 -20.670 3.487 604 HA SER 76 HA SER 76 13.778 -19.820 6.284 605 HB2 SER 76 HB2 SER 76 14.414 -22.433 6.581 606 HB3 SER 76 HB1 SER 76 12.825 -21.750 6.821 607 HG SER 76 HG SER 76 12.287 -22.327 4.691 608 H ALA 77 HN ALA 77 15.839 -20.491 7.403 609 HA ALA 77 HA ALA 77 18.122 -21.199 5.746 610 HB1 ALA 77 HB1 ALA 77 18.173 -18.856 5.312 611 HB2 ALA 77 HB2 ALA 77 19.403 -19.152 6.548 612 HB3 ALA 77 HB3 ALA 77 17.843 -18.469 7.005 613 H TYR 78 HN TYR 78 20.182 -21.308 7.134 614 HA TYR 78 HA TYR 78 19.501 -21.955 9.911 615 HB2 TYR 78 HB2 TYR 78 21.324 -23.401 8.009 616 HB3 TYR 78 HB1 TYR 78 21.660 -23.426 9.726 617 HD1 TYR 78 HD2 TYR 78 19.115 -24.306 7.149 618 HD2 TYR 78 HD1 TYR 78 20.305 -24.652 11.266 619 HE1 TYR 78 HE2 TYR 78 17.399 -26.050 7.513 620 HE2 TYR 78 HE1 TYR 78 18.598 -26.380 11.626 621 HH TYR 78 HH TYR 78 17.250 -27.939 10.423 622 H LEU 79 HN LEU 79 20.539 -21.015 11.456 623 HA LEU 79 HA LEU 79 22.941 -19.400 10.861 624 HB2 LEU 79 HB2 LEU 79 20.912 -18.033 11.260 625 HB3 LEU 79 HB1 LEU 79 20.750 -18.752 12.853 626 HG LEU 79 HG LEU 79 23.348 -17.401 12.046 627 HD11 LEU 79 HD11 LEU 79 22.518 -15.290 12.920 628 HD12 LEU 79 HD12 LEU 79 20.939 -16.008 13.226 629 HD13 LEU 79 HD13 LEU 79 21.514 -15.822 11.576 630 HD21 LEU 79 HD21 LEU 79 22.531 -16.923 14.735 631 HD22 LEU 79 HD22 LEU 79 23.866 -17.920 14.169 632 HD23 LEU 79 HD23 LEU 79 22.280 -18.642 14.425 633 H TYR 80 HN TYR 80 24.670 -20.045 12.074 634 HA TYR 80 HA TYR 80 24.117 -21.738 14.432 635 HB2 TYR 80 HB2 TYR 80 25.861 -22.354 12.476 636 HB3 TYR 80 HB1 TYR 80 26.892 -21.282 13.401 637 HD1 TYR 80 HD2 TYR 80 27.652 -21.816 15.663 638 HD2 TYR 80 HD1 TYR 80 25.039 -24.462 13.490 639 HE1 TYR 80 HE2 TYR 80 28.097 -23.635 17.298 640 HE2 TYR 80 HE1 TYR 80 25.489 -26.243 15.116 641 HH TYR 80 HH TYR 80 26.243 -26.260 17.653 642 H LEU 81 HN LEU 81 24.263 -20.788 16.402 643 HA LEU 81 HA LEU 81 25.626 -18.180 16.502 644 HB2 LEU 81 HB2 LEU 81 23.133 -18.205 16.929 645 HB3 LEU 81 HB1 LEU 81 23.445 -19.209 18.330 646 HG LEU 81 HG LEU 81 24.904 -17.458 19.289 647 HD11 LEU 81 HD11 LEU 81 24.278 -16.163 16.644 648 HD12 LEU 81 HD12 LEU 81 25.780 -16.165 17.564 649 HD13 LEU 81 HD13 LEU 81 24.453 -15.126 18.060 650 HD21 LEU 81 HD21 LEU 81 22.983 -15.683 19.474 651 HD22 LEU 81 HD22 LEU 81 22.717 -17.302 20.115 652 HD23 LEU 81 HD23 LEU 81 22.046 -16.853 18.546 653 H LEU 82 HN LEU 82 27.273 -17.918 17.839 654 HA LEU 82 HA LEU 82 28.035 -20.174 19.602 655 HB2 LEU 82 HB2 LEU 82 29.765 -18.117 18.232 656 HB3 LEU 82 HB1 LEU 82 30.326 -19.408 19.290 657 HG LEU 82 HG LEU 82 28.799 -19.836 16.687 658 HD11 LEU 82 HD11 LEU 82 30.979 -19.052 16.120 659 HD12 LEU 82 HD12 LEU 82 31.020 -20.803 15.949 660 HD13 LEU 82 HD13 LEU 82 31.738 -20.044 17.362 661 HD21 LEU 82 HD21 LEU 82 28.365 -21.668 18.195 662 HD22 LEU 82 HD22 LEU 82 30.045 -21.715 18.724 663 HD23 LEU 82 HD23 LEU 82 29.622 -22.218 17.088 664 H SER 83 HN SER 83 28.789 -19.788 21.647 665 HA SER 83 HA SER 83 28.010 -17.333 22.916 666 HB2 SER 83 HB2 SER 83 29.629 -18.823 24.686 667 HB3 SER 83 HB1 SER 83 27.888 -18.780 24.625 668 HG SER 83 HG SER 83 28.937 -20.889 24.402 669 H ALA 84 HN ALA 84 29.698 -16.796 20.864 670 HA ALA 84 HA ALA 84 32.426 -16.542 21.824 671 HB1 ALA 84 HB1 ALA 84 33.005 -16.261 19.688 672 HB2 ALA 84 HB2 ALA 84 31.755 -15.062 19.401 673 HB3 ALA 84 HB3 ALA 84 31.365 -16.791 19.306 674 H ARG 85 HN ARG 85 33.225 -14.193 20.787 675 HA ARG 85 HA ARG 85 31.685 -12.063 22.084 676 HB2 ARG 85 HB2 ARG 85 34.679 -12.260 22.383 677 HB3 ARG 85 HB1 ARG 85 33.537 -11.229 23.236 678 HG2 ARG 85 HG2 ARG 85 33.273 -14.233 23.553 679 HG3 ARG 85 HG1 ARG 85 34.526 -13.383 24.409 680 HD2 ARG 85 HD2 ARG 85 32.630 -13.464 25.844 681 HD3 ARG 85 HD1 ARG 85 32.831 -11.793 25.331 682 HE ARG 85 HE ARG 85 31.007 -13.315 23.659 683 HH11 ARG 85 HH21 ARG 85 31.379 -11.505 26.639 684 HH12 ARG 85 HH22 ARG 85 29.730 -11.097 26.755 685 HH21 ARG 85 HH11 ARG 85 28.772 -12.736 23.824 686 HH22 ARG 85 HH12 ARG 85 28.243 -11.779 25.139 687 H ASN 86 HN ASN 86 33.078 -9.947 21.468 688 HA ASN 86 HA ASN 86 33.075 -9.844 18.594 689 HB2 ASN 86 HB2 ASN 86 32.617 -7.903 20.284 690 HB3 ASN 86 HB1 ASN 86 34.369 -7.743 20.309 691 HD21 ASN 86 HD21 ASN 86 35.069 -8.187 17.627 692 HD22 ASN 86 HD22 ASN 86 34.356 -7.032 16.631 693 H THR 87 HN THR 87 34.884 -11.855 19.636 694 HA THR 87 HA THR 87 37.561 -10.894 19.349 695 HB THR 87 HB THR 87 37.528 -13.667 18.969 696 HG1 THR 87 HG1 THR 87 35.523 -14.052 19.542 697 HG21 THR 87 HG21 THR 87 37.804 -11.959 21.454 698 HG22 THR 87 HG22 THR 87 39.096 -12.528 20.401 699 HG23 THR 87 HG23 THR 87 38.227 -13.671 21.404 700 H SER 88 HN SER 88 37.174 -9.773 17.370 701 HA SER 88 HA SER 88 36.247 -10.830 15.013 702 HB2 SER 88 HB2 SER 88 38.411 -8.758 15.209 703 HB3 SER 88 HB1 SER 88 37.132 -8.877 14.015 704 HG SER 88 HG SER 88 36.270 -7.496 15.380 705 H LEU 89 HN LEU 89 37.264 -11.678 13.160 706 HA LEU 89 HA LEU 89 39.612 -13.298 13.681 707 HB2 LEU 89 HB2 LEU 89 37.998 -12.998 11.133 708 HB3 LEU 89 HB1 LEU 89 39.222 -14.218 11.446 709 HG LEU 89 HG LEU 89 36.650 -13.884 13.038 710 HD11 LEU 89 HD11 LEU 89 36.754 -14.879 10.545 711 HD12 LEU 89 HD12 LEU 89 35.690 -15.525 11.783 712 HD13 LEU 89 HD13 LEU 89 37.214 -16.329 11.438 713 HD21 LEU 89 HD21 LEU 89 38.940 -15.884 13.194 714 HD22 LEU 89 HD22 LEU 89 37.368 -16.171 13.921 715 HD23 LEU 89 HD23 LEU 89 38.350 -14.821 14.471 716 H ASN 90 HN ASN 90 40.991 -11.470 14.051 717 HA ASN 90 HA ASN 90 42.527 -10.833 11.735 718 HB2 ASN 90 HB2 ASN 90 42.413 -8.315 12.413 719 HB3 ASN 90 HB1 ASN 90 41.201 -8.989 11.314 720 HD21 ASN 90 HD21 ASN 90 41.763 -7.743 14.552 721 HD22 ASN 90 HD22 ASN 90 40.142 -7.685 15.037 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 6.589 0.094 -1.006 2 H2 MET 1 HT2 MET 1 6.915 0.040 0.638 3 H3 MET 1 HT3 MET 1 6.091 1.362 0.013 4 HA MET 1 HA MET 1 5.162 -1.083 1.024 5 HB2 MET 1 HB2 MET 1 4.158 1.583 0.516 6 HB3 MET 1 HB1 MET 1 2.984 0.407 -0.057 7 HG2 MET 1 HG2 MET 1 4.190 0.531 2.719 8 HG3 MET 1 HG1 MET 1 2.540 0.911 2.270 9 HE1 MET 1 HE1 MET 1 5.089 -1.904 3.120 10 HE2 MET 1 HE2 MET 1 3.866 -2.900 3.876 11 HE3 MET 1 HE3 MET 1 4.001 -1.208 4.333 12 HA PRO 2 HA PRO 2 2.941 -1.610 -3.389 13 HB2 PRO 2 HB2 PRO 2 5.170 -0.484 -5.016 14 HB3 PRO 2 HB1 PRO 2 3.424 -0.432 -5.272 15 HG2 PRO 2 HG2 PRO 2 4.597 1.728 -4.430 16 HG3 PRO 2 HG1 PRO 2 3.059 1.237 -3.713 17 HD2 PRO 2 HD2 PRO 2 5.798 0.971 -2.532 18 HD3 PRO 2 HD1 PRO 2 4.249 1.395 -1.753 19 H THR 3 HN THR 3 6.520 -1.641 -3.279 20 HA THR 3 HA THR 3 6.548 -4.395 -4.253 21 HB THR 3 HB THR 3 9.135 -3.877 -3.885 22 HG1 THR 3 HG1 THR 3 9.406 -1.912 -3.317 23 HG21 THR 3 HG21 THR 3 7.347 -2.920 -6.129 24 HG22 THR 3 HG22 THR 3 8.325 -4.382 -6.055 25 HG23 THR 3 HG23 THR 3 9.105 -2.815 -6.219 26 H GLN 4 HN GLN 4 5.511 -5.232 -2.394 27 HA GLN 4 HA GLN 4 6.319 -4.673 0.230 28 HB2 GLN 4 HB2 GLN 4 4.881 -7.094 -0.846 29 HB3 GLN 4 HB1 GLN 4 5.087 -6.735 0.860 30 HG2 GLN 4 HG2 GLN 4 3.933 -4.555 0.554 31 HG3 GLN 4 HG1 GLN 4 3.688 -4.929 -1.151 32 HE21 GLN 4 HE21 GLN 4 3.228 -7.888 -0.322 33 HE22 GLN 4 HE22 GLN 4 1.647 -7.892 0.249 34 H ASP 5 HN ASP 5 7.552 -5.716 1.659 35 HA ASP 5 HA ASP 5 9.848 -7.186 0.645 36 HB2 ASP 5 HB2 ASP 5 8.981 -6.255 3.374 37 HB3 ASP 5 HB1 ASP 5 10.338 -7.344 3.158 38 H ILE 6 HN ILE 6 10.454 -9.175 2.071 39 HA ILE 6 HA ILE 6 8.039 -10.883 2.250 40 HB ILE 6 HB ILE 6 9.365 -12.737 1.391 41 HG12 ILE 6 HG12 ILE 6 11.511 -10.682 0.790 42 HG13 ILE 6 HG11 ILE 6 11.616 -11.785 2.161 43 HG21 ILE 6 HG21 ILE 6 8.188 -11.756 -0.388 44 HG22 ILE 6 HG22 ILE 6 9.848 -11.556 -0.961 45 HG23 ILE 6 HG23 ILE 6 9.018 -10.218 -0.194 46 HD11 ILE 6 HD11 ILE 6 11.406 -12.561 -0.761 47 HD12 ILE 6 HD12 ILE 6 11.444 -13.689 0.599 48 HD13 ILE 6 HD13 ILE 6 12.842 -12.664 0.257 49 H ARG 7 HN ARG 7 8.245 -12.713 3.575 50 HA ARG 7 HA ARG 7 9.703 -12.124 6.049 51 HB2 ARG 7 HB2 ARG 7 7.652 -14.327 5.563 52 HB3 ARG 7 HB1 ARG 7 8.311 -13.782 7.078 53 HG2 ARG 7 HG2 ARG 7 7.350 -11.563 6.837 54 HG3 ARG 7 HG1 ARG 7 6.741 -11.967 5.233 55 HD2 ARG 7 HD2 ARG 7 5.938 -13.435 7.756 56 HD3 ARG 7 HD1 ARG 7 5.001 -12.143 7.024 57 HE ARG 7 HE ARG 7 5.490 -14.113 5.031 58 HH11 ARG 7 HH21 ARG 7 3.760 -13.661 8.009 59 HH12 ARG 7 HH22 ARG 7 2.529 -14.779 7.640 60 HH21 ARG 7 HH11 ARG 7 3.924 -15.594 4.511 61 HH22 ARG 7 HH12 ARG 7 2.614 -15.920 5.588 62 H LEU 8 HN LEU 8 11.565 -13.096 6.455 63 HA LEU 8 HA LEU 8 12.173 -15.695 5.204 64 HB2 LEU 8 HB2 LEU 8 13.576 -13.743 4.459 65 HB3 LEU 8 HB1 LEU 8 14.119 -13.548 6.118 66 HG LEU 8 HG LEU 8 15.595 -14.913 4.431 67 HD11 LEU 8 HD11 LEU 8 15.141 -16.363 6.995 68 HD12 LEU 8 HD12 LEU 8 15.738 -14.697 7.024 69 HD13 LEU 8 HD13 LEU 8 16.644 -15.948 6.185 70 HD21 LEU 8 HD21 LEU 8 13.510 -16.409 3.887 71 HD22 LEU 8 HD22 LEU 8 13.915 -17.226 5.404 72 HD23 LEU 8 HD23 LEU 8 15.074 -17.184 4.099 73 H TRP 9 HN TRP 9 12.329 -17.335 6.660 74 HA TRP 9 HA TRP 9 12.424 -16.662 9.531 75 HB2 TRP 9 HB2 TRP 9 12.276 -19.450 8.420 76 HB3 TRP 9 HB1 TRP 9 11.725 -18.837 9.970 77 HD1 TRP 9 HD1 TRP 9 10.145 -16.285 8.691 78 HE1 TRP 9 HE1 TRP 9 7.856 -16.775 7.543 79 HE3 TRP 9 HE3 TRP 9 10.657 -21.259 7.792 80 HZ2 TRP 9 HZ2 TRP 9 6.470 -19.012 6.405 81 HZ3 TRP 9 HZ3 TRP 9 8.878 -22.542 6.678 82 HH2 TRP 9 HH2 TRP 9 6.767 -21.401 5.985 83 H VAL 10 HN VAL 10 14.188 -17.067 10.775 84 HA VAL 10 HA VAL 10 16.366 -18.581 9.491 85 HB VAL 10 HB VAL 10 16.910 -16.505 11.592 86 HG11 VAL 10 HG11 VAL 10 18.589 -17.261 9.231 87 HG12 VAL 10 HG12 VAL 10 18.583 -18.273 10.678 88 HG13 VAL 10 HG13 VAL 10 19.089 -16.579 10.771 89 HG21 VAL 10 HG21 VAL 10 17.358 -14.913 9.732 90 HG22 VAL 10 HG22 VAL 10 15.637 -15.288 9.856 91 HG23 VAL 10 HG23 VAL 10 16.634 -16.046 8.606 92 H SER 11 HN SER 11 16.897 -20.360 10.485 93 HA SER 11 HA SER 11 15.737 -20.982 13.095 94 HB2 SER 11 HB2 SER 11 17.508 -22.826 11.536 95 HB3 SER 11 HB1 SER 11 16.144 -23.208 12.564 96 HG SER 11 HG SER 11 16.192 -22.142 9.940 97 H VAL 12 HN VAL 12 16.904 -20.388 14.869 98 HA VAL 12 HA VAL 12 19.771 -20.035 14.544 99 HB VAL 12 HB VAL 12 18.052 -19.225 16.852 100 HG11 VAL 12 HG11 VAL 12 20.502 -17.776 15.877 101 HG12 VAL 12 HG12 VAL 12 20.687 -19.234 16.854 102 HG13 VAL 12 HG13 VAL 12 19.805 -17.843 17.492 103 HG21 VAL 12 HG21 VAL 12 17.751 -17.051 15.774 104 HG22 VAL 12 HG22 VAL 12 17.169 -18.292 14.681 105 HG23 VAL 12 HG23 VAL 12 18.747 -17.547 14.409 106 H GLU 13 HN GLU 13 21.034 -21.641 15.136 107 HA GLU 13 HA GLU 13 20.295 -23.300 17.479 108 HB2 GLU 13 HB2 GLU 13 21.810 -24.112 14.981 109 HB3 GLU 13 HB1 GLU 13 21.669 -25.100 16.425 110 HG2 GLU 13 HG2 GLU 13 19.257 -25.170 16.253 111 HG3 GLU 13 HG1 GLU 13 19.264 -24.084 14.874 112 H ASP 14 HN ASP 14 21.607 -22.997 19.156 113 HA ASP 14 HA ASP 14 24.180 -21.679 18.736 114 HB2 ASP 14 HB2 ASP 14 23.085 -20.501 20.400 115 HB3 ASP 14 HB1 ASP 14 22.290 -21.971 20.962 116 H ALA 15 HN ALA 15 26.039 -22.298 19.618 117 HA ALA 15 HA ALA 15 26.737 -25.037 19.419 118 HB1 ALA 15 HB1 ALA 15 28.891 -24.272 20.494 119 HB2 ALA 15 HB2 ALA 15 28.158 -22.681 20.651 120 HB3 ALA 15 HB3 ALA 15 28.420 -23.374 19.051 121 H GLN 16 HN GLN 16 25.947 -22.952 22.152 122 HA GLN 16 HA GLN 16 26.399 -25.119 24.050 123 HB2 GLN 16 HB2 GLN 16 25.168 -22.370 24.593 124 HB3 GLN 16 HB1 GLN 16 25.673 -23.561 25.780 125 HG2 GLN 16 HG2 GLN 16 27.517 -22.245 23.777 126 HG3 GLN 16 HG1 GLN 16 27.396 -21.839 25.485 127 HE21 GLN 16 HE21 GLN 16 29.375 -23.481 23.463 128 HE22 GLN 16 HE22 GLN 16 29.892 -24.709 24.498 129 H MET 17 HN MET 17 24.317 -24.935 21.780 130 HA MET 17 HA MET 17 22.512 -26.153 21.320 131 HB2 MET 17 HB2 MET 17 22.490 -26.904 24.265 132 HB3 MET 17 HB1 MET 17 21.396 -27.531 23.044 133 HG2 MET 17 HG2 MET 17 23.250 -28.410 21.732 134 HG3 MET 17 HG1 MET 17 24.418 -27.731 22.857 135 HE1 MET 17 HE1 MET 17 21.800 -31.334 22.992 136 HE2 MET 17 HE2 MET 17 21.567 -29.848 22.103 137 HE3 MET 17 HE3 MET 17 20.919 -29.992 23.728 138 H HIS 18 HN HIS 18 22.400 -23.266 22.416 139 HA HIS 18 HA HIS 18 19.610 -23.109 23.237 140 HB2 HIS 18 HB2 HIS 18 21.431 -20.866 22.207 141 HB3 HIS 18 HB1 HIS 18 19.811 -20.693 22.822 142 HD1 HIS 18 HD1 HIS 18 23.239 -21.760 23.949 143 HD2 HIS 18 HD2 HIS 18 19.564 -20.648 25.600 144 HE1 HIS 18 HE1 HIS 18 23.617 -21.432 26.472 145 HE2 HIS 18 HE2 HIS 18 21.367 -20.761 27.470 146 H THR 19 HN THR 19 17.886 -23.139 21.875 147 HA THR 19 HA THR 19 18.446 -22.847 18.982 148 HB THR 19 HB THR 19 16.365 -24.656 20.196 149 HG1 THR 19 HG1 THR 19 18.827 -25.007 20.541 150 HG21 THR 19 HG21 THR 19 16.013 -25.426 18.054 151 HG22 THR 19 HG22 THR 19 17.637 -25.035 17.513 152 HG23 THR 19 HG23 THR 19 16.439 -23.762 17.686 153 H VAL 20 HN VAL 20 17.355 -21.184 18.090 154 HA VAL 20 HA VAL 20 14.623 -20.717 18.974 155 HB VAL 20 HB VAL 20 14.936 -18.245 19.097 156 HG11 VAL 20 HG11 VAL 20 15.026 -19.896 21.099 157 HG12 VAL 20 HG12 VAL 20 15.620 -18.264 21.356 158 HG13 VAL 20 HG13 VAL 20 16.757 -19.577 21.101 159 HG21 VAL 20 HG21 VAL 20 17.876 -19.031 18.918 160 HG22 VAL 20 HG22 VAL 20 17.324 -17.493 19.565 161 HG23 VAL 20 HG23 VAL 20 16.996 -17.896 17.885 162 H THR 21 HN THR 21 13.392 -19.317 17.535 163 HA THR 21 HA THR 21 14.431 -19.415 14.774 164 HB THR 21 HB THR 21 11.554 -19.784 15.670 165 HG1 THR 21 HG1 THR 21 12.987 -21.553 16.117 166 HG21 THR 21 HG21 THR 21 11.891 -18.703 13.431 167 HG22 THR 21 HG22 THR 21 11.083 -20.247 13.348 168 HG23 THR 21 HG23 THR 21 12.803 -20.127 12.928 169 H ILE 22 HN ILE 22 14.301 -17.561 13.637 170 HA ILE 22 HA ILE 22 12.730 -15.371 14.830 171 HB ILE 22 HB ILE 22 14.463 -13.790 14.215 172 HG12 ILE 22 HG12 ILE 22 16.127 -16.225 13.494 173 HG13 ILE 22 HG11 ILE 22 15.389 -15.116 12.325 174 HG21 ILE 22 HG21 ILE 22 16.171 -14.456 15.883 175 HG22 ILE 22 HG22 ILE 22 15.537 -16.094 15.890 176 HG23 ILE 22 HG23 ILE 22 14.543 -14.754 16.480 177 HD11 ILE 22 HD11 ILE 22 17.873 -14.705 12.988 178 HD12 ILE 22 HD12 ILE 22 17.210 -14.076 14.488 179 HD13 ILE 22 HD13 ILE 22 16.770 -13.329 12.953 180 H TRP 23 HN TRP 23 11.886 -13.892 13.398 181 HA TRP 23 HA TRP 23 11.705 -14.824 10.593 182 HB2 TRP 23 HB2 TRP 23 9.677 -13.317 12.285 183 HB3 TRP 23 HB1 TRP 23 9.511 -13.634 10.566 184 HD1 TRP 23 HD1 TRP 23 8.450 -15.864 9.902 185 HE1 TRP 23 HE1 TRP 23 7.848 -18.048 11.134 186 HE3 TRP 23 HE3 TRP 23 10.525 -14.926 14.471 187 HZ2 TRP 23 HZ2 TRP 23 8.176 -19.230 13.698 188 HZ3 TRP 23 HZ3 TRP 23 10.361 -16.599 16.290 189 HH2 TRP 23 HH2 TRP 23 9.183 -18.751 15.904 190 H LEU 24 HN LEU 24 12.636 -13.505 9.161 191 HA LEU 24 HA LEU 24 13.082 -10.687 9.952 192 HB2 LEU 24 HB2 LEU 24 14.621 -12.376 7.976 193 HB3 LEU 24 HB1 LEU 24 14.975 -10.702 8.385 194 HG LEU 24 HG LEU 24 15.025 -13.018 10.358 195 HD11 LEU 24 HD11 LEU 24 16.923 -12.721 8.538 196 HD12 LEU 24 HD12 LEU 24 17.312 -13.032 10.227 197 HD13 LEU 24 HD13 LEU 24 17.420 -11.407 9.609 198 HD21 LEU 24 HD21 LEU 24 16.368 -11.002 11.541 199 HD22 LEU 24 HD22 LEU 24 14.630 -11.261 11.784 200 HD23 LEU 24 HD23 LEU 24 15.195 -10.041 10.642 201 H THR 25 HN THR 25 12.326 -9.109 8.666 202 HA THR 25 HA THR 25 10.832 -9.994 6.280 203 HB THR 25 HB THR 25 10.285 -7.412 7.724 204 HG1 THR 25 HG1 THR 25 10.232 -9.033 9.295 205 HG21 THR 25 HG21 THR 25 9.263 -8.150 5.467 206 HG22 THR 25 HG22 THR 25 8.176 -7.592 6.722 207 HG23 THR 25 HG23 THR 25 8.342 -9.320 6.417 208 H VAL 26 HN VAL 26 11.859 -9.511 4.479 209 HA VAL 26 HA VAL 26 13.075 -6.892 4.062 210 HB VAL 26 HB VAL 26 15.187 -8.070 3.229 211 HG11 VAL 26 HG11 VAL 26 15.042 -6.768 5.378 212 HG12 VAL 26 HG12 VAL 26 16.195 -8.100 5.442 213 HG13 VAL 26 HG13 VAL 26 14.622 -8.275 6.189 214 HG21 VAL 26 HG21 VAL 26 14.504 -10.353 3.130 215 HG22 VAL 26 HG22 VAL 26 13.849 -10.318 4.773 216 HG23 VAL 26 HG23 VAL 26 15.582 -10.274 4.523 217 H ARG 27 HN ARG 27 14.189 -7.132 1.740 218 HA ARG 27 HA ARG 27 12.225 -8.427 -0.011 219 HB2 ARG 27 HB2 ARG 27 13.237 -7.058 -1.836 220 HB3 ARG 27 HB1 ARG 27 12.516 -6.071 -0.583 221 HG2 ARG 27 HG2 ARG 27 15.479 -6.759 -0.485 222 HG3 ARG 27 HG1 ARG 27 14.899 -5.442 -1.471 223 HD2 ARG 27 HD2 ARG 27 14.941 -5.657 1.514 224 HD3 ARG 27 HD1 ARG 27 15.359 -4.307 0.511 225 HE ARG 27 HE ARG 27 12.684 -5.063 1.435 226 HH11 ARG 27 HH21 ARG 27 14.629 -3.063 -0.670 227 HH12 ARG 27 HH22 ARG 27 13.467 -1.834 -0.841 228 HH21 ARG 27 HH11 ARG 27 11.113 -3.452 1.213 229 HH22 ARG 27 HH12 ARG 27 11.418 -2.053 0.250 230 HA PRO 28 HA PRO 28 15.134 -11.628 -0.727 231 HB2 PRO 28 HB2 PRO 28 14.688 -12.228 -3.380 232 HB3 PRO 28 HB1 PRO 28 13.645 -12.744 -2.043 233 HG2 PRO 28 HG2 PRO 28 13.250 -10.488 -3.939 234 HG3 PRO 28 HG1 PRO 28 12.081 -11.625 -3.241 235 HD2 PRO 28 HD2 PRO 28 12.310 -9.109 -2.284 236 HD3 PRO 28 HD1 PRO 28 11.862 -10.465 -1.242 237 H ASP 29 HN ASP 29 15.059 -8.788 -2.586 238 HA ASP 29 HA ASP 29 17.527 -9.053 -3.996 239 HB2 ASP 29 HB2 ASP 29 15.673 -7.478 -4.641 240 HB3 ASP 29 HB1 ASP 29 16.157 -6.465 -3.281 241 H MET 30 HN MET 30 16.656 -8.204 -0.766 242 HA MET 30 HA MET 30 18.811 -6.538 -0.068 243 HB2 MET 30 HB2 MET 30 16.693 -7.850 1.361 244 HB3 MET 30 HB1 MET 30 18.202 -8.213 2.180 245 HG2 MET 30 HG2 MET 30 17.628 -5.383 1.324 246 HG3 MET 30 HG1 MET 30 16.892 -6.020 2.778 247 HE1 MET 30 HE1 MET 30 17.795 -7.080 4.490 248 HE2 MET 30 HE2 MET 30 19.207 -6.495 5.343 249 HE3 MET 30 HE3 MET 30 19.351 -7.906 4.301 250 H THR 31 HN THR 31 20.589 -7.239 1.508 251 HA THR 31 HA THR 31 21.828 -9.627 0.356 252 HB THR 31 HB THR 31 22.798 -7.072 0.238 253 HG1 THR 31 HG1 THR 31 23.688 -9.601 -0.218 254 HG21 THR 31 HG21 THR 31 24.868 -7.113 1.675 255 HG22 THR 31 HG22 THR 31 24.175 -8.436 2.564 256 HG23 THR 31 HG23 THR 31 23.370 -6.845 2.557 257 H VAL 32 HN VAL 32 23.223 -10.908 1.611 258 HA VAL 32 HA VAL 32 22.095 -11.706 4.044 259 HB VAL 32 HB VAL 32 24.800 -12.316 2.828 260 HG11 VAL 32 HG11 VAL 32 23.412 -13.565 5.212 261 HG12 VAL 32 HG12 VAL 32 24.964 -12.721 5.204 262 HG13 VAL 32 HG13 VAL 32 24.799 -14.270 4.382 263 HG21 VAL 32 HG21 VAL 32 23.604 -14.525 2.396 264 HG22 VAL 32 HG22 VAL 32 23.011 -13.173 1.448 265 HG23 VAL 32 HG23 VAL 32 22.110 -13.725 2.863 266 H ALA 33 HN ALA 33 25.047 -9.852 3.401 267 HA ALA 33 HA ALA 33 25.930 -9.529 6.042 268 HB1 ALA 33 HB1 ALA 33 27.493 -8.338 4.965 269 HB2 ALA 33 HB2 ALA 33 26.354 -7.029 4.781 270 HB3 ALA 33 HB3 ALA 33 26.499 -8.256 3.513 271 H SER 34 HN SER 34 23.726 -7.476 4.209 272 HA SER 34 HA SER 34 23.076 -5.745 6.359 273 HB2 SER 34 HB2 SER 34 21.438 -6.469 3.925 274 HB3 SER 34 HB1 SER 34 21.123 -5.111 4.989 275 HG SER 34 HG SER 34 22.343 -4.334 3.289 276 H LEU 35 HN LEU 35 21.595 -8.719 5.149 277 HA LEU 35 HA LEU 35 19.421 -8.803 6.969 278 HB2 LEU 35 HB2 LEU 35 19.548 -10.176 4.912 279 HB3 LEU 35 HB1 LEU 35 20.885 -11.077 5.615 280 HG LEU 35 HG LEU 35 19.428 -11.859 7.445 281 HD11 LEU 35 HD11 LEU 35 16.845 -11.367 6.699 282 HD12 LEU 35 HD12 LEU 35 17.605 -9.828 6.286 283 HD13 LEU 35 HD13 LEU 35 17.734 -10.487 7.931 284 HD21 LEU 35 HD21 LEU 35 17.981 -12.285 4.820 285 HD22 LEU 35 HD22 LEU 35 18.091 -13.388 6.174 286 HD23 LEU 35 HD23 LEU 35 19.519 -13.081 5.183 287 H LYS 36 HN LYS 36 22.710 -10.156 7.083 288 HA LYS 36 HA LYS 36 22.604 -11.529 9.508 289 HB2 LYS 36 HB2 LYS 36 24.385 -11.626 7.756 290 HB3 LYS 36 HB1 LYS 36 24.886 -10.001 8.226 291 HG2 LYS 36 HG2 LYS 36 25.334 -10.851 10.539 292 HG3 LYS 36 HG1 LYS 36 24.951 -12.475 9.990 293 HD2 LYS 36 HD2 LYS 36 26.990 -10.757 8.631 294 HD3 LYS 36 HD1 LYS 36 27.440 -11.844 9.963 295 HE2 LYS 36 HE2 LYS 36 26.391 -13.740 8.559 296 HE3 LYS 36 HE1 LYS 36 26.280 -12.577 7.242 297 HZ1 LYS 36 HZ1 LYS 36 28.526 -14.043 8.162 298 HZ2 LYS 36 HZ2 LYS 36 28.879 -12.387 8.138 299 HZ3 LYS 36 HZ3 LYS 36 28.328 -13.168 6.740 300 H ASP 37 HN ASP 37 23.437 -8.226 8.622 301 HA ASP 37 HA ASP 37 24.160 -7.263 11.159 302 HB2 ASP 37 HB2 ASP 37 24.711 -6.066 9.154 303 HB3 ASP 37 HB1 ASP 37 23.022 -5.808 8.768 304 H MET 38 HN MET 38 20.955 -7.314 9.538 305 HA MET 38 HA MET 38 19.582 -5.820 11.484 306 HB2 MET 38 HB2 MET 38 18.576 -8.144 9.897 307 HB3 MET 38 HB1 MET 38 17.621 -6.951 10.797 308 HG2 MET 38 HG2 MET 38 18.655 -5.192 9.429 309 HG3 MET 38 HG1 MET 38 19.372 -6.398 8.396 310 HE1 MET 38 HE1 MET 38 16.239 -8.198 9.443 311 HE2 MET 38 HE2 MET 38 17.553 -8.679 8.393 312 HE3 MET 38 HE3 MET 38 15.947 -8.525 7.731 313 H VAL 39 HN VAL 39 20.244 -9.138 11.148 314 HA VAL 39 HA VAL 39 18.737 -10.085 13.302 315 HB VAL 39 HB VAL 39 21.318 -11.237 12.195 316 HG11 VAL 39 HG11 VAL 39 20.714 -11.937 14.642 317 HG12 VAL 39 HG12 VAL 39 20.993 -13.200 13.453 318 HG13 VAL 39 HG13 VAL 39 19.352 -12.771 13.893 319 HG21 VAL 39 HG21 VAL 39 19.535 -12.967 11.408 320 HG22 VAL 39 HG22 VAL 39 19.669 -11.430 10.533 321 HG23 VAL 39 HG23 VAL 39 18.379 -11.670 11.710 322 H PHE 40 HN PHE 40 22.012 -8.795 13.137 323 HA PHE 40 HA PHE 40 22.631 -9.063 15.904 324 HB2 PHE 40 HB2 PHE 40 24.424 -8.583 14.315 325 HB3 PHE 40 HB1 PHE 40 23.621 -7.086 13.846 326 HD1 PHE 40 HD2 PHE 40 24.754 -8.807 16.990 327 HD2 PHE 40 HD1 PHE 40 24.318 -5.109 14.845 328 HE1 PHE 40 HE2 PHE 40 25.851 -7.582 18.847 329 HE2 PHE 40 HE1 PHE 40 25.414 -3.900 16.683 330 HZ PHE 40 HZ PHE 40 26.188 -5.129 18.699 331 H LEU 41 HN LEU 41 21.166 -6.526 13.931 332 HA LEU 41 HA LEU 41 20.879 -4.536 15.941 333 HB2 LEU 41 HB2 LEU 41 18.972 -5.143 13.655 334 HB3 LEU 41 HB1 LEU 41 19.095 -3.645 14.557 335 HG LEU 41 HG LEU 41 21.281 -4.845 12.890 336 HD11 LEU 41 HD11 LEU 41 19.191 -3.879 11.731 337 HD12 LEU 41 HD12 LEU 41 20.761 -3.344 11.196 338 HD13 LEU 41 HD13 LEU 41 19.802 -2.314 12.272 339 HD21 LEU 41 HD21 LEU 41 22.329 -2.621 13.187 340 HD22 LEU 41 HD22 LEU 41 22.193 -3.542 14.686 341 HD23 LEU 41 HD23 LEU 41 21.050 -2.209 14.342 342 H ASP 42 HN ASP 42 18.812 -7.021 14.748 343 HA ASP 42 HA ASP 42 16.643 -6.414 16.533 344 HB2 ASP 42 HB2 ASP 42 16.442 -7.309 14.156 345 HB3 ASP 42 HB1 ASP 42 16.855 -8.871 14.799 346 H TYR 43 HN TYR 43 18.837 -9.233 16.280 347 HA TYR 43 HA TYR 43 17.765 -10.161 18.886 348 HB2 TYR 43 HB2 TYR 43 19.239 -11.779 16.803 349 HB3 TYR 43 HB1 TYR 43 18.394 -12.364 18.230 350 HD1 TYR 43 HD2 TYR 43 15.918 -12.070 18.473 351 HD2 TYR 43 HD1 TYR 43 17.989 -11.181 14.830 352 HE1 TYR 43 HE2 TYR 43 13.760 -12.041 17.263 353 HE2 TYR 43 HE1 TYR 43 15.879 -11.155 13.613 354 HH TYR 43 HH TYR 43 13.440 -10.632 14.385 355 H GLY 44 HN GLY 44 20.478 -8.592 17.705 356 HA2 GLY 44 HA2 GLY 44 22.395 -8.012 18.859 357 HA3 GLY 44 HA1 GLY 44 21.830 -9.002 20.181 358 H PHE 45 HN PHE 45 21.908 -10.572 17.144 359 HA PHE 45 HA PHE 45 24.008 -12.334 18.080 360 HB2 PHE 45 HB2 PHE 45 22.525 -12.350 15.436 361 HB3 PHE 45 HB1 PHE 45 23.584 -13.605 16.043 362 HD1 PHE 45 HD1 PHE 45 22.079 -12.535 18.995 363 HD2 PHE 45 HD2 PHE 45 21.071 -14.613 15.338 364 HE1 PHE 45 HE1 PHE 45 20.208 -13.626 20.121 365 HE2 PHE 45 HE2 PHE 45 19.176 -15.690 16.502 366 HZ PHE 45 HZ PHE 45 18.744 -15.201 18.891 367 HA PRO 46 HA PRO 46 26.929 -9.583 15.934 368 HB2 PRO 46 HB2 PRO 46 29.197 -10.723 16.846 369 HB3 PRO 46 HB1 PRO 46 28.219 -9.628 17.835 370 HG2 PRO 46 HG2 PRO 46 28.277 -12.606 17.866 371 HG3 PRO 46 HG1 PRO 46 28.251 -11.473 19.230 372 HD2 PRO 46 HD2 PRO 46 25.990 -12.730 18.431 373 HD3 PRO 46 HD1 PRO 46 25.969 -11.069 19.051 374 HA PRO 47 HA PRO 47 27.926 -11.919 12.296 375 HB2 PRO 47 HB2 PRO 47 30.517 -11.126 11.843 376 HB3 PRO 47 HB1 PRO 47 29.061 -10.183 11.369 377 HG2 PRO 47 HG2 PRO 47 30.862 -9.885 13.725 378 HG3 PRO 47 HG1 PRO 47 30.101 -8.629 12.719 379 HD2 PRO 47 HD2 PRO 47 29.071 -9.176 15.110 380 HD3 PRO 47 HD1 PRO 47 28.003 -8.874 13.720 381 H VAL 48 HN VAL 48 30.326 -11.977 14.881 382 HA VAL 48 HA VAL 48 31.690 -14.304 14.007 383 HB VAL 48 HB VAL 48 32.641 -12.819 15.722 384 HG11 VAL 48 HG11 VAL 48 30.827 -13.896 17.852 385 HG12 VAL 48 HG12 VAL 48 30.216 -12.593 16.818 386 HG13 VAL 48 HG13 VAL 48 31.681 -12.363 17.746 387 HG21 VAL 48 HG21 VAL 48 33.091 -15.393 15.614 388 HG22 VAL 48 HG22 VAL 48 32.137 -15.475 17.089 389 HG23 VAL 48 HG23 VAL 48 33.610 -14.522 17.048 390 H LEU 49 HN LEU 49 28.967 -13.778 16.139 391 HA LEU 49 HA LEU 49 28.552 -16.565 16.662 392 HB2 LEU 49 HB2 LEU 49 26.831 -14.168 17.238 393 HB3 LEU 49 HB1 LEU 49 26.361 -15.806 17.647 394 HG LEU 49 HG LEU 49 28.988 -14.580 18.571 395 HD11 LEU 49 HD11 LEU 49 26.249 -14.426 19.722 396 HD12 LEU 49 HD12 LEU 49 27.672 -13.422 20.051 397 HD13 LEU 49 HD13 LEU 49 27.501 -14.981 20.820 398 HD21 LEU 49 HD21 LEU 49 28.492 -16.588 20.244 399 HD22 LEU 49 HD22 LEU 49 29.308 -16.850 18.707 400 HD23 LEU 49 HD23 LEU 49 27.594 -17.204 18.865 401 H GLN 50 HN GLN 50 27.181 -14.250 14.413 402 HA GLN 50 HA GLN 50 25.100 -16.019 13.639 403 HB2 GLN 50 HB2 GLN 50 26.213 -13.582 12.265 404 HB3 GLN 50 HB1 GLN 50 24.882 -14.533 11.622 405 HG2 GLN 50 HG2 GLN 50 23.676 -14.177 13.814 406 HG3 GLN 50 HG1 GLN 50 24.956 -13.035 14.246 407 HE21 GLN 50 HE21 GLN 50 24.093 -10.953 13.924 408 HE22 GLN 50 HE22 GLN 50 23.252 -10.505 12.512 409 H GLN 51 HN GLN 51 26.252 -18.015 13.311 410 HA GLN 51 HA GLN 51 27.722 -18.160 10.806 411 HB2 GLN 51 HB2 GLN 51 27.196 -20.098 13.025 412 HB3 GLN 51 HB1 GLN 51 27.243 -20.755 11.387 413 HG2 GLN 51 HG2 GLN 51 29.379 -18.974 12.546 414 HG3 GLN 51 HG1 GLN 51 29.462 -20.737 12.542 415 HE21 GLN 51 HE21 GLN 51 30.670 -18.209 10.864 416 HE22 GLN 51 HE22 GLN 51 30.743 -18.876 9.307 417 H TRP 52 HN TRP 52 26.290 -17.457 9.321 418 HA TRP 52 HA TRP 52 23.571 -18.409 9.148 419 HB2 TRP 52 HB2 TRP 52 25.380 -16.681 7.460 420 HB3 TRP 52 HB1 TRP 52 23.925 -17.348 6.747 421 HD1 TRP 52 HD1 TRP 52 25.032 -15.098 9.644 422 HE1 TRP 52 HE1 TRP 52 23.046 -13.543 10.283 423 HE3 TRP 52 HE3 TRP 52 21.402 -17.017 6.595 424 HZ2 TRP 52 HZ2 TRP 52 20.289 -13.178 9.548 425 HZ3 TRP 52 HZ3 TRP 52 19.126 -16.051 6.593 426 HH2 TRP 52 HH2 TRP 52 18.575 -14.134 8.072 427 H VAL 53 HN VAL 53 22.964 -20.333 8.254 428 HA VAL 53 HA VAL 53 24.870 -21.558 6.358 429 HB VAL 53 HB VAL 53 23.183 -23.032 8.383 430 HG11 VAL 53 HG11 VAL 53 24.881 -24.874 7.650 431 HG12 VAL 53 HG12 VAL 53 25.116 -23.870 6.225 432 HG13 VAL 53 HG13 VAL 53 23.521 -24.509 6.599 433 HG21 VAL 53 HG21 VAL 53 26.110 -22.222 8.363 434 HG22 VAL 53 HG22 VAL 53 25.516 -23.564 9.339 435 HG23 VAL 53 HG23 VAL 53 24.910 -21.942 9.625 436 H ILE 54 HN ILE 54 24.105 -21.903 4.472 437 HA ILE 54 HA ILE 54 21.459 -22.928 4.085 438 HB ILE 54 HB ILE 54 20.991 -21.424 2.156 439 HG12 ILE 54 HG12 ILE 54 23.253 -19.770 3.288 440 HG13 ILE 54 HG11 ILE 54 23.321 -20.671 1.742 441 HG21 ILE 54 HG21 ILE 54 21.327 -19.797 4.684 442 HG22 ILE 54 HG22 ILE 54 20.036 -21.002 4.449 443 HG23 ILE 54 HG23 ILE 54 20.141 -19.594 3.392 444 HD11 ILE 54 HD11 ILE 54 21.371 -18.489 2.449 445 HD12 ILE 54 HD12 ILE 54 21.479 -19.321 0.893 446 HD13 ILE 54 HD13 ILE 54 22.794 -18.262 1.433 447 H GLY 55 HN GLY 55 21.266 -23.972 1.975 448 HA2 GLY 55 HA2 GLY 55 23.489 -25.618 1.516 449 HA3 GLY 55 HA1 GLY 55 22.077 -25.481 0.477 450 H GLN 56 HN GLN 56 22.446 -22.707 -0.102 451 HA GLN 56 HA GLN 56 24.478 -23.056 -2.195 452 HB2 GLN 56 HB2 GLN 56 23.228 -21.214 -3.319 453 HB3 GLN 56 HB1 GLN 56 22.342 -22.719 -3.082 454 HG2 GLN 56 HG2 GLN 56 22.165 -20.551 -1.007 455 HG3 GLN 56 HG1 GLN 56 21.247 -20.443 -2.517 456 HE21 GLN 56 HE21 GLN 56 20.434 -23.059 -2.938 457 HE22 GLN 56 HE22 GLN 56 19.491 -23.614 -1.656 458 H ARG 57 HN ARG 57 25.185 -22.039 0.506 459 HA ARG 57 HA ARG 57 25.556 -19.236 0.448 460 HB2 ARG 57 HB2 ARG 57 27.247 -21.290 1.877 461 HB3 ARG 57 HB1 ARG 57 27.464 -19.562 2.064 462 HG2 ARG 57 HG2 ARG 57 25.116 -19.355 2.794 463 HG3 ARG 57 HG1 ARG 57 24.960 -21.135 2.726 464 HD2 ARG 57 HD2 ARG 57 26.957 -19.607 4.407 465 HD3 ARG 57 HD1 ARG 57 25.462 -20.299 5.021 466 HE ARG 57 HE ARG 57 26.955 -22.332 3.701 467 HH11 ARG 57 HH21 ARG 57 26.965 -20.391 6.636 468 HH12 ARG 57 HH22 ARG 57 28.014 -21.468 7.464 469 HH21 ARG 57 HH11 ARG 57 28.318 -23.740 4.842 470 HH22 ARG 57 HH12 ARG 57 28.775 -23.396 6.445 471 H LEU 58 HN LEU 58 27.136 -17.905 -0.152 472 HA LEU 58 HA LEU 58 29.474 -18.954 -1.618 473 HB2 LEU 58 HB2 LEU 58 28.027 -16.314 -2.086 474 HB3 LEU 58 HB1 LEU 58 29.531 -16.771 -2.834 475 HG LEU 58 HG LEU 58 28.068 -17.350 -4.523 476 HD11 LEU 58 HD11 LEU 58 29.301 -19.439 -3.634 477 HD12 LEU 58 HD12 LEU 58 27.941 -19.662 -4.724 478 HD13 LEU 58 HD13 LEU 58 27.719 -19.926 -3.004 479 HD21 LEU 58 HD21 LEU 58 26.068 -18.191 -2.397 480 HD22 LEU 58 HD22 LEU 58 25.804 -18.286 -4.141 481 HD23 LEU 58 HD23 LEU 58 26.014 -16.726 -3.381 482 H ALA 59 HN ALA 59 31.415 -17.885 -1.033 483 HA ALA 59 HA ALA 59 31.536 -17.061 1.683 484 HB1 ALA 59 HB1 ALA 59 33.487 -18.080 0.696 485 HB2 ALA 59 HB2 ALA 59 33.880 -16.422 1.157 486 HB3 ALA 59 HB3 ALA 59 33.565 -16.809 -0.538 487 H ARG 60 HN ARG 60 29.640 -15.431 0.564 488 HA ARG 60 HA ARG 60 30.870 -12.813 0.926 489 HB2 ARG 60 HB2 ARG 60 30.422 -13.640 -1.615 490 HB3 ARG 60 HB1 ARG 60 28.861 -12.936 -1.243 491 HG2 ARG 60 HG2 ARG 60 29.776 -10.947 -1.761 492 HG3 ARG 60 HG1 ARG 60 30.635 -11.029 -0.219 493 HD2 ARG 60 HD2 ARG 60 31.597 -11.923 -2.933 494 HD3 ARG 60 HD1 ARG 60 32.259 -10.657 -1.921 495 HE ARG 60 HE ARG 60 32.493 -12.805 -0.286 496 HH11 ARG 60 HH21 ARG 60 33.315 -12.337 -3.638 497 HH12 ARG 60 HH22 ARG 60 34.576 -13.491 -3.629 498 HH21 ARG 60 HH11 ARG 60 34.123 -14.317 -0.259 499 HH22 ARG 60 HH12 ARG 60 35.044 -14.661 -1.674 500 H ASP 61 HN ASP 61 29.765 -11.808 2.402 501 HA ASP 61 HA ASP 61 27.052 -12.492 3.206 502 HB2 ASP 61 HB2 ASP 61 28.735 -10.053 3.882 503 HB3 ASP 61 HB1 ASP 61 27.176 -10.443 4.540 504 H GLN 62 HN GLN 62 28.607 -10.572 0.880 505 HA GLN 62 HA GLN 62 26.603 -8.568 0.565 506 HB2 GLN 62 HB2 GLN 62 28.620 -9.142 -1.588 507 HB3 GLN 62 HB1 GLN 62 27.960 -7.616 -1.046 508 HG2 GLN 62 HG2 GLN 62 29.939 -9.324 0.507 509 HG3 GLN 62 HG1 GLN 62 30.256 -7.779 -0.279 510 HE21 GLN 62 HE21 GLN 62 28.383 -6.062 0.560 511 HE22 GLN 62 HE22 GLN 62 28.286 -6.009 2.253 512 H GLU 63 HN GLU 63 26.440 -11.733 -0.168 513 HA GLU 63 HA GLU 63 25.256 -11.650 -2.758 514 HB2 GLU 63 HB2 GLU 63 25.354 -13.704 -0.567 515 HB3 GLU 63 HB1 GLU 63 24.257 -13.910 -1.926 516 HG2 GLU 63 HG2 GLU 63 27.230 -13.418 -2.218 517 HG3 GLU 63 HG1 GLU 63 26.464 -15.002 -2.295 518 H THR 64 HN THR 64 23.055 -12.043 -3.235 519 HA THR 64 HA THR 64 21.310 -10.360 -1.711 520 HB THR 64 HB THR 64 19.711 -11.598 -3.565 521 HG1 THR 64 HG1 THR 64 21.745 -12.733 -4.240 522 HG21 THR 64 HG21 THR 64 19.539 -9.471 -4.187 523 HG22 THR 64 HG22 THR 64 21.176 -9.448 -4.838 524 HG23 THR 64 HG23 THR 64 20.888 -9.064 -3.150 525 H LEU 65 HN LEU 65 19.258 -11.072 -0.871 526 HA LEU 65 HA LEU 65 19.391 -13.540 0.566 527 HB2 LEU 65 HB2 LEU 65 17.041 -11.742 -0.052 528 HB3 LEU 65 HB1 LEU 65 17.005 -13.073 1.110 529 HG LEU 65 HG LEU 65 18.774 -10.622 1.200 530 HD11 LEU 65 HD11 LEU 65 16.542 -10.087 1.903 531 HD12 LEU 65 HD12 LEU 65 17.554 -10.203 3.345 532 HD13 LEU 65 HD13 LEU 65 16.470 -11.520 2.927 533 HD21 LEU 65 HD21 LEU 65 20.093 -12.390 2.090 534 HD22 LEU 65 HD22 LEU 65 18.724 -13.108 2.941 535 HD23 LEU 65 HD23 LEU 65 19.412 -11.565 3.478 536 H HIS 66 HN HIS 66 17.907 -12.455 -2.385 537 HA HIS 66 HA HIS 66 16.581 -14.799 -3.158 538 HB2 HIS 66 HB2 HIS 66 16.528 -12.543 -4.353 539 HB3 HIS 66 HB1 HIS 66 18.072 -12.997 -5.073 540 HD1 HIS 66 HD1 HIS 66 17.645 -15.938 -5.715 541 HD2 HIS 66 HD2 HIS 66 14.679 -13.063 -6.387 542 HE1 HIS 66 HE1 HIS 66 16.156 -16.836 -7.538 543 HE2 HIS 66 HE2 HIS 66 14.351 -15.111 -7.963 544 H SER 67 HN SER 67 20.006 -14.063 -2.966 545 HA SER 67 HA SER 67 20.993 -15.963 -4.760 546 HB2 SER 67 HB2 SER 67 22.308 -15.119 -2.149 547 HB3 SER 67 HB1 SER 67 23.068 -15.845 -3.534 548 HG SER 67 HG SER 67 23.379 -13.884 -4.095 549 H HIS 68 HN HIS 68 19.775 -16.269 -1.474 550 HA HIS 68 HA HIS 68 20.574 -18.974 -1.084 551 HB2 HIS 68 HB2 HIS 68 20.026 -17.908 0.964 552 HB3 HIS 68 HB1 HIS 68 18.665 -17.087 0.277 553 HD1 HIS 68 HD1 HIS 68 19.318 -20.897 0.305 554 HD2 HIS 68 HD2 HIS 68 16.527 -18.092 1.689 555 HE1 HIS 68 HE1 HIS 68 17.413 -22.187 1.346 556 HE2 HIS 68 HE2 HIS 68 15.672 -20.469 2.125 557 H GLY 69 HN GLY 69 17.982 -17.344 -2.679 558 HA2 GLY 69 HA2 GLY 69 16.995 -18.634 -4.554 559 HA3 GLY 69 HA1 GLY 69 16.742 -19.938 -3.406 560 H VAL 70 HN VAL 70 16.358 -16.904 -1.970 561 HA VAL 70 HA VAL 70 13.573 -17.363 -1.590 562 HB VAL 70 HB VAL 70 15.076 -14.850 -0.874 563 HG11 VAL 70 HG11 VAL 70 12.727 -16.295 0.402 564 HG12 VAL 70 HG12 VAL 70 12.620 -14.865 -0.621 565 HG13 VAL 70 HG13 VAL 70 13.440 -14.772 0.945 566 HG21 VAL 70 HG21 VAL 70 15.259 -16.197 1.384 567 HG22 VAL 70 HG22 VAL 70 16.461 -16.454 0.124 568 HG23 VAL 70 HG23 VAL 70 15.122 -17.594 0.323 569 H ARG 71 HN ARG 71 12.086 -16.821 -3.026 570 HA ARG 71 HA ARG 71 12.476 -14.370 -4.667 571 HB2 ARG 71 HB2 ARG 71 10.633 -16.724 -5.172 572 HB3 ARG 71 HB1 ARG 71 10.770 -15.245 -6.132 573 HG2 ARG 71 HG2 ARG 71 13.064 -15.736 -6.670 574 HG3 ARG 71 HG1 ARG 71 13.043 -17.187 -5.662 575 HD2 ARG 71 HD2 ARG 71 12.675 -17.829 -7.991 576 HD3 ARG 71 HD1 ARG 71 11.210 -18.110 -7.053 577 HE ARG 71 HE ARG 71 11.235 -15.497 -8.217 578 HH11 ARG 71 HH21 ARG 71 10.713 -18.874 -8.894 579 HH12 ARG 71 HH22 ARG 71 9.684 -18.601 -10.241 580 HH21 ARG 71 HH11 ARG 71 9.844 -15.118 -9.987 581 HH22 ARG 71 HH12 ARG 71 9.177 -16.410 -10.888 582 H GLN 72 HN GLN 72 10.925 -15.687 -2.011 583 HA GLN 72 HA GLN 72 9.172 -13.454 -1.693 584 HB2 GLN 72 HB2 GLN 72 7.108 -15.057 -1.622 585 HB3 GLN 72 HB1 GLN 72 7.670 -14.422 -3.160 586 HG2 GLN 72 HG2 GLN 72 9.118 -16.854 -2.548 587 HG3 GLN 72 HG1 GLN 72 7.394 -17.104 -2.359 588 HE21 GLN 72 HE21 GLN 72 8.633 -14.718 -4.692 589 HE22 GLN 72 HE22 GLN 72 8.161 -15.584 -6.064 590 H ASN 73 HN ASN 73 7.496 -14.156 0.087 591 HA ASN 73 HA ASN 73 9.097 -14.803 2.389 592 HB2 ASN 73 HB2 ASN 73 7.347 -14.109 3.686 593 HB3 ASN 73 HB1 ASN 73 6.919 -13.246 2.207 594 HD21 ASN 73 HD21 ASN 73 5.416 -14.771 0.724 595 HD22 ASN 73 HD22 ASN 73 4.202 -15.592 1.586 596 H GLY 74 HN GLY 74 8.442 -16.481 3.990 597 HA2 GLY 74 HA2 GLY 74 7.556 -18.599 4.505 598 HA3 GLY 74 HA1 GLY 74 7.206 -18.877 2.806 599 H ASP 75 HN ASP 75 10.264 -17.592 2.941 600 HA ASP 75 HA ASP 75 11.452 -20.245 2.660 601 HB2 ASP 75 HB2 ASP 75 11.953 -18.111 1.195 602 HB3 ASP 75 HB1 ASP 75 13.108 -17.764 2.480 603 H SER 76 HN SER 76 13.344 -20.807 3.774 604 HA SER 76 HA SER 76 13.513 -19.614 6.478 605 HB2 SER 76 HB2 SER 76 13.831 -22.564 6.188 606 HB3 SER 76 HB1 SER 76 13.206 -21.624 7.531 607 HG SER 76 HG SER 76 11.397 -21.112 5.967 608 H ALA 77 HN ALA 77 15.551 -19.713 7.472 609 HA ALA 77 HA ALA 77 17.757 -20.910 5.929 610 HB1 ALA 77 HB1 ALA 77 18.709 -18.542 7.269 611 HB2 ALA 77 HB2 ALA 77 17.352 -18.106 6.236 612 HB3 ALA 77 HB3 ALA 77 18.749 -18.928 5.550 613 H TYR 78 HN TYR 78 19.778 -21.091 7.334 614 HA TYR 78 HA TYR 78 18.944 -21.706 10.098 615 HB2 TYR 78 HB2 TYR 78 21.017 -23.078 8.382 616 HB3 TYR 78 HB1 TYR 78 20.770 -23.402 10.083 617 HD1 TYR 78 HD1 TYR 78 19.291 -23.696 6.719 618 HD2 TYR 78 HD2 TYR 78 18.765 -24.548 10.903 619 HE1 TYR 78 HE1 TYR 78 17.428 -25.224 6.175 620 HE2 TYR 78 HE2 TYR 78 16.892 -26.074 10.358 621 HH TYR 78 HH TYR 78 16.334 -27.494 8.082 622 H LEU 79 HN LEU 79 19.997 -20.825 11.698 623 HA LEU 79 HA LEU 79 22.453 -19.298 11.130 624 HB2 LEU 79 HB2 LEU 79 20.294 -17.980 11.630 625 HB3 LEU 79 HB1 LEU 79 20.405 -18.610 13.262 626 HG LEU 79 HG LEU 79 21.417 -16.382 13.092 627 HD11 LEU 79 HD11 LEU 79 22.432 -18.315 14.536 628 HD12 LEU 79 HD12 LEU 79 23.282 -16.789 14.313 629 HD13 LEU 79 HD13 LEU 79 23.782 -18.192 13.396 630 HD21 LEU 79 HD21 LEU 79 23.657 -17.424 11.389 631 HD22 LEU 79 HD22 LEU 79 23.042 -15.779 11.583 632 HD23 LEU 79 HD23 LEU 79 22.152 -16.927 10.603 633 H TYR 80 HN TYR 80 24.112 -20.170 12.182 634 HA TYR 80 HA TYR 80 23.552 -21.826 14.538 635 HB2 TYR 80 HB2 TYR 80 24.670 -23.047 12.763 636 HB3 TYR 80 HB1 TYR 80 25.918 -21.820 12.651 637 HD1 TYR 80 HD1 TYR 80 24.326 -23.967 15.304 638 HD2 TYR 80 HD2 TYR 80 27.949 -22.281 13.724 639 HE1 TYR 80 HE1 TYR 80 25.618 -25.150 17.029 640 HE2 TYR 80 HE2 TYR 80 29.243 -23.468 15.458 641 HH TYR 80 HH TYR 80 27.820 -25.885 17.461 642 H LEU 81 HN LEU 81 24.287 -21.188 16.483 643 HA LEU 81 HA LEU 81 25.936 -18.724 16.544 644 HB2 LEU 81 HB2 LEU 81 24.147 -19.796 18.751 645 HB3 LEU 81 HB1 LEU 81 25.075 -18.316 18.766 646 HG LEU 81 HG LEU 81 22.954 -18.933 16.738 647 HD11 LEU 81 HD11 LEU 81 22.917 -17.421 19.369 648 HD12 LEU 81 HD12 LEU 81 21.760 -18.624 18.813 649 HD13 LEU 81 HD13 LEU 81 21.773 -17.002 18.101 650 HD21 LEU 81 HD21 LEU 81 23.101 -16.428 16.375 651 HD22 LEU 81 HD22 LEU 81 24.567 -17.319 15.917 652 HD23 LEU 81 HD23 LEU 81 24.503 -16.429 17.439 653 H LEU 82 HN LEU 82 27.842 -18.793 17.268 654 HA LEU 82 HA LEU 82 29.038 -21.237 18.288 655 HB2 LEU 82 HB2 LEU 82 30.244 -18.460 17.997 656 HB3 LEU 82 HB1 LEU 82 31.114 -19.904 18.470 657 HG LEU 82 HG LEU 82 31.548 -19.733 16.149 658 HD11 LEU 82 HD11 LEU 82 29.132 -21.521 16.247 659 HD12 LEU 82 HD12 LEU 82 30.712 -21.986 16.898 660 HD13 LEU 82 HD13 LEU 82 30.519 -21.652 15.175 661 HD21 LEU 82 HD21 LEU 82 28.626 -19.476 15.422 662 HD22 LEU 82 HD22 LEU 82 30.061 -19.018 14.515 663 HD23 LEU 82 HD23 LEU 82 29.561 -18.049 15.889 664 H SER 83 HN SER 83 30.228 -21.318 20.310 665 HA SER 83 HA SER 83 28.581 -20.488 22.453 666 HB2 SER 83 HB2 SER 83 31.414 -21.517 22.642 667 HB3 SER 83 HB1 SER 83 30.175 -21.541 23.887 668 HG SER 83 HG SER 83 30.500 -23.119 21.613 669 H ALA 84 HN ALA 84 29.857 -18.341 20.739 670 HA ALA 84 HA ALA 84 31.417 -16.785 22.630 671 HB1 ALA 84 HB1 ALA 84 30.282 -15.186 20.510 672 HB2 ALA 84 HB2 ALA 84 30.954 -16.656 19.818 673 HB3 ALA 84 HB3 ALA 84 31.965 -15.606 20.781 674 H ARG 85 HN ARG 85 30.519 -14.525 23.073 675 HA ARG 85 HA ARG 85 27.627 -14.670 23.616 676 HB2 ARG 85 HB2 ARG 85 29.817 -14.501 25.619 677 HB3 ARG 85 HB1 ARG 85 28.368 -13.551 25.912 678 HG2 ARG 85 HG2 ARG 85 27.106 -15.369 26.390 679 HG3 ARG 85 HG1 ARG 85 27.709 -16.289 25.027 680 HD2 ARG 85 HD2 ARG 85 29.435 -15.826 27.464 681 HD3 ARG 85 HD1 ARG 85 28.247 -17.118 27.407 682 HE ARG 85 HE ARG 85 29.506 -17.629 25.145 683 HH11 ARG 85 HH21 ARG 85 30.877 -16.662 28.217 684 HH12 ARG 85 HH22 ARG 85 32.318 -17.547 28.004 685 HH21 ARG 85 HH11 ARG 85 31.388 -18.798 24.868 686 HH22 ARG 85 HH12 ARG 85 32.638 -18.803 26.060 687 H ASN 86 HN ASN 86 26.537 -12.801 23.653 688 HA ASN 86 HA ASN 86 28.003 -10.289 23.312 689 HB2 ASN 86 HB2 ASN 86 27.535 -11.071 21.058 690 HB3 ASN 86 HB1 ASN 86 25.815 -11.234 21.463 691 HD21 ASN 86 HD21 ASN 86 24.723 -9.480 20.514 692 HD22 ASN 86 HD22 ASN 86 25.253 -7.877 20.579 693 H THR 87 HN THR 87 27.283 -9.265 25.119 694 HA THR 87 HA THR 87 24.446 -8.682 25.236 695 HB THR 87 HB THR 87 24.410 -10.541 26.712 696 HG1 THR 87 HG1 THR 87 23.533 -9.469 28.309 697 HG21 THR 87 HG21 THR 87 26.662 -11.076 27.115 698 HG22 THR 87 HG22 THR 87 26.081 -10.558 28.691 699 HG23 THR 87 HG23 THR 87 27.044 -9.459 27.706 700 H SER 88 HN SER 88 24.021 -6.728 26.340 701 HA SER 88 HA SER 88 26.059 -4.807 26.183 702 HB2 SER 88 HB2 SER 88 23.682 -4.478 27.978 703 HB3 SER 88 HB1 SER 88 24.516 -3.272 27.005 704 HG SER 88 HG SER 88 22.612 -5.209 26.312 705 H LEU 89 HN LEU 89 25.331 -7.082 28.528 706 HA LEU 89 HA LEU 89 26.622 -5.907 30.810 707 HB2 LEU 89 HB2 LEU 89 26.084 -8.792 30.063 708 HB3 LEU 89 HB1 LEU 89 26.809 -8.293 31.582 709 HG LEU 89 HG LEU 89 24.122 -7.265 30.609 710 HD11 LEU 89 HD11 LEU 89 24.000 -9.688 30.984 711 HD12 LEU 89 HD12 LEU 89 23.146 -8.819 32.270 712 HD13 LEU 89 HD13 LEU 89 24.733 -9.496 32.577 713 HD21 LEU 89 HD21 LEU 89 24.647 -5.754 32.259 714 HD22 LEU 89 HD22 LEU 89 25.849 -6.802 33.005 715 HD23 LEU 89 HD23 LEU 89 24.142 -7.048 33.330 716 H ASN 90 HN ASN 90 27.665 -7.756 28.038 717 HA ASN 90 HA ASN 90 30.267 -8.286 29.095 718 HB2 ASN 90 HB2 ASN 90 30.804 -9.394 27.093 719 HB3 ASN 90 HB1 ASN 90 29.125 -9.770 27.398 720 HD21 ASN 90 HD21 ASN 90 29.459 -6.525 26.203 721 HD22 ASN 90 HD22 ASN 90 29.094 -6.853 24.591 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 3.794 -0.452 2.967 2 H2 MET 1 HT2 MET 1 2.608 -1.555 2.526 3 H3 MET 1 HT3 MET 1 2.189 -0.245 3.510 4 HA MET 1 HA MET 1 1.564 0.772 1.658 5 HB2 MET 1 HB2 MET 1 4.326 0.504 0.427 6 HB3 MET 1 HB1 MET 1 3.259 1.905 0.450 7 HG2 MET 1 HG2 MET 1 3.658 1.899 3.034 8 HG3 MET 1 HG1 MET 1 5.048 0.893 2.658 9 HE1 MET 1 HE1 MET 1 5.894 3.048 4.132 10 HE2 MET 1 HE2 MET 1 4.532 4.112 3.858 11 HE3 MET 1 HE3 MET 1 6.150 4.649 3.428 12 HA PRO 2 HA PRO 2 0.456 -1.911 -1.678 13 HB2 PRO 2 HB2 PRO 2 2.185 -0.543 -3.700 14 HB3 PRO 2 HB1 PRO 2 0.453 -0.920 -3.746 15 HG2 PRO 2 HG2 PRO 2 1.218 1.535 -3.311 16 HG3 PRO 2 HG1 PRO 2 -0.121 0.855 -2.373 17 HD2 PRO 2 HD2 PRO 2 2.706 1.320 -1.503 18 HD3 PRO 2 HD1 PRO 2 1.190 1.539 -0.590 19 H THR 3 HN THR 3 3.929 -1.145 -1.748 20 HA THR 3 HA THR 3 4.697 -3.597 -3.026 21 HB THR 3 HB THR 3 7.006 -2.724 -2.352 22 HG1 THR 3 HG1 THR 3 6.854 -1.269 -0.861 23 HG21 THR 3 HG21 THR 3 6.714 -0.685 -3.933 24 HG22 THR 3 HG22 THR 3 5.041 -1.217 -4.081 25 HG23 THR 3 HG23 THR 3 6.355 -2.287 -4.556 26 H GLN 4 HN GLN 4 6.225 -5.139 -1.966 27 HA GLN 4 HA GLN 4 6.013 -5.281 0.944 28 HB2 GLN 4 HB2 GLN 4 4.782 -7.227 -0.950 29 HB3 GLN 4 HB1 GLN 4 5.515 -7.858 0.512 30 HG2 GLN 4 HG2 GLN 4 3.683 -5.496 0.833 31 HG3 GLN 4 HG1 GLN 4 2.954 -7.042 0.484 32 HE21 GLN 4 HE21 GLN 4 4.518 -5.191 2.977 33 HE22 GLN 4 HE22 GLN 4 4.469 -6.384 4.167 34 H ASP 5 HN ASP 5 7.404 -6.692 1.891 35 HA ASP 5 HA ASP 5 9.902 -7.308 0.448 36 HB2 ASP 5 HB2 ASP 5 9.112 -7.018 3.329 37 HB3 ASP 5 HB1 ASP 5 10.410 -8.132 2.959 38 H ILE 6 HN ILE 6 10.663 -9.585 1.876 39 HA ILE 6 HA ILE 6 8.399 -11.410 1.628 40 HB ILE 6 HB ILE 6 9.866 -13.181 0.853 41 HG12 ILE 6 HG12 ILE 6 12.030 -11.091 0.484 42 HG13 ILE 6 HG11 ILE 6 12.023 -12.221 1.846 43 HG21 ILE 6 HG21 ILE 6 8.799 -12.089 -0.949 44 HG22 ILE 6 HG22 ILE 6 10.493 -12.103 -1.439 45 HG23 ILE 6 HG23 ILE 6 9.788 -10.644 -0.776 46 HD11 ILE 6 HD11 ILE 6 13.399 -12.898 -0.218 47 HD12 ILE 6 HD12 ILE 6 11.837 -13.154 -1.014 48 HD13 ILE 6 HD13 ILE 6 12.252 -14.084 0.411 49 H ARG 7 HN ARG 7 8.480 -13.178 3.024 50 HA ARG 7 HA ARG 7 9.737 -12.417 5.566 51 HB2 ARG 7 HB2 ARG 7 7.388 -14.275 5.017 52 HB3 ARG 7 HB1 ARG 7 8.003 -13.781 6.589 53 HG2 ARG 7 HG2 ARG 7 7.602 -11.460 6.173 54 HG3 ARG 7 HG1 ARG 7 7.124 -11.775 4.514 55 HD2 ARG 7 HD2 ARG 7 5.114 -13.066 5.376 56 HD3 ARG 7 HD1 ARG 7 5.637 -12.687 6.998 57 HE ARG 7 HE ARG 7 4.818 -10.555 6.769 58 HH11 ARG 7 HH21 ARG 7 5.141 -12.046 3.632 59 HH12 ARG 7 HH22 ARG 7 4.422 -10.765 2.776 60 HH21 ARG 7 HH11 ARG 7 3.815 -8.812 5.617 61 HH22 ARG 7 HH12 ARG 7 3.654 -8.896 3.915 62 H LEU 8 HN LEU 8 11.451 -13.420 6.186 63 HA LEU 8 HA LEU 8 12.031 -16.135 5.213 64 HB2 LEU 8 HB2 LEU 8 13.546 -14.301 4.448 65 HB3 LEU 8 HB1 LEU 8 13.944 -13.945 6.117 66 HG LEU 8 HG LEU 8 15.512 -15.489 4.646 67 HD11 LEU 8 HD11 LEU 8 15.307 -15.020 7.322 68 HD12 LEU 8 HD12 LEU 8 16.567 -15.958 6.527 69 HD13 LEU 8 HD13 LEU 8 15.190 -16.784 7.245 70 HD21 LEU 8 HD21 LEU 8 15.033 -17.766 4.580 71 HD22 LEU 8 HD22 LEU 8 13.459 -17.080 4.249 72 HD23 LEU 8 HD23 LEU 8 13.849 -17.679 5.874 73 H TRP 9 HN TRP 9 12.061 -17.673 6.742 74 HA TRP 9 HA TRP 9 12.040 -16.890 9.595 75 HB2 TRP 9 HB2 TRP 9 11.783 -19.710 8.614 76 HB3 TRP 9 HB1 TRP 9 11.166 -18.965 10.079 77 HD1 TRP 9 HD1 TRP 9 9.771 -16.433 8.736 78 HE1 TRP 9 HE1 TRP 9 7.586 -16.791 7.394 79 HE3 TRP 9 HE3 TRP 9 10.190 -21.384 7.699 80 HZ2 TRP 9 HZ2 TRP 9 6.233 -18.912 6.041 81 HZ3 TRP 9 HZ3 TRP 9 8.488 -22.551 6.390 82 HH2 TRP 9 HH2 TRP 9 6.479 -21.301 5.545 83 H VAL 10 HN VAL 10 13.665 -17.470 10.971 84 HA VAL 10 HA VAL 10 15.903 -18.930 9.727 85 HB VAL 10 HB VAL 10 16.347 -16.872 11.856 86 HG11 VAL 10 HG11 VAL 10 18.079 -17.926 9.596 87 HG12 VAL 10 HG12 VAL 10 18.143 -18.477 11.272 88 HG13 VAL 10 HG13 VAL 10 18.575 -16.824 10.873 89 HG21 VAL 10 HG21 VAL 10 16.685 -16.161 8.950 90 HG22 VAL 10 HG22 VAL 10 16.418 -15.124 10.350 91 HG23 VAL 10 HG23 VAL 10 15.072 -15.989 9.656 92 H SER 11 HN SER 11 16.506 -20.664 10.697 93 HA SER 11 HA SER 11 15.610 -21.219 13.443 94 HB2 SER 11 HB2 SER 11 17.132 -23.077 11.607 95 HB3 SER 11 HB1 SER 11 16.194 -23.479 13.032 96 HG SER 11 HG SER 11 14.610 -23.718 11.715 97 H VAL 12 HN VAL 12 16.982 -20.672 15.012 98 HA VAL 12 HA VAL 12 19.789 -20.205 14.293 99 HB VAL 12 HB VAL 12 18.435 -19.206 16.779 100 HG11 VAL 12 HG11 VAL 12 20.762 -18.826 16.803 101 HG12 VAL 12 HG12 VAL 12 20.070 -17.295 16.282 102 HG13 VAL 12 HG13 VAL 12 20.803 -18.373 15.101 103 HG21 VAL 12 HG21 VAL 12 16.959 -18.511 14.931 104 HG22 VAL 12 HG22 VAL 12 18.350 -17.951 14.005 105 HG23 VAL 12 HG23 VAL 12 17.888 -17.121 15.491 106 H GLU 13 HN GLU 13 21.271 -21.532 15.098 107 HA GLU 13 HA GLU 13 20.627 -22.984 17.581 108 HB2 GLU 13 HB2 GLU 13 22.040 -24.055 15.161 109 HB3 GLU 13 HB1 GLU 13 22.040 -24.870 16.723 110 HG2 GLU 13 HG2 GLU 13 19.512 -24.860 16.666 111 HG3 GLU 13 HG1 GLU 13 19.589 -24.169 15.061 112 H ASP 14 HN ASP 14 21.966 -22.794 19.150 113 HA ASP 14 HA ASP 14 24.387 -21.196 18.827 114 HB2 ASP 14 HB2 ASP 14 22.753 -20.921 20.757 115 HB3 ASP 14 HB1 ASP 14 23.369 -22.450 21.364 116 H ALA 15 HN ALA 15 26.366 -21.813 19.699 117 HA ALA 15 HA ALA 15 27.401 -24.323 18.917 118 HB1 ALA 15 HB1 ALA 15 28.926 -22.489 19.236 119 HB2 ALA 15 HB2 ALA 15 29.299 -23.685 20.489 120 HB3 ALA 15 HB3 ALA 15 28.372 -22.252 20.894 121 H GLN 16 HN GLN 16 26.107 -23.041 21.882 122 HA GLN 16 HA GLN 16 26.633 -25.347 23.506 123 HB2 GLN 16 HB2 GLN 16 24.832 -22.947 23.868 124 HB3 GLN 16 HB1 GLN 16 25.066 -24.178 25.106 125 HG2 GLN 16 HG2 GLN 16 27.187 -23.490 25.594 126 HG3 GLN 16 HG1 GLN 16 27.578 -23.115 23.925 127 HE21 GLN 16 HE21 GLN 16 26.733 -21.049 23.070 128 HE22 GLN 16 HE22 GLN 16 26.452 -19.756 24.109 129 H MET 17 HN MET 17 24.804 -25.187 20.898 130 HA MET 17 HA MET 17 23.221 -26.486 20.025 131 HB2 MET 17 HB2 MET 17 23.328 -27.965 22.683 132 HB3 MET 17 HB1 MET 17 22.347 -28.450 21.317 133 HG2 MET 17 HG2 MET 17 24.310 -28.679 19.895 134 HG3 MET 17 HG1 MET 17 25.350 -28.097 21.182 135 HE1 MET 17 HE1 MET 17 22.883 -30.486 19.928 136 HE2 MET 17 HE2 MET 17 22.221 -30.853 21.511 137 HE3 MET 17 HE3 MET 17 23.202 -32.050 20.692 138 H HIS 18 HN HIS 18 22.686 -24.077 21.737 139 HA HIS 18 HA HIS 18 19.932 -24.491 22.588 140 HB2 HIS 18 HB2 HIS 18 21.172 -22.878 23.892 141 HB3 HIS 18 HB1 HIS 18 21.692 -22.020 22.453 142 HD1 HIS 18 HD1 HIS 18 20.556 -19.803 22.779 143 HD2 HIS 18 HD2 HIS 18 17.912 -23.001 23.262 144 HE1 HIS 18 HE1 HIS 18 18.225 -18.801 22.976 145 HE2 HIS 18 HE2 HIS 18 16.610 -20.755 23.276 146 H THR 19 HN THR 19 18.222 -24.270 21.284 147 HA THR 19 HA THR 19 18.724 -23.338 18.532 148 HB THR 19 HB THR 19 16.693 -25.322 19.565 149 HG1 THR 19 HG1 THR 19 18.691 -26.204 19.681 150 HG21 THR 19 HG21 THR 19 17.477 -24.800 16.675 151 HG22 THR 19 HG22 THR 19 16.115 -23.996 17.439 152 HG23 THR 19 HG23 THR 19 16.116 -25.732 17.286 153 H VAL 20 HN VAL 20 17.621 -21.614 17.800 154 HA VAL 20 HA VAL 20 15.073 -20.866 19.112 155 HB VAL 20 HB VAL 20 17.050 -18.774 18.222 156 HG11 VAL 20 HG11 VAL 20 14.873 -18.786 20.319 157 HG12 VAL 20 HG12 VAL 20 14.700 -18.109 18.697 158 HG13 VAL 20 HG13 VAL 20 15.859 -17.413 19.840 159 HG21 VAL 20 HG21 VAL 20 18.270 -20.189 19.854 160 HG22 VAL 20 HG22 VAL 20 16.893 -20.099 20.944 161 HG23 VAL 20 HG23 VAL 20 17.828 -18.641 20.578 162 H THR 21 HN THR 21 13.702 -19.524 17.776 163 HA THR 21 HA THR 21 14.254 -19.732 14.874 164 HB THR 21 HB THR 21 11.581 -20.065 16.250 165 HG1 THR 21 HG1 THR 21 13.078 -21.800 16.461 166 HG21 THR 21 HG21 THR 21 12.430 -20.168 13.347 167 HG22 THR 21 HG22 THR 21 11.286 -19.068 14.086 168 HG23 THR 21 HG23 THR 21 10.873 -20.765 13.919 169 H ILE 22 HN ILE 22 14.078 -17.838 13.802 170 HA ILE 22 HA ILE 22 12.408 -15.741 15.007 171 HB ILE 22 HB ILE 22 