NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
23213 | 2ju8 | 15434 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA MET 1 HA MET 1 19.040 10.974 -2.398 2 H1 MET 1 HT1 MET 1 17.085 11.217 -0.188 3 H2 MET 1 HT2 MET 1 17.221 12.243 -1.527 4 H3 MET 1 HT3 MET 1 18.465 12.177 -0.383 5 HB2 MET 1 HB2 MET 1 18.594 9.184 -0.001 6 HB3 MET 1 HB1 MET 1 19.735 8.893 -1.307 7 HG2 MET 1 HG2 MET 1 20.939 10.945 -0.678 8 HG3 MET 1 HG1 MET 1 19.823 11.163 0.669 9 HE1 MET 1 HE1 MET 1 21.336 7.813 -0.734 10 HE2 MET 1 HE2 MET 1 22.755 7.619 0.297 11 HE3 MET 1 HE3 MET 1 22.680 8.948 -0.860 12 H ASN 2 HN ASN 2 16.394 9.353 -0.639 13 HA ASN 2 HA ASN 2 15.711 7.878 -3.066 14 HB2 ASN 2 HB2 ASN 2 14.101 6.684 -1.529 15 HB3 ASN 2 HB1 ASN 2 15.804 6.503 -1.116 16 H PHE 3 HN PHE 3 14.403 8.884 -4.439 17 HA PHE 3 HA PHE 3 11.887 9.959 -3.480 18 HD1 PHE 3 HD2 PHE 3 11.345 12.228 -2.362 19 HD2 PHE 3 HD1 PHE 3 15.434 12.381 -3.536 20 HE1 PHE 3 HE2 PHE 3 11.909 13.347 -0.244 21 HE2 PHE 3 HE1 PHE 3 16.004 13.500 -1.419 22 HZ PHE 3 HZ PHE 3 14.240 13.982 0.229 23 HB2 PHE 3 HB2 PHE 3 13.855 11.639 -5.046 24 HB3 PHE 3 HB1 PHE 3 12.162 12.057 -4.817 25 H SER 4 HN SER 4 10.553 8.745 -4.623 26 HA SER 4 HA SER 4 9.386 7.910 -6.384 27 HG SER 4 HG SER 4 10.322 8.585 -9.583 28 HB2 SER 4 HB2 SER 4 9.525 10.102 -7.420 29 HB3 SER 4 HB1 SER 4 11.145 9.751 -8.021 30 H GLY 5 HN GLY 5 9.485 6.078 -7.581 31 HA2 GLY 5 HA2 GLY 5 11.617 5.127 -9.084 32 HA3 GLY 5 HA1 GLY 5 11.854 4.524 -7.451 33 H LYS 6 HN LYS 6 11.382 2.929 -9.775 34 HA LYS 6 HA LYS 6 8.637 1.972 -9.428 35 HB2 LYS 6 HB2 LYS 6 9.580 2.358 -11.719 36 HB3 LYS 6 HB1 LYS 6 10.710 1.050 -11.416 37 HG2 LYS 6 HG2 LYS 6 8.881 -0.522 -11.199 38 HG3 LYS 6 HG1 LYS 6 7.713 0.783 -11.414 39 HD2 LYS 6 HD2 LYS 6 8.586 1.198 -13.660 40 HD3 LYS 6 HD1 LYS 6 9.765 -0.095 -13.444 41 HE2 LYS 6 HE2 LYS 6 7.950 -1.711 -13.199 42 HE3 LYS 6 HE1 LYS 6 6.767 -0.421 -13.405 43 HZ1 LYS 6 HZ1 LYS 6 8.760 -1.287 -15.430 44 HZ2 LYS 6 HZ2 LYS 6 7.638 -0.038 -15.632 45 HZ3 LYS 6 HZ3 LYS 6 7.104 -1.634 -15.459 46 H TYR 7 HN TYR 7 8.151 0.154 -8.359 47 HA TYR 7 HA TYR 7 10.293 -1.763 -7.779 48 HD1 TYR 7 HD1 TYR 7 8.919 1.618 -5.964 49 HD2 TYR 7 HD2 TYR 7 11.874 -1.350 -5.212 50 HE1 TYR 7 HE1 TYR 7 10.514 3.375 -5.322 51 HE2 TYR 7 HE2 TYR 7 13.477 0.400 -4.569 52 HH TYR 7 HH TYR 7 13.850 2.774 -4.914 53 HB2 TYR 7 HB2 TYR 7 8.308 -0.731 -5.742 54 HB3 TYR 7 HB1 TYR 7 9.538 -1.959 -5.459 55 H GLN 8 HN GLN 8 9.658 -3.907 -7.581 56 HA GLN 8 HA GLN 8 6.860 -4.474 -8.327 57 HB2 GLN 8 HB2 GLN 8 8.338 -4.921 -10.201 58 HB3 GLN 8 HB1 GLN 8 9.388 -5.894 -9.180 59 HG2 GLN 8 HG2 GLN 8 8.218 -7.534 -10.226 60 HG3 GLN 8 HG1 GLN 8 7.197 -7.292 -8.809 61 H VAL 9 HN VAL 9 5.761 -5.789 -6.981 62 HA VAL 9 HA VAL 9 6.997 -6.784 -4.612 63 HB VAL 9 HB VAL 9 4.870 -7.688 -4.006 64 H GLN 10 HN GLN 10 7.535 -8.901 -4.050 65 HA GLN 10 HA GLN 10 7.418 -10.873 -6.224 66 HB2 GLN 10 HB2 GLN 10 9.754 -10.053 -4.536 67 HB3 GLN 10 HB1 GLN 10 9.674 -11.659 -5.235 68 HG2 GLN 10 HG2 GLN 10 9.380 -10.570 -7.471 69 HG3 GLN 10 HG1 GLN 10 9.731 -9.032 -6.684 70 H SER 11 HN SER 11 6.875 -10.181 -2.926 71 HA SER 11 HA SER 11 5.772 -12.778 -2.498 72 HG SER 11 HG SER 11 8.535 -11.067 -1.333 73 HB2 SER 11 HB2 SER 11 7.243 -13.454 -0.631 74 HB3 SER 11 HB1 SER 11 8.112 -13.367 -2.163 75 H GLN 12 HN GLN 12 4.587 -12.984 -0.596 76 HA GLN 12 HA GLN 12 4.424 -10.705 1.219 77 HB2 GLN 12 HB2 GLN 12 2.765 -10.066 -0.370 78 HB3 GLN 12 HB1 GLN 12 2.141 -11.706 -0.485 79 HG2 GLN 12 HG2 GLN 12 0.592 -10.419 0.776 80 HG3 GLN 12 HG1 GLN 12 1.402 -11.523 1.885 81 H GLU 13 HN GLU 13 3.663 -11.258 3.268 82 HA GLU 13 HA GLU 13 3.372 -14.148 3.729 83 HB2 GLU 13 HB2 GLU 13 4.197 -11.946 5.630 84 HB3 GLU 13 HB1 GLU 13 4.024 -13.641 6.067 85 HG2 GLU 13 HG2 GLU 13 5.784 -14.222 4.462 86 HG3 GLU 13 HG1 GLU 13 5.973 -12.513 4.069 87 H ASN 14 HN ASN 14 1.631 -14.973 4.795 88 HA ASN 14 HA ASN 14 -0.449 -15.118 5.710 89 HB2 ASN 14 HB2 ASN 14 -0.548 -13.810 7.526 90 HB3 ASN 14 HB1 ASN 14 0.599 -12.676 6.823 91 H PHE 15 HN PHE 15 -2.451 -15.107 4.822 92 HA PHE 15 HA PHE 15 -3.209 -12.953 3.004 93 HD1 PHE 15 HD1 PHE 15 -2.644 -12.810 0.158 94 HD2 PHE 15 HD2 PHE 15 -0.654 -16.009 2.136 95 HE1 PHE 15 HE1 PHE 15 -0.561 -12.239 -1.021 96 HE2 PHE 15 HE2 PHE 15 1.434 -15.443 0.963 97 HZ PHE 15 HZ PHE 15 1.482 -13.556 -0.618 98 HB2 PHE 15 HB2 PHE 15 -3.023 -15.851 2.177 99 HB3 PHE 15 HB1 PHE 15 -3.882 -14.623 1.258 100 H GLU 16 HN GLU 16 -4.324 -16.243 3.804 101 HA GLU 16 HA GLU 16 -7.031 -15.775 3.632 102 HB2 GLU 16 HB2 GLU 16 -5.549 -17.717 5.401 103 HB3 GLU 16 HB1 GLU 16 -7.291 -17.746 5.157 104 HG2 GLU 16 HG2 GLU 16 -5.187 -18.114 3.036 105 HG3 GLU 16 HG1 GLU 16 -6.202 -19.371 3.737 106 HA PRO 17 HA PRO 17 -7.259 -14.756 8.350 107 HB2 PRO 17 HB2 PRO 17 -4.987 -13.779 9.505 108 HB3 PRO 17 HB1 PRO 17 -5.461 -15.480 9.566 109 HG2 PRO 17 HG2 PRO 17 -3.484 -14.126 7.784 110 HG3 PRO 17 HG1 PRO 17 -3.378 -15.704 8.581 111 HD2 PRO 17 HD2 PRO 17 -4.003 -15.427 5.960 112 HD3 PRO 17 HD1 PRO 17 -4.638 -16.748 6.961 113 H PHE 18 HN PHE 18 -4.839 -12.892 6.546 114 HA PHE 18 HA PHE 18 -5.488 -10.349 7.502 115 HD1 PHE 18 HD1 PHE 18 -3.828 -8.192 6.892 116 HD2 PHE 18 HD2 PHE 18 -4.978 -9.889 3.164 117 HE1 PHE 18 HE1 PHE 18 -3.913 -5.943 5.896 118 HE2 PHE 18 HE2 PHE 18 -5.065 -7.645 2.162 119 HZ PHE 18 HZ PHE 18 -4.532 -5.667 3.529 120 HB2 PHE 18 HB2 PHE 18 -3.445 -10.640 6.298 121 HB3 PHE 18 HB1 PHE 18 -4.292 -11.284 4.893 122 H MET 19 HN MET 19 -6.599 -11.973 4.538 123 HA MET 19 HA MET 19 -8.339 -9.921 3.697 124 HB2 MET 19 HB2 MET 19 -9.282 -11.629 2.199 125 HB3 MET 19 HB1 MET 19 -7.526 -11.598 2.161 126 HG2 MET 19 HG2 MET 19 -7.813 -13.830 2.283 127 HG3 MET 19 HG1 MET 19 -7.843 -13.475 4.007 128 HE1 MET 19 HE1 MET 19 -9.068 -16.025 2.241 129 HE2 MET 19 HE2 MET 19 -10.520 -16.375 3.179 130 HE3 MET 19 HE3 MET 19 -8.996 -16.048 4.004 131 H LYS 20 HN LYS 20 -8.917 -12.871 5.581 132 HA LYS 20 HA LYS 20 -11.698 -12.708 5.715 133 HB2 LYS 20 HB2 LYS 20 -9.572 -14.015 7.318 134 HB3 LYS 20 HB1 LYS 20 -11.165 -13.888 8.057 135 HG2 LYS 20 HG2 LYS 20 -12.125 -15.014 6.079 136 HG3 LYS 20 HG1 LYS 20 -10.493 -15.206 5.436 137 HD2 LYS 20 HD2 LYS 20 -9.875 -16.523 7.404 138 HD3 LYS 20 HD1 LYS 20 -11.509 -16.334 8.043 139 HE2 LYS 20 HE2 LYS 20 -12.416 -17.518 6.121 140 HE3 LYS 20 HE1 LYS 20 -10.798 -17.671 5.436 141 HZ1 LYS 20 HZ1 LYS 20 -11.484 -19.700 6.551 142 HZ2 LYS 20 HZ2 LYS 20 -11.703 -18.860 8.003 143 HZ3 LYS 20 HZ3 LYS 20 -10.155 -19.011 7.341 144 H ALA 21 HN ALA 21 -9.229 -11.267 7.806 145 HA ALA 21 HA ALA 21 -11.053 -10.183 9.693 146 HB1 ALA 21 HB1 ALA 21 -9.151 -8.886 10.498 147 HB2 ALA 21 HB2 ALA 21 -8.231 -9.327 9.060 148 HB3 ALA 21 HB3 ALA 21 -8.698 -10.568 10.222 149 H MET 22 HN MET 22 -10.027 -9.187 6.562 150 HA MET 22 HA MET 22 -10.947 -6.445 6.971 151 HB2 MET 22 HB2 MET 22 -8.851 -6.748 5.761 152 HB3 MET 22 HB1 MET 22 -9.658 -7.771 4.581 153 HG2 MET 22 HG2 MET 22 -9.319 -5.571 3.670 154 HG3 MET 22 HG1 MET 22 -11.041 -5.869 3.895 155 HE1 MET 22 HE1 MET 22 -9.790 -2.946 3.413 156 HE2 MET 22 HE2 MET 22 -10.758 -2.029 4.566 157 HE3 MET 22 HE3 MET 22 -11.509 -3.295 3.594 158 H GLY 23 HN GLY 23 -11.366 -8.675 4.231 159 HA2 GLY 23 HA2 GLY 23 -13.984 -9.280 4.272 160 HA3 GLY 23 HA1 GLY 23 -14.012 -7.602 3.748 161 H LEU 24 HN LEU 24 -11.264 -9.416 2.824 162 HA LEU 24 HA LEU 24 -12.122 -9.312 0.047 163 HG LEU 24 HG LEU 24 -9.865 -10.567 -1.339 164 HB2 LEU 24 HB2 LEU 24 -9.855 -8.516 0.876 165 HB3 LEU 24 HB1 LEU 24 -9.449 -10.204 1.101 166 HA PRO 25 HA PRO 25 -13.206 -13.635 0.110 167 HB2 PRO 25 HB2 PRO 25 -13.588 -13.983 -2.537 168 HB3 PRO 25 HB1 PRO 25 -14.729 -13.080 -1.531 169 HG2 PRO 25 HG2 PRO 25 -12.549 -12.047 -3.309 170 HG3 PRO 25 HG1 PRO 25 -14.223 -11.484 -3.159 171 HD2 PRO 25 HD2 PRO 25 -12.158 -10.243 -1.942 172 HD3 PRO 25 HD1 PRO 25 -13.784 -10.304 -1.229 173 H GLU 26 HN GLU 26 -11.970 -15.387 0.188 174 HA GLU 26 HA GLU 26 -9.289 -15.497 -0.389 175 HB2 GLU 26 HB2 GLU 26 -9.515 -17.973 -0.284 176 HB3 GLU 26 HB1 GLU 26 -10.288 -17.132 1.050 177 HG2 GLU 26 HG2 GLU 26 -12.460 -17.397 -0.035 178 HG3 GLU 26 HG1 GLU 26 -11.684 -18.237 -1.376 179 H ASP 27 HN ASP 27 -11.943 -15.984 -2.583 180 HA ASP 27 HA ASP 27 -10.626 -17.441 -4.585 181 HB2 ASP 27 HB2 ASP 27 -12.853 -15.410 -4.850 182 HB3 ASP 27 HB1 ASP 27 -12.357 -16.533 -6.112 183 H LEU 28 HN LEU 28 -10.934 -13.941 -4.101 184 HA LEU 28 HA LEU 28 -9.509 -13.224 -6.445 185 HG LEU 28 HG LEU 28 -10.631 -11.084 -6.961 186 HB2 LEU 28 HB2 LEU 28 -10.502 -11.816 -4.031 187 HB3 LEU 28 HB1 LEU 28 -9.230 -11.030 -4.948 188 H ILE 29 HN ILE 29 -8.520 -13.708 -3.081 189 HA ILE 29 HA ILE 29 -5.928 -12.650 -3.298 190 HB ILE 29 HB ILE 29 -6.933 -14.836 -1.478 191 H GLN 30 HN GLN 30 -7.094 -15.980 -3.728 192 HA GLN 30 HA GLN 30 -4.646 -17.225 -4.113 193 HB2 GLN 30 HB2 GLN 30 -7.324 -17.846 -5.365 194 HB3 GLN 30 HB1 GLN 30 -5.930 -18.914 -5.437 195 HG2 GLN 30 HG2 GLN 30 -7.337 -18.015 -2.930 196 HG3 GLN 30 HG1 GLN 30 -7.491 -19.595 -3.702 197 H LYS 31 HN LYS 31 -6.711 -15.589 -6.486 198 HA LYS 31 HA LYS 31 -5.056 -16.180 -8.719 199 HB2 LYS 31 HB2 LYS 31 -7.108 -13.990 -8.355 200 HB3 LYS 31 HB1 LYS 31 -6.386 -14.461 -9.887 201 HG2 LYS 31 HG2 LYS 31 -7.409 -16.629 -9.766 202 HG3 LYS 31 HG1 LYS 31 -8.019 -16.290 -8.143 203 HD2 LYS 31 HD2 LYS 31 -9.479 -14.591 -8.972 204 HD3 LYS 31 HD1 LYS 31 -8.748 -14.671 -10.576 205 HE2 LYS 31 HE2 LYS 31 -10.338 -16.848 -9.220 206 HE3 LYS 31 HE1 LYS 31 -10.891 -15.825 -10.544 207 HZ1 LYS 31 HZ1 LYS 31 -8.649 -17.769 -10.667 208 HZ2 LYS 31 HZ2 LYS 31 -9.145 -16.769 -11.939 209 HZ3 LYS 31 HZ3 LYS 31 -10.181 -17.973 -11.357 210 H GLY 32 HN GLY 32 -5.098 -13.590 -6.360 211 HA2 GLY 32 HA2 GLY 32 -3.324 -11.896 -7.884 212 HA3 GLY 32 HA1 GLY 32 -3.897 -11.606 -6.252 213 H LYS 33 HN LYS 33 -2.939 -14.236 -5.286 214 HA LYS 33 HA LYS 33 -0.359 -13.402 -4.485 215 HB2 LYS 33 HB2 LYS 33 -0.198 -15.548 -3.349 216 HB3 LYS 33 HB1 LYS 33 -1.779 -14.829 -3.079 217 HG2 LYS 33 HG2 LYS 33 -2.744 -16.295 -4.768 218 HG3 LYS 33 HG1 LYS 33 -1.159 -17.010 -5.058 219 HD2 LYS 33 HD2 LYS 33 -2.441 -17.018 -2.340 220 HD3 LYS 33 HD1 LYS 33 -2.756 -18.284 -3.528 221 HE2 LYS 33 HE2 LYS 33 -1.017 -19.108 -2.168 222 HE3 LYS 33 HE1 LYS 33 -0.245 -18.587 -3.665 223 HZ1 LYS 33 HZ1 LYS 33 0.551 -16.634 -2.617 224 HZ2 LYS 33 HZ2 LYS 33 0.920 -17.917 -1.580 225 HZ3 LYS 33 HZ3 LYS 33 -0.383 -16.897 -1.231 226 H ASP 34 HN ASP 34 -1.509 -15.435 -7.070 227 HA ASP 34 HA ASP 34 1.115 -16.497 -7.660 228 HB2 ASP 34 HB2 ASP 34 -1.499 -16.674 -9.173 229 HB3 ASP 34 HB1 ASP 34 -0.018 -17.507 -9.635 230 H ILE 35 HN ILE 35 -0.417 -13.597 -8.186 231 HA ILE 35 HA ILE 35 1.152 -13.059 -10.621 232 HB ILE 35 HB ILE 35 -1.332 -11.649 -9.638 233 H LYS 36 HN LYS 36 2.871 -11.815 -10.353 234 HA LYS 36 HA LYS 36 3.406 -10.457 -7.894 235 HB2 LYS 36 HB2 LYS 36 4.859 -10.351 -10.547 236 HB3 LYS 36 HB1 LYS 36 5.473 -9.720 -9.024 237 HG2 LYS 36 HG2 LYS 36 5.464 -11.971 -8.081 238 HG3 LYS 36 HG1 LYS 36 4.836 -12.608 -9.601 239 HD2 LYS 36 HD2 LYS 36 6.854 -11.860 -10.756 240 HD3 LYS 36 HD1 LYS 36 7.478 -11.189 -9.247 241 HE2 LYS 36 HE2 LYS 36 8.482 -13.360 -9.711 242 HE3 LYS 36 HE1 LYS 36 7.489 -13.423 -8.256 243 HZ1 LYS 36 HZ1 LYS 36 5.717 -14.433 -9.548 244 HZ2 LYS 36 HZ2 LYS 36 7.129 -15.355 -9.660 245 HZ3 LYS 36 HZ3 LYS 36 6.663 -14.365 -10.950 246 H GLY 37 HN GLY 37 2.126 -8.744 -7.448 247 HA2 GLY 37 HA2 GLY 37 1.002 -6.966 -9.293 248 HA3 GLY 37 HA1 GLY 37 1.237 -6.632 -7.584 249 H VAL 38 HN VAL 38 1.427 -4.542 -9.222 250 HA VAL 38 HA VAL 38 4.328 -4.056 -9.441 251 HB VAL 38 HB VAL 38 2.294 -2.595 -11.101 252 H SER 39 HN SER 39 5.110 -2.082 -8.756 253 HA SER 39 HA SER 39 3.203 -0.238 -7.495 254 HG SER 39 HG SER 39 4.018 -2.705 -6.080 255 HB2 SER 39 HB2 SER 39 5.772 -1.226 -6.231 256 HB3 SER 39 HB1 SER 39 4.701 0.001 -5.554 257 H GLU 40 HN GLU 40 3.557 1.835 -8.001 258 HA GLU 40 HA GLU 40 6.222 2.613 -8.967 259 HB2 GLU 40 HB2 GLU 40 3.568 3.336 -10.222 260 HB3 GLU 40 HB1 GLU 40 5.109 4.058 -10.663 261 HG2 GLU 40 HG2 GLU 40 5.939 1.977 -11.459 262 HG3 GLU 40 HG1 GLU 40 4.520 1.120 -10.859 263 H ILE 41 HN ILE 41 7.022 4.307 -7.911 264 HA ILE 41 HA ILE 41 5.150 5.973 -6.362 265 HB ILE 41 HB ILE 41 8.118 5.750 -5.900 266 H VAL 42 HN VAL 42 4.785 7.934 -7.118 267 HA VAL 42 HA VAL 42 6.826 9.218 -8.803 268 HB VAL 42 HB VAL 42 3.879 9.863 -8.617 269 H HIS 43 HN HIS 43 8.013 10.686 -7.766 270 HA HIS 43 HA HIS 43 6.815 12.135 -5.511 271 HD1 HIS 43 HD1 HIS 43 10.820 13.837 -6.192 272 HD2 HIS 43 HD2 HIS 43 8.434 13.095 -2.871 273 HE1 HIS 43 HE1 HIS 43 11.353 15.674 -4.558 274 HE2 HIS 43 HE2 HIS 43 9.867 15.228 -2.572 275 HB2 HIS 43 HB2 HIS 43 8.817 11.051 -4.836 276 HB3 HIS 43 HB1 HIS 43 9.679 11.576 -6.277 277 H GLU 44 HN GLU 44 6.064 14.101 -5.933 278 HA GLU 44 HA GLU 44 7.588 15.838 -7.734 279 HB2 GLU 44 HB2 GLU 44 5.692 14.811 -8.993 280 HB3 GLU 44 HB1 GLU 44 4.583 15.558 -7.852 281 HG2 GLU 44 HG2 GLU 44 5.354 17.762 -8.524 282 HG3 GLU 44 HG1 GLU 44 6.486 17.029 -9.659 283 H GLY 45 HN GLY 45 8.296 17.260 -6.240 284 HA2 GLY 45 HA2 GLY 45 8.270 18.847 -4.576 285 HA3 GLY 45 HA1 GLY 45 6.822 19.396 -5.399 286 H LYS 46 HN LYS 46 7.876 16.941 -3.045 287 HA LYS 46 HA LYS 46 7.012 16.283 -1.051 288 HB2 LYS 46 HB2 LYS 46 5.185 18.673 -1.288 289 HB3 LYS 46 HB1 LYS 46 5.501 17.750 0.170 290 HG2 LYS 46 HG2 LYS 46 7.856 18.436 0.076 291 HG3 LYS 46 HG1 LYS 46 7.490 19.417 -1.345 292 HD2 LYS 46 HD2 LYS 46 5.911 20.740 -0.039 293 HD3 LYS 46 HD1 LYS 46 6.240 19.744 1.382 294 HE2 LYS 46 HE2 LYS 46 8.525 20.486 1.437 295 HE3 LYS 46 HE1 LYS 46 8.318 21.351 -0.084 296 HZ1 LYS 46 HZ1 LYS 46 6.734 22.815 1.007 297 HZ2 LYS 46 HZ2 LYS 46 8.225 22.852 1.804 298 HZ3 LYS 46 HZ3 LYS 46 6.934 21.982 2.467 299 H LYS 47 HN LYS 47 4.942 16.754 -3.763 300 HA LYS 47 HA LYS 47 2.779 15.203 -2.586 301 HB2 LYS 47 HB2 LYS 47 3.027 16.318 -5.386 302 HB3 LYS 47 HB1 LYS 47 1.576 15.649 -4.653 303 HG2 LYS 47 HG2 LYS 47 1.578 17.471 -3.012 304 HG3 LYS 47 HG1 LYS 47 3.013 18.147 -3.780 305 HD2 LYS 47 HD2 LYS 47 0.399 17.690 -5.208 306 HD3 LYS 47 HD1 LYS 47 0.855 19.222 -4.457 307 HE2 LYS 47 HE2 LYS 47 2.845 19.307 -5.895 308 HE3 LYS 47 HE1 LYS 47 2.341 17.806 -6.669 309 HZ1 LYS 47 HZ1 LYS 47 1.704 19.720 -7.985 310 HZ2 LYS 47 HZ2 LYS 47 0.828 20.363 -6.689 311 HZ3 LYS 47 HZ3 LYS 47 0.325 18.921 -7.417 312 H VAL 48 HN VAL 48 3.108 13.081 -2.485 313 HA VAL 48 HA VAL 48 4.443 11.760 -4.747 314 HB VAL 48 HB VAL 48 4.089 10.705 -1.940 315 H LYS 49 HN LYS 49 3.330 10.400 -5.984 316 HA LYS 49 HA LYS 49 0.634 9.617 -5.113 317 HB2 LYS 49 HB2 LYS 49 1.814 9.807 -7.891 318 HB3 LYS 49 HB1 LYS 49 0.185 9.252 -7.530 319 HG2 LYS 49 HG2 LYS 49 -0.359 11.436 -6.592 320 HG3 LYS 49 HG1 LYS 49 1.279 11.995 -6.937 321 HD2 LYS 49 HD2 LYS 49 -0.222 12.774 -8.665 322 HD3 LYS 49 HD1 LYS 49 0.884 11.575 -9.339 323 HE2 LYS 49 HE2 LYS 49 -0.848 9.864 -9.151 324 HE3 LYS 49 HE1 LYS 49 -1.950 11.047 -8.449 325 HZ1 LYS 49 HZ1 LYS 49 -0.795 11.168 -11.183 326 HZ2 LYS 49 HZ2 LYS 49 -1.851 12.305 -10.511 327 HZ3 LYS 49 HZ3 LYS 49 -2.383 10.725 -10.801 328 H LEU 50 HN LEU 50 0.092 7.519 -4.914 329 HA LEU 50 HA LEU 50 2.194 5.541 -5.477 330 HG LEU 50 HG LEU 50 1.465 3.723 -2.374 331 HB2 LEU 50 HB2 LEU 50 1.012 5.991 -3.127 332 HB3 LEU 50 HB1 LEU 50 -0.160 4.870 -3.789 333 H THR 51 HN THR 51 1.893 4.126 -7.066 334 HA THR 51 HA THR 51 -0.855 3.677 -8.030 335 HB THR 51 HB THR 51 1.671 3.689 -9.693 336 HG1 THR 51 HG1 THR 51 0.357 5.732 -8.851 337 H ILE 52 HN ILE 52 -1.544 1.640 -8.002 338 HA ILE 52 HA ILE 52 0.437 -0.539 -7.982 339 HB ILE 52 HB ILE 52 -2.066 -0.420 -6.291 340 H THR 53 HN THR 53 0.087 -2.008 -9.530 341 HA THR 53 HA THR 53 -2.558 -2.031 -10.825 342 HB THR 53 HB THR 53 0.113 -2.853 -11.980 343 HG1 THR 53 HG1 THR 53 -0.433 -0.925 -13.336 344 H TYR 54 HN TYR 54 -3.739 -3.827 -10.818 345 HA TYR 54 HA TYR 54 -2.450 -6.358 -10.038 346 HD1 TYR 54 HD2 TYR 54 -2.329 -7.274 -7.851 347 HD2 TYR 54 HD1 TYR 54 -4.964 -3.968 -7.380 348 HE1 TYR 54 HE2 TYR 54 -1.312 -6.783 -5.667 349 HE2 TYR 54 HE1 TYR 54 -3.953 -3.465 -5.195 350 HH TYR 54 HH TYR 54 -2.695 -4.643 -3.433 351 HB2 TYR 54 HB2 TYR 54 -5.156 -5.267 -9.262 352 HB3 TYR 54 HB1 TYR 54 -4.728 -6.964 -9.081 353 H GLY 55 HN GLY 55 -2.324 -7.579 -11.813 354 HA2 GLY 55 HA2 GLY 55 -3.005 -8.819 -13.626 355 HA3 GLY 55 HA1 GLY 55 -4.660 -8.489 -13.138 356 H SER 56 HN SER 56 -5.669 -6.532 -13.890 357 HA SER 56 HA SER 56 -4.321 -5.209 -16.132 358 HG SER 56 HG SER 56 -7.280 -7.278 -15.614 359 HB2 SER 56 HB2 SER 56 -6.345 -5.416 -17.528 360 HB3 SER 56 HB1 SER 56 -5.672 -6.995 -17.126 361 H LYS 57 HN LYS 57 -5.404 -4.654 -13.277 362 HA LYS 57 HA LYS 57 -7.002 -2.279 -13.968 363 HB2 LYS 57 HB2 LYS 57 -8.179 -3.832 -12.500 364 HB3 LYS 57 HB1 LYS 57 -6.846 -3.778 -11.353 365 HG2 LYS 57 HG2 LYS 57 -7.269 -1.406 -10.959 366 HG3 LYS 57 HG1 LYS 57 -8.594 -1.449 -12.124 367 HD2 LYS 57 HD2 LYS 57 -8.521 -3.277 -9.754 368 HD3 LYS 57 HD1 LYS 57 -9.183 -1.646 -9.638 369 HE2 LYS 57 HE2 LYS 57 -10.106 -3.809 -11.529 370 HE3 LYS 57 HE1 LYS 57 -10.937 -3.301 -10.060 371 HZ1 LYS 57 HZ1 LYS 57 -11.894 -2.292 -12.046 372 HZ2 LYS 57 HZ2 LYS 57 -10.410 -1.571 -12.417 373 HZ3 LYS 57 HZ3 LYS 57 -11.245 -1.115 -11.019 374 H VAL 58 HN VAL 58 -6.290 -0.295 -13.429 375 HA VAL 58 HA VAL 58 -3.691 -0.143 -12.051 376 HB VAL 58 HB VAL 58 -4.908 1.920 -13.896 377 H ILE 59 HN ILE 59 -3.609 0.821 -10.129 378 HA ILE 59 HA ILE 59 -5.923 2.437 -9.278 379 HB ILE 59 HB ILE 59 -3.996 0.868 -7.559 380 H HIS 60 HN HIS 60 -5.512 4.541 -9.201 381 HA HIS 60 HA HIS 60 -2.772 5.411 -8.539 382 HD1 HIS 60 HD1 HIS 60 -5.262 8.895 -9.232 383 HD2 HIS 60 HD2 HIS 60 -6.138 5.609 -11.620 384 HE1 HIS 60 HE1 HIS 60 -7.599 9.282 -10.080 385 HE2 HIS 60 HE2 HIS 60 -8.115 7.273 -11.509 386 HB2 HIS 60 HB2 HIS 60 -3.213 7.447 -9.815 387 HB3 HIS 60 HB1 HIS 60 -3.478 6.025 -10.817 388 H ASN 61 HN ASN 61 -2.445 6.814 -6.897 389 HA ASN 61 HA ASN 61 -4.760 8.090 -5.630 390 HB2 ASN 61 HB2 ASN 61 -2.750 6.311 -4.243 391 HB3 ASN 61 HB1 ASN 61 -3.780 7.447 -3.378 392 H GLU 62 HN GLU 62 -4.145 9.814 -4.117 393 HA GLU 62 HA GLU 62 -1.439 10.872 -4.517 394 HB2 GLU 62 HB2 GLU 62 -2.864 11.955 -6.193 395 HB3 GLU 62 HB1 GLU 62 -3.982 12.457 -4.932 396 HG2 GLU 62 HG2 GLU 62 -2.211 13.830 -3.931 397 HG3 GLU 62 HG1 GLU 62 -1.124 13.353 -5.233 398 H PHE 63 HN PHE 63 -0.577 11.822 -2.746 399 HA PHE 63 HA PHE 63 -2.287 12.687 -0.559 400 HD1 PHE 63 HD2 PHE 63 1.482 11.185 0.720 401 HD2 PHE 63 HD1 PHE 63 -1.241 8.859 -1.577 402 HE1 PHE 63 HE2 PHE 63 3.336 9.747 -0.016 403 HE2 PHE 63 HE1 PHE 63 0.610 7.416 -2.318 404 HZ PHE 63 HZ PHE 63 2.897 7.851 -1.537 405 HB2 PHE 63 HB2 PHE 63 -0.921 11.323 1.079 406 HB3 PHE 63 HB1 PHE 63 -2.038 10.408 0.074 407 H THR 64 HN THR 64 -1.236 14.023 0.973 408 HA THR 64 HA THR 64 1.292 15.154 -0.021 409 HB THR 64 HB THR 64 -0.694 16.480 1.838 410 HG1 THR 64 HG1 THR 64 -1.455 16.049 -0.381 411 H LEU 65 HN LEU 65 3.080 14.976 1.171 412 HA LEU 65 HA LEU 65 3.206 13.421 3.495 413 HG LEU 65 HG LEU 65 4.825 13.663 0.844 414 HB2 LEU 65 HB2 LEU 65 5.176 15.474 2.482 415 HB3 LEU 65 HB1 LEU 65 5.516 14.279 3.719 416 H GLY 66 HN GLY 66 3.157 13.870 5.638 417 HA2 GLY 66 HA2 GLY 66 2.778 15.037 7.579 418 HA3 GLY 66 HA1 GLY 66 3.546 16.408 6.793 419 H GLU 67 HN GLU 67 0.641 14.784 5.652 420 HA GLU 67 HA GLU 67 -1.107 16.821 6.717 421 HB2 GLU 67 HB2 GLU 67 -0.159 17.943 4.750 422 HB3 GLU 67 HB1 GLU 67 -0.663 16.599 3.734 423 HG2 GLU 67 HG2 GLU 67 -2.992 17.092 4.205 424 HG3 GLU 67 HG1 GLU 67 -2.510 18.402 5.278 425 H GLU 68 HN GLU 68 -3.037 15.954 7.132 426 HA GLU 68 HA GLU 68 -3.611 13.250 6.380 427 HB2 GLU 68 HB2 GLU 68 -4.279 14.165 8.563 428 HB3 GLU 68 HB1 GLU 68 -5.351 15.304 7.762 429 HG2 GLU 68 HG2 GLU 68 -6.691 13.462 6.908 430 HG3 GLU 68 HG1 GLU 68 -5.607 12.306 7.682 431 H CYS 69 HN CYS 69 -4.479 12.630 4.519 432 HA CYS 69 HA CYS 69 -6.287 14.484 3.114 433 HG CYS 69 HG CYS 69 -5.962 14.974 0.190 434 HB2 CYS 69 HB2 CYS 69 -4.112 14.096 1.950 435 HB3 CYS 69 HB1 CYS 69 -4.512 12.384 1.859 436 H GLU 70 HN GLU 70 -7.978 13.478 1.832 437 HA GLU 70 HA GLU 70 -9.008 11.090 3.167 438 HB2 GLU 70 HB2 GLU 70 -10.492 13.027 3.068 439 HB3 GLU 70 HB1 GLU 70 -10.365 13.051 1.316 440 HG2 GLU 70 HG2 GLU 70 -11.439 10.849 1.218 441 HG3 GLU 70 HG1 GLU 70 -11.597 10.865 2.974 442 H LEU 71 HN LEU 71 -8.801 9.173 2.256 443 HA LEU 71 HA LEU 71 -8.579 9.019 -0.678 444 HG LEU 71 HG LEU 71 -7.928 5.891 -0.442 445 HB2 LEU 71 HB2 LEU 71 -6.466 8.430 0.292 446 HB3 LEU 71 HB1 LEU 71 -7.233 7.359 1.448 447 H GLU 72 HN GLU 72 -9.702 7.408 -1.740 448 HA GLU 72 HA GLU 72 -11.954 6.315 -0.267 449 HB2 GLU 72 HB2 GLU 72 -12.998 5.992 -2.325 450 HB3 GLU 72 HB1 GLU 72 -12.030 7.432 -2.603 451 HG2 GLU 72 HG2 GLU 72 -10.292 6.000 -3.640 452 HG3 GLU 72 HG1 GLU 72 -11.381 4.626 -3.467 453 H THR 73 HN THR 73 -12.458 4.127 -0.117 454 HA THR 73 HA THR 73 -10.148 2.359 -0.267 455 HB THR 73 HB THR 73 -11.444 2.364 1.814 456 HG1 THR 73 HG1 THR 73 -12.031 -0.043 1.622 457 H MET 74 HN MET 74 -10.895 -0.052 -0.836 458 HA MET 74 HA MET 74 -11.500 -0.020 -3.599 459 HB2 MET 74 HB2 MET 74 -10.097 -1.739 -2.446 460 HB3 MET 74 HB1 MET 74 -11.565 -2.401 -1.741 461 HG2 MET 74 HG2 MET 74 -12.406 -3.009 -3.891 462 HG3 MET 74 HG1 MET 74 -11.090 -2.164 -4.700 463 HE1 MET 74 HE1 MET 74 -10.990 -4.370 -1.500 464 HE2 MET 74 HE2 MET 74 -10.448 -5.931 -2.115 465 HE3 MET 74 HE3 MET 74 -12.062 -5.336 -2.513 466 H THR 75 HN THR 75 -13.502 0.034 -0.852 467 HA THR 75 HA THR 75 -15.776 -1.160 -2.239 468 HB THR 75 HB THR 75 -16.969 -1.079 -0.187 469 HG1 THR 75 HG1 THR 75 -16.632 0.477 1.200 470 H GLY 76 HN GLY 76 -14.343 1.854 -1.976 471 HA2 GLY 76 HA2 GLY 76 -15.153 3.733 -3.172 472 HA3 GLY 76 HA1 GLY 76 -16.787 3.120 -2.983 473 H GLU 77 HN GLU 77 -15.545 2.733 -0.018 474 HA GLU 77 HA GLU 77 -16.922 4.997 1.035 475 HB2 GLU 77 HB2 GLU 77 -16.920 2.899 2.241 476 HB3 GLU 77 HB1 GLU 77 -15.176 2.969 2.381 477 HG2 GLU 77 HG2 GLU 77 -15.314 4.908 3.802 478 HG3 GLU 77 HG1 GLU 77 -17.064 4.961 3.596 479 H LYS 78 HN LYS 78 -16.147 6.854 1.933 480 HA LYS 78 HA LYS 78 -13.406 7.552 1.238 481 HB2 LYS 78 HB2 LYS 78 -15.554 9.322 2.413 482 HB3 LYS 78 HB1 LYS 78 -14.059 9.839 1.644 483 HG2 LYS 78 HG2 LYS 78 -16.333 8.415 0.271 484 HG3 LYS 78 HG1 LYS 78 -15.997 10.146 0.188 485 HD2 LYS 78 HD2 LYS 78 -13.811 9.653 -0.828 486 HD3 LYS 78 HD1 LYS 78 -14.187 7.930 -0.773 487 HE2 LYS 78 HE2 LYS 78 -14.599 8.890 -2.993 488 HE3 LYS 78 HE1 LYS 78 -16.075 8.266 -2.257 489 HZ1 LYS 78 HZ1 LYS 78 -15.250 11.119 -2.339 490 HZ2 LYS 78 HZ2 LYS 78 -16.660 10.527 -1.617 491 HZ3 LYS 78 HZ3 LYS 78 -16.455 10.409 -3.292 492 H VAL 79 HN VAL 79 -11.819 7.361 2.672 493 HA VAL 79 HA VAL 79 -12.472 7.665 5.533 494 HB VAL 79 HB VAL 79 -10.673 6.066 6.056 495 H LYS 80 HN LYS 80 -10.947 8.708 6.847 496 HA LYS 80 HA LYS 80 -9.138 10.476 5.378 497 HB2 LYS 80 HB2 LYS 80 -9.065 11.799 7.437 498 HB3 LYS 80 HB1 LYS 80 -10.722 11.524 6.920 499 HG2 LYS 80 HG2 LYS 80 -10.903 9.704 8.576 500 HG3 LYS 80 HG1 LYS 80 -9.272 10.086 9.130 501 HD2 LYS 80 HD2 LYS 80 -10.037 12.382 9.657 502 HD3 LYS 80 HD1 LYS 80 -11.675 11.907 9.205 503 HE2 LYS 80 HE2 LYS 80 -10.014 10.736 11.431 504 HE3 LYS 80 HE1 LYS 80 -11.404 11.805 11.612 505 HZ1 LYS 80 HZ1 LYS 80 -12.785 10.093 10.578 506 HZ2 LYS 80 HZ2 LYS 80 -12.040 9.521 11.984 507 HZ3 LYS 80 HZ3 LYS 80 -11.446 9.065 10.468 508 H ALA 81 HN ALA 81 -6.970 10.396 5.544 509 HA ALA 81 HA ALA 81 -5.729 8.858 7.686 510 HB1 ALA 81 HB1 ALA 81 -5.216 8.228 4.783 511 HB2 ALA 81 HB2 ALA 81 -6.144 7.227 5.900 512 HB3 ALA 81 HB3 ALA 81 -4.421 7.486 6.170 513 H VAL 82 HN VAL 82 -3.673 9.507 8.193 514 HA VAL 82 HA VAL 82 -2.609 11.774 6.649 515 HB VAL 82 HB VAL 82 -3.272 12.523 8.836 516 H VAL 83 HN VAL 83 -0.820 11.353 5.568 517 HA VAL 83 HA VAL 83 0.932 9.185 6.508 518 HB VAL 83 HB VAL 83 0.072 8.700 4.324 519 H LYS 84 HN LYS 84 2.831 9.734 7.326 520 HA LYS 84 HA LYS 84 4.125 12.209 6.404 521 HB2 LYS 84 HB2 LYS 84 4.159 11.328 9.287 522 HB3 LYS 84 HB1 LYS 84 4.701 12.861 8.620 523 HG2 LYS 84 HG2 LYS 84 2.329 13.341 7.998 524 HG3 LYS 84 HG1 LYS 84 1.866 11.888 8.884 525 HD2 LYS 84 HD2 LYS 84 3.397 14.187 10.095 526 HD3 LYS 84 HD1 LYS 84 1.643 14.012 10.186 527 HE2 LYS 84 HE2 LYS 84 1.874 11.931 11.390 528 HE3 LYS 84 HE1 LYS 84 3.626 11.980 11.203 529 HZ1 LYS 84 HZ1 LYS 84 3.681 13.983 12.550 530 HZ2 LYS 84 HZ2 LYS 84 2.946 12.719 13.400 531 HZ3 LYS 84 HZ3 LYS 84 1.998 13.946 12.722 532 H MET 85 HN MET 85 6.409 12.219 6.528 533 HA MET 85 HA MET 85 7.567 9.531 6.548 534 HB2 MET 85 HB2 MET 85 9.465 10.536 5.365 535 HB3 MET 85 HB1 MET 85 7.951 10.875 4.537 536 HG2 MET 85 HG2 MET 85 7.923 13.114 5.556 537 HG3 MET 85 HG1 MET 85 9.477 12.768 6.313 538 HE1 MET 85 HE1 MET 85 11.716 12.345 4.957 539 HE2 MET 85 HE2 MET 85 11.829 12.405 3.198 540 HE3 MET 85 HE3 MET 85 10.936 11.101 3.981 541 H GLU 86 HN GLU 86 9.337 8.985 7.816 542 HA GLU 86 HA GLU 86 9.736 10.729 10.132 543 HB2 GLU 86 HB2 GLU 86 9.042 8.347 10.475 544 HB3 GLU 86 HB1 GLU 86 10.580 7.848 9.786 545 HG2 GLU 86 HG2 GLU 86 10.612 7.780 12.220 546 HG3 GLU 86 HG1 GLU 86 11.772 8.947 11.588 547 H GLY 87 HN GLY 87 11.233 9.864 7.258 548 HA2 GLY 87 HA2 GLY 87 13.258 11.407 6.964 549 HA3 GLY 87 HA1 GLY 87 13.911 10.496 8.315 550 H ASP 88 HN ASP 88 15.304 8.995 7.733 551 HA ASP 88 HA ASP 88 15.304 8.007 5.005 552 HB2 ASP 88 HB2 ASP 88 17.415 8.823 5.982 553 HB3 ASP 88 HB1 ASP 88 17.305 7.592 7.237 554 H ASN 89 HN ASN 89 14.658 6.089 4.435 555 HA ASN 89 HA ASN 89 13.684 4.056 4.488 556 HB2 ASN 89 HB2 ASN 89 14.895 2.330 5.553 557 HB3 ASN 89 HB1 ASN 89 16.076 3.552 5.100 558 H LYS 90 HN LYS 90 12.782 6.176 6.620 559 HA LYS 90 HA LYS 90 10.988 4.281 7.953 560 HB2 LYS 90 HB2 LYS 90 12.694 6.361 9.290 561 HB3 LYS 90 HB1 LYS 90 11.213 5.772 10.036 562 HG2 LYS 90 HG2 LYS 90 12.070 3.732 10.480 563 HG3 LYS 90 HG1 LYS 90 13.149 3.750 9.084 564 HD2 LYS 90 HD2 LYS 90 14.564 5.408 10.254 565 HD3 LYS 90 HD1 LYS 90 13.508 5.274 11.663 566 HE2 LYS 90 HE2 LYS 90 14.082 2.978 11.966 567 HE3 LYS 90 HE1 LYS 90 14.943 2.931 10.427 568 HZ1 LYS 90 HZ1 LYS 90 16.457 3.092 12.311 569 HZ2 LYS 90 HZ2 LYS 90 15.736 4.543 12.794 570 HZ3 LYS 90 HZ3 LYS 90 16.572 4.463 11.326 571 H MET 91 HN MET 91 8.950 4.812 7.757 572 HA MET 91 HA MET 91 8.149 7.622 7.654 573 HB2 MET 91 HB2 MET 91 7.422 5.541 5.586 574 HB3 MET 91 HB1 MET 91 6.564 7.065 5.772 575 HG2 MET 91 HG2 MET 91 8.690 8.257 5.337 576 HG3 MET 91 HG1 MET 91 9.456 6.700 5.027 577 HE1 MET 91 HE1 MET 91 10.244 7.653 2.639 578 HE2 MET 91 HE2 MET 91 9.429 9.180 2.982 579 HE3 MET 91 HE3 MET 91 9.129 8.344 1.460 580 H VAL 92 HN VAL 92 6.306 8.007 8.784 581 HA VAL 92 HA VAL 92 4.887 5.641 9.820 582 HB VAL 92 HB VAL 92 5.014 8.375 11.092 583 H THR 93 HN THR 93 2.946 5.330 9.016 584 HA THR 93 HA THR 93 1.212 7.641 8.493 585 HB THR 93 HB THR 93 1.990 6.987 6.305 586 HG1 THR 93 HG1 THR 93 -0.354 5.748 5.925 587 H THR 94 HN THR 94 -0.653 7.459 9.569 588 HA THR 94 HA THR 94 -1.628 4.750 10.206 589 HB THR 94 HB THR 94 -1.931 7.116 12.053 590 HG1 THR 94 HG1 THR 94 0.309 6.360 11.734 591 H PHE 95 HN PHE 95 -3.786 4.378 10.009 592 HA PHE 95 HA PHE 95 -5.545 6.644 9.424 593 HD1 PHE 95 HD1 PHE 95 -3.270 3.757 7.600 594 HD2 PHE 95 HD2 PHE 95 -7.508 3.424 7.403 595 HE1 PHE 95 HE1 PHE 95 -3.055 1.355 7.129 596 HE2 PHE 95 HE2 PHE 95 -7.300 1.018 6.931 597 HZ PHE 95 HZ PHE 95 -5.093 -0.020 6.781 598 HB2 PHE 95 HB2 PHE 95 -6.501 5.544 7.482 599 HB3 PHE 95 HB1 PHE 95 -4.766 5.740 7.257 600 H LYS 96 HN LYS 96 -7.452 6.511 10.415 601 HA LYS 96 HA LYS 96 -9.165 5.755 11.693 602 HB2 LYS 96 HB2 LYS 96 -8.581 3.096 10.378 603 HB3 LYS 96 HB1 LYS 96 -10.067 3.539 11.209 604 HG2 LYS 96 HG2 LYS 96 -10.577 5.187 9.535 605 HG3 LYS 96 HG1 LYS 96 -9.023 4.919 8.745 606 HD2 LYS 96 HD2 LYS 96 -10.689 3.750 7.493 607 HD3 LYS 96 HD1 LYS 96 -9.724 2.548 8.353 608 HE2 LYS 96 HE2 LYS 96 -12.098 2.013 8.475 609 HE3 LYS 96 HE1 LYS 96 -11.453 2.388 10.072 610 HZ1 LYS 96 HZ1 LYS 96 -13.603 3.435 9.695 611 HZ2 LYS 96 HZ2 LYS 96 -12.990 4.263 8.355 612 HZ3 LYS 96 HZ3 LYS 96 -12.394 4.600 9.901 613 H GLY 97 HN GLY 97 -7.520 2.628 11.745 614 HA2 GLY 97 HA2 GLY 97 -6.495 3.129 14.428 615 HA3 GLY 97 HA1 GLY 97 -7.755 1.912 14.293 616 H ILE 98 HN ILE 98 -5.719 2.149 11.574 617 HA ILE 98 HA ILE 98 -4.362 -0.331 12.377 618 HB ILE 98 HB ILE 98 -4.697 0.808 9.599 619 H LYS 99 HN LYS 99 -2.169 -0.489 12.401 620 HA LYS 99 HA LYS 99 -0.686 2.020 12.131 621 HB2 LYS 99 HB2 LYS 99 -0.643 0.180 14.111 622 HB3 LYS 99 HB1 LYS 99 0.673 -0.422 13.110 623 HG2 LYS 99 HG2 LYS 99 0.600 2.466 13.844 624 HG3 LYS 99 HG1 LYS 99 1.136 1.277 15.032 625 HD2 LYS 99 HD2 LYS 99 2.282 1.505 12.253 626 HD3 LYS 99 HD1 LYS 99 2.970 2.307 13.666 627 HE2 LYS 99 HE2 LYS 99 2.656 -0.659 13.221 628 HE3 LYS 99 HE1 LYS 99 4.162 0.255 13.285 629 HZ1 LYS 99 HZ1 LYS 99 3.704 0.767 15.606 630 HZ2 LYS 99 HZ2 LYS 99 3.756 -0.905 15.358 631 HZ3 LYS 99 HZ3 LYS 99 2.267 -0.124 15.542 632 H SER 100 HN SER 100 0.370 2.403 10.305 633 HA SER 100 HA SER 100 1.413 0.109 8.786 634 HG SER 100 HG SER 100 -0.749 0.292 6.871 635 HB2 SER 100 HB2 SER 100 0.281 2.694 7.695 636 HB3 SER 100 HB1 SER 100 1.022 1.422 6.724 637 H VAL 101 HN VAL 101 3.548 0.070 8.648 638 HA VAL 101 HA VAL 101 5.010 2.630 8.689 639 HB VAL 101 HB VAL 101 5.864 0.020 9.957 640 H THR 102 HN THR 102 6.124 2.985 6.907 641 HA THR 102 HA THR 102 6.920 0.683 5.249 642 HB THR 102 HB THR 102 6.314 3.509 4.357 643 HG1 THR 102 HG1 THR 102 4.592 2.152 3.220 644 H GLU 103 HN GLU 103 9.041 0.379 4.903 645 HA GLU 103 HA GLU 103 10.899 2.444 5.778 646 HB2 GLU 103 HB2 GLU 103 11.173 -0.498 5.205 647 HB3 GLU 103 HB1 GLU 103 12.572 0.541 5.398 648 HG2 GLU 103 HG2 GLU 103 11.770 1.170 7.635 649 HG3 GLU 103 HG1 GLU 103 10.430 0.042 7.443 650 H PHE 104 HN PHE 104 11.899 3.708 4.363 651 HA PHE 104 HA PHE 104 11.688 3.006 1.513 652 HD1 PHE 104 HD1 PHE 104 9.125 4.892 1.667 653 HD2 PHE 104 HD2 PHE 104 12.755 5.774 -0.371 654 HE1 PHE 104 HE1 PHE 104 7.863 5.278 -0.408 655 HE2 PHE 104 HE2 PHE 104 11.500 6.163 -2.449 656 HZ PHE 104 HZ PHE 104 9.049 5.915 -2.472 657 HB2 PHE 104 HB2 PHE 104 11.174 5.377 2.884 658 HB3 PHE 104 HB1 PHE 104 12.683 5.677 2.027 659 H ASN 105 HN ASN 105 13.371 2.181 0.538 660 HA ASN 105 HA ASN 105 16.068 3.065 1.327 661 HB2 ASN 105 HB2 ASN 105 15.290 0.297 0.380 662 HB3 ASN 105 HB1 ASN 105 16.908 0.826 0.828 663 H GLY 106 HN GLY 106 17.640 3.134 -0.369 664 HA2 GLY 106 HA2 GLY 106 16.501 3.970 -2.879 665 HA3 GLY 106 HA1 GLY 106 18.204 3.984 -2.449 666 H ASP 107 HN ASP 107 15.993 1.212 -2.410 667 HA ASP 107 HA ASP 107 16.800 0.138 -4.891 668 HB2 ASP 107 HB2 ASP 107 18.167 -1.768 -4.019 669 HB3 ASP 107 HB1 ASP 107 18.957 -0.199 -3.883 670 H THR 108 HN THR 108 15.444 -0.328 -1.700 671 HA THR 108 HA THR 108 13.503 -2.188 -2.855 672 HB THR 108 HB THR 108 13.603 -3.565 -0.736 673 HG1 THR 108 HG1 THR 108 15.159 -3.192 0.682 674 H ILE 109 HN ILE 109 11.472 -2.158 -1.905 675 HA ILE 109 HA ILE 109 11.062 -0.126 0.191 676 HB ILE 109 HB ILE 109 9.435 -0.609 -2.299 677 H THR 110 HN THR 110 10.210 -0.957 1.970 678 HA THR 110 HA THR 110 8.550 -3.386 1.752 679 HB THR 110 HB THR 110 10.166 -2.528 4.159 680 HG1 THR 110 HG1 THR 110 11.038 -4.790 2.991 681 H ASN 111 HN ASN 111 6.578 -3.425 2.716 682 HA ASN 111 HA ASN 111 5.765 -1.018 4.218 683 HB2 ASN 111 HB2 ASN 111 4.739 -1.042 1.990 684 HB3 ASN 111 HB1 ASN 111 4.092 -2.651 2.293 685 H THR 112 HN THR 112 4.620 -1.316 6.094 686 HA THR 112 HA THR 112 4.111 -4.116 6.877 687 HB THR 112 HB THR 112 4.712 -1.950 8.875 688 HG1 THR 112 HG1 THR 112 6.887 -3.263 8.696 689 H MET 113 HN MET 113 2.048 -4.567 7.183 690 HA MET 113 HA MET 113 0.264 -2.461 8.216 691 HB2 MET 113 HB2 MET 113 -0.305 -4.560 6.119 692 HB3 MET 113 HB1 MET 113 -1.569 -3.642 6.926 693 HG2 MET 113 HG2 MET 113 -0.652 -1.572 6.048 694 HG3 MET 113 HG1 MET 113 0.654 -2.468 5.274 695 HE1 MET 113 HE1 MET 113 -1.515 -1.329 2.220 696 HE2 MET 113 HE2 MET 113 0.064 -1.259 3.005 697 HE3 MET 113 HE3 MET 113 -1.312 -0.411 3.713 698 H THR 114 HN THR 114 -0.541 -2.968 10.165 699 HA THR 114 HA THR 114 -0.823 -5.829 10.824 700 HB THR 114 HB THR 114 -0.167 -3.617 12.776 701 HG1 THR 114 HG1 THR 114 1.914 -4.504 12.758 702 H LEU 115 HN LEU 115 -2.830 -6.446 11.139 703 HA LEU 115 HA LEU 115 -4.700 -4.714 12.542 704 HG LEU 115 HG LEU 115 -5.099 -7.104 9.712 705 HB2 LEU 115 HB2 LEU 115 -6.470 -5.205 10.858 706 HB3 LEU 115 HB1 LEU 115 -5.185 -4.165 10.282 707 H GLY 116 HN GLY 116 -5.431 -5.899 14.180 708 HA2 GLY 116 HA2 GLY 116 -6.274 -7.668 15.374 709 HA3 GLY 116 HA1 GLY 116 -6.746 -8.369 13.834 710 H ASP 117 HN ASP 117 -3.545 -7.626 15.191 711 HA ASP 117 HA ASP 117 -1.739 -8.915 15.664 712 HB2 ASP 117 HB2 ASP 117 -3.350 -10.212 17.044 713 HB3 ASP 117 HB1 ASP 117 -3.665 -11.248 15.654 714 H ILE 118 HN ILE 118 -3.313 -8.954 12.833 715 HA ILE 118 HA ILE 118 -1.823 -11.092 11.552 716 HB ILE 118 HB ILE 118 -3.558 -9.011 10.231 717 H VAL 119 HN VAL 119 -0.059 -10.863 10.279 718 HA VAL 119 HA VAL 119 1.060 -8.150 10.050 719 HB VAL 119 HB VAL 119 2.582 -10.755 10.016 720 H TYR 120 HN TYR 120 1.011 -7.303 8.123 721 HA TYR 120 HA TYR 120 1.215 -9.067 5.767 722 HD1 TYR 120 HD1 TYR 120 -1.571 -9.408 4.552 723 HD2 TYR 120 HD2 TYR 120 0.651 -5.946 3.466 724 HE1 TYR 120 HE1 TYR 120 -2.060 -9.843 2.181 725 HE2 TYR 120 HE2 TYR 120 0.166 -6.368 1.094 726 HH TYR 120 HH TYR 120 -2.170 -8.624 0.070 727 HB2 TYR 120 HB2 TYR 120 -0.963 -7.732 6.215 728 HB3 TYR 120 HB1 TYR 120 -0.024 -6.314 5.767 729 H LYS 121 HN LYS 121 3.139 -8.861 4.764 730 HA LYS 121 HA LYS 121 4.434 -6.218 4.771 731 HB2 LYS 121 HB2 LYS 121 5.547 -7.699 6.392 732 HB3 LYS 121 HB1 LYS 121 5.830 -8.875 5.117 733 HG2 LYS 121 HG2 LYS 121 7.239 -7.265 3.940 734 HG3 LYS 121 HG1 LYS 121 6.953 -6.082 5.218 735 HD2 LYS 121 HD2 LYS 121 9.079 -7.115 5.612 736 HD3 LYS 121 HD1 LYS 121 7.950 -7.693 6.838 737 HE2 LYS 121 HE2 LYS 121 7.599 -9.738 5.498 738 HE3 LYS 121 HE1 LYS 121 8.801 -9.163 4.344 739 HZ1 LYS 121 HZ1 LYS 121 9.747 -10.735 5.921 740 HZ2 LYS 121 HZ2 LYS 121 9.307 -9.737 7.214 741 HZ3 LYS 121 HZ3 LYS 121 10.459 -9.209 6.093 742 H ARG 122 HN ARG 122 4.865 -5.474 2.806 743 HA ARG 122 HA ARG 122 4.847 -7.365 0.564 744 HE ARG 122 HE ARG 122 4.287 -2.554 -0.235 745 HB2 ARG 122 HB2 ARG 122 3.264 -5.759 0.064 746 HB3 ARG 122 HB1 ARG 122 4.167 -4.468 0.842 747 HG2 ARG 122 HG2 ARG 122 5.742 -4.444 -1.018 748 HG3 ARG 122 HG1 ARG 122 4.856 -5.762 -1.790 749 HD2 ARG 122 HD2 ARG 122 4.264 -3.583 -2.743 750 HD3 ARG 122 HD1 ARG 122 2.882 -4.354 -1.968 751 HH11 ARG 122 HH11 ARG 122 1.858 -2.792 -2.722 752 HH12 ARG 122 HH12 ARG 122 1.048 -1.337 -2.247 753 HH21 ARG 122 HH21 ARG 122 3.224 -0.640 0.397 754 HH22 ARG 122 HH22 ARG 122 1.822 -0.117 -0.476 755 H VAL 123 HN VAL 123 6.660 -7.872 -0.418 756 HA VAL 123 HA VAL 123 9.051 -6.218 0.028 757 HB VAL 123 HB VAL 123 8.931 -9.065 -0.984 758 H SER 124 HN SER 124 9.709 -4.981 -1.626 759 HA SER 124 HA SER 124 9.147 -5.909 -4.357 760 HG SER 124 HG SER 124 6.943 -4.982 -3.991 761 HB2 SER 124 HB2 SER 124 8.930 -3.037 -3.437 762 HB3 SER 124 HB1 SER 124 8.586 -3.655 -5.052 763 H LYS 125 HN LYS 125 10.662 -5.463 -5.915 764 HA LYS 125 HA LYS 125 13.258 -4.504 -4.916 765 HB2 LYS 125 HB2 LYS 125 14.266 -5.829 -6.726 766 HB3 LYS 125 HB1 LYS 125 13.276 -6.823 -5.675 767 HG2 LYS 125 HG2 LYS 125 11.623 -7.098 -7.236 768 HG3 LYS 125 HG1 LYS 125 12.139 -5.700 -8.170 769 HD2 LYS 125 HD2 LYS 125 13.747 -8.230 -7.878 770 HD3 LYS 125 HD1 LYS 125 12.669 -7.896 -9.233 771 HE2 LYS 125 HE2 LYS 125 13.983 -5.926 -9.808 772 HE3 LYS 125 HE1 LYS 125 15.045 -6.221 -8.432 773 HZ1 LYS 125 HZ1 LYS 125 14.681 -8.051 -10.744 774 HZ2 LYS 125 HZ2 LYS 125 15.723 -8.304 -9.436 775 HZ3 LYS 125 HZ3 LYS 125 16.004 -7.024 -10.505 776 H ARG 126 HN ARG 126 14.508 -3.105 -6.207 777 HA ARG 126 HA ARG 126 13.002 -1.160 -7.636 778 HE ARG 126 HE ARG 126 16.168 2.376 -9.452 779 HB2 ARG 126 HB2 ARG 126 14.974 -0.559 -6.321 780 HB3 ARG 126 HB1 ARG 126 15.992 -1.517 -7.387 781 HG2 ARG 126 HG2 ARG 126 15.388 -0.023 -9.256 782 HG3 ARG 126 HG1 ARG 126 14.458 0.965 -8.127 783 HD2 ARG 126 HD2 ARG 126 16.502 1.367 -6.823 784 HD3 ARG 126 HD1 ARG 126 17.420 0.409 -7.983 785 HH11 ARG 126 HH11 ARG 126 18.435 2.242 -6.808 786 HH12 ARG 126 HH12 ARG 126 19.222 3.723 -7.239 787 HH21 ARG 126 HH21 ARG 126 17.202 4.326 -10.027 788 HH22 ARG 126 HH22 ARG 126 18.523 4.907 -9.070 789 H ILE 127 HN ILE 127 12.810 -0.769 -9.779 790 HA ILE 127 HA ILE 127 14.311 -2.400 -11.684 791 HB ILE 127 HB ILE 127 12.120 -2.737 -12.968 792 H9 OLA 128 HH1 OLA 128 -8.650 -7.794 -5.590 793 H10 OLA 128 HI1 OLA 128 -8.360 -6.624 -3.452 794 H21 OLA 128 HA1 OLA 128 -8.460 -9.179 -13.175 795 H22 OLA 128 HA2 OLA 128 -8.252 -10.845 -12.637 796 H31 OLA 128 HB1 OLA 128 -9.858 -9.487 -10.724 797 H32 OLA 128 HB2 OLA 128 -8.244 -10.172 -10.522 798 H41 OLA 128 HC1 OLA 128 -9.057 -7.409 -10.695 799 H42 OLA 128 HC2 OLA 128 -7.859 -7.794 -11.933 800 H51 OLA 128 HD1 OLA 128 -6.714 -9.008 -9.844 801 H52 OLA 128 HD2 OLA 128 -6.422 -7.315 -10.248 802 H61 OLA 128 HE1 OLA 128 -8.761 -7.836 -8.530 803 H62 OLA 128 HE2 OLA 128 -7.552 -6.552 -8.445 804 H71 OLA 128 HF1 OLA 128 -7.660 -9.116 -7.060 805 H72 OLA 128 HF2 OLA 128 -6.102 -8.807 -7.831 806 H81 OLA 128 HG1 OLA 128 -5.735 -7.784 -5.823 807 H82 OLA 128 HG2 OLA 128 -6.430 -6.429 -6.716 808 H111 OLA 128 HJ1 OLA 128 -5.544 -6.806 -3.610 809 H112 OLA 128 HJ2 OLA 128 -5.958 -5.434 -4.643 810 H121 OLA 128 HK1 OLA 128 -7.515 -5.019 -2.415 811 H122 OLA 128 HK2 OLA 128 -6.025 -5.677 -1.736 812 H131 OLA 128 HL1 OLA 128 -4.973 -3.929 -3.468 813 H132 OLA 128 HL2 OLA 128 -5.398 -3.501 -1.809 814 H141 OLA 128 HM1 OLA 128 -7.714 -3.250 -3.465 815 H142 OLA 128 HM2 OLA 128 -6.375 -2.371 -4.206 816 H151 OLA 128 HN1 OLA 128 -6.640 -1.994 -1.307 817 H152 OLA 128 HN2 OLA 128 -7.990 -1.374 -2.259 818 H161 OLA 128 HP1 OLA 128 -5.616 -0.624 -3.594 819 H162 OLA 128 HP2 OLA 128 -5.390 -0.252 -1.884 820 H171 OLA 128 HQ1 OLA 128 -7.905 0.673 -2.251 821 H172 OLA 128 HQ2 OLA 128 -7.216 0.958 -3.857 822 H181 OLA 128 HR1 OLA 128 -5.493 1.715 -1.600 823 H182 OLA 128 HR2 OLA 128 -5.824 2.564 -3.109 824 H183 OLA 128 HR3 OLA 128 -6.968 2.665 -1.771 825 H9 OLA 129 HH1 OLA 129 -1.552 6.818 0.107 826 H10 OLA 129 HI1 OLA 129 -3.484 5.568 0.961 827 H21 OLA 129 HA1 OLA 129 3.274 1.951 0.408 828 H22 OLA 129 HA2 OLA 129 4.665 2.064 1.484 829 H31 OLA 129 HB1 OLA 129 4.888 4.456 0.854 830 H32 OLA 129 HB2 OLA 129 3.400 4.308 -0.081 831 H41 OLA 129 HC1 OLA 129 3.646 3.766 2.877 832 H42 OLA 129 HC2 OLA 129 2.160 3.738 1.922 833 H51 OLA 129 HD1 OLA 129 2.792 5.854 3.331 834 H52 OLA 129 HD2 OLA 129 3.833 6.209 1.952 835 H61 OLA 129 HE1 OLA 129 1.727 5.783 0.529 836 H62 OLA 129 HE2 OLA 129 1.848 7.304 1.420 837 H71 OLA 129 HF1 OLA 129 0.037 5.000 1.822 838 H72 OLA 129 HF2 OLA 129 0.644 5.789 3.280 839 H81 OLA 129 HG1 OLA 129 -0.991 7.283 3.010 840 H82 OLA 129 HG2 OLA 129 -0.079 7.893 1.629 841 H111 OLA 129 HJ1 OLA 129 -1.902 5.137 3.393 842 H112 OLA 129 HJ2 OLA 129 -3.043 6.468 3.604 843 H121 OLA 129 HK1 OLA 129 -4.613 4.944 4.022 844 H122 OLA 129 HK2 OLA 129 -4.498 4.455 2.329 845 H131 OLA 129 HL1 OLA 129 -3.820 2.967 4.651 846 H132 OLA 129 HL2 OLA 129 -2.337 3.268 3.743 847 H141 OLA 129 HM1 OLA 129 -4.793 2.323 2.324 848 H142 OLA 129 HM2 OLA 129 -3.781 1.172 3.200 849 H151 OLA 129 HN1 OLA 129 -1.970 1.494 1.797 850 H152 OLA 129 HN2 OLA 129 -2.530 3.086 1.275 851 H161 OLA 129 HP1 OLA 129 -4.425 1.936 0.106 852 H162 OLA 129 HP2 OLA 129 -3.645 0.400 0.487 853 H171 OLA 129 HQ1 OLA 129 -3.219 1.683 -1.815 854 H172 OLA 129 HQ2 OLA 129 -1.975 2.468 -0.829 855 H181 OLA 129 HR1 OLA 129 -0.676 0.687 -1.092 856 H182 OLA 129 HR2 OLA 129 -1.941 -0.123 -2.017 857 H183 OLA 129 HR3 OLA 129 -1.881 -0.298 -0.263 Start of MODEL 2 1 HA MET 1 HA MET 1 16.975 11.806 -1.571 2 H1 MET 1 HT1 MET 1 17.471 11.156 0.694 3 H2 MET 1 HT2 MET 1 17.010 9.562 0.361 4 H3 MET 1 HT3 MET 1 15.864 10.804 0.299 5 HB2 MET 1 HB2 MET 1 19.250 11.076 -0.975 6 HB3 MET 1 HB1 MET 1 18.820 9.416 -1.367 7 HG2 MET 1 HG2 MET 1 18.530 9.977 -3.681 8 HG3 MET 1 HG1 MET 1 18.773 11.689 -3.336 9 HE1 MET 1 HE1 MET 1 22.544 11.814 -2.339 10 HE2 MET 1 HE2 MET 1 21.159 11.651 -1.259 11 HE3 MET 1 HE3 MET 1 21.080 12.751 -2.634 12 H ASN 2 HN ASN 2 16.285 8.452 -0.831 13 HA ASN 2 HA ASN 2 15.298 7.915 -3.499 14 HB2 ASN 2 HB2 ASN 2 14.545 5.720 -2.251 15 HB3 ASN 2 HB1 ASN 2 16.233 5.981 -2.671 16 H PHE 3 HN PHE 3 13.366 8.570 -4.122 17 HA PHE 3 HA PHE 3 11.097 8.263 -2.304 18 HD1 PHE 3 HD2 PHE 3 10.303 9.826 -0.484 19 HD2 PHE 3 HD1 PHE 3 13.425 11.888 -2.513 20 HE1 PHE 3 HE2 PHE 3 11.152 10.652 1.672 21 HE2 PHE 3 HE1 PHE 3 14.281 12.717 -0.359 22 HZ PHE 3 HZ PHE 3 13.143 12.100 1.736 23 HB2 PHE 3 HB2 PHE 3 11.796 10.827 -3.746 24 HB3 PHE 3 HB1 PHE 3 10.229 10.514 -3.007 25 H SER 4 HN SER 4 12.155 9.120 -5.584 26 HA SER 4 HA SER 4 9.658 8.017 -6.650 27 HG SER 4 HG SER 4 9.956 11.127 -8.106 28 HB2 SER 4 HB2 SER 4 11.832 9.610 -8.028 29 HB3 SER 4 HB1 SER 4 10.331 9.072 -8.777 30 H GLY 5 HN GLY 5 9.575 6.180 -7.819 31 HA2 GLY 5 HA2 GLY 5 11.516 5.018 -9.382 32 HA3 GLY 5 HA1 GLY 5 11.834 4.421 -7.760 33 H LYS 6 HN LYS 6 11.245 2.631 -9.706 34 HA LYS 6 HA LYS 6 8.433 1.899 -9.218 35 HB2 LYS 6 HB2 LYS 6 9.155 2.243 -11.602 36 HB3 LYS 6 HB1 LYS 6 10.241 0.873 -11.410 37 HG2 LYS 6 HG2 LYS 6 8.198 -0.483 -10.780 38 HG3 LYS 6 HG1 LYS 6 7.239 0.884 -11.349 39 HD2 LYS 6 HD2 LYS 6 9.218 -0.726 -12.963 40 HD3 LYS 6 HD1 LYS 6 7.461 -0.768 -13.110 41 HE2 LYS 6 HE2 LYS 6 9.304 1.524 -13.749 42 HE3 LYS 6 HE1 LYS 6 8.329 0.587 -14.880 43 HZ1 LYS 6 HZ1 LYS 6 6.335 1.459 -13.816 44 HZ2 LYS 6 HZ2 LYS 6 7.303 2.713 -14.409 45 HZ3 LYS 6 HZ3 LYS 6 7.279 2.373 -12.753 46 H TYR 7 HN TYR 7 8.006 0.142 -8.047 47 HA TYR 7 HA TYR 7 10.191 -1.769 -7.550 48 HD1 TYR 7 HD2 TYR 7 11.482 -0.097 -6.172 49 HD2 TYR 7 HD1 TYR 7 7.623 0.757 -4.600 50 HE1 TYR 7 HE2 TYR 7 12.251 2.147 -5.521 51 HE2 TYR 7 HE1 TYR 7 8.382 3.001 -3.947 52 HH TYR 7 HH TYR 7 11.293 4.357 -5.049 53 HB2 TYR 7 HB2 TYR 7 7.986 -1.298 -5.568 54 HB3 TYR 7 HB1 TYR 7 9.605 -1.935 -5.295 55 H GLN 8 HN GLN 8 9.715 -3.935 -7.626 56 HA GLN 8 HA GLN 8 6.997 -4.622 -8.535 57 HB2 GLN 8 HB2 GLN 8 8.748 -4.864 -10.272 58 HB3 GLN 8 HB1 GLN 8 9.595 -6.002 -9.233 59 HG2 GLN 8 HG2 GLN 8 8.346 -7.180 -10.926 60 HG3 GLN 8 HG1 GLN 8 7.674 -7.514 -9.332 61 H VAL 9 HN VAL 9 5.878 -6.007 -7.326 62 HA VAL 9 HA VAL 9 6.943 -7.061 -4.909 63 HB VAL 9 HB VAL 9 4.364 -7.846 -6.275 64 H GLN 10 HN GLN 10 7.585 -9.122 -4.385 65 HA GLN 10 HA GLN 10 7.624 -11.101 -6.555 66 HB2 GLN 10 HB2 GLN 10 9.852 -10.290 -4.703 67 HB3 GLN 10 HB1 GLN 10 9.860 -11.802 -5.586 68 HG2 GLN 10 HG2 GLN 10 9.816 -10.622 -7.691 69 HG3 GLN 10 HG1 GLN 10 9.686 -9.081 -6.847 70 H SER 11 HN SER 11 7.003 -10.406 -3.259 71 HA SER 11 HA SER 11 5.877 -12.983 -2.808 72 HG SER 11 HG SER 11 7.261 -14.806 -1.034 73 HB2 SER 11 HB2 SER 11 8.211 -13.620 -2.496 74 HB3 SER 11 HB1 SER 11 8.423 -12.330 -1.315 75 H GLN 12 HN GLN 12 4.942 -13.215 -0.643 76 HA GLN 12 HA GLN 12 4.738 -10.773 0.936 77 HB2 GLN 12 HB2 GLN 12 2.919 -10.942 -0.933 78 HB3 GLN 12 HB1 GLN 12 2.192 -12.141 0.126 79 HG2 GLN 12 HG2 GLN 12 2.902 -9.388 1.076 80 HG3 GLN 12 HG1 GLN 12 1.355 -9.757 0.317 81 H GLU 13 HN GLU 13 3.848 -11.129 3.065 82 HA GLU 13 HA GLU 13 4.056 -13.943 3.915 83 HB2 GLU 13 HB2 GLU 13 4.439 -11.424 5.544 84 HB3 GLU 13 HB1 GLU 13 4.633 -13.069 6.134 85 HG2 GLU 13 HG2 GLU 13 6.283 -11.807 3.957 86 HG3 GLU 13 HG1 GLU 13 6.772 -11.968 5.643 87 H ASN 14 HN ASN 14 2.342 -14.934 4.795 88 HA ASN 14 HA ASN 14 0.270 -15.335 5.638 89 HB2 ASN 14 