14.018 -14.013 14.404 172 HG12 ILE 22 HG12 ILE 22 15.911 -16.291 13.757 173 HG13 ILE 22 HG11 ILE 22 15.099 -15.267 12.545 174 HG21 ILE 22 HG21 ILE 22 15.395 -14.281 16.264 175 HG22 ILE 22 HG22 ILE 22 15.612 -15.998 16.006 176 HG23 ILE 22 HG23 ILE 22 14.086 -15.390 16.652 177 HD11 ILE 22 HD11 ILE 22 17.429 -14.504 13.060 178 HD12 ILE 22 HD12 ILE 22 16.922 -14.210 14.725 179 HD13 ILE 22 HD13 ILE 22 16.206 -13.290 13.416 180 H TRP 23 HN TRP 23 11.575 -14.235 13.550 181 HA TRP 23 HA TRP 23 11.374 -15.238 10.768 182 HB2 TRP 23 HB2 TRP 23 9.357 -13.734 12.452 183 HB3 TRP 23 HB1 TRP 23 9.148 -14.090 10.742 184 HD1 TRP 23 HD1 TRP 23 8.184 -16.406 10.132 185 HE1 TRP 23 HE1 TRP 23 7.651 -18.567 11.438 186 HE3 TRP 23 HE3 TRP 23 10.192 -15.226 14.675 187 HZ2 TRP 23 HZ2 TRP 23 8.009 -19.635 14.042 188 HZ3 TRP 23 HZ3 TRP 23 10.078 -16.827 16.551 189 HH2 TRP 23 HH2 TRP 23 8.977 -19.043 16.238 190 H LEU 24 HN LEU 24 12.199 -13.916 9.247 191 HA LEU 24 HA LEU 24 12.574 -11.084 9.982 192 HB2 LEU 24 HB2 LEU 24 14.314 -12.724 8.136 193 HB3 LEU 24 HB1 LEU 24 14.553 -11.054 8.595 194 HG LEU 24 HG LEU 24 14.548 -13.374 10.564 195 HD11 LEU 24 HD11 LEU 24 16.877 -11.655 9.752 196 HD12 LEU 24 HD12 LEU 24 16.543 -13.209 8.974 197 HD13 LEU 24 HD13 LEU 24 16.885 -13.126 10.708 198 HD21 LEU 24 HD21 LEU 24 15.759 -11.298 11.812 199 HD22 LEU 24 HD22 LEU 24 14.039 -11.629 11.972 200 HD23 LEU 24 HD23 LEU 24 14.601 -10.399 10.838 201 H THR 25 HN THR 25 11.927 -9.550 8.616 202 HA THR 25 HA THR 25 10.567 -10.414 6.153 203 HB THR 25 HB THR 25 10.246 -7.679 7.328 204 HG1 THR 25 HG1 THR 25 9.907 -8.704 9.117 205 HG21 THR 25 HG21 THR 25 9.114 -8.239 5.250 206 HG22 THR 25 HG22 THR 25 7.917 -8.055 6.524 207 HG23 THR 25 HG23 THR 25 8.384 -9.665 5.981 208 H VAL 26 HN VAL 26 11.797 -10.141 4.415 209 HA VAL 26 HA VAL 26 13.533 -7.779 4.170 210 HB VAL 26 HB VAL 26 15.395 -9.238 3.473 211 HG11 VAL 26 HG11 VAL 26 14.353 -9.935 6.236 212 HG12 VAL 26 HG12 VAL 26 15.196 -8.435 5.844 213 HG13 VAL 26 HG13 VAL 26 16.023 -9.989 5.692 214 HG21 VAL 26 HG21 VAL 26 15.201 -11.661 4.216 215 HG22 VAL 26 HG22 VAL 26 14.304 -11.221 2.759 216 HG23 VAL 26 HG23 VAL 26 13.456 -11.414 4.299 217 H ARG 27 HN ARG 27 14.489 -7.754 1.925 218 HA ARG 27 HA ARG 27 12.564 -8.926 0.023 219 HB2 ARG 27 HB2 ARG 27 13.608 -7.216 -1.633 220 HB3 ARG 27 HB1 ARG 27 12.479 -6.603 -0.432 221 HG2 ARG 27 HG2 ARG 27 15.432 -6.663 0.149 222 HG3 ARG 27 HG1 ARG 27 14.753 -5.384 -0.835 223 HD2 ARG 27 HD2 ARG 27 13.449 -4.500 0.862 224 HD3 ARG 27 HD1 ARG 27 13.385 -5.993 1.768 225 HE ARG 27 HE ARG 27 15.968 -4.588 1.554 226 HH11 ARG 27 HH21 ARG 27 13.140 -5.479 3.518 227 HH12 ARG 27 HH22 ARG 27 13.930 -5.080 4.973 228 HH21 ARG 27 HH11 ARG 27 16.932 -4.069 3.534 229 HH22 ARG 27 HH12 ARG 27 16.090 -4.274 5.013 230 HA PRO 28 HA PRO 28 15.666 -11.726 -1.432 231 HB2 PRO 28 HB2 PRO 28 14.997 -10.749 -4.164 232 HB3 PRO 28 HB1 PRO 28 15.035 -12.411 -3.546 233 HG2 PRO 28 HG2 PRO 28 12.721 -11.265 -3.950 234 HG3 PRO 28 HG1 PRO 28 12.994 -12.192 -2.456 235 HD2 PRO 28 HD2 PRO 28 12.938 -9.207 -2.793 236 HD3 PRO 28 HD1 PRO 28 12.285 -10.219 -1.482 237 H ASP 29 HN ASP 29 15.482 -8.456 -2.440 238 HA ASP 29 HA ASP 29 17.955 -8.123 -3.771 239 HB2 ASP 29 HB2 ASP 29 16.186 -6.137 -2.322 240 HB3 ASP 29 HB1 ASP 29 17.538 -5.733 -3.363 241 H MET 30 HN MET 30 17.090 -8.504 -0.456 242 HA MET 30 HA MET 30 19.257 -7.018 0.659 243 HB2 MET 30 HB2 MET 30 17.385 -9.046 1.799 244 HB3 MET 30 HB1 MET 30 18.782 -8.511 2.722 245 HG2 MET 30 HG2 MET 30 18.052 -6.177 2.484 246 HG3 MET 30 HG1 MET 30 16.661 -6.713 1.545 247 HE1 MET 30 HE1 MET 30 17.894 -6.702 5.669 248 HE2 MET 30 HE2 MET 30 18.788 -7.524 4.413 249 HE3 MET 30 HE3 MET 30 17.729 -8.449 5.476 250 H THR 31 HN THR 31 20.859 -8.125 2.113 251 HA THR 31 HA THR 31 21.889 -10.509 0.810 252 HB THR 31 HB THR 31 23.107 -8.419 0.042 253 HG1 THR 31 HG1 THR 31 24.000 -10.723 0.543 254 HG21 THR 31 HG21 THR 31 24.198 -8.428 2.852 255 HG22 THR 31 HG22 THR 31 23.044 -7.221 2.243 256 HG23 THR 31 HG23 THR 31 24.648 -7.359 1.542 257 H VAL 32 HN VAL 32 23.449 -11.707 2.156 258 HA VAL 32 HA VAL 32 22.314 -12.296 4.636 259 HB VAL 32 HB VAL 32 25.079 -12.963 3.582 260 HG11 VAL 32 HG11 VAL 32 24.874 -14.875 5.270 261 HG12 VAL 32 HG12 VAL 32 23.593 -13.914 6.025 262 HG13 VAL 32 HG13 VAL 32 25.227 -13.272 5.911 263 HG21 VAL 32 HG21 VAL 32 22.465 -14.503 3.629 264 HG22 VAL 32 HG22 VAL 32 24.009 -15.163 3.102 265 HG23 VAL 32 HG23 VAL 32 23.255 -13.858 2.189 266 H ALA 33 HN ALA 33 25.196 -10.437 3.837 267 HA ALA 33 HA ALA 33 26.048 -9.838 6.418 268 HB1 ALA 33 HB1 ALA 33 27.548 -8.578 5.309 269 HB2 ALA 33 HB2 ALA 33 26.289 -7.474 4.781 270 HB3 ALA 33 HB3 ALA 33 26.667 -8.893 3.816 271 H SER 34 HN SER 34 23.720 -8.053 4.400 272 HA SER 34 HA SER 34 23.061 -6.166 6.407 273 HB2 SER 34 HB2 SER 34 21.020 -5.756 5.037 274 HB3 SER 34 HB1 SER 34 22.527 -5.592 4.162 275 HG SER 34 HG SER 34 21.563 -8.195 4.044 276 H LEU 35 HN LEU 35 21.671 -9.272 5.463 277 HA LEU 35 HA LEU 35 19.441 -9.193 7.174 278 HB2 LEU 35 HB2 LEU 35 19.651 -10.767 5.283 279 HB3 LEU 35 HB1 LEU 35 21.005 -11.543 6.105 280 HG LEU 35 HG LEU 35 19.574 -12.252 7.942 281 HD11 LEU 35 HD11 LEU 35 16.969 -11.847 7.264 282 HD12 LEU 35 HD12 LEU 35 17.699 -10.360 6.645 283 HD13 LEU 35 HD13 LEU 35 17.902 -10.807 8.339 284 HD21 LEU 35 HD21 LEU 35 19.678 -13.571 5.734 285 HD22 LEU 35 HD22 LEU 35 18.097 -12.866 5.377 286 HD23 LEU 35 HD23 LEU 35 18.308 -13.892 6.798 287 H LYS 36 HN LYS 36 22.686 -10.581 7.628 288 HA LYS 36 HA LYS 36 22.103 -11.447 10.271 289 HB2 LYS 36 HB2 LYS 36 24.403 -12.042 10.476 290 HB3 LYS 36 HB1 LYS 36 24.017 -12.247 8.764 291 HG2 LYS 36 HG2 LYS 36 25.044 -10.157 8.206 292 HG3 LYS 36 HG1 LYS 36 25.353 -9.754 9.892 293 HD2 LYS 36 HD2 LYS 36 26.774 -11.811 10.086 294 HD3 LYS 36 HD1 LYS 36 26.501 -12.110 8.366 295 HE2 LYS 36 HE2 LYS 36 27.600 -10.024 7.771 296 HE3 LYS 36 HE1 LYS 36 27.792 -9.580 9.463 297 HZ1 LYS 36 HZ1 LYS 36 28.907 -12.118 9.188 298 HZ2 LYS 36 HZ2 LYS 36 29.737 -10.655 9.370 299 HZ3 LYS 36 HZ3 LYS 36 29.398 -11.251 7.829 300 H ASP 37 HN ASP 37 23.298 -8.495 8.868 301 HA ASP 37 HA ASP 37 24.113 -7.204 11.220 302 HB2 ASP 37 HB2 ASP 37 24.663 -6.344 8.992 303 HB3 ASP 37 HB1 ASP 37 22.962 -5.985 8.710 304 H MET 38 HN MET 38 20.907 -7.153 9.564 305 HA MET 38 HA MET 38 19.709 -5.398 11.418 306 HB2 MET 38 HB2 MET 38 17.879 -7.536 10.563 307 HB3 MET 38 HB1 MET 38 17.779 -5.804 10.433 308 HG2 MET 38 HG2 MET 38 19.314 -5.832 8.488 309 HG3 MET 38 HG1 MET 38 19.333 -7.593 8.623 310 HE1 MET 38 HE1 MET 38 17.497 -8.957 9.013 311 HE2 MET 38 HE2 MET 38 16.262 -9.093 7.772 312 HE3 MET 38 HE3 MET 38 15.883 -8.287 9.274 313 H VAL 39 HN VAL 39 20.068 -8.846 11.330 314 HA VAL 39 HA VAL 39 18.599 -9.451 13.630 315 HB VAL 39 HB VAL 39 20.960 -10.904 12.378 316 HG11 VAL 39 HG11 VAL 39 20.104 -11.371 14.966 317 HG12 VAL 39 HG12 VAL 39 20.799 -12.569 13.885 318 HG13 VAL 39 HG13 VAL 39 19.063 -12.446 14.028 319 HG21 VAL 39 HG21 VAL 39 18.499 -12.298 12.105 320 HG22 VAL 39 HG22 VAL 39 19.401 -11.470 10.839 321 HG23 VAL 39 HG23 VAL 39 18.149 -10.617 11.710 322 H PHE 40 HN PHE 40 21.943 -8.493 13.146 323 HA PHE 40 HA PHE 40 22.741 -8.688 15.861 324 HB2 PHE 40 HB2 PHE 40 24.472 -8.437 14.220 325 HB3 PHE 40 HB1 PHE 40 23.734 -6.980 13.570 326 HD1 PHE 40 HD2 PHE 40 24.733 -8.198 17.003 327 HD2 PHE 40 HD1 PHE 40 24.833 -5.020 14.105 328 HE1 PHE 40 HE2 PHE 40 26.029 -6.792 18.579 329 HE2 PHE 40 HE1 PHE 40 26.121 -3.626 15.683 330 HZ PHE 40 HZ PHE 40 26.724 -4.516 17.928 331 H LEU 41 HN LEU 41 21.367 -6.052 13.912 332 HA LEU 41 HA LEU 41 21.222 -4.088 15.984 333 HB2 LEU 41 HB2 LEU 41 19.211 -4.466 13.754 334 HB3 LEU 41 HB1 LEU 41 19.570 -2.988 14.628 335 HG LEU 41 HG LEU 41 21.482 -4.473 12.825 336 HD11 LEU 41 HD11 LEU 41 19.581 -3.351 11.650 337 HD12 LEU 41 HD12 LEU 41 21.161 -2.694 11.250 338 HD13 LEU 41 HD13 LEU 41 20.106 -1.817 12.360 339 HD21 LEU 41 HD21 LEU 41 22.894 -3.400 14.226 340 HD22 LEU 41 HD22 LEU 41 21.735 -2.106 14.634 341 HD23 LEU 41 HD23 LEU 41 22.595 -2.093 13.083 342 H ASP 42 HN ASP 42 19.021 -6.457 14.768 343 HA ASP 42 HA ASP 42 16.837 -5.739 16.482 344 HB2 ASP 42 HB2 ASP 42 16.885 -7.004 14.119 345 HB3 ASP 42 HB1 ASP 42 16.819 -8.403 15.167 346 H TYR 43 HN TYR 43 19.000 -8.559 16.505 347 HA TYR 43 HA TYR 43 17.816 -9.289 19.122 348 HB2 TYR 43 HB2 TYR 43 19.267 -11.044 17.140 349 HB3 TYR 43 HB1 TYR 43 18.504 -11.559 18.631 350 HD1 TYR 43 HD2 TYR 43 15.977 -10.998 18.955 351 HD2 TYR 43 HD1 TYR 43 17.954 -10.915 15.137 352 HE1 TYR 43 HE2 TYR 43 13.787 -11.146 17.808 353 HE2 TYR 43 HE1 TYR 43 15.765 -11.056 14.003 354 HH TYR 43 HH TYR 43 13.159 -10.272 15.034 355 H GLY 44 HN GLY 44 20.575 -7.831 17.940 356 HA2 GLY 44 HA2 GLY 44 22.512 -7.265 19.051 357 HA3 GLY 44 HA1 GLY 44 21.883 -8.124 20.456 358 H PHE 45 HN PHE 45 22.035 -9.738 17.424 359 HA PHE 45 HA PHE 45 23.844 -11.736 18.496 360 HB2 PHE 45 HB2 PHE 45 22.375 -11.495 15.853 361 HB3 PHE 45 HB1 PHE 45 23.502 -12.789 16.228 362 HD1 PHE 45 HD1 PHE 45 21.906 -11.791 19.283 363 HD2 PHE 45 HD2 PHE 45 21.239 -14.058 15.660 364 HE1 PHE 45 HE1 PHE 45 20.136 -13.058 20.393 365 HE2 PHE 45 HE2 PHE 45 19.446 -15.320 16.808 366 HZ PHE 45 HZ PHE 45 18.894 -14.824 19.174 367 HA PRO 46 HA PRO 46 27.268 -9.108 16.898 368 HB2 PRO 46 HB2 PRO 46 29.173 -11.049 17.591 369 HB3 PRO 46 HB1 PRO 46 28.692 -9.661 18.563 370 HG2 PRO 46 HG2 PRO 46 27.747 -12.471 18.761 371 HG3 PRO 46 HG1 PRO 46 28.036 -11.321 20.050 372 HD2 PRO 46 HD2 PRO 46 25.558 -11.850 19.338 373 HD3 PRO 46 HD1 PRO 46 26.036 -10.160 19.663 374 HA PRO 47 HA PRO 47 27.329 -11.064 12.867 375 HB2 PRO 47 HB2 PRO 47 29.603 -9.887 11.879 376 HB3 PRO 47 HB1 PRO 47 28.011 -9.101 11.909 377 HG2 PRO 47 HG2 PRO 47 30.302 -8.779 13.803 378 HG3 PRO 47 HG1 PRO 47 29.181 -7.571 13.158 379 HD2 PRO 47 HD2 PRO 47 28.862 -8.472 15.633 380 HD3 PRO 47 HD1 PRO 47 27.442 -8.144 14.612 381 H VAL 48 HN VAL 48 30.242 -11.032 14.841 382 HA VAL 48 HA VAL 48 31.607 -13.094 13.443 383 HB VAL 48 HB VAL 48 32.952 -11.828 14.926 384 HG11 VAL 48 HG11 VAL 48 32.145 -12.294 17.554 385 HG12 VAL 48 HG12 VAL 48 30.630 -12.021 16.704 386 HG13 VAL 48 HG13 VAL 48 31.905 -10.811 16.645 387 HG21 VAL 48 HG21 VAL 48 32.494 -14.330 16.568 388 HG22 VAL 48 HG22 VAL 48 34.015 -13.503 16.238 389 HG23 VAL 48 HG23 VAL 48 33.217 -14.424 14.962 390 H LEU 49 HN LEU 49 29.323 -13.133 16.116 391 HA LEU 49 HA LEU 49 29.451 -15.969 16.436 392 HB2 LEU 49 HB2 LEU 49 27.600 -13.865 17.489 393 HB3 LEU 49 HB1 LEU 49 27.240 -15.571 17.690 394 HG LEU 49 HG LEU 49 29.575 -15.915 18.626 395 HD11 LEU 49 HD11 LEU 49 30.393 -13.631 19.700 396 HD12 LEU 49 HD12 LEU 49 29.631 -12.955 18.273 397 HD13 LEU 49 HD13 LEU 49 30.915 -14.149 18.105 398 HD21 LEU 49 HD21 LEU 49 28.214 -15.981 20.424 399 HD22 LEU 49 HD22 LEU 49 27.310 -14.521 19.973 400 HD23 LEU 49 HD23 LEU 49 28.869 -14.399 20.779 401 H GLN 50 HN GLN 50 27.390 -13.787 14.624 402 HA GLN 50 HA GLN 50 25.452 -15.767 13.956 403 HB2 GLN 50 HB2 GLN 50 26.172 -13.195 12.552 404 HB3 GLN 50 HB1 GLN 50 24.853 -14.240 12.069 405 HG2 GLN 50 HG2 GLN 50 23.896 -14.006 14.385 406 HG3 GLN 50 HG1 GLN 50 25.131 -12.772 14.703 407 HE21 GLN 50 HE21 GLN 50 24.275 -10.699 14.380 408 HE22 GLN 50 HE22 GLN 50 23.173 -10.312 13.139 409 H GLN 51 HN GLN 51 26.195 -17.621 13.043 410 HA GLN 51 HA GLN 51 27.673 -17.317 10.513 411 HB2 GLN 51 HB2 GLN 51 27.831 -19.316 12.687 412 HB3 GLN 51 HB1 GLN 51 27.669 -20.012 11.080 413 HG2 GLN 51 HG2 GLN 51 30.057 -19.679 11.625 414 HG3 GLN 51 HG1 GLN 51 29.590 -18.680 10.262 415 HE21 GLN 51 HE21 GLN 51 28.523 -17.633 13.466 416 HE22 GLN 51 HE22 GLN 51 29.670 -16.385 13.606 417 H TRP 52 HN TRP 52 26.167 -16.978 9.095 418 HA TRP 52 HA TRP 52 23.524 -18.132 9.307 419 HB2 TRP 52 HB2 TRP 52 24.871 -16.110 7.549 420 HB3 TRP 52 HB1 TRP 52 23.354 -16.835 7.033 421 HD1 TRP 52 HD1 TRP 52 24.843 -14.771 9.921 422 HE1 TRP 52 HE1 TRP 52 22.872 -13.504 11.093 423 HE3 TRP 52 HE3 TRP 52 20.891 -16.782 7.420 424 HZ2 TRP 52 HZ2 TRP 52 20.027 -13.393 10.943 425 HZ3 TRP 52 HZ3 TRP 52 18.571 -16.087 7.943 426 HH2 TRP 52 HH2 TRP 52 18.151 -14.391 9.708 427 H VAL 53 HN VAL 53 22.732 -19.864 8.198 428 HA VAL 53 HA VAL 53 24.357 -20.840 5.943 429 HB VAL 53 HB VAL 53 22.759 -22.528 7.856 430 HG11 VAL 53 HG11 VAL 53 24.531 -23.160 5.489 431 HG12 VAL 53 HG12 VAL 53 22.860 -23.658 5.780 432 HG13 VAL 53 HG13 VAL 53 24.166 -24.342 6.741 433 HG21 VAL 53 HG21 VAL 53 24.669 -21.716 9.090 434 HG22 VAL 53 HG22 VAL 53 25.741 -21.928 7.710 435 HG23 VAL 53 HG23 VAL 53 25.097 -23.333 8.544 436 H ILE 54 HN ILE 54 23.355 -20.878 4.142 437 HA ILE 54 HA ILE 54 20.468 -21.296 4.003 438 HB ILE 54 HB ILE 54 22.055 -19.275 2.350 439 HG12 ILE 54 HG12 ILE 54 19.664 -18.875 4.176 440 HG13 ILE 54 HG11 ILE 54 21.319 -18.587 4.693 441 HG21 ILE 54 HG21 ILE 54 19.642 -18.800 1.507 442 HG22 ILE 54 HG22 ILE 54 19.327 -20.456 2.009 443 HG23 ILE 54 HG23 ILE 54 20.576 -20.118 0.808 444 HD11 ILE 54 HD11 ILE 54 20.083 -17.235 2.272 445 HD12 ILE 54 HD12 ILE 54 21.616 -16.822 3.073 446 HD13 ILE 54 HD13 ILE 54 20.083 -16.541 3.887 447 H GLY 55 HN GLY 55 19.979 -22.934 2.670 448 HA2 GLY 55 HA2 GLY 55 21.683 -24.887 2.000 449 HA3 GLY 55 HA1 GLY 55 20.248 -24.561 1.036 450 H GLN 56 HN GLN 56 21.099 -22.032 0.063 451 HA GLN 56 HA GLN 56 22.999 -22.926 -2.007 452 HB2 GLN 56 HB2 GLN 56 20.995 -20.661 -1.935 453 HB3 GLN 56 HB1 GLN 56 22.063 -21.020 -3.288 454 HG2 GLN 56 HG2 GLN 56 21.091 -23.201 -3.602 455 HG3 GLN 56 HG1 GLN 56 20.157 -23.062 -2.120 456 HE21 GLN 56 HE21 GLN 56 18.031 -22.865 -2.760 457 HE22 GLN 56 HE22 GLN 56 17.457 -21.803 -3.933 458 H ARG 57 HN ARG 57 23.433 -21.552 0.838 459 HA ARG 57 HA ARG 57 24.468 -19.025 0.275 460 HB2 ARG 57 HB2 ARG 57 25.179 -18.853 2.493 461 HB3 ARG 57 HB1 ARG 57 23.802 -19.923 2.570 462 HG2 ARG 57 HG2 ARG 57 25.131 -21.411 3.665 463 HG3 ARG 57 HG1 ARG 57 25.971 -21.685 2.166 464 HD2 ARG 57 HD2 ARG 57 27.613 -21.067 3.821 465 HD3 ARG 57 HD1 ARG 57 27.463 -19.744 2.682 466 HE ARG 57 HE ARG 57 25.940 -19.617 5.237 467 HH11 ARG 57 HH21 ARG 57 28.492 -18.378 3.149 468 HH12 ARG 57 HH22 ARG 57 28.729 -17.016 4.147 469 HH21 ARG 57 HH11 ARG 57 26.305 -17.838 6.466 470 HH22 ARG 57 HH12 ARG 57 27.492 -16.673 6.024 471 H LEU 58 HN LEU 58 26.407 -18.154 0.031 472 HA LEU 58 HA LEU 58 28.666 -19.899 -0.771 473 HB2 LEU 58 HB2 LEU 58 27.817 -17.113 -1.582 474 HB3 LEU 58 HB1 LEU 58 29.497 -17.586 -1.700 475 HG LEU 58 HG LEU 58 28.045 -17.897 -3.787 476 HD11 LEU 58 HD11 LEU 58 29.812 -20.038 -2.619 477 HD12 LEU 58 HD12 LEU 58 30.157 -18.862 -3.888 478 HD13 LEU 58 HD13 LEU 58 29.078 -20.210 -4.211 479 HD21 LEU 58 HD21 LEU 58 26.670 -19.834 -3.945 480 HD22 LEU 58 HD22 LEU 58 26.130 -18.990 -2.510 481 HD23 LEU 58 HD23 LEU 58 27.156 -20.432 -2.365 482 H ALA 59 HN ALA 59 30.787 -19.121 -0.044 483 HA ALA 59 HA ALA 59 30.797 -18.297 2.700 484 HB1 ALA 59 HB1 ALA 59 32.596 -19.715 1.757 485 HB2 ALA 59 HB2 ALA 59 33.214 -18.237 2.504 486 HB3 ALA 59 HB3 ALA 59 33.119 -18.354 0.753 487 H ARG 60 HN ARG 60 29.334 -16.438 1.422 488 HA ARG 60 HA ARG 60 30.976 -14.022 1.568 489 HB2 ARG 60 HB2 ARG 60 30.986 -14.733 -0.775 490 HB3 ARG 60 HB1 ARG 60 29.239 -14.791 -0.779 491 HG2 ARG 60 HG2 ARG 60 29.091 -12.382 -0.487 492 HG3 ARG 60 HG1 ARG 60 30.825 -12.270 -0.212 493 HD2 ARG 60 HD2 ARG 60 30.253 -11.652 -2.542 494 HD3 ARG 60 HD1 ARG 60 31.307 -13.056 -2.469 495 HE ARG 60 HE ARG 60 28.459 -13.721 -2.589 496 HH11 ARG 60 HH21 ARG 60 31.352 -13.014 -4.424 497 HH12 ARG 60 HH22 ARG 60 30.766 -13.800 -5.830 498 HH21 ARG 60 HH11 ARG 60 27.768 -14.740 -4.373 499 HH22 ARG 60 HH12 ARG 60 28.697 -14.822 -5.837 500 H ASP 61 HN ASP 61 30.057 -12.740 2.910 501 HA ASP 61 HA ASP 61 27.394 -12.909 3.944 502 HB2 ASP 61 HB2 ASP 61 29.547 -10.808 4.095 503 HB3 ASP 61 HB1 ASP 61 27.926 -10.467 4.646 504 H GLN 62 HN GLN 62 28.919 -11.104 1.421 505 HA GLN 62 HA GLN 62 26.784 -9.292 0.935 506 HB2 GLN 62 HB2 GLN 62 29.140 -10.026 -0.824 507 HB3 GLN 62 HB1 GLN 62 28.076 -8.642 -1.041 508 HG2 GLN 62 HG2 GLN 62 29.733 -9.142 1.457 509 HG3 GLN 62 HG1 GLN 62 30.183 -8.068 0.154 510 HE21 GLN 62 HE21 GLN 62 28.993 -7.857 3.167 511 HE22 GLN 62 HE22 GLN 62 27.957 -6.536 2.994 512 H GLU 63 HN GLU 63 26.453 -12.413 0.619 513 HA GLU 63 HA GLU 63 25.544 -12.796 -2.071 514 HB2 GLU 63 HB2 GLU 63 24.965 -14.192 0.550 515 HB3 GLU 63 HB1 GLU 63 24.211 -14.648 -0.976 516 HG2 GLU 63 HG2 GLU 63 27.195 -14.410 -0.717 517 HG3 GLU 63 HG1 GLU 63 26.367 -15.913 -0.321 518 H THR 64 HN THR 64 23.571 -12.175 -2.939 519 HA THR 64 HA THR 64 21.748 -10.669 -1.294 520 HB THR 64 HB THR 64 20.506 -11.352 -3.769 521 HG1 THR 64 HG1 THR 64 22.422 -11.988 -4.548 522 HG21 THR 64 HG21 THR 64 21.164 -8.861 -4.229 523 HG22 THR 64 HG22 THR 64 21.734 -8.878 -2.551 524 HG23 THR 64 HG23 THR 64 20.064 -9.244 -2.920 525 H LEU 65 HN LEU 65 19.632 -11.341 -0.747 526 HA LEU 65 HA LEU 65 19.368 -14.074 -0.011 527 HB2 LEU 65 HB2 LEU 65 17.261 -11.915 -0.329 528 HB3 LEU 65 HB1 LEU 65 16.983 -13.459 0.470 529 HG LEU 65 HG LEU 65 18.984 -11.346 1.309 530 HD11 LEU 65 HD11 LEU 65 16.471 -10.947 1.676 531 HD12 LEU 65 HD12 LEU 65 17.521 -10.809 3.088 532 HD13 LEU 65 HD13 LEU 65 16.570 -12.268 2.834 533 HD21 LEU 65 HD21 LEU 65 19.190 -12.740 3.353 534 HD22 LEU 65 HD22 LEU 65 19.848 -13.533 1.931 535 HD23 LEU 65 HD23 LEU 65 18.257 -14.018 2.573 536 H HIS 66 HN HIS 66 18.196 -12.159 -2.689 537 HA HIS 66 HA HIS 66 16.581 -13.981 -4.054 538 HB2 HIS 66 HB2 HIS 66 17.014 -11.522 -4.592 539 HB3 HIS 66 HB1 HIS 66 18.501 -12.040 -5.363 540 HD1 HIS 66 HD1 HIS 66 18.124 -13.966 -7.324 541 HD2 HIS 66 HD2 HIS 66 14.809 -11.660 -6.233 542 HE1 HIS 66 HE1 HIS 66 16.454 -14.166 -9.208 543 HE2 HIS 66 HE2 HIS 66 14.423 -12.750 -8.549 544 H SER 67 HN SER 67 20.103 -13.574 -4.009 545 HA SER 67 HA SER 67 20.806 -15.193 -6.152 546 HB2 SER 67 HB2 SER 67 22.532 -15.280 -3.713 547 HB3 SER 67 HB1 SER 67 22.937 -14.968 -5.392 548 HG SER 67 HG SER 67 22.016 -13.378 -3.374 549 H HIS 68 HN HIS 68 20.048 -15.967 -2.807 550 HA HIS 68 HA HIS 68 20.697 -18.789 -3.119 551 HB2 HIS 68 HB2 HIS 68 19.477 -17.274 -0.800 552 HB3 HIS 68 HB1 HIS 68 19.988 -18.966 -0.768 553 HD1 HIS 68 HD1 HIS 68 21.534 -17.390 1.195 554 HD2 HIS 68 HD2 HIS 68 22.568 -17.417 -2.832 555 HE1 HIS 68 HE1 HIS 68 23.953 -16.604 1.069 556 HE2 HIS 68 HE2 HIS 68 24.583 -16.609 -1.444 557 H GLY 69 HN GLY 69 18.361 -17.115 -4.408 558 HA2 GLY 69 HA2 GLY 69 16.419 -17.781 -5.346 559 HA3 GLY 69 HA1 GLY 69 16.543 -19.334 -4.537 560 H VAL 70 HN VAL 70 16.979 -16.734 -2.380 561 HA VAL 70 HA VAL 70 14.381 -17.180 -1.168 562 HB VAL 70 HB VAL 70 16.358 -14.989 -0.526 563 HG11 VAL 70 HG11 VAL 70 14.161 -14.867 0.538 564 HG12 VAL 70 HG12 VAL 70 15.405 -15.214 1.736 565 HG13 VAL 70 HG13 VAL 70 14.345 -16.505 1.168 566 HG21 VAL 70 HG21 VAL 70 16.389 -17.816 0.608 567 HG22 VAL 70 HG22 VAL 70 17.491 -16.504 1.021 568 HG23 VAL 70 HG23 VAL 70 17.546 -17.214 -0.582 569 H ARG 71 HN ARG 71 13.155 -16.614 -2.959 570 HA ARG 71 HA ARG 71 13.263 -13.795 -3.840 571 HB2 ARG 71 HB2 ARG 71 12.442 -16.309 -5.281 572 HB3 ARG 71 HB1 ARG 71 12.331 -14.671 -5.943 573 HG2 ARG 71 HG2 ARG 71 14.718 -14.329 -5.660 574 HG3 ARG 71 HG1 ARG 71 14.892 -15.883 -4.872 575 HD2 ARG 71 HD2 ARG 71 13.910 -15.559 -7.725 576 HD3 ARG 71 HD1 ARG 71 15.587 -15.874 -7.281 577 HE ARG 71 HE ARG 71 13.939 -17.811 -6.040 578 HH11 ARG 71 HH21 ARG 71 15.044 -16.796 -9.176 579 HH12 ARG 71 HH22 ARG 71 14.969 -18.365 -9.867 580 HH21 ARG 71 HH11 ARG 71 13.842 -19.915 -6.958 581 HH22 ARG 71 HH12 ARG 71 14.276 -20.147 -8.594 582 H GLN 72 HN GLN 72 11.463 -15.718 -1.926 583 HA GLN 72 HA GLN 72 9.221 -13.909 -2.097 584 HB2 GLN 72 HB2 GLN 72 7.576 -15.822 -2.186 585 HB3 GLN 72 HB1 GLN 72 8.331 -15.442 -3.716 586 HG2 GLN 72 HG2 GLN 72 9.622 -17.447 -1.903 587 HG3 GLN 72 HG1 GLN 72 8.194 -17.927 -2.801 588 HE21 GLN 72 HE21 GLN 72 9.644 -15.634 -4.769 589 HE22 GLN 72 HE22 GLN 72 10.591 -16.666 -5.713 590 H ASN 73 HN ASN 73 7.640 -14.454 -0.445 591 HA ASN 73 HA ASN 73 8.976 -14.820 2.085 592 HB2 ASN 73 HB2 ASN 73 6.966 -14.150 3.107 593 HB3 ASN 73 HB1 ASN 73 6.924 -13.308 1.559 594 HD21 ASN 73 HD21 ASN 73 5.973 -15.131 -0.215 595 HD22 ASN 73 HD22 ASN 73 4.478 -15.754 0.258 596 H GLY 74 HN GLY 74 8.545 -16.448 3.655 597 HA2 GLY 74 HA2 GLY 74 7.517 -18.455 4.345 598 HA3 GLY 74 HA1 GLY 74 7.215 -18.893 2.673 599 H ASP 75 HN ASP 75 10.215 -17.670 2.534 600 HA ASP 75 HA ASP 75 11.441 -20.258 2.460 601 HB2 ASP 75 HB2 ASP 75 12.031 -18.137 1.065 602 HB3 ASP 75 HB1 ASP 75 13.023 -17.693 2.444 603 H SER 76 HN SER 76 13.184 -20.898 3.757 604 HA SER 76 HA SER 76 13.196 -19.694 6.467 605 HB2 SER 76 HB2 SER 76 13.439 -22.676 6.212 606 HB3 SER 76 HB1 SER 76 12.775 -21.693 7.498 607 HG SER 76 HG SER 76 11.098 -21.115 5.828 608 H ALA 77 HN ALA 77 15.168 -19.777 7.585 609 HA ALA 77 HA ALA 77 17.474 -20.873 6.086 610 HB1 ALA 77 HB1 ALA 77 17.290 -18.136 7.364 611 HB2 ALA 77 HB2 ALA 77 17.452 -18.490 5.642 612 HB3 ALA 77 HB3 ALA 77 18.775 -18.857 6.749 613 H TYR 78 HN TYR 78 19.470 -20.973 7.417 614 HA TYR 78 HA TYR 78 18.831 -21.786 10.183 615 HB2 TYR 78 HB2 TYR 78 19.311 -23.680 8.723 616 HB3 TYR 78 HB1 TYR 78 20.819 -22.949 8.221 617 HD1 TYR 78 HD2 TYR 78 22.746 -22.824 9.780 618 HD2 TYR 78 HD1 TYR 78 19.041 -24.658 10.958 619 HE1 TYR 78 HE2 TYR 78 23.867 -23.859 11.691 620 HE2 TYR 78 HE1 TYR 78 20.160 -25.689 12.861 621 HH TYR 78 HH TYR 78 22.073 -25.775 14.099 622 H LEU 79 HN LEU 79 19.886 -20.693 11.707 623 HA LEU 79 HA LEU 79 22.341 -19.237 10.957 624 HB2 LEU 79 HB2 LEU 79 20.592 -17.654 11.493 625 HB3 LEU 79 HB1 LEU 79 20.224 -18.516 12.984 626 HG LEU 79 HG LEU 79 22.516 -18.002 13.845 627 HD11 LEU 79 HD11 LEU 79 22.832 -17.050 11.077 628 HD12 LEU 79 HD12 LEU 79 24.046 -17.574 12.244 629 HD13 LEU 79 HD13 LEU 79 23.425 -15.930 12.298 630 HD21 LEU 79 HD21 LEU 79 22.060 -15.747 14.412 631 HD22 LEU 79 HD22 LEU 79 20.462 -16.434 14.118 632 HD23 LEU 79 HD23 LEU 79 21.236 -15.439 12.887 633 H TYR 80 HN TYR 80 24.127 -19.784 11.948 634 HA TYR 80 HA TYR 80 23.962 -21.570 14.266 635 HB2 TYR 80 HB2 TYR 80 25.195 -22.520 12.397 636 HB3 TYR 80 HB1 TYR 80 26.160 -21.058 12.245 637 HD1 TYR 80 HD2 TYR 80 25.192 -22.772 15.437 638 HD2 TYR 80 HD1 TYR 80 28.343 -21.930 12.641 639 HE1 TYR 80 HE2 TYR 80 26.822 -23.691 16.998 640 HE2 TYR 80 HE1 TYR 80 29.985 -22.872 14.218 641 HH TYR 80 HH TYR 80 29.868 -23.167 17.079 642 H LEU 81 HN LEU 81 24.500 -20.727 16.195 643 HA LEU 81 HA LEU 81 25.993 -18.188 16.195 644 HB2 LEU 81 HB2 LEU 81 24.169 -19.347 18.317 645 HB3 LEU 81 HB1 LEU 81 25.150 -17.909 18.548 646 HG LEU 81 HG LEU 81 23.095 -18.258 16.357 647 HD11 LEU 81 HD11 LEU 81 21.685 -16.746 17.654 648 HD12 LEU 81 HD12 LEU 81 22.942 -16.535 18.864 649 HD13 LEU 81 HD13 LEU 81 22.132 -18.088 18.700 650 HD21 LEU 81 HD21 LEU 81 23.398 -15.739 16.201 651 HD22 LEU 81 HD22 LEU 81 24.769 -16.682 15.651 652 HD23 LEU 81 HD23 LEU 81 24.801 -15.913 17.250 653 H LEU 82 HN LEU 82 27.911 -18.187 16.760 654 HA LEU 82 HA LEU 82 29.231 -20.586 17.609 655 HB2 LEU 82 HB2 LEU 82 30.167 -17.850 16.840 656 HB3 LEU 82 HB1 LEU 82 31.261 -18.923 17.700 657 HG LEU 82 HG LEU 82 30.997 -20.672 16.024 658 HD11 LEU 82 HD11 LEU 82 28.940 -18.785 14.872 659 HD12 LEU 82 HD12 LEU 82 28.722 -20.449 15.400 660 HD13 LEU 82 HD13 LEU 82 29.656 -20.104 13.941 661 HD21 LEU 82 HD21 LEU 82 31.942 -19.497 14.066 662 HD22 LEU 82 HD22 LEU 82 32.678 -18.945 15.566 663 HD23 LEU 82 HD23 LEU 82 31.466 -17.942 14.758 664 H SER 83 HN SER 83 30.698 -20.725 19.320 665 HA SER 83 HA SER 83 29.504 -20.249 21.829 666 HB2 SER 83 HB2 SER 83 32.451 -20.745 21.599 667 HB3 SER 83 HB1 SER 83 31.280 -21.431 22.703 668 HG SER 83 HG SER 83 31.407 -23.034 21.329 669 H ALA 84 HN ALA 84 31.377 -18.246 19.859 670 HA ALA 84 HA ALA 84 32.862 -16.649 21.563 671 HB1 ALA 84 HB1 ALA 84 31.566 -16.173 18.931 672 HB2 ALA 84 HB2 ALA 84 33.252 -16.012 19.409 673 HB3 ALA 84 HB3 ALA 84 32.093 -14.770 19.850 674 H ARG 85 HN ARG 85 32.496 -14.418 22.168 675 HA ARG 85 HA ARG 85 29.755 -13.820 23.063 676 HB2 ARG 85 HB2 ARG 85 32.231 -13.661 24.792 677 HB3 ARG 85 HB1 ARG 85 30.619 -13.126 25.255 678 HG2 ARG 85 HG2 ARG 85 29.783 -15.451 25.028 679 HG3 ARG 85 HG1 ARG 85 31.397 -15.986 24.568 680 HD2 ARG 85 HD2 ARG 85 31.184 -16.405 26.916 681 HD3 ARG 85 HD1 ARG 85 32.265 -15.032 26.698 682 HE ARG 85 HE ARG 85 29.397 -14.560 27.217 683 HH11 ARG 85 HH21 ARG 85 32.753 -14.203 28.162 684 HH12 ARG 85 HH22 ARG 85 32.414 -13.183 29.491 685 HH21 ARG 85 HH11 ARG 85 28.956 -13.177 29.015 686 HH22 ARG 85 HH12 ARG 85 30.225 -12.585 29.974 687 H ASN 86 HN ASN 86 29.415 -11.552 23.022 688 HA ASN 86 HA ASN 86 31.726 -9.944 22.101 689 HB2 ASN 86 HB2 ASN 86 29.511 -10.020 20.733 690 HB3 ASN 86 HB1 ASN 86 28.892 -8.937 21.986 691 HD21 ASN 86 HD21 ASN 86 29.789 -6.767 22.079 692 HD22 ASN 86 HD22 ASN 86 30.823 -6.189 20.866 693 H THR 87 HN THR 87 32.680 -9.491 24.047 694 HA THR 87 HA THR 87 31.255 -8.876 26.372 695 HB THR 87 HB THR 87 33.925 -7.639 26.267 696 HG1 THR 87 HG1 THR 87 34.528 -9.144 24.868 697 HG21 THR 87 HG21 THR 87 32.985 -10.026 27.873 698 HG22 THR 87 HG22 THR 87 32.475 -8.390 28.264 699 HG23 THR 87 HG23 THR 87 34.168 -8.800 28.317 700 H SER 88 HN SER 88 29.705 -7.492 25.337 701 HA SER 88 HA SER 88 30.532 -4.704 24.964 702 HB2 SER 88 HB2 SER 88 27.715 -5.478 24.507 703 HB3 SER 88 HB1 SER 88 28.783 -4.462 23.551 704 HG SER 88 HG SER 88 28.990 -7.330 23.747 705 H LEU 89 HN LEU 89 30.905 -4.695 27.319 706 HA LEU 89 HA LEU 89 28.816 -5.024 29.199 707 HB2 LEU 89 HB2 LEU 89 30.480 -3.385 30.553 708 HB3 LEU 89 HB1 LEU 89 30.789 -5.097 30.344 709 HG LEU 89 HG LEU 89 31.765 -3.225 28.190 710 HD11 LEU 89 HD11 LEU 89 33.727 -2.641 29.334 711 HD12 LEU 89 HD12 LEU 89 33.366 -3.717 30.688 712 HD13 LEU 89 HD13 LEU 89 32.415 -2.260 30.443 713 HD21 LEU 89 HD21 LEU 89 33.054 -4.992 27.620 714 HD22 LEU 89 HD22 LEU 89 31.938 -5.961 28.594 715 HD23 LEU 89 HD23 LEU 89 33.454 -5.393 29.281 716 H ASN 90 HN ASN 90 27.651 -3.595 27.264 717 HA ASN 90 HA ASN 90 27.307 -0.905 28.433 718 HB2 ASN 90 HB2 ASN 90 26.486 -0.347 26.027 719 HB3 ASN 90 HB1 ASN 90 28.210 -0.391 26.356 720 HD21 ASN 90 HD21 ASN 90 25.813 -2.970 25.695 721 HD22 ASN 90 HD22 ASN 90 26.663 -3.690 24.415 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 0.593 -3.525 0.746 2 H2 MET 1 HT2 MET 1 0.086 -4.967 0.020 3 H3 MET 1 HT3 MET 1 -1.053 -3.823 0.481 4 HA MET 1 HA MET 1 -1.012 -3.264 -1.666 5 HB2 MET 1 HB2 MET 1 1.668 -2.100 -0.820 6 HB3 MET 1 HB1 MET 1 0.712 -1.589 -2.211 7 HG2 MET 1 HG2 MET 1 -0.572 -0.260 -0.934 8 HG3 MET 1 HG1 MET 1 -0.939 -1.560 0.199 9 HE1 MET 1 HE1 MET 1 0.146 1.189 2.627 10 HE2 MET 1 HE2 MET 1 -1.052 -0.032 2.212 11 HE3 MET 1 HE3 MET 1 -0.806 1.333 1.146 12 HA PRO 2 HA PRO 2 1.100 -6.256 -4.201 13 HB2 PRO 2 HB2 PRO 2 1.311 -4.121 -6.274 14 HB3 PRO 2 HB1 PRO 2 0.563 -5.719 -6.373 15 HG2 PRO 2 HG2 PRO 2 -0.951 -3.599 -6.236 16 HG3 PRO 2 HG1 PRO 2 -1.386 -5.045 -5.318 17 HD2 PRO 2 HD2 PRO 2 -0.151 -2.509 -4.317 18 HD3 PRO 2 HD1 PRO 2 -1.405 -3.552 -3.579 19 H THR 3 HN THR 3 3.277 -6.839 -4.504 20 HA THR 3 HA THR 3 5.536 -6.694 -4.650 21 HB THR 3 HB THR 3 5.612 -3.744 -5.052 22 HG1 THR 3 HG1 THR 3 3.897 -4.004 -6.162 23 HG21 THR 3 HG21 THR 3 7.654 -4.818 -5.452 24 HG22 THR 3 HG22 THR 3 6.990 -4.628 -7.063 25 HG23 THR 3 HG23 THR 3 6.922 -6.191 -6.266 26 H GLN 4 HN GLN 4 5.864 -7.217 -2.551 27 HA GLN 4 HA GLN 4 6.501 -4.993 -0.681 28 HB2 GLN 4 HB2 GLN 4 5.299 -7.674 0.045 29 HB3 GLN 4 HB1 GLN 4 5.652 -6.354 1.140 30 HG2 GLN 4 HG2 GLN 4 3.699 -5.348 0.702 31 HG3 GLN 4 HG1 GLN 4 3.972 -5.375 -1.029 32 HE21 GLN 4 HE21 GLN 4 2.237 -6.892 1.556 33 HE22 GLN 4 HE22 GLN 4 1.502 -8.098 0.631 34 H ASP 5 HN ASP 5 7.571 -6.361 1.296 35 HA ASP 5 HA ASP 5 10.021 -7.533 0.199 36 HB2 ASP 5 HB2 ASP 5 9.140 -6.725 2.979 37 HB3 ASP 5 HB1 ASP 5 10.571 -7.700 2.710 38 H ILE 6 HN ILE 6 10.655 -9.505 1.891 39 HA ILE 6 HA ILE 6 8.286 -11.239 1.990 40 HB ILE 6 HB ILE 6 9.639 -13.124 1.283 41 HG12 ILE 6 HG12 ILE 6 11.811 -11.104 0.623 42 HG13 ILE 6 HG11 ILE 6 11.883 -12.139 2.044 43 HG21 ILE 6 HG21 ILE 6 9.823 -12.475 -1.098 44 HG22 ILE 6 HG22 ILE 6 9.826 -10.776 -0.634 45 HG23 ILE 6 HG23 ILE 6 8.384 -11.753 -0.379 46 HD11 ILE 6 HD11 ILE 6 11.444 -13.287 -0.690 47 HD12 ILE 6 HD12 ILE 6 12.078 -14.087 0.755 48 HD13 ILE 6 HD13 ILE 6 13.072 -12.915 -0.125 49 H ARG 7 HN ARG 7 8.430 -12.973 3.499 50 HA ARG 7 HA ARG 7 9.957 -12.172 5.873 51 HB2 ARG 7 HB2 ARG 7 7.796 -14.284 5.647 52 HB3 ARG 7 HB1 ARG 7 8.546 -13.691 7.122 53 HG2 ARG 7 HG2 ARG 7 7.683 -11.333 6.035 54 HG3 ARG 7 HG1 ARG 7 6.449 -12.430 5.439 55 HD2 ARG 7 HD2 ARG 7 7.102 -11.667 8.249 56 HD3 ARG 7 HD1 ARG 7 5.554 -11.813 7.482 57 HE ARG 7 HE ARG 7 6.091 -14.358 7.480 58 HH11 ARG 7 HH21 ARG 7 7.107 -12.069 9.941 59 HH12 ARG 7 HH22 ARG 7 7.154 -13.233 11.182 60 HH21 ARG 7 HH11 ARG 7 6.158 -15.928 9.200 61 HH22 ARG 7 HH12 ARG 7 6.601 -15.432 10.770 62 H LEU 8 HN LEU 8 11.742 -13.128 6.321 63 HA LEU 8 HA LEU 8 12.319 -15.766 5.165 64 HB2 LEU 8 HB2 LEU 8 13.705 -13.889 4.329 65 HB3 LEU 8 HB1 LEU 8 14.219 -13.549 5.973 66 HG LEU 8 HG LEU 8 15.791 -14.985 4.454 67 HD11 LEU 8 HD11 LEU 8 15.525 -16.561 6.880 68 HD12 LEU 8 HD12 LEU 8 15.438 -14.837 7.195 69 HD13 LEU 8 HD13 LEU 8 16.818 -15.507 6.330 70 HD21 LEU 8 HD21 LEU 8 15.285 -17.217 4.069 71 HD22 LEU 8 HD22 LEU 8 13.663 -16.571 3.967 72 HD23 LEU 8 HD23 LEU 8 14.225 -17.344 5.457 73 H TRP 9 HN TRP 9 12.414 -17.333 6.625 74 HA TRP 9 HA TRP 9 12.578 -16.660 9.483 75 HB2 TRP 9 HB2 TRP 9 12.354 -19.447 8.355 76 HB3 TRP 9 HB1 TRP 9 11.852 -18.838 9.927 77 HD1 TRP 9 HD1 TRP 9 10.285 -16.232 8.662 78 HE1 TRP 9 HE1 TRP 9 7.979 -16.684 7.571 79 HE3 TRP 9 HE3 TRP 9 10.713 -21.200 7.766 80 HZ2 TRP 9 HZ2 TRP 9 6.527 -18.883 6.466 81 HZ3 TRP 9 HZ3 TRP 9 8.934 -22.458 6.707 82 HH2 TRP 9 HH2 TRP 9 6.783 -21.296 6.034 83 H VAL 10 HN VAL 10 14.382 -17.130 10.675 84 HA VAL 10 HA VAL 10 16.554 -18.525 9.226 85 HB VAL 10 HB VAL 10 16.924 -16.612 11.521 86 HG11 VAL 10 HG11 VAL 10 19.218 -16.539 10.700 87 HG12 VAL 10 HG12 VAL 10 18.818 -17.682 9.437 88 HG13 VAL 10 HG13 VAL 10 18.758 -18.186 11.142 89 HG21 VAL 10 HG21 VAL 10 17.510 -14.916 9.888 90 HG22 VAL 10 HG22 VAL 10 15.876 -15.442 9.540 91 HG23 VAL 10 HG23 VAL 10 17.225 -16.019 8.553 92 H SER 11 HN SER 11 17.103 -20.405 9.991 93 HA SER 11 HA SER 11 16.010 -21.405 12.503 94 HB2 SER 11 HB2 SER 11 17.927 -22.917 10.742 95 HB3 SER 11 HB1 SER 11 16.591 -23.510 11.703 96 HG SER 11 HG SER 11 16.533 -22.027 9.273 97 H VAL 12 HN VAL 12 17.182 -21.197 14.381 98 HA VAL 12 HA VAL 12 20.043 -20.662 14.077 99 HB VAL 12 HB VAL 12 18.038 -19.694 16.090 100 HG11 VAL 12 HG11 VAL 12 20.042 -18.348 16.948 101 HG12 VAL 12 HG12 VAL 12 21.044 -19.519 16.095 102 HG13 VAL 12 HG13 VAL 12 19.977 -20.048 17.390 103 HG21 VAL 12 HG21 VAL 12 18.116 -17.669 15.024 104 HG22 VAL 12 HG22 VAL 12 18.563 -18.657 13.628 105 HG23 VAL 12 HG23 VAL 12 19.801 -17.837 14.575 106 H GLU 13 HN GLU 13 21.398 -22.005 14.978 107 HA GLU 13 HA GLU 13 20.517 -23.711 17.226 108 HB2 GLU 13 HB2 GLU 13 22.397 -24.428 14.970 109 HB3 GLU 13 HB1 GLU 13 22.203 -25.386 16.435 110 HG2 GLU 13 HG2 GLU 13 19.780 -25.653 15.919 111 HG3 GLU 13 HG1 GLU 13 19.995 -24.731 14.439 112 H ASP 14 HN ASP 14 21.676 -23.383 18.995 113 HA ASP 14 HA ASP 14 24.201 -21.896 18.705 114 HB2 ASP 14 HB2 ASP 14 23.323 -20.504 20.252 115 HB3 ASP 14 HB1 ASP 14 21.967 -21.585 20.476 116 H ALA 15 HN ALA 15 25.906 -22.380 19.969 117 HA ALA 15 HA ALA 15 26.645 -25.126 20.063 118 HB1 ALA 15 HB1 ALA 15 27.912 -22.713 21.342 119 HB2 ALA 15 HB2 ALA 15 28.434 -23.553 19.873 120 HB3 ALA 15 HB3 ALA 15 28.606 -24.320 21.455 121 H GLN 16 HN GLN 16 25.452 -22.926 22.511 122 HA GLN 16 HA GLN 16 25.830 -24.716 24.707 123 HB2 GLN 16 HB2 GLN 16 24.019 -22.283 24.443 124 HB3 GLN 16 HB1 GLN 16 24.410 -23.123 25.936 125 HG2 GLN 16 HG2 GLN 16 26.466 -21.889 24.099 126 HG3 GLN 16 HG1 GLN 16 25.839 -21.104 25.548 127 HE21 GLN 16 HE21 GLN 16 28.424 -23.048 24.479 128 HE22 GLN 16 HE22 GLN 16 28.824 -23.703 25.981 129 H MET 17 HN MET 17 23.910 -24.880 22.085 130 HA MET 17 HA MET 17 22.441 -26.380 21.443 131 HB2 MET 17 HB2 MET 17 22.445 -27.374 24.305 132 HB3 MET 17 HB1 MET 17 21.537 -28.117 22.993 133 HG2 MET 17 HG2 MET 17 23.582 -28.429 21.679 134 HG3 MET 17 HG1 MET 17 24.535 -27.673 22.954 135 HE1 MET 17 HE1 MET 17 21.532 -30.306 22.933 136 HE2 MET 17 HE2 MET 17 22.498 -31.776 22.941 137 HE3 MET 17 HE3 MET 17 22.676 -30.645 21.617 138 H HIS 18 HN HIS 18 21.633 -23.931 21.625 139 HA HIS 18 HA HIS 18 18.823 -24.096 22.568 140 HB2 HIS 18 HB2 HIS 18 20.471 -21.658 21.802 141 HB3 HIS 18 HB1 HIS 18 18.778 -21.637 22.238 142 HD1 HIS 18 HD1 HIS 18 22.135 -22.504 23.677 143 HD2 HIS 18 HD2 HIS 18 18.308 -21.505 24.997 144 HE1 HIS 18 HE1 HIS 18 22.285 -22.131 26.243 145 HE2 HIS 18 HE2 HIS 18 19.936 -21.515 27.018 146 H THR 19 HN THR 19 17.396 -24.470 20.940 147 HA THR 19 HA THR 19 18.269 -23.872 18.176 148 HB THR 19 HB THR 19 16.118 -25.820 18.986 149 HG1 THR 19 HG1 THR 19 18.837 -26.001 19.236 150 HG21 THR 19 HG21 THR 19 16.679 -26.775 16.728 151 HG22 THR 19 HG22 THR 19 17.782 -25.414 16.474 152 HG23 THR 19 HG23 THR 19 16.066 -25.132 16.672 153 H VAL 20 HN VAL 20 17.303 -22.092 17.424 154 HA VAL 20 HA VAL 20 14.443 -21.737 17.984 155 HB VAL 20 HB VAL 20 14.783 -19.299 18.355 156 HG11 VAL 20 HG11 VAL 20 15.275 -19.516 20.648 157 HG12 VAL 20 HG12 VAL 20 16.380 -20.854 20.394 158 HG13 VAL 20 HG13 VAL 20 14.639 -21.099 20.198 159 HG21 VAL 20 HG21 VAL 20 16.887 -18.757 17.455 160 HG22 VAL 20 HG22 VAL 20 17.685 -20.147 18.183 161 HG23 VAL 20 HG23 VAL 20 17.221 -18.772 19.177 162 H THR 21 HN THR 21 13.401 -20.232 16.570 163 HA THR 21 HA THR 21 14.802 -19.890 14.017 164 HB THR 21 HB THR 21 11.840 -20.424 14.397 165 HG1 THR 21 HG1 THR 21 13.411 -22.188 14.661 166 HG21 THR 21 HG21 THR 21 12.450 -18.924 12.475 167 HG22 THR 21 HG22 THR 21 11.725 -20.437 11.986 168 HG23 THR 21 HG23 THR 21 13.472 -20.216 11.844 169 H ILE 22 HN ILE 22 14.811 -17.833 13.303 170 HA ILE 22 HA ILE 22 13.064 -15.925 14.736 171 HB ILE 22 HB ILE 22 14.788 -14.233 14.515 172 HG12 ILE 22 HG12 ILE 22 16.566 -16.441 13.456 173 HG13 ILE 22 HG11 ILE 22 15.807 -15.194 12.434 174 HG21 ILE 22 HG21 ILE 22 16.194 -16.610 15.695 175 HG22 ILE 22 HG22 ILE 22 14.716 -15.996 16.440 176 HG23 ILE 22 HG23 ILE 22 16.121 -14.955 16.290 177 HD11 ILE 22 HD11 ILE 22 17.430 -14.321 14.814 178 HD12 ILE 22 HD12 ILE 22 17.147 -13.514 13.276 179 HD13 ILE 22 HD13 ILE 22 18.265 -14.861 13.356 180 H TRP 23 HN TRP 23 12.310 -14.212 13.600 181 HA TRP 23 HA TRP 23 11.865 -14.907 10.754 182 HB2 TRP 23 HB2 TRP 23 9.994 -13.255 12.450 183 HB3 TRP 23 HB1 TRP 23 9.666 -14.241 11.043 184 HD1 TRP 23 HD1 TRP 23 10.669 -14.709 14.758 185 HE1 TRP 23 HE1 TRP 23 9.912 -17.049 15.499 186 HE3 TRP 23 HE3 TRP 23 8.892 -16.500 10.341 187 HZ2 TRP 23 HZ2 TRP 23 8.709 -19.380 14.382 188 HZ3 TRP 23 HZ3 TRP 23 7.939 -18.786 10.197 189 HH2 TRP 23 HH2 TRP 23 7.844 -20.225 12.225 190 H LEU 24 HN LEU 24 12.669 -13.563 9.314 191 HA LEU 24 HA LEU 24 13.052 -10.699 10.033 192 HB2 LEU 24 HB2 LEU 24 14.626 -12.393 8.083 193 HB3 LEU 24 HB1 LEU 24 14.921 -10.697 8.453 194 HG LEU 24 HG LEU 24 15.066 -12.946 10.508 195 HD11 LEU 24 HD11 LEU 24 16.853 -12.960 8.699 196 HD12 LEU 24 HD12 LEU 24 17.429 -12.822 10.364 197 HD13 LEU 24 HD13 LEU 24 17.359 -11.394 9.333 198 HD21 LEU 24 HD21 LEU 24 14.640 -10.965 11.726 199 HD22 LEU 24 HD22 LEU 24 15.533 -9.961 10.582 200 HD23 LEU 24 HD23 LEU 24 16.398 -11.043 11.681 201 H THR 25 HN THR 25 12.306 -9.190 8.556 202 HA THR 25 HA THR 25 10.854 -10.240 6.205 203 HB THR 25 HB THR 25 10.328 -7.569 7.486 204 HG1 THR 25 HG1 THR 25 9.613 -8.621 9.140 205 HG21 THR 25 HG21 THR 25 7.969 -8.475 6.551 206 HG22 THR 25 HG22 THR 25 9.046 -9.354 5.476 207 HG23 THR 25 HG23 THR 25 9.117 -7.598 5.541 208 H VAL 26 HN VAL 26 11.964 -9.833 4.378 209 HA VAL 26 HA VAL 26 13.176 -7.221 3.927 210 HB VAL 26 HB VAL 26 15.355 -8.225 3.264 211 HG11 VAL 26 HG11 VAL 26 14.718 -8.868 6.146 212 HG12 VAL 26 HG12 VAL 26 14.904 -7.217 5.573 213 HG13 VAL 26 HG13 VAL 26 16.260 -8.352 5.471 214 HG21 VAL 26 HG21 VAL 26 14.873 -10.500 2.854 215 HG22 VAL 26 HG22 VAL 26 14.020 -10.703 4.382 216 HG23 VAL 26 HG23 VAL 26 15.777 -10.545 4.366 217 H ARG 27 HN ARG 27 14.212 -7.300 1.649 218 HA ARG 27 HA ARG 27 12.380 -8.775 -0.124 219 HB2 ARG 27 HB2 ARG 27 13.347 -7.230 -1.908 220 HB3 ARG 27 HB1 ARG 27 12.326 -6.476 -0.694 221 HG2 ARG 27 HG2 ARG 27 14.910 -6.344 0.446 222 HG3 ARG 27 HG1 ARG 27 15.161 -6.004 -1.248 223 HD2 ARG 27 HD2 ARG 27 13.115 -4.676 0.499 224 HD3 ARG 27 HD1 ARG 27 14.648 -3.941 0.058 225 HE ARG 27 HE ARG 27 12.269 -3.987 -1.529 226 HH11 ARG 27 HH21 ARG 27 15.712 -4.297 -1.712 227 HH12 ARG 27 HH22 ARG 27 15.892 -3.888 -3.350 228 HH21 ARG 27 HH11 ARG 27 12.396 -3.365 -3.740 229 HH22 ARG 27 HH12 ARG 27 13.894 -3.304 -4.550 230 HA PRO 28 HA PRO 28 15.598 -11.648 -1.315 231 HB2 PRO 28 HB2 PRO 28 14.742 -11.124 -4.124 232 HB3 PRO 28 HB1 PRO 28 14.882 -12.660 -3.240 233 HG2 PRO 28 HG2 PRO 28 12.513 -11.626 -3.733 234 HG3 PRO 28 HG1 PRO 28 12.848 -12.391 -2.167 235 HD2 PRO 28 HD2 PRO 28 12.637 -9.480 -2.815 236 HD3 PRO 28 HD1 PRO 28 12.128 -10.349 -1.358 237 H ASP 29 HN ASP 29 15.134 -8.607 -2.837 238 HA ASP 29 HA ASP 29 17.530 -8.316 -4.322 239 HB2 ASP 29 HB2 ASP 29 15.581 -6.984 -4.824 240 HB3 ASP 29 HB1 ASP 29 15.636 -6.231 -3.229 241 H MET 30 HN MET 30 16.711 -7.716 -0.990 242 HA MET 30 HA MET 30 18.853 -6.035 -0.261 243 HB2 MET 30 HB2 MET 30 16.755 -7.479 1.096 244 HB3 MET 30 HB1 MET 30 18.279 -7.820 1.900 245 HG2 MET 30 HG2 MET 30 17.681 -4.971 1.172 246 HG3 MET 30 HG1 MET 30 16.838 -5.684 2.527 247 HE1 MET 30 HE1 MET 30 19.157 -6.334 5.225 248 HE2 MET 30 HE2 MET 30 18.854 -7.648 4.121 249 HE3 MET 30 HE3 MET 30 17.567 -6.494 4.472 250 H THR 31 HN THR 31 20.550 -6.957 1.425 251 HA THR 31 HA THR 31 21.773 -9.367 0.250 252 HB THR 31 HB THR 31 22.772 -6.917 -0.267 253 HG1 THR 31 HG1 THR 31 23.676 -9.419 -0.441 254 HG21 THR 31 HG21 THR 31 24.409 -7.755 2.114 255 HG22 THR 31 HG22 THR 31 23.103 -6.574 2.280 256 HG23 THR 31 HG23 THR 31 24.477 -6.247 1.231 257 H VAL 32 HN VAL 32 23.223 -10.515 1.624 258 HA VAL 32 HA VAL 32 22.084 -10.919 4.130 259 HB VAL 32 HB VAL 32 24.614 -11.959 2.872 260 HG11 VAL 32 HG11 VAL 32 24.844 -11.866 5.436 261 HG12 VAL 32 HG12 VAL 32 24.843 -13.486 4.764 262 HG13 VAL 32 HG13 VAL 32 23.392 -12.865 5.526 263 HG21 VAL 32 HG21 VAL 32 22.339 -12.648 2.096 264 HG22 VAL 32 HG22 VAL 32 22.059 -13.331 3.704 265 HG23 VAL 32 HG23 VAL 32 23.345 -13.980 2.679 266 H ALA 33 HN ALA 33 25.019 -9.224 3.172 267 HA ALA 33 HA ALA 33 26.164 -8.687 5.619 268 HB1 ALA 33 HB1 ALA 33 27.305 -6.981 4.606 269 HB2 ALA 33 HB2 ALA 33 25.895 -6.342 3.791 270 HB3 ALA 33 HB3 ALA 33 26.714 -7.755 3.140 271 H SER 34 HN SER 34 23.527 -6.861 4.053 272 HA SER 34 HA SER 34 23.056 -5.122 6.275 273 HB2 SER 34 HB2 SER 34 21.146 -5.953 4.096 274 HB3 SER 34 HB1 SER 34 21.027 -4.520 5.114 275 HG SER 34 HG SER 34 23.104 -3.907 4.214 276 H LEU 35 HN LEU 35 21.846 -8.245 5.277 277 HA LEU 35 HA LEU 35 19.717 -8.482 7.124 278 HB2 LEU 35 HB2 LEU 35 20.022 -9.950 5.110 279 HB3 LEU 35 HB1 LEU 35 21.440 -10.638 5.905 280 HG LEU 35 HG LEU 35 20.104 -11.546 7.700 281 HD11 LEU 35 HD11 LEU 35 17.987 -9.829 6.429 282 HD12 LEU 35 HD12 LEU 35 18.384 -10.125 8.125 283 HD13 LEU 35 HD13 LEU 35 17.502 -11.348 7.210 284 HD21 LEU 35 HD21 LEU 35 20.301 -12.902 5.689 285 HD22 LEU 35 HD22 LEU 35 18.924 -12.054 4.957 286 HD23 LEU 35 HD23 LEU 35 18.671 -13.093 6.350 287 H LYS 36 HN LYS 36 23.134 -9.280 7.282 288 HA LYS 36 HA LYS 36 23.237 -10.560 9.816 289 HB2 LYS 36 HB2 LYS 36 25.186 -8.739 8.428 290 HB3 LYS 36 HB1 LYS 36 25.571 -9.639 9.891 291 HG2 LYS 36 HG2 LYS 36 24.593 -10.988 7.368 292 HG3 LYS 36 HG1 LYS 36 26.298 -10.670 7.679 293 HD2 LYS 36 HD2 LYS 36 25.851 -11.816 9.986 294 HD3 LYS 36 HD1 LYS 36 24.411 -12.436 9.198 295 HE2 LYS 36 HE2 LYS 36 26.470 -13.957 9.043 296 HE3 LYS 36 HE1 LYS 36 25.682 -13.592 7.504 297 HZ1 LYS 36 HZ1 LYS 36 27.374 -12.167 6.886 298 HZ2 LYS 36 HZ2 LYS 36 28.208 -13.366 7.707 299 HZ3 LYS 36 HZ3 LYS 36 27.921 -11.886 8.470 300 H ASP 37 HN ASP 37 23.466 -7.248 8.803 301 HA ASP 37 HA ASP 37 24.046 -6.030 11.263 302 HB2 ASP 37 HB2 ASP 37 24.305 -4.766 9.253 303 HB3 ASP 37 HB1 ASP 37 22.600 -4.934 8.851 304 H MET 38 HN MET 38 20.871 -6.433 9.724 305 HA MET 38 HA MET 38 19.421 -5.278 11.844 306 HB2 MET 38 HB2 MET 38 17.831 -7.353 10.665 307 HB3 MET 38 HB1 MET 38 17.671 -5.624 10.582 308 HG2 MET 38 HG2 MET 38 19.343 -5.502 8.769 309 HG3 MET 38 HG1 MET 38 19.445 -7.268 8.785 310 HE1 MET 38 HE1 MET 38 17.434 -8.626 9.100 311 HE2 MET 38 HE2 MET 38 16.385 -8.757 7.703 312 HE3 MET 38 HE3 MET 38 15.828 -7.914 9.122 313 H VAL 39 HN VAL 39 20.412 -8.597 11.273 314 HA VAL 39 HA VAL 39 18.982 -9.747 13.368 315 HB VAL 39 HB VAL 39 21.685 -10.515 12.237 316 HG11 VAL 39 HG11 VAL 39 20.037 -12.637 13.440 317 HG12 VAL 39 HG12 VAL 39 20.615 -11.468 14.621 318 HG13 VAL 39 HG13 VAL 39 21.761 -12.327 13.602 319 HG21 VAL 39 HG21 VAL 39 20.549 -11.419 10.521 320 HG22 VAL 39 HG22 VAL 39 19.090 -10.630 11.100 321 HG23 VAL 39 HG23 VAL 39 19.468 -12.278 11.608 322 H PHE 40 HN PHE 40 22.134 -8.169 13.257 323 HA PHE 40 HA PHE 40 22.746 -8.519 16.001 324 HB2 PHE 40 HB2 PHE 40 24.512 -7.940 14.482 325 HB3 PHE 40 HB1 PHE 40 23.658 -6.448 14.018 326 HD1 PHE 40 HD2 PHE 40 24.703 -8.173 17.223 327 HD2 PHE 40 HD1 PHE 40 24.520 -4.498 14.997 328 HE1 PHE 40 HE2 PHE 40 25.776 -6.981 19.102 329 HE2 PHE 40 HE1 PHE 40 25.591 -3.313 16.892 330 HZ PHE 40 HZ PHE 40 26.224 -4.543 18.937 331 H LEU 41 HN LEU 41 21.167 -5.927 14.158 332 HA LEU 41 HA LEU 41 20.780 -4.130 16.319 333 HB2 LEU 41 HB2 LEU 41 18.934 -4.660 13.973 334 HB3 LEU 41 HB1 LEU 41 18.924 -3.233 14.986 335 HG LEU 41 HG LEU 41 21.178 -4.159 13.239 336 HD11 LEU 41 HD11 LEU 41 20.695 -2.207 11.881 337 HD12 LEU 41 HD12 LEU 41 19.403 -1.739 12.963 338 HD13 LEU 41 HD13 LEU 41 19.260 -3.226 12.005 339 HD21 LEU 41 HD21 LEU 41 21.907 -1.694 13.822 340 HD22 LEU 41 HD22 LEU 41 22.327 -3.074 14.842 341 HD23 LEU 41 HD23 LEU 41 20.979 -2.015 15.308 342 H ASP 42 HN ASP 42 18.812 -6.603 14.932 343 HA ASP 42 HA ASP 42 16.556 -6.321 16.655 344 HB2 ASP 42 HB2 ASP 42 17.395 -8.533 14.815 345 HB3 ASP 42 HB1 ASP 42 15.895 -8.584 15.727 346 H TYR 43 HN TYR 43 19.014 -8.876 16.539 347 HA TYR 43 HA TYR 43 18.026 -9.774 19.176 348 HB2 TYR 43 HB2 TYR 43 19.629 -11.431 17.243 349 HB3 TYR 43 HB1 TYR 43 18.662 -11.966 18.608 350 HD1 TYR 43 HD2 TYR 43 16.122 -11.459 18.578 351 HD2 TYR 43 HD1 TYR 43 18.622 -11.253 15.086 352 HE1 TYR 43 HE2 TYR 43 14.137 -11.610 17.137 353 HE2 TYR 43 HE1 TYR 43 16.630 -11.410 13.658 354 HH TYR 43 HH TYR 43 13.974 -10.722 14.151 355 H GLY 44 HN GLY 44 20.551 -8.024 18.014 356 HA2 GLY 44 HA2 GLY 44 22.524 -7.353 19.047 357 HA3 GLY 44 HA1 GLY 44 22.054 -8.312 20.428 358 H PHE 45 HN PHE 45 21.977 -9.968 17.475 359 HA PHE 45 HA PHE 45 23.917 -11.854 18.330 360 HB2 PHE 45 HB2 PHE 45 22.494 -11.441 15.696 361 HB3 PHE 45 HB1 PHE 45 23.655 -12.730 15.970 362 HD1 PHE 45 HD1 PHE 45 22.075 -12.082 19.103 363 HD2 PHE 45 HD2 PHE 45 21.372 -14.000 15.290 364 HE1 PHE 45 HE1 PHE 45 20.352 -13.486 20.118 365 HE2 PHE 45 HE2 PHE 45 19.626 -15.402 16.343 366 HZ PHE 45 HZ PHE 45 19.113 -15.150 18.757 367 HA PRO 46 HA PRO 46 27.281 -9.272 16.897 368 HB2 PRO 46 HB2 PRO 46 29.313 -10.796 17.821 369 HB3 PRO 46 HB1 PRO 46 28.315 -9.787 18.880 370 HG2 PRO 46 HG2 PRO 46 28.108 -12.716 18.367 371 HG3 PRO 46 HG1 PRO 46 27.993 -11.871 19.910 372 HD2 PRO 46 HD2 PRO 46 25.787 -12.689 18.597 373 HD3 PRO 46 HD1 PRO 46 25.777 -11.207 19.551 374 HA PRO 47 HA PRO 47 28.209 -11.125 12.990 375 HB2 PRO 47 HB2 PRO 47 30.797 -10.261 12.642 376 HB3 PRO 47 HB1 PRO 47 29.356 -9.283 12.275 377 HG2 PRO 47 HG2 PRO 47 31.136 -9.262 14.660 378 HG3 PRO 47 HG1 PRO 47 30.342 -7.902 13.845 379 HD2 PRO 47 HD2 PRO 47 29.355 -8.816 16.152 380 HD3 PRO 47 HD1 PRO 47 28.266 -8.296 14.846 381 H VAL 48 HN VAL 48 30.545 -11.548 15.603 382 HA VAL 48 HA VAL 48 31.975 -13.685 14.439 383 HB VAL 48 HB VAL 48 32.871 -12.580 16.412 384 HG11 VAL 48 HG11 VAL 48 31.747 -12.220 18.355 385 HG12 VAL 48 HG12 VAL 48 30.931 -13.761 18.337 386 HG13 VAL 48 HG13 VAL 48 30.326 -12.417 17.345 387 HG21 VAL 48 HG21 VAL 48 33.775 -14.487 17.321 388 HG22 VAL 48 HG22 VAL 48 32.889 -15.302 16.052 389 HG23 VAL 48 HG23 VAL 48 32.205 -15.191 17.673 390 H LEU 49 HN LEU 49 29.149 -13.566 16.496 391 HA LEU 49 HA LEU 49 28.746 -16.411 16.489 392 HB2 LEU 49 HB2 LEU 49 26.999 -14.165 17.461 393 HB3 LEU 49 HB1 LEU 49 26.573 -15.868 17.589 394 HG LEU 49 HG LEU 49 29.169 -14.736 18.710 395 HD11 LEU 49 HD11 LEU 49 26.875 -14.001 19.804 396 HD12 LEU 49 HD12 LEU 49 28.224 -14.563 20.793 397 HD13 LEU 49 HD13 LEU 49 26.905 -15.651 20.423 398 HD21 LEU 49 HD21 LEU 49 27.762 -17.416 18.906 399 HD22 LEU 49 HD22 LEU 49 29.053 -16.935 19.980 400 HD23 LEU 49 HD23 LEU 49 29.380 -17.101 18.265 401 H GLN 50 HN GLN 50 27.390 -13.743 14.634 402 HA GLN 50 HA GLN 50 25.267 -15.273 13.564 403 HB2 GLN 50 HB2 GLN 50 26.621 -12.815 12.481 404 HB3 GLN 50 HB1 GLN 50 25.239 -13.565 11.695 405 HG2 GLN 50 HG2 GLN 50 24.026 -13.363 13.943 406 HG3 GLN 50 HG1 GLN 50 25.357 -12.320 14.446 407 HE21 GLN 50 HE21 GLN 50 24.583 -10.174 14.262 408 HE22 GLN 50 HE22 GLN 50 23.762 -9.599 12.876 409 H GLN 51 HN GLN 51 26.129 -17.270 13.046 410 HA GLN 51 HA GLN 51 27.796 -17.361 10.604 411 HB2 GLN 51 HB2 GLN 51 26.903 -19.589 12.449 412 HB3 GLN 51 HB1 GLN 51 28.017 -19.724 11.111 413 HG2 GLN 51 HG2 GLN 51 29.643 -18.299 12.182 414 HG3 GLN 51 HG1 GLN 51 28.520 -17.902 13.476 415 HE21 GLN 51 HE21 GLN 51 27.558 -19.963 14.556 416 HE22 GLN 51 HE22 GLN 51 28.701 -21.176 14.958 417 H TRP 52 HN TRP 52 26.494 -17.208 8.853 418 HA TRP 52 HA TRP 52 23.864 -18.508 8.908 419 HB2 TRP 52 HB2 TRP 52 25.179 -16.568 6.987 420 HB3 TRP 52 HB1 TRP 52 23.697 -17.415 6.605 421 HD1 TRP 52 HD1 TRP 52 25.001 -15.291 9.597 422 HE1 TRP 52 HE1 TRP 52 23.042 -13.806 10.416 423 HE3 TRP 52 HE3 TRP 52 21.329 -16.853 6.433 424 HZ2 TRP 52 HZ2 TRP 52 20.268 -13.358 9.795 425 HZ3 TRP 52 HZ3 TRP 52 19.049 -15.885 6.565 426 HH2 TRP 52 HH2 TRP 52 18.532 -14.142 8.247 427 H VAL 53 HN VAL 53 23.465 -20.354 7.786 428 HA VAL 53 HA VAL 53 25.679 -21.384 6.103 429 HB VAL 53 HB VAL 53 23.972 -22.869 8.118 430 HG11 VAL 53 HG11 VAL 53 24.148 -24.328 6.227 431 HG12 VAL 53 HG12 VAL 53 25.353 -24.862 7.397 432 HG13 VAL 53 HG13 VAL 53 25.851 -23.926 5.996 433 HG21 VAL 53 HG21 VAL 53 26.336 -23.479 8.954 434 HG22 VAL 53 HG22 VAL 53 25.809 -21.824 9.218 435 HG23 VAL 53 HG23 VAL 53 26.921 -22.196 7.900 436 H ILE 54 HN ILE 54 25.078 -21.808 4.083 437 HA ILE 54 HA ILE 54 22.269 -22.521 3.560 438 HB ILE 54 HB ILE 54 23.945 -21.108 1.480 439 HG12 ILE 54 HG12 ILE 54 24.008 -19.680 3.594 440 HG13 ILE 54 HG11 ILE 54 23.170 -18.932 2.249 441 HG21 ILE 54 HG21 ILE 54 21.554 -20.224 1.026 442 HG22 ILE 54 HG22 ILE 54 21.009 -21.424 2.161 443 HG23 ILE 54 HG23 ILE 54 21.824 -21.930 0.674 444 HD11 ILE 54 HD11 ILE 54 22.033 -20.019 4.796 445 HD12 ILE 54 HD12 ILE 54 21.025 -20.106 3.362 446 HD13 ILE 54 HD13 ILE 54 21.637 -18.555 3.919 447 H GLY 55 HN GLY 55 22.172 -24.531 2.783 448 HA2 GLY 55 HA2 GLY 55 24.465 -26.083 2.600 449 HA3 GLY 55 HA1 GLY 55 22.883 -26.621 2.067 450 H GLN 56 HN GLN 56 22.402 -25.093 -0.142 451 HA GLN 56 HA GLN 56 24.610 -25.937 -1.934 452 HB2 GLN 56 HB2 GLN 56 21.640 -25.717 -2.441 453 HB3 GLN 56 HB1 GLN 56 22.833 -25.997 -3.690 454 HG2 GLN 56 HG2 GLN 56 23.604 -28.026 -2.610 455 HG3 GLN 56 