HB2 ASN 14 0.607 -12.505 6.625 90 HB3 ASN 14 HB1 ASN 14 -0.832 -13.459 6.968 91 H PHE 15 HN PHE 15 -1.347 -15.675 4.276 92 HA PHE 15 HA PHE 15 -2.364 -13.397 2.707 93 HD1 PHE 15 HD2 PHE 15 -0.403 -17.147 2.433 94 HD2 PHE 15 HD1 PHE 15 -0.675 -13.613 0.079 95 HE1 PHE 15 HE2 PHE 15 1.976 -17.363 1.844 96 HE2 PHE 15 HE1 PHE 15 1.703 -13.824 -0.517 97 HZ PHE 15 HZ PHE 15 3.032 -15.701 0.366 98 HB2 PHE 15 HB2 PHE 15 -2.545 -16.242 1.773 99 HB3 PHE 15 HB1 PHE 15 -2.658 -14.766 0.827 100 H GLU 16 HN GLU 16 -3.364 -16.712 3.534 101 HA GLU 16 HA GLU 16 -6.104 -16.316 3.335 102 HB2 GLU 16 HB2 GLU 16 -4.722 -18.259 5.190 103 HB3 GLU 16 HB1 GLU 16 -6.357 -18.387 4.558 104 HG2 GLU 16 HG2 GLU 16 -5.474 -18.628 2.298 105 HG3 GLU 16 HG1 GLU 16 -3.832 -18.488 2.923 106 HA PRO 17 HA PRO 17 -6.089 -15.661 8.243 107 HB2 PRO 17 HB2 PRO 17 -3.654 -13.943 8.266 108 HB3 PRO 17 HB1 PRO 17 -4.269 -15.039 9.506 109 HG2 PRO 17 HG2 PRO 17 -2.189 -15.735 8.004 110 HG3 PRO 17 HG1 PRO 17 -3.429 -16.926 8.445 111 HD2 PRO 17 HD2 PRO 17 -2.974 -15.528 5.848 112 HD3 PRO 17 HD1 PRO 17 -3.530 -17.184 6.158 113 H PHE 18 HN PHE 18 -4.678 -13.205 6.083 114 HA PHE 18 HA PHE 18 -5.875 -10.956 7.198 115 HD1 PHE 18 HD1 PHE 18 -4.115 -8.684 6.511 116 HD2 PHE 18 HD2 PHE 18 -6.780 -9.822 3.395 117 HE1 PHE 18 HE1 PHE 18 -4.662 -6.318 6.119 118 HE2 PHE 18 HE2 PHE 18 -7.330 -7.459 2.997 119 HZ PHE 18 HZ PHE 18 -6.272 -5.702 4.358 120 HB2 PHE 18 HB2 PHE 18 -4.038 -10.908 5.536 121 HB3 PHE 18 HB1 PHE 18 -5.186 -11.389 4.286 122 H MET 19 HN MET 19 -7.072 -12.893 4.418 123 HA MET 19 HA MET 19 -9.395 -11.375 3.996 124 HB2 MET 19 HB2 MET 19 -10.277 -13.475 2.882 125 HB3 MET 19 HB1 MET 19 -8.796 -12.805 2.243 126 HG2 MET 19 HG2 MET 19 -8.396 -15.065 2.258 127 HG3 MET 19 HG1 MET 19 -7.625 -14.517 3.742 128 HE1 MET 19 HE1 MET 19 -11.531 -14.670 3.545 129 HE2 MET 19 HE2 MET 19 -11.859 -16.368 3.884 130 HE3 MET 19 HE3 MET 19 -11.089 -15.905 2.369 131 H LYS 20 HN LYS 20 -8.794 -14.054 6.204 132 HA LYS 20 HA LYS 20 -11.449 -14.636 6.888 133 HB2 LYS 20 HB2 LYS 20 -9.016 -14.800 8.664 134 HB3 LYS 20 HB1 LYS 20 -10.526 -15.676 8.886 135 HG2 LYS 20 HG2 LYS 20 -10.107 -16.853 6.755 136 HG3 LYS 20 HG1 LYS 20 -8.564 -16.013 6.634 137 HD2 LYS 20 HD2 LYS 20 -7.931 -16.996 8.840 138 HD3 LYS 20 HD1 LYS 20 -9.407 -17.960 8.774 139 HE2 LYS 20 HE2 LYS 20 -7.220 -18.011 6.699 140 HE3 LYS 20 HE1 LYS 20 -7.394 -19.184 8.004 141 HZ1 LYS 20 HZ1 LYS 20 -9.528 -19.833 7.115 142 HZ2 LYS 20 HZ2 LYS 20 -8.343 -19.980 5.917 143 HZ3 LYS 20 HZ3 LYS 20 -9.414 -18.671 5.889 144 H ALA 21 HN ALA 21 -9.159 -12.357 8.387 145 HA ALA 21 HA ALA 21 -10.979 -11.537 10.425 146 HB1 ALA 21 HB1 ALA 21 -8.468 -10.187 9.455 147 HB2 ALA 21 HB2 ALA 21 -8.564 -11.402 10.729 148 HB3 ALA 21 HB3 ALA 21 -9.331 -9.829 10.952 149 H MET 22 HN MET 22 -9.473 -9.400 8.062 150 HA MET 22 HA MET 22 -11.167 -7.284 8.177 151 HB2 MET 22 HB2 MET 22 -9.185 -7.062 6.927 152 HB3 MET 22 HB1 MET 22 -9.586 -8.419 5.886 153 HG2 MET 22 HG2 MET 22 -9.787 -6.300 4.718 154 HG3 MET 22 HG1 MET 22 -11.340 -7.124 4.832 155 HE1 MET 22 HE1 MET 22 -10.136 -3.502 7.431 156 HE2 MET 22 HE2 MET 22 -9.121 -4.166 6.151 157 HE3 MET 22 HE3 MET 22 -9.422 -5.105 7.613 158 H GLY 23 HN GLY 23 -11.882 -10.354 6.737 159 HA2 GLY 23 HA2 GLY 23 -14.079 -11.055 6.207 160 HA3 GLY 23 HA1 GLY 23 -14.555 -9.365 6.061 161 H LEU 24 HN LEU 24 -11.629 -9.954 4.592 162 HA LEU 24 HA LEU 24 -12.645 -9.496 1.956 163 HG LEU 24 HG LEU 24 -10.222 -10.139 0.309 164 HB2 LEU 24 HB2 LEU 24 -10.435 -8.703 2.956 165 HB3 LEU 24 HB1 LEU 24 -9.864 -10.344 2.779 166 HA PRO 25 HA PRO 25 -13.071 -13.806 0.854 167 HB2 PRO 25 HB2 PRO 25 -13.103 -13.638 -1.821 168 HB3 PRO 25 HB1 PRO 25 -14.424 -12.977 -0.845 169 HG2 PRO 25 HG2 PRO 25 -12.057 -11.553 -2.021 170 HG3 PRO 25 HG1 PRO 25 -13.771 -11.103 -2.107 171 HD2 PRO 25 HD2 PRO 25 -12.085 -10.003 -0.334 172 HD3 PRO 25 HD1 PRO 25 -13.788 -10.296 0.056 173 H GLU 26 HN GLU 26 -11.568 -15.366 0.880 174 HA GLU 26 HA GLU 26 -8.857 -15.024 0.518 175 HB2 GLU 26 HB2 GLU 26 -9.869 -16.972 1.647 176 HB3 GLU 26 HB1 GLU 26 -10.423 -17.577 0.092 177 HG2 GLU 26 HG2 GLU 26 -8.128 -17.835 -0.648 178 HG3 GLU 26 HG1 GLU 26 -7.545 -17.171 0.878 179 H ASP 27 HN ASP 27 -11.315 -15.535 -1.876 180 HA ASP 27 HA ASP 27 -9.759 -16.520 -3.985 181 HB2 ASP 27 HB2 ASP 27 -12.241 -14.797 -3.988 182 HB3 ASP 27 HB1 ASP 27 -11.530 -15.467 -5.454 183 H LEU 28 HN LEU 28 -10.518 -13.168 -3.066 184 HA LEU 28 HA LEU 28 -9.075 -11.965 -5.176 185 HG LEU 28 HG LEU 28 -10.461 -9.861 -5.368 186 HB2 LEU 28 HB2 LEU 28 -10.226 -11.035 -2.594 187 HB3 LEU 28 HB1 LEU 28 -9.057 -10.001 -3.392 188 H ILE 29 HN ILE 29 -8.182 -12.826 -1.861 189 HA ILE 29 HA ILE 29 -5.650 -11.597 -1.868 190 HB ILE 29 HB ILE 29 -6.758 -13.881 -0.253 191 H GLN 30 HN GLN 30 -6.646 -14.915 -2.642 192 HA GLN 30 HA GLN 30 -4.070 -15.915 -3.172 193 HB2 GLN 30 HB2 GLN 30 -6.777 -16.797 -4.180 194 HB3 GLN 30 HB1 GLN 30 -5.291 -17.698 -4.450 195 HG2 GLN 30 HG2 GLN 30 -6.446 -17.027 -1.751 196 HG3 GLN 30 HG1 GLN 30 -6.615 -18.577 -2.581 197 H LYS 31 HN LYS 31 -6.463 -14.331 -5.219 198 HA LYS 31 HA LYS 31 -5.103 -14.747 -7.671 199 HB2 LYS 31 HB2 LYS 31 -7.188 -12.746 -6.808 200 HB3 LYS 31 HB1 LYS 31 -6.544 -12.796 -8.443 201 HG2 LYS 31 HG2 LYS 31 -7.436 -14.953 -8.829 202 HG3 LYS 31 HG1 LYS 31 -7.826 -15.170 -7.121 203 HD2 LYS 31 HD2 LYS 31 -9.518 -13.464 -7.237 204 HD3 LYS 31 HD1 LYS 31 -9.056 -13.060 -8.892 205 HE2 LYS 31 HE2 LYS 31 -10.190 -15.699 -7.970 206 HE3 LYS 31 HE1 LYS 31 -11.081 -14.438 -8.820 207 HZ1 LYS 31 HZ1 LYS 31 -9.590 -14.710 -10.704 208 HZ2 LYS 31 HZ2 LYS 31 -10.358 -16.171 -10.331 209 HZ3 LYS 31 HZ3 LYS 31 -8.744 -15.926 -9.888 210 H GLY 32 HN GLY 32 -4.871 -12.346 -5.148 211 HA2 GLY 32 HA2 GLY 32 -3.347 -10.454 -6.652 212 HA3 GLY 32 HA1 GLY 32 -3.548 -10.479 -4.907 213 H LYS 33 HN LYS 33 -2.456 -12.847 -4.168 214 HA LYS 33 HA LYS 33 0.291 -12.305 -4.170 215 HB2 LYS 33 HB2 LYS 33 0.558 -14.478 -3.095 216 HB3 LYS 33 HB1 LYS 33 -0.820 -13.619 -2.421 217 HG2 LYS 33 HG2 LYS 33 -2.347 -14.975 -3.716 218 HG3 LYS 33 HG1 LYS 33 -0.994 -15.788 -4.504 219 HD2 LYS 33 HD2 LYS 33 -1.532 -15.839 -1.535 220 HD3 LYS 33 HD1 LYS 33 -2.017 -17.107 -2.661 221 HE2 LYS 33 HE2 LYS 33 0.354 -17.416 -3.281 222 HE3 LYS 33 HE1 LYS 33 0.802 -16.206 -2.079 223 HZ1 LYS 33 HZ1 LYS 33 -0.553 -18.791 -1.527 224 HZ2 LYS 33 HZ2 LYS 33 -0.168 -17.624 -0.364 225 HZ3 LYS 33 HZ3 LYS 33 1.065 -18.427 -1.197 226 H ASP 34 HN ASP 34 -1.683 -14.196 -6.326 227 HA ASP 34 HA ASP 34 0.408 -15.690 -7.530 228 HB2 ASP 34 HB2 ASP 34 -1.938 -16.375 -7.703 229 HB3 ASP 34 HB1 ASP 34 -2.305 -14.921 -8.626 230 H ILE 35 HN ILE 35 -1.256 -12.695 -8.469 231 HA ILE 35 HA ILE 35 0.600 -12.293 -10.671 232 HB ILE 35 HB ILE 35 -1.628 -10.477 -9.750 233 H LYS 36 HN LYS 36 2.462 -11.251 -10.414 234 HA LYS 36 HA LYS 36 3.291 -10.035 -8.030 235 HB2 LYS 36 HB2 LYS 36 4.386 -9.504 -10.800 236 HB3 LYS 36 HB1 LYS 36 5.225 -9.269 -9.273 237 HG2 LYS 36 HG2 LYS 36 4.288 -11.931 -10.322 238 HG3 LYS 36 HG1 LYS 36 5.930 -11.303 -10.477 239 HD2 LYS 36 HD2 LYS 36 6.138 -11.231 -8.044 240 HD3 LYS 36 HD1 LYS 36 4.485 -11.826 -7.878 241 HE2 LYS 36 HE2 LYS 36 6.778 -13.294 -9.175 242 HE3 LYS 36 HE1 LYS 36 6.112 -13.623 -7.576 243 HZ1 LYS 36 HZ1 LYS 36 5.251 -15.161 -9.227 244 HZ2 LYS 36 HZ2 LYS 36 4.644 -13.876 -10.146 245 HZ3 LYS 36 HZ3 LYS 36 4.004 -14.193 -8.613 246 H GLY 37 HN GLY 37 2.761 -8.151 -7.163 247 HA2 GLY 37 HA2 GLY 37 1.116 -6.277 -8.560 248 HA3 GLY 37 HA1 GLY 37 1.740 -6.099 -6.928 249 H VAL 38 HN VAL 38 1.540 -4.016 -8.794 250 HA VAL 38 HA VAL 38 4.388 -3.405 -9.249 251 HB VAL 38 HB VAL 38 2.091 -2.307 -10.873 252 H SER 39 HN SER 39 5.133 -1.492 -8.456 253 HA SER 39 HA SER 39 3.172 0.416 -7.397 254 HG SER 39 HG SER 39 6.495 -0.181 -6.249 255 HB2 SER 39 HB2 SER 39 4.528 0.679 -5.340 256 HB3 SER 39 HB1 SER 39 3.865 -0.948 -5.502 257 H GLU 40 HN GLU 40 3.607 2.470 -7.849 258 HA GLU 40 HA GLU 40 6.355 3.238 -8.545 259 HB2 GLU 40 HB2 GLU 40 5.102 2.847 -10.641 260 HB3 GLU 40 HB1 GLU 40 3.888 4.002 -10.116 261 HG2 GLU 40 HG2 GLU 40 5.438 5.798 -10.226 262 HG3 GLU 40 HG1 GLU 40 6.779 4.696 -10.538 263 H ILE 41 HN ILE 41 6.995 5.009 -7.473 264 HA ILE 41 HA ILE 41 4.904 6.700 -6.269 265 HB ILE 41 HB ILE 41 7.732 6.316 -5.281 266 H VAL 42 HN VAL 42 4.751 8.711 -6.936 267 HA VAL 42 HA VAL 42 7.000 9.916 -8.400 268 HB VAL 42 HB VAL 42 4.095 10.763 -8.392 269 H HIS 43 HN HIS 43 8.186 11.270 -7.210 270 HA HIS 43 HA HIS 43 6.928 12.605 -4.926 271 HD1 HIS 43 HD1 HIS 43 11.158 14.044 -5.107 272 HD2 HIS 43 HD2 HIS 43 8.263 13.347 -2.209 273 HE1 HIS 43 HE1 HIS 43 11.608 15.725 -3.290 274 HE2 HIS 43 HE2 HIS 43 9.836 15.292 -1.552 275 HB2 HIS 43 HB2 HIS 43 8.836 11.361 -4.258 276 HB3 HIS 43 HB1 HIS 43 9.805 11.991 -5.583 277 H GLU 44 HN GLU 44 6.294 14.608 -5.176 278 HA GLU 44 HA GLU 44 7.960 16.477 -6.703 279 HB2 GLU 44 HB2 GLU 44 5.995 15.621 -8.076 280 HB3 GLU 44 HB1 GLU 44 4.947 16.439 -6.927 281 HG2 GLU 44 HG2 GLU 44 7.069 17.803 -8.562 282 HG3 GLU 44 HG1 GLU 44 5.365 17.707 -8.999 283 H GLY 45 HN GLY 45 8.662 17.683 -5.008 284 HA2 GLY 45 HA2 GLY 45 8.603 19.153 -3.242 285 HA3 GLY 45 HA1 GLY 45 6.999 19.589 -3.814 286 H LYS 46 HN LYS 46 5.244 18.945 -2.680 287 HA LYS 46 HA LYS 46 5.723 17.147 -0.397 288 HB2 LYS 46 HB2 LYS 46 3.907 18.372 0.775 289 HB3 LYS 46 HB1 LYS 46 5.306 19.373 0.424 290 HG2 LYS 46 HG2 LYS 46 4.134 20.342 -1.492 291 HG3 LYS 46 HG1 LYS 46 2.727 19.340 -1.130 292 HD2 LYS 46 HD2 LYS 46 2.510 20.425 1.049 293 HD3 LYS 46 HD1 LYS 46 3.932 21.413 0.704 294 HE2 LYS 46 HE2 LYS 46 2.773 22.431 -1.187 295 HE3 LYS 46 HE1 LYS 46 1.358 21.427 -0.867 296 HZ1 LYS 46 HZ1 LYS 46 2.487 23.442 1.001 297 HZ2 LYS 46 HZ2 LYS 46 1.105 22.506 1.270 298 HZ3 LYS 46 HZ3 LYS 46 1.113 23.664 0.036 299 H LYS 47 HN LYS 47 4.146 17.532 -3.303 300 HA LYS 47 HA LYS 47 1.849 15.872 -2.587 301 HB2 LYS 47 HB2 LYS 47 2.580 17.186 -5.211 302 HB3 LYS 47 HB1 LYS 47 1.085 16.319 -4.886 303 HG2 LYS 47 HG2 LYS 47 0.493 17.976 -3.191 304 HG3 LYS 47 HG1 LYS 47 1.992 18.842 -3.522 305 HD2 LYS 47 HD2 LYS 47 1.296 19.365 -5.729 306 HD3 LYS 47 HD1 LYS 47 -0.105 18.296 -5.610 307 HE2 LYS 47 HE2 LYS 47 -0.733 20.655 -5.369 308 HE3 LYS 47 HE1 LYS 47 -1.077 19.732 -3.907 309 HZ1 LYS 47 HZ1 LYS 47 0.966 20.595 -2.934 310 HZ2 LYS 47 HZ2 LYS 47 -0.070 21.855 -3.380 311 HZ3 LYS 47 HZ3 LYS 47 1.279 21.493 -4.334 312 H VAL 48 HN VAL 48 2.205 13.749 -2.554 313 HA VAL 48 HA VAL 48 3.962 12.592 -4.620 314 HB VAL 48 HB VAL 48 3.365 11.528 -1.855 315 H LYS 49 HN LYS 49 3.164 11.066 -5.940 316 HA LYS 49 HA LYS 49 0.402 10.163 -5.456 317 HB2 LYS 49 HB2 LYS 49 1.893 10.526 -8.059 318 HB3 LYS 49 HB1 LYS 49 0.278 9.844 -7.922 319 HG2 LYS 49 HG2 LYS 49 -0.524 11.954 -6.971 320 HG3 LYS 49 HG1 LYS 49 1.094 12.636 -7.146 321 HD2 LYS 49 HD2 LYS 49 0.980 12.371 -9.553 322 HD3 LYS 49 HD1 LYS 49 -0.591 11.577 -9.414 323 HE2 LYS 49 HE2 LYS 49 -0.872 13.895 -10.078 324 HE3 LYS 49 HE1 LYS 49 -1.535 13.633 -8.466 325 HZ1 LYS 49 HZ1 LYS 49 0.462 14.590 -7.518 326 HZ2 LYS 49 HZ2 LYS 49 -0.254 15.682 -8.593 327 HZ3 LYS 49 HZ3 LYS 49 1.123 14.818 -9.058 328 H LEU 50 HN LEU 50 -0.024 8.034 -5.344 329 HA LEU 50 HA LEU 50 2.200 6.178 -5.898 330 HG LEU 50 HG LEU 50 3.013 5.097 -3.853 331 HB2 LEU 50 HB2 LEU 50 1.078 6.595 -3.484 332 HB3 LEU 50 HB1 LEU 50 0.012 5.340 -4.086 333 H THR 51 HN THR 51 1.870 4.691 -7.429 334 HA THR 51 HA THR 51 -0.908 4.158 -8.261 335 HB THR 51 HB THR 51 1.546 4.102 -10.029 336 HG1 THR 51 HG1 THR 51 1.160 6.218 -9.833 337 H ILE 52 HN ILE 52 -1.579 2.127 -8.143 338 HA ILE 52 HA ILE 52 0.415 -0.040 -8.065 339 HB ILE 52 HB ILE 52 -2.141 0.072 -6.455 340 H THR 53 HN THR 53 0.025 -1.730 -9.407 341 HA THR 53 HA THR 53 -2.576 -1.753 -10.794 342 HB THR 53 HB THR 53 0.095 -2.622 -11.917 343 HG1 THR 53 HG1 THR 53 -0.003 -0.721 -13.092 344 H TYR 54 HN TYR 54 -3.736 -3.563 -10.730 345 HA TYR 54 HA TYR 54 -2.426 -6.034 -9.809 346 HD1 TYR 54 HD2 TYR 54 -2.384 -6.861 -7.527 347 HD2 TYR 54 HD1 TYR 54 -4.969 -3.487 -7.366 348 HE1 TYR 54 HE2 TYR 54 -1.420 -6.236 -5.357 349 HE2 TYR 54 HE1 TYR 54 -4.010 -2.851 -5.192 350 HH TYR 54 HH TYR 54 -2.823 -3.914 -3.319 351 HB2 TYR 54 HB2 TYR 54 -5.163 -4.950 -9.138 352 HB3 TYR 54 HB1 TYR 54 -4.703 -6.625 -8.850 353 H GLY 55 HN GLY 55 -2.243 -7.323 -11.533 354 HA2 GLY 55 HA2 GLY 55 -2.881 -8.674 -13.282 355 HA3 GLY 55 HA1 GLY 55 -4.549 -8.330 -12.849 356 H SER 56 HN SER 56 -5.558 -6.438 -13.729 357 HA SER 56 HA SER 56 -4.165 -5.184 -15.980 358 HG SER 56 HG SER 56 -7.259 -7.554 -16.114 359 HB2 SER 56 HB2 SER 56 -6.131 -5.519 -17.442 360 HB3 SER 56 HB1 SER 56 -5.411 -7.052 -16.950 361 H LYS 57 HN LYS 57 -5.390 -4.541 -13.197 362 HA LYS 57 HA LYS 57 -7.056 -2.273 -14.055 363 HB2 LYS 57 HB2 LYS 57 -8.246 -3.713 -12.545 364 HB3 LYS 57 HB1 LYS 57 -6.905 -3.709 -11.408 365 HG2 LYS 57 HG2 LYS 57 -7.261 -1.285 -11.051 366 HG3 LYS 57 HG1 LYS 57 -8.666 -1.368 -12.116 367 HD2 LYS 57 HD2 LYS 57 -8.491 -3.258 -9.825 368 HD3 LYS 57 HD1 LYS 57 -8.923 -1.577 -9.503 369 HE2 LYS 57 HE2 LYS 57 -10.909 -2.974 -9.813 370 HE3 LYS 57 HE1 LYS 57 -10.782 -1.743 -11.067 371 HZ1 LYS 57 HZ1 LYS 57 -9.945 -3.381 -12.591 372 HZ2 LYS 57 HZ2 LYS 57 -11.405 -3.935 -11.939 373 HZ3 LYS 57 HZ3 LYS 57 -9.938 -4.571 -11.388 374 H VAL 58 HN VAL 58 -6.335 -0.262 -13.775 375 HA VAL 58 HA VAL 58 -3.783 0.106 -12.400 376 HB VAL 58 HB VAL 58 -4.009 0.905 -14.732 377 H ILE 59 HN ILE 59 -3.604 1.216 -10.549 378 HA ILE 59 HA ILE 59 -5.978 2.670 -9.581 379 HB ILE 59 HB ILE 59 -3.977 1.144 -7.908 380 H HIS 60 HN HIS 60 -5.617 4.775 -9.512 381 HA HIS 60 HA HIS 60 -2.879 5.722 -8.959 382 HD1 HIS 60 HD1 HIS 60 -4.767 9.410 -9.388 383 HD2 HIS 60 HD2 HIS 60 -1.295 7.797 -10.999 384 HE1 HIS 60 HE1 HIS 60 -3.106 11.298 -9.431 385 HE2 HIS 60 HE2 HIS 60 -0.992 10.282 -10.352 386 HB2 HIS 60 HB2 HIS 60 -3.678 6.331 -11.192 387 HB3 HIS 60 HB1 HIS 60 -5.096 7.100 -10.489 388 H ASN 61 HN ASN 61 -2.531 6.881 -7.177 389 HA ASN 61 HA ASN 61 -4.796 8.229 -5.880 390 HB2 ASN 61 HB2 ASN 61 -2.782 6.448 -4.486 391 HB3 ASN 61 HB1 ASN 61 -3.965 7.460 -3.667 392 H GLU 62 HN GLU 62 -4.115 9.863 -4.292 393 HA GLU 62 HA GLU 62 -1.375 10.825 -4.553 394 HB2 GLU 62 HB2 GLU 62 -2.236 13.155 -4.988 395 HB3 GLU 62 HB1 GLU 62 -2.400 12.033 -6.331 396 HG2 GLU 62 HG2 GLU 62 -4.728 11.760 -5.915 397 HG3 GLU 62 HG1 GLU 62 -4.619 12.663 -4.404 398 H PHE 63 HN PHE 63 -0.642 11.904 -2.766 399 HA PHE 63 HA PHE 63 -2.526 12.733 -0.714 400 HD1 PHE 63 HD2 PHE 63 1.321 11.378 0.267 401 HD2 PHE 63 HD1 PHE 63 -1.641 8.738 -1.275 402 HE1 PHE 63 HE2 PHE 63 3.089 9.845 -0.495 403 HE2 PHE 63 HE1 PHE 63 0.122 7.203 -2.038 404 HZ PHE 63 HZ PHE 63 2.490 7.755 -1.649 405 HB2 PHE 63 HB2 PHE 63 -1.103 11.434 1.004 406 HB3 PHE 63 HB1 PHE 63 -2.285 10.540 0.056 407 H THR 64 HN THR 64 -1.638 14.113 0.868 408 HA THR 64 HA THR 64 0.855 15.404 0.009 409 HB THR 64 HB THR 64 -1.290 16.489 1.846 410 HG1 THR 64 HG1 THR 64 -2.151 17.418 0.094 411 H LEU 65 HN LEU 65 2.614 15.373 1.252 412 HA LEU 65 HA LEU 65 2.728 13.737 3.565 413 HG LEU 65 HG LEU 65 4.146 13.939 0.852 414 HB2 LEU 65 HB2 LEU 65 4.768 15.710 2.542 415 HB3 LEU 65 HB1 LEU 65 5.065 14.413 3.683 416 H GLY 66 HN GLY 66 2.745 14.235 5.697 417 HA2 GLY 66 HA2 GLY 66 2.685 15.488 7.628 418 HA3 GLY 66 HA1 GLY 66 3.191 16.880 6.685 419 H GLU 67 HN GLU 67 0.404 15.310 5.483 420 HA GLU 67 HA GLU 67 -1.420 16.975 7.032 421 HB2 GLU 67 HB2 GLU 67 -0.984 17.254 4.067 422 HB3 GLU 67 HB1 GLU 67 -2.483 17.753 4.836 423 HG2 GLU 67 HG2 GLU 67 0.231 18.785 5.614 424 HG3 GLU 67 HG1 GLU 67 -0.843 19.583 4.468 425 H GLU 68 HN GLU 68 -3.533 16.264 7.061 426 HA GLU 68 HA GLU 68 -3.938 13.501 6.398 427 HB2 GLU 68 HB2 GLU 68 -4.885 14.549 8.441 428 HB3 GLU 68 HB1 GLU 68 -5.917 15.545 7.429 429 HG2 GLU 68 HG2 GLU 68 -7.053 13.578 6.594 430 HG3 GLU 68 HG1 GLU 68 -5.980 12.538 7.530 431 H CYS 69 HN CYS 69 -4.593 12.770 4.487 432 HA CYS 69 HA CYS 69 -6.211 14.549 2.784 433 HG CYS 69 HG CYS 69 -3.635 15.064 0.169 434 HB2 CYS 69 HB2 CYS 69 -4.036 12.600 2.053 435 HB3 CYS 69 HB1 CYS 69 -5.214 13.158 0.869 436 H GLU 70 HN GLU 70 -7.850 13.602 1.512 437 HA GLU 70 HA GLU 70 -8.902 11.134 2.681 438 HB2 GLU 70 HB2 GLU 70 -10.334 13.161 2.663 439 HB3 GLU 70 HB1 GLU 70 -10.284 13.150 0.907 440 HG2 GLU 70 HG2 GLU 70 -11.386 10.973 0.885 441 HG3 GLU 70 HG1 GLU 70 -11.435 10.982 2.647 442 H LEU 71 HN LEU 71 -8.662 9.294 1.632 443 HA LEU 71 HA LEU 71 -8.424 9.349 -1.302 444 HG LEU 71 HG LEU 71 -7.465 6.522 -1.765 445 HB2 LEU 71 HB2 LEU 71 -6.325 8.746 -0.065 446 HB3 LEU 71 HB1 LEU 71 -7.164 7.336 0.559 447 H GLU 72 HN GLU 72 -9.446 7.738 -2.475 448 HA GLU 72 HA GLU 72 -11.762 6.603 -1.160 449 HB2 GLU 72 HB2 GLU 72 -11.648 7.725 -3.503 450 HB3 GLU 72 HB1 GLU 72 -11.047 6.162 -4.042 451 HG2 GLU 72 HG2 GLU 72 -13.071 5.091 -3.189 452 HG3 GLU 72 HG1 GLU 72 -13.672 6.665 -2.665 453 H THR 73 HN THR 73 -11.904 4.599 -0.427 454 HA THR 73 HA THR 73 -9.718 2.771 -0.673 455 HB THR 73 HB THR 73 -11.073 1.250 0.690 456 HG1 THR 73 HG1 THR 73 -13.096 2.981 -0.124 457 H MET 74 HN MET 74 -10.216 0.409 -1.195 458 HA MET 74 HA MET 74 -10.991 0.231 -3.908 459 HB2 MET 74 HB2 MET 74 -10.573 -2.143 -3.704 460 HB3 MET 74 HB1 MET 74 -9.316 -1.256 -2.854 461 HG2 MET 74 HG2 MET 74 -11.709 -2.446 -1.482 462 HG3 MET 74 HG1 MET 74 -10.187 -3.304 -1.701 463 HE1 MET 74 HE1 MET 74 -11.535 -2.867 1.153 464 HE2 MET 74 HE2 MET 74 -10.119 -2.434 2.111 465 HE3 MET 74 HE3 MET 74 -10.009 -3.715 0.903 466 H THR 75 HN THR 75 -12.804 0.258 -1.064 467 HA THR 75 HA THR 75 -14.999 -1.326 -2.156 468 HB THR 75 HB THR 75 -16.087 -1.044 -0.013 469 HG1 THR 75 HG1 THR 75 -15.102 0.251 1.606 470 H GLY 76 HN GLY 76 -13.995 1.947 -1.859 471 HA2 GLY 76 HA2 GLY 76 -15.053 3.618 -3.242 472 HA3 GLY 76 HA1 GLY 76 -16.589 2.811 -2.957 473 H GLU 77 HN GLU 77 -14.832 2.880 -0.129 474 HA GLU 77 HA GLU 77 -16.514 5.003 0.939 475 HB2 GLU 77 HB2 GLU 77 -16.361 2.892 2.168 476 HB3 GLU 77 HB1 GLU 77 -14.619 3.086 2.312 477 HG2 GLU 77 HG2 GLU 77 -14.953 5.092 3.664 478 HG3 GLU 77 HG1 GLU 77 -16.700 4.895 3.521 479 H LYS 78 HN LYS 78 -15.776 6.902 1.809 480 HA LYS 78 HA LYS 78 -13.127 7.739 0.974 481 HB2 LYS 78 HB2 LYS 78 -15.364 9.279 2.305 482 HB3 LYS 78 HB1 LYS 78 -13.867 9.982 1.709 483 HG2 LYS 78 HG2 LYS 78 -15.882 8.545 -0.003 484 HG3 LYS 78 HG1 LYS 78 -15.777 10.296 0.180 485 HD2 LYS 78 HD2 LYS 78 -13.538 10.287 -0.756 486 HD3 LYS 78 HD1 LYS 78 -13.565 8.525 -0.862 487 HE2 LYS 78 HE2 LYS 78 -14.020 9.557 -3.030 488 HE3 LYS 78 HE1 LYS 78 -15.409 8.638 -2.452 489 HZ1 LYS 78 HZ1 LYS 78 -16.085 10.760 -3.372 490 HZ2 LYS 78 HZ2 LYS 78 -15.091 11.587 -2.282 491 HZ3 LYS 78 HZ3 LYS 78 -16.420 10.708 -1.714 492 H VAL 79 HN VAL 79 -11.409 7.645 2.248 493 HA VAL 79 HA VAL 79 -11.804 7.771 5.165 494 HB VAL 79 HB VAL 79 -9.885 6.244 5.435 495 H LYS 80 HN LYS 80 -10.160 8.776 6.377 496 HA LYS 80 HA LYS 80 -8.378 10.507 4.790 497 HB2 LYS 80 HB2 LYS 80 -9.510 11.024 7.548 498 HB3 LYS 80 HB1 LYS 80 -8.509 12.127 6.609 499 HG2 LYS 80 HG2 LYS 80 -10.246 12.375 4.960 500 HG3 LYS 80 HG1 LYS 80 -11.238 11.166 5.776 501 HD2 LYS 80 HD2 LYS 80 -11.379 12.610 7.746 502 HD3 LYS 80 HD1 LYS 80 -10.379 13.817 6.936 503 HE2 LYS 80 HE2 LYS 80 -12.724 14.426 6.797 504 HE3 LYS 80 HE1 LYS 80 -12.090 14.051 5.195 505 HZ1 LYS 80 HZ1 LYS 80 -13.699 12.214 6.887 506 HZ2 LYS 80 HZ2 LYS 80 -13.101 11.865 5.343 507 HZ3 LYS 80 HZ3 LYS 80 -14.269 13.070 5.543 508 H ALA 81 HN ALA 81 -6.224 10.422 5.169 509 HA ALA 81 HA ALA 81 -5.242 9.198 7.633 510 HB1 ALA 81 HB1 ALA 81 -5.530 7.348 6.031 511 HB2 ALA 81 HB2 ALA 81 -3.845 7.598 6.488 512 HB3 ALA 81 HB3 ALA 81 -4.427 8.163 4.923 513 H VAL 82 HN VAL 82 -3.231 9.858 8.254 514 HA VAL 82 HA VAL 82 -2.063 12.059 6.721 515 HB VAL 82 HB VAL 82 -1.461 11.186 9.553 516 H VAL 83 HN VAL 83 -0.390 11.645 5.458 517 HA VAL 83 HA VAL 83 1.360 9.367 6.098 518 HB VAL 83 HB VAL 83 0.328 9.047 3.965 519 H LYS 84 HN LYS 84 3.293 9.864 6.891 520 HA LYS 84 HA LYS 84 4.507 12.435 6.159 521 HB2 LYS 84 HB2 LYS 84 4.462 10.878 8.721 522 HB3 LYS 84 HB1 LYS 84 5.760 12.004 8.387 523 HG2 LYS 84 HG2 LYS 84 4.162 13.822 8.172 524 HG3 LYS 84 HG1 LYS 84 2.834 12.693 8.443 525 HD2 LYS 84 HD2 LYS 84 3.221 13.778 10.513 526 HD3 LYS 84 HD1 LYS 84 3.901 12.158 10.667 527 HE2 LYS 84 HE2 LYS 84 5.551 14.551 9.890 528 HE3 LYS 84 HE1 LYS 84 5.305 14.070 11.568 529 HZ1 LYS 84 HZ1 LYS 84 7.023 12.716 11.298 530 HZ2 LYS 84 HZ2 LYS 84 7.080 12.986 9.631 531 HZ3 LYS 84 HZ3 LYS 84 6.075 11.779 10.257 532 H MET 85 HN MET 85 6.782 12.479 5.846 533 HA MET 85 HA MET 85 7.950 9.839 5.261 534 HB2 MET 85 HB2 MET 85 9.294 10.914 3.528 535 HB3 MET 85 HB1 MET 85 7.579 11.170 3.237 536 HG2 MET 85 HG2 MET 85 7.697 13.421 3.917 537 HG3 MET 85 HG1 MET 85 9.297 13.202 4.624 538 HE1 MET 85 HE1 MET 85 8.480 15.586 2.605 539 HE2 MET 85 HE2 MET 85 9.939 15.647 1.614 540 HE3 MET 85 HE3 MET 85 10.066 15.420 3.359 541 H GLU 86 HN GLU 86 9.954 9.355 6.018 542 HA GLU 86 HA GLU 86 11.158 11.312 7.846 543 HB2 GLU 86 HB2 GLU 86 10.463 9.152 8.843 544 HB3 GLU 86 HB1 GLU 86 11.548 8.316 7.742 545 HG2 GLU 86 HG2 GLU 86 12.558 8.506 9.920 546 HG3 GLU 86 HG1 GLU 86 13.455 9.475 8.751 547 H GLY 87 HN GLY 87 11.554 9.748 4.889 548 HA2 GLY 87 HA2 GLY 87 13.219 9.784 3.313 549 HA3 GLY 87 HA1 GLY 87 13.903 11.129 4.212 550 H ASP 88 HN ASP 88 13.494 8.197 5.962 551 HA ASP 88 HA ASP 88 16.165 7.240 5.345 552 HB2 ASP 88 HB2 ASP 88 15.425 8.203 8.114 553 HB3 ASP 88 HB1 ASP 88 16.887 7.307 7.717 554 H ASN 89 HN ASN 89 14.685 5.507 4.591 555 HA ASN 89 HA ASN 89 13.724 3.464 4.794 556 HB2 ASN 89 HB2 ASN 89 15.142 3.169 7.425 557 HB3 ASN 89 HB1 ASN 89 14.827 1.945 6.197 558 H LYS 90 HN LYS 90 12.502 5.858 6.414 559 HA LYS 90 HA LYS 90 10.625 4.120 7.854 560 HB2 LYS 90 HB2 LYS 90 12.049 6.520 8.947 561 HB3 LYS 90 HB1 LYS 90 10.488 6.027 9.590 562 HG2 LYS 90 HG2 LYS 90 11.380 4.364 10.755 563 HG3 LYS 90 HG1 LYS 90 12.331 3.802 9.378 564 HD2 LYS 90 HD2 LYS 90 13.937 5.671 9.846 565 HD3 LYS 90 HD1 LYS 90 13.039 5.983 11.333 566 HE2 LYS 90 HE2 LYS 90 13.530 3.761 12.142 567 HE3 LYS 90 HE1 LYS 90 14.315 3.346 10.618 568 HZ1 LYS 90 HZ1 LYS 90 15.235 5.412 12.544 569 HZ2 LYS 90 HZ2 LYS 90 15.986 5.045 11.073 570 HZ3 LYS 90 HZ3 LYS 90 15.939 3.891 12.310 571 H MET 91 HN MET 91 8.585 4.482 7.495 572 HA MET 91 HA MET 91 7.646 7.105 6.605 573 HB2 MET 91 HB2 MET 91 7.029 4.513 5.168 574 HB3 MET 91 HB1 MET 91 6.305 6.073 4.807 575 HG2 MET 91 HG2 MET 91 9.237 5.431 4.574 576 HG3 MET 91 HG1 MET 91 8.089 5.446 3.237 577 HE1 MET 91 HE1 MET 91 6.246 7.797 3.731 578 HE2 MET 91 HE2 MET 91 7.060 7.677 2.171 579 HE3 MET 91 HE3 MET 91 7.065 9.204 3.052 580 H VAL 92 HN VAL 92 5.897 7.662 7.781 581 HA VAL 92 HA VAL 92 4.422 5.487 9.120 582 HB VAL 92 HB VAL 92 4.717 8.359 10.002 583 H THR 93 HN THR 93 2.477 5.109 8.387 584 HA THR 93 HA THR 93 0.786 7.351 7.533 585 HB THR 93 HB THR 93 1.479 6.404 5.457 586 HG1 THR 93 HG1 THR 93 -0.790 5.009 5.302 587 H THR 94 HN THR 94 -1.007 7.386 8.736 588 HA THR 94 HA THR 94 -2.019 4.822 9.796 589 HB THR 94 HB THR 94 -2.204 7.543 11.110 590 HG1 THR 94 HG1 THR 94 -0.564 5.268 11.568 591 H PHE 95 HN PHE 95 -4.040 4.285 9.268 592 HA PHE 95 HA PHE 95 -5.918 6.394 8.482 593 HD1 PHE 95 HD1 PHE 95 -3.317 3.619 6.911 594 HD2 PHE 95 HD2 PHE 95 -7.501 2.910 6.583 595 HE1 PHE 95 HE1 PHE 95 -2.881 1.221 6.574 596 HE2 PHE 95 HE2 PHE 95 -7.072 0.511 6.249 597 HZ PHE 95 HZ PHE 95 -4.761 -0.336 6.246 598 HB2 PHE 95 HB2 PHE 95 -6.680 5.110 6.558 599 HB3 PHE 95 HB1 PHE 95 -4.959 5.445 6.417 600 H LYS 96 HN LYS 96 -7.887 6.177 9.326 601 HA LYS 96 HA LYS 96 -9.619 5.387 10.558 602 HB2 LYS 96 HB2 LYS 96 -8.757 2.752 9.357 603 HB3 LYS 96 HB1 LYS 96 -10.264 3.011 10.220 604 HG2 LYS 96 HG2 LYS 96 -9.472 4.493 7.723 605 HG3 LYS 96 HG1 LYS 96 -10.478 3.043 7.747 606 HD2 LYS 96 HD2 LYS 96 -11.131 5.593 9.220 607 HD3 LYS 96 HD1 LYS 96 -11.770 5.170 7.629 608 HE2 LYS 96 HE2 LYS 96 -12.120 3.503 10.116 609 HE3 LYS 96 HE1 LYS 96 -13.316 4.648 9.506 610 HZ1 LYS 96 HZ1 LYS 96 -13.817 2.396 8.804 611 HZ2 LYS 96 HZ2 LYS 96 -12.306 2.259 8.058 612 HZ3 LYS 96 HZ3 LYS 96 -13.446 3.358 7.463 613 H GLY 97 HN GLY 97 -7.786 2.389 10.922 614 HA2 GLY 97 HA2 GLY 97 -6.949 3.132 13.610 615 HA3 GLY 97 HA1 GLY 97 -8.131 1.836 13.498 616 H ILE 98 HN ILE 98 -6.310 1.660 10.774 617 HA ILE 98 HA ILE 98 -4.766 -0.565 11.837 618 HB ILE 98 HB ILE 98 -5.235 0.393 9.011 619 H LYS 99 HN LYS 99 -2.578 -0.628 11.997 620 HA LYS 99 HA LYS 99 -1.155 1.894 11.570 621 HB2 LYS 99 HB2 LYS 99 -1.147 0.128 13.678 622 HB3 LYS 99 HB1 LYS 99 0.316 -0.322 12.808 623 HG2 LYS 99 HG2 LYS 99 -0.350 2.462 13.753 624 HG3 LYS 99 HG1 LYS 99 0.719 1.331 14.585 625 HD2 LYS 99 HD2 LYS 99 2.222 1.312 12.673 626 HD3 LYS 99 HD1 LYS 99 1.133 2.377 11.783 627 HE2 LYS 99 HE2 LYS 99 1.470 4.121 13.468 628 HE3 LYS 99 HE1 LYS 99 2.560 3.056 14.354 629 HZ1 LYS 99 HZ1 LYS 99 2.994 4.059 11.592 630 HZ2 LYS 99 HZ2 LYS 99 4.043 3.047 12.449 631 HZ3 LYS 99 HZ3 LYS 99 3.774 4.629 12.981 632 H SER 100 HN SER 100 0.048 2.144 9.815 633 HA SER 100 HA SER 100 1.217 -0.251 8.570 634 HG SER 100 HG SER 100 -0.615 -0.502 6.887 635 HB2 SER 100 HB2 SER 100 0.112 2.215 7.215 636 HB3 SER 100 HB1 SER 100 1.013 0.946 6.386 637 H VAL 101 HN VAL 101 3.351 -0.278 8.595 638 HA VAL 101 HA VAL 101 4.802 2.290 8.630 639 HB VAL 101 HB VAL 101 5.745 -0.299 9.870 640 H THR 102 HN THR 102 6.035 2.628 6.900 641 HA THR 102 HA THR 102 6.879 0.295 5.308 642 HB THR 102 HB THR 102 6.365 3.118 4.360 643 HG1 THR 102 HG1 THR 102 4.403 2.425 4.017 644 H GLU 103 HN GLU 103 8.990 -0.059 5.052 645 HA GLU 103 HA GLU 103 10.873 1.961 6.016 646 HB2 GLU 103 HB2 GLU 103 11.156 -0.260 6.957 647 HB3 GLU 103 HB1 GLU 103 11.244 -0.968 5.350 648 HG2 GLU 103 HG2 GLU 103 13.327 0.261 4.939 649 HG3 GLU 103 HG1 GLU 103 13.240 0.925 6.570 650 H PHE 104 HN PHE 104 11.868 3.248 4.597 651 HA PHE 104 HA PHE 104 11.750 2.538 1.764 652 HD1 PHE 104 HD2 PHE 104 13.429 4.501 0.041 653 HD2 PHE 104 HD1 PHE 104 9.572 5.414 1.580 654 HE1 PHE 104 HE2 PHE 104 12.662 5.051 -2.226 655 HE2 PHE 104 HE1 PHE 104 8.794 5.961 -0.682 656 HZ PHE 104 HZ PHE 104 10.337 5.784 -2.596 657 HB2 PHE 104 HB2 PHE 104 11.252 4.883 3.036 658 HB3 PHE 104 HB1 PHE 104 12.922 5.129 2.534 659 H ASN 105 HN ASN 105 13.378 1.552 0.850 660 HA ASN 105 HA ASN 105 16.123 2.231 1.675 661 HB2 ASN 105 HB2 ASN 105 15.227 -0.484 0.697 662 HB3 ASN 105 HB1 ASN 105 16.804 -0.052 1.344 663 H GLY 106 HN GLY 106 17.717 2.147 0.001 664 HA2 GLY 106 HA2 GLY 106 16.642 2.910 -2.578 665 HA3 GLY 106 HA1 GLY 106 18.334 2.940 -2.101 666 H ASP 107 HN ASP 107 16.492 0.059 -1.564 667 HA ASP 107 HA ASP 107 17.426 -1.164 -4.039 668 HB2 ASP 107 HB2 ASP 107 18.198 -2.192 -1.300 669 HB3 ASP 107 HB1 ASP 107 18.449 -3.066 -2.808 670 H THR 108 HN THR 108 15.724 -1.655 -0.952 671 HA THR 108 HA THR 108 13.645 -3.110 -2.414 672 HB THR 108 HB THR 108 14.794 -4.132 0.190 673 HG1 THR 108 HG1 THR 108 15.075 -5.195 -2.443 674 H ILE 109 HN ILE 109 11.683 -2.390 -1.912 675 HA ILE 109 HA ILE 109 11.371 -0.731 0.492 676 HB ILE 109 HB ILE 109 9.866 -0.852 -2.110 677 H THR 110 HN THR 110 10.371 -1.564 2.187 678 HA THR 110 HA THR 110 8.522 -3.828 1.785 679 HB THR 110 HB THR 110 10.110 -3.227 4.284 680 HG1 THR 110 HG1 THR 110 11.455 -3.849 2.486 681 H ASN 111 HN ASN 111 6.518 -3.784 2.741 682 HA ASN 111 HA ASN 111 5.898 -1.412 4.384 683 HB2 ASN 111 HB2 ASN 111 4.903 -1.137 2.171 684 HB3 ASN 111 HB1 ASN 111 4.126 -2.708 2.305 685 H THR 112 HN THR 112 4.589 -1.704 6.161 686 HA THR 112 HA THR 112 3.901 -4.501 6.804 687 HB THR 112 HB THR 112 4.451 -2.372 8.868 688 HG1 THR 112 HG1 THR 112 6.424 -2.538 7.971 689 H MET 113 HN MET 113 1.810 -4.909 7.027 690 HA MET 113 HA MET 113 0.020 -2.738 7.895 691 HB2 MET 113 HB2 MET 113 -0.583 -4.912 5.877 692 HB3 MET 113 HB1 MET 113 -1.741 -3.727 6.469 693 HG2 MET 113 HG2 MET 113 -0.363 -1.933 5.515 694 HG3 MET 113 HG1 MET 113 0.750 -3.146 4.883 695 HE1 MET 113 HE1 MET 113 -3.608 -2.580 3.477 696 HE2 MET 113 HE2 MET 113 -2.790 -1.521 4.627 697 HE3 MET 113 HE3 MET 113 -3.198 -3.175 5.085 698 H THR 114 HN THR 114 -0.939 -3.186 9.791 699 HA THR 114 HA THR 114 -1.204 -6.024 10.545 700 HB THR 114 HB THR 114 -0.997 -3.653 12.408 701 HG1 THR 114 HG1 THR 114 0.901 -5.287 11.210 702 H LEU 115 HN LEU 115 -3.191 -6.799 10.640 703 HA LEU 115 HA LEU 115 -5.360 -5.123 11.632 704 HG LEU 115 HG LEU 115 -7.633 -5.197 8.720 705 HB2 LEU 115 HB2 LEU 115 -5.377 -4.883 9.171 706 HB3 LEU 115 HB1 LEU 115 -5.516 -6.620 9.012 707 H GLY 116 HN GLY 116 -6.224 -6.246 13.256 708 HA2 GLY 116 HA2 GLY 116 -7.091 -7.996 14.466 709 HA3 GLY 116 HA1 GLY 116 -7.277 -8.848 12.940 710 H ASP 117 HN ASP 117 -4.337 -7.680 14.531 711 HA ASP 117 HA ASP 117 -2.481 -8.727 15.314 712 HB2 ASP 117 HB2 ASP 117 -4.265 -11.167 15.440 713 HB3 ASP 117 HB1 ASP 117 -2.667 -11.038 16.165 714 H ILE 118 HN ILE 118 -3.766 -9.221 12.387 715 HA ILE 118 HA ILE 118 -1.973 -11.323 11.486 716 HB ILE 118 HB ILE 118 -3.714 -9.599 9.737 717 H VAL 119 HN VAL 119 -0.150 -11.046 10.302 718 HA VAL 119 HA VAL 119 0.741 -8.272 9.908 719 HB VAL 119 HB VAL 119 2.406 -10.783 10.126 720 H TYR 120 HN TYR 120 0.631 -7.548 7.934 721 HA TYR 120 HA TYR 120 1.014 -9.419 5.691 722 HD1 TYR 120 HD2 TYR 120 0.563 -6.312 3.374 723 HD2 TYR 120 HD1 TYR 120 -1.707 -9.824 4.161 724 HE1 TYR 120 HE2 TYR 120 0.307 -6.682 0.957 725 HE2 TYR 120 HE1 TYR 120 -1.969 -10.205 1.745 726 HH TYR 120 HH TYR 120 -0.144 -8.549 -0.582 727 HB2 TYR 120 HB2 TYR 120 -1.246 -8.271 5.916 728 HB3 TYR 120 HB1 TYR 120 -0.415 -6.750 5.602 729 H LYS 121 HN LYS 121 2.918 -9.182 4.704 730 HA LYS 121 HA LYS 121 4.154 -6.511 4.659 731 HB2 LYS 121 HB2 LYS 121 5.246 -7.972 6.326 732 HB3 LYS 121 HB1 LYS 121 5.589 -9.140 5.057 733 HG2 LYS 121 HG2 LYS 121 6.934 -7.398 3.903 734 HG3 LYS 121 HG1 LYS 121 6.683 -6.349 5.299 735 HD2 LYS 121 HD2 LYS 121 7.974 -9.075 5.403 736 HD3 LYS 121 HD1 LYS 121 8.852 -7.547 5.351 737 HE2 LYS 121 HE2 LYS 121 6.961 -8.469 7.513 738 HE3 LYS 121 HE1 LYS 121 8.717 -8.343 7.632 739 HZ1 LYS 121 HZ1 LYS 121 6.849 -6.073 7.205 740 HZ2 LYS 121 HZ2 LYS 121 8.531 -5.954 7.329 741 HZ3 LYS 121 HZ3 LYS 121 7.620 -6.456 8.662 742 H ARG 122 HN ARG 122 4.763 -5.809 2.702 743 HA ARG 122 HA ARG 122 4.775 -7.761 0.510 744 HE ARG 122 HE ARG 122 1.904 -4.312 -0.026 745 HB2 ARG 122 HB2 ARG 122 4.318 -5.904 -1.000 746 HB3 ARG 122 HB1 ARG 122 3.105 -5.985 0.269 747 HG2 ARG 122 HG2 ARG 122 4.053 -4.129 1.404 748 HG3 ARG 122 HG1 ARG 122 5.476 -4.138 0.359 749 HD2 ARG 122 HD2 ARG 122 3.899 -2.358 -0.246 750 HD3 ARG 122 HD1 ARG 122 4.108 -3.527 -1.549 751 HH11 ARG 122 HH11 ARG 122 2.855 -1.692 -2.118 752 HH12 ARG 122 HH12 ARG 122 1.240 -1.361 -2.649 753 HH21 ARG 122 HH21 ARG 122 -0.225 -3.883 -0.720 754 HH22 ARG 122 HH22 ARG 122 -0.512 -2.608 -1.855 755 H VAL 123 HN VAL 123 6.529 -8.087 -0.694 756 HA VAL 123 HA VAL 123 8.915 -6.460 -0.104 757 HB VAL 123 HB VAL 123 8.814 -9.311 -1.108 758 H SER 124 HN SER 124 9.556 -5.177 -1.713 759 HA SER 124 HA SER 124 9.136 -6.083 -4.477 760 HG SER 124 HG SER 124 7.988 -2.345 -3.359 761 HB2 SER 124 HB2 SER 124 8.563 -3.771 -5.132 762 HB3 SER 124 HB1 SER 124 7.409 -4.429 -3.973 763 H LYS 125 HN LYS 125 10.752 -5.635 -5.919 764 HA LYS 125 HA LYS 125 13.204 -4.495 -4.766 765 HB2 LYS 125 HB2 LYS 125 14.447 -5.799 -6.346 766 HB3 LYS 125 HB1 LYS 125 13.254 -6.851 -5.615 767 HG2 LYS 125 HG2 LYS 125 11.889 -6.814 -7.513 768 HG3 LYS 125 HG1 LYS 125 12.846 -5.536 -8.253 769 HD2 LYS 125 HD2 LYS 125 13.837 -8.314 -7.628 770 HD3 LYS 125 HD1 LYS 125 13.316 -7.758 -9.220 771 HE2 LYS 125 HE2 LYS 125 15.592 -6.581 -7.625 772 HE3 LYS 125 HE1 LYS 125 15.772 -7.737 -8.945 773 HZ1 LYS 125 HZ1 LYS 125 14.767 -6.134 -10.442 774 HZ2 LYS 125 HZ2 LYS 125 16.129 -5.467 -9.691 775 HZ3 LYS 125 HZ3 LYS 125 14.579 -5.026 -9.177 776 H ARG 126 HN ARG 126 14.439 -2.998 -5.939 777 HA ARG 126 HA ARG 126 12.857 -1.276 -7.646 778 HE ARG 126 HE ARG 126 15.898 2.704 -8.814 779 HB2 ARG 126 HB2 ARG 126 14.202 -0.248 -5.914 780 HB3 ARG 126 HB1 ARG 126 15.659 -1.006 -6.545 781 HG2 ARG 126 HG2 ARG 126 15.489 0.312 -8.581 782 HG3 ARG 126 HG1 ARG 126 13.998 1.050 -7.990 783 HD2 ARG 126 HD2 ARG 126 15.176 2.085 -6.164 784 HD3 ARG 126 HD1 ARG 126 16.661 1.235 -6.587 785 HH11 ARG 126 HH11 ARG 126 16.886 3.309 -5.527 786 HH12 ARG 126 HH12 ARG 126 17.600 4.845 -5.890 787 HH21 ARG 126 HH21 ARG 126 16.834 4.723 -9.300 788 HH22 ARG 126 HH22 ARG 126 17.569 5.649 -8.035 789 H ILE 127 HN ILE 127 12.914 -1.235 -9.789 790 HA ILE 127 HA ILE 127 15.146 -2.593 -11.157 791 HB ILE 127 HB ILE 127 13.515 -2.924 -13.051 792 H9 OLA 128 HH1 OLA 128 -8.324 -7.396 -3.783 793 H10 OLA 128 HI1 OLA 128 -7.784 -5.997 -1.838 794 H21 OLA 128 HA1 OLA 128 -9.079 -9.354 -11.490 795 H22 OLA 128 HA2 OLA 128 -8.825 -10.851 -10.594 796 H31 OLA 128 HB1 OLA 128 -10.175 -8.795 -9.029 797 H32 OLA 128 HB2 OLA 128 -8.775 -9.792 -8.627 798 H41 OLA 128 HC1 OLA 128 -8.896 -7.056 -9.611 799 H42 OLA 128 HC2 OLA 128 -7.803 -8.074 -10.553 800 H51 OLA 128 HD1 OLA 128 -6.895 -8.836 -8.264 801 H52 OLA 128 HD2 OLA 128 -6.430 -7.245 -8.870 802 H61 OLA 128 HE1 OLA 128 -8.871 -7.428 -7.187 803 H62 OLA 128 HE2 OLA 128 -7.678 -6.132 -7.314 804 H71 OLA 128 HF1 OLA 128 -7.787 -8.394 -5.484 805 H72 OLA 128 HF2 OLA 128 -6.224 -8.240 -6.286 806 H81 OLA 128 HG1 OLA 128 -5.698 -6.633 -4.842 807 H82 OLA 128 HG2 OLA 128 -6.979 -5.638 -5.540 808 H111 OLA 128 HJ1 OLA 128 -5.192 -5.468 -2.961 809 H112 OLA 128 HJ2 OLA 128 -6.300 -4.255 -3.606 810 H121 OLA 128 HK1 OLA 128 -7.030 -3.813 -1.243 811 H122 OLA 128 HK2 OLA 128 -5.703 -4.851 -0.715 812 H131 OLA 128 HL1 OLA 128 -4.969 -2.742 -2.634 813 H132 OLA 128 HL2 OLA 128 -4.132 -3.300 -1.184 814 H141 OLA 128 HM1 OLA 128 -4.775 -1.143 -0.611 815 H142 OLA 128 HM2 OLA 128 -6.054 -2.135 0.091 816 H151 OLA 128 HN1 OLA 128 -7.486 -0.814 -1.001 817 H152 OLA 128 HN2 OLA 128 -6.959 -1.639 -2.469 818 H161 OLA 128 HP1 OLA 128 -5.005 0.277 -2.029 819 H162 OLA 128 HP2 OLA 128 -6.514 1.097 -1.619 820 H171 OLA 128 HQ1 OLA 128 -6.595 -0.510 -4.085 821 H172 OLA 128 HQ2 OLA 128 -5.534 0.906 -4.137 822 H181 OLA 128 HR1 OLA 128 -8.102 1.458 -2.883 823 H182 OLA 128 HR2 OLA 128 -7.268 2.318 -4.178 824 H183 OLA 128 HR3 OLA 128 -8.258 0.908 -4.551 825 H9 OLA 129 HH1 OLA 129 -2.692 8.448 0.799 826 H10 OLA 129 HI1 OLA 129 -4.594 6.960 1.229 827 H21 OLA 129 HA1 OLA 129 2.408 1.445 2.540 828 H22 OLA 129 HA2 OLA 129 3.093 1.078 0.956 829 H31 OLA 129 HB1 OLA 129 3.538 3.332 1.157 830 H32 OLA 129 HB2 OLA 129 2.018 3.340 0.260 831 H41 OLA 129 HC1 OLA 129 2.450 3.887 3.187 832 H42 OLA 129 HC2 OLA 129 0.855 3.564 2.504 833 H51 OLA 129 HD1 OLA 129 2.664 5.904 2.084 834 H52 OLA 129 HD2 OLA 129 1.523 5.448 0.816 835 H61 OLA 129 HE1 OLA 129 1.025 6.972 3.137 836 H62 OLA 129 HE2 OLA 129 0.181 5.434 3.343 837 H71 OLA 129 HF1 OLA 129 -0.014 7.053 0.820 838 H72 OLA 129 HF2 OLA 129 -1.054 5.734 1.355 839 H81 OLA 129 HG1 OLA 129 -1.628 7.256 3.343 840 H82 OLA 129 HG2 OLA 129 -0.910 8.551 2.383 841 H111 OLA 129 HJ1 OLA 129 -2.809 5.182 2.635 842 H112 OLA 129 HJ2 OLA 129 -3.476 6.320 3.807 843 H121 OLA 129 HK1 OLA 129 -5.484 5.345 3.755 844 H122 OLA 129 HK2 OLA 129 -5.495 5.286 1.991 845 H131 OLA 129 HL1 OLA 129 -5.234 3.132 3.733 846 H132 OLA 129 HL2 OLA 129 -3.605 3.400 3.109 847 H141 OLA 129 HM1 OLA 129 -5.646 3.566 1.041 848 H142 OLA 129 HM2 OLA 129 -5.618 1.998 1.850 849 H151 OLA 129 HN1 OLA 129 -3.982 1.510 0.396 850 H152 OLA 129 HN2 OLA 129 -2.962 2.464 1.474 851 H161 OLA 129 HP1 OLA 129 -2.852 4.221 0.038 852 H162 OLA 129 HP2 OLA 129 -4.481 3.951 -0.585 853 H171 OLA 129 HQ1 OLA 129 -2.439 1.895 -1.222 854 H172 OLA 129 HQ2 OLA 129 -3.770 2.521 -2.209 855 H181 OLA 129 HR1 OLA 129 -1.185 3.127 -2.641 856 H182 OLA 129 HR2 OLA 129 -1.627 4.437 -1.548 857 H183 OLA 129 HR3 OLA 129 -2.517 4.207 -3.053 Start of MODEL 3 1 HA MET 1 HA MET 1 8.569 11.693 -2.923 2 H1 MET 1 HT1 MET 1 8.659 9.649 -4.131 3 H2 MET 1 HT2 MET 1 7.214 9.715 -3.255 4 H3 MET 1 HT3 MET 1 8.486 8.742 -2.712 5 HB2 MET 1 HB2 MET 1 8.581 11.596 -0.416 6 HB3 MET 1 HB1 MET 1 7.060 11.121 -1.158 7 HG2 MET 1 HG2 MET 1 7.696 8.756 -0.869 8 HG3 MET 1 HG1 MET 1 9.161 9.281 -0.040 9 HE1 MET 1 HE1 MET 1 8.371 7.645 2.004 10 HE2 MET 1 HE2 MET 1 6.913 7.257 1.092 11 HE3 MET 1 HE3 MET 1 6.789 7.784 2.771 12 H ASN 2 HN ASN 2 10.112 8.708 -1.814 13 HA ASN 2 HA ASN 2 12.675 10.148 -1.704 14 HB2 ASN 2 HB2 ASN 2 11.766 7.617 -0.332 15 HB3 ASN 2 HB1 ASN 2 13.443 8.156 -0.348 16 H PHE 3 HN PHE 3 14.166 9.723 -3.169 17 HA PHE 3 HA PHE 3 15.407 8.697 -4.766 18 HD1 PHE 3 HD1 PHE 3 17.461 6.920 -4.033 19 HD2 PHE 3 HD2 PHE 3 13.958 6.164 -1.737 20 HE1 PHE 3 HE1 PHE 3 18.845 6.646 -2.018 21 HE2 PHE 3 HE2 PHE 3 15.337 5.889 0.283 22 HZ PHE 3 HZ PHE 3 17.783 6.130 0.144 23 HB2 PHE 3 HB2 PHE 3 13.843 6.202 -4.093 24 HB3 PHE 3 HB1 PHE 3 15.299 6.272 -5.079 25 H SER 4 HN SER 4 11.934 8.167 -4.876 26 HA SER 4 HA SER 4 10.441 8.154 -6.592 27 HG SER 4 HG SER 4 11.084 9.245 -9.488 28 HB2 SER 4 HB2 SER 4 11.331 10.426 -6.938 29 HB3 SER 4 HB1 SER 4 12.596 9.773 -7.978 30 H GLY 5 HN GLY 5 10.372 6.003 -7.107 31 HA2 GLY 5 HA2 GLY 5 11.439 5.253 -9.664 32 HA3 GLY 5 HA1 GLY 5 12.251 4.428 -8.342 33 H LYS 6 HN LYS 6 11.127 2.755 -9.982 34 HA LYS 6 HA LYS 6 8.456 2.132 -8.917 35 HB2 LYS 6 HB2 LYS 6 8.679 2.461 -11.386 36 HB3 LYS 6 HB1 LYS 6 9.745 1.062 -11.433 37 HG2 LYS 6 HG2 LYS 6 7.936 -0.352 -10.608 38 HG3 LYS 6 HG1 LYS 6 6.867 1.050 -10.541 39 HD2 LYS 6 HD2 LYS 6 6.367 -0.091 -12.562 40 HD3 LYS 6 HD1 LYS 6 7.289 1.345 -13.009 41 HE2 LYS 6 HE2 LYS 6 9.321 -0.017 -13.164 42 HE3 LYS 6 HE1 LYS 6 8.388 -1.450 -12.731 43 HZ1 LYS 6 HZ1 LYS 6 8.703 -1.314 -15.112 44 HZ2 LYS 6 HZ2 LYS 6 7.986 0.216 -15.155 45 HZ3 LYS 6 HZ3 LYS 6 7.063 -1.136 -14.735 46 H TYR 7 HN TYR 7 8.154 0.381 -7.714 47 HA TYR 7 HA TYR 7 10.302 -1.632 -7.584 48 HD1 TYR 7 HD1 TYR 7 9.462 1.621 -6.087 49 HD2 TYR 7 HD2 TYR 7 11.764 -1.571 -4.468 50 HE1 TYR 7 HE1 TYR 7 11.220 3.218 -5.454 51 HE2 TYR 7 HE2 TYR 7 13.526 0.020 -3.825 52 HH TYR 7 HH TYR 7 14.313 2.295 -4.567 53 HB2 TYR 7 HB2 TYR 7 8.458 -0.682 -5.378 54 HB3 TYR 7 HB1 TYR 7 9.607 -2.009 -5.229 55 H GLN 8 HN GLN 8 9.660 -3.834 -7.321 56 HA GLN 8 HA GLN 8 6.881 -4.341 -8.156 57 HB2 GLN 8 HB2 GLN 8 8.491 -4.828 -9.935 58 HB3 GLN 8 HB1 GLN 8 9.373 -5.900 -8.859 59 HG2 GLN 8 HG2 GLN 8 8.142 -7.388 -10.087 60 HG3 GLN 8 HG1 GLN 8 7.107 -7.158 -8.680 61 H VAL 9 HN VAL 9 5.672 -5.580 -6.891 62 HA VAL 9 HA VAL 9 6.715 -6.682 -4.457 63 HB VAL 9 HB VAL 9 3.985 -7.112 -5.678 64 H GLN 10 HN GLN 10 7.728 -8.585 -4.320 65 HA GLN 10 HA GLN 10 7.378 -10.550 -6.441 66 HB2 GLN 10 HB2 GLN 10 9.379 -10.281 -4.210 67 HB3 GLN 10 HB1 GLN 10 9.305 -11.690 -5.261 68 HG2 GLN 10 HG2 GLN 10 9.795 -8.853 -6.130 69 HG3 GLN 10 HG1 GLN 10 10.999 -10.133 -6.009 70 H SER 11 HN SER 11 6.811 -10.206 -2.977 71 HA SER 11 HA SER 11 4.912 -12.337 -3.010 72 HG SER 11 HG SER 11 8.414 -13.459 -1.294 73 HB2 SER 11 HB2 SER 11 6.051 -13.828 -1.413 74 HB3 SER 11 HB1 SER 11 6.946 -13.696 -2.925 75 H GLN 12 HN GLN 12 4.083 -12.814 -0.757 76 HA GLN 12 HA GLN 12 4.467 -10.618 1.130 77 HB2 GLN 12 HB2 GLN 12 2.543 -10.164 -0.536 78 HB3 GLN 12 HB1 GLN 12 1.681 -11.427 0.331 79 HG2 GLN 12 HG2 GLN 12 2.835 -9.012 1.692 80 HG3 GLN 12 HG1 GLN 12 1.204 -9.055 1.026 81 H GLU 13 HN GLU 13 4.145 -11.198 3.253 82 HA GLU 13 HA GLU 13 3.781 -14.057 3.742 83 HB2 GLU 13 HB2 GLU 13 4.761 -11.835 5.540 84 HB3 GLU 13 HB1 GLU 13 4.637 -13.521 6.017 85 HG2 GLU 13 HG2 GLU 13 6.355 -12.477 3.777 86 HG3 GLU 13 HG1 GLU 13 6.920 -12.871 5.401 87 H ASN 14 HN ASN 14 2.059 -14.910 4.738 88 HA ASN 14 HA ASN 14 0.026 -15.114 5.734 89 HB2 ASN 14 HB2 ASN 14 0.842 -12.494 7.003 90 HB3 ASN 14 HB1 ASN 14 -0.606 -13.388 7.454 91 H PHE 15 HN PHE 15 -1.340 -15.046 4.019 92 HA PHE 15 HA PHE 15 -2.408 -12.401 3.274 93 HD1 PHE 15 HD1 PHE 15 -4.080 -11.980 1.138 94 HD2 PHE 15 HD2 PHE 15 -0.046 -13.004 0.246 95 HE1 PHE 15 HE1 PHE 15 -3.910 -10.015 -0.332 96 HE2 PHE 15 HE2 PHE 15 0.132 -11.040 -1.225 97 HZ PHE 15 HZ PHE 15 -1.798 -9.551 -1.525 98 HB2 PHE 15 HB2 PHE 15 -1.252 -14.368 1.632 99 HB3 PHE 15 HB1 PHE 15 -2.981 -14.448 1.321 100 H GLU 16 HN GLU 16 -3.310 -15.851 3.335 101 HA GLU 16 HA GLU 16 -6.042 -15.594 3.101 102 HB2 GLU 16 HB2 GLU 16 -4.412 -17.622 4.624 103 HB3 GLU 16 HB1 GLU 16 -6.151 -17.761 4.410 104 HG2 GLU 16 HG2 GLU 16 -5.802 -17.718 1.959 105 HG3 GLU 16 HG1 GLU 16 -4.063 -17.727 2.245 106 HA PRO 17 HA PRO 17 -6.450 -15.307 7.957 107 HB2 PRO 17 HB2 PRO 17 -4.311 -14.119 9.202 108 HB3 PRO 17 HB1 PRO 17 -4.574 -15.862 9.122 109 HG2 PRO 17 HG2 PRO 17 -2.807 -14.127 7.446 110 HG3 PRO 17 HG1 PRO 17 -2.488 -15.739 8.116 111 HD2 PRO 17 HD2 PRO 17 -3.157 -15.382 5.538 112 HD3 PRO 17 HD1 PRO 17 -3.691 -16.807 6.452 113 H PHE 18 HN PHE 18 -4.391 -12.866 6.400 114 HA PHE 18 HA PHE 18 -5.524 -10.629 7.713 115 HD1 PHE 18 HD1 PHE 18 -4.794 -7.965 7.132 116 HD2 PHE 18 HD2 PHE 18 -4.269 -9.931 3.397 117 HE1 PHE 18 HE1 PHE 18 -5.299 -5.861 5.961 118 HE2 PHE 18 HE2 PHE 18 -4.772 -7.833 2.217 119 HZ PHE 18 HZ PHE 18 -5.289 -5.794 3.498 120 HB2 PHE 18 HB2 PHE 18 -3.446 -10.165 6.815 121 HB3 PHE 18 HB1 PHE 18 -3.768 -11.062 5.337 122 H MET 19 HN MET 19 -6.019 -11.923 4.447 123 HA MET 19 HA MET 19 -7.970 -10.082 3.629 124 HB2 MET 19 HB2 MET 19 -8.424 -11.660 1.831 125 HB3 MET 19 HB1 MET 19 -6.697 -11.468 2.081 126 HG2 MET 19 HG2 MET 19 -6.870 -13.738 1.816 127 HG3 MET 19 HG1 MET 19 -6.946 -13.584 3.568 128 HE1 MET 19 HE1 MET 19 -7.961 -16.107 3.647 129 HE2 MET 19 HE2 MET 19 -7.891 -16.173 1.886 130 HE3 MET 19 HE3 MET 19 -9.384 -16.592 2.726 131 H LYS 20 HN LYS 20 -8.294 -13.284 5.106 132 HA LYS 20 HA LYS 20 -11.124 -13.363 4.881 133 HB2 LYS 20 HB2 LYS 20 -9.186 -15.195 5.407 134 HB3 LYS 20 HB1 LYS 20 -9.889 -14.976 6.997 135 HG2 LYS 20 HG2 LYS 20 -12.125 -15.429 5.989 136 HG3 LYS 20 HG1 LYS 20 -11.296 -15.829 4.484 137 HD2 LYS 20 HD2 LYS 20 -9.966 -17.518 5.822 138 HD3 LYS 20 HD1 LYS 20 -11.105 -17.234 7.141 139 HE2 LYS 20 HE2 LYS 20 -11.789 -18.213 4.371 140 HE3 LYS 20 HE1 LYS 20 -11.750 -19.190 5.839 141 HZ1 LYS 20 HZ1 LYS 20 -13.574 -16.902 5.327 142 HZ2 LYS 20 HZ2 LYS 20 -13.536 -17.828 6.741 143 HZ3 LYS 20 HZ3 LYS 20 -14.001 -18.539 5.280 144 H ALA 21 HN ALA 21 -8.915 -12.374 7.456 145 HA ALA 21 HA ALA 21 -10.865 -12.072 9.474 146 HB1 ALA 21 HB1 ALA 21 -9.196 -10.721 10.637 147 HB2 ALA 21 HB2 ALA 21 -8.233 -10.630 9.162 148 HB3 ALA 21 HB3 ALA 21 -8.474 -12.183 9.964 149 H MET 22 HN MET 22 -10.440 -10.394 6.619 150 HA MET 22 HA MET 22 -11.642 -7.928 7.668 151 HB2 MET 22 HB2 MET 22 -9.636 -7.557 6.364 152 HB3 MET 22 HB1 MET 22 -10.273 -8.517 5.037 153 HG2 MET 22 HG2 MET 22 -10.491 -6.248 4.422 154 HG3 MET 22 HG1 MET 22 -12.106 -6.830 4.814 155 HE1 MET 22 HE1 MET 22 -11.258 -3.703 4.605 156 HE2 MET 22 HE2 MET 22 -12.187 -3.073 5.965 157 HE3 MET 22 HE3 MET 22 -12.896 -4.288 4.900 158 H GLY 23 HN GLY 23 -11.882 -9.770 4.620 159 HA2 GLY 23 HA2 GLY 23 -14.465 -10.636 4.723 160 HA3 GLY 23 HA1 GLY 23 -14.614 -8.952 4.238 161 H LEU 24 HN LEU 24 -11.708 -10.166 3.165 162 HA LEU 24 HA LEU 24 -12.638 -10.227 0.432 163 HG LEU 24 HG LEU 24 -10.154 -11.115 -1.000 164 HB2 LEU 24 HB2 LEU 24 -10.487 -9.156 1.279 165 HB3 LEU 24 HB1 LEU 24 -9.854 -10.782 1.431 166 HA PRO 25 HA PRO 25 -13.060 -14.687 0.473 167 HB2 PRO 25 HB2 PRO 25 -13.644 -15.053 -2.124 168 HB3 PRO 25 HB1 PRO 25 -14.801 -14.319 -1.005 169 HG2 PRO 25 HG2 PRO 25 -12.956 -12.991 -2.958 170 HG3 PRO 25 HG1 PRO 25 -14.668 -12.660 -2.642 171 HD2 PRO 25 HD2 PRO 25 -12.659 -11.171 -1.597 172 HD3 PRO 25 HD1 PRO 25 -14.208 -11.412 -0.766 173 H GLU 26 HN GLU 26 -11.495 -16.166 0.440 174 HA GLU 26 HA GLU 26 -8.921 -15.805 -0.384 175 HB2 GLU 26 HB2 GLU 26 -8.619 -18.205 -0.180 176 HB3 GLU 26 HB1 GLU 26 -9.667 -17.616 1.103 177 HG2 GLU 26 HG2 GLU 26 -11.623 -18.393 -0.151 178 HG3 GLU 26 HG1 GLU 26 -10.555 -19.014 -1.409 179 H ASP 27 HN ASP 27 -11.625 -16.718 -2.377 180 HA ASP 27 HA ASP 27 -10.275 -17.918 -4.512 181 HB2 ASP 27 HB2 ASP 27 -12.801 -16.270 -4.411 182 HB3 ASP 27 HB1 ASP 27 -12.221 -17.022 -5.895 183 H LEU 28 HN LEU 28 -11.054 -14.496 -3.946 184 HA LEU 28 HA LEU 28 -9.809 -13.558 -6.318 185 HG LEU 28 HG LEU 28 -11.337 -11.727 -6.779 186 HB2 LEU 28 HB2 LEU 28 -10.898 -12.305 -3.847 187 HB3 LEU 28 HB1 LEU 28 -9.824 -11.347 -4.849 188 H ILE 29 HN ILE 29 -8.689 -13.961 -2.994 189 HA ILE 29 HA ILE 29 -6.276 -12.540 -3.243 190 HB ILE 29 HB ILE 29 -7.005 -14.841 -1.436 191 H GLN 30 HN GLN 30 -7.041 -15.951 -3.811 192 HA GLN 30 HA GLN 30 -4.433 -16.845 -4.299 193 HB2 GLN 30 HB2 GLN 30 -7.089 -17.845 -5.326 194 HB3 GLN 30 HB1 GLN 30 -5.569 -18.689 -5.594 195 HG2 GLN 30 HG2 GLN 30 -6.697 -18.032 -2.883 196 HG3 GLN 30 HG1 GLN 30 -6.896 -19.582 -3.708 197 H LYS 31 HN LYS 31 -6.893 -15.627 -6.559 198 HA LYS 31 HA LYS 31 -5.285 -15.971 -8.869 199 HB2 LYS 31 HB2 LYS 31 -6.994 -14.889 -10.069 200 HB3 LYS 31 HB1 LYS 31 -7.818 -15.741 -8.771 201 HG2 LYS 31 HG2 LYS 31 -8.153 -13.737 -7.550 202 HG3 LYS 31 HG1 LYS 31 -7.087 -12.831 -8.625 203 HD2 LYS 31 HD2 LYS 31 -9.674 -14.131 -9.476 204 HD3 LYS 31 HD1 LYS 31 -9.510 -12.431 -9.036 205 HE2 LYS 31 HE2 LYS 31 -7.902 -12.115 -10.852 206 HE3 LYS 31 HE1 LYS 31 -8.053 -13.818 -11.285 207 HZ1 LYS 31 HZ1 LYS 31 -9.406 -12.425 -12.714 208 HZ2 LYS 31 HZ2 LYS 31 -10.238 -11.807 -11.375 209 HZ3 LYS 31 HZ3 LYS 31 -10.390 -13.441 -11.784 210 H GLY 32 HN GLY 32 -5.630 -13.384 -6.545 211 HA2 GLY 32 HA2 GLY 32 -4.274 -11.431 -8.170 212 HA3 GLY 32 HA1 GLY 32 -4.734 -11.249 -6.486 213 H LYS 33 HN LYS 33 -3.327 -13.637 -5.582 214 HA LYS 33 HA LYS 33 -0.770 -12.441 -5.166 215 HB2 LYS 33 HB2 LYS 33 -0.265 -14.408 -3.824 216 HB3 LYS 33 HB1 LYS 33 -1.869 -13.802 -3.436 217 HG2 LYS 33 HG2 LYS 33 -2.875 -15.551 -4.794 218 HG3 LYS 33 HG1 LYS 33 -1.273 -16.146 -5.234 219 HD2 LYS 33 HD2 LYS 33 -2.284 -15.978 -2.399 220 HD3 LYS 33 HD1 LYS 33 -2.412 -17.424 -3.401 221 HE2 LYS 33 HE2 LYS 33 0.139 -16.028 -2.598 222 HE3 LYS 33 HE1 LYS 33 -0.467 -17.545 -1.939 223 HZ1 LYS 33 HZ1 LYS 33 1.239 -17.911 -3.613 224 HZ2 LYS 33 HZ2 LYS 33 0.316 -17.089 -4.767 225 HZ3 LYS 33 HZ3 LYS 33 -0.245 -18.548 -4.121 226 H ASP 34 HN ASP 34 -2.037 -14.736 -7.420 227 HA ASP 34 HA ASP 34 0.348 -16.051 -8.136 228 HB2 ASP 34 HB2 ASP 34 -1.922 -16.832 -8.772 229 HB3 ASP 34 HB1 ASP 34 -2.049 -15.476 -9.889 230 H ILE 35 HN ILE 35 -0.990 -12.956 -9.011 231 HA ILE 35 HA ILE 35 1.138 -12.549 -10.992 232 HB ILE 35 HB ILE 35 -1.276 -10.816 -10.436 233 H LYS 36 HN LYS 36 2.888 -11.440 -10.440 234 HA LYS 36 HA LYS 36 3.322 -10.349 -7.899 235 HB2 LYS 36 HB2 LYS 36 4.773 -9.720 -10.478 236 HB3 LYS 36 HB1 LYS 36 5.372 -9.392 -8.858 237 HG2 LYS 36 HG2 LYS 36 5.393 -11.795 -8.385 238 HG3 LYS 36 HG1 LYS 36 4.815 -12.113 -10.020 239 HD2 LYS 36 HD2 LYS 36 7.393 -10.694 -9.354 240 HD3 LYS 36 HD1 LYS 36 7.266 -12.404 -9.766 241 HE2 LYS 36 HE2 LYS 36 6.323 -11.795 -11.950 242 HE3 LYS 36 HE1 LYS 36 6.478 -10.090 -11.535 243 HZ1 LYS 36 HZ1 LYS 36 8.723 -12.021 -11.777 244 HZ2 LYS 36 HZ2 LYS 36 8.874 -10.385 -11.374 245 HZ3 LYS 36 HZ3 LYS 36 8.318 -10.830 -12.908 246 H GLY 37 HN GLY 37 2.635 -8.526 -7.007 247 HA2 GLY 37 HA2 GLY 37 1.058 -6.629 -8.360 248 HA3 GLY 37 HA1 GLY 37 1.751 -6.423 -6.758 249 H VAL 38 HN VAL 38 1.461 -4.348 -8.641 250 HA VAL 38 HA VAL 38 4.288 -3.750 -9.242 251 HB VAL 38 HB VAL 38 1.915 -2.659 -10.756 252 H SER 39 HN SER 39 5.096 -1.895 -8.431 253 HA SER 39 HA SER 39 3.231 0.109 -7.367 254 HG SER 39 HG SER 39 2.829 -1.263 -5.546 255 HB2 SER 39 HB2 SER 39 5.622 -1.009 -5.883 256 HB3 SER 39 HB1 SER 39 4.627 0.341 -5.339 257 H GLU 40 HN GLU 40 3.815 2.186 -7.713 258 HA GLU 40 HA GLU 40 6.557 2.740 -8.608 259 HB2 GLU 40 HB2 GLU 40 5.106 2.516 -10.595 260 HB3 GLU 40 HB1 GLU 40 4.062 3.781 -9.963 261 HG2 GLU 40 HG2 GLU 40 6.057 5.301 -10.016 262 HG3 GLU 40 HG1 GLU 40 6.907 4.021 -10.881 263 H ILE 41 HN ILE 41 7.438 4.478 -7.648 264 HA ILE 41 HA ILE 41 5.634 6.245 -6.128 265 HB ILE 41 HB ILE 41 8.572 6.117 -5.582 266 H VAL 42 HN VAL 42 5.365 8.186 -6.946 267 HA VAL 42 HA VAL 42 7.478 9.370 -8.616 268 HB VAL 42 HB VAL 42 4.555 10.130 -8.481 269 H HIS 43 HN HIS 43 8.604 11.011 -7.774 270 HA HIS 43 HA HIS 43 7.492 12.380 -5.423 271 HD1 HIS 43 HD1 HIS 43 11.913 13.700 -5.884 272 HD2 HIS 43 HD2 HIS 43 8.750 13.776 -3.191 273 HE1 HIS 43 HE1 HIS 43 12.381 15.638 -4.353 274 HE2 HIS 43 HE2 HIS 43 10.430 15.696 -2.761 275 HB2 HIS 43 HB2 HIS 43 9.522 11.321 -4.826 276 HB3 HIS 43 HB1 HIS 43 10.328 11.857 -6.294 277 H GLU 44 HN GLU 44 6.688 14.322 -5.784 278 HA GLU 44 HA GLU 44 8.127 16.154 -7.569 279 HB2 GLU 44 HB2 GLU 44 5.131 15.740 -7.586 280 HB3 GLU 44 HB1 GLU 44 5.999 16.958 -8.510 281 HG2 GLU 44 HG2 GLU 44 7.179 15.159 -9.711 282 HG3 GLU 44 HG1 GLU 44 6.216 13.976 -8.828 283 H GLY 45 HN GLY 45 8.867 17.542 -6.050 284 HA2 GLY 45 HA2 GLY 45 8.836 19.179 -4.439 285 HA3 GLY 45 HA1 GLY 45 7.148 19.423 -4.870 286 H LYS 46 HN LYS 46 5.612 18.824 -3.460 287 HA LYS 46 HA LYS 46 6.451 17.202 -1.148 288 HB2 LYS 46 HB2 LYS 46 4.610 18.453 0.088 289 HB3 LYS 46 HB1 LYS 46 6.062 19.365 -0.294 290 HG2 LYS 46 HG2 LYS 46 4.896 20.316 -2.257 291 HG3 LYS 46 HG1 LYS 46 3.432 19.474 -1.752 292 HD2 LYS 46 HD2 LYS 46 3.334 21.759 -0.994 293 HD3 LYS 46 HD1 LYS 46 3.527 20.696 0.402 294 HE2 LYS 46 HE2 LYS 46 5.904 21.195 0.482 295 HE3 LYS 46 HE1 LYS 46 5.760 22.200 -0.959 296 HZ1 LYS 46 HZ1 LYS 46 4.346 23.710 0.253 297 HZ2 LYS 46 HZ2 LYS 46 5.798 23.504 1.093 298 HZ3 LYS 46 HZ3 LYS 46 4.396 22.725 1.626 299 H LYS 47 HN LYS 47 4.520 17.330 -3.850 300 HA LYS 47 HA LYS 47 2.410 15.645 -2.728 301 HB2 LYS 47 HB2 LYS 47 2.729 16.900 -5.459 302 HB3 LYS 47 HB1 LYS 47 1.390 15.857 -5.006 303 HG2 LYS 47 HG2 LYS 47 0.524 17.989 -4.752 304 HG3 LYS 47 HG1 LYS 47 0.986 17.543 -3.109 305 HD2 LYS 47 HD2 LYS 47 1.704 19.792 -3.497 306 HD3 LYS 47 HD1 LYS 47 3.135 18.762 -3.463 307 HE2 LYS 47 HE2 LYS 47 3.277 20.375 -5.279 308 HE3 LYS 47 HE1 LYS 47 3.170 18.733 -5.909 309 HZ1 LYS 47 HZ1 LYS 47 0.939 20.686 -5.743 310 HZ2 LYS 47 HZ2 LYS 47 0.799 19.096 -6.300 311 HZ3 LYS 47 HZ3 LYS 47 1.744 20.208 -7.152 312 H VAL 48 HN VAL 48 2.716 13.525 -2.706 313 HA VAL 48 HA VAL 48 4.493 12.336 -4.723 314 HB VAL 48 HB VAL 48 5.143 11.929 -2.399 315 H LYS 49 HN LYS 49 3.786 10.798 -6.104 316 HA LYS 49 HA LYS 49 0.928 10.120 -5.961 317 HB2 LYS 49 HB2 LYS 49 2.764 10.135 -8.361 318 HB3 LYS 49 HB1 LYS 49 1.054 9.733 -8.383 319 HG2 LYS 49 HG2 LYS 49 0.627 12.053 -7.480 320 HG3 LYS 49 HG1 LYS 49 2.321 12.397 -7.831 321 HD2 LYS 49 HD2 LYS 49 1.180 13.154 -9.726 322 HD3 LYS 49 HD1 LYS 49 1.799 11.572 -10.200 323 HE2 LYS 49 HE2 LYS 49 -0.967 11.950 -9.087 324 HE3 LYS 49 HE1 LYS 49 -0.617 12.110 -10.807 325 HZ1 LYS 49 HZ1 LYS 49 -1.350 9.899 -10.392 326 HZ2 LYS 49 HZ2 LYS 49 -0.249 9.693 -9.128 327 HZ3 LYS 49 HZ3 LYS 49 0.309 9.825 -10.718 328 H LEU 50 HN LEU 50 0.410 8.111 -5.502 329 HA LEU 50 HA LEU 50 2.437 6.006 -5.852 330 HG LEU 50 HG LEU 50 2.019 4.948 -2.413 331 HB2 LEU 50 HB2 LEU 50 0.904 6.764 -3.593 332 HB3 LEU 50 HB1 LEU 50 0.298 5.208 -4.119 333 H THR 51 HN THR 51 2.014 4.512 -7.341 334 HA THR 51 HA THR 51 -0.802 4.030 -8.059 335 HB THR 51 HB THR 51 1.536 4.023 -9.978 336 HG1 THR 51 HG1 THR 51 0.201 5.849 -10.846 337 H ILE 52 HN ILE 52 -1.441 2.002 -7.892 338 HA ILE 52 HA ILE 52 0.561 -0.152 -8.000 339 HB ILE 52 HB ILE 52 -1.807 -0.079 -6.124 340 H THR 53 HN THR 53 0.093 -1.628 -9.517 341 HA THR 53 HA THR 53 -2.679 -1.740 -10.505 342 HB THR 53 HB THR 53 -0.167 -2.521 -11.991 343 HG1 THR 53 HG1 THR 53 -1.453 -0.413 -13.039 344 H TYR 54 HN TYR 54 -3.782 -3.565 -10.349 345 HA TYR 54 HA TYR 54 -2.326 -6.052 -9.746 346 HD1 TYR 54 HD2 TYR 54 -2.176 -7.358 -7.603 347 HD2 TYR 54 HD1 TYR 54 -4.177 -3.699 -6.756 348 HE1 TYR 54 HE2 TYR 54 -0.842 -7.110 -5.551 349 HE2 TYR 54 HE1 TYR 54 -2.850 -3.442 -4.703 350 HH TYR 54 HH TYR 54 -1.600 -4.900 -3.121 351 HB2 TYR 54 HB2 TYR 54 -4.868 -4.959 -8.570 352 HB3 TYR 54 HB1 TYR 54 -4.543 -6.687 -8.563 353 H GLY 55 HN GLY 55 -2.390 -7.272 -11.528 354 HA2 GLY 55 HA2 GLY 55 -3.260 -8.545 -13.231 355 HA3 GLY 55 HA1 GLY 55 -4.849 -8.266 -12.533 356 H SER 56 HN SER 56 -6.012 -6.341 -13.154 357 HA SER 56 HA SER 56 -5.011 -4.998 -15.558 358 HG SER 56 HG SER 56 -6.988 -5.539 -17.820 359 HB2 SER 56 HB2 SER 56 -6.423 -6.876 -16.318 360 HB3 SER 56 HB1 SER 56 -7.760 -6.251 -15.353 361 H LYS 57 HN LYS 57 -5.713 -4.431 -12.601 362 HA LYS 57 HA LYS 57 -7.444 -2.103 -13.115 363 HB2 LYS 57 HB2 LYS 57 -8.492 -3.628 -11.562 364 HB3 LYS 57 HB1 LYS 57 -7.043 -3.661 -10.565 365 HG2 LYS 57 HG2 LYS 57 -7.344 -1.336 -9.978 366 HG3 LYS 57 HG1 LYS 57 -8.731 -1.215 -11.063 367 HD2 LYS 57 HD2 LYS 57 -8.642 -3.200 -8.821 368 HD3 LYS 57 HD1 LYS 57 -9.202 -1.546 -8.568 369 HE2 LYS 57 HE2 LYS 57 -10.347 -3.525 -10.538 370 HE3 LYS 57 HE1 LYS 57 -11.064 -3.083 -8.990 371 HZ1 LYS 57 HZ1 LYS 57 -12.087 -1.888 -10.826 372 HZ2 LYS 57 HZ2 LYS 57 -10.592 -1.226 -11.260 373 HZ3 LYS 57 HZ3 LYS 57 -11.300 -0.817 -9.779 374 H VAL 58 HN VAL 58 -6.670 -0.117 -12.714 375 HA VAL 58 HA VAL 58 -3.992 0.065 -11.506 376 HB VAL 58 HB VAL 58 -5.349 2.008 -13.383 377 H ILE 59 HN ILE 59 -3.787 1.066 -9.617 378 HA ILE 59 HA ILE 59 -6.033 2.714 -8.658 379 HB ILE 59 HB ILE 59 -4.027 1.143 -7.033 380 H HIS 60 HN HIS 60 -5.609 4.809 -8.637 381 HA HIS 60 HA HIS 60 -2.827 5.681 -8.194 382 HD1 HIS 60 HD1 HIS 60 -5.518 9.112 -8.844 383 HD2 HIS 60 HD2 HIS 60 -6.333 5.662 -11.012 384 HE1 HIS 60 HE1 HIS 60 -7.911 9.333 -9.583 385 HE2 HIS 60 HE2 HIS 60 -8.392 7.220 -10.868 386 HB2 HIS 60 HB2 HIS 60 -3.436 7.746 -9.408 387 HB3 HIS 60 HB1 HIS 60 -3.644 6.307 -10.399 388 H ASN 61 HN ASN 61 -2.368 6.955 -6.512 389 HA ASN 61 HA ASN 61 -4.416 8.549 -5.223 390 HB2 ASN 61 HB2 ASN 61 -3.000 6.316 -3.751 391 HB3 ASN 61 HB1 ASN 61 -3.949 7.580 -2.975 392 H GLU 62 HN GLU 62 -3.538 10.443 -4.748 393 HA GLU 62 HA GLU 62 -0.633 10.567 -4.264 394 HB2 GLU 62 HB2 GLU 62 -0.752 12.891 -5.138 395 HB3 GLU 62 HB1 GLU 62 -1.189 11.679 -6.336 396 HG2 GLU 62 HG2 GLU 62 -3.592 12.138 -5.774 397 HG3 GLU 62 HG1 GLU 62 -3.026 13.501 -4.810 398 H PHE 63 HN PHE 63 0.137 11.809 -2.554 399 HA PHE 63 HA PHE 63 -1.787 13.276 -0.932 400 HD1 PHE 63 HD1 PHE 63 -2.089 9.546 -1.223 401 HD2 PHE 63 HD2 PHE 63 1.420 10.738 0.871 402 HE1 PHE 63 HE1 PHE 63 -1.040 7.386 -1.756 403 HE2 PHE 63 HE2 PHE 63 2.474 8.579 0.341 404 HZ PHE 63 HZ PHE 63 1.243 6.900 -0.974 405 HB2 PHE 63 HB2 PHE 63 -0.601 11.978 1.098 406 HB3 PHE 63 HB1 PHE 63 -2.100 11.433 0.359 407 H THR 64 HN THR 64 -0.860 14.742 0.531 408 HA THR 64 HA THR 64 1.866 15.513 -0.200 409 HB THR 64 HB THR 64 -0.204 17.088 1.343 410 HG1 THR 64 HG1 THR 64 0.607 17.336 -1.381 411 H LEU 65 HN LEU 65 3.530 15.399 1.167 412 HA LEU 65 HA LEU 65 3.428 13.919 3.527 413 HG LEU 65 HG LEU 65 5.216 14.188 1.000 414 HB2 LEU 65 HB2 LEU 65 5.496 15.968 2.724 415 HB3 LEU 65 HB1 LEU 65 5.708 14.715 3.932 416 H GLY 66 HN GLY 66 3.303 14.426 5.673 417 HA2 GLY 66 HA2 GLY 66 2.730 15.619 7.546 418 HA3 GLY 66 HA1 GLY 66 3.536 16.985 6.792 419 H GLU 67 HN GLU 67 0.600 15.172 5.900 420 HA GLU 67 HA GLU 67 -1.168 17.270 6.667 421 HB2 GLU 67 HB2 GLU 67 -0.174 18.322 4.674 422 HB3 GLU 67 HB1 GLU 67 -0.650 16.933 3.706 423 HG2 GLU 67 HG2 GLU 67 -2.201 18.719 3.340 424 HG3 GLU 67 HG1 GLU 67 -3.011 17.425 4.222 425 H GLU 68 HN GLU 68 -3.304 16.635 6.617 426 HA GLU 68 HA GLU 68 -3.777 13.816 6.315 427 HB2 GLU 68 HB2 GLU 68 -4.804 15.183 8.124 428 HB3 GLU 68 HB1 GLU 68 -5.748 16.033 6.907 429 HG2 GLU 68 HG2 GLU 68 -6.896 14.000 6.314 430 HG3 GLU 68 HG1 GLU 68 -5.887 13.071 7.423 431 H CYS 69 HN CYS 69 -4.327 12.845 4.481 432 HA CYS 69 HA CYS 69 -5.764 14.407 2.433 433 HG CYS 69 HG CYS 69 -2.541 14.505 2.970 434 HB2 CYS 69 HB2 CYS 69 -3.885 12.090 1.952 435 HB3 CYS 69 HB1 CYS 69 -4.669 13.078 0.725 436 H GLU 70 HN GLU 70 -7.238 13.189 1.070 437 HA GLU 70 HA GLU 70 -8.359 10.857 2.478 438 HB2 GLU 70 HB2 GLU 70 -9.786 12.898 2.549 439 HB3 GLU 70 HB1 GLU 70 -9.862 12.862 0.794 440 HG2 GLU 70 HG2 GLU 70 -10.974 10.702 0.867 441 HG3 GLU 70 HG1 GLU 70 -10.866 10.698 2.626 442 H LEU 71 HN LEU 71 -8.185 9.020 1.409 443 HA LEU 71 HA LEU 71 -8.173 9.083 -1.536 444 HG LEU 71 HG LEU 71 -7.411 6.582 1.067 445 HB2 LEU 71 HB2 LEU 71 -6.768 7.051 -1.450 446 HB3 LEU 71 HB1 LEU 71 -5.990 8.464 -0.763 447 H GLU 72 HN GLU 72 -9.302 7.516 -2.631 448 HA GLU 72 HA GLU 72 -11.490 6.334 -1.155 449 HB2 GLU 72 HB2 GLU 72 -12.408 7.108 -3.078 450 HB3 GLU 72 HB1 GLU 72 -10.894 6.995 -3.965 451 HG2 GLU 72 HG2 GLU 72 -11.219 4.633 -4.299 452 HG3 GLU 72 HG1 GLU 72 -12.683 4.663 -3.315 453 H THR 73 HN THR 73 -11.623 4.282 -0.530 454 HA THR 73 HA THR 73 -9.440 2.474 -1.115 455 HB THR 73 HB THR 73 -10.581 0.936 0.467 456 HG1 THR 73 HG1 THR 73 -12.316 2.808 1.437 457 H MET 74 HN MET 74 -10.236 0.048 -1.340 458 HA MET 74 HA MET 74 -11.319 -0.197 -3.927 459 HB2 MET 74 HB2 MET 74 -9.781 -1.834 -2.794 460 HB3 MET 74 HB1 MET 74 -11.149 -2.366 -1.827 461 HG2 MET 74 HG2 MET 74 -11.243 -2.411 -4.819 462 HG3 MET 74 HG1 MET 74 -10.513 -3.724 -3.900 463 HE1 MET 74 HE1 MET 74 -12.200 -5.491 -4.975 464 HE2 MET 74 HE2 MET 74 -12.882 -4.182 -5.940 465 HE3 MET 74 HE3 MET 74 -13.947 -5.250 -5.025 466 H THR 75 HN THR 75 -12.732 -0.495 -0.719 467 HA THR 75 HA THR 75 -15.228 -1.561 -1.493 468 HB THR 75 HB THR 75 -16.051 -0.836 0.681 469 HG1 THR 75 HG1 THR 75 -15.254 0.918 1.539 470 H GLY 76 HN GLY 76 -13.861 1.548 -1.853 471 HA2 GLY 76 HA2 GLY 76 -14.826 3.201 -3.258 472 HA3 GLY 76 HA1 GLY 76 -16.417 2.550 -2.886 473 H GLU 77 HN GLU 77 -14.943 2.591 -0.012 474 HA GLU 77 HA GLU 77 -16.331 4.965 0.836 475 HB2 GLU 77 HB2 GLU 77 -16.357 2.970 2.238 476 HB3 GLU 77 HB1 GLU 77 -14.603 3.012 2.365 477 HG2 GLU 77 HG2 GLU 77 -14.716 5.102 3.583 478 HG3 GLU 77 HG1 GLU 77 -16.469 5.134 3.403 479 H LYS 78 HN LYS 78 -15.449 6.845 1.641 480 HA LYS 78 HA LYS 78 -12.720 7.398 0.776 481 HB2 LYS 78 HB2 LYS 78 -14.766 9.318 1.896 482 HB3 LYS 78 HB1 LYS 78 -13.280 9.730 1.052 483 HG2 LYS 78 HG2 LYS 78 -15.615 8.272 -0.170 484 HG3 LYS 78 HG1 LYS 78 -15.282 9.995 -0.348 485 HD2 LYS 78 HD2 LYS 78 -13.111 9.437 -1.383 486 HD3 LYS 78 HD1 LYS 78 -13.518 7.723 -1.264 487 HE2 LYS 78 HE2 LYS 78 -13.979 8.554 -3.501 488 HE3 LYS 78 HE1 LYS 78 -15.477 8.101 -2.690 489 HZ1 LYS 78 HZ1 LYS 78 -15.861 10.435 -2.185 490 HZ2 LYS 78 HZ2 LYS 78 -15.711 10.199 -3.853 491 HZ3 LYS 78 HZ3 LYS 78 -14.428 10.864 -2.973 492 H VAL 79 HN VAL 79 -11.081 7.257 2.159 493 HA VAL 79 HA VAL 79 -11.625 7.718 5.022 494 HB VAL 79 HB VAL 79 -9.736 6.210 5.525 495 H LYS 80 HN LYS 80 -10.309 9.066 6.152 496 HA LYS 80 HA LYS 80 -8.276 10.512 4.593 497 HB2 LYS 80 HB2 LYS 80 -8.600 12.341 6.254 498 HB3 LYS 80 HB1 LYS 80 -10.045 11.967 5.324 499 HG2 LYS 80 HG2 LYS 80 -10.888 10.638 7.220 500 HG3 LYS 80 HG1 LYS 80 -9.466 11.111 8.152 501 HD2 LYS 80 HD2 LYS 80 -10.111 13.462 7.941 502 HD3 LYS 80 HD1 LYS 80 -11.528 12.991 7.002 503 HE2 LYS 80 HE2 LYS 80 -10.954 12.232 9.864 504 HE3 LYS 80 HE1 LYS 80 -12.124 13.435 9.323 505 HZ1 LYS 80 HZ1 LYS 80 -13.184 11.323 9.840 506 HZ2 LYS 80 HZ2 LYS 80 -12.226 10.536 8.690 507 HZ3 LYS 80 HZ3 LYS 80 -13.355 11.695 8.197 508 H ALA 81 HN ALA 81 -6.198 10.536 5.235 509 HA ALA 81 HA ALA 81 -5.503 9.713 7.946 510 HB1 ALA 81 HB1 ALA 81 -4.422 8.295 5.516 511 HB2 ALA 81 HB2 ALA 81 -5.583 7.631 6.664 512 HB3 ALA 81 HB3 ALA 81 -3.942 8.009 7.189 513 H VAL 82 HN VAL 82 -3.498 10.409 8.648 514 HA VAL 82 HA VAL 82 -2.277 12.513 7.044 515 HB VAL 82 HB VAL 82 -1.682 11.703 9.896 516 H VAL 83 HN VAL 83 -0.556 12.106 5.826 517 HA VAL 83 HA VAL 83 1.132 9.792 6.500 518 HB VAL 83 HB VAL 83 0.128 9.536 4.332 519 H LYS 84 HN LYS 84 3.100 10.188 7.254 520 HA LYS 84 HA LYS 84 4.486 12.644 6.422 521 HB2 LYS 84 HB2 LYS 84 4.550 11.597 9.251 522 HB3 LYS 84 HB1 LYS 84 5.227 13.104 8.653 523 HG2 LYS 84 HG2 LYS 84 2.930 13.890 8.161 524 HG3 LYS 84 HG1 LYS 84 2.307 12.412 8.896 525 HD2 LYS 84 HD2 LYS 84 2.210 14.125 10.552 526 HD3 LYS 84 HD1 LYS 84 3.533 13.043 10.990 527 HE2 LYS 84 HE2 LYS 84 5.134 14.609 9.998 528 HE3 LYS 84 HE1 LYS 84 3.811 15.688 9.564 529 HZ1 LYS 84 HZ1 LYS 84 3.300 15.951 11.909 530 HZ2 LYS 84 HZ2 LYS 84 4.904 16.392 11.600 531 HZ3 LYS 84 HZ3 LYS 84 4.562 14.905 12.329 532 H MET 85 HN MET 85 6.767 12.522 6.436 533 HA MET 85 HA MET 85 7.772 9.771 6.304 534 HB2 MET 85 HB2 MET 85 9.647 10.720 5.012 535 HB3 MET 85 HB1 MET 85 8.090 11.078 4.278 536 HG2 MET 85 HG2 MET 85 8.155 13.328 5.172 537 HG3 MET 85 HG1 MET 85 9.677 12.978 5.990 538 HE1 MET 85 HE1 MET 85 11.983 12.621 4.761 539 HE2 MET 85 HE2 MET 85 12.150 12.523 3.008 540 HE3 MET 85 HE3 MET 85 11.265 11.273 3.881 541 H GLU 86 HN GLU 86 9.374 9.038 7.606 542 HA GLU 86 HA GLU 86 10.133 10.744 9.833 543 HB2 GLU 86 HB2 GLU 86 9.336 8.448 10.268 544 HB3 GLU 86 HB1 GLU 86 10.699 7.814 9.358 545 HG2 GLU 86 HG2 GLU 86 11.077 7.672 11.757 546 HG3 GLU 86 HG1 GLU 86 12.244 8.740 10.983 547 H GLY 87 HN GLY 87 11.395 9.740 6.868 548 HA2 GLY 87 HA2 GLY 87 13.453 11.169 6.374 549 HA3 GLY 87 HA1 GLY 87 14.151 10.318 7.741 550 H ASP 88 HN ASP 88 15.435 8.708 7.212 551 HA ASP 88 HA ASP 88 15.128 7.460 4.576 552 HB2 ASP 88 HB2 ASP 88 17.517 7.417 6.427 553 HB3 ASP 88 HB1 ASP 88 17.460 6.808 4.776 554 H ASN 89 HN ASN 89 14.349 5.526 4.436 555 HA ASN 89 HA ASN 89 13.896 3.334 4.811 556 HB2 ASN 89 HB2 ASN 89 15.726 3.595 7.201 557 HB3 ASN 89 HB1 ASN 89 15.092 2.085 6.555 558 H LYS 90 HN LYS 90 12.975 5.816 6.803 559 HA LYS 90 HA LYS 90 11.047 4.037 8.132 560 HB2 LYS 90 HB2 LYS 90 12.572 6.321 9.360 561 HB3 LYS 90 HB1 LYS 90 11.109 5.664 10.081 562 HG2 LYS 90 HG2 LYS 90 12.647 4.452 11.204 563 HG3 LYS 90 HG1 LYS 90 12.423 3.392 9.816 564 HD2 LYS 90 HD2 LYS 90 14.387 4.344 8.744 565 HD3 LYS 90 HD1 LYS 90 14.601 5.461 10.092 566 HE2 LYS 90 HE2 LYS 90 14.736 2.452 10.249 567 HE3 LYS 90 HE1 LYS 90 16.117 3.547 10.262 568 HZ1 LYS 90 HZ1 LYS 90 13.968 3.440 12.310 569 HZ2 LYS 90 HZ2 LYS 90 15.277 4.509 12.319 570 HZ3 LYS 90 HZ3 LYS 90 15.542 2.849 12.492 571 H MET 91 HN MET 91 9.006 4.539 7.922 572 HA MET 91 HA MET 91 8.186 7.289 7.344 573 HB2 MET 91 HB2 MET 91 7.227 4.903 5.745 574 HB3 MET 91 HB1 MET 91 6.720 6.571 5.531 575 HG2 MET 91 HG2 MET 91 9.503 5.521 5.078 576 HG3 MET 91 HG1 MET 91 8.312 5.858 3.823 577 HE1 MET 91 HE1 MET 91 11.358 7.069 4.036 578 HE2 MET 91 HE2 MET 91 11.035 8.695 3.436 579 HE3 MET 91 HE3 MET 91 10.271 7.304 2.669 580 H VAL 92 HN VAL 92 6.269 7.837 8.334 581 HA VAL 92 HA VAL 92 4.831 5.645 9.680 582 HB VAL 92 HB VAL 92 4.318 7.284 11.517 583 H THR 93 HN THR 93 2.824 5.445 9.040 584 HA THR 93 HA THR 93 1.253 7.846 8.417 585 HB THR 93 HB THR 93 1.831 6.952 6.260 586 HG1 THR 93 HG1 THR 93 -0.284 6.478 5.507 587 H THR 94 HN THR 94 -0.739 7.869 9.332 588 HA THR 94 HA THR 94 -1.687 5.354 10.558 589 HB THR 94 HB THR 94 -2.026 8.150 11.658 590 HG1 THR 94 HG1 THR 94 -0.092 7.696 12.412 591 H PHE 95 HN PHE 95 -3.635 4.683 9.926 592 HA PHE 95 HA PHE 95 -5.606 6.647 9.008 593 HD1 PHE 95 HD1 PHE 95 -2.793 3.973 7.729 594 HD2 PHE 95 HD2 PHE 95 -6.881 3.145 6.884 595 HE1 PHE 95 HE1 PHE 95 -2.244 1.595 7.421 596 HE2 PHE 95 HE2 PHE 95 -6.340 0.765 6.575 597 HZ PHE 95 HZ PHE 95 -4.018 -0.013 6.844 598 HB2 PHE 95 HB2 PHE 95 -6.161 5.354 7.037 599 HB3 PHE 95 HB1 PHE 95 -4.448 5.753 7.008 600 H LYS 96 HN LYS 96 -7.663 6.217 9.590 601 HA LYS 96 HA LYS 96 -9.365 5.321 10.799 602 HB2 LYS 96 HB2 LYS 96 -8.276 2.780 9.579 603 HB3 LYS 96 HB1 LYS 96 -9.835 2.913 10.384 604 HG2 LYS 96 HG2 LYS 96 -10.526 4.581 8.705 605 HG3 LYS 96 HG1 LYS 96 -8.985 4.348 7.876 606 HD2 LYS 96 HD2 LYS 96 -10.991 2.155 8.400 607 HD3 LYS 96 HD1 LYS 96 -10.871 3.055 6.887 608 HE2 LYS 96 HE2 LYS 96 -8.609 2.256 6.554 609 HE3 LYS 96 HE1 LYS 96 -8.643 1.432 8.113 610 HZ1 LYS 96 HZ1 LYS 96 -9.045 -0.087 6.263 611 HZ2 LYS 96 HZ2 LYS 96 -10.408 0.804 5.807 612 HZ3 LYS 96 HZ3 LYS 96 -10.387 -0.006 7.291 613 H GLY 97 HN GLY 97 -7.639 2.321 11.229 614 HA2 GLY 97 HA2 GLY 97 -6.852 3.070 13.950 615 HA3 GLY 97 HA1 GLY 97 -7.982 1.737 13.759 616 H ILE 98 HN ILE 98 -6.224 1.491 11.091 617 HA ILE 98 HA ILE 98 -4.505 -0.562 12.232 618 HB ILE 98 HB ILE 98 -5.009 0.181 9.345 619 H LYS 99 HN LYS 99 -2.305 -0.495 12.278 620 HA LYS 99 HA LYS 99 -1.080 2.088 11.649 621 HB2 LYS 99 HB2 LYS 99 -0.863 0.727 13.906 622 HB3 LYS 99 HB1 LYS 99 0.411 -0.105 13.018 623 HG2 LYS 99 HG2 LYS 99 1.556 2.001 12.639 624 HG3 LYS 99 HG1 LYS 99 0.266 2.870 13.471 625 HD2 LYS 99 HD2 LYS 99 1.961 0.726 14.741 626 HD3 LYS 99 HD1 LYS 99 2.293 2.455 14.864 627 HE2 LYS 99 HE2 LYS 99 -0.253 1.112 15.766 628 HE3 LYS 99 HE1 LYS 99 1.085 1.548 16.826 629 HZ1 LYS 99 HZ1 LYS 99 -0.640 3.219 16.893 630 HZ2 LYS 99 HZ2 LYS 99 -0.549 3.435 15.218 631 HZ3 LYS 99 HZ3 LYS 99 0.758 3.870 16.196 632 H SER 100 HN SER 100 0.216 2.363 9.966 633 HA SER 100 HA SER 100 1.324 -0.032 8.663 634 HG SER 100 HG SER 100 1.161 1.711 5.526 635 HB2 SER 100 HB2 SER 100 -0.470 0.958 7.305 636 HB3 SER 100 HB1 SER 100 0.365 2.509 7.328 637 H VAL 101 HN VAL 101 3.458 -0.103 8.718 638 HA VAL 101 HA VAL 101 4.957 2.437 8.816 639 HB VAL 101 HB VAL 101 5.755 -0.255 9.950 640 H THR 102 HN THR 102 6.160 2.851 7.082 641 HA THR 102 HA THR 102 6.838 0.606 5.302 642 HB THR 102 HB THR 102 6.403 3.510 4.587 643 HG1 THR 102 HG1 THR 102 4.495 2.811 3.733 644 H GLU 103 HN GLU 103 8.891 0.160 4.957 645 HA GLU 103 HA GLU 103 10.947 1.998 5.936 646 HB2 GLU 103 HB2 GLU 103 11.051 -0.359 6.663 647 HB3 GLU 103 HB1 GLU 103 11.154 -0.874 4.986 648 HG2 GLU 103 HG2 GLU 103 13.283 0.408 4.799 649 HG3 GLU 103 HG1 GLU 103 13.189 0.709 6.533 650 H PHE 104 HN PHE 104 12.029 3.267 4.527 651 HA PHE 104 HA PHE 104 11.737 2.624 1.664 652 HD1 PHE 104 HD2 PHE 104 12.603 4.975 -0.364 653 HD2 PHE 104 HD1 PHE 104 9.178 4.919 2.163 654 HE1 PHE 104 HE2 PHE 104 11.160 5.370 -2.316 655 HE2 PHE 104 HE1 PHE 104 7.729 5.315 0.214 656 HZ PHE 104 HZ PHE 104 8.715 5.539 -2.028 657 HB2 PHE 104 HB2 PHE 104 11.345 5.022 3.098 658 HB3 PHE 104 HB1 PHE 104 12.770 5.264 2.093 659 H ASN 105 HN ASN 105 13.415 1.765 0.699 660 HA ASN 105 HA ASN 105 16.105 2.661 1.483 661 HB2 ASN 105 HB2 ASN 105 15.308 0.208 2.082 662 HB3 ASN 105 HB1 ASN 105 15.714 -0.094 0.395 663 H GLY 106 HN GLY 106 17.687 2.666 -0.212 664 HA2 GLY 106 HA2 GLY 106 16.568 3.490 -2.728 665 HA3 GLY 106 HA1 GLY 106 18.272 3.439 -2.310 666 H ASP 107 HN ASP 107 15.945 0.761 -2.239 667 HA ASP 107 HA ASP 107 16.733 -0.367 -4.709 668 HB2 ASP 107 HB2 ASP 107 18.844 -0.745 -3.487 669 HB3 ASP 107 HB1 ASP 107 17.962 -1.641 -2.254 670 H THR 108 HN THR 108 15.399 -0.850 -1.488 671 HA THR 108 HA THR 108 13.294 -2.504 -2.672 672 HB THR 108 HB THR 108 13.366 -4.066 -0.735 673 HG1 THR 108 HG1 THR 108 14.524 -3.166 0.847 674 H ILE 109 HN ILE 109 11.307 -2.367 -1.670 675 HA ILE 109 HA ILE 109 11.111 -0.479 0.588 676 HB ILE 109 HB ILE 109 9.351 -0.689 -1.849 677 H THR 110 HN THR 110 10.205 -1.323 2.340 678 HA THR 110 HA THR 110 8.507 -3.713 2.035 679 HB THR 110 HB THR 110 10.120 -2.896 4.460 680 HG1 THR 110 HG1 THR 110 11.159 -5.042 3.669 681 H ASN 111 HN ASN 111 6.521 -3.769 2.983 682 HA ASN 111 HA ASN 111 5.685 -1.359 4.460 683 HB2 ASN 111 HB2 ASN 111 4.064 -3.004 2.504 684 HB3 ASN 111 HB1 ASN 111 3.433 -1.671 3.468 685 H THR 112 HN THR 112 4.631 -1.647 6.353 686 HA THR 112 HA THR 112 4.004 -4.422 7.128 687 HB THR 112 HB THR 112 4.582 -2.419 9.253 688 HG1 THR 112 HG1 THR 112 6.898 -3.487 8.758 689 H MET 113 HN MET 113 1.908 -4.747 7.363 690 HA MET 113 HA MET 113 0.255 -2.578 8.474 691 HB2 MET 113 HB2 MET 113 -0.571 -4.629 6.408 692 HB3 MET 113 HB1 MET 113 -1.623 -3.414 7.119 693 HG2 MET 113 HG2 MET 113 -0.267 -1.649 6.124 694 HG3 MET 113 HG1 MET 113 0.800 -2.863 5.419 695 HE1 MET 113 HE1 MET 113 0.455 -1.745 3.010 696 HE2 MET 113 HE2 MET 113 -0.595 -0.538 3.749 697 HE3 MET 113 HE3 MET 113 -1.133 -1.416 2.316 698 H THR 114 HN THR 114 -0.573 -3.093 10.392 699 HA THR 114 HA THR 114 -1.026 -5.946 10.984 700 HB THR 114 HB THR 114 -0.110 -3.791 12.898 701 HG1 THR 114 HG1 THR 114 1.170 -6.121 11.863 702 H LEU 115 HN LEU 115 -3.064 -6.451 11.330 703 HA LEU 115 HA LEU 115 -4.843 -4.463 12.564 704 HG LEU 115 HG LEU 115 -5.132 -7.327 10.213 705 HB2 LEU 115 HB2 LEU 115 -6.665 -5.377 11.063 706 HB3 LEU 115 HB1 LEU 115 -5.462 -4.353 10.302 707 H GLY 116 HN GLY 116 -5.565 -5.249 14.418 708 HA2 GLY 116 HA2 GLY 116 -6.526 -6.710 15.923 709 HA3 GLY 116 HA1 GLY 116 -6.755 -7.847 14.600 710 H ASP 117 HN ASP 117 -4.858 -9.084 13.906 711 HA ASP 117 HA ASP 117 -2.614 -9.250 15.717 712 HB2 ASP 117 HB2 ASP 117 -4.362 -10.599 16.849 713 HB3 ASP 117 HB1 ASP 117 -4.472 -11.618 15.417 714 H ILE 118 HN ILE 118 -3.758 -9.253 12.698 715 HA ILE 118 HA ILE 118 -2.105 -11.365 11.596 716 HB ILE 118 HB ILE 118 -3.506 -9.314 9.939 717 H VAL 119 HN VAL 119 -0.217 -11.113 10.538 718 HA VAL 119 HA VAL 119 0.971 -8.425 10.520 719 HB VAL 119 HB VAL 119 2.337 -11.117 10.390 720 H TYR 120 HN TYR 120 1.133 -7.422 8.637 721 HA TYR 120 HA TYR 120 1.194 -9.043 6.174 722 HD1 TYR 120 HD2 TYR 120 1.426 -5.476 4.489 723 HD2 TYR 120 HD1 TYR 120 -1.416 -8.643 4.403 724 HE1 TYR 120 HE2 TYR 120 1.275 -5.268 2.043 725 HE2 TYR 120 HE1 TYR 120 -1.575 -8.441 1.959 726 HH TYR 120 HH TYR 120 -1.168 -6.697 0.224 727 HB2 TYR 120 HB2 TYR 120 -0.825 -7.620 6.475 728 HB3 TYR 120 HB1 TYR 120 0.213 -6.203 6.533 729 H LYS 121 HN LYS 121 3.097 -9.044 5.165 730 HA LYS 121 HA LYS 121 4.742 -6.608 5.257 731 HB2 LYS 121 HB2 LYS 121 5.716 -8.260 6.773 732 HB3 LYS 121 HB1 LYS 121 5.740 -9.453 5.481 733 HG2 LYS 121 HG2 LYS 121 7.366 -8.171 4.258 734 HG3 LYS 121 HG1 LYS 121 7.267 -6.860 5.433 735 HD2 LYS 121 HD2 LYS 121 9.250 -8.159 5.868 736 HD3 LYS 121 HD1 LYS 121 8.094 -8.419 7.175 737 HE2 LYS 121 HE2 LYS 121 7.409 -10.532 6.157 738 HE3 LYS 121 HE1 LYS 121 8.545 -10.267 4.833 739 HZ1 LYS 121 HZ1 LYS 121 10.364 -10.360 6.407 740 HZ2 LYS 121 HZ2 LYS 121 9.436 -11.769 6.514 741 HZ3 LYS 121 HZ3 LYS 121 9.286 -10.567 7.695 742 H ARG 122 HN ARG 122 5.199 -5.835 3.301 743 HA ARG 122 HA ARG 122 4.950 -7.650 0.998 744 HE ARG 122 HE ARG 122 3.916 -3.038 0.465 745 HB2 ARG 122 HB2 ARG 122 3.408 -5.995 0.571 746 HB3 ARG 122 HB1 ARG 122 4.348 -4.752 1.384 747 HG2 ARG 122 HG2 ARG 122 5.844 -4.586 -0.484 748 HG3 ARG 122 HG1 ARG 122 5.078 -5.966 -1.273 749 HD2 ARG 122 HD2 ARG 122 4.389 -3.736 -2.171 750 HD3 ARG 122 HD1 ARG 122 3.057 -4.748 -1.613 751 HH11 ARG 122 HH11 ARG 122 2.187 -2.995 -2.560 752 HH12 ARG 122 HH12 ARG 122 1.215 -1.626 -2.134 753 HH21 ARG 122 HH21 ARG 122 2.638 -1.237 1.036 754 HH22 ARG 122 HH22 ARG 122 1.473 -0.627 -0.091 755 H VAL 123 HN VAL 123 6.655 -8.087 -0.217 756 HA VAL 123 HA VAL 123 9.142 -6.594 0.279 757 HB VAL 123 HB VAL 123 8.793 -9.352 -0.916 758 H SER 124 HN SER 124 9.763 -5.220 -1.260 759 HA SER 124 HA SER 124 9.095 -5.847 -4.053 760 HG SER 124 HG SER 124 6.680 -3.363 -3.208 761 HB2 SER 124 HB2 SER 124 8.938 -3.084 -2.828 762 HB3 SER 124 HB1 SER 124 8.560 -3.519 -4.494 763 H LYS 125 HN LYS 125 10.555 -5.139 -5.619 764 HA LYS 125 HA LYS 125 13.103 -4.064 -4.611 765 HB2 LYS 125 HB2 LYS 125 14.291 -5.540 -6.204 766 HB3 LYS 125 HB1 LYS 125 13.404 -6.438 -4.987 767 HG2 LYS 125 HG2 LYS 125 11.898 -7.261 -6.461 768 HG3 LYS 125 HG1 LYS 125 12.073 -5.901 -7.564 769 HD2 LYS 125 HD2 LYS 125 13.050 -7.821 -8.610 770 HD3 LYS 125 HD1 LYS 125 14.361 -6.745 -8.120 771 HE2 LYS 125 HE2 LYS 125 14.943 -9.022 -7.575 772 HE3 LYS 125 HE1 LYS 125 14.677 -8.114 -6.087 773 HZ1 LYS 125 HZ1 LYS 125 12.469 -9.082 -5.933 774 HZ2 LYS 125 HZ2 LYS 125 13.646 -10.296 -5.994 775 HZ3 LYS 125 HZ3 LYS 125 12.720 -9.948 -7.365 776 H ARG 126 HN ARG 126 14.224 -2.684 -5.993 777 HA ARG 126 HA ARG 126 12.609 -1.221 -7.832 778 HE ARG 126 HE ARG 126 15.262 2.550 -9.857 779 HB2 ARG 126 HB2 ARG 126 14.322 -0.125 -6.459 780 HB3 ARG 126 HB1 ARG 126 15.578 -1.040 -7.281 781 HG2 ARG 126 HG2 ARG 126 15.023 0.062 -9.382 782 HG3 ARG 126 HG1 ARG 126 13.740 0.966 -8.574 783 HD2 ARG 126 HD2 ARG 126 15.384 2.040 -7.134 784 HD3 ARG 126 HD1 ARG 126 16.675 1.106 -7.890 785 HH11 ARG 126 HH11 ARG 126 17.513 3.025 -7.240 786 HH12 ARG 126 HH12 ARG 126 18.213 4.450 -7.931 787 HH21 ARG 126 HH21 ARG 126 16.181 4.423 -10.775 788 HH22 ARG 126 HH22 ARG 126 17.458 5.244 -9.942 789 H ILE 127 HN ILE 127 12.530 -1.273 -10.005 790 HA ILE 127 HA ILE 127 14.452 -2.968 -11.444 791 HB ILE 127 HB ILE 127 12.586 -3.791 -12.886 792 H9 OLA 128 HH1 OLA 128 -7.798 -7.899 -4.368 793 H10 OLA 128 HI1 OLA 128 -7.202 -6.525 -2.422 794 H21 OLA 128 HA1 OLA 128 -8.407 -8.215 -12.498 795 H22 OLA 128 HA2 OLA 128 -8.415 -9.807 -11.738 796 H31 OLA 128 HB1 OLA 128 -9.982 -7.644 -10.439 797 H32 OLA 128 HB2 OLA 128 -9.100 -8.993 -9.719 798 H41 OLA 128 HC1 OLA 128 -8.267 -6.339 -9.882 799 H42 OLA 128 HC2 OLA 128 -7.314 -7.188 -11.100 800 H51 OLA 128 HD1 OLA 128 -6.867 -8.921 -9.260 801 H52 OLA 128 HD2 OLA 128 -6.032 -7.370 -9.158 802 H61 OLA 128 HE1 OLA 128 -8.544 -8.122 -7.665 803 H62 OLA 128 HE2 OLA 128 -7.711 -6.570 -7.566 804 H71 OLA 128 HF1 OLA 128 -7.222 -8.941 -6.081 805 H72 OLA 128 HF2 OLA 128 -5.808 -8.623 -7.087 806 H81 OLA 128 HG1 OLA 128 -5.184 -7.211 -5.467 807 H82 OLA 128 HG2 OLA 128 -6.419 -6.132 -6.119 808 H111 OLA 128 HJ1 OLA 128 -4.633 -6.026 -3.652 809 H112 OLA 128 HJ2 OLA 128 -5.743 -4.748 -4.156 810 H121 OLA 128 HK1 OLA 128 -5.924 -5.360 -1.312 811 H122 OLA 128 HK2 OLA 128 -4.318 -4.815 -1.799 812 H131 OLA 128 HL1 OLA 128 -6.301 -3.136 -1.134 813 H132 OLA 128 HL2 OLA 128 -6.612 -3.284 -2.865 814 H141 OLA 128 HM1 OLA 128 -4.711 -2.193 -3.438 815 H142 OLA 128 HM2 OLA 128 -3.799 -2.849 -2.074 816 H151 OLA 128 HN1 OLA 128 -4.010 -0.858 -1.097 817 H152 OLA 128 HN2 OLA 128 -5.731 -1.210 -0.917 818 H161 OLA 128 HP1 OLA 128 -4.888 -0.191 -3.555 819 H162 OLA 128 HP2 OLA 128 -4.775 0.949 -2.212 820 H171 OLA 128 HQ1 OLA 128 -7.245 -0.227 -1.835 821 H172 OLA 128 HQ2 OLA 128 -7.129 -0.064 -3.595 822 H181 OLA 128 HR1 OLA 128 -6.201 2.278 -2.106 823 H182 OLA 128 HR2 OLA 128 -7.266 2.174 -3.508 824 H183 OLA 128 HR3 OLA 128 -7.912 1.914 -1.887 825 H9 OLA 129 HH1 OLA 129 -1.190 6.593 0.762 826 H10 OLA 129 HI1 OLA 129 -3.118 5.277 1.510 827 H21 OLA 129 HA1 OLA 129 4.979 2.578 1.206 828 H22 OLA 129 HA2 OLA 129 5.504 4.114 0.517 829 H31 OLA 129 HB1 OLA 129 3.387 4.767 0.002 830 H32 OLA 129 HB2 OLA 129 2.823 3.116 -0.263 831 H41 OLA 129 HC1 OLA 129 3.254 2.924 2.336 832 H42 OLA 129 HC2 OLA 129 1.746 3.587 1.701 833 H51 OLA 129 HD1 OLA 129 3.091 4.846 3.575 834 H52 OLA 129 HD2 OLA 129 4.033 5.432 2.200 835 H61 OLA 129 HE1 OLA 129 1.779 6.061 1.161 836 H62 OLA 129 HE2 OLA 129 2.370 7.053 2.497 837 H71 OLA 129 HF1 OLA 129 0.330 4.837 2.681 838 H72 OLA 129 HF2 OLA 129 0.953 5.762 4.047 839 H81 OLA 129 HG1 OLA 129 -0.808 7.107 3.686 840 H82 OLA 129 HG2 OLA 129 0.152 7.742 2.348 841 H111 OLA 129 HJ1 OLA 129 -1.642 5.062 4.077 842 H112 OLA 129 HJ2 OLA 129 -3.019 6.168 4.141 843 H121 OLA 129 HK1 OLA 129 -3.974 4.145 4.747 844 H122 OLA 129 HK2 OLA 129 -4.315 4.221 3.016 845 H131 OLA 129 HL1 OLA 129 -2.689 2.330 4.515 846 H132 OLA 129 HL2 OLA 129 -1.835 3.015 3.131 847 H141 OLA 129 HM1 OLA 129 -4.624 1.941 2.870 848 H142 OLA 129 HM2 OLA 129 -3.217 0.878 2.771 849 H151 OLA 129 HN1 OLA 129 -3.232 3.345 1.110 850 H152 OLA 129 HN2 OLA 129 -4.265 2.003 0.616 851 H161 OLA 129 HP1 OLA 129 -2.480 0.598 0.217 852 H162 OLA 129 HP2 OLA 129 -1.411 1.477 1.313 853 H171 OLA 129 HQ1 OLA 129 -1.759 1.798 -1.525 854 H172 OLA 129 HQ2 OLA 129 -2.120 3.313 -0.685 855 H181 OLA 129 HR1 OLA 129 0.296 2.945 -1.350 856 H182 OLA 129 HR2 OLA 129 0.343 1.688 -0.114 857 H183 OLA 129 HR3 OLA 129 0.006 3.360 0.339 Start of MODEL 4 1 HA MET 1 HA MET 1 16.701 12.881 -2.039 2 H1 MET 1 HT1 MET 1 18.869 12.332 -1.133 3 H2 MET 1 HT2 MET 1 18.878 10.879 -2.000 4 H3 MET 1 HT3 MET 1 17.726 11.132 -0.789 5 HB2 MET 1 HB2 MET 1 17.441 13.341 -4.345 6 HB3 MET 1 HB1 MET 1 18.681 13.737 -3.164 7 HG2 MET 1 HG2 MET 1 18.648 11.124 -4.636 8 HG3 MET 1 HG1 MET 1 19.423 12.566 -5.289 9 HE1 MET 1 HE1 MET 1 22.488 10.429 -4.155 10 HE2 MET 1 HE2 MET 1 21.758 11.344 -5.475 11 HE3 MET 1 HE3 MET 1 20.990 9.866 -4.896 12 H ASN 2 HN ASN 2 17.015 9.786 -1.788 13 HA ASN 2 HA ASN 2 15.714 8.850 -4.191 14 HB2 ASN 2 HB2 ASN 2 15.644 6.664 -2.961 15 HB3 ASN 2 HB1 ASN 2 17.259 7.342 -3.135 16 H PHE 3 HN PHE 3 13.623 9.145 -4.538 17 HA PHE 3 HA PHE 3 11.731 8.686 -2.362 18 HD1 PHE 3 HD2 PHE 3 10.722 10.701 -0.563 19 HD2 PHE 3 HD1 PHE 3 13.752 12.165 -3.166 20 HE1 PHE 3 HE2 PHE 3 11.797 11.835 1.336 21 HE2 PHE 3 HE1 PHE 3 14.836 13.301 -1.271 22 HZ PHE 3 HZ PHE 3 13.860 13.138 0.983 23 HB2 PHE 3 HB2 PHE 3 11.773 11.194 -4.050 24 HB3 PHE 3 HB1 PHE 3 10.435 10.721 -3.008 25 H SER 4 HN SER 4 12.238 9.292 -5.811 26 HA SER 4 HA SER 4 9.747 7.859 -6.407 27 HG SER 4 HG SER 4 10.314 8.839 -9.778 28 HB2 SER 4 HB2 SER 4 9.982 10.047 -7.479 29 HB3 SER 4 HB1 SER 4 11.506 9.542 -8.208 30 H GLY 5 HN GLY 5 9.713 5.946 -7.452 31 HA2 GLY 5 HA2 GLY 5 11.706 4.889 -9.097 32 HA3 GLY 5 HA1 GLY 5 12.026 4.326 -7.464 33 H LYS 6 HN LYS 6 11.275 2.769 -9.814 34 HA LYS 6 HA LYS 6 8.560 1.892 -9.186 35 HB2 LYS 6 HB2 LYS 6 9.210 2.227 -11.552 36 HB3 LYS 6 HB1 LYS 6 10.422 0.965 -11.380 37 HG2 LYS 6 HG2 LYS 6 8.685 -0.674 -10.938 38 HG3 LYS 6 HG1 LYS 6 7.453 0.583 -11.047 39 HD2 LYS 6 HD2 LYS 6 8.144 1.004 -13.385 40 HD3 LYS 6 HD1 LYS 6 9.290 -0.333 -13.259 41 HE2 LYS 6 HE2 LYS 6 7.231 -1.040 -14.356 42 HE3 LYS 6 HE1 LYS 6 7.454 -1.877 -12.820 43 HZ1 LYS 6 HZ1 LYS 6 5.893 -0.341 -11.799 44 HZ2 LYS 6 HZ2 LYS 6 5.173 -1.141 -13.104 45 HZ3 LYS 6 HZ3 LYS 6 5.680 0.463 -13.273 46 H TYR 7 HN TYR 7 8.240 0.333 -7.769 47 HA TYR 7 HA TYR 7 10.331 -1.699 -7.382 48 HD1 TYR 7 HD1 TYR 7 9.400 1.684 -6.096 49 HD2 TYR 7 HD2 TYR 7 11.621 -1.465 -4.292 50 HE1 TYR 7 HE1 TYR 7 11.136 3.293 -5.431 51 HE2 TYR 7 HE2 TYR 7 13.363 0.138 -3.622 52 HH TYR 7 HH TYR 7 14.191 2.311 -4.214 53 HB2 TYR 7 HB2 TYR 7 8.352 -0.560 -5.398 54 HB3 TYR 7 HB1 TYR 7 9.452 -1.891 -5.065 55 H GLN 8 HN GLN 8 9.674 -3.866 -7.144 56 HA GLN 8 HA GLN 8 6.888 -4.396 -7.949 57 HB2 GLN 8 HB2 GLN 8 8.424 -4.821 -9.801 58 HB3 GLN 8 HB1 GLN 8 9.381 -5.885 -8.781 59 HG2 GLN 8 HG2 GLN 8 8.134 -7.375 -9.999 60 HG3 GLN 8 HG1 GLN 8 7.178 -7.221 -8.527 61 H VAL 9 HN VAL 9 5.754 -5.685 -6.664 62 HA VAL 9 HA VAL 9 6.880 -6.781 -4.289 63 HB VAL 9 HB VAL 9 4.178 -7.354 -5.517 64 H GLN 10 HN GLN 10 7.762 -8.743 -3.968 65 HA GLN 10 HA GLN 10 7.629 -10.660 -6.180 66 HB2 GLN 10 HB2 GLN 10 9.640 -10.301 -3.965 67 HB3 GLN 10 HB1 GLN 10 9.660 -11.654 -5.085 68 HG2 GLN 10 HG2 GLN 10 9.826 -10.008 -6.951 69 HG3 GLN 10 HG1 GLN 10 10.013 -8.741 -5.740 70 H SER 11 HN SER 11 6.967 -10.309 -2.749 71 HA SER 11 HA SER 11 5.296 -12.622 -2.788 72 HG SER 11 HG SER 11 8.003 -11.761 -0.918 73 HB2 SER 11 HB2 SER 11 6.518 -13.959 -1.116 74 HB3 SER 11 HB1 SER 11 7.444 -13.776 -2.603 75 H GLN 12 HN GLN 12 4.330 -13.096 -0.668 76 HA GLN 12 HA GLN 12 4.501 -10.971 1.321 77 HB2 GLN 12 HB2 GLN 12 2.768 -10.055 0.007 78 HB3 GLN 12 HB1 GLN 12 2.050 -11.628 -0.298 79 HG2 GLN 12 HG2 GLN 12 0.619 -10.503 1.201 80 HG3 GLN 12 HG1 GLN 12 1.466 -11.730 2.141 81 H GLU 13 HN GLU 13 3.786 -11.607 3.384 82 HA GLU 13 HA GLU 13 3.537 -14.507 3.706 83 HB2 GLU 13 HB2 GLU 13 4.080 -12.360 5.766 84 HB3 GLU 13 HB1 GLU 13 4.075 -14.092 6.071 85 HG2 GLU 13 HG2 GLU 13 5.964 -12.649 4.226 86 HG3 GLU 13 HG1 GLU 13 6.337 -13.194 5.860 87 H ASN 14 HN ASN 14 1.678 -15.442 4.260 88 HA ASN 14 HA ASN 14 -0.459 -15.768 4.972 89 HB2 ASN 14 HB2 ASN 14 -0.053 -13.138 6.417 90 HB3 ASN 14 HB1 ASN 14 -1.407 -14.236 6.671 91 H PHE 15 HN PHE 15 -2.540 -15.323 4.271 92 HA PHE 15 HA PHE 15 -3.049 -12.826 2.853 93 HD1 PHE 15 HD1 PHE 15 -3.406 -12.108 0.206 94 HD2 PHE 15 HD2 PHE 15 -0.611 -15.251 0.845 95 HE1 PHE 15 HE1 PHE 15 -1.766 -10.932 -1.200 96 HE2 PHE 15 HE2 PHE 15 1.035 -14.081 -0.559 97 HZ PHE 15 HZ PHE 15 0.438 -11.938 -1.624 98 HB2 PHE 15 HB2 PHE 15 -2.807 -15.502 1.567 99 HB3 PHE 15 HB1 PHE 15 -4.075 -14.430 0.990 100 H GLU 16 HN GLU 16 -4.416 -16.066 3.381 101 HA GLU 16 HA GLU 16 -7.094 -15.399 3.217 102 HB2 GLU 16 HB2 GLU 16 -5.794 -17.548 4.895 103 HB3 GLU 16 HB1 GLU 16 -7.512 -17.459 4.531 104 HG2 GLU 16 HG2 GLU 16 -7.046 -17.713 2.163 105 HG3 GLU 16 HG1 GLU 16 -5.314 -17.744 2.493 106 HA PRO 17 HA PRO 17 -7.266 -14.768 8.011 107 HB2 PRO 17 HB2 PRO 17 -4.966 -14.069 9.274 108 HB3 PRO 17 HB1 PRO 17 -5.510 -15.742 9.111 109 HG2 PRO 17 HG2 PRO 17 -3.499 -14.240 7.477 110 HG3 PRO 17 HG1 PRO 17 -3.406 -15.888 8.124 111 HD2 PRO 17 HD2 PRO 17 -4.046 -15.392 5.553 112 HD3 PRO 17 HD1 PRO 17 -4.743 -16.754 6.452 113 H PHE 18 HN PHE 18 -4.695 -12.810 6.484 114 HA PHE 18 HA PHE 18 -5.366 -10.400 7.770 115 HD1 PHE 18 HD1 PHE 18 -3.105 -8.603 7.895 116 HD2 PHE 18 HD2 PHE 18 -4.701 -8.841 3.957 117 HE1 PHE 18 HE1 PHE 18 -2.892 -6.163 7.666 118 HE2 PHE 18 HE2 PHE 18 -4.490 -6.401 3.720 119 HZ PHE 18 HZ PHE 18 -3.585 -5.058 5.575 120 HB2 PHE 18 HB2 PHE 18 -3.203 -10.728 6.663 121 HB3 PHE 18 HB1 PHE 18 -4.008 -10.813 5.098 122 H MET 19 HN MET 19 -6.185 -11.573 4.520 123 HA MET 19 HA MET 19 -7.789 -9.380 3.796 124 HB2 MET 19 HB2 MET 19 -7.831 -12.231 2.814 125 HB3 MET 19 HB1 MET 19 -8.652 -10.887 2.034 126 HG2 MET 19 HG2 MET 19 -5.681 -11.138 2.441 127 HG3 MET 19 HG1 MET 19 -6.549 -11.420 0.931 128 HE1 MET 19 HE1 MET 19 -4.041 -9.392 1.259 129 HE2 MET 19 HE2 MET 19 -4.617 -8.071 0.242 130 HE3 MET 19 HE3 MET 19 -4.865 -9.744 -0.259 131 H LYS 20 HN LYS 20 -8.632 -12.511 5.263 132 HA LYS 20 HA LYS 20 -11.413 -12.207 5.180 133 HB2 LYS 20 HB2 LYS 20 -9.558 -13.780 6.931 134 HB3 LYS 20 HB1 LYS 20 -11.273 -13.718 7.311 135 HG2 LYS 20 HG2 LYS 20 -11.805 -14.618 5.111 136 HG3 LYS 20 HG1 LYS 20 -10.089 -14.654 4.706 137 HD2 LYS 20 HD2 LYS 20 -9.677 -16.247 6.496 138 HD3 LYS 20 HD1 LYS 20 -11.376 -16.177 6.972 139 HE2 LYS 20 HE2 LYS 20 -10.332 -17.134 4.308 140 HE3 LYS 20 HE1 LYS 20 -10.880 -18.169 5.627 141 HZ1 LYS 20 HZ1 LYS 20 -13.081 -17.196 5.431 142 HZ2 LYS 20 HZ2 LYS 20 -12.599 -17.873 3.958 143 HZ3 LYS 20 HZ3 LYS 20 -12.555 -16.196 4.171 144 H ALA 21 HN ALA 21 -9.048 -11.171 7.593 145 HA ALA 21 HA ALA 21 -10.922 -10.183 9.469 146 HB1 ALA 21 HB1 ALA 21 -8.046 -9.377 9.027 147 HB2 ALA 21 HB2 ALA 21 -8.614 -10.668 10.087 148 HB3 ALA 21 HB3 ALA 21 -9.016 -8.988 10.449 149 H MET 22 HN MET 22 -9.718 -8.985 6.488 150 HA MET 22 HA MET 22 -10.512 -6.238 7.015 151 HB2 MET 22 HB2 MET 22 -8.493 -6.557 5.726 152 HB3 MET 22 HB1 MET 22 -9.336 -7.587 4.578 153 HG2 MET 22 HG2 MET 22 -9.038 -5.470 3.558 154 HG3 MET 22 HG1 MET 22 -10.745 -5.627 3.964 155 HE1 MET 22 HE1 MET 22 -9.318 -2.847 3.227 156 HE2 MET 22 HE2 MET 22 -10.065 -1.789 4.423 157 HE3 MET 22 HE3 MET 22 -11.036 -3.007 3.595 158 H GLY 23 HN GLY 23 -11.132 -8.280 4.180 159 HA2 GLY 23 HA2 GLY 23 -13.772 -8.787 4.269 160 HA3 GLY 23 HA1 GLY 23 -13.746 -7.081 3.847 161 H LEU 24 HN LEU 24 -11.459 -9.577 2.832 162 HA LEU 24 HA LEU 24 -12.325 -9.112 0.059 163 HG LEU 24 HG LEU 24 -10.231 -10.157 -1.580 164 HB2 LEU 24 HB2 LEU 24 -9.987 -8.350 0.827 165 HB3 LEU 24 HB1 LEU 24 -9.586 -10.054 0.837 166 HA PRO 25 HA PRO 25 -13.341 -13.427 0.022 167 HB2 PRO 25 HB2 PRO 25 -13.783 -13.732 -2.616 168 HB3 PRO 25 HB1 PRO 25 -14.894 -12.832 -1.575 169 HG2 PRO 25 HG2 PRO 25 -12.750 -11.796 -3.395 170 HG3 PRO 25 HG1 PRO 25 -14.412 -11.216 -3.186 171 HD2 PRO 25 HD2 PRO 25 -12.279 -10.029 -2.008 172 HD3 PRO 25 HD1 PRO 25 -13.895 -10.048 -1.274 173 H GLU 26 HN GLU 26 -12.192 -15.222 -0.029 174 HA GLU 26 HA GLU 26 -9.518 -15.393 -0.620 175 HB2 GLU 26 HB2 GLU 26 -11.545 -17.595 -0.642 176 HB3 GLU 26 HB1 GLU 26 -9.811 -17.842 -0.591 177 HG2 GLU 26 HG2 GLU 26 -9.707 -16.699 1.556 178 HG3 GLU 26 HG1 GLU 26 -11.447 -16.420 1.497 179 H ASP 27 HN ASP 27 -12.235 -15.914 -2.781 180 HA ASP 27 HA ASP 27 -10.918 -17.240 -4.854 181 HB2 ASP 27 HB2 ASP 27 -13.165 -15.228 -5.095 182 HB3 ASP 27 HB1 ASP 27 -12.717 -16.430 -6.301 183 H LEU 28 HN LEU 28 -11.390 -13.749 -4.362 184 HA LEU 28 HA LEU 28 -9.907 -12.988 -6.668 185 HG LEU 28 HG LEU 28 -11.348 -11.065 -7.235 186 HB2 LEU 28 HB2 LEU 28 -10.979 -11.553 -4.276 187 HB3 LEU 28 HB1 LEU 28 -9.830 -10.739 -5.321 188 H ILE 29 HN ILE 29 -9.102 -13.439 -3.283 189 HA ILE 29 HA ILE 29 -6.592 -12.201 -3.251 190 HB ILE 29 HB ILE 29 -7.546 -14.541 -1.602 191 H GLN 30 HN GLN 30 -7.444 -15.602 -3.867 192 HA GLN 30 HA GLN 30 -4.827 -16.564 -4.119 193 HB2 GLN 30 HB2 GLN 30 -7.360 -17.553 -5.438 194 HB3 GLN 30 HB1 GLN 30 -5.851 -18.452 -5.354 195 HG2 GLN 30 HG2 GLN 30 -7.535 -17.583 -3.015 196 HG3 GLN 30 HG1 GLN 30 -7.419 -19.217 -3.670 197 H LYS 31 HN LYS 31 -7.034 -15.220 -6.539 198 HA LYS 31 HA LYS 31 -5.322 -15.671 -8.758 199 HB2 LYS 31 HB2 LYS 31 -7.575 -13.685 -8.418 200 HB3 LYS 31 HB1 LYS 31 -6.815 -14.105 -9.947 201 HG2 LYS 31 HG2 LYS 31 -7.654 -16.323 -9.853 202 HG3 LYS 31 HG1 LYS 31 -8.191 -16.113 -8.184 203 HD2 LYS 31 HD2 LYS 31 -9.857 -14.514 -8.872 204 HD3 LYS 31 HD1 LYS 31 -9.256 -14.546 -10.531 205 HE2 LYS 31 HE2 LYS 31 -9.887 -16.901 -10.714 206 HE3 LYS 31 HE1 LYS 31 -10.476 -16.877 -9.052 207 HZ1 LYS 31 HZ1 LYS 31 -12.115 -15.215 -9.703 208 HZ2 LYS 31 HZ2 LYS 31 -12.289 -16.629 -10.616 209 HZ3 LYS 31 HZ3 LYS 31 -11.559 -15.267 -11.302 210 H GLY 32 HN GLY 32 -5.645 -13.071 -6.434 211 HA2 GLY 32 HA2 GLY 32 -4.097 -11.166 -7.899 212 HA3 GLY 32 HA1 GLY 32 -4.537 -11.063 -6.203 213 H LYS 33 HN LYS 33 -3.346 -13.302 -5.154 214 HA LYS 33 HA LYS 33 -0.693 -12.453 -4.818 215 HB2 LYS 33 HB2 LYS 33 -0.370 -14.567 -3.586 216 HB3 LYS 33 HB1 LYS 33 -1.831 -13.723 -3.096 217 HG2 LYS 33 HG2 LYS 33 -3.179 -15.236 -4.439 218 HG3 LYS 33 HG1 LYS 33 -1.722 -16.062 -4.990 219 HD2 LYS 33 HD2 LYS 33 -2.535 -15.846 -2.095 220 HD3 LYS 33 HD1 LYS 33 -2.950 -17.213 -3.131 221 HE2 LYS 33 HE2 LYS 33 -0.161 -16.273 -2.466 222 HE3 LYS 33 HE1 LYS 33 -0.965 -17.687 -1.785 223 HZ1 LYS 33 HZ1 LYS 33 -0.272 -17.289 -4.646 224 HZ2 LYS 33 HZ2 LYS 33 -1.073 -18.639 -4.013 225 HZ3 LYS 33 HZ3 LYS 33 0.525 -18.317 -3.563 226 H ASP 34 HN ASP 34 -2.139 -14.754 -7.015 227 HA ASP 34 HA ASP 34 0.191 -16.122 -7.795 228 HB2 ASP 34 HB2 ASP 34 -2.134 -16.853 -8.319 229 HB3 ASP 34 HB1 ASP 34 -2.247 -15.543 -9.491 230 H ILE 35 HN ILE 35 -0.929 -12.950 -8.459 231 HA ILE 35 HA ILE 35 1.070 -12.636 -10.600 232 HB ILE 35 HB ILE 35 -1.389 -10.980 -10.011 233 H LYS 36 HN LYS 36 2.845 -11.535 -10.119 234 HA LYS 36 HA LYS 36 3.370 -10.416 -7.606 235 HB2 LYS 36 HB2 LYS 36 4.733 -9.903 -10.257 236 HB3 LYS 36 HB1 LYS 36 5.378 -9.438 -8.690 237 HG2 LYS 36 HG2 LYS 36 5.419 -11.813 -8.032 238 HG3 LYS 36 HG1 LYS 36 4.858 -12.242 -9.650 239 HD2 LYS 36 HD2 LYS 36 6.859 -11.264 -10.626 240 HD3 LYS 36 HD1 LYS 36 7.408 -10.751 -9.030 241 HE2 LYS 36 HE2 LYS 36 8.566 -12.768 -9.678 242 HE3 LYS 36 HE1 LYS 36 7.486 -13.112 -8.328 243 HZ1 LYS 36 HZ1 LYS 36 6.956 -13.713 -11.188 244 HZ2 LYS 36 HZ2 LYS 36 5.873 -13.997 -9.920 245 HZ3 LYS 36 HZ3 LYS 36 7.338 -14.839 -9.983 246 H GLY 37 HN GLY 37 2.476 -8.666 -6.746 247 HA2 GLY 37 HA2 GLY 37 0.970 -6.757 -8.104 248 HA3 GLY 37 HA1 GLY 37 1.658 -6.537 -6.503 249 H VAL 38 HN VAL 38 1.340 -4.520 -8.490 250 HA VAL 38 HA VAL 38 4.166 -3.858 -9.017 251 HB VAL 38 HB VAL 38 1.817 -2.885 -10.646 252 H SER 39 HN SER 39 4.887 -1.961 -8.226 253 HA SER 39 HA SER 39 2.920 0.022 -7.330 254 HG SER 39 HG SER 39 2.976 -2.082 -5.871 255 HB2 SER 39 HB2 SER 39 5.232 -0.999 -5.666 256 HB3 SER 39 HB1 SER 39 4.181 0.348 -5.228 257 H GLU 40 HN GLU 40 3.447 2.079 -7.731 258 HA GLU 40 HA GLU 40 6.225 