HG1 GLN 56 22.507 -27.755 -1.247 456 HE21 GLN 56 HE21 GLN 56 20.273 -28.250 -1.569 457 HE22 GLN 56 HE22 GLN 56 19.688 -29.013 -2.967 458 H ARG 57 HN ARG 57 23.238 -23.179 -0.717 459 HA ARG 57 HA ARG 57 23.940 -21.623 -3.133 460 HB2 ARG 57 HB2 ARG 57 22.284 -20.726 -0.765 461 HB3 ARG 57 HB1 ARG 57 22.563 -19.855 -2.240 462 HG2 ARG 57 HG2 ARG 57 21.235 -22.581 -2.186 463 HG3 ARG 57 HG1 ARG 57 20.320 -21.091 -2.193 464 HD2 ARG 57 HD2 ARG 57 22.218 -22.078 -4.341 465 HD3 ARG 57 HD1 ARG 57 20.481 -21.848 -4.471 466 HE ARG 57 HE ARG 57 21.760 -19.375 -3.757 467 HH11 ARG 57 HH21 ARG 57 21.158 -21.529 -6.442 468 HH12 ARG 57 HH22 ARG 57 21.376 -20.304 -7.615 469 HH21 ARG 57 HH11 ARG 57 22.057 -17.834 -5.255 470 HH22 ARG 57 HH12 ARG 57 21.921 -18.133 -6.941 471 H LEU 58 HN LEU 58 24.844 -19.465 -2.711 472 HA LEU 58 HA LEU 58 27.212 -19.683 -1.128 473 HB2 LEU 58 HB2 LEU 58 25.944 -17.335 -2.545 474 HB3 LEU 58 HB1 LEU 58 27.534 -17.292 -1.788 475 HG LEU 58 HG LEU 58 26.751 -19.259 -3.969 476 HD11 LEU 58 HD11 LEU 58 27.929 -17.915 -5.517 477 HD12 LEU 58 HD12 LEU 58 28.542 -16.842 -4.280 478 HD13 LEU 58 HD13 LEU 58 26.818 -16.830 -4.703 479 HD21 LEU 58 HD21 LEU 58 29.288 -18.659 -2.429 480 HD22 LEU 58 HD22 LEU 58 29.370 -19.317 -4.056 481 HD23 LEU 58 HD23 LEU 58 28.549 -20.218 -2.790 482 H ALA 59 HN ALA 59 27.773 -18.415 0.683 483 HA ALA 59 HA ALA 59 25.464 -17.489 2.282 484 HB1 ALA 59 HB1 ALA 59 26.518 -18.214 4.224 485 HB2 ALA 59 HB2 ALA 59 28.113 -18.204 3.479 486 HB3 ALA 59 HB3 ALA 59 26.965 -19.494 3.084 487 H ARG 60 HN ARG 60 27.290 -16.125 0.258 488 HA ARG 60 HA ARG 60 29.025 -14.389 1.595 489 HB2 ARG 60 HB2 ARG 60 27.581 -14.023 -1.040 490 HB3 ARG 60 HB1 ARG 60 28.807 -12.907 -0.428 491 HG2 ARG 60 HG2 ARG 60 30.442 -14.664 -0.348 492 HG3 ARG 60 HG1 ARG 60 29.252 -15.869 -0.867 493 HD2 ARG 60 HD2 ARG 60 30.589 -15.188 -2.788 494 HD3 ARG 60 HD1 ARG 60 28.940 -14.622 -3.006 495 HE ARG 60 HE ARG 60 30.623 -12.671 -1.727 496 HH11 ARG 60 HH21 ARG 60 29.759 -14.090 -4.819 497 HH12 ARG 60 HH22 ARG 60 30.197 -12.720 -5.733 498 HH21 ARG 60 HH11 ARG 60 31.207 -10.803 -2.973 499 HH22 ARG 60 HH12 ARG 60 31.035 -10.804 -4.659 500 H ASP 61 HN ASP 61 28.785 -12.522 2.591 501 HA ASP 61 HA ASP 61 26.282 -11.509 3.493 502 HB2 ASP 61 HB2 ASP 61 29.099 -10.465 3.438 503 HB3 ASP 61 HB1 ASP 61 27.770 -9.402 3.861 504 H GLN 62 HN GLN 62 28.481 -10.934 0.930 505 HA GLN 62 HA GLN 62 27.517 -8.484 -0.083 506 HB2 GLN 62 HB2 GLN 62 29.180 -10.660 -1.368 507 HB3 GLN 62 HB1 GLN 62 28.909 -9.052 -2.027 508 HG2 GLN 62 HG2 GLN 62 29.918 -7.976 -0.171 509 HG3 GLN 62 HG1 GLN 62 30.002 -9.445 0.764 510 HE21 GLN 62 HE21 GLN 62 32.435 -8.434 0.608 511 HE22 GLN 62 HE22 GLN 62 33.392 -9.130 -0.605 512 H GLU 63 HN GLU 63 26.719 -11.839 -0.849 513 HA GLU 63 HA GLU 63 25.389 -11.227 -3.266 514 HB2 GLU 63 HB2 GLU 63 25.445 -13.669 -1.522 515 HB3 GLU 63 HB1 GLU 63 24.293 -13.550 -2.834 516 HG2 GLU 63 HG2 GLU 63 27.268 -13.115 -3.197 517 HG3 GLU 63 HG1 GLU 63 26.436 -14.638 -3.518 518 H THR 64 HN THR 64 23.194 -11.469 -3.795 519 HA THR 64 HA THR 64 21.470 -9.926 -2.166 520 HB THR 64 HB THR 64 19.851 -11.235 -3.975 521 HG1 THR 64 HG1 THR 64 21.723 -12.295 -4.856 522 HG21 THR 64 HG21 THR 64 21.253 -8.630 -3.821 523 HG22 THR 64 HG22 THR 64 19.563 -9.021 -4.067 524 HG23 THR 64 HG23 THR 64 20.666 -9.090 -5.429 525 H LEU 65 HN LEU 65 19.432 -10.683 -1.286 526 HA LEU 65 HA LEU 65 19.748 -13.051 0.244 527 HB2 LEU 65 HB2 LEU 65 17.326 -11.331 -0.282 528 HB3 LEU 65 HB1 LEU 65 17.334 -12.659 0.879 529 HG LEU 65 HG LEU 65 19.183 -10.261 0.923 530 HD11 LEU 65 HD11 LEU 65 17.937 -9.717 3.032 531 HD12 LEU 65 HD12 LEU 65 16.835 -11.032 2.635 532 HD13 LEU 65 HD13 LEU 65 16.946 -9.627 1.573 533 HD21 LEU 65 HD21 LEU 65 18.923 -12.675 2.766 534 HD22 LEU 65 HD22 LEU 65 19.746 -11.190 3.231 535 HD23 LEU 65 HD23 LEU 65 20.362 -12.133 1.897 536 H HIS 66 HN HIS 66 18.047 -12.328 -2.698 537 HA HIS 66 HA HIS 66 16.780 -14.796 -3.159 538 HB2 HIS 66 HB2 HIS 66 16.448 -12.809 -4.599 539 HB3 HIS 66 HB1 HIS 66 18.098 -12.962 -5.184 540 HD1 HIS 66 HD1 HIS 66 17.697 -16.298 -5.254 541 HD2 HIS 66 HD2 HIS 66 15.462 -13.347 -7.221 542 HE1 HIS 66 HE1 HIS 66 16.625 -17.393 -7.255 543 HE2 HIS 66 HE2 HIS 66 15.269 -15.614 -8.456 544 H SER 67 HN SER 67 20.125 -13.772 -3.692 545 HA SER 67 HA SER 67 21.051 -15.954 -5.133 546 HB2 SER 67 HB2 SER 67 22.590 -14.494 -2.988 547 HB3 SER 67 HB1 SER 67 23.239 -15.352 -4.352 548 HG SER 67 HG SER 67 23.237 -13.359 -5.035 549 H HIS 68 HN HIS 68 20.366 -15.594 -1.676 550 HA HIS 68 HA HIS 68 21.742 -18.039 -1.024 551 HB2 HIS 68 HB2 HIS 68 20.073 -16.223 0.721 552 HB3 HIS 68 HB1 HIS 68 21.154 -17.494 1.275 553 HD1 HIS 68 HD1 HIS 68 23.780 -17.194 0.243 554 HD2 HIS 68 HD2 HIS 68 21.424 -13.751 0.516 555 HE1 HIS 68 HE1 HIS 68 25.332 -15.234 0.075 556 HE2 HIS 68 HE2 HIS 68 23.942 -13.135 0.251 557 H GLY 69 HN GLY 69 18.841 -17.366 -2.399 558 HA2 GLY 69 HA2 GLY 69 17.417 -19.120 -3.063 559 HA3 GLY 69 HA1 GLY 69 17.789 -19.991 -1.587 560 H VAL 70 HN VAL 70 17.346 -16.889 -0.624 561 HA VAL 70 HA VAL 70 14.586 -17.443 0.123 562 HB VAL 70 HB VAL 70 15.964 -16.697 1.934 563 HG11 VAL 70 HG11 VAL 70 16.762 -14.422 0.176 564 HG12 VAL 70 HG12 VAL 70 17.797 -15.727 0.822 565 HG13 VAL 70 HG13 VAL 70 17.115 -14.514 1.900 566 HG21 VAL 70 HG21 VAL 70 14.405 -14.260 1.027 567 HG22 VAL 70 HG22 VAL 70 14.769 -14.704 2.680 568 HG23 VAL 70 HG23 VAL 70 13.631 -15.670 1.742 569 H ARG 71 HN ARG 71 13.222 -17.012 -1.411 570 HA ARG 71 HA ARG 71 13.567 -14.566 -3.089 571 HB2 ARG 71 HB2 ARG 71 12.026 -17.004 -3.935 572 HB3 ARG 71 HB1 ARG 71 12.738 -15.728 -4.910 573 HG2 ARG 71 HG2 ARG 71 14.678 -16.797 -5.088 574 HG3 ARG 71 HG1 ARG 71 14.842 -17.061 -3.360 575 HD2 ARG 71 HD2 ARG 71 13.189 -18.726 -5.287 576 HD3 ARG 71 HD1 ARG 71 14.715 -19.200 -4.547 577 HE ARG 71 HE ARG 71 13.076 -18.620 -2.388 578 HH11 ARG 71 HH21 ARG 71 12.915 -20.723 -5.166 579 HH12 ARG 71 HH22 ARG 71 11.979 -21.913 -4.361 580 HH21 ARG 71 HH11 ARG 71 11.819 -20.214 -1.336 581 HH22 ARG 71 HH12 ARG 71 11.360 -21.623 -2.197 582 H GLN 72 HN GLN 72 11.329 -16.652 -1.378 583 HA GLN 72 HA GLN 72 9.245 -14.572 -1.652 584 HB2 GLN 72 HB2 GLN 72 8.970 -17.569 -1.736 585 HB3 GLN 72 HB1 GLN 72 7.609 -16.502 -1.432 586 HG2 GLN 72 HG2 GLN 72 7.951 -15.413 -3.535 587 HG3 GLN 72 HG1 GLN 72 9.409 -16.363 -3.859 588 HE21 GLN 72 HE21 GLN 72 9.118 -18.628 -4.362 589 HE22 GLN 72 HE22 GLN 72 7.600 -19.281 -4.778 590 H ASN 73 HN ASN 73 7.763 -14.483 0.009 591 HA ASN 73 HA ASN 73 8.853 -14.746 2.657 592 HB2 ASN 73 HB2 ASN 73 6.659 -14.124 3.470 593 HB3 ASN 73 HB1 ASN 73 7.013 -13.103 2.074 594 HD21 ASN 73 HD21 ASN 73 5.721 -13.440 0.117 595 HD22 ASN 73 HD22 ASN 73 4.375 -14.454 0.136 596 H GLY 74 HN GLY 74 8.837 -16.490 3.949 597 HA2 GLY 74 HA2 GLY 74 7.716 -18.514 4.693 598 HA3 GLY 74 HA1 GLY 74 7.312 -18.856 3.025 599 H ASP 75 HN ASP 75 10.174 -17.592 2.553 600 HA ASP 75 HA ASP 75 11.535 -20.123 2.431 601 HB2 ASP 75 HB2 ASP 75 12.354 -17.301 1.724 602 HB3 ASP 75 HB1 ASP 75 13.544 -18.581 1.805 603 H SER 76 HN SER 76 13.307 -20.744 3.596 604 HA SER 76 HA SER 76 13.581 -19.389 6.214 605 HB2 SER 76 HB2 SER 76 13.881 -22.359 6.019 606 HB3 SER 76 HB1 SER 76 13.296 -21.361 7.335 607 HG SER 76 HG SER 76 11.491 -20.864 5.711 608 H ALA 77 HN ALA 77 15.639 -19.525 7.238 609 HA ALA 77 HA ALA 77 17.862 -20.560 5.576 610 HB1 ALA 77 HB1 ALA 77 19.108 -18.601 5.766 611 HB2 ALA 77 HB2 ALA 77 18.150 -17.981 7.108 612 HB3 ALA 77 HB3 ALA 77 17.484 -17.993 5.468 613 H TYR 78 HN TYR 78 19.942 -20.576 6.834 614 HA TYR 78 HA TYR 78 19.438 -21.678 9.535 615 HB2 TYR 78 HB2 TYR 78 20.628 -22.842 7.255 616 HB3 TYR 78 HB1 TYR 78 21.939 -22.515 8.372 617 HD1 TYR 78 HD1 TYR 78 21.288 -23.103 10.970 618 HD2 TYR 78 HD2 TYR 78 19.557 -24.869 7.447 619 HE1 TYR 78 HE1 TYR 78 20.623 -25.070 12.281 620 HE2 TYR 78 HE2 TYR 78 18.892 -26.824 8.744 621 HH TYR 78 HH TYR 78 19.742 -27.150 12.210 622 H LEU 79 HN LEU 79 20.401 -20.674 11.193 623 HA LEU 79 HA LEU 79 22.847 -19.132 10.694 624 HB2 LEU 79 HB2 LEU 79 20.881 -17.687 11.100 625 HB3 LEU 79 HB1 LEU 79 20.698 -18.410 12.705 626 HG LEU 79 HG LEU 79 23.344 -17.218 11.870 627 HD11 LEU 79 HD11 LEU 79 21.023 -15.671 13.041 628 HD12 LEU 79 HD12 LEU 79 21.605 -15.519 11.384 629 HD13 LEU 79 HD13 LEU 79 22.642 -15.044 12.739 630 HD21 LEU 79 HD21 LEU 79 22.553 -16.647 14.553 631 HD22 LEU 79 HD22 LEU 79 23.827 -17.741 14.017 632 HD23 LEU 79 HD23 LEU 79 22.194 -18.339 14.273 633 H TYR 80 HN TYR 80 24.509 -19.747 12.025 634 HA TYR 80 HA TYR 80 23.810 -21.612 14.203 635 HB2 TYR 80 HB2 TYR 80 25.539 -22.033 12.042 636 HB3 TYR 80 HB1 TYR 80 26.610 -21.755 13.407 637 HD1 TYR 80 HD2 TYR 80 26.128 -23.007 15.617 638 HD2 TYR 80 HD1 TYR 80 24.400 -24.117 11.829 639 HE1 TYR 80 HE2 TYR 80 25.597 -25.208 16.513 640 HE2 TYR 80 HE1 TYR 80 23.858 -26.335 12.732 641 HH TYR 80 HH TYR 80 23.415 -27.239 15.004 642 H LEU 81 HN LEU 81 24.333 -21.183 16.218 643 HA LEU 81 HA LEU 81 26.068 -18.842 16.701 644 HB2 LEU 81 HB2 LEU 81 23.880 -20.012 18.423 645 HB3 LEU 81 HB1 LEU 81 24.909 -18.671 18.905 646 HG LEU 81 HG LEU 81 23.136 -18.701 16.454 647 HD11 LEU 81 HD11 LEU 81 22.755 -17.306 19.142 648 HD12 LEU 81 HD12 LEU 81 21.815 -18.685 18.584 649 HD13 LEU 81 HD13 LEU 81 21.698 -17.134 17.748 650 HD21 LEU 81 HD21 LEU 81 23.558 -16.224 16.536 651 HD22 LEU 81 HD22 LEU 81 25.004 -17.151 16.185 652 HD23 LEU 81 HD23 LEU 81 24.717 -16.514 17.822 653 H LEU 82 HN LEU 82 27.714 -18.978 18.051 654 HA LEU 82 HA LEU 82 28.460 -21.677 19.016 655 HB2 LEU 82 HB2 LEU 82 30.252 -19.301 18.448 656 HB3 LEU 82 HB1 LEU 82 30.799 -20.868 19.034 657 HG LEU 82 HG LEU 82 29.349 -20.359 16.425 658 HD11 LEU 82 HD11 LEU 82 32.179 -20.278 17.121 659 HD12 LEU 82 HD12 LEU 82 31.367 -19.796 15.639 660 HD13 LEU 82 HD13 LEU 82 31.847 -21.462 15.858 661 HD21 LEU 82 HD21 LEU 82 28.777 -22.598 17.027 662 HD22 LEU 82 HD22 LEU 82 30.347 -22.886 17.770 663 HD23 LEU 82 HD23 LEU 82 30.203 -22.799 16.019 664 H SER 83 HN SER 83 29.848 -21.635 21.038 665 HA SER 83 HA SER 83 28.332 -20.461 23.091 666 HB2 SER 83 HB2 SER 83 31.145 -21.558 23.383 667 HB3 SER 83 HB1 SER 83 29.915 -21.382 24.621 668 HG SER 83 HG SER 83 30.307 -23.444 23.008 669 H ALA 84 HN ALA 84 30.325 -18.902 21.048 670 HA ALA 84 HA ALA 84 31.688 -17.068 22.754 671 HB1 ALA 84 HB1 ALA 84 32.480 -16.316 20.799 672 HB2 ALA 84 HB2 ALA 84 30.889 -15.785 20.322 673 HB3 ALA 84 HB3 ALA 84 31.422 -17.416 19.922 674 H ARG 85 HN ARG 85 31.042 -15.051 23.465 675 HA ARG 85 HA ARG 85 28.199 -14.377 23.121 676 HB2 ARG 85 HB2 ARG 85 29.650 -14.580 25.761 677 HB3 ARG 85 HB1 ARG 85 28.095 -13.787 25.561 678 HG2 ARG 85 HG2 ARG 85 27.122 -15.872 24.677 679 HG3 ARG 85 HG1 ARG 85 28.670 -16.700 24.896 680 HD2 ARG 85 HD2 ARG 85 28.522 -16.194 27.370 681 HD3 ARG 85 HD1 ARG 85 26.975 -15.443 27.063 682 HE ARG 85 HE ARG 85 25.993 -17.527 26.802 683 HH11 ARG 85 HH21 ARG 85 29.448 -17.760 26.910 684 HH12 ARG 85 HH22 ARG 85 29.502 -19.443 27.185 685 HH21 ARG 85 HH11 ARG 85 26.036 -19.840 27.186 686 HH22 ARG 85 HH12 ARG 85 27.549 -20.626 27.347 687 H ASN 86 HN ASN 86 27.835 -12.287 22.824 688 HA ASN 86 HA ASN 86 30.123 -10.429 23.090 689 HB2 ASN 86 HB2 ASN 86 28.884 -8.934 21.635 690 HB3 ASN 86 HB1 ASN 86 29.088 -10.500 20.857 691 HD21 ASN 86 HD21 ASN 86 26.965 -8.620 20.191 692 HD22 ASN 86 HD22 ASN 86 25.483 -9.363 20.568 693 H THR 87 HN THR 87 26.765 -10.905 23.744 694 HA THR 87 HA THR 87 26.533 -8.621 25.448 695 HB THR 87 HB THR 87 24.297 -9.801 25.988 696 HG1 THR 87 HG1 THR 87 25.225 -11.305 23.733 697 HG21 THR 87 HG21 THR 87 23.316 -8.763 24.142 698 HG22 THR 87 HG22 THR 87 24.657 -9.147 23.059 699 HG23 THR 87 HG23 THR 87 24.840 -7.909 24.288 700 H SER 88 HN SER 88 25.774 -8.934 27.744 701 HA SER 88 HA SER 88 26.372 -9.527 29.886 702 HB2 SER 88 HB2 SER 88 26.390 -12.159 28.478 703 HB3 SER 88 HB1 SER 88 27.312 -12.072 29.948 704 HG SER 88 HG SER 88 24.588 -11.356 29.575 705 H LEU 89 HN LEU 89 28.067 -7.961 28.879 706 HA LEU 89 HA LEU 89 30.708 -8.838 28.341 707 HB2 LEU 89 HB2 LEU 89 29.552 -6.228 29.370 708 HB3 LEU 89 HB1 LEU 89 31.285 -6.481 29.254 709 HG LEU 89 HG LEU 89 30.547 -5.398 27.214 710 HD11 LEU 89 HD11 LEU 89 31.785 -6.642 25.832 711 HD12 LEU 89 HD12 LEU 89 30.860 -8.112 26.098 712 HD13 LEU 89 HD13 LEU 89 32.100 -7.620 27.254 713 HD21 LEU 89 HD21 LEU 89 28.901 -6.406 25.729 714 HD22 LEU 89 HD22 LEU 89 28.159 -6.131 27.302 715 HD23 LEU 89 HD23 LEU 89 28.651 -7.755 26.825 716 H ASN 90 HN ASN 90 28.956 -8.026 31.212 717 HA ASN 90 HA ASN 90 31.147 -8.500 33.035 718 HB2 ASN 90 HB2 ASN 90 29.178 -8.355 34.709 719 HB3 ASN 90 HB1 ASN 90 29.657 -6.898 33.864 720 HD21 ASN 90 HD21 ASN 90 26.935 -8.629 34.688 721 HD22 ASN 90 HD22 ASN 90 25.895 -8.131 33.445 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 6.847 0.224 0.303 2 H2 MET 1 HT2 MET 1 5.949 -0.963 -0.501 3 H3 MET 1 HT3 MET 1 5.437 0.634 -0.543 4 HA MET 1 HA MET 1 6.904 1.237 -2.126 5 HB2 MET 1 HB2 MET 1 8.668 -1.167 -1.581 6 HB3 MET 1 HB1 MET 1 9.081 0.348 -2.382 7 HG2 MET 1 HG2 MET 1 8.906 -0.244 0.551 8 HG3 MET 1 HG1 MET 1 10.068 0.713 -0.341 9 HE1 MET 1 HE1 MET 1 9.556 1.735 2.066 10 HE2 MET 1 HE2 MET 1 8.676 3.250 2.131 11 HE3 MET 1 HE3 MET 1 10.046 3.098 1.042 12 HA PRO 2 HA PRO 2 5.027 -1.228 -5.293 13 HB2 PRO 2 HB2 PRO 2 7.670 -1.396 -6.674 14 HB3 PRO 2 HB1 PRO 2 6.092 -0.883 -7.294 15 HG2 PRO 2 HG2 PRO 2 7.896 0.939 -6.754 16 HG3 PRO 2 HG1 PRO 2 6.204 1.214 -6.296 17 HD2 PRO 2 HD2 PRO 2 8.514 0.488 -4.543 18 HD3 PRO 2 HD1 PRO 2 7.135 1.553 -4.211 19 H THR 3 HN THR 3 8.297 -2.364 -4.428 20 HA THR 3 HA THR 3 7.516 -5.143 -4.875 21 HB THR 3 HB THR 3 9.858 -5.692 -4.275 22 HG1 THR 3 HG1 THR 3 11.286 -3.918 -4.029 23 HG21 THR 3 HG21 THR 3 9.304 -5.185 -6.597 24 HG22 THR 3 HG22 THR 3 10.915 -4.613 -6.223 25 HG23 THR 3 HG23 THR 3 9.577 -3.469 -6.325 26 H GLN 4 HN GLN 4 6.905 -6.499 -3.321 27 HA GLN 4 HA GLN 4 6.333 -5.414 -0.707 28 HB2 GLN 4 HB2 GLN 4 5.910 -8.174 -1.858 29 HB3 GLN 4 HB1 GLN 4 5.367 -7.652 -0.279 30 HG2 GLN 4 HG2 GLN 4 3.966 -5.926 -1.242 31 HG3 GLN 4 HG1 GLN 4 4.539 -6.300 -2.867 32 HE21 GLN 4 HE21 GLN 4 1.754 -6.577 -1.590 33 HE22 GLN 4 HE22 GLN 4 1.319 -8.181 -1.914 34 H ASP 5 HN ASP 5 7.117 -6.195 1.247 35 HA ASP 5 HA ASP 5 9.765 -7.381 1.156 36 HB2 ASP 5 HB2 ASP 5 8.020 -6.464 3.457 37 HB3 ASP 5 HB1 ASP 5 9.590 -7.250 3.596 38 H ILE 6 HN ILE 6 10.138 -9.322 2.401 39 HA ILE 6 HA ILE 6 7.765 -11.073 2.482 40 HB ILE 6 HB ILE 6 9.129 -12.886 1.627 41 HG12 ILE 6 HG12 ILE 6 11.315 -10.817 1.199 42 HG13 ILE 6 HG11 ILE 6 11.345 -11.982 2.523 43 HG21 ILE 6 HG21 ILE 6 9.628 -11.821 -0.689 44 HG22 ILE 6 HG22 ILE 6 9.086 -10.312 0.038 45 HG23 ILE 6 HG23 ILE 6 7.971 -11.667 -0.092 46 HD11 ILE 6 HD11 ILE 6 11.053 -12.827 -0.358 47 HD12 ILE 6 HD12 ILE 6 11.467 -13.821 1.031 48 HD13 ILE 6 HD13 ILE 6 12.627 -12.631 0.415 49 H ARG 7 HN ARG 7 7.953 -12.839 3.937 50 HA ARG 7 HA ARG 7 9.497 -12.086 6.319 51 HB2 ARG 7 HB2 ARG 7 7.399 -14.266 6.041 52 HB3 ARG 7 HB1 ARG 7 8.131 -13.671 7.520 53 HG2 ARG 7 HG2 ARG 7 7.226 -11.379 7.005 54 HG3 ARG 7 HG1 ARG 7 6.332 -12.090 5.659 55 HD2 ARG 7 HD2 ARG 7 6.084 -12.883 8.572 56 HD3 ARG 7 HD1 ARG 7 4.908 -11.946 7.694 57 HE ARG 7 HE ARG 7 5.382 -14.809 7.505 58 HH11 ARG 7 HH21 ARG 7 3.943 -11.983 6.034 59 HH12 ARG 7 HH22 ARG 7 2.762 -12.870 5.175 60 HH21 ARG 7 HH11 ARG 7 3.789 -15.990 6.325 61 HH22 ARG 7 HH12 ARG 7 2.671 -15.150 5.345 62 H LEU 8 HN LEU 8 11.392 -12.971 6.594 63 HA LEU 8 HA LEU 8 11.993 -15.554 5.320 64 HB2 LEU 8 HB2 LEU 8 13.395 -13.592 4.677 65 HB3 LEU 8 HB1 LEU 8 13.903 -13.422 6.345 66 HG LEU 8 HG LEU 8 15.433 -14.721 4.654 67 HD11 LEU 8 HD11 LEU 8 16.483 -15.029 6.550 68 HD12 LEU 8 HD12 LEU 8 15.552 -16.499 6.807 69 HD13 LEU 8 HD13 LEU 8 14.993 -14.978 7.484 70 HD21 LEU 8 HD21 LEU 8 13.853 -17.111 5.576 71 HD22 LEU 8 HD22 LEU 8 14.968 -16.973 4.235 72 HD23 LEU 8 HD23 LEU 8 13.356 -16.292 4.091 73 H TRP 9 HN TRP 9 12.200 -17.265 6.627 74 HA TRP 9 HA TRP 9 12.272 -16.852 9.535 75 HB2 TRP 9 HB2 TRP 9 12.306 -19.515 8.128 76 HB3 TRP 9 HB1 TRP 9 11.821 -19.158 9.772 77 HD1 TRP 9 HD1 TRP 9 10.030 -16.563 8.744 78 HE1 TRP 9 HE1 TRP 9 7.688 -17.137 7.764 79 HE3 TRP 9 HE3 TRP 9 10.762 -21.436 7.601 80 HZ2 TRP 9 HZ2 TRP 9 6.348 -19.401 6.640 81 HZ3 TRP 9 HZ3 TRP 9 9.044 -22.774 6.591 82 HH2 TRP 9 HH2 TRP 9 6.763 -21.755 6.085 83 H VAL 10 HN VAL 10 14.046 -17.262 10.735 84 HA VAL 10 HA VAL 10 16.308 -18.548 9.347 85 HB VAL 10 HB VAL 10 16.739 -16.732 11.695 86 HG11 VAL 10 HG11 VAL 10 18.639 -18.041 11.085 87 HG12 VAL 10 HG12 VAL 10 18.914 -16.434 10.411 88 HG13 VAL 10 HG13 VAL 10 18.386 -17.736 9.365 89 HG21 VAL 10 HG21 VAL 10 17.159 -14.906 10.127 90 HG22 VAL 10 HG22 VAL 10 15.466 -15.390 10.019 91 HG23 VAL 10 HG23 VAL 10 16.623 -15.893 8.776 92 H SER 11 HN SER 11 16.718 -20.468 10.093 93 HA SER 11 HA SER 11 15.663 -21.342 12.660 94 HB2 SER 11 HB2 SER 11 17.458 -22.887 10.817 95 HB3 SER 11 HB1 SER 11 16.293 -23.520 11.963 96 HG SER 11 HG SER 11 14.658 -22.718 10.688 97 H VAL 12 HN VAL 12 16.824 -20.560 14.349 98 HA VAL 12 HA VAL 12 19.714 -20.289 14.017 99 HB VAL 12 HB VAL 12 18.121 -19.237 16.320 100 HG11 VAL 12 HG11 VAL 12 20.764 -19.174 15.920 101 HG12 VAL 12 HG12 VAL 12 19.895 -17.841 16.669 102 HG13 VAL 12 HG13 VAL 12 20.326 -17.751 14.969 103 HG21 VAL 12 HG21 VAL 12 16.827 -18.407 14.498 104 HG22 VAL 12 HG22 VAL 12 18.248 -18.141 13.493 105 HG23 VAL 12 HG23 VAL 12 17.937 -17.095 14.874 106 H GLU 13 HN GLU 13 21.056 -21.640 14.917 107 HA GLU 13 HA GLU 13 20.276 -23.010 17.394 108 HB2 GLU 13 HB2 GLU 13 21.872 -24.144 15.100 109 HB3 GLU 13 HB1 GLU 13 21.843 -24.853 16.713 110 HG2 GLU 13 HG2 GLU 13 19.363 -25.011 16.565 111 HG3 GLU 13 HG1 GLU 13 19.446 -24.412 14.916 112 H ASP 14 HN ASP 14 21.575 -22.579 19.058 113 HA ASP 14 HA ASP 14 24.141 -21.255 18.453 114 HB2 ASP 14 HB2 ASP 14 23.710 -19.782 20.051 115 HB3 ASP 14 HB1 ASP 14 22.099 -20.463 20.197 116 H ALA 15 HN ALA 15 25.833 -21.514 20.075 117 HA ALA 15 HA ALA 15 26.693 -24.220 20.129 118 HB1 ALA 15 HB1 ALA 15 27.730 -21.695 21.359 119 HB2 ALA 15 HB2 ALA 15 28.451 -22.677 20.075 120 HB3 ALA 15 HB3 ALA 15 28.474 -23.248 21.741 121 H GLN 16 HN GLN 16 25.149 -22.170 22.509 122 HA GLN 16 HA GLN 16 25.420 -24.122 24.622 123 HB2 GLN 16 HB2 GLN 16 23.640 -21.669 24.435 124 HB3 GLN 16 HB1 GLN 16 23.927 -22.635 25.890 125 HG2 GLN 16 HG2 GLN 16 26.058 -21.159 24.316 126 HG3 GLN 16 HG1 GLN 16 25.332 -20.589 25.812 127 HE21 GLN 16 HE21 GLN 16 28.079 -22.100 24.723 128 HE22 GLN 16 HE22 GLN 16 28.446 -23.003 26.108 129 H MET 17 HN MET 17 24.014 -24.467 21.867 130 HA MET 17 HA MET 17 22.582 -25.959 21.043 131 HB2 MET 17 HB2 MET 17 22.205 -26.777 23.943 132 HB3 MET 17 HB1 MET 17 21.504 -27.610 22.565 133 HG2 MET 17 HG2 MET 17 23.693 -28.051 21.606 134 HG3 MET 17 HG1 MET 17 24.476 -27.103 22.858 135 HE1 MET 17 HE1 MET 17 21.443 -29.858 23.281 136 HE2 MET 17 HE2 MET 17 22.545 -31.209 23.096 137 HE3 MET 17 HE3 MET 17 22.445 -30.004 21.823 138 H HIS 18 HN HIS 18 21.742 -23.222 21.924 139 HA HIS 18 HA HIS 18 18.908 -23.476 22.473 140 HB2 HIS 18 HB2 HIS 18 20.572 -21.128 21.523 141 HB3 HIS 18 HB1 HIS 18 18.862 -21.042 21.892 142 HD1 HIS 18 HD1 HIS 18 22.129 -21.853 23.507 143 HD2 HIS 18 HD2 HIS 18 18.270 -20.771 24.615 144 HE1 HIS 18 HE1 HIS 18 22.172 -21.370 26.072 145 HE2 HIS 18 HE2 HIS 18 19.798 -20.717 26.701 146 H THR 19 HN THR 19 17.395 -23.855 20.973 147 HA THR 19 HA THR 19 18.093 -23.436 18.128 148 HB THR 19 HB THR 19 16.143 -25.459 19.228 149 HG1 THR 19 HG1 THR 19 18.214 -25.983 19.868 150 HG21 THR 19 HG21 THR 19 17.443 -25.528 16.501 151 HG22 THR 19 HG22 THR 19 16.022 -24.530 16.787 152 HG23 THR 19 HG23 THR 19 15.940 -26.252 17.051 153 H VAL 20 HN VAL 20 17.006 -21.688 17.419 154 HA VAL 20 HA VAL 20 14.167 -21.451 18.127 155 HB VAL 20 HB VAL 20 14.418 -19.007 18.486 156 HG11 VAL 20 HG11 VAL 20 15.318 -19.195 20.747 157 HG12 VAL 20 HG12 VAL 20 16.107 -20.710 20.347 158 HG13 VAL 20 HG13 VAL 20 14.347 -20.618 20.390 159 HG21 VAL 20 HG21 VAL 20 17.371 -19.721 18.289 160 HG22 VAL 20 HG22 VAL 20 16.797 -18.268 19.089 161 HG23 VAL 20 HG23 VAL 20 16.490 -18.496 17.371 162 H THR 21 HN THR 21 12.982 -19.985 16.754 163 HA THR 21 HA THR 21 14.160 -19.723 14.067 164 HB THR 21 HB THR 21 11.232 -20.151 14.724 165 HG1 THR 21 HG1 THR 21 12.296 -22.038 15.174 166 HG21 THR 21 HG21 THR 21 12.747 -19.483 12.291 167 HG22 THR 21 HG22 THR 21 11.033 -19.346 12.614 168 HG23 THR 21 HG23 THR 21 11.698 -20.880 12.086 169 H ILE 22 HN ILE 22 14.080 -17.657 13.271 170 HA ILE 22 HA ILE 22 12.291 -15.762 14.652 171 HB ILE 22 HB ILE 22 13.962 -14.002 14.388 172 HG12 ILE 22 HG12 ILE 22 15.829 -16.203 13.437 173 HG13 ILE 22 HG11 ILE 22 15.076 -14.994 12.380 174 HG21 ILE 22 HG21 ILE 22 15.375 -14.628 16.167 175 HG22 ILE 22 HG22 ILE 22 15.370 -16.326 15.710 176 HG23 ILE 22 HG23 ILE 22 13.926 -15.597 16.423 177 HD11 ILE 22 HD11 ILE 22 16.581 -14.011 14.773 178 HD12 ILE 22 HD12 ILE 22 16.361 -13.269 13.193 179 HD13 ILE 22 HD13 ILE 22 17.502 -14.599 13.388 180 H TRP 23 HN TRP 23 11.485 -14.096 13.389 181 HA TRP 23 HA TRP 23 11.359 -14.782 10.519 182 HB2 TRP 23 HB2 TRP 23 9.335 -13.542 12.397 183 HB3 TRP 23 HB1 TRP 23 9.169 -13.479 10.650 184 HD1 TRP 23 HD1 TRP 23 8.239 -15.536 9.467 185 HE1 TRP 23 HE1 TRP 23 7.618 -17.923 10.159 186 HE3 TRP 23 HE3 TRP 23 10.043 -15.541 14.232 187 HZ2 TRP 23 HZ2 TRP 23 7.846 -19.628 12.462 188 HZ3 TRP 23 HZ3 TRP 23 9.823 -17.554 15.654 189 HH2 TRP 23 HH2 TRP 23 8.723 -19.600 14.770 190 H LEU 24 HN LEU 24 12.290 -13.408 9.193 191 HA LEU 24 HA LEU 24 12.749 -10.619 10.088 192 HB2 LEU 24 HB2 LEU 24 14.189 -12.190 7.944 193 HB3 LEU 24 HB1 LEU 24 14.617 -10.592 8.534 194 HG LEU 24 HG LEU 24 14.619 -13.128 10.219 195 HD11 LEU 24 HD11 LEU 24 16.962 -11.483 9.264 196 HD12 LEU 24 HD12 LEU 24 16.437 -12.988 8.491 197 HD13 LEU 24 HD13 LEU 24 16.994 -12.987 10.166 198 HD21 LEU 24 HD21 LEU 24 16.125 -11.320 11.547 199 HD22 LEU 24 HD22 LEU 24 14.413 -11.565 11.883 200 HD23 LEU 24 HD23 LEU 24 14.929 -10.223 10.858 201 H THR 25 HN THR 25 11.830 -9.003 8.880 202 HA THR 25 HA THR 25 10.467 -9.844 6.410 203 HB THR 25 HB THR 25 9.766 -7.290 7.813 204 HG1 THR 25 HG1 THR 25 9.796 -8.901 9.413 205 HG21 THR 25 HG21 THR 25 8.613 -7.631 5.750 206 HG22 THR 25 HG22 THR 25 7.464 -8.118 6.980 207 HG23 THR 25 HG23 THR 25 8.348 -9.338 6.079 208 H VAL 26 HN VAL 26 11.545 -9.309 4.679 209 HA VAL 26 HA VAL 26 12.524 -6.626 4.219 210 HB VAL 26 HB VAL 26 14.806 -7.479 3.552 211 HG11 VAL 26 HG11 VAL 26 14.278 -7.980 6.484 212 HG12 VAL 26 HG12 VAL 26 14.260 -6.359 5.795 213 HG13 VAL 26 HG13 VAL 26 15.728 -7.320 5.742 214 HG21 VAL 26 HG21 VAL 26 13.767 -9.964 4.968 215 HG22 VAL 26 HG22 VAL 26 15.481 -9.653 4.719 216 HG23 VAL 26 HG23 VAL 26 14.415 -9.842 3.332 217 H ARG 27 HN ARG 27 13.863 -7.056 1.887 218 HA ARG 27 HA ARG 27 11.981 -8.722 0.351 219 HB2 ARG 27 HB2 ARG 27 12.714 -7.362 -1.654 220 HB3 ARG 27 HB1 ARG 27 11.626 -6.567 -0.533 221 HG2 ARG 27 HG2 ARG 27 14.588 -6.262 -0.089 222 HG3 ARG 27 HG1 ARG 27 13.898 -5.409 -1.449 223 HD2 ARG 27 HD2 ARG 27 13.600 -4.911 1.440 224 HD3 ARG 27 HD1 ARG 27 13.525 -3.761 0.121 225 HE ARG 27 HE ARG 27 11.367 -4.918 1.535 226 HH11 ARG 27 HH21 ARG 27 12.289 -4.239 -1.758 227 HH12 ARG 27 HH22 ARG 27 10.719 -3.888 -2.328 228 HH21 ARG 27 HH11 ARG 27 9.242 -4.395 0.840 229 HH22 ARG 27 HH12 ARG 27 8.917 -3.980 -0.803 230 HA PRO 28 HA PRO 28 15.108 -11.551 -0.879 231 HB2 PRO 28 HB2 PRO 28 14.376 -10.937 -3.690 232 HB3 PRO 28 HB1 PRO 28 14.447 -12.506 -2.877 233 HG2 PRO 28 HG2 PRO 28 12.110 -11.430 -3.377 234 HG3 PRO 28 HG1 PRO 28 12.401 -12.182 -1.797 235 HD2 PRO 28 HD2 PRO 28 12.304 -9.284 -2.507 236 HD3 PRO 28 HD1 PRO 28 11.694 -10.118 -1.054 237 H ASP 29 HN ASP 29 14.908 -8.476 -2.427 238 HA ASP 29 HA ASP 29 17.332 -8.379 -3.852 239 HB2 ASP 29 HB2 ASP 29 15.433 -6.751 -4.069 240 HB3 ASP 29 HB1 ASP 29 15.958 -6.048 -2.542 241 H MET 30 HN MET 30 16.595 -7.896 -0.497 242 HA MET 30 HA MET 30 18.927 -6.464 0.244 243 HB2 MET 30 HB2 MET 30 16.673 -7.589 1.611 244 HB3 MET 30 HB1 MET 30 18.141 -8.136 2.411 245 HG2 MET 30 HG2 MET 30 18.075 -5.257 1.643 246 HG3 MET 30 HG1 MET 30 17.017 -5.752 2.965 247 HE1 MET 30 HE1 MET 30 17.511 -7.196 4.587 248 HE2 MET 30 HE2 MET 30 18.577 -6.445 5.763 249 HE3 MET 30 HE3 MET 30 19.082 -7.929 4.957 250 H THR 31 HN THR 31 20.599 -7.183 1.599 251 HA THR 31 HA THR 31 21.828 -9.555 0.424 252 HB THR 31 HB THR 31 22.838 -6.929 1.412 253 HG1 THR 31 HG1 THR 31 23.907 -8.366 -0.710 254 HG21 THR 31 HG21 THR 31 24.446 -9.476 1.293 255 HG22 THR 31 HG22 THR 31 24.191 -8.379 2.660 256 HG23 THR 31 HG23 THR 31 25.143 -7.842 1.280 257 H VAL 32 HN VAL 32 22.860 -11.098 1.649 258 HA VAL 32 HA VAL 32 21.739 -11.750 4.152 259 HB VAL 32 HB VAL 32 24.311 -12.674 2.836 260 HG11 VAL 32 HG11 VAL 32 23.954 -14.672 4.412 261 HG12 VAL 32 HG12 VAL 32 22.913 -13.610 5.349 262 HG13 VAL 32 HG13 VAL 32 24.612 -13.201 5.118 263 HG21 VAL 32 HG21 VAL 32 22.147 -13.163 1.631 264 HG22 VAL 32 HG22 VAL 32 21.598 -14.032 3.069 265 HG23 VAL 32 HG23 VAL 32 22.995 -14.607 2.170 266 H ALA 33 HN ALA 33 24.877 -10.305 3.323 267 HA ALA 33 HA ALA 33 25.869 -10.102 5.877 268 HB1 ALA 33 HB1 ALA 33 27.274 -9.570 3.975 269 HB2 ALA 33 HB2 ALA 33 27.253 -8.188 5.060 270 HB3 ALA 33 HB3 ALA 33 26.297 -8.156 3.584 271 H SER 34 HN SER 34 23.801 -7.828 4.134 272 HA SER 34 HA SER 34 23.511 -5.927 6.222 273 HB2 SER 34 HB2 SER 34 21.583 -6.641 4.004 274 HB3 SER 34 HB1 SER 34 21.552 -5.175 4.959 275 HG SER 34 HG SER 34 22.654 -5.109 2.828 276 H LEU 35 HN LEU 35 21.704 -8.826 5.255 277 HA LEU 35 HA LEU 35 19.624 -8.567 7.127 278 HB2 LEU 35 HB2 LEU 35 19.484 -10.023 5.181 279 HB3 LEU 35 HB1 LEU 35 20.747 -11.062 5.852 280 HG LEU 35 HG LEU 35 19.339 -11.560 7.793 281 HD11 LEU 35 HD11 LEU 35 17.605 -9.471 6.533 282 HD12 LEU 35 HD12 LEU 35 17.892 -9.832 8.235 283 HD13 LEU 35 HD13 LEU 35 16.794 -10.838 7.295 284 HD21 LEU 35 HD21 LEU 35 17.667 -12.002 5.300 285 HD22 LEU 35 HD22 LEU 35 17.806 -13.025 6.725 286 HD23 LEU 35 HD23 LEU 35 19.163 -12.896 5.617 287 H LYS 36 HN LYS 36 22.655 -10.423 7.266 288 HA LYS 36 HA LYS 36 22.168 -11.437 9.871 289 HB2 LYS 36 HB2 LYS 36 24.438 -12.221 9.864 290 HB3 LYS 36 HB1 LYS 36 23.862 -12.333 8.200 291 HG2 LYS 36 HG2 LYS 36 24.954 -10.207 7.685 292 HG3 LYS 36 HG1 LYS 36 25.611 -10.104 9.325 293 HD2 LYS 36 HD2 LYS 36 26.758 -12.302 8.941 294 HD3 LYS 36 HD1 LYS 36 26.161 -12.282 7.280 295 HE2 LYS 36 HE2 LYS 36 27.412 -10.110 6.904 296 HE3 LYS 36 HE1 LYS 36 28.033 -10.248 8.541 297 HZ1 LYS 36 HZ1 LYS 36 29.202 -11.252 6.337 298 HZ2 LYS 36 HZ2 LYS 36 28.423 -12.624 6.958 299 HZ3 LYS 36 HZ3 LYS 36 29.519 -11.768 7.916 300 H ASP 37 HN ASP 37 23.622 -8.547 8.637 301 HA ASP 37 HA ASP 37 24.656 -7.454 11.028 302 HB2 ASP 37 HB2 ASP 37 25.260 -6.486 8.916 303 HB3 ASP 37 HB1 ASP 37 23.586 -6.132 8.529 304 H MET 38 HN MET 38 21.472 -6.965 9.440 305 HA MET 38 HA MET 38 20.521 -5.367 11.564 306 HB2 MET 38 HB2 MET 38 18.464 -5.315 10.551 307 HB3 MET 38 HB1 MET 38 19.562 -5.457 9.176 308 HG2 MET 38 HG2 MET 38 19.139 -7.811 9.046 309 HG3 MET 38 HG1 MET 38 18.152 -7.765 10.514 310 HE1 MET 38 HE1 MET 38 15.061 -7.826 9.596 311 HE2 MET 38 HE2 MET 38 16.458 -8.878 9.738 312 HE3 MET 38 HE3 MET 38 15.644 -8.716 8.185 313 H VAL 39 HN VAL 39 20.438 -8.800 10.967 314 HA VAL 39 HA VAL 39 18.681 -9.499 13.059 315 HB VAL 39 HB VAL 39 21.033 -11.011 11.864 316 HG11 VAL 39 HG11 VAL 39 20.444 -12.913 13.050 317 HG12 VAL 39 HG12 VAL 39 18.814 -12.357 13.380 318 HG13 VAL 39 HG13 VAL 39 20.163 -11.697 14.290 319 HG21 VAL 39 HG21 VAL 39 18.506 -12.183 11.293 320 HG22 VAL 39 HG22 VAL 39 19.590 -11.390 10.161 321 HG23 VAL 39 HG23 VAL 39 18.336 -10.462 10.966 322 H PHE 40 HN PHE 40 22.126 -8.849 12.921 323 HA PHE 40 HA PHE 40 22.699 -9.352 15.648 324 HB2 PHE 40 HB2 PHE 40 24.601 -9.054 14.212 325 HB3 PHE 40 HB1 PHE 40 23.987 -7.512 13.642 326 HD1 PHE 40 HD2 PHE 40 24.604 -9.052 17.031 327 HD2 PHE 40 HD1 PHE 40 25.123 -5.660 14.437 328 HE1 PHE 40 HE2 PHE 40 25.768 -7.853 18.837 329 HE2 PHE 40 HE1 PHE 40 26.281 -4.455 16.254 330 HZ PHE 40 HZ PHE 40 26.612 -5.548 18.459 331 H LEU 41 HN LEU 41 21.666 -6.422 13.931 332 HA LEU 41 HA LEU 41 21.641 -4.676 16.168 333 HB2 LEU 41 HB2 LEU 41 19.651 -4.607 13.887 334 HB3 LEU 41 HB1 LEU 41 20.175 -3.273 14.895 335 HG LEU 41 HG LEU 41 21.906 -4.811 12.966 336 HD11 LEU 41 HD11 LEU 41 21.823 -2.955 11.531 337 HD12 LEU 41 HD12 LEU 41 21.115 -1.915 12.767 338 HD13 LEU 41 HD13 LEU 41 20.153 -3.185 12.033 339 HD21 LEU 41 HD21 LEU 41 23.409 -4.136 14.525 340 HD22 LEU 41 HD22 LEU 41 22.477 -2.692 15.001 341 HD23 LEU 41 HD23 LEU 41 23.389 -2.719 13.480 342 H ASP 42 HN ASP 42 19.246 -6.702 14.689 343 HA ASP 42 HA ASP 42 17.163 -5.941 16.485 344 HB2 ASP 42 HB2 ASP 42 16.841 -6.745 14.088 345 HB3 ASP 42 HB1 ASP 42 17.039 -8.371 14.726 346 H TYR 43 HN TYR 43 19.073 -8.915 16.253 347 HA TYR 43 HA TYR 43 17.725 -9.852 18.714 348 HB2 TYR 43 HB2 TYR 43 19.218 -11.432 16.613 349 HB3 TYR 43 HB1 TYR 43 18.416 -12.093 18.033 350 HD1 TYR 43 HD2 TYR 43 15.945 -11.911 18.310 351 HD2 TYR 43 HD1 TYR 43 17.936 -10.687 14.709 352 HE1 TYR 43 HE2 TYR 43 13.788 -11.885 17.129 353 HE2 TYR 43 HE1 TYR 43 15.779 -10.665 13.526 354 HH TYR 43 HH TYR 43 13.243 -10.297 14.536 355 H GLY 44 HN GLY 44 20.564 -8.335 17.982 356 HA2 GLY 44 HA2 GLY 44 22.515 -8.107 19.173 357 HA3 GLY 44 HA1 GLY 44 21.777 -9.049 20.463 358 H PHE 45 HN PHE 45 22.091 -10.118 17.177 359 HA PHE 45 HA PHE 45 23.623 -12.484 18.034 360 HB2 PHE 45 HB2 PHE 45 22.149 -11.770 15.489 361 HB3 PHE 45 HB1 PHE 45 23.202 -13.166 15.615 362 HD1 PHE 45 HD1 PHE 45 21.575 -12.426 18.776 363 HD2 PHE 45 HD2 PHE 45 21.005 -14.375 14.968 364 HE1 PHE 45 HE1 PHE 45 19.733 -13.743 19.713 365 HE2 PHE 45 HE2 PHE 45 19.156 -15.694 15.942 366 HZ PHE 45 HZ PHE 45 18.520 -15.378 18.316 367 HA PRO 46 HA PRO 46 27.056 -9.632 16.689 368 HB2 PRO 46 HB2 PRO 46 28.904 -11.671 17.448 369 HB3 PRO 46 HB1 PRO 46 28.536 -10.173 18.299 370 HG2 PRO 46 HG2 PRO 46 27.511 -12.892 18.812 371 HG3 PRO 46 HG1 PRO 46 27.686 -11.517 19.908 372 HD2 PRO 46 HD2 PRO 46 25.282 -12.304 19.085 373 HD3 PRO 46 HD1 PRO 46 25.663 -10.584 19.334 374 HA PRO 47 HA PRO 47 27.155 -11.573 12.640 375 HB2 PRO 47 HB2 PRO 47 29.284 -10.186 11.600 376 HB3 PRO 47 HB1 PRO 47 27.626 -9.550 11.687 377 HG2 PRO 47 HG2 PRO 47 29.942 -9.033 13.499 378 HG3 PRO 47 HG1 PRO 47 28.699 -7.922 12.904 379 HD2 PRO 47 HD2 PRO 47 28.549 -8.864 15.394 380 HD3 PRO 47 HD1 PRO 47 27.077 -8.646 14.423 381 H VAL 48 HN VAL 48 30.023 -11.341 14.618 382 HA VAL 48 HA VAL 48 31.635 -13.200 13.196 383 HB VAL 48 HB VAL 48 32.755 -11.809 14.782 384 HG11 VAL 48 HG11 VAL 48 31.660 -12.776 17.298 385 HG12 VAL 48 HG12 VAL 48 30.390 -12.073 16.301 386 HG13 VAL 48 HG13 VAL 48 31.812 -11.132 16.701 387 HG21 VAL 48 HG21 VAL 48 33.511 -14.230 14.688 388 HG22 VAL 48 HG22 VAL 48 32.539 -14.527 16.133 389 HG23 VAL 48 HG23 VAL 48 33.892 -13.412 16.200 390 H LEU 49 HN LEU 49 29.308 -13.511 15.811 391 HA LEU 49 HA LEU 49 29.640 -16.335 16.118 392 HB2 LEU 49 HB2 LEU 49 27.654 -14.338 17.160 393 HB3 LEU 49 HB1 LEU 49 27.345 -16.058 17.301 394 HG LEU 49 HG LEU 49 29.793 -16.199 18.257 395 HD11 LEU 49 HD11 LEU 49 29.560 -13.627 19.530 396 HD12 LEU 49 HD12 LEU 49 29.623 -13.433 17.786 397 HD13 LEU 49 HD13 LEU 49 30.897 -14.310 18.616 398 HD21 LEU 49 HD21 LEU 49 27.391 -16.310 19.448 399 HD22 LEU 49 HD22 LEU 49 27.937 -14.776 20.119 400 HD23 LEU 49 HD23 LEU 49 28.878 -16.237 20.389 401 H GLN 50 HN GLN 50 27.480 -14.261 14.299 402 HA GLN 50 HA GLN 50 25.581 -16.221 13.643 403 HB2 GLN 50 HB2 GLN 50 26.366 -13.727 12.142 404 HB3 GLN 50 HB1 GLN 50 25.053 -14.770 11.651 405 HG2 GLN 50 HG2 GLN 50 24.006 -14.439 13.909 406 HG3 GLN 50 HG1 GLN 50 25.265 -13.249 14.262 407 HE21 GLN 50 HE21 GLN 50 24.315 -11.205 14.004 408 HE22 GLN 50 HE22 GLN 50 23.362 -10.754 12.666 409 H GLN 51 HN GLN 51 26.045 -18.105 12.727 410 HA GLN 51 HA GLN 51 27.504 -17.982 10.181 411 HB2 GLN 51 HB2 GLN 51 27.157 -20.326 12.059 412 HB3 GLN 51 HB1 GLN 51 27.634 -20.493 10.381 413 HG2 GLN 51 HG2 GLN 51 29.571 -18.977 10.808 414 HG3 GLN 51 HG1 GLN 51 29.123 -18.945 12.516 415 HE21 GLN 51 HE21 GLN 51 30.800 -20.212 13.452 416 HE22 GLN 51 HE22 GLN 51 31.135 -21.804 12.967 417 H TRP 52 HN TRP 52 25.995 -17.543 8.776 418 HA TRP 52 HA TRP 52 23.335 -18.687 8.917 419 HB2 TRP 52 HB2 TRP 52 24.779 -16.899 6.931 420 HB3 TRP 52 HB1 TRP 52 23.181 -17.550 6.612 421 HD1 TRP 52 HD1 TRP 52 24.961 -15.446 9.353 422 HE1 TRP 52 HE1 TRP 52 23.216 -13.804 10.364 423 HE3 TRP 52 HE3 TRP 52 20.789 -16.897 6.792 424 HZ2 TRP 52 HZ2 TRP 52 20.426 -13.196 10.087 425 HZ3 TRP 52 HZ3 TRP 52 18.611 -15.752 7.183 426 HH2 TRP 52 HH2 TRP 52 18.449 -13.917 8.822 427 H VAL 53 HN VAL 53 23.130 -20.790 8.366 428 HA VAL 53 HA VAL 53 25.186 -21.934 6.619 429 HB VAL 53 HB VAL 53 22.989 -23.530 7.928 430 HG11 VAL 53 HG11 VAL 53 25.859 -24.331 7.663 431 HG12 VAL 53 HG12 VAL 53 24.817 -24.396 6.247 432 HG13 VAL 53 HG13 VAL 53 24.414 -25.329 7.683 433 HG21 VAL 53 HG21 VAL 53 25.520 -22.447 9.224 434 HG22 VAL 53 HG22 VAL 53 24.575 -23.772 9.891 435 HG23 VAL 53 HG23 VAL 53 23.865 -22.166 9.761 436 H ILE 54 HN ILE 54 24.855 -22.156 4.570 437 HA ILE 54 HA ILE 54 22.209 -22.759 3.497 438 HB ILE 54 HB ILE 54 24.017 -20.520 2.497 439 HG12 ILE 54 HG12 ILE 54 21.250 -20.332 3.756 440 HG13 ILE 54 HG11 ILE 54 22.750 -19.986 4.618 441 HG21 ILE 54 HG21 ILE 54 22.157 -22.042 1.043 442 HG22 ILE 54 HG22 ILE 54 22.713 -20.408 0.638 443 HG23 ILE 54 HG23 ILE 54 21.254 -20.626 1.582 444 HD11 ILE 54 HD11 ILE 54 21.803 -18.562 2.120 445 HD12 ILE 54 HD12 ILE 54 23.297 -18.221 2.989 446 HD13 ILE 54 HD13 ILE 54 21.740 -17.915 3.758 447 H GLY 55 HN GLY 55 22.450 -24.372 1.945 448 HA2 GLY 55 HA2 GLY 55 24.842 -25.733 1.604 449 HA3 GLY 55 HA1 GLY 55 23.499 -25.809 0.459 450 H GLN 56 HN GLN 56 23.523 -23.017 -0.138 451 HA GLN 56 HA GLN 56 25.550 -22.941 -2.192 452 HB2 GLN 56 HB2 GLN 56 23.462 -20.923 -1.341 453 HB3 GLN 56 HB1 GLN 56 24.474 -20.826 -2.775 454 HG2 GLN 56 HG2 GLN 56 23.507 -22.820 -3.723 455 HG3 GLN 56 HG1 GLN 56 22.627 -23.171 -2.236 456 HE21 GLN 56 HE21 GLN 56 22.846 -19.846 -3.197 457 HE22 GLN 56 HE22 GLN 56 21.246 -19.683 -3.735 458 H ARG 57 HN ARG 57 26.068 -22.647 0.891 459 HA ARG 57 HA ARG 57 26.752 -20.206 1.749 460 HB2 ARG 57 HB2 ARG 57 28.819 -21.407 2.862 461 HB3 ARG 57 HB1 ARG 57 27.178 -21.796 3.330 462 HG2 ARG 57 HG2 ARG 57 27.371 -23.927 2.616 463 HG3 ARG 57 HG1 ARG 57 27.942 -23.439 1.031 464 HD2 ARG 57 HD2 ARG 57 29.649 -23.647 3.524 465 HD3 ARG 57 HD1 ARG 57 29.589 -24.797 2.189 466 HE ARG 57 HE ARG 57 30.155 -22.128 1.283 467 HH11 ARG 57 HH21 ARG 57 31.504 -24.985 2.716 468 HH12 ARG 57 HH22 ARG 57 33.103 -24.732 2.169 469 HH21 ARG 57 HH11 ARG 57 32.283 -21.743 0.513 470 HH22 ARG 57 HH12 ARG 57 33.554 -22.824 0.871 471 H LEU 58 HN LEU 58 27.367 -18.922 -0.086 472 HA LEU 58 HA LEU 58 29.992 -19.245 -1.257 473 HB2 LEU 58 HB2 LEU 58 28.093 -16.881 -1.314 474 HB3 LEU 58 HB1 LEU 58 29.586 -16.998 -2.232 475 HG LEU 58 HG LEU 58 27.220 -18.892 -2.506 476 HD11 LEU 58 HD11 LEU 58 26.843 -16.583 -3.403 477 HD12 LEU 58 HD12 LEU 58 26.840 -17.845 -4.638 478 HD13 LEU 58 HD13 LEU 58 28.245 -16.817 -4.447 479 HD21 LEU 58 HD21 LEU 58 28.600 -19.501 -4.627 480 HD22 LEU 58 HD22 LEU 58 29.123 -20.164 -3.092 481 HD23 LEU 58 HD23 LEU 58 29.965 -18.769 -3.784 482 H ALA 59 HN ALA 59 31.772 -17.880 -0.825 483 HA ALA 59 HA ALA 59 32.062 -17.064 1.920 484 HB1 ALA 59 HB1 ALA 59 33.894 -17.803 0.082 485 HB2 ALA 59 HB2 ALA 59 34.284 -16.788 1.464 486 HB3 ALA 59 HB3 ALA 59 33.993 -16.053 -0.105 487 H ARG 60 HN ARG 60 30.359 -15.744 -0.491 488 HA ARG 60 HA ARG 60 31.001 -12.939 0.119 489 HB2 ARG 60 HB2 ARG 60 30.989 -13.486 -2.249 490 HB3 ARG 60 HB1 ARG 60 29.406 -14.243 -2.103 491 HG2 ARG 60 HG2 ARG 60 28.391 -12.071 -1.551 492 HG3 ARG 60 HG1 ARG 60 29.975 -11.285 -1.637 493 HD2 ARG 60 HD2 ARG 60 28.664 -12.782 -3.927 494 HD3 ARG 60 HD1 ARG 60 28.611 -11.043 -3.737 495 HE ARG 60 HE ARG 60 31.276 -11.526 -3.642 496 HH11 ARG 60 HH21 ARG 60 28.755 -12.556 -5.860 497 HH12 ARG 60 HH22 ARG 60 29.807 -12.674 -7.195 498 HH21 ARG 60 HH11 ARG 60 32.664 -11.658 -5.471 499 HH22 ARG 60 HH12 ARG 60 32.032 -12.182 -6.977 500 H ASP 61 HN ASP 61 29.950 -12.539 2.034 501 HA ASP 61 HA ASP 61 27.244 -13.372 2.546 502 HB2 ASP 61 HB2 ASP 61 27.405 -11.885 4.516 503 HB3 ASP 61 HB1 ASP 61 28.712 -13.050 4.447 504 H GLN 62 HN GLN 62 28.690 -11.006 0.749 505 HA GLN 62 HA GLN 62 26.906 -8.838 1.069 506 HB2 GLN 62 HB2 GLN 62 28.578 -9.474 -1.383 507 HB3 GLN 62 HB1 GLN 62 27.931 -7.916 -0.898 508 HG2 GLN 62 HG2 GLN 62 29.975 -9.499 0.703 509 HG3 GLN 62 HG1 GLN 62 30.300 -8.098 -0.294 510 HE21 GLN 62 HE21 GLN 62 29.633 -9.004 2.857 511 HE22 GLN 62 HE22 GLN 62 29.108 -7.509 3.462 512 H GLU 63 HN GLU 63 26.670 -11.828 -0.605 513 HA GLU 63 HA GLU 63 25.138 -11.138 -2.760 514 HB2 GLU 63 HB2 GLU 63 25.956 -13.594 -1.628 515 HB3 GLU 63 HB1 GLU 63 24.213 -13.697 -1.831 516 HG2 GLU 63 HG2 GLU 63 26.226 -12.975 -3.977 517 HG3 GLU 63 HG1 GLU 63 25.286 -14.448 -3.880 518 H THR 64 HN THR 64 22.936 -11.558 -3.238 519 HA THR 64 HA THR 64 21.145 -10.121 -1.650 520 HB THR 64 HB THR 64 19.992 -11.952 -3.628 521 HG1 THR 64 HG1 THR 64 21.984 -11.860 -4.576 522 HG21 THR 64 HG21 THR 64 19.165 -9.721 -2.636 523 HG22 THR 64 HG22 THR 64 18.918 -10.013 -4.349 524 HG23 THR 64 HG23 THR 64 20.226 -8.951 -3.809 525 H LEU 65 HN LEU 65 19.219 -10.946 -0.612 526 HA LEU 65 HA LEU 65 19.489 -13.357 0.902 527 HB2 LEU 65 HB2 LEU 65 17.028 -11.714 0.248 528 HB3 LEU 65 HB1 LEU 65 17.073 -13.022 1.428 529 HG LEU 65 HG LEU 65 18.763 -10.513 1.523 530 HD11 LEU 65 HD11 LEU 65 17.390 -9.936 3.486 531 HD12 LEU 65 HD12 LEU 65 16.382 -11.349 3.178 532 HD13 LEU 65 HD13 LEU 65 16.441 -10.032 2.003 533 HD21 LEU 65 HD21 LEU 65 19.211 -11.386 3.871 534 HD22 LEU 65 HD22 LEU 65 20.005 -12.248 2.574 535 HD23 LEU 65 HD23 LEU 65 18.562 -12.937 3.339 536 H HIS 66 HN HIS 66 17.875 -12.477 -2.047 537 HA HIS 66 HA HIS 66 16.444 -14.782 -2.605 538 HB2 HIS 66 HB2 HIS 66 16.361 -12.707 -3.975 539 HB3 HIS 66 HB1 HIS 66 17.957 -13.086 -4.611 540 HD1 HIS 66 HD1 HIS 66 17.551 -13.834 -6.955 541 HD2 HIS 66 HD2 HIS 66 14.850 -15.582 -4.290 542 HE1 HIS 66 HE1 HIS 66 16.203 -15.550 -8.286 543 HE2 HIS 66 HE2 HIS 66 14.560 -16.608 -6.672 544 H SER 67 HN SER 67 19.857 -14.433 -2.332 545 HA SER 67 HA SER 67 20.851 -16.271 -4.160 546 HB2 SER 67 HB2 SER 67 22.675 -16.619 -2.465 547 HB3 SER 67 HB1 SER 67 22.353 -14.938 -2.852 548 HG SER 67 HG SER 67 21.523 -14.641 -0.942 549 H HIS 68 HN HIS 68 19.577 -16.842 -0.910 550 HA HIS 68 HA HIS 68 19.874 -19.716 -1.087 551 HB2 HIS 68 HB2 HIS 68 19.794 -18.489 1.119 552 HB3 HIS 68 HB1 HIS 68 18.077 -18.209 0.830 553 HD1 HIS 68 HD1 HIS 68 17.125 -19.818 2.687 554 HD2 HIS 68 HD2 HIS 68 19.775 -21.677 0.030 555 HE1 HIS 68 HE1 HIS 68 16.984 -22.268 3.138 556 HE2 HIS 68 HE2 HIS 68 18.586 -23.434 1.541 557 H GLY 69 HN GLY 69 17.989 -17.695 -2.756 558 HA2 GLY 69 HA2 GLY 69 16.282 -18.247 -4.214 559 HA3 GLY 69 HA1 GLY 69 15.975 -19.728 -3.314 560 H VAL 70 HN VAL 70 16.438 -17.128 -1.224 561 HA VAL 70 HA VAL 70 13.790 -17.154 -0.262 562 HB VAL 70 HB VAL 70 15.798 -14.915 0.103 563 HG11 VAL 70 HG11 VAL 70 13.789 -16.008 2.070 564 HG12 VAL 70 HG12 VAL 70 13.386 -14.720 0.942 565 HG13 VAL 70 HG13 VAL 70 14.653 -14.476 2.142 566 HG21 VAL 70 HG21 VAL 70 17.185 -16.418 1.074 567 HG22 VAL 70 HG22 VAL 70 16.014 -17.729 0.887 568 HG23 VAL 70 HG23 VAL 70 15.955 -16.689 2.297 569 H ARG 71 HN ARG 71 12.563 -16.867 -2.086 570 HA ARG 71 HA ARG 71 12.792 -14.413 -3.660 571 HB2 ARG 71 HB2 ARG 71 12.730 -16.635 -4.751 572 HB3 ARG 71 HB1 ARG 71 11.135 -16.901 -4.075 573 HG2 ARG 71 HG2 ARG 71 10.242 -14.993 -5.340 574 HG3 ARG 71 HG1 ARG 71 11.870 -14.658 -5.963 575 HD2 ARG 71 HD2 ARG 71 11.940 -16.948 -6.954 576 HD3 ARG 71 HD1 ARG 71 10.285 -17.198 -6.423 577 HE ARG 71 HE ARG 71 10.325 -14.880 -8.011 578 HH11 ARG 71 HH21 ARG 71 11.013 -18.285 -8.242 579 HH12 ARG 71 HH22 ARG 71 10.555 -18.428 -9.881 580 HH21 ARG 71 HH11 ARG 71 9.685 -15.060 -10.235 581 HH22 ARG 71 HH12 ARG 71 9.783 -16.570 -11.028 582 H GLN 72 HN GLN 72 10.663 -16.083 -1.452 583 HA GLN 72 HA GLN 72 8.912 -13.741 -1.307 584 HB2 GLN 72 HB2 GLN 72 6.880 -15.060 -1.624 585 HB3 GLN 72 HB1 GLN 72 7.977 -15.313 -2.990 586 HG2 GLN 72 HG2 GLN 72 8.277 -17.223 -0.738 587 HG3 GLN 72 HG1 GLN 72 6.811 -17.360 -1.694 588 HE21 GLN 72 HE21 GLN 72 10.267 -17.898 -1.720 589 HE22 GLN 72 HE22 GLN 72 10.309 -18.474 -3.312 590 H ASN 73 HN ASN 73 7.218 -14.205 0.490 591 HA ASN 73 HA ASN 73 8.650 -14.790 2.891 592 HB2 ASN 73 HB2 ASN 73 6.757 -14.166 4.047 593 HB3 ASN 73 HB1 ASN 73 6.387 -13.377 2.510 594 HD21 ASN 73 HD21 ASN 73 4.679 -14.333 1.225 595 HD22 ASN 73 HD22 ASN 73 3.666 -15.547 1.851 596 H GLY 74 HN GLY 74 8.093 -16.532 4.427 597 HA2 GLY 74 HA2 GLY 74 7.439 -18.713 4.891 598 HA3 GLY 74 HA1 GLY 74 7.046 -18.976 3.198 599 H ASP 75 HN ASP 75 9.725 -17.488 2.687 600 HA ASP 75 HA ASP 75 11.266 -19.859 2.392 601 HB2 ASP 75 HB2 ASP 75 11.794 -16.947 1.824 602 HB3 ASP 75 HB1 ASP 75 13.086 -18.124 1.704 603 H SER 76 HN SER 76 13.143 -20.414 3.409 604 HA SER 76 HA SER 76 13.421 -19.257 6.118 605 HB2 SER 76 HB2 SER 76 13.896 -22.165 5.623 606 HB3 SER 76 HB1 SER 76 13.321 -21.341 7.056 607 HG SER 76 HG SER 76 11.433 -20.798 5.478 608 H ALA 77 HN ALA 77 15.475 -19.452 7.130 609 HA ALA 77 HA ALA 77 17.725 -20.426 5.531 610 HB1 ALA 77 HB1 ALA 77 17.303 -17.671 5.752 611 HB2 ALA 77 HB2 ALA 77 18.810 -18.473 5.318 612 HB3 ALA 77 HB3 ALA 77 18.512 -18.021 6.994 613 H TYR 78 HN TYR 78 19.749 -20.603 6.939 614 HA TYR 78 HA TYR 78 18.868 -21.598 9.588 615 HB2 TYR 78 HB2 TYR 78 19.720 -23.098 7.535 616 HB3 TYR 78 HB1 TYR 78 21.270 -22.694 8.246 617 HD1 TYR 78 HD2 TYR 78 17.968 -24.226 8.901 618 HD2 TYR 78 HD1 TYR 78 21.968 -23.644 10.373 619 HE1 TYR 78 HE2 TYR 78 17.573 -25.923 10.616 620 HE2 TYR 78 HE1 TYR 78 21.576 -25.355 12.099 621 HH TYR 78 HH TYR 78 19.974 -26.582 13.139 622 H LEU 79 HN LEU 79 19.855 -20.802 11.342 623 HA LEU 79 HA LEU 79 22.457 -19.470 11.020 624 HB2 LEU 79 HB2 LEU 79 20.128 -18.732 12.691 625 HB3 LEU 79 HB1 LEU 79 21.722 -18.495 13.396 626 HG LEU 79 HG LEU 79 20.922 -17.451 10.655 627 HD11 LEU 79 HD11 LEU 79 21.208 -15.933 13.269 628 HD12 LEU 79 HD12 LEU 79 19.653 -16.366 12.558 629 HD13 LEU 79 HD13 LEU 79 20.743 -15.271 11.707 630 HD21 LEU 79 HD21 LEU 79 23.425 -17.554 12.260 631 HD22 LEU 79 HD22 LEU 79 23.043 -15.974 11.590 632 HD23 LEU 79 HD23 LEU 79 23.189 -17.366 10.528 633 H TYR 80 HN TYR 80 24.092 -20.220 11.968 634 HA TYR 80 HA TYR 80 23.813 -22.119 14.214 635 HB2 TYR 80 HB2 TYR 80 24.719 -23.208 12.231 636 HB3 TYR 80 HB1 TYR 80 25.895 -21.925 12.012 637 HD1 TYR 80 HD1 TYR 80 24.860 -24.733 14.241 638 HD2 TYR 80 HD2 TYR 80 27.928 -21.904 13.233 639 HE1 TYR 80 HE1 TYR 80 26.449 -25.966 15.661 640 HE2 TYR 80 HE2 TYR 80 29.537 -23.142 14.662 641 HH TYR 80 HH TYR 80 29.423 -24.678 16.614 642 H LEU 81 HN LEU 81 24.527 -21.164 16.074 643 HA LEU 81 HA LEU 81 26.237 -18.773 15.764 644 HB2 LEU 81 HB2 LEU 81 24.408 -19.421 18.088 645 HB3 LEU 81 HB1 LEU 81 25.313 -17.939 17.841 646 HG LEU 81 HG LEU 81 23.215 -19.013 15.970 647 HD11 LEU 81 HD11 LEU 81 23.154 -16.730 17.968 648 HD12 LEU 81 HD12 LEU 81 22.138 -18.178 17.987 649 HD13 LEU 81 HD13 LEU 81 21.930 -16.964 16.730 650 HD21 LEU 81 HD21 LEU 81 24.527 -17.746 14.571 651 HD22 LEU 81 HD22 LEU 81 25.081 -16.658 15.853 652 HD23 LEU 81 HD23 LEU 81 23.463 -16.486 15.174 653 H LEU 82 HN LEU 82 28.054 -18.554 16.662 654 HA LEU 82 HA LEU 82 29.457 -20.842 17.638 655 HB2 LEU 82 HB2 LEU 82 30.303 -17.970 17.387 656 HB3 LEU 82 HB1 LEU 82 31.374 -19.279 17.885 657 HG LEU 82 HG LEU 82 29.799 -19.320 15.282 658 HD11 LEU 82 HD11 LEU 82 32.556 -19.084 14.764 659 HD12 LEU 82 HD12 LEU 82 32.193 -17.834 15.949 660 HD13 LEU 82 HD13 LEU 82 31.293 -17.909 14.435 661 HD21 LEU 82 HD21 LEU 82 31.885 -20.996 14.922 662 HD22 LEU 82 HD22 LEU 82 30.375 -21.531 15.651 663 HD23 LEU 82 HD23 LEU 82 31.740 -21.127 16.671 664 H SER 83 HN SER 83 30.528 -21.176 19.551 665 HA SER 83 HA SER 83 29.174 -20.491 21.948 666 HB2 SER 83 HB2 SER 83 31.884 -21.498 22.338 667 HB3 SER 83 HB1 SER 83 30.339 -22.195 22.775 668 HG SER 83 HG SER 83 30.833 -23.542 21.207 669 H ALA 84 HN ALA 84 29.821 -18.119 20.732 670 HA ALA 84 HA ALA 84 31.892 -16.955 22.501 671 HB1 ALA 84 HB1 ALA 84 31.379 -16.547 19.739 672 HB2 ALA 84 HB2 ALA 84 32.491 -15.653 20.755 673 HB3 ALA 84 HB3 ALA 84 30.843 -15.086 20.558 674 H ARG 85 HN ARG 85 30.642 -14.269 22.161 675 HA ARG 85 HA ARG 85 28.591 -14.655 24.189 676 HB2 ARG 85 HB2 ARG 85 29.756 -12.126 23.006 677 HB3 ARG 85 HB1 ARG 85 28.371 -12.122 24.084 678 HG2 ARG 85 HG2 ARG 85 29.819 -13.511 25.703 679 HG3 ARG 85 HG1 ARG 85 31.188 -13.018 24.706 680 HD2 ARG 85 HD2 ARG 85 29.214 -11.109 25.970 681 HD3 ARG 85 HD1 ARG 85 30.765 -11.488 26.682 682 HE ARG 85 HE ARG 85 30.219 -9.746 24.403 683 HH11 ARG 85 HH21 ARG 85 32.571 -11.714 26.045 684 HH12 ARG 85 HH22 ARG 85 33.923 -10.767 25.565 685 HH21 ARG 85 HH11 ARG 85 32.005 -8.468 23.766 686 HH22 ARG 85 HH12 ARG 85 33.602 -8.907 24.263 687 H ASN 86 HN ASN 86 27.049 -15.771 23.076 688 HA ASN 86 HA ASN 86 25.829 -14.625 20.706 689 HB2 ASN 86 HB2 ASN 86 25.882 -17.110 21.100 690 HB3 ASN 86 HB1 ASN 86 24.772 -16.850 22.449 691 HD21 ASN 86 HD21 ASN 86 23.266 -18.268 21.072 692 HD22 ASN 86 HD22 ASN 86 22.352 -17.484 19.880 693 H THR 87 HN THR 87 23.516 -14.072 20.657 694 HA THR 87 HA THR 87 21.975 -12.462 21.333 695 HB THR 87 HB THR 87 21.282 -13.249 23.912 696 HG1 THR 87 HG1 THR 87 22.895 -14.884 23.819 697 HG21 THR 87 HG21 THR 87 19.860 -13.021 21.864 698 HG22 THR 87 HG22 THR 87 19.480 -14.422 22.852 699 HG23 THR 87 HG23 THR 87 20.408 -14.620 21.363 700 H SER 88 HN SER 88 24.534 -11.497 21.582 701 HA SER 88 HA SER 88 24.399 -9.926 24.077 702 HB2 SER 88 HB2 SER 88 26.886 -11.084 22.829 703 HB3 SER 88 HB1 SER 88 26.816 -10.084 24.264 704 HG SER 88 HG SER 88 25.492 -12.614 23.920 705 H LEU 89 HN LEU 89 24.833 -7.843 23.913 706 HA LEU 89 HA LEU 89 24.681 -6.559 21.402 707 HB2 LEU 89 HB2 LEU 89 25.424 -5.499 24.135 708 HB3 LEU 89 HB1 LEU 89 25.132 -4.500 22.715 709 HG LEU 89 HG LEU 89 23.092 -6.458 23.835 710 HD11 LEU 89 HD11 LEU 89 22.008 -4.702 24.903 711 HD12 LEU 89 HD12 LEU 89 22.875 -3.475 23.997 712 HD13 LEU 89 HD13 LEU 89 23.703 -4.384 25.266 713 HD21 LEU 89 HD21 LEU 89 22.519 -6.140 21.576 714 HD22 LEU 89 HD22 LEU 89 23.120 -4.480 21.544 715 HD23 LEU 89 HD23 LEU 89 21.618 -4.862 22.370 716 H ASN 90 HN ASN 90 27.387 -7.186 23.582 717 HA ASN 90 HA ASN 90 29.255 -6.686 21.395 718 HB2 ASN 90 HB2 ASN 90 30.330 -4.953 22.314 719 HB3 ASN 90 HB1 ASN 90 28.768 -4.607 23.018 720 HD21 ASN 90 HD21 ASN 90 28.437 -5.495 25.308 721 HD22 ASN 90 HD22 ASN 90 29.779 -5.614 26.322 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 10.293 -1.637 1.048 2 H2 MET 1 HT2 MET 1 8.874 -1.738 0.145 3 H3 MET 1 HT3 MET 1 8.803 -1.403 1.806 4 HA MET 1 HA MET 1 8.843 0.703 1.422 5 HB2 MET 1 HB2 MET 1 11.520 0.066 0.086 6 HB3 MET 1 HB1 MET 1 10.899 1.729 0.322 7 HG2 MET 1 HG2 MET 1 10.770 1.288 2.754 8 HG3 MET 1 HG1 MET 1 11.413 -0.323 2.481 9 HE1 MET 1 HE1 MET 1 12.879 3.179 0.628 10 HE2 MET 1 HE2 MET 1 13.376 3.716 2.226 11 HE3 MET 1 HE3 MET 1 11.697 3.286 1.951 12 HA PRO 2 HA PRO 2 8.106 1.717 -3.258 13 HB2 PRO 2 HB2 PRO 2 9.850 -0.349 -4.506 14 HB3 PRO 2 HB1 PRO 2 9.467 1.289 -5.049 15 HG2 PRO 2 HG2 PRO 2 11.816 0.813 -3.984 16 HG3 PRO 2 HG1 PRO 2 10.949 2.301 -3.569 17 HD2 PRO 2 HD2 PRO 2 11.407 -0.105 -1.913 18 HD3 PRO 2 HD1 PRO 2 11.215 1.618 -1.490 19 H THR 3 HN THR 3 8.965 -1.628 -2.433 20 HA THR 3 HA THR 3 6.211 -2.451 -3.100 21 HB THR 3 HB THR 3 6.915 -4.399 -4.166 22 HG1 THR 3 HG1 THR 3 8.230 -5.467 -2.944 23 HG21 THR 3 HG21 THR 3 7.859 -2.239 -5.289 24 HG22 THR 3 HG22 THR 3 8.430 -3.800 -5.847 25 HG23 THR 3 HG23 THR 3 9.421 -2.843 -4.748 26 H GLN 4 HN GLN 4 5.646 -4.471 -1.837 27 HA GLN 4 HA GLN 4 6.360 -4.072 0.925 28 HB2 GLN 4 HB2 GLN 4 4.793 -6.321 -0.390 29 HB3 GLN 4 HB1 GLN 4 4.953 -6.066 1.341 30 HG2 GLN 4 HG2 GLN 4 3.703 -4.062 -0.577 31 HG3 GLN 4 HG1 GLN 4 2.827 -5.157 0.483 32 HE21 GLN 4 HE21 GLN 4 4.044 -2.042 0.326 33 HE22 GLN 4 HE22 GLN 4 4.097 -1.686 1.975 34 H ASP 5 HN ASP 5 7.427 -5.628 2.207 35 HA ASP 5 HA ASP 5 9.590 -6.984 0.808 36 HB2 ASP 5 HB2 ASP 5 9.022 -6.509 3.741 37 HB3 ASP 5 HB1 ASP 5 10.375 -7.458 3.170 38 H ILE 6 HN ILE 6 10.177 -9.172 2.020 39 HA ILE 6 HA ILE 6 7.727 -10.832 2.062 40 HB ILE 6 HB ILE 6 8.980 -12.620 1.008 41 HG12 ILE 6 HG12 ILE 6 11.295 -10.702 0.670 42 HG13 ILE 6 HG11 ILE 6 11.270 -11.915 1.962 43 HG21 ILE 6 HG21 ILE 6 9.431 -11.557 -1.233 44 HG22 ILE 6 HG22 ILE 6 9.287 -9.982 -0.470 45 HG23 ILE 6 HG23 ILE 6 7.889 -11.050 -0.540 46 HD11 ILE 6 HD11 ILE 6 12.486 -12.579 -0.159 47 HD12 ILE 6 HD12 ILE 6 10.916 -12.542 -0.964 48 HD13 ILE 6 HD13 ILE 6 11.199 -13.678 0.363 49 H ARG 7 HN ARG 7 7.857 -12.689 3.462 50 HA ARG 7 HA ARG 7 9.572 -12.116 5.776 51 HB2 ARG 7 HB2 ARG 7 7.179 -13.965 5.573 52 HB3 ARG 7 HB1 ARG 7 8.102 -13.631 7.029 53 HG2 ARG 7 HG2 ARG 7 7.590 -11.169 6.723 54 HG3 ARG 7 HG1 ARG 7 6.522 -11.638 5.403 55 HD2 ARG 7 HD2 ARG 7 6.237 -12.682 8.238 56 HD3 ARG 7 HD1 ARG 7 5.329 -11.329 7.595 57 HE ARG 7 HE ARG 7 4.941 -13.476 5.839 58 HH11 ARG 7 HH21 ARG 7 4.362 -12.652 9.184 59 HH12 ARG 7 HH22 ARG 7 2.948 -13.618 9.307 60 HH21 ARG 7 HH11 ARG 7 3.053 -14.748 6.024 61 HH22 ARG 7 HH12 ARG 7 2.206 -14.833 7.508 62 H LEU 8 HN LEU 8 11.216 -13.259 6.332 63 HA LEU 8 HA LEU 8 11.679 -15.883 5.075 64 HB2 LEU 8 HB2 LEU 8 13.218 -13.931 4.476 65 HB3 LEU 8 HB1 LEU 8 13.766 -13.967 6.145 66 HG LEU 8 HG LEU 8 13.925 -16.308 4.210 67 HD11 LEU 8 HD11 LEU 8 16.157 -14.588 5.318 68 HD12 LEU 8 HD12 LEU 8 15.485 -14.390 3.700 69 HD13 LEU 8 HD13 LEU 8 16.302 -15.896 4.151 70 HD21 LEU 8 HD21 LEU 8 14.461 -16.010 7.127 71 HD22 LEU 8 HD22 LEU 8 15.680 -16.863 6.193 72 HD23 LEU 8 HD23 LEU 8 14.016 -17.429 6.170 73 H TRP 9 HN TRP 9 11.869 -17.554 6.530 74 HA TRP 9 HA TRP 9 11.920 -16.901 9.429 75 HB2 TRP 9 HB2 TRP 9 11.673 -19.680 8.315 76 HB3 TRP 9 HB1 TRP 9 11.126 -19.058 9.864 77 HD1 TRP 9 HD1 TRP 9 9.503 -16.534 8.870 78 HE1 TRP 9 HE1 TRP 9 7.291 -16.894 7.587 79 HE3 TRP 9 HE3 TRP 9 10.215 -21.289 7.241 80 HZ2 TRP 9 HZ2 TRP 9 6.016 -18.923 6.065 81 HZ3 TRP 9 HZ3 TRP 9 8.542 -22.421 5.867 82 HH2 TRP 9 HH2 TRP 9 6.393 -21.223 5.261 83 H VAL 10 HN VAL 10 13.732 -17.273 10.618 84 HA VAL 10 HA VAL 10 15.836 -18.867 9.289 85 HB VAL 10 HB VAL 10 16.247 -16.543 11.159 86 HG11 VAL 10 HG11 VAL 10 18.582 -16.808 9.895 87 HG12 VAL 10 HG12 VAL 10 18.030 -18.477 9.758 88 HG13 VAL 10 HG13 VAL 10 18.186 -17.731 11.344 89 HG21 VAL 10 HG21 VAL 10 15.253 -15.821 8.983 90 HG22 VAL 10 HG22 VAL 10 16.569 -16.629 8.126 91 HG23 VAL 10 HG23 VAL 10 16.904 -15.269 9.191 92 H SER 11 HN SER 11 16.415 -20.598 10.334 93 HA SER 11 HA SER 11 15.584 -21.017 13.121 94 HB2 SER 11 HB2 SER 11 16.920 -22.885 11.145 95 HB3 SER 11 HB1 SER 11 16.364 -23.314 12.750 96 HG SER 11 HG SER 11 14.936 -22.805 10.397 97 H VAL 12 HN VAL 12 16.988 -20.811 14.773 98 HA VAL 12 HA VAL 12 19.795 -20.335 14.033 99 HB VAL 12 HB VAL 12 18.052 -19.201 16.196 100 HG11 VAL 12 HG11 VAL 12 20.382 -17.829 16.489 101 HG12 VAL 12 HG12 VAL 12 21.021 -19.402 16.041 102 HG13 VAL 12 HG13 VAL 12 19.978 -19.245 17.452 103 HG21 VAL 12 HG21 VAL 12 19.718 -17.486 14.418 104 HG22 VAL 12 HG22 VAL 12 18.083 -17.234 15.004 105 HG23 VAL 12 HG23 VAL 12 18.361 -18.306 13.641 106 H GLU 13 HN GLU 13 21.261 -21.651 14.813 107 HA GLU 13 HA GLU 13 20.575 -23.509 17.009 108 HB2 GLU 13 HB2 GLU 13 22.536 -23.757 14.726 109 HB3 GLU 13 HB1 GLU 13 22.428 -24.910 16.056 110 HG2 GLU 13 HG2 GLU 13 19.940 -24.209 14.520 111 HG3 GLU 13 HG1 GLU 13 21.114 -25.324 13.825 112 H ASP 14 HN ASP 14 21.517 -23.087 18.851 113 HA ASP 14 HA ASP 14 23.835 -21.301 18.967 114 HB2 ASP 14 HB2 ASP 14 21.891 -20.962 20.427 115 HB3 ASP 14 HB1 ASP 14 22.316 -22.491 21.251 116 H ALA 15 HN ALA 15 25.733 -21.899 19.388 117 HA ALA 15 HA ALA 15 26.658 -24.589 19.393 118 HB1 ALA 15 HB1 ALA 15 28.227 -22.848 18.864 119 HB2 ALA 15 HB2 ALA 15 28.769 -23.604 20.376 120 HB3 ALA 15 HB3 ALA 15 27.917 -22.061 20.412 121 H GLN 16 HN GLN 16 25.469 -22.456 21.834 122 HA GLN 16 HA GLN 16 26.353 -23.975 24.102 123 HB2 GLN 16 HB2 GLN 16 24.097 -21.960 23.904 124 HB3 GLN 16 HB1 GLN 16 24.817 -22.591 25.382 125 HG2 GLN 16 HG2 GLN 16 26.345 -21.032 23.263 126 HG3 GLN 16 HG1 GLN 16 25.752 -20.362 24.773 127 HE21 GLN 16 HE21 GLN 16 28.463 -21.796 23.374 128 HE22 GLN 16 HE22 GLN 16 29.249 -22.256 24.805 129 H MET 17 HN MET 17 24.307 -24.686 21.667 130 HA MET 17 HA MET 17 23.007 -26.469 21.278 131 HB2 MET 17 HB2 MET 17 23.160 -27.029 24.253 132 HB3 MET 17 HB1 MET 17 22.352 -28.039 23.080 133 HG2 MET 17 HG2 MET 17 25.311 -27.329 22.982 134 HG3 MET 17 HG1 MET 17 24.639 -28.879 23.470 135 HE1 MET 17 HE1 MET 17 22.281 -29.509 21.535 136 HE2 MET 17 HE2 MET 17 23.570 -30.541 22.131 137 HE3 MET 17 HE3 MET 17 23.234 -30.488 20.407 138 H HIS 18 HN HIS 18 21.944 -24.160 21.130 139 HA HIS 18 HA HIS 18 19.227 -24.545 22.255 140 HB2 HIS 18 HB2 HIS 18 20.398 -21.824 21.593 141 HB3 HIS 18 HB1 HIS 18 18.858 -22.195 22.332 142 HD1 HIS 18 HD1 HIS 18 22.179 -21.180 23.284 143 HD2 HIS 18 HD2 HIS 18 19.292 -23.732 24.951 144 HE1 HIS 18 HE1 HIS 18 22.762 -21.452 25.735 145 HE2 HIS 18 HE2 HIS 18 21.025 -23.018 26.754 146 H THR 19 HN THR 19 17.584 -24.315 20.782 147 HA THR 19 HA THR 19 18.333 -23.574 18.039 148 HB THR 19 HB THR 19 16.198 -25.586 18.805 149 HG1 THR 19 HG1 THR 19 18.814 -25.959 17.700 150 HG21 THR 19 HG21 THR 19 15.862 -24.343 16.693 151 HG22 THR 19 HG22 THR 19 16.133 -26.052 16.404 152 HG23 THR 19 HG23 THR 19 17.430 -24.890 16.120 153 H VAL 20 HN VAL 20 17.271 -21.798 17.399 154 HA VAL 20 HA VAL 20 14.599 -21.296 18.491 155 HB VAL 20 HB VAL 20 15.150 -18.879 18.844 156 HG11 VAL 20 HG11 VAL 20 15.102 -20.551 20.685 157 HG12 VAL 20 HG12 VAL 20 16.230 -19.225 20.994 158 HG13 VAL 20 HG13 VAL 20 16.839 -20.791 20.488 159 HG21 VAL 20 HG21 VAL 20 17.767 -18.648 19.288 160 HG22 VAL 20 HG22 VAL 20 17.101 -18.356 17.695 161 HG23 VAL 20 HG23 VAL 20 17.871 -19.910 18.062 162 H THR 21 HN THR 21 13.386 -19.697 17.332 163 HA THR 21 HA THR 21 14.067 -19.711 14.443 164 HB THR 21 HB THR 21 11.302 -19.681 15.668 165 HG1 THR 21 HG1 THR 21 11.876 -21.634 16.193 166 HG21 THR 21 HG21 THR 21 12.265 -20.409 12.878 167 HG22 THR 21 HG22 THR 21 11.539 -18.862 13.325 168 HG23 THR 21 HG23 THR 21 10.594 -20.320 13.423 169 H ILE 22 HN ILE 22 14.189 -17.749 13.502 170 HA ILE 22 HA ILE 22 12.741 -15.544 14.812 171 HB ILE 22 HB ILE 22 14.514 -13.996 14.270 172 HG12 ILE 22 HG12 ILE 22 16.110 -16.404 13.291 173 HG13 ILE 22 HG11 ILE 22 15.328 -15.189 12.260 174 HG21 ILE 22 HG21 ILE 22 15.861 -16.338 15.616 175 HG22 ILE 22 HG22 ILE 22 14.584 -15.410 16.421 176 HG23 ILE 22 HG23 ILE 22 16.080 -14.622 15.931 177 HD11 ILE 22 HD11 ILE 22 17.821 -14.832 12.776 178 HD12 ILE 22 HD12 ILE 22 17.298 -14.381 14.397 179 HD13 ILE 22 HD13 ILE 22 16.741 -13.457 13.000 180 H TRP 23 HN TRP 23 11.889 -14.046 13.469 181 HA TRP 23 HA TRP 23 11.440 -14.997 10.704 182 HB2 TRP 23 HB2 TRP 23 9.658 -13.119 12.259 183 HB3 TRP 23 HB1 TRP 23 9.247 -14.136 10.884 184 HD1 TRP 23 HD1 TRP 23 10.233 -14.434 14.597 185 HE1 TRP 23 HE1 TRP 23 9.263 -16.582 15.545 186 HE3 TRP 23 HE3 TRP 23 8.204 -16.396 10.354 187 HZ2 TRP 23 HZ2 TRP 23 7.784 -18.878 14.632 188 HZ3 TRP 23 HZ3 TRP 23 7.010 -18.568 10.414 189 HH2 TRP 23 HH2 TRP 23 6.798 -19.813 12.561 190 H LEU 24 HN LEU 24 12.253 -13.689 9.133 191 HA LEU 24 HA LEU 24 12.721 -10.853 9.826 192 HB2 LEU 24 HB2 LEU 24 14.325 -12.540 7.898 193 HB3 LEU 24 HB1 LEU 24 14.597 -10.848 8.281 194 HG LEU 24 HG LEU 24 14.744 -13.117 10.299 195 HD11 LEU 24 HD11 LEU 24 16.987 -13.185 10.050 196 HD12 LEU 24 HD12 LEU 24 17.124 -11.468 9.691 197 HD13 LEU 24 HD13 LEU 24 16.625 -12.600 8.426 198 HD21 LEU 24 HD21 LEU 24 15.908 -11.128 11.578 199 HD22 LEU 24 HD22 LEU 24 14.154 -11.242 11.576 200 HD23 LEU 24 HD23 LEU 24 14.965 -10.113 10.493 201 H THR 25 HN THR 25 11.857 -9.356 8.540 202 HA THR 25 HA THR 25 10.495 -10.290 6.104 203 HB THR 25 HB THR 25 10.062 -7.647 7.489 204 HG1 THR 25 HG1 THR 25 9.496 -9.169 9.017 205 HG21 THR 25 HG21 THR 25 8.024 -7.599 6.229 206 HG22 THR 25 HG22 THR 25 8.206 -9.291 5.753 207 HG23 THR 25 HG23 THR 25 9.297 -8.080 5.115 208 H VAL 26 HN VAL 26 11.568 -9.839 4.298 209 HA VAL 26 HA VAL 26 13.076 -7.358 3.974 210 HB VAL 26 HB VAL 26 15.087 -8.694 3.203 211 HG11 VAL 26 HG11 VAL 26 14.708 -7.564 5.508 212 HG12 VAL 26 HG12 VAL 26 16.027 -8.701 5.299 213 HG13 VAL 26 HG13 VAL 26 14.547 -9.220 6.109 214 HG21 VAL 26 HG21 VAL 26 14.251 -10.876 2.890 215 HG22 VAL 26 HG22 VAL 26 13.430 -10.918 4.451 216 HG23 VAL 26 HG23 VAL 26 15.191 -10.995 4.369 217 H ARG 27 HN ARG 27 14.361 -7.945 1.667 218 HA ARG 27 HA ARG 27 12.269 -9.048 -0.073 219 HB2 ARG 27 HB2 ARG 27 13.377 -7.495 -1.870 220 HB3 ARG 27 HB1 ARG 27 12.168 -6.874 -0.757 221 HG2 ARG 27 HG2 ARG 27 14.377 -6.379 0.738 222 HG3 ARG 27 HG1 ARG 27 15.099 -6.303 -0.870 223 HD2 ARG 27 HD2 ARG 27 12.952 -4.638 0.341 224 HD3 ARG 27 HD1 ARG 27 14.415 -4.125 -0.444 225 HE ARG 27 HE ARG 27 13.433 -4.613 -2.593 226 HH11 ARG 27 HH21 ARG 27 11.167 -5.062 0.130 227 HH12 ARG 27 HH22 ARG 27 9.812 -4.933 -0.895 228 HH21 ARG 27 HH11 ARG 27 11.532 -4.446 -3.874 229 HH22 ARG 27 HH12 ARG 27 9.993 -4.590 -3.141 230 HA PRO 28 HA PRO 28 15.202 -12.007 -1.598 231 HB2 PRO 28 HB2 PRO 28 14.417 -11.042 -4.304 232 HB3 PRO 28 HB1 PRO 28 14.417 -12.694 -3.677 233 HG2 PRO 28 HG2 PRO 28 12.154 -11.446 -3.974 234 HG3 PRO 28 HG1 PRO 28 12.447 -12.374 -2.489 235 HD2 PRO 28 HD2 PRO 28 12.487 -9.411 -2.869 236 HD3 PRO 28 HD1 PRO 28 11.878 -10.372 -1.505 237 H ASP 29 HN ASP 29 15.099 -8.772 -2.786 238 HA ASP 29 HA ASP 29 17.550 -8.675 -4.240 239 HB2 ASP 29 HB2 ASP 29 15.857 -6.501 -3.020 240 HB3 ASP 29 HB1 ASP 29 17.232 -6.230 -4.062 241 H MET 30 HN MET 30 16.766 -8.607 -0.906 242 HA MET 30 HA MET 30 18.950 -6.961 -0.068 243 HB2 MET 30 HB2 MET 30 17.037 -8.728 1.391 244 HB3 MET 30 HB1 MET 30 18.504 -8.172 2.192 245 HG2 MET 30 HG2 MET 30 17.922 -5.852 1.715 246 HG3 MET 30 HG1 MET 30 16.470 -6.346 0.860 247 HE1 MET 30 HE1 MET 30 18.508 -6.306 3.961 248 HE2 MET 30 HE2 MET 30 18.013 -7.970 4.284 249 HE3 MET 30 HE3 MET 30 17.440 -6.678 5.319 250 H THR 31 HN THR 31 20.596 -7.560 1.282 251 HA THR 31 HA THR 31 22.012 -9.923 0.300 252 HB THR 31 HB THR 31 22.732 -7.129 0.969 253 HG1 THR 31 HG1 THR 31 24.097 -8.909 -0.729 254 HG21 THR 31 HG21 THR 31 24.526 -9.457 1.624 255 HG22 THR 31 HG22 THR 31 24.044 -8.073 2.637 256 HG23 THR 31 HG23 THR 31 25.127 -7.823 1.273 257 H VAL 32 HN VAL 32 23.108 -11.257 1.746 258 HA VAL 32 HA VAL 32 21.816 -11.817 4.170 259 HB VAL 32 HB VAL 32 24.569 -12.606 3.184 260 HG11 VAL 32 HG11 VAL 32 24.278 -14.461 4.945 261 HG12 VAL 32 HG12 VAL 32 23.055 -13.416 5.671 262 HG13 VAL 32 HG13 VAL 32 24.723 -12.859 5.538 263 HG21 VAL 32 HG21 VAL 32 22.013 -14.232 3.419 264 HG22 VAL 32 HG22 VAL 32 23.503 -14.682 2.596 265 HG23 VAL 32 HG23 VAL 32 22.493 -13.405 1.933 266 H ALA 33 HN ALA 33 24.850 -10.111 3.546 267 HA ALA 33 HA ALA 33 25.662 -9.614 6.120 268 HB1 ALA 33 HB1 ALA 33 27.011 -7.928 5.280 269 HB2 ALA 33 HB2 ALA 33 25.804 -7.342 4.158 270 HB3 ALA 33 HB3 ALA 33 26.690 -8.815 3.801 271 H SER 34 HN SER 34 23.212 -7.917 4.195 272 HA SER 34 HA SER 34 22.594 -5.908 6.086 273 HB2 SER 34 HB2 SER 34 20.604 -7.038 4.158 274 HB3 SER 34 HB1 SER 34 20.812 -5.383 4.709 275 HG SER 34 HG SER 34 22.977 -5.560 3.624 276 H LEU 35 HN LEU 35 21.211 -9.136 5.516 277 HA LEU 35 HA LEU 35 19.201 -8.937 7.534 278 HB2 LEU 35 HB2 LEU 35 20.521 -11.234 6.164 279 HB3 LEU 35 HB1 LEU 35 19.504 -11.548 7.577 280 HG LEU 35 HG LEU 35 18.674 -10.075 5.058 281 HD11 LEU 35 HD11 LEU 35 19.051 -12.705 5.122 282 HD12 LEU 35 HD12 LEU 35 17.554 -12.060 4.424 283 HD13 LEU 35 HD13 LEU 35 17.561 -12.676 6.057 284 HD21 LEU 35 HD21 LEU 35 17.286 -9.193 6.693 285 HD22 LEU 35 HD22 LEU 35 17.407 -10.626 7.713 286 HD23 LEU 35 HD23 LEU 35 16.377 -10.652 6.280 287 H LYS 36 HN LYS 36 22.499 -10.053 7.522 288 HA LYS 36 HA LYS 36 22.671 -11.010 10.124 289 HB2 LYS 36 HB2 LYS 36 24.387 -11.381 8.539 290 HB3 LYS 36 HB1 LYS 36 24.655 -9.655 8.311 291 HG2 LYS 36 HG2 LYS 36 24.913 -10.547 11.136 292 HG3 LYS 36 HG1 LYS 36 26.110 -11.243 10.052 293 HD2 LYS 36 HD2 LYS 36 25.506 -8.300 10.351 294 HD3 LYS 36 HD1 LYS 36 26.918 -9.142 10.978 295 HE2 LYS 36 HE2 LYS 36 27.978 -8.835 9.020 296 HE3 LYS 36 HE1 LYS 36 26.755 -9.780 8.187 297 HZ1 LYS 36 HZ1 LYS 36 27.139 -7.322 7.505 298 HZ2 LYS 36 HZ2 LYS 36 26.223 -6.931 8.868 299 HZ3 LYS 36 HZ3 LYS 36 25.529 -7.801 7.656 300 H ASP 37 HN ASP 37 23.078 -7.749 8.782 301 HA ASP 37 HA ASP 37 23.805 -6.532 11.213 302 HB2 ASP 37 HB2 ASP 37 22.554 -5.407 8.716 303 HB3 ASP 37 HB1 ASP 37 22.940 -4.409 10.106 304 H MET 38 HN MET 38 20.584 -6.924 9.670 305 HA MET 38 HA MET 38 19.204 -5.523 11.721 306 HB2 MET 38 HB2 MET 38 17.737 -7.803 10.571 307 HB3 MET 38 HB1 MET 38 17.305 -6.108 10.729 308 HG2 MET 38 HG2 MET 38 18.846 -5.573 8.846 309 HG3 MET 38 HG1 MET 38 19.064 -7.305 8.608 310 HE1 MET 38 HE1 MET 38 17.050 -8.887 8.881 311 HE2 MET 38 HE2 MET 38 15.526 -8.683 8.037 312 HE3 MET 38 HE3 MET 38 15.717 -8.015 9.642 313 H VAL 39 HN VAL 39 20.110 -8.844 11.248 314 HA VAL 39 HA VAL 39 18.806 -9.923 13.450 315 HB VAL 39 HB VAL 39 21.433 -10.771 12.160 316 HG11 VAL 39 HG11 VAL 39 19.691 -12.567 13.832 317 HG12 VAL 39 HG12 VAL 39 20.992 -11.637 14.589 318 HG13 VAL 39 HG13 VAL 39 21.352 -12.811 13.339 319 HG21 VAL 39 HG21 VAL 39 20.175 -11.978 10.683 320 HG22 VAL 39 HG22 VAL 39 18.922 -10.805 11.060 321 HG23 VAL 39 HG23 VAL 39 18.946 -12.366 11.874 322 H PHE 40 HN PHE 40 21.935 -8.345 13.080 323 HA PHE 40 HA PHE 40 22.830 -8.615 15.745 324 HB2 PHE 40 HB2 PHE 40 24.338 -7.933 13.921 325 HB3 PHE 40 HB1 PHE 40 23.393 -6.452 13.731 326 HD1 PHE 40 HD2 PHE 40 25.199 -8.373 16.400 327 HD2 PHE 40 HD1 PHE 40 24.040 -4.533 14.874 328 HE1 PHE 40 HE2 PHE 40 26.513 -7.271 18.177 329 HE2 PHE 40 HE1 PHE 40 25.348 -3.429 16.659 330 HZ PHE 40 HZ PHE 40 26.595 -4.798 18.311 331 H LEU 41 HN LEU 41 20.907 -6.147 14.054 332 HA LEU 41 HA LEU 41 20.715 -4.295 16.189 333 HB2 LEU 41 HB2 LEU 41 18.613 -4.967 14.106 334 HB3 LEU 41 HB1 LEU 41 18.638 -3.526 15.096 335 HG LEU 41 HG LEU 41 20.746 -4.370 13.160 336 HD11 LEU 41 HD11 LEU 41 18.709 -2.125 12.990 337 HD12 LEU 41 HD12 LEU 41 18.683 -3.610 12.041 338 HD13 LEU 41 HD13 LEU 41 19.965 -2.433 11.793 339 HD21 LEU 41 HD21 LEU 41 21.876 -3.159 14.749 340 HD22 LEU 41 HD22 LEU 41 20.535 -2.040 15.060 341 HD23 LEU 41 HD23 LEU 41 21.497 -1.912 13.567 342 H ASP 42 HN ASP 42 18.714 -6.935 15.198 343 HA ASP 42 HA ASP 42 16.860 -6.658 17.407 344 HB2 ASP 42 HB2 ASP 42 17.117 -8.642 15.216 345 HB3 ASP 42 HB1 ASP 42 16.236 -9.119 16.655 346 H TYR 43 HN TYR 43 19.370 -9.078 16.732 347 HA TYR 43 HA TYR 43 18.945 -10.079 19.464 348 HB2 TYR 43 HB2 TYR 43 20.320 -11.623 17.263 349 HB3 TYR 43 HB1 TYR 43 19.520 -12.193 18.729 350 HD1 TYR 43 HD2 TYR 43 17.002 -11.960 18.969 351 HD2 TYR 43 HD1 TYR 43 19.063 -11.223 15.282 352 HE1 TYR 43 HE2 TYR 43 14.863 -12.128 17.736 353 HE2 TYR 43 HE1 TYR 43 16.941 -11.390 14.049 354 HH TYR 43 HH TYR 43 14.742 -11.362 14.296 355 H GLY 44 HN GLY 44 21.190 -8.228 17.825 356 HA2 GLY 44 HA2 GLY 44 23.279 -7.475 18.468 357 HA3 GLY 44 HA1 GLY 44 23.006 -8.279 20.008 358 H PHE 45 HN PHE 45 22.798 -10.087 17.077 359 HA PHE 45 HA PHE 45 24.853 -11.905 17.896 360 HB2 PHE 45 HB2 PHE 45 23.290 -11.633 15.315 361 HB3 PHE 45 HB1 PHE 45 24.479 -12.886 15.603 362 HD1 PHE 45 HD1 PHE 45 22.974 -12.169 18.749 363 HD2 PHE 45 HD2 PHE 45 22.194 -14.186 15.013 364 HE1 PHE 45 HE1 PHE 45 21.281 -13.562 19.847 365 HE2 PHE 45 HE2 PHE 45 20.489 -15.572 16.133 366 HZ PHE 45 HZ PHE 45 20.027 -15.267 18.552 367 HA PRO 46 HA PRO 46 28.063 -9.234 16.016 368 HB2 PRO 46 HB2 PRO 46 30.178 -10.804 16.741 369 HB3 PRO 46 HB1 PRO 46 29.429 -9.618 17.820 370 HG2 PRO 46 HG2 PRO 46 28.984 -12.554 17.676 371 HG3 PRO 46 HG1 PRO 46 29.183 -11.543 19.112 372 HD2 PRO 46 HD2 PRO 46 26.746 -12.343 18.372 373 HD3 PRO 46 HD1 PRO 46 26.991 -10.687 18.989 374 HA PRO 47 HA PRO 47 28.512 -11.230 12.156 375 HB2 PRO 47 HB2 PRO 47 31.142 -10.793 11.485 376 HB3 PRO 47 HB1 PRO 47 29.851 -9.587 11.310 377 HG2 PRO 47 HG2 PRO 47 31.884 -9.874 13.477 378 HG3 PRO 47 HG1 PRO 47 31.242 -8.409 12.723 379 HD2 PRO 47 HD2 PRO 47 30.378 -9.151 15.144 380 HD3 PRO 47 HD1 PRO 47 29.259 -8.435 13.971 381 H VAL 48 HN VAL 48 31.038 -11.983 14.458 382 HA VAL 48 HA VAL 48 31.845 -14.405 13.220 383 HB VAL 48 HB VAL 48 33.274 -13.307 14.860 384 HG11 VAL 48 HG11 VAL 48 32.717 -13.201 17.215 385 HG12 VAL 48 HG12 VAL 48 31.213 -14.054 16.954 386 HG13 VAL 48 HG13 VAL 48 31.434 -12.421 16.297 387 HG21 VAL 48 HG21 VAL 48 32.279 -16.037 15.782 388 HG22 VAL 48 HG22 VAL 48 33.757 -15.301 16.341 389 HG23 VAL 48 HG23 VAL 48 33.578 -15.730 14.633 390 H LEU 49 HN LEU 49 29.528 -13.663 15.754 391 HA LEU 49 HA LEU 49 28.656 -16.414 16.036 392 HB2 LEU 49 HB2 LEU 49 27.457 -13.862 17.114 393 HB3 LEU 49 HB1 LEU 49 26.823 -15.459 17.437 394 HG LEU 49 HG LEU 49 29.692 -14.657 18.099 395 HD11 LEU 49 HD11 LEU 49 28.538 -15.093 20.482 396 HD12 LEU 49 HD12 LEU 49 27.162 -14.409 19.653 397 HD13 LEU 49 HD13 LEU 49 28.680 -13.497 19.774 398 HD21 LEU 49 HD21 LEU 49 29.384 -16.765 19.558 399 HD22 LEU 49 HD22 LEU 49 29.619 -16.957 17.827 400 HD23 LEU 49 HD23 LEU 49 27.997 -17.119 18.515 401 H GLN 50 HN GLN 50 27.486 -13.557 14.385 402 HA GLN 50 HA GLN 50 24.980 -14.685 13.673 403 HB2 GLN 50 HB2 GLN 50 25.980 -12.162 13.653 404 HB3 GLN 50 HB1 GLN 50 26.076 -12.506 11.941 405 HG2 GLN 50 HG2 GLN 50 23.549 -13.037 13.538 406 HG3 GLN 50 HG1 GLN 50 23.902 -11.465 12.839 407 HE21 GLN 50 HE21 GLN 50 25.307 -13.104 10.496 408 HE22 GLN 50 HE22 GLN 50 23.976 -13.526 9.545 409 H GLN 51 HN GLN 51 25.901 -16.785 12.943 410 HA GLN 51 HA GLN 51 26.890 -16.633 10.169 411 HB2 GLN 51 HB2 GLN 51 27.090 -18.874 12.191 412 HB3 GLN 51 HB1 GLN 51 27.657 -18.944 10.528 413 HG2 GLN 51 HG2 GLN 51 29.145 -17.003 10.955 414 HG3 GLN 51 HG1 GLN 51 28.583 -16.974 12.624 415 HE21 GLN 51 HE21 GLN 51 31.066 -17.299 12.852 416 HE22 GLN 51 HE22 GLN 51 31.619 -18.905 12.947 417 H TRP 52 HN TRP 52 25.516 -17.025 8.655 418 HA TRP 52 HA TRP 52 23.051 -18.561 9.132 419 HB2 TRP 52 HB2 TRP 52 24.027 -16.820 6.853 420 HB3 TRP 52 HB1 TRP 52 22.604 -17.859 6.745 421 HD1 TRP 52 HD1 TRP 52 23.736 -15.622 9.691 422 HE1 TRP 52 HE1 TRP 52 21.805 -14.037 10.267 423 HE3 TRP 52 HE3 TRP 52 20.443 -16.918 6.016 424 HZ2 TRP 52 HZ2 TRP 52 19.190 -13.396 9.291 425 HZ3 TRP 52 HZ3 TRP 52 18.219 -15.787 5.865 426 HH2 TRP 52 HH2 TRP 52 17.605 -14.052 7.489 427 H VAL 53 HN VAL 53 22.900 -20.612 8.381 428 HA VAL 53 HA VAL 53 25.163 -21.601 6.763 429 HB VAL 53 HB VAL 53 23.072 -23.379 7.984 430 HG11 VAL 53 HG11 VAL 53 26.050 -23.783 7.651 431 HG12 VAL 53 HG12 VAL 53 24.890 -24.227 6.407 432 HG13 VAL 53 HG13 VAL 53 24.836 -25.004 7.989 433 HG21 VAL 53 HG21 VAL 53 23.707 -22.010 9.888 434 HG22 VAL 53 HG22 VAL 53 25.412 -22.091 9.451 435 HG23 VAL 53 HG23 VAL 53 24.580 -23.532 10.025 436 H ILE 54 HN ILE 54 24.771 -21.741 4.691 437 HA ILE 54 HA ILE 54 22.077 -22.362 3.716 438 HB ILE 54 HB ILE 54 23.849 -20.110 2.760 439 HG12 ILE 54 HG12 ILE 54 21.079 -19.995 4.015 440 HG13 ILE 54 HG11 ILE 54 22.575 -19.677 4.891 441 HG21 ILE 54 HG21 ILE 54 22.532 -21.287 0.933 442 HG22 ILE 54 HG22 ILE 54 21.996 -19.619 1.184 443 HG23 ILE 54 HG23 ILE 54 21.084 -20.958 1.874 444 HD11 ILE 54 HD11 ILE 54 21.066 -17.858 3.334 445 HD12 ILE 54 HD12 ILE 54 22.575 -18.117 2.468 446 HD13 ILE 54 HD13 ILE 54 22.598 -17.560 4.143 447 H GLY 55 HN GLY 55 22.169 -23.917 2.188 448 HA2 GLY 55 HA2 GLY 55 24.577 -25.216 1.544 449 HA3 GLY 55 HA1 GLY 55 23.032 -25.445 0.720 450 H GLN 56 HN GLN 56 22.521 -23.056 -0.362 451 HA GLN 56 HA GLN 56 24.146 -23.064 -2.682 452 HB2 GLN 56 HB2 GLN 56 22.057 -21.093 -1.734 453 HB3 GLN 56 HB1 GLN 56 22.814 -21.049 -3.316 454 HG2 GLN 56 HG2 GLN 56 22.026 -23.309 -3.825 455 HG3 GLN 56 HG1 GLN 56 21.303 -23.451 -2.230 456 HE21 GLN 56 HE21 GLN 56 20.848 -20.248 -3.172 457 HE22 GLN 56 HE22 GLN 56 19.314 -20.418 -3.857 458 H ARG 57 HN ARG 57 24.027 -20.889 0.088 459 HA ARG 57 HA ARG 57 25.656 -18.861 -1.006 460 HB2 ARG 57 HB2 ARG 57 24.105 -18.857 1.109 461 HB3 ARG 57 HB1 ARG 57 25.590 -19.320 1.949 462 HG2 ARG 57 HG2 ARG 57 26.653 -17.286 0.638 463 HG3 ARG 57 HG1 ARG 57 24.982 -16.778 0.444 464 HD2 ARG 57 HD2 ARG 57 25.763 -15.736 2.416 465 HD3 ARG 57 HD1 ARG 57 24.725 -17.051 2.969 466 HE ARG 57 HE ARG 57 27.664 -17.375 2.726 467 HH11 ARG 57 HH21 ARG 57 24.727 -17.544 4.658 468 HH12 ARG 57 HH22 ARG 57 25.540 -18.224 6.020 469 HH21 ARG 57 HH11 ARG 57 28.691 -18.223 4.622 470 HH22 ARG 57 HH12 ARG 57 27.769 -18.576 6.010 471 H LEU 58 HN LEU 58 27.736 -18.234 -0.456 472 HA LEU 58 HA LEU 58 29.590 -20.297 0.592 473 HB2 LEU 58 HB2 LEU 58 30.262 -17.974 -1.243 474 HB3 LEU 58 HB1 LEU 58 31.358 -19.229 -0.681 475 HG LEU 58 HG LEU 58 28.924 -19.715 -2.447 476 HD11 LEU 58 HD11 LEU 58 31.881 -19.603 -3.029 477 HD12 LEU 58 HD12 LEU 58 30.592 -18.642 -3.750 478 HD13 LEU 58 HD13 LEU 58 30.712 -20.363 -4.106 479 HD21 LEU 58 HD21 LEU 58 29.957 -21.995 -2.659 480 HD22 LEU 58 HD22 LEU 58 29.353 -21.669 -1.045 481 HD23 LEU 58 HD23 LEU 58 31.090 -21.570 -1.381 482 H ALA 59 HN ALA 59 31.571 -19.054 1.557 483 HA ALA 59 HA ALA 59 30.576 -17.587 3.791 484 HB1 ALA 59 HB1 ALA 59 33.409 -17.929 2.777 485 HB2 ALA 59 HB2 ALA 59 32.597 -18.863 4.047 486 HB3 ALA 59 HB3 ALA 59 32.983 -17.165 4.311 487 H ARG 60 HN ARG 60 29.493 -16.276 1.823 488 HA ARG 60 HA ARG 60 30.960 -13.723 1.590 489 HB2 ARG 60 HB2 ARG 60 30.907 -14.916 -0.562 490 HB3 ARG 60 HB1 ARG 60 29.151 -15.050 -0.428 491 HG2 ARG 60 HG2 ARG 60 28.874 -12.661 -0.658 492 HG3 ARG 60 HG1 ARG 60 30.616 -12.398 -0.529 493 HD2 ARG 60 HD2 ARG 60 29.853 -12.325 -2.897 494 HD3 ARG 60 HD1 ARG 60 31.014 -13.604 -2.586 495 HE ARG 60 HE ARG 60 28.179 -14.343 -2.427 496 HH11 ARG 60 HH21 ARG 60 31.092 -14.200 -4.367 497 HH12 ARG 60 HH22 ARG 60 30.655 -15.519 -5.356 498 HH21 ARG 60 HH11 ARG 60 27.614 -16.144 -3.747 499 HH22 ARG 60 HH12 ARG 60 28.659 -16.621 -5.011 500 H ASP 61 HN ASP 61 29.980 -12.329 2.865 501 HA ASP 61 HA ASP 61 27.350 -12.596 3.889 502 HB2 ASP 61 HB2 ASP 61 27.739 -10.396 4.888 503 HB3 ASP 61 HB1 ASP 61 29.091 -11.485 5.149 504 H GLN 62 HN GLN 62 28.721 -10.943 1.208 505 HA GLN 62 HA GLN 62 26.724 -8.991 0.832 506 HB2 GLN 62 HB2 GLN 62 28.722 -10.119 -1.152 507 HB3 GLN 62 HB1 GLN 62 27.691 -8.733 -1.458 508 HG2 GLN 62 HG2 GLN 62 28.614 -7.535 0.443 509 HG3 GLN 62 HG1 GLN 62 29.597 -8.911 0.889 510 HE21 GLN 62 HE21 GLN 62 31.511 -9.355 -0.367 511 HE22 GLN 62 HE22 GLN 62 32.101 -8.269 -1.522 512 H GLU 63 HN GLU 63 26.735 -12.323 0.114 513 HA GLU 63 HA GLU 63 25.298 -12.636 -2.136 514 HB2 GLU 63 HB2 GLU 63 25.104 -14.185 0.436 515 HB3 GLU 63 HB1 GLU 63 24.246 -14.664 -1.032 516 HG2 GLU 63 HG2 GLU 63 27.182 -14.068 -1.114 517 HG3 GLU 63 HG1 GLU 63 26.635 -15.631 -0.561 518 H THR 64 HN THR 64 23.339 -12.395 -2.908 519 HA THR 64 HA THR 64 21.464 -10.757 -1.549 520 HB THR 64 HB THR 64 20.306 -12.062 -3.837 521 HG1 THR 64 HG1 THR 64 22.266 -12.635 -4.493 522 HG21 THR 64 HG21 THR 64 19.610 -9.886 -3.508 523 HG22 THR 64 HG22 THR 64 20.815 -9.623 -4.749 524 HG23 THR 64 HG23 THR 64 21.208 -9.314 -3.055 525 H LEU 65 HN LEU 65 19.366 -11.386 -0.889 526 HA LEU 65 HA LEU 65 19.239 -13.903 0.414 527 HB2 LEU 65 HB2 LEU 65 16.972 -12.040 -0.341 528 HB3 LEU 65 HB1 LEU 65 16.886 -13.376 0.818 529 HG LEU 65 HG LEU 65 18.573 -10.883 1.068 530 HD11 LEU 65 HD11 LEU 65 16.363 -11.944 2.800 531 HD12 LEU 65 HD12 LEU 65 16.186 -10.665 1.619 532 HD13 LEU 65 HD13 LEU 65 17.233 -10.431 3.020 533 HD21 LEU 65 HD21 LEU 65 19.863 -12.819 1.907 534 HD22 LEU 65 HD22 LEU 65 18.489 -13.332 2.892 535 HD23 LEU 65 HD23 LEU 65 19.307 -11.796 3.209 536 H HIS 66 HN HIS 66 18.058 -12.698 -2.640 537 HA HIS 66 HA HIS 66 16.674 -15.006 -3.489 538 HB2 HIS 66 HB2 HIS 66 16.809 -12.674 -4.636 539 HB3 HIS 66 HB1 HIS 66 18.294 -13.280 -5.360 540 HD1 HIS 66 HD1 HIS 66 18.036 -15.622 -6.723 541 HD2 HIS 66 HD2 HIS 66 14.498 -13.577 -5.875 542 HE1 HIS 66 HE1 HIS 66 16.238 -16.620 -8.225 543 HE2 HIS 66 HE2 HIS 66 14.077 -15.370 -7.718 544 H SER 67 HN SER 67 20.101 -14.118 -3.554 545 HA SER 67 HA SER 67 21.051 -16.315 -5.041 546 HB2 SER 67 HB2 SER 67 22.540 -14.911 -2.785 547 HB3 SER 67 HB1 SER 67 23.206 -15.802 -4.115 548 HG SER 67 HG SER 67 22.792 -14.193 -5.465 549 H HIS 68 HN HIS 68 20.354 -15.876 -1.633 550 HA HIS 68 HA HIS 68 21.121 -18.544 -0.849 551 HB2 HIS 68 HB2 HIS 68 21.056 -17.244 1.059 552 HB3 HIS 68 HB1 HIS 68 19.740 -16.244 0.473 553 HD1 HIS 68 HD1 HIS 68 18.082 -16.491 2.373 554 HD2 HIS 68 HD2 HIS 68 19.433 -20.206 1.009 555 HE1 HIS 68 HE1 HIS 68 16.642 -18.261 3.502 556 HE2 HIS 68 HE2 HIS 68 17.428 -20.508 2.658 557 H GLY 69 HN GLY 69 18.279 -16.980 -2.122 558 HA2 GLY 69 HA2 GLY 69 16.945 -18.473 -3.598 559 HA3 GLY 69 HA1 GLY 69 16.908 -19.618 -2.265 560 H VAL 70 HN VAL 70 16.715 -16.441 -1.128 561 HA VAL 70 HA VAL 70 13.940 -16.830 -0.437 562 HB VAL 70 HB VAL 70 15.521 -14.310 -0.058 563 HG11 VAL 70 HG11 VAL 70 13.808 -13.668 1.306 564 HG12 VAL 70 HG12 VAL 70 13.741 -15.244 2.094 565 HG13 VAL 70 HG13 VAL 70 12.894 -14.991 0.587 566 HG21 VAL 70 HG21 VAL 70 16.409 -15.174 2.021 567 HG22 VAL 70 HG22 VAL 70 16.784 -16.366 0.766 568 HG23 VAL 70 HG23 VAL 70 15.439 -16.642 1.874 569 H ARG 71 HN ARG 71 12.318 -16.193 -1.648 570 HA ARG 71 HA ARG 71 12.763 -14.124 -3.755 571 HB2 ARG 71 HB2 ARG 71 11.084 -16.584 -4.109 572 HB3 ARG 71 HB1 ARG 71 11.631 -15.463 -5.326 573 HG2 ARG 71 HG2 ARG 71 13.856 -16.167 -5.276 574 HG3 ARG 71 HG1 ARG 71 13.745 -16.910 -3.701 575 HD2 ARG 71 HD2 ARG 71 12.954 -17.988 -6.360 576 HD3 ARG 71 HD1 ARG 71 13.688 -18.813 -5.002 577 HE ARG 71 HE ARG 71 10.923 -18.656 -5.584 578 HH11 ARG 71 HH21 ARG 71 13.171 -18.577 -2.834 579 HH12 ARG 71 HH22 ARG 71 11.995 -19.043 -1.703 580 HH21 ARG 71 HH11 ARG 71 9.379 -19.298 -4.018 581 HH22 ARG 71 HH12 ARG 71 9.802 -19.498 -2.380 582 H GLN 72 HN GLN 72 10.511 -15.901 -1.733 583 HA GLN 72 HA GLN 72 8.720 -13.569 -1.674 584 HB2 GLN 72 HB2 GLN 72 7.907 -16.383 -2.369 585 HB3 GLN 72 HB1 GLN 72 6.768 -15.149 -1.838 586 HG2 GLN 72 HG2 GLN 72 7.339 -13.728 -3.677 587 HG3 GLN 72 HG1 GLN 72 8.610 -14.818 -4.229 588 HE21 GLN 72 HE21 GLN 72 7.920 -16.936 -5.020 589 HE22 GLN 72 HE22 GLN 72 6.362 -17.184 -5.647 590 H ASN 73 HN ASN 73 7.204 -13.715 0.019 591 HA ASN 73 HA ASN 73 8.273 -14.287 2.548 592 HB2 ASN 73 HB2 ASN 73 6.091 -13.923 3.448 593 HB3 ASN 73 HB1 ASN 73 6.194 -12.892 2.031 594 HD21 ASN 73 HD21 ASN 73 5.623 -14.443 -0.075 595 HD22 ASN 73 HD22 ASN 73 4.118 -15.207 0.059 596 H GLY 74 HN GLY 74 8.269 -16.063 3.883 597 HA2 GLY 74 HA2 GLY 74 7.470 -18.142 4.569 598 HA3 GLY 74 HA1 GLY 74 6.959 -18.540 2.939 599 H ASP 75 HN ASP 75 9.874 -17.101 2.560 600 HA ASP 75 HA ASP 75 11.252 -19.587 2.155 601 HB2 ASP 75 HB2 ASP 75 12.098 -16.705 1.903 602 HB3 ASP 75 HB1 ASP 75 13.267 -18.001 1.764 603 H SER 76 HN SER 76 13.064 -20.350 3.276 604 HA SER 76 HA SER 76 13.196 -19.399 6.069 605 HB2 SER 76 HB2 SER 76 13.463 -22.320 5.414 606 HB3 SER 76 HB1 SER 76 12.927 -21.533 6.886 607 HG SER 76 HG SER 76 11.121 -20.735 5.394 608 H ALA 77 HN ALA 77 15.191 -19.740 7.185 609 HA ALA 77 HA ALA 77 17.481 -20.728 5.621 610 HB1 ALA 77 HB1 ALA 77 17.182 -18.090 5.603 611 HB2 ALA 77 HB2 ALA 77 18.769 -18.829 5.736 612 HB3 ALA 77 HB3 ALA 77 17.960 -18.222 7.180 613 H TYR 78 HN TYR 78 19.486 -20.939 6.982 614 HA TYR 78 HA TYR 78 18.762 -21.921 9.684 615 HB2 TYR 78 HB2 TYR 78 19.512 -23.464 7.620 616 HB3 TYR 78 HB1 TYR 78 21.107 -22.975 8.162 617 HD1 TYR 78 HD1 TYR 78 17.935 -24.553 9.231 618 HD2 TYR 78 HD2 TYR 78 22.085 -23.925 10.144 619 HE1 TYR 78 HE1 TYR 78 17.796 -26.270 10.992 620 HE2 TYR 78 HE2 TYR 78 21.966 -25.645 11.907 621 HH TYR 78 HH TYR 78 19.947 -26.675 13.421 622 H LEU 79 HN LEU 79 19.861 -20.968 11.350 623 HA LEU 79 HA LEU 79 22.365 -19.504 10.742 624 HB2 LEU 79 HB2 LEU 79 20.301 -18.102 11.233 625 HB3 LEU 79 HB1 LEU 79 20.340 -18.764 12.857 626 HG LEU 79 HG LEU 79 22.823 -17.476 11.704 627 HD11 LEU 79 HD11 LEU 79 22.185 -15.336 12.530 628 HD12 LEU 79 HD12 LEU 79 20.663 -15.961 13.158 629 HD13 LEU 79 HD13 LEU 79 20.927 -15.869 11.416 630 HD21 LEU 79 HD21 LEU 79 22.478 -16.841 14.394 631 HD22 LEU 79 HD22 LEU 79 23.541 -18.092 13.753 632 HD23 LEU 79 HD23 LEU 79 21.917 -18.510 14.299 633 H TYR 80 HN TYR 80 24.068 -19.860 12.066 634 HA TYR 80 HA TYR 80 23.639 -21.680 14.372 635 HB2 TYR 80 HB2 TYR 80 24.748 -22.859 12.503 636 HB3 TYR 80 HB1 TYR 80 26.029 -21.648 12.509 637 HD1 TYR 80 HD1 TYR 80 24.525 -24.463 14.371 638 HD2 TYR 80 HD2 TYR 80 27.676 -21.531 14.331 639 HE1 TYR 80 HE1 TYR 80 25.663 -25.669 16.179 640 HE2 TYR 80 HE2 TYR 80 28.823 -22.745 16.143 641 HH TYR 80 HH TYR 80 28.571 -24.358 17.750 642 H LEU 81 HN LEU 81 24.476 -20.999 16.272 643 HA LEU 81 HA LEU 81 26.213 -18.598 16.215 644 HB2 LEU 81 HB2 LEU 81 24.561 -19.644 18.522 645 HB3 LEU 81 HB1 LEU 81 25.498 -18.168 18.505 646 HG LEU 81 HG LEU 81 23.216 -18.779 16.647 647 HD11 LEU 81 HD11 LEU 81 22.556 -18.366 19.059 648 HD12 LEU 81 HD12 LEU 81 21.926 -17.147 17.960 649 HD13 LEU 81 HD13 LEU 81 23.326 -16.781 18.960 650 HD21 LEU 81 HD21 LEU 81 23.431 -16.213 16.276 651 HD22 LEU 81 HD22 LEU 81 24.603 -17.271 15.507 652 HD23 LEU 81 HD23 LEU 81 25.042 -16.389 16.969 653 H LEU 82 HN LEU 82 28.156 -18.758 16.898 654 HA LEU 82 HA LEU 82 29.313 -21.280 17.783 655 HB2 LEU 82 HB2 LEU 82 30.590 -18.524 17.594 656 HB3 LEU 82 HB1 LEU 82 31.420 -20.015 17.973 657 HG LEU 82 HG LEU 82 29.865 -19.630 15.388 658 HD11 LEU 82 HD11 LEU 82 32.670 -18.924 16.141 659 HD12 LEU 82 HD12 LEU 82 31.552 -18.112 15.049 660 HD13 LEU 82 HD13 LEU 82 32.367 -19.588 14.536 661 HD21 LEU 82 HD21 LEU 82 30.940 -21.947 16.645 662 HD22 LEU 82 HD22 LEU 82 32.098 -21.498 15.412 663 HD23 LEU 82 HD23 LEU 82 30.425 -21.786 14.965 664 H SER 83 HN SER 83 30.594 -21.404 19.798 665 HA SER 83 HA SER 83 29.024 -20.673 22.024 666 HB2 SER 83 HB2 SER 83 31.927 -21.374 22.177 667 HB3 SER 83 HB1 SER 83 30.669 -21.755 23.338 668 HG SER 83 HG SER 83 31.560 -23.240 21.381 669 H ALA 84 HN ALA 84 31.154 -18.876 20.153 670 HA ALA 84 HA ALA 84 32.427 -17.114 21.929 671 HB1 ALA 84 HB1 ALA 84 33.109 -16.663 19.784 672 HB2 ALA 84 HB2 ALA 84 31.876 -15.421 19.919 673 HB3 ALA 84 HB3 ALA 84 31.515 -16.925 19.088 674 H ARG 85 HN ARG 85 31.779 -14.741 22.159 675 HA ARG 85 HA ARG 85 28.904 -14.588 22.915 676 HB2 ARG 85 HB2 ARG 85 31.188 -13.239 24.325 677 HB3 ARG 85 HB1 ARG 85 29.502 -13.240 24.807 678 HG2 ARG 85 HG2 ARG 85 29.647 -15.754 25.043 679 HG3 ARG 85 HG1 ARG 85 31.392 -15.626 24.813 680 HD2 ARG 85 HD2 ARG 85 29.741 -14.348 26.989 681 HD3 ARG 85 HD1 ARG 85 30.970 -15.599 27.181 682 HE ARG 85 HE ARG 85 32.246 -13.434 25.951 683 HH11 ARG 85 HH21 ARG 85 30.596 -14.088 28.946 684 HH12 ARG 85 HH22 ARG 85 31.412 -12.866 29.823 685 HH21 ARG 85 HH11 ARG 85 33.290 -11.786 27.075 686 HH22 ARG 85 HH12 ARG 85 32.971 -11.520 28.728 687 H ASN 86 HN ASN 86 28.229 -12.294 23.199 688 HA ASN 86 HA ASN 86 28.936 -10.755 20.840 689 HB2 ASN 86 HB2 ASN 86 26.582 -10.847 21.807 690 HB3 ASN 86 HB1 ASN 86 27.184 -9.857 23.139 691 HD21 ASN 86 HD21 ASN 86 25.369 -8.394 22.035 692 HD22 ASN 86 HD22 ASN 86 25.929 -7.327 20.846 693 H THR 87 HN THR 87 29.511 -8.447 21.049 694 HA THR 87 HA THR 87 31.230 -7.945 23.374 695 HB THR 87 HB THR 87 32.465 -8.700 21.179 696 HG1 THR 87 HG1 THR 87 34.158 -7.345 21.746 697 HG21 THR 87 HG21 THR 87 31.106 -7.024 19.787 698 HG22 THR 87 HG22 THR 87 32.841 -7.040 19.527 699 HG23 THR 87 HG23 THR 87 32.116 -5.772 20.504 700 H SER 88 HN SER 88 31.759 -5.630 23.608 701 HA SER 88 HA SER 88 29.438 -3.970 22.801 702 HB2 SER 88 HB2 SER 88 30.826 -3.654 25.441 703 HB3 SER 88 HB1 SER 88 29.205 -3.191 24.966 704 HG SER 88 HG SER 88 29.069 -5.684 24.616 705 H LEU 89 HN LEU 89 29.802 -1.628 22.916 706 HA LEU 89 HA LEU 89 32.041 -0.790 21.512 707 HB2 LEU 89 HB2 LEU 89 29.930 0.421 21.529 708 HB3 LEU 89 HB1 LEU 89 30.081 0.748 23.248 709 HG LEU 89 HG LEU 89 32.372 1.516 21.545 710 HD11 LEU 89 HD11 LEU 89 30.126 3.506 21.762 711 HD12 LEU 89 HD12 LEU 89 29.962 2.288 20.516 712 HD13 LEU 89 HD13 LEU 89 31.355 3.373 20.524 713 HD21 LEU 89 HD21 LEU 89 30.927 2.656 23.952 714 HD22 LEU 89 HD22 LEU 89 32.172 3.557 23.113 715 HD23 LEU 89 HD23 LEU 89 32.579 2.039 23.888 716 H ASN 90 HN ASN 90 31.221 -0.715 24.911 717 HA ASN 90 HA ASN 90 34.054 -0.187 25.528 718 HB2 ASN 90 HB2 ASN 90 33.033 0.787 27.743 719 HB3 ASN 90 HB1 ASN 90 33.145 1.778 26.301 720 HD21 ASN 90 HD21 ASN 90 30.782 -0.784 27.015 721 HD22 ASN 90 HD22 ASN 90 29.397 0.209 26.923 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 1.131 -4.688 -0.080 2 H2 MET 1 HT2 MET 1 0.195 -3.304 -0.387 3 H3 MET 1 HT3 MET 1 1.662 -3.172 0.441 4 HA MET 1 HA MET 1 1.213 -2.948 -2.268 5 HB2 MET 1 HB2 MET 1 2.868 -1.682 -1.087 6 HB3 MET 1 HB1 MET 1 3.709 -3.137 -0.554 7 HG2 MET 1 HG2 MET 1 4.276 -3.650 -2.927 8 HG3 MET 1 HG1 MET 1 3.487 -2.149 -3.426 9 HE1 MET 1 HE1 MET 1 3.796 -0.084 -2.372 10 HE2 MET 1 HE2 MET 1 5.378 0.662 -2.380 11 HE3 MET 1 HE3 MET 1 4.727 0.044 -0.875 12 HA PRO 2 HA PRO 2 1.601 -7.311 -3.481 13 HB2 PRO 2 HB2 PRO 2 1.937 -6.902 -6.161 14 HB3 PRO 2 HB1 PRO 2 0.367 -6.843 -5.345 15 HG2 PRO 2 HG2 PRO 2 2.131 -4.570 -6.146 16 HG3 PRO 2 HG1 PRO 2 0.378 -4.739 -6.283 17 HD2 PRO 2 HD2 PRO 2 1.393 -3.277 -4.318 18 HD3 PRO 2 HD1 PRO 2 -0.027 -4.320 -4.045 19 H THR 3 HN THR 3 3.855 -4.830 -4.531 20 HA THR 3 HA THR 3 6.013 -6.732 -4.983 21 HB THR 3 HB THR 3 6.640 -3.830 -4.873 22 HG1 THR 3 HG1 THR 3 4.794 -4.990 -6.683 23 HG21 THR 3 HG21 THR 3 7.055 -5.894 -7.056 24 HG22 THR 3 HG22 THR 3 8.148 -5.653 -5.695 25 HG23 THR 3 HG23 THR 3 7.900 -4.361 -6.845 26 H GLN 4 HN GLN 4 4.793 -6.616 -2.367 27 HA GLN 4 HA GLN 4 6.194 -5.140 -0.470 28 HB2 GLN 4 HB2 GLN 4 5.509 -7.054 1.094 29 HB3 GLN 4 HB1 GLN 4 4.215 -6.208 0.258 30 HG2 GLN 4 HG2 GLN 4 3.655 -8.025 -0.997 31 HG3 GLN 4 HG1 GLN 4 5.325 -8.514 -1.239 32 HE21 GLN 4 HE21 GLN 4 5.216 -10.693 -0.556 33 HE22 GLN 4 HE22 GLN 4 4.725 -11.165 0.996 34 H ASP 5 HN ASP 5 7.407 -6.378 1.318 35 HA ASP 5 HA ASP 5 9.798 -7.667 0.204 36 HB2 ASP 5 HB2 ASP 5 9.028 -6.817 2.998 37 HB3 ASP 5 HB1 ASP 5 10.470 -7.746 2.634 38 H ILE 6 HN ILE 6 10.529 -9.627 1.653 39 HA ILE 6 HA ILE 6 8.164 -11.363 1.947 40 HB ILE 6 HB ILE 6 9.455 -13.209 1.061 41 HG12 ILE 6 HG12 ILE 6 11.632 -11.182 0.448 42 HG13 ILE 6 HG11 ILE 6 11.733 -12.308 1.791 43 HG21 ILE 6 HG21 ILE 6 8.184 -11.603 -0.473 44 HG22 ILE 6 HG22 ILE 6 9.474 -12.518 -1.264 45 HG23 ILE 6 HG23 ILE 6 9.738 -10.839 -0.803 46 HD11 ILE 6 HD11 ILE 6 11.305 -13.187 -1.070 47 HD12 ILE 6 HD12 ILE 6 11.662 -14.202 0.318 48 HD13 ILE 6 HD13 ILE 6 12.886 -13.082 -0.299 49 H ARG 7 HN ARG 7 8.390 -13.070 3.376 50 HA ARG 7 HA ARG 7 9.890 -12.306 5.773 51 HB2 ARG 7 HB2 ARG 7 7.876 -14.548 5.427 52 HB3 ARG 7 HB1 ARG 7 8.555 -13.947 6.920 53 HG2 ARG 7 HG2 ARG 7 7.574 -11.756 6.590 54 HG3 ARG 7 HG1 ARG 7 6.908 -12.226 5.034 55 HD2 ARG 7 HD2 ARG 7 6.251 -13.570 7.665 56 HD3 ARG 7 HD1 ARG 7 5.224 -12.398 6.863 57 HE ARG 7 HE ARG 7 5.611 -14.271 4.913 58 HH11 ARG 7 HH21 ARG 7 4.583 -14.416 8.238 59 HH12 ARG 7 HH22 ARG 7 3.640 -15.825 8.038 60 HH21 ARG 7 HH11 ARG 7 4.404 -16.133 4.620 61 HH22 ARG 7 HH12 ARG 7 3.530 -16.835 5.934 62 H LEU 8 HN LEU 8 11.645 -13.312 6.438 63 HA LEU 8 HA LEU 8 12.431 -15.850 5.181 64 HB2 LEU 8 HB2 LEU 8 13.836 -13.843 4.625 65 HB3 LEU 8 HB1 LEU 8 14.197 -13.673 6.331 66 HG LEU 8 HG LEU 8 15.842 -14.968 4.694 67 HD11 LEU 8 HD11 LEU 8 16.123 -14.564 7.120 68 HD12 LEU 8 HD12 LEU 8 16.760 -16.109 6.561 69 HD13 LEU 8 HD13 LEU 8 15.232 -16.057 7.425 70 HD21 LEU 8 HD21 LEU 8 13.914 -16.648 4.131 71 HD22 LEU 8 HD22 LEU 8 14.260 -17.332 5.733 72 HD23 LEU 8 HD23 LEU 8 15.505 -17.283 4.514 73 H TRP 9 HN TRP 9 12.566 -17.544 6.584 74 HA TRP 9 HA TRP 9 12.418 -17.035 9.477 75 HB2 TRP 9 HB2 TRP 9 12.432 -19.706 8.057 76 HB3 TRP 9 HB1 TRP 9 11.981 -19.383 9.714 77 HD1 TRP 9 HD1 TRP 9 10.182 -16.785 8.994 78 HE1 TRP 9 HE1 TRP 9 7.808 -17.227 7.982 79 HE3 TRP 9 HE3 TRP 9 10.870 -21.470 7.217 80 HZ2 TRP 9 HZ2 TRP 9 6.448 -19.320 6.590 81 HZ3 TRP 9 HZ3 TRP 9 9.084 -22.675 6.054 82 HH2 TRP 9 HH2 TRP 9 6.839 -21.594 5.733 83 H VAL 10 HN VAL 10 14.085 -17.519 10.841 84 HA VAL 10 HA VAL 10 16.439 -18.804 9.627 85 HB VAL 10 HB VAL 10 16.798 -16.786 11.815 86 HG11 VAL 10 HG11 VAL 10 18.674 -18.225 11.201 87 HG12 VAL 10 HG12 VAL 10 19.000 -16.550 10.741 88 HG13 VAL 10 HG13 VAL 10 18.527 -17.714 9.520 89 HG21 VAL 10 HG21 VAL 10 17.051 -14.998 10.227 90 HG22 VAL 10 HG22 VAL 10 15.465 -15.689 9.915 91 HG23 VAL 10 HG23 VAL 10 16.836 -16.088 8.869 92 H SER 11 HN SER 11 17.012 -20.588 10.655 93 HA SER 11 HA SER 11 15.915 -21.114 13.333 94 HB2 SER 11 HB2 SER 11 17.496 -23.038 11.620 95 HB3 SER 11 HB1 SER 11 16.419 -23.392 12.959 96 HG SER 11 HG SER 11 14.873 -23.461 11.535 97 H VAL 12 HN VAL 12 17.140 -20.403 14.937 98 HA VAL 12 HA VAL 12 20.016 -20.128 14.518 99 HB VAL 12 HB VAL 12 18.381 -19.147 16.846 100 HG11 VAL 12 HG11 VAL 12 20.653 -17.558 15.886 101 HG12 VAL 12 HG12 VAL 12 21.116 -19.160 16.457 102 HG13 VAL 12 HG13 VAL 12 20.229 -18.068 17.511 103 HG21 VAL 12 HG21 VAL 12 17.315 -17.749 15.421 104 HG22 VAL 12 HG22 VAL 12 18.299 -18.251 14.057 105 HG23 VAL 12 HG23 VAL 12 18.858 -16.967 15.124 106 H GLU 13 HN GLU 13 21.332 -21.650 15.295 107 HA GLU 13 HA GLU 13 20.476 -23.091 17.706 108 HB2 GLU 13 HB2 GLU 13 22.089 -24.139 15.395 109 HB3 GLU 13 HB1 GLU 13 22.092 -24.924 16.971 110 HG2 GLU 13 HG2 GLU 13 19.624 -25.080 16.897 111 HG3 GLU 13 HG1 GLU 13 19.605 -24.362 15.317 112 H ASP 14 HN ASP 14 21.491 -22.689 19.411 113 HA ASP 14 HA ASP 14 23.988 -21.200 19.447 114 HB2 ASP 14 HB2 ASP 14 22.139 -20.680 20.985 115 HB3 ASP 14 HB1 ASP 14 22.371 -22.263 21.760 116 H ALA 15 HN ALA 15 25.872 -21.892 20.166 117 HA ALA 15 HA ALA 15 26.686 -24.611 19.949 118 HB1 ALA 15 HB1 ALA 15 28.705 -23.772 21.308 119 HB2 ALA 15 HB2 ALA 15 27.875 -22.216 21.297 120 HB3 ALA 15 HB3 ALA 15 28.379 -22.945 19.775 121 H GLN 16 HN GLN 16 25.286 -22.715 22.434 122 HA GLN 16 HA GLN 16 25.818 -24.564 24.615 123 HB2 GLN 16 HB2 GLN 16 23.853 -22.282 24.418 124 HB3 GLN 16 HB1 GLN 16 24.364 -23.092 25.902 125 HG2 GLN 16 HG2 GLN 16 26.212 -21.566 24.033 126 HG3 GLN 16 HG1 GLN 16 25.561 -20.935 25.536 127 HE21 GLN 16 HE21 GLN 16 28.255 -22.512 24.269 128 HE22 GLN 16 HE22 GLN 16 28.857 -23.172 25.704 129 H MET 17 HN MET 17 24.096 -24.937 21.925 130 HA MET 17 HA MET 17 22.535 -26.364 21.242 131 HB2 MET 17 HB2 MET 17 22.558 -27.328 24.115 132 HB3 MET 17 HB1 MET 17 21.608 -28.060 22.834 133 HG2 MET 17 HG2 MET 17 23.607 -28.480 21.506 134 HG3 MET 17 HG1 MET 17 24.606 -27.676 22.717 135 HE1 MET 17 HE1 MET 17 22.369 -30.511 21.723 136 HE2 MET 17 HE2 MET 17 21.497 -30.193 23.216 137 HE3 MET 17 HE3 MET 17 22.411 -31.678 23.053 138 H HIS 18 HN HIS 18 21.823 -23.821 21.720 139 HA HIS 18 HA HIS 18 19.012 -24.020 22.679 140 HB2 HIS 18 HB2 HIS 18 20.551 -21.469 22.045 141 HB3 HIS 18 HB1 HIS 18 18.952 -21.610 22.720 142 HD1 HIS 18 HD1 HIS 18 22.259 -20.963 23.868 143 HD2 HIS 18 HD2 HIS 18 19.142 -23.391 25.276 144 HE1 HIS 18 HE1 HIS 18 22.727 -21.418 26.310 145 HE2 HIS 18 HE2 HIS 18 20.855 -22.935 27.164 146 H THR 19 HN THR 19 17.485 -24.105 21.138 147 HA THR 19 HA THR 19 18.257 -23.402 18.376 148 HB THR 19 HB THR 19 15.991 -25.220 19.229 149 HG1 THR 19 HG1 THR 19 17.764 -26.274 19.888 150 HG21 THR 19 HG21 THR 19 16.165 -24.088 16.883 151 HG22 THR 19 HG22 THR 19 15.838 -25.806 16.968 152 HG23 THR 19 HG23 THR 19 17.461 -25.239 16.594 153 H VAL 20 HN VAL 20 17.353 -21.570 17.654 154 HA VAL 20 HA VAL 20 14.718 -20.773 18.725 155 HB VAL 20 HB VAL 20 16.790 -18.747 17.974 156 HG11 VAL 20 HG11 VAL 20 14.315 -18.211 18.338 157 HG12 VAL 20 HG12 VAL 20 15.479 -17.251 19.245 158 HG13 VAL 20 HG13 VAL 20 14.610 -18.553 20.042 159 HG21 VAL 20 HG21 VAL 20 18.035 -19.818 19.663 160 HG22 VAL 20 HG22 VAL 20 16.592 -20.339 20.538 161 HG23 VAL 20 HG23 VAL 20 17.102 -18.660 20.603 162 H THR 21 HN THR 21 13.307 -20.011 17.308 163 HA THR 21 HA THR 21 14.075 -19.905 14.446 164 HB THR 21 HB THR 21 11.261 -19.959 15.550 165 HG1 THR 21 HG1 THR 21 11.666 -21.897 16.069 166 HG21 THR 21 HG21 THR 21 10.695 -20.694 13.288 167 HG22 THR 21 HG22 THR 21 12.393 -20.710 12.829 168 HG23 THR 21 HG23 THR 21 11.596 -19.192 13.213 169 H ILE 22 HN ILE 22 14.146 -17.896 13.540 170 HA ILE 22 HA ILE 22 12.538 -15.794 14.829 171 HB ILE 22 HB ILE 22 14.303 -14.153 14.451 172 HG12 ILE 22 HG12 ILE 22 16.019 -16.508 13.613 173 HG13 ILE 22 HG11 ILE 22 15.316 -15.323 12.491 174 HG21 ILE 22 HG21 ILE 22 15.736 -14.793 16.236 175 HG22 ILE 22 HG22 ILE 22 15.580 -16.497 15.862 176 HG23 ILE 22 HG23 ILE 22 14.218 -15.628 16.575 177 HD11 ILE 22 HD11 ILE 22 17.020 -14.428 14.818 178 HD12 ILE 22 HD12 ILE 22 16.643 -13.562 13.332 179 HD13 ILE 22 HD13 ILE 22 17.757 -14.928 13.297 180 H TRP 23 HN TRP 23 11.773 -14.211 13.483 181 HA TRP 23 HA TRP 23 11.607 -14.992 10.633 182 HB2 TRP 23 HB2 TRP 23 9.610 -13.612 12.444 183 HB3 TRP 23 HB1 TRP 23 9.426 -13.708 10.699 184 HD1 TRP 23 HD1 TRP 23 8.431 -15.862 9.735 185 HE1 TRP 23 HE1 TRP 23 7.785 -18.163 10.690 186 HE3 TRP 23 HE3 TRP 23 10.325 -15.421 14.450 187 HZ2 TRP 23 HZ2 TRP 23 8.021 -19.613 13.109 188 HZ3 TRP 23 HZ3 TRP 23 10.092 -17.284 16.069 189 HH2 TRP 23 HH2 TRP 23 8.942 -19.381 15.404 190 H LEU 24 HN LEU 24 12.461 -13.602 9.207 191 HA LEU 24 HA LEU 24 12.728 -10.749 9.978 192 HB2 LEU 24 HB2 LEU 24 14.581 -12.288 8.118 193 HB3 LEU 24 HB1 LEU 24 14.748 -10.641 8.678 194 HG LEU 24 HG LEU 24 14.790 -13.056 10.519 195 HD11 LEU 24 HD11 LEU 24 17.159 -11.306 9.994 196 HD12 LEU 24 HD12 LEU 24 16.783 -12.608 8.859 197 HD13 LEU 24 HD13 LEU 24 17.085 -12.967 10.554 198 HD21 LEU 24 HD21 LEU 24 14.624 -10.140 10.966 199 HD22 LEU 24 HD22 LEU 24 15.984 -10.890 11.785 200 HD23 LEU 24 HD23 LEU 24 14.355 -11.473 12.086 201 H THR 25 HN THR 25 11.909 -9.303 8.462 202 HA THR 25 HA THR 25 10.896 -10.498 5.959 203 HB THR 25 HB THR 25 9.843 -7.992 7.312 204 HG1 THR 25 HG1 THR 25 9.286 -9.702 8.559 205 HG21 THR 25 HG21 THR 25 8.580 -9.682 5.144 206 HG22 THR 25 HG22 THR 25 9.576 -8.276 4.785 207 HG23 THR 25 HG23 THR 25 8.088 -8.088 5.703 208 H VAL 26 HN VAL 26 11.905 -9.937 4.193 209 HA VAL 26 HA VAL 26 13.080 -7.291 3.866 210 HB VAL 26 HB VAL 26 15.281 -8.288 3.214 211 HG11 VAL 26 HG11 VAL 26 14.655 -9.062 6.063 212 HG12 VAL 26 HG12 VAL 26 14.689 -7.368 5.567 213 HG13 VAL 26 HG13 VAL 26 16.134 -8.361 5.416 214 HG21 VAL 26 HG21 VAL 26 14.626 -10.567 2.759 215 HG22 VAL 26 HG22 VAL 26 14.000 -10.782 4.393 216 HG23 VAL 26 HG23 VAL 26 15.733 -10.618 4.129 217 H ARG 27 HN ARG 27 14.180 -7.284 1.619 218 HA ARG 27 HA ARG 27 12.353 -8.588 -0.268 219 HB2 ARG 27 HB2 ARG 27 13.586 -7.073 -1.939 220 HB3 ARG 27 HB1 ARG 27 12.520 -6.279 -0.795 221 HG2 ARG 27 HG2 ARG 27 15.340 -6.655 0.118 222 HG3 ARG 27 HG1 ARG 27 15.102 -5.524 -1.195 223 HD2 ARG 27 HD2 ARG 27 13.146 -5.201 1.023 224 HD3 ARG 27 HD1 ARG 27 14.803 -4.929 1.448 225 HE ARG 27 HE ARG 27 14.996 -3.294 -0.306 226 HH11 ARG 27 HH21 ARG 27 11.693 -4.316 0.497 227 HH12 ARG 27 HH22 ARG 27 11.006 -2.868 -0.074 228 HH21 ARG 27 HH11 ARG 27 13.978 -1.374 -1.086 229 HH22 ARG 27 HH12 ARG 27 12.282 -1.199 -0.967 230 HA PRO 28 HA PRO 28 15.493 -11.603 -1.470 231 HB2 PRO 28 HB2 PRO 28 14.583 -10.994 -4.243 232 HB3 PRO 28 HB1 PRO 28 14.710 -12.561 -3.398 233 HG2 PRO 28 HG2 PRO 28 12.349 -11.507 -3.806 234 HG3 PRO 28 HG1 PRO 28 12.741 -12.270 -2.261 235 HD2 PRO 28 HD2 PRO 28 12.561 -9.330 -2.858 236 HD3 PRO 28 HD1 PRO 28 12.057 -10.239 -1.409 237 H ASP 29 HN ASP 29 15.128 -8.461 -2.838 238 HA ASP 29 HA ASP 29 17.539 -8.221 -4.314 239 HB2 ASP 29 HB2 ASP 29 15.578 -6.698 -4.577 240 HB3 ASP 29 HB1 ASP 29 15.937 -6.021 -2.998 241 H MET 30 HN MET 30 16.765 -8.086 -0.953 242 HA MET 30 HA MET 30 18.994 -6.490 -0.101 243 HB2 MET 30 HB2 MET 30 16.777 -7.820 1.194 244 HB3 MET 30 HB1 MET 30 18.287 -8.266 1.981 245 HG2 MET 30 HG2 MET 30 17.989 -5.382 1.319 246 HG3 MET 30 HG1 MET 30 16.934 -6.003 2.582 247 HE1 MET 30 HE1 MET 30 18.022 -8.023 4.068 248 HE2 MET 30 HE2 MET 30 17.747 -6.585 5.033 249 HE3 MET 30 HE3 MET 30 19.259 -7.456 5.197 250 H THR 31 HN THR 31 20.536 -7.383 1.482 251 HA THR 31 HA THR 31 21.918 -9.648 0.222 252 HB THR 31 HB THR 31 22.797 -6.978 1.221 253 HG1 THR 31 HG1 THR 31 24.034 -8.432 -0.810 254 HG21 THR 31 HG21 THR 31 25.079 -7.684 1.431 255 HG22 THR 31 HG22 THR 31 24.609 -9.360 1.061 256 HG23 THR 31 HG23 THR 31 24.065 -8.589 2.557 257 H VAL 32 HN VAL 32 22.872 -11.196 1.529 258 HA VAL 32 HA VAL 32 21.604 -11.781 3.966 259 HB VAL 32 HB VAL 32 24.231 -12.840 2.878 260 HG11 VAL 32 HG11 VAL 32 24.306 -13.483 5.115 261 HG12 VAL 32 HG12 VAL 32 23.485 -14.849 4.374 262 HG13 VAL 32 HG13 VAL 32 22.556 -13.637 5.246 263 HG21 VAL 32 HG21 VAL 32 22.281 -13.225 1.405 264 HG22 VAL 32 HG22 VAL 32 21.413 -13.973 2.762 265 HG23 VAL 32 HG23 VAL 32 22.863 -14.728 2.117 266 H ALA 33 HN ALA 33 24.784 -10.415 3.280 267 HA ALA 33 HA ALA 33 25.748 -10.166 5.900 268 HB1 ALA 33 HB1 ALA 33 27.165 -8.385 5.073 269 HB2 ALA 33 HB2 ALA 33 26.151 -8.178 3.644 270 HB3 ALA 33 HB3 ALA 33 27.070 -9.669 3.876 271 H SER 34 HN SER 34 23.700 -7.949 4.044 272 HA SER 34 HA SER 34 23.322 -6.024 6.088 273 HB2 SER 34 HB2 SER 34 21.253 -6.768 4.053 274 HB3 SER 34 HB1 SER 34 21.606 -5.183 4.733 275 HG SER 34 HG SER 34 23.809 -5.704 3.673 276 H LEU 35 HN LEU 35 21.645 -8.987 5.175 277 HA LEU 35 HA LEU 35 19.547 -8.830 7.073 278 HB2 LEU 35 HB2 LEU 35 19.468 -10.347 5.122 279 HB3 LEU 35 HB1 LEU 35 20.816 -11.263 5.790 280 HG LEU 35 HG LEU 35 19.489 -11.888 7.734 281 HD11 LEU 35 HD11 LEU 35 17.906 -10.402 8.292 282 HD12 LEU 35 HD12 LEU 35 16.872 -11.278 7.162 283 HD13 LEU 35 HD13 LEU 35 17.687 -9.806 6.648 284 HD21 LEU 35 HD21 LEU 35 18.145 -12.352 5.052 285 HD22 LEU 35 HD22 LEU 35 17.723 -13.217 6.525 286 HD23 LEU 35 HD23 LEU 35 19.341 -13.383 5.846 287 H LYS 36 HN LYS 36 22.713 -10.334 7.130 288 HA LYS 36 HA LYS 36 22.664 -11.520 9.704 289 HB2 LYS 36 HB2 LYS 36 24.877 -10.359 8.018 290 HB3 LYS 36 HB1 LYS 36 25.170 -11.181 9.543 291 HG2 LYS 36 HG2 LYS 36 24.271 -13.252 8.708 292 HG3 LYS 36 HG1 LYS 36 23.636 -12.485 7.262 293 HD2 LYS 36 HD2 LYS 36 25.727 -13.705 6.770 294 HD3 LYS 36 HD1 LYS 36 25.903 -11.971 6.498 295 HE2 LYS 36 HE2 LYS 36 27.001 -11.763 8.724 296 HE3 LYS 36 HE1 LYS 36 26.880 -13.510 8.943 297 HZ1 LYS 36 HZ1 LYS 36 28.359 -13.841 7.083 298 HZ2 LYS 36 HZ2 LYS 36 29.028 -12.672 8.081 299 HZ3 LYS 36 HZ3 LYS 36 28.319 -12.196 6.653 300 H ASP 37 HN ASP 37 23.560 -8.346 8.537 301 HA ASP 37 HA ASP 37 24.551 -7.258 10.920 302 HB2 ASP 37 HB2 ASP 37 24.757 -6.278 8.621 303 HB3 ASP 37 HB1 ASP 37 23.087 -5.753 8.769 304 H MET 38 HN MET 38 21.231 -7.155 9.595 305 HA MET 38 HA MET 38 20.117 -5.546 11.630 306 HB2 MET 38 HB2 MET 38 18.301 -7.625 10.610 307 HB3 MET 38 HB1 