2.736 -8.419 259 HB2 GLU 40 HB2 GLU 40 4.995 2.393 -10.525 260 HB3 GLU 40 HB1 GLU 40 3.795 3.570 -10.014 261 HG2 GLU 40 HG2 GLU 40 5.371 5.339 -10.109 262 HG3 GLU 40 HG1 GLU 40 6.703 4.217 -10.383 263 H ILE 41 HN ILE 41 6.920 4.660 -7.596 264 HA ILE 41 HA ILE 41 4.879 6.357 -6.310 265 HB ILE 41 HB ILE 41 7.678 5.945 -5.270 266 H VAL 42 HN VAL 42 4.774 8.300 -7.175 267 HA VAL 42 HA VAL 42 7.186 9.475 -8.387 268 HB VAL 42 HB VAL 42 4.376 10.475 -8.804 269 H HIS 43 HN HIS 43 8.182 10.905 -7.087 270 HA HIS 43 HA HIS 43 6.506 12.478 -5.245 271 HD1 HIS 43 HD1 HIS 43 7.061 11.712 -2.034 272 HD2 HIS 43 HD2 HIS 43 9.751 14.369 -3.757 273 HE1 HIS 43 HE1 HIS 43 7.422 13.511 -0.317 274 HE2 HIS 43 HE2 HIS 43 8.976 15.159 -1.421 275 HB2 HIS 43 HB2 HIS 43 8.053 10.841 -4.168 276 HB3 HIS 43 HB1 HIS 43 9.406 11.724 -4.862 277 H GLU 44 HN GLU 44 6.321 14.523 -5.798 278 HA GLU 44 HA GLU 44 8.670 15.967 -6.787 279 HB2 GLU 44 HB2 GLU 44 5.917 16.068 -8.032 280 HB3 GLU 44 HB1 GLU 44 7.238 17.157 -8.432 281 HG2 GLU 44 HG2 GLU 44 8.554 15.308 -9.263 282 HG3 GLU 44 HG1 GLU 44 7.290 14.171 -8.793 283 H GLY 45 HN GLY 45 8.997 17.246 -5.042 284 HA2 GLY 45 HA2 GLY 45 8.676 19.005 -3.601 285 HA3 GLY 45 HA1 GLY 45 7.320 19.476 -4.612 286 H LYS 46 HN LYS 46 8.050 16.782 -2.396 287 HA LYS 46 HA LYS 46 6.945 15.927 -0.608 288 HB2 LYS 46 HB2 LYS 46 5.286 18.438 -0.543 289 HB3 LYS 46 HB1 LYS 46 5.627 17.340 0.782 290 HG2 LYS 46 HG2 LYS 46 7.972 18.003 0.743 291 HG3 LYS 46 HG1 LYS 46 7.643 19.105 -0.593 292 HD2 LYS 46 HD2 LYS 46 5.877 20.126 0.996 293 HD3 LYS 46 HD1 LYS 46 6.777 19.292 2.265 294 HE2 LYS 46 HE2 LYS 46 7.741 21.417 2.199 295 HE3 LYS 46 HE1 LYS 46 8.847 20.411 1.262 296 HZ1 LYS 46 HZ1 LYS 46 7.836 21.227 -0.763 297 HZ2 LYS 46 HZ2 LYS 46 8.404 22.520 0.165 298 HZ3 LYS 46 HZ3 LYS 46 6.749 22.175 0.120 299 H LYS 47 HN LYS 47 5.411 16.714 -3.473 300 HA LYS 47 HA LYS 47 2.837 15.555 -2.744 301 HB2 LYS 47 HB2 LYS 47 2.738 17.470 -4.189 302 HB3 LYS 47 HB1 LYS 47 3.912 16.772 -5.292 303 HG2 LYS 47 HG2 LYS 47 2.272 15.009 -5.857 304 HG3 LYS 47 HG1 LYS 47 1.095 15.826 -4.827 305 HD2 LYS 47 HD2 LYS 47 1.098 17.752 -6.202 306 HD3 LYS 47 HD1 LYS 47 2.486 17.176 -7.126 307 HE2 LYS 47 HE2 LYS 47 1.091 15.272 -7.908 308 HE3 LYS 47 HE1 LYS 47 -0.289 15.999 -7.086 309 HZ1 LYS 47 HZ1 LYS 47 1.274 17.261 -9.274 310 HZ2 LYS 47 HZ2 LYS 47 -0.057 17.949 -8.491 311 HZ3 LYS 47 HZ3 LYS 47 -0.257 16.561 -9.435 312 H VAL 48 HN VAL 48 2.809 13.400 -2.610 313 HA VAL 48 HA VAL 48 4.406 11.851 -4.525 314 HB VAL 48 HB VAL 48 4.949 11.435 -2.192 315 H LYS 49 HN LYS 49 3.545 10.263 -5.755 316 HA LYS 49 HA LYS 49 0.638 9.825 -5.609 317 HB2 LYS 49 HB2 LYS 49 2.343 10.119 -8.090 318 HB3 LYS 49 HB1 LYS 49 0.656 9.620 -8.092 319 HG2 LYS 49 HG2 LYS 49 0.091 11.804 -7.017 320 HG3 LYS 49 HG1 LYS 49 1.771 12.288 -7.261 321 HD2 LYS 49 HD2 LYS 49 0.520 13.172 -9.081 322 HD3 LYS 49 HD1 LYS 49 1.450 11.810 -9.708 323 HE2 LYS 49 HE2 LYS 49 -0.536 10.380 -9.505 324 HE3 LYS 49 HE1 LYS 49 -1.461 11.758 -8.911 325 HZ1 LYS 49 HZ1 LYS 49 -1.044 12.878 -11.029 326 HZ2 LYS 49 HZ2 LYS 49 -1.866 11.416 -11.250 327 HZ3 LYS 49 HZ3 LYS 49 -0.213 11.516 -11.596 328 H LEU 50 HN LEU 50 0.131 7.733 -5.332 329 HA LEU 50 HA LEU 50 2.200 5.732 -5.955 330 HG LEU 50 HG LEU 50 2.897 4.449 -4.031 331 HB2 LEU 50 HB2 LEU 50 1.190 6.203 -3.538 332 HB3 LEU 50 HB1 LEU 50 -0.048 5.105 -4.112 333 H THR 51 HN THR 51 1.775 4.182 -7.384 334 HA THR 51 HA THR 51 -1.020 3.812 -8.239 335 HB THR 51 HB THR 51 1.431 3.615 -10.002 336 HG1 THR 51 HG1 THR 51 -0.085 5.736 -9.258 337 H ILE 52 HN ILE 52 -1.778 1.817 -8.048 338 HA ILE 52 HA ILE 52 0.123 -0.430 -7.958 339 HB ILE 52 HB ILE 52 -2.348 -0.097 -6.249 340 H THR 53 HN THR 53 -0.300 -1.993 -9.397 341 HA THR 53 HA THR 53 -2.996 -2.061 -10.586 342 HB THR 53 HB THR 53 -0.403 -2.840 -11.932 343 HG1 THR 53 HG1 THR 53 -0.920 -0.891 -13.186 344 H TYR 54 HN TYR 54 -4.100 -3.907 -10.513 345 HA TYR 54 HA TYR 54 -2.669 -6.368 -9.750 346 HD1 TYR 54 HD2 TYR 54 -2.349 -7.094 -7.555 347 HD2 TYR 54 HD1 TYR 54 -5.294 -4.068 -7.040 348 HE1 TYR 54 HE2 TYR 54 -1.309 -6.454 -5.423 349 HE2 TYR 54 HE1 TYR 54 -4.260 -3.418 -4.905 350 HH TYR 54 HH TYR 54 -1.194 -4.441 -3.960 351 HB2 TYR 54 HB2 TYR 54 -5.405 -5.404 -8.904 352 HB3 TYR 54 HB1 TYR 54 -4.853 -7.058 -8.670 353 H GLY 55 HN GLY 55 -2.563 -7.617 -11.513 354 HA2 GLY 55 HA2 GLY 55 -3.261 -8.913 -13.275 355 HA3 GLY 55 HA1 GLY 55 -4.907 -8.659 -12.716 356 H SER 56 HN SER 56 -6.059 -6.790 -13.461 357 HA SER 56 HA SER 56 -4.886 -5.436 -15.785 358 HG SER 56 HG SER 56 -5.552 -7.334 -17.561 359 HB2 SER 56 HB2 SER 56 -7.617 -6.742 -15.753 360 HB3 SER 56 HB1 SER 56 -6.967 -5.763 -17.067 361 H LYS 57 HN LYS 57 -5.723 -4.803 -12.909 362 HA LYS 57 HA LYS 57 -7.510 -2.544 -13.536 363 HB2 LYS 57 HB2 LYS 57 -8.592 -4.014 -11.984 364 HB3 LYS 57 HB1 LYS 57 -7.154 -4.106 -10.980 365 HG2 LYS 57 HG2 LYS 57 -7.412 -1.791 -10.325 366 HG3 LYS 57 HG1 LYS 57 -8.790 -1.613 -11.413 367 HD2 LYS 57 HD2 LYS 57 -9.624 -1.928 -9.185 368 HD3 LYS 57 HD1 LYS 57 -9.961 -3.388 -10.117 369 HE2 LYS 57 HE2 LYS 57 -9.148 -3.937 -7.884 370 HE3 LYS 57 HE1 LYS 57 -8.023 -4.483 -9.126 371 HZ1 LYS 57 HZ1 LYS 57 -7.743 -2.030 -7.475 372 HZ2 LYS 57 HZ2 LYS 57 -6.675 -2.509 -8.695 373 HZ3 LYS 57 HZ3 LYS 57 -6.846 -3.454 -7.303 374 H VAL 58 HN VAL 58 -6.641 -0.586 -13.423 375 HA VAL 58 HA VAL 58 -4.066 -0.267 -12.058 376 HB VAL 58 HB VAL 58 -5.454 1.538 -14.047 377 H ILE 59 HN ILE 59 -3.910 0.796 -10.200 378 HA ILE 59 HA ILE 59 -6.195 2.436 -9.328 379 HB ILE 59 HB ILE 59 -4.271 0.891 -7.587 380 H HIS 60 HN HIS 60 -5.767 4.521 -9.265 381 HA HIS 60 HA HIS 60 -2.987 5.397 -8.861 382 HD1 HIS 60 HD1 HIS 60 -5.974 8.572 -8.940 383 HD2 HIS 60 HD2 HIS 60 -6.472 5.553 -11.752 384 HE1 HIS 60 HE1 HIS 60 -8.380 8.712 -9.660 385 HE2 HIS 60 HE2 HIS 60 -8.637 6.927 -11.418 386 HB2 HIS 60 HB2 HIS 60 -3.752 7.559 -9.856 387 HB3 HIS 60 HB1 HIS 60 -3.887 6.185 -10.950 388 H ASN 61 HN ASN 61 -2.434 6.813 -7.260 389 HA ASN 61 HA ASN 61 -4.510 8.013 -5.608 390 HB2 ASN 61 HB2 ASN 61 -2.427 6.121 -4.494 391 HB3 ASN 61 HB1 ASN 61 -3.489 7.134 -3.521 392 H GLU 62 HN GLU 62 -3.691 9.655 -4.157 393 HA GLU 62 HA GLU 62 -0.925 10.497 -4.554 394 HB2 GLU 62 HB2 GLU 62 -2.190 11.611 -6.342 395 HB3 GLU 62 HB1 GLU 62 -3.292 12.283 -5.149 396 HG2 GLU 62 HG2 GLU 62 -1.407 13.517 -4.149 397 HG3 GLU 62 HG1 GLU 62 -0.358 12.893 -5.422 398 H PHE 63 HN PHE 63 -0.056 11.275 -2.693 399 HA PHE 63 HA PHE 63 -1.893 12.322 -0.651 400 HD1 PHE 63 HD1 PHE 63 -2.890 9.409 -0.546 401 HD2 PHE 63 HD2 PHE 63 1.348 9.081 -0.624 402 HE1 PHE 63 HE1 PHE 63 -3.086 7.167 -1.542 403 HE2 PHE 63 HE2 PHE 63 1.165 6.844 -1.626 404 HZ PHE 63 HZ PHE 63 -1.056 5.882 -2.086 405 HB2 PHE 63 HB2 PHE 63 0.369 10.857 0.480 406 HB3 PHE 63 HB1 PHE 63 -1.331 10.815 0.922 407 H THR 64 HN THR 64 -0.976 13.770 0.847 408 HA THR 64 HA THR 64 1.566 14.973 -0.045 409 HB THR 64 HB THR 64 -0.688 16.296 1.493 410 HG1 THR 64 HG1 THR 64 -1.511 16.685 -0.409 411 H LEU 65 HN LEU 65 3.215 14.516 1.294 412 HA LEU 65 HA LEU 65 3.068 13.177 3.677 413 HG LEU 65 HG LEU 65 4.815 15.624 1.608 414 HB2 LEU 65 HB2 LEU 65 5.353 14.140 4.162 415 HB3 LEU 65 HB1 LEU 65 5.164 13.286 2.645 416 H GLY 66 HN GLY 66 3.139 13.695 5.850 417 HA2 GLY 66 HA2 GLY 66 2.515 14.838 7.732 418 HA3 GLY 66 HA1 GLY 66 3.287 16.226 6.986 419 H GLU 67 HN GLU 67 0.571 14.659 5.461 420 HA GLU 67 HA GLU 67 -1.289 16.654 6.501 421 HB2 GLU 67 HB2 GLU 67 -0.573 16.335 3.590 422 HB3 GLU 67 HB1 GLU 67 -2.074 17.083 4.116 423 HG2 GLU 67 HG2 GLU 67 0.658 18.039 4.932 424 HG3 GLU 67 HG1 GLU 67 -0.249 18.677 3.562 425 H GLU 68 HN GLU 68 -3.468 16.078 6.338 426 HA GLU 68 HA GLU 68 -3.917 13.219 6.040 427 HB2 GLU 68 HB2 GLU 68 -4.798 14.435 8.007 428 HB3 GLU 68 HB1 GLU 68 -5.805 15.406 6.941 429 HG2 GLU 68 HG2 GLU 68 -7.001 13.400 6.236 430 HG3 GLU 68 HG1 GLU 68 -5.986 12.423 7.295 431 H CYS 69 HN CYS 69 -4.737 12.324 4.275 432 HA CYS 69 HA CYS 69 -6.311 13.988 2.427 433 HG CYS 69 HG CYS 69 -3.660 11.127 3.064 434 HB2 CYS 69 HB2 CYS 69 -5.325 12.659 0.562 435 HB3 CYS 69 HB1 CYS 69 -4.144 13.638 1.424 436 H GLU 70 HN GLU 70 -7.846 12.812 1.090 437 HA GLU 70 HA GLU 70 -9.003 10.562 2.557 438 HB2 GLU 70 HB2 GLU 70 -10.464 12.467 2.037 439 HB3 GLU 70 HB1 GLU 70 -10.156 12.237 0.322 440 HG2 GLU 70 HG2 GLU 70 -11.184 9.998 0.471 441 HG3 GLU 70 HG1 GLU 70 -11.566 10.320 2.162 442 H LEU 71 HN LEU 71 -8.910 8.536 1.840 443 HA LEU 71 HA LEU 71 -8.097 8.081 -0.957 444 HG LEU 71 HG LEU 71 -5.055 6.811 0.740 445 HB2 LEU 71 HB2 LEU 71 -7.435 6.458 1.501 446 HB3 LEU 71 HB1 LEU 71 -7.070 5.961 -0.140 447 H GLU 72 HN GLU 72 -9.090 6.523 -2.126 448 HA GLU 72 HA GLU 72 -11.702 5.703 -1.180 449 HB2 GLU 72 HB2 GLU 72 -11.959 6.357 -3.352 450 HB3 GLU 72 HB1 GLU 72 -10.320 5.904 -3.794 451 HG2 GLU 72 HG2 GLU 72 -10.968 3.570 -3.869 452 HG3 GLU 72 HG1 GLU 72 -12.611 3.995 -3.392 453 H THR 73 HN THR 73 -12.172 3.765 -0.379 454 HA THR 73 HA THR 73 -10.115 1.759 -0.152 455 HB THR 73 HB THR 73 -11.767 0.494 1.163 456 HG1 THR 73 HG1 THR 73 -13.511 1.956 -0.186 457 H MET 74 HN MET 74 -10.952 -0.619 -0.436 458 HA MET 74 HA MET 74 -11.354 -0.999 -3.225 459 HB2 MET 74 HB2 MET 74 -11.348 -3.388 -2.702 460 HB3 MET 74 HB1 MET 74 -10.033 -2.564 -1.876 461 HG2 MET 74 HG2 MET 74 -11.333 -2.555 0.190 462 HG3 MET 74 HG1 MET 74 -12.650 -3.383 -0.637 463 HE1 MET 74 HE1 MET 74 -11.422 -4.416 2.049 464 HE2 MET 74 HE2 MET 74 -11.173 -6.136 1.751 465 HE3 MET 74 HE3 MET 74 -12.657 -5.354 1.208 466 H THR 75 HN THR 75 -13.464 -0.844 -0.485 467 HA THR 75 HA THR 75 -15.693 -2.108 -1.823 468 HB THR 75 HB THR 75 -16.967 -1.653 0.161 469 HG1 THR 75 HG1 THR 75 -16.228 0.485 0.555 470 H GLY 76 HN GLY 76 -14.787 1.178 -0.832 471 HA2 GLY 76 HA2 GLY 76 -15.410 2.811 -2.711 472 HA3 GLY 76 HA1 GLY 76 -17.040 2.223 -2.417 473 H GLU 77 HN GLU 77 -15.533 2.170 0.492 474 HA GLU 77 HA GLU 77 -16.921 4.515 1.399 475 HB2 GLU 77 HB2 GLU 77 -16.975 2.609 2.824 476 HB3 GLU 77 HB1 GLU 77 -15.228 2.484 2.799 477 HG2 GLU 77 HG2 GLU 77 -14.996 4.479 4.097 478 HG3 GLU 77 HG1 GLU 77 -16.728 4.794 3.993 479 H LYS 78 HN LYS 78 -16.069 6.410 2.163 480 HA LYS 78 HA LYS 78 -13.381 7.037 1.254 481 HB2 LYS 78 HB2 LYS 78 -15.489 8.818 2.495 482 HB3 LYS 78 HB1 LYS 78 -13.983 9.362 1.771 483 HG2 LYS 78 HG2 LYS 78 -16.227 7.965 0.325 484 HG3 LYS 78 HG1 LYS 78 -15.871 9.692 0.269 485 HD2 LYS 78 HD2 LYS 78 -13.663 9.182 -0.698 486 HD3 LYS 78 HD1 LYS 78 -14.068 7.464 -0.681 487 HE2 LYS 78 HE2 LYS 78 -14.416 8.431 -2.894 488 HE3 LYS 78 HE1 LYS 78 -15.938 7.883 -2.191 489 HZ1 LYS 78 HZ1 LYS 78 -16.440 10.160 -1.576 490 HZ2 LYS 78 HZ2 LYS 78 -16.160 10.053 -3.242 491 HZ3 LYS 78 HZ3 LYS 78 -14.970 10.693 -2.224 492 H VAL 79 HN VAL 79 -11.680 6.883 2.549 493 HA VAL 79 HA VAL 79 -12.100 7.140 5.455 494 HB VAL 79 HB VAL 79 -10.118 5.707 5.761 495 H LYS 80 HN LYS 80 -10.511 8.211 6.680 496 HA LYS 80 HA LYS 80 -8.907 10.117 5.123 497 HB2 LYS 80 HB2 LYS 80 -9.828 10.289 7.998 498 HB3 LYS 80 HB1 LYS 80 -8.936 11.529 7.128 499 HG2 LYS 80 HG2 LYS 80 -10.811 11.809 5.591 500 HG3 LYS 80 HG1 LYS 80 -11.706 10.558 6.454 501 HD2 LYS 80 HD2 LYS 80 -10.717 13.119 7.704 502 HD3 LYS 80 HD1 LYS 80 -12.352 12.876 7.090 503 HE2 LYS 80 HE2 LYS 80 -12.668 11.032 8.673 504 HE3 LYS 80 HE1 LYS 80 -11.037 11.287 9.291 505 HZ1 LYS 80 HZ1 LYS 80 -13.258 13.255 9.406 506 HZ2 LYS 80 HZ2 LYS 80 -11.694 13.503 9.999 507 HZ3 LYS 80 HZ3 LYS 80 -12.689 12.331 10.704 508 H ALA 81 HN ALA 81 -6.748 10.050 5.209 509 HA ALA 81 HA ALA 81 -5.429 8.785 7.482 510 HB1 ALA 81 HB1 ALA 81 -4.915 7.881 4.654 511 HB2 ALA 81 HB2 ALA 81 -5.836 6.979 5.857 512 HB3 ALA 81 HB3 ALA 81 -4.118 7.291 6.113 513 H VAL 82 HN VAL 82 -3.403 9.537 7.891 514 HA VAL 82 HA VAL 82 -2.389 11.632 6.090 515 HB VAL 82 HB VAL 82 -3.006 12.644 8.165 516 H VAL 83 HN VAL 83 -0.570 11.155 5.068 517 HA VAL 83 HA VAL 83 1.114 8.991 6.089 518 HB VAL 83 HB VAL 83 0.453 8.775 3.758 519 H LYS 84 HN LYS 84 2.911 9.439 7.159 520 HA LYS 84 HA LYS 84 4.246 12.016 6.665 521 HB2 LYS 84 HB2 LYS 84 2.856 11.768 8.857 522 HB3 LYS 84 HB1 LYS 84 4.194 10.765 9.393 523 HG2 LYS 84 HG2 LYS 84 5.689 12.741 8.775 524 HG3 LYS 84 HG1 LYS 84 4.194 13.676 8.713 525 HD2 LYS 84 HD2 LYS 84 5.127 12.079 11.096 526 HD3 LYS 84 HD1 LYS 84 5.347 13.818 10.903 527 HE2 LYS 84 HE2 LYS 84 2.693 12.383 10.966 528 HE3 LYS 84 HE1 LYS 84 3.407 13.269 12.313 529 HZ1 LYS 84 HZ1 LYS 84 2.653 14.443 9.691 530 HZ2 LYS 84 HZ2 LYS 84 3.306 15.289 11.001 531 HZ3 LYS 84 HZ3 LYS 84 1.767 14.596 11.124 532 H MET 85 HN MET 85 6.458 11.975 6.596 533 HA MET 85 HA MET 85 7.679 9.312 6.656 534 HB2 MET 85 HB2 MET 85 9.518 10.338 5.372 535 HB3 MET 85 HB1 MET 85 7.964 10.523 4.573 536 HG2 MET 85 HG2 MET 85 8.868 12.604 4.293 537 HG3 MET 85 HG1 MET 85 7.933 12.834 5.769 538 HE1 MET 85 HE1 MET 85 9.273 15.022 6.258 539 HE2 MET 85 HE2 MET 85 10.324 14.832 4.854 540 HE3 MET 85 HE3 MET 85 11.025 15.109 6.450 541 H GLU 86 HN GLU 86 9.395 8.811 7.941 542 HA GLU 86 HA GLU 86 9.864 10.610 10.179 543 HB2 GLU 86 HB2 GLU 86 9.341 8.194 10.537 544 HB3 GLU 86 HB1 GLU 86 10.868 7.791 9.766 545 HG2 GLU 86 HG2 GLU 86 11.062 7.698 12.177 546 HG3 GLU 86 HG1 GLU 86 12.076 8.982 11.519 547 H GLY 87 HN GLY 87 11.257 9.914 7.224 548 HA2 GLY 87 HA2 GLY 87 13.173 11.583 6.883 549 HA3 GLY 87 HA1 GLY 87 13.955 10.655 8.152 550 H ASP 88 HN ASP 88 15.170 8.977 7.566 551 HA ASP 88 HA ASP 88 14.991 8.091 4.767 552 HB2 ASP 88 HB2 ASP 88 17.104 9.198 5.288 553 HB3 ASP 88 HB1 ASP 88 17.371 8.094 6.632 554 H ASN 89 HN ASN 89 14.300 6.139 4.423 555 HA ASN 89 HA ASN 89 13.982 3.894 4.566 556 HB2 ASN 89 HB2 ASN 89 16.316 3.746 5.361 557 HB3 ASN 89 HB1 ASN 89 15.753 3.972 7.013 558 H LYS 90 HN LYS 90 12.961 6.111 6.819 559 HA LYS 90 HA LYS 90 11.082 4.138 7.922 560 HB2 LYS 90 HB2 LYS 90 12.514 6.324 9.417 561 HB3 LYS 90 HB1 LYS 90 11.089 5.510 10.047 562 HG2 LYS 90 HG2 LYS 90 12.704 4.271 11.029 563 HG3 LYS 90 HG1 LYS 90 12.502 3.355 9.539 564 HD2 LYS 90 HD2 LYS 90 14.411 4.497 8.554 565 HD3 LYS 90 HD1 LYS 90 14.596 5.477 10.008 566 HE2 LYS 90 HE2 LYS 90 14.849 2.475 9.864 567 HE3 LYS 90 HE1 LYS 90 16.191 3.613 9.947 568 HZ1 LYS 90 HZ1 LYS 90 15.680 2.674 12.113 569 HZ2 LYS 90 HZ2 LYS 90 14.098 3.265 12.024 570 HZ3 LYS 90 HZ3 LYS 90 15.398 4.342 12.105 571 H MET 91 HN MET 91 9.015 4.626 7.793 572 HA MET 91 HA MET 91 8.147 7.404 7.505 573 HB2 MET 91 HB2 MET 91 8.397 6.509 5.212 574 HB3 MET 91 HB1 MET 91 7.313 5.187 5.620 575 HG2 MET 91 HG2 MET 91 5.542 6.870 6.081 576 HG3 MET 91 HG1 MET 91 6.637 8.113 5.477 577 HE1 MET 91 HE1 MET 91 7.472 8.270 2.976 578 HE2 MET 91 HE2 MET 91 7.073 7.086 1.732 579 HE3 MET 91 HE3 MET 91 8.105 6.629 3.088 580 H VAL 92 HN VAL 92 6.348 7.803 8.704 581 HA VAL 92 HA VAL 92 4.885 5.452 9.718 582 HB VAL 92 HB VAL 92 5.315 8.083 11.136 583 H THR 93 HN THR 93 2.897 5.292 9.005 584 HA THR 93 HA THR 93 1.279 7.719 8.670 585 HB THR 93 HB THR 93 1.794 7.247 6.425 586 HG1 THR 93 HG1 THR 93 -0.371 5.868 5.957 587 H THR 94 HN THR 94 -0.876 7.515 9.245 588 HA THR 94 HA THR 94 -1.704 4.870 10.265 589 HB THR 94 HB THR 94 -2.915 6.009 12.096 590 HG1 THR 94 HG1 THR 94 -1.430 8.350 11.647 591 H PHE 95 HN PHE 95 -3.638 4.163 9.549 592 HA PHE 95 HA PHE 95 -5.594 6.122 8.598 593 HD1 PHE 95 HD1 PHE 95 -2.672 3.533 7.430 594 HD2 PHE 95 HD2 PHE 95 -6.653 2.755 6.142 595 HE1 PHE 95 HE1 PHE 95 -2.079 1.179 7.032 596 HE2 PHE 95 HE2 PHE 95 -6.067 0.399 5.743 597 HZ PHE 95 HZ PHE 95 -3.778 -0.393 6.188 598 HB2 PHE 95 HB2 PHE 95 -5.983 4.945 6.527 599 HB3 PHE 95 HB1 PHE 95 -4.276 5.354 6.638 600 H LYS 96 HN LYS 96 -7.561 5.729 9.339 601 HA LYS 96 HA LYS 96 -9.344 4.721 10.319 602 HB2 LYS 96 HB2 LYS 96 -9.159 3.441 8.133 603 HB3 LYS 96 HB1 LYS 96 -8.369 2.165 9.048 604 HG2 LYS 96 HG2 LYS 96 -10.343 1.853 10.399 605 HG3 LYS 96 HG1 LYS 96 -11.137 3.214 9.605 606 HD2 LYS 96 HD2 LYS 96 -11.968 1.175 8.645 607 HD3 LYS 96 HD1 LYS 96 -10.954 1.988 7.450 608 HE2 LYS 96 HE2 LYS 96 -9.088 0.511 8.040 609 HE3 LYS 96 HE1 LYS 96 -10.112 -0.305 9.222 610 HZ1 LYS 96 HZ1 LYS 96 -10.614 -0.205 6.296 611 HZ2 LYS 96 HZ2 LYS 96 -11.559 -1.020 7.437 612 HZ3 LYS 96 HZ3 LYS 96 -9.975 -1.529 7.135 613 H GLY 97 HN GLY 97 -6.589 4.592 11.622 614 HA2 GLY 97 HA2 GLY 97 -6.158 4.040 13.872 615 HA3 GLY 97 HA1 GLY 97 -7.437 2.837 13.798 616 H ILE 98 HN ILE 98 -5.812 2.273 11.081 617 HA ILE 98 HA ILE 98 -4.294 0.097 12.269 618 HB ILE 98 HB ILE 98 -4.907 0.772 9.388 619 H LYS 99 HN LYS 99 -2.085 -0.080 12.228 620 HA LYS 99 HA LYS 99 -0.655 2.364 11.496 621 HB2 LYS 99 HB2 LYS 99 -0.480 0.890 13.753 622 HB3 LYS 99 HB1 LYS 99 0.809 0.155 12.801 623 HG2 LYS 99 HG2 LYS 99 1.848 2.339 12.501 624 HG3 LYS 99 HG1 LYS 99 0.554 3.090 13.437 625 HD2 LYS 99 HD2 LYS 99 2.382 0.942 14.501 626 HD3 LYS 99 HD1 LYS 99 2.654 2.671 14.721 627 HE2 LYS 99 HE2 LYS 99 0.570 2.884 15.927 628 HE3 LYS 99 HE1 LYS 99 0.183 1.192 15.620 629 HZ1 LYS 99 HZ1 LYS 99 2.076 0.539 16.950 630 HZ2 LYS 99 HZ2 LYS 99 1.059 1.543 17.855 631 HZ3 LYS 99 HZ3 LYS 99 2.498 2.157 17.212 632 H SER 100 HN SER 100 0.443 2.490 9.698 633 HA SER 100 HA SER 100 1.472 0.016 8.493 634 HG SER 100 HG SER 100 -0.873 2.649 7.546 635 HB2 SER 100 HB2 SER 100 1.255 1.356 6.287 636 HB3 SER 100 HB1 SER 100 -0.212 0.684 6.998 637 H VAL 101 HN VAL 101 3.611 -0.055 8.456 638 HA VAL 101 HA VAL 101 5.094 2.490 8.507 639 HB VAL 101 HB VAL 101 6.061 -0.205 9.469 640 H THR 102 HN THR 102 6.212 2.974 6.752 641 HA THR 102 HA THR 102 6.959 0.795 4.919 642 HB THR 102 HB THR 102 6.443 3.691 4.220 643 HG1 THR 102 HG1 THR 102 4.528 2.509 4.758 644 H GLU 103 HN GLU 103 9.048 0.491 4.483 645 HA GLU 103 HA GLU 103 10.995 2.382 5.552 646 HB2 GLU 103 HB2 GLU 103 11.060 -0.496 4.721 647 HB3 GLU 103 HB1 GLU 103 12.553 0.421 4.773 648 HG2 GLU 103 HG2 GLU 103 12.298 -0.758 6.833 649 HG3 GLU 103 HG1 GLU 103 12.090 0.967 7.138 650 H PHE 104 HN PHE 104 12.140 3.712 4.243 651 HA PHE 104 HA PHE 104 11.873 3.250 1.340 652 HD1 PHE 104 HD2 PHE 104 12.633 5.932 -0.488 653 HD2 PHE 104 HD1 PHE 104 9.197 5.234 1.920 654 HE1 PHE 104 HE2 PHE 104 11.187 6.381 -2.428 655 HE2 PHE 104 HE1 PHE 104 7.743 5.680 -0.014 656 HZ PHE 104 HZ PHE 104 8.726 6.288 -2.176 657 HB2 PHE 104 HB2 PHE 104 11.354 5.536 2.918 658 HB3 PHE 104 HB1 PHE 104 12.770 5.906 1.942 659 H ASN 105 HN ASN 105 13.618 2.475 0.412 660 HA ASN 105 HA ASN 105 16.237 3.524 1.233 661 HB2 ASN 105 HB2 ASN 105 15.525 0.685 0.489 662 HB3 ASN 105 HB1 ASN 105 17.179 1.277 0.588 663 H GLY 106 HN GLY 106 17.830 3.635 -0.466 664 HA2 GLY 106 HA2 GLY 106 16.719 4.561 -2.917 665 HA3 GLY 106 HA1 GLY 106 18.430 4.372 -2.562 666 H ASP 107 HN ASP 107 16.304 1.626 -2.226 667 HA ASP 107 HA ASP 107 16.620 0.651 -4.880 668 HB2 ASP 107 HB2 ASP 107 18.096 -1.279 -4.286 669 HB3 ASP 107 HB1 ASP 107 18.904 0.285 -4.239 670 H THR 108 HN THR 108 15.572 0.268 -1.597 671 HA THR 108 HA THR 108 13.665 -1.763 -2.514 672 HB THR 108 HB THR 108 15.506 -2.986 -1.438 673 HG1 THR 108 HG1 THR 108 13.846 -3.632 0.470 674 H ILE 109 HN ILE 109 11.693 -1.792 -1.499 675 HA ILE 109 HA ILE 109 11.241 0.098 0.700 676 HB ILE 109 HB ILE 109 9.639 -0.036 -1.853 677 H THR 110 HN THR 110 10.225 -0.861 2.334 678 HA THR 110 HA THR 110 8.625 -3.272 1.767 679 HB THR 110 HB THR 110 10.090 -2.616 4.330 680 HG1 THR 110 HG1 THR 110 10.983 -4.818 3.091 681 H ASN 111 HN ASN 111 6.602 -3.459 2.621 682 HA ASN 111 HA ASN 111 5.586 -1.131 4.114 683 HB2 ASN 111 HB2 ASN 111 4.538 -1.162 1.971 684 HB3 ASN 111 HB1 ASN 111 4.235 -2.894 2.069 685 H THR 112 HN THR 112 4.619 -1.461 6.033 686 HA THR 112 HA THR 112 4.094 -4.252 6.840 687 HB THR 112 HB THR 112 4.775 -2.081 8.811 688 HG1 THR 112 HG1 THR 112 6.484 -3.503 7.101 689 H MET 113 HN MET 113 2.001 -4.643 7.157 690 HA MET 113 HA MET 113 0.304 -2.465 8.190 691 HB2 MET 113 HB2 MET 113 -0.407 -4.596 6.167 692 HB3 MET 113 HB1 MET 113 -1.578 -3.523 6.920 693 HG2 MET 113 HG2 MET 113 -0.439 -1.595 5.948 694 HG3 MET 113 HG1 MET 113 0.734 -2.672 5.194 695 HE1 MET 113 HE1 MET 113 0.214 -1.501 2.856 696 HE2 MET 113 HE2 MET 113 -0.999 -0.464 3.609 697 HE3 MET 113 HE3 MET 113 -1.402 -1.384 2.159 698 H THR 114 HN THR 114 -0.538 -2.890 10.128 699 HA THR 114 HA THR 114 -0.781 -5.717 10.934 700 HB THR 114 HB THR 114 -0.397 -3.331 12.749 701 HG1 THR 114 HG1 THR 114 1.410 -4.271 11.271 702 H LEU 115 HN LEU 115 -2.767 -6.457 11.230 703 HA LEU 115 HA LEU 115 -4.877 -4.592 12.083 704 HG LEU 115 HG LEU 115 -7.304 -5.507 9.423 705 HB2 LEU 115 HB2 LEU 115 -4.947 -5.235 9.609 706 HB3 LEU 115 HB1 LEU 115 -5.331 -6.858 10.143 707 H GLY 116 HN GLY 116 -5.568 -5.205 14.025 708 HA2 GLY 116 HA2 GLY 116 -6.302 -6.537 15.748 709 HA3 GLY 116 HA1 GLY 116 -6.523 -7.817 14.565 710 H ASP 117 HN ASP 117 -4.749 -9.204 14.080 711 HA ASP 117 HA ASP 117 -2.391 -9.049 15.778 712 HB2 ASP 117 HB2 ASP 117 -4.224 -11.459 15.821 713 HB3 ASP 117 HB1 ASP 117 -2.671 -11.331 16.639 714 H ILE 118 HN ILE 118 -3.241 -9.032 12.869 715 HA ILE 118 HA ILE 118 -1.686 -11.331 11.899 716 HB ILE 118 HB ILE 118 -3.293 -9.537 10.113 717 H VAL 119 HN VAL 119 0.147 -11.061 10.727 718 HA VAL 119 HA VAL 119 1.147 -8.309 10.462 719 HB VAL 119 HB VAL 119 2.773 -10.845 10.365 720 H TYR 120 HN TYR 120 1.298 -7.435 8.543 721 HA TYR 120 HA TYR 120 1.421 -9.196 6.181 722 HD1 TYR 120 HD2 TYR 120 1.146 -5.991 3.978 723 HD2 TYR 120 HD1 TYR 120 -1.389 -9.304 4.814 724 HE1 TYR 120 HE2 TYR 120 0.714 -6.260 1.572 725 HE2 TYR 120 HE1 TYR 120 -1.830 -9.581 2.412 726 HH TYR 120 HH TYR 120 0.001 -8.068 0.021 727 HB2 TYR 120 HB2 TYR 120 -0.706 -7.821 6.571 728 HB3 TYR 120 HB1 TYR 120 0.276 -6.398 6.242 729 H LYS 121 HN LYS 121 3.338 -9.079 5.170 730 HA LYS 121 HA LYS 121 4.766 -6.500 5.185 731 HB2 LYS 121 HB2 LYS 121 5.800 -8.117 6.770 732 HB3 LYS 121 HB1 LYS 121 6.071 -9.218 5.425 733 HG2 LYS 121 HG2 LYS 121 7.529 -7.580 4.363 734 HG3 LYS 121 HG1 LYS 121 7.240 -6.453 5.689 735 HD2 LYS 121 HD2 LYS 121 9.338 -7.513 6.095 736 HD3 LYS 121 HD1 LYS 121 8.178 -8.184 7.242 737 HE2 LYS 121 HE2 LYS 121 7.900 -10.149 5.821 738 HE3 LYS 121 HE1 LYS 121 9.036 -9.475 4.654 739 HZ1 LYS 121 HZ1 LYS 121 10.122 -11.085 6.065 740 HZ2 LYS 121 HZ2 LYS 121 9.660 -10.240 7.456 741 HZ3 LYS 121 HZ3 LYS 121 10.755 -9.546 6.370 742 H ARG 122 HN ARG 122 5.179 -5.756 3.224 743 HA ARG 122 HA ARG 122 5.074 -7.627 0.962 744 HE ARG 122 HE ARG 122 5.758 -3.999 -2.844 745 HB2 ARG 122 HB2 ARG 122 3.431 -6.020 0.596 746 HB3 ARG 122 HB1 ARG 122 4.406 -4.721 1.264 747 HG2 ARG 122 HG2 ARG 122 5.488 -5.968 -1.165 748 HG3 ARG 122 HG1 ARG 122 3.960 -5.109 -1.370 749 HD2 ARG 122 HD2 ARG 122 5.018 -3.160 -0.187 750 HD3 ARG 122 HD1 ARG 122 6.550 -4.024 -0.281 751 HH11 ARG 122 HH11 ARG 122 5.959 -1.488 -0.441 752 HH12 ARG 122 HH12 ARG 122 6.279 -0.232 -1.591 753 HH21 ARG 122 HH21 ARG 122 6.182 -2.358 -4.367 754 HH22 ARG 122 HH22 ARG 122 6.401 -0.728 -3.825 755 H VAL 123 HN VAL 123 6.849 -8.067 -0.140 756 HA VAL 123 HA VAL 123 9.245 -6.429 0.327 757 HB VAL 123 HB VAL 123 9.038 -9.229 -0.802 758 H SER 124 HN SER 124 9.792 -5.043 -1.235 759 HA SER 124 HA SER 124 9.340 -5.828 -4.025 760 HG SER 124 HG SER 124 9.715 -2.852 -2.408 761 HB2 SER 124 HB2 SER 124 8.573 -3.594 -4.604 762 HB3 SER 124 HB1 SER 124 7.546 -4.260 -3.335 763 H LYS 125 HN LYS 125 10.915 -5.274 -5.448 764 HA LYS 125 HA LYS 125 13.228 -3.813 -4.355 765 HB2 LYS 125 HB2 LYS 125 14.632 -5.221 -5.864 766 HB3 LYS 125 HB1 LYS 125 13.824 -6.129 -4.595 767 HG2 LYS 125 HG2 LYS 125 13.414 -7.503 -6.338 768 HG3 LYS 125 HG1 LYS 125 12.003 -6.456 -6.479 769 HD2 LYS 125 HD2 LYS 125 12.954 -6.724 -8.661 770 HD3 LYS 125 HD1 LYS 125 13.278 -5.077 -8.123 771 HE2 LYS 125 HE2 LYS 125 15.544 -5.753 -7.461 772 HE3 LYS 125 HE1 LYS 125 15.213 -7.390 -8.024 773 HZ1 LYS 125 HZ1 LYS 125 16.440 -6.108 -9.666 774 HZ2 LYS 125 HZ2 LYS 125 15.205 -4.954 -9.722 775 HZ3 LYS 125 HZ3 LYS 125 14.912 -6.532 -10.256 776 H ARG 126 HN ARG 126 14.374 -2.441 -5.758 777 HA ARG 126 HA ARG 126 12.753 -1.129 -7.705 778 HE ARG 126 HE ARG 126 15.443 2.621 -9.828 779 HB2 ARG 126 HB2 ARG 126 14.356 0.099 -6.311 780 HB3 ARG 126 HB1 ARG 126 15.686 -0.773 -7.060 781 HG2 ARG 126 HG2 ARG 126 15.156 0.235 -9.211 782 HG3 ARG 126 HG1 ARG 126 13.794 1.091 -8.482 783 HD2 ARG 126 HD2 ARG 126 15.319 2.293 -7.014 784 HD3 ARG 126 HD1 ARG 126 16.686 1.410 -7.689 785 HH11 ARG 126 HH11 ARG 126 16.945 3.657 -6.857 786 HH12 ARG 126 HH12 ARG 126 17.474 5.174 -7.502 787 HH21 ARG 126 HH21 ARG 126 16.139 4.617 -10.686 788 HH22 ARG 126 HH22 ARG 126 17.016 5.721 -9.680 789 H ILE 127 HN ILE 127 12.482 -1.684 -9.749 790 HA ILE 127 HA ILE 127 14.466 -3.435 -11.023 791 HB ILE 127 HB ILE 127 12.733 -3.981 -12.654 792 H9 OLA 128 HH1 OLA 128 -8.707 -5.829 -5.673 793 H10 OLA 128 HI1 OLA 128 -8.435 -4.442 -3.665 794 H21 OLA 128 HA1 OLA 128 -8.648 -12.092 -10.237 795 H22 OLA 128 HA2 OLA 128 -10.389 -11.829 -10.146 796 H31 OLA 128 HB1 OLA 128 -9.781 -9.618 -8.979 797 H32 OLA 128 HB2 OLA 128 -9.628 -11.121 -8.067 798 H41 OLA 128 HC1 OLA 128 -7.178 -10.687 -9.422 799 H42 OLA 128 HC2 OLA 128 -7.491 -10.665 -7.684 800 H51 OLA 128 HD1 OLA 128 -6.837 -8.490 -9.412 801 H52 OLA 128 HD2 OLA 128 -8.445 -8.222 -8.739 802 H61 OLA 128 HE1 OLA 128 -6.406 -7.357 -7.425 803 H62 OLA 128 HE2 OLA 128 -6.151 -9.049 -6.993 804 H71 OLA 128 HF1 OLA 128 -8.789 -7.668 -6.580 805 H72 OLA 128 HF2 OLA 128 -8.222 -9.183 -5.873 806 H81 OLA 128 HG1 OLA 128 -7.554 -8.018 -4.098 807 H82 OLA 128 HG2 OLA 128 -6.331 -7.265 -5.127 808 H111 OLA 128 HJ1 OLA 128 -7.490 -6.707 -2.204 809 H112 OLA 128 HJ2 OLA 128 -6.081 -6.030 -3.024 810 H121 OLA 128 HK1 OLA 128 -7.562 -3.874 -1.937 811 H122 OLA 128 HK2 OLA 128 -7.395 -5.098 -0.675 812 H131 OLA 128 HL1 OLA 128 -5.016 -4.332 -2.310 813 H132 OLA 128 HL2 OLA 128 -5.092 -4.954 -0.659 814 H141 OLA 128 HM1 OLA 128 -5.341 -2.906 0.236 815 H142 OLA 128 HM2 OLA 128 -6.416 -2.366 -1.056 816 H151 OLA 128 HN1 OLA 128 -3.917 -2.668 -2.263 817 H152 OLA 128 HN2 OLA 128 -3.591 -1.900 -0.707 818 H161 OLA 128 HP1 OLA 128 -4.004 -0.046 -1.984 819 H162 OLA 128 HP2 OLA 128 -5.637 -0.391 -1.410 820 H171 OLA 128 HQ1 OLA 128 -5.255 -1.927 -3.749 821 H172 OLA 128 HQ2 OLA 128 -4.668 -0.294 -4.098 822 H181 OLA 128 HR1 OLA 128 -7.374 -1.246 -3.769 823 H182 OLA 128 HR2 OLA 128 -7.020 0.083 -2.664 824 H183 OLA 128 HR3 OLA 128 -6.795 0.295 -4.400 825 H9 OLA 129 HH1 OLA 129 -0.402 6.184 1.077 826 H10 OLA 129 HI1 OLA 129 -2.843 6.434 1.142 827 H21 OLA 129 HA1 OLA 129 2.605 -0.290 1.151 828 H22 OLA 129 HA2 OLA 129 3.033 -0.352 -0.557 829 H31 OLA 129 HB1 OLA 129 3.883 1.696 0.001 830 H32 OLA 129 HB2 OLA 129 2.258 2.159 -0.508 831 H41 OLA 129 HC1 OLA 129 3.519 2.345 2.108 832 H42 OLA 129 HC2 OLA 129 1.940 1.558 2.165 833 H51 OLA 129 HD1 OLA 129 2.612 4.303 1.130 834 H52 OLA 129 HD2 OLA 129 1.074 3.504 0.792 835 H61 OLA 129 HE1 OLA 129 2.024 3.703 3.613 836 H62 OLA 129 HE2 OLA 129 0.377 3.620 2.985 837 H71 OLA 129 HF1 OLA 129 1.933 5.923 3.658 838 H72 OLA 129 HF2 OLA 129 1.535 5.970 1.939 839 H81 OLA 129 HG1 OLA 129 -0.620 5.264 3.863 840 H82 OLA 129 HG2 OLA 129 -0.103 6.951 3.769 841 H111 OLA 129 HJ1 OLA 129 -2.414 6.771 4.083 842 H112 OLA 129 HJ2 OLA 129 -3.944 6.830 3.207 843 H121 OLA 129 HK1 OLA 129 -2.449 4.249 3.476 844 H122 OLA 129 HK2 OLA 129 -3.470 4.832 4.792 845 H131 OLA 129 HL1 OLA 129 -4.948 5.094 2.392 846 H132 OLA 129 HL2 OLA 129 -5.255 4.016 3.755 847 H141 OLA 129 HM1 OLA 129 -5.016 2.431 2.152 848 H142 OLA 129 HM2 OLA 129 -3.307 2.633 2.549 849 H151 OLA 129 HN1 OLA 129 -2.841 3.440 0.522 850 H152 OLA 129 HN2 OLA 129 -4.198 4.567 0.580 851 H161 OLA 129 HP1 OLA 129 -5.631 2.443 0.124 852 H162 OLA 129 HP2 OLA 129 -4.107 1.759 -0.445 853 H171 OLA 129 HQ1 OLA 129 -4.669 4.444 -1.483 854 H172 OLA 129 HQ2 OLA 129 -4.137 2.984 -2.334 855 H181 OLA 129 HR1 OLA 129 -6.859 2.762 -1.351 856 H182 OLA 129 HR2 OLA 129 -6.218 2.492 -2.972 857 H183 OLA 129 HR3 OLA 129 -6.653 4.122 -2.456 Start of MODEL 5 1 HA MET 1 HA MET 1 16.393 12.567 -0.139 2 H1 MET 1 HT1 MET 1 16.697 11.326 1.903 3 H2 MET 1 HT2 MET 1 16.526 9.867 1.067 4 H3 MET 1 HT3 MET 1 15.223 10.940 1.166 5 HB2 MET 1 HB2 MET 1 18.543 12.023 -1.158 6 HB3 MET 1 HB1 MET 1 18.661 11.948 0.595 7 HG2 MET 1 HG2 MET 1 18.471 9.510 0.495 8 HG3 MET 1 HG1 MET 1 18.381 9.597 -1.262 9 HE1 MET 1 HE1 MET 1 20.456 7.727 0.137 10 HE2 MET 1 HE2 MET 1 21.931 8.085 -0.761 11 HE3 MET 1 HE3 MET 1 20.393 7.945 -1.612 12 H ASN 2 HN ASN 2 16.028 9.110 -0.455 13 HA ASN 2 HA ASN 2 15.355 9.395 -3.294 14 HB2 ASN 2 HB2 ASN 2 15.422 6.904 -3.322 15 HB3 ASN 2 HB1 ASN 2 16.948 7.634 -2.833 16 H PHE 3 HN PHE 3 13.319 9.250 -4.009 17 HA PHE 3 HA PHE 3 11.268 8.065 -2.289 18 HD1 PHE 3 HD2 PHE 3 9.862 9.444 -0.314 19 HD2 PHE 3 HD1 PHE 3 12.677 12.001 -2.224 20 HE1 PHE 3 HE2 PHE 3 10.518 10.350 1.877 21 HE2 PHE 3 HE1 PHE 3 13.340 12.912 -0.036 22 HZ PHE 3 HZ PHE 3 12.259 12.086 2.018 23 HB2 PHE 3 HB2 PHE 3 11.095 10.827 -3.507 24 HB3 PHE 3 HB1 PHE 3 9.748 9.982 -2.751 25 H SER 4 HN SER 4 12.208 9.292 -5.449 26 HA SER 4 HA SER 4 9.933 8.106 -6.772 27 HG SER 4 HG SER 4 12.949 10.390 -7.973 28 HB2 SER 4 HB2 SER 4 11.002 8.913 -8.843 29 HB3 SER 4 HB1 SER 4 10.886 10.192 -7.633 30 H GLY 5 HN GLY 5 9.870 6.245 -7.935 31 HA2 GLY 5 HA2 GLY 5 11.854 4.776 -9.072 32 HA3 GLY 5 HA1 GLY 5 11.917 4.292 -7.383 33 H LYS 6 HN LYS 6 11.303 2.589 -9.590 34 HA LYS 6 HA LYS 6 8.440 2.055 -9.183 35 HB2 LYS 6 HB2 LYS 6 9.397 2.356 -11.530 36 HB3 LYS 6 HB1 LYS 6 10.203 0.813 -11.289 37 HG2 LYS 6 HG2 LYS 6 8.077 -0.300 -11.021 38 HG3 LYS 6 HG1 LYS 6 7.228 1.239 -11.128 39 HD2 LYS 6 HD2 LYS 6 7.021 0.290 -13.264 40 HD3 LYS 6 HD1 LYS 6 8.307 1.487 -13.426 41 HE2 LYS 6 HE2 LYS 6 8.831 -1.429 -12.891 42 HE3 LYS 6 HE1 LYS 6 8.724 -0.756 -14.516 43 HZ1 LYS 6 HZ1 LYS 6 10.697 -0.056 -12.416 44 HZ2 LYS 6 HZ2 LYS 6 10.531 0.797 -13.868 45 HZ3 LYS 6 HZ3 LYS 6 11.000 -0.828 -13.890 46 H TYR 7 HN TYR 7 7.797 0.311 -8.099 47 HA TYR 7 HA TYR 7 9.686 -1.875 -7.633 48 HD1 TYR 7 HD2 TYR 7 11.568 -1.005 -5.320 49 HD2 TYR 7 HD1 TYR 7 8.175 1.545 -5.610 50 HE1 TYR 7 HE2 TYR 7 12.988 0.936 -4.807 51 HE2 TYR 7 HE1 TYR 7 9.585 3.491 -5.098 52 HH TYR 7 HH TYR 7 11.725 3.968 -3.980 53 HB2 TYR 7 HB2 TYR 7 7.908 -0.854 -5.427 54 HB3 TYR 7 HB1 TYR 7 9.305 -1.918 -5.303 55 H GLN 8 HN GLN 8 8.781 -3.788 -8.093 56 HA GLN 8 HA GLN 8 5.865 -3.928 -8.312 57 HB2 GLN 8 HB2 GLN 8 6.120 -5.644 -9.904 58 HB3 GLN 8 HB1 GLN 8 7.394 -4.504 -10.291 59 HG2 GLN 8 HG2 GLN 8 7.806 -6.956 -8.616 60 HG3 GLN 8 HG1 GLN 8 8.044 -6.912 -10.366 61 H VAL 9 HN VAL 9 4.690 -5.464 -7.214 62 HA VAL 9 HA VAL 9 5.768 -6.384 -4.749 63 HB VAL 9 HB VAL 9 3.189 -7.158 -6.097 64 H GLN 10 HN GLN 10 6.285 -8.465 -4.085 65 HA GLN 10 HA GLN 10 6.665 -10.408 -6.266 66 HB2 GLN 10 HB2 GLN 10 8.342 -9.944 -3.798 67 HB3 GLN 10 HB1 GLN 10 8.578 -11.276 -4.920 68 HG2 GLN 10 HG2 GLN 10 8.754 -8.364 -5.649 69 HG3 GLN 10 HG1 GLN 10 10.131 -9.405 -5.291 70 H SER 11 HN SER 11 6.293 -10.271 -2.709 71 HA SER 11 HA SER 11 4.393 -12.468 -2.858 72 HG SER 11 HG SER 11 4.624 -14.298 -1.396 73 HB2 SER 11 HB2 SER 11 6.548 -13.614 -2.654 74 HB3 SER 11 HB1 SER 11 6.925 -12.664 -1.219 75 H GLN 12 HN GLN 12 3.506 -12.993 -0.646 76 HA GLN 12 HA GLN 12 3.559 -10.724 1.201 77 HB2 GLN 12 HB2 GLN 12 1.685 -10.169 -0.163 78 HB3 GLN 12 HB1 GLN 12 1.104 -11.829 -0.164 79 HG2 GLN 12 HG2 GLN 12 -0.286 -10.480 1.257 80 HG3 GLN 12 HG1 GLN 12 0.613 -11.638 2.236 81 H GLU 13 HN GLU 13 3.362 -11.304 3.318 82 HA GLU 13 HA GLU 13 3.062 -14.176 3.872 83 HB2 GLU 13 HB2 GLU 13 4.207 -13.709 5.996 84 HB3 GLU 13 HB1 GLU 13 5.172 -13.203 4.616 85 HG2 GLU 13 HG2 GLU 13 4.510 -10.893 4.977 86 HG3 GLU 13 HG1 GLU 13 3.495 -11.386 6.333 87 H ASN 14 HN ASN 14 1.566 -14.938 5.328 88 HA ASN 14 HA ASN 14 -0.406 -14.997 6.468 89 HB2 ASN 14 HB2 ASN 14 0.972 -12.578 7.524 90 HB3 ASN 14 HB1 ASN 14 -0.727 -12.786 7.938 91 H PHE 15 HN PHE 15 -1.516 -14.853 4.393 92 HA PHE 15 HA PHE 15 -2.802 -12.253 3.945 93 HD1 PHE 15 HD2 PHE 15 -4.182 -11.504 2.723 94 HD2 PHE 15 HD1 PHE 15 -1.452 -12.978 -0.192 95 HE1 PHE 15 HE2 PHE 15 -4.699 -9.586 1.275 96 HE2 PHE 15 HE1 PHE 15 -1.967 -11.061 -1.644 97 HZ PHE 15 HZ PHE 15 -3.518 -9.380 -0.961 98 HB2 PHE 15 HB2 PHE 15 -1.429 -13.770 2.171 99 HB3 PHE 15 HB1 PHE 15 -3.050 -14.392 1.923 100 H GLU 16 HN GLU 16 -3.373 -15.719 4.297 101 HA GLU 16 HA GLU 16 -6.086 -15.883 3.816 102 HB2 GLU 16 HB2 GLU 16 -4.495 -17.362 5.923 103 HB3 GLU 16 HB1 GLU 16 -6.092 -17.824 5.352 104 HG2 GLU 16 HG2 GLU 16 -5.205 -18.177 3.114 105 HG3 GLU 16 HG1 GLU 16 -3.605 -17.681 3.664 106 HA PRO 17 HA PRO 17 -7.029 -14.640 8.382 107 HB2 PRO 17 HB2 PRO 17 -5.150 -13.233 9.734 108 HB3 PRO 17 HB1 PRO 17 -5.228 -14.999 9.779 109 HG2 PRO 17 HG2 PRO 17 -3.460 -13.223 8.139 110 HG3 PRO 17 HG1 PRO 17 -3.045 -14.698 9.029 111 HD2 PRO 17 HD2 PRO 17 -3.463 -14.678 6.355 112 HD3 PRO 17 HD1 PRO 17 -3.859 -16.078 7.370 113 H PHE 18 HN PHE 18 -4.879 -12.555 6.534 114 HA PHE 18 HA PHE 18 -5.923 -10.065 7.274 115 HD1 PHE 18 HD1 PHE 18 -4.086 -7.951 6.785 116 HD2 PHE 18 HD2 PHE 18 -5.599 -9.444 3.098 117 HE1 PHE 18 HE1 PHE 18 -4.277 -5.651 5.937 118 HE2 PHE 18 HE2 PHE 18 -5.793 -7.144 2.243 119 HZ PHE 18 HZ PHE 18 -5.130 -5.244 3.662 120 HB2 PHE 18 HB2 PHE 18 -3.795 -10.323 6.090 121 HB3 PHE 18 HB1 PHE 18 -4.640 -10.921 4.668 122 H MET 19 HN MET 19 -6.696 -12.094 4.441 123 HA MET 19 HA MET 19 -8.692 -10.456 3.362 124 HB2 MET 19 HB2 MET 19 -9.334 -12.330 2.035 125 HB3 MET 19 HB1 MET 19 -7.596 -12.335 2.193 126 HG2 MET 19 HG2 MET 19 -8.103 -14.547 2.459 127 HG3 MET 19 HG1 MET 19 -8.022 -13.991 4.128 128 HE1 MET 19 HE1 MET 19 -9.419 -16.328 4.782 129 HE2 MET 19 HE2 MET 19 -9.337 -16.673 3.056 130 HE3 MET 19 HE3 MET 19 -10.880 -16.773 3.904 131 H LYS 20 HN LYS 20 -8.854 -12.939 5.858 132 HA LYS 20 HA LYS 20 -11.664 -13.110 6.011 133 HB2 LYS 20 HB2 LYS 20 -9.470 -13.680 7.989 134 HB3 LYS 20 HB1 LYS 20 -11.166 -13.922 8.387 135 HG2 LYS 20 HG2 LYS 20 -11.303 -15.434 6.384 136 HG3 LYS 20 HG1 LYS 20 -9.547 -15.317 6.279 137 HD2 LYS 20 HD2 LYS 20 -9.370 -16.188 8.573 138 HD3 LYS 20 HD1 LYS 20 -11.126 -16.347 8.636 139 HE2 LYS 20 HE2 LYS 20 -9.269 -17.772 6.733 140 HE3 LYS 20 HE1 LYS 20 -10.083 -18.486 8.125 141 HZ1 LYS 20 HZ1 LYS 20 -12.211 -18.012 7.067 142 HZ2 LYS 20 HZ2 LYS 20 -11.250 -18.997 6.082 143 HZ3 LYS 20 HZ3 LYS 20 -11.417 -17.354 5.724 144 H ALA 21 HN ALA 21 -9.327 -11.089 7.755 145 HA ALA 21 HA ALA 21 -11.271 -9.829 9.412 146 HB1 ALA 21 HB1 ALA 21 -8.482 -8.923 8.711 147 HB2 ALA 21 HB2 ALA 21 -8.916 -9.985 10.050 148 HB3 ALA 21 HB3 ALA 21 -9.472 -8.311 10.037 149 H MET 22 HN MET 22 -9.212 -8.308 6.946 150 HA MET 22 HA MET 22 -10.601 -5.958 6.645 151 HB2 MET 22 HB2 MET 22 -8.436 -6.215 5.664 152 HB3 MET 22 HB1 MET 22 -8.987 -7.537 4.646 153 HG2 MET 22 HG2 MET 22 -8.679 -5.456 3.400 154 HG3 MET 22 HG1 MET 22 -10.344 -6.031 3.348 155 HE1 MET 22 HE1 MET 22 -10.791 -2.145 3.279 156 HE2 MET 22 HE2 MET 22 -11.303 -3.666 2.551 157 HE3 MET 22 HE3 MET 22 -9.617 -3.161 2.442 158 H GLY 23 HN GLY 23 -11.446 -9.099 5.439 159 HA2 GLY 23 HA2 GLY 23 -13.700 -9.597 4.811 160 HA3 GLY 23 HA1 GLY 23 -13.881 -7.932 4.271 161 H LEU 24 HN LEU 24 -10.921 -9.137 3.331 162 HA LEU 24 HA LEU 24 -11.665 -9.182 0.572 163 HG LEU 24 HG LEU 24 -9.179 -11.058 -0.069 164 HB2 LEU 24 HB2 LEU 24 -9.556 -8.278 0.966 165 HB3 LEU 24 HB1 LEU 24 -9.125 -9.518 2.111 166 HA PRO 25 HA PRO 25 -12.488 -13.547 0.229 167 HB2 PRO 25 HB2 PRO 25 -12.431 -13.784 -2.423 168 HB3 PRO 25 HB1 PRO 25 -13.673 -12.790 -1.643 169 HG2 PRO 25 HG2 PRO 25 -11.015 -11.902 -2.747 170 HG3 PRO 25 HG1 PRO 25 -12.627 -11.307 -3.199 171 HD2 PRO 25 HD2 PRO 25 -11.179 -10.004 -1.422 172 HD3 PRO 25 HD1 PRO 25 -12.915 -10.235 -1.139 173 H GLU 26 HN GLU 26 -11.161 -15.263 0.483 174 HA GLU 26 HA GLU 26 -8.442 -15.305 0.112 175 HB2 GLU 26 HB2 GLU 26 -8.598 -17.676 0.427 176 HB3 GLU 26 HB1 GLU 26 -9.806 -16.920 1.438 177 HG2 GLU 26 HG2 GLU 26 -11.523 -17.457 -0.213 178 HG3 GLU 26 HG1 GLU 26 -10.302 -18.238 -1.219 179 H ASP 27 HN ASP 27 -11.003 -15.854 -2.189 180 HA ASP 27 HA ASP 27 -9.625 -17.244 -4.181 181 HB2 ASP 27 HB2 ASP 27 -11.855 -15.212 -4.409 182 HB3 ASP 27 HB1 ASP 27 -11.285 -16.196 -5.754 183 H LEU 28 HN LEU 28 -9.982 -13.746 -3.671 184 HA LEU 28 HA LEU 28 -8.430 -12.953 -5.879 185 HG LEU 28 HG LEU 28 -10.130 -9.870 -4.923 186 HB2 LEU 28 HB2 LEU 28 -9.490 -11.673 -3.448 187 HB3 LEU 28 HB1 LEU 28 -8.053 -10.922 -4.110 188 H ILE 29 HN ILE 29 -7.611 -13.823 -2.580 189 HA ILE 29 HA ILE 29 -4.964 -12.953 -2.495 190 HB ILE 29 HB ILE 29 -6.357 -15.246 -1.150 191 H GLN 30 HN GLN 30 -6.273 -16.084 -3.555 192 HA GLN 30 HA GLN 30 -3.846 -17.310 -4.194 193 HB2 GLN 30 HB2 GLN 30 -6.467 -17.753 -5.627 194 HB3 GLN 30 HB1 GLN 30 -5.134 -18.889 -5.475 195 HG2 GLN 30 HG2 GLN 30 -6.947 -17.917 -3.279 196 HG3 GLN 30 HG1 GLN 30 -6.895 -19.534 -3.985 197 H LYS 31 HN LYS 31 -5.994 -15.331 -6.197 198 HA LYS 31 HA LYS 31 -4.474 -15.604 -8.578 199 HB2 LYS 31 HB2 LYS 31 -6.507 -13.537 -7.740 200 HB3 LYS 31 HB1 LYS 31 -5.811 -13.633 -9.351 201 HG2 LYS 31 HG2 LYS 31 -6.787 -15.794 -9.707 202 HG3 LYS 31 HG1 LYS 31 -7.356 -15.857 -8.037 203 HD2 LYS 31 HD2 LYS 31 -8.908 -14.098 -8.410 204 HD3 LYS 31 HD1 LYS 31 -8.201 -13.720 -9.981 205 HE2 LYS 31 HE2 LYS 31 -8.945 -15.875 -10.845 206 HE3 LYS 31 HE1 LYS 31 -9.618 -16.286 -9.269 207 HZ1 LYS 31 HZ1 LYS 31 -10.503 -14.039 -11.001 208 HZ2 LYS 31 HZ2 LYS 31 -11.141 -14.414 -9.480 209 HZ3 LYS 31 HZ3 LYS 31 -11.331 -15.495 -10.767 210 H GLY 32 HN GLY 32 -4.319 -13.406 -5.860 211 HA2 GLY 32 HA2 GLY 32 -2.548 -11.566 -7.234 212 HA3 GLY 32 HA1 GLY 32 -3.090 -11.446 -5.570 213 H LYS 33 HN LYS 33 -2.181 -14.331 -5.158 214 HA LYS 33 HA LYS 33 0.460 -13.629 -4.277 215 HB2 LYS 33 HB2 LYS 33 0.534 -15.868 -3.313 216 HB3 LYS 33 HB1 LYS 33 -0.978 -15.064 -2.911 217 HG2 LYS 33 HG2 LYS 33 -2.152 -16.342 -4.585 218 HG3 LYS 33 HG1 LYS 33 -0.642 -17.085 -5.117 219 HD2 LYS 33 HD2 LYS 33 -1.770 -17.348 -2.334 220 HD3 LYS 33 HD1 LYS 33 -2.029 -18.526 -3.623 221 HE2 LYS 33 HE2 LYS 33 0.390 -18.869 -3.790 222 HE3 LYS 33 HE1 LYS 33 0.645 -17.696 -2.499 223 HZ1 LYS 33 HZ1 LYS 33 -0.871 -20.235 -2.221 224 HZ2 LYS 33 HZ2 LYS 33 -0.550 -19.126 -0.985 225 HZ3 LYS 33 HZ3 LYS 33 0.720 -19.988 -1.699 226 H ASP 34 HN ASP 34 -0.900 -15.558 -6.881 227 HA ASP 34 HA ASP 34 1.666 -16.636 -7.648 228 HB2 ASP 34 HB2 ASP 34 -1.057 -16.760 -8.949 229 HB3 ASP 34 HB1 ASP 34 0.377 -17.533 -9.616 230 H ILE 35 HN ILE 35 -0.003 -13.741 -8.192 231 HA ILE 35 HA ILE 35 1.608 -13.185 -10.601 232 HB ILE 35 HB ILE 35 -0.878 -11.723 -9.710 233 H LYS 36 HN LYS 36 2.989 -11.490 -10.601 234 HA LYS 36 HA LYS 36 3.607 -10.246 -8.082 235 HB2 LYS 36 HB2 LYS 36 5.405 -9.105 -9.369 236 HB3 LYS 36 HB1 LYS 36 5.431 -10.855 -9.556 237 HG2 LYS 36 HG2 LYS 36 4.260 -10.611 -11.715 238 HG3 LYS 36 HG1 LYS 36 4.346 -8.860 -11.531 239 HD2 LYS 36 HD2 LYS 36 6.146 -9.532 -12.950 240 HD3 LYS 36 HD1 LYS 36 6.836 -9.080 -11.391 241 HE2 LYS 36 HE2 LYS 36 6.990 -11.422 -10.757 242 HE3 LYS 36 HE1 LYS 36 6.232 -11.900 -12.275 243 HZ1 LYS 36 HZ1 LYS 36 8.114 -10.990 -13.471 244 HZ2 LYS 36 HZ2 LYS 36 8.641 -12.142 -12.349 245 HZ3 LYS 36 HZ3 LYS 36 8.835 -10.494 -12.024 246 H GLY 37 HN GLY 37 3.443 -8.047 -7.574 247 HA2 GLY 37 HA2 GLY 37 1.318 -6.673 -9.063 248 HA3 GLY 37 HA1 GLY 37 1.854 -6.282 -7.432 249 H VAL 38 HN VAL 38 1.575 -4.189 -9.102 250 HA VAL 38 HA VAL 38 4.380 -3.467 -9.611 251 HB VAL 38 HB VAL 38 2.143 -2.615 -11.443 252 H SER 39 HN SER 39 4.960 -1.550 -8.809 253 HA SER 39 HA SER 39 2.878 0.405 -8.151 254 HG SER 39 HG SER 39 3.665 1.798 -6.400 255 HB2 SER 39 HB2 SER 39 3.348 -0.831 -6.085 256 HB3 SER 39 HB1 SER 39 5.068 -0.480 -6.257 257 H GLU 40 HN GLU 40 3.459 2.508 -8.399 258 HA GLU 40 HA GLU 40 6.264 3.105 -9.013 259 HB2 GLU 40 HB2 GLU 40 5.053 2.813 -11.146 260 HB3 GLU 40 HB1 GLU 40 3.906 4.050 -10.653 261 HG2 GLU 40 HG2 GLU 40 5.962 5.572 -10.441 262 HG3 GLU 40 HG1 GLU 40 6.784 4.342 -11.398 263 H ILE 41 HN ILE 41 6.981 4.832 -7.915 264 HA ILE 41 HA ILE 41 4.960 6.596 -6.693 265 HB ILE 41 HB ILE 41 7.772 6.209 -5.687 266 H VAL 42 HN VAL 42 4.862 8.566 -7.502 267 HA VAL 42 HA VAL 42 7.262 9.718 -8.753 268 HB VAL 42 HB VAL 42 4.412 10.663 -9.080 269 H HIS 43 HN HIS 43 8.328 11.081 -7.471 270 HA HIS 43 HA HIS 43 6.860 12.492 -5.369 271 HD1 HIS 43 HD1 HIS 43 11.136 13.930 -5.175 272 HD2 HIS 43 HD2 HIS 43 7.885 13.397 -2.641 273 HE1 HIS 43 HE1 HIS 43 11.388 15.676 -3.381 274 HE2 HIS 43 HE2 HIS 43 9.378 15.373 -1.892 275 HB2 HIS 43 HB2 HIS 43 8.732 11.298 -4.518 276 HB3 HIS 43 HB1 HIS 43 9.792 11.917 -5.778 277 H GLU 44 HN GLU 44 6.192 14.464 -5.777 278 HA GLU 44 HA GLU 44 7.957 16.315 -7.212 279 HB2 GLU 44 HB2 GLU 44 5.039 15.821 -7.807 280 HB3 GLU 44 HB1 GLU 44 5.898 17.258 -8.345 281 HG2 GLU 44 HG2 GLU 44 6.712 14.447 -9.039 282 HG3 GLU 44 HG1 GLU 44 5.698 15.468 -10.058 283 H GLY 45 HN GLY 45 8.464 17.601 -5.515 284 HA2 GLY 45 HA2 GLY 45 8.175 19.286 -3.974 285 HA3 GLY 45 HA1 GLY 45 6.517 19.430 -4.541 286 H LYS 46 HN LYS 46 5.029 19.057 -3.042 287 HA LYS 46 HA LYS 46 5.751 17.370 -0.745 288 HB2 LYS 46 HB2 LYS 46 3.781 18.502 0.360 289 HB3 LYS 46 HB1 LYS 46 5.145 19.544 -0.006 290 HG2 LYS 46 HG2 LYS 46 3.985 20.379 -1.977 291 HG3 LYS 46 HG1 LYS 46 2.622 19.312 -1.631 292 HD2 LYS 46 HD2 LYS 46 2.307 20.458 0.529 293 HD3 LYS 46 HD1 LYS 46 3.631 21.552 0.123 294 HE2 LYS 46 HE2 LYS 46 1.614 22.688 -0.401 295 HE3 LYS 46 HE1 LYS 46 2.340 22.188 -1.927 296 HZ1 LYS 46 HZ1 LYS 46 -0.025 21.756 -1.916 297 HZ2 LYS 46 HZ2 LYS 46 0.119 20.801 -0.528 298 HZ3 LYS 46 HZ3 LYS 46 0.828 20.296 -1.979 299 H LYS 47 HN LYS 47 3.901 17.393 -3.560 300 HA LYS 47 HA LYS 47 1.967 15.461 -2.498 301 HB2 LYS 47 HB2 LYS 47 0.743 15.790 -4.596 302 HB3 LYS 47 HB1 LYS 47 1.028 17.320 -3.779 303 HG2 LYS 47 HG2 LYS 47 2.864 17.808 -5.298 304 HG3 LYS 47 HG1 LYS 47 2.619 16.259 -6.107 305 HD2 LYS 47 HD2 LYS 47 0.257 17.044 -6.580 306 HD3 LYS 47 HD1 LYS 47 0.786 18.637 -6.035 307 HE2 LYS 47 HE2 LYS 47 2.538 18.634 -7.752 308 HE3 LYS 47 HE1 LYS 47 1.978 17.057 -8.309 309 HZ1 LYS 47 HZ1 LYS 47 -0.147 18.047 -8.878 310 HZ2 LYS 47 HZ2 LYS 47 1.109 18.849 -9.679 311 HZ3 LYS 47 HZ3 LYS 47 0.378 19.560 -8.330 312 H VAL 48 HN VAL 48 2.071 13.357 -2.958 313 HA VAL 48 HA VAL 48 4.004 12.480 -5.007 314 HB VAL 48 HB VAL 48 3.286 11.046 -2.447 315 H LYS 49 HN LYS 49 3.190 11.296 -6.620 316 HA LYS 49 HA LYS 49 0.438 10.361 -6.425 317 HB2 LYS 49 HB2 LYS 49 0.759 11.588 -8.394 318 HB3 LYS 49 HB1 LYS 49 2.342 10.880 -8.687 319 HG2 LYS 49 HG2 LYS 49 1.346 8.789 -9.306 320 HG3 LYS 49 HG1 LYS 49 -0.263 9.390 -8.902 321 HD2 LYS 49 HD2 LYS 49 0.003 9.502 -11.284 322 HD3 LYS 49 HD1 LYS 49 0.034 11.149 -10.651 323 HE2 LYS 49 HE2 LYS 49 2.479 11.141 -10.759 324 HE3 LYS 49 HE1 LYS 49 2.447 9.493 -11.386 325 HZ1 LYS 49 HZ1 LYS 49 1.304 11.888 -12.718 326 HZ2 LYS 49 HZ2 LYS 49 1.222 10.309 -13.318 327 HZ3 LYS 49 HZ3 LYS 49 2.721 11.081 -13.168 328 H LEU 50 HN LEU 50 -0.028 8.292 -6.045 329 HA LEU 50 HA LEU 50 2.079 6.284 -6.501 330 HG LEU 50 HG LEU 50 0.554 3.944 -5.154 331 HB2 LEU 50 HB2 LEU 50 1.494 6.626 -4.129 332 HB3 LEU 50 HB1 LEU 50 -0.172 6.219 -4.489 333 H THR 51 HN THR 51 1.690 4.816 -8.009 334 HA THR 51 HA THR 51 -1.112 4.229 -8.706 335 HB THR 51 HB THR 51 1.211 4.381 -10.639 336 HG1 THR 51 HG1 THR 51 0.173 6.405 -9.744 337 H ILE 52 HN ILE 52 -1.653 2.153 -8.572 338 HA ILE 52 HA ILE 52 0.455 0.108 -8.769 339 HB ILE 52 HB ILE 52 -1.880 0.023 -6.851 340 H THR 53 HN THR 53 0.020 -1.481 -10.199 341 HA THR 53 HA THR 53 -2.761 -1.709 -11.151 342 HB THR 53 HB THR 53 -0.242 -2.156 -12.760 343 HG1 THR 53 HG1 THR 53 -0.559 -0.173 -13.539 344 H TYR 54 HN TYR 54 -3.704 -3.626 -11.043 345 HA TYR 54 HA TYR 54 -2.024 -6.007 -10.601 346 HD1 TYR 54 HD2 TYR 54 -1.440 -6.938 -8.492 347 HD2 TYR 54 HD1 TYR 54 -4.360 -4.015 -7.474 348 HE1 TYR 54 HE2 TYR 54 -0.165 -6.381 -6.465 349 HE2 TYR 54 HE1 TYR 54 -3.093 -3.450 -5.444 350 HH TYR 54 HH TYR 54 0.088 -4.469 -4.918 351 HB2 TYR 54 HB2 TYR 54 -4.681 -5.279 -9.363 352 HB3 TYR 54 HB1 TYR 54 -4.027 -6.913 -9.324 353 H GLY 55 HN GLY 55 -2.056 -7.155 -12.432 354 HA2 GLY 55 HA2 GLY 55 -2.896 -8.425 -14.159 355 HA3 GLY 55 HA1 GLY 55 -4.489 -8.236 -13.438 356 H SER 56 HN SER 56 -5.713 -6.312 -13.944 357 HA SER 56 HA SER 56 -4.780 -4.782 -16.257 358 HG SER 56 HG SER 56 -6.367 -4.247 -17.812 359 HB2 SER 56 HB2 SER 56 -6.042 -6.687 -17.179 360 HB3 SER 56 HB1 SER 56 -7.435 -6.235 -16.197 361 H LYS 57 HN LYS 57 -5.580 -4.454 -13.283 362 HA LYS 57 HA LYS 57 -7.560 -2.309 -13.656 363 HB2 LYS 57 HB2 LYS 57 -8.238 -4.032 -12.060 364 HB3 LYS 57 HB1 LYS 57 -6.756 -3.789 -11.145 365 HG2 LYS 57 HG2 LYS 57 -7.462 -1.489 -10.638 366 HG3 LYS 57 HG1 LYS 57 -8.967 -1.774 -11.517 367 HD2 LYS 57 HD2 LYS 57 -9.305 -3.755 -9.932 368 HD3 LYS 57 HD1 LYS 57 -8.024 -3.033 -8.958 369 HE2 LYS 57 HE2 LYS 57 -10.218 -2.346 -8.154 370 HE3 LYS 57 HE1 LYS 57 -9.318 -0.967 -8.781 371 HZ1 LYS 57 HZ1 LYS 57 -11.443 -2.450 -10.233 372 HZ2 LYS 57 HZ2 LYS 57 -10.578 -1.129 -10.838 373 HZ3 LYS 57 HZ3 LYS 57 -11.614 -0.927 -9.517 374 H VAL 58 HN VAL 58 -6.943 -0.256 -13.422 375 HA VAL 58 HA VAL 58 -4.227 0.263 -12.449 376 HB VAL 58 HB VAL 58 -6.107 2.085 -13.960 377 H ILE 59 HN ILE 59 -3.883 1.162 -10.533 378 HA ILE 59 HA ILE 59 -6.150 2.445 -9.155 379 HB ILE 59 HB ILE 59 -3.754 1.075 -7.922 380 H HIS 60 HN HIS 60 -5.965 4.574 -9.056 381 HA HIS 60 HA HIS 60 -3.263 5.742 -8.863 382 HD1 HIS 60 HD1 HIS 60 -6.395 8.752 -8.999 383 HD2 HIS 60 HD2 HIS 60 -6.935 5.513 -11.545 384 HE1 HIS 60 HE1 HIS 60 -8.844 8.746 -9.568 385 HE2 HIS 60 HE2 HIS 60 -9.129 6.833 -11.183 386 HB2 HIS 60 HB2 HIS 60 -4.195 7.757 -9.953 387 HB3 HIS 60 HB1 HIS 60 -4.330 6.327 -10.971 388 H ASN 61 HN ASN 61 -2.815 7.115 -7.234 389 HA ASN 61 HA ASN 61 -4.968 8.287 -5.664 390 HB2 ASN 61 HB2 ASN 61 -2.896 6.437 -4.467 391 HB3 ASN 61 HB1 ASN 61 -3.970 7.470 -3.527 392 H GLU 62 HN GLU 62 -4.157 9.877 -4.082 393 HA GLU 62 HA GLU 62 -1.433 10.819 -4.537 394 HB2 GLU 62 HB2 GLU 62 -2.815 11.972 -6.223 395 HB3 GLU 62 HB1 GLU 62 -3.857 12.582 -4.946 396 HG2 GLU 62 HG2 GLU 62 -1.942 13.802 -4.000 397 HG3 GLU 62 HG1 GLU 62 -0.944 13.231 -5.337 398 H PHE 63 HN PHE 63 -0.542 11.829 -2.779 399 HA PHE 63 HA PHE 63 -2.258 12.689 -0.594 400 HD1 PHE 63 HD2 PHE 63 1.543 11.297 0.522 401 HD2 PHE 63 HD1 PHE 63 -1.241 8.751 -1.447 402 HE1 PHE 63 HE2 PHE 63 3.392 9.853 -0.216 403 HE2 PHE 63 HE1 PHE 63 0.605 7.302 -2.189 404 HZ PHE 63 HZ PHE 63 2.913 7.832 -1.565 405 HB2 PHE 63 HB2 PHE 63 -0.882 11.333 1.046 406 HB3 PHE 63 HB1 PHE 63 -2.006 10.419 0.047 407 H THR 64 HN THR 64 -1.245 14.022 0.935 408 HA THR 64 HA THR 64 1.207 15.285 -0.058 409 HB THR 64 HB THR 64 -0.775 16.293 1.995 410 HG1 THR 64 HG1 THR 64 -0.641 16.462 -0.772 411 H LEU 65 HN LEU 65 3.079 15.189 1.036 412 HA LEU 65 HA LEU 65 3.330 13.426 3.262 413 HG LEU 65 HG LEU 65 4.639 13.698 0.402 414 HB2 LEU 65 HB2 LEU 65 5.354 15.343 2.100 415 HB3 LEU 65 HB1 LEU 65 5.703 14.032 3.209 416 H GLY 66 HN GLY 66 2.956 13.900 5.320 417 HA2 GLY 66 HA2 GLY 66 3.425 15.126 7.303 418 HA3 GLY 66 HA1 GLY 66 3.671 16.563 6.324 419 H GLU 67 HN GLU 67 1.034 15.451 4.951 420 HA GLU 67 HA GLU 67 -0.791 16.654 6.927 421 HB2 GLU 67 HB2 GLU 67 -0.846 16.976 3.921 422 HB3 GLU 67 HB1 GLU 67 -2.084 17.571 5.017 423 HG2 GLU 67 HG2 GLU 67 0.801 18.428 5.020 424 HG3 GLU 67 HG1 GLU 67 -0.539 19.330 4.313 425 H GLU 68 HN GLU 68 -3.020 15.967 6.778 426 HA GLU 68 HA GLU 68 -3.212 13.129 6.194 427 HB2 GLU 68 HB2 GLU 68 -4.099 13.946 8.309 428 HB3 GLU 68 HB1 GLU 68 -5.164 15.062 7.464 429 HG2 GLU 68 HG2 GLU 68 -6.323 13.127 6.454 430 HG3 GLU 68 HG1 GLU 68 -5.302 12.056 7.409 431 H CYS 69 HN CYS 69 -3.902 12.404 4.293 432 HA CYS 69 HA CYS 69 -5.663 14.129 2.683 433 HG CYS 69 HG CYS 69 -4.572 14.261 -0.500 434 HB2 CYS 69 HB2 CYS 69 -3.422 13.587 1.704 435 HB3 CYS 69 HB1 CYS 69 -3.889 11.890 1.697 436 H GLU 70 HN GLU 70 -7.309 13.062 1.398 437 HA GLU 70 HA GLU 70 -8.438 10.774 2.836 438 HB2 GLU 70 HB2 GLU 70 -9.786 12.871 2.517 439 HB3 GLU 70 HB1 GLU 70 -9.786 12.540 0.791 440 HG2 GLU 70 HG2 GLU 70 -11.002 10.496 1.128 441 HG3 GLU 70 HG1 GLU 70 -10.889 10.675 2.878 442 H LEU 71 HN LEU 71 -8.264 8.814 2.008 443 HA LEU 71 HA LEU 71 -7.889 8.527 -0.903 444 HG LEU 71 HG LEU 71 -4.601 7.225 0.264 445 HB2 LEU 71 HB2 LEU 71 -6.801 6.865 1.367 446 HB3 LEU 71 HB1 LEU 71 -6.745 6.357 -0.308 447 H GLU 72 HN GLU 72 -9.212 7.248 -2.001 448 HA GLU 72 HA GLU 72 -11.486 6.118 -0.612 449 HB2 GLU 72 HB2 GLU 72 -12.256 7.134 -2.516 450 HB3 GLU 72 HB1 GLU 72 -10.798 6.778 -3.426 451 HG2 GLU 72 HG2 GLU 72 -11.491 4.493 -3.716 452 HG3 GLU 72 HG1 GLU 72 -12.920 4.769 -2.720 453 H THR 73 HN THR 73 -11.652 4.066 -0.017 454 HA THR 73 HA THR 73 -9.566 2.193 -0.560 455 HB THR 73 HB THR 73 -10.929 0.600 0.739 456 HG1 THR 73 HG1 THR 73 -12.927 1.367 1.604 457 H MET 74 HN MET 74 -10.191 -0.110 -1.231 458 HA MET 74 HA MET 74 -11.003 -0.082 -3.914 459 HB2 MET 74 HB2 MET 74 -9.532 -1.802 -2.947 460 HB3 MET 74 HB1 MET 74 -10.879 -2.422 -2.004 461 HG2 MET 74 HG2 MET 74 -12.059 -2.921 -4.134 462 HG3 MET 74 HG1 MET 74 -10.597 -2.446 -4.997 463 HE1 MET 74 HE1 MET 74 -10.554 -6.331 -5.406 464 HE2 MET 74 HE2 MET 74 -10.410 -4.783 -6.239 465 HE3 MET 74 HE3 MET 74 -11.934 -5.237 -5.474 466 H THR 75 HN THR 75 -12.773 -0.630 -0.953 467 HA THR 75 HA THR 75 -15.091 -1.805 -2.021 468 HB THR 75 HB THR 75 -16.197 -1.196 0.029 469 HG1 THR 75 HG1 THR 75 -15.764 0.731 0.785 470 H GLY 76 HN GLY 76 -14.258 1.585 -1.407 471 HA2 GLY 76 HA2 GLY 76 -15.109 3.033 -3.344 472 HA3 GLY 76 HA1 GLY 76 -16.682 2.400 -2.874 473 H GLU 77 HN GLU 77 -15.403 2.483 -0.019 474 HA GLU 77 HA GLU 77 -16.442 5.129 0.590 475 HB2 GLU 77 HB2 GLU 77 -17.174 3.257 1.972 476 HB3 GLU 77 HB1 GLU 77 -15.507 2.888 2.394 477 HG2 GLU 77 HG2 GLU 77 -15.321 5.053 3.522 478 HG3 GLU 77 HG1 GLU 77 -17.002 5.398 3.120 479 H LYS 78 HN LYS 78 -15.200 6.849 0.890 480 HA LYS 78 HA LYS 78 -12.333 6.557 0.918 481 HB2 LYS 78 HB2 LYS 78 -12.652 9.208 1.147 482 HB3 LYS 78 HB1 LYS 78 -12.731 8.357 -0.387 483 HG2 LYS 78 HG2 LYS 78 -14.542 9.976 -0.141 484 HG3 LYS 78 HG1 LYS 78 -15.148 8.325 -0.284 485 HD2 LYS 78 HD2 LYS 78 -15.383 8.230 2.165 486 HD3 LYS 78 HD1 LYS 78 -14.849 9.909 2.266 487 HE2 LYS 78 HE2 LYS 78 -17.322 9.625 2.361 488 HE3 LYS 78 HE1 LYS 78 -16.768 10.662 1.048 489 HZ1 LYS 78 HZ1 LYS 78 -17.500 7.797 0.761 490 HZ2 LYS 78 HZ2 LYS 78 -17.045 8.843 -0.490 491 HZ3 LYS 78 HZ3 LYS 78 -18.495 9.102 0.343 492 H VAL 79 HN VAL 79 -10.941 7.088 2.543 493 HA VAL 79 HA VAL 79 -12.120 7.846 5.131 494 HB VAL 79 HB VAL 79 -10.486 6.351 6.256 495 H LYS 80 HN LYS 80 -10.567 8.790 6.647 496 HA LYS 80 HA LYS 80 -8.646 10.461 5.220 497 HB2 LYS 80 HB2 LYS 80 -8.583 11.777 7.325 498 HB3 LYS 80 HB1 LYS 80 -10.191 11.652 6.630 499 HG2 LYS 80 HG2 LYS 80 -10.796 9.958 8.248 500 HG3 LYS 80 HG1 LYS 80 -9.160 9.974 8.908 501 HD2 LYS 80 HD2 LYS 80 -10.620 11.280 10.327 502 HD3 LYS 80 HD1 LYS 80 -9.464 12.346 9.527 503 HE2 LYS 80 HE2 LYS 80 -11.697 13.319 9.519 504 HE3 LYS 80 HE1 LYS 80 -11.165 12.954 7.879 505 HZ1 LYS 80 HZ1 LYS 80 -12.500 10.952 7.916 506 HZ2 LYS 80 HZ2 LYS 80 -13.466 12.298 8.256 507 HZ3 LYS 80 HZ3 LYS 80 -12.987 11.266 9.506 508 H ALA 81 HN ALA 81 -6.523 10.209 5.350 509 HA ALA 81 HA ALA 81 -5.342 8.809 7.622 510 HB1 ALA 81 HB1 ALA 81 -4.042 7.322 6.196 511 HB2 ALA 81 HB2 ALA 81 -4.843 7.973 4.766 512 HB3 ALA 81 HB3 ALA 81 -5.771 7.063 5.959 513 H VAL 82 HN VAL 82 -3.280 9.463 8.104 514 HA VAL 82 HA VAL 82 -2.184 11.600 6.407 515 HB VAL 82 HB VAL 82 -2.850 12.501 8.536 516 H VAL 83 HN VAL 83 -0.443 11.043 5.331 517 HA VAL 83 HA VAL 83 1.346 8.996 6.456 518 HB VAL 83 HB VAL 83 0.477 8.271 4.348 519 H LYS 84 HN LYS 84 3.261 9.647 7.171 520 HA LYS 84 HA LYS 84 4.451 12.089 6.030 521 HB2 LYS 84 HB2 LYS 84 4.676 11.343 8.940 522 HB3 LYS 84 HB1 LYS 84 5.118 12.863 8.175 523 HG2 LYS 84 HG2 LYS 84 2.779 13.371 7.773 524 HG3 LYS 84 HG1 LYS 84 2.306 11.820 8.467 525 HD2 LYS 84 HD2 LYS 84 2.000 13.561 10.113 526 HD3 LYS 84 HD1 LYS 84 3.326 12.510 10.613 527 HE2 LYS 84 HE2 LYS 84 4.935 14.141 9.734 528 HE3 LYS 84 HE1 LYS 84 3.601 15.193 9.259 529 HZ1 LYS 84 HZ1 LYS 84 4.593 15.857 11.372 530 HZ2 LYS 84 HZ2 LYS 84 4.206 14.353 12.043 531 HZ3 LYS 84 HZ3 LYS 84 2.973 15.410 11.567 532 H MET 85 HN MET 85 6.733 12.178 6.047 533 HA MET 85 HA MET 85 7.978 9.546 6.030 534 HB2 MET 85 HB2 MET 85 9.789 10.563 4.815 535 HB3 MET 85 HB1 MET 85 8.275 11.095 4.099 536 HG2 MET 85 HG2 MET 85 9.817 12.727 6.095 537 HG3 MET 85 HG1 MET 85 10.047 12.851 4.352 538 HE1 MET 85 HE1 MET 85 9.541 15.480 4.510 539 HE2 MET 85 HE2 MET 85 9.318 15.310 6.251 540 HE3 MET 85 HE3 MET 85 8.099 16.140 5.286 541 H GLU 86 HN GLU 86 9.742 8.977 7.297 542 HA GLU 86 HA GLU 86 10.138 10.688 9.641 543 HB2 GLU 86 HB2 GLU 86 9.371 8.363 10.031 544 HB3 GLU 86 HB1 GLU 86 10.853 7.776 9.290 545 HG2 GLU 86 HG2 GLU 86 10.954 7.714 11.729 546 HG3 GLU 86 HG1 GLU 86 12.174 8.786 11.041 547 H GLY 87 HN GLY 87 11.723 9.504 6.858 548 HA2 GLY 87 HA2 GLY 87 13.770 11.087 6.558 549 HA3 GLY 87 HA1 GLY 87 14.359 10.196 7.951 550 H ASP 88 HN ASP 88 15.353 8.283 7.648 551 HA ASP 88 HA ASP 88 15.627 7.375 4.868 552 HB2 ASP 88 HB2 ASP 88 17.662 8.132 6.231 553 HB3 ASP 88 HB1 ASP 88 17.441 6.648 7.158 554 H ASN 89 HN ASN 89 14.651 5.560 4.320 555 HA ASN 89 HA ASN 89 13.683 3.510 4.402 556 HB2 ASN 89 HB2 ASN 89 15.222 2.766 6.844 557 HB3 ASN 89 HB1 ASN 89 14.894 1.822 5.399 558 H LYS 90 HN LYS 90 12.796 5.768 6.423 559 HA LYS 90 HA LYS 90 10.985 3.958 7.864 560 HB2 LYS 90 HB2 LYS 90 12.300 6.357 9.136 561 HB3 LYS 90 HB1 LYS 90 11.226 5.212 9.919 562 HG2 LYS 90 HG2 LYS 90 13.953 4.592 8.835 563 HG3 LYS 90 HG1 LYS 90 13.515 4.822 10.526 564 HD2 LYS 90 HD2 LYS 90 11.757 2.886 9.547 565 HD3 LYS 90 HD1 LYS 90 13.343 2.476 8.887 566 HE2 LYS 90 HE2 LYS 90 14.290 2.585 11.156 567 HE3 LYS 90 HE1 LYS 90 12.685 2.931 11.796 568 HZ1 LYS 90 HZ1 LYS 90 13.241 0.595 12.026 569 HZ2 LYS 90 HZ2 LYS 90 13.475 0.455 10.356 570 HZ3 LYS 90 HZ3 LYS 90 11.934 0.788 10.968 571 H MET 91 HN MET 91 8.940 4.443 7.623 572 HA MET 91 HA MET 91 8.093 7.223 7.346 573 HB2 MET 91 HB2 MET 91 7.528 5.021 5.372 574 HB3 MET 91 HB1 MET 91 6.467 6.416 5.525 575 HG2 MET 91 HG2 MET 91 8.472 7.861 5.109 576 HG3 MET 91 HG1 MET 91 9.360 6.390 4.718 577 HE1 MET 91 HE1 MET 91 9.891 7.757 2.385 578 HE2 MET 91 HE2 MET 91 8.805 9.058 2.872 579 HE3 MET 91 HE3 MET 91 8.615 8.297 1.293 580 H VAL 92 HN VAL 92 6.293 7.657 8.500 581 HA VAL 92 HA VAL 92 4.847 5.347 9.616 582 HB VAL 92 HB VAL 92 6.003 6.491 11.371 583 H THR 93 HN THR 93 2.863 5.089 8.925 584 HA THR 93 HA THR 93 1.197 7.447 8.378 585 HB THR 93 HB THR 93 1.816 6.719 6.191 586 HG1 THR 93 HG1 THR 93 -0.396 5.562 5.682 587 H THR 94 HN THR 94 -0.704 7.373 9.428 588 HA THR 94 HA THR 94 -1.687 4.735 10.319 589 HB THR 94 HB THR 94 -1.869 7.305 11.903 590 HG1 THR 94 HG1 THR 94 -0.333 4.995 12.523 591 H PHE 95 HN PHE 95 -3.816 4.315 10.061 592 HA PHE 95 HA PHE 95 -5.622 6.508 9.349 593 HD1 PHE 95 HD1 PHE 95 -3.192 3.702 7.864 594 HD2 PHE 95 HD2 PHE 95 -7.357 3.075 7.264 595 HE1 PHE 95 HE1 PHE 95 -2.772 1.307 7.483 596 HE2 PHE 95 HE2 PHE 95 -6.946 0.680 6.884 597 HZ PHE 95 HZ PHE 95 -4.650 -0.206 6.993 598 HB2 PHE 95 HB2 PHE 95 -6.555 5.232 7.473 599 HB3 PHE 95 HB1 PHE 95 -4.848 5.569 7.223 600 H LYS 96 HN LYS 96 -7.516 6.388 10.352 601 HA LYS 96 HA LYS 96 -9.223 5.666 11.659 602 HB2 LYS 96 HB2 LYS 96 -8.586 2.971 10.446 603 HB3 LYS 96 HB1 LYS 96 -10.058 3.381 11.314 604 HG2 LYS 96 HG2 LYS 96 -10.656 4.987 9.600 605 HG3 LYS 96 HG1 LYS 96 -9.146 4.663 8.746 606 HD2 LYS 96 HD2 LYS 96 -10.884 3.434 7.657 607 HD3 LYS 96 HD1 LYS 96 -9.871 2.282 8.527 608 HE2 LYS 96 HE2 LYS 96 -12.182 1.704 8.863 609 HE3 LYS 96 HE1 LYS 96 -11.511 2.301 10.379 610 HZ1 LYS 96 HZ1 LYS 96 -12.543 4.442 9.956 611 HZ2 LYS 96 HZ2 LYS 96 -13.708 3.215 9.952 612 HZ3 LYS 96 HZ3 LYS 96 -13.175 3.879 8.490 613 H GLY 97 HN GLY 97 -7.580 2.554 11.882 614 HA2 GLY 97 HA2 GLY 97 -6.494 3.215 14.505 615 HA3 GLY 97 HA1 GLY 97 -7.777 2.014 14.482 616 H ILE 98 HN ILE 98 -5.652 2.166 11.780 617 HA ILE 98 HA ILE 98 -4.369 -0.327 12.673 618 HB ILE 98 HB ILE 98 -4.882 0.668 9.867 619 H LYS 99 HN LYS 99 -2.170 -0.515 12.647 620 HA LYS 99 HA LYS 99 -0.682 1.974 12.263 621 HB2 LYS 99 HB2 LYS 99 -0.569 0.231 14.300 622 HB3 LYS 99 HB1 LYS 99 0.658 -0.487 13.260 623 HG2 LYS 99 HG2 LYS 99 1.731 0.987 14.800 624 HG3 LYS 99 HG1 LYS 99 1.808 1.710 13.193 625 HD2 LYS 99 HD2 LYS 99 -0.029 3.189 13.732 626 HD3 LYS 99 HD1 LYS 99 -0.230 2.411 15.304 627 HE2 LYS 99 HE2 LYS 99 2.008 3.151 15.954 628 HE3 LYS 99 HE1 LYS 99 2.211 3.925 14.383 629 HZ1 LYS 99 HZ1 LYS 99 0.140 4.637 16.390 630 HZ2 LYS 99 HZ2 LYS 99 0.381 5.399 14.899 631 HZ3 LYS 99 HZ3 LYS 99 1.564 5.504 16.103 632 H SER 100 HN SER 100 0.336 2.314 10.416 633 HA SER 100 HA SER 100 1.347 -0.017 8.930 634 HG SER 100 HG SER 100 0.518 1.366 5.797 635 HB2 SER 100 HB2 SER 100 -0.532 0.971 7.735 636 HB3 SER 100 HB1 SER 100 0.225 2.561 7.811 637 H VAL 101 HN VAL 101 3.478 -0.076 8.801 638 HA VAL 101 HA VAL 101 4.965 2.470 8.789 639 HB VAL 101 HB VAL 101 5.883 -0.123 10.044 640 H THR 102 HN THR 102 6.089 2.777 6.997 641 HA THR 102 HA THR 102 6.829 0.427 5.384 642 HB THR 102 HB THR 102 6.324 3.244 4.410 643 HG1 THR 102 HG1 THR 102 4.734 0.929 3.951 644 H GLU 103 HN GLU 103 8.910 0.074 4.983 645 HA GLU 103 HA GLU 103 10.862 2.076 5.839 646 HB2 GLU 103 HB2 GLU 103 11.277 -0.089 6.757 647 HB3 GLU 103 HB1 GLU 103 11.081 -0.869 5.192 648 HG2 GLU 103 HG2 GLU 103 13.135 0.476 4.477 649 HG3 GLU 103 HG1 GLU 103 13.367 0.787 6.194 650 H PHE 104 HN PHE 104 11.791 3.363 4.361 651 HA PHE 104 HA PHE 104 11.421 2.672 1.539 652 HD1 PHE 104 HD2 PHE 104 12.900 5.055 -0.261 653 HD2 PHE 104 HD1 PHE 104 9.048 5.106 1.535 654 HE1 PHE 104 HE2 PHE 104 11.901 5.595 -2.439 655 HE2 PHE 104 HE1 PHE 104 8.037 5.644 -0.636 656 HZ PHE 104 HZ PHE 104 9.461 5.893 -2.634 657 HB2 PHE 104 HB2 PHE 104 10.940 4.985 2.874 658 HB3 PHE 104 HB1 PHE 104 12.545 5.304 2.219 659 H ASN 105 HN ASN 105 13.007 1.726 0.511 660 HA ASN 105 HA ASN 105 15.771 2.600 1.018 661 HB2 ASN 105 HB2 ASN 105 14.936 -0.208 0.260 662 HB3 ASN 105 HB1 ASN 105 16.568 0.345 0.610 663 H GLY 106 HN GLY 106 17.169 2.559 -0.838 664 HA2 GLY 106 HA2 GLY 106 15.753 3.231 -3.265 665 HA3 GLY 106 HA1 GLY 106 17.490 3.310 -3.015 666 H ASP 107 HN ASP 107 15.905 0.354 -2.198 667 HA ASP 107 HA ASP 107 16.416 -0.837 -4.801 668 HB2 ASP 107 HB2 ASP 107 17.832 -1.773 -2.298 669 HB3 ASP 107 HB1 ASP 107 17.820 -2.638 -3.832 670 H THR 108 HN THR 108 15.202 -1.165 -1.507 671 HA THR 108 HA THR 108 13.183 -3.034 -2.509 672 HB THR 108 HB THR 108 14.771 -3.546 0.014 673 HG1 THR 108 HG1 THR 108 15.361 -5.477 -1.258 674 H ILE 109 HN ILE 109 11.217 -2.446 -1.897 675 HA ILE 109 HA ILE 109 10.947 -0.593 0.375 676 HB ILE 109 HB ILE 109 9.176 -1.016 -2.030 677 H THR 110 HN THR 110 10.053 -1.366 2.171 678 HA THR 110 HA THR 110 8.314 -3.738 1.969 679 HB THR 110 HB THR 110 10.024 -2.903 4.319 680 HG1 THR 110 HG1 THR 110 10.517 -5.304 3.052 681 H ASN 111 HN ASN 111 6.346 -3.718 2.922 682 HA ASN 111 HA ASN 111 5.577 -1.282 4.397 683 HB2 ASN 111 HB2 ASN 111 3.860 -2.939 2.534 684 HB3 ASN 111 HB1 ASN 111 3.321 -1.530 3.441 685 H THR 112 HN THR 112 4.534 -1.556 6.321 686 HA THR 112 HA THR 112 3.905 -4.333 7.099 687 HB THR 112 HB THR 112 4.699 -2.205 9.076 688 HG1 THR 112 HG1 THR 112 6.388 -2.624 7.447 689 H MET 113 HN MET 113 1.798 -4.628 7.334 690 HA MET 113 HA MET 113 0.196 -2.469 8.539 691 HB2 MET 113 HB2 MET 113 -0.726 -4.429 6.426 692 HB3 MET 113 HB1 MET 113 -1.702 -3.164 7.161 693 HG2 MET 113 HG2 MET 113 -0.213 -1.473 6.191 694 HG3 MET 113 HG1 MET 113 0.723 -2.755 5.425 695 HE1 MET 113 HE1 MET 113 -1.176 -1.074 2.418 696 HE2 MET 113 HE2 MET 113 0.397 -1.629 2.997 697 HE3 MET 113 HE3 MET 113 -0.438 -0.318 3.830 698 H THR 114 HN THR 114 -0.622 -3.060 10.459 699 HA THR 114 HA THR 114 -1.106 -5.934 10.907 700 HB THR 114 HB THR 114 -0.262 -3.910 12.988 701 HG1 THR 114 HG1 THR 114 1.153 -5.734 11.390 702 H LEU 115 HN LEU 115 -3.150 -6.433 11.192 703 HA LEU 115 HA LEU 115 -4.877 -4.698 12.762 704 HG LEU 115 HG LEU 115 -5.760 -6.844 9.819 705 HB2 LEU 115 HB2 LEU 115 -6.693 -4.833 11.110 706 HB3 LEU 115 HB1 LEU 115 -5.302 -3.953 10.514 707 H GLY 116 HN GLY 116 -5.684 -5.944 14.309 708 HA2 GLY 116 HA2 GLY 116 -6.730 -7.718 15.340 709 HA3 GLY 116 HA1 GLY 116 -7.097 -8.350 13.742 710 H ASP 117 HN ASP 117 -3.974 -7.700 15.293 711 HA ASP 117 HA ASP 117 -2.204 -9.024 15.810 712 HB2 ASP 117 HB2 ASP 117 -3.939 -10.308 17.089 713 HB3 ASP 117 HB1 ASP 117 -4.130 -11.351 15.684 714 H ILE 118 HN ILE 118 -3.671 -8.991 12.932 715 HA ILE 118 HA ILE 118 -2.208 -11.152 11.662 716 HB ILE 118 HB ILE 118 -3.788 -8.988 10.282 717 H VAL 119 HN VAL 119 -0.409 -10.954 10.413 718 HA VAL 119 HA VAL 119 0.846 -8.291 10.344 719 HB VAL 119 HB VAL 119 2.162 -11.008 10.216 720 H TYR 120 HN TYR 120 0.841 -7.319 8.452 721 HA TYR 120 HA TYR 120 0.846 -8.963 6.005 722 HD1 TYR 120 HD2 TYR 120 1.067 -5.588 4.199 723 HD2 TYR 120 HD1 TYR 120 -2.023 -8.503 4.414 724 HE1 TYR 120 HE2 TYR 120 0.774 -5.448 1.763 725 HE2 TYR 120 HE1 TYR 120 -2.326 -8.373 1.978 726 HH TYR 120 HH TYR 120 -1.896 -6.783 0.152 727 HB2 TYR 120 HB2 TYR 120 -1.188 -7.558 6.393 728 HB3 TYR 120 HB1 TYR 120 -0.165 -6.129 6.356 729 H LYS 121 HN LYS 121 2.716 -8.930 4.923 730 HA LYS 121 HA LYS 121 4.325 -6.468 4.992 731 HB2 LYS 121 HB2 LYS 121 5.281 -8.249 6.464 732 HB3 LYS 121 HB1 LYS 121 5.458 -9.266 5.041 733 HG2 LYS 121 HG2 LYS 121 6.958 -7.598 4.048 734 HG3 LYS 121 HG1 LYS 121 6.800 -6.609 5.500 735 HD2 LYS 121 HD2 LYS 121 7.875 -9.427 5.441 736 HD3 LYS 121 HD1 LYS 121 8.870 -7.970 5.465 737 HE2 LYS 121 HE2 LYS 121 7.852 -7.332 7.610 738 HE3 LYS 121 HE1 LYS 121 6.896 -8.814 7.586 739 HZ1 LYS 121 HZ1 LYS 121 8.962 -10.087 7.614 740 HZ2 LYS 121 HZ2 LYS 121 8.842 -9.078 8.965 741 HZ3 LYS 121 HZ3 LYS 121 9.860 -8.654 7.683 742 H ARG 122 HN ARG 122 4.707 -5.669 3.039 743 HA ARG 122 HA ARG 122 4.412 -7.449 0.718 744 HE ARG 122 HE ARG 122 1.699 -5.001 -1.073 745 HB2 ARG 122 HB2 ARG 122 2.861 -5.686 0.520 746 HB3 ARG 122 HB1 ARG 122 4.020 -4.485 1.072 747 HG2 ARG 122 HG2 ARG 122 5.288 -4.815 -1.028 748 HG3 ARG 122 HG1 ARG 122 4.027 -5.920 -1.575 749 HD2 ARG 122 HD2 ARG 122 3.666 -3.007 -0.876 750 HD3 ARG 122 HD1 ARG 122 3.696 -3.689 -2.503 751 HH11 ARG 122 HH11 ARG 122 2.401 -1.797 -2.251 752 HH12 ARG 122 HH12 ARG 122 0.735 -1.356 -2.421 753 HH21 ARG 122 HH21 ARG 122 -0.495 -4.426 -1.292 754 HH22 ARG 122 HH22 ARG 122 -0.910 -2.847 -1.871 755 H VAL 123 HN VAL 123 6.172 -8.014 -0.357 756 HA VAL 123 HA VAL 123 8.616 -6.417 -0.007 757 HB VAL 123 HB VAL 123 8.321 -9.285 -0.920 758 H SER 124 HN SER 124 9.169 -5.152 -1.640 759 HA SER 124 HA SER 124 8.496 -5.998 -4.382 760 HG SER 124 HG SER 124 7.779 -2.757 -2.403 761 HB2 SER 124 HB2 SER 124 8.095 -3.631 -4.953 762 HB3 SER 124 HB1 SER 124 6.984 -4.194 -3.705 763 H LYS 125 HN LYS 125 10.009 -5.473 -5.986 764 HA LYS 125 HA LYS 125 12.671 -4.760 -4.955 765 HB2 LYS 125 HB2 LYS 125 11.995 -6.126 -7.552 766 HB3 LYS 125 HB1 LYS 125 13.592 -5.935 -6.857 767 HG2 LYS 125 HG2 LYS 125 12.803 -7.345 -4.968 768 HG3 LYS 125 HG1 LYS 125 11.330 -7.633 -5.889 769 HD2 LYS 125 HD2 LYS 125 12.795 -9.471 -6.305 770 HD3 LYS 125 HD1 LYS 125 12.764 -8.466 -7.759 771 HE2 LYS 125 HE2 LYS 125 15.040 -9.224 -7.159 772 HE3 LYS 125 HE1 LYS 125 14.879 -7.468 -7.167 773 HZ1 LYS 125 HZ1 LYS 125 16.124 -8.256 -5.244 774 HZ2 LYS 125 HZ2 LYS 125 14.804 -9.190 -4.747 775 HZ3 LYS 125 HZ3 LYS 125 14.685 -7.502 -4.766 776 H ARG 126 HN ARG 126 13.967 -3.260 -6.058 777 HA ARG 126 HA ARG 126 12.462 -1.247 -7.513 778 HE ARG 126 HE ARG 126 14.691 2.603 -8.968 779 HB2 ARG 126 HB2 ARG 126 14.118 -0.707 -5.678 780 HB3 ARG 126 HB1 ARG 126 15.395 -1.213 -6.773 781 HG2 ARG 126 HG2 ARG 126 13.468 0.868 -7.677 782 HG3 ARG 126 HG1 ARG 126 14.737 1.309 -6.533 783 HD2 ARG 126 HD2 ARG 126 16.425 0.436 -8.086 784 HD3 ARG 126 HD1 ARG 126 15.149 0.025 -9.231 785 HH11 ARG 126 HH11 ARG 126 17.741 0.943 -9.263 786 HH12 ARG 126 HH12 ARG 126 18.538 2.275 -10.030 787 HH21 ARG 126 HH21 ARG 126 15.731 4.362 -9.978 788 HH22 ARG 126 HH22 ARG 126 17.394 4.219 -10.439 789 H ILE 127 HN ILE 127 12.330 -1.248 -9.655 790 HA ILE 127 HA ILE 127 14.610 -2.202 -11.234 791 HB ILE 127 HB ILE 127 13.045 -3.327 -12.817 792 H9 OLA 128 HH1 OLA 128 -5.503 -8.662 -4.393 793 H10 OLA 128 HI1 OLA 128 -6.499 -7.977 -2.260 794 H21 OLA 128 HA1 OLA 128 -8.421 -6.919 -12.596 795 H22 OLA 128 HA2 OLA 128 -8.279 -8.586 -12.037 796 H31 OLA 128 HB1 OLA 128 -7.935 -6.304 -10.515 797 H32 OLA 128 HB2 OLA 128 -9.544 -6.872 -10.066 798 H41 OLA 128 HC1 OLA 128 -7.861 -9.140 -10.193 799 H42 OLA 128 HC2 OLA 128 -8.617 -8.417 -8.769 800 H51 OLA 128 HD1 OLA 128 -6.006 -8.693 -8.924 801 H52 OLA 128 HD2 OLA 128 -6.124 -7.195 -9.850 802 H61 OLA 128 HE1 OLA 128 -7.740 -7.039 -7.474 803 H62 OLA 128 HE2 OLA 128 -6.413 -5.999 -7.996 804 H71 OLA 128 HF1 OLA 128 -6.142 -8.617 -6.518 805 H72 OLA 128 HF2 OLA 128 -4.804 -7.598 -7.057 806 H81 OLA 128 HG1 OLA 128 -5.081 -6.126 -5.374 807 H82 OLA 128 HG2 OLA 128 -6.843 -6.218 -5.456 808 H111 OLA 128 HJ1 OLA 128 -7.534 -5.670 -3.866 809 H112 OLA 128 HJ2 OLA 128 -7.861 -6.030 -2.170 810 H121 OLA 128 HK1 OLA 128 -6.347 -4.517 -1.584 811 H122 OLA 128 HK2 OLA 128 -5.102 -5.498 -2.360 812 H131 OLA 128 HL1 OLA 128 -6.604 -4.013 -4.323 813 H132 OLA 128 HL2 OLA 128 -4.866 -4.019 -4.007 814 H141 OLA 128 HM1 OLA 128 -4.966 -2.190 -2.647 815 H142 OLA 128 HM2 OLA 128 -6.610 -2.546 -2.110 816 H151 OLA 128 HN1 OLA 128 -7.551 -1.690 -4.103 817 H152 OLA 128 HN2 OLA 128 -5.981 -1.641 -4.908 818 H161 OLA 128 HP1 OLA 128 -5.596 0.415 -4.150 819 H162 OLA 128 HP2 OLA 128 -5.899 -0.095 -2.489 820 H171 OLA 128 HQ1 OLA 128 -8.154 0.475 -2.592 821 H172 OLA 128 HQ2 OLA 128 -8.186 0.421 -4.361 822 H181 OLA 128 HR1 OLA 128 -8.151 2.685 -4.036 823 H182 OLA 128 HR2 OLA 128 -7.223 2.565 -2.540 824 H183 OLA 128 HR3 OLA 128 -6.418 2.363 -4.097 825 H9 OLA 129 HH1 OLA 129 -1.251 7.358 0.679 826 H10 OLA 129 HI1 OLA 129 -3.243 6.193 1.515 827 H21 OLA 129 HA1 OLA 129 1.154 0.174 -0.640 828 H22 OLA 129 HA2 OLA 129 2.415 0.024 0.584 829 H31 OLA 129 HB1 OLA 129 0.999 2.629 0.252 830 H32 OLA 129 HB2 OLA 129 0.204 1.310 1.115 831 H41 OLA 129 HC1 OLA 129 2.981 2.258 1.782 832 H42 OLA 129 HC2 OLA 129 1.927 1.215 2.740 833 H51 OLA 129 HD1 OLA 129 0.319 3.248 2.730 834 H52 OLA 129 HD2 OLA 129 1.713 3.256 3.812 835 H61 OLA 129 HE1 OLA 129 2.734 4.351 1.512 836 H62 OLA 129 HE2 OLA 129 2.184 5.255 2.925 837 H71 OLA 129 HF1 OLA 129 1.239 5.594 0.391 838 H72 OLA 129 HF2 OLA 129 0.045 4.487 1.072 839 H81 OLA 129 HG1 OLA 129 0.054 6.122 3.088 840 H82 OLA 129 HG2 OLA 129 0.773 7.256 1.944 841 H111 OLA 129 HJ1 OLA 129 -1.605 4.171 2.682 842 H112 OLA 129 HJ2 OLA 129 -1.698 5.470 3.875 843 H121 OLA 129 HK1 OLA 129 -3.637 4.543 4.498 844 H122 OLA 129 HK2 OLA 129 -4.301 5.238 3.018 845 H131 OLA 129 HL1 OLA 129 -4.617 2.699 3.516 846 H132 OLA 129 HL2 OLA 129 -2.953 2.570 2.941 847 H141 OLA 129 HM1 OLA 129 -4.703 4.187 1.233 848 H142 OLA 129 HM2 OLA 129 -5.168 2.489 1.351 849 H151 OLA 129 HN1 OLA 129 -2.614 2.077 0.935 850 H152 OLA 129 HN2 OLA 129 -2.671 3.704 0.256 851 H161 OLA 129 HP1 OLA 129 -4.778 2.716 -1.003 852 H162 OLA 129 HP2 OLA 129 -3.935 1.193 -0.712 853 H171 OLA 129 HQ1 OLA 129 -2.639 3.595 -1.999 854 H172 OLA 129 HQ2 OLA 129 -2.007 1.943 -1.907 855 H181 OLA 129 HR1 OLA 129 -3.233 1.256 -3.657 856 H182 OLA 129 HR2 OLA 129 -3.386 2.974 -4.023 857 H183 OLA 129 HR3 OLA 129 -4.659 2.147 -3.126 Start of MODEL 6 1 HA MET 1 HA MET 1 18.473 10.906 -1.144 2 H1 MET 1 HT1 MET 1 17.122 10.361 1.435 3 H2 MET 1 HT2 MET 1 16.638 11.504 0.288 4 H3 MET 1 HT3 MET 1 18.114 11.690 1.095 5 HB2 MET 1 HB2 MET 1 19.982 10.196 0.698 6 HB3 MET 1 HB1 MET 1 19.000 8.753 0.915 7 HG2 MET 1 HG2 MET 1 19.547 8.044 -1.362 8 HG3 MET 1 HG1 MET 1 20.550 9.481 -1.559 9 HE1 MET 1 HE1 MET 1 23.361 8.835 1.116 10 HE2 MET 1 HE2 MET 1 21.842 9.691 1.378 11 HE3 MET 1 HE3 MET 1 22.751 9.945 -0.112 12 H ASN 2 HN ASN 2 16.285 8.915 0.745 13 HA ASN 2 HA ASN 2 15.689 7.264 -1.597 14 HB2 ASN 2 HB2 ASN 2 14.328 5.926 0.051 15 HB3 ASN 2 HB1 ASN 2 16.056 5.978 0.385 16 H PHE 3 HN PHE 3 14.121 7.916 -2.897 17 HA PHE 3 HA PHE 3 11.512 8.461 -2.075 18 HD1 PHE 3 HD2 PHE 3 14.734 10.774 -1.234 19 HD2 PHE 3 HD1 PHE 3 12.425 11.798 -4.657 20 HE1 PHE 3 HE2 PHE 3 16.653 12.010 -2.153 21 HE2 PHE 3 HE1 PHE 3 14.338 13.037 -5.584 22 HZ PHE 3 HZ PHE 3 16.456 13.145 -4.331 23 HB2 PHE 3 HB2 PHE 3 11.382 10.877 -2.727 24 HB3 PHE 3 HB1 PHE 3 12.285 10.580 -1.247 25 H SER 4 HN SER 4 10.298 7.894 -3.706 26 HA SER 4 HA SER 4 9.487 7.542 -5.800 27 HG SER 4 HG SER 4 10.285 9.650 -8.531 28 HB2 SER 4 HB2 SER 4 10.031 9.889 -6.281 29 HB3 SER 4 HB1 SER 4 11.681 9.428 -6.697 30 H GLY 5 HN GLY 5 9.797 6.100 -7.472 31 HA2 GLY 5 HA2 GLY 5 11.936 5.163 -8.760 32 HA3 GLY 5 HA1 GLY 5 12.149 4.413 -7.184 33 H LYS 6 HN LYS 6 11.871 2.838 -9.406 34 HA LYS 6 HA LYS 6 9.082 1.936 -9.387 35 HB2 LYS 6 HB2 LYS 6 10.484 2.355 -11.537 36 HB3 LYS 6 HB1 LYS 6 11.223 0.803 -11.163 37 HG2 LYS 6 HG2 LYS 6 8.250 1.052 -11.289 38 HG3 LYS 6 HG1 LYS 6 9.194 0.911 -12.772 39 HD2 LYS 6 HD2 LYS 6 10.184 -1.171 -11.926 40 HD3 LYS 6 HD1 LYS 6 9.210 -1.028 -10.460 41 HE2 LYS 6 HE2 LYS 6 7.171 -1.177 -11.782 42 HE3 LYS 6 HE1 LYS 6 8.123 -1.268 -13.265 43 HZ1 LYS 6 HZ1 LYS 6 9.055 -3.350 -12.517 44 HZ2 LYS 6 HZ2 LYS 6 7.367 -3.449 -12.516 45 HZ3 LYS 6 HZ3 LYS 6 8.204 -3.255 -11.059 46 H TYR 7 HN TYR 7 8.465 0.079 -8.459 47 HA TYR 7 HA TYR 7 10.517 -1.824 -7.572 48 HD1 TYR 7 HD2 TYR 7 11.893 -0.651 -5.464 49 HD2 TYR 7 HD1 TYR 7 8.115 1.305 -5.569 50 HE1 TYR 7 HE2 TYR 7 12.973 1.460 -4.812 51 HE2 TYR 7 HE1 TYR 7 9.187 3.422 -4.921 52 HH TYR 7 HH TYR 7 11.222 4.184 -3.784 53 HB2 TYR 7 HB2 TYR 7 8.208 -1.029 -5.803 54 HB3 TYR 7 HB1 TYR 7 9.669 -1.912 -5.364 55 H GLN 8 HN GLN 8 9.757 -3.994 -7.343 56 HA GLN 8 HA GLN 8 7.168 -4.461 -8.664 57 HB2 GLN 8 HB2 GLN 8 9.352 -5.078 -9.901 58 HB3 GLN 8 HB1 GLN 8 9.444 -6.415 -8.762 59 HG2 GLN 8 HG2 GLN 8 8.413 -7.252 -10.710 60 HG3 GLN 8 HG1 GLN 8 7.137 -7.073 -9.504 61 H VAL 9 HN VAL 9 5.713 -5.228 -7.288 62 HA VAL 9 HA VAL 9 6.374 -6.471 -4.811 63 HB VAL 9 HB VAL 9 3.728 -6.501 -6.275 64 H GLN 10 HN GLN 10 7.093 -8.497 -4.585 65 HA GLN 10 HA GLN 10 6.746 -10.401 -6.747 66 HB2 GLN 10 HB2 GLN 10 8.301 -10.670 -4.172 67 HB3 GLN 10 HB1 GLN 10 8.376 -11.753 -5.554 68 HG2 GLN 10 HG2 GLN 10 9.362 -10.041 -6.913 69 HG3 GLN 10 HG1 GLN 10 9.154 -8.850 -5.631 70 H SER 11 HN SER 11 6.418 -10.607 -3.194 71 HA SER 11 HA SER 11 3.944 -12.100 -3.531 72 HG SER 11 HG SER 11 4.748 -14.155 -0.982 73 HB2 SER 11 HB2 SER 11 5.646 -13.852 -3.578 74 HB3 SER 11 HB1 SER 11 6.326 -13.249 -2.068 75 H GLN 12 HN GLN 12 2.948 -12.626 -1.356 76 HA GLN 12 HA GLN 12 3.723 -10.784 0.774 77 HB2 GLN 12 HB2 GLN 12 1.988 -9.785 -0.912 78 HB3 GLN 12 HB1 GLN 12 0.853 -10.837 -0.083 79 HG2 GLN 12 HG2 GLN 12 2.569 -8.820 1.327 80 HG3 GLN 12 HG1 GLN 12 0.948 -8.478 0.734 81 H GLU 13 HN GLU 13 3.365 -11.626 2.765 82 HA GLU 13 HA GLU 13 1.925 -14.188 2.900 83 HB2 GLU 13 HB2 GLU 13 3.219 -14.625 4.938 84 HB3 GLU 13 HB1 GLU 13 4.274 -14.299 3.570 85 HG2 GLU 13 HG2 GLU 13 4.589 -12.006 4.372 86 HG3 GLU 13 HG1 GLU 13 3.552 -12.355 5.755 87 H ASN 14 HN ASN 14 0.523 -14.611 4.641 88 HA ASN 14 HA ASN 14 -0.839 -14.163 6.448 89 HB2 ASN 14 HB2 ASN 14 -0.689 -12.278 7.708 90 HB3 ASN 14 HB1 ASN 14 0.797 -12.060 6.794 91 H PHE 15 HN PHE 15 -1.285 -13.981 3.455 92 HA PHE 15 HA PHE 15 -3.392 -12.172 2.990 93 HD1 PHE 15 HD1 PHE 15 -4.470 -11.509 1.095 94 HD2 PHE 15 HD2 PHE 15 -0.878 -13.445 -0.116 95 HE1 PHE 15 HE1 PHE 15 -4.037 -9.693 -0.509 96 HE2 PHE 15 HE2 PHE 15 -0.439 -11.633 -1.719 97 HZ PHE 15 HZ PHE 15 -2.018 -9.753 -1.917 98 HB2 PHE 15 HB2 PHE 15 -2.118 -14.374 1.563 99 HB3 PHE 15 HB1 PHE 15 -3.843 -14.255 1.229 100 H GLU 16 HN GLU 16 -3.460 -15.646 3.799 101 HA GLU 16 HA GLU 16 -6.208 -16.019 3.694 102 HB2 GLU 16 HB2 GLU 16 -4.234 -17.358 5.549 103 HB3 GLU 16 HB1 GLU 16 -5.859 -17.935 5.208 104 HG2 GLU 16 HG2 GLU 16 -5.220 -18.129 2.815 105 HG3 GLU 16 HG1 GLU 16 -3.569 -17.713 3.272 106 HA PRO 17 HA PRO 17 -6.592 -14.835 8.348 107 HB2 PRO 17 HB2 PRO 17 -4.595 -13.396 9.486 108 HB3 PRO 17 HB1 PRO 17 -4.641 -15.163 9.508 109 HG2 PRO 17 HG2 PRO 17 -3.100 -13.329 7.716 110 HG3 PRO 17 HG1 PRO 17 -2.575 -14.830 8.502 111 HD2 PRO 17 HD2 PRO 17 -3.317 -14.718 5.895 112 HD3 PRO 17 HD1 PRO 17 -3.554 -16.159 6.899 113 H PHE 18 HN PHE 18 -4.683 -12.472 6.483 114 HA PHE 18 HA PHE 18 -5.929 -10.165 7.524 115 HD1 PHE 18 HD1 PHE 18 -4.621 -7.811 7.316 116 HD2 PHE 18 HD2 PHE 18 -5.412 -9.105 3.340 117 HE1 PHE 18 HE1 PHE 18 -5.094 -5.487 6.658 118 HE2 PHE 18 HE2 PHE 18 -5.883 -6.785 2.674 119 HZ PHE 18 HZ PHE 18 -5.714 -4.968 4.337 120 HB2 PHE 18 HB2 PHE 18 -3.794 -10.031 6.368 121 HB3 PHE 18 HB1 PHE 18 -4.530 -10.608 4.876 122 H MET 19 HN MET 19 -6.659 -12.167 4.704 123 HA MET 19 HA MET 19 -8.671 -10.519 3.594 124 HB2 MET 19 HB2 MET 19 -9.086 -12.282 2.121 125 HB3 MET 19 HB1 MET 19 -7.396 -12.452 2.526 126 HG2 MET 19 HG2 MET 19 -8.136 -14.612 2.608 127 HG3 MET 19 HG1 MET 19 -8.232 -14.127 4.300 128 HE1 MET 19 HE1 MET 19 -11.278 -16.619 3.532 129 HE2 MET 19 HE2 MET 19 -9.750 -16.452 4.396 130 HE3 MET 19 HE3 MET 19 -9.758 -16.603 2.641 131 H LYS 20 HN LYS 20 -8.809 -13.085 6.019 132 HA LYS 20 HA LYS 20 -11.650 -13.164 6.100 133 HB2 LYS 20 HB2 LYS 20 -9.476 -14.130 7.934 134 HB3 LYS 20 HB1 LYS 20 -11.166 -14.229 8.416 135 HG2 LYS 20 HG2 LYS 20 -11.609 -15.551 6.358 136 HG3 LYS 20 HG1 LYS 20 -9.874 -15.544 6.038 137 HD2 LYS 20 HD2 LYS 20 -9.466 -16.678 8.159 138 HD3 LYS 20 HD1 LYS 20 -11.195 -16.657 8.512 139 HE2 LYS 20 HE2 LYS 20 -9.874 -18.073 6.196 140 HE3 LYS 20 HE1 LYS 20 -10.483 -18.837 7.664 141 HZ1 LYS 20 HZ1 LYS 20 -12.119 -17.363 5.668 142 HZ2 LYS 20 HZ2 LYS 20 -12.710 -18.079 7.083 143 HZ3 LYS 20 HZ3 LYS 20 -12.061 -19.044 5.855 144 H ALA 21 HN ALA 21 -9.192 -11.504 8.034 145 HA ALA 21 HA ALA 21 -11.046 -10.281 9.819 146 HB1 ALA 21 HB1 ALA 21 -8.686 -10.685 10.394 147 HB2 ALA 21 HB2 ALA 21 -9.156 -9.001 10.618 148 HB3 ALA 21 HB3 ALA 21 -8.207 -9.472 9.206 149 H MET 22 HN MET 22 -8.869 -8.674 7.513 150 HA MET 22 HA MET 22 -10.105 -6.214 7.468 151 HB2 MET 22 HB2 MET 22 -7.944 -6.458 6.496 152 HB3 MET 22 HB1 MET 22 -8.523 -7.650 5.342 153 HG2 MET 22 HG2 MET 22 -8.110 -5.483 4.301 154 HG3 MET 22 HG1 MET 22 -9.802 -5.963 4.182 155 HE1 MET 22 HE1 MET 22 -8.268 -2.849 7.231 156 HE2 MET 22 HE2 MET 22 -7.217 -3.596 6.026 157 HE3 MET 22 HE3 MET 22 -7.916 -4.575 7.316 158 H GLY 23 HN GLY 23 -10.724 -8.974 5.288 159 HA2 GLY 23 HA2 GLY 23 -13.216 -9.189 4.853 160 HA3 GLY 23 HA1 GLY 23 -13.108 -7.515 4.330 161 H LEU 24 HN LEU 24 -10.291 -9.100 3.475 162 HA LEU 24 HA LEU 24 -11.002 -9.066 0.699 163 HG LEU 24 HG LEU 24 -8.817 -10.821 -0.405 164 HB2 LEU 24 HB2 LEU 24 -8.729 -8.487 1.506 165 HB3 LEU 24 HB1 LEU 24 -8.513 -10.135 2.029 166 HA PRO 25 HA PRO 25 -12.185 -13.336 0.557 167 HB2 PRO 25 HB2 PRO 25 -12.561 -13.188 -2.250 168 HB3 PRO 25 HB1 PRO 25 -13.771 -12.886 -1.000 169 HG2 PRO 25 HG2 PRO 25 -12.788 -10.964 -2.736 170 HG3 PRO 25 HG1 PRO 25 -13.551 -10.621 -1.172 171 HD2 PRO 25 HD2 PRO 25 -10.639 -10.821 -1.843 172 HD3 PRO 25 HD1 PRO 25 -11.496 -9.602 -0.865 173 H GLU 26 HN GLU 26 -11.145 -15.216 0.314 174 HA GLU 26 HA GLU 26 -8.523 -15.465 -0.475 175 HB2 GLU 26 HB2 GLU 26 -10.603 -17.248 0.312 176 HB3 GLU 26 HB1 GLU 26 -9.799 -17.925 -1.100 177 HG2 GLU 26 HG2 GLU 26 -7.654 -17.776 0.013 178 HG3 GLU 26 HG1 GLU 26 -8.413 -17.029 1.418 179 H ASP 27 HN ASP 27 -11.407 -15.540 -2.459 180 HA ASP 27 HA ASP 27 -10.414 -16.743 -4.760 181 HB2 ASP 27 HB2 ASP 27 -12.778 -16.108 -4.483 182 HB3 ASP 27 HB1 ASP 27 -12.334 -14.406 -4.567 183 H LEU 28 HN LEU 28 -10.232 -13.390 -3.680 184 HA LEU 28 HA LEU 28 -8.734 -12.453 -5.904 185 HG LEU 28 HG LEU 28 -9.723 -10.196 -5.957 186 HB2 LEU 28 HB2 LEU 28 -9.410 -11.385 -3.195 187 HB3 LEU 28 HB1 LEU 28 -8.136 -10.607 -4.117 188 H ILE 29 HN ILE 29 -7.929 -13.854 -2.792 189 HA ILE 29 HA ILE 29 -5.219 -13.204 -2.637 190 HB ILE 29 HB ILE 29 -6.767 -15.544 -1.574 191 H GLN 30 HN GLN 30 -6.786 -16.069 -4.051 192 HA GLN 30 HA GLN 30 -4.419 -17.352 -4.854 193 HB2 GLN 30 HB2 GLN 30 -7.276 -17.584 -5.768 194 HB3 GLN 30 HB1 GLN 30 -5.994 -18.564 -6.468 195 HG2 GLN 30 HG2 GLN 30 -6.944 -19.912 -4.813 196 HG3 GLN 30 HG1 GLN 30 -5.463 -19.283 -4.091 197 H LYS 31 HN LYS 31 -6.551 -15.099 -6.549 198 HA LYS 31 HA LYS 31 -5.185 -15.257 -9.032 199 HB2 LYS 31 HB2 LYS 31 -7.008 -13.132 -7.901 200 HB3 LYS 31 HB1 LYS 31 -6.425 -13.152 -9.559 201 HG2 LYS 31 HG2 LYS 31 -7.589 -15.182 -10.019 202 HG3 LYS 31 HG1 LYS 31 -8.019 -15.379 -8.320 203 HD2 LYS 31 HD2 LYS 31 -9.464 -13.481 -8.391 204 HD3 LYS 31 HD1 LYS 31 -8.888 -13.035 -9.999 205 HE2 LYS 31 HE2 LYS 31 -11.100 -14.117 -10.056 206 HE3 LYS 31 HE1 LYS 31 -9.882 -15.027 -10.946 207 HZ1 LYS 31 HZ1 LYS 31 -9.670 -16.533 -9.090 208 HZ2 LYS 31 HZ2 LYS 31 -11.290 -16.453 -9.568 209 HZ3 LYS 31 HZ3 LYS 31 -10.777 -15.634 -8.179 210 H GLY 32 HN GLY 32 -4.739 -13.350 -6.140 211 HA2 GLY 32 HA2 GLY 32 -2.959 -11.451 -7.370 212 HA3 GLY 32 HA1 GLY 32 -3.304 -11.602 -5.657 213 H LYS 33 HN LYS 33 -2.538 -14.377 -5.413 214 HA LYS 33 HA LYS 33 0.205 -14.035 -4.895 215 HB2 LYS 33 HB2 LYS 33 0.245 -16.437 -4.406 216 HB3 LYS 33 HB1 LYS 33 -1.138 -15.649 -3.662 217 HG2 LYS 33 HG2 LYS 33 -2.603 -16.513 -5.370 218 HG3 LYS 33 HG1 LYS 33 -1.232 -17.214 -6.231 219 HD2 LYS 33 HD2 LYS 33 -2.012 -17.955 -3.413 220 HD3 LYS 33 HD1 LYS 33 -2.539 -18.841 -4.845 221 HE2 LYS 33 HE2 LYS 33 -0.198 -19.280 -5.424 222 HE3 LYS 33 HE1 LYS 33 0.320 -18.404 -3.985 223 HZ1 LYS 33 HZ1 LYS 33 0.320 -20.788 -3.614 224 HZ2 LYS 33 HZ2 LYS 33 -1.324 -20.878 -4.002 225 HZ3 LYS 33 HZ3 LYS 33 -0.827 -20.037 -2.622 226 H ASP 34 HN ASP 34 -1.495 -15.080 -7.725 227 HA ASP 34 HA ASP 34 0.906 -16.170 -8.954 228 HB2 ASP 34 HB2 ASP 34 -1.942 -15.906 -9.927 229 HB3 ASP 34 HB1 ASP 34 -0.636 -16.535 -10.925 230 H ILE 35 HN ILE 35 -0.932 -13.237 -8.896 231 HA ILE 35 HA ILE 35 0.554 -12.179 -11.198 232 HB ILE 35 HB ILE 35 -1.804 -10.982 -9.729 233 H LYS 36 HN LYS 36 2.368 -11.112 -10.771 234 HA LYS 36 HA LYS 36 2.938 -10.098 -8.129 235 HB2 LYS 36 HB2 LYS 36 4.510 -9.974 -10.710 236 HB3 LYS 36 HB1 LYS 36 5.103 -9.403 -9.157 237 HG2 LYS 36 HG2 LYS 36 4.816 -11.703 -8.264 238 HG3 LYS 36 HG1 LYS 36 4.392 -12.231 -9.893 239 HD2 LYS 36 HD2 LYS 36 6.572 -11.507 -10.709 240 HD3 LYS 36 HD1 LYS 36 6.994 -10.929 -9.095 241 HE2 LYS 36 HE2 LYS 36 6.414 -13.783 -9.882 242 HE3 LYS 36 HE1 LYS 36 7.999 -13.103 -9.513 243 HZ1 LYS 36 HZ1 LYS 36 7.241 -12.664 -7.257 244 HZ2 LYS 36 HZ2 LYS 36 7.104 -14.309 -7.627 245 HZ3 LYS 36 HZ3 LYS 36 5.725 -13.328 -7.612 246 H GLY 37 HN GLY 37 1.967 -8.270 -7.521 247 HA2 GLY 37 HA2 GLY 37 0.924 -6.294 -9.191 248 HA3 GLY 37 HA1 GLY 37 1.314 -6.072 -7.493 249 H VAL 38 HN VAL 38 1.574 -4.006 -9.282 250 HA VAL 38 HA VAL 38 4.501 -3.714 -9.483 251 HB VAL 38 HB VAL 38 2.523 -2.258 -11.231 252 H SER 39 HN SER 39 5.397 -1.877 -8.645 253 HA SER 39 HA SER 39 3.541 0.102 -7.506 254 HG SER 39 HG SER 39 4.152 -2.345 -6.086 255 HB2 SER 39 HB2 SER 39 6.039 -0.996 -6.199 256 HB3 SER 39 HB1 SER 39 5.035 0.300 -5.549 257 H GLU 40 HN GLU 40 3.886 2.077 -8.193 258 HA GLU 40 HA GLU 40 6.613 2.931 -8.859 259 HB2 GLU 40 HB2 GLU 40 4.139 3.327 -10.548 260 HB3 GLU 40 HB1 GLU 40 5.619 4.246 -10.774 261 HG2 GLU 40 HG2 GLU 40 6.836 2.302 -11.355 262 HG3 GLU 40 HG1 GLU 40 5.491 1.251 -10.911 263 H ILE 41 HN ILE 41 7.141 4.746 -7.815 264 HA ILE 41 HA ILE 41 4.953 6.496 -6.897 265 HB ILE 41 HB ILE 41 7.480 6.124 -5.318 266 H VAL 42 HN VAL 42 5.129 8.551 -7.468 267 HA VAL 42 HA VAL 42 7.719 9.524 -8.464 268 HB VAL 42 HB VAL 42 4.996 10.734 -8.962 269 H HIS 43 HN HIS 43 8.799 10.740 -7.045 270 HA HIS 43 HA HIS 43 7.270 12.278 -5.061 271 HD1 HIS 43 HD1 HIS 43 8.695 11.163 -1.814 272 HD2 HIS 43 HD2 HIS 43 10.172 14.381 -3.988 273 HE1 HIS 43 HE1 HIS 43 9.150 12.968 -0.121 274 HE2 HIS 43 HE2 HIS 43 10.144 14.863 -1.449 275 HB2 HIS 43 HB2 HIS 43 8.906 10.619 -4.200 276 HB3 HIS 43 HB1 HIS 43 10.194 11.505 -5.007 277 H GLU 44 HN GLU 44 7.031 14.355 -5.459 278 HA GLU 44 HA GLU 44 9.278 15.872 -6.573 279 HB2 GLU 44 HB2 GLU 44 7.715 15.361 -8.422 280 HB3 GLU 44 HB1 GLU 44 6.418 16.129 -7.520 281 HG2 GLU 44 HG2 GLU 44 7.300 17.599 -9.242 282 HG3 GLU 44 HG1 GLU 44 7.565 18.259 -7.628 283 H GLY 45 HN GLY 45 9.766 17.032 -4.783 284 HA2 GLY 45 HA2 GLY 45 9.572 18.696 -3.208 285 HA3 GLY 45 HA1 GLY 45 8.091 19.188 -4.019 286 H LYS 46 HN LYS 46 6.144 18.650 -3.151 287 HA LYS 46 HA LYS 46 6.194 17.016 -0.696 288 HB2 LYS 46 HB2 LYS 46 4.321 18.430 0.123 289 HB3 LYS 46 HB1 LYS 46 5.817 19.321 -0.090 290 HG2 LYS 46 HG2 LYS 46 5.013 20.292 -2.129 291 HG3 LYS 46 HG1 LYS 46 3.566 19.280 -2.084 292 HD2 LYS 46 HD2 LYS 46 2.864 20.370 -0.014 293 HD3 LYS 46 HD1 LYS 46 4.315 21.375 -0.046 294 HE2 LYS 46 HE2 LYS 46 2.456 22.640 -0.907 295 HE3 LYS 46 HE1 LYS 46 3.583 22.287 -2.216 296 HZ1 LYS 46 HZ1 LYS 46 2.144 20.469 -2.909 297 HZ2 LYS 46 HZ2 LYS 46 1.308 21.939 -2.918 298 HZ3 LYS 46 HZ3 LYS 46 1.056 20.831 -1.665 299 H LYS 47 HN LYS 47 4.962 17.394 -3.805 300 HA LYS 47 HA LYS 47 2.516 15.892 -3.279 301 HB2 LYS 47 HB2 LYS 47 2.335 17.780 -4.799 302 HB3 LYS 47 HB1 LYS 47 3.606 17.118 -5.818 303 HG2 LYS 47 HG2 LYS 47 2.178 15.215 -6.371 304 HG3 LYS 47 HG1 LYS 47 0.913 15.870 -5.338 305 HD2 LYS 47 HD2 LYS 47 0.486 16.369 -7.684 306 HD3 LYS 47 HD1 LYS 47 0.752 17.834 -6.742 307 HE2 LYS 47 HE2 LYS 47 3.095 17.863 -7.524 308 HE3 LYS 47 HE1 LYS 47 2.747 16.462 -8.537 309 HZ1 LYS 47 HZ1 LYS 47 1.429 19.116 -8.756 310 HZ2 LYS 47 HZ2 LYS 47 1.116 17.773 -9.735 311 HZ3 LYS 47 HZ3 LYS 47 2.629 18.525 -9.793 312 H VAL 48 HN VAL 48 2.645 13.751 -3.207 313 HA VAL 48 HA VAL 48 4.540 12.407 -5.022 314 HB VAL 48 HB VAL 48 3.642 11.331 -2.351 315 H LYS 49 HN LYS 49 3.656 11.115 -6.474 316 HA LYS 49 HA LYS 49 0.858 10.288 -6.135 317 HB2 LYS 49 HB2 LYS 49 2.613 10.337 -8.600 318 HB3 LYS 49 HB1 LYS 49 0.930 9.831 -8.568 319 HG2 LYS 49 HG2 LYS 49 1.764 12.565 -7.672 320 HG3 LYS 49 HG1 LYS 49 1.452 12.195 -9.368 321 HD2 LYS 49 HD2 LYS 49 -0.809 11.433 -8.765 322 HD3 LYS 49 HD1 LYS 49 -0.489 11.857 -7.081 323 HE2 LYS 49 HE2 LYS 49 -1.775 13.593 -8.264 324 HE3 LYS 49 HE1 LYS 49 -0.219 14.183 -7.678 325 HZ1 LYS 49 HZ1 LYS 49 -0.801 13.337 -10.467 326 HZ2 LYS 49 HZ2 LYS 49 0.679 13.928 -9.902 327 HZ3 LYS 49 HZ3 LYS 49 -0.677 14.937 -9.930 328 H LEU 50 HN LEU 50 0.328 8.197 -5.827 329 HA LEU 50 HA LEU 50 2.433 6.180 -6.271 330 HG LEU 50 HG LEU 50 3.014 4.660 -4.516 331 HB2 LEU 50 HB2 LEU 50 1.734 6.768 -3.840 332 HB3 LEU 50 HB1 LEU 50 0.273 5.873 -4.209 333 H THR 51 HN THR 51 1.929 4.745 -7.774 334 HA THR 51 HA THR 51 -0.913 4.125 -8.224 335 HB THR 51 HB THR 51 1.192 4.410 -10.375 336 HG1 THR 51 HG1 THR 51 0.533 6.440 -9.636 337 H ILE 52 HN ILE 52 -1.390 2.039 -8.092 338 HA ILE 52 HA ILE 52 0.798 0.083 -8.305 339 HB ILE 52 HB ILE 52 -1.892 -0.238 -6.960 340 H THR 53 HN THR 53 0.808 -1.183 -10.059 341 HA THR 53 HA THR 53 -1.633 -1.284 -11.691 342 HB THR 53 HB THR 53 1.206 -1.954 -12.494 343 HG1 THR 53 HG1 THR 53 -0.398 0.367 -12.868 344 H TYR 54 HN TYR 54 -2.708 -3.092 -11.988 345 HA TYR 54 HA TYR 54 -1.484 -5.640 -11.161 346 HD1 TYR 54 HD2 TYR 54 -2.320 -6.886 -8.674 347 HD2 TYR 54 HD1 TYR 54 -5.318 -7.012 -11.690 348 HE1 TYR 54 HE2 TYR 54 -2.753 -9.246 -8.137 349 HE2 TYR 54 HE1 TYR 54 -5.759 -9.372 -11.162 350 HH TYR 54 HH TYR 54 -4.561 -10.887 -8.368 351 HB2 TYR 54 HB2 TYR 54 -3.293 -4.817 -9.625 352 HB3 TYR 54 HB1 TYR 54 -4.418 -4.913 -10.976 353 H GLY 55 HN GLY 55 -2.259 -7.533 -12.337 354 HA2 GLY 55 HA2 GLY 55 -2.372 -7.065 -15.136 355 HA3 GLY 55 HA1 GLY 55 -2.560 -8.620 -14.341 356 H SER 56 HN SER 56 -4.698 -6.045 -13.419 357 HA SER 56 HA SER 56 -6.739 -6.732 -15.332 358 HG SER 56 HG SER 56 -8.982 -8.164 -14.319 359 HB2 SER 56 HB2 SER 56 -6.981 -8.585 -13.757 360 HB3 SER 56 HB1 SER 56 -7.107 -7.448 -12.415 361 H LYS 57 HN LYS 57 -6.040 -5.134 -12.221 362 HA LYS 57 HA LYS 57 -7.636 -2.848 -13.171 363 HB2 LYS 57 HB2 LYS 57 -8.949 -4.020 -11.501 364 HB3 LYS 57 HB1 LYS 57 -7.599 -3.985 -10.374 365 HG2 LYS 57 HG2 LYS 57 -7.735 -1.499 -10.382 366 HG3 LYS 57 HG1 LYS 57 -9.186 -1.631 -11.377 367 HD2 LYS 57 HD2 LYS 57 -10.199 -3.035 -9.579 368 HD3 LYS 57 HD1 LYS 57 -8.791 -2.680 -8.578 369 HE2 LYS 57 HE2 LYS 57 -10.711 -0.651 -9.719 370 HE3 LYS 57 HE1 LYS 57 -10.660 -1.197 -8.043 371 HZ1 LYS 57 HZ1 LYS 57 -8.480 0.236 -9.466 372 HZ2 LYS 57 HZ2 LYS 57 -8.425 -0.289 -7.860 373 HZ3 LYS 57 HZ3 LYS 57 -9.523 0.914 -8.317 374 H VAL 58 HN VAL 58 -6.702 -0.917 -13.030 375 HA VAL 58 HA VAL 58 -4.095 -0.709 -11.718 376 HB VAL 58 HB VAL 58 -4.305 -0.081 -14.121 377 H ILE 59 HN ILE 59 -3.696 0.758 -10.095 378 HA ILE 59 HA ILE 59 -5.999 2.341 -9.158 379 HB ILE 59 HB ILE 59 -3.941 1.014 -7.392 380 H HIS 60 HN HIS 60 -5.649 4.439 -9.046 381 HA HIS 60 HA HIS 60 -2.872 5.412 -8.827 382 HD1 HIS 60 HD1 HIS 60 -5.660 8.802 -9.528 383 HD2 HIS 60 HD2 HIS 60 -6.574 5.147 -11.282 384 HE1 HIS 60 HE1 HIS 60 -8.114 8.913 -10.073 385 HE2 HIS 60 HE2 HIS 60 -8.642 6.697 -11.151 386 HB2 HIS 60 HB2 HIS 60 -3.613 7.421 -10.057 387 HB3 HIS 60 HB1 HIS 60 -3.840 5.952 -11.001 388 H ASN 61 HN ASN 61 -2.405 6.981 -7.310 389 HA ASN 61 HA ASN 61 -4.636 8.075 -5.750 390 HB2 ASN 61 HB2 ASN 61 -2.259 6.592 -4.621 391 HB3 ASN 61 HB1 ASN 61 -3.308 7.621 -3.650 392 H GLU 62 HN GLU 62 -3.995 9.871 -4.343 393 HA GLU 62 HA GLU 62 -1.496 11.210 -5.055 394 HB2 GLU 62 HB2 GLU 62 -3.034 12.113 -6.676 395 HB3 GLU 62 HB1 GLU 62 -4.251 12.393 -5.440 396 HG2 GLU 62 HG2 GLU 62 -2.707 14.037 -4.386 397 HG3 GLU 62 HG1 GLU 62 -1.627 13.829 -5.765 398 H PHE 63 HN PHE 63 -0.569 12.044 -3.287 399 HA PHE 63 HA PHE 63 -2.202 13.096 -1.130 400 HD1 PHE 63 HD2 PHE 63 1.479 11.430 0.223 401 HD2 PHE 63 HD1 PHE 63 -1.392 9.167 -1.955 402 HE1 PHE 63 HE2 PHE 63 3.238 9.846 -0.441 403 HE2 PHE 63 HE1 PHE 63 0.364 7.578 -2.623 404 HZ PHE 63 HZ PHE 63 2.663 7.886 -1.845 405 HB2 PHE 63 HB2 PHE 63 -0.904 11.746 0.571 406 HB3 PHE 63 HB1 PHE 63 -2.084 10.849 -0.378 407 H THR 64 HN THR 64 -1.095 14.441 0.316 408 HA THR 64 HA THR 64 1.542 15.324 -0.658 409 HB THR 64 HB THR 64 -0.556 16.952 0.793 410 HG1 THR 64 HG1 THR 64 0.288 17.517 -1.819 411 H LEU 65 HN LEU 65 3.213 15.210 0.699 412 HA LEU 65 HA LEU 65 3.183 13.836 3.085 413 HG LEU 65 HG LEU 65 4.995 14.078 0.632 414 HB2 LEU 65 HB2 LEU 65 5.112 15.992 2.225 415 HB3 LEU 65 HB1 LEU 65 5.397 14.849 3.523 416 H GLY 66 HN GLY 66 2.852 14.304 5.189 417 HA2 GLY 66 HA2 GLY 66 2.163 15.456 7.050 418 HA3 GLY 66 HA1 GLY 66 2.977 16.852 6.361 419 H GLU 67 HN GLU 67 0.103 14.949 5.450 420 HA GLU 67 HA GLU 67 -1.680 17.118 5.998 421 HB2 GLU 67 HB2 GLU 67 -0.659 17.891 3.883 422 HB3 GLU 67 HB1 GLU 67 -1.183 16.406 3.102 423 HG2 GLU 67 HG2 GLU 67 -2.684 18.195 2.542 424 HG3 GLU 67 HG1 GLU 67 -3.519 17.014 3.552 425 H GLU 68 HN GLU 68 -3.813 16.488 6.017 426 HA GLU 68 HA GLU 68 -4.296 13.638 5.975 427 HB2 GLU 68 HB2 GLU 68 -5.246 14.990 7.769 428 HB3 GLU 68 HB1 GLU 68 -6.103 15.984 6.601 429 HG2 GLU 68 HG2 GLU 68 -7.400 14.000 5.918 430 HG3 GLU 68 HG1 GLU 68 -6.589 13.071 7.178 431 H CYS 69 HN CYS 69 -5.027 12.554 4.250 432 HA CYS 69 HA CYS 69 -6.528 14.042 2.197 