MET 38 18.138 -5.887 10.684 308 HG2 MET 38 HG2 MET 38 19.750 -5.697 8.780 309 HG3 MET 38 HG1 MET 38 19.651 -7.453 8.624 310 HE1 MET 38 HE1 MET 38 16.019 -7.722 9.285 311 HE2 MET 38 HE2 MET 38 17.501 -8.611 9.060 312 HE3 MET 38 HE3 MET 38 16.348 -8.515 7.747 313 H VAL 39 HN VAL 39 20.529 -8.970 11.332 314 HA VAL 39 HA VAL 39 18.948 -9.802 13.438 315 HB VAL 39 HB VAL 39 21.577 -11.011 12.539 316 HG11 VAL 39 HG11 VAL 39 19.269 -12.468 13.830 317 HG12 VAL 39 HG12 VAL 39 20.568 -11.810 14.814 318 HG13 VAL 39 HG13 VAL 39 20.907 -13.034 13.591 319 HG21 VAL 39 HG21 VAL 39 20.485 -11.794 10.728 320 HG22 VAL 39 HG22 VAL 39 19.207 -10.646 11.100 321 HG23 VAL 39 HG23 VAL 39 19.095 -12.306 11.685 322 H PHE 40 HN PHE 40 22.273 -8.665 13.406 323 HA PHE 40 HA PHE 40 22.810 -8.989 16.180 324 HB2 PHE 40 HB2 PHE 40 24.632 -8.600 14.670 325 HB3 PHE 40 HB1 PHE 40 23.928 -7.075 14.124 326 HD1 PHE 40 HD2 PHE 40 24.981 -8.783 17.311 327 HD2 PHE 40 HD1 PHE 40 24.664 -5.090 15.132 328 HE1 PHE 40 HE2 PHE 40 26.147 -7.604 19.135 329 HE2 PHE 40 HE1 PHE 40 25.820 -3.916 16.970 330 HZ PHE 40 HZ PHE 40 26.563 -5.175 18.973 331 H LEU 41 HN LEU 41 21.521 -6.332 14.223 332 HA LEU 41 HA LEU 41 21.251 -4.403 16.269 333 HB2 LEU 41 HB2 LEU 41 19.443 -4.853 13.866 334 HB3 LEU 41 HB1 LEU 41 19.583 -3.380 14.800 335 HG LEU 41 HG LEU 41 21.807 -4.679 13.254 336 HD11 LEU 41 HD11 LEU 41 21.506 -3.061 11.575 337 HD12 LEU 41 HD12 LEU 41 20.512 -2.029 12.606 338 HD13 LEU 41 HD13 LEU 41 19.860 -3.538 11.979 339 HD21 LEU 41 HD21 LEU 41 22.942 -3.533 14.853 340 HD22 LEU 41 HD22 LEU 41 21.661 -2.329 15.106 341 HD23 LEU 41 HD23 LEU 41 22.722 -2.224 13.695 342 H ASP 42 HN ASP 42 19.143 -6.779 14.919 343 HA ASP 42 HA ASP 42 16.897 -6.158 16.583 344 HB2 ASP 42 HB2 ASP 42 16.865 -7.159 14.225 345 HB3 ASP 42 HB1 ASP 42 17.122 -8.704 15.019 346 H TYR 43 HN TYR 43 19.150 -8.931 16.594 347 HA TYR 43 HA TYR 43 17.889 -9.835 19.126 348 HB2 TYR 43 HB2 TYR 43 19.550 -11.440 17.166 349 HB3 TYR 43 HB1 TYR 43 18.724 -12.034 18.601 350 HD1 TYR 43 HD2 TYR 43 16.214 -11.961 18.765 351 HD2 TYR 43 HD1 TYR 43 18.330 -10.969 15.155 352 HE1 TYR 43 HE2 TYR 43 14.121 -12.164 17.483 353 HE2 TYR 43 HE1 TYR 43 16.235 -11.172 13.875 354 HH TYR 43 HH TYR 43 13.726 -10.852 14.605 355 H GLY 44 HN GLY 44 20.716 -8.291 18.068 356 HA2 GLY 44 HA2 GLY 44 22.599 -7.731 19.252 357 HA3 GLY 44 HA1 GLY 44 21.950 -8.590 20.643 358 H PHE 45 HN PHE 45 22.024 -10.308 17.692 359 HA PHE 45 HA PHE 45 23.875 -12.232 18.771 360 HB2 PHE 45 HB2 PHE 45 22.461 -12.026 16.102 361 HB3 PHE 45 HB1 PHE 45 23.578 -13.323 16.504 362 HD1 PHE 45 HD1 PHE 45 21.940 -12.242 19.523 363 HD2 PHE 45 HD2 PHE 45 21.316 -14.633 15.966 364 HE1 PHE 45 HE1 PHE 45 20.169 -13.459 20.652 365 HE2 PHE 45 HE2 PHE 45 19.508 -15.853 17.144 366 HZ PHE 45 HZ PHE 45 18.932 -15.281 19.470 367 HA PRO 46 HA PRO 46 27.209 -9.560 17.334 368 HB2 PRO 46 HB2 PRO 46 29.286 -11.094 18.247 369 HB3 PRO 46 HB1 PRO 46 28.315 -10.024 19.261 370 HG2 PRO 46 HG2 PRO 46 27.996 -12.959 18.869 371 HG3 PRO 46 HG1 PRO 46 28.008 -12.056 20.387 372 HD2 PRO 46 HD2 PRO 46 25.686 -12.788 19.349 373 HD3 PRO 46 HD1 PRO 46 25.863 -11.151 20.038 374 HA PRO 47 HA PRO 47 28.238 -11.271 13.397 375 HB2 PRO 47 HB2 PRO 47 30.814 -10.396 13.097 376 HB3 PRO 47 HB1 PRO 47 29.378 -9.377 12.814 377 HG2 PRO 47 HG2 PRO 47 31.151 -9.551 15.210 378 HG3 PRO 47 HG1 PRO 47 30.423 -8.119 14.452 379 HD2 PRO 47 HD2 PRO 47 29.383 -9.109 16.680 380 HD3 PRO 47 HD1 PRO 47 28.311 -8.510 15.386 381 H VAL 48 HN VAL 48 30.525 -11.786 15.991 382 HA VAL 48 HA VAL 48 32.035 -13.867 14.813 383 HB VAL 48 HB VAL 48 32.760 -12.749 16.861 384 HG11 VAL 48 HG11 VAL 48 31.573 -12.627 18.810 385 HG12 VAL 48 HG12 VAL 48 30.742 -14.144 18.543 386 HG13 VAL 48 HG13 VAL 48 30.227 -12.688 17.675 387 HG21 VAL 48 HG21 VAL 48 33.254 -14.750 18.276 388 HG22 VAL 48 HG22 VAL 48 33.590 -15.020 16.579 389 HG23 VAL 48 HG23 VAL 48 32.130 -15.699 17.305 390 H LEU 49 HN LEU 49 29.152 -13.872 16.818 391 HA LEU 49 HA LEU 49 28.689 -16.715 16.576 392 HB2 LEU 49 HB2 LEU 49 26.888 -14.516 17.609 393 HB3 LEU 49 HB1 LEU 49 26.542 -16.239 17.681 394 HG LEU 49 HG LEU 49 28.953 -14.924 18.977 395 HD11 LEU 49 HD11 LEU 49 26.893 -16.263 20.612 396 HD12 LEU 49 HD12 LEU 49 26.420 -14.719 19.918 397 HD13 LEU 49 HD13 LEU 49 27.865 -14.839 20.930 398 HD21 LEU 49 HD21 LEU 49 29.416 -17.217 18.303 399 HD22 LEU 49 HD22 LEU 49 27.902 -17.776 19.052 400 HD23 LEU 49 HD23 LEU 49 29.206 -17.153 20.041 401 H GLN 50 HN GLN 50 27.533 -13.807 15.060 402 HA GLN 50 HA GLN 50 25.306 -14.788 13.748 403 HB2 GLN 50 HB2 GLN 50 26.078 -12.364 13.924 404 HB3 GLN 50 HB1 GLN 50 27.189 -12.748 12.608 405 HG2 GLN 50 HG2 GLN 50 25.327 -11.845 11.493 406 HG3 GLN 50 HG1 GLN 50 25.101 -13.570 11.314 407 HE21 GLN 50 HE21 GLN 50 24.368 -11.268 14.030 408 HE22 GLN 50 HE22 GLN 50 22.746 -11.748 14.142 409 H GLN 51 HN GLN 51 26.471 -17.000 13.339 410 HA GLN 51 HA GLN 51 27.678 -16.994 10.645 411 HB2 GLN 51 HB2 GLN 51 27.427 -19.320 12.574 412 HB3 GLN 51 HB1 GLN 51 28.357 -19.275 11.091 413 HG2 GLN 51 HG2 GLN 51 28.884 -17.607 13.571 414 HG3 GLN 51 HG1 GLN 51 29.866 -18.928 12.962 415 HE21 GLN 51 HE21 GLN 51 30.201 -15.777 13.204 416 HE22 GLN 51 HE22 GLN 51 30.887 -15.372 11.716 417 H TRP 52 HN TRP 52 26.336 -17.174 9.060 418 HA TRP 52 HA TRP 52 23.684 -18.348 9.475 419 HB2 TRP 52 HB2 TRP 52 24.881 -16.369 7.575 420 HB3 TRP 52 HB1 TRP 52 23.476 -17.294 7.062 421 HD1 TRP 52 HD1 TRP 52 24.477 -15.409 10.293 422 HE1 TRP 52 HE1 TRP 52 22.431 -14.077 11.106 423 HE3 TRP 52 HE3 TRP 52 21.146 -16.714 6.675 424 HZ2 TRP 52 HZ2 TRP 52 19.685 -13.632 10.278 425 HZ3 TRP 52 HZ3 TRP 52 18.841 -15.826 6.702 426 HH2 TRP 52 HH2 TRP 52 18.113 -14.288 8.499 427 H VAL 53 HN VAL 53 23.048 -20.160 8.456 428 HA VAL 53 HA VAL 53 24.862 -21.296 6.417 429 HB VAL 53 HB VAL 53 22.965 -23.024 7.966 430 HG11 VAL 53 HG11 VAL 53 24.399 -23.756 5.965 431 HG12 VAL 53 HG12 VAL 53 24.419 -24.754 7.418 432 HG13 VAL 53 HG13 VAL 53 25.751 -23.664 7.092 433 HG21 VAL 53 HG21 VAL 53 24.031 -21.969 9.830 434 HG22 VAL 53 HG22 VAL 53 25.580 -21.888 8.996 435 HG23 VAL 53 HG23 VAL 53 24.957 -23.441 9.556 436 H ILE 54 HN ILE 54 23.978 -21.343 4.486 437 HA ILE 54 HA ILE 54 21.111 -21.786 4.185 438 HB ILE 54 HB ILE 54 22.613 -19.561 2.699 439 HG12 ILE 54 HG12 ILE 54 20.239 -19.362 4.571 440 HG13 ILE 54 HG11 ILE 54 21.893 -19.103 5.125 441 HG21 ILE 54 HG21 ILE 54 20.299 -19.074 1.854 442 HG22 ILE 54 HG22 ILE 54 19.823 -20.656 2.433 443 HG23 ILE 54 HG23 ILE 54 21.058 -20.511 1.174 444 HD11 ILE 54 HD11 ILE 54 20.705 -16.982 4.480 445 HD12 ILE 54 HD12 ILE 54 20.622 -17.583 2.832 446 HD13 ILE 54 HD13 ILE 54 22.190 -17.265 3.574 447 H GLY 55 HN GLY 55 20.744 -23.328 2.647 448 HA2 GLY 55 HA2 GLY 55 22.852 -24.861 1.609 449 HA3 GLY 55 HA1 GLY 55 21.201 -24.867 0.980 450 H GLN 56 HN GLN 56 20.973 -22.271 0.206 451 HA GLN 56 HA GLN 56 22.562 -22.215 -2.244 452 HB2 GLN 56 HB2 GLN 56 20.322 -20.491 -1.236 453 HB3 GLN 56 HB1 GLN 56 21.062 -20.323 -2.836 454 HG2 GLN 56 HG2 GLN 56 19.764 -22.839 -1.782 455 HG3 GLN 56 HG1 GLN 56 18.971 -21.705 -2.877 456 HE21 GLN 56 HE21 GLN 56 20.661 -24.588 -2.918 457 HE22 GLN 56 HE22 GLN 56 21.302 -24.495 -4.485 458 H ARG 57 HN ARG 57 23.618 -21.578 0.546 459 HA ARG 57 HA ARG 57 24.283 -18.788 0.408 460 HB2 ARG 57 HB2 ARG 57 24.297 -20.207 2.599 461 HB3 ARG 57 HB1 ARG 57 25.832 -20.811 2.010 462 HG2 ARG 57 HG2 ARG 57 26.752 -18.531 1.901 463 HG3 ARG 57 HG1 ARG 57 25.211 -17.879 2.447 464 HD2 ARG 57 HD2 ARG 57 26.716 -18.058 4.366 465 HD3 ARG 57 HD1 ARG 57 25.404 -19.187 4.546 466 HE ARG 57 HE ARG 57 26.872 -20.971 4.188 467 HH11 ARG 57 HH21 ARG 57 28.438 -17.900 3.653 468 HH12 ARG 57 HH22 ARG 57 30.011 -18.547 3.606 469 HH21 ARG 57 HH11 ARG 57 28.989 -21.855 4.096 470 HH22 ARG 57 HH12 ARG 57 30.311 -20.815 3.849 471 H LEU 58 HN LEU 58 26.035 -17.856 -0.406 472 HA LEU 58 HA LEU 58 28.125 -19.501 -1.699 473 HB2 LEU 58 HB2 LEU 58 27.242 -16.669 -2.376 474 HB3 LEU 58 HB1 LEU 58 28.512 -17.578 -3.181 475 HG LEU 58 HG LEU 58 25.585 -18.423 -3.106 476 HD11 LEU 58 HD11 LEU 58 25.531 -17.776 -5.457 477 HD12 LEU 58 HD12 LEU 58 27.206 -17.248 -5.382 478 HD13 LEU 58 HD13 LEU 58 25.970 -16.393 -4.465 479 HD21 LEU 58 HD21 LEU 58 26.751 -20.424 -3.441 480 HD22 LEU 58 HD22 LEU 58 28.120 -19.625 -4.216 481 HD23 LEU 58 HD23 LEU 58 26.620 -19.853 -5.101 482 H ALA 59 HN ALA 59 30.292 -18.553 -1.448 483 HA ALA 59 HA ALA 59 30.842 -17.751 1.207 484 HB1 ALA 59 HB1 ALA 59 32.537 -17.766 -1.293 485 HB2 ALA 59 HB2 ALA 59 32.631 -18.817 0.126 486 HB3 ALA 59 HB3 ALA 59 33.157 -17.150 0.240 487 H ARG 60 HN ARG 60 28.923 -15.994 -0.030 488 HA ARG 60 HA ARG 60 30.143 -13.434 0.575 489 HB2 ARG 60 HB2 ARG 60 28.699 -14.102 -1.985 490 HB3 ARG 60 HB1 ARG 60 28.844 -12.456 -1.385 491 HG2 ARG 60 HG2 ARG 60 31.229 -12.588 -1.398 492 HG3 ARG 60 HG1 ARG 60 31.158 -14.307 -1.847 493 HD2 ARG 60 HD2 ARG 60 31.612 -12.924 -3.844 494 HD3 ARG 60 HD1 ARG 60 30.054 -13.727 -3.950 495 HE ARG 60 HE ARG 60 30.165 -10.949 -2.944 496 HH11 ARG 60 HH21 ARG 60 29.295 -13.243 -5.436 497 HH12 ARG 60 HH22 ARG 60 28.204 -12.163 -6.197 498 HH21 ARG 60 HH11 ARG 60 28.725 -9.519 -4.023 499 HH22 ARG 60 HH12 ARG 60 27.924 -10.051 -5.432 500 H ASP 61 HN ASP 61 28.980 -13.139 2.369 501 HA ASP 61 HA ASP 61 26.127 -13.547 2.490 502 HB2 ASP 61 HB2 ASP 61 26.246 -12.118 4.524 503 HB3 ASP 61 HB1 ASP 61 27.303 -13.510 4.617 504 H GLN 62 HN GLN 62 28.272 -11.473 1.090 505 HA GLN 62 HA GLN 62 26.867 -9.009 0.982 506 HB2 GLN 62 HB2 GLN 62 28.966 -10.212 -0.849 507 HB3 GLN 62 HB1 GLN 62 28.417 -8.545 -0.891 508 HG2 GLN 62 HG2 GLN 62 29.180 -8.123 1.344 509 HG3 GLN 62 HG1 GLN 62 29.555 -9.815 1.615 510 HE21 GLN 62 HE21 GLN 62 31.775 -10.010 1.637 511 HE22 GLN 62 HE22 GLN 62 32.829 -9.291 0.525 512 H GLU 63 HN GLU 63 26.869 -11.971 -0.980 513 HA GLU 63 HA GLU 63 25.490 -11.032 -3.205 514 HB2 GLU 63 HB2 GLU 63 25.851 -13.715 -1.982 515 HB3 GLU 63 HB1 GLU 63 24.495 -13.552 -3.083 516 HG2 GLU 63 HG2 GLU 63 27.313 -12.687 -3.740 517 HG3 GLU 63 HG1 GLU 63 26.634 -14.235 -4.215 518 H THR 64 HN THR 64 23.334 -11.157 -3.849 519 HA THR 64 HA THR 64 21.546 -10.028 -2.018 520 HB THR 64 HB THR 64 19.945 -10.930 -4.059 521 HG1 THR 64 HG1 THR 64 21.776 -11.871 -5.111 522 HG21 THR 64 HG21 THR 64 21.261 -8.533 -4.919 523 HG22 THR 64 HG22 THR 64 21.062 -8.474 -3.167 524 HG23 THR 64 HG23 THR 64 19.677 -8.740 -4.199 525 H LEU 65 HN LEU 65 19.560 -10.809 -1.242 526 HA LEU 65 HA LEU 65 19.629 -13.416 -0.125 527 HB2 LEU 65 HB2 LEU 65 17.318 -11.488 -0.512 528 HB3 LEU 65 HB1 LEU 65 17.247 -12.952 0.467 529 HG LEU 65 HG LEU 65 19.154 -10.652 0.912 530 HD11 LEU 65 HD11 LEU 65 16.646 -11.499 2.346 531 HD12 LEU 65 HD12 LEU 65 16.885 -10.008 1.441 532 HD13 LEU 65 HD13 LEU 65 17.755 -10.272 2.957 533 HD21 LEU 65 HD21 LEU 65 20.208 -12.579 1.772 534 HD22 LEU 65 HD22 LEU 65 18.697 -13.293 2.346 535 HD23 LEU 65 HD23 LEU 65 19.393 -11.899 3.169 536 H HIS 66 HN HIS 66 18.047 -12.017 -2.932 537 HA HIS 66 HA HIS 66 16.585 -14.261 -3.784 538 HB2 HIS 66 HB2 HIS 66 16.397 -11.956 -4.790 539 HB3 HIS 66 HB1 HIS 66 17.928 -12.235 -5.599 540 HD1 HIS 66 HD1 HIS 66 18.006 -13.977 -7.521 541 HD2 HIS 66 HD2 HIS 66 14.188 -13.509 -5.854 542 HE1 HIS 66 HE1 HIS 66 16.362 -15.136 -9.067 543 HE2 HIS 66 HE2 HIS 66 14.068 -14.860 -8.078 544 H SER 67 HN SER 67 19.976 -13.384 -4.275 545 HA SER 67 HA SER 67 20.706 -15.365 -6.126 546 HB2 SER 67 HB2 SER 67 22.417 -14.392 -3.820 547 HB3 SER 67 HB1 SER 67 22.950 -15.077 -5.331 548 HG SER 67 HG SER 67 23.111 -12.921 -5.483 549 H HIS 68 HN HIS 68 20.103 -15.505 -2.689 550 HA HIS 68 HA HIS 68 21.030 -18.236 -2.513 551 HB2 HIS 68 HB2 HIS 68 19.684 -16.517 -0.424 552 HB3 HIS 68 HB1 HIS 68 20.497 -18.060 -0.148 553 HD1 HIS 68 HD1 HIS 68 23.091 -18.063 -1.274 554 HD2 HIS 68 HD2 HIS 68 21.462 -14.406 -0.091 555 HE1 HIS 68 HE1 HIS 68 25.042 -16.416 -1.041 556 HE2 HIS 68 HE2 HIS 68 24.044 -14.192 -0.334 557 H GLY 69 HN GLY 69 18.504 -17.006 -3.941 558 HA2 GLY 69 HA2 GLY 69 16.773 -18.135 -4.876 559 HA3 GLY 69 HA1 GLY 69 17.155 -19.515 -3.867 560 H VAL 70 HN VAL 70 16.715 -16.657 -2.014 561 HA VAL 70 HA VAL 70 14.178 -17.716 -1.096 562 HB VAL 70 HB VAL 70 15.751 -16.745 0.515 563 HG11 VAL 70 HG11 VAL 70 16.919 -14.933 0.050 564 HG12 VAL 70 HG12 VAL 70 15.445 -13.957 0.062 565 HG13 VAL 70 HG13 VAL 70 16.011 -14.669 -1.440 566 HG21 VAL 70 HG21 VAL 70 13.974 -16.118 1.769 567 HG22 VAL 70 HG22 VAL 70 12.978 -16.065 0.317 568 HG23 VAL 70 HG23 VAL 70 13.823 -14.623 0.866 569 H ARG 71 HN ARG 71 13.119 -17.623 -3.030 570 HA ARG 71 HA ARG 71 12.719 -15.279 -4.573 571 HB2 ARG 71 HB2 ARG 71 11.344 -17.972 -4.535 572 HB3 ARG 71 HB1 ARG 71 10.972 -16.678 -5.682 573 HG2 ARG 71 HG2 ARG 71 13.161 -16.670 -6.602 574 HG3 ARG 71 HG1 ARG 71 13.817 -17.656 -5.306 575 HD2 ARG 71 HD2 ARG 71 11.687 -18.636 -7.233 576 HD3 ARG 71 HD1 ARG 71 13.405 -18.892 -7.474 577 HE ARG 71 HE ARG 71 12.901 -19.769 -4.891 578 HH11 ARG 71 HH21 ARG 71 11.762 -20.560 -8.103 579 HH12 ARG 71 HH22 ARG 71 11.478 -22.201 -7.727 580 HH21 ARG 71 HH11 ARG 71 12.559 -21.939 -4.418 581 HH22 ARG 71 HH12 ARG 71 11.930 -23.010 -5.605 582 H GLN 72 HN GLN 72 10.797 -16.902 -2.138 583 HA GLN 72 HA GLN 72 9.049 -14.529 -1.910 584 HB2 GLN 72 HB2 GLN 72 8.186 -17.403 -2.163 585 HB3 GLN 72 HB1 GLN 72 7.138 -16.132 -1.550 586 HG2 GLN 72 HG2 GLN 72 7.337 -14.889 -3.591 587 HG3 GLN 72 HG1 GLN 72 8.505 -16.033 -4.249 588 HE21 GLN 72 HE21 GLN 72 7.726 -18.166 -4.804 589 HE22 GLN 72 HE22 GLN 72 6.074 -18.477 -5.052 590 H ASN 73 HN ASN 73 7.664 -14.715 0.007 591 HA ASN 73 HA ASN 73 9.183 -15.071 2.387 592 HB2 ASN 73 HB2 ASN 73 7.318 -14.337 3.544 593 HB3 ASN 73 HB1 ASN 73 6.969 -13.626 1.961 594 HD21 ASN 73 HD21 ASN 73 5.404 -14.966 0.601 595 HD22 ASN 73 HD22 ASN 73 4.250 -15.908 1.415 596 H GLY 74 HN GLY 74 8.828 -16.654 4.047 597 HA2 GLY 74 HA2 GLY 74 7.979 -18.675 4.836 598 HA3 GLY 74 HA1 GLY 74 7.456 -19.123 3.224 599 H ASP 75 HN ASP 75 10.518 -17.774 3.085 600 HA ASP 75 HA ASP 75 11.730 -20.398 2.705 601 HB2 ASP 75 HB2 ASP 75 12.179 -18.117 1.360 602 HB3 ASP 75 HB1 ASP 75 13.388 -17.932 2.616 603 H SER 76 HN SER 76 13.737 -20.932 3.768 604 HA SER 76 HA SER 76 13.871 -19.775 6.472 605 HB2 SER 76 HB2 SER 76 14.601 -22.333 6.980 606 HB3 SER 76 HB1 SER 76 12.983 -21.699 7.183 607 HG SER 76 HG SER 76 12.444 -22.472 5.160 608 H ALA 77 HN ALA 77 15.872 -19.698 7.457 609 HA ALA 77 HA ALA 77 18.235 -20.616 5.943 610 HB1 ALA 77 HB1 ALA 77 19.415 -18.545 6.552 611 HB2 ALA 77 HB2 ALA 77 17.947 -17.922 7.302 612 HB3 ALA 77 HB3 ALA 77 18.001 -18.179 5.557 613 H TYR 78 HN TYR 78 20.186 -20.690 7.444 614 HA TYR 78 HA TYR 78 19.222 -21.500 10.116 615 HB2 TYR 78 HB2 TYR 78 20.447 -23.104 8.186 616 HB3 TYR 78 HB1 TYR 78 21.733 -22.658 9.310 617 HD1 TYR 78 HD2 TYR 78 21.165 -22.749 11.860 618 HD2 TYR 78 HD1 TYR 78 19.015 -24.875 8.800 619 HE1 TYR 78 HE2 TYR 78 20.307 -24.276 13.538 620 HE2 TYR 78 HE1 TYR 78 18.139 -26.427 10.500 621 HH TYR 78 HH TYR 78 19.418 -26.611 13.613 622 H LEU 79 HN LEU 79 20.070 -20.618 11.828 623 HA LEU 79 HA LEU 79 22.556 -19.063 11.546 624 HB2 LEU 79 HB2 LEU 79 20.066 -18.500 12.932 625 HB3 LEU 79 HB1 LEU 79 21.438 -18.406 14.025 626 HG LEU 79 HG LEU 79 21.405 -17.036 11.316 627 HD11 LEU 79 HD11 LEU 79 20.722 -15.033 12.357 628 HD12 LEU 79 HD12 LEU 79 20.947 -15.689 13.975 629 HD13 LEU 79 HD13 LEU 79 19.600 -16.240 12.978 630 HD21 LEU 79 HD21 LEU 79 23.319 -17.311 13.575 631 HD22 LEU 79 HD22 LEU 79 23.102 -15.666 12.989 632 HD23 LEU 79 HD23 LEU 79 23.607 -16.934 11.884 633 H TYR 80 HN TYR 80 24.283 -19.784 12.531 634 HA TYR 80 HA TYR 80 23.955 -21.860 14.620 635 HB2 TYR 80 HB2 TYR 80 24.907 -22.723 12.491 636 HB3 TYR 80 HB1 TYR 80 26.214 -21.542 12.634 637 HD1 TYR 80 HD2 TYR 80 27.830 -21.670 14.473 638 HD2 TYR 80 HD1 TYR 80 24.851 -24.707 13.911 639 HE1 TYR 80 HE2 TYR 80 29.080 -23.183 16.009 640 HE2 TYR 80 HE1 TYR 80 26.071 -26.208 15.423 641 HH TYR 80 HH TYR 80 27.822 -25.608 17.493 642 H LEU 81 HN LEU 81 24.611 -21.087 16.566 643 HA LEU 81 HA LEU 81 26.497 -18.809 16.514 644 HB2 LEU 81 HB2 LEU 81 24.735 -19.612 18.837 645 HB3 LEU 81 HB1 LEU 81 25.629 -18.125 18.626 646 HG LEU 81 HG LEU 81 23.382 -19.074 16.891 647 HD11 LEU 81 HD11 LEU 81 22.428 -18.314 18.955 648 HD12 LEU 81 HD12 LEU 81 22.240 -16.955 17.852 649 HD13 LEU 81 HD13 LEU 81 23.530 -16.941 19.047 650 HD21 LEU 81 HD21 LEU 81 25.005 -17.704 15.617 651 HD22 LEU 81 HD22 LEU 81 24.836 -16.390 16.799 652 HD23 LEU 81 HD23 LEU 81 23.479 -16.865 15.805 653 H LEU 82 HN LEU 82 28.354 -18.968 17.355 654 HA LEU 82 HA LEU 82 29.445 -21.499 18.181 655 HB2 LEU 82 HB2 LEU 82 30.683 -18.721 18.105 656 HB3 LEU 82 HB1 LEU 82 31.549 -20.120 18.682 657 HG LEU 82 HG LEU 82 31.898 -19.505 16.227 658 HD11 LEU 82 HD11 LEU 82 31.585 -21.997 15.524 659 HD12 LEU 82 HD12 LEU 82 31.185 -22.240 17.222 660 HD13 LEU 82 HD13 LEU 82 32.752 -21.550 16.760 661 HD21 LEU 82 HD21 LEU 82 29.517 -19.080 15.642 662 HD22 LEU 82 HD22 LEU 82 29.143 -20.788 15.952 663 HD23 LEU 82 HD23 LEU 82 30.214 -20.347 14.641 664 H SER 83 HN SER 83 30.975 -21.435 20.231 665 HA SER 83 HA SER 83 29.301 -21.428 22.475 666 HB2 SER 83 HB2 SER 83 31.453 -21.634 23.762 667 HB3 SER 83 HB1 SER 83 31.227 -22.823 22.501 668 HG SER 83 HG SER 83 33.328 -21.661 22.633 669 H ALA 84 HN ALA 84 31.163 -18.928 21.029 670 HA ALA 84 HA ALA 84 31.400 -17.080 23.121 671 HB1 ALA 84 HB1 ALA 84 32.338 -15.902 21.463 672 HB2 ALA 84 HB2 ALA 84 30.754 -15.604 20.773 673 HB3 ALA 84 HB3 ALA 84 31.692 -17.007 20.259 674 H ARG 85 HN ARG 85 30.121 -15.232 23.595 675 HA ARG 85 HA ARG 85 27.217 -15.608 23.147 676 HB2 ARG 85 HB2 ARG 85 28.703 -15.496 25.657 677 HB3 ARG 85 HB1 ARG 85 27.511 -14.223 25.578 678 HG2 ARG 85 HG2 ARG 85 26.230 -15.932 26.443 679 HG3 ARG 85 HG1 ARG 85 25.899 -16.170 24.729 680 HD2 ARG 85 HD2 ARG 85 28.202 -17.570 26.096 681 HD3 ARG 85 HD1 ARG 85 26.589 -18.248 26.158 682 HE ARG 85 HE ARG 85 28.342 -18.063 23.826 683 HH11 ARG 85 HH21 ARG 85 25.118 -18.630 25.051 684 HH12 ARG 85 HH22 ARG 85 24.613 -19.516 23.680 685 HH21 ARG 85 HH11 ARG 85 27.642 -19.212 21.947 686 HH22 ARG 85 HH12 ARG 85 26.048 -19.861 21.952 687 H ASN 86 HN ASN 86 26.183 -13.390 24.147 688 HA ASN 86 HA ASN 86 27.221 -11.281 22.376 689 HB2 ASN 86 HB2 ASN 86 24.822 -11.871 22.246 690 HB3 ASN 86 HB1 ASN 86 24.644 -11.456 23.953 691 HD21 ASN 86 HD21 ASN 86 22.998 -9.849 22.966 692 HD22 ASN 86 HD22 ASN 86 23.597 -8.362 22.447 693 H THR 87 HN THR 87 28.957 -10.422 23.503 694 HA THR 87 HA THR 87 28.668 -9.674 26.289 695 HB THR 87 HB THR 87 30.970 -8.607 25.823 696 HG1 THR 87 HG1 THR 87 30.295 -8.959 23.394 697 HG21 THR 87 HG21 THR 87 31.940 -11.050 25.500 698 HG22 THR 87 HG22 THR 87 30.263 -11.523 25.770 699 HG23 THR 87 HG23 THR 87 31.124 -10.577 26.982 700 H SER 88 HN SER 88 29.017 -7.440 27.019 701 HA SER 88 HA SER 88 27.392 -5.643 25.487 702 HB2 SER 88 HB2 SER 88 28.969 -4.687 27.845 703 HB3 SER 88 HB1 SER 88 27.332 -4.318 27.355 704 HG SER 88 HG SER 88 27.016 -5.676 28.971 705 H LEU 89 HN LEU 89 28.415 -5.122 23.626 706 HA LEU 89 HA LEU 89 31.172 -4.591 23.341 707 HB2 LEU 89 HB2 LEU 89 30.138 -3.150 21.282 708 HB3 LEU 89 HB1 LEU 89 30.416 -4.878 21.228 709 HG LEU 89 HG LEU 89 27.787 -4.006 22.394 710 HD11 LEU 89 HD11 LEU 89 28.275 -3.898 19.427 711 HD12 LEU 89 HD12 LEU 89 28.107 -2.483 20.463 712 HD13 LEU 89 HD13 LEU 89 26.768 -3.603 20.288 713 HD21 LEU 89 HD21 LEU 89 28.744 -6.420 21.905 714 HD22 LEU 89 HD22 LEU 89 28.277 -6.063 20.244 715 HD23 LEU 89 HD23 LEU 89 27.066 -6.053 21.527 716 H ASN 90 HN ASN 90 28.448 -2.568 23.997 717 HA ASN 90 HA ASN 90 29.512 -0.026 23.645 718 HB2 ASN 90 HB2 ASN 90 27.526 -0.920 25.748 719 HB3 ASN 90 HB1 ASN 90 27.842 0.753 25.314 720 HD21 ASN 90 HD21 ASN 90 27.710 1.040 22.706 721 HD22 ASN 90 HD22 ASN 90 26.332 0.331 22.014 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 5.459 -2.133 -1.933 2 H2 MET 1 HT2 MET 1 5.288 -3.571 -1.061 3 H3 MET 1 HT3 MET 1 6.537 -2.525 -0.690 4 HA MET 1 HA MET 1 4.942 -2.344 0.977 5 HB2 MET 1 HB2 MET 1 5.906 -0.195 0.290 6 HB3 MET 1 HB1 MET 1 4.650 0.091 -0.881 7 HG2 MET 1 HG2 MET 1 4.290 1.271 1.270 8 HG3 MET 1 HG1 MET 1 2.958 0.199 0.871 9 HE1 MET 1 HE1 MET 1 2.149 -1.706 2.264 10 HE2 MET 1 HE2 MET 1 1.924 -0.168 3.063 11 HE3 MET 1 HE3 MET 1 2.452 -1.552 4.001 12 HA PRO 2 HA PRO 2 0.496 -2.011 -0.996 13 HB2 PRO 2 HB2 PRO 2 0.440 -2.191 -3.749 14 HB3 PRO 2 HB1 PRO 2 0.371 -0.657 -2.866 15 HG2 PRO 2 HG2 PRO 2 2.732 -1.962 -4.149 16 HG3 PRO 2 HG1 PRO 2 2.243 -0.259 -4.154 17 HD2 PRO 2 HD2 PRO 2 4.181 -1.052 -2.576 18 HD3 PRO 2 HD1 PRO 2 2.975 0.134 -1.993 19 H THR 3 HN THR 3 3.150 -3.567 -2.537 20 HA THR 3 HA THR 3 1.928 -6.229 -2.267 21 HB THR 3 HB THR 3 4.551 -5.923 -3.620 22 HG1 THR 3 HG1 THR 3 3.723 -4.249 -4.642 23 HG21 THR 3 HG21 THR 3 1.966 -7.392 -4.224 24 HG22 THR 3 HG22 THR 3 3.446 -8.080 -3.566 25 HG23 THR 3 HG23 THR 3 3.413 -7.493 -5.222 26 H GLN 4 HN GLN 4 2.802 -7.387 -0.570 27 HA GLN 4 HA GLN 4 4.620 -5.997 1.139 28 HB2 GLN 4 HB2 GLN 4 3.309 -8.707 1.410 29 HB3 GLN 4 HB1 GLN 4 4.417 -8.031 2.601 30 HG2 GLN 4 HG2 GLN 4 1.868 -6.689 1.660 31 HG3 GLN 4 HG1 GLN 4 2.083 -7.565 3.174 32 HE21 GLN 4 HE21 GLN 4 2.102 -4.438 2.040 33 HE22 GLN 4 HE22 GLN 4 3.133 -3.749 3.193 34 H ASP 5 HN ASP 5 6.539 -6.747 1.976 35 HA ASP 5 HA ASP 5 8.391 -7.758 0.047 36 HB2 ASP 5 HB2 ASP 5 8.490 -6.884 2.902 37 HB3 ASP 5 HB1 ASP 5 9.825 -7.831 2.313 38 H ILE 6 HN ILE 6 9.956 -9.497 1.723 39 HA ILE 6 HA ILE 6 8.056 -11.725 2.015 40 HB ILE 6 HB ILE 6 9.736 -13.261 1.243 41 HG12 ILE 6 HG12 ILE 6 11.503 -10.885 0.585 42 HG13 ILE 6 HG11 ILE 6 11.733 -11.864 2.037 43 HG21 ILE 6 HG21 ILE 6 9.055 -10.914 -0.509 44 HG22 ILE 6 HG22 ILE 6 8.475 -12.566 -0.615 45 HG23 ILE 6 HG23 ILE 6 10.109 -12.166 -1.145 46 HD11 ILE 6 HD11 ILE 6 11.652 -13.047 -0.750 47 HD12 ILE 6 HD12 ILE 6 12.104 -13.824 0.756 48 HD13 ILE 6 HD13 ILE 6 13.148 -12.576 0.072 49 H ARG 7 HN ARG 7 8.534 -13.210 3.611 50 HA ARG 7 HA ARG 7 10.178 -12.046 5.756 51 HB2 ARG 7 HB2 ARG 7 8.140 -14.143 6.354 52 HB3 ARG 7 HB1 ARG 7 8.685 -12.773 7.315 53 HG2 ARG 7 HG2 ARG 7 7.541 -11.385 5.273 54 HG3 ARG 7 HG1 ARG 7 6.604 -12.867 5.188 55 HD2 ARG 7 HD2 ARG 7 5.427 -11.395 6.643 56 HD3 ARG 7 HD1 ARG 7 6.141 -12.641 7.663 57 HE ARG 7 HE ARG 7 8.016 -10.595 7.546 58 HH11 ARG 7 HH21 ARG 7 4.721 -11.009 8.646 59 HH12 ARG 7 HH22 ARG 7 4.814 -9.730 9.769 60 HH21 ARG 7 HH11 ARG 7 8.126 -8.920 9.015 61 HH22 ARG 7 HH12 ARG 7 6.782 -8.509 10.005 62 H LEU 8 HN LEU 8 11.816 -13.122 6.495 63 HA LEU 8 HA LEU 8 12.262 -15.853 5.480 64 HB2 LEU 8 HB2 LEU 8 13.898 -14.294 4.592 65 HB3 LEU 8 HB1 LEU 8 14.233 -13.686 6.216 66 HG LEU 8 HG LEU 8 14.977 -16.010 6.873 67 HD11 LEU 8 HD11 LEU 8 14.408 -16.510 3.951 68 HD12 LEU 8 HD12 LEU 8 13.931 -17.436 5.365 69 HD13 LEU 8 HD13 LEU 8 15.599 -17.467 4.834 70 HD21 LEU 8 HD21 LEU 8 16.825 -14.722 6.448 71 HD22 LEU 8 HD22 LEU 8 16.333 -14.329 4.795 72 HD23 LEU 8 HD23 LEU 8 17.025 -15.909 5.165 73 H TRP 9 HN TRP 9 12.435 -17.391 6.936 74 HA TRP 9 HA TRP 9 12.435 -16.631 9.781 75 HB2 TRP 9 HB2 TRP 9 12.088 -19.441 8.785 76 HB3 TRP 9 HB1 TRP 9 11.411 -18.673 10.210 77 HD1 TRP 9 HD1 TRP 9 10.136 -16.080 8.702 78 HE1 TRP 9 HE1 TRP 9 8.055 -16.428 7.256 79 HE3 TRP 9 HE3 TRP 9 10.532 -21.083 7.815 80 HZ2 TRP 9 HZ2 TRP 9 6.716 -18.564 5.868 81 HZ3 TRP 9 HZ3 TRP 9 8.892 -22.243 6.448 82 HH2 TRP 9 HH2 TRP 9 6.947 -20.993 5.456 83 H VAL 10 HN VAL 10 14.332 -16.761 10.825 84 HA VAL 10 HA VAL 10 16.432 -18.427 9.590 85 HB VAL 10 HB VAL 10 16.979 -16.337 11.667 86 HG11 VAL 10 HG11 VAL 10 18.583 -17.387 9.332 87 HG12 VAL 10 HG12 VAL 10 18.788 -17.861 11.017 88 HG13 VAL 10 HG13 VAL 10 19.123 -16.208 10.516 89 HG21 VAL 10 HG21 VAL 10 16.674 -15.832 8.679 90 HG22 VAL 10 HG22 VAL 10 17.300 -14.691 9.869 91 HG23 VAL 10 HG23 VAL 10 15.615 -15.190 9.943 92 H SER 11 HN SER 11 16.786 -20.276 10.535 93 HA SER 11 HA SER 11 15.962 -20.710 13.283 94 HB2 SER 11 HB2 SER 11 17.356 -22.545 11.321 95 HB3 SER 11 HB1 SER 11 16.791 -22.988 12.917 96 HG SER 11 HG SER 11 14.775 -22.868 12.291 97 H VAL 12 HN VAL 12 17.319 -20.695 14.963 98 HA VAL 12 HA VAL 12 20.133 -20.009 14.432 99 HB VAL 12 HB VAL 12 18.242 -19.242 16.663 100 HG11 VAL 12 HG11 VAL 12 20.258 -17.875 17.463 101 HG12 VAL 12 HG12 VAL 12 21.225 -18.952 16.452 102 HG13 VAL 12 HG13 VAL 12 20.281 -19.609 17.778 103 HG21 VAL 12 HG21 VAL 12 18.347 -17.066 15.805 104 HG22 VAL 12 HG22 VAL 12 18.355 -18.017 14.325 105 HG23 VAL 12 HG23 VAL 12 19.862 -17.356 14.962 106 H GLU 13 HN GLU 13 21.580 -21.423 15.160 107 HA GLU 13 HA GLU 13 20.736 -23.487 17.094 108 HB2 GLU 13 HB2 GLU 13 22.923 -23.522 15.008 109 HB3 GLU 13 HB1 GLU 13 22.630 -24.794 16.183 110 HG2 GLU 13 HG2 GLU 13 20.239 -23.949 14.644 111 HG3 GLU 13 HG1 GLU 13 21.504 -24.745 13.718 112 H ASP 14 HN ASP 14 21.414 -23.058 19.037 113 HA ASP 14 HA ASP 14 23.685 -21.317 19.523 114 HB2 ASP 14 HB2 ASP 14 21.573 -21.432 20.947 115 HB3 ASP 14 HB1 ASP 14 22.234 -22.931 21.613 116 H ALA 15 HN ALA 15 25.514 -21.937 20.575 117 HA ALA 15 HA ALA 15 26.755 -24.349 19.753 118 HB1 ALA 15 HB1 ALA 15 27.552 -22.881 22.256 119 HB2 ALA 15 HB2 ALA 15 27.870 -22.246 20.637 120 HB3 ALA 15 HB3 ALA 15 28.571 -23.791 21.131 121 H GLN 16 HN GLN 16 24.668 -23.574 22.346 122 HA GLN 16 HA GLN 16 25.192 -25.898 23.977 123 HB2 GLN 16 HB2 GLN 16 22.531 -24.483 24.013 124 HB3 GLN 16 HB1 GLN 16 23.459 -25.171 25.340 125 HG2 GLN 16 HG2 GLN 16 24.086 -22.618 23.842 126 HG3 GLN 16 HG1 GLN 16 23.574 -22.763 25.505 127 HE21 GLN 16 HE21 GLN 16 26.225 -21.902 24.024 128 HE22 GLN 16 HE22 GLN 16 27.423 -22.661 24.950 129 H MET 17 HN MET 17 24.245 -25.768 20.917 130 HA MET 17 HA MET 17 23.217 -27.146 19.481 131 HB2 MET 17 HB2 MET 17 22.896 -28.976 21.894 132 HB3 MET 17 HB1 MET 17 22.534 -29.423 20.238 133 HG2 MET 17 HG2 MET 17 25.257 -28.486 21.209 134 HG3 MET 17 HG1 MET 17 24.819 -30.157 20.901 135 HE1 MET 17 HE1 MET 17 24.653 -31.276 18.728 136 HE2 MET 17 HE2 MET 17 24.362 -30.495 17.183 137 HE3 MET 17 HE3 MET 17 23.157 -30.367 18.450 138 H HIS 18 HN HIS 18 21.880 -25.158 21.230 139 HA HIS 18 HA HIS 18 19.126 -26.098 21.368 140 HB2 HIS 18 HB2 HIS 18 20.055 -24.615 23.167 141 HB3 HIS 18 HB1 HIS 18 20.240 -23.352 21.951 142 HD1 HIS 18 HD1 HIS 18 18.390 -21.731 22.134 143 HD2 HIS 18 HD2 HIS 18 17.061 -25.626 22.827 144 HE1 HIS 18 HE1 HIS 18 15.882 -21.592 22.509 145 HE2 HIS 18 HE2 HIS 18 15.065 -23.946 22.940 146 H THR 19 HN THR 19 17.656 -25.740 19.796 147 HA THR 19 HA THR 19 18.475 -24.096 17.507 148 HB THR 19 HB THR 19 16.200 -26.088 17.644 149 HG1 THR 19 HG1 THR 19 18.965 -26.378 17.020 150 HG21 THR 19 HG21 THR 19 15.977 -24.660 15.750 151 HG22 THR 19 HG22 THR 19 16.719 -26.135 15.146 152 HG23 THR 19 HG23 THR 19 17.707 -24.703 15.421 153 H VAL 20 HN VAL 20 17.512 -22.195 17.177 154 HA VAL 20 HA VAL 20 14.814 -21.707 18.277 155 HB VAL 20 HB VAL 20 16.913 -19.545 18.121 156 HG11 VAL 20 HG11 VAL 20 14.280 -19.885 19.572 157 HG12 VAL 20 HG12 VAL 20 14.729 -18.630 18.414 158 HG13 VAL 20 HG13 VAL 20 15.452 -18.653 20.016 159 HG21 VAL 20 HG21 VAL 20 17.035 -20.004 20.708 160 HG22 VAL 20 HG22 VAL 20 18.009 -20.981 19.618 161 HG23 VAL 20 HG23 VAL 20 16.500 -21.624 20.259 162 H THR 21 HN THR 21 13.739 -19.849 17.086 163 HA THR 21 HA THR 21 14.822 -19.506 14.369 164 HB THR 21 HB THR 21 11.899 -20.014 14.982 165 HG1 THR 21 HG1 THR 21 13.291 -21.877 15.096 166 HG21 THR 21 HG21 THR 21 11.803 -20.145 12.440 167 HG22 THR 21 HG22 THR 21 13.425 -19.475 12.415 168 HG23 THR 21 HG23 THR 21 12.099 -18.545 13.096 169 H ILE 22 HN ILE 22 14.781 -17.490 13.597 170 HA ILE 22 HA ILE 22 13.125 -15.523 15.044 171 HB ILE 22 HB ILE 22 14.832 -13.819 14.682 172 HG12 ILE 22 HG12 ILE 22 16.562 -16.068 13.589 173 HG13 ILE 22 HG11 ILE 22 15.760 -14.836 12.600 174 HG21 ILE 22 HG21 ILE 22 16.311 -16.157 15.877 175 HG22 ILE 22 HG22 ILE 22 14.895 -15.471 16.685 176 HG23 ILE 22 HG23 ILE 22 16.313 -14.465 16.378 177 HD11 ILE 22 HD11 ILE 22 17.893 -14.380 14.689 178 HD12 ILE 22 HD12 ILE 22 16.968 -13.080 13.928 179 HD13 ILE 22 HD13 ILE 22 18.027 -14.104 12.953 180 H TRP 23 HN TRP 23 12.263 -13.915 13.777 181 HA TRP 23 HA TRP 23 11.905 -14.784 10.975 182 HB2 TRP 23 HB2 TRP 23 9.999 -13.100 12.573 183 HB3 TRP 23 HB1 TRP 23 9.655 -14.144 11.196 184 HD1 TRP 23 HD1 TRP 23 10.160 -14.193 14.953 185 HE1 TRP 23 HE1 TRP 23 9.665 -16.529 15.864 186 HE3 TRP 23 HE3 TRP 23 9.653 -16.744 10.601 187 HZ2 TRP 23 HZ2 TRP 23 9.108 -19.152 14.896 188 HZ3 TRP 23 HZ3 TRP 23 9.126 -19.189 10.614 189 HH2 TRP 23 HH2 TRP 23 8.855 -20.376 12.785 190 H LEU 24 HN LEU 24 12.561 -13.433 9.413 191 HA LEU 24 HA LEU 24 12.875 -10.562 10.087 192 HB2 LEU 24 HB2 LEU 24 14.602 -12.179 8.205 193 HB3 LEU 24 HB1 LEU 24 14.783 -10.475 8.590 194 HG LEU 24 HG LEU 24 14.992 -12.728 10.627 195 HD11 LEU 24 HD11 LEU 24 16.871 -12.359 8.826 196 HD12 LEU 24 HD12 LEU 24 17.282 -12.585 10.525 197 HD13 LEU 24 HD13 LEU 24 17.278 -10.970 9.839 198 HD21 LEU 24 HD21 LEU 24 14.290 -10.814 11.838 199 HD22 LEU 24 HD22 LEU 24 15.199 -9.709 10.805 200 HD23 LEU 24 HD23 LEU 24 16.039 -10.743 11.949 201 H THR 25 HN THR 25 12.158 -9.072 8.595 202 HA THR 25 HA THR 25 10.729 -10.171 6.254 203 HB THR 25 HB THR 25 10.122 -7.444 7.321 204 HG1 THR 25 HG1 THR 25 9.884 -8.386 9.173 205 HG21 THR 25 HG21 THR 25 7.770 -8.376 6.703 206 HG22 THR 25 HG22 THR 25 8.655 -9.661 5.874 207 HG23 THR 25 HG23 THR 25 8.897 -7.990 5.421 208 H VAL 26 HN VAL 26 11.658 -9.757 4.357 209 HA VAL 26 HA VAL 26 12.963 -7.208 3.868 210 HB VAL 26 HB VAL 26 15.056 -8.333 3.092 211 HG11 VAL 26 HG11 VAL 26 14.803 -7.295 5.389 212 HG12 VAL 26 HG12 VAL 26 16.040 -8.536 5.257 213 HG13 VAL 26 HG13 VAL 26 14.493 -8.921 6.010 214 HG21 VAL 26 HG21 VAL 26 14.412 -10.587 2.711 215 HG22 VAL 26 HG22 VAL 26 13.648 -10.733 4.295 216 HG23 VAL 26 HG23 VAL 26 15.399 -10.667 4.167 217 H ARG 27 HN ARG 27 14.173 -7.704 1.535 218 HA ARG 27 HA ARG 27 12.092 -8.876 -0.190 219 HB2 ARG 27 HB2 ARG 27 13.226 -7.463 -1.989 220 HB3 ARG 27 HB1 ARG 27 12.250 -6.588 -0.824 221 HG2 ARG 27 HG2 ARG 27 15.026 -6.925 0.080 222 HG3 ARG 27 HG1 ARG 27 14.907 -6.049 -1.425 223 HD2 ARG 27 HD2 ARG 27 13.325 -4.459 -0.473 224 HD3 ARG 27 HD1 ARG 27 13.268 -5.369 1.023 225 HE ARG 27 HE ARG 27 15.273 -4.393 1.654 226 HH11 ARG 27 HH21 ARG 27 14.734 -3.983 -1.773 227 HH12 ARG 27 HH22 ARG 27 16.084 -2.956 -2.011 228 HH21 ARG 27 HH11 ARG 27 17.116 -3.002 1.316 229 HH22 ARG 27 HH12 ARG 27 17.446 -2.419 -0.260 230 HA PRO 28 HA PRO 28 15.011 -11.999 -1.573 231 HB2 PRO 28 HB2 PRO 28 14.353 -11.082 -4.327 232 HB3 PRO 28 HB1 PRO 28 14.309 -12.712 -3.641 233 HG2 PRO 28 HG2 PRO 28 12.060 -11.477 -4.056 234 HG3 PRO 28 HG1 PRO 28 12.293 -12.372 -2.559 235 HD2 PRO 28 HD2 PRO 28 12.346 -9.387 -2.916 236 HD3 PRO 28 HD1 PRO 28 11.740 -10.354 -1.562 237 H ASP 29 HN ASP 29 15.153 -8.735 -2.952 238 HA ASP 29 HA ASP 29 17.810 -9.138 -3.971 239 HB2 ASP 29 HB2 ASP 29 17.713 -6.748 -4.583 240 HB3 ASP 29 HB1 ASP 29 16.435 -7.722 -5.297 241 H MET 30 HN MET 30 16.750 -8.749 -0.933 242 HA MET 30 HA MET 30 18.671 -6.816 0.037 243 HB2 MET 30 HB2 MET 30 16.721 -8.702 1.284 244 HB3 MET 30 HB1 MET 30 18.180 -8.402 2.198 245 HG2 MET 30 HG2 MET 30 16.681 -6.095 1.009 246 HG3 MET 30 HG1 MET 30 16.187 -6.756 2.567 247 HE1 MET 30 HE1 MET 30 18.873 -7.569 4.129 248 HE2 MET 30 HE2 MET 30 17.316 -6.859 4.522 249 HE3 MET 30 HE3 MET 30 18.787 -6.027 5.007 250 H THR 31 HN THR 31 20.425 -7.597 1.571 251 HA THR 31 HA THR 31 21.720 -9.918 0.317 252 HB THR 31 HB THR 31 22.637 -7.602 -0.197 253 HG1 THR 31 HG1 THR 31 23.796 -9.873 0.004 254 HG21 THR 31 HG21 THR 31 24.239 -7.626 2.251 255 HG22 THR 31 HG22 THR 31 22.527 -7.253 2.509 256 HG23 THR 31 HG23 THR 31 23.481 -6.276 1.409 257 H VAL 32 HN VAL 32 23.134 -11.184 1.562 258 HA VAL 32 HA VAL 32 22.117 -11.831 4.104 259 HB VAL 32 HB VAL 32 24.760 -12.598 2.819 260 HG11 VAL 32 HG11 VAL 32 25.101 -13.076 5.068 261 HG12 VAL 32 HG12 VAL 32 24.451 -14.588 4.446 262 HG13 VAL 32 HG13 VAL 32 23.411 -13.489 5.342 263 HG21 VAL 32 HG21 VAL 32 21.986 -13.805 2.828 264 HG22 VAL 32 HG22 VAL 32 23.419 -14.783 2.510 265 HG23 VAL 32 HG23 VAL 32 23.016 -13.432 1.444 266 H ALA 33 HN ALA 33 25.023 -10.063 3.123 267 HA ALA 33 HA ALA 33 26.125 -9.670 5.647 268 HB1 ALA 33 HB1 ALA 33 27.582 -8.788 4.146 269 HB2 ALA 33 HB2 ALA 33 26.744 -7.289 4.492 270 HB3 ALA 33 HB3 ALA 33 26.318 -8.218 3.061 271 H SER 34 HN SER 34 23.772 -7.610 3.952 272 HA SER 34 HA SER 34 23.339 -5.813 6.136 273 HB2 SER 34 HB2 SER 34 21.391 -6.422 3.891 274 HB3 SER 34 HB1 SER 34 21.408 -5.035 4.942 275 HG SER 34 HG SER 34 22.467 -4.362 3.172 276 H LEU 35 HN LEU 35 21.640 -8.710 4.988 277 HA LEU 35 HA LEU 35 19.515 -8.595 6.818 278 HB2 LEU 35 HB2 LEU 35 19.494 -10.028 4.796 279 HB3 LEU 35 HB1 LEU 35 20.769 -11.013 5.498 280 HG LEU 35 HG LEU 35 19.324 -11.686 7.342 281 HD11 LEU 35 HD11 LEU 35 16.761 -10.943 6.776 282 HD12 LEU 35 HD12 LEU 35 17.625 -9.492 6.258 283 HD13 LEU 35 HD13 LEU 35 17.829 -10.119 7.897 284 HD21 LEU 35 HD21 LEU 35 17.616 -12.915 6.074 285 HD22 LEU 35 HD22 LEU 35 19.187 -13.023 5.274 286 HD23 LEU 35 HD23 LEU 35 17.936 -11.926 4.656 287 H LYS 36 HN LYS 36 22.650 -10.173 6.975 288 HA LYS 36 HA LYS 36 22.424 -11.441 9.476 289 HB2 LYS 36 HB2 LYS 36 24.219 -11.924 8.005 290 HB3 LYS 36 HB1 LYS 36 24.718 -10.233 7.936 291 HG2 LYS 36 HG2 LYS 36 24.636 -11.303 10.684 292 HG3 LYS 36 HG1 LYS 36 25.794 -12.151 9.646 293 HD2 LYS 36 HD2 LYS 36 25.629 -9.182 10.150 294 HD3 LYS 36 HD1 LYS 36 26.876 -10.269 10.750 295 HE2 LYS 36 HE2 LYS 36 28.065 -9.991 8.855 296 HE3 LYS 36 HE1 LYS 36 26.742 -10.582 7.875 297 HZ1 LYS 36 HZ1 LYS 36 27.565 -8.208 7.473 298 HZ2 LYS 36 HZ2 LYS 36 26.728 -7.788 8.902 299 HZ3 LYS 36 HZ3 LYS 36 25.895 -8.381 7.597 300 H ASP 37 HN ASP 37 23.471 -8.201 8.488 301 HA ASP 37 HA ASP 37 24.299 -7.331 11.042 302 HB2 ASP 37 HB2 ASP 37 23.608 -5.884 8.488 303 HB3 ASP 37 HB1 ASP 37 23.856 -5.004 9.976 304 H MET 38 HN MET 38 21.121 -7.034 9.440 305 HA MET 38 HA MET 38 19.998 -5.282 11.324 306 HB2 MET 38 HB2 MET 38 18.121 -7.360 10.431 307 HB3 MET 38 HB1 MET 38 18.038 -5.615 10.350 308 HG2 MET 38 HG2 MET 38 19.655 -5.648 8.436 309 HG3 MET 38 HG1 MET 38 19.544 -7.403 8.467 310 HE1 MET 38 HE1 MET 38 17.409 -8.521 8.964 311 HE2 MET 38 HE2 MET 38 16.161 -8.492 7.741 312 HE3 MET 38 HE3 MET 38 15.959 -7.551 9.203 313 H VAL 39 HN VAL 39 20.345 -8.719 11.310 314 HA VAL 39 HA VAL 39 18.777 -9.315 13.513 315 HB VAL 39 HB VAL 39 21.351 -10.667 12.619 316 HG11 VAL 39 HG11 VAL 39 19.163 -11.705 14.449 317 HG12 VAL 39 HG12 VAL 39 20.815 -11.311 14.934 318 HG13 VAL 39 HG13 VAL 39 20.508 -12.644 13.821 319 HG21 VAL 39 HG21 VAL 39 18.460 -10.857 11.804 320 HG22 VAL 39 HG22 VAL 39 19.423 -12.330 11.834 321 HG23 VAL 39 HG23 VAL 39 19.917 -10.988 10.822 322 H PHE 40 HN PHE 40 22.135 -8.302 13.231 323 HA PHE 40 HA PHE 40 22.756 -8.247 16.015 324 HB2 PHE 40 HB2 PHE 40 24.548 -8.260 14.494 325 HB3 PHE 40 HB1 PHE 40 23.937 -6.829 13.632 326 HD1 PHE 40 HD2 PHE 40 25.051 -7.955 17.058 327 HD2 PHE 40 HD1 PHE 40 24.763 -4.709 14.238 328 HE1 PHE 40 HE2 PHE 40 26.327 -6.493 18.596 329 HE2 PHE 40 HE1 PHE 40 26.038 -3.258 15.787 330 HZ PHE 40 HZ PHE 40 26.816 -4.131 17.945 331 H LEU 41 HN LEU 41 21.566 -5.854 13.696 332 HA LEU 41 HA LEU 41 21.492 -3.645 15.468 333 HB2 LEU 41 HB2 LEU 41 19.606 -4.284 13.184 334 HB3 LEU 41 HB1 LEU 41 19.807 -2.715 13.929 335 HG LEU 41 HG LEU 41 21.971 -4.277 12.577 336 HD11 LEU 41 HD11 LEU 41 20.380 -3.408 10.919 337 HD12 LEU 41 HD12 LEU 41 21.862 -2.476 10.833 338 HD13 LEU 41 HD13 LEU 41 20.457 -1.804 11.649 339 HD21 LEU 41 HD21 LEU 41 23.015 -1.817 12.732 340 HD22 LEU 41 HD22 LEU 41 23.141 -3.016 14.028 341 HD23 LEU 41 HD23 LEU 41 21.922 -1.738 14.132 342 H ASP 42 HN ASP 42 19.174 -6.018 14.586 343 HA ASP 42 HA ASP 42 17.049 -5.025 16.273 344 HB2 ASP 42 HB2 ASP 42 16.719 -6.325 14.142 345 HB3 ASP 42 HB1 ASP 42 17.160 -7.767 15.041 346 H TYR 43 HN TYR 43 19.055 -7.953 16.481 347 HA TYR 43 HA TYR 43 17.956 -8.475 19.160 348 HB2 TYR 43 HB2 TYR 43 19.624 -10.254 17.369 349 HB3 TYR 43 HB1 TYR 43 18.861 -10.702 18.886 350 HD1 TYR 43 HD2 TYR 43 16.358 -10.779 19.096 351 HD2 TYR 43 HD1 TYR 43 18.324 -10.062 15.340 352 HE1 TYR 43 HE2 TYR 43 14.274 -11.309 17.896 353 HE2 TYR 43 HE1 TYR 43 16.241 -10.597 14.142 354 HH TYR 43 HH TYR 43 13.655 -10.447 14.877 355 H GLY 44 HN GLY 44 20.914 -7.578 17.588 356 HA2 GLY 44 HA2 GLY 44 22.928 -6.851 18.527 357 HA3 GLY 44 HA1 GLY 44 22.267 -7.170 20.128 358 H PHE 45 HN PHE 45 21.971 -9.693 17.847 359 HA PHE 45 HA PHE 45 23.377 -11.565 19.349 360 HB2 PHE 45 HB2 PHE 45 22.574 -11.453 16.449 361 HB3 PHE 45 HB1 PHE 45 23.614 -12.749 17.029 362 HD1 PHE 45 HD1 PHE 45 21.274 -11.417 19.522 363 HD2 PHE 45 HD2 PHE 45 21.706 -14.310 16.336 364 HE1 PHE 45 HE1 PHE 45 19.315 -12.654 20.359 365 HE2 PHE 45 HE2 PHE 45 19.737 -15.527 17.194 366 HZ PHE 45 HZ PHE 45 18.539 -14.701 19.206 367 HA PRO 46 HA PRO 46 27.502 -9.914 18.809 368 HB2 PRO 46 HB2 PRO 46 28.738 -12.392 19.333 369 HB3 PRO 46 HB1 PRO 46 28.459 -11.067 20.480 370 HG2 PRO 46 HG2 PRO 46 26.936 -13.571 20.083 371 HG3 PRO 46 HG1 PRO 46 27.086 -12.618 21.543 372 HD2 PRO 46 HD2 PRO 46 24.847 -12.670 20.084 373 HD3 PRO 46 HD1 PRO 46 25.304 -11.188 20.947 374 HA PRO 47 HA PRO 47 27.713 -11.194 14.505 375 HB2 PRO 47 HB2 PRO 47 30.124 -10.003 13.914 376 HB3 PRO 47 HB1 PRO 47 28.564 -9.147 13.914 377 HG2 PRO 47 HG2 PRO 47 30.675 -9.249 16.022 378 HG3 PRO 47 HG1 PRO 47 29.683 -7.883 15.501 379 HD2 PRO 47 HD2 PRO 47 29.106 -9.140 17.759 380 HD3 PRO 47 HD1 PRO 47 27.799 -8.581 16.693 381 H VAL 48 HN VAL 48 30.335 -11.718 16.765 382 HA VAL 48 HA VAL 48 31.786 -13.571 15.169 383 HB VAL 48 HB VAL 48 32.937 -12.713 17.068 384 HG11 VAL 48 HG11 VAL 48 31.963 -12.200 19.015 385 HG12 VAL 48 HG12 VAL 48 31.410 -13.837 19.274 386 HG13 VAL 48 HG13 VAL 48 30.428 -12.709 18.330 387 HG21 VAL 48 HG21 VAL 48 32.298 -15.364 18.284 388 HG22 VAL 48 HG22 VAL 48 33.858 -14.673 17.854 389 HG23 VAL 48 HG23 VAL 48 32.850 -15.393 16.609 390 H LEU 49 HN LEU 49 29.246 -13.968 17.583 391 HA LEU 49 HA LEU 49 29.001 -16.823 17.202 392 HB2 LEU 49 HB2 LEU 49 27.381 -14.768 18.668 393 HB3 LEU 49 HB1 LEU 49 26.770 -16.387 18.434 394 HG LEU 49 HG LEU 49 29.122 -17.171 19.338 395 HD11 LEU 49 HD11 LEU 49 30.490 -15.580 20.043 396 HD12 LEU 49 HD12 LEU 49 29.294 -15.017 21.205 397 HD13 LEU 49 HD13 LEU 49 29.344 -14.330 19.585 398 HD21 LEU 49 HD21 LEU 49 27.163 -15.910 21.295 399 HD22 LEU 49 HD22 LEU 49 28.230 -17.289 21.556 400 HD23 LEU 49 HD23 LEU 49 26.866 -17.444 20.470 401 H GLN 50 HN GLN 50 27.369 -13.952 16.061 402 HA GLN 50 HA GLN 50 25.191 -15.296 14.895 403 HB2 GLN 50 HB2 GLN 50 25.672 -12.712 15.439 404 HB3 GLN 50 HB1 GLN 50 26.043 -12.657 13.732 405 HG2 GLN 50 HG2 GLN 50 23.498 -14.052 14.564 406 HG3 GLN 50 HG1 GLN 50 23.568 -12.309 14.662 407 HE21 GLN 50 HE21 GLN 50 25.636 -13.477 12.160 408 HE22 GLN 50 HE22 GLN 50 24.573 -13.167 10.889 409 H GLN 51 HN GLN 51 26.343 -17.079 13.788 410 HA GLN 51 HA GLN 51 27.556 -16.276 11.220 411 HB2 GLN 51 HB2 GLN 51 27.575 -18.993 12.570 412 HB3 GLN 51 HB1 GLN 51 28.446 -18.539 11.113 413 HG2 GLN 51 HG2 GLN 51 28.880 -17.301 13.851 414 HG3 GLN 51 HG1 GLN 51 29.941 -18.463 13.067 415 HE21 GLN 51 HE21 GLN 51 30.288 -15.477 13.804 416 HE22 GLN 51 HE22 GLN 51 30.869 -14.782 12.362 417 H TRP 52 HN TRP 52 26.395 -16.457 9.415 418 HA TRP 52 HA TRP 52 23.793 -17.788 9.536 419 HB2 TRP 52 HB2 TRP 52 25.078 -15.816 7.665 420 HB3 TRP 52 HB1 TRP 52 23.745 -16.801 7.097 421 HD1 TRP 52 HD1 TRP 52 24.449 -14.839 10.321 422 HE1 TRP 52 HE1 TRP 52 22.315 -13.479 10.938 423 HE3 TRP 52 HE3 TRP 52 21.427 -16.246 6.491 424 HZ2 TRP 52 HZ2 TRP 52 19.666 -13.087 9.888 425 HZ3 TRP 52 HZ3 TRP 52 19.109 -15.372 6.307 426 HH2 TRP 52 HH2 TRP 52 18.235 -13.789 8.013 427 H VAL 53 HN VAL 53 23.367 -19.673 8.656 428 HA VAL 53 HA VAL 53 25.184 -20.788 6.632 429 HB VAL 53 HB VAL 53 23.800 -22.171 8.946 430 HG11 VAL 53 HG11 VAL 53 24.932 -24.244 7.921 431 HG12 VAL 53 HG12 VAL 53 25.031 -23.313 6.436 432 HG13 VAL 53 HG13 VAL 53 23.455 -23.675 7.151 433 HG21 VAL 53 HG21 VAL 53 26.713 -22.011 8.089 434 HG22 VAL 53 HG22 VAL 53 26.105 -22.916 9.470 435 HG23 VAL 53 HG23 VAL 53 26.002 -21.158 9.461 436 H ILE 54 HN ILE 54 24.148 -21.370 4.820 437 HA ILE 54 HA ILE 54 21.275 -21.878 4.894 438 HB ILE 54 HB ILE 54 22.622 -19.934 3.045 439 HG12 ILE 54 HG12 ILE 54 20.373 -19.429 5.025 440 HG13 ILE 54 HG11 ILE 54 22.064 -19.069 5.370 441 HG21 ILE 54 HG21 ILE 54 19.767 -20.971 3.149 442 HG22 ILE 54 HG22 ILE 54 20.880 -21.116 1.788 443 HG23 ILE 54 HG23 ILE 54 20.235 -19.544 2.250 444 HD11 ILE 54 HD11 ILE 54 22.143 -17.329 3.828 445 HD12 ILE 54 HD12 ILE 54 20.480 -17.205 4.405 446 HD13 ILE 54 HD13 ILE 54 20.819 -17.988 2.867 447 H GLY 55 HN GLY 55 20.829 -23.632 3.667 448 HA2 GLY 55 HA2 GLY 55 22.835 -25.261 2.651 449 HA3 GLY 55 HA1 GLY 55 21.137 -25.370 2.173 450 H GLN 56 HN GLN 56 20.876 -22.845 1.009 451 HA GLN 56 HA GLN 56 22.332 -23.361 -1.493 452 HB2 GLN 56 HB2 GLN 56 19.766 -21.877 -0.974 453 HB3 GLN 56 HB1 GLN 56 20.515 -22.028 -2.559 454 HG2 GLN 56 HG2 GLN 56 19.790 -24.366 -0.803 455 HG3 GLN 56 HG1 GLN 56 18.755 -23.786 -2.109 456 HE21 GLN 56 HE21 GLN 56 20.922 -26.188 -1.510 457 HE22 GLN 56 HE22 GLN 56 21.601 -26.373 -3.050 458 H ARG 57 HN ARG 57 23.037 -21.390 0.947 459 HA ARG 57 HA ARG 57 23.333 -18.934 -0.591 460 HB2 ARG 57 HB2 ARG 57 24.580 -17.954 1.178 461 HB3 ARG 57 HB1 ARG 57 23.182 -18.699 1.897 462 HG2 ARG 57 HG2 ARG 57 24.536 -20.580 2.710 463 HG3 ARG 57 HG1 ARG 57 25.903 -20.104 1.735 464 HD2 ARG 57 HD2 ARG 57 24.754 -18.440 4.009 465 HD3 ARG 57 HD1 ARG 57 26.160 -19.474 4.115 466 HE ARG 57 HE ARG 57 26.675 -17.804 1.962 467 HH11 ARG 57 HH21 ARG 57 26.122 -17.504 5.426 468 HH12 ARG 57 HH22 ARG 57 26.988 -16.030 5.544 469 HH21 ARG 57 HH11 ARG 57 27.806 -15.829 2.169 470 HH22 ARG 57 HH12 ARG 57 27.923 -15.060 3.707 471 H LEU 58 HN LEU 58 25.496 -17.851 -0.706 472 HA LEU 58 HA LEU 58 27.567 -19.750 -1.586 473 HB2 LEU 58 HB2 LEU 58 26.894 -17.063 -2.822 474 HB3 LEU 58 HB1 LEU 58 28.174 -18.165 -3.329 475 HG LEU 58 HG LEU 58 25.209 -18.872 -3.370 476 HD11 LEU 58 HD11 LEU 58 25.932 -17.142 -5.028 477 HD12 LEU 58 HD12 LEU 58 25.322 -18.628 -5.748 478 HD13 LEU 58 HD13 LEU 58 27.056 -18.321 -5.697 479 HD21 LEU 58 HD21 LEU 58 27.761 -20.362 -3.953 480 HD22 LEU 58 HD22 LEU 58 26.359 -20.684 -4.953 481 HD23 LEU 58 HD23 LEU 58 26.271 -20.944 -3.220 482 H ALA 59 HN ALA 59 29.714 -18.968 -1.329 483 HA ALA 59 HA ALA 59 30.202 -17.829 1.197 484 HB1 ALA 59 HB1 ALA 59 32.593 -17.749 0.457 485 HB2 ALA 59 HB2 ALA 59 32.072 -18.238 -1.145 486 HB3 ALA 59 HB3 ALA 59 31.837 -19.325 0.228 487 H ARG 60 HN ARG 60 28.551 -16.024 -0.045 488 HA ARG 60 HA ARG 60 30.230 -13.627 -0.005 489 HB2 ARG 60 HB2 ARG 60 29.603 -14.474 -2.415 490 HB3 ARG 60 HB1 ARG 60 28.027 -13.820 -2.055 491 HG2 ARG 60 HG2 ARG 60 28.896 -11.888 -2.848 492 HG3 ARG 60 HG1 ARG 60 29.596 -11.716 -1.253 493 HD2 ARG 60 HD2 ARG 60 30.918 -12.909 -3.710 494 HD3 ARG 60 HD1 ARG 60 31.429 -11.477 -2.855 495 HE ARG 60 HE ARG 60 31.812 -14.250 -2.025 496 HH11 ARG 60 HH21 ARG 60 32.010 -10.868 -1.229 497 HH12 ARG 60 HH22 ARG 60 33.002 -11.107 0.151 498 HH21 ARG 60 HH11 ARG 60 33.059 -14.577 -0.176 499 HH22 ARG 60 HH12 ARG 60 33.620 -13.259 0.766 500 H ASP 61 HN ASP 61 29.475 -12.811 1.861 501 HA ASP 61 HA ASP 61 26.776 -12.984 2.765 502 HB2 ASP 61 HB2 ASP 61 29.036 -11.107 3.531 503 HB3 ASP 61 HB1 ASP 61 27.447 -11.044 4.261 504 H GLN 62 HN GLN 62 28.589 -10.783 0.836 505 HA GLN 62 HA GLN 62 26.727 -8.674 0.728 506 HB2 GLN 62 HB2 GLN 62 28.942 -9.418 -1.190 507 HB3 GLN 62 HB1 GLN 62 28.165 -7.840 -1.052 508 HG2 GLN 62 HG2 GLN 62 30.044 -7.525 0.268 509 HG3 GLN 62 HG1 GLN 62 28.887 -8.021 1.499 510 HE21 GLN 62 HE21 GLN 62 31.706 -8.339 1.836 511 HE22 GLN 62 HE22 GLN 62 32.063 -10.001 1.841 512 H GLU 63 HN GLU 63 26.383 -11.761 -0.464 513 HA GLU 63 HA GLU 63 25.282 -11.075 -3.027 514 HB2 GLU 63 HB2 GLU 63 26.248 -13.431 -2.021 515 HB3 GLU 63 HB1 GLU 63 24.522 -13.703 -1.931 516 HG2 GLU 63 HG2 GLU 63 25.394 -14.430 -4.120 517 HG3 GLU 63 HG1 GLU 63 24.275 -13.093 -4.324 518 H THR 64 HN THR 64 23.103 -11.571 -3.685 519 HA THR 64 HA THR 64 21.222 -10.272 -2.025 520 HB THR 64 HB THR 64 19.816 -11.423 -4.111 521 HG1 THR 64 HG1 THR 64 21.668 -12.354 -4.948 522 HG21 THR 64 HG21 THR 64 19.797 -9.272 -4.995 523 HG22 THR 64 HG22 THR 64 21.443 -8.903 -4.456 524 HG23 THR 64 HG23 THR 64 20.117 -9.018 -3.287 525 H LEU 65 HN LEU 65 19.240 -11.203 -1.203 526 HA LEU 65 HA LEU 65 19.503 -13.775 0.001 527 HB2 LEU 65 HB2 LEU 65 17.004 -12.129 -0.490 528 HB3 LEU 65 HB1 LEU 65 17.095 -13.543 0.544 529 HG LEU 65 HG LEU 65 18.717 -11.024 0.909 530 HD11 LEU 65 HD11 LEU 65 16.277 -10.770 1.351 531 HD12 LEU 65 HD12 LEU 65 17.267 -10.527 2.786 532 HD13 LEU 65 HD13 LEU 65 16.395 -12.042 2.562 533 HD21 LEU 65 HD21 LEU 65 18.354 -13.357 2.825 534 HD22 LEU 65 HD22 LEU 65 19.415 -11.965 3.021 535 HD23 LEU 65 HD23 LEU 65 19.790 -13.169 1.804 536 H HIS 66 HN HIS 66 17.777 -12.609 -2.828 537 HA HIS 66 HA HIS 66 16.487 -14.969 -3.585 538 HB2 HIS 66 HB2 HIS 66 16.321 -12.600 -4.641 539 HB3 HIS 66 HB1 HIS 66 17.676 -13.106 -5.641 540 HD1 HIS 66 HD1 HIS 66 17.156 -15.837 -6.500 541 HD2 HIS 66 HD2 HIS 66 13.966 -13.163 -6.034 542 HE1 HIS 66 HE1 HIS 66 15.235 -16.695 -7.949 543 HE2 HIS 66 HE2 HIS 66 13.306 -15.057 -7.655 544 H SER 67 HN SER 67 19.842 -14.070 -3.781 545 HA SER 67 HA SER 67 20.725 -15.791 -5.788 546 HB2 SER 67 HB2 SER 67 22.407 -15.320 -3.355 547 HB3 SER 67 HB1 SER 67 22.869 -15.334 -5.044 548 HG SER 67 HG SER 67 21.867 -13.408 -3.434 549 H HIS 68 HN HIS 68 19.984 -16.432 -2.378 550 HA HIS 68 HA HIS 68 20.838 -19.193 -2.796 551 HB2 HIS 68 HB2 HIS 68 21.010 -19.535 -0.536 552 HB3 HIS 68 HB1 HIS 68 21.398 -17.817 -0.616 553 HD1 HIS 68 HD1 HIS 68 20.108 -16.451 1.050 554 HD2 HIS 68 HD2 HIS 68 18.087 -20.000 0.148 555 HE1 HIS 68 HE1 HIS 68 18.108 -16.584 2.606 556 HE2 HIS 68 HE2 HIS 68 16.845 -18.717 2.027 557 H GLY 69 HN GLY 69 18.363 -17.715 -3.811 558 HA2 GLY 69 HA2 GLY 69 16.656 -18.889 -4.831 559 HA3 GLY 69 HA1 GLY 69 16.761 -20.127 -3.584 560 H VAL 70 HN VAL 70 16.723 -17.054 -2.127 561 HA VAL 70 HA VAL 70 14.030 -17.492 -1.190 562 HB VAL 70 HB VAL 70 15.641 -14.943 -0.933 563 HG11 VAL 70 HG11 VAL 70 14.217 -14.420 0.805 564 HG12 VAL 70 HG12 VAL 70 13.820 -16.102 1.149 565 HG13 VAL 70 HG13 VAL 70 13.100 -15.294 -0.245 566 HG21 VAL 70 HG21 VAL 70 15.816 -17.566 0.507 567 HG22 VAL 70 HG22 VAL 70 16.231 -16.068 1.332 568 HG23 VAL 70 HG23 VAL 70 17.127 -16.566 -0.109 569 H ARG 71 HN ARG 71 12.979 -17.578 -3.197 570 HA ARG 71 HA ARG 71 12.874 -15.359 -5.038 571 HB2 ARG 71 HB2 ARG 71 10.947 -17.659 -4.553 572 HB3 ARG 71 HB1 ARG 71 10.951 -16.531 -5.913 573 HG2 ARG 71 HG2 ARG 71 13.132 -17.266 -6.644 574 HG3 ARG 71 HG1 ARG 71 13.309 -18.324 -5.246 575 HD2 ARG 71 HD2 ARG 71 11.176 -18.566 -7.383 576 HD3 ARG 71 HD1 ARG 71 12.597 -19.590 -7.271 577 HE ARG 71 HE ARG 71 10.193 -19.834 -5.721 578 HH11 ARG 71 HH21 ARG 71 13.649 -20.226 -5.596 579 HH12 ARG 71 HH22 ARG 71 13.648 -21.439 -4.386 580 HH21 ARG 71 HH11 ARG 71 10.151 -21.490 -4.065 581 HH22 ARG 71 HH12 ARG 71 11.622 -22.160 -3.515 582 H GLN 72 HN GLN 72 10.902 -16.586 -2.432 583 HA GLN 72 HA GLN 72 9.661 -13.990 -1.950 584 HB2 GLN 72 HB2 GLN 72 8.196 -16.503 -2.737 585 HB3 GLN 72 HB1 GLN 72 7.402 -15.184 -1.909 586 HG2 GLN 72 HG2 GLN 72 7.966 -13.633 -3.643 587 HG3 GLN 72 HG1 GLN 72 8.924 -14.849 -4.506 588 HE21 GLN 72 HE21 GLN 72 7.551 -16.949 -4.935 589 HE22 GLN 72 HE22 GLN 72 5.985 -16.679 -5.525 590 H ASN 73 HN ASN 73 7.968 -14.459 -0.087 591 HA ASN 73 HA ASN 73 9.459 -15.286 2.199 592 HB2 ASN 73 HB2 ASN 73 7.663 -14.650 3.470 593 HB3 ASN 73 HB1 ASN 73 7.188 -13.797 1.991 594 HD21 ASN 73 HD21 ASN 73 5.349 -14.677 0.835 595 HD22 ASN 73 HD22 ASN 73 4.383 -15.902 1.498 596 H GLY 74 HN GLY 74 8.794 -17.047 3.669 597 HA2 GLY 74 HA2 GLY 74 7.760 -19.231 3.914 598 HA3 GLY 74 HA1 GLY 74 7.847 -19.429 2.191 599 H ASP 75 HN ASP 75 10.646 -18.088 2.405 600 HA ASP 75 HA ASP 75 12.088 -20.582 2.633 601 HB2 ASP 75 HB2 ASP 75 12.720 -18.794 0.954 602 HB3 ASP 75 HB1 ASP 75 13.291 -17.825 2.313 603 H SER 76 HN SER 76 14.000 -20.747 3.988 604 HA SER 76 HA SER 76 13.745 -19.261 6.467 605 HB2 SER 76 HB2 SER 76 12.704 -21.515 6.727 606 HB3 SER 76 HB1 SER 76 14.262 -22.241 6.363 607 HG SER 76 HG SER 76 14.192 -20.234 8.308 608 H ALA 77 HN ALA 77 15.801 -19.282 7.722 609 HA ALA 77 HA ALA 77 18.183 -20.039 6.146 610 HB1 ALA 77 HB1 ALA 77 19.241 -17.902 7.214 611 HB2 ALA 77 HB2 ALA 77 17.573 -17.363 7.376 612 HB3 ALA 77 HB3 ALA 77 18.228 -17.741 5.783 613 H TYR 78 HN TYR 78 20.163 -20.107 7.549 614 HA TYR 78 HA TYR 78 19.411 -21.282 10.155 615 HB2 TYR 78 HB2 TYR 78 20.379 -22.558 7.924 616 HB3 TYR 78 HB1 TYR 78 21.857 -22.185 8.782 617 HD1 TYR 78 HD2 TYR 78 18.440 -23.548 9.388 618 HD2 TYR 78 HD1 TYR 78 22.612 -23.668 10.405 619 HE1 TYR 78 HE2 TYR 78 18.026 -25.505 10.854 620 HE2 TYR 78 HE1 TYR 78 22.216 -25.619 11.843 621 HH TYR 78 HH TYR 78 20.258 -26.634 13.120 622 H LEU 79 HN LEU 79 20.300 -20.293 11.831 623 HA LEU 79 HA LEU 79 22.812 -18.791 11.499 624 HB2 LEU 79 HB2 LEU 79 20.361 -18.184 12.881 625 HB3 LEU 79 HB1 LEU 79 21.686 -18.208 14.031 626 HG LEU 79 HG LEU 79 21.837 -16.682 11.396 627 HD11 LEU 79 HD11 LEU 79 21.300 -15.463 14.100 628 HD12 LEU 79 HD12 LEU 79 19.996 -15.907 12.992 629 HD13 LEU 79 HD13 LEU 79 21.199 -14.718 12.507 630 HD21 LEU 79 HD21 LEU 79 23.821 -17.458 13.203 631 HD22 LEU 79 HD22 LEU 79 23.396 -15.850 13.752 632 HD23 LEU 79 HD23 LEU 79 23.922 -16.096 12.091 633 H TYR 80 HN TYR 80 24.564 -19.608 12.438 634 HA TYR 80 HA TYR 80 24.168 -21.712 14.484 635 HB2 TYR 80 HB2 TYR 80 25.343 -22.196 12.149 636 HB3 TYR 80 HB1 TYR 80 26.729 -21.466 12.953 637 HD1 TYR 80 HD2 TYR 80 27.053 -22.280 15.492 638 HD2 TYR 80 HD1 TYR 80 25.082 -24.509 12.404 639 HE1 TYR 80 HE2 TYR 80 27.447 -24.365 16.751 640 HE2 TYR 80 HE1 TYR 80 25.468 -26.598 13.643 641 HH TYR 80 HH TYR 80 26.048 -26.832 16.679 642 H LEU 81 HN LEU 81 24.821 -21.146 16.484 643 HA LEU 81 HA LEU 81 26.725 -18.899 16.692 644 HB2 LEU 81 HB2 LEU 81 24.464 -19.796 18.453 645 HB3 LEU 81 HB1 LEU 81 25.771 -18.804 19.096 646 HG LEU 81 HG LEU 81 25.333 -17.145 17.215 647 HD11 LEU 81 HD11 LEU 81 24.226 -18.167 15.520 648 HD12 LEU 81 HD12 LEU 81 22.838 -17.485 16.362 649 HD13 LEU 81 HD13 LEU 81 23.263 -19.181 16.590 650 HD21 LEU 81 HD21 LEU 81 22.923 -17.697 18.987 651 HD22 LEU 81 HD22 LEU 81 23.370 -16.155 18.265 652 HD23 LEU 81 HD23 LEU 81 24.382 -16.862 19.523 653 H LEU 82 HN LEU 82 28.662 -19.309 17.377 654 HA LEU 82 HA LEU 82 29.404 -21.923 18.347 655 HB2 LEU 82 HB2 LEU 82 31.017 -19.388 17.978 656 HB3 LEU 82 HB1 LEU 82 31.663 -20.938 18.516 657 HG LEU 82 HG LEU 82 32.095 -20.966 16.188 658 HD11 LEU 82 HD11 LEU 82 29.398 -22.314 16.280 659 HD12 LEU 82 HD12 LEU 82 30.850 -23.002 17.018 660 HD13 LEU 82 HD13 LEU 82 30.790 -22.709 15.285 661 HD21 LEU 82 HD21 LEU 82 30.611 -20.205 14.480 662 HD22 LEU 82 HD22 LEU 82 30.616 -18.944 15.708 663 HD23 LEU 82 HD23 LEU 82 29.254 -20.070 15.587 664 H SER 83 HN SER 83 30.520 -22.314 20.337 665 HA SER 83 HA SER 83 29.145 -21.419 22.576 666 HB2 SER 83 HB2 SER 83 31.479 -22.236 23.659 667 HB3 SER 83 HB1 SER 83 30.220 -23.330 23.117 668 HG SER 83 HG SER 83 32.489 -22.394 21.691 669 H ALA 84 HN ALA 84 29.040 -19.223 22.902 670 HA ALA 84 HA ALA 84 31.345 -17.949 23.988 671 HB1 ALA 84 HB1 ALA 84 32.158 -17.290 21.976 672 HB2 ALA 84 HB2 ALA 84 30.964 -16.012 22.150 673 HB3 ALA 84 HB3 ALA 84 30.604 -17.433 21.170 674 H ARG 85 HN ARG 85 30.764 -15.463 24.087 675 HA ARG 85 HA ARG 85 27.924 -15.106 24.733 676 HB2 ARG 85 HB2 ARG 85 30.290 -14.715 26.553 677 HB3 ARG 85 HB1 ARG 85 28.963 -13.593 26.644 678 HG2 ARG 85 HG2 ARG 85 28.228 -15.191 28.177 679 HG3 ARG 85 HG1 ARG 85 27.433 -15.752 26.720 680 HD2 ARG 85 HD2 ARG 85 28.862 -17.435 28.247 681 HD3 ARG 85 HD1 ARG 85 28.774 -17.607 26.516 682 HE ARG 85 HE ARG 85 31.020 -17.080 26.394 683 HH11 ARG 85 HH21 ARG 85 29.747 -16.070 29.462 684 HH12 ARG 85 HH22 ARG 85 31.268 -15.724 30.159 685 HH21 ARG 85 HH11 ARG 85 33.061 -16.639 27.292 686 HH22 ARG 85 HH12 ARG 85 33.210 -16.075 28.896 687 H ASN 86 HN ASN 86 27.294 -12.859 24.580 688 HA ASN 86 HA ASN 86 28.596 -11.549 22.416 689 HB2 ASN 86 HB2 ASN 86 26.206 -11.119 22.874 690 HB3 ASN 86 HB1 ASN 86 26.648 -10.382 24.406 691 HD21 ASN 86 HD21 ASN 86 26.825 -9.874 20.866 692 HD22 ASN 86 HD22 ASN 86 27.262 -8.242 20.984 693 H THR 87 HN THR 87 30.496 -10.598 22.451 694 HA THR 87 HA THR 87 31.719 -9.862 24.898 695 HB THR 87 HB THR 87 32.792 -8.817 22.321 696 HG1 THR 87 HG1 THR 87 32.937 -10.697 21.381 697 HG21 THR 87 HG21 THR 87 34.533 -10.626 23.620 698 HG22 THR 87 HG22 THR 87 33.770 -9.700 24.907 699 HG23 THR 87 HG23 THR 87 34.615 -8.876 23.604 700 H SER 88 HN SER 88 31.433 -7.973 25.930 701 HA SER 88 HA SER 88 29.554 -6.115 25.108 702 HB2 SER 88 HB2 SER 88 31.501 -5.172 27.107 703 HB3 SER 88 HB1 SER 88 29.761 -5.336 27.197 704 HG SER 88 HG SER 88 29.968 -7.372 27.880 705 H LEU 89 HN LEU 89 31.717 -6.357 23.112 706 HA LEU 89 HA LEU 89 32.989 -3.741 23.119 707 HB2 LEU 89 HB2 LEU 89 33.881 -4.433 20.891 708 HB3 LEU 89 HB1 LEU 89 34.327 -5.513 22.198 709 HG LEU 89 HG LEU 89 32.192 -6.888 21.481 710 HD11 LEU 89 HD11 LEU 89 32.388 -4.844 19.343 711 HD12 LEU 89 HD12 LEU 89 31.031 -5.848 19.855 712 HD13 LEU 89 HD13 LEU 89 32.254 -6.512 18.797 713 HD21 LEU 89 HD21 LEU 89 34.550 -7.645 21.205 714 HD22 LEU 89 HD22 LEU 89 34.644 -6.763 19.690 715 HD23 LEU 89 HD23 LEU 89 33.543 -8.124 19.849 716 H ASN 90 HN ASN 90 30.069 -5.133 22.142 717 HA ASN 90 HA ASN 90 29.547 -2.991 20.203 718 HB2 ASN 90 HB2 ASN 90 27.364 -4.362 19.877 719 HB3 ASN 90 HB1 ASN 90 28.857 -4.954 19.164 720 HD21 ASN 90 HD21 ASN 90 27.866 -5.133 22.595 721 HD22 ASN 90 HD22 ASN 90 27.827 -6.837 22.681 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 0.558 -8.582 -2.495 2 H2 MET 1 HT2 MET 1 2.206 -8.683 -2.873 3 H3 MET 1 HT3 MET 1 1.101 -8.293 -4.065 4 HA MET 1 HA MET 1 0.883 -6.146 -3.400 5 HB2 MET 1 HB2 MET 1 1.462 -7.279 -0.675 6 HB3 MET 1 HB1 MET 1 1.567 -5.543 -0.955 7 HG2 MET 1 HG2 MET 1 -0.780 -5.683 -1.952 8 HG3 MET 1 HG1 MET 1 -0.876 -7.308 -1.293 9 HE1 MET 1 HE1 MET 1 -3.073 -4.922 0.986 10 HE2 MET 1 HE2 MET 1 -3.105 -6.249 -0.161 11 HE3 MET 1 HE3 MET 1 -2.688 -4.639 -0.718 12 HA PRO 2 HA PRO 2 5.380 -6.116 -4.536 13 HB2 PRO 2 HB2 PRO 2 4.460 -3.430 -5.454 14 HB3 PRO 2 HB1 PRO 2 5.430 -4.655 -6.291 15 HG2 PRO 2 HG2 PRO 2 2.918 -4.290 -6.957 16 HG3 PRO 2 HG1 PRO 2 3.589 -5.932 -6.894 17 HD2 PRO 2 HD2 PRO 2 1.767 -4.570 -4.957 18 HD3 PRO 2 HD1 PRO 2 1.814 -6.284 -5.454 19 H THR 3 HN THR 3 3.382 -3.820 -2.808 20 HA THR 3 HA THR 3 5.396 -2.145 -1.751 21 HB THR 3 HB THR 3 3.648 -1.690 0.025 22 HG1 THR 3 HG1 THR 3 2.288 -3.251 0.216 23 HG21 THR 3 HG21 THR 3 3.288 -0.135 -1.571 24 HG22 THR 3 HG22 THR 3 1.902 -1.110 -2.028 25 HG23 THR 3 HG23 THR 3 3.440 -1.294 -2.882 26 H GLN 4 HN GLN 4 4.267 -5.347 -0.902 27 HA GLN 4 HA GLN 4 5.455 -5.339 1.722 28 HB2 GLN 4 HB2 GLN 4 4.298 -7.535 0.046 29 HB3 GLN 4 HB1 GLN 4 4.974 -7.810 1.640 30 HG2 GLN 4 HG2 GLN 4 3.375 -6.219 2.630 31 HG3 GLN 4 HG1 GLN 4 2.698 -5.879 1.042 32 HE21 GLN 4 HE21 GLN 4 1.463 -7.225 3.523 33 HE22 GLN 4 HE22 GLN 4 0.869 -8.692 2.934 34 H ASP 5 HN ASP 5 7.154 -6.461 2.417 35 HA ASP 5 HA ASP 5 9.325 -7.097 0.538 36 HB2 ASP 5 HB2 ASP 5 9.158 -6.775 3.548 37 HB3 ASP 5 HB1 ASP 5 10.577 -7.439 2.790 38 H ILE 6 HN ILE 6 10.511 -9.180 2.137 39 HA ILE 6 HA ILE 6 8.401 -11.227 1.956 40 HB ILE 6 HB ILE 6 10.011 -12.809 1.092 41 HG12 ILE 6 HG12 ILE 6 11.958 -10.521 0.950 42 HG13 ILE 6 HG11 ILE 6 12.010 -11.715 2.249 43 HG21 ILE 6 HG21 ILE 6 10.529 -11.657 -1.117 44 HG22 ILE 6 HG22 ILE 6 9.965 -10.160 -0.390 45 HG23 ILE 6 HG23 ILE 6 8.842 -11.497 -0.609 46 HD11 ILE 6 HD11 ILE 6 12.661 -13.397 0.851 47 HD12 ILE 6 HD12 ILE 6 13.476 -12.029 0.078 48 HD13 ILE 6 HD13 ILE 6 11.966 -12.664 -0.594 49 H ARG 7 HN ARG 7 8.770 -13.103 3.232 50 HA ARG 7 HA ARG 7 9.906 -12.337 5.838 51 HB2 ARG 7 HB2 ARG 7 7.963 -14.563 5.195 52 HB3 ARG 7 HB1 ARG 7 8.431 -13.938 6.763 53 HG2 ARG 7 HG2 ARG 7 7.485 -11.746 6.283 54 HG3 ARG 7 HG1 ARG 7 7.063 -12.283 4.651 55 HD2 ARG 7 HD2 ARG 7 6.017 -13.598 7.168 56 HD3 ARG 7 HD1 ARG 7 5.146 -12.373 6.252 57 HE ARG 7 HE ARG 7 5.813 -14.315 4.391 58 HH11 ARG 7 HH21 ARG 7 4.105 -14.185 7.395 59 HH12 ARG 7 HH22 ARG 7 2.961 -15.385 6.989 60 HH21 ARG 7 HH11 ARG 7 4.352 -15.902 3.794 61 HH22 ARG 7 HH12 ARG 7 3.118 -16.414 4.868 62 H LEU 8 HN LEU 8 11.706 -13.303 6.434 63 HA LEU 8 HA LEU 8 12.391 -15.913 5.276 64 HB2 LEU 8 HB2 LEU 8 14.056 -14.401 4.612 65 HB3 LEU 8 HB1 LEU 8 14.215 -13.681 6.217 66 HG LEU 8 HG LEU 8 14.967 -15.985 7.033 67 HD11 LEU 8 HD11 LEU 8 15.164 -16.547 4.072 68 HD12 LEU 8 HD12 LEU 8 13.982 -17.271 5.154 69 HD13 LEU 8 HD13 LEU 8 15.701 -17.598 5.380 70 HD21 LEU 8 HD21 LEU 8 16.565 -14.150 6.474 71 HD22 LEU 8 HD22 LEU 8 16.654 -14.769 4.827 72 HD23 LEU 8 HD23 LEU 8 17.233 -15.758 6.181 73 H TRP 9 HN TRP 9 12.586 -17.549 6.642 74 HA TRP 9 HA TRP 9 12.378 -16.992 9.549 75 HB2 TRP 9 HB2 TRP 9 12.013 -19.741 8.403 76 HB3 TRP 9 HB1 TRP 9 11.259 -18.985 9.795 77 HD1 TRP 9 HD1 TRP 9 10.070 -16.381 8.427 78 HE1 TRP 9 HE1 TRP 9 8.125 -16.579 6.781 79 HE3 TRP 9 HE3 TRP 9 10.615 -21.254 7.106 80 HZ2 TRP 9 HZ2 TRP 9 6.950 -18.590 5.080 81 HZ3 TRP 9 HZ3 TRP 9 9.113 -22.292 5.486 82 HH2 TRP 9 HH2 TRP 9 7.254 -20.961 4.455 83 H VAL 10 HN VAL 10 14.066 -17.588 10.804 84 HA VAL 10 HA VAL 10 16.243 -19.069 9.455 85 HB VAL 10 HB VAL 10 16.539 -16.860 11.477 86 HG11 VAL 10 HG11 VAL 10 18.875 -16.935 10.990 87 HG12 VAL 10 HG12 VAL 10 18.662 -18.143 9.724 88 HG13 VAL 10 HG13 VAL 10 18.385 -18.567 11.405 89 HG21 VAL 10 HG21 VAL 10 17.487 -15.652 9.401 90 HG22 VAL 10 HG22 VAL 10 15.741 -15.796 9.531 91 HG23 VAL 10 HG23 VAL 10 16.624 -16.863 8.446 92 H SER 11 HN SER 11 17.024 -20.755 10.417 93 HA SER 11 HA SER 11 16.057 -21.512 13.091 94 HB2 SER 11 HB2 SER 11 17.904 -23.149 11.377 95 HB3 SER 11 HB1 SER 11 16.698 -23.669 12.541 96 HG SER 11 HG SER 11 16.371 -22.694 9.896 97 H VAL 12 HN VAL 12 17.291 -20.849 14.782 98 HA VAL 12 HA VAL 12 20.110 -20.207 14.258 99 HB VAL 12 HB VAL 12 18.390 -19.347 16.566 100 HG11 VAL 12 HG11 VAL 12 20.991 -19.230 16.651 101 HG12 VAL 12 HG12 VAL 12 20.064 -17.804 17.081 102 HG13 VAL 12 HG13 VAL 12 20.806 -17.919 15.485 103 HG21 VAL 12 HG21 VAL 12 18.138 -17.194 15.332 104 HG22 VAL 12 HG22 VAL 12 17.376 -18.535 14.477 105 HG23 VAL 12 HG23 VAL 12 18.936 -17.917 13.937 106 H GLU 13 HN GLU 13 21.644 -21.421 15.184 107 HA GLU 13 HA GLU 13 20.998 -22.818 17.677 108 HB2 GLU 13 HB2 GLU 13 22.636 -23.944 15.409 109 HB3 GLU 13 HB1 GLU 13 22.633 -24.599 17.035 110 HG2 GLU 13 HG2 GLU 13 20.164 -24.899 16.928 111 HG3 GLU 13 HG1 GLU 13 20.184 -24.278 15.281 112 H ASP 14 HN ASP 14 22.378 -22.633 19.278 113 HA ASP 14 HA ASP 14 24.670 -20.834 18.871 114 HB2 ASP 14 HB2 ASP 14 23.122 -19.967 20.486 115 HB3 ASP 14 HB1 ASP 14 23.101 -21.544 21.299 116 H ALA 15 HN ALA 15 26.534 -21.090 20.122 117 HA ALA 15 HA ALA 15 27.911 -23.483 19.799 118 HB1 ALA 15 HB1 ALA 15 28.971 -21.267 20.234 119 HB2 ALA 15 HB2 ALA 15 29.596 -22.537 21.304 120 HB3 ALA 15 HB3 ALA 15 28.414 -21.376 21.901 121 H GLN 16 HN GLN 16 25.811 -22.417 22.363 122 HA GLN 16 HA GLN 16 26.566 -24.686 24.085 123 HB2 GLN 16 HB2 GLN 16 24.839 -22.270 24.600 124 HB3 GLN 16 HB1 GLN 16 25.197 -23.511 25.790 125 HG2 GLN 16 HG2 GLN 16 27.359 -22.810 26.113 126 HG3 GLN 16 HG1 GLN 16 27.586 -22.365 24.427 127 HE21 GLN 16 HE21 GLN 16 25.801 -20.454 23.884 128 HE22 GLN 16 HE22 GLN 16 25.919 -19.142 24.931 129 H MET 17 HN MET 17 24.781 -24.525 21.528 130 HA MET 17 HA MET 17 23.157 -25.861 20.723 131 HB2 MET 17 HB2 MET 17 22.910 -26.980 23.559 132 HB3 MET 17 HB1 MET 17 22.005 -27.517 22.167 133 HG2 MET 17 HG2 MET 17 24.039 -28.124 20.972 134 HG3 MET 17 HG1 MET 17 25.013 -27.472 22.289 135 HE1 MET 17 HE1 MET 17 21.617 -29.637 22.584 136 HE2 MET 17 HE2 MET 17 22.354 -31.203 22.317 137 HE3 MET 17 HE3 MET 17 22.489 -29.968 21.079 138 H HIS 18 HN HIS 18 22.717 -23.146 21.935 139 HA HIS 18 HA HIS 18 19.942 -23.239 22.782 140 HB2 HIS 18 HB2 HIS 18 21.507 -20.783 21.809 141 HB3 HIS 18 HB1 HIS 18 19.952 -20.822 22.532 142 HD1 HIS 18 HD1 HIS 18 23.540 -20.979 23.492 143 HD2 HIS 18 HD2 HIS 18 19.806 -21.548 25.294 144 HE1 HIS 18 HE1 HIS 18 23.913 -20.967 25.999 145 HE2 HIS 18 HE2 HIS 18 21.655 -21.310 27.099 146 H THR 19 HN THR 19 18.421 -23.794 21.364 147 HA THR 19 HA THR 19 18.861 -23.158 18.535 148 HB THR 19 HB THR 19 16.942 -25.169 19.729 149 HG1 THR 19 HG1 THR 19 19.531 -25.302 19.689 150 HG21 THR 19 HG21 THR 19 16.568 -24.158 17.363 151 HG22 THR 19 HG22 THR 19 16.567 -25.903 17.524 152 HG23 THR 19 HG23 THR 19 17.987 -25.084 16.898 153 H VAL 20 HN VAL 20 17.710 -21.537 17.702 154 HA VAL 20 HA VAL 20 15.043 -20.941 18.823 155 HB VAL 20 HB VAL 20 16.948 -18.752 17.979 156 HG11 VAL 20 HG11 VAL 20 15.394 -17.510 19.632 157 HG12 VAL 20 HG12 VAL 20 14.327 -18.888 19.461 158 HG13 VAL 20 HG13 VAL 20 14.752 -17.921 18.047 159 HG21 VAL 20 HG21 VAL 20 16.587 -20.037 20.703 160 HG22 VAL 20 HG22 VAL 20 17.241 -18.418 20.505 161 HG23 VAL 20 HG23 VAL 20 18.098 -19.807 19.824 162 H THR 21 HN THR 21 13.616 -19.910 17.383 163 HA THR 21 HA THR 21 14.338 -20.088 14.527 164 HB THR 21 HB THR 21 11.557 -20.263 15.722 165 HG1 THR 21 HG1 THR 21 11.684 -22.450 15.292 166 HG21 THR 21 HG21 THR 21 11.728 -19.464 13.383 167 HG22 THR 21 HG22 THR 21 10.909 -21.002 13.495 168 HG23 THR 21 HG23 THR 21 12.583 -20.939 12.942 169 H ILE 22 HN ILE 22 14.355 -18.085 13.582 170 HA ILE 22 HA ILE 22 12.711 -16.021 14.894 171 HB ILE 22 HB ILE 22 14.386 -14.333 14.415 172 HG12 ILE 22 HG12 ILE 22 16.136 -16.642 13.481 173 HG13 ILE 22 HG11 ILE 22 15.355 -15.446 12.425 174 HG21 ILE 22 HG21 ILE 22 15.869 -14.846 16.143 175 HG22 ILE 22 HG22 ILE 22 15.876 -16.564 15.796 176 HG23 ILE 22 HG23 ILE 22 14.460 -15.817 16.552 177 HD11 ILE 22 HD11 ILE 22 17.825 -15.031 13.138 178 HD12 ILE 22 HD12 ILE 22 17.129 -14.532 14.680 179 HD13 ILE 22 HD13 ILE 22 16.690 -13.681 13.192 180 H TRP 23 HN TRP 23 11.846 -14.480 13.628 181 HA TRP 23 HA TRP 23 11.473 -15.301 10.814 182 HB2 TRP 23 HB2 TRP 23 9.579 -13.641 12.470 183 HB3 TRP 23 HB1 TRP 23 9.230 -14.565 11.010 184 HD1 TRP 23 HD1 TRP 23 9.679 -14.933 14.752 185 HE1 TRP 23 HE1 TRP 23 9.106 -17.322 15.470 186 HE3 TRP 23 HE3 TRP 23 9.187 -17.091 10.180 187 HZ2 TRP 23 HZ2 TRP 23 8.498 -19.857 14.239 188 HZ3 TRP 23 HZ3 TRP 23 8.611 -19.502 9.967 189 HH2 TRP 23 HH2 TRP 23 8.268 -20.878 11.995 190 H LEU 24 HN LEU 24 12.302 -13.936 9.384 191 HA LEU 24 HA LEU 24 12.807 -11.161 10.250 192 HB2 LEU 24 HB2 LEU 24 14.286 -12.788 8.182 193 HB3 LEU 24 HB1 LEU 24 14.702 -11.183 8.758 194 HG LEU 24 HG LEU 24 14.600 -13.653 10.547 195 HD11 LEU 24 HD11 LEU 24 16.953 -13.670 10.518 196 HD12 LEU 24 HD12 LEU 24 17.055 -12.164 9.634 197 HD13 LEU 24 HD13 LEU 24 16.468 -13.635 8.826 198 HD21 LEU 24 HD21 LEU 24 14.408 -11.973 12.109 199 HD22 LEU 24 HD22 LEU 24 15.042 -10.731 11.021 200 HD23 LEU 24 HD23 LEU 24 16.140 -11.847 11.827 201 H THR 25 HN THR 25 12.176 -9.546 8.947 202 HA THR 25 HA THR 25 10.698 -10.280 6.504 203 HB THR 25 HB THR 25 10.525 -7.521 7.652 204 HG1 THR 25 HG1 THR 25 10.237 -9.419 9.285 205 HG21 THR 25 HG21 THR 25 8.605 -9.461 6.332 206 HG22 THR 25 HG22 THR 25 9.332 -8.034 5.612 207 HG23 THR 25 HG23 THR 25 8.149 -7.857 6.901 208 H VAL 26 HN VAL 26 11.807 -10.009 4.736 209 HA VAL 26 HA VAL 26 13.858 -7.914 4.554 210 HB VAL 26 HB VAL 26 15.555 -9.502 3.914 211 HG11 VAL 26 HG11 VAL 26 15.883 -10.652 5.989 212 HG12 VAL 26 HG12 VAL 26 14.151 -10.727 6.298 213 HG13 VAL 26 HG13 VAL 26 14.995 -9.177 6.379 214 HG21 VAL 26 HG21 VAL 26 14.331 -11.174 2.682 215 HG22 VAL 26 HG22 VAL 26 13.289 -11.522 4.058 216 HG23 VAL 26 HG23 VAL 26 14.982 -11.998 4.096 217 H ARG 27 HN ARG 27 14.954 -8.505 2.230 218 HA ARG 27 HA ARG 27 12.806 -9.034 0.331 219 HB2 ARG 27 HB2 ARG 27 13.554 -7.128 -1.049 220 HB3 ARG 27 HB1 ARG 27 12.775 -6.711 0.464 221 HG2 ARG 27 HG2 ARG 27 15.486 -7.013 1.110 222 HG3 ARG 27 HG1 ARG 27 15.542 -6.066 -0.348 223 HD2 ARG 27 HD2 ARG 27 14.549 -5.388 2.335 224 HD3 ARG 27 HD1 ARG 27 15.218 -4.305 1.135 225 HE ARG 27 HE ARG 27 12.495 -4.675 1.707 226 HH11 ARG 27 HH21 ARG 27 14.605 -4.613 -1.161 227 HH12 ARG 27 HH22 ARG 27 13.385 -3.972 -2.146 228 HH21 ARG 27 HH11 ARG 27 10.925 -3.872 0.317 229 HH22 ARG 27 HH12 ARG 27 11.261 -3.533 -1.336 230 HA PRO 28 HA PRO 28 15.853 -11.603 -1.575 231 HB2 PRO 28 HB2 PRO 28 14.942 -10.437 -4.150 232 HB3 PRO 28 HB1 PRO 28 15.038 -12.142 -3.656 233 HG2 PRO 28 HG2 PRO 28 12.697 -10.964 -3.799 234 HG3 PRO 28 HG1 PRO 28 13.062 -12.046 -2.439 235 HD2 PRO 28 HD2 PRO 28 12.972 -9.040 -2.478 236 HD3 PRO 28 HD1 PRO 28 12.453 -10.184 -1.218 237 H ASP 29 HN ASP 29 15.642 -8.187 -2.383 238 HA ASP 29 HA ASP 29 18.212 -8.125 -3.680 239 HB2 ASP 29 HB2 ASP 29 17.823 -5.641 -3.696 240 HB3 ASP 29 HB1 ASP 29 16.668 -6.609 -4.599 241 H MET 30 HN MET 30 17.368 -8.430 -0.560 242 HA MET 30 HA MET 30 19.337 -6.658 0.611 243 HB2 MET 30 HB2 MET 30 17.483 -8.745 1.678 244 HB3 MET 30 HB1 MET 30 18.933 -8.359 2.588 245 HG2 MET 30 HG2 MET 30 18.367 -6.098 2.799 246 HG3 MET 30 HG1 MET 30 17.058 -6.161 1.648 247 HE1 MET 30 HE1 MET 30 18.462 -7.081 5.093 248 HE2 MET 30 HE2 MET 30 18.191 -8.707 4.463 249 HE3 MET 30 HE3 MET 30 17.227 -8.134 5.791 250 H THR 31 HN THR 31 21.044 -7.764 2.057 251 HA THR 31 HA THR 31 22.064 -10.160 0.734 252 HB THR 31 HB THR 31 23.321 -8.077 0.016 253 HG1 THR 31 HG1 THR 31 24.196 -10.350 0.316 254 HG21 THR 31 HG21 THR 31 24.304 -8.109 2.878 255 HG22 THR 31 HG22 THR 31 23.239 -6.859 2.193 256 HG23 THR 31 HG23 THR 31 24.862 -7.079 1.579 257 H VAL 32 HN VAL 32 23.599 -11.333 2.102 258 HA VAL 32 HA VAL 32 22.400 -11.950 4.554 259 HB VAL 32 HB VAL 32 25.152 -12.558 3.484 260 HG11 VAL 32 HG11 VAL 32 23.640 -13.782 5.824 261 HG12 VAL 32 HG12 VAL 32 25.151 -12.870 5.901 262 HG13 VAL 32 HG13 VAL 32 25.119 -14.449 5.130 263 HG21 VAL 32 HG21 VAL 32 23.324 -13.420 2.094 264 HG22 VAL 32 HG22 VAL 32 22.593 -14.206 3.496 265 HG23 VAL 32 HG23 VAL 32 24.170 -14.736 2.897 266 H ALA 33 HN ALA 33 25.253 -10.023 3.765 267 HA ALA 33 HA ALA 33 26.136 -9.384 6.330 268 HB1 ALA 33 HB1 ALA 33 26.441 -6.994 4.931 269 HB2 ALA 33 HB2 ALA 33 26.400 -8.196 3.655 270 HB3 ALA 33 HB3 ALA 33 27.577 -8.330 4.949 271 H SER 34 HN SER 34 23.605 -7.723 4.381 272 HA SER 34 HA SER 34 22.944 -5.886 6.448 273 HB2 SER 34 HB2 SER 34 20.722 -5.758 5.123 274 HB3 SER 34 HB1 SER 34 22.187 -5.160 4.384 275 HG SER 34 HG SER 34 21.560 -7.906 3.969 276 H LEU 35 HN LEU 35 21.767 -9.074 5.562 277 HA LEU 35 HA LEU 35 19.584 -9.232 7.361 278 HB2 LEU 35 HB2 LEU 35 19.985 -10.823 5.449 279 HB3 LEU 35 HB1 LEU 35 21.390 -11.416 6.324 280 HG LEU 35 HG LEU 35 20.013 -12.189 8.164 281 HD11 LEU 35 HD11 LEU 35 17.418 -12.151 7.474 282 HD12 LEU 35 HD12 LEU 35 17.928 -10.668 6.669 283 HD13 LEU 35 HD13 LEU 35 18.174 -10.860 8.412 284 HD21 LEU 35 HD21 LEU 35 18.963 -13.029 5.444 285 HD22 LEU 35 HD22 LEU 35 18.735 -13.923 6.952 286 HD23 LEU 35 HD23 LEU 35 20.355 -13.717 6.295 287 H LYS 36 HN LYS 36 23.013 -10.075 7.636 288 HA LYS 36 HA LYS 36 23.027 -11.282 10.127 289 HB2 LYS 36 HB2 LYS 36 24.863 -11.106 8.420 290 HB3 LYS 36 HB1 LYS 36 25.066 -9.428 8.897 291 HG2 LYS 36 HG2 LYS 36 25.316 -10.357 11.306 292 HG3 LYS 36 HG1 LYS 36 25.662 -11.902 10.545 293 HD2 LYS 36 HD2 LYS 36 27.038 -9.299 9.949 294 HD3 LYS 36 HD1 LYS 36 27.754 -10.579 10.954 295 HE2 LYS 36 HE2 LYS 36 27.447 -10.395 7.968 296 HE3 LYS 36 HE1 LYS 36 28.751 -11.050 8.929 297 HZ1 LYS 36 HZ1 LYS 36 27.215 -12.589 7.622 298 HZ2 LYS 36 HZ2 LYS 36 26.152 -12.498 8.951 299 HZ3 LYS 36 HZ3 LYS 36 27.783 -13.035 9.119 300 H ASP 37 HN ASP 37 23.354 -7.917 9.111 301 HA ASP 37 HA ASP 37 23.786 -6.823 11.662 302 HB2 ASP 37 HB2 ASP 37 24.405 -5.609 9.666 303 HB3 ASP 37 HB1 ASP 37 22.725 -5.499 9.161 304 H MET 38 HN MET 38 20.701 -7.012 9.789 305 HA MET 38 HA MET 38 19.157 -5.665 11.728 306 HB2 MET 38 HB2 MET 38 17.740 -7.908 10.487 307 HB3 MET 38 HB1 MET 38 17.367 -6.211 10.551 308 HG2 MET 38 HG2 MET 38 19.057 -5.751 8.787 309 HG3 MET 38 HG1 MET 38 19.305 -7.494 8.661 310 HE1 MET 38 HE1 MET 38 16.670 -9.220 7.399 311 HE2 MET 38 HE2 MET 38 15.752 -8.628 8.758 312 HE3 MET 38 HE3 MET 38 17.444 -9.016 8.967 313 H VAL 39 HN VAL 39 19.980 -9.009 11.344 314 HA VAL 39 HA VAL 39 18.474 -9.989 13.477 315 HB VAL 39 HB VAL 39 21.054 -11.010 12.269 316 HG11 VAL 39 HG11 VAL 39 19.326 -12.951 13.668 317 HG12 VAL 39 HG12 VAL 39 20.136 -11.830 14.761 318 HG13 VAL 39 HG13 VAL 39 21.069 -12.808 13.639 319 HG21 VAL 39 HG21 VAL 39 19.692 -11.730 10.618 320 HG22 VAL 39 HG22 VAL 39 18.310 -11.001 11.418 321 HG23 VAL 39 HG23 VAL 39 18.763 -12.663 11.783 322 H PHE 40 HN PHE 40 21.706 -8.588 13.279 323 HA PHE 40 HA PHE 40 22.382 -8.871 16.016 324 HB2 PHE 40 HB2 PHE 40 24.131 -8.344 14.370 325 HB3 PHE 40 HB1 PHE 40 23.290 -6.857 13.964 326 HD1 PHE 40 HD2 PHE 40 24.316 -8.523 17.180 327 HD2 PHE 40 HD1 PHE 40 24.278 -4.951 14.796 328 HE1 PHE 40 HE2 PHE 40 25.503 -7.321 18.972 329 HE2 PHE 40 HE1 PHE 40 25.466 -3.741 16.603 330 HZ PHE 40 HZ PHE 40 26.085 -4.922 18.691 331 H LEU 41 HN LEU 41 20.828 -6.332 14.104 332 HA LEU 41 HA LEU 41 20.478 -4.405 16.154 333 HB2 LEU 41 HB2 LEU 41 18.581 -5.033 13.862 334 HB3 LEU 41 HB1 LEU 41 18.621 -3.564 14.809 335 HG LEU 41 HG LEU 41 20.874 -4.581 13.097 336 HD11 LEU 41 HD11 LEU 41 20.306 -3.002 11.477 337 HD12 LEU 41 HD12 LEU 41 19.255 -2.104 12.559 338 HD13 LEU 41 HD13 LEU 41 18.750 -3.677 11.939 339 HD21 LEU 41 HD21 LEU 41 20.582 -2.342 15.029 340 HD22 LEU 41 HD22 LEU 41 21.468 -2.028 13.523 341 HD23 LEU 41 HD23 LEU 41 21.983 -3.337 14.605 342 H ASP 42 HN ASP 42 18.479 -6.921 14.914 343 HA ASP 42 HA ASP 42 16.311 -6.424 16.735 344 HB2 ASP 42 HB2 ASP 42 16.068 -7.323 14.357 345 HB3 ASP 42 HB1 ASP 42 16.500 -8.891 15.012 346 H TYR 43 HN TYR 43 18.677 -9.060 16.542 347 HA TYR 43 HA TYR 43 17.537 -10.109 19.057 348 HB2 TYR 43 HB2 TYR 43 19.222 -11.544 16.997 349 HB3 TYR 43 HB1 TYR 43 18.480 -12.243 18.430 350 HD1 TYR 43 HD2 TYR 43 15.990 -12.368 18.679 351 HD2 TYR 43 HD1 TYR 43 17.880 -11.058 15.054 352 HE1 TYR 43 HE2 TYR 43 13.870 -12.658 17.462 353 HE2 TYR 43 HE1 TYR 43 15.765 -11.346 13.846 354 HH TYR 43 HH TYR 43 13.305 -11.275 14.550 355 H GLY 44 HN GLY 44 20.110 -8.213 18.139 356 HA2 GLY 44 HA2 GLY 44 22.060 -7.659 19.205 357 HA3 GLY 44 HA1 GLY 44 21.452 -8.533 20.603 358 H PHE 45 HN PHE 45 21.779 -9.977 17.469 359 HA PHE 45 HA PHE 45 23.444 -12.084 18.546 360 HB2 PHE 45 HB2 PHE 45 22.105 -11.586 15.888 361 HB3 PHE 45 HB1 PHE 45 23.314 -12.839 16.064 362 HD1 PHE 45 HD1 PHE 45 21.509 -12.283 19.164 363 HD2 PHE 45 HD2 PHE 45 21.318 -14.306 15.356 364 HE1 PHE 45 HE1 PHE 45 19.829 -13.824 20.059 365 HE2 PHE 45 HE2 PHE 45 19.624 -15.849 16.270 366 HZ PHE 45 HZ PHE 45 18.873 -15.612 18.626 367 HA PRO 46 HA PRO 46 26.950 -9.458 17.514 368 HB2 PRO 46 HB2 PRO 46 28.886 -11.280 18.266 369 HB3 PRO 46 HB1 PRO 46 28.098 -10.126 19.346 370 HG2 PRO 46 HG2 PRO 46 27.452 -13.010 18.936 371 HG3 PRO 46 HG1 PRO 46 27.462 -12.102 20.435 372 HD2 PRO 46 HD2 PRO 46 25.189 -12.686 19.238 373 HD3 PRO 46 HD1 PRO 46 25.391 -11.096 20.012 374 HA PRO 47 HA PRO 47 27.346 -11.141 13.370 375 HB2 PRO 47 HB2 PRO 47 29.407 -9.514 12.560 376 HB3 PRO 47 HB1 PRO 47 27.693 -9.019 12.541 377 HG2 PRO 47 HG2 PRO 47 29.824 -8.441 14.551 378 HG3 PRO 47 HG1 PRO 47 28.543 -7.385 13.932 379 HD2 PRO 47 HD2 PRO 47 28.301 -8.482 16.334 380 HD3 PRO 47 HD1 PRO 47 26.885 -8.354 15.274 381 H VAL 48 HN VAL 48 30.094 -10.753 15.508 382 HA VAL 48 HA VAL 48 31.927 -12.345 14.068 383 HB VAL 48 HB VAL 48 32.866 -11.019 15.776 384 HG11 VAL 48 HG11 VAL 48 31.831 -12.011 18.247 385 HG12 VAL 48 HG12 VAL 48 30.449 -11.652 17.206 386 HG13 VAL 48 HG13 VAL 48 31.634 -10.412 17.544 387 HG21 VAL 48 HG21 VAL 48 33.738 -13.424 15.652 388 HG22 VAL 48 HG22 VAL 48 32.761 -13.755 17.085 389 HG23 VAL 48 HG23 VAL 48 34.061 -12.573 17.163 390 H LEU 49 HN LEU 49 29.542 -13.108 16.521 391 HA LEU 49 HA LEU 49 30.180 -15.880 16.694 392 HB2 LEU 49 HB2 LEU 49 27.894 -14.218 17.617 393 HB3 LEU 49 HB1 LEU 49 27.822 -15.962 17.723 394 HG LEU 49 HG LEU 49 30.154 -15.857 18.847 395 HD11 LEU 49 HD11 LEU 49 31.077 -13.823 19.064 396 HD12 LEU 49 HD12 LEU 49 29.764 -13.358 20.145 397 HD13 LEU 49 HD13 LEU 49 29.631 -13.058 18.421 398 HD21 LEU 49 HD21 LEU 49 27.496 -15.684 19.880 399 HD22 LEU 49 HD22 LEU 49 28.497 -14.658 20.886 400 HD23 LEU 49 HD23 LEU 49 28.930 -16.353 20.637 401 H GLN 50 HN GLN 50 27.837 -14.004 14.895 402 HA GLN 50 HA GLN 50 26.141 -16.086 14.140 403 HB2 GLN 50 HB2 GLN 50 26.739 -13.496 12.707 404 HB3 GLN 50 HB1 GLN 50 25.487 -14.623 12.198 405 HG2 GLN 50 HG2 GLN 50 24.392 -14.358 14.403 406 HG3 GLN 50 HG1 GLN 50 25.615 -13.168 14.871 407 HE21 GLN 50 HE21 GLN 50 24.571 -11.073 14.702 408 HE22 GLN 50 HE22 GLN 50 23.676 -10.636 13.340 409 H GLN 51 HN GLN 51 26.341 -17.744 12.826 410 HA GLN 51 HA GLN 51 27.914 -17.391 10.397 411 HB2 GLN 51 HB2 GLN 51 27.818 -19.869 12.113 412 HB3 GLN 51 HB1 GLN 51 28.248 -19.921 10.394 413 HG2 GLN 51 HG2 GLN 51 30.035 -18.215 10.846 414 HG3 GLN 51 HG1 GLN 51 29.676 -18.339 12.560 415 HE21 GLN 51 HE21 GLN 51 29.193 -21.428 11.327 416 HE22 GLN 51 HE22 GLN 51 30.743 -22.041 11.612 417 H TRP 52 HN TRP 52 26.598 -17.309 8.800 418 HA TRP 52 HA TRP 52 23.871 -18.376 9.058 419 HB2 TRP 52 HB2 TRP 52 25.197 -16.345 7.257 420 HB3 TRP 52 HB1 TRP 52 23.597 -17.001 6.925 421 HD1 TRP 52 HD1 TRP 52 25.459 -15.026 9.700 422 HE1 TRP 52 HE1 TRP 52 23.656 -13.644 11.012 423 HE3 TRP 52 HE3 TRP 52 21.248 -16.747 7.454 424 HZ2 TRP 52 HZ2 TRP 52 20.795 -13.352 11.039 425 HZ3 TRP 52 HZ3 TRP 52 19.025 -15.934 8.111 426 HH2 TRP 52 HH2 TRP 52 18.809 -14.219 9.927 427 H VAL 53 HN VAL 53 23.274 -20.190 7.951 428 HA VAL 53 HA VAL 53 24.965 -20.967 5.659 429 HB VAL 53 HB VAL 53 23.772 -22.851 7.705 430 HG11 VAL 53 HG11 VAL 53 25.167 -24.543 6.523 431 HG12 VAL 53 HG12 VAL 53 25.586 -23.332 5.334 432 HG13 VAL 53 HG13 VAL 53 23.906 -23.874 5.481 433 HG21 VAL 53 HG21 VAL 53 26.269 -23.275 8.167 434 HG22 VAL 53 HG22 VAL 53 25.631 -21.760 8.769 435 HG23 VAL 53 HG23 VAL 53 26.583 -21.788 7.278 436 H ILE 54 HN ILE 54 23.938 -21.450 3.866 437 HA ILE 54 HA ILE 54 21.054 -22.023 3.939 438 HB ILE 54 HB ILE 54 22.519 -20.253 1.947 439 HG12 ILE 54 HG12 ILE 54 20.225 -19.588 3.814 440 HG13 ILE 54 HG11 ILE 54 21.907 -19.250 4.231 441 HG21 ILE 54 HG21 ILE 54 19.564 -20.924 2.071 442 HG22 ILE 54 HG22 ILE 54 20.674 -21.718 0.956 443 HG23 ILE 54 HG23 ILE 54 20.388 -19.980 0.844 444 HD11 ILE 54 HD11 ILE 54 22.105 -17.805 2.241 445 HD12 ILE 54 HD12 ILE 54 20.768 -17.282 3.260 446 HD13 ILE 54 HD13 ILE 54 20.442 -18.189 1.792 447 H GLY 55 HN GLY 55 20.587 -23.917 2.899 448 HA2 GLY 55 HA2 GLY 55 22.626 -25.620 2.060 449 HA3 GLY 55 HA1 GLY 55 20.931 -25.850 1.685 450 H GLN 56 HN GLN 56 20.462 -23.573 0.181 451 HA GLN 56 HA GLN 56 21.576 -24.402 -2.365 452 HB2 GLN 56 HB2 GLN 56 19.707 -22.105 -1.767 453 HB3 GLN 56 HB1 GLN 56 20.041 -22.763 -3.349 454 HG2 GLN 56 HG2 GLN 56 18.810 -24.324 -1.070 455 HG3 GLN 56 HG1 GLN 56 17.922 -23.638 -2.429 456 HE21 GLN 56 HE21 GLN 56 20.660 -24.508 -3.982 457 HE22 GLN 56 HE22 GLN 56 20.296 -26.121 -4.335 458 H ARG 57 HN ARG 57 22.457 -22.065 -0.034 459 HA ARG 57 HA ARG 57 24.128 -20.737 -2.032 460 HB2 ARG 57 HB2 ARG 57 22.783 -18.989 -1.950 461 HB3 ARG 57 HB1 ARG 57 21.962 -19.537 -0.491 462 HG2 ARG 57 HG2 ARG 57 23.612 -18.532 0.920 463 HG3 ARG 57 HG1 ARG 57 24.753 -18.377 -0.394 464 HD2 ARG 57 HD2 ARG 57 22.121 -16.915 -0.305 465 HD3 ARG 57 HD1 ARG 57 23.659 -16.210 0.173 466 HE ARG 57 HE ARG 57 22.792 -16.654 -2.530 467 HH11 ARG 57 HH21 ARG 57 25.566 -16.630 -0.378 468 HH12 ARG 57 HH22 ARG 57 26.687 -16.295 -1.632 469 HH21 ARG 57 HH11 ARG 57 24.280 -16.259 -4.181 470 HH22 ARG 57 HH12 ARG 57 25.959 -16.080 -3.842 471 H LEU 58 HN LEU 58 26.034 -19.938 -1.532 472 HA LEU 58 HA LEU 58 27.457 -21.116 0.653 473 HB2 LEU 58 HB2 LEU 58 28.204 -18.924 -1.316 474 HB3 LEU 58 HB1 LEU 58 29.286 -19.575 -0.103 475 HG LEU 58 HG LEU 58 28.744 -21.899 -1.083 476 HD11 LEU 58 HD11 LEU 58 28.236 -21.630 -3.619 477 HD12 LEU 58 HD12 LEU 58 27.567 -20.070 -3.158 478 HD13 LEU 58 HD13 LEU 58 26.894 -21.555 -2.480 479 HD21 LEU 58 HD21 LEU 58 30.484 -21.654 -2.784 480 HD22 LEU 58 HD22 LEU 58 30.916 -20.669 -1.398 481 HD23 LEU 58 HD23 LEU 58 30.225 -19.913 -2.843 482 H ALA 59 HN ALA 59 28.032 -20.304 2.534 483 HA ALA 59 HA ALA 59 26.464 -18.314 3.776 484 HB1 ALA 59 HB1 ALA 59 28.998 -19.725 4.628 485 HB2 ALA 59 HB2 ALA 59 27.352 -20.058 5.149 486 HB3 ALA 59 HB3 ALA 59 28.149 -18.570 5.651 487 H ARG 60 HN ARG 60 27.295 -16.979 1.666 488 HA ARG 60 HA ARG 60 29.562 -15.310 2.528 489 HB2 ARG 60 HB2 ARG 60 29.026 -16.339 0.031 490 HB3 ARG 60 HB1 ARG 60 28.343 -14.720 -0.071 491 HG2 ARG 60 HG2 ARG 60 30.547 -14.340 -0.709 492 HG3 ARG 60 HG1 ARG 60 30.592 -13.926 0.993 493 HD2 ARG 60 HD2 ARG 60 31.391 -16.598 -0.212 494 HD3 ARG 60 HD1 ARG 60 32.509 -15.418 0.437 495 HE ARG 60 HE ARG 60 30.803 -17.243 1.942 496 HH11 ARG 60 HH21 ARG 60 32.777 -14.370 1.977 497 HH12 ARG 60 HH22 ARG 60 32.941 -14.340 3.682 498 HH21 ARG 60 HH11 ARG 60 31.005 -17.178 4.247 499 HH22 ARG 60 HH12 ARG 60 31.924 -15.923 4.974 500 H ASP 61 HN ASP 61 29.308 -13.509 3.423 501 HA ASP 61 HA ASP 61 26.848 -12.571 4.242 502 HB2 ASP 61 HB2 ASP 61 29.622 -11.470 4.322 503 HB3 ASP 61 HB1 ASP 61 28.273 -10.458 4.802 504 H GLN 62 HN GLN 62 28.978 -11.395 1.712 505 HA GLN 62 HA GLN 62 27.513 -9.034 1.220 506 HB2 GLN 62 HB2 GLN 62 29.595 -10.320 -0.517 507 HB3 GLN 62 HB1 GLN 62 29.100 -8.637 -0.519 508 HG2 GLN 62 HG2 GLN 62 30.746 -8.286 0.999 509 HG3 GLN 62 HG1 GLN 62 29.693 -9.056 2.162 510 HE21 GLN 62 HE21 GLN 62 32.763 -9.299 0.744 511 HE22 GLN 62 HE22 GLN 62 33.074 -10.907 1.154 512 H GLU 63 HN GLU 63 26.907 -12.192 0.066 513 HA GLU 63 HA GLU 63 25.966 -11.313 -2.520 514 HB2 GLU 63 HB2 GLU 63 25.748 -14.018 -1.166 515 HB3 GLU 63 HB1 GLU 63 25.162 -13.679 -2.788 516 HG2 GLU 63 HG2 GLU 63 27.413 -12.946 -3.482 517 HG3 GLU 63 HG1 GLU 63 28.028 -13.312 -1.862 518 H THR 64 HN THR 64 23.886 -11.183 -3.334 519 HA THR 64 HA THR 64 22.002 -10.060 -1.600 520 HB THR 64 HB THR 64 21.317 -11.164 -4.318 521 HG1 THR 64 HG1 THR 64 23.167 -9.186 -3.604 522 HG21 THR 64 HG21 THR 64 19.680 -9.607 -4.299 523 HG22 THR 64 HG22 THR 64 20.700 -8.372 -3.582 524 HG23 THR 64 HG23 THR 64 19.924 -9.577 -2.562 525 H LEU 65 HN LEU 65 19.974 -10.879 -0.895 526 HA LEU 65 HA LEU 65 19.901 -13.615 -0.126 527 HB2 LEU 65 HB2 LEU 65 17.645 -11.608 -0.347 528 HB3 LEU 65 HB1 LEU 65 17.485 -13.180 0.428 529 HG LEU 65 HG LEU 65 19.357 -10.944 1.257 530 HD11 LEU 65 HD11 LEU 65 17.100 -12.043 2.898 531 HD12 LEU 65 HD12 LEU 65 16.817 -10.778 1.711 532 HD13 LEU 65 HD13 LEU 65 17.927 -10.500 3.046 533 HD21 LEU 65 HD21 LEU 65 18.871 -13.682 2.504 534 HD22 LEU 65 HD22 LEU 65 19.788 -12.373 3.248 535 HD23 LEU 65 HD23 LEU 65 20.386 -13.118 1.774 536 H HIS 66 HN HIS 66 18.426 -11.852 -2.787 537 HA HIS 66 HA HIS 66 16.740 -13.669 -3.948 538 HB2 HIS 66 HB2 HIS 66 17.341 -11.391 -4.862 539 HB3 HIS 66 HB1 HIS 66 18.826 -12.099 -5.495 540 HD1 HIS 66 HD1 HIS 66 18.551 -12.524 -7.918 541 HD2 HIS 66 HD2 HIS 66 15.032 -13.376 -5.829 542 HE1 HIS 66 HE1 HIS 66 16.857 -13.370 -9.623 543 HE2 HIS 66 HE2 HIS 66 14.719 -13.882 -8.350 544 H SER 67 HN SER 67 20.260 -13.693 -4.017 545 HA SER 67 HA SER 67 20.703 -15.726 -5.845 546 HB2 SER 67 HB2 SER 67 22.491 -14.325 -4.958 547 HB3 SER 67 HB1 SER 67 22.291 -15.034 -3.365 548 HG SER 67 HG SER 67 22.969 -16.415 -5.782 549 H HIS 68 HN HIS 68 19.340 -15.944 -2.682 550 HA HIS 68 HA HIS 68 19.917 -18.741 -2.302 551 HB2 HIS 68 HB2 HIS 68 19.528 -17.654 -0.266 552 HB3 HIS 68 HB1 HIS 68 18.173 -16.729 -0.856 553 HD1 HIS 68 HD1 HIS 68 16.039 -17.590 0.178 554 HD2 HIS 68 HD2 HIS 68 18.758 -20.686 -0.506 555 HE1 HIS 68 HE1 HIS 68 14.917 -19.719 0.938 556 HE2 HIS 68 HE2 HIS 68 16.550 -21.618 0.537 557 H GLY 69 HN GLY 69 17.924 -17.080 -4.414 558 HA2 GLY 69 HA2 GLY 69 16.546 -18.073 -6.055 559 HA3 GLY 69 HA1 GLY 69 16.470 -19.533 -5.073 560 H VAL 70 HN VAL 70 16.088 -16.717 -3.320 561 HA VAL 70 HA VAL 70 13.279 -17.289 -2.864 562 HB VAL 70 HB VAL 70 14.356 -16.989 -0.835 563 HG11 VAL 70 HG11 VAL 70 16.003 -15.180 -0.397 564 HG12 VAL 70 HG12 VAL 70 15.852 -14.647 -2.066 565 HG13 VAL 70 HG13 VAL 70 16.526 -16.237 -1.704 566 HG21 VAL 70 HG21 VAL 70 13.523 -14.990 0.114 567 HG22 VAL 70 HG22 VAL 70 12.375 -15.389 -1.153 568 HG23 VAL 70 HG23 VAL 70 13.581 -14.114 -1.406 569 H ARG 71 HN ARG 71 11.818 -16.284 -4.005 570 HA ARG 71 HA ARG 71 12.443 -13.672 -5.231 571 HB2 ARG 71 HB2 ARG 71 10.263 -14.418 -6.609 572 HB3 ARG 71 HB1 ARG 71 11.889 -14.905 -7.058 573 HG2 ARG 71 HG2 ARG 71 11.599 -17.009 -5.708 574 HG3 ARG 71 HG1 ARG 71 9.913 -16.565 -5.442 575 HD2 ARG 71 HD2 ARG 71 10.000 -18.079 -7.333 576 HD3 ARG 71 HD1 ARG 71 9.608 -16.484 -7.928 577 HE ARG 71 HE ARG 71 11.672 -16.351 -8.969 578 HH11 ARG 71 HH21 ARG 71 11.541 -19.152 -6.860 579 HH12 ARG 71 HH22 ARG 71 12.998 -19.837 -7.411 580 HH21 ARG 71 HH11 ARG 71 13.650 -17.263 -9.717 581 HH22 ARG 71 HH12 ARG 71 14.220 -18.735 -9.066 582 H GLN 72 HN GLN 72 10.482 -15.278 -2.923 583 HA GLN 72 HA GLN 72 9.299 -12.838 -2.080 584 HB2 GLN 72 HB2 GLN 72 6.959 -13.692 -2.223 585 HB3 GLN 72 HB1 GLN 72 7.678 -13.417 -3.807 586 HG2 GLN 72 HG2 GLN 72 8.395 -15.938 -3.663 587 HG3 GLN 72 HG1 GLN 72 7.168 -16.017 -2.400 588 HE21 GLN 72 HE21 GLN 72 7.525 -14.810 -5.786 589 HE22 GLN 72 HE22 GLN 72 5.946 -15.242 -6.216 590 H ASN 73 HN ASN 73 7.824 -13.431 -0.096 591 HA ASN 73 HA ASN 73 9.323 -14.786 1.808 592 HB2 ASN 73 HB2 ASN 73 7.527 -14.616 3.280 593 HB3 ASN 73 HB1 ASN 73 7.286 -13.229 2.220 594 HD21 ASN 73 HD21 ASN 73 5.776 -13.923 0.193 595 HD22 ASN 73 HD22 ASN 73 4.430 -14.860 0.615 596 H GLY 74 HN GLY 74 8.826 -16.721 3.018 597 HA2 GLY 74 HA2 GLY 74 7.715 -18.919 3.053 598 HA3 GLY 74 HA1 GLY 74 7.803 -18.935 1.298 599 H ASP 75 HN ASP 75 10.592 -17.505 2.109 600 HA ASP 75 HA ASP 75 12.133 -19.928 1.812 601 HB2 ASP 75 HB2 ASP 75 14.036 -18.149 2.081 602 HB3 ASP 75 HB1 ASP 75 13.129 -18.194 0.576 603 H SER 76 HN SER 76 14.116 -20.157 3.234 604 HA SER 76 HA SER 76 13.760 -19.306 5.987 605 HB2 SER 76 HB2 SER 76 13.957 -22.283 5.580 606 HB3 SER 76 HB1 SER 76 13.325 -21.364 6.936 607 HG SER 76 HG SER 76 11.689 -20.610 5.276 608 H ALA 77 HN ALA 77 15.702 -19.624 7.250 609 HA ALA 77 HA ALA 77 18.060 -20.609 5.745 610 HB1 ALA 77 HB1 ALA 77 19.369 -18.710 6.272 611 HB2 ALA 77 HB2 ALA 77 18.174 -18.092 7.401 612 HB3 ALA 77 HB3 ALA 77 17.842 -18.070 5.670 613 H TYR 78 HN TYR 78 20.047 -20.854 7.134 614 HA TYR 78 HA TYR 78 19.323 -21.888 9.811 615 HB2 TYR 78 HB2 TYR 78 20.178 -23.392 7.763 616 HB3 TYR 78 HB1 TYR 78 21.742 -22.855 8.345 617 HD1 TYR 78 HD1 TYR 78 22.514 -23.454 10.677 618 HD2 TYR 78 HD2 TYR 78 18.786 -24.853 9.060 619 HE1 TYR 78 HE1 TYR 78 22.376 -25.156 12.443 620 HE2 TYR 78 HE2 TYR 78 18.646 -26.543 10.828 621 HH TYR 78 HH TYR 78 21.010 -26.659 13.476 622 H LEU 79 HN LEU 79 20.300 -20.841 11.459 623 HA LEU 79 HA LEU 79 22.784 -19.355 10.887 624 HB2 LEU 79 HB2 LEU 79 21.017 -17.757 11.253 625 HB3 LEU 79 HB1 LEU 79 20.497 -18.602 12.716 626 HG LEU 79 HG LEU 79 22.750 -18.101 13.741 627 HD11 LEU 79 HD11 LEU 79 23.400 -17.393 11.061 628 HD12 LEU 79 HD12 LEU 79 24.425 -17.313 12.492 629 HD13 LEU 79 HD13 LEU 79 23.463 -15.920 12.023 630 HD21 LEU 79 HD21 LEU 79 21.954 -16.138 14.556 631 HD22 LEU 79 HD22 LEU 79 20.539 -16.457 13.554 632 HD23 LEU 79 HD23 LEU 79 21.823 -15.406 12.959 633 H TYR 80 HN TYR 80 24.474 -19.757 12.129 634 HA TYR 80 HA TYR 80 24.073 -21.378 14.562 635 HB2 TYR 80 HB2 TYR 80 25.047 -22.815 12.886 636 HB3 TYR 80 HB1 TYR 80 26.255 -21.598 12.475 637 HD1 TYR 80 HD1 TYR 80 25.008 -23.497 15.494 638 HD2 TYR 80 HD2 TYR 80 28.371 -21.808 13.418 639 HE1 TYR 80 HE1 TYR 80 26.524 -24.431 17.195 640 HE2 TYR 80 HE2 TYR 80 29.888 -22.737 15.110 641 HH TYR 80 HH TYR 80 29.995 -23.679 17.135 642 H LEU 81 HN LEU 81 25.042 -20.621 16.359 643 HA LEU 81 HA LEU 81 26.628 -18.148 16.042 644 HB2 LEU 81 HB2 LEU 81 25.149 -19.130 18.494 645 HB3 LEU 81 HB1 LEU 81 26.012 -17.626 18.361 646 HG LEU 81 HG LEU 81 23.713 -18.434 16.581 647 HD11 LEU 81 HD11 LEU 81 23.805 -16.466 18.913 648 HD12 LEU 81 HD12 LEU 81 22.967 -18.011 18.909 649 HD13 LEU 81 HD13 LEU 81 22.420 -16.708 17.851 650 HD21 LEU 81 HD21 LEU 81 24.592 -16.813 15.269 651 HD22 LEU 81 HD22 LEU 81 25.630 -16.171 16.564 652 HD23 LEU 81 HD23 LEU 81 23.942 -15.690 16.455 653 H LEU 82 HN LEU 82 28.603 -18.137 16.484 654 HA LEU 82 HA LEU 82 30.041 -20.488 17.360 655 HB2 LEU 82 HB2 LEU 82 30.811 -17.760 16.422 656 HB3 LEU 82 HB1 LEU 82 32.009 -18.709 17.297 657 HG LEU 82 HG LEU 82 31.941 -18.933 14.720 658 HD11 LEU 82 HD11 LEU 82 32.504 -21.308 14.820 659 HD12 LEU 82 HD12 LEU 82 31.806 -21.422 16.439 660 HD13 LEU 82 HD13 LEU 82 33.227 -20.413 16.150 661 HD21 LEU 82 HD21 LEU 82 30.345 -20.743 13.982 662 HD22 LEU 82 HD22 LEU 82 29.558 -19.209 14.355 663 HD23 LEU 82 HD23 LEU 82 29.462 -20.549 15.486 664 H SER 83 HN SER 83 31.515 -20.606 19.111 665 HA SER 83 HA SER 83 30.329 -19.901 21.555 666 HB2 SER 83 HB2 SER 83 33.250 -20.588 21.384 667 HB3 SER 83 HB1 SER 83 32.065 -20.988 22.609 668 HG SER 83 HG SER 83 32.336 -22.805 21.392 669 H ALA 84 HN ALA 84 30.008 -17.852 22.014 670 HA ALA 84 HA ALA 84 31.980 -16.256 23.123 671 HB1 ALA 84 HB1 ALA 84 31.621 -15.859 20.222 672 HB2 ALA 84 HB2 ALA 84 32.913 -15.313 21.282 673 HB3 ALA 84 HB3 ALA 84 31.431 -14.381 21.168 674 H ARG 85 HN ARG 85 30.916 -13.783 23.049 675 HA ARG 85 HA ARG 85 28.040 -14.158 23.614 676 HB2 ARG 85 HB2 ARG 85 30.039 -12.697 25.333 677 HB3 ARG 85 HB1 ARG 85 28.304 -12.638 25.591 678 HG2 ARG 85 HG2 ARG 85 29.986 -15.171 25.642 679 HG3 ARG 85 HG1 ARG 85 29.424 -14.313 27.070 680 HD2 ARG 85 HD2 ARG 85 27.605 -15.617 26.967 681 HD3 ARG 85 HD1 ARG 85 27.062 -14.624 25.646 682 HE ARG 85 HE ARG 85 28.210 -16.215 24.121 683 HH11 ARG 85 HH21 ARG 85 27.201 -17.277 27.311 684 HH12 ARG 85 HH22 ARG 85 27.362 -18.940 26.933 685 HH21 ARG 85 HH11 ARG 85 28.446 -18.387 23.653 686 HH22 ARG 85 HH12 ARG 85 28.117 -19.583 24.804 687 H ASN 86 HN ASN 86 26.802 -12.199 23.605 688 HA ASN 86 HA ASN 86 27.464 -10.457 21.444 689 HB2 ASN 86 HB2 ASN 86 25.520 -9.098 22.316 690 HB3 ASN 86 HB1 ASN 86 25.123 -10.767 21.907 691 HD21 ASN 86 HD21 ASN 86 23.674 -9.033 23.822 692 HD22 ASN 86 HD22 ASN 86 23.756 -9.811 25.317 693 H THR 87 HN THR 87 28.941 -8.965 21.461 694 HA THR 87 HA THR 87 30.189 -8.078 23.840 695 HB THR 87 HB THR 87 30.846 -6.345 21.692 696 HG1 THR 87 HG1 THR 87 30.068 -7.491 20.091 697 HG21 THR 87 HG21 THR 87 32.626 -7.083 22.980 698 HG22 THR 87 HG22 THR 87 32.811 -8.121 21.578 699 HG23 THR 87 HG23 THR 87 32.055 -8.748 23.036 700 H SER 88 HN SER 88 27.548 -7.677 24.169 701 HA SER 88 HA SER 88 27.322 -4.963 24.925 702 HB2 SER 88 HB2 SER 88 25.228 -5.743 22.917 703 HB3 SER 88 HB1 SER 88 25.719 -4.149 23.454 704 HG SER 88 HG SER 88 27.845 -4.901 22.422 705 H LEU 89 HN LEU 89 26.186 -5.199 26.793 706 HA LEU 89 HA LEU 89 24.833 -7.715 27.234 707 HB2 LEU 89 HB2 LEU 89 25.318 -5.402 29.115 708 HB3 LEU 89 HB1 LEU 89 24.733 -7.004 29.558 709 HG LEU 89 HG LEU 89 27.405 -6.496 28.198 710 HD11 LEU 89 HD11 LEU 89 26.749 -7.062 31.103 711 HD12 LEU 89 HD12 LEU 89 27.532 -5.626 30.427 712 HD13 LEU 89 HD13 LEU 89 28.366 -7.173 30.402 713 HD21 LEU 89 HD21 LEU 89 26.723 -8.705 27.652 714 HD22 LEU 89 HD22 LEU 89 25.983 -8.970 29.220 715 HD23 LEU 89 HD23 LEU 89 27.742 -8.929 29.065 716 H ASN 90 HN ASN 90 23.176 -7.347 25.746 717 HA ASN 90 HA ASN 90 21.080 -5.423 26.497 718 HB2 ASN 90 HB2 ASN 90 20.005 -6.072 24.383 719 HB3 ASN 90 HB1 ASN 90 21.660 -5.550 24.138 720 HD21 ASN 90 HD21 ASN 90 19.520 -8.332 23.978 721 HD22 ASN 90 HD22 ASN 90 20.643 -9.378 23.255 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 3.885 -7.473 -8.486 2 H2 MET 1 HT2 MET 1 4.958 -7.180 -9.779 3 H3 MET 1 HT3 MET 1 4.447 -5.910 -8.760 4 HA MET 1 HA MET 1 6.199 -8.181 -8.047 5 HB2 MET 1 HB2 MET 1 6.529 -5.330 -8.705 6 HB3 MET 1 HB1 MET 1 7.326 -5.754 -7.204 7 HG2 MET 1 HG2 MET 1 7.709 -7.310 -9.785 8 HG3 MET 1 HG1 MET 1 8.745 -5.998 -9.297 9 HE1 MET 1 HE1 MET 1 10.149 -5.841 -7.323 10 HE2 MET 1 HE2 MET 1 10.522 -7.088 -6.147 11 HE3 MET 1 HE3 MET 1 8.966 -6.284 -6.089 12 HA PRO 2 HA PRO 2 4.370 -7.977 -3.956 13 HB2 PRO 2 HB2 PRO 2 7.161 -7.944 -2.936 14 HB3 PRO 2 HB1 PRO 2 5.819 -9.022 -2.517 15 HG2 PRO 2 HG2 PRO 2 7.745 -9.948 -4.047 16 HG3 PRO 2 HG1 PRO 2 6.070 -10.335 -4.418 17 HD2 PRO 2 HD2 PRO 2 7.837 -8.360 -5.820 18 HD3 PRO 2 HD1 PRO 2 6.592 -9.452 -6.468 19 H THR 3 HN THR 3 3.851 -6.251 -2.622 20 HA THR 3 HA THR 3 5.337 -3.731 -2.952 21 HB THR 3 HB THR 3 3.139 -2.835 -1.905 22 HG1 THR 3 HG1 THR 3 1.852 -4.404 -1.373 23 HG21 THR 3 HG21 THR 3 3.994 -2.871 -4.364 24 HG22 THR 3 HG22 THR 3 2.309 -2.496 -4.070 25 HG23 THR 3 HG23 THR 3 2.782 -4.118 -4.603 26 H GLN 4 HN GLN 4 4.969 -6.242 -0.818 27 HA GLN 4 HA GLN 4 5.894 -4.589 1.460 28 HB2 GLN 4 HB2 GLN 4 4.361 -7.210 1.479 29 HB3 GLN 4 HB1 GLN 4 5.082 -6.469 2.892 30 HG2 GLN 4 HG2 GLN 4 3.683 -4.486 2.629 31 HG3 GLN 4 HG1 GLN 4 2.994 -5.155 1.141 32 HE21 GLN 4 HE21 GLN 4 2.475 -4.970 4.478 33 HE22 GLN 4 HE22 GLN 4 1.407 -6.274 4.627 34 H ASP 5 HN ASP 5 7.478 -5.636 2.782 35 HA ASP 5 HA ASP 5 9.591 -6.984 1.456 36 HB2 ASP 5 HB2 ASP 5 8.869 -6.807 4.404 37 HB3 ASP 5 HB1 ASP 5 10.333 -7.534 3.781 38 H ILE 6 HN ILE 6 10.296 -9.168 2.524 39 HA ILE 6 HA ILE 6 7.959 -10.960 2.529 40 HB ILE 6 HB ILE 6 9.310 -12.663 1.499 41 HG12 ILE 6 HG12 ILE 6 11.487 -10.599 1.146 42 HG13 ILE 6 HG11 ILE 6 11.546 -11.817 2.422 43 HG21 ILE 6 HG21 ILE 6 9.778 -11.459 -0.744 44 HG22 ILE 6 HG22 ILE 6 9.311 -9.984 0.064 45 HG23 ILE 6 HG23 ILE 6 8.139 -11.284 -0.125 46 HD11 ILE 6 HD11 ILE 6 11.239 -12.430 -0.510 47 HD12 ILE 6 HD12 ILE 6 11.527 -13.584 0.790 48 HD13 ILE 6 HD13 ILE 6 12.790 -12.438 0.317 49 H ARG 7 HN ARG 7 8.169 -12.820 3.852 50 HA ARG 7 HA ARG 7 9.674 -12.182 6.270 51 HB2 ARG 7 HB2 ARG 7 7.488 -14.214 5.776 52 HB3 ARG 7 HB1 ARG 7 8.117 -13.717 7.340 53 HG2 ARG 7 HG2 ARG 7 7.006 -11.620 5.461 54 HG3 ARG 7 HG1 ARG 7 5.914 -12.594 6.429 55 HD2 ARG 7 HD2 ARG 7 8.233 -11.006 7.578 56 HD3 ARG 7 HD1 ARG 7 6.583 -10.421 7.519 57 HE ARG 7 HE ARG 7 7.671 -12.305 9.361 58 HH11 ARG 7 HH21 ARG 7 4.793 -11.380 7.601 59 HH12 ARG 7 HH22 ARG 7 3.705 -12.063 8.725 60 HH21 ARG 7 HH11 ARG 7 6.178 -13.225 10.892 61 HH22 ARG 7 HH12 ARG 7 4.499 -13.128 10.591 62 H LEU 8 HN LEU 8 11.422 -13.256 6.796 63 HA LEU 8 HA LEU 8 11.946 -15.889 5.580 64 HB2 LEU 8 HB2 LEU 8 13.630 -14.367 4.768 65 HB3 LEU 8 HB1 LEU 8 13.829 -13.657 6.369 66 HG LEU 8 HG LEU 8 14.695 -15.850 7.217 67 HD11 LEU 8 HD11 LEU 8 15.441 -17.235 4.926 68 HD12 LEU 8 HD12 LEU 8 13.788 -16.754 4.589 69 HD13 LEU 8 HD13 LEU 8 14.157 -17.662 6.047 70 HD21 LEU 8 HD21 LEU 8 16.265 -14.083 6.315 71 HD22 LEU 8 HD22 LEU 8 16.215 -14.910 4.756 72 HD23 LEU 8 HD23 LEU 8 16.866 -15.726 6.170 73 H TRP 9 HN TRP 9 12.141 -17.523 6.957 74 HA TRP 9 HA TRP 9 12.092 -16.889 9.828 75 HB2 TRP 9 HB2 TRP 9 11.811 -19.625 8.615 76 HB3 TRP 9 HB1 TRP 9 11.252 -19.059 10.174 77 HD1 TRP 9 HD1 TRP 9 9.979 -16.302 8.974 78 HE1 TRP 9 HE1 TRP 9 7.717 -16.469 7.742 79 HE3 TRP 9 HE3 TRP 9 10.007 -21.220 7.853 80 HZ2 TRP 9 HZ2 TRP 9 6.123 -18.474 6.436 81 HZ3 TRP 9 HZ3 TRP 9 8.155 -22.261 6.625 82 HH2 TRP 9 HH2 TRP 9 6.182 -20.882 5.904 83 H VAL 10 HN VAL 10 13.793 -17.427 11.084 84 HA VAL 10 HA VAL 10 15.994 -18.874 9.744 85 HB VAL 10 HB VAL 10 16.106 -16.566 11.667 86 HG11 VAL 10 HG11 VAL 10 18.309 -18.438 10.726 87 HG12 VAL 10 HG12 VAL 10 17.865 -18.056 12.383 88 HG13 VAL 10 HG13 VAL 10 18.626 -16.831 11.376 89 HG21 VAL 10 HG21 VAL 10 17.482 -15.581 9.804 90 HG22 VAL 10 HG22 VAL 10 15.807 -15.883 9.322 91 HG23 VAL 10 HG23 VAL 10 17.098 -16.985 8.826 92 H SER 11 HN SER 11 16.608 -20.630 10.614 93 HA SER 11 HA SER 11 15.585 -21.447 13.233 94 HB2 SER 11 HB2 SER 11 17.349 -23.165 11.530 95 HB3 SER 11 HB1 SER 11 15.980 -23.605 12.523 96 HG SER 11 HG SER 11 15.942 -22.147 10.079 97 H VAL 12 HN VAL 12 16.847 -20.957 14.934 98 HA VAL 12 HA VAL 12 19.661 -20.372 14.431 99 HB VAL 12 HB VAL 12 17.853 -19.580 16.722 100 HG11 VAL 12 HG11 VAL 12 20.118 -19.589 17.450 101 HG12 VAL 12 HG12 VAL 12 19.671 -17.914 17.162 102 HG13 VAL 12 HG13 VAL 12 20.670 -18.781 15.985 103 HG21 VAL 12 HG21 VAL 12 18.814 -17.999 14.299 104 HG22 VAL 12 HG22 VAL 12 17.855 -17.354 15.637 105 HG23 VAL 12 HG23 VAL 12 17.161 -18.571 14.573 106 H GLU 13 HN GLU 13 21.161 -21.749 15.246 107 HA GLU 13 HA GLU 13 20.438 -23.349 17.602 108 HB2 GLU 13 HB2 GLU 13 22.175 -24.133 15.276 109 HB3 GLU 13 HB1 GLU 13 22.397 -24.868 16.857 110 HG2 GLU 13 HG2 GLU 13 20.055 -25.555 16.884 111 HG3 GLU 13 HG1 GLU 13 19.774 -24.889 15.298 112 H ASP 14 HN ASP 14 21.590 -23.061 19.339 113 HA ASP 14 HA ASP 14 23.982 -21.318 19.236 114 HB2 ASP 14 HB2 ASP 14 22.309 -20.469 20.774 115 HB3 ASP 14 HB1 ASP 14 22.153 -22.065 21.500 116 H ALA 15 HN ALA 15 25.798 -21.868 20.327 117 HA ALA 15 HA ALA 15 26.746 -24.460 19.954 118 HB1 ALA 15 HB1 ALA 15 28.436 -22.929 20.109 119 HB2 ALA 15 HB2 ALA 15 28.534 -23.636 21.722 120 HB3 ALA 15 HB3 ALA 15 27.677 -22.108 21.466 121 H GLN 16 HN GLN 16 25.020 -23.095 22.669 122 HA GLN 16 HA GLN 16 25.677 -25.307 24.444 123 HB2 GLN 16 HB2 GLN 16 23.407 -23.304 24.702 124 HB3 GLN 16 HB1 GLN 16 24.078 -24.346 25.951 125 HG2 GLN 16 HG2 GLN 16 25.632 -22.146 24.540 126 HG3 GLN 16 HG1 GLN 16 24.915 -21.990 26.133 127 HE21 GLN 16 HE21 GLN 16 27.828 -22.432 24.786 128 HE22 GLN 16 HE22 GLN 16 28.569 -23.409 25.944 129 H MET 17 HN MET 17 24.686 -25.929 21.796 130 HA MET 17 HA MET 17 23.063 -26.987 20.642 131 HB2 MET 17 HB2 MET 17 23.162 -28.591 23.195 132 HB3 MET 17 HB1 MET 17 22.229 -29.097 21.792 133 HG2 MET 17 HG2 MET 17 24.295 -28.983 20.402 134 HG3 MET 17 HG1 MET 17 25.212 -28.564 21.855 135 HE1 MET 17 HE1 MET 17 26.316 -30.390 20.377 136 HE2 MET 17 HE2 MET 17 26.196 -32.108 20.698 137 HE3 MET 17 HE3 MET 17 26.897 -31.050 21.913 138 H HIS 18 HN HIS 18 22.071 -24.751 21.418 139 HA HIS 18 HA HIS 18 19.324 -25.376 22.338 140 HB2 HIS 18 HB2 HIS 18 21.061 -22.962 22.739 141 HB3 HIS 18 HB1 HIS 18 19.322 -22.738 22.552 142 HD1 HIS 18 HD1 HIS 18 21.651 -25.039 24.598 143 HD2 HIS 18 HD2 HIS 18 18.035 -22.952 24.938 144 HE1 HIS 18 HE1 HIS 18 20.830 -25.394 26.946 145 HE2 HIS 18 HE2 HIS 18 18.637 -24.121 27.185 146 H THR 19 HN THR 19 17.676 -24.947 20.956 147 HA THR 19 HA THR 19 18.425 -23.821 18.340 148 HB THR 19 HB THR 19 16.277 -25.875 18.925 149 HG1 THR 19 HG1 THR 19 18.581 -26.433 19.260 150 HG21 THR 19 HG21 THR 19 16.530 -26.226 16.424 151 HG22 THR 19 HG22 THR 19 17.457 -24.730 16.373 152 HG23 THR 19 HG23 THR 19 15.774 -24.716 16.900 153 H VAL 20 HN VAL 20 17.338 -22.046 17.731 154 HA VAL 20 HA VAL 20 14.694 -21.502 18.914 155 HB VAL 20 HB VAL 20 16.712 -19.310 18.429 156 HG11 VAL 20 HG11 VAL 20 15.173 -18.288 20.243 157 