433 HG CYS 69 HG CYS 69 -2.586 13.338 0.997 434 HB2 CYS 69 HB2 CYS 69 -4.534 11.811 1.756 435 HB3 CYS 69 HB1 CYS 69 -5.510 12.562 0.497 436 H GLU 70 HN GLU 70 -8.139 12.882 1.049 437 HA GLU 70 HA GLU 70 -9.276 10.682 2.611 438 HB2 GLU 70 HB2 GLU 70 -10.678 12.681 2.141 439 HB3 GLU 70 HB1 GLU 70 -10.549 12.332 0.425 440 HG2 GLU 70 HG2 GLU 70 -11.628 10.134 0.851 441 HG3 GLU 70 HG1 GLU 70 -11.878 10.637 2.523 442 H LEU 71 HN LEU 71 -9.030 8.666 1.922 443 HA LEU 71 HA LEU 71 -8.673 8.200 -0.965 444 HG LEU 71 HG LEU 71 -7.858 5.146 -0.523 445 HB2 LEU 71 HB2 LEU 71 -6.604 7.783 0.257 446 HB3 LEU 71 HB1 LEU 71 -7.442 6.690 1.341 447 H GLU 72 HN GLU 72 -9.681 6.430 -1.887 448 HA GLU 72 HA GLU 72 -12.054 5.540 -0.486 449 HB2 GLU 72 HB2 GLU 72 -11.835 6.260 -2.983 450 HB3 GLU 72 HB1 GLU 72 -11.266 4.613 -3.225 451 HG2 GLU 72 HG2 GLU 72 -13.360 3.789 -2.194 452 HG3 GLU 72 HG1 GLU 72 -13.926 5.458 -2.113 453 H THR 73 HN THR 73 -12.208 3.692 0.594 454 HA THR 73 HA THR 73 -10.036 1.784 0.513 455 HB THR 73 HB THR 73 -11.326 0.593 2.283 456 HG1 THR 73 HG1 THR 73 -13.426 1.288 1.654 457 H MET 74 HN MET 74 -10.563 -0.589 0.436 458 HA MET 74 HA MET 74 -11.863 -1.182 -2.019 459 HB2 MET 74 HB2 MET 74 -11.403 -3.561 -1.402 460 HB3 MET 74 HB1 MET 74 -9.987 -2.521 -1.362 461 HG2 MET 74 HG2 MET 74 -9.755 -3.780 0.553 462 HG3 MET 74 HG1 MET 74 -10.495 -2.297 1.152 463 HE1 MET 74 HE1 MET 74 -12.137 -5.311 -0.806 464 HE2 MET 74 HE2 MET 74 -12.739 -6.284 0.537 465 HE3 MET 74 HE3 MET 74 -11.004 -6.081 0.303 466 H THR 75 HN THR 75 -13.036 -0.745 1.109 467 HA THR 75 HA THR 75 -15.247 -2.595 0.930 468 HB THR 75 HB THR 75 -16.031 -1.589 3.014 469 HG1 THR 75 HG1 THR 75 -15.552 0.470 3.208 470 H GLY 76 HN GLY 76 -14.625 0.770 0.239 471 HA2 GLY 76 HA2 GLY 76 -16.002 1.828 -1.468 472 HA3 GLY 76 HA1 GLY 76 -17.391 1.011 -0.766 473 H GLU 77 HN GLU 77 -15.331 2.107 1.639 474 HA GLU 77 HA GLU 77 -17.042 4.449 2.088 475 HB2 GLU 77 HB2 GLU 77 -17.162 2.717 3.818 476 HB3 GLU 77 HB1 GLU 77 -15.433 2.868 4.065 477 HG2 GLU 77 HG2 GLU 77 -15.669 5.094 4.896 478 HG3 GLU 77 HG1 GLU 77 -17.381 5.114 4.474 479 H LYS 78 HN LYS 78 -16.169 6.439 2.555 480 HA LYS 78 HA LYS 78 -13.440 6.836 1.669 481 HB2 LYS 78 HB2 LYS 78 -15.458 8.883 2.607 482 HB3 LYS 78 HB1 LYS 78 -13.961 9.209 1.746 483 HG2 LYS 78 HG2 LYS 78 -16.322 7.693 0.653 484 HG3 LYS 78 HG1 LYS 78 -15.897 9.364 0.276 485 HD2 LYS 78 HD2 LYS 78 -13.771 8.600 -0.678 486 HD3 LYS 78 HD1 LYS 78 -14.209 6.931 -0.308 487 HE2 LYS 78 HE2 LYS 78 -14.649 7.426 -2.645 488 HE3 LYS 78 HE1 LYS 78 -16.156 7.123 -1.783 489 HZ1 LYS 78 HZ1 LYS 78 -16.356 9.026 -3.248 490 HZ2 LYS 78 HZ2 LYS 78 -15.066 9.797 -2.474 491 HZ3 LYS 78 HZ3 LYS 78 -16.506 9.512 -1.635 492 H VAL 79 HN VAL 79 -11.734 7.017 2.963 493 HA VAL 79 HA VAL 79 -12.180 7.751 5.782 494 HB VAL 79 HB VAL 79 -10.338 6.253 6.427 495 H LYS 80 HN LYS 80 -10.623 9.030 6.765 496 HA LYS 80 HA LYS 80 -8.780 10.360 4.902 497 HB2 LYS 80 HB2 LYS 80 -9.869 11.310 7.559 498 HB3 LYS 80 HB1 LYS 80 -8.788 12.225 6.517 499 HG2 LYS 80 HG2 LYS 80 -10.476 12.333 4.795 500 HG3 LYS 80 HG1 LYS 80 -11.554 11.314 5.751 501 HD2 LYS 80 HD2 LYS 80 -11.635 13.029 7.491 502 HD3 LYS 80 HD1 LYS 80 -10.541 14.044 6.549 503 HE2 LYS 80 HE2 LYS 80 -12.880 14.736 6.297 504 HE3 LYS 80 HE1 LYS 80 -12.183 14.202 4.769 505 HZ1 LYS 80 HZ1 LYS 80 -13.281 12.073 5.044 506 HZ2 LYS 80 HZ2 LYS 80 -14.415 13.326 5.095 507 HZ3 LYS 80 HZ3 LYS 80 -13.932 12.566 6.526 508 H ALA 81 HN ALA 81 -6.621 10.391 5.254 509 HA ALA 81 HA ALA 81 -5.565 9.503 7.824 510 HB1 ALA 81 HB1 ALA 81 -5.826 7.442 6.549 511 HB2 ALA 81 HB2 ALA 81 -4.123 7.817 6.806 512 HB3 ALA 81 HB3 ALA 81 -4.867 8.124 5.237 513 H VAL 82 HN VAL 82 -3.561 10.287 8.306 514 HA VAL 82 HA VAL 82 -2.483 12.286 6.464 515 HB VAL 82 HB VAL 82 -1.725 11.807 9.349 516 H VAL 83 HN VAL 83 -0.757 11.835 5.272 517 HA VAL 83 HA VAL 83 0.948 9.571 6.050 518 HB VAL 83 HB VAL 83 -0.023 9.216 3.892 519 H LYS 84 HN LYS 84 2.880 10.013 6.849 520 HA LYS 84 HA LYS 84 4.313 12.399 5.911 521 HB2 LYS 84 HB2 LYS 84 4.248 11.528 8.799 522 HB3 LYS 84 HB1 LYS 84 5.011 12.966 8.141 523 HG2 LYS 84 HG2 LYS 84 2.798 13.840 7.524 524 HG3 LYS 84 HG1 LYS 84 2.053 12.414 8.244 525 HD2 LYS 84 HD2 LYS 84 3.821 14.343 9.742 526 HD3 LYS 84 HD1 LYS 84 2.059 14.425 9.722 527 HE2 LYS 84 HE2 LYS 84 3.671 12.058 10.669 528 HE3 LYS 84 HE1 LYS 84 2.964 13.282 11.722 529 HZ1 LYS 84 HZ1 LYS 84 0.776 12.659 10.925 530 HZ2 LYS 84 HZ2 LYS 84 1.569 11.314 11.574 531 HZ3 LYS 84 HZ3 LYS 84 1.448 11.497 9.896 532 H MET 85 HN MET 85 6.597 12.269 6.035 533 HA MET 85 HA MET 85 7.579 9.507 6.097 534 HB2 MET 85 HB2 MET 85 9.414 10.232 4.728 535 HB3 MET 85 HB1 MET 85 7.930 10.850 4.019 536 HG2 MET 85 HG2 MET 85 9.741 12.471 5.790 537 HG3 MET 85 HG1 MET 85 9.842 12.447 4.032 538 HE1 MET 85 HE1 MET 85 9.549 15.128 3.942 539 HE2 MET 85 HE2 MET 85 9.548 15.085 5.705 540 HE3 MET 85 HE3 MET 85 8.287 15.968 4.843 541 H GLU 86 HN GLU 86 9.273 8.875 7.383 542 HA GLU 86 HA GLU 86 9.852 10.629 9.624 543 HB2 GLU 86 HB2 GLU 86 9.210 8.304 10.078 544 HB3 GLU 86 HB1 GLU 86 10.596 7.739 9.158 545 HG2 GLU 86 HG2 GLU 86 10.975 7.623 11.568 546 HG3 GLU 86 HG1 GLU 86 12.110 8.708 10.769 547 H GLY 87 HN GLY 87 11.313 9.557 6.737 548 HA2 GLY 87 HA2 GLY 87 13.247 11.137 6.206 549 HA3 GLY 87 HA1 GLY 87 13.952 10.483 7.674 550 H ASP 88 HN ASP 88 15.120 8.654 7.559 551 HA ASP 88 HA ASP 88 15.496 7.502 4.909 552 HB2 ASP 88 HB2 ASP 88 17.160 7.279 7.423 553 HB3 ASP 88 HB1 ASP 88 17.560 6.523 5.884 554 H ASN 89 HN ASN 89 14.785 5.603 4.382 555 HA ASN 89 HA ASN 89 13.704 3.617 4.441 556 HB2 ASN 89 HB2 ASN 89 14.728 1.892 5.749 557 HB3 ASN 89 HB1 ASN 89 15.990 2.985 5.195 558 H LYS 90 HN LYS 90 12.758 5.861 6.424 559 HA LYS 90 HA LYS 90 10.786 4.110 7.697 560 HB2 LYS 90 HB2 LYS 90 12.480 6.177 9.077 561 HB3 LYS 90 HB1 LYS 90 10.936 5.654 9.736 562 HG2 LYS 90 HG2 LYS 90 11.682 3.543 10.196 563 HG3 LYS 90 HG1 LYS 90 12.982 3.620 9.005 564 HD2 LYS 90 HD2 LYS 90 14.216 5.158 10.411 565 HD3 LYS 90 HD1 LYS 90 12.886 5.209 11.570 566 HE2 LYS 90 HE2 LYS 90 14.319 2.668 10.834 567 HE3 LYS 90 HE1 LYS 90 14.839 3.708 12.163 568 HZ1 LYS 90 HZ1 LYS 90 12.172 2.419 11.911 569 HZ2 LYS 90 HZ2 LYS 90 12.667 3.412 13.187 570 HZ3 LYS 90 HZ3 LYS 90 13.416 1.916 12.941 571 H MET 91 HN MET 91 8.789 4.744 7.447 572 HA MET 91 HA MET 91 8.134 7.572 7.133 573 HB2 MET 91 HB2 MET 91 7.416 5.397 5.165 574 HB3 MET 91 HB1 MET 91 6.547 6.922 5.252 575 HG2 MET 91 HG2 MET 91 8.681 8.105 4.822 576 HG3 MET 91 HG1 MET 91 9.458 6.537 4.605 577 HE1 MET 91 HE1 MET 91 9.224 8.047 0.963 578 HE2 MET 91 HE2 MET 91 10.311 7.470 2.228 579 HE3 MET 91 HE3 MET 91 9.422 8.978 2.448 580 H VAL 92 HN VAL 92 6.280 8.112 8.199 581 HA VAL 92 HA VAL 92 4.766 5.867 9.359 582 HB VAL 92 HB VAL 92 4.078 7.572 11.119 583 H THR 93 HN THR 93 2.827 5.566 8.619 584 HA THR 93 HA THR 93 1.130 7.870 7.955 585 HB THR 93 HB THR 93 1.781 7.074 5.800 586 HG1 THR 93 HG1 THR 93 -0.272 6.186 5.058 587 H THR 94 HN THR 94 -0.802 7.775 8.978 588 HA THR 94 HA THR 94 -1.631 5.149 10.039 589 HB THR 94 HB THR 94 -2.121 7.827 11.351 590 HG1 THR 94 HG1 THR 94 -0.015 7.428 11.743 591 H PHE 95 HN PHE 95 -3.570 4.440 9.502 592 HA PHE 95 HA PHE 95 -5.657 6.345 8.734 593 HD1 PHE 95 HD1 PHE 95 -2.900 3.635 7.137 594 HD2 PHE 95 HD2 PHE 95 -7.077 2.949 6.706 595 HE1 PHE 95 HE1 PHE 95 -2.463 1.245 6.756 596 HE2 PHE 95 HE2 PHE 95 -6.646 0.555 6.325 597 HZ PHE 95 HZ PHE 95 -4.365 -0.304 6.350 598 HB2 PHE 95 HB2 PHE 95 -6.235 5.156 6.737 599 HB3 PHE 95 HB1 PHE 95 -4.506 5.477 6.668 600 H LYS 96 HN LYS 96 -7.533 5.904 9.712 601 HA LYS 96 HA LYS 96 -9.047 4.878 11.077 602 HB2 LYS 96 HB2 LYS 96 -8.237 2.534 9.348 603 HB3 LYS 96 HB1 LYS 96 -9.606 2.514 10.446 604 HG2 LYS 96 HG2 LYS 96 -9.281 4.415 8.133 605 HG3 LYS 96 HG1 LYS 96 -10.243 2.937 8.106 606 HD2 LYS 96 HD2 LYS 96 -10.686 5.263 9.977 607 HD3 LYS 96 HD1 LYS 96 -11.606 4.958 8.503 608 HE2 LYS 96 HE2 LYS 96 -11.410 3.039 10.821 609 HE3 LYS 96 HE1 LYS 96 -12.735 4.180 10.581 610 HZ1 LYS 96 HZ1 LYS 96 -13.293 1.980 9.752 611 HZ2 LYS 96 HZ2 LYS 96 -11.965 2.007 8.707 612 HZ3 LYS 96 HZ3 LYS 96 -13.240 3.095 8.482 613 H GLY 97 HN GLY 97 -9.024 2.105 11.965 614 HA2 GLY 97 HA2 GLY 97 -7.188 2.431 14.181 615 HA3 GLY 97 HA1 GLY 97 -8.378 1.153 13.988 616 H ILE 98 HN ILE 98 -6.079 1.902 11.472 617 HA ILE 98 HA ILE 98 -4.629 -0.586 12.108 618 HB ILE 98 HB ILE 98 -5.219 0.502 9.351 619 H LYS 99 HN LYS 99 -2.429 -0.532 12.053 620 HA LYS 99 HA LYS 99 -1.196 2.098 11.688 621 HB2 LYS 99 HB2 LYS 99 -0.870 0.526 13.756 622 HB3 LYS 99 HB1 LYS 99 0.266 -0.314 12.704 623 HG2 LYS 99 HG2 LYS 99 1.485 1.237 14.041 624 HG3 LYS 99 HG1 LYS 99 1.468 1.834 12.381 625 HD2 LYS 99 HD2 LYS 99 -0.402 3.337 12.981 626 HD3 LYS 99 HD1 LYS 99 -0.280 2.782 14.650 627 HE2 LYS 99 HE2 LYS 99 2.014 3.620 14.763 628 HE3 LYS 99 HE1 LYS 99 1.898 4.168 13.090 629 HZ1 LYS 99 HZ1 LYS 99 0.085 5.649 13.768 630 HZ2 LYS 99 HZ2 LYS 99 1.520 5.996 14.592 631 HZ3 LYS 99 HZ3 LYS 99 0.278 5.158 15.375 632 H SER 100 HN SER 100 0.019 2.566 9.972 633 HA SER 100 HA SER 100 1.009 0.331 8.329 634 HG SER 100 HG SER 100 1.551 1.105 6.189 635 HB2 SER 100 HB2 SER 100 -0.815 1.462 7.175 636 HB3 SER 100 HB1 SER 100 -0.013 3.018 7.385 637 H VAL 101 HN VAL 101 3.140 0.226 8.227 638 HA VAL 101 HA VAL 101 4.695 2.724 8.351 639 HB VAL 101 HB VAL 101 5.405 0.109 9.694 640 H THR 102 HN THR 102 5.896 2.996 6.600 641 HA THR 102 HA THR 102 6.635 0.620 5.025 642 HB THR 102 HB THR 102 6.192 3.446 4.045 643 HG1 THR 102 HG1 THR 102 4.221 2.800 3.579 644 H GLU 103 HN GLU 103 8.711 0.219 4.658 645 HA GLU 103 HA GLU 103 10.699 2.142 5.611 646 HB2 GLU 103 HB2 GLU 103 11.074 -0.007 6.530 647 HB3 GLU 103 HB1 GLU 103 10.784 -0.808 4.993 648 HG2 GLU 103 HG2 GLU 103 13.086 1.063 5.231 649 HG3 GLU 103 HG1 GLU 103 13.202 -0.541 5.953 650 H PHE 104 HN PHE 104 11.905 3.312 4.228 651 HA PHE 104 HA PHE 104 11.663 2.627 1.370 652 HD1 PHE 104 HD1 PHE 104 9.060 4.427 1.669 653 HD2 PHE 104 HD2 PHE 104 12.528 5.420 -0.586 654 HE1 PHE 104 HE1 PHE 104 7.662 4.762 -0.328 655 HE2 PHE 104 HE2 PHE 104 11.137 5.758 -2.586 656 HZ PHE 104 HZ PHE 104 8.702 5.438 -2.460 657 HB2 PHE 104 HB2 PHE 104 11.178 5.034 2.751 658 HB3 PHE 104 HB1 PHE 104 12.627 5.298 1.788 659 H ASN 105 HN ASN 105 13.383 1.754 0.487 660 HA ASN 105 HA ASN 105 16.041 2.752 1.264 661 HB2 ASN 105 HB2 ASN 105 15.120 -0.067 0.769 662 HB3 ASN 105 HB1 ASN 105 16.809 0.379 0.544 663 H GLY 106 HN GLY 106 17.631 2.762 -0.427 664 HA2 GLY 106 HA2 GLY 106 16.533 3.563 -2.943 665 HA3 GLY 106 HA1 GLY 106 18.240 3.450 -2.542 666 H ASP 107 HN ASP 107 16.034 0.729 -2.223 667 HA ASP 107 HA ASP 107 16.555 -0.395 -4.776 668 HB2 ASP 107 HB2 ASP 107 17.984 -2.279 -4.033 669 HB3 ASP 107 HB1 ASP 107 18.792 -0.720 -3.900 670 H THR 108 HN THR 108 15.265 -0.560 -1.583 671 HA THR 108 HA THR 108 13.410 -2.638 -2.489 672 HB THR 108 HB THR 108 15.122 -3.817 -1.202 673 HG1 THR 108 HG1 THR 108 12.928 -3.760 0.543 674 H ILE 109 HN ILE 109 11.366 -2.551 -1.636 675 HA ILE 109 HA ILE 109 10.792 -0.420 0.312 676 HB ILE 109 HB ILE 109 9.295 -0.951 -2.258 677 H THR 110 HN THR 110 9.781 -1.224 2.026 678 HA THR 110 HA THR 110 8.130 -3.644 1.685 679 HB THR 110 HB THR 110 9.612 -2.775 4.175 680 HG1 THR 110 HG1 THR 110 10.786 -4.817 3.600 681 H ASN 111 HN ASN 111 6.076 -3.658 2.453 682 HA ASN 111 HA ASN 111 5.125 -1.196 3.775 683 HB2 ASN 111 HB2 ASN 111 4.145 -1.511 1.553 684 HB3 ASN 111 HB1 ASN 111 3.601 -3.124 2.005 685 H THR 112 HN THR 112 4.161 -1.370 5.746 686 HA THR 112 HA THR 112 3.604 -4.103 6.714 687 HB THR 112 HB THR 112 4.404 -1.833 8.524 688 HG1 THR 112 HG1 THR 112 6.481 -3.278 8.386 689 H MET 113 HN MET 113 1.519 -4.445 7.009 690 HA MET 113 HA MET 113 -0.115 -2.292 8.180 691 HB2 MET 113 HB2 MET 113 -0.936 -4.299 6.071 692 HB3 MET 113 HB1 MET 113 -2.061 -3.251 6.926 693 HG2 MET 113 HG2 MET 113 -0.690 -1.309 6.048 694 HG3 MET 113 HG1 MET 113 0.097 -2.478 4.988 695 HE1 MET 113 HE1 MET 113 -2.974 -3.795 2.902 696 HE2 MET 113 HE2 MET 113 -2.356 -4.464 4.412 697 HE3 MET 113 HE3 MET 113 -1.234 -3.928 3.160 698 H THR 114 HN THR 114 -0.876 -2.830 10.134 699 HA THR 114 HA THR 114 -1.218 -5.699 10.729 700 HB THR 114 HB THR 114 -0.372 -3.570 12.701 701 HG1 THR 114 HG1 THR 114 1.671 -4.541 12.541 702 H LEU 115 HN LEU 115 -3.193 -6.301 11.272 703 HA LEU 115 HA LEU 115 -4.968 -4.375 12.604 704 HG LEU 115 HG LEU 115 -7.567 -6.158 11.746 705 HB2 LEU 115 HB2 LEU 115 -5.640 -4.338 10.293 706 HB3 LEU 115 HB1 LEU 115 -5.649 -6.089 10.216 707 H GLY 116 HN GLY 116 -5.503 -5.212 14.509 708 HA2 GLY 116 HA2 GLY 116 -6.414 -6.725 16.010 709 HA3 GLY 116 HA1 GLY 116 -6.559 -7.887 14.700 710 H ASP 117 HN ASP 117 -4.493 -8.902 13.970 711 HA ASP 117 HA ASP 117 -2.241 -8.903 15.734 712 HB2 ASP 117 HB2 ASP 117 -3.923 -10.257 17.019 713 HB3 ASP 117 HB1 ASP 117 -3.934 -11.414 15.692 714 H ILE 118 HN ILE 118 -3.270 -8.895 12.829 715 HA ILE 118 HA ILE 118 -1.588 -11.051 11.757 716 HB ILE 118 HB ILE 118 -3.362 -9.346 10.054 717 H VAL 119 HN VAL 119 0.183 -10.622 10.523 718 HA VAL 119 HA VAL 119 0.915 -7.788 10.227 719 HB VAL 119 HB VAL 119 2.839 -10.098 10.128 720 H TYR 120 HN TYR 120 0.771 -6.988 8.289 721 HA TYR 120 HA TYR 120 0.927 -8.754 5.951 722 HD1 TYR 120 HD2 TYR 120 1.113 -5.514 3.934 723 HD2 TYR 120 HD1 TYR 120 -1.993 -8.382 4.412 724 HE1 TYR 120 HE2 TYR 120 0.785 -5.558 1.497 725 HE2 TYR 120 HE1 TYR 120 -2.324 -8.437 1.977 726 HH TYR 120 HH TYR 120 -1.912 -7.036 0.030 727 HB2 TYR 120 HB2 TYR 120 -1.093 -7.309 6.304 728 HB3 TYR 120 HB1 TYR 120 -0.059 -5.897 6.142 729 H LYS 121 HN LYS 121 2.787 -8.791 4.854 730 HA LYS 121 HA LYS 121 4.447 -6.361 4.819 731 HB2 LYS 121 HB2 LYS 121 5.350 -9.219 5.148 732 HB3 LYS 121 HB1 LYS 121 6.440 -7.892 4.773 733 HG2 LYS 121 HG2 LYS 121 5.826 -6.795 6.869 734 HG3 LYS 121 HG1 LYS 121 4.737 -8.134 7.245 735 HD2 LYS 121 HD2 LYS 121 7.688 -8.477 6.747 736 HD3 LYS 121 HD1 LYS 121 6.994 -8.238 8.351 737 HE2 LYS 121 HE2 LYS 121 5.697 -10.259 8.143 738 HE3 LYS 121 HE1 LYS 121 6.222 -10.465 6.472 739 HZ1 LYS 121 HZ1 LYS 121 8.473 -10.795 7.232 740 HZ2 LYS 121 HZ2 LYS 121 7.447 -11.890 8.015 741 HZ3 LYS 121 HZ3 LYS 121 8.015 -10.526 8.838 742 H ARG 122 HN ARG 122 4.861 -5.628 2.849 743 HA ARG 122 HA ARG 122 4.534 -7.457 0.568 744 HE ARG 122 HE ARG 122 2.024 -5.087 -1.464 745 HB2 ARG 122 HB2 ARG 122 3.064 -5.683 0.212 746 HB3 ARG 122 HB1 ARG 122 4.165 -4.496 0.897 747 HG2 ARG 122 HG2 ARG 122 5.591 -4.695 -1.084 748 HG3 ARG 122 HG1 ARG 122 4.469 -5.874 -1.764 749 HD2 ARG 122 HD2 ARG 122 3.761 -3.036 -1.029 750 HD3 ARG 122 HD1 ARG 122 4.147 -3.588 -2.659 751 HH11 ARG 122 HH11 ARG 122 2.791 -2.144 -3.167 752 HH12 ARG 122 HH12 ARG 122 1.192 -1.944 -3.802 753 HH21 ARG 122 HH21 ARG 122 -0.081 -4.831 -2.294 754 HH22 ARG 122 HH22 ARG 122 -0.442 -3.469 -3.302 755 H VAL 123 HN VAL 123 6.269 -8.071 -0.525 756 HA VAL 123 HA VAL 123 8.804 -6.661 -0.058 757 HB VAL 123 HB VAL 123 8.388 -9.414 -1.235 758 H SER 124 HN SER 124 9.535 -5.366 -1.615 759 HA SER 124 HA SER 124 8.936 -6.044 -4.409 760 HG SER 124 HG SER 124 6.939 -4.762 -2.851 761 HB2 SER 124 HB2 SER 124 8.742 -3.277 -3.198 762 HB3 SER 124 HB1 SER 124 8.552 -3.661 -4.908 763 H LYS 125 HN LYS 125 10.559 -5.716 -5.852 764 HA LYS 125 HA LYS 125 13.119 -4.790 -4.738 765 HB2 LYS 125 HB2 LYS 125 14.177 -6.089 -6.548 766 HB3 LYS 125 HB1 LYS 125 13.161 -7.088 -5.524 767 HG2 LYS 125 HG2 LYS 125 11.682 -7.531 -7.150 768 HG3 LYS 125 HG1 LYS 125 11.900 -5.966 -7.925 769 HD2 LYS 125 HD2 LYS 125 12.765 -7.700 -9.367 770 HD3 LYS 125 HD1 LYS 125 14.102 -6.725 -8.757 771 HE2 LYS 125 HE2 LYS 125 14.560 -8.430 -7.056 772 HE3 LYS 125 HE1 LYS 125 13.230 -9.404 -7.678 773 HZ1 LYS 125 HZ1 LYS 125 14.395 -9.575 -9.791 774 HZ2 LYS 125 HZ2 LYS 125 15.348 -10.171 -8.528 775 HZ3 LYS 125 HZ3 LYS 125 15.674 -8.647 -9.185 776 H ARG 126 HN ARG 126 14.310 -3.222 -5.757 777 HA ARG 126 HA ARG 126 12.858 -1.470 -7.523 778 HE ARG 126 HE ARG 126 15.124 2.391 -9.059 779 HB2 ARG 126 HB2 ARG 126 14.357 -0.685 -5.661 780 HB3 ARG 126 HB1 ARG 126 15.729 -1.239 -6.609 781 HG2 ARG 126 HG2 ARG 126 13.809 0.651 -7.868 782 HG3 ARG 126 HG1 ARG 126 14.942 1.266 -6.663 783 HD2 ARG 126 HD2 ARG 126 16.808 0.345 -7.957 784 HD3 ARG 126 HD1 ARG 126 15.671 -0.257 -9.164 785 HH11 ARG 126 HH11 ARG 126 18.061 0.565 -9.508 786 HH12 ARG 126 HH12 ARG 126 18.820 1.783 -10.479 787 HH21 ARG 126 HH21 ARG 126 16.115 3.995 -10.335 788 HH22 ARG 126 HH22 ARG 126 17.713 3.733 -10.950 789 H ILE 127 HN ILE 127 12.889 -1.544 -9.662 790 HA ILE 127 HA ILE 127 15.275 -2.547 -11.036 791 HB ILE 127 HB ILE 127 13.865 -3.824 -12.623 792 H9 OLA 128 HH1 OLA 128 -4.778 -7.565 -4.024 793 H10 OLA 128 HI1 OLA 128 -4.312 -6.220 -2.024 794 H21 OLA 128 HA1 OLA 128 -8.583 -8.118 -10.845 795 H22 OLA 128 HA2 OLA 128 -8.238 -9.291 -9.576 796 H31 OLA 128 HB1 OLA 128 -10.106 -7.048 -8.984 797 H32 OLA 128 HB2 OLA 128 -9.012 -7.919 -7.907 798 H41 OLA 128 HC1 OLA 128 -8.522 -5.437 -8.761 799 H42 OLA 128 HC2 OLA 128 -7.788 -6.332 -10.093 800 H51 OLA 128 HD1 OLA 128 -6.632 -7.693 -8.212 801 H52 OLA 128 HD2 OLA 128 -6.019 -6.088 -8.617 802 H61 OLA 128 HE1 OLA 128 -8.118 -5.976 -6.620 803 H62 OLA 128 HE2 OLA 128 -6.492 -5.293 -6.587 804 H71 OLA 128 HF1 OLA 128 -7.255 -8.133 -5.912 805 H72 OLA 128 HF2 OLA 128 -5.604 -7.506 -5.952 806 H81 OLA 128 HG1 OLA 128 -7.112 -5.742 -4.349 807 H82 OLA 128 HG2 OLA 128 -7.525 -7.380 -3.836 808 H111 OLA 128 HJ1 OLA 128 -6.559 -4.527 -2.789 809 H112 OLA 128 HJ2 OLA 128 -7.099 -5.759 -1.645 810 H121 OLA 128 HK1 OLA 128 -5.402 -5.075 -0.057 811 H122 OLA 128 HK2 OLA 128 -4.755 -3.908 -1.213 812 H131 OLA 128 HL1 OLA 128 -7.292 -3.816 0.359 813 H132 OLA 128 HL2 OLA 128 -7.197 -2.974 -1.189 814 H141 OLA 128 HM1 OLA 128 -4.958 -2.041 -0.180 815 H142 OLA 128 HM2 OLA 128 -5.731 -2.451 1.355 816 H151 OLA 128 HN1 OLA 128 -6.646 -0.406 1.198 817 H152 OLA 128 HN2 OLA 128 -7.751 -1.169 0.053 818 H161 OLA 128 HP1 OLA 128 -5.255 -0.347 -1.189 819 H162 OLA 128 HP2 OLA 128 -6.120 1.003 -0.450 820 H171 OLA 128 HQ1 OLA 128 -8.162 -0.253 -1.702 821 H172 OLA 128 HQ2 OLA 128 -6.823 -0.636 -2.797 822 H181 OLA 128 HR1 OLA 128 -6.485 2.052 -2.147 823 H182 OLA 128 HR2 OLA 128 -7.080 1.395 -3.672 824 H183 OLA 128 HR3 OLA 128 -8.220 1.858 -2.408 825 H9 OLA 129 HH1 OLA 129 -1.312 6.597 0.176 826 H10 OLA 129 HI1 OLA 129 -3.608 6.409 1.021 827 H21 OLA 129 HA1 OLA 129 3.784 0.679 0.613 828 H22 OLA 129 HA2 OLA 129 5.230 1.071 -0.316 829 H31 OLA 129 HB1 OLA 129 4.915 3.105 0.612 830 H32 OLA 129 HB2 OLA 129 3.813 3.301 -0.753 831 H41 OLA 129 HC1 OLA 129 3.079 2.470 2.053 832 H42 OLA 129 HC2 OLA 129 1.954 2.529 0.694 833 H51 OLA 129 HD1 OLA 129 2.896 4.664 2.396 834 H52 OLA 129 HD2 OLA 129 3.209 5.017 0.696 835 H61 OLA 129 HE1 OLA 129 0.552 4.266 1.907 836 H62 OLA 129 HE2 OLA 129 0.845 4.533 0.187 837 H71 OLA 129 HF1 OLA 129 1.751 6.709 1.933 838 H72 OLA 129 HF2 OLA 129 0.861 6.771 0.411 839 H81 OLA 129 HG1 OLA 129 -0.484 5.823 2.910 840 H82 OLA 129 HG2 OLA 129 -0.302 7.550 2.598 841 H111 OLA 129 HJ1 OLA 129 -2.365 6.993 3.666 842 H112 OLA 129 HJ2 OLA 129 -4.066 6.672 3.325 843 H121 OLA 129 HK1 OLA 129 -1.951 4.530 3.248 844 H122 OLA 129 HK2 OLA 129 -2.864 4.926 4.705 845 H131 OLA 129 HL1 OLA 129 -4.592 4.554 2.405 846 H132 OLA 129 HL2 OLA 129 -4.656 3.800 3.999 847 H141 OLA 129 HM1 OLA 129 -4.077 1.908 2.958 848 H142 OLA 129 HM2 OLA 129 -2.462 2.611 2.835 849 H151 OLA 129 HN1 OLA 129 -3.492 3.738 0.684 850 H152 OLA 129 HN2 OLA 129 -4.596 2.363 0.769 851 H161 OLA 129 HP1 OLA 129 -2.842 0.805 0.542 852 H162 OLA 129 HP2 OLA 129 -1.611 2.026 0.875 853 H171 OLA 129 HQ1 OLA 129 -2.288 1.189 -1.618 854 H172 OLA 129 HQ2 OLA 129 -3.333 2.605 -1.442 855 H181 OLA 129 HR1 OLA 129 -0.345 2.532 -1.049 856 H182 OLA 129 HR2 OLA 129 -1.372 3.943 -0.800 857 H183 OLA 129 HR3 OLA 129 -1.204 3.247 -2.413 Start of MODEL 7 1 HA MET 1 HA MET 1 12.952 14.432 -1.207 2 H1 MET 1 HT1 MET 1 15.212 13.805 0.600 3 H2 MET 1 HT2 MET 1 13.592 13.961 1.058 4 H3 MET 1 HT3 MET 1 14.436 15.303 0.469 5 HB2 MET 1 HB2 MET 1 15.078 15.475 -1.889 6 HB3 MET 1 HB1 MET 1 15.871 13.908 -1.807 7 HG2 MET 1 HG2 MET 1 14.346 13.090 -3.574 8 HG3 MET 1 HG1 MET 1 13.677 14.717 -3.700 9 HE1 MET 1 HE1 MET 1 16.790 16.763 -4.931 10 HE2 MET 1 HE2 MET 1 16.277 16.504 -3.264 11 HE3 MET 1 HE3 MET 1 15.077 16.831 -4.514 12 H ASN 2 HN ASN 2 11.792 12.711 -1.745 13 HA ASN 2 HA ASN 2 12.552 10.084 -0.903 14 HB2 ASN 2 HB2 ASN 2 10.167 11.076 -1.116 15 HB3 ASN 2 HB1 ASN 2 10.307 10.661 -2.821 16 H PHE 3 HN PHE 3 13.572 8.545 -2.005 17 HA PHE 3 HA PHE 3 14.886 9.100 -4.428 18 HD1 PHE 3 HD1 PHE 3 17.588 8.061 -3.813 19 HD2 PHE 3 HD2 PHE 3 14.702 7.056 -0.851 20 HE1 PHE 3 HE1 PHE 3 19.206 8.630 -2.050 21 HE2 PHE 3 HE2 PHE 3 16.315 7.624 0.918 22 HZ PHE 3 HZ PHE 3 18.566 8.418 0.322 23 HB2 PHE 3 HB2 PHE 3 14.385 6.414 -3.141 24 HB3 PHE 3 HB1 PHE 3 15.601 6.762 -4.366 25 H SER 4 HN SER 4 11.703 8.056 -3.846 26 HA SER 4 HA SER 4 10.045 7.238 -5.191 27 HG SER 4 HG SER 4 9.542 10.016 -6.436 28 HB2 SER 4 HB2 SER 4 11.657 8.651 -7.333 29 HB3 SER 4 HB1 SER 4 9.950 8.227 -7.427 30 H GLY 5 HN GLY 5 10.376 6.623 -8.055 31 HA2 GLY 5 HA2 GLY 5 11.584 5.043 -9.405 32 HA3 GLY 5 HA1 GLY 5 12.147 4.276 -7.930 33 H LYS 6 HN LYS 6 11.175 2.686 -9.858 34 HA LYS 6 HA LYS 6 8.415 2.047 -9.074 35 HB2 LYS 6 HB2 LYS 6 8.865 2.391 -11.492 36 HB3 LYS 6 HB1 LYS 6 10.000 1.049 -11.451 37 HG2 LYS 6 HG2 LYS 6 7.264 0.501 -10.482 38 HG3 LYS 6 HG1 LYS 6 7.459 0.788 -12.211 39 HD2 LYS 6 HD2 LYS 6 9.132 -1.185 -10.669 40 HD3 LYS 6 HD1 LYS 6 7.622 -1.621 -11.468 41 HE2 LYS 6 HE2 LYS 6 10.047 -0.432 -12.814 42 HE3 LYS 6 HE1 LYS 6 9.576 -2.131 -12.862 43 HZ1 LYS 6 HZ1 LYS 6 8.881 -0.927 -14.851 44 HZ2 LYS 6 HZ2 LYS 6 7.946 0.121 -13.909 45 HZ3 LYS 6 HZ3 LYS 6 7.548 -1.520 -13.994 46 H TYR 7 HN TYR 7 8.027 0.336 -7.837 47 HA TYR 7 HA TYR 7 10.184 -1.636 -7.458 48 HD1 TYR 7 HD2 TYR 7 11.687 -0.632 -5.870 49 HD2 TYR 7 HD1 TYR 7 8.046 1.134 -4.559 50 HE1 TYR 7 HE2 TYR 7 12.930 1.345 -5.108 51 HE2 TYR 7 HE1 TYR 7 9.280 3.120 -3.793 52 HH TYR 7 HH TYR 7 12.530 3.699 -4.633 53 HB2 TYR 7 HB2 TYR 7 7.977 -0.964 -5.507 54 HB3 TYR 7 HB1 TYR 7 9.396 -1.964 -5.211 55 H GLN 8 HN GLN 8 9.620 -3.847 -7.241 56 HA GLN 8 HA GLN 8 6.965 -4.531 -8.322 57 HB2 GLN 8 HB2 GLN 8 8.683 -4.883 -10.014 58 HB3 GLN 8 HB1 GLN 8 9.624 -5.849 -8.886 59 HG2 GLN 8 HG2 GLN 8 8.484 -7.273 -10.460 60 HG3 GLN 8 HG1 GLN 8 7.842 -7.524 -8.839 61 H VAL 9 HN VAL 9 5.786 -5.827 -7.082 62 HA VAL 9 HA VAL 9 6.757 -6.844 -4.612 63 HB VAL 9 HB VAL 9 4.211 -7.604 -6.048 64 H GLN 10 HN GLN 10 7.239 -8.962 -4.015 65 HA GLN 10 HA GLN 10 7.646 -10.820 -6.256 66 HB2 GLN 10 HB2 GLN 10 9.213 -10.422 -3.714 67 HB3 GLN 10 HB1 GLN 10 9.432 -11.809 -4.768 68 HG2 GLN 10 HG2 GLN 10 9.987 -10.259 -6.616 69 HG3 GLN 10 HG1 GLN 10 9.882 -8.920 -5.473 70 H SER 11 HN SER 11 6.692 -10.596 -2.853 71 HA SER 11 HA SER 11 4.796 -12.688 -3.108 72 HG SER 11 HG SER 11 6.106 -14.769 -0.595 73 HB2 SER 11 HB2 SER 11 6.800 -14.101 -3.073 74 HB3 SER 11 HB1 SER 11 7.305 -13.356 -1.557 75 H GLN 12 HN GLN 12 3.873 -13.320 -0.929 76 HA GLN 12 HA GLN 12 4.283 -11.321 1.164 77 HB2 GLN 12 HB2 GLN 12 2.551 -10.237 0.006 78 HB3 GLN 12 HB1 GLN 12 1.723 -11.745 -0.357 79 HG2 GLN 12 HG2 GLN 12 0.430 -10.653 1.279 80 HG3 GLN 12 HG1 GLN 12 1.266 -11.963 2.109 81 H GLU 13 HN GLU 13 4.096 -12.170 3.170 82 HA GLU 13 HA GLU 13 3.280 -14.977 3.377 83 HB2 GLU 13 HB2 GLU 13 4.430 -14.935 5.561 84 HB3 GLU 13 HB1 GLU 13 5.491 -14.461 4.241 85 HG2 GLU 13 HG2 GLU 13 5.261 -12.133 4.840 86 HG3 GLU 13 HG1 GLU 13 4.098 -12.547 6.100 87 H ASN 14 HN ASN 14 1.635 -15.670 4.688 88 HA ASN 14 HA ASN 14 -0.328 -15.588 5.837 89 HB2 ASN 14 HB2 ASN 14 1.086 -13.244 7.118 90 HB3 ASN 14 HB1 ASN 14 -0.481 -13.837 7.664 91 H PHE 15 HN PHE 15 -1.751 -15.168 4.163 92 HA PHE 15 HA PHE 15 -2.534 -12.349 3.857 93 HD1 PHE 15 HD2 PHE 15 -4.803 -12.173 2.046 94 HD2 PHE 15 HD1 PHE 15 -0.909 -12.095 0.332 95 HE1 PHE 15 HE2 PHE 15 -5.410 -10.160 0.768 96 HE2 PHE 15 HE1 PHE 15 -1.510 -10.083 -0.949 97 HZ PHE 15 HZ PHE 15 -3.720 -9.103 -0.737 98 HB2 PHE 15 HB2 PHE 15 -1.408 -13.711 1.885 99 HB3 PHE 15 HB1 PHE 15 -3.043 -14.329 1.686 100 H GLU 16 HN GLU 16 -3.617 -15.717 3.895 101 HA GLU 16 HA GLU 16 -6.338 -15.391 3.515 102 HB2 GLU 16 HB2 GLU 16 -4.880 -17.370 5.268 103 HB3 GLU 16 HB1 GLU 16 -6.591 -17.479 4.878 104 HG2 GLU 16 HG2 GLU 16 -4.338 -17.534 2.882 105 HG3 GLU 16 HG1 GLU 16 -5.218 -18.939 3.479 106 HA PRO 17 HA PRO 17 -6.958 -14.741 8.268 107 HB2 PRO 17 HB2 PRO 17 -4.848 -13.750 9.672 108 HB3 PRO 17 HB1 PRO 17 -5.189 -15.478 9.530 109 HG2 PRO 17 HG2 PRO 17 -3.227 -13.801 8.013 110 HG3 PRO 17 HG1 PRO 17 -3.021 -15.425 8.694 111 HD2 PRO 17 HD2 PRO 17 -3.510 -15.003 6.070 112 HD3 PRO 17 HD1 PRO 17 -4.101 -16.439 6.927 113 H PHE 18 HN PHE 18 -4.548 -12.596 6.785 114 HA PHE 18 HA PHE 18 -5.485 -10.203 7.935 115 HD1 PHE 18 HD1 PHE 18 -3.207 -8.714 8.413 116 HD2 PHE 18 HD2 PHE 18 -4.595 -8.285 4.414 117 HE1 PHE 18 HE1 PHE 18 -2.916 -6.277 8.579 118 HE2 PHE 18 HE2 PHE 18 -4.307 -5.846 4.572 119 HZ PHE 18 HZ PHE 18 -3.468 -4.839 6.657 120 HB2 PHE 18 HB2 PHE 18 -3.248 -10.618 6.786 121 HB3 PHE 18 HB1 PHE 18 -4.106 -10.420 5.260 122 H MET 19 HN MET 19 -6.096 -11.603 4.715 123 HA MET 19 HA MET 19 -7.784 -9.605 3.749 124 HB2 MET 19 HB2 MET 19 -8.624 -11.322 2.184 125 HB3 MET 19 HB1 MET 19 -6.870 -11.269 2.271 126 HG2 MET 19 HG2 MET 19 -7.228 -13.518 2.304 127 HG3 MET 19 HG1 MET 19 -7.209 -13.168 4.029 128 HE1 MET 19 HE1 MET 19 -9.941 -16.039 3.216 129 HE2 MET 19 HE2 MET 19 -8.390 -15.754 4.003 130 HE3 MET 19 HE3 MET 19 -8.512 -15.683 2.246 131 H LYS 20 HN LYS 20 -8.516 -12.440 5.720 132 HA LYS 20 HA LYS 20 -11.327 -12.221 5.571 133 HB2 LYS 20 HB2 LYS 20 -9.386 -13.637 7.315 134 HB3 LYS 20 HB1 LYS 20 -11.023 -13.439 7.934 135 HG2 LYS 20 HG2 LYS 20 -11.852 -14.479 5.814 136 HG3 LYS 20 HG1 LYS 20 -10.171 -14.832 5.407 137 HD2 LYS 20 HD2 LYS 20 -9.954 -16.138 7.472 138 HD3 LYS 20 HD1 LYS 20 -11.643 -15.799 7.858 139 HE2 LYS 20 HE2 LYS 20 -12.317 -16.928 5.774 140 HE3 LYS 20 HE1 LYS 20 -10.628 -17.310 5.451 141 HZ1 LYS 20 HZ1 LYS 20 -10.577 -18.586 7.517 142 HZ2 LYS 20 HZ2 LYS 20 -11.748 -19.184 6.452 143 HZ3 LYS 20 HZ3 LYS 20 -12.214 -18.248 7.781 144 H ALA 21 HN ALA 21 -8.936 -10.895 7.802 145 HA ALA 21 HA ALA 21 -10.817 -9.738 9.589 146 HB1 ALA 21 HB1 ALA 21 -7.928 -9.006 9.124 147 HB2 ALA 21 HB2 ALA 21 -8.516 -10.229 10.251 148 HB3 ALA 21 HB3 ALA 21 -8.910 -8.529 10.510 149 H MET 22 HN MET 22 -9.865 -8.911 6.460 150 HA MET 22 HA MET 22 -10.609 -6.092 6.826 151 HB2 MET 22 HB2 MET 22 -8.468 -6.403 5.734 152 HB3 MET 22 HB1 MET 22 -9.188 -7.486 4.552 153 HG2 MET 22 HG2 MET 22 -8.762 -5.268 3.631 154 HG3 MET 22 HG1 MET 22 -10.478 -5.670 3.619 155 HE1 MET 22 HE1 MET 22 -8.541 -2.809 6.681 156 HE2 MET 22 HE2 MET 22 -7.652 -3.525 5.339 157 HE3 MET 22 HE3 MET 22 -8.250 -4.548 6.645 158 H GLY 23 HN GLY 23 -10.910 -8.282 4.044 159 HA2 GLY 23 HA2 GLY 23 -13.588 -8.797 4.001 160 HA3 GLY 23 HA1 GLY 23 -13.469 -7.165 3.356 161 H LEU 24 HN LEU 24 -10.698 -8.915 2.675 162 HA LEU 24 HA LEU 24 -11.398 -9.076 -0.123 163 HG LEU 24 HG LEU 24 -7.776 -9.140 -0.913 164 HB2 LEU 24 HB2 LEU 24 -9.119 -8.415 1.040 165 HB3 LEU 24 HB1 LEU 24 -8.839 -10.141 0.983 166 HA PRO 25 HA PRO 25 -12.779 -13.327 0.369 167 HB2 PRO 25 HB2 PRO 25 -13.263 -13.787 -2.269 168 HB3 PRO 25 HB1 PRO 25 -14.376 -12.900 -1.222 169 HG2 PRO 25 HG2 PRO 25 -12.326 -11.839 -3.134 170 HG3 PRO 25 HG1 PRO 25 -14.004 -11.316 -2.895 171 HD2 PRO 25 HD2 PRO 25 -11.942 -9.973 -1.831 172 HD3 PRO 25 HD1 PRO 25 -13.488 -10.136 -0.969 173 H GLU 26 HN GLU 26 -11.596 -15.123 0.464 174 HA GLU 26 HA GLU 26 -8.968 -15.351 -0.201 175 HB2 GLU 26 HB2 GLU 26 -9.167 -17.632 0.343 176 HB3 GLU 26 HB1 GLU 26 -10.362 -16.805 1.316 177 HG2 GLU 26 HG2 GLU 26 -11.633 -18.531 0.601 178 HG3 GLU 26 HG1 GLU 26 -11.913 -17.420 -0.740 179 H ASP 27 HN ASP 27 -11.743 -15.983 -2.262 180 HA ASP 27 HA ASP 27 -10.422 -17.484 -4.241 181 HB2 ASP 27 HB2 ASP 27 -12.292 -16.729 -5.738 182 HB3 ASP 27 HB1 ASP 27 -12.813 -17.465 -4.227 183 H LEU 28 HN LEU 28 -10.888 -13.991 -3.879 184 HA LEU 28 HA LEU 28 -9.703 -13.285 -6.346 185 HG LEU 28 HG LEU 28 -9.583 -10.961 -6.762 186 HB2 LEU 28 HB2 LEU 28 -11.230 -11.868 -4.926 187 HB3 LEU 28 HB1 LEU 28 -9.863 -11.586 -3.866 188 H ILE 29 HN ILE 29 -8.426 -13.668 -3.077 189 HA ILE 29 HA ILE 29 -5.884 -12.574 -3.498 190 HB ILE 29 HB ILE 29 -6.769 -14.748 -1.613 191 H GLN 30 HN GLN 30 -7.083 -15.872 -3.992 192 HA GLN 30 HA GLN 30 -4.683 -17.156 -4.501 193 HB2 GLN 30 HB2 GLN 30 -7.364 -17.632 -5.811 194 HB3 GLN 30 HB1 GLN 30 -6.005 -18.745 -5.877 195 HG2 GLN 30 HG2 GLN 30 -7.543 -17.908 -3.433 196 HG3 GLN 30 HG1 GLN 30 -7.561 -19.488 -4.215 197 H LYS 31 HN LYS 31 -6.770 -15.420 -6.804 198 HA LYS 31 HA LYS 31 -5.071 -15.848 -9.040 199 HB2 LYS 31 HB2 LYS 31 -7.313 -13.920 -8.484 200 HB3 LYS 31 HB1 LYS 31 -6.393 -13.843 -9.980 201 HG2 LYS 31 HG2 LYS 31 -8.301 -15.102 -10.482 202 HG3 LYS 31 HG1 LYS 31 -7.001 -16.282 -10.311 203 HD2 LYS 31 HD2 LYS 31 -7.747 -16.822 -8.069 204 HD3 LYS 31 HD1 LYS 31 -8.989 -15.572 -8.153 205 HE2 LYS 31 HE2 LYS 31 -10.017 -16.776 -10.051 206 HE3 LYS 31 HE1 LYS 31 -8.816 -18.051 -9.863 207 HZ1 LYS 31 HZ1 LYS 31 -10.802 -17.240 -7.808 208 HZ2 LYS 31 HZ2 LYS 31 -9.657 -18.474 -7.641 209 HZ3 LYS 31 HZ3 LYS 31 -10.898 -18.622 -8.780 210 H GLY 32 HN GLY 32 -5.227 -13.427 -6.526 211 HA2 GLY 32 HA2 GLY 32 -3.595 -11.474 -7.776 212 HA3 GLY 32 HA1 GLY 32 -3.935 -11.591 -6.058 213 H LYS 33 HN LYS 33 -2.794 -13.857 -5.241 214 HA LYS 33 HA LYS 33 -0.093 -13.248 -5.022 215 HB2 LYS 33 HB2 LYS 33 0.159 -15.546 -4.107 216 HB3 LYS 33 HB1 LYS 33 -1.172 -14.648 -3.391 217 HG2 LYS 33 HG2 LYS 33 -2.733 -15.842 -4.889 218 HG3 LYS 33 HG1 LYS 33 -1.376 -16.797 -5.491 219 HD2 LYS 33 HD2 LYS 33 -2.197 -16.663 -2.591 220 HD3 LYS 33 HD1 LYS 33 -2.726 -17.921 -3.710 221 HE2 LYS 33 HE2 LYS 33 -0.454 -18.647 -4.043 222 HE3 LYS 33 HE1 LYS 33 0.158 -17.301 -3.083 223 HZ1 LYS 33 HZ1 LYS 33 -0.873 -18.219 -1.136 224 HZ2 LYS 33 HZ2 LYS 33 0.090 -19.411 -1.853 225 HZ3 LYS 33 HZ3 LYS 33 -1.590 -19.460 -2.037 226 H ASP 34 HN ASP 34 -1.770 -15.193 -7.393 227 HA ASP 34 HA ASP 34 0.484 -16.518 -8.467 228 HB2 ASP 34 HB2 ASP 34 -1.801 -17.282 -8.902 229 HB3 ASP 34 HB1 ASP 34 -2.146 -15.797 -9.783 230 H ILE 35 HN ILE 35 -0.804 -13.324 -8.872 231 HA ILE 35 HA ILE 35 1.154 -12.795 -11.011 232 HB ILE 35 HB ILE 35 -1.373 -11.269 -10.353 233 H LYS 36 HN LYS 36 2.908 -11.758 -10.348 234 HA LYS 36 HA LYS 36 3.236 -10.582 -7.823 235 HB2 LYS 36 HB2 LYS 36 4.821 -10.084 -10.354 236 HB3 LYS 36 HB1 LYS 36 5.342 -9.681 -8.723 237 HG2 LYS 36 HG2 LYS 36 5.369 -12.027 -8.119 238 HG3 LYS 36 HG1 LYS 36 4.765 -12.463 -9.719 239 HD2 LYS 36 HD2 LYS 36 6.789 -11.541 -10.738 240 HD3 LYS 36 HD1 LYS 36 7.388 -11.087 -9.140 241 HE2 LYS 36 HE2 LYS 36 7.441 -13.423 -8.472 242 HE3 LYS 36 HE1 LYS 36 6.775 -13.902 -10.033 243 HZ1 LYS 36 HZ1 LYS 36 8.761 -13.018 -11.100 244 HZ2 LYS 36 HZ2 LYS 36 9.160 -14.216 -9.976 245 HZ3 LYS 36 HZ3 LYS 36 9.402 -12.586 -9.594 246 H GLY 37 HN GLY 37 2.637 -8.677 -7.033 247 HA2 GLY 37 HA2 GLY 37 1.125 -6.828 -8.562 248 HA3 GLY 37 HA1 GLY 37 1.696 -6.585 -6.919 249 H VAL 38 HN VAL 38 1.566 -4.627 -9.006 250 HA VAL 38 HA VAL 38 4.438 -4.006 -9.287 251 HB VAL 38 HB VAL 38 2.324 -2.951 -11.150 252 H SER 39 HN SER 39 5.103 -2.070 -8.502 253 HA SER 39 HA SER 39 3.059 -0.080 -7.808 254 HG SER 39 HG SER 39 6.021 -0.591 -5.264 255 HB2 SER 39 HB2 SER 39 4.176 0.313 -5.633 256 HB3 SER 39 HB1 SER 39 3.520 -1.318 -5.761 257 H GLU 40 HN GLU 40 3.684 2.044 -7.872 258 HA GLU 40 HA GLU 40 6.450 2.648 -8.663 259 HB2 GLU 40 HB2 GLU 40 5.121 2.575 -10.716 260 HB3 GLU 40 HB1 GLU 40 3.953 3.690 -10.021 261 HG2 GLU 40 HG2 GLU 40 5.835 5.355 -9.844 262 HG3 GLU 40 HG1 GLU 40 6.791 4.237 -10.816 263 H ILE 41 HN ILE 41 7.246 4.606 -7.875 264 HA ILE 41 HA ILE 41 5.376 6.127 -6.169 265 HB ILE 41 HB ILE 41 8.319 5.765 -5.620 266 H VAL 42 HN VAL 42 5.061 8.105 -6.909 267 HA VAL 42 HA VAL 42 7.244 9.461 -8.348 268 HB VAL 42 HB VAL 42 4.272 10.025 -8.441 269 H HIS 43 HN HIS 43 8.312 10.894 -7.112 270 HA HIS 43 HA HIS 43 6.841 12.237 -4.952 271 HD1 HIS 43 HD1 HIS 43 11.095 13.721 -4.946 272 HD2 HIS 43 HD2 HIS 43 8.009 13.258 -2.202 273 HE1 HIS 43 HE1 HIS 43 11.438 15.533 -3.237 274 HE2 HIS 43 HE2 HIS 43 9.585 15.208 -1.561 275 HB2 HIS 43 HB2 HIS 43 8.708 11.113 -4.041 276 HB3 HIS 43 HB1 HIS 43 9.768 11.632 -5.344 277 H GLU 44 HN GLU 44 6.160 14.216 -5.372 278 HA GLU 44 HA GLU 44 7.907 16.040 -6.855 279 HB2 GLU 44 HB2 GLU 44 6.326 15.203 -8.498 280 HB3 GLU 44 HB1 GLU 44 4.978 15.594 -7.443 281 HG2 GLU 44 HG2 GLU 44 5.209 17.228 -9.216 282 HG3 GLU 44 HG1 GLU 44 5.484 17.961 -7.637 283 H GLY 45 HN GLY 45 8.373 17.503 -5.330 284 HA2 GLY 45 HA2 GLY 45 8.113 19.077 -3.679 285 HA3 GLY 45 HA1 GLY 45 6.631 19.476 -4.528 286 H LYS 46 HN LYS 46 7.818 16.919 -2.343 287 HA LYS 46 HA LYS 46 6.987 16.054 -0.418 288 HB2 LYS 46 HB2 LYS 46 5.224 18.504 -0.451 289 HB3 LYS 46 HB1 LYS 46 5.336 17.373 0.890 290 HG2 LYS 46 HG2 LYS 46 7.689 17.907 1.169 291 HG3 LYS 46 HG1 LYS 46 7.612 19.010 -0.205 292 HD2 LYS 46 HD2 LYS 46 7.471 20.287 1.832 293 HD3 LYS 46 HD1 LYS 46 5.907 20.337 1.014 294 HE2 LYS 46 HE2 LYS 46 5.082 18.573 2.507 295 HE3 LYS 46 HE1 LYS 46 6.643 18.541 3.326 296 HZ1 LYS 46 HZ1 LYS 46 5.020 19.860 4.541 297 HZ2 LYS 46 HZ2 LYS 46 4.812 20.878 3.205 298 HZ3 LYS 46 HZ3 LYS 46 6.300 20.829 4.006 299 H LYS 47 HN LYS 47 4.942 16.664 -3.097 300 HA LYS 47 HA LYS 47 2.783 15.020 -2.041 301 HB2 LYS 47 HB2 LYS 47 3.092 16.415 -4.707 302 HB3 LYS 47 HB1 LYS 47 1.666 15.522 -4.198 303 HG2 LYS 47 HG2 LYS 47 1.355 17.093 -2.341 304 HG3 LYS 47 HG1 LYS 47 2.768 17.999 -2.885 305 HD2 LYS 47 HD2 LYS 47 0.831 19.122 -3.708 306 HD3 LYS 47 HD1 LYS 47 1.606 18.327 -5.079 307 HE2 LYS 47 HE2 LYS 47 0.002 16.547 -5.033 308 HE3 LYS 47 HE1 LYS 47 -0.695 17.152 -3.530 309 HZ1 LYS 47 HZ1 LYS 47 -0.721 18.611 -6.118 310 HZ2 LYS 47 HZ2 LYS 47 -1.466 19.104 -4.681 311 HZ3 LYS 47 HZ3 LYS 47 -2.022 17.730 -5.492 312 H VAL 48 HN VAL 48 3.150 12.903 -2.058 313 HA VAL 48 HA VAL 48 4.528 11.734 -4.378 314 HB VAL 48 HB VAL 48 4.175 10.555 -1.621 315 H LYS 49 HN LYS 49 3.439 10.462 -5.716 316 HA LYS 49 HA LYS 49 0.728 9.636 -4.956 317 HB2 LYS 49 HB2 LYS 49 2.037 9.934 -7.662 318 HB3 LYS 49 HB1 LYS 49 0.420 9.288 -7.420 319 HG2 LYS 49 HG2 LYS 49 -0.255 11.417 -6.390 320 HG3 LYS 49 HG1 LYS 49 1.356 12.062 -6.717 321 HD2 LYS 49 HD2 LYS 49 1.020 11.858 -9.084 322 HD3 LYS 49 HD1 LYS 49 -0.502 10.999 -8.842 323 HE2 LYS 49 HE2 LYS 49 -1.462 13.000 -7.809 324 HE3 LYS 49 HE1 LYS 49 0.060 13.856 -8.050 325 HZ1 LYS 49 HZ1 LYS 49 -1.585 14.370 -9.766 326 HZ2 LYS 49 HZ2 LYS 49 -1.629 12.743 -10.225 327 HZ3 LYS 49 HZ3 LYS 49 -0.208 13.638 -10.424 328 H LEU 50 HN LEU 50 0.108 7.538 -4.939 329 HA LEU 50 HA LEU 50 2.208 5.537 -5.454 330 HG LEU 50 HG LEU 50 0.271 3.207 -4.492 331 HB2 LEU 50 HB2 LEU 50 1.564 5.576 -3.134 332 HB3 LEU 50 HB1 LEU 50 -0.134 5.491 -3.553 333 H THR 51 HN THR 51 1.906 4.201 -7.113 334 HA THR 51 HA THR 51 -0.851 3.751 -8.054 335 HB THR 51 HB THR 51 1.623 3.905 -9.788 336 HG1 THR 51 HG1 THR 51 -0.318 5.722 -10.316 337 H ILE 52 HN ILE 52 -1.479 1.702 -8.079 338 HA ILE 52 HA ILE 52 0.553 -0.414 -8.283 339 HB ILE 52 HB ILE 52 -1.855 -0.584 -6.471 340 H THR 53 HN THR 53 0.087 -1.944 -9.773 341 HA THR 53 HA THR 53 -2.677 -2.025 -10.798 342 HB THR 53 HB THR 53 -0.138 -2.495 -12.371 343 HG1 THR 53 HG1 THR 53 -1.046 -0.236 -11.705 344 H TYR 54 HN TYR 54 -3.685 -3.919 -10.770 345 HA TYR 54 HA TYR 54 -2.082 -6.360 -10.371 346 HD1 TYR 54 HD2 TYR 54 -1.528 -7.278 -8.242 347 HD2 TYR 54 HD1 TYR 54 -4.478 -4.372 -7.262 348 HE1 TYR 54 HE2 TYR 54 -0.305 -6.741 -6.178 349 HE2 TYR 54 HE1 TYR 54 -3.263 -3.828 -5.194 350 HH TYR 54 HH TYR 54 -1.646 -4.910 -3.671 351 HB2 TYR 54 HB2 TYR 54 -4.754 -5.620 -9.171 352 HB3 TYR 54 HB1 TYR 54 -4.094 -7.251 -9.132 353 H GLY 55 HN GLY 55 -2.118 -7.444 -12.247 354 HA2 GLY 55 HA2 GLY 55 -2.968 -8.634 -14.023 355 HA3 GLY 55 HA1 GLY 55 -4.552 -8.476 -13.279 356 H SER 56 HN SER 56 -5.828 -6.612 -13.752 357 HA SER 56 HA SER 56 -4.932 -5.032 -16.056 358 HG SER 56 HG SER 56 -8.691 -6.286 -16.075 359 HB2 SER 56 HB2 SER 56 -7.160 -5.308 -17.112 360 HB3 SER 56 HB1 SER 56 -6.287 -6.833 -16.978 361 H LYS 57 HN LYS 57 -5.627 -4.746 -13.022 362 HA LYS 57 HA LYS 57 -7.482 -2.478 -13.308 363 HB2 LYS 57 HB2 LYS 57 -8.296 -4.155 -11.763 364 HB3 LYS 57 HB1 LYS 57 -6.782 -4.103 -10.868 365 HG2 LYS 57 HG2 LYS 57 -7.233 -1.773 -10.245 366 HG3 LYS 57 HG1 LYS 57 -8.761 -1.845 -11.126 367 HD2 LYS 57 HD2 LYS 57 -8.101 -3.784 -8.942 368 HD3 LYS 57 HD1 LYS 57 -8.837 -2.219 -8.598 369 HE2 LYS 57 HE2 LYS 57 -10.717 -2.779 -10.044 370 HE3 LYS 57 HE1 LYS 57 -9.968 -4.325 -10.440 371 HZ1 LYS 57 HZ1 LYS 57 -10.155 -4.972 -8.124 372 HZ2 LYS 57 HZ2 LYS 57 -11.674 -4.562 -8.742 373 HZ3 LYS 57 HZ3 LYS 57 -10.853 -3.482 -7.732 374 H VAL 58 HN VAL 58 -6.629 -0.516 -13.221 375 HA VAL 58 HA VAL 58 -3.985 -0.174 -12.023 376 HB VAL 58 HB VAL 58 -4.351 0.626 -14.336 377 H ILE 59 HN ILE 59 -3.725 0.795 -10.125 378 HA ILE 59 HA ILE 59 -5.994 2.309 -9.008 379 HB ILE 59 HB ILE 59 -3.883 0.756 -7.502 380 H HIS 60 HN HIS 60 -5.627 4.410 -8.936 381 HA HIS 60 HA HIS 60 -2.862 5.330 -8.490 382 HD1 HIS 60 HD1 HIS 60 -6.111 8.003 -8.791 383 HD2 HIS 60 HD2 HIS 60 -5.755 5.552 -12.127 384 HE1 HIS 60 HE1 HIS 60 -8.358 8.071 -9.916 385 HE2 HIS 60 HE2 HIS 60 -8.082 6.675 -11.996 386 HB2 HIS 60 HB2 HIS 60 -3.574 7.429 -9.686 387 HB3 HIS 60 HB1 HIS 60 -3.506 5.985 -10.689 388 H ASN 61 HN ASN 61 -2.454 6.560 -6.787 389 HA ASN 61 HA ASN 61 -4.639 8.001 -5.472 390 HB2 ASN 61 HB2 ASN 61 -2.766 6.040 -4.141 391 HB3 ASN 61 HB1 ASN 61 -3.687 7.240 -3.244 392 H GLU 62 HN GLU 62 -3.842 9.640 -3.928 393 HA GLU 62 HA GLU 62 -1.059 10.441 -4.309 394 HB2 GLU 62 HB2 GLU 62 -1.806 12.793 -4.781 395 HB3 GLU 62 HB1 GLU 62 -2.132 11.644 -6.072 396 HG2 GLU 62 HG2 GLU 62 -4.457 11.450 -5.236 397 HG3 GLU 62 HG1 GLU 62 -4.101 12.727 -4.073 398 H PHE 63 HN PHE 63 -0.185 11.532 -2.595 399 HA PHE 63 HA PHE 63 -1.917 12.536 -0.489 400 HD1 PHE 63 HD2 PHE 63 1.843 10.803 0.734 401 HD2 PHE 63 HD1 PHE 63 -1.234 8.668 -1.285 402 HE1 PHE 63 HE2 PHE 63 3.497 9.152 -0.031 403 HE2 PHE 63 HE1 PHE 63 0.416 7.013 -2.055 404 HZ PHE 63 HZ PHE 63 2.775 7.245 -1.431 405 HB2 PHE 63 HB2 PHE 63 -0.496 11.220 1.213 406 HB3 PHE 63 HB1 PHE 63 -1.765 10.358 0.351 407 H THR 64 HN THR 64 -0.976 14.053 0.835 408 HA THR 64 HA THR 64 1.655 15.022 -0.051 409 HB THR 64 HB THR 64 -0.490 16.516 1.476 410 HG1 THR 64 HG1 THR 64 -1.237 17.121 -0.423 411 H LEU 65 HN LEU 65 3.342 15.044 1.305 412 HA LEU 65 HA LEU 65 3.373 13.620 3.690 413 HG LEU 65 HG LEU 65 5.183 13.740 1.295 414 HB2 LEU 65 HB2 LEU 65 5.237 15.785 2.723 415 HB3 LEU 65 HB1 LEU 65 5.560 14.764 4.110 416 H GLY 66 HN GLY 66 3.180 14.119 5.820 417 HA2 GLY 66 HA2 GLY 66 2.448 15.246 7.676 418 HA3 GLY 66 HA1 GLY 66 3.252 16.645 6.986 419 H GLU 67 HN GLU 67 0.642 15.045 5.319 420 HA GLU 67 HA GLU 67 -1.269 17.075 6.202 421 HB2 GLU 67 HB2 GLU 67 -0.475 16.580 3.332 422 HB3 GLU 67 HB1 GLU 67 -1.947 17.424 3.790 423 HG2 GLU 67 HG2 GLU 67 0.807 18.302 4.616 424 HG3 GLU 67 HG1 GLU 67 -0.027 18.894 3.181 425 H GLU 68 HN GLU 68 -3.345 16.378 6.290 426 HA GLU 68 HA GLU 68 -3.804 13.544 5.854 427 HB2 GLU 68 HB2 GLU 68 -4.570 14.673 7.929 428 HB3 GLU 68 HB1 GLU 68 -5.664 15.654 6.964 429 HG2 GLU 68 HG2 GLU 68 -6.846 13.639 6.252 430 HG3 GLU 68 HG1 GLU 68 -5.753 12.659 7.229 431 H CYS 69 HN CYS 69 -4.624 12.771 4.026 432 HA CYS 69 HA CYS 69 -6.238 14.569 2.339 433 HG CYS 69 HG CYS 69 -4.679 13.303 -1.211 434 HB2 CYS 69 HB2 CYS 69 -4.027 13.884 1.384 435 HB3 CYS 69 HB1 CYS 69 -4.585 12.215 1.414 436 H GLU 70 HN GLU 70 -7.928 13.578 1.070 437 HA GLU 70 HA GLU 70 -9.237 11.410 2.538 438 HB2 GLU 70 HB2 GLU 70 -10.326 13.694 1.855 439 HB3 GLU 70 HB1 GLU 70 -10.511 12.921 0.286 440 HG2 GLU 70 HG2 GLU 70 -12.537 12.637 1.488 441 HG3 GLU 70 HG1 GLU 70 -11.730 11.072 1.407 442 H LEU 71 HN LEU 71 -9.198 9.399 1.779 443 HA LEU 71 HA LEU 71 -8.707 8.998 -1.099 444 HG LEU 71 HG LEU 71 -7.762 6.776 -1.712 445 HB2 LEU 71 HB2 LEU 71 -6.815 8.294 0.289 446 HB3 LEU 71 HB1 LEU 71 -7.873 7.249 1.216 447 H GLU 72 HN GLU 72 -9.897 7.473 -2.193 448 HA GLU 72 HA GLU 72 -12.425 6.771 -0.958 449 HB2 GLU 72 HB2 GLU 72 -12.012 7.669 -3.371 450 HB3 GLU 72 HB1 GLU 72 -11.624 5.995 -3.743 451 HG2 GLU 72 HG2 GLU 72 -13.831 5.310 -2.952 452 HG3 GLU 72 HG1 GLU 72 -14.215 6.992 -2.590 453 H THR 73 HN THR 73 -12.795 4.886 -0.004 454 HA THR 73 HA THR 73 -10.867 2.730 -0.274 455 HB THR 73 HB THR 73 -13.357 2.521 1.382 456 HG1 THR 73 HG1 THR 73 -12.034 3.570 3.069 457 H MET 74 HN MET 74 -11.676 0.467 -0.494 458 HA MET 74 HA MET 74 -13.191 0.199 -2.882 459 HB2 MET 74 HB2 MET 74 -11.373 -1.352 -2.235 460 HB3 MET 74 HB1 MET 74 -12.360 -1.933 -0.901 461 HG2 MET 74 HG2 MET 74 -14.034 -2.735 -2.499 462 HG3 MET 74 HG1 MET 74 -13.021 -2.178 -3.828 463 HE1 MET 74 HE1 MET 74 -9.882 -4.493 -3.481 464 HE2 MET 74 HE2 MET 74 -10.097 -2.913 -2.727 465 HE3 MET 74 HE3 MET 74 -10.636 -3.180 -4.384 466 H THR 75 HN THR 75 -13.978 0.177 0.476 467 HA THR 75 HA THR 75 -16.391 -1.292 0.383 468 HB THR 75 HB THR 75 -16.921 -0.243 2.531 469 HG1 THR 75 HG1 THR 75 -16.233 1.756 2.715 470 H GLY 76 HN GLY 76 -15.583 1.745 -0.864 471 HA2 GLY 76 HA2 GLY 76 -17.096 2.913 -2.300 472 HA3 GLY 76 HA1 GLY 76 -18.428 2.325 -1.316 473 H GLU 77 HN GLU 77 -16.715 3.041 1.114 474 HA GLU 77 HA GLU 77 -17.608 5.814 1.248 475 HB2 GLU 77 HB2 GLU 77 -18.376 4.328 3.007 476 HB3 GLU 77 HB1 GLU 77 -16.718 3.928 3.400 477 HG2 GLU 77 HG2 GLU 77 -16.287 6.122 4.205 478 HG3 GLU 77 HG1 GLU 77 -17.839 6.702 3.601 479 H LYS 78 HN LYS 78 -16.273 7.518 1.824 480 HA LYS 78 HA LYS 78 -13.487 7.142 1.174 481 HB2 LYS 78 HB2 LYS 78 -13.598 9.755 1.757 482 HB3 LYS 78 HB1 LYS 78 -14.072 9.096 0.199 483 HG2 LYS 78 HG2 LYS 78 -15.685 10.726 1.026 484 HG3 LYS 78 HG1 LYS 78 -16.403 9.125 0.860 485 HD2 LYS 78 HD2 LYS 78 -17.165 10.049 2.924 486 HD3 LYS 78 HD1 LYS 78 -15.996 8.780 3.299 487 HE2 LYS 78 HE2 LYS 78 -14.255 10.506 3.577 488 HE3 LYS 78 HE1 LYS 78 -15.465 11.751 3.270 489 HZ1 LYS 78 HZ1 LYS 78 -15.461 9.829 5.534 490 HZ2 LYS 78 HZ2 LYS 78 -16.684 10.957 5.226 491 HZ3 LYS 78 HZ3 LYS 78 -15.127 11.485 5.625 492 H VAL 79 HN VAL 79 -11.742 7.429 2.494 493 HA VAL 79 HA VAL 79 -12.297 7.859 5.353 494 HB VAL 79 HB VAL 79 -10.518 6.224 5.894 495 H LYS 80 HN LYS 80 -10.981 9.262 6.381 496 HA LYS 80 HA LYS 80 -8.970 10.619 4.773 497 HB2 LYS 80 HB2 LYS 80 -8.929 12.249 6.660 498 HB3 LYS 80 HB1 LYS 80 -10.512 12.056 5.924 499 HG2 LYS 80 HG2 LYS 80 -11.163 10.559 7.763 500 HG3 LYS 80 HG1 LYS 80 -9.587 10.822 8.510 501 HD2 LYS 80 HD2 LYS 80 -10.063 13.196 8.726 502 HD3 LYS 80 HD1 LYS 80 -11.615 12.976 7.914 503 HE2 LYS 80 HE2 LYS 80 -11.891 13.112 10.338 504 HE3 LYS 80 HE1 LYS 80 -12.367 11.529 9.727 505 HZ1 LYS 80 HZ1 LYS 80 -9.772 12.175 11.016 506 HZ2 LYS 80 HZ2 LYS 80 -10.225 10.655 10.429 507 HZ3 LYS 80 HZ3 LYS 80 -11.053 11.338 11.738 508 H ALA 81 HN ALA 81 -6.827 10.616 5.139 509 HA ALA 81 HA ALA 81 -5.771 9.385 7.564 510 HB1 ALA 81 HB1 ALA 81 -4.371 7.821 6.372 511 HB2 ALA 81 HB2 ALA 81 -5.001 8.390 4.825 512 HB3 ALA 81 HB3 ALA 81 -6.060 7.541 5.950 513 H VAL 82 HN VAL 82 -3.767 10.106 8.142 514 HA VAL 82 HA VAL 82 -2.598 12.194 6.430 515 HB VAL 82 HB VAL 82 -3.343 13.090 8.553 516 H VAL 83 HN VAL 83 -0.699 11.778 5.532 517 HA VAL 83 HA VAL 83 0.919 9.576 6.624 518 HB VAL 83 HB VAL 83 0.198 9.151 4.350 519 H LYS 84 HN LYS 84 2.944 