HG12 VAL 20 HG12 VAL 20 14.056 -19.585 19.832 158 HG13 VAL 20 HG13 VAL 20 14.534 -18.400 18.610 159 HG21 VAL 20 HG21 VAL 20 16.288 -21.022 20.894 160 HG22 VAL 20 HG22 VAL 20 16.860 -19.368 21.032 161 HG23 VAL 20 HG23 VAL 20 17.825 -20.548 20.154 162 H THR 21 HN THR 21 13.406 -20.021 17.567 163 HA THR 21 HA THR 21 14.288 -19.931 14.759 164 HB THR 21 HB THR 21 11.445 -20.332 15.702 165 HG1 THR 21 HG1 THR 21 12.800 -22.107 16.188 166 HG21 THR 21 HG21 THR 21 12.833 -20.096 13.068 167 HG22 THR 21 HG22 THR 21 11.237 -19.533 13.555 168 HG23 THR 21 HG23 THR 21 11.508 -21.246 13.205 169 H ILE 22 HN ILE 22 14.189 -17.926 13.867 170 HA ILE 22 HA ILE 22 12.434 -15.944 15.171 171 HB ILE 22 HB ILE 22 14.082 -14.192 14.807 172 HG12 ILE 22 HG12 ILE 22 15.961 -16.428 13.917 173 HG13 ILE 22 HG11 ILE 22 15.225 -15.185 12.876 174 HG21 ILE 22 HG21 ILE 22 14.028 -15.763 16.871 175 HG22 ILE 22 HG22 ILE 22 15.394 -14.665 16.665 176 HG23 ILE 22 HG23 ILE 22 15.574 -16.375 16.267 177 HD11 ILE 22 HD11 ILE 22 17.453 -14.467 13.432 178 HD12 ILE 22 HD12 ILE 22 17.142 -14.723 15.153 179 HD13 ILE 22 HD13 ILE 22 16.306 -13.436 14.281 180 H TRP 23 HN TRP 23 11.669 -14.273 13.813 181 HA TRP 23 HA TRP 23 11.524 -15.063 10.961 182 HB2 TRP 23 HB2 TRP 23 9.495 -13.527 12.639 183 HB3 TRP 23 HB1 TRP 23 9.376 -13.905 10.921 184 HD1 TRP 23 HD1 TRP 23 8.284 -16.102 10.297 185 HE1 TRP 23 HE1 TRP 23 7.636 -18.269 11.531 186 HE3 TRP 23 HE3 TRP 23 10.323 -15.147 14.897 187 HZ2 TRP 23 HZ2 TRP 23 7.939 -19.432 14.109 188 HZ3 TRP 23 HZ3 TRP 23 10.104 -16.818 16.715 189 HH2 TRP 23 HH2 TRP 23 8.916 -18.955 16.320 190 H LEU 24 HN LEU 24 12.334 -13.727 9.516 191 HA LEU 24 HA LEU 24 12.977 -10.950 10.333 192 HB2 LEU 24 HB2 LEU 24 14.319 -12.693 8.277 193 HB3 LEU 24 HB1 LEU 24 14.834 -11.084 8.759 194 HG LEU 24 HG LEU 24 14.689 -13.513 10.593 195 HD11 LEU 24 HD11 LEU 24 16.536 -13.400 8.808 196 HD12 LEU 24 HD12 LEU 24 17.031 -13.601 10.500 197 HD13 LEU 24 HD13 LEU 24 17.142 -12.022 9.730 198 HD21 LEU 24 HD21 LEU 24 15.228 -10.597 11.067 199 HD22 LEU 24 HD22 LEU 24 16.222 -11.783 11.899 200 HD23 LEU 24 HD23 LEU 24 14.474 -11.811 12.115 201 H THR 25 HN THR 25 12.163 -9.338 9.081 202 HA THR 25 HA THR 25 10.694 -10.136 6.656 203 HB THR 25 HB THR 25 10.331 -7.474 7.972 204 HG1 THR 25 HG1 THR 25 10.299 -8.863 9.647 205 HG21 THR 25 HG21 THR 25 7.844 -8.474 7.386 206 HG22 THR 25 HG22 THR 25 8.808 -9.285 6.156 207 HG23 THR 25 HG23 THR 25 8.830 -7.533 6.291 208 H VAL 26 HN VAL 26 11.743 -9.702 4.821 209 HA VAL 26 HA VAL 26 13.271 -7.231 4.476 210 HB VAL 26 HB VAL 26 15.291 -8.468 3.698 211 HG11 VAL 26 HG11 VAL 26 15.081 -7.587 6.043 212 HG12 VAL 26 HG12 VAL 26 16.174 -8.956 5.890 213 HG13 VAL 26 HG13 VAL 26 14.566 -9.187 6.547 214 HG21 VAL 26 HG21 VAL 26 14.336 -10.659 3.157 215 HG22 VAL 26 HG22 VAL 26 13.786 -10.867 4.826 216 HG23 VAL 26 HG23 VAL 26 15.503 -10.860 4.460 217 H ARG 27 HN ARG 27 14.534 -7.795 2.148 218 HA ARG 27 HA ARG 27 12.401 -8.743 0.351 219 HB2 ARG 27 HB2 ARG 27 13.573 -7.198 -1.385 220 HB3 ARG 27 HB1 ARG 27 12.512 -6.457 -0.204 221 HG2 ARG 27 HG2 ARG 27 15.333 -6.791 0.610 222 HG3 ARG 27 HG1 ARG 27 15.040 -5.620 -0.665 223 HD2 ARG 27 HD2 ARG 27 13.098 -5.463 1.533 224 HD3 ARG 27 HD1 ARG 27 14.730 -5.096 2.031 225 HE ARG 27 HE ARG 27 14.573 -3.572 -0.151 226 HH11 ARG 27 HH21 ARG 27 12.113 -4.105 2.363 227 HH12 ARG 27 HH22 ARG 27 11.519 -2.506 2.208 228 HH21 ARG 27 HH11 ARG 27 13.661 -1.451 -0.293 229 HH22 ARG 27 HH12 ARG 27 12.365 -1.044 0.739 230 HA PRO 28 HA PRO 28 15.423 -11.746 -1.133 231 HB2 PRO 28 HB2 PRO 28 14.487 -10.951 -3.846 232 HB3 PRO 28 HB1 PRO 28 14.570 -12.558 -3.113 233 HG2 PRO 28 HG2 PRO 28 12.268 -11.383 -3.410 234 HG3 PRO 28 HG1 PRO 28 12.633 -12.268 -1.912 235 HD2 PRO 28 HD2 PRO 28 12.558 -9.296 -2.342 236 HD3 PRO 28 HD1 PRO 28 12.040 -10.250 -0.933 237 H ASP 29 HN ASP 29 15.123 -8.536 -2.395 238 HA ASP 29 HA ASP 29 17.468 -8.438 -3.966 239 HB2 ASP 29 HB2 ASP 29 15.707 -6.334 -2.766 240 HB3 ASP 29 HB1 ASP 29 17.111 -5.921 -3.735 241 H MET 30 HN MET 30 16.891 -8.247 -0.604 242 HA MET 30 HA MET 30 19.135 -6.620 0.104 243 HB2 MET 30 HB2 MET 30 17.266 -8.389 1.594 244 HB3 MET 30 HB1 MET 30 18.828 -8.039 2.336 245 HG2 MET 30 HG2 MET 30 18.444 -5.663 2.129 246 HG3 MET 30 HG1 MET 30 16.925 -5.919 1.286 247 HE1 MET 30 HE1 MET 30 18.077 -8.004 4.896 248 HE2 MET 30 HE2 MET 30 18.288 -6.347 5.461 249 HE3 MET 30 HE3 MET 30 19.084 -6.864 3.997 250 H THR 31 HN THR 31 20.857 -7.396 1.460 251 HA THR 31 HA THR 31 22.179 -9.606 0.124 252 HB THR 31 HB THR 31 23.004 -6.968 1.164 253 HG1 THR 31 HG1 THR 31 24.259 -8.391 -0.907 254 HG21 THR 31 HG21 THR 31 24.806 -9.391 1.227 255 HG22 THR 31 HG22 THR 31 24.361 -8.290 2.541 256 HG23 THR 31 HG23 THR 31 25.375 -7.713 1.240 257 H VAL 32 HN VAL 32 23.363 -11.125 1.367 258 HA VAL 32 HA VAL 32 22.110 -11.962 3.723 259 HB VAL 32 HB VAL 32 24.884 -12.650 2.687 260 HG11 VAL 32 HG11 VAL 32 24.706 -13.259 5.021 261 HG12 VAL 32 HG12 VAL 32 24.611 -14.723 4.037 262 HG13 VAL 32 HG13 VAL 32 23.146 -14.037 4.751 263 HG21 VAL 32 HG21 VAL 32 23.036 -13.163 1.081 264 HG22 VAL 32 HG22 VAL 32 22.205 -14.062 2.342 265 HG23 VAL 32 HG23 VAL 32 23.758 -14.624 1.744 266 H ALA 33 HN ALA 33 25.232 -10.247 3.320 267 HA ALA 33 HA ALA 33 25.928 -10.112 6.033 268 HB1 ALA 33 HB1 ALA 33 27.386 -9.463 4.084 269 HB2 ALA 33 HB2 ALA 33 27.407 -8.302 5.409 270 HB3 ALA 33 HB3 ALA 33 26.461 -7.969 3.957 271 H SER 34 HN SER 34 23.869 -8.012 4.065 272 HA SER 34 HA SER 34 23.332 -6.053 6.011 273 HB2 SER 34 HB2 SER 34 21.284 -6.893 3.988 274 HB3 SER 34 HB1 SER 34 21.724 -5.292 4.577 275 HG SER 34 HG SER 34 23.499 -5.301 3.298 276 H LEU 35 HN LEU 35 21.904 -9.160 5.210 277 HA LEU 35 HA LEU 35 19.641 -9.008 6.891 278 HB2 LEU 35 HB2 LEU 35 20.690 -10.869 5.138 279 HB3 LEU 35 HB1 LEU 35 20.835 -11.684 6.689 280 HG LEU 35 HG LEU 35 18.315 -10.534 5.447 281 HD11 LEU 35 HD11 LEU 35 17.723 -12.637 4.949 282 HD12 LEU 35 HD12 LEU 35 18.389 -13.284 6.451 283 HD13 LEU 35 HD13 LEU 35 19.445 -13.005 5.075 284 HD21 LEU 35 HD21 LEU 35 18.778 -11.715 8.211 285 HD22 LEU 35 HD22 LEU 35 17.191 -11.464 7.505 286 HD23 LEU 35 HD23 LEU 35 18.218 -10.081 7.855 287 H LYS 36 HN LYS 36 22.931 -10.162 7.409 288 HA LYS 36 HA LYS 36 22.621 -10.943 10.124 289 HB2 LYS 36 HB2 LYS 36 24.998 -9.923 8.584 290 HB3 LYS 36 HB1 LYS 36 25.091 -10.418 10.272 291 HG2 LYS 36 HG2 LYS 36 24.275 -12.660 9.657 292 HG3 LYS 36 HG1 LYS 36 24.221 -12.168 7.960 293 HD2 LYS 36 HD2 LYS 36 26.595 -11.745 7.917 294 HD3 LYS 36 HD1 LYS 36 26.719 -12.011 9.655 295 HE2 LYS 36 HE2 LYS 36 27.483 -13.953 8.347 296 HE3 LYS 36 HE1 LYS 36 26.140 -14.341 9.403 297 HZ1 LYS 36 HZ1 LYS 36 25.933 -13.672 6.518 298 HZ2 LYS 36 HZ2 LYS 36 24.624 -14.162 7.514 299 HZ3 LYS 36 HZ3 LYS 36 25.914 -15.224 7.149 300 H ASP 37 HN ASP 37 23.447 -7.950 8.504 301 HA ASP 37 HA ASP 37 24.087 -6.396 10.737 302 HB2 ASP 37 HB2 ASP 37 24.506 -5.677 8.419 303 HB3 ASP 37 HB1 ASP 37 22.780 -5.499 8.174 304 H MET 38 HN MET 38 20.945 -6.626 9.059 305 HA MET 38 HA MET 38 19.617 -4.998 10.980 306 HB2 MET 38 HB2 MET 38 17.576 -6.675 10.098 307 HB3 MET 38 HB1 MET 38 18.021 -5.129 9.444 308 HG2 MET 38 HG2 MET 38 19.339 -6.013 7.751 309 HG3 MET 38 HG1 MET 38 19.419 -7.614 8.495 310 HE1 MET 38 HE1 MET 38 16.239 -9.300 8.161 311 HE2 MET 38 HE2 MET 38 15.878 -7.971 9.245 312 HE3 MET 38 HE3 MET 38 17.455 -8.733 9.326 313 H VAL 39 HN VAL 39 20.131 -8.466 10.800 314 HA VAL 39 HA VAL 39 18.567 -9.124 13.052 315 HB VAL 39 HB VAL 39 21.064 -10.411 11.917 316 HG11 VAL 39 HG11 VAL 39 19.140 -12.005 13.548 317 HG12 VAL 39 HG12 VAL 39 20.135 -10.891 14.460 318 HG13 VAL 39 HG13 VAL 39 20.890 -12.118 13.440 319 HG21 VAL 39 HG21 VAL 39 19.695 -11.419 10.424 320 HG22 VAL 39 HG22 VAL 39 18.450 -10.275 10.894 321 HG23 VAL 39 HG23 VAL 39 18.537 -11.853 11.676 322 H PHE 40 HN PHE 40 21.916 -8.066 12.635 323 HA PHE 40 HA PHE 40 22.564 -8.110 15.400 324 HB2 PHE 40 HB2 PHE 40 24.330 -7.963 13.718 325 HB3 PHE 40 HB1 PHE 40 23.677 -6.420 13.159 326 HD1 PHE 40 HD2 PHE 40 24.838 -8.061 16.336 327 HD2 PHE 40 HD1 PHE 40 24.483 -4.428 14.063 328 HE1 PHE 40 HE2 PHE 40 26.098 -6.828 18.089 329 HE2 PHE 40 HE1 PHE 40 25.718 -3.211 15.821 330 HZ PHE 40 HZ PHE 40 26.529 -4.406 17.821 331 H LEU 41 HN LEU 41 21.275 -5.598 13.223 332 HA LEU 41 HA LEU 41 21.178 -3.528 15.154 333 HB2 LEU 41 HB2 LEU 41 19.152 -3.991 12.930 334 HB3 LEU 41 HB1 LEU 41 19.432 -2.509 13.819 335 HG LEU 41 HG LEU 41 21.398 -3.888 12.031 336 HD11 LEU 41 HD11 LEU 41 19.889 -1.303 11.617 337 HD12 LEU 41 HD12 LEU 41 19.666 -2.811 10.728 338 HD13 LEU 41 HD13 LEU 41 21.171 -1.922 10.584 339 HD21 LEU 41 HD21 LEU 41 22.369 -1.358 12.478 340 HD22 LEU 41 HD22 LEU 41 22.876 -2.865 13.253 341 HD23 LEU 41 HD23 LEU 41 21.717 -1.810 14.074 342 H ASP 42 HN ASP 42 18.927 -5.927 14.133 343 HA ASP 42 HA ASP 42 16.794 -5.101 15.848 344 HB2 ASP 42 HB2 ASP 42 16.613 -6.438 13.625 345 HB3 ASP 42 HB1 ASP 42 16.941 -7.825 14.639 346 H TYR 43 HN TYR 43 18.958 -7.904 15.974 347 HA TYR 43 HA TYR 43 17.894 -8.516 18.663 348 HB2 TYR 43 HB2 TYR 43 19.374 -10.333 16.740 349 HB3 TYR 43 HB1 TYR 43 18.684 -10.759 18.298 350 HD1 TYR 43 HD2 TYR 43 16.181 -10.577 18.655 351 HD2 TYR 43 HD1 TYR 43 18.013 -10.241 14.783 352 HE1 TYR 43 HE2 TYR 43 14.014 -11.038 17.597 353 HE2 TYR 43 HE1 TYR 43 15.842 -10.720 13.709 354 HH TYR 43 HH TYR 43 13.392 -10.512 14.330 355 H GLY 44 HN GLY 44 20.674 -7.157 17.225 356 HA2 GLY 44 HA2 GLY 44 22.741 -6.629 18.172 357 HA3 GLY 44 HA1 GLY 44 22.124 -7.288 19.679 358 H PHE 45 HN PHE 45 21.773 -9.305 16.994 359 HA PHE 45 HA PHE 45 23.029 -11.448 18.172 360 HB2 PHE 45 HB2 PHE 45 21.959 -10.889 15.483 361 HB3 PHE 45 HB1 PHE 45 23.190 -12.139 15.532 362 HD1 PHE 45 HD1 PHE 45 20.881 -11.386 18.359 363 HD2 PHE 45 HD2 PHE 45 21.758 -14.042 15.085 364 HE1 PHE 45 HE1 PHE 45 19.225 -13.006 19.221 365 HE2 PHE 45 HE2 PHE 45 20.097 -15.661 15.965 366 HZ PHE 45 HZ PHE 45 18.835 -15.136 18.042 367 HA PRO 46 HA PRO 46 27.370 -10.221 17.770 368 HB2 PRO 46 HB2 PRO 46 28.270 -12.822 18.331 369 HB3 PRO 46 HB1 PRO 46 28.004 -11.525 19.516 370 HG2 PRO 46 HG2 PRO 46 26.174 -13.737 18.729 371 HG3 PRO 46 HG1 PRO 46 26.475 -13.077 20.342 372 HD2 PRO 46 HD2 PRO 46 24.275 -12.462 19.120 373 HD3 PRO 46 HD1 PRO 46 25.172 -11.150 19.909 374 HA PRO 47 HA PRO 47 27.191 -11.707 13.402 375 HB2 PRO 47 HB2 PRO 47 29.415 -10.298 12.593 376 HB3 PRO 47 HB1 PRO 47 27.776 -9.620 12.645 377 HG2 PRO 47 HG2 PRO 47 29.991 -9.359 14.620 378 HG3 PRO 47 HG1 PRO 47 28.838 -8.149 14.048 379 HD2 PRO 47 HD2 PRO 47 28.469 -9.260 16.425 380 HD3 PRO 47 HD1 PRO 47 27.071 -8.958 15.361 381 H VAL 48 HN VAL 48 29.991 -11.628 15.463 382 HA VAL 48 HA VAL 48 31.590 -13.437 13.984 383 HB VAL 48 HB VAL 48 32.563 -12.019 15.691 384 HG11 VAL 48 HG11 VAL 48 30.480 -12.127 17.208 385 HG12 VAL 48 HG12 VAL 48 32.051 -12.146 17.994 386 HG13 VAL 48 HG13 VAL 48 31.153 -13.644 17.801 387 HG21 VAL 48 HG21 VAL 48 32.861 -14.719 16.971 388 HG22 VAL 48 HG22 VAL 48 34.083 -13.557 16.464 389 HG23 VAL 48 HG23 VAL 48 33.293 -14.564 15.259 390 H LEU 49 HN LEU 49 29.274 -13.822 16.611 391 HA LEU 49 HA LEU 49 29.563 -16.690 16.724 392 HB2 LEU 49 HB2 LEU 49 27.553 -14.811 17.911 393 HB3 LEU 49 HB1 LEU 49 27.517 -16.547 18.178 394 HG LEU 49 HG LEU 49 29.973 -14.877 18.713 395 HD11 LEU 49 HD11 LEU 49 28.406 -13.999 20.280 396 HD12 LEU 49 HD12 LEU 49 29.308 -15.194 21.171 397 HD13 LEU 49 HD13 LEU 49 27.688 -15.581 20.587 398 HD21 LEU 49 HD21 LEU 49 29.693 -17.222 20.352 399 HD22 LEU 49 HD22 LEU 49 30.932 -16.883 19.149 400 HD23 LEU 49 HD23 LEU 49 29.442 -17.687 18.678 401 H GLN 50 HN GLN 50 27.210 -14.465 15.247 402 HA GLN 50 HA GLN 50 25.521 -16.658 14.576 403 HB2 GLN 50 HB2 GLN 50 24.180 -15.008 13.208 404 HB3 GLN 50 HB1 GLN 50 24.367 -14.579 14.894 405 HG2 GLN 50 HG2 GLN 50 25.802 -12.859 14.434 406 HG3 GLN 50 HG1 GLN 50 26.345 -13.514 12.882 407 HE21 GLN 50 HE21 GLN 50 24.839 -10.891 13.909 408 HE22 GLN 50 HE22 GLN 50 23.610 -10.725 12.751 409 H GLN 51 HN GLN 51 26.398 -18.166 13.354 410 HA GLN 51 HA GLN 51 27.440 -17.369 10.724 411 HB2 GLN 51 HB2 GLN 51 27.639 -19.992 12.245 412 HB3 GLN 51 HB1 GLN 51 28.269 -19.728 10.623 413 HG2 GLN 51 HG2 GLN 51 30.066 -18.566 11.370 414 HG3 GLN 51 HG1 GLN 51 29.107 -17.612 12.478 415 HE21 GLN 51 HE21 GLN 51 28.737 -18.476 14.646 416 HE22 GLN 51 HE22 GLN 51 29.716 -19.720 15.247 417 H TRP 52 HN TRP 52 26.118 -17.529 9.081 418 HA TRP 52 HA TRP 52 23.509 -18.829 9.400 419 HB2 TRP 52 HB2 TRP 52 24.714 -17.068 7.253 420 HB3 TRP 52 HB1 TRP 52 23.108 -17.777 7.170 421 HD1 TRP 52 HD1 TRP 52 25.013 -15.793 9.932 422 HE1 TRP 52 HE1 TRP 52 23.391 -14.025 10.905 423 HE3 TRP 52 HE3 TRP 52 20.879 -16.769 7.105 424 HZ2 TRP 52 HZ2 TRP 52 20.669 -13.156 10.507 425 HZ3 TRP 52 HZ3 TRP 52 18.802 -15.460 7.421 426 HH2 TRP 52 HH2 TRP 52 18.703 -13.675 9.110 427 H VAL 53 HN VAL 53 22.996 -20.751 8.446 428 HA VAL 53 HA VAL 53 25.089 -21.863 6.677 429 HB VAL 53 HB VAL 53 22.940 -23.445 8.098 430 HG11 VAL 53 HG11 VAL 53 23.889 -24.671 6.341 431 HG12 VAL 53 HG12 VAL 53 24.734 -25.241 7.774 432 HG13 VAL 53 HG13 VAL 53 25.523 -24.103 6.678 433 HG21 VAL 53 HG21 VAL 53 25.712 -22.624 9.069 434 HG22 VAL 53 HG22 VAL 53 24.830 -24.003 9.726 435 HG23 VAL 53 HG23 VAL 53 24.160 -22.387 9.882 436 H ILE 54 HN ILE 54 24.650 -21.924 4.670 437 HA ILE 54 HA ILE 54 22.070 -22.745 3.712 438 HB ILE 54 HB ILE 54 23.343 -20.146 2.728 439 HG12 ILE 54 HG12 ILE 54 20.698 -20.621 4.150 440 HG13 ILE 54 HG11 ILE 54 22.137 -19.945 4.911 441 HG21 ILE 54 HG21 ILE 54 22.209 -21.545 0.939 442 HG22 ILE 54 HG22 ILE 54 21.477 -19.954 1.227 443 HG23 ILE 54 HG23 ILE 54 20.729 -21.398 1.899 444 HD11 ILE 54 HD11 ILE 54 20.356 -18.737 2.862 445 HD12 ILE 54 HD12 ILE 54 22.045 -18.251 2.872 446 HD13 ILE 54 HD13 ILE 54 21.038 -17.990 4.302 447 H GLY 55 HN GLY 55 22.556 -24.384 2.358 448 HA2 GLY 55 HA2 GLY 55 25.153 -25.192 1.811 449 HA3 GLY 55 HA1 GLY 55 23.722 -25.783 0.967 450 H GLN 56 HN GLN 56 22.924 -23.417 -0.212 451 HA GLN 56 HA GLN 56 24.817 -23.385 -2.439 452 HB2 GLN 56 HB2 GLN 56 22.047 -22.170 -2.261 453 HB3 GLN 56 HB1 GLN 56 23.057 -22.293 -3.698 454 HG2 GLN 56 HG2 GLN 56 22.122 -24.678 -2.068 455 HG3 GLN 56 HG1 GLN 56 21.383 -24.129 -3.568 456 HE21 GLN 56 HE21 GLN 56 23.588 -26.373 -2.456 457 HE22 GLN 56 HE22 GLN 56 24.520 -26.549 -3.856 458 H ARG 57 HN ARG 57 24.800 -21.692 0.248 459 HA ARG 57 HA ARG 57 24.648 -18.976 -0.505 460 HB2 ARG 57 HB2 ARG 57 24.966 -20.117 1.886 461 HB3 ARG 57 HB1 ARG 57 26.659 -19.796 1.557 462 HG2 ARG 57 HG2 ARG 57 26.000 -17.399 0.990 463 HG3 ARG 57 HG1 ARG 57 24.417 -17.771 1.653 464 HD2 ARG 57 HD2 ARG 57 25.662 -16.822 3.458 465 HD3 ARG 57 HD1 ARG 57 25.616 -18.560 3.745 466 HE ARG 57 HE ARG 57 27.894 -17.485 2.252 467 HH11 ARG 57 HH21 ARG 57 26.652 -18.868 5.252 468 HH12 ARG 57 HH22 ARG 57 28.208 -19.014 5.944 469 HH21 ARG 57 HH11 ARG 57 29.919 -17.737 3.224 470 HH22 ARG 57 HH12 ARG 57 30.086 -18.381 4.793 471 H LEU 58 HN LEU 58 26.084 -17.620 -1.433 472 HA LEU 58 HA LEU 58 28.554 -18.679 -2.536 473 HB2 LEU 58 HB2 LEU 58 27.431 -15.868 -2.583 474 HB3 LEU 58 HB1 LEU 58 28.835 -16.423 -3.480 475 HG LEU 58 HG LEU 58 25.997 -17.463 -3.808 476 HD11 LEU 58 HD11 LEU 58 27.172 -16.434 -6.202 477 HD12 LEU 58 HD12 LEU 58 27.289 -15.217 -4.959 478 HD13 LEU 58 HD13 LEU 58 25.722 -15.900 -5.381 479 HD21 LEU 58 HD21 LEU 58 27.341 -18.458 -5.928 480 HD22 LEU 58 HD22 LEU 58 27.163 -19.336 -4.419 481 HD23 LEU 58 HD23 LEU 58 28.657 -18.476 -4.751 482 H ALA 59 HN ALA 59 30.629 -17.737 -2.052 483 HA ALA 59 HA ALA 59 31.142 -17.513 0.720 484 HB1 ALA 59 HB1 ALA 59 33.425 -16.744 0.034 485 HB2 ALA 59 HB2 ALA 59 32.876 -16.663 -1.629 486 HB3 ALA 59 HB3 ALA 59 32.925 -18.214 -0.791 487 H ARG 60 HN ARG 60 30.235 -15.281 -1.676 488 HA ARG 60 HA ARG 60 31.028 -12.837 -0.474 489 HB2 ARG 60 HB2 ARG 60 30.394 -13.127 -2.834 490 HB3 ARG 60 HB1 ARG 60 28.735 -13.439 -2.340 491 HG2 ARG 60 HG2 ARG 60 28.672 -11.168 -1.278 492 HG3 ARG 60 HG1 ARG 60 30.278 -10.855 -1.938 493 HD2 ARG 60 HD2 ARG 60 27.869 -11.612 -3.617 494 HD3 ARG 60 HD1 ARG 60 28.459 -9.974 -3.427 495 HE ARG 60 HE ARG 60 30.682 -11.272 -4.222 496 HH11 ARG 60 HH21 ARG 60 27.343 -11.311 -5.502 497 HH12 ARG 60 HH22 ARG 60 27.887 -11.523 -7.088 498 HH21 ARG 60 HH11 ARG 60 31.286 -11.591 -6.428 499 HH22 ARG 60 HH12 ARG 60 30.064 -11.675 -7.632 500 H ASP 61 HN ASP 61 30.316 -12.235 1.552 501 HA ASP 61 HA ASP 61 27.718 -13.039 2.530 502 HB2 ASP 61 HB2 ASP 61 28.131 -11.670 4.485 503 HB3 ASP 61 HB1 ASP 61 29.597 -12.577 4.166 504 H GLN 62 HN GLN 62 29.009 -10.573 0.635 505 HA GLN 62 HA GLN 62 26.976 -8.639 1.010 506 HB2 GLN 62 HB2 GLN 62 28.930 -9.024 -1.268 507 HB3 GLN 62 HB1 GLN 62 27.825 -7.662 -1.141 508 HG2 GLN 62 HG2 GLN 62 28.790 -7.061 1.049 509 HG3 GLN 62 HG1 GLN 62 29.873 -8.439 0.923 510 HE21 GLN 62 HE21 GLN 62 29.841 -5.137 0.391 511 HE22 GLN 62 HE22 GLN 62 31.069 -5.060 -0.774 512 H GLU 63 HN GLU 63 27.010 -11.669 -0.533 513 HA GLU 63 HA GLU 63 25.600 -11.132 -2.791 514 HB2 GLU 63 HB2 GLU 63 26.361 -13.550 -1.474 515 HB3 GLU 63 HB1 GLU 63 24.666 -13.696 -1.875 516 HG2 GLU 63 HG2 GLU 63 27.007 -13.413 -3.712 517 HG3 GLU 63 HG1 GLU 63 25.613 -14.447 -3.793 518 H THR 64 HN THR 64 23.517 -11.430 -3.432 519 HA THR 64 HA THR 64 21.592 -10.077 -1.880 520 HB THR 64 HB THR 64 20.565 -11.672 -4.117 521 HG1 THR 64 HG1 THR 64 22.768 -11.447 -4.802 522 HG21 THR 64 HG21 THR 64 19.747 -9.527 -4.824 523 HG22 THR 64 HG22 THR 64 20.868 -8.685 -3.751 524 HG23 THR 64 HG23 THR 64 19.536 -9.623 -3.079 525 H LEU 65 HN LEU 65 19.676 -10.928 -0.945 526 HA LEU 65 HA LEU 65 19.831 -13.507 0.245 527 HB2 LEU 65 HB2 LEU 65 17.441 -11.709 -0.173 528 HB3 LEU 65 HB1 LEU 65 17.419 -13.159 0.830 529 HG LEU 65 HG LEU 65 19.159 -10.716 1.224 530 HD11 LEU 65 HD11 LEU 65 16.999 -11.746 3.050 531 HD12 LEU 65 HD12 LEU 65 16.676 -10.573 1.787 532 HD13 LEU 65 HD13 LEU 65 17.781 -10.164 3.095 533 HD21 LEU 65 HD21 LEU 65 19.746 -11.811 3.395 534 HD22 LEU 65 HD22 LEU 65 20.396 -12.638 2.000 535 HD23 LEU 65 HD23 LEU 65 18.975 -13.294 2.834 536 H HIS 66 HN HIS 66 18.236 -12.243 -2.587 537 HA HIS 66 HA HIS 66 16.633 -14.312 -3.376 538 HB2 HIS 66 HB2 HIS 66 17.640 -12.019 -4.571 539 HB3 HIS 66 HB1 HIS 66 18.204 -13.297 -5.638 540 HD1 HIS 66 HD1 HIS 66 15.837 -11.169 -6.221 541 HD2 HIS 66 HD2 HIS 66 15.354 -15.174 -5.158 542 HE1 HIS 66 HE1 HIS 66 13.553 -11.856 -7.038 543 HE2 HIS 66 HE2 HIS 66 13.219 -14.259 -6.406 544 H SER 67 HN SER 67 20.150 -14.097 -3.569 545 HA SER 67 HA SER 67 20.668 -16.296 -5.193 546 HB2 SER 67 HB2 SER 67 22.349 -15.259 -2.915 547 HB3 SER 67 HB1 SER 67 22.885 -16.182 -4.306 548 HG SER 67 HG SER 67 23.034 -13.689 -4.394 549 H HIS 68 HN HIS 68 19.801 -16.093 -1.788 550 HA HIS 68 HA HIS 68 20.515 -18.788 -1.157 551 HB2 HIS 68 HB2 HIS 68 20.385 -17.521 0.779 552 HB3 HIS 68 HB1 HIS 68 19.045 -16.565 0.224 553 HD1 HIS 68 HD1 HIS 68 19.448 -20.361 0.892 554 HD2 HIS 68 HD2 HIS 68 16.878 -17.182 1.833 555 HE1 HIS 68 HE1 HIS 68 17.610 -21.295 2.344 556 HE2 HIS 68 HE2 HIS 68 16.009 -19.361 2.879 557 H GLY 69 HN GLY 69 18.137 -17.424 -3.091 558 HA2 GLY 69 HA2 GLY 69 16.680 -18.680 -4.418 559 HA3 GLY 69 HA1 GLY 69 16.747 -19.997 -3.256 560 H VAL 70 HN VAL 70 16.415 -17.236 -1.499 561 HA VAL 70 HA VAL 70 13.638 -17.775 -0.986 562 HB VAL 70 HB VAL 70 14.994 -17.245 0.897 563 HG11 VAL 70 HG11 VAL 70 15.841 -14.739 -0.588 564 HG12 VAL 70 HG12 VAL 70 16.855 -16.111 -0.147 565 HG13 VAL 70 HG13 VAL 70 16.179 -15.083 1.106 566 HG21 VAL 70 HG21 VAL 70 12.657 -16.101 0.670 567 HG22 VAL 70 HG22 VAL 70 13.593 -14.629 0.410 568 HG23 VAL 70 HG23 VAL 70 13.768 -15.514 1.915 569 H ARG 71 HN ARG 71 12.786 -17.305 -3.042 570 HA ARG 71 HA ARG 71 13.119 -14.786 -4.316 571 HB2 ARG 71 HB2 ARG 71 11.003 -16.886 -4.696 572 HB3 ARG 71 HB1 ARG 71 11.210 -15.526 -5.778 573 HG2 ARG 71 HG2 ARG 71 13.736 -16.397 -5.889 574 HG3 ARG 71 HG1 ARG 71 13.014 -17.902 -5.360 575 HD2 ARG 71 HD2 ARG 71 12.906 -18.123 -7.654 576 HD3 ARG 71 HD1 ARG 71 11.305 -17.519 -7.304 577 HE ARG 71 HE ARG 71 13.566 -15.855 -8.290 578 HH11 ARG 71 HH21 ARG 71 10.127 -16.461 -7.991 579 HH12 ARG 71 HH22 ARG 71 9.660 -15.192 -9.018 580 HH21 ARG 71 HH11 ARG 71 12.942 -14.137 -9.685 581 HH22 ARG 71 HH12 ARG 71 11.281 -13.847 -9.997 582 H GLN 72 HN GLN 72 10.737 -16.063 -2.121 583 HA GLN 72 HA GLN 72 9.787 -13.373 -1.575 584 HB2 GLN 72 HB2 GLN 72 7.369 -14.156 -1.814 585 HB3 GLN 72 HB1 GLN 72 8.245 -13.985 -3.322 586 HG2 GLN 72 HG2 GLN 72 8.812 -16.462 -3.107 587 HG3 GLN 72 HG1 GLN 72 7.581 -16.511 -1.859 588 HE21 GLN 72 HE21 GLN 72 7.759 -17.386 -4.883 589 HE22 GLN 72 HE22 GLN 72 6.248 -16.820 -5.460 590 H ASN 73 HN ASN 73 7.797 -13.713 0.104 591 HA ASN 73 HA ASN 73 8.945 -14.456 2.529 592 HB2 ASN 73 HB2 ASN 73 6.556 -14.372 3.356 593 HB3 ASN 73 HB1 ASN 73 7.090 -12.928 2.520 594 HD21 ASN 73 HD21 ASN 73 4.396 -14.622 2.759 595 HD22 ASN 73 HD22 ASN 73 3.822 -14.551 1.163 596 H GLY 74 HN GLY 74 8.271 -16.105 4.032 597 HA2 GLY 74 HA2 GLY 74 7.272 -18.115 4.591 598 HA3 GLY 74 HA1 GLY 74 7.024 -18.486 2.894 599 H ASP 75 HN ASP 75 10.096 -17.377 3.081 600 HA ASP 75 HA ASP 75 11.174 -20.059 2.890 601 HB2 ASP 75 HB2 ASP 75 12.060 -18.183 1.450 602 HB3 ASP 75 HB1 ASP 75 12.770 -17.506 2.914 603 H SER 76 HN SER 76 12.826 -20.886 4.121 604 HA SER 76 HA SER 76 13.036 -19.812 6.850 605 HB2 SER 76 HB2 SER 76 13.095 -22.772 6.292 606 HB3 SER 76 HB1 SER 76 12.638 -21.931 7.779 607 HG SER 76 HG SER 76 10.920 -21.052 6.163 608 H ALA 77 HN ALA 77 15.117 -19.890 7.718 609 HA ALA 77 HA ALA 77 17.245 -21.149 6.091 610 HB1 ALA 77 HB1 ALA 77 16.862 -18.320 6.471 611 HB2 ALA 77 HB2 ALA 77 18.105 -19.155 5.543 612 HB3 ALA 77 HB3 ALA 77 18.363 -18.822 7.252 613 H TYR 78 HN TYR 78 19.375 -21.251 7.309 614 HA TYR 78 HA TYR 78 18.762 -21.904 10.114 615 HB2 TYR 78 HB2 TYR 78 19.587 -23.672 8.157 616 HB3 TYR 78 HB1 TYR 78 21.088 -23.269 8.985 617 HD1 TYR 78 HD1 TYR 78 20.588 -22.866 11.697 618 HD2 TYR 78 HD2 TYR 78 18.560 -25.582 9.052 619 HE1 TYR 78 HE1 TYR 78 19.924 -24.181 13.594 620 HE2 TYR 78 HE2 TYR 78 17.872 -26.943 10.978 621 HH TYR 78 HH TYR 78 19.314 -26.598 13.949 622 H LEU 79 HN LEU 79 19.828 -20.872 11.629 623 HA LEU 79 HA LEU 79 22.380 -19.558 10.957 624 HB2 LEU 79 HB2 LEU 79 20.719 -17.847 11.290 625 HB3 LEU 79 HB1 LEU 79 20.154 -18.623 12.766 626 HG LEU 79 HG LEU 79 22.385 -18.218 13.813 627 HD11 LEU 79 HD11 LEU 79 24.146 -17.578 12.617 628 HD12 LEU 79 HD12 LEU 79 23.272 -16.195 11.951 629 HD13 LEU 79 HD13 LEU 79 23.199 -17.742 11.144 630 HD21 LEU 79 HD21 LEU 79 22.027 -15.924 14.262 631 HD22 LEU 79 HD22 LEU 79 20.422 -16.558 13.904 632 HD23 LEU 79 HD23 LEU 79 21.288 -15.623 12.690 633 H TYR 80 HN TYR 80 24.103 -20.040 12.233 634 HA TYR 80 HA TYR 80 23.542 -21.643 14.648 635 HB2 TYR 80 HB2 TYR 80 25.056 -22.412 12.417 636 HB3 TYR 80 HB1 TYR 80 26.252 -21.969 13.618 637 HD1 TYR 80 HD2 TYR 80 25.557 -22.723 16.126 638 HD2 TYR 80 HD1 TYR 80 24.321 -24.625 12.476 639 HE1 TYR 80 HE2 TYR 80 25.128 -24.804 17.365 640 HE2 TYR 80 HE1 TYR 80 23.884 -26.701 13.702 641 HH TYR 80 HH TYR 80 23.241 -27.144 16.290 642 H LEU 81 HN LEU 81 24.338 -20.944 16.544 643 HA LEU 81 HA LEU 81 26.236 -18.705 16.452 644 HB2 LEU 81 HB2 LEU 81 24.046 -19.325 18.416 645 HB3 LEU 81 HB1 LEU 81 25.413 -18.346 18.887 646 HG LEU 81 HG LEU 81 24.918 -17.022 16.651 647 HD11 LEU 81 HD11 LEU 81 23.176 -18.562 15.853 648 HD12 LEU 81 HD12 LEU 81 22.523 -16.950 16.136 649 HD13 LEU 81 HD13 LEU 81 22.239 -18.232 17.312 650 HD21 LEU 81 HD21 LEU 81 23.307 -15.566 17.949 651 HD22 LEU 81 HD22 LEU 81 24.790 -15.973 18.810 652 HD23 LEU 81 HD23 LEU 81 23.288 -16.819 19.194 653 H LEU 82 HN LEU 82 28.168 -19.003 17.326 654 HA LEU 82 HA LEU 82 28.736 -21.644 18.362 655 HB2 LEU 82 HB2 LEU 82 30.419 -19.440 17.246 656 HB3 LEU 82 HB1 LEU 82 31.161 -20.515 18.406 657 HG LEU 82 HG LEU 82 31.253 -21.179 15.888 658 HD11 LEU 82 HD11 LEU 82 30.426 -23.075 18.092 659 HD12 LEU 82 HD12 LEU 82 32.066 -22.673 17.592 660 HD13 LEU 82 HD13 LEU 82 31.020 -23.602 16.527 661 HD21 LEU 82 HD21 LEU 82 29.387 -22.184 14.917 662 HD22 LEU 82 HD22 LEU 82 28.542 -20.957 15.846 663 HD23 LEU 82 HD23 LEU 82 28.671 -22.606 16.446 664 H SER 83 HN SER 83 30.253 -21.902 20.221 665 HA SER 83 HA SER 83 29.083 -21.180 22.560 666 HB2 SER 83 HB2 SER 83 32.067 -21.392 22.419 667 HB3 SER 83 HB1 SER 83 30.938 -22.046 23.596 668 HG SER 83 HG SER 83 31.001 -23.798 22.427 669 H ALA 84 HN ALA 84 28.577 -19.217 23.172 670 HA ALA 84 HA ALA 84 29.402 -16.835 22.304 671 HB1 ALA 84 HB1 ALA 84 27.813 -17.648 24.389 672 HB2 ALA 84 HB2 ALA 84 28.110 -15.984 23.901 673 HB3 ALA 84 HB3 ALA 84 29.065 -16.708 25.199 674 H ARG 85 HN ARG 85 31.257 -15.837 22.144 675 HA ARG 85 HA ARG 85 33.586 -16.727 23.543 676 HB2 ARG 85 HB2 ARG 85 33.101 -14.391 21.690 677 HB3 ARG 85 HB1 ARG 85 34.662 -14.819 22.383 678 HG2 ARG 85 HG2 ARG 85 34.607 -17.017 21.334 679 HG3 ARG 85 HG1 ARG 85 32.988 -16.727 20.719 680 HD2 ARG 85 HD2 ARG 85 34.705 -16.330 18.985 681 HD3 ARG 85 HD1 ARG 85 33.772 -14.879 19.330 682 HE ARG 85 HE ARG 85 36.060 -14.889 20.983 683 HH11 ARG 85 HH21 ARG 85 35.278 -14.707 17.585 684 HH12 ARG 85 HH22 ARG 85 36.561 -13.609 17.242 685 HH21 ARG 85 HH11 ARG 85 37.729 -13.484 20.496 686 HH22 ARG 85 HH12 ARG 85 37.977 -12.918 18.896 687 H ASN 86 HN ASN 86 34.655 -15.728 25.202 688 HA ASN 86 HA ASN 86 33.156 -13.842 26.793 689 HB2 ASN 86 HB2 ASN 86 34.716 -15.574 27.788 690 HB3 ASN 86 HB1 ASN 86 36.060 -14.615 27.178 691 HD21 ASN 86 HD21 ASN 86 33.093 -14.231 29.196 692 HD22 ASN 86 HD22 ASN 86 33.784 -13.061 30.203 693 H THR 87 HN THR 87 33.061 -12.508 24.775 694 HA THR 87 HA THR 87 35.431 -11.018 24.139 695 HB THR 87 HB THR 87 33.963 -11.477 22.322 696 HG1 THR 87 HG1 THR 87 34.831 -9.243 22.510 697 HG21 THR 87 HG21 THR 87 31.568 -10.288 22.503 698 HG22 THR 87 HG22 THR 87 31.799 -10.625 24.203 699 HG23 THR 87 HG23 THR 87 31.829 -11.936 23.032 700 H SER 88 HN SER 88 36.069 -9.148 25.086 701 HA SER 88 HA SER 88 34.813 -8.270 27.422 702 HB2 SER 88 HB2 SER 88 36.717 -6.601 25.772 703 HB3 SER 88 HB1 SER 88 36.481 -6.598 27.514 704 HG SER 88 HG SER 88 38.346 -7.828 26.655 705 H LEU 89 HN LEU 89 33.233 -6.824 27.773 706 HA LEU 89 HA LEU 89 31.611 -5.916 25.659 707 HB2 LEU 89 HB2 LEU 89 31.648 -5.165 28.589 708 HB3 LEU 89 HB1 LEU 89 30.401 -4.650 27.455 709 HG LEU 89 HG LEU 89 31.106 -7.563 27.966 710 HD11 LEU 89 HD11 LEU 89 30.133 -6.346 29.963 711 HD12 LEU 89 HD12 LEU 89 29.232 -7.727 29.370 712 HD13 LEU 89 HD13 LEU 89 28.676 -6.097 28.994 713 HD21 LEU 89 HD21 LEU 89 28.643 -7.646 26.982 714 HD22 LEU 89 HD22 LEU 89 30.011 -7.578 25.898 715 HD23 LEU 89 HD23 LEU 89 29.093 -6.116 26.248 716 H ASN 90 HN ASN 90 34.017 -4.322 27.595 717 HA ASN 90 HA ASN 90 33.492 -1.676 26.987 718 HB2 ASN 90 HB2 ASN 90 35.911 -1.211 27.467 719 HB3 ASN 90 HB1 ASN 90 35.095 -2.152 28.700 720 HD21 ASN 90 HD21 ASN 90 35.949 -3.723 25.684 721 HD22 ASN 90 HD22 ASN 90 37.247 -4.620 26.289 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 4.260 -0.170 4.024 2 H2 MET 1 HT2 MET 1 4.969 0.706 2.790 3 H3 MET 1 HT3 MET 1 5.931 0.062 4.019 4 HA MET 1 HA MET 1 6.282 -1.618 2.549 5 HB2 MET 1 HB2 MET 1 3.460 -2.135 3.547 6 HB3 MET 1 HB1 MET 1 4.336 -3.293 2.564 7 HG2 MET 1 HG2 MET 1 6.182 -3.321 4.215 8 HG3 MET 1 HG1 MET 1 5.289 -2.200 5.235 9 HE1 MET 1 HE1 MET 1 5.535 -5.901 6.613 10 HE2 MET 1 HE2 MET 1 6.603 -4.843 5.713 11 HE3 MET 1 HE3 MET 1 5.821 -6.181 4.892 12 HA PRO 2 HA PRO 2 4.097 0.720 -0.978 13 HB2 PRO 2 HB2 PRO 2 6.847 0.262 -2.044 14 HB3 PRO 2 HB1 PRO 2 5.809 1.699 -2.144 15 HG2 PRO 2 HG2 PRO 2 7.836 1.707 -0.488 16 HG3 PRO 2 HG1 PRO 2 6.280 2.373 0.030 17 HD2 PRO 2 HD2 PRO 2 7.518 -0.248 0.767 18 HD3 PRO 2 HD1 PRO 2 6.569 0.879 1.760 19 H THR 3 HN THR 3 6.366 -2.004 -0.997 20 HA THR 3 HA THR 3 4.561 -3.515 -2.766 21 HB THR 3 HB THR 3 6.785 -4.594 -3.626 22 HG1 THR 3 HG1 THR 3 8.538 -3.581 -3.159 23 HG21 THR 3 HG21 THR 3 5.264 -3.284 -5.042 24 HG22 THR 3 HG22 THR 3 6.929 -2.911 -5.423 25 HG23 THR 3 HG23 THR 3 5.977 -1.785 -4.459 26 H GLN 4 HN GLN 4 4.819 -5.897 -2.466 27 HA GLN 4 HA GLN 4 4.904 -6.355 0.336 28 HB2 GLN 4 HB2 GLN 4 4.574 -8.329 -1.901 29 HB3 GLN 4 HB1 GLN 4 4.441 -8.738 -0.211 30 HG2 GLN 4 HG2 GLN 4 2.617 -7.043 0.088 31 HG3 GLN 4 HG1 GLN 4 2.722 -6.684 -1.633 32 HE21 GLN 4 HE21 GLN 4 0.258 -7.449 -1.161 33 HE22 GLN 4 HE22 GLN 4 -0.007 -9.094 -1.484 34 H ASP 5 HN ASP 5 6.308 -7.100 1.556 35 HA ASP 5 HA ASP 5 9.067 -7.576 0.703 36 HB2 ASP 5 HB2 ASP 5 7.856 -7.675 3.488 37 HB3 ASP 5 HB1 ASP 5 9.560 -7.701 3.057 38 H ILE 6 HN ILE 6 10.123 -9.486 2.030 39 HA ILE 6 HA ILE 6 8.281 -11.781 1.994 40 HB ILE 6 HB ILE 6 10.099 -13.242 1.343 41 HG12 ILE 6 HG12 ILE 6 11.805 -10.761 0.944 42 HG13 ILE 6 HG11 ILE 6 11.956 -11.808 2.361 43 HG21 ILE 6 HG21 ILE 6 9.811 -10.810 -0.418 44 HG22 ILE 6 HG22 ILE 6 8.789 -12.251 -0.474 45 HG23 ILE 6 HG23 ILE 6 10.491 -12.336 -0.977 46 HD11 ILE 6 HD11 ILE 6 12.309 -13.729 0.794 47 HD12 ILE 6 HD12 ILE 6 13.599 -12.528 0.757 48 HD13 ILE 6 HD13 ILE 6 12.398 -12.574 -0.535 49 H ARG 7 HN ARG 7 8.669 -13.357 3.555 50 HA ARG 7 HA ARG 7 9.882 -12.212 5.994 51 HB2 ARG 7 HB2 ARG 7 7.844 -14.432 5.873 52 HB3 ARG 7 HB1 ARG 7 8.285 -13.386 7.228 53 HG2 ARG 7 HG2 ARG 7 7.376 -11.415 5.990 54 HG3 ARG 7 HG1 ARG 7 6.891 -12.516 4.693 55 HD2 ARG 7 HD2 ARG 7 5.913 -12.772 7.555 56 HD3 ARG 7 HD1 ARG 7 5.044 -11.945 6.271 57 HE ARG 7 HE ARG 7 5.630 -14.506 5.304 58 HH11 ARG 7 HH21 ARG 7 3.839 -13.039 7.906 59 HH12 ARG 7 HH22 ARG 7 2.669 -14.285 7.988 60 HH21 ARG 7 HH11 ARG 7 4.052 -16.151 5.388 61 HH22 ARG 7 HH12 ARG 7 2.794 -16.074 6.560 62 H LEU 8 HN LEU 8 11.764 -13.082 6.508 63 HA LEU 8 HA LEU 8 12.286 -15.847 5.696 64 HB2 LEU 8 HB2 LEU 8 13.962 -14.453 4.815 65 HB3 LEU 8 HB1 LEU 8 14.116 -13.534 6.308 66 HG LEU 8 HG LEU 8 14.990 -15.617 7.442 67 HD11 LEU 8 HD11 LEU 8 15.392 -17.597 6.303 68 HD12 LEU 8 HD12 LEU 8 15.347 -16.820 4.716 69 HD13 LEU 8 HD13 LEU 8 13.860 -17.107 5.587 70 HD21 LEU 8 HD21 LEU 8 17.141 -15.705 5.945 71 HD22 LEU 8 HD22 LEU 8 16.738 -14.206 6.786 72 HD23 LEU 8 HD23 LEU 8 16.369 -14.387 5.067 73 H TRP 9 HN TRP 9 12.438 -17.346 7.178 74 HA TRP 9 HA TRP 9 12.645 -16.580 10.029 75 HB2 TRP 9 HB2 TRP 9 11.725 -19.312 9.584 76 HB3 TRP 9 HB1 TRP 9 10.966 -18.037 10.522 77 HD1 TRP 9 HD1 TRP 9 10.047 -15.960 8.554 78 HE1 TRP 9 HE1 TRP 9 8.426 -16.453 6.645 79 HE3 TRP 9 HE3 TRP 9 10.623 -21.015 8.197 80 HZ2 TRP 9 HZ2 TRP 9 7.482 -18.670 5.168 81 HZ3 TRP 9 HZ3 TRP 9 9.322 -22.301 6.503 82 HH2 TRP 9 HH2 TRP 9 7.763 -21.142 4.998 83 H VAL 10 HN VAL 10 14.382 -17.326 11.062 84 HA VAL 10 HA VAL 10 16.039 -19.264 9.579 85 HB VAL 10 HB VAL 10 16.868 -16.805 11.122 86 HG11 VAL 10 HG11 VAL 10 19.167 -17.568 10.131 87 HG12 VAL 10 HG12 VAL 10 18.456 -19.180 10.233 88 HG13 VAL 10 HG13 VAL 10 18.609 -18.178 11.683 89 HG21 VAL 10 HG21 VAL 10 16.517 -17.486 8.263 90 HG22 VAL 10 HG22 VAL 10 18.056 -16.722 8.658 91 HG23 VAL 10 HG23 VAL 10 16.549 -15.915 9.063 92 H SER 11 HN SER 11 16.661 -20.993 10.607 93 HA SER 11 HA SER 11 15.910 -21.446 13.374 94 HB2 SER 11 HB2 SER 11 17.719 -23.180 11.684 95 HB3 SER 11 HB1 SER 11 16.723 -23.651 13.042 96 HG SER 11 HG SER 11 15.761 -24.210 11.047 97 H VAL 12 HN VAL 12 17.221 -21.066 15.113 98 HA VAL 12 HA VAL 12 19.994 -20.339 14.494 99 HB VAL 12 HB VAL 12 18.048 -19.124 16.449 100 HG11 VAL 12 HG11 VAL 12 21.027 -18.684 16.164 101 HG12 VAL 12 HG12 VAL 12 20.206 -19.304 17.591 102 HG13 VAL 12 HG13 VAL 12 19.971 -17.634 17.095 103 HG21 VAL 12 HG21 VAL 12 18.407 -18.504 13.832 104 HG22 VAL 12 HG22 VAL 12 19.687 -17.520 14.542 105 HG23 VAL 12 HG23 VAL 12 18.022 -17.306 15.061 106 H GLU 13 HN GLU 13 21.555 -21.258 15.635 107 HA GLU 13 HA GLU 13 20.966 -22.583 18.184 108 HB2 GLU 13 HB2 GLU 13 22.436 -23.879 15.879 109 HB3 GLU 13 HB1 GLU 13 22.485 -24.470 17.535 110 HG2 GLU 13 HG2 GLU 13 20.023 -24.710 17.520 111 HG3 GLU 13 HG1 GLU 13 19.993 -24.162 15.846 112 H ASP 14 HN ASP 14 22.581 -22.306 19.658 113 HA ASP 14 HA ASP 14 24.963 -20.911 18.689 114 HB2 ASP 14 HB2 ASP 14 25.184 -19.789 20.679 115 HB3 ASP 14 HB1 ASP 14 23.456 -20.070 20.757 116 H ALA 15 HN ALA 15 26.886 -21.502 20.339 117 HA ALA 15 HA ALA 15 27.709 -24.070 19.559 118 HB1 ALA 15 HB1 ALA 15 29.470 -22.699 20.159 119 HB2 ALA 15 HB2 ALA 15 29.382 -23.812 21.523 120 HB3 ALA 15 HB3 ALA 15 28.711 -22.187 21.670 121 H GLN 16 HN GLN 16 26.151 -22.936 22.488 122 HA GLN 16 HA GLN 16 26.216 -25.489 23.836 123 HB2 GLN 16 HB2 GLN 16 24.365 -23.164 24.373 124 HB3 GLN 16 HB1 GLN 16 24.829 -24.451 25.478 125 HG2 GLN 16 HG2 GLN 16 26.752 -22.385 24.345 126 HG3 GLN 16 HG1 GLN 16 26.030 -22.337 25.943 127 HE21 GLN 16 HE21 GLN 16 28.945 -22.832 24.877 128 HE22 GLN 16 HE22 GLN 16 29.423 -24.192 25.766 129 H MET 17 HN MET 17 24.679 -24.367 21.149 130 HA MET 17 HA MET 17 23.063 -25.139 19.836 131 HB2 MET 17 HB2 MET 17 23.922 -27.412 20.941 132 HB3 MET 17 HB1 MET 17 22.307 -27.388 21.633 133 HG2 MET 17 HG2 MET 17 21.475 -28.150 19.719 134 HG3 MET 17 HG1 MET 17 22.010 -26.708 18.869 135 HE1 MET 17 HE1 MET 17 24.716 -26.422 18.820 136 HE2 MET 17 HE2 MET 17 24.155 -26.708 17.180 137 HE3 MET 17 HE3 MET 17 25.571 -27.564 17.764 138 H HIS 18 HN HIS 18 22.465 -23.132 21.674 139 HA HIS 18 HA HIS 18 19.879 -23.525 22.875 140 HB2 HIS 18 HB2 HIS 18 21.327 -21.059 21.875 141 HB3 HIS 18 HB1 HIS 18 19.709 -20.985 22.543 142 HD1 HIS 18 HD1 HIS 18 23.210 -21.993 23.485 143 HD2 HIS 18 HD2 HIS 18 19.599 -21.032 25.335 144 HE1 HIS 18 HE1 HIS 18 23.689 -21.800 26.007 145 HE2 HIS 18 HE2 HIS 18 21.502 -21.197 27.119 146 H THR 19 HN THR 19 18.348 -24.379 21.556 147 HA THR 19 HA THR 19 18.224 -23.723 18.761 148 HB THR 19 HB THR 19 16.058 -25.107 20.354 149 HG1 THR 19 HG1 THR 19 18.184 -26.002 20.775 150 HG21 THR 19 HG21 THR 19 15.860 -26.363 18.169 151 HG22 THR 19 HG22 THR 19 17.001 -25.212 17.478 152 HG23 THR 19 HG23 THR 19 15.449 -24.658 18.086 153 H VAL 20 HN VAL 20 17.518 -21.783 18.119 154 HA VAL 20 HA VAL 20 14.991 -20.773 19.187 155 HB VAL 20 HB VAL 20 16.070 -18.407 19.049 156 HG11 VAL 20 HG11 VAL 20 16.590 -18.490 21.395 157 HG12 VAL 20 HG12 VAL 20 16.992 -20.197 21.311 158 HG13 VAL 20 HG13 VAL 20 15.314 -19.680 21.138 159 HG21 VAL 20 HG21 VAL 20 18.306 -19.888 18.286 160 HG22 VAL 20 HG22 VAL 20 18.606 -19.594 19.983 161 HG23 VAL 20 HG23 VAL 20 18.345 -18.235 18.893 162 H THR 21 HN THR 21 14.005 -19.125 17.789 163 HA THR 21 HA THR 21 14.831 -19.417 14.970 164 HB THR 21 HB THR 21 11.973 -19.304 15.979 165 HG1 THR 21 HG1 THR 21 12.635 -21.212 16.613 166 HG21 THR 21 HG21 THR 21 13.282 -19.705 13.281 167 HG22 THR 21 HG22 THR 21 11.987 -18.595 13.718 168 HG23 THR 21 HG23 THR 21 11.665 -20.312 13.605 169 H ILE 22 HN ILE 22 14.850 -17.555 13.779 170 HA ILE 22 HA ILE 22 13.782 -15.107 15.066 171 HB ILE 22 HB ILE 22 15.633 -13.866 14.114 172 HG12 ILE 22 HG12 ILE 22 16.755 -16.564 13.262 173 HG13 ILE 22 HG11 ILE 22 16.021 -15.355 12.189 174 HG21 ILE 22 HG21 ILE 22 16.408 -16.239 15.845 175 HG22 ILE 22 HG22 ILE 22 16.006 -14.602 16.362 176 HG23 ILE 22 HG23 ILE 22 17.503 -14.903 15.491 177 HD11 ILE 22 HD11 ILE 22 18.377 -15.001 12.056 178 HD12 ILE 22 HD12 ILE 22 18.550 -15.087 13.810 179 HD13 ILE 22 HD13 ILE 22 17.740 -13.705 13.072 180 H TRP 23 HN TRP 23 13.063 -13.466 13.644 181 HA TRP 23 HA TRP 23 12.253 -14.518 10.989 182 HB2 TRP 23 HB2 TRP 23 10.677 -12.544 12.632 183 HB3 TRP 23 HB1 TRP 23 10.155 -13.463 11.230 184 HD1 TRP 23 HD1 TRP 23 10.902 -13.839 14.951 185 HE1 TRP 23 HE1 TRP 23 9.856 -16.034 15.800 186 HE3 TRP 23 HE3 TRP 23 9.388 -15.833 10.528 187 HZ2 TRP 23 HZ2 TRP 23 8.539 -18.355 14.719 188 HZ3 TRP 23 HZ3 TRP 23 8.237 -18.038 10.452 189 HH2 TRP 23 HH2 TRP 23 7.818 -19.291 12.551 190 H LEU 24 HN LEU 24 12.859 -13.304 9.310 191 HA LEU 24 HA LEU 24 13.459 -10.432 9.769 192 HB2 LEU 24 HB2 LEU 24 14.692 -12.240 7.671 193 HB3 LEU 24 HB1 LEU 24 14.980 -10.529 7.846 194 HG LEU 24 HG LEU 24 16.847 -11.491 8.930 195 HD11 LEU 24 HD11 LEU 24 15.407 -9.851 10.373 196 HD12 LEU 24 HD12 LEU 24 16.747 -10.732 11.086 197 HD13 LEU 24 HD13 LEU 24 15.106 -11.291 11.349 198 HD21 LEU 24 HD21 LEU 24 15.475 -13.795 9.015 199 HD22 LEU 24 HD22 LEU 24 15.291 -13.313 10.704 200 HD23 LEU 24 HD23 LEU 24 16.900 -13.500 10.008 201 H THR 25 HN THR 25 12.221 -9.054 8.656 202 HA THR 25 HA THR 25 10.629 -10.092 6.389 203 HB THR 25 HB THR 25 10.330 -7.380 7.710 204 HG1 THR 25 HG1 THR 25 9.923 -8.776 9.329 205 HG21 THR 25 HG21 THR 25 8.226 -9.028 6.304 206 HG22 THR 25 HG22 THR 25 9.333 -8.008 5.400 207 HG23 THR 25 HG23 THR 25 8.253 -7.288 6.580 208 H VAL 26 HN VAL 26 11.629 -9.780 4.488 209 HA VAL 26 HA VAL 26 13.178 -7.325 4.075 210 HB VAL 26 HB VAL 26 15.106 -8.650 3.244 211 HG11 VAL 26 HG11 VAL 26 14.342 -9.334 6.092 212 HG12 VAL 26 HG12 VAL 26 15.016 -7.784 5.586 213 HG13 VAL 26 HG13 VAL 26 15.967 -9.265 5.417 214 HG21 VAL 26 HG21 VAL 26 15.207 -11.055 3.922 215 HG22 VAL 26 HG22 VAL 26 13.988 -10.759 2.695 216 HG23 VAL 26 HG23 VAL 26 13.512 -10.983 4.382 217 H ARG 27 HN ARG 27 14.366 -7.885 1.762 218 HA ARG 27 HA ARG 27 12.267 -8.774 -0.097 219 HB2 ARG 27 HB2 ARG 27 13.284 -7.133 -1.741 220 HB3 ARG 27 HB1 ARG 27 12.335 -6.418 -0.457 221 HG2 ARG 27 HG2 ARG 27 15.190 -6.744 0.278 222 HG3 ARG 27 HG1 ARG 27 14.955 -5.708 -1.117 223 HD2 ARG 27 HD2 ARG 27 13.811 -5.327 1.663 224 HD3 ARG 27 HD1 ARG 27 14.870 -4.274 0.780 225 HE ARG 27 HE ARG 27 13.051 -3.638 -0.652 226 HH11 ARG 27 HH21 ARG 27 12.149 -5.754 2.007 227 HH12 ARG 27 HH22 ARG 27 10.477 -5.340 1.859 228 HH21 ARG 27 HH11 ARG 27 10.796 -3.139 -0.747 229 HH22 ARG 27 HH12 ARG 27 9.736 -3.908 0.372 230 HA PRO 28 HA PRO 28 15.331 -11.631 -1.503 231 HB2 PRO 28 HB2 PRO 28 14.682 -10.771 -4.246 232 HB3 PRO 28 HB1 PRO 28 14.692 -12.408 -3.548 233 HG2 PRO 28 HG2 PRO 28 12.397 -11.197 -4.037 234 HG3 PRO 28 HG1 PRO 28 12.608 -12.118 -2.541 235 HD2 PRO 28 HD2 PRO 28 12.613 -9.140 -2.899 236 HD3 PRO 28 HD1 PRO 28 11.984 -10.125 -1.559 237 H ASP 29 HN ASP 29 15.279 -8.353 -2.668 238 HA ASP 29 HA ASP 29 17.871 -8.293 -3.827 239 HB2 ASP 29 HB2 ASP 29 15.939 -6.142 -3.002 240 HB3 ASP 29 HB1 ASP 29 17.557 -5.746 -3.538 241 H MET 30 HN MET 30 16.815 -8.443 -0.630 242 HA MET 30 HA MET 30 18.841 -6.888 0.617 243 HB2 MET 30 HB2 MET 30 16.873 -8.927 1.514 244 HB3 MET 30 HB1 MET 30 18.351 -8.870 2.433 245 HG2 MET 30 HG2 MET 30 16.847 -6.330 1.798 246 HG3 MET 30 HG1 MET 30 16.491 -7.280 3.228 247 HE1 MET 30 HE1 MET 30 17.759 -7.943 4.855 248 HE2 MET 30 HE2 MET 30 19.053 -7.032 5.614 249 HE3 MET 30 HE3 MET 30 19.447 -8.298 4.455 250 H THR 31 HN THR 31 20.599 -7.892 1.957 251 HA THR 31 HA THR 31 21.835 -10.161 0.563 252 HB THR 31 HB THR 31 22.697 -7.705 -0.001 253 HG1 THR 31 HG1 THR 31 23.866 -10.148 0.057 254 HG21 THR 31 HG21 THR 31 23.058 -7.457 2.606 255 HG22 THR 31 HG22 THR 31 24.157 -6.713 1.454 256 HG23 THR 31 HG23 THR 31 24.609 -8.216 2.239 257 H VAL 32 HN VAL 32 23.474 -11.269 1.811 258 HA VAL 32 HA VAL 32 22.475 -11.944 4.324 259 HB VAL 32 HB VAL 32 25.166 -12.499 3.084 260 HG11 VAL 32 HG11 VAL 32 25.752 -13.201 5.165 261 HG12 VAL 32 HG12 VAL 32 24.668 -14.547 4.870 262 HG13 VAL 32 HG13 VAL 32 24.097 -13.145 5.765 263 HG21 VAL 32 HG21 VAL 32 23.036 -13.363 1.951 264 HG22 VAL 32 HG22 VAL 32 22.777 -14.341 3.396 265 HG23 VAL 32 HG23 VAL 32 24.217 -14.582 2.412 266 H ALA 33 HN ALA 33 25.264 -9.899 3.454 267 HA ALA 33 HA ALA 33 26.232 -9.415 6.024 268 HB1 ALA 33 HB1 ALA 33 26.813 -8.374 3.506 269 HB2 ALA 33 HB2 ALA 33 27.544 -7.862 5.024 270 HB3 ALA 33 HB3 ALA 33 26.170 -6.993 4.382 271 H SER 34 HN SER 34 23.661 -7.803 4.232 272 HA SER 34 HA SER 34 22.980 -5.957 6.246 273 HB2 SER 34 HB2 SER 34 21.165 -7.121 4.123 274 HB3 SER 34 HB1 SER 34 20.938 -5.617 5.004 275 HG SER 34 HG SER 34 21.903 -5.081 3.109 276 H LEU 35 HN LEU 35 21.844 -9.248 5.536 277 HA LEU 35 HA LEU 35 19.855 -9.364 7.564 278 HB2 LEU 35 HB2 LEU 35 21.485 -11.490 6.193 279 HB3 LEU 35 HB1 LEU 35 20.357 -11.884 7.471 280 HG LEU 35 HG LEU 35 19.632 -10.375 4.942 281 HD11 LEU 35 HD11 LEU 35 19.307 -13.241 5.803 282 HD12 LEU 35 HD12 LEU 35 20.039 -12.630 4.320 283 HD13 LEU 35 HD13 LEU 35 18.287 -12.521 4.561 284 HD21 LEU 35 HD21 LEU 35 17.302 -11.289 6.032 285 HD22 LEU 35 HD22 LEU 35 17.975 -9.683 6.325 286 HD23 LEU 35 HD23 LEU 35 18.252 -10.975 7.494 287 H LYS 36 HN LYS 36 23.301 -10.107 7.526 288 HA LYS 36 HA LYS 36 23.617 -11.201 10.057 289 HB2 LYS 36 HB2 LYS 36 25.271 -11.030 8.220 290 HB3 LYS 36 HB1 LYS 36 25.408 -9.308 8.536 291 HG2 LYS 36 HG2 LYS 36 25.871 -10.193 11.034 292 HG3 LYS 36 HG1 LYS 36 26.449 -11.601 10.157 293 HD2 LYS 36 HD2 LYS 36 27.260 -8.771 9.604 294 HD3 LYS 36 HD1 LYS 36 28.266 -9.886 10.530 295 HE2 LYS 36 HE2 LYS 36 27.689 -9.781 7.576 296 HE3 LYS 36 HE1 LYS 36 29.202 -10.111 8.392 297 HZ1 LYS 36 HZ1 LYS 36 26.936 -12.032 8.489 298 HZ2 LYS 36 HZ2 LYS 36 28.584 -12.313 8.803 299 HZ3 LYS 36 HZ3 LYS 36 28.046 -11.996 7.224 300 H ASP 37 HN ASP 37 23.695 -7.870 8.887 301 HA ASP 37 HA ASP 37 24.245 -6.633 11.356 302 HB2 ASP 37 HB2 ASP 37 24.544 -5.580 9.110 303 HB3 ASP 37 HB1 ASP 37 22.796 -5.436 9.004 304 H MET 38 HN MET 38 21.108 -6.992 9.639 305 HA MET 38 HA MET 38 19.641 -5.658 11.639 306 HB2 MET 38 HB2 MET 38 17.942 -7.673 10.484 307 HB3 MET 38 HB1 MET 38 17.889 -5.932 10.342 308 HG2 MET 38 HG2 MET 38 19.593 -5.994 8.564 309 HG3 MET 38 HG1 MET 38 19.617 -7.760 8.710 310 HE1 MET 38 HE1 MET 38 16.200 -8.342 9.124 311 HE2 MET 38 HE2 MET 38 17.693 -9.190 8.771 312 HE3 MET 38 HE3 MET 38 16.429 -9.116 7.559 313 H VAL 39 HN VAL 39 20.380 -9.069 11.283 314 HA VAL 39 HA VAL 39 18.719 -9.963 13.339 315 HB VAL 39 HB VAL 39 21.370 -11.038 12.342 316 HG11 VAL 39 HG11 VAL 39 21.477 -12.477 14.077 317 HG12 VAL 39 HG12 VAL 39 19.862 -13.050 13.730 318 HG13 VAL 39 HG13 VAL 39 20.086 -11.718 14.842 319 HG21 VAL 39 HG21 VAL 39 19.588 -12.898 11.689 320 HG22 VAL 39 HG22 VAL 39 19.784 -11.473 10.672 321 HG23 VAL 39 HG23 VAL 39 18.456 -11.565 11.822 322 H PHE 40 HN PHE 40 21.973 -8.603 13.432 323 HA PHE 40 HA PHE 40 22.284 -8.824 16.242 324 HB2 PHE 40 HB2 PHE 40 24.237 -8.329 14.938 325 HB3 PHE 40 HB1 PHE 40 23.469 -6.888 14.256 326 HD1 PHE 40 HD2 PHE 40 24.250 -8.395 17.615 327 HD2 PHE 40 HD1 PHE 40 23.872 -4.814 15.263 328 HE1 PHE 40 HE2 PHE 40 24.970 -7.047 19.553 329 HE2 PHE 40 HE1 PHE 40 24.586 -3.467 17.222 330 HZ PHE 40 HZ PHE 40 25.131 -4.585 19.357 331 H LEU 41 HN LEU 41 21.016 -6.282 14.111 332 HA LEU 41 HA LEU 41 20.483 -4.352 16.122 333 HB2 LEU 41 HB2 LEU 41 18.884 -4.870 13.596 334 HB3 LEU 41 HB1 LEU 41 18.867 -3.402 14.546 335 HG LEU 41 HG LEU 41 21.238 -4.562 13.130 336 HD11 LEU 41 HD11 LEU 41 19.500 -2.170 12.514 337 HD12 LEU 41 HD12 LEU 41 19.698 -3.619 11.529 338 HD13 LEU 41 HD13 LEU 41 21.036 -2.486 11.718 339 HD21 LEU 41 HD21 LEU 41 22.071 -3.439 15.006 340 HD22 LEU 41 HD22 LEU 41 20.920 -2.089 14.840 341 HD23 LEU 41 HD23 LEU 41 22.249 -2.292 13.683 342 H ASP 42 HN ASP 42 18.595 -6.823 14.655 343 HA ASP 42 HA ASP 42 16.204 -6.267 16.120 344 HB2 ASP 42 HB2 ASP 42 16.591 -7.517 13.773 345 HB3 ASP 42 HB1 ASP 42 16.516 -8.921 14.811 346 H TYR 43 HN TYR 43 18.559 -8.940 16.342 347 HA TYR 43 HA TYR 43 17.220 -9.806 18.842 348 HB2 TYR 43 HB2 TYR 43 19.019 -11.417 17.024 349 HB3 TYR 43 HB1 TYR 43 18.121 -11.974 18.433 350 HD1 TYR 43 HD2 TYR 43 15.614 -11.997 18.443 351 HD2 TYR 43 HD1 TYR 43 17.893 -11.074 14.919 352 HE1 TYR 43 HE2 TYR 43 13.609 -12.372 17.040 353 HE2 TYR 43 HE1 TYR 43 15.917 -11.442 13.525 354 HH TYR 43 HH TYR 43 13.317 -11.301 13.989 355 H GLY 44 HN GLY 44 20.000 -8.166 17.895 356 HA2 GLY 44 HA2 GLY 44 21.846 -7.520 19.160 357 HA3 GLY 44 HA1 GLY 44 21.109 -8.340 20.522 358 H PHE 45 HN PHE 45 21.486 -10.228 17.680 359 HA PHE 45 HA PHE 45 23.219 -12.055 19.032 360 HB2 PHE 45 HB2 PHE 45 22.272 -11.931 16.159 361 HB3 PHE 45 HB1 PHE 45 23.297 -13.207 16.783 362 HD1 PHE 45 HD1 PHE 45 21.168 -12.123 19.455 363 HD2 PHE 45 HD2 PHE 45 21.150 -14.496 15.841 364 HE1 PHE 45 HE1 PHE 45 19.204 -13.336 20.254 365 HE2 PHE 45 HE2 PHE 45 19.157 -15.706 16.676 366 HZ PHE 45 HZ PHE 45 18.183 -15.129 18.881 367 HA PRO 46 HA PRO 46 26.933 -9.786 17.928 368 HB2 PRO 46 HB2 PRO 46 28.735 -11.756 18.651 369 HB3 PRO 46 HB1 PRO 46 28.038 -10.568 19.754 370 HG2 PRO 46 HG2 PRO 46 27.243 -13.394 19.320 371 HG3 PRO 46 HG1 PRO 46 27.292 -12.470 20.821 372 HD2 PRO 46 HD2 PRO 46 24.959 -12.959 19.559 373 HD3 PRO 46 HD1 PRO 46 25.233 -11.425 20.427 374 HA PRO 47 HA PRO 47 26.986 -11.550 13.778 375 HB2 PRO 47 HB2 PRO 47 29.029 -10.012 12.796 376 HB3 PRO 47 HB1 PRO 47 27.336 -9.472 12.900 377 HG2 PRO 47 HG2 PRO 47 29.621 -8.913 14.741 378 HG3 PRO 47 HG1 PRO 47 28.327 -7.837 14.196 379 HD2 PRO 47 HD2 PRO 47 28.211 -8.891 16.628 380 HD3 PRO 47 HD1 PRO 47 26.732 -8.742 15.658 381 H VAL 48 HN VAL 48 29.894 -11.227 15.699 382 HA VAL 48 HA VAL 48 31.547 -12.864 14.105 383 HB VAL 48 HB VAL 48 32.657 -11.540 15.727 384 HG11 VAL 48 HG11 VAL 48 31.832 -12.664 18.254 385 HG12 VAL 48 HG12 VAL 48 30.397 -12.110 17.390 386 HG13 VAL 48 HG13 VAL 48 31.726 -11.011 17.687 387 HG21 VAL 48 HG21 VAL 48 32.712 -14.292 17.001 388 HG22 VAL 48 HG22 VAL 48 34.032 -13.139 16.869 389 HG23 VAL 48 HG23 VAL 48 33.455 -13.981 15.434 390 H LEU 49 HN LEU 49 29.384 -13.601 16.791 391 HA LEU 49 HA LEU 49 30.045 -16.402 16.876 392 HB2 LEU 49 HB2 LEU 49 27.804 -14.767 18.042 393 HB3 LEU 49 HB1 LEU 49 27.819 -16.516 18.128 394 HG LEU 49 HG LEU 49 30.206 -16.328 19.054 395 HD11 LEU 49 HD11 LEU 49 29.872 -13.845 20.390 396 HD12 LEU 49 HD12 LEU 49 29.601 -13.539 18.681 397 HD13 LEU 49 HD13 LEU 49 31.099 -14.296 19.216 398 HD21 LEU 49 HD21 LEU 49 27.609 -15.887 20.408 399 HD22 LEU 49 HD22 LEU 49 29.001 -15.346 21.341 400 HD23 LEU 49 HD23 LEU 49 28.912 -17.011 20.793 401 H GLN 50 HN GLN 50 27.495 -14.509 15.348 402 HA GLN 50 HA GLN 50 26.053 -16.841 14.666 403 HB2 GLN 50 HB2 GLN 50 24.486 -15.404 13.473 404 HB3 GLN 50 HB1 GLN 50 24.833 -14.772 15.078 405 HG2 GLN 50 HG2 GLN 50 25.308 -12.823 14.065 406 HG3 GLN 50 HG1 GLN 50 26.770 -13.589 13.444 407 HE21 GLN 50 HE21 GLN 50 26.924 -13.648 11.207 408 HE22 GLN 50 HE22 GLN 50 25.619 -13.469 10.138 409 H GLN 51 HN GLN 51 26.380 -18.195 13.183 410 HA GLN 51 HA GLN 51 27.709 -17.457 10.643 411 HB2 GLN 51 HB2 GLN 51 27.458 -20.125 12.058 412 HB3 GLN 51 HB1 GLN 51 28.198 -19.889 10.478 413 HG2 GLN 51 HG2 GLN 51 29.134 -18.448 12.976 414 HG3 GLN 51 HG1 GLN 51 29.821 -19.965 12.419 415 HE21 GLN 51 HE21 GLN 51 29.982 -19.636 9.672 416 HE22 GLN 51 HE22 GLN 51 30.978 -18.319 9.300 417 H TRP 52 HN TRP 52 26.522 -17.654 8.842 418 HA TRP 52 HA TRP 52 23.771 -18.702 9.050 419 HB2 TRP 52 HB2 TRP 52 25.144 -16.852 7.100 420 HB3 TRP 52 HB1 TRP 52 23.595 -17.602 6.750 421 HD1 TRP 52 HD1 TRP 52 25.111 -15.654 9.752 422 HE1 TRP 52 HE1 TRP 52 23.316 -14.046 10.625 423 HE3 TRP 52 HE3 TRP 52 21.306 -16.847 6.582 424 HZ2 TRP 52 HZ2 TRP 52 20.575 -13.351 10.025 425 HZ3 TRP 52 HZ3 TRP 52 19.111 -15.704 6.753 426 HH2 TRP 52 HH2 TRP 52 18.744 -13.964 8.473 427 H VAL 53 HN VAL 53 23.121 -20.475 7.945 428 HA VAL 53 HA VAL 53 24.984 -21.614 5.960 429 HB VAL 53 HB VAL 53 23.293 -23.043 8.024 430 HG11 VAL 53 HG11 VAL 53 24.839 -24.177 5.683 431 HG12 VAL 53 HG12 VAL 53 23.086 -24.258 5.921 432 HG13 VAL 53 HG13 VAL 53 24.168 -25.131 6.999 433 HG21 VAL 53 HG21 VAL 53 25.456 -23.969 8.741 434 HG22 VAL 53 HG22 VAL 53 25.514 -22.204 8.784 435 HG23 VAL 53 HG23 VAL 53 26.278 -23.081 7.460 436 H ILE 54 HN ILE 54 24.106 -21.810 4.007 437 HA ILE 54 HA ILE 54 21.193 -22.070 3.731 438 HB ILE 54 HB ILE 54 22.985 -20.200 2.146 439 HG12 ILE 54 HG12 ILE 54 20.561 -19.597 3.872 440 HG13 ILE 54 HG11 ILE 54 22.223 -19.420 4.427 441 HG21 ILE 54 HG21 ILE 54 20.854 -19.550 0.981 442 HG22 ILE 54 HG22 ILE 54 20.039 -20.865 1.812 443 HG23 ILE 54 HG23 ILE 54 21.317 -21.218 0.653 444 HD11 ILE 54 HD11 ILE 54 22.653 -17.839 2.552 445 HD12 ILE 54 HD12 ILE 54 21.392 -17.258 3.642 446 HD13 ILE 54 HD13 ILE 54 20.959 -17.968 2.089 447 H GLY 55 HN GLY 55 20.695 -23.786 2.534 448 HA2 GLY 55 HA2 GLY 55 22.706 -25.505 1.530 449 HA3 GLY 55 HA1 GLY 55 20.986 -25.697 1.257 450 H GLN 56 HN GLN 56 20.468 -23.303 -0.081 451 HA GLN 56 HA GLN 56 20.964 -24.094 -2.728 452 HB2 GLN 56 HB2 GLN 56 20.159 -21.366 -1.718 453 HB3 GLN 56 HB1 GLN 56 19.905 -21.989 -3.344 454 HG2 GLN 56 HG2 GLN 56 17.888 -22.683 -2.556 455 HG3 GLN 56 HG1 GLN 56 18.778 -24.000 -1.817 456 HE21 GLN 56 HE21 GLN 56 16.609 -21.547 -1.061 457 HE22 GLN 56 HE22 GLN 56 16.966 -21.415 0.591 458 H ARG 57 HN ARG 57 22.410 -21.453 -0.850 459 HA ARG 57 HA ARG 57 24.779 -21.432 -2.594 460 HB2 ARG 57 HB2 ARG 57 23.038 -19.045 -2.002 461 HB3 ARG 57 HB1 ARG 57 24.651 -18.916 -2.668 462 HG2 ARG 57 HG2 ARG 57 22.399 -20.501 -3.969 463 HG3 ARG 57 HG1 ARG 57 22.782 -18.856 -4.396 464 HD2 ARG 57 HD2 ARG 57 24.397 -21.345 -4.904 465 HD3 ARG 57 HD1 ARG 57 24.017 -20.043 -6.001 466 HE ARG 57 HE ARG 57 26.336 -20.265 -4.459 467 HH11 ARG 57 HH21 ARG 57 23.936 -17.854 -5.295 468 HH12 ARG 57 HH22 ARG 57 25.012 -16.533 -5.047 469 HH21 ARG 57 HH11 ARG 57 27.734 -18.494 -4.157 470 HH22 ARG 57 HH12 ARG 57 27.178 -16.887 -4.381 471 H LEU 58 HN LEU 58 26.520 -20.064 -1.647 472 HA LEU 58 HA LEU 58 26.864 -20.602 1.141 473 HB2 LEU 58 HB2 LEU 58 28.363 -18.778 -0.753 474 HB3 LEU 58 HB1 LEU 58 28.822 -18.992 0.922 475 HG LEU 58 HG LEU 58 28.601 -21.290 -1.061 476 HD11 LEU 58 HD11 LEU 58 30.395 -19.619 -1.618 477 HD12 LEU 58 HD12 LEU 58 30.983 -21.233 -1.235 478 HD13 LEU 58 HD13 LEU 58 31.114 -19.954 -0.042 479 HD21 LEU 58 HD21 LEU 58 29.751 -21.040 1.745 480 HD22 LEU 58 HD22 LEU 58 29.968 -22.438 0.712 481 HD23 LEU 58 HD23 LEU 58 28.363 -22.029 1.287 482 H ALA 59 HN ALA 59 26.527 -19.315 2.861 483 HA ALA 59 HA ALA 59 24.757 -17.058 2.537 484 HB1 ALA 59 HB1 ALA 59 26.122 -17.745 5.117 485 HB2 ALA 59 HB2 ALA 59 24.821 -18.774 4.509 486 HB3 ALA 59 HB3 ALA 59 24.521 -17.068 4.843 487 H ARG 60 HN ARG 60 27.102 -16.572 1.130 488 HA ARG 60 HA ARG 60 28.895 -15.062 2.717 489 HB2 ARG 60 HB2 ARG 60 29.749 -15.911 0.611 490 HB3 ARG 60 HB1 ARG 60 28.525 -15.002 -0.296 491 HG2 ARG 60 HG2 ARG 60 29.533 -12.918 0.162 492 HG3 ARG 60 HG1 ARG 60 30.388 -13.529 1.566 493 HD2 ARG 60 HD2 ARG 60 31.953 -13.120 -0.234 494 HD3 ARG 60 HD1 ARG 60 31.884 -14.836 0.109 495 HE ARG 60 HE ARG 60 30.122 -14.123 -2.072 496 HH11 ARG 60 HH21 ARG 60 33.456 -14.574 -1.141 497 HH12 ARG 60 HH22 ARG 60 34.001 -14.974 -2.703 498 HH21 ARG 60 HH11 ARG 60 30.846 -14.671 -4.195 499 HH22 ARG 60 HH12 ARG 60 32.504 -15.012 -4.469 500 H ASP 61 HN ASP 61 29.040 -12.989 3.165 501 HA ASP 61 HA ASP 61 26.725 -11.695 3.842 502 HB2 ASP 61 HB2 ASP 61 29.508 -10.649 3.443 503 HB3 ASP 61 HB1 ASP 61 28.234 -9.650 4.080 504 H GLN 62 HN GLN 62 28.844 -11.033 1.118 505 HA GLN 62 HA GLN 62 27.447 -8.716 0.274 506 HB2 GLN 62 HB2 GLN 62 29.457 -10.289 -1.319 507 HB3 GLN 62 HB1 GLN 62 29.055 -8.585 -1.457 508 HG2 GLN 62 HG2 GLN 62 30.628 -8.102 0.057 509 HG3 GLN 62 HG1 GLN 62 29.686 -8.941 1.271 510 HE21 GLN 62 HE21 GLN 62 31.387 -10.062 2.394 511 HE22 GLN 62 HE22 GLN 62 32.401 -11.170 1.631 512 H GLU 63 HN GLU 63 26.665 -11.956 -0.235 513 HA GLU 63 HA GLU 63 25.541 -11.439 -2.864 514 HB2 GLU 63 HB2 GLU 63 25.710 -13.941 -1.203 515 HB3 GLU 63 HB1 GLU 63 24.769 -13.872 -2.703 516 HG2 GLU 63 HG2 GLU 63 26.788 -13.119 -3.893 517 HG3 GLU 63 HG1 GLU 63 27.688 -13.210 -2.376 518 H THR 64 HN THR 64 23.444 -11.351 -3.424 519 HA THR 64 HA THR 64 21.725 -10.307 -1.420 520 HB THR 64 HB THR 64 20.238 -10.559 -3.733 521 HG1 THR 64 HG1 THR 64 22.040 -11.360 -4.850 522 HG21 THR 64 HG21 THR 64 21.843 -8.141 -3.800 523 HG22 THR 64 HG22 THR 64 21.305 -8.492 -2.152 524 HG23 THR 64 HG23 THR 64 20.141 -8.405 -3.468 525 H LEU 65 HN LEU 65 19.465 -11.004 -1.213 526 HA LEU 65 HA LEU 65 19.299 -13.774 -0.616 527 HB2 LEU 65 HB2 LEU 65 17.128 -11.676 -0.848 528 HB3 LEU 65 HB1 LEU 65 16.834 -13.287 -0.211 529 HG LEU 65 HG LEU 65 18.711 -11.186 0.906 530 HD11 LEU 65 HD11 LEU 65 16.144 -11.012 1.224 531 HD12 LEU 65 HD12 LEU 65 17.183 -10.860 2.641 532 HD13 LEU 65 HD13 LEU 65 16.352 -12.372 2.319 533 HD21 LEU 65 HD21 LEU 65 19.739 -12.749 2.075 534 HD22 LEU 65 HD22 LEU 65 18.854 -14.046 1.241 535 HD23 LEU 65 HD23 LEU 65 18.233 -13.358 2.731 536 H HIS 66 HN HIS 66 18.183 -11.800 -3.306 537 HA HIS 66 HA HIS 66 16.824 -13.700 -4.868 538 HB2 HIS 66 HB2 HIS 66 18.472 -11.275 -5.505 539 HB3 HIS 66 HB1 HIS 66 18.195 -12.406 -6.806 540 HD1 HIS 66 HD1 HIS 66 16.777 -9.356 -5.715 541 HD2 HIS 66 HD2 HIS 66 15.078 -13.076 -6.674 542 HE1 HIS 66 HE1 HIS 66 14.391 -8.936 -6.306 543 HE2 HIS 66 HE2 HIS 66 13.333 -11.200 -6.885 544 H SER 67 HN SER 67 20.284 -13.042 -4.537 545 HA SER 67 HA SER 67 21.187 -14.936 -6.398 546 HB2 SER 67 HB2 SER 67 22.828 -14.107 -4.047 547 HB3 SER 67 HB1 SER 67 23.303 -14.363 -5.720 548 HG SER 67 HG SER 67 22.718 -12.413 -6.178 549 H HIS 68 HN HIS 68 19.979 -15.355 -3.134 550 HA HIS 68 HA HIS 68 21.365 -17.890 -2.837 551 HB2 HIS 68 HB2 HIS 68 19.685 -16.188 -1.015 552 HB3 HIS 68 HB1 HIS 68 20.116 -17.856 -0.615 553 HD1 HIS 68 HD1 HIS 68 21.684 -14.450 -1.245 554 HD2 HIS 68 HD2 HIS 68 22.797 -18.264 0.047 555 HE1 HIS 68 HE1 HIS 68 24.032 -14.250 -0.347 556 HE2 HIS 68 HE2 HIS 68 24.772 -16.604 0.350 557 H GLY 69 HN GLY 69 18.624 -16.807 -4.296 558 HA2 GLY 69 HA2 GLY 69 17.139 -18.212 -5.455 559 HA3 GLY 69 HA1 GLY 69 17.560 -19.528 -4.365 560 H VAL 70 HN VAL 70 17.165 -16.918 -2.450 561 HA VAL 70 HA VAL 70 14.438 -17.669 -1.757 562 HB VAL 70 HB VAL 70 15.829 -17.527 0.152 563 HG11 VAL 70 HG11 VAL 70 17.792 -16.542 -0.609 564 HG12 VAL 70 HG12 VAL 70 17.173 -15.438 0.624 565 HG13 VAL 70 HG13 VAL 70 16.942 -15.064 -1.085 566 HG21 VAL 70 HG21 VAL 70 14.799 -15.863 1.480 567 HG22 VAL 70 HG22 VAL 70 13.621 -16.092 0.199 568 HG23 VAL 70 HG23 VAL 70 14.712 -14.713 0.159 569 H ARG 71 HN ARG 71 13.417 -16.871 -3.541 570 HA ARG 71 HA ARG 71 13.721 -14.025 -4.173 571 HB2 ARG 71 HB2 ARG 71 12.543 -16.316 -5.746 572 HB3 ARG 71 HB1 ARG 71 12.705 -14.661 -6.336 573 HG2 ARG 71 HG2 ARG 71 15.194 -14.795 -5.936 574 HG3 ARG 71 HG1 ARG 71 14.977 -16.441 -5.421 575 HD2 ARG 71 HD2 ARG 71 14.139 -15.498 -8.175 576 HD3 ARG 71 HD1 ARG 71 15.710 -16.191 -7.822 577 HE ARG 71 HE ARG 71 13.727 -17.959 -6.845 578 HH11 ARG 71 HH21 ARG 71 15.008 -16.707 -9.829 579 HH12 ARG 71 HH22 ARG 71 14.579 -18.080 -10.755 580 HH21 ARG 71 HH11 ARG 71 13.176 -19.778 -8.042 581 HH22 ARG 71 HH12 ARG 71 13.525 -19.881 -9.717 582 H GLN 72 HN GLN 72 11.570 -16.038 -2.557 583 HA GLN 72 HA GLN 72 9.690 -13.861 -2.319 584 HB2 GLN 72 HB2 GLN 72 7.712 -15.118 -2.953 585 HB3 GLN 72 HB1 GLN 72 8.839 -15.116 -4.303 586 HG2 GLN 72 HG2 GLN 72 9.682 -17.362 -3.450 587 HG3 GLN 72 HG1 GLN 72 8.308 -17.371 -2.354 588 HE21 GLN 72 HE21 GLN 72 9.171 -17.290 -5.788 589 HE22 GLN 72 HE22 GLN 72 7.706 -17.906 -6.372 590 H ASN 73 HN ASN 73 8.100 -14.289 -0.603 591 HA ASN 73 HA ASN 73 9.334 -15.250 1.736 592 HB2 ASN 73 HB2 ASN 73 7.242 -14.961 2.863 593 HB3 ASN 73 HB1 ASN 73 7.362 -13.666 1.672 594 HD21 ASN 73 HD21 ASN 73 5.594 -13.471 0.279 595 HD22 ASN 73 HD22 ASN 73 4.432 -14.684 0.034 596 H GLY 74 HN GLY 74 8.619 -17.009 3.116 597 HA2 GLY 74 HA2 GLY 74 7.715 -19.276 3.361 598 HA3 GLY 74 HA1 GLY 74 7.730 -19.428 1.622 599 H ASP 75 HN ASP 75 10.476 -17.781 2.478 600 HA ASP 75 HA ASP 75 12.176 -20.057 2.023 601 HB2 ASP 75 HB2 ASP 75 13.937 -18.228 2.280 602 HB3 ASP 75 HB1 ASP 75 12.795 -18.024 0.938 603 H SER 76 HN SER 76 14.174 -20.118 3.490 604 HA SER 76 HA SER 76 13.814 -19.364 6.230 605 HB2 SER 76 HB2 SER 76 13.930 -22.338 5.742 606 HB3 SER 76 HB1 SER 76 13.562 -21.465 7.219 607 HG SER 76 HG SER 76 11.726 -20.562 5.814 608 H ALA 77 HN ALA 77 15.714 -19.986 7.552 609 HA ALA 77 HA ALA 77 18.027 -20.915 6.010 610 HB1 ALA 77 HB1 ALA 77 19.118 -18.963 5.865 611 HB2 ALA 77 HB2 ALA 77 18.770 -18.548 7.539 612 HB3 ALA 77 HB3 ALA 77 17.596 -18.177 6.279 613 H TYR 78 HN TYR 78 19.993 -21.136 7.418 614 HA TYR 78 HA TYR 78 19.199 -21.878 10.174 615 HB2 TYR 78 HB2 TYR 78 20.000 -23.636 8.280 616 HB3 TYR 78 HB1 TYR 78 21.563 -23.150 8.901 617 HD1 TYR 78 HD1 TYR 78 21.473 -22.869 11.695 618 HD2 TYR 78 HD2 TYR 78 19.138 -25.540 9.264 619 HE1 TYR 78 HE1 TYR 78 21.154 -24.347 13.627 620 HE2 TYR 78 HE2 TYR 78 18.814 -27.023 11.193 621 HH TYR 78 HH TYR 78 20.601 -26.563 14.143 622 H LEU 79 HN LEU 79 20.203 -20.742 11.718 623 HA LEU 79 HA LEU 79 22.729 -19.395 11.023 624 HB2 LEU 79 HB2 LEU 79 20.767 -17.902 11.380 625 HB3 LEU 79 HB1 LEU 79 20.692 -18.466 13.053 626 HG LEU 79 HG LEU 79 23.231 -17.298 11.865 627 HD11 LEU 79 HD11 LEU 79 21.468 -15.643 11.547 628 HD12 LEU 79 HD12 LEU 79 22.575 -15.125 12.808 629 HD13 LEU 79 HD13 LEU 79 21.002 -15.783 13.239 630 HD21 LEU 79 HD21 LEU 79 23.982 -17.881 13.917 631 HD22 LEU 79 HD22 LEU 79 22.364 -18.299 14.486 632 HD23 LEU 79 HD23 LEU 79 22.933 -16.641 14.582 633 H TYR 80 HN TYR 80 24.423 -19.786 12.265 634 HA TYR 80 HA TYR 80 24.054 -21.339 14.751 635 HB2 TYR 80 HB2 TYR 80 25.916 -21.647 12.518 636 HB3 TYR 80 HB1 TYR 80 26.704 -21.657 14.087 637 HD1 TYR 80 HD1 TYR 80 23.989 -23.258 12.088 638 HD2 TYR 80 HD2 TYR 80 26.455 -23.408 15.594 639 HE1 TYR 80 HE1 TYR 80 23.201 -25.545 12.545 640 HE2 TYR 80 HE2 TYR 80 25.722 -25.636 16.070 641 HH TYR 80 HH TYR 80 23.050 -26.895 14.958 642 H LEU 81 HN LEU 81 24.791 -20.511 16.602 643 HA LEU 81 HA LEU 81 26.527 -18.136 16.427 644 HB2 LEU 81 HB2 LEU 81 24.646 -19.009 18.634 645 HB3 LEU 81 HB1 LEU 81 25.953 -17.863 18.907 646 HG LEU 81 HG LEU 81 24.910 -16.730 16.708 647 HD11 LEU 81 HD11 LEU 81 22.561 -18.080 18.049 648 HD12 LEU 81 HD12 LEU 81 23.206 -18.480 16.462 649 HD13 LEU 81 HD13 LEU 81 22.472 -16.896 16.743 650 HD21 LEU 81 HD21 LEU 81 23.581 -15.288 18.243 651 HD22 LEU 81 HD22 LEU 81 25.204 -15.603 18.863 652 HD23 LEU 81 HD23 LEU 81 23.818 -16.472 19.528 653 H LEU 82 HN LEU 82 28.556 -18.814 16.458 654 HA LEU 82 HA LEU 82 29.249 -21.308 17.658 655 HB2 LEU 82 HB2 LEU 82 31.060 -19.191 16.523 656 HB3 LEU 82 HB1 LEU 82 31.551 -20.815 17.013 657 HG LEU 82 HG LEU 82 29.471 -20.175 14.886 658 HD11 LEU 82 HD11 LEU 82 31.583 -19.661 13.975 659 HD12 LEU 82 HD12 LEU 82 31.217 -21.289 13.386 660 HD13 LEU 82 HD13 LEU 82 32.350 -21.066 14.713 661 HD21 LEU 82 HD21 LEU 82 30.496 -22.793 16.053 662 HD22 LEU 82 HD22 LEU 82 29.839 -22.722 14.428 663 HD23 LEU 82 HD23 LEU 82 28.820 -22.317 15.781 664 H SER 83 HN SER 83 30.784 -21.736 19.240 665 HA SER 83 HA SER 83 30.180 -20.701 21.655 666 HB2 SER 83 HB2 SER 83 32.918 -21.570 21.759 667 HB3 SER 83 HB1 SER 83 31.472 -22.361 22.340 668 HG SER 83 HG SER 83 31.491 -23.608 20.644 669 H ALA 84 HN ALA 84 30.199 -18.606 22.119 670 HA ALA 84 HA ALA 84 32.600 -17.285 22.745 671 HB1 ALA 84 HB1 ALA 84 31.855 -16.955 20.025 672 HB2 ALA 84 HB2 ALA 84 33.085 -16.065 20.924 673 HB3 ALA 84 HB3 ALA 84 31.436 -15.459 20.862 674 H ARG 85 HN ARG 85 31.931 -14.751 23.001 675 HA ARG 85 HA ARG 85 29.236 -14.712 24.217 676 HB2 ARG 85 HB2 ARG 85 31.627 -13.374 25.490 677 HB3 ARG 85 HB1 ARG 85 30.012 -13.558 26.156 678 HG2 ARG 85 HG2 ARG 85 32.023 -15.777 25.654 679 HG3 ARG 85 HG1 ARG 85 31.540 -15.149 27.214 680 HD2 ARG 85 HD2 ARG 85 30.004 -16.959 25.373 681 HD3 ARG 85 HD1 ARG 85 30.279 -17.050 27.060 682 HE ARG 85 HE ARG 85 28.721 -15.083 27.321 683 HH11 ARG 85 HH21 ARG 85 28.553 -17.114 24.444 684 HH12 ARG 85 HH22 ARG 85 26.851 -17.068 24.343 685 HH21 ARG 85 HH11 ARG 85 26.406 -14.999 27.124 686 HH22 ARG 85 HH12 ARG 85 25.609 -15.828 25.868 687 H ASN 86 HN ASN 86 28.369 -12.585 24.439 688 HA ASN 86 HA ASN 86 28.877 -10.931 22.179 689 HB2 ASN 86 HB2 ASN 86 27.223 -9.405 23.123 690 HB3 ASN 86 HB1 ASN 86 26.625 -11.051 23.221 691 HD21 ASN 86 HD21 ASN 86 28.761 -11.281 25.623 692 HD22 ASN 86 HD22 ASN 86 27.870 -10.635 26.907 693 H THR 87 HN THR 87 30.265 -9.330 21.950 694 HA THR 87 HA THR 87 32.213 -8.785 23.926 695 HB THR 87 HB THR 87 32.737 -6.835 22.308 696 HG1 THR 87 HG1 THR 87 31.414 -6.602 20.722 697 HG21 THR 87 HG21 THR 87 34.194 -8.559 22.062 698 HG22 THR 87 HG22 THR 87 33.386 -8.717 20.514 699 HG23 THR 87 HG23 THR 87 32.946 -9.779 21.860 700 H SER 88 HN SER 88 29.202 -7.262 23.017 701 HA SER 88 HA SER 88 29.410 -5.586 25.427 702 HB2 SER 88 HB2 SER 88 28.279 -4.697 22.765 703 HB3 SER 88 HB1 SER 88 28.249 -3.779 24.253 704 HG SER 88 HG SER 88 30.138 -3.886 22.436 705 H LEU 89 HN LEU 89 27.456 -5.280 26.518 706 HA LEU 89 HA LEU 89 25.565 -7.380 26.353 707 HB2 LEU 89 HB2 LEU 89 25.415 -4.672 27.716 708 HB3 LEU 89 HB1 LEU 89 24.223 -5.946 27.920 709 HG LEU 89 HG LEU 89 27.181 -6.284 28.516 710 HD11 LEU 89 HD11 LEU 89 24.842 -5.691 30.342 711 HD12 LEU 89 HD12 LEU 89 26.306 -4.732 30.112 712 HD13 LEU 89 HD13 LEU 89 26.396 -6.303 30.900 713 HD21 LEU 89 HD21 LEU 89 24.731 -8.041 28.802 714 HD22 LEU 89 HD22 LEU 89 26.133 -8.261 29.843 715 HD23 LEU 89 HD23 LEU 89 26.303 -8.429 28.098 716 H ASN 90 HN ASN 90 25.614 -4.090 25.223 717 HA ASN 90 HA ASN 90 23.285 -4.663 23.500 718 HB2 ASN 90 HB2 ASN 90 24.020 -2.101 24.923 719 HB3 ASN 90 HB1 ASN 90 22.868 -2.195 23.594 720 HD21 ASN 90 HD21 ASN 90 23.326 -2.929 26.988 721 HD22 ASN 90 HD22 ASN 90 21.758 -3.508 27.258 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 5.264 1.606 -6.200 2 H2 MET 1 HT2 MET 1 6.182 2.627 -7.141 3 H3 MET 1 HT3 MET 1 4.596 3.075 -6.693 4 HA MET 1 HA MET 1 7.091 3.385 -5.322 5 HB2 MET 1 HB2 MET 1 4.457 4.658 -5.367 6 HB3 MET 1 HB1 MET 1 5.031 4.446 -3.713 7 HG2 MET 1 HG2 MET 1 6.161 6.364 -4.087 8 HG3 MET 1 HG1 MET 1 7.318 5.372 -4.935 9 HE1 MET 1 HE1 MET 1 7.294 6.320 -8.392 10 HE2 MET 1 HE2 MET 1 6.638 4.767 -7.897 11 HE3 MET 1 HE3 MET 1 7.984 5.459 -7.008 12 HA PRO 2 HA PRO 2 4.990 0.967 -1.626 13 HB2 PRO 2 HB2 PRO 2 2.886 -0.502 -3.122 14 HB3 PRO 2 HB1 PRO 2 2.817 0.229 -1.507 15 HG2 PRO 2 HG2 PRO 2 1.559 1.357 -3.517 16 HG3 PRO 2 HG1 PRO 2 2.422 2.372 -2.345 17 HD2 PRO 2 HD2 PRO 2 3.237 1.578 -5.113 18 HD3 PRO 2 HD1 PRO 2 3.410 3.145 -4.273 19 H THR 3 HN THR 3 6.026 -1.008 -1.138 20 HA THR 3 HA THR 3 6.427 -2.918 -3.334 21 HB THR 3 HB THR 3 8.734 -3.318 -2.211 22 HG1 THR 3 HG1 THR 3 8.649 -2.049 -0.466 23 HG21 THR 3 HG21 THR 3 8.274 -2.313 -4.483 24 HG22 THR 3 HG22 THR 3 9.765 -1.769 -3.732 25 HG23 THR 3 HG23 THR 3 8.350 -0.724 -3.730 26 H GLN 4 HN GLN 4 6.813 -5.102 -2.614 27 HA GLN 4 HA GLN 4 5.725 -5.601 0.088 28 HB2 GLN 4 HB2 GLN 4 5.622 -7.348 -2.348 29 HB3 GLN 4 HB1 GLN 4 5.078 -7.816 -0.758 30 HG2 GLN 4 HG2 GLN 4 3.476 -5.949 -0.689 31 HG3 GLN 4 HG1 GLN 4 3.953 -5.472 -2.318 32 HE21 GLN 4 HE21 GLN 4 2.154 -6.047 -3.593 33 HE22 GLN 4 HE22 GLN 4 1.457 -7.594 -3.576 34 H ASP 5 HN ASP 5 6.959 -6.479 1.419 35 HA ASP 5 HA ASP 5 9.595 -7.538 0.646 36 HB2 ASP 5 HB2 ASP 5 8.346 -7.005 3.354 37 HB3 ASP 5 HB1 ASP 5 9.904 -7.786 3.092 38 H ILE 6 HN ILE 6 10.216 -9.570 1.897 39 HA ILE 6 HA ILE 6 7.927 -11.416 1.915 40 HB ILE 6 HB ILE 6 9.339 -13.158 1.016 41 HG12 ILE 6 HG12 ILE 6 11.471 -11.030 0.620 42 HG13 ILE 6 HG11 ILE 6 11.534 -12.211 1.920 43 HG21 ILE 6 HG21 ILE 6 9.651 -12.218 -1.290 44 HG22 ILE 6 HG22 ILE 6 9.445 -10.607 -0.617 45 HG23 ILE 6 HG23 ILE 6 8.096 -11.749 -0.588 46 HD11 ILE 6 HD11 ILE 6 11.315 -12.956 -1.003 47 HD12 ILE 6 HD12 ILE 6 11.588 -14.038 0.359 48 HD13 ILE 6 HD13 ILE 6 12.842 -12.887 -0.113 49 H ARG 7 HN ARG 7 8.230 -13.221 3.248 50 HA ARG 7 HA ARG 7 9.593 -12.485 5.738 51 HB2 ARG 7 HB2 ARG 7 7.567 -14.691 5.253 52 HB3 ARG 7 HB1 ARG 7 8.199 -14.132 6.785 53 HG2 ARG 7 HG2 ARG 7 7.256 -11.908 6.457 54 HG3 ARG 7 HG1 ARG 7 6.602 -12.356 4.893 55 HD2 ARG 7 HD2 ARG 7 5.893 -13.726 7.506 56 HD3 ARG 7 HD1 ARG 7 4.916 -12.504 6.726 57 HE ARG 7 HE ARG 7 5.297 -14.482 4.784 58 HH11 ARG 7 HH21 ARG 7 3.990 -14.270 8.000 59 HH12 ARG 7 HH22 ARG 7 2.869 -15.538 7.749 60 HH21 ARG 7 HH11 ARG 7 3.853 -16.106 4.447 61 HH22 ARG 7 HH12 ARG 7 2.773 -16.613 5.701 62 H LEU 8 HN LEU 8 11.395 -13.444 6.323 63 HA LEU 8 HA LEU 8 12.085 -16.080 5.211 64 HB2 LEU 8 HB2 LEU 8 13.600 -14.432 4.276 65 HB3 LEU 8 HB1 LEU 8 13.872 -13.736 5.870 66 HG LEU 8 HG LEU 8 14.848 -15.909 6.642 67 HD11 LEU 8 HD11 LEU 8 15.565 -17.331 4.473 68 HD12 LEU 8 HD12 LEU 8 14.004 -16.720 3.914 69 HD13 LEU 8 HD13 LEU 8 14.114 -17.635 5.419 70 HD21 LEU 8 HD21 LEU 8 16.273 -15.012 4.130 71 HD22 LEU 8 HD22 LEU 8 16.966 -15.573 5.653 72 HD23 LEU 8 HD23 LEU 8 16.197 -13.992 5.571 73 H TRP 9 HN TRP 9 12.487 -17.603 6.687 74 HA TRP 9 HA TRP 9 12.571 -16.787 9.531 75 HB2 TRP 9 HB2 TRP 9 12.273 -19.590 8.495 76 HB3 TRP 9 HB1 TRP 9 11.869 -18.961 10.084 77 HD1 TRP 9 HD1 TRP 9 10.204 -16.392 9.125 78 HE1 TRP 9 HE1 TRP 9 7.887 -16.753 8.104 79 HE3 TRP 9 HE3 TRP 9 10.679 -21.236 7.686 80 HZ2 TRP 9 HZ2 TRP 9 6.405 -18.881 6.802 81 HZ3 TRP 9 HZ3 TRP 9 8.892 -22.402 6.572 82 HH2 TRP 9 HH2 TRP 9 6.693 -21.235 6.108 83 H VAL 10 HN VAL 10 14.335 -17.302 10.739 84 HA VAL 10 HA VAL 10 16.486 -18.786 9.336 85 HB VAL 10 HB VAL 10 17.115 -16.832 11.528 86 HG11 VAL 10 HG11 VAL 10 18.625 -17.834 9.097 87 HG12 VAL 10 HG12 VAL 10 18.880 -18.360 10.763 88 HG13 VAL 10 HG13 VAL 10 19.230 -16.699 10.295 89 HG21 VAL 10 HG21 VAL 10 17.483 -15.136 9.772 90 HG22 VAL 10 HG22 VAL 10 15.774 -15.530 9.927 91 HG23 VAL 10 HG23 VAL 10 16.714 -16.180 8.580 92 H SER 11 HN SER 11 17.025 -20.626 10.221 93 HA SER 11 HA SER 11 16.079 -21.297 12.898 94 HB2 SER 11 HB2 SER 11 17.780 -23.062 11.137 95 HB3 SER 11 HB1 SER 11 16.631 -23.507 12.384 96 HG SER 11 HG SER 11 14.961 -23.012 11.044 97 H VAL 12 HN VAL 12 17.320 -20.930 14.586 98 HA VAL 12 HA VAL 12 20.151 -20.295 14.119 99 HB VAL 12 HB VAL 12 18.089 -19.311 16.080 100 HG11 VAL 12 HG11 VAL 12 20.068 -19.555 17.421 101 HG12 VAL 12 HG12 VAL 12 19.970 -17.858 16.961 102 HG13 VAL 12 HG13 VAL 12 21.088 -18.936 16.119 103 HG21 VAL 12 HG21 VAL 12 19.896 -17.632 14.357 104 HG22 VAL 12 HG22 VAL 12 18.312 -17.237 15.000 105 HG23 VAL 12 HG23 VAL 12 18.454 -18.370 13.658 106 H GLU 13 HN GLU 13 21.612 -21.570 15.021 107 HA GLU 13 HA GLU 13 20.786 -23.376 17.211 108 HB2 GLU 13 HB2 GLU 13 23.119 -23.714 15.316 109 HB3 GLU 13 HB1 GLU 13 22.499 -24.881 16.483 110 HG2 GLU 13 HG2 GLU 13 20.377 -23.964 14.670 111 HG3 GLU 13 HG1 GLU 13 21.723 -24.665 13.805 112 H ASP 14 HN ASP 14 21.428 -22.629 19.090 113 HA ASP 14 HA ASP 14 23.596 -20.726 19.324 114 HB2 ASP 14 HB2 ASP 14 21.504 -20.571 20.686 115 HB3 ASP 14 HB1 ASP 14 22.010 -22.025 21.539 116 H ALA 15 HN ALA 15 25.221 -20.972 20.992 117 HA ALA 15 HA ALA 15 26.923 -23.223 20.599 118 HB1 ALA 15 HB1 ALA 15 27.532 -22.133 23.145 119 HB2 ALA 15 HB2 ALA 15 26.972 -20.805 22.151 120 HB3 ALA 15 HB3 ALA 15 28.324 -21.814 21.605 121 H GLN 16 HN GLN 16 24.302 -22.568 22.722 122 HA GLN 16 HA GLN 16 24.771 -24.718 24.579 123 HB2 GLN 16 HB2 GLN 16 22.175 -23.248 23.960 124 HB3 GLN 16 HB1 GLN 16 22.520 -24.229 25.374 125 HG2 GLN 16 HG2 GLN 16 24.034 -21.691 24.656 126 HG3 GLN 16 HG1 GLN 16 22.759 -21.804 25.848 127 HE21 GLN 16 HE21 GLN 16 26.061 -21.823 25.586 128 HE22 GLN 16 HE22 GLN 16 26.447 -22.680 26.994 129 H MET 17 HN MET 17 24.108 -24.702 21.360 130 HA MET 17 HA MET 17 23.289 -26.119 19.850 131 HB2 MET 17 HB2 MET 17 23.380 -28.107 22.135 132 HB3 MET 17 HB1 MET 17 22.945 -28.512 20.472 133 HG2 MET 17 HG2 MET 17 25.106 -27.666 19.650 134 HG3 MET 17 HG1 MET 17 25.564 -27.233 21.289 135 HE1 MET 17 HE1 MET 17 25.217 -31.239 19.257 136 HE2 MET 17 HE2 MET 17 24.433 -29.727 18.852 137 HE3 MET 17 HE3 MET 17 23.709 -30.779 20.053 138 H HIS 18 HN HIS 18 21.650 -24.478 21.581 139 HA HIS 18 HA HIS 18 19.069 -25.835 21.511 140 HB2 HIS 18 HB2 HIS 18 19.516 -24.348 23.416 141 HB3 HIS 18 HB1 HIS 18 19.787 -23.001 22.306 142 HD1 HIS 18 HD1 HIS 18 17.775 -21.530 22.193 143 HD2 HIS 18 HD2 HIS 18 16.717 -25.549 22.656 144 HE1 HIS 18 HE1 HIS 18 15.253 -21.620 22.171 145 HE2 HIS 18 HE2 HIS 18 14.586 -24.047 22.465 146 H THR 19 HN THR 19 17.724 -25.630 19.813 147 HA THR 19 HA THR 19 18.607 -23.972 17.588 148 HB THR 19 HB THR 19 16.289 -25.892 17.553 149 HG1 THR 19 HG1 THR 19 19.011 -26.488 16.979 150 HG21 THR 19 HG21 THR 19 16.415 -24.625 15.557 151 HG22 THR 19 HG22 THR 19 17.233 -26.125 15.149 152 HG23 THR 19 HG23 THR 19 18.169 -24.691 15.520 153 H VAL 20 HN VAL 20 17.636 -22.104 17.143 154 HA VAL 20 HA VAL 20 14.927 -21.603 18.231 155 HB VAL 20 HB VAL 20 16.975 -19.432 17.837 156 HG11 VAL 20 HG11 VAL 20 14.678 -18.668 18.109 157 HG12 VAL 20 HG12 VAL 20 15.562 -18.348 19.590 158 HG13 VAL 20 HG13 VAL 20 14.472 -19.715 19.513 159 HG21 VAL 20 HG21 VAL 20 16.720 -21.399 20.090 160 HG22 VAL 20 HG22 VAL 20 17.094 -19.729 20.484 161 HG23 VAL 20 HG23 VAL 20 18.169 -20.643 19.434 162 H THR 21 HN THR 21 13.707 -20.058 16.982 163 HA THR 21 HA THR 21 14.580 -19.863 14.173 164 HB THR 21 HB THR 21 11.740 -20.283 15.128 165 HG1 THR 21 HG1 THR 21 13.006 -22.101 15.458 166 HG21 THR 21 HG21 THR 21 12.988 -20.377 12.356 167 HG22 THR 21 HG22 THR 21 11.972 -19.078 12.981 168 HG23 THR 21 HG23 THR 21 11.296 -20.671 12.741 169 H ILE 22 HN ILE 22 14.479 -17.874 13.338 170 HA ILE 22 HA ILE 22 12.871 -15.874 14.793 171 HB ILE 22 HB ILE 22 14.542 -14.166 14.277 172 HG12 ILE 22 HG12 ILE 22 16.240 -16.452 13.242 173 HG13 ILE 22 HG11 ILE 22 15.393 -15.279 12.209 174 HG21 ILE 22 HG21 ILE 22 15.964 -16.522 15.551 175 HG22 ILE 22 HG22 ILE 22 14.736 -15.575 16.399 176 HG23 ILE 22 HG23 ILE 22 16.228 -14.811 15.856 177 HD11 ILE 22 HD11 ILE 22 17.444 -14.534 14.316 178 HD12 ILE 22 HD12 ILE 22 16.669 -13.443 13.174 179 HD13 ILE 22 HD13 ILE 22 17.798 -14.674 12.599 180 H TRP 23 HN TRP 23 11.902 -14.342 13.538 181 HA TRP 23 HA TRP 23 11.482 -15.211 10.748 182 HB2 TRP 23 HB2 TRP 23 9.572 -13.470 12.329 183 HB3 TRP 23 HB1 TRP 23 9.255 -14.509 10.956 184 HD1 TRP 23 HD1 TRP 23 10.198 -14.797 14.692 185 HE1 TRP 23 HE1 TRP 23 9.354 -17.053 15.587 186 HE3 TRP 23 HE3 TRP 23 8.384 -16.810 10.389 187 HZ2 TRP 23 HZ2 TRP 23 8.063 -19.424 14.594 188 HZ3 TRP 23 HZ3 TRP 23 7.357 -19.060 10.375 189 HH2 TRP 23 HH2 TRP 23 7.190 -20.364 12.486 190 H LEU 24 HN LEU 24 12.320 -13.879 9.239 191 HA LEU 24 HA LEU 24 12.715 -11.038 9.943 192 HB2 LEU 24 HB2 LEU 24 14.338 -12.749 8.042 193 HB3 LEU 24 HB1 LEU 24 14.643 -11.070 8.442 194 HG LEU 24 HG LEU 24 14.692 -13.332 10.483 195 HD11 LEU 24 HD11 LEU 24 17.064 -11.787 9.441 196 HD12 LEU 24 HD12 LEU 24 16.551 -13.322 8.725 197 HD13 LEU 24 HD13 LEU 24 17.042 -13.243 10.420 198 HD21 LEU 24 HD21 LEU 24 16.147 -11.218 11.462 199 HD22 LEU 24 HD22 LEU 24 14.479 -11.580 11.918 200 HD23 LEU 24 HD23 LEU 24 14.814 -10.373 10.667 201 H THR 25 HN THR 25 11.845 -9.574 8.565 202 HA THR 25 HA THR 25 10.652 -10.633 6.087 203 HB THR 25 HB THR 25 9.693 -8.186 7.577 204 HG1 THR 25 HG1 THR 25 9.511 -9.970 8.890 205 HG21 THR 25 HG21 THR 25 8.911 -8.233 5.316 206 HG22 THR 25 HG22 THR 25 7.575 -8.809 6.296 207 HG23 THR 25 HG23 THR 25 8.563 -9.955 5.400 208 H VAL 26 HN VAL 26 11.647 -9.961 4.328 209 HA VAL 26 HA VAL 26 12.725 -7.263 4.072 210 HB VAL 26 HB VAL 26 14.993 -8.205 3.445 211 HG11 VAL 26 HG11 VAL 26 14.351 -7.195 5.736 212 HG12 VAL 26 HG12 VAL 26 15.793 -8.191 5.664 213 HG13 VAL 26 HG13 VAL 26 14.302 -8.859 6.311 214 HG21 VAL 26 HG21 VAL 26 13.689 -10.695 4.597 215 HG22 VAL 26 HG22 VAL 26 15.426 -10.477 4.565 216 HG23 VAL 26 HG23 VAL 26 14.513 -10.504 3.048 217 H ARG 27 HN ARG 27 14.217 -7.567 1.833 218 HA ARG 27 HA ARG 27 12.355 -8.754 -0.114 219 HB2 ARG 27 HB2 ARG 27 13.688 -7.217 -1.721 220 HB3 ARG 27 HB1 ARG 27 12.449 -6.496 -0.705 221 HG2 ARG 27 HG2 ARG 27 15.186 -6.646 0.508 222 HG3 ARG 27 HG1 ARG 27 15.017 -5.574 -0.859 223 HD2 ARG 27 HD2 ARG 27 13.956 -4.045 0.319 224 HD3 ARG 27 HD1 ARG 27 12.735 -5.184 0.861 225 HE ARG 27 HE ARG 27 15.369 -4.895 2.222 226 HH11 ARG 27 HH21 ARG 27 11.850 -5.018 2.315 227 HH12 ARG 27 HH22 ARG 27 11.767 -4.884 3.995 228 HH21 ARG 27 HH11 ARG 27 15.224 -4.735 4.522 229 HH22 ARG 27 HH12 ARG 27 13.708 -4.723 5.272 230 HA PRO 28 HA PRO 28 15.546 -11.736 -1.272 231 HB2 PRO 28 HB2 PRO 28 14.732 -11.073 -4.061 232 HB3 PRO 28 HB1 PRO 28 14.825 -12.642 -3.239 233 HG2 PRO 28 HG2 PRO 28 12.519 -11.536 -3.746 234 HG3 PRO 28 HG1 PRO 28 12.791 -12.406 -2.225 235 HD2 PRO 28 HD2 PRO 28 12.619 -9.447 -2.687 236 HD3 PRO 28 HD1 PRO 28 12.100 -10.409 -1.285 237 H ASP 29 HN ASP 29 15.148 -8.623 -2.657 238 HA ASP 29 HA ASP 29 17.568 -8.332 -4.114 239 HB2 ASP 29 HB2 ASP 29 15.747 -6.835 -4.557 240 HB3 ASP 29 HB1 ASP 29 15.749 -6.274 -2.888 241 H MET 30 HN MET 30 16.700 -7.869 -0.793 242 HA MET 30 HA MET 30 18.887 -6.297 0.013 243 HB2 MET 30 HB2 MET 30 16.889 -7.944 1.394 244 HB3 MET 30 HB1 MET 30 18.417 -7.803 2.233 245 HG2 MET 30 HG2 MET 30 18.324 -5.362 2.035 246 HG3 MET 30 HG1 MET 30 16.782 -5.467 1.191 247 HE1 MET 30 HE1 MET 30 17.808 -7.636 4.779 248 HE2 MET 30 HE2 MET 30 18.073 -5.996 5.377 249 HE3 MET 30 HE3 MET 30 18.879 -6.524 3.906 250 H THR 31 HN THR 31 20.540 -6.899 1.448 251 HA THR 31 HA THR 31 22.108 -9.078 0.318 252 HB THR 31 HB THR 31 22.850 -6.755 2.090 253 HG1 THR 31 HG1 THR 31 23.611 -6.846 -0.558 254 HG21 THR 31 HG21 THR 31 25.132 -7.338 1.021 255 HG22 THR 31 HG22 THR 31 24.354 -8.899 0.655 256 HG23 THR 31 HG23 THR 31 24.479 -8.337 2.320 257 H VAL 32 HN VAL 32 22.964 -10.683 1.660 258 HA VAL 32 HA VAL 32 21.545 -11.381 4.017 259 HB VAL 32 HB VAL 32 24.270 -12.287 3.011 260 HG11 VAL 32 HG11 VAL 32 24.012 -14.178 4.550 261 HG12 VAL 32 HG12 VAL 32 22.507 -13.506 5.166 262 HG13 VAL 32 HG13 VAL 32 24.027 -12.667 5.450 263 HG21 VAL 32 HG21 VAL 32 23.107 -14.180 2.125 264 HG22 VAL 32 HG22 VAL 32 22.227 -12.758 1.577 265 HG23 VAL 32 HG23 VAL 32 21.599 -13.723 2.914 266 H ALA 33 HN ALA 33 24.640 -9.811 3.491 267 HA ALA 33 HA ALA 33 25.411 -9.419 6.178 268 HB1 ALA 33 HB1 ALA 33 26.826 -7.703 5.426 269 HB2 ALA 33 HB2 ALA 33 25.833 -7.348 4.020 270 HB3 ALA 33 HB3 ALA 33 26.771 -8.841 4.091 271 H SER 34 HN SER 34 23.363 -7.346 4.164 272 HA SER 34 HA SER 34 22.827 -5.452 6.189 273 HB2 SER 34 HB2 SER 34 20.908 -6.385 4.034 274 HB3 SER 34 HB1 SER 34 20.868 -4.859 4.900 275 HG SER 34 HG SER 34 21.945 -4.324 3.131 276 H LEU 35 HN LEU 35 21.279 -8.491 5.285 277 HA LEU 35 HA LEU 35 19.252 -8.441 7.245 278 HB2 LEU 35 HB2 LEU 35 19.131 -9.883 5.272 279 HB3 LEU 35 HB1 LEU 35 20.533 -10.787 5.820 280 HG LEU 35 HG LEU 35 19.345 -11.536 7.800 281 HD11 LEU 35 HD11 LEU 35 17.315 -9.554 6.807 282 HD12 LEU 35 HD12 LEU 35 17.808 -9.941 8.457 283 HD13 LEU 35 HD13 LEU 35 16.721 -11.021 7.583 284 HD21 LEU 35 HD21 LEU 35 17.558 -12.873 6.671 285 HD22 LEU 35 HD22 LEU 35 19.105 -12.938 5.843 286 HD23 LEU 35 HD23 LEU 35 17.801 -11.913 5.213 287 H LYS 36 HN LYS 36 22.446 -9.928 7.174 288 HA LYS 36 HA LYS 36 22.480 -11.099 9.750 289 HB2 LYS 36 HB2 LYS 36 24.179 -11.681 8.171 290 HB3 LYS 36 HB1 LYS 36 24.636 -9.985 7.972 291 HG2 LYS 36 HG2 LYS 36 24.820 -10.852 10.778 292 HG3 LYS 36 HG1 LYS 36 25.843 -11.808 9.717 293 HD2 LYS 36 HD2 LYS 36 25.817 -8.784 9.598 294 HD3 LYS 36 HD1 LYS 36 26.864 -9.669 10.690 295 HE2 LYS 36 HE2 LYS 36 28.208 -10.477 9.016 296 HE3 LYS 36 HE1 LYS 36 26.905 -10.593 7.853 297 HZ1 LYS 36 HZ1 LYS 36 28.548 -8.262 8.557 298 HZ2 LYS 36 HZ2 LYS 36 26.990 -7.952 8.003 299 HZ3 LYS 36 HZ3 LYS 36 28.113 -8.880 7.054 300 H ASP 37 HN ASP 37 23.580 -8.001 8.514 301 HA ASP 37 HA ASP 37 24.543 -6.986 10.934 302 HB2 ASP 37 HB2 ASP 37 23.771 -5.770 8.297 303 HB3 ASP 37 HB1 ASP 37 24.106 -4.727 9.665 304 H MET 38 HN MET 38 21.358 -6.663 9.343 305 HA MET 38 HA MET 38 20.305 -5.022 11.402 306 HB2 MET 38 HB2 MET 38 18.260 -5.137 10.361 307 HB3 MET 38 HB1 MET 38 19.375 -5.356 9.009 308 HG2 MET 38 HG2 MET 38 19.038 -7.675 9.014 309 HG3 MET 38 HG1 MET 38 18.127 -7.658 10.529 310 HE1 MET 38 HE1 MET 38 15.026 -7.935 9.857 311 HE2 MET 38 HE2 MET 38 16.470 -8.927 9.904 312 HE3 MET 38 HE3 MET 38 15.500 -8.879 8.445 313 H VAL 39 HN VAL 39 20.472 -8.488 10.877 314 HA VAL 39 HA VAL 39 18.873 -9.259 13.070 315 HB VAL 39 HB VAL 39 21.204 -10.650 11.689 316 HG11 VAL 39 HG11 VAL 39 20.847 -12.574 12.933 317 HG12 VAL 39 HG12 VAL 39 19.254 -12.092 13.470 318 HG13 VAL 39 HG13 VAL 39 20.686 -11.359 14.195 319 HG21 VAL 39 HG21 VAL 39 19.637 -11.251 10.181 320 HG22 VAL 39 HG22 VAL 39 18.443 -10.274 11.018 321 HG23 VAL 39 HG23 VAL 39 18.661 -11.965 11.453 322 H PHE 40 HN PHE 40 22.250 -8.364 12.725 323 HA PHE 40 HA PHE 40 22.980 -8.805 15.441 324 HB2 PHE 40 HB2 PHE 40 24.793 -8.388 13.892 325 HB3 PHE 40 HB1 PHE 40 24.092 -6.852 13.413 326 HD1 PHE 40 HD2 PHE 40 25.100 -8.581 16.609 327 HD2 PHE 40 HD1 PHE 40 24.972 -4.927 14.362 328 HE1 PHE 40 HE2 PHE 40 26.265 -7.421 18.442 329 HE2 PHE 40 HE1 PHE 40 26.124 -3.763 16.191 330 HZ PHE 40 HZ PHE 40 26.772 -5.010 18.257 331 H LEU 41 HN LEU 41 21.662 -5.977 13.733 332 HA LEU 41 HA LEU 41 21.537 -4.250 15.994 333 HB2 LEU 41 HB2 LEU 41 19.466 -4.346 13.778 334 HB3 LEU 41 HB1 LEU 41 19.888 -2.985 14.799 335 HG LEU 41 HG LEU 41 21.638 -4.289 12.730 336 HD11 LEU 41 HD11 LEU 41 21.425 -2.215 11.484 337 HD12 LEU 41 HD12 LEU 41 20.430 -1.524 12.760 338 HD13 LEU 41 HD13 LEU 41 19.825 -2.882 11.811 339 HD21 LEU 41 HD21 LEU 41 23.071 -2.234 13.194 340 HD22 LEU 41 HD22 LEU 41 23.112 -3.564 14.358 341 HD23 LEU 41 HD23 LEU 41 22.178 -2.094 14.725 342 H ASP 42 HN ASP 42 19.373 -6.568 14.586 343 HA ASP 42 HA ASP 42 17.215 -6.031 16.347 344 HB2 ASP 42 HB2 ASP 42 17.302 -7.264 13.967 345 HB3 ASP 42 HB1 ASP 42 17.293 -8.682 15.001 346 H TYR 43 HN TYR 43 19.472 -8.787 16.261 347 HA TYR 43 HA TYR 43 18.492 -9.531 18.970 348 HB2 TYR 43 HB2 TYR 43 19.860 -11.312 16.948 349 HB3 TYR 43 HB1 TYR 43 19.183 -11.782 18.496 350 HD1 TYR 43 HD2 TYR 43 16.714 -11.519 18.946 351 HD2 TYR 43 HD1 TYR 43 18.429 -11.014 15.048 352 HE1 TYR 43 HE2 TYR 43 14.479 -11.751 17.934 353 HE2 TYR 43 HE1 TYR 43 16.207 -11.250 14.019 354 HH TYR 43 HH TYR 43 13.733 -10.751 15.016 355 H GLY 44 HN GLY 44 21.109 -7.981 17.654 356 HA2 GLY 44 HA2 GLY 44 23.149 -7.442 18.604 357 HA3 GLY 44 HA1 GLY 44 22.664 -8.344 20.028 358 H PHE 45 HN PHE 45 22.475 -9.925 16.983 359 HA PHE 45 HA PHE 45 24.473 -11.893 17.780 360 HB2 PHE 45 HB2 PHE 45 22.723 -11.686 15.292 361 HB3 PHE 45 HB1 PHE 45 23.864 -12.974 15.625 362 HD1 PHE 45 HD1 PHE 45 22.575 -11.979 18.771 363 HD2 PHE 45 HD2 PHE 45 21.474 -14.187 15.218 364 HE1 PHE 45 HE1 PHE 45 20.885 -13.207 20.046 365 HE2 PHE 45 HE2 PHE 45 19.773 -15.401 16.524 366 HZ PHE 45 HZ PHE 45 19.474 -14.918 18.939 367 HA PRO 46 HA PRO 46 27.374 -9.176 15.520 368 HB2 PRO 46 HB2 PRO 46 29.677 -10.286 16.414 369 HB3 PRO 46 HB1 PRO 46 28.703 -9.186 17.392 370 HG2 PRO 46 HG2 PRO 46 28.750 -12.164 17.472 371 HG3 PRO 46 HG1 PRO 46 28.771 -11.021 18.826 372 HD2 PRO 46 HD2 PRO 46 26.481 -12.236 18.109 373 HD3 PRO 46 HD1 PRO 46 26.531 -10.549 18.683 374 HA PRO 47 HA PRO 47 28.098 -11.612 11.917 375 HB2 PRO 47 HB2 PRO 47 30.585 -10.805 11.126 376 HB3 PRO 47 HB1 PRO 47 29.118 -9.830 10.865 377 HG2 PRO 47 HG2 PRO 47 31.197 -9.597 12.996 378 HG3 PRO 47 HG1 PRO 47 30.366 -8.322 12.096 379 HD2 PRO 47 HD2 PRO 47 29.605 -8.867 14.575 380 HD3 PRO 47 HD1 PRO 47 28.385 -8.484 13.344 381 H VAL 48 HN VAL 48 30.656 -11.562 14.289 382 HA VAL 48 HA VAL 48 32.060 -13.825 13.367 383 HB VAL 48 HB VAL 48 33.072 -12.318 14.973 384 HG11 VAL 48 HG11 VAL 48 30.753 -11.946 16.147 385 HG12 VAL 48 HG12 VAL 48 32.235 -11.788 17.064 386 HG13 VAL 48 HG13 VAL 48 31.283 -13.251 17.208 387 HG21 VAL 48 HG21 VAL 48 33.755 -14.725 15.026 388 HG22 VAL 48 HG22 VAL 48 32.587 -15.008 16.318 389 HG23 VAL 48 HG23 VAL 48 33.948 -13.931 16.582 390 H LEU 49 HN LEU 49 29.474 -13.410 15.709 391 HA LEU 49 HA LEU 49 29.144 -16.243 16.201 392 HB2 LEU 49 HB2 LEU 49 27.438 -13.859 16.921 393 HB3 LEU 49 HB1 LEU 49 27.055 -15.499 17.397 394 HG LEU 49 HG LEU 49 29.731 -14.218 18.019 395 HD11 LEU 49 HD11 LEU 49 27.929 -12.987 19.222 396 HD12 LEU 49 HD12 LEU 49 28.912 -13.942 20.295 397 HD13 LEU 49 HD13 LEU 49 27.311 -14.534 19.795 398 HD21 LEU 49 HD21 LEU 49 30.120 -16.440 18.312 399 HD22 LEU 49 HD22 LEU 49 28.413 -16.827 18.622 400 HD23 LEU 49 HD23 LEU 49 29.398 -16.103 19.879 401 H GLN 50 HN GLN 50 27.592 -13.781 14.182 402 HA GLN 50 HA GLN 50 25.526 -15.545 13.313 403 HB2 GLN 50 HB2 GLN 50 26.503 -12.928 12.203 404 HB3 GLN 50 HB1 GLN 50 25.236 -13.859 11.430 405 HG2 GLN 50 HG2 GLN 50 24.085 -13.864 13.744 406 HG3 GLN 50 HG1 GLN 50 25.220 -12.561 14.134 407 HE21 GLN 50 HE21 GLN 50 24.164 -10.582 13.849 408 HE22 GLN 50 HE22 GLN 50 23.160 -10.213 12.523 409 H GLN 51 HN GLN 51 26.621 -17.392 12.749 410 HA GLN 51 HA GLN 51 27.979 -17.239 10.149 411 HB2 GLN 51 HB2 GLN 51 27.715 -19.511 12.132 412 HB3 GLN 51 HB1 GLN 51 28.489 -19.650 10.554 413 HG2 GLN 51 HG2 GLN 51 30.126 -17.935 11.125 414 HG3 GLN 51 HG1 GLN 51 29.342 -17.654 12.674 415 HE21 GLN 51 HE21 GLN 51 29.072 -19.890 13.957 416 HE22 GLN 51 HE22 GLN 51 30.487 -20.839 13.985 417 H TRP 52 HN TRP 52 26.464 -16.997 8.703 418 HA TRP 52 HA TRP 52 23.884 -18.321 8.897 419 HB2 TRP 52 HB2 TRP 52 25.138 -16.392 6.922 420 HB3 TRP 52 HB1 TRP 52 23.586 -17.166 6.634 421 HD1 TRP 52 HD1 TRP 52 25.265 -14.937 9.350 422 HE1 TRP 52 HE1 TRP 52 23.403 -13.401 10.367 423 HE3 TRP 52 HE3 TRP 52 21.175 -16.696 6.859 424 HZ2 TRP 52 HZ2 TRP 52 20.576 -12.997 10.123 425 HZ3 TRP 52 HZ3 TRP 52 18.931 -15.710 7.259 426 HH2 TRP 52 HH2 TRP 52 18.660 -13.862 8.895 427 H VAL 53 HN VAL 53 23.404 -20.204 7.896 428 HA VAL 53 HA VAL 53 25.354 -21.198 5.911 429 HB VAL 53 HB VAL 53 23.821 -22.673 8.055 430 HG11 VAL 53 HG11 VAL 53 24.983 -24.707 7.013 431 HG12 VAL 53 HG12 VAL 53 25.189 -23.709 5.569 432 HG13 VAL 53 HG13 VAL 53 23.568 -24.083 6.165 433 HG21 VAL 53 HG21 VAL 53 26.043 -21.644 8.631 434 HG22 VAL 53 HG22 VAL 53 26.773 -22.608 7.348 435 HG23 VAL 53 HG23 VAL 53 26.046 -23.403 8.736 436 H ILE 54 HN ILE 54 24.594 -21.499 3.981 437 HA ILE 54 HA ILE 54 21.739 -22.047 3.582 438 HB ILE 54 HB ILE 54 23.426 -20.037 2.063 439 HG12 ILE 54 HG12 ILE 54 20.953 -19.607 3.779 440 HG13 ILE 54 HG11 ILE 54 22.593 -19.340 4.357 441 HG21 ILE 54 HG21 ILE 54 21.268 -19.511 0.930 442 HG22 ILE 54 HG22 ILE 54 20.528 -20.871 1.754 443 HG23 ILE 54 HG23 ILE 54 21.795 -21.153 0.554 444 HD11 ILE 54 HD11 ILE 54 22.079 -18.008 1.793 445 HD12 ILE 54 HD12 ILE 54 22.766 -17.371 3.286 446 HD13 ILE 54 HD13 ILE 54 21.020 -17.464 3.097 447 H GLY 55 HN GLY 55 21.464 -23.790 2.241 448 HA2 GLY 55 HA2 GLY 55 23.663 -25.254 1.270 449 HA3 GLY 55 HA1 GLY 55 21.996 -25.493 0.738 450 H GLN 56 HN GLN 56 21.504 -22.941 -0.253 451 HA GLN 56 HA GLN 56 22.600 -23.085 -2.869 452 HB2 GLN 56 HB2 GLN 56 21.035 -20.852 -1.567 453 HB3 GLN 56 HB1 GLN 56 21.318 -21.058 -3.285 454 HG2 GLN 56 HG2 GLN 56 19.377 -22.197 -3.284 455 HG3 GLN 56 HG1 GLN 56 20.327 -23.540 -2.665 456 HE21 GLN 56 HE21 GLN 56 17.444 -22.528 -2.095 457 HE22 GLN 56 HE22 GLN 56 17.364 -22.491 -0.399 458 H ARG 57 HN ARG 57 23.490 -21.253 -0.002 459 HA ARG 57 HA ARG 57 25.667 -19.946 -1.539 460 HB2 ARG 57 HB2 ARG 57 23.851 -18.612 0.464 461 HB3 ARG 57 HB1 ARG 57 25.273 -17.876 -0.247 462 HG2 ARG 57 HG2 ARG 57 22.978 -18.931 -1.961 463 HG3 ARG 57 HG1 ARG 57 23.055 -17.289 -1.346 464 HD2 ARG 57 HD2 ARG 57 24.016 -17.199 -3.536 465 HD3 ARG 57 HD1 ARG 57 25.341 -17.065 -2.386 466 HE ARG 57 HE ARG 57 24.775 -19.772 -3.301 467 HH11 ARG 57 HH21 ARG 57 26.648 -16.787 -3.735 468 HH12 ARG 57 HH22 ARG 57 27.793 -17.546 -4.732 469 HH21 ARG 57 HH11 ARG 57 26.356 -20.728 -4.636 470 HH22 ARG 57 HH12 ARG 57 27.649 -19.807 -5.259 471 H LEU 58 HN LEU 58 27.513 -19.464 -0.560 472 HA LEU 58 HA LEU 58 28.244 -20.926 1.832 473 HB2 LEU 58 HB2 LEU 58 29.730 -18.894 0.138 474 HB3 LEU 58 HB1 LEU 58 30.424 -19.699 1.525 475 HG LEU 58 HG LEU 58 31.130 -20.900 -0.423 476 HD11 LEU 58 HD11 LEU 58 28.892 -22.648 0.565 477 HD12 LEU 58 HD12 LEU 58 30.188 -22.168 1.661 478 HD13 LEU 58 HD13 LEU 58 30.557 -23.067 0.199 479 HD21 LEU 58 HD21 LEU 58 29.768 -21.554 -2.199 480 HD22 LEU 58 HD22 LEU 58 28.985 -20.046 -1.756 481 HD23 LEU 58 HD23 LEU 58 28.311 -21.589 -1.222 482 H ALA 59 HN ALA 59 29.059 -19.848 3.723 483 HA ALA 59 HA ALA 59 27.284 -17.942 4.766 484 HB1 ALA 59 HB1 ALA 59 28.530 -19.505 6.194 485 HB2 ALA 59 HB2 ALA 59 28.783 -17.842 6.696 486 HB3 ALA 59 HB3 ALA 59 30.042 -18.683 5.790 487 H ARG 60 HN ARG 60 28.034 -16.800 2.477 488 HA ARG 60 HA ARG 60 29.917 -14.627 3.104 489 HB2 ARG 60 HB2 ARG 60 30.017 -16.022 0.931 490 HB3 ARG 60 HB1 ARG 60 28.555 -15.168 0.468 491 HG2 ARG 60 HG2 ARG 60 29.842 -13.506 -0.306 492 HG3 ARG 60 HG1 ARG 60 30.292 -13.116 1.345 493 HD2 ARG 60 HD2 ARG 60 31.701 -15.151 -0.413 494 HD3 ARG 60 HD1 ARG 60 32.324 -13.559 -0.087 495 HE ARG 60 HE ARG 60 32.409 -15.828 1.668 496 HH11 ARG 60 HH21 ARG 60 32.256 -12.335 1.503 497 HH12 ARG 60 HH22 ARG 60 33.020 -12.091 3.010 498 HH21 ARG 60 HH11 ARG 60 33.441 -15.497 3.709 499 HH22 ARG 60 HH12 ARG 60 33.683 -13.910 4.284 500 H ASP 61 HN ASP 61 28.869 -13.027 4.158 501 HA ASP 61 HA ASP 61 26.078 -12.720 4.097 502 HB2 ASP 61 HB2 ASP 61 26.410 -10.766 5.464 503 HB3 ASP 61 HB1 ASP 61 27.383 -12.090 6.061 504 H GLN 62 HN GLN 62 28.547 -11.387 2.145 505 HA GLN 62 HA GLN 62 27.148 -9.056 1.337 506 HB2 GLN 62 HB2 GLN 62 29.372 -10.547 -0.065 507 HB3 GLN 62 HB1 GLN 62 28.753 -8.976 -0.567 508 HG2 GLN 62 HG2 GLN 62 29.299 -8.044 1.676 509 HG3 GLN 62 HG1 GLN 62 29.980 -9.597 2.142 510 HE21 GLN 62 HE21 GLN 62 32.233 -9.363 2.113 511 HE22 GLN 62 HE22 GLN 62 33.105 -8.620 0.866 512 H GLU 63 HN GLU 63 26.483 -12.253 0.715 513 HA GLU 63 HA GLU 63 25.536 -12.229 -1.937 514 HB2 GLU 63 HB2 GLU 63 24.850 -13.852 0.489 515 HB3 GLU 63 HB1 GLU 63 24.012 -14.109 -1.036 516 HG2 GLU 63 HG2 GLU 63 27.030 -14.219 -0.711 517 HG3 GLU 63 HG1 GLU 63 25.959 -15.623 -0.633 518 H THR 64 HN THR 64 23.461 -11.923 -2.765 519 HA THR 64 HA THR 64 21.676 -10.082 -1.430 520 HB THR 64 HB THR 64 20.436 -11.501 -3.637 521 HG1 THR 64 HG1 THR 64 22.449 -12.053 -4.282 522 HG21 THR 64 HG21 THR 64 20.758 -9.113 -4.652 523 HG22 THR 64 HG22 THR 64 21.350 -8.688 -3.049 524 HG23 THR 64 HG23 THR 64 19.728 -9.327 -3.247 525 H LEU 65 HN LEU 65 19.523 -10.682 -0.684 526 HA LEU 65 HA LEU 65 19.410 -13.176 0.688 527 HB2 LEU 65 HB2 LEU 65 17.178 -11.255 -0.032 528 HB3 LEU 65 HB1 LEU 65 17.012 -12.605 1.095 529 HG LEU 65 HG LEU 65 18.817 -10.189 1.375 530 HD11 LEU 65 HD11 LEU 65 16.377 -9.985 1.946 531 HD12 LEU 65 HD12 LEU 65 17.493 -9.620 3.263 532 HD13 LEU 65 HD13 LEU 65 16.673 -11.181 3.203 533 HD21 LEU 65 HD21 LEU 65 20.155 -11.843 2.306 534 HD22 LEU 65 HD22 LEU 65 18.784 -12.817 2.876 535 HD23 LEU 65 HD23 LEU 65 19.220 -11.319 3.694 536 H HIS 66 HN HIS 66 18.065 -12.075 -2.333 537 HA HIS 66 HA HIS 66 16.620 -14.365 -3.081 538 HB2 HIS 66 HB2 HIS 66 16.657 -12.202 -4.377 539 HB3 HIS 66 HB1 HIS 66 18.271 -12.611 -4.922 540 HD1 HIS 66 HD1 HIS 66 17.684 -15.752 -5.334 541 HD2 HIS 66 HD2 HIS 66 15.385 -12.604 -6.887 542 HE1 HIS 66 HE1 HIS 66 16.517 -16.629 -7.396 543 HE2 HIS 66 HE2 HIS 66 15.126 -14.699 -8.347 544 H SER 67 HN SER 67 20.074 -13.670 -3.115 545 HA SER 67 HA SER 67 20.941 -15.745 -4.768 546 HB2 SER 67 HB2 SER 67 22.592 -14.985 -2.384 547 HB3 SER 67 HB1 SER 67 23.049 -15.239 -4.061 548 HG SER 67 HG SER 67 22.058 -13.103 -2.731 549 H HIS 68 HN HIS 68 19.810 -15.780 -1.481 550 HA HIS 68 HA HIS 68 20.729 -18.426 -0.807 551 HB2 HIS 68 HB2 HIS 68 20.122 -17.037 1.077 552 HB3 HIS 68 HB1 HIS 68 18.605 -16.589 0.349 553 HD1 HIS 68 HD1 HIS 68 18.972 -20.200 -0.090 554 HD2 HIS 68 HD2 HIS 68 17.697 -17.712 3.029 555 HE1 HIS 68 HE1 HIS 68 17.709 -21.653 1.542 556 HE2 HIS 68 HE2 HIS 68 16.898 -20.176 3.418 557 H GLY 69 HN GLY 69 18.082 -17.013 -2.525 558 HA2 GLY 69 HA2 GLY 69 17.049 -18.403 -4.243 559 HA3 GLY 69 HA1 GLY 69 16.957 -19.697 -3.056 560 H VAL 70 HN VAL 70 16.498 -16.973 -1.335 561 HA VAL 70 HA VAL 70 13.696 -17.417 -0.970 562 HB VAL 70 HB VAL 70 15.209 -15.013 0.013 563 HG11 VAL 70 HG11 VAL 70 13.569 -16.279 1.976 564 HG12 VAL 70 HG12 VAL 70 12.621 -16.110 0.495 565 HG13 VAL 70 HG13 VAL 70 13.397 -14.705 1.226 566 HG21 VAL 70 HG21 VAL 70 15.853 -17.834 0.579 567 HG22 VAL 70 HG22 VAL 70 15.422 -16.929 2.028 568 HG23 VAL 70 HG23 VAL 70 16.717 -16.345 0.979 569 H ARG 71 HN ARG 71 12.548 -16.886 -2.801 570 HA ARG 71 HA ARG 71 12.944 -14.187 -3.966 571 HB2 ARG 71 HB2 ARG 71 11.392 -16.558 -5.057 572 HB3 ARG 71 HB1 ARG 71 11.774 -15.029 -5.870 573 HG2 ARG 71 HG2 ARG 71 14.163 -15.510 -5.733 574 HG3 ARG 71 HG1 ARG 71 13.839 -17.045 -4.931 575 HD2 ARG 71 HD2 ARG 71 12.905 -16.284 -7.730 576 HD3 ARG 71 HD1 ARG 71 14.223 -17.370 -7.370 577 HE ARG 71 HE ARG 71 11.416 -17.974 -7.291 578 HH11 ARG 71 HH21 ARG 71 14.506 -18.754 -5.883 579 HH12 ARG 71 HH22 ARG 71 14.078 -20.368 -5.488 580 HH21 ARG 71 HH11 ARG 71 10.843 -20.135 -6.758 581 HH22 ARG 71 HH12 ARG 71 11.978 -21.158 -6.000 582 H GLN 72 HN GLN 72 10.980 -16.153 -2.017 583 HA GLN 72 HA GLN 72 8.757 -14.225 -2.019 584 HB2 GLN 72 HB2 GLN 72 7.186 -16.151 -1.987 585 HB3 GLN 72 HB1 GLN 72 8.137 -16.091 -3.470 586 HG2 GLN 72 HG2 GLN 72 9.006 -17.774 -1.107 587 HG3 GLN 72 HG1 GLN 72 7.928 -18.384 -2.345 588 HE21 GLN 72 HE21 GLN 72 8.791 -18.590 -4.564 589 HE22 GLN 72 HE22 GLN 72 10.463 -18.623 -4.826 590 H ASN 73 HN ASN 73 7.263 -14.803 -0.146 591 HA ASN 73 HA ASN 73 8.834 -14.892 2.292 592 HB2 ASN 73 HB2 ASN 73 6.919 -14.145 3.400 593 HB3 ASN 73 HB1 ASN 73 6.547 -13.546 1.769 594 HD21 ASN 73 HD21 ASN 73 5.395 -15.517 0.484 595 HD22 ASN 73 HD22 ASN 73 4.143 -16.262 1.354 596 H GLY 74 HN GLY 74 8.392 -16.367 4.041 597 HA2 GLY 74 HA2 GLY 74 7.604 -18.315 4.957 598 HA3 GLY 74 HA1 GLY 74 6.995 -18.843 3.403 599 H ASP 75 HN ASP 75 10.170 -17.674 3.117 600 HA ASP 75 HA ASP 75 11.141 -20.416 2.947 601 HB2 ASP 75 HB2 ASP 75 11.697 -18.349 1.290 602 HB3 ASP 75 HB1 ASP 75 13.015 -18.179 2.442 603 H SER 76 HN SER 76 13.532 -20.632 3.746 604 HA SER 76 HA SER 76 13.695 -19.373 6.347 605 HB2 SER 76 HB2 SER 76 14.252 -21.701 7.350 606 HB3 SER 76 HB1 SER 76 12.598 -21.243 7.024 607 HG SER 76 HG SER 76 12.883 -23.231 6.162 608 H ALA 77 HN ALA 77 15.794 -19.588 7.398 609 HA ALA 77 HA ALA 77 18.078 -20.392 5.685 610 HB1 ALA 77 HB1 ALA 77 19.276 -18.314 6.606 611 HB2 ALA 77 HB2 ALA 77 17.668 -17.733 7.050 612 HB3 ALA 77 HB3 ALA 77 18.060 -18.042 5.356 613 H TYR 78 HN TYR 78 20.157 -20.528 7.007 614 HA TYR 78 HA TYR 78 19.473 -21.646 9.668 615 HB2 TYR 78 HB2 TYR 78 20.365 -22.992 7.487 616 HB3 TYR 78 HB1 TYR 78 21.889 -22.572 8.239 617 HD1 TYR 78 HD2 TYR 78 18.582 -24.157 8.881 618 HD2 TYR 78 HD1 TYR 78 22.662 -23.761 10.191 619 HE1 TYR 78 HE2 TYR 78 18.239 -26.001 10.477 620 HE2 TYR 78 HE1 TYR 78 22.317 -25.624 11.789 621 HH TYR 78 HH TYR 78 20.507 -26.805 12.962 622 H LEU 79 HN LEU 79 20.383 -20.693 11.352 623 HA LEU 79 HA LEU 79 22.952 -19.300 11.006 624 HB2 LEU 79 HB2 LEU 79 20.580 -18.589 12.594 625 HB3 LEU 79 HB1 LEU 79 22.123 -18.348 13.402 626 HG LEU 79 HG LEU 79 21.479 -17.273 10.619 627 HD11 LEU 79 HD11 LEU 79 21.405 -15.070 11.834 628 HD12 LEU 79 HD12 LEU 79 21.385 -15.967 13.354 629 HD13 LEU 79 HD13 LEU 79 20.050 -16.139 12.206 630 HD21 LEU 79 HD21 LEU 79 23.772 -17.145 10.648 631 HD22 LEU 79 HD22 LEU 79 23.879 -17.378 12.377 632 HD23 LEU 79 HD23 LEU 79 23.514 -15.788 11.727 633 H TYR 80 HN TYR 80 24.607 -20.003 12.024 634 HA TYR 80 HA TYR 80 24.253 -21.983 14.196 635 HB2 TYR 80 HB2 TYR 80 25.448 -22.728 12.081 636 HB3 TYR 80 HB1 TYR 80 26.699 -21.547 12.461 637 HD1 TYR 80 HD2 TYR 80 27.977 -21.735 14.561 638 HD2 TYR 80 HD1 TYR 80 25.261 -24.800 13.297 639 HE1 TYR 80 HE2 TYR 80 29.033 -23.343 16.160 640 HE2 TYR 80 HE1 TYR 80 26.280 -26.384 14.855 641 HH TYR 80 HH TYR 80 27.836 -26.694 16.400 642 H LEU 81 HN LEU 81 24.472 -20.884 16.098 643 HA LEU 81 HA LEU 81 26.341 -18.604 16.147 644 HB2 LEU 81 HB2 LEU 81 24.009 -19.204 17.945 645 HB3 LEU 81 HB1 LEU 81 25.028 -17.775 18.057 646 HG LEU 81 HG LEU 81 23.333 -18.586 15.701 647 HD11 LEU 81 HD11 LEU 81 22.103 -17.683 17.735 648 HD12 LEU 81 HD12 LEU 81 21.895 -16.699 16.287 649 HD13 LEU 81 HD13 LEU 81 23.008 -16.183 17.542 650 HD21 LEU 81 HD21 LEU 81 25.060 -17.372 14.715 651 HD22 LEU 81 HD22 LEU 81 25.262 -16.298 16.120 652 HD23 LEU 81 HD23 LEU 81 23.883 -16.113 15.044 653 H LEU 82 HN LEU 82 27.862 -18.462 17.589 654 HA LEU 82 HA LEU 82 28.484 -20.837 19.229 655 HB2 LEU 82 HB2 LEU 82 30.131 -18.513 18.252 656 HB3 LEU 82 HB1 LEU 82 30.680 -19.476 19.615 657 HG LEU 82 HG LEU 82 31.565 -20.223 17.384 658 HD11 LEU 82 HD11 LEU 82 31.126 -21.703 19.506 659 HD12 LEU 82 HD12 LEU 82 31.544 -22.465 17.972 660 HD13 LEU 82 HD13 LEU 82 29.868 -22.439 18.505 661 HD21 LEU 82 HD21 LEU 82 28.768 -21.294 16.919 662 HD22 LEU 82 HD22 LEU 82 30.136 -21.313 15.819 663 HD23 LEU 82 HD23 LEU 82 29.336 -19.784 16.190 664 H SER 83 HN SER 83 29.481 -20.307 21.451 665 HA SER 83 HA SER 83 27.613 -19.158 23.114 666 HB2 SER 83 HB2 SER 83 30.196 -18.657 24.203 667 HB3 SER 83 HB1 SER 83 29.063 -19.918 24.625 668 HG SER 83 HG SER 83 30.294 -21.284 23.595 669 H ALA 84 HN ALA 84 26.797 -17.216 22.956 670 HA ALA 84 HA ALA 84 27.962 -15.269 21.449 671 HB1 ALA 84 HB1 ALA 84 26.248 -13.738 22.880 672 HB2 ALA 84 HB2 ALA 84 25.596 -15.357 23.197 673 HB3 ALA 84 HB3 ALA 84 25.808 -14.780 21.532 674 H ARG 85 HN ARG 85 28.941 -13.303 21.898 675 HA ARG 85 HA ARG 85 30.740 -13.380 24.076 676 HB2 ARG 85 HB2 ARG 85 30.396 -11.794 21.669 677 HB3 ARG 85 HB1 ARG 85 30.690 -10.752 23.041 678 HG2 ARG 85 HG2 ARG 85 32.852 -11.201 22.615 679 HG3 ARG 85 HG1 ARG 85 32.593 -12.648 23.565 680 HD2 ARG 85 HD2 ARG 85 32.295 -12.464 20.538 681 HD3 ARG 85 HD1 ARG 85 33.700 -13.071 21.384 682 HE ARG 85 HE ARG 85 31.449 -14.519 22.300 683 HH11 ARG 85 HH21 ARG 85 33.418 -14.073 19.447 684 HH12 ARG 85 HH22 ARG 85 33.150 -15.626 18.829 685 HH21 ARG 85 HH11 ARG 85 31.048 -16.653 21.457 686 HH22 ARG 85 HH12 ARG 85 31.801 -17.095 19.979 687 H ASN 86 HN ASN 86 28.690 -13.713 25.426 688 HA ASN 86 HA ASN 86 27.146 -11.491 26.294 689 HB2 ASN 86 HB2 ASN 86 26.561 -12.892 28.199 690 HB3 ASN 86 HB1 ASN 86 26.417 -13.799 26.706 691 HD21 ASN 86 HD21 ASN 86 26.699 -15.402 28.869 692 HD22 ASN 86 HD22 ASN 86 28.270 -16.018 29.017 693 H THR 87 HN THR 87 30.305 -11.640 26.335 694 HA THR 87 HA THR 87 31.155 -11.107 28.964 695 HB THR 87 HB THR 87 33.100 -10.145 27.668 696 HG1 THR 87 HG1 THR 87 31.258 -9.981 25.774 697 HG21 THR 87 HG21 THR 87 32.147 -12.839 26.701 698 HG22 THR 87 HG22 THR 87 32.840 -12.578 28.300 699 HG23 THR 87 HG23 THR 87 33.811 -12.292 26.850 700 H SER 88 HN SER 88 31.991 -8.882 29.601 701 HA SER 88 HA SER 88 29.959 -6.928 29.292 702 HB2 SER 88 HB2 SER 88 32.432 -5.762 30.213 703 HB3 SER 88 HB1 SER 88 30.955 -6.091 31.084 704 HG SER 88 HG SER 88 32.297 -7.435 32.078 705 H LEU 89 HN LEU 89 29.793 -6.719 27.025 706 HA LEU 89 HA LEU 89 32.014 -5.948 25.401 707 HB2 LEU 89 HB2 LEU 89 29.045 -5.774 24.849 708 HB3 LEU 89 HB1 LEU 89 30.302 -5.521 23.650 709 HG LEU 89 HG LEU 89 29.879 -8.107 25.214 710 HD11 LEU 89 HD11 LEU 89 28.693 -8.937 23.486 711 HD12 LEU 89 HD12 LEU 89 29.548 -8.006 22.266 712 HD13 LEU 89 HD13 LEU 89 28.271 -7.254 23.231 713 HD21 LEU 89 HD21 LEU 89 31.872 -7.253 23.078 714 HD22 LEU 89 HD22 LEU 89 31.490 -8.939 23.398 715 HD23 LEU 89 HD23 LEU 89 32.210 -7.957 24.660 716 H ASN 90 HN ASN 90 32.652 -4.264 26.923 717 HA ASN 90 HA ASN 90 31.737 -1.703 25.889 718 HB2 ASN 90 HB2 ASN 90 31.971 -0.821 28.324 719 HB3 ASN 90 HB1 ASN 90 30.454 -1.553 27.823 720 HD21 ASN 90 HD21 ASN 90 33.592 -2.902 28.949 721 HD22 ASN 90 HD22 ASN 90 32.941 -3.879 30.176
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