9.944 7.311 520 HA LYS 84 HA LYS 84 4.186 12.535 6.691 521 HB2 LYS 84 HB2 LYS 84 4.221 11.224 9.410 522 HB3 LYS 84 HB1 LYS 84 4.964 12.758 8.978 523 HG2 LYS 84 HG2 LYS 84 2.652 13.578 8.399 524 HG3 LYS 84 HG1 LYS 84 2.040 12.110 9.166 525 HD2 LYS 84 HD2 LYS 84 2.785 12.757 11.273 526 HD3 LYS 84 HD1 LYS 84 3.943 13.914 10.616 527 HE2 LYS 84 HE2 LYS 84 2.076 15.315 9.849 528 HE3 LYS 84 HE1 LYS 84 0.938 14.175 10.568 529 HZ1 LYS 84 HZ1 LYS 84 2.988 15.743 12.040 530 HZ2 LYS 84 HZ2 LYS 84 1.911 14.639 12.736 531 HZ3 LYS 84 HZ3 LYS 84 1.325 16.056 12.023 532 H MET 85 HN MET 85 6.468 12.575 6.751 533 HA MET 85 HA MET 85 7.648 9.910 6.397 534 HB2 MET 85 HB2 MET 85 9.427 11.104 5.114 535 HB3 MET 85 HB1 MET 85 7.824 11.229 4.403 536 HG2 MET 85 HG2 MET 85 8.595 13.375 4.197 537 HG3 MET 85 HG1 MET 85 7.701 13.465 5.712 538 HE1 MET 85 HE1 MET 85 11.188 13.420 3.983 539 HE2 MET 85 HE2 MET 85 11.259 11.928 4.923 540 HE3 MET 85 HE3 MET 85 12.293 13.292 5.351 541 H GLU 86 HN GLU 86 9.499 9.314 7.442 542 HA GLU 86 HA GLU 86 10.266 11.002 9.715 543 HB2 GLU 86 HB2 GLU 86 9.473 8.728 10.237 544 HB3 GLU 86 HB1 GLU 86 10.747 8.056 9.230 545 HG2 GLU 86 HG2 GLU 86 11.283 7.927 11.608 546 HG3 GLU 86 HG1 GLU 86 12.437 8.924 10.722 547 H GLY 87 HN GLY 87 11.289 10.043 6.677 548 HA2 GLY 87 HA2 GLY 87 13.333 11.386 6.017 549 HA3 GLY 87 HA1 GLY 87 14.120 10.541 7.339 550 H ASP 88 HN ASP 88 15.474 9.099 6.545 551 HA ASP 88 HA ASP 88 14.766 7.694 4.080 552 HB2 ASP 88 HB2 ASP 88 17.435 7.879 5.496 553 HB3 ASP 88 HB1 ASP 88 17.142 7.114 3.936 554 H ASN 89 HN ASN 89 14.224 5.669 4.091 555 HA ASN 89 HA ASN 89 14.088 3.454 4.620 556 HB2 ASN 89 HB2 ASN 89 15.804 4.077 7.024 557 HB3 ASN 89 HB1 ASN 89 15.382 2.472 6.439 558 H LYS 90 HN LYS 90 12.941 5.987 6.489 559 HA LYS 90 HA LYS 90 11.113 4.121 7.839 560 HB2 LYS 90 HB2 LYS 90 12.412 6.543 9.079 561 HB3 LYS 90 HB1 LYS 90 11.094 5.643 9.814 562 HG2 LYS 90 HG2 LYS 90 12.844 4.662 10.854 563 HG3 LYS 90 HG1 LYS 90 12.730 3.614 9.444 564 HD2 LYS 90 HD2 LYS 90 14.468 4.943 8.329 565 HD3 LYS 90 HD1 LYS 90 14.599 5.963 9.765 566 HE2 LYS 90 HE2 LYS 90 15.121 2.992 9.672 567 HE3 LYS 90 HE1 LYS 90 16.361 4.246 9.663 568 HZ1 LYS 90 HZ1 LYS 90 16.031 3.330 11.876 569 HZ2 LYS 90 HZ2 LYS 90 14.400 3.778 11.844 570 HZ3 LYS 90 HZ3 LYS 90 15.602 4.967 11.838 571 H MET 91 HN MET 91 9.056 4.503 7.577 572 HA MET 91 HA MET 91 8.080 7.204 7.029 573 HB2 MET 91 HB2 MET 91 7.548 4.785 5.295 574 HB3 MET 91 HB1 MET 91 6.606 6.266 5.214 575 HG2 MET 91 HG2 MET 91 9.571 6.117 4.742 576 HG3 MET 91 HG1 MET 91 8.352 6.075 3.470 577 HE1 MET 91 HE1 MET 91 9.833 9.646 3.007 578 HE2 MET 91 HE2 MET 91 9.576 8.052 2.295 579 HE3 MET 91 HE3 MET 91 10.768 8.265 3.577 580 H VAL 92 HN VAL 92 6.100 7.612 7.964 581 HA VAL 92 HA VAL 92 4.692 5.304 9.123 582 HB VAL 92 HB VAL 92 5.906 6.294 10.940 583 H THR 93 HN THR 93 2.680 5.182 8.484 584 HA THR 93 HA THR 93 1.147 7.645 8.005 585 HB THR 93 HB THR 93 1.736 6.869 5.800 586 HG1 THR 93 HG1 THR 93 -0.760 7.034 6.676 587 H THR 94 HN THR 94 -0.902 7.620 8.816 588 HA THR 94 HA THR 94 -1.888 5.056 9.890 589 HB THR 94 HB THR 94 -2.938 6.363 11.747 590 HG1 THR 94 HG1 THR 94 -2.755 8.467 11.738 591 H PHE 95 HN PHE 95 -3.878 4.491 9.300 592 HA PHE 95 HA PHE 95 -5.772 6.556 8.455 593 HD1 PHE 95 HD1 PHE 95 -3.063 3.857 7.212 594 HD2 PHE 95 HD2 PHE 95 -7.103 3.159 6.071 595 HE1 PHE 95 HE1 PHE 95 -2.541 1.483 6.830 596 HE2 PHE 95 HE2 PHE 95 -6.588 0.786 5.688 597 HZ PHE 95 HZ PHE 95 -4.295 -0.053 6.056 598 HB2 PHE 95 HB2 PHE 95 -6.396 5.327 6.449 599 HB3 PHE 95 HB1 PHE 95 -4.678 5.708 6.409 600 H LYS 96 HN LYS 96 -7.712 6.275 9.316 601 HA LYS 96 HA LYS 96 -9.475 5.382 10.425 602 HB2 LYS 96 HB2 LYS 96 -9.635 3.945 8.438 603 HB3 LYS 96 HB1 LYS 96 -8.533 2.795 9.177 604 HG2 LYS 96 HG2 LYS 96 -10.123 2.254 10.875 605 HG3 LYS 96 HG1 LYS 96 -11.192 3.557 10.357 606 HD2 LYS 96 HD2 LYS 96 -12.141 1.611 9.451 607 HD3 LYS 96 HD1 LYS 96 -11.285 2.362 8.104 608 HE2 LYS 96 HE2 LYS 96 -10.091 0.191 9.817 609 HE3 LYS 96 HE1 LYS 96 -10.997 -0.135 8.339 610 HZ1 LYS 96 HZ1 LYS 96 -9.375 1.325 7.172 611 HZ2 LYS 96 HZ2 LYS 96 -8.708 -0.100 7.791 612 HZ3 LYS 96 HZ3 LYS 96 -8.454 1.368 8.593 613 H GLY 97 HN GLY 97 -7.468 2.463 10.689 614 HA2 GLY 97 HA2 GLY 97 -6.726 3.091 13.416 615 HA3 GLY 97 HA1 GLY 97 -7.916 1.808 13.263 616 H ILE 98 HN ILE 98 -5.886 1.868 10.593 617 HA ILE 98 HA ILE 98 -4.382 -0.425 11.641 618 HB ILE 98 HB ILE 98 -4.788 0.468 8.783 619 H LYS 99 HN LYS 99 -2.186 -0.454 11.735 620 HA LYS 99 HA LYS 99 -0.829 2.090 11.230 621 HB2 LYS 99 HB2 LYS 99 -0.718 0.615 13.436 622 HB3 LYS 99 HB1 LYS 99 0.549 -0.211 12.532 623 HG2 LYS 99 HG2 LYS 99 1.845 1.764 12.366 624 HG3 LYS 99 HG1 LYS 99 0.520 2.763 12.968 625 HD2 LYS 99 HD2 LYS 99 2.131 2.443 14.728 626 HD3 LYS 99 HD1 LYS 99 0.657 1.563 15.130 627 HE2 LYS 99 HE2 LYS 99 1.672 -0.516 14.378 628 HE3 LYS 99 HE1 LYS 99 3.133 0.349 13.904 629 HZ1 LYS 99 HZ1 LYS 99 2.080 0.188 16.677 630 HZ2 LYS 99 HZ2 LYS 99 3.527 0.920 16.196 631 HZ3 LYS 99 HZ3 LYS 99 3.344 -0.756 16.066 632 H SER 100 HN SER 100 0.350 2.345 9.467 633 HA SER 100 HA SER 100 1.491 -0.051 8.195 634 HG SER 100 HG SER 100 -1.075 1.012 6.003 635 HB2 SER 100 HB2 SER 100 0.368 2.436 6.894 636 HB3 SER 100 HB1 SER 100 1.304 1.218 6.029 637 H VAL 101 HN VAL 101 3.622 -0.103 8.218 638 HA VAL 101 HA VAL 101 5.097 2.450 8.260 639 HB VAL 101 HB VAL 101 5.934 -0.140 9.578 640 H THR 102 HN THR 102 6.338 2.755 6.542 641 HA THR 102 HA THR 102 7.161 0.400 4.978 642 HB THR 102 HB THR 102 6.705 3.220 3.989 643 HG1 THR 102 HG1 THR 102 5.153 0.848 3.898 644 H GLU 103 HN GLU 103 9.252 0.038 4.674 645 HA GLU 103 HA GLU 103 11.182 1.993 5.685 646 HB2 GLU 103 HB2 GLU 103 11.376 -0.303 6.522 647 HB3 GLU 103 HB1 GLU 103 11.512 -0.909 4.879 648 HG2 GLU 103 HG2 GLU 103 13.619 0.300 4.609 649 HG3 GLU 103 HG1 GLU 103 13.484 0.897 6.261 650 H PHE 104 HN PHE 104 12.250 3.276 4.287 651 HA PHE 104 HA PHE 104 12.129 2.560 1.435 652 HD1 PHE 104 HD1 PHE 104 9.573 4.546 1.749 653 HD2 PHE 104 HD2 PHE 104 13.102 5.227 -0.528 654 HE1 PHE 104 HE1 PHE 104 8.200 4.932 -0.257 655 HE2 PHE 104 HE2 PHE 104 11.738 5.615 -2.538 656 HZ PHE 104 HZ PHE 104 9.276 5.469 -2.400 657 HB2 PHE 104 HB2 PHE 104 11.717 4.987 2.824 658 HB3 PHE 104 HB1 PHE 104 13.179 5.193 1.866 659 H ASN 105 HN ASN 105 13.832 1.646 0.583 660 HA ASN 105 HA ASN 105 16.511 2.506 1.448 661 HB2 ASN 105 HB2 ASN 105 15.761 -0.299 0.593 662 HB3 ASN 105 HB1 ASN 105 17.339 0.244 1.151 663 H GLY 106 HN GLY 106 18.151 2.422 -0.203 664 HA2 GLY 106 HA2 GLY 106 17.110 3.177 -2.778 665 HA3 GLY 106 HA1 GLY 106 18.800 3.128 -2.309 666 H ASP 107 HN ASP 107 16.519 0.429 -2.118 667 HA ASP 107 HA ASP 107 17.306 -0.787 -4.549 668 HB2 ASP 107 HB2 ASP 107 18.626 -2.665 -3.579 669 HB3 ASP 107 HB1 ASP 107 19.438 -1.106 -3.470 670 H THR 108 HN THR 108 16.050 -1.231 -1.273 671 HA THR 108 HA THR 108 13.987 -2.990 -2.400 672 HB THR 108 HB THR 108 15.547 -3.677 0.096 673 HG1 THR 108 HG1 THR 108 15.420 -5.201 -2.290 674 H ILE 109 HN ILE 109 12.011 -2.432 -1.766 675 HA ILE 109 HA ILE 109 11.730 -0.788 0.666 676 HB ILE 109 HB ILE 109 10.325 -0.706 -1.969 677 H THR 110 HN THR 110 10.531 -1.539 2.294 678 HA THR 110 HA THR 110 8.891 -3.940 1.814 679 HB THR 110 HB THR 110 10.332 -3.136 4.349 680 HG1 THR 110 HG1 THR 110 11.895 -4.340 3.594 681 H ASN 111 HN ASN 111 6.830 -4.020 2.585 682 HA ASN 111 HA ASN 111 5.797 -1.561 3.839 683 HB2 ASN 111 HB2 ASN 111 4.897 -1.882 1.601 684 HB3 ASN 111 HB1 ASN 111 4.407 -3.525 2.004 685 H THR 112 HN THR 112 4.765 -1.720 5.758 686 HA THR 112 HA THR 112 4.233 -4.435 6.786 687 HB THR 112 HB THR 112 4.775 -2.124 8.620 688 HG1 THR 112 HG1 THR 112 6.892 -3.823 7.914 689 H MET 113 HN MET 113 2.142 -4.833 7.004 690 HA MET 113 HA MET 113 0.375 -2.660 7.914 691 HB2 MET 113 HB2 MET 113 -0.129 -4.773 5.822 692 HB3 MET 113 HB1 MET 113 -1.444 -3.916 6.617 693 HG2 MET 113 HG2 MET 113 -0.556 -1.794 5.804 694 HG3 MET 113 HG1 MET 113 0.764 -2.648 5.011 695 HE1 MET 113 HE1 MET 113 -1.270 -0.573 3.598 696 HE2 MET 113 HE2 MET 113 -1.536 -1.393 2.060 697 HE3 MET 113 HE3 MET 113 0.082 -1.334 2.760 698 H THR 114 HN THR 114 -0.514 -3.072 9.838 699 HA THR 114 HA THR 114 -0.807 -5.895 10.642 700 HB THR 114 HB THR 114 -0.218 -3.539 12.444 701 HG1 THR 114 HG1 THR 114 1.496 -4.541 10.988 702 H LEU 115 HN LEU 115 -2.818 -6.540 10.945 703 HA LEU 115 HA LEU 115 -4.779 -4.723 12.116 704 HG LEU 115 HG LEU 115 -7.262 -6.235 10.933 705 HB2 LEU 115 HB2 LEU 115 -5.119 -4.480 9.723 706 HB3 LEU 115 HB1 LEU 115 -5.196 -6.222 9.529 707 H GLY 116 HN GLY 116 -5.526 -5.755 13.847 708 HA2 GLY 116 HA2 GLY 116 -6.448 -7.406 15.155 709 HA3 GLY 116 HA1 GLY 116 -6.750 -8.313 13.680 710 H ASP 117 HN ASP 117 -3.697 -7.217 15.117 711 HA ASP 117 HA ASP 117 -1.846 -8.321 15.823 712 HB2 ASP 117 HB2 ASP 117 -3.762 -10.633 16.192 713 HB3 ASP 117 HB1 ASP 117 -2.112 -10.577 16.808 714 H ILE 118 HN ILE 118 -3.261 -8.834 12.989 715 HA ILE 118 HA ILE 118 -1.676 -11.118 12.122 716 HB ILE 118 HB ILE 118 -3.393 -9.366 10.372 717 H VAL 119 HN VAL 119 0.142 -11.005 10.886 718 HA VAL 119 HA VAL 119 1.239 -8.323 10.435 719 HB VAL 119 HB VAL 119 2.620 -9.831 11.783 720 H TYR 120 HN TYR 120 1.788 -7.562 8.499 721 HA TYR 120 HA TYR 120 1.567 -9.334 6.160 722 HD1 TYR 120 HD2 TYR 120 1.662 -6.055 4.163 723 HD2 TYR 120 HD1 TYR 120 -1.307 -9.079 4.541 724 HE1 TYR 120 HE2 TYR 120 1.389 -6.085 1.720 725 HE2 TYR 120 HE1 TYR 120 -1.583 -9.121 2.099 726 HH TYR 120 HH TYR 120 -1.200 -7.609 0.174 727 HB2 TYR 120 HB2 TYR 120 -0.512 -7.972 6.469 728 HB3 TYR 120 HB1 TYR 120 0.466 -6.517 6.339 729 H LYS 121 HN LYS 121 3.446 -9.302 5.084 730 HA LYS 121 HA LYS 121 4.970 -6.787 5.013 731 HB2 LYS 121 HB2 LYS 121 6.048 -8.325 6.580 732 HB3 LYS 121 HB1 LYS 121 6.106 -9.568 5.338 733 HG2 LYS 121 HG2 LYS 121 7.592 -8.161 3.999 734 HG3 LYS 121 HG1 LYS 121 7.541 -6.922 5.255 735 HD2 LYS 121 HD2 LYS 121 9.568 -8.204 5.491 736 HD3 LYS 121 HD1 LYS 121 8.499 -8.557 6.849 737 HE2 LYS 121 HE2 LYS 121 7.855 -10.648 5.887 738 HE3 LYS 121 HE1 LYS 121 8.686 -10.274 4.378 739 HZ1 LYS 121 HZ1 LYS 121 10.011 -10.640 7.012 740 HZ2 LYS 121 HZ2 LYS 121 10.788 -10.352 5.537 741 HZ3 LYS 121 HZ3 LYS 121 9.951 -11.802 5.783 742 H ARG 122 HN ARG 122 5.309 -6.083 3.021 743 HA ARG 122 HA ARG 122 5.073 -7.990 0.802 744 HE ARG 122 HE ARG 122 4.597 -3.334 -0.120 745 HB2 ARG 122 HB2 ARG 122 3.533 -6.235 0.489 746 HB3 ARG 122 HB1 ARG 122 4.689 -5.008 0.985 747 HG2 ARG 122 HG2 ARG 122 5.949 -5.348 -1.067 748 HG3 ARG 122 HG1 ARG 122 4.834 -6.627 -1.552 749 HD2 ARG 122 HD2 ARG 122 4.360 -4.469 -2.653 750 HD3 ARG 122 HD1 ARG 122 3.013 -5.055 -1.678 751 HH11 ARG 122 HH11 ARG 122 2.422 -3.252 -2.842 752 HH12 ARG 122 HH12 ARG 122 1.894 -1.631 -2.536 753 HH21 ARG 122 HH21 ARG 122 3.907 -1.199 0.291 754 HH22 ARG 122 HH22 ARG 122 2.735 -0.465 -0.752 755 H VAL 123 HN VAL 123 6.730 -8.428 -0.498 756 HA VAL 123 HA VAL 123 9.288 -7.093 0.044 757 HB VAL 123 HB VAL 123 8.739 -9.714 -1.362 758 H SER 124 HN SER 124 9.948 -5.613 -1.373 759 HA SER 124 HA SER 124 9.243 -5.972 -4.201 760 HG SER 124 HG SER 124 7.412 -4.435 -2.058 761 HB2 SER 124 HB2 SER 124 9.169 -3.301 -2.784 762 HB3 SER 124 HB1 SER 124 8.694 -3.639 -4.449 763 H LYS 125 HN LYS 125 10.772 -5.380 -5.674 764 HA LYS 125 HA LYS 125 13.346 -4.443 -4.587 765 HB2 LYS 125 HB2 LYS 125 14.456 -5.758 -6.328 766 HB3 LYS 125 HB1 LYS 125 13.442 -6.775 -5.327 767 HG2 LYS 125 HG2 LYS 125 11.795 -6.955 -6.970 768 HG3 LYS 125 HG1 LYS 125 12.542 -5.699 -7.950 769 HD2 LYS 125 HD2 LYS 125 13.799 -8.364 -7.313 770 HD3 LYS 125 HD1 LYS 125 12.945 -7.992 -8.808 771 HE2 LYS 125 HE2 LYS 125 15.116 -7.613 -9.449 772 HE3 LYS 125 HE1 LYS 125 14.639 -5.999 -8.926 773 HZ1 LYS 125 HZ1 LYS 125 15.712 -6.377 -6.817 774 HZ2 LYS 125 HZ2 LYS 125 16.815 -6.662 -8.065 775 HZ3 LYS 125 HZ3 LYS 125 16.107 -7.964 -7.250 776 H ARG 126 HN ARG 126 14.573 -3.008 -5.853 777 HA ARG 126 HA ARG 126 12.970 -1.261 -7.503 778 HE ARG 126 HE ARG 126 14.818 2.672 -9.147 779 HB2 ARG 126 HB2 ARG 126 14.695 -0.515 -5.778 780 HB3 ARG 126 HB1 ARG 126 15.922 -1.005 -6.937 781 HG2 ARG 126 HG2 ARG 126 13.775 0.907 -7.748 782 HG3 ARG 126 HG1 ARG 126 15.172 1.469 -6.828 783 HD2 ARG 126 HD2 ARG 126 16.663 0.583 -8.546 784 HD3 ARG 126 HD1 ARG 126 15.275 -0.002 -9.460 785 HH11 ARG 126 HH11 ARG 126 17.406 0.750 -10.467 786 HH12 ARG 126 HH12 ARG 126 17.876 1.947 -11.628 787 HH21 ARG 126 HH21 ARG 126 15.428 4.252 -10.675 788 HH22 ARG 126 HH22 ARG 126 16.752 3.938 -11.746 789 H ILE 127 HN ILE 127 12.918 -1.201 -9.650 790 HA ILE 127 HA ILE 127 15.105 -2.377 -11.199 791 HB ILE 127 HB ILE 127 13.414 -3.473 -12.711 792 H9 OLA 128 HH1 OLA 128 -4.876 -7.586 -4.056 793 H10 OLA 128 HI1 OLA 128 -5.280 -6.169 -2.092 794 H21 OLA 128 HA1 OLA 128 -9.775 -9.057 -11.700 795 H22 OLA 128 HA2 OLA 128 -8.084 -8.870 -12.164 796 H31 OLA 128 HB1 OLA 128 -9.169 -8.476 -9.641 797 H32 OLA 128 HB2 OLA 128 -8.350 -10.036 -9.528 798 H41 OLA 128 HC1 OLA 128 -7.219 -7.333 -10.100 799 H42 OLA 128 HC2 OLA 128 -6.411 -8.764 -10.744 800 H51 OLA 128 HD1 OLA 128 -6.750 -9.579 -8.225 801 H52 OLA 128 HD2 OLA 128 -5.338 -8.657 -8.749 802 H61 OLA 128 HE1 OLA 128 -7.812 -7.594 -7.391 803 H62 OLA 128 HE2 OLA 128 -6.547 -6.574 -8.080 804 H71 OLA 128 HF1 OLA 128 -6.079 -8.658 -5.953 805 H72 OLA 128 HF2 OLA 128 -4.915 -7.481 -6.562 806 H81 OLA 128 HG1 OLA 128 -6.281 -5.660 -5.676 807 H82 OLA 128 HG2 OLA 128 -7.463 -6.829 -5.082 808 H111 OLA 128 HJ1 OLA 128 -6.701 -4.330 -3.826 809 H112 OLA 128 HJ2 OLA 128 -7.860 -5.466 -3.128 810 H121 OLA 128 HK1 OLA 128 -7.833 -3.771 -1.554 811 H122 OLA 128 HK2 OLA 128 -6.660 -4.912 -0.891 812 H131 OLA 128 HL1 OLA 128 -4.895 -3.546 -2.145 813 H132 OLA 128 HL2 OLA 128 -5.613 -2.826 -0.701 814 H141 OLA 128 HM1 OLA 128 -7.183 -2.168 -3.012 815 H142 OLA 128 HM2 OLA 128 -5.492 -1.736 -3.286 816 H151 OLA 128 HN1 OLA 128 -5.634 -0.693 -0.918 817 H152 OLA 128 HN2 OLA 128 -7.378 -0.755 -1.178 818 H161 OLA 128 HP1 OLA 128 -5.601 0.441 -3.262 819 H162 OLA 128 HP2 OLA 128 -6.045 1.384 -1.837 820 H171 OLA 128 HQ1 OLA 128 -8.180 -0.008 -3.400 821 H172 OLA 128 HQ2 OLA 128 -7.514 1.521 -3.994 822 H181 OLA 128 HR1 OLA 128 -7.923 2.198 -1.443 823 H182 OLA 128 HR2 OLA 128 -9.165 2.369 -2.684 824 H183 OLA 128 HR3 OLA 128 -9.178 0.969 -1.609 825 H9 OLA 129 HH1 OLA 129 -1.259 6.618 0.640 826 H10 OLA 129 HI1 OLA 129 -3.634 6.560 1.259 827 H21 OLA 129 HA1 OLA 129 2.939 1.804 -1.111 828 H22 OLA 129 HA2 OLA 129 3.952 1.454 0.290 829 H31 OLA 129 HB1 OLA 129 4.534 4.091 -0.603 830 H32 OLA 129 HB2 OLA 129 2.782 3.921 -0.467 831 H41 OLA 129 HC1 OLA 129 4.881 3.721 1.641 832 H42 OLA 129 HC2 OLA 129 3.393 2.792 1.825 833 H51 OLA 129 HD1 OLA 129 3.542 5.189 2.819 834 H52 OLA 129 HD2 OLA 129 3.270 5.703 1.153 835 H61 OLA 129 HE1 OLA 129 1.457 4.240 3.013 836 H62 OLA 129 HE2 OLA 129 1.307 3.964 1.277 837 H71 OLA 129 HF1 OLA 129 1.380 6.747 2.381 838 H72 OLA 129 HF2 OLA 129 0.715 6.174 0.850 839 H81 OLA 129 HG1 OLA 129 -0.704 4.793 2.813 840 H82 OLA 129 HG2 OLA 129 -0.563 6.442 3.427 841 H111 OLA 129 HJ1 OLA 129 -2.646 4.963 3.591 842 H112 OLA 129 HJ2 OLA 129 -3.271 6.570 3.970 843 H121 OLA 129 HK1 OLA 129 -5.228 5.437 4.113 844 H122 OLA 129 HK2 OLA 129 -5.235 5.702 2.368 845 H131 OLA 129 HL1 OLA 129 -5.484 3.272 3.593 846 H132 OLA 129 HL2 OLA 129 -3.763 3.316 3.209 847 H141 OLA 129 HM1 OLA 129 -4.870 4.243 0.897 848 H142 OLA 129 HM2 OLA 129 -6.085 3.082 1.436 849 H151 OLA 129 HN1 OLA 129 -4.811 1.484 0.550 850 H152 OLA 129 HN2 OLA 129 -3.654 1.794 1.846 851 H161 OLA 129 HP1 OLA 129 -2.210 2.847 0.479 852 H162 OLA 129 HP2 OLA 129 -3.495 3.651 -0.426 853 H171 OLA 129 HQ1 OLA 129 -3.882 1.107 -1.233 854 H172 OLA 129 HQ2 OLA 129 -2.806 2.238 -2.070 855 H181 OLA 129 HR1 OLA 129 -2.109 0.039 -0.155 856 H182 OLA 129 HR2 OLA 129 -1.000 1.377 -0.457 857 H183 OLA 129 HR3 OLA 129 -1.497 0.328 -1.784 Start of MODEL 8 1 HA MET 1 HA MET 1 17.011 12.845 -1.782 2 H1 MET 1 HT1 MET 1 17.178 10.918 -0.366 3 H2 MET 1 HT2 MET 1 18.601 11.830 -0.295 4 H3 MET 1 HT3 MET 1 18.562 10.395 -1.187 5 HB2 MET 1 HB2 MET 1 19.415 11.627 -3.152 6 HB3 MET 1 HB1 MET 1 18.474 12.969 -3.790 7 HG2 MET 1 HG2 MET 1 19.097 14.350 -1.912 8 HG3 MET 1 HG1 MET 1 19.952 13.000 -1.169 9 HE1 MET 1 HE1 MET 1 22.934 12.452 -3.634 10 HE2 MET 1 HE2 MET 1 21.371 11.634 -3.625 11 HE3 MET 1 HE3 MET 1 22.201 11.967 -2.106 12 H ASN 2 HN ASN 2 16.975 9.548 -1.819 13 HA ASN 2 HA ASN 2 15.706 9.289 -4.435 14 HB2 ASN 2 HB2 ASN 2 15.656 6.852 -3.881 15 HB3 ASN 2 HB1 ASN 2 17.275 7.542 -3.884 16 H PHE 3 HN PHE 3 13.581 9.390 -4.694 17 HA PHE 3 HA PHE 3 11.816 8.558 -2.517 18 HD1 PHE 3 HD2 PHE 3 10.713 10.217 -0.483 19 HD2 PHE 3 HD1 PHE 3 13.617 12.218 -2.865 20 HE1 PHE 3 HE2 PHE 3 11.753 11.124 1.553 21 HE2 PHE 3 HE1 PHE 3 14.663 13.128 -0.833 22 HZ PHE 3 HZ PHE 3 13.730 12.583 1.380 23 HB2 PHE 3 HB2 PHE 3 11.702 11.257 -3.874 24 HB3 PHE 3 HB1 PHE 3 10.389 10.594 -2.907 25 H SER 4 HN SER 4 12.219 9.473 -5.893 26 HA SER 4 HA SER 4 9.693 8.182 -6.594 27 HG SER 4 HG SER 4 10.617 8.784 -9.847 28 HB2 SER 4 HB2 SER 4 10.130 10.338 -7.644 29 HB3 SER 4 HB1 SER 4 11.660 9.742 -8.289 30 H GLY 5 HN GLY 5 9.535 6.276 -7.656 31 HA2 GLY 5 HA2 GLY 5 11.324 5.040 -9.318 32 HA3 GLY 5 HA1 GLY 5 11.843 4.575 -7.705 33 H LYS 6 HN LYS 6 10.670 3.027 -9.979 34 HA LYS 6 HA LYS 6 8.152 2.106 -8.834 35 HB2 LYS 6 HB2 LYS 6 8.069 0.670 -10.901 36 HB3 LYS 6 HB1 LYS 6 8.063 2.405 -11.189 37 HG2 LYS 6 HG2 LYS 6 10.382 2.364 -11.811 38 HG3 LYS 6 HG1 LYS 6 10.504 0.655 -11.382 39 HD2 LYS 6 HD2 LYS 6 8.904 0.099 -13.140 40 HD3 LYS 6 HD1 LYS 6 8.750 1.807 -13.553 41 HE2 LYS 6 HE2 LYS 6 11.129 1.870 -14.138 42 HE3 LYS 6 HE1 LYS 6 11.269 0.159 -13.736 43 HZ1 LYS 6 HZ1 LYS 6 9.736 -0.369 -15.503 44 HZ2 LYS 6 HZ2 LYS 6 11.019 0.541 -16.126 45 HZ3 LYS 6 HZ3 LYS 6 9.517 1.270 -15.859 46 H TYR 7 HN TYR 7 7.832 0.129 -7.950 47 HA TYR 7 HA TYR 7 10.148 -1.669 -7.720 48 HD1 TYR 7 HD2 TYR 7 11.617 -0.095 -6.375 49 HD2 TYR 7 HD1 TYR 7 7.923 0.718 -4.427 50 HE1 TYR 7 HE2 TYR 7 12.458 2.119 -5.715 51 HE2 TYR 7 HE1 TYR 7 8.754 2.934 -3.764 52 HH TYR 7 HH TYR 7 11.626 4.283 -5.051 53 HB2 TYR 7 HB2 TYR 7 8.192 -1.317 -5.465 54 HB3 TYR 7 HB1 TYR 7 9.834 -1.954 -5.419 55 H GLN 8 HN GLN 8 9.652 -3.907 -7.521 56 HA GLN 8 HA GLN 8 6.895 -4.586 -8.322 57 HB2 GLN 8 HB2 GLN 8 8.508 -4.936 -10.136 58 HB3 GLN 8 HB1 GLN 8 9.471 -5.971 -9.093 59 HG2 GLN 8 HG2 GLN 8 8.316 -7.512 -10.328 60 HG3 GLN 8 HG1 GLN 8 7.287 -7.366 -8.905 61 H VAL 9 HN VAL 9 5.800 -5.813 -6.943 62 HA VAL 9 HA VAL 9 7.008 -6.905 -4.603 63 HB VAL 9 HB VAL 9 4.245 -7.451 -5.702 64 H GLN 10 HN GLN 10 7.713 -8.942 -4.198 65 HA GLN 10 HA GLN 10 7.567 -10.853 -6.417 66 HB2 GLN 10 HB2 GLN 10 9.503 -10.716 -4.105 67 HB3 GLN 10 HB1 GLN 10 9.540 -11.901 -5.399 68 HG2 GLN 10 HG2 GLN 10 9.878 -10.059 -7.016 69 HG3 GLN 10 HG1 GLN 10 9.969 -8.938 -5.658 70 H SER 11 HN SER 11 7.068 -10.537 -2.930 71 HA SER 11 HA SER 11 5.269 -12.794 -2.983 72 HG SER 11 HG SER 11 5.730 -14.862 -1.614 73 HB2 SER 11 HB2 SER 11 7.453 -13.897 -2.685 74 HB3 SER 11 HB1 SER 11 7.753 -12.909 -1.258 75 H GLN 12 HN GLN 12 4.315 -13.207 -0.785 76 HA GLN 12 HA GLN 12 4.412 -10.934 1.035 77 HB2 GLN 12 HB2 GLN 12 2.589 -10.700 -0.839 78 HB3 GLN 12 HB1 GLN 12 1.715 -11.876 0.128 79 HG2 GLN 12 HG2 GLN 12 2.785 -9.330 1.292 80 HG3 GLN 12 HG1 GLN 12 1.200 -9.431 0.531 81 H GLU 13 HN GLU 13 3.452 -11.399 3.124 82 HA GLU 13 HA GLU 13 3.256 -14.296 3.638 83 HB2 GLU 13 HB2 GLU 13 4.140 -12.119 5.536 84 HB3 GLU 13 HB1 GLU 13 4.069 -13.838 5.900 85 HG2 GLU 13 HG2 GLU 13 5.739 -14.219 4.096 86 HG3 GLU 13 HG1 GLU 13 5.883 -12.469 3.928 87 H ASN 14 HN ASN 14 1.536 -15.098 4.720 88 HA ASN 14 HA ASN 14 -0.509 -15.242 5.695 89 HB2 ASN 14 HB2 ASN 14 0.224 -12.474 6.651 90 HB3 ASN 14 HB1 ASN 14 -1.279 -13.271 7.105 91 H PHE 15 HN PHE 15 -2.299 -15.335 4.532 92 HA PHE 15 HA PHE 15 -3.167 -12.925 3.082 93 HD1 PHE 15 HD2 PHE 15 -1.236 -16.563 2.350 94 HD2 PHE 15 HD1 PHE 15 -1.923 -12.920 0.260 95 HE1 PHE 15 HE2 PHE 15 1.072 -16.618 1.501 96 HE2 PHE 15 HE1 PHE 15 0.385 -12.968 -0.591 97 HZ PHE 15 HZ PHE 15 1.862 -14.857 -0.029 98 HB2 PHE 15 HB2 PHE 15 -3.477 -15.718 1.996 99 HB3 PHE 15 HB1 PHE 15 -3.751 -14.198 1.161 100 H GLU 16 HN GLU 16 -4.312 -16.217 3.847 101 HA GLU 16 HA GLU 16 -7.019 -15.776 3.713 102 HB2 GLU 16 HB2 GLU 16 -5.534 -17.602 5.609 103 HB3 GLU 16 HB1 GLU 16 -7.263 -17.675 5.303 104 HG2 GLU 16 HG2 GLU 16 -6.826 -18.182 2.955 105 HG3 GLU 16 HG1 GLU 16 -5.091 -18.111 3.265 106 HA PRO 17 HA PRO 17 -6.982 -14.581 8.473 107 HB2 PRO 17 HB2 PRO 17 -4.365 -13.190 8.531 108 HB3 PRO 17 HB1 PRO 17 -5.129 -14.193 9.765 109 HG2 PRO 17 HG2 PRO 17 -3.065 -15.098 8.326 110 HG3 PRO 17 HG1 PRO 17 -4.402 -16.167 8.797 111 HD2 PRO 17 HD2 PRO 17 -3.811 -14.898 6.162 112 HD3 PRO 17 HD1 PRO 17 -4.475 -16.505 6.522 113 H PHE 18 HN PHE 18 -5.157 -12.588 6.163 114 HA PHE 18 HA PHE 18 -6.122 -10.089 7.022 115 HD1 PHE 18 HD1 PHE 18 -4.407 -7.980 6.428 116 HD2 PHE 18 HD2 PHE 18 -6.169 -9.410 2.829 117 HE1 PHE 18 HE1 PHE 18 -4.700 -5.661 5.658 118 HE2 PHE 18 HE2 PHE 18 -6.466 -7.094 2.050 119 HZ PHE 18 HZ PHE 18 -5.730 -5.216 3.465 120 HB2 PHE 18 HB2 PHE 18 -4.116 -10.333 5.634 121 HB3 PHE 18 HB1 PHE 18 -5.105 -10.913 4.293 122 H MET 19 HN MET 19 -7.196 -12.104 4.251 123 HA MET 19 HA MET 19 -9.274 -10.407 3.408 124 HB2 MET 19 HB2 MET 19 -10.206 -12.442 2.302 125 HB3 MET 19 HB1 MET 19 -8.530 -12.113 1.927 126 HG2 MET 19 HG2 MET 19 -8.343 -14.317 2.287 127 HG3 MET 19 HG1 MET 19 -8.195 -13.797 3.965 128 HE1 MET 19 HE1 MET 19 -10.371 -17.171 3.868 129 HE2 MET 19 HE2 MET 19 -8.880 -16.467 4.493 130 HE3 MET 19 HE3 MET 19 -9.083 -16.701 2.758 131 H LYS 20 HN LYS 20 -9.239 -12.955 5.837 132 HA LYS 20 HA LYS 20 -12.049 -12.993 6.206 133 HB2 LYS 20 HB2 LYS 20 -9.775 -13.880 7.972 134 HB3 LYS 20 HB1 LYS 20 -11.469 -14.174 8.349 135 HG2 LYS 20 HG2 LYS 20 -11.609 -15.369 6.123 136 HG3 LYS 20 HG1 LYS 20 -9.852 -15.270 6.073 137 HD2 LYS 20 HD2 LYS 20 -9.769 -16.434 8.263 138 HD3 LYS 20 HD1 LYS 20 -11.521 -16.633 8.180 139 HE2 LYS 20 HE2 LYS 20 -11.307 -17.945 6.156 140 HE3 LYS 20 HE1 LYS 20 -9.563 -17.675 6.134 141 HZ1 LYS 20 HZ1 LYS 20 -11.096 -19.197 8.174 142 HZ2 LYS 20 HZ2 LYS 20 -9.443 -18.855 8.280 143 HZ3 LYS 20 HZ3 LYS 20 -10.024 -19.835 7.030 144 H ALA 21 HN ALA 21 -9.407 -11.372 7.937 145 HA ALA 21 HA ALA 21 -11.120 -10.136 9.856 146 HB1 ALA 21 HB1 ALA 21 -8.765 -10.596 10.324 147 HB2 ALA 21 HB2 ALA 21 -9.149 -8.887 10.535 148 HB3 ALA 21 HB3 ALA 21 -8.293 -9.427 9.090 149 H MET 22 HN MET 22 -8.980 -8.460 7.592 150 HA MET 22 HA MET 22 -10.152 -5.998 7.612 151 HB2 MET 22 HB2 MET 22 -8.075 -6.215 6.527 152 HB3 MET 22 HB1 MET 22 -8.670 -7.468 5.448 153 HG2 MET 22 HG2 MET 22 -8.342 -5.387 4.257 154 HG3 MET 22 HG1 MET 22 -10.049 -5.827 4.289 155 HE1 MET 22 HE1 MET 22 -7.277 -3.413 5.594 156 HE2 MET 22 HE2 MET 22 -7.788 -4.187 7.093 157 HE3 MET 22 HE3 MET 22 -8.131 -2.479 6.821 158 H GLY 23 HN GLY 23 -11.143 -8.792 5.698 159 HA2 GLY 23 HA2 GLY 23 -13.510 -8.995 5.162 160 HA3 GLY 23 HA1 GLY 23 -13.539 -7.256 4.906 161 H LEU 24 HN LEU 24 -10.717 -8.618 3.704 162 HA LEU 24 HA LEU 24 -11.469 -8.116 0.985 163 HG LEU 24 HG LEU 24 -9.286 -9.662 -0.405 164 HB2 LEU 24 HB2 LEU 24 -9.188 -7.717 1.894 165 HB3 LEU 24 HB1 LEU 24 -8.993 -9.436 2.123 166 HA PRO 25 HA PRO 25 -12.836 -12.262 0.111 167 HB2 PRO 25 HB2 PRO 25 -12.340 -11.862 -2.718 168 HB3 PRO 25 HB1 PRO 25 -13.881 -11.860 -1.857 169 HG2 PRO 25 HG2 PRO 25 -12.829 -9.622 -2.968 170 HG3 PRO 25 HG1 PRO 25 -13.836 -9.588 -1.510 171 HD2 PRO 25 HD2 PRO 25 -10.847 -9.511 -1.734 172 HD3 PRO 25 HD1 PRO 25 -11.928 -8.490 -0.758 173 H GLU 26 HN GLU 26 -11.756 -14.113 0.337 174 HA GLU 26 HA GLU 26 -9.065 -14.506 0.009 175 HB2 GLU 26 HB2 GLU 26 -9.555 -16.863 0.215 176 HB3 GLU 26 HB1 GLU 26 -10.581 -15.953 1.302 177 HG2 GLU 26 HG2 GLU 26 -12.404 -16.125 -0.370 178 HG3 GLU 26 HG1 GLU 26 -11.362 -17.170 -1.334 179 H ASP 27 HN ASP 27 -11.652 -14.848 -2.341 180 HA ASP 27 HA ASP 27 -10.267 -16.289 -4.308 181 HB2 ASP 27 HB2 ASP 27 -12.476 -14.240 -4.587 182 HB3 ASP 27 HB1 ASP 27 -11.913 -15.273 -5.898 183 H LEU 28 HN LEU 28 -10.609 -12.798 -3.799 184 HA LEU 28 HA LEU 28 -9.049 -11.995 -6.000 185 HG LEU 28 HG LEU 28 -10.319 -9.935 -6.364 186 HB2 LEU 28 HB2 LEU 28 -9.931 -10.685 -3.461 187 HB3 LEU 28 HB1 LEU 28 -8.729 -9.890 -4.461 188 H ILE 29 HN ILE 29 -8.243 -12.859 -2.695 189 HA ILE 29 HA ILE 29 -5.611 -11.953 -2.578 190 HB ILE 29 HB ILE 29 -7.123 -14.115 -1.201 191 H GLN 30 HN GLN 30 -6.855 -15.106 -3.628 192 HA GLN 30 HA GLN 30 -4.390 -16.294 -4.204 193 HB2 GLN 30 HB2 GLN 30 -7.038 -16.834 -5.551 194 HB3 GLN 30 HB1 GLN 30 -5.664 -17.920 -5.469 195 HG2 GLN 30 HG2 GLN 30 -7.165 -16.932 -3.088 196 HG3 GLN 30 HG1 GLN 30 -7.471 -18.473 -3.885 197 H LYS 31 HN LYS 31 -6.561 -14.406 -6.275 198 HA LYS 31 HA LYS 31 -5.030 -14.742 -8.640 199 HB2 LYS 31 HB2 LYS 31 -7.240 -12.917 -7.791 200 HB3 LYS 31 HB1 LYS 31 -6.343 -12.539 -9.256 201 HG2 LYS 31 HG2 LYS 31 -8.260 -13.768 -9.902 202 HG3 LYS 31 HG1 LYS 31 -6.876 -14.850 -10.067 203 HD2 LYS 31 HD2 LYS 31 -7.423 -15.845 -7.882 204 HD3 LYS 31 HD1 LYS 31 -8.830 -14.788 -7.769 205 HE2 LYS 31 HE2 LYS 31 -9.771 -15.802 -9.774 206 HE3 LYS 31 HE1 LYS 31 -8.353 -16.838 -9.928 207 HZ1 LYS 31 HZ1 LYS 31 -10.291 -16.866 -7.677 208 HZ2 LYS 31 HZ2 LYS 31 -8.916 -17.844 -7.794 209 HZ3 LYS 31 HZ3 LYS 31 -10.178 -18.025 -8.905 210 H GLY 32 HN GLY 32 -4.900 -12.473 -5.984 211 HA2 GLY 32 HA2 GLY 32 -3.154 -10.628 -7.347 212 HA3 GLY 32 HA1 GLY 32 -3.612 -10.575 -5.654 213 H LYS 33 HN LYS 33 -2.728 -13.312 -5.110 214 HA LYS 33 HA LYS 33 0.025 -12.697 -4.578 215 HB2 LYS 33 HB2 LYS 33 0.071 -14.815 -3.377 216 HB3 LYS 33 HB1 LYS 33 -1.360 -13.898 -2.936 217 HG2 LYS 33 HG2 LYS 33 -2.629 -15.279 -4.600 218 HG3 LYS 33 HG1 LYS 33 -1.197 -16.306 -4.708 219 HD2 LYS 33 HD2 LYS 33 -2.353 -15.632 -2.037 220 HD3 LYS 33 HD1 LYS 33 -3.092 -16.887 -3.022 221 HE2 LYS 33 HE2 LYS 33 -0.985 -18.093 -3.115 222 HE3 LYS 33 HE1 LYS 33 -0.194 -16.806 -2.206 223 HZ1 LYS 33 HZ1 LYS 33 -1.632 -17.299 -0.328 224 HZ2 LYS 33 HZ2 LYS 33 -0.758 -18.672 -0.786 225 HZ3 LYS 33 HZ3 LYS 33 -2.392 -18.534 -1.201 226 H ASP 34 HN ASP 34 -1.702 -14.574 -6.935 227 HA ASP 34 HA ASP 34 0.523 -16.165 -7.762 228 HB2 ASP 34 HB2 ASP 34 -1.809 -16.869 -8.143 229 HB3 ASP 34 HB1 ASP 34 -2.033 -15.513 -9.245 230 H ILE 35 HN ILE 35 -0.622 -12.983 -8.501 231 HA ILE 35 HA ILE 35 1.346 -12.773 -10.686 232 HB ILE 35 HB ILE 35 -1.013 -10.953 -10.197 233 H LYS 36 HN LYS 36 3.094 -11.589 -10.315 234 HA LYS 36 HA LYS 36 3.615 -10.303 -7.879 235 HB2 LYS 36 HB2 LYS 36 5.566 -9.284 -9.170 236 HB3 LYS 36 HB1 LYS 36 5.482 -11.039 -9.112 237 HG2 LYS 36 HG2 LYS 36 4.450 -11.024 -11.359 238 HG3 LYS 36 HG1 LYS 36 4.674 -9.273 -11.413 239 HD2 LYS 36 HD2 LYS 36 7.081 -9.554 -11.217 240 HD3 LYS 36 HD1 LYS 36 6.885 -11.303 -11.082 241 HE2 LYS 36 HE2 LYS 36 5.897 -11.346 -13.335 242 HE3 LYS 36 HE1 LYS 36 6.151 -9.606 -13.466 243 HZ1 LYS 36 HZ1 LYS 36 8.528 -9.970 -13.266 244 HZ2 LYS 36 HZ2 LYS 36 7.907 -10.854 -14.567 245 HZ3 LYS 36 HZ3 LYS 36 8.289 -11.639 -13.119 246 H GLY 37 HN GLY 37 2.577 -8.563 -7.153 247 HA2 GLY 37 HA2 GLY 37 1.256 -6.682 -8.819 248 HA3 GLY 37 HA1 GLY 37 1.541 -6.509 -7.094 249 H VAL 38 HN VAL 38 1.662 -4.251 -8.445 250 HA VAL 38 HA VAL 38 4.543 -3.671 -8.571 251 HB VAL 38 HB VAL 38 3.364 -3.801 -10.868 252 H SER 39 HN SER 39 5.182 -1.726 -7.713 253 HA SER 39 HA SER 39 3.105 0.091 -6.715 254 HG SER 39 HG SER 39 5.818 -1.536 -4.174 255 HB2 SER 39 HB2 SER 39 4.313 0.302 -4.564 256 HB3 SER 39 HB1 SER 39 3.726 -1.340 -4.829 257 H GLU 40 HN GLU 40 3.508 2.117 -7.344 258 HA GLU 40 HA GLU 40 6.310 2.904 -7.807 259 HB2 GLU 40 HB2 GLU 40 5.000 2.548 -9.926 260 HB3 GLU 40 HB1 GLU 40 3.942 3.858 -9.422 261 HG2 GLU 40 HG2 GLU 40 5.728 5.430 -9.529 262 HG3 GLU 40 HG1 GLU 40 6.903 4.153 -9.835 263 H ILE 41 HN ILE 41 6.912 4.969 -7.178 264 HA ILE 41 HA ILE 41 4.853 6.542 -5.767 265 HB ILE 41 HB ILE 41 7.717 6.332 -4.847 266 H VAL 42 HN VAL 42 4.631 8.487 -6.636 267 HA VAL 42 HA VAL 42 6.933 9.704 -8.013 268 HB VAL 42 HB VAL 42 4.024 10.458 -8.321 269 H HIS 43 HN HIS 43 7.951 11.205 -6.833 270 HA HIS 43 HA HIS 43 6.409 12.703 -4.830 271 HD1 HIS 43 HD1 HIS 43 10.540 14.320 -4.708 272 HD2 HIS 43 HD2 HIS 43 7.469 13.643 -1.991 273 HE1 HIS 43 HE1 HIS 43 10.768 16.124 -2.972 274 HE2 HIS 43 HE2 HIS 43 8.902 15.695 -1.335 275 HB2 HIS 43 HB2 HIS 43 8.272 11.574 -3.852 276 HB3 HIS 43 HB1 HIS 43 9.363 12.139 -5.111 277 H GLU 44 HN GLU 44 5.732 14.640 -5.432 278 HA GLU 44 HA GLU 44 7.548 16.383 -6.939 279 HB2 GLU 44 HB2 GLU 44 4.675 15.810 -7.664 280 HB3 GLU 44 HB1 GLU 44 5.587 17.171 -8.304 281 HG2 GLU 44 HG2 GLU 44 6.411 14.297 -8.622 282 HG3 GLU 44 HG1 GLU 44 5.467 15.194 -9.810 283 H GLY 45 HN GLY 45 7.927 17.903 -5.431 284 HA2 GLY 45 HA2 GLY 45 7.562 19.565 -3.889 285 HA3 GLY 45 HA1 GLY 45 6.169 19.944 -4.886 286 H LYS 46 HN LYS 46 7.079 17.453 -2.500 287 HA LYS 46 HA LYS 46 6.068 16.711 -0.610 288 HB2 LYS 46 HB2 LYS 46 4.164 19.033 -0.801 289 HB3 LYS 46 HB1 LYS 46 4.600 18.117 0.628 290 HG2 LYS 46 HG2 LYS 46 6.892 18.985 0.463 291 HG3 LYS 46 HG1 LYS 46 6.391 19.970 -0.914 292 HD2 LYS 46 HD2 LYS 46 4.723 21.084 0.516 293 HD3 LYS 46 HD1 LYS 46 5.285 20.128 1.890 294 HE2 LYS 46 HE2 LYS 46 7.025 21.983 0.282 295 HE3 LYS 46 HE1 LYS 46 6.231 22.432 1.790 296 HZ1 LYS 46 HZ1 LYS 46 7.460 20.672 2.909 297 HZ2 LYS 46 HZ2 LYS 46 8.517 21.765 2.168 298 HZ3 LYS 46 HZ3 LYS 46 8.227 20.257 1.460 299 H LYS 47 HN LYS 47 4.258 17.279 -3.469 300 HA LYS 47 HA LYS 47 1.973 15.735 -2.537 301 HB2 LYS 47 HB2 LYS 47 2.593 17.296 -5.016 302 HB3 LYS 47 HB1 LYS 47 1.330 16.074 -5.064 303 HG2 LYS 47 HG2 LYS 47 0.287 18.158 -4.628 304 HG3 LYS 47 HG1 LYS 47 0.255 17.234 -3.127 305 HD2 LYS 47 HD2 LYS 47 2.026 18.500 -2.204 306 HD3 LYS 47 HD1 LYS 47 2.381 19.267 -3.753 307 HE2 LYS 47 HE2 LYS 47 1.187 20.793 -2.270 308 HE3 LYS 47 HE1 LYS 47 0.216 20.398 -3.688 309 HZ1 LYS 47 HZ1 LYS 47 -0.991 18.777 -2.343 310 HZ2 LYS 47 HZ2 LYS 47 -1.120 20.333 -1.695 311 HZ3 LYS 47 HZ3 LYS 47 -0.079 19.206 -0.984 312 H VAL 48 HN VAL 48 2.269 13.612 -2.430 313 HA VAL 48 HA VAL 48 3.869 12.301 -4.515 314 HB VAL 48 HB VAL 48 3.069 11.236 -1.810 315 H LYS 49 HN LYS 49 3.073 10.663 -5.732 316 HA LYS 49 HA LYS 49 0.222 9.992 -5.396 317 HB2 LYS 49 HB2 LYS 49 1.823 10.152 -7.957 318 HB3 LYS 49 HB1 LYS 49 0.133 9.682 -7.838 319 HG2 LYS 49 HG2 LYS 49 -0.445 11.899 -7.020 320 HG3 LYS 49 HG1 LYS 49 1.254 12.375 -7.087 321 HD2 LYS 49 HD2 LYS 49 -0.357 11.465 -9.469 322 HD3 LYS 49 HD1 LYS 49 -0.091 13.153 -9.034 323 HE2 LYS 49 HE2 LYS 49 2.051 11.134 -9.702 324 HE3 LYS 49 HE1 LYS 49 1.469 12.411 -10.770 325 HZ1 LYS 49 HZ1 LYS 49 3.513 13.073 -9.705 326 HZ2 LYS 49 HZ2 LYS 49 2.854 12.799 -8.171 327 HZ3 LYS 49 HZ3 LYS 49 2.245 14.043 -9.140 328 H LEU 50 HN LEU 50 -0.243 7.901 -5.101 329 HA LEU 50 HA LEU 50 1.917 5.945 -5.496 330 HG LEU 50 HG LEU 50 1.025 4.180 -2.407 331 HB2 LEU 50 HB2 LEU 50 0.550 6.435 -3.241 332 HB3 LEU 50 HB1 LEU 50 -0.512 5.236 -3.950 333 H THR 51 HN THR 51 1.724 4.398 -6.985 334 HA THR 51 HA THR 51 -0.952 3.853 -8.097 335 HB THR 51 HB THR 51 1.624 3.858 -9.676 336 HG1 THR 51 HG1 THR 51 -0.387 5.713 -10.205 337 H ILE 52 HN ILE 52 -1.546 1.792 -7.990 338 HA ILE 52 HA ILE 52 0.525 -0.293 -7.895 339 HB ILE 52 HB ILE 52 -1.976 -0.295 -6.202 340 H THR 53 HN THR 53 0.113 -2.088 -9.115 341 HA THR 53 HA THR 53 -2.505 -2.180 -10.470 342 HB THR 53 HB THR 53 0.158 -3.096 -11.580 343 HG1 THR 53 HG1 THR 53 0.188 -1.222 -12.668 344 H TYR 54 HN TYR 54 -3.667 -3.979 -10.274 345 HA TYR 54 HA TYR 54 -2.327 -6.412 -9.294 346 HD1 TYR 54 HD2 TYR 54 -2.241 -7.141 -6.918 347 HD2 TYR 54 HD1 TYR 54 -4.760 -3.711 -6.941 348 HE1 TYR 54 HE2 TYR 54 -1.208 -6.374 -4.821 349 HE2 TYR 54 HE1 TYR 54 -3.733 -2.935 -4.847 350 HH TYR 54 HH TYR 54 -2.518 -3.876 -2.932 351 HB2 TYR 54 HB2 TYR 54 -5.050 -5.317 -8.578 352 HB3 TYR 54 HB1 TYR 54 -4.555 -6.965 -8.219 353 H GLY 55 HN GLY 55 -2.215 -7.785 -10.959 354 HA2 GLY 55 HA2 GLY 55 -2.914 -9.188 -12.643 355 HA3 GLY 55 HA1 GLY 55 -4.567 -8.803 -12.187 356 H SER 56 HN SER 56 -5.558 -6.913 -13.100 357 HA SER 56 HA SER 56 -4.195 -5.715 -15.392 358 HG SER 56 HG SER 56 -6.801 -6.373 -17.740 359 HB2 SER 56 HB2 SER 56 -5.451 -7.669 -16.264 360 HB3 SER 56 HB1 SER 56 -6.937 -6.982 -15.608 361 H LYS 57 HN LYS 57 -5.337 -4.995 -12.643 362 HA LYS 57 HA LYS 57 -7.103 -2.808 -13.515 363 HB2 LYS 57 HB2 LYS 57 -8.165 -4.291 -11.910 364 HB3 LYS 57 HB1 LYS 57 -6.820 -4.081 -10.795 365 HG2 LYS 57 HG2 LYS 57 -7.364 -1.695 -10.597 366 HG3 LYS 57 HG1 LYS 57 -8.734 -1.933 -11.686 367 HD2 LYS 57 HD2 LYS 57 -8.420 -3.533 -9.175 368 HD3 LYS 57 HD1 LYS 57 -9.195 -1.948 -9.166 369 HE2 LYS 57 HE2 LYS 57 -10.841 -2.728 -10.777 370 HE3 LYS 57 HE1 LYS 57 -10.039 -4.295 -10.866 371 HZ1 LYS 57 HZ1 LYS 57 -10.580 -4.693 -8.567 372 HZ2 LYS 57 HZ2 LYS 57 -11.995 -4.318 -9.414 373 HZ3 LYS 57 HZ3 LYS 57 -11.276 -3.159 -8.416 374 H VAL 58 HN VAL 58 -6.550 -0.737 -13.140 375 HA VAL 58 HA VAL 58 -3.926 -0.273 -11.900 376 HB VAL 58 HB VAL 58 -5.499 1.547 -13.732 377 H ILE 59 HN ILE 59 -3.818 0.729 -10.002 378 HA ILE 59 HA ILE 59 -6.180 2.232 -9.079 379 HB ILE 59 HB ILE 59 -4.242 0.625 -7.407 380 H HIS 60 HN HIS 60 -5.789 4.330 -8.986 381 HA HIS 60 HA HIS 60 -3.077 5.226 -8.253 382 HD1 HIS 60 HD1 HIS 60 -5.885 8.441 -9.464 383 HD2 HIS 60 HD2 HIS 60 -5.887 4.931 -11.689 384 HE1 HIS 60 HE1 HIS 60 -8.085 8.418 -10.679 385 HE2 HIS 60 HE2 HIS 60 -8.014 6.343 -12.107 386 HB2 HIS 60 HB2 HIS 60 -3.598 7.294 -9.581 387 HB3 HIS 60 HB1 HIS 60 -3.469 5.823 -10.539 388 H ASN 61 HN ASN 61 -2.844 6.866 -6.783 389 HA ASN 61 HA ASN 61 -5.193 8.210 -5.723 390 HB2 ASN 61 HB2 ASN 61 -3.490 6.321 -4.106 391 HB3 ASN 61 HB1 ASN 61 -4.418 7.612 -3.349 392 H GLU 62 HN GLU 62 -4.712 10.105 -4.548 393 HA GLU 62 HA GLU 62 -1.891 10.948 -4.669 394 HB2 GLU 62 HB2 GLU 62 -4.299 12.695 -5.216 395 HB3 GLU 62 HB1 GLU 62 -2.613 13.192 -5.286 396 HG2 GLU 62 HG2 GLU 62 -2.239 11.647 -7.145 397 HG3 GLU 62 HG1 GLU 62 -3.934 11.169 -7.080 398 H PHE 63 HN PHE 63 -1.076 11.889 -2.883 399 HA PHE 63 HA PHE 63 -2.847 12.980 -0.856 400 HD1 PHE 63 HD2 PHE 63 0.826 11.253 0.181 401 HD2 PHE 63 HD1 PHE 63 -2.403 8.886 -1.262 402 HE1 PHE 63 HE2 PHE 63 2.418 9.510 -0.510 403 HE2 PHE 63 HE1 PHE 63 -0.816 7.138 -1.954 404 HZ PHE 63 HZ PHE 63 1.598 7.448 -1.579 405 HB2 PHE 63 HB2 PHE 63 -1.573 11.598 0.910 406 HB3 PHE 63 HB1 PHE 63 -2.848 10.801 -0.008 407 H THR 64 HN THR 64 -1.809 14.318 0.676 408 HA THR 64 HA THR 64 0.853 15.223 -0.194 409 HB THR 64 HB THR 64 -1.229 16.757 1.376 410 HG1 THR 64 HG1 THR 64 -0.606 16.581 -1.362 411 H LEU 65 HN LEU 65 2.536 15.116 1.152 412 HA LEU 65 HA LEU 65 2.459 13.609 3.497 413 HG LEU 65 HG LEU 65 4.165 16.295 1.610 414 HB2 LEU 65 HB2 LEU 65 4.763 14.417 3.879 415 HB3 LEU 65 HB1 LEU 65 4.498 13.817 2.256 416 H GLY 66 HN GLY 66 2.996 14.254 5.688 417 HA2 GLY 66 HA2 GLY 66 2.395 15.383 7.598 418 HA3 GLY 66 HA1 GLY 66 3.065 16.771 6.759 419 H GLU 67 HN GLU 67 0.201 14.984 5.754 420 HA GLU 67 HA GLU 67 -1.635 16.861 6.906 421 HB2 GLU 67 HB2 GLU 67 -0.698 18.127 4.959 422 HB3 GLU 67 HB1 GLU 67 -1.338 16.879 3.900 423 HG2 GLU 67 HG2 GLU 67 -2.799 18.811 3.955 424 HG3 GLU 67 HG1 GLU 67 -3.599 17.396 4.638 425 H GLU 68 HN GLU 68 -3.729 16.127 6.884 426 HA GLU 68 HA GLU 68 -4.105 13.345 6.300 427 HB2 GLU 68 HB2 GLU 68 -5.145 14.512 8.243 428 HB3 GLU 68 HB1 GLU 68 -6.150 15.418 7.123 429 HG2 GLU 68 HG2 GLU 68 -7.185 13.354 6.356 430 HG3 GLU 68 HG1 GLU 68 -6.161 12.426 7.453 431 H CYS 69 HN CYS 69 -4.658 12.536 4.382 432 HA CYS 69 HA CYS 69 -6.205 14.236 2.539 433 HG CYS 69 HG CYS 69 -6.549 13.037 -0.052 434 HB2 CYS 69 HB2 CYS 69 -3.847 13.759 1.812 435 HB3 CYS 69 HB1 CYS 69 -4.275 12.053 1.744 436 H GLU 70 HN GLU 70 -7.668 13.114 1.097 437 HA GLU 70 HA GLU 70 -8.752 10.688 2.354 438 HB2 GLU 70 HB2 GLU 70 -10.239 12.669 2.323 439 HB3 GLU 70 HB1 GLU 70 -10.157 12.675 0.567 440 HG2 GLU 70 HG2 GLU 70 -11.250 10.531 0.463 441 HG3 GLU 70 HG1 GLU 70 -11.236 10.407 2.222 442 H LEU 71 HN LEU 71 -8.488 8.845 1.313 443 HA LEU 71 HA LEU 71 -8.206 8.897 -1.620 444 HG LEU 71 HG LEU 71 -7.716 6.199 0.861 445 HB2 LEU 71 HB2 LEU 71 -6.758 6.946 -1.451 446 HB3 LEU 71 HB1 LEU 71 -6.103 8.297 -0.548 447 H GLU 72 HN GLU 72 -9.196 7.277 -2.815 448 HA GLU 72 HA GLU 72 -11.550 6.161 -1.559 449 HB2 GLU 72 HB2 GLU 72 -11.380 7.248 -3.906 450 HB3 GLU 72 HB1 GLU 72 -10.739 5.692 -4.413 451 HG2 GLU 72 HG2 GLU 72 -12.784 4.605 -3.592 452 HG3 GLU 72 HG1 GLU 72 -13.420 6.190 -3.151 453 H THR 73 HN THR 73 -11.849 4.103 -0.973 454 HA THR 73 HA THR 73 -9.610 2.258 -1.284 455 HB THR 73 HB THR 73 -10.775 0.858 0.368 456 HG1 THR 73 HG1 THR 73 -12.626 2.500 1.279 457 H MET 74 HN MET 74 -10.432 -0.157 -1.407 458 HA MET 74 HA MET 74 -11.495 -0.493 -4.009 459 HB2 MET 74 HB2 MET 74 -11.386 -2.893 -3.529 460 HB3 MET 74 HB1 MET 74 -9.909 -2.079 -3.033 461 HG2 MET 74 HG2 MET 74 -10.770 -2.048 -0.709 462 HG3 MET 74 HG1 MET 74 -12.155 -2.993 -1.253 463 HE1 MET 74 HE1 MET 74 -7.796 -4.503 -1.352 464 HE2 MET 74 HE2 MET 74 -8.277 -2.944 -0.680 465 HE3 MET 74 HE3 MET 74 -8.406 -3.234 -2.415 466 H THR 75 HN THR 75 -12.905 -0.416 -0.846 467 HA THR 75 HA THR 75 -15.378 -1.680 -1.598 468 HB THR 75 HB THR 75 -16.157 -1.154 0.607 469 HG1 THR 75 HG1 THR 75 -14.685 1.008 0.345 470 H GLY 76 HN GLY 76 -14.074 1.279 -2.300 471 HA2 GLY 76 HA2 GLY 76 -15.114 2.996 -3.498 472 HA3 GLY 76 HA1 GLY 76 -16.678 2.335 -3.044 473 H GLU 77 HN GLU 77 -15.394 2.291 -0.191 474 HA GLU 77 HA GLU 77 -16.584 4.758 0.643 475 HB2 GLU 77 HB2 GLU 77 -16.743 2.737 2.020 476 HB3 GLU 77 HB1 GLU 77 -14.995 2.713 2.205 477 HG2 GLU 77 HG2 GLU 77 -15.055 4.775 3.449 478 HG3 GLU 77 HG1 GLU 77 -16.789 4.925 3.174 479 H LYS 78 HN LYS 78 -15.617 6.605 1.372 480 HA LYS 78 HA LYS 78 -12.829 6.968 0.616 481 HB2 LYS 78 HB2 LYS 78 -14.832 9.005 1.599 482 HB3 LYS 78 HB1 LYS 78 -13.264 9.349 0.888 483 HG2 LYS 78 HG2 LYS 78 -15.538 7.988 -0.541 484 HG3 LYS 78 HG1 LYS 78 -15.139 9.700 -0.672 485 HD2 LYS 78 HD2 LYS 78 -13.277 7.435 -1.391 486 HD3 LYS 78 HD1 LYS 78 -14.257 8.341 -2.547 487 HE2 LYS 78 HE2 LYS 78 -12.097 9.465 -0.763 488 HE3 LYS 78 HE1 LYS 78 -11.974 9.184 -2.500 489 HZ1 LYS 78 HZ1 LYS 78 -13.740 10.805 -2.845 490 HZ2 LYS 78 HZ2 LYS 78 -12.434 11.499 -2.024 491 HZ3 LYS 78 HZ3 LYS 78 -13.838 11.083 -1.178 492 H VAL 79 HN VAL 79 -11.206 6.969 2.023 493 HA VAL 79 HA VAL 79 -11.818 7.383 4.878 494 HB VAL 79 HB VAL 79 -9.959 5.854 5.417 495 H LYS 80 HN LYS 80 -10.317 8.533 6.115 496 HA LYS 80 HA LYS 80 -8.426 10.139 4.538 497 HB2 LYS 80 HB2 LYS 80 -9.638 10.734 7.243 498 HB3 LYS 80 HB1 LYS 80 -8.587 11.805 6.324 499 HG2 LYS 80 HG2 LYS 80 -10.258 12.005 4.585 500 HG3 LYS 80 HG1 LYS 80 -11.304 10.862 5.430 501 HD2 LYS 80 HD2 LYS 80 -11.395 12.424 7.349 502 HD3 LYS 80 HD1 LYS 80 -10.429 13.575 6.422 503 HE2 LYS 80 HE2 LYS 80 -12.169 13.696 4.727 504 HE3 LYS 80 HE1 LYS 80 -13.126 12.502 5.600 505 HZ1 LYS 80 HZ1 LYS 80 -13.896 14.754 6.026 506 HZ2 LYS 80 HZ2 LYS 80 -12.373 15.189 6.618 507 HZ3 LYS 80 HZ3 LYS 80 -13.307 14.048 7.445 508 H ALA 81 HN ALA 81 -6.290 10.189 5.030 509 HA ALA 81 HA ALA 81 -5.353 8.981 7.515 510 HB1 ALA 81 HB1 ALA 81 -4.398 8.003 4.828 511 HB2 ALA 81 HB2 ALA 81 -5.494 7.129 5.900 512 HB3 ALA 81 HB3 ALA 81 -3.837 7.457 6.409 513 H VAL 82 HN VAL 82 -3.390 9.725 8.210 514 HA VAL 82 HA VAL 82 -2.266 11.980 6.717 515 HB VAL 82 HB VAL 82 -1.771 11.148 9.583 516 H VAL 83 HN VAL 83 -0.562 11.551 5.475 517 HA VAL 83 HA VAL 83 1.252 9.375 6.268 518 HB VAL 83 HB VAL 83 0.335 8.957 4.100 519 H LYS 84 HN LYS 84 3.177 9.885 7.020 520 HA LYS 84 HA LYS 84 4.456 12.390 6.164 521 HB2 LYS 84 HB2 LYS 84 4.544 11.384 9.005 522 HB3 LYS 84 HB1 LYS 84 5.127 12.925 8.393 523 HG2 LYS 84 HG2 LYS 84 2.909 13.716 8.042 524 HG3 LYS 84 HG1 LYS 84 2.228 12.124 8.379 525 HD2 LYS 84 HD2 LYS 84 1.925 13.540 10.307 526 HD3 LYS 84 HD1 LYS 84 3.107 12.287 10.691 527 HE2 LYS 84 HE2 LYS 84 3.821 14.456 11.546 528 HE3 LYS 84 HE1 LYS 84 4.922 13.874 10.299 529 HZ1 LYS 84 HZ1 LYS 84 2.774 15.889 9.916 530 HZ2 LYS 84 HZ2 LYS 84 3.808 15.320 8.705 531 HZ3 LYS 84 HZ3 LYS 84 4.433 16.212 10.000 532 H MET 85 HN MET 85 6.749 12.366 6.233 533 HA MET 85 HA MET 85 7.854 9.673 6.043 534 HB2 MET 85 HB2 MET 85 9.824 10.811 5.036 535 HB3 MET 85 HB1 MET 85 8.327 11.116 4.166 536 HG2 MET 85 HG2 MET 85 8.143 13.300 5.247 537 HG3 MET 85 HG1 MET 85 9.643 12.993 6.118 538 HE1 MET 85 HE1 MET 85 10.586 15.287 5.255 539 HE2 MET 85 HE2 MET 85 9.139 15.619 4.302 540 HE3 MET 85 HE3 MET 85 10.733 15.731 3.554 541 H GLU 86 HN GLU 86 9.422 8.878 7.366 542 HA GLU 86 HA GLU 86 10.014 10.478 9.749 543 HB2 GLU 86 HB2 GLU 86 8.966 8.231 10.037 544 HB3 GLU 86 HB1 GLU 86 10.402 7.511 9.328 545 HG2 GLU 86 HG2 GLU 86 10.477 7.337 11.730 546 HG3 GLU 86 HG1 GLU 86 11.754 8.409 11.160 547 H GLY 87 HN GLY 87 11.403 9.465 6.870 548 HA2 GLY 87 HA2 GLY 87 13.556 10.518 6.343 549 HA3 GLY 87 HA1 GLY 87 14.096 10.035 7.942 550 H ASP 88 HN ASP 88 14.046 9.248 4.685 551 HA ASP 88 HA ASP 88 14.789 7.508 3.448 552 HB2 ASP 88 HB2 ASP 88 16.263 6.513 5.870 553 HB3 ASP 88 HB1 ASP 88 16.779 6.523 4.184 554 H ASN 89 HN ASN 89 15.674 5.044 5.008 555 HA ASN 89 HA ASN 89 13.769 3.238 4.512 556 HB2 ASN 89 HB2 ASN 89 14.840 1.784 6.137 557 HB3 ASN 89 HB1 ASN 89 16.043 2.710 5.248 558 H LYS 90 HN LYS 90 13.077 5.748 6.568 559 HA LYS 90 HA LYS 90 11.061 4.083 7.906 560 HB2 LYS 90 HB2 LYS 90 12.572 6.396 9.114 561 HB3 LYS 90 HB1 LYS 90 11.269 5.519 9.897 562 HG2 LYS 90 HG2 LYS 90 13.960 4.445 9.126 563 HG3 LYS 90 HG1 LYS 90 13.325 4.731 10.743 564 HD2 LYS 90 HD2 LYS 90 11.503 3.059 10.152 565 HD3 LYS 90 HD1 LYS 90 12.512 2.645 8.766 566 HE2 LYS 90 HE2 LYS 90 14.374 2.145 10.306 567 HE3 LYS 90 HE1 LYS 90 13.300 2.470 11.666 568 HZ1 LYS 90 HZ1 LYS 90 11.883 0.655 10.937 569 HZ2 LYS 90 HZ2 LYS 90 13.459 0.106 11.207 570 HZ3 LYS 90 HZ3 LYS 90 12.908 0.347 9.627 571 H MET 91 HN MET 91 9.086 4.612 7.461 572 HA MET 91 HA MET 91 8.319 7.422 7.154 573 HB2 MET 91 HB2 MET 91 7.640 5.178 5.246 574 HB3 MET 91 HB1 MET 91 6.764 6.702 5.291 575 HG2 MET 91 HG2 MET 91 8.869 7.886 4.794 576 HG3 MET 91 HG1 MET 91 9.681 6.327 4.657 577 HE1 MET 91 HE1 MET 91 6.324 7.750 1.823 578 HE2 MET 91 HE2 MET 91 6.982 8.730 3.134 579 HE3 MET 91 HE3 MET 91 6.036 7.287 3.500 580 H VAL 92 HN VAL 92 6.508 7.894 8.307 581 HA VAL 92 HA VAL 92 5.033 5.599 9.422 582 HB VAL 92 HB VAL 92 5.314 8.356 10.616 583 H THR 93 HN THR 93 3.090 5.310 8.659 584 HA THR 93 HA THR 93 1.369 7.627 8.121 585 HB THR 93 HB THR 93 1.967 6.995 5.919 586 HG1 THR 93 HG1 THR 93 -0.367 5.444 6.191 587 H THR 94 HN THR 94 -0.590 7.454 9.075 588 HA THR 94 HA THR 94 -1.421 4.774 9.979 589 HB THR 94 HB THR 94 -2.607 6.159 11.864 590 HG1 THR 94 HG1 THR 94 -1.804 8.109 12.224 591 H PHE 95 HN PHE 95 -3.364 4.137 9.393 592 HA PHE 95 HA PHE 95 -5.421 6.125 8.759 593 HD1 PHE 95 HD1 PHE 95 -2.733 3.427 7.282 594 HD2 PHE 95 HD2 PHE 95 -6.842 2.879 6.322 595 HE1 PHE 95 HE1 PHE 95 -2.298 1.055 6.783 596 HE2 PHE 95 HE2 PHE 95 -6.415 0.508 5.823 597 HZ PHE 95 HZ PHE 95 -4.141 -0.406 6.054 598 HB2 PHE 95 HB2 PHE 95 -6.049 5.013 6.721 599 HB3 PHE 95 HB1 PHE 95 -4.324 5.348 6.639 600 H LYS 96 HN LYS 96 -7.236 5.699 9.841 601 HA LYS 96 HA LYS 96 -8.755 4.628 11.163 602 HB2 LYS 96 HB2 LYS 96 -8.083 2.190 9.505 603 HB3 LYS 96 HB1 LYS 96 -9.584 2.514 10.362 604 HG2 LYS 96 HG2 LYS 96 -10.039 4.386 8.856 605 HG3 LYS 96 HG1 LYS 96 -8.538 4.052 7.992 606 HD2 LYS 96 HD2 LYS 96 -10.264 3.055 6.721 607 HD3 LYS 96 HD1 LYS 96 -9.458 1.732 7.563 608 HE2 LYS 96 HE2 LYS 96 -11.864 1.448 7.665 609 HE3 LYS 96 HE1 LYS 96 -11.222 1.769 9.275 610 HZ1 LYS 96 HZ1 LYS 96 -12.529 3.764 7.504 611 HZ2 LYS 96 HZ2 LYS 96 -11.914 4.073 9.049 612 HZ3 LYS 96 HZ3 LYS 96 -13.234 3.033 8.858 613 H GLY 97 HN GLY 97 -8.724 1.775 11.876 614 HA2 GLY 97 HA2 GLY 97 -6.865 1.985 14.079 615 HA3 GLY 97 HA1 GLY 97 -8.018 0.687 13.806 616 H ILE 98 HN ILE 98 -6.119 1.365 11.080 617 HA ILE 98 HA ILE 98 -4.511 -1.036 11.594 618 HB ILE 98 HB ILE 98 -4.897 0.354 8.946 619 H LYS 99 HN LYS 99 -2.335 -0.950 11.741 620 HA LYS 99 HA LYS 99 -1.076 1.686 11.477 621 HB2 LYS 99 HB2 LYS 99 -0.898 0.263 13.610 622 HB3 LYS 99 HB1 LYS 99 0.196 -0.760 12.684 623 HG2 LYS 99 HG2 LYS 99 1.725 1.062 12.362 624 HG3 LYS 99 HG1 LYS 99 0.599 2.190 13.121 625 HD2 LYS 99 HD2 LYS 99 2.296 1.616 14.718 626 HD3 LYS 99 HD1 LYS 99 0.779 0.865 15.218 627 HE2 LYS 99 HE2 LYS 99 1.510 -1.259 14.254 628 HE3 LYS 99 HE1 LYS 99 3.019 -0.508 13.735 629 HZ1 LYS 99 HZ1 LYS 99 3.301 -1.747 15.790 630 HZ2 LYS 99 HZ2 LYS 99 2.117 -0.807 16.548 631 HZ3 LYS 99 HZ3 LYS 99 3.568 -0.096 16.051 632 H SER 100 HN SER 100 0.113 2.117 9.746 633 HA SER 100 HA SER 100 1.318 -0.140 8.295 634 HG SER 100 HG SER 100 0.064 3.140 6.347 635 HB2 SER 100 HB2 SER 100 1.055 1.281 6.226 636 HB3 SER 100 HB1 SER 100 -0.453 0.701 6.929 637 H VAL 101 HN VAL 101 3.447 -0.121 8.289 638 HA VAL 101 HA VAL 101 4.852 2.470 8.366 639 HB VAL 101 HB VAL 101 5.636 -0.085 9.783 640 H THR 102 HN THR 102 6.103 2.788 6.647 641 HA THR 102 HA THR 102 6.956 0.434 5.092 642 HB THR 102 HB THR 102 6.553 3.247 4.065 643 HG1 THR 102 HG1 THR 102 4.840 1.056 4.319 644 H GLU 103 HN GLU 103 9.054 0.106 4.739 645 HA GLU 103 HA GLU 103 10.945 2.095 5.760 646 HB2 GLU 103 HB2 GLU 103 11.266 -0.056 6.741 647 HB3 GLU 103 HB1 GLU 103 11.201 -0.860 5.178 648 HG2 GLU 103 HG2 GLU 103 13.310 0.471 4.617 649 HG3 GLU 103 HG1 GLU 103 13.397 0.808 6.343 650 H PHE 104 HN PHE 104 11.952 3.374 4.351 651 HA PHE 104 HA PHE 104 11.910 2.677 1.518 652 HD1 PHE 104 HD2 PHE 104 13.667 4.989 -0.110 653 HD2 PHE 104 HD1 PHE 104 9.662 5.213 1.304 654 HE1 PHE 104 HE2 PHE 104 12.912 5.572 -2.375 655 HE2 PHE 104 HE1 PHE 104 8.892 5.794 -0.959 656 HZ PHE 104 HZ PHE 104 10.517 5.978 -2.806 657 HB2 PHE 104 HB2 PHE 104 11.411 5.012 2.816 658 HB3 PHE 104 HB1 PHE 104 13.083 5.249 2.319 659 H ASN 105 HN ASN 105 13.535 1.650 0.671 660 HA ASN 105 HA ASN 105 16.283 2.365 1.447 661 HB2 ASN 105 HB2 ASN 105 15.018 -0.317 1.130 662 HB3 ASN 105 HB1 ASN 105 16.685 -0.132 0.599 663 H GLY 106 HN GLY 106 17.855 2.226 -0.260 664 HA2 GLY 106 HA2 GLY 106 16.713 2.936 -2.825 665 HA3 GLY 106 HA1 GLY 106 18.414 2.984 -2.392 666 H ASP 107 HN ASP 107 16.489 0.122 -1.864 667 HA ASP 107 HA ASP 107 17.389 -1.128 -4.323 668 HB2 ASP 107 HB2 ASP 107 18.287 -2.117 -1.611 669 HB3 ASP 107 HB1 ASP 107 18.449 -3.031 -3.107 670 H THR 108 HN THR 108 15.870 -1.676 -1.147 671 HA THR 108 HA THR 108 13.717 -3.134 -2.509 672 HB THR 108 HB THR 108 15.082 -4.131 -0.000 673 HG1 THR 108 HG1 THR 108 15.210 -5.939 -1.878 674 H ILE 109 HN ILE 109 11.805 -2.332 -1.952 675 HA ILE 109 HA ILE 109 11.589 -0.778 0.532 676 HB ILE 109 HB ILE 109 9.980 -0.757 -2.014 677 H THR 110 HN THR 110 10.503 -1.580 2.212 678 HA THR 110 HA THR 110 8.668 -3.842 1.736 679 HB THR 110 HB THR 110 10.246 -3.277 4.253 680 HG1 THR 110 HG1 THR 110 11.410 -5.195 3.540 681 H ASN 111 HN ASN 111 6.648 -3.822 2.638 682 HA ASN 111 HA ASN 111 5.942 -1.425 4.216 683 HB2 ASN 111 HB2 ASN 111 4.961 -1.373 1.953 684 HB3 ASN 111 HB1 ASN 111 4.192 -2.926 2.259 685 H THR 112 HN THR 112 4.725 -1.701 6.052 686 HA THR 112 HA THR 112 4.099 -4.492 6.779 687 HB THR 112 HB THR 112 4.603 -2.454 8.904 688 HG1 THR 112 HG1 THR 112 6.896 -3.575 8.587 689 H MET 113 HN MET 113 2.010 -4.873 6.982 690 HA MET 113 HA MET 113 0.255 -2.752 8.030 691 HB2 MET 113 HB2 MET 113 -0.331 -4.787 5.872 692 HB3 MET 113 HB1 MET 113 -1.569 -3.813 6.652 693 HG2 MET 113 HG2 MET 113 -0.555 -1.789 5.811 694 HG3 MET 113 HG1 MET 113 0.767 -2.717 5.108 695 HE1 MET 113 HE1 MET 113 -1.056 -0.599 3.448 696 HE2 MET 113 HE2 MET 113 -1.192 -1.509 1.941 697 HE3 MET 113 HE3 MET 113 0.338 -1.478 2.818 698 H THR 114 HN THR 114 -0.609 -3.303 9.937 699 HA THR 114 HA THR 114 -1.041 -6.166 10.477 700 HB THR 114 HB THR 114 -0.053 -4.126 12.474 701 HG1 THR 114 HG1 THR 114 1.386 -5.179 10.719 702 H LEU 115 HN LEU 115 -3.047 -6.681 10.992 703 HA LEU 115 HA LEU 115 -4.734 -4.651 12.295 704 HG LEU 115 HG LEU 115 -5.563 -7.771 10.374 705 HB2 LEU 115 HB2 LEU 115 -6.675 -5.564 11.054 706 HB3 LEU 115 HB1 LEU 115 -5.495 -4.780 10.025 707 H GLY 116 HN GLY 116 -5.229 -5.307 14.267 708 HA2 GLY 116 HA2 GLY 116 -5.983 -6.663 15.975 709 HA3 GLY 116 HA1 GLY 116 -6.354 -7.888 14.769 710 H ASP 117 HN ASP 117 -4.572 -9.217 13.986 711 HA ASP 117 HA ASP 117 -2.157 -9.274 15.602 712 HB2 ASP 117 HB2 ASP 117 -4.115 -11.580 15.525 713 HB3 ASP 117 HB1 ASP 117 -2.467 -11.700 16.135 714 H ILE 118 HN ILE 118 -3.519 -9.329 12.699 715 HA ILE 118 HA ILE 118 -1.962 -11.433 11.458 716 HB ILE 118 HB ILE 118 -3.548 -9.300 10.053 717 H VAL 119 HN VAL 119 -0.155 -11.188 10.270 718 HA VAL 119 HA VAL 119 0.989 -8.481 10.128 719 HB VAL 119 HB VAL 119 2.527 -11.068 9.940 720 H TYR 120 HN TYR 120 0.932 -7.598 8.179 721 HA TYR 120 HA TYR 120 1.110 -9.360 5.817 722 HD1 TYR 120 HD2 TYR 120 0.819 -6.222 3.612 723 HD2 TYR 120 HD1 TYR 120 -1.784 -9.478 4.472 724 HE1 TYR 120 HE2 TYR 120 0.386 -6.507 1.206 725 HE2 TYR 120 HE1 TYR 120 -2.223 -9.771 2.070 726 HH TYR 120 HH TYR 120 -2.130 -8.442 0.006 727 HB2 TYR 120 HB2 TYR 120 -1.052 -8.048 6.218 728 HB3 TYR 120 HB1 TYR 120 -0.114 -6.594 5.889 729 H LYS 121 HN LYS 121 3.022 -9.219 4.829 730 HA LYS 121 HA LYS 121 4.375 -6.610 4.744 731 HB2 LYS 121 HB2 LYS 121 5.440 -8.063 6.432 732 HB3 LYS 121 HB1 LYS 121 5.722 -9.278 5.193 733 HG2 LYS 121 HG2 LYS 121 7.209 -7.785 4.013 734 HG3 LYS 121 HG1 LYS 121 6.861 -6.490 5.160 735 HD2 LYS 121 HD2 LYS 121 8.971 -7.474 5.741 736 HD3 LYS 121 HD1 LYS 121 7.787 -7.927 6.969 737 HE2 LYS 121 HE2 LYS 121 7.485 -10.095 5.817 738 HE3 LYS 121 HE1 LYS 121 8.749 -9.638 4.678 739 HZ1 LYS 121 HZ1 LYS 121 9.071 -10.002 7.608 740 HZ2 LYS 121 HZ2 LYS 121 10.290 -9.470 6.562 741 HZ3 LYS 121 HZ3 LYS 121 9.655 -11.029 6.397 742 H ARG 122 HN ARG 122 5.075 -5.986 2.779 743 HA ARG 122 HA ARG 122 5.080 -8.014 0.649 744 HE ARG 122 HE ARG 122 4.468 -2.015 0.243 745 HB2 ARG 122 HB2 ARG 122 4.466 -6.268 -0.939 746 HB3 ARG 122 HB1 ARG 122 3.278 -6.378 0.351 747 HG2 ARG 122 HG2 ARG 122 4.014 -4.386 1.346 748 HG3 ARG 122 HG1 ARG 122 5.508 -4.372 0.406 749 HD2 ARG 122 HD2 ARG 122 4.314 -3.885 -1.610 750 HD3 ARG 122 HD1 ARG 122 2.761 -4.124 -0.807 751 HH11 ARG 122 HH11 ARG 122 1.762 -2.904 -1.763 752 HH12 ARG 122 HH12 ARG 122 1.095 -1.307 -1.793 753 HH21 ARG 122 HH21 ARG 122 3.599 0.091 0.204 754 HH22 ARG 122 HH22 ARG 122 2.142 0.396 -0.679 755 H VAL 123 HN VAL 123 6.879 -8.308 -0.501 756 HA VAL 123 HA VAL 123 9.147 -6.518 0.038 757 HB VAL 123 HB VAL 123 9.187 -9.282 -1.188 758 H SER 124 HN SER 124 9.667 -5.085 -1.475 759 HA SER 124 HA SER 124 8.976 -5.698 -4.273 760 HG SER 124 HG SER 124 6.832 -4.497 -3.861 761 HB2 SER 124 HB2 SER 124 9.051 -2.974 -2.963 762 HB3 SER 124 HB1 SER 124 8.614 -3.314 -4.636 763 H LYS 125 HN LYS 125 10.468 -5.343 -5.839 764 HA LYS 125 HA LYS 125 13.173 -4.626 -4.932 765 HB2 LYS 125 HB2 LYS 125 12.285 -6.836 -6.353 766 HB3 LYS 125 HB1 LYS 125 12.967 -5.799 -7.595 767 HG2 LYS 125 HG2 LYS 125 14.443 -6.525 -5.087 768 HG3 LYS 125 HG1 LYS 125 14.496 -7.499 -6.555 769 HD2 LYS 125 HD2 LYS 125 15.210 -4.572 -6.472 770 HD3 LYS 125 HD1 LYS 125 16.392 -5.868 -6.280 771 HE2 LYS 125 HE2 LYS 125 15.721 -6.753 -8.490 772 HE3 LYS 125 HE1 LYS 125 14.628 -5.381 -8.678 773 HZ1 LYS 125 HZ1 LYS 125 17.585 -5.258 -8.422 774 HZ2 LYS 125 HZ2 LYS 125 16.569 -3.908 -8.488 775 HZ3 LYS 125 HZ3 LYS 125 16.681 -4.946 -9.819 776 H ARG 126 HN ARG 126 14.323 -3.024 -5.940 777 HA ARG 126 HA ARG 126 12.840 -1.028 -7.329 778 HE ARG 126 HE ARG 126 15.777 2.877 -8.466 779 HB2 ARG 126 HB2 ARG 126 14.701 -0.481 -5.814 780 HB3 ARG 126 HB1 ARG 126 15.825 -1.273 -6.909 781 HG2 ARG 126 HG2 ARG 126 15.294 0.369 -8.641 782 HG3 ARG 126 HG1 ARG 126 14.173 1.166 -7.536 783 HD2 ARG 126 HD2 ARG 126 16.027 1.610 -5.993 784 HD3 ARG 126 HD1 ARG 126 17.142 0.835 -7.116 785 HH11 ARG 126 HH11 ARG 126 18.151 2.464 -5.948 786 HH12 ARG 126 HH12 ARG 126 18.921 3.986 -6.248 787 HH21 ARG 126 HH21 ARG 126 16.786 4.884 -8.865 788 HH22 ARG 126 HH22 ARG 126 18.145 5.361 -7.902 789 H ILE 127 HN ILE 127 12.528 -0.753 -9.433 790 HA ILE 127 HA ILE 127 14.380 -1.957 -11.353 791 HB ILE 127 HB ILE 127 12.415 -2.724 -12.732 792 H9 OLA 128 HH1 OLA 128 -7.549 -7.794 -3.564 793 H10 OLA 128 HI1 OLA 128 -6.652 -6.653 -1.583 794 H21 OLA 128 HA1 OLA 128 -8.521 -9.984 -10.980 795 H22 OLA 128 HA2 OLA 128 -9.783 -10.834 -10.089 796 H31 OLA 128 HB1 OLA 128 -8.948 -7.972 -9.626 797 H32 OLA 128 HB2 OLA 128 -10.164 -8.866 -8.711 798 H41 OLA 128 HC1 OLA 128 -7.816 -10.432 -8.706 799 H42 OLA 128 HC2 OLA 128 -8.567 -9.591 -7.348 800 H51 OLA 128 HD1 OLA 128 -6.191 -8.887 -8.924 801 H52 OLA 128 HD2 OLA 128 -7.289 -7.544 -8.599 802 H61 OLA 128 HE1 OLA 128 -5.382 -8.134 -6.906 803 H62 OLA 128 HE2 OLA 128 -6.515 -9.377 -6.373 804 H71 OLA 128 HF1 OLA 128 -7.547 -6.612 -6.710 805 H72 OLA 128 HF2 OLA 128 -8.008 -7.859 -5.549 806 H81 OLA 128 HG1 OLA 128 -5.279 -7.107 -5.111 807 H82 OLA 128 HG2 OLA 128 -6.294 -5.661 -5.140 808 H111 OLA 128 HJ1 OLA 128 -4.348 -5.855 -3.102 809 H112 OLA 128 HJ2 OLA 128 -5.583 -4.616 -3.342 810 H121 OLA 128 HK1 OLA 128 -5.839 -4.571 -0.825 811 H122 OLA 128 HK2 OLA 128 -4.378 -5.558 -0.749 812 H131 OLA 128 HL1 OLA 128 -3.765 -3.448 -2.478 813 H132 OLA 128 HL2 OLA 128 -3.188 -3.679 -0.827 814 H141 OLA 128 HM1 OLA 128 -4.153 -1.677 -0.472 815 H142 OLA 128 HM2 OLA 128 -5.637 -2.628 -0.359 816 H151 OLA 128 HN1 OLA 128 -6.387 -1.958 -2.408 817 H152 OLA 128 HN2 OLA 128 -4.758 -1.745 -3.055 818 H161 OLA 128 HP1 OLA 128 -4.491 0.335 -1.978 819 H162 OLA 128 HP2 OLA 128 -5.897 0.066 -0.944 820 H171 OLA 128 HQ1 OLA 128 -6.319 0.079 -3.891 821 H172 OLA 128 HQ2 OLA 128 -6.033 1.629 -3.080 822 H181 OLA 128 HR1 OLA 128 -7.829 0.791 -1.410 823 H182 OLA 128 HR2 OLA 128 -8.339 1.419 -2.977 824 H183 OLA 128 HR3 OLA 128 -8.269 -0.322 -2.703 825 H9 OLA 129 HH1 OLA 129 -0.948 6.437 0.568 826 H10 OLA 129 HI1 OLA 129 -3.050 5.376 1.266 827 H21 OLA 129 HA1 OLA 129 6.006 2.744 -0.358 828 H22 OLA 129 HA2 OLA 129 4.906 3.894 -1.117 829 H31 OLA 129 HB1 OLA 129 3.071 2.992 0.283 830 H32 OLA 129 HB2 OLA 129 4.247 1.959 1.099 831 H41 OLA 129 HC1 OLA 129 5.481 4.312 1.389 832 H42 OLA 129 HC2 OLA 129 4.298 3.705 2.548 833 H51 OLA 129 HD1 OLA 129 4.146 6.146 1.496 834 H52 OLA 129 HD2 OLA 129 3.276 5.262 0.240 835 H61 OLA 129 HE1 OLA 129 2.621 5.409 3.178 836 H62 OLA 129 HE2 OLA 129 1.850 4.280 2.062 837 H71 OLA 129 HF1 OLA 129 1.788 7.292 1.936 838 H72 OLA 129 HF2 OLA 129 1.145 6.231 0.678 839 H81 OLA 129 HG1 OLA 129 0.090 5.341 3.141 840 H82 OLA 129 HG2 OLA 129 -0.092 7.096 3.105 841 H111 OLA 129 HJ1 OLA 129 -1.596 4.293 3.541 842 H112 OLA 129 HJ2 OLA 129 -2.389 5.799 4.011 843 H121 OLA 129 HK1 OLA 129 -4.071 4.309 4.452 844 H122 OLA 129 HK2 OLA 129 -4.443 4.705 2.773 845 H131 OLA 129 HL1 OLA 129 -3.853 2.166 3.905 846 H132 OLA 129 HL2 OLA 129 -2.555 2.581 2.782 847 H141 OLA 129 HM1 OLA 129 -5.317 3.096 1.860 848 H142 OLA 129 HM2 OLA 129 -4.841 1.403 2.016 849 H151 OLA 129 HN1 OLA 129 -3.079 3.358 0.584 850 H152 OLA 129 HN2 OLA 129 -4.455 2.621 -0.238 851 H161 OLA 129 HP1 OLA 129 -3.578 0.439 0.056 852 H162 OLA 129 HP2 OLA 129 -2.351 1.011 1.190 853 H171 OLA 129 HQ1 OLA 129 -1.946 0.580 -1.488 854 H172 OLA 129 HQ2 OLA 129 -2.235 2.325 -1.424 855 H181 OLA 129 HR1 OLA 129 -0.581 2.178 0.619 856 H182 OLA 129 HR2 OLA 129 0.022 2.266 -1.037 857 H183 OLA 129 HR3 OLA 129 -0.052 0.713 -0.205 Start of MODEL 9 1 HA MET 1 HA MET 1 16.848 13.031 -4.636 2 H1 MET 1 HT1 MET 1 15.723 13.312 -2.552 3 H2 MET 1 HT2 MET 1 17.297 13.919 -2.435 4 H3 MET 1 HT3 MET 1 16.913 12.426 -1.738 5 HB2 MET 1 HB2 MET 1 19.134 12.975 -3.658 6 HB3 MET 1 HB1 MET 1 18.815 11.352 -3.064 7 HG2 MET 1 HG2 MET 1 18.474 10.611 -5.398 8 HG3 MET 1 HG1 MET 1 18.923 12.226 -5.942 9 HE1 MET 1 HE1 MET 1 21.334 13.299 -5.519 10 HE2 MET 1 HE2 MET 1 22.652 12.449 -4.710 11 HE3 MET 1 HE3 MET 1 21.221 12.934 -3.798 12 H ASN 2 HN ASN 2 16.943 10.417 -2.205 13 HA ASN 2 HA ASN 2 15.655 8.595 -4.048 14 HB2 ASN 2 HB2 ASN 2 15.794 7.008 -2.068 15 HB3 ASN 2 HB1 ASN 2 17.328 7.592 -2.702 16 H PHE 3 HN PHE 3 13.580 9.165 -4.408 17 HA PHE 3 HA PHE 3 11.735 8.860 -2.177 18 HD1 PHE 3 HD2 PHE 3 10.399 10.772 -0.564 19 HD2 PHE 3 HD1 PHE 3 13.756 12.306 -2.678 20 HE1 PHE 3 HE2 PHE 3 11.206 11.838 1.500 21 HE2 PHE 3 HE1 PHE 3 14.573 13.373 -0.618 22 HZ PHE 3 HZ PHE 3 13.288 13.137 1.480 23 HB2 PHE 3 HB2 PHE 3 11.951 11.351 -3.857 24 HB3 PHE 3 HB1 PHE 3 10.453 10.913 -3.045 25 H SER 4 HN SER 4 12.096 9.467 -5.655 26 HA SER 4 HA SER 4 9.626 7.954 -6.133 27 HG SER 4 HG SER 4 8.601 9.000 -8.571 28 HB2 SER 4 HB2 SER 4 9.683 10.163 -7.166 29 HB3 SER 4 HB1 SER 4 11.195 9.768 -7.981 30 H GLY 5 HN GLY 5 9.657 5.994 -7.045 31 HA2 GLY 5 HA2 GLY 5 11.702 5.122 -8.832 32 HA3 GLY 5 HA1 GLY 5 11.928 4.435 -7.231 33 H LYS 6 HN LYS 6 11.595 2.597 -9.041 34 HA LYS 6 HA LYS 6 8.756 1.820 -8.870 35 HB2 LYS 6 HB2 LYS 6 9.676 2.290 -11.195 36 HB3 LYS 6 HB1 LYS 6 10.685 0.867 -10.984 37 HG2 LYS 6 HG2 LYS 6 8.527 -0.401 -10.530 38 HG3 LYS 6 HG1 LYS 6 7.698 1.021 -11.152 39 HD2 LYS 6 HD2 LYS 6 8.941 0.827 -13.255 40 HD3 LYS 6 HD1 LYS 6 9.753 -0.613 -12.636 41 HE2 LYS 6 HE2 LYS 6 7.611 -1.760 -12.461 42 HE3 LYS 6 HE1 LYS 6 6.778 -0.315 -13.033 43 HZ1 LYS 6 HZ1 LYS 6 7.948 -0.507 -15.133 44 HZ2 LYS 6 HZ2 LYS 6 7.089 -1.927 -14.807 45 HZ3 LYS 6 HZ3 LYS 6 8.766 -1.883 -14.585 46 H TYR 7 HN TYR 7 8.355 0.090 -7.677 47 HA TYR 7 HA TYR 7 10.497 -1.891 -7.282 48 HD1 TYR 7 HD2 TYR 7 12.147 -1.290 -4.891 49 HD2 TYR 7 HD1 TYR 7 8.838 1.360 -5.237 50 HE1 TYR 7 HE2 TYR 7 13.599 0.595 -4.270 51 HE2 TYR 7 HE1 TYR 7 10.281 3.254 -4.620 52 HH TYR 7 HH TYR 7 12.388 3.649 -3.418 53 HB2 TYR 7 HB2 TYR 7 8.494 -1.030 -5.188 54 HB3 TYR 7 HB1 TYR 7 9.849 -2.136 -4.969 55 H GLN 8 HN GLN 8 9.850 -4.059 -7.127 56 HA GLN 8 HA GLN 8 7.079 -4.566 -7.987 57 HB2 GLN 8 HB2 GLN 8 8.711 -5.052 -9.747 58 HB3 GLN 8 HB1 GLN 8 9.584 -6.118 -8.655 59 HG2 GLN 8 HG2 GLN 8 8.380 -7.620 -9.888 60 HG3 GLN 8 HG1 GLN 8 7.317 -7.382 -8.502 61 H VAL 9 HN VAL 9 5.867 -5.830 -6.741 62 HA VAL 9 HA VAL 9 6.837 -6.858 -4.272 63 HB VAL 9 HB VAL 9 4.240 -7.488 -5.678 64 H GLN 10 HN GLN 10 7.764 -8.777 -3.870 65 HA GLN 10 HA GLN 10 7.811 -10.758 -6.022 66 HB2 GLN 10 HB2 GLN 10 9.584 -10.397 -3.607 67 HB3 GLN 10 HB1 GLN 10 9.738 -11.710 -4.762 68 HG2 GLN 10 HG2 GLN 10 10.159 -10.077 -6.542 69 HG3 GLN 10 HG1 GLN 10 10.047 -8.779 -5.356 70 H SER 11 HN SER 11 7.041 -10.407 -2.588 71 HA SER 11 HA SER 11 5.237 -12.616 -2.698 72 HG SER 11 HG SER 11 6.570 -14.196 0.075 73 HB2 SER 11 HB2 SER 11 7.295 -13.908 -2.533 74 HB3 SER 11 HB1 SER 11 7.789 -12.978 -1.119 75 H GLN 12 HN GLN 12 4.180 -13.042 -0.617 76 HA GLN 12 HA GLN 12 4.513 -10.988 1.429 77 HB2 GLN 12 HB2 GLN 12 2.776 -10.324 -0.396 78 HB3 GLN 12 HB1 GLN 12 1.755 -11.534 0.368 79 HG2 GLN 12 HG2 GLN 12 2.984 -9.208 1.824 80 HG3 GLN 12 HG1 GLN 12 1.363 -9.201 1.134 81 H GLU 13 HN GLU 13 4.202 -11.793 3.441 82 HA GLU 13 HA GLU 13 3.347 -14.580 3.642 83 HB2 GLU 13 HB2 GLU 13 4.640 -12.786 5.704 84 HB3 GLU 13 HB1 GLU 13 4.283 -14.493 5.920 85 HG2 GLU 13 HG2 GLU 13 5.796 -14.985 4.008 86 HG3 GLU 13 HG1 GLU 13 6.237 -13.279 3.984 87 H ASN 14 HN ASN 14 1.544 -15.242 4.649 88 HA ASN 14 HA ASN 14 -0.498 -15.196 5.638 89 HB2 ASN 14 HB2 ASN 14 0.689 -12.808 7.066 90 HB3 ASN 14 HB1 ASN 14 -0.857 -13.541 7.483 91 H PHE 15 HN PHE 15 -1.886 -14.813 4.009 92 HA PHE 15 HA PHE 15 -2.561 -11.999 3.450 93 HD1 PHE 15 HD1 PHE 15 -4.394 -11.539 1.014 94 HD2 PHE 15 HD2 PHE 15 -0.213 -12.257 0.681 95 HE1 PHE 15 HE1 PHE 15 -4.151 -9.479 -0.308 96 HE2 PHE 15 HE2 PHE 15 0.039 -10.198 -0.642 97 HZ PHE 15 HZ PHE 15 -1.920 -8.816 -1.150 98 HB2 PHE 15 HB2 PHE 15 -1.565 -13.865 1.646 99 HB3 PHE 15 HB1 PHE 15 -3.296 -13.857 1.332 100 H GLU 16 HN GLU 16 -3.853 -15.304 3.192 101 HA GLU 16 HA GLU 16 -6.531 -14.776 2.919 102 HB2 GLU 16 HB2 GLU 16 -5.228 -17.019 4.468 103 HB3 GLU 16 HB1 GLU 16 -6.919 -16.987 3.995 104 HG2 GLU 16 HG2 GLU 16 -6.314 -17.002 1.663 105 HG3 GLU 16 HG1 GLU 16 -4.603 -16.895 2.077 106 HA PRO 17 HA PRO 17 -7.141 -14.696 7.732 107 HB2 PRO 17 HB2 PRO 17 -5.001 -13.904 9.221 108 HB3 PRO 17 HB1 PRO 17 -5.394 -15.596 8.899 109 HG2 PRO 17 HG2 PRO 17 -3.396 -13.824 7.546 110 HG3 PRO 17 HG1 PRO 17 -3.226 -15.513 8.060 111 HD2 PRO 17 HD2 PRO 17 -3.712 -14.838 5.498 112 HD3 PRO 17 HD1 PRO 17 -4.371 -16.318 6.221 113 H PHE 18 HN PHE 18 -4.705 -12.393 6.528 114 HA PHE 18 HA PHE 18 -5.713 -10.168 7.966 115 HD1 PHE 18 HD1 PHE 18 -3.788 -8.134 8.460 116 HD2 PHE 18 HD2 PHE 18 -4.612 -8.343 4.290 117 HE1 PHE 18 HE1 PHE 18 -3.772 -5.676 8.340 118 HE2 PHE 18 HE2 PHE 18 -4.598 -5.885 4.163 119 HZ PHE 18 HZ PHE 18 -4.168 -4.551 6.172 120 HB2 PHE 18 HB2 PHE 18 -3.424 -10.206 7.139 121 HB3 PHE 18 HB1 PHE 18 -3.999 -10.293 5.477 122 H MET 19 HN MET 19 -6.072 -11.163 4.585 123 HA MET 19 HA MET 19 -7.709 -9.053 3.739 124 HB2 MET 19 HB2 MET 19 -8.236 -10.471 1.836 125 HB3 MET 19 HB1 MET 19 -6.523 -10.559 2.214 126 HG2 MET 19 HG2 MET 19 -7.001 -12.761 1.842 127 HG3 MET 19 HG1 MET 19 -7.229 -12.663 3.586 128 HE1 MET 19 HE1 MET 19 -8.373 -14.998 1.656 129 HE2 MET 19 HE2 MET 19 -9.987 -15.225 2.330 130 HE3 MET 19 HE3 MET 19 -8.607 -15.013 3.403 131 H LYS 20 HN LYS 20 -8.557 -12.260 4.990 132 HA LYS 20 HA LYS 20 -11.351 -11.915 4.626 133 HB2 LYS 20 HB2 LYS 20 -9.707 -14.034 5.162 134 HB3 LYS 20 HB1 LYS 20 -10.524 -13.810 6.697 135 HG2 LYS 20 HG2 LYS 20 -12.687 -13.930 5.528 136 HG3 LYS 20 HG1 LYS 20 -11.829 -14.238 4.022 137 HD2 LYS 20 HD2 LYS 20 -10.834 -16.258 5.047 138 HD3 LYS 20 HD1 LYS 20 -11.798 -15.966 6.495 139 HE2 LYS 20 HE2 LYS 20 -12.875 -16.462 3.721 140 HE3 LYS 20 HE1 LYS 20 -12.846 -17.631 5.042 141 HZ1 LYS 20 HZ1 LYS 20 -14.321 -15.052 5.057 142 HZ2 LYS 20 HZ2 LYS 20 -14.308 -16.190 6.309 143 HZ3 LYS 20 HZ3 LYS 20 -15.014 -16.578 4.821 144 H ALA 21 HN ALA 21 -9.169 -11.432 7.363 145 HA ALA 21 HA ALA 21 -11.165 -10.927 9.295 146 HB1 ALA 21 HB1 ALA 21 -8.846 -11.430 9.898 147 HB2 ALA 21 HB2 ALA 21 -9.386 -9.916 10.624 148 HB3 ALA 21 HB3 ALA 21 -8.331 -9.889 9.209 149 H MET 22 HN MET 22 -10.221 -9.187 6.587 150 HA MET 22 HA MET 22 -11.108 -6.613 7.676 151 HB2 MET 22 HB2 MET 22 -9.004 -6.515 6.497 152 HB3 MET 22 HB1 MET 22 -9.692 -7.341 5.106 153 HG2 MET 22 HG2 MET 22 -9.491 -5.027 4.586 154 HG3 MET 22 HG1 MET 22 -11.202 -5.406 4.770 155 HE1 MET 22 HE1 MET 22 -11.721 -2.816 4.915 156 HE2 MET 22 HE2 MET 22 -10.009 -2.417 4.786 157 HE3 MET 22 HE3 MET 22 -10.981 -1.725 6.085 158 H GLY 23 HN GLY 23 -11.458 -8.225 4.512 159 HA2 GLY 23 HA2 GLY 23 -14.148 -8.700 4.456 160 HA3 GLY 23 HA1 GLY 23 -14.015 -6.992 4.067 161 H LEU 24 HN LEU 24 -11.272 -8.582 3.021 162 HA LEU 24 HA LEU 24 -12.075 -8.323 0.267 163 HG LEU 24 HG LEU 24 -9.863 -9.403 -1.239 164 HB2 LEU 24 HB2 LEU 24 -9.777 -7.784 1.310 165 HB3 LEU 24 HB1 LEU 24 -9.487 -9.510 1.222 166 HA PRO 25 HA PRO 25 -13.180 -12.620 -0.177 167 HB2 PRO 25 HB2 PRO 25 -13.316 -12.355 -3.022 168 HB3 PRO 25 HB1 PRO 25 -14.644 -12.289 -1.864 169 HG2 PRO 25 HG2 PRO 25 -13.774 -10.153 -3.384 170 HG3 PRO 25 HG1 PRO 25 -14.693 -10.014 -1.877 171 HD2 PRO 25 HD2 PRO 25 -11.752 -9.733 -2.340 172 HD3 PRO 25 HD1 PRO 25 -12.825 -8.797 -1.275 173 H GLU 26 HN GLU 26 -11.832 -14.300 -0.090 174 HA GLU 26 HA GLU 26 -9.226 -14.400 -0.945 175 HB2 GLU 26 HB2 GLU 26 -10.340 -15.977 0.641 176 HB3 GLU 26 HB1 GLU 26 -11.071 -16.779 -0.741 177 HG2 GLU 26 HG2 GLU 26 -8.858 -17.341 -1.596 178 HG3 GLU 26 HG1 GLU 26 -8.118 -16.529 -0.217 179 H ASP 27 HN ASP 27 -12.108 -15.006 -2.835 180 HA ASP 27 HA ASP 27 -11.030 -16.546 -4.895 181 HB2 ASP 27 HB2 ASP 27 -13.246 -14.496 -4.935 182 HB3 ASP 27 HB1 ASP 27 -12.857 -15.528 -6.309 183 H LEU 28 HN LEU 28 -11.261 -12.994 -4.675 184 HA LEU 28 HA LEU 28 -9.909 -12.543 -7.138 185 HG LEU 28 HG LEU 28 -11.594 -10.879 -7.613 186 HB2 LEU 28 HB2 LEU 28 -10.547 -10.777 -4.788 187 HB3 LEU 28 HB1 LEU 28 -9.626 -10.190 -6.160 188 H ILE 29 HN ILE 29 -8.912 -12.746 -3.793 189 HA ILE 29 HA ILE 29 -6.298 -11.755 -4.043 190 HB ILE 29 HB ILE 29 -7.381 -13.769 -2.078 191 H GLN 30 HN GLN 30 -7.568 -15.052 -4.378 192 HA GLN 30 HA GLN 30 -5.174 -16.450 -4.468 193 HB2 GLN 30 HB2 GLN 30 -7.783 -16.937 -5.902 194 HB3 GLN 30 HB1 GLN 30 -6.438 -18.068 -5.968 195 HG2 GLN 30 HG2 GLN 30 -7.817 -17.168 -3.449 196 HG3 GLN 30 HG1 GLN 30 -8.138 -18.682 -4.300 197 H LYS 31 HN LYS 31 -6.930 -14.922 -7.149 198 HA LYS 31 HA LYS 31 -5.016 -15.625 -9.125 199 HB2 LYS 31 HB2 LYS 31 -7.133 -13.469 -9.122 200 HB3 LYS 31 HB1 LYS 31 -6.206 -13.961 -10.531 201 HG2 LYS 31 HG2 LYS 31 -7.192 -16.124 -10.528 202 HG3 LYS 31 HG1 LYS 31 -7.945 -15.840 -8.956 203 HD2 LYS 31 HD2 LYS 31 -9.387 -14.158 -9.890 204 HD3 LYS 31 HD1 LYS 31 -8.554 -14.250 -11.442 205 HE2 LYS 31 HE2 LYS 31 -9.315 -16.542 -11.734 206 HE3 LYS 31 HE1 LYS 31 -10.097 -16.500 -10.155 207 HZ1 LYS 31 HZ1 LYS 31 -11.570 -14.772 -10.960 208 HZ2 LYS 31 HZ2 LYS 31 -11.675 -16.135 -11.955 209 HZ3 LYS 31 HZ3 LYS 31 -10.807 -14.778 -12.470 210 H GLY 32 HN GLY 32 -5.352 -12.916 -6.938 211 HA2 GLY 32 HA2 GLY 32 -3.461 -11.247 -8.321 212 HA3 GLY 32 HA1 GLY 32 -4.164 -10.941 -6.744 213 H LYS 33 HN LYS 33 -3.235 -13.573 -5.693 214 HA LYS 33 HA LYS 33 -0.701 -12.664 -4.764 215 HB2 LYS 33 HB2 LYS 33 -0.620 -14.740 -3.481 216 HB3 LYS 33 HB1 LYS 33 -2.184 -13.957 -3.317 217 HG2 LYS 33 HG2 LYS 33 -3.189 -15.524 -4.831 218 HG3 LYS 33 HG1 LYS 33 -1.618 -16.249 -5.183 219 HD2 LYS 33 HD2 LYS 33 -2.881 -16.190 -2.445 220 HD3 LYS 33 HD1 LYS 33 -3.012 -17.546 -3.567 221 HE2 LYS 33 HE2 LYS 33 -0.603 -17.826 -3.552 222 HE3 LYS 33 HE1 LYS 33 -0.423 -16.417 -2.507 223 HZ1 LYS 33 HZ1 LYS 33 -1.848 -18.922 -1.784 224 HZ2 LYS 33 HZ2 LYS 33 -1.627 -17.581 -0.777 225 HZ3 LYS 33 HZ3 LYS 33 -0.293 -18.498 -1.269 226 H ASP 34 HN ASP 34 -1.732 -14.842 -7.274 227 HA ASP 34 HA ASP 34 0.855 -16.043 -7.632 228 HB2 ASP 34 HB2 ASP 34 -1.670 -16.068 -9.287 229 HB3 ASP 34 HB1 ASP 34 -0.193 -16.883 -9.793 230 H ILE 35 HN ILE 35 -0.365 -13.034 -8.287 231 HA ILE 35 HA ILE 35 1.461 -12.632 -10.567 232 HB ILE 35 HB ILE 35 -0.931 -10.952 -9.801 233 H LYS 36 HN LYS 36 3.210 -11.434 -10.211 234 HA LYS 36 HA LYS 36 3.847 -10.337 -7.702 235 HB2 LYS 36 HB2 LYS 36 5.063 -9.650 -10.386 236 HB3 LYS 36 HB1 LYS 36 5.797 -9.380 -8.812 237 HG2 LYS 36 HG2 LYS 36 6.009 -11.732 -8.434 238 HG3 LYS 36 HG1 LYS 36 5.081 -12.096 -9.891 239 HD2 LYS 36 HD2 LYS 36 7.393 -12.418 -10.397 240 HD3 LYS 36 HD1 LYS 36 6.865 -10.945 -11.214 241 HE2 LYS 36 HE2 LYS 36 9.040 -10.606 -10.193 242 HE3 LYS 36 HE1 LYS 36 7.827 -9.610 -9.388 243 HZ1 LYS 36 HZ1 LYS 36 9.278 -10.668 -7.785 244 HZ2 LYS 36 HZ2 LYS 36 8.893 -12.199 -8.393 245 HZ3 LYS 36 HZ3 LYS 36 7.705 -11.272 -7.626 246 H GLY 37 HN GLY 37 2.945 -8.617 -6.782 247 HA2 GLY 37 HA2 GLY 37 1.328 -6.739 -8.085 248 HA3 GLY 37 HA1 GLY 37 2.025 -6.537 -6.486 249 H VAL 38 HN VAL 38 1.645 -4.426 -8.280 250 HA VAL 38 HA VAL 38 4.436 -3.710 -8.915 251 HB VAL 38 HB VAL 38 2.005 -2.639 -10.349 252 H SER 39 HN SER 39 5.192 -1.857 -8.047 253 HA SER 39 HA SER 39 3.268 0.029 -6.879 254 HG SER 39 HG SER 39 6.041 -1.980 -4.879 255 HB2 SER 39 HB2 SER 39 4.677 0.231 -4.857 256 HB3 SER 39 HB1 SER 39 4.031 -1.399 -5.050 257 H GLU 40 HN GLU 40 3.671 2.073 -7.376 258 HA GLU 40 HA GLU 40 6.407 2.878 -8.080 259 HB2 GLU 40 HB2 GLU 40 3.903 3.405 -9.680 260 HB3 GLU 40 HB1 GLU 40 5.392 4.310 -9.904 261 HG2 GLU 40 HG2 GLU 40 6.552 2.383 -10.618 262 HG3 GLU 40 HG1 GLU 40 5.219 1.325 -10.162 263 H ILE 41 HN ILE 41 7.030 4.687 -7.062 264 HA ILE 41 HA ILE 41 4.930 6.337 -5.813 265 HB ILE 41 HB ILE 41 7.791 6.157 -4.882 266 H VAL 42 HN VAL 42 4.676 8.271 -6.687 267 HA VAL 42 HA VAL 42 6.966 9.542 -8.034 268 HB VAL 42 HB VAL 42 4.006 10.053 -8.390 269 H HIS 43 HN HIS 43 7.938 11.058 -6.832 270 HA HIS 43 HA HIS 43 6.343 12.503 -4.835 271 HD1 HIS 43 HD1 HIS 43 10.394 14.259 -4.780 272 HD2 HIS 43 HD2 HIS 43 7.432 13.495 -1.967 273 HE1 HIS 43 HE1 HIS 43 10.586 16.104 -3.082 274 HE2 HIS 43 HE2 HIS 43 8.721 15.674 -1.444 275 HB2 HIS 43 HB2 HIS 43 8.212 11.449 -3.818 276 HB3 HIS 43 HB1 HIS 43 9.305 11.995 -5.084 277 H GLU 44 HN GLU 44 5.644 14.449 -5.382 278 HA GLU 44 HA GLU 44 7.413 16.222 -6.905 279 HB2 GLU 44 HB2 GLU 44 5.801 15.187 -8.485 280 HB3 GLU 44 HB1 GLU 44 4.479 15.843 -7.527 281 HG2 GLU 44 HG2 GLU 44 4.879 17.213 -9.475 282 HG3 GLU 44 HG1 GLU 44 5.256 18.108 -8.003 283 H GLY 45 HN GLY 45 7.826 17.672 -5.326 284 HA2 GLY 45 HA2 GLY 45 7.478 19.266 -3.704 285 HA3 GLY 45 HA1 GLY 45 6.143 19.750 -4.736 286 H LYS 46 HN LYS 46 6.908 17.227 -2.337 287 HA LYS 46 HA LYS 46 5.792 16.475 -0.511 288 HB2 LYS 46 HB2 LYS 46 4.063 18.920 -0.874 289 HB3 LYS 46 HB1 LYS 46 4.079 17.883 0.542 290 HG2 LYS 46 HG2 LYS 46 6.461 18.461 0.885 291 HG3 LYS 46 HG1 LYS 46 6.342 19.591 -0.465 292 HD2 LYS 46 HD2 LYS 46 4.631 19.703 2.016 293 HD3 LYS 46 HD1 LYS 46 6.090 20.664 1.764 294 HE2 LYS 46 HE2 LYS 46 5.067 21.683 -0.215 295 HE3 LYS 46 HE1 LYS 46 3.607 20.731 0.050 296 HZ1 LYS 46 HZ1 LYS 46 3.291 21.848 2.161 297 HZ2 LYS 46 HZ2 LYS 46 3.387 22.985 0.912 298 HZ3 LYS 46 HZ3 LYS 46 4.711 22.741 1.938 299 H LYS 47 HN LYS 47 4.157 17.025 -3.471 300 HA LYS 47 HA LYS 47 1.822 15.475 -2.681 301 HB2 LYS 47 HB2 LYS 47 2.575 16.699 -5.344 302 HB3 LYS 47 HB1 LYS 47 1.053 15.889 -4.997 303 HG2 LYS 47 HG2 LYS 47 0.469 17.578 -3.385 304 HG3 LYS 47 HG1 LYS 47 2.036 18.362 -3.590 305 HD2 LYS 47 HD2 LYS 47 0.414 19.589 -4.857 306 HD3 LYS 47 HD1 LYS 47 1.459 18.728 -5.989 307 HE2 LYS 47 HE2 LYS 47 -0.237 16.984 -6.231 308 HE3 LYS 47 HE1 LYS 47 -1.277 17.832 -5.087 309 HZ1 LYS 47 HZ1 LYS 47 -0.385 18.866 -7.725 310 HZ2 LYS 47 HZ2 LYS 47 -1.354 19.709 -6.624 311 HZ3 LYS 47 HZ3 LYS 47 -1.935 18.298 -7.351 312 H VAL 48 HN VAL 48 2.120 13.348 -2.550 313 HA VAL 48 HA VAL 48 3.855 12.052 -4.534 314 HB VAL 48 HB VAL 48 2.973 11.015 -1.841 315 H LYS 49 HN LYS 49 2.975 10.818 -6.036 316 HA LYS 49 HA LYS 49 0.172 10.008 -5.762 317 HB2 LYS 49 HB2 LYS 49 1.945 9.917 -8.211 318 HB3 LYS 49 HB1 LYS 49 0.208 9.641 -8.165 319 HG2 LYS 49 HG2 LYS 49 1.550 12.242 -7.457 320 HG3 LYS 49 HG1 LYS 49 0.835 11.868 -9.027 321 HD2 LYS 49 HD2 LYS 49 -1.344 11.539 -7.943 322 HD3 LYS 49 HD1 LYS 49 -0.623 11.935 -6.381 323 HE2 LYS 49 HE2 LYS 49 -0.769 13.766 -8.776 324 HE3 LYS 49 HE1 LYS 49 -1.810 13.848 -7.356 325 HZ1 LYS 49 HZ1 LYS 49 -0.016 15.454 -7.227 326 HZ2 LYS 49 HZ2 LYS 49 1.137 14.223 -7.364 327 HZ3 LYS 49 HZ3 LYS 49 0.139 14.300 -5.999 328 H LEU 50 HN LEU 50 -0.364 7.946 -5.382 329 HA LEU 50 HA LEU 50 1.763 5.923 -5.611 330 HG LEU 50 HG LEU 50 0.888 4.407 -2.386 331 HB2 LEU 50 HB2 LEU 50 0.500 6.602 -3.365 332 HB3 LEU 50 HB1 LEU 50 -0.661 5.433 -3.962 333 H THR 51 HN THR 51 1.522 4.390 -7.087 334 HA THR 51 HA THR 51 -1.193 3.779 -8.051 335 HB THR 51 HB THR 51 1.301 3.829 -9.760 336 HG1 THR 51 HG1 THR 51 -0.445 5.596 -10.608 337 H ILE 52 HN ILE 52 -1.753 1.710 -7.928 338 HA ILE 52 HA ILE 52 0.364 -0.335 -7.811 339 HB ILE 52 HB ILE 52 -2.187 -0.353 -6.190 340 H THR 53 HN THR 53 0.127 -1.929 -9.256 341 HA THR 53 HA THR 53 -2.472 -2.148 -10.624 342 HB THR 53 HB THR 53 0.253 -2.923 -11.678 343 HG1 THR 53 HG1 THR 53 -0.928 -0.538 -11.520 344 H TYR 54 HN TYR 54 -3.558 -3.998 -10.572 345 HA TYR 54 HA TYR 54 -2.190 -6.410 -9.575 346 HD1 TYR 54 HD2 TYR 54 -2.322 -7.302 -7.210 347 HD2 TYR 54 HD1 TYR 54 -4.817 -3.859 -7.335 348 HE1 TYR 54 HE2 TYR 54 -1.484 -6.622 -5.000 349 HE2 TYR 54 HE1 TYR 54 -3.987 -3.169 -5.126 350 HH TYR 54 HH TYR 54 -2.955 -4.188 -3.147 351 HB2 TYR 54 HB2 TYR 54 -4.989 -5.421 -9.026 352 HB3 TYR 54 HB1 TYR 54 -4.484 -7.075 -8.705 353 H GLY 55 HN GLY 55 -1.909 -7.733 -11.259 354 HA2 GLY 55 HA2 GLY 55 -2.445 -9.131 -13.005 355 HA3 GLY 55 HA1 GLY 55 -4.137 -8.805 -12.662 356 H SER 56 HN SER 56 -5.136 -6.960 -13.638 357 HA SER 56 HA SER 56 -3.648 -5.737 -15.847 358 HG SER 56 HG SER 56 -6.735 -6.963 -15.110 359 HB2 SER 56 HB2 SER 56 -5.557 -6.110 -17.381 360 HB3 SER 56 HB1 SER 56 -4.836 -7.625 -16.838 361 H LYS 57 HN LYS 57 -5.034 -5.047 -13.132 362 HA LYS 57 HA LYS 57 -6.596 -2.762 -14.142 363 HB2 LYS 57 HB2 LYS 57 -7.887 -4.309 -12.740 364 HB3 LYS 57 HB1 LYS 57 -6.735 -4.077 -11.432 365 HG2 LYS 57 HG2 LYS 57 -7.333 -1.714 -11.310 366 HG3 LYS 57 HG1 LYS 57 -8.477 -1.934 -12.638 367 HD2 LYS 57 HD2 LYS 57 -8.617 -3.489 -10.076 368 HD3 LYS 57 HD1 LYS 57 -9.462 -1.960 -10.311 369 HE2 LYS 57 HE2 LYS 57 -9.811 -4.456 -11.970 370 HE3 LYS 57 HE1 LYS 57 -10.927 -3.874 -10.736 371 HZ1 LYS 57 HZ1 LYS 57 -11.660 -3.263 -12.953 372 HZ2 LYS 57 HZ2 LYS 57 -10.212 -2.436 -13.234 373 HZ3 LYS 57 HZ3 LYS 57 -11.286 -1.880 -12.051 374 H VAL 58 HN VAL 58 -5.868 -0.770 -13.781 375 HA VAL 58 HA VAL 58 -3.509 -0.461 -12.059 376 HB VAL 58 HB VAL 58 -4.583 1.462 -14.128 377 H ILE 59 HN ILE 59 -3.671 0.571 -10.176 378 HA ILE 59 HA ILE 59 -6.104 2.148 -9.652 379 HB ILE 59 HB ILE 59 -4.330 0.729 -7.660 380 H HIS 60 HN HIS 60 -5.827 4.261 -9.472 381 HA HIS 60 HA HIS 60 -3.145 5.273 -8.793 382 HD1 HIS 60 HD1 HIS 60 -5.174 8.887 -9.098 383 HD2 HIS 60 HD2 HIS 60 -1.616 7.510 -10.746 384 HE1 HIS 60 HE1 HIS 60 -3.604 10.850 -9.044 385 HE2 HIS 60 HE2 HIS 60 -1.486 10.017 -10.124 386 HB2 HIS 60 HB2 HIS 60 -3.913 5.936 -11.013 387 HB3 HIS 60 HB1 HIS 60 -5.382 6.616 -10.322 388 H ASN 61 HN ASN 61 -2.874 6.851 -7.249 389 HA ASN 61 HA ASN 61 -5.197 7.902 -5.844 390 HB2 ASN 61 HB2 ASN 61 -3.053 6.278 -4.454 391 HB3 ASN 61 HB1 ASN 61 -4.293 7.222 -3.632 392 H GLU 62 HN GLU 62 -4.594 9.594 -4.271 393 HA GLU 62 HA GLU 62 -1.928 10.728 -4.615 394 HB2 GLU 62 HB2 GLU 62 -2.985 12.993 -5.064 395 HB3 GLU 62 HB1 GLU 62 -3.020 11.838 -6.390 396 HG2 GLU 62 HG2 GLU 62 -5.339 11.291 -5.846 397 HG3 GLU 62 HG1 GLU 62 -5.303 12.465 -4.531 398 H PHE 63 HN PHE 63 -1.173 11.535 -2.769 399 HA PHE 63 HA PHE 63 -2.978 12.641 -0.780 400 HD1 PHE 63 HD2 PHE 63 0.598 10.947 0.469 401 HD2 PHE 63 HD1 PHE 63 -2.447 8.495 -1.206 402 HE1 PHE 63 HE2 PHE 63 2.285 9.249 -0.100 403 HE2 PHE 63 HE1 PHE 63 -0.767 6.791 -1.778 404 HZ PHE 63 HZ PHE 63 1.590 7.149 -1.208 405 HB2 PHE 63 HB2 PHE 63 -1.863 11.218 1.019 406 HB3 PHE 63 HB1 PHE 63 -3.037 10.409 -0.011 407 H THR 64 HN THR 64 -1.936 13.902 0.824 408 HA THR 64 HA THR 64 0.653 14.930 -0.063 409 HB THR 64 HB THR 64 -1.228 16.087 2.002 410 HG1 THR 64 HG1 THR 64 -1.667 15.937 -0.525 411 H LEU 65 HN LEU 65 2.472 14.695 1.053 412 HA LEU 65 HA LEU 65 2.990 12.756 2.848 413 HG LEU 65 HG LEU 65 4.476 13.970 0.563 414 HB2 LEU 65 HB2 LEU 65 4.348 15.414 2.579 415 HB3 LEU 65 HB1 LEU 65 4.993 14.093 3.536 416 H GLY 66 HN GLY 66 3.639 15.806 4.254 417 HA2 GLY 66 HA2 GLY 66 2.740 14.936 6.823 418 HA3 GLY 66 HA1 GLY 66 3.403 16.513 6.438 419 H GLU 67 HN GLU 67 0.531 14.961 5.053 420 HA GLU 67 HA GLU 67 -1.225 16.709 6.569 421 HB2 GLU 67 HB2 GLU 67 -0.907 16.876 3.579 422 HB3 GLU 67 HB1 GLU 67 -2.359 17.427 4.399 423 HG2 GLU 67 HG2 GLU 67 0.408 18.453 4.981 424 HG3 GLU 67 HG1 GLU 67 -0.730 19.222 3.877 425 H GLU 68 HN GLU 68 -3.120 15.743 7.006 426 HA GLU 68 HA GLU 68 -3.546 13.044 6.147 427 HB2 GLU 68 HB2 GLU 68 -4.166 13.805 8.400 428 HB3 GLU 68 HB1 GLU 68 -5.348 14.906 7.709 429 HG2 GLU 68 HG2 GLU 68 -6.591 13.001 6.806 430 HG3 GLU 68 HG1 GLU 68 -5.410 11.902 7.521 431 H CYS 69 HN CYS 69 -4.460 12.451 4.302 432 HA CYS 69 HA CYS 69 -6.390 14.278 3.029 433 HG CYS 69 HG CYS 69 -5.292 14.399 -0.530 434 HB2 CYS 69 HB2 CYS 69 -4.256 13.983 1.778 435 HB3 CYS 69 HB1 CYS 69 -4.606 12.262 1.659 436 H GLU 70 HN GLU 70 -8.096 13.274 1.784 437 HA GLU 70 HA GLU 70 -9.009 10.799 3.055 438 HB2 GLU 70 HB2 GLU 70 -10.531 12.699 3.178 439 HB3 GLU 70 HB1 GLU 70 -10.504 12.860 1.427 440 HG2 GLU 70 HG2 GLU 70 -11.570 10.676 1.205 441 HG3 GLU 70 HG1 GLU 70 -11.591 10.509 2.960 442 H LEU 71 HN LEU 71 -8.785 8.950 2.006 443 HA LEU 71 HA LEU 71 -8.645 8.989 -0.934 444 HG LEU 71 HG LEU 71 -6.211 8.892 -1.033 445 HB2 LEU 71 HB2 LEU 71 -7.418 7.111 1.080 446 HB3 LEU 71 HB1 LEU 71 -7.506 6.737 -0.630 447 H GLU 72 HN GLU 72 -9.806 7.504 -2.125 448 HA GLU 72 HA GLU 72 -12.196 6.524 -0.816 449 HB2 GLU 72 HB2 GLU 72 -12.032 7.702 -3.120 450 HB3 GLU 72 HB1 GLU 72 -11.537 6.124 -3.718 451 HG2 GLU 72 HG2 GLU 72 -13.624 5.161 -2.857 452 HG3 GLU 72 HG1 GLU 72 -14.116 6.766 -2.318 453 H THR 73 HN THR 73 -12.678 4.452 -0.380 454 HA THR 73 HA THR 73 -10.578 2.473 -0.744 455 HB THR 73 HB THR 73 -11.936 1.038 0.721 456 HG1 THR 73 HG1 THR 73 -13.739 2.803 1.588 457 H MET 74 HN MET 74 -11.386 0.174 -1.247 458 HA MET 74 HA MET 74 -12.472 0.191 -3.871 459 HB2 MET 74 HB2 MET 74 -10.815 -1.472 -3.057 460 HB3 MET 74 HB1 MET 74 -12.055 -2.162 -2.021 461 HG2 MET 74 HG2 MET 74 -11.749 -3.464 -4.056 462 HG3 MET 74 HG1 MET 74 -13.372 -2.783 -3.954 463 HE1 MET 74 HE1 MET 74 -10.100 -0.830 -4.868 464 HE2 MET 74 HE2 MET 74 -10.066 -0.978 -6.625 465 HE3 MET 74 HE3 MET 74 -9.810 -2.401 -5.615 466 H THR 75 HN THR 75 -13.832 -0.174 -0.712 467 HA THR 75 HA THR 75 -16.282 -1.409 -1.580 468 HB THR 75 HB THR 75 -17.046 -1.156 0.682 469 HG1 THR 75 HG1 THR 75 -15.368 0.981 0.653 470 H GLY 76 HN GLY 76 -15.054 1.805 -1.303 471 HA2 GLY 76 HA2 GLY 76 -16.149 3.584 -2.510 472 HA3 GLY 76 HA1 GLY 76 -17.693 2.845 -2.107 473 H GLU 77 HN GLU 77 -15.631 2.720 0.517 474 HA GLU 77 HA GLU 77 -17.113 4.825 1.862 475 HB2 GLU 77 HB2 GLU 77 -16.851 2.663 2.978 476 HB3 GLU 77 HB1 GLU 77 -15.102 2.823 2.911 477 HG2 GLU 77 HG2 GLU 77 -15.233 4.783 4.369 478 HG3 GLU 77 HG1 GLU 77 -16.984 4.597 4.449 479 H LYS 78 HN LYS 78 -16.187 6.616 2.858 480 HA LYS 78 HA LYS 78 -13.663 7.481 1.684 481 HB2 LYS 78 HB2 LYS 78 -15.638 9.008 3.390 482 HB3 LYS 78 HB1 LYS 78 -14.256 9.695 2.551 483 HG2 LYS 78 HG2 LYS 78 -16.573 8.336 1.193 484 HG3 LYS 78 HG1 LYS 78 -16.413 10.081 1.407 485 HD2 LYS 78 HD2 LYS 78 -14.326 10.037 0.114 486 HD3 LYS 78 HD1 LYS 78 -14.511 8.295 -0.113 487 HE2 LYS 78 HE2 LYS 78 -15.272 9.550 -2.074 488 HE3 LYS 78 HE1 LYS 78 -16.591 8.655 -1.319 489 HZ1 LYS 78 HZ1 LYS 78 -16.047 11.557 -0.988 490 HZ2 LYS 78 HZ2 LYS 78 -17.295 10.705 -0.232 491 HZ3 LYS 78 HZ3 LYS 78 -17.290 10.878 -1.915 492 H VAL 79 HN VAL 79 -11.811 7.222 2.733 493 HA VAL 79 HA VAL 79 -11.856 7.216 5.680 494 HB VAL 79 HB VAL 79 -9.983 5.653 5.671 495 H LYS 80 HN LYS 80 -10.165 8.230 6.759 496 HA LYS 80 HA LYS 80 -8.556 10.047 5.091 497 HB2 LYS 80 HB2 LYS 80 -8.373 11.438 7.148 498 HB3 LYS 80 HB1 LYS 80 -10.024 11.251 6.573 499 HG2 LYS 80 HG2 LYS 80 -10.424 9.541 8.272 500 HG3 LYS 80 HG1 LYS 80 -8.767 9.731 8.849 501 HD2 LYS 80 HD2 LYS 80 -9.967 11.056 10.325 502 HD3 LYS 80 HD1 LYS 80 -9.414 12.226 9.127 503 HE2 LYS 80 HE2 LYS 80 -12.128 10.907 9.150 504 HE3 LYS 80 HE1 LYS 80 -11.784 12.531 9.745 505 HZ1 LYS 80 HZ1 LYS 80 -11.017 13.097 7.484 506 HZ2 LYS 80 HZ2 LYS 80 -12.653 12.673 7.537 507 HZ3 LYS 80 HZ3 LYS 80 -11.514 11.571 6.949 508 H ALA 81 HN ALA 81 -6.381 9.960 5.166 509 HA ALA 81 HA ALA 81 -5.061 8.584 7.370 510 HB1 ALA 81 HB1 ALA 81 -5.553 6.838 5.700 511 HB2 ALA 81 HB2 ALA 81 -3.824 7.086 5.941 512 HB3 ALA 81 HB3 ALA 81 -4.618 7.744 4.510 513 H VAL 82 HN VAL 82 -3.002 9.259 7.759 514 HA VAL 82 HA VAL 82 -1.894 11.285 5.937 515 HB VAL 82 HB VAL 82 -2.702 12.439 7.888 516 H VAL 83 HN VAL 83 -0.101 10.557 5.029 517 HA VAL 83 HA VAL 83 1.630 8.730 6.558 518 HB VAL 83 HB VAL 83 0.883 7.650 4.565 519 H LYS 84 HN LYS 84 3.379 9.673 7.391 520 HA LYS 84 HA LYS 84 4.509 12.014 6.045 521 HB2 LYS 84 HB2 LYS 84 4.551 11.016 8.872 522 HB3 LYS 84 HB1 LYS 84 5.758 12.153 8.310 523 HG2 LYS 84 HG2 LYS 84 3.955 13.706 7.662 524 HG3 LYS 84 HG1 LYS 84 2.782 12.568 8.329 525 HD2 LYS 84 HD2 LYS 84 3.230 14.297 9.949 526 HD3 LYS 84 HD1 LYS 84 3.896 12.771 10.529 527 HE2 LYS 84 HE2 LYS 84 5.444 14.625 10.912 528 HE3 LYS 84 HE1 LYS 84 6.118 13.443 9.788 529 HZ1 LYS 84 HZ1 LYS 84 5.505 14.881 7.954 530 HZ2 LYS 84 HZ2 LYS 84 6.496 15.713 9.042 531 HZ3 LYS 84 HZ3 LYS 84 4.831 16.010 9.022 532 H MET 85 HN MET 85 6.667 12.112 5.495 533 HA MET 85 HA MET 85 8.090 9.537 5.555 534 HB2 MET 85 HB2 MET 85 9.314 10.338 3.569 535 HB3 MET 85 HB1 MET 85 7.581 10.256 3.296 536 HG2 MET 85 HG2 MET 85 8.098 12.262 2.332 537 HG3 MET 85 HG1 MET 85 7.632 12.771 3.953 538 HE1 MET 85 HE1 MET 85 9.266 14.609 1.956 539 HE2 MET 85 HE2 MET 85 10.520 15.265 3.008 540 HE3 MET 85 HE3 MET 85 8.862 15.130 3.593 541 H GLU 86 HN GLU 86 10.162 9.414 6.282 542 HA GLU 86 HA GLU 86 11.184 11.796 7.650 543 HB2 GLU 86 HB2 GLU 86 10.774 9.804 9.037 544 HB3 GLU 86 HB1 GLU 86 11.890 8.886 8.038 545 HG2 GLU 86 HG2 GLU 86 13.119 9.461 9.922 546 HG3 GLU 86 HG1 GLU 86 13.630 10.604 8.692 547 H GLY 87 HN GLY 87 11.791 9.618 5.098 548 HA2 GLY 87 HA2 GLY 87 13.399 9.664 3.442 549 HA3 GLY 87 HA1 GLY 87 14.002 11.150 4.159 550 H ASP 88 HN ASP 88 13.694 8.111 5.888 551 HA ASP 88 HA ASP 88 16.532 7.553 5.642 552 HB2 ASP 88 HB2 ASP 88 16.291 9.243 7.495 553 HB3 ASP 88 HB1 ASP 88 15.327 8.052 8.369 554 H ASN 89 HN ASN 89 14.876 5.854 4.596 555 HA ASN 89 HA ASN 89 14.037 3.739 4.624 556 HB2 ASN 89 HB2 ASN 89 16.412 3.346 5.349 557 HB3 ASN 89 HB1 ASN 89 15.840 3.351 7.015 558 H LYS 90 HN LYS 90 12.981 5.904 6.602 559 HA LYS 90 HA LYS 90 11.238 4.028 8.026 560 HB2 LYS 90 HB2 LYS 90 13.206 5.276 9.328 561 HB3 LYS 90 HB1 LYS 90 11.983 6.528 9.423 562 HG2 LYS 90 HG2 LYS 90 11.521 3.688 10.268 563 HG3 LYS 90 HG1 LYS 90 12.105 4.952 11.350 564 HD2 LYS 90 HD2 LYS 90 10.006 5.599 11.701 565 HD3 LYS 90 HD1 LYS 90 9.857 5.980 9.982 566 HE2 LYS 90 HE2 LYS 90 8.109 4.440 10.592 567 HE3 LYS 90 HE1 LYS 90 9.273 3.606 9.557 568 HZ1 LYS 90 HZ1 LYS 90 9.269 3.451 12.523 569 HZ2 LYS 90 HZ2 LYS 90 10.228 2.549 11.460 570 HZ3 LYS 90 HZ3 LYS 90 8.555 2.299 11.511 571 H MET 91 HN MET 91 9.180 4.437 7.811 572 HA MET 91 HA MET 91 8.215 7.159 7.358 573 HB2 MET 91 HB2 MET 91 8.489 6.183 5.116 574 HB3 MET 91 HB1 MET 91 7.496 4.812 5.587 575 HG2 MET 91 HG2 MET 91 5.579 6.277 5.878 576 HG3 MET 91 HG1 MET 91 6.572 7.670 5.452 577 HE1 MET 91 HE1 MET 91 8.366 6.599 3.103 578 HE2 MET 91 HE2 MET 91 7.523 8.148 3.057 579 HE3 MET 91 HE3 MET 91 7.384 7.028 1.701 580 H VAL 92 HN VAL 92 6.071 7.498 8.072 581 HA VAL 92 HA VAL 92 4.811 5.197 9.404 582 HB VAL 92 HB VAL 92 5.921 6.414 11.155 583 H THR 93 HN THR 93 2.804 4.893 8.774 584 HA THR 93 HA THR 93 1.141 7.208 8.057 585 HB THR 93 HB THR 93 1.820 6.284 5.939 586 HG1 THR 93 HG1 THR 93 -0.623 5.080 5.903 587 H THR 94 HN THR 94 -0.913 7.143 8.844 588 HA THR 94 HA THR 94 -1.803 4.615 10.077 589 HB THR 94 HB THR 94 -2.860 5.894 11.886 590 HG1 THR 94 HG1 THR 94 -2.293 7.972 10.273 591 H PHE 95 HN PHE 95 -3.723 3.915 9.397 592 HA PHE 95 HA PHE 95 -5.710 5.860 8.488 593 HD1 PHE 95 HD1 PHE 95 -2.872 3.190 7.172 594 HD2 PHE 95 HD2 PHE 95 -6.960 2.449 6.257 595 HE1 PHE 95 HE1 PHE 95 -2.356 0.811 6.823 596 HE2 PHE 95 HE2 PHE 95 -6.452 0.068 5.908 597 HZ PHE 95 HZ PHE 95 -4.174 -0.756 6.165 598 HB2 PHE 95 HB2 PHE 95 -6.193 4.651 6.466 599 HB3 PHE 95 HB1 PHE 95 -4.473 5.013 6.495 600 H LYS 96 HN LYS 96 -7.663 5.476 9.283 601 HA LYS 96 HA LYS 96 -9.393 4.502 10.377 602 HB2 LYS 96 HB2 LYS 96 -8.319 2.132 8.863 603 HB3 LYS 96 HB1 LYS 96 -9.760 2.028 9.866 604 HG2 LYS 96 HG2 LYS 96 -10.800 3.800 8.514 605 HG3 LYS 96 HG1 LYS 96 -9.369 3.826 7.483 606 HD2 LYS 96 HD2 LYS 96 -10.968 1.325 7.956 607 HD3 LYS 96 HD1 LYS 96 -11.354 2.460 6.662 608 HE2 LYS 96 HE2 LYS 96 -8.674 1.129 7.027 609 HE3 LYS 96 HE1 LYS 96 -9.933 0.553 5.937 610 HZ1 LYS 96 HZ1 LYS 96 -8.634 3.220 5.788 611 HZ2 LYS 96 HZ2 LYS 96 -9.799 2.620 4.720 612 HZ3 LYS 96 HZ3 LYS 96 -8.272 1.901 4.792 613 H GLY 97 HN GLY 97 -6.626 4.520 11.619 614 HA2 GLY 97 HA2 GLY 97 -6.054 4.085 13.844 615 HA3 GLY 97 HA1 GLY 97 -7.385 2.943 13.939 616 H ILE 98 HN ILE 98 -5.665 2.283 11.186 617 HA ILE 98 HA ILE 98 -4.390 -0.010 12.446 618 HB ILE 98 HB ILE 98 -4.640 0.711 9.519 619 H LYS 99 HN LYS 99 -2.193 -0.365 12.523 620 HA LYS 99 HA LYS 99 -0.538 1.993 12.001 621 HB2 LYS 99 HB2 LYS 99 -0.632 0.376 14.174 622 HB3 LYS 99 HB1 LYS 99 0.670 -0.388 13.266 623 HG2 LYS 99 HG2 LYS 99 1.650 1.172 14.761 624 HG3 LYS 99 HG1 LYS 99 1.783 1.841 13.133 625 HD2 LYS 99 HD2 LYS 99 -0.190 3.240 13.562 626 HD3 LYS 99 HD1 LYS 99 -0.289 2.586 15.199 627 HE2 LYS 99 HE2 LYS 99 1.980 4.199 14.038 628 HE3 LYS 99 HE1 LYS 99 0.799 4.752 15.227 629 HZ1 LYS 99 HZ1 LYS 99 2.858 4.151 16.300 630 HZ2 LYS 99 HZ2 LYS 99 2.810 2.601 15.626 631 HZ3 LYS 99 HZ3 LYS 99 1.646 3.065 16.762 632 H SER 100 HN SER 100 0.558 2.106 10.181 633 HA SER 100 HA SER 100 1.581 -0.389 9.016 634 HG SER 100 HG SER 100 -0.844 0.123 8.367 635 HB2 SER 100 HB2 SER 100 0.479 2.042 7.603 636 HB3 SER 100 HB1 SER 100 1.389 0.773 6.783 637 H VAL 101 HN VAL 101 3.726 -0.497 9.014 638 HA VAL 101 HA VAL 101 5.246 2.022 9.111 639 HB VAL 101 HB VAL 101 6.084 -0.749 9.982 640 H THR 102 HN THR 102 6.270 2.584 7.321 641 HA THR 102 HA THR 102 7.049 0.472 5.421 642 HB THR 102 HB THR 102 6.378 3.348 4.773 643 HG1 THR 102 HG1 THR 102 4.469 2.320 5.243 644 H GLU 103 HN GLU 103 9.176 0.200 5.169 645 HA GLU 103 HA GLU 103 10.983 2.326 6.017 646 HB2 GLU 103 HB2 GLU 103 11.355 -0.607 5.417 647 HB3 GLU 103 HB1 GLU 103 12.702 0.485 5.670 648 HG2 GLU 103 HG2 GLU 103 11.876 1.015 7.896 649 HG3 GLU 103 HG1 GLU 103 10.520 -0.085 7.650 650 H PHE 104 HN PHE 104 12.197 3.480 4.576 651 HA PHE 104 HA PHE 104 11.829 2.751 1.739 652 HD1 PHE 104 HD1 PHE 104 9.203 4.467 2.199 653 HD2 PHE 104 HD2 PHE 104 12.455 5.527 -0.335 654 HE1 PHE 104 HE1 PHE 104 7.646 4.719 0.311 655 HE2 PHE 104 HE2 PHE 104 10.903 5.783 -2.226 656 HZ PHE 104 HZ PHE 104 8.495 5.378 -1.904 657 HB2 PHE 104 HB2 PHE 104 11.388 5.188 3.103 658 HB3 PHE 104 HB1 PHE 104 12.751 5.441 2.017 659 H ASN 105 HN ASN 105 13.502 1.913 0.778 660 HA ASN 105 HA ASN 105 16.190 2.931 1.414 661 HB2 ASN 105 HB2 ASN 105 15.232 0.295 1.773 662 HB3 ASN 105 HB1 ASN 105 16.298 0.251 0.372 663 H GLY 106 HN GLY 106 17.697 2.923 -0.354 664 HA2 GLY 106 HA2 GLY 106 16.436 3.571 -2.856 665 HA3 GLY 106 HA1 GLY 106 18.156 3.628 -2.507 666 H ASP 107 HN ASP 107 16.058 0.805 -2.120 667 HA ASP 107 HA ASP 107 16.693 -0.405 -4.588 668 HB2 ASP 107 HB2 ASP 107 18.217 -2.192 -3.712 669 HB3 ASP 107 HB1 ASP 107 18.942 -0.590 -3.773 670 H THR 108 HN THR 108 15.598 -0.683 -1.282 671 HA THR 108 HA THR 108 13.724 -2.760 -2.142 672 HB THR 108 HB THR 108 15.337 -2.980 0.405 673 HG1 THR 108 HG1 THR 108 15.427 -4.777 -1.780 674 H ILE 109 HN ILE 109 11.710 -2.475 -1.398 675 HA ILE 109 HA ILE 109 11.301 -0.500 0.757 676 HB ILE 109 HB ILE 109 9.583 -1.057 -1.660 677 H THR 110 HN THR 110 10.436 -1.307 2.554 678 HA THR 110 HA THR 110 8.919 -3.828 2.382 679 HB THR 110 HB THR 110 10.301 -2.710 4.827 680 HG1 THR 110 HG1 THR 110 12.072 -3.562 4.057 681 H ASN 111 HN ASN 111 6.907 -3.986 3.276 682 HA ASN 111 HA ASN 111 5.815 -1.560 4.551 683 HB2 ASN 111 HB2 ASN 111 4.992 -1.854 2.227 684 HB3 ASN 111 HB1 ASN 111 4.340 -3.426 2.681 685 H THR 112 HN THR 112 4.790 -1.837 6.449 686 HA THR 112 HA THR 112 4.195 -4.600 7.305 687 HB THR 112 HB THR 112 4.802 -2.421 9.278 688 HG1 THR 112 HG1 THR 112 6.939 -4.033 8.767 689 H MET 113 HN MET 113 2.072 -4.941 7.542 690 HA MET 113 HA MET 113 0.416 -2.726 8.563 691 HB2 MET 113 HB2 MET 113 -0.343 -4.801 6.498 692 HB3 MET 113 HB1 MET 113 -1.471 -3.670 7.232 693 HG2 MET 113 HG2 MET 113 -0.195 -1.802 6.298 694 HG3 MET 113 HG1 MET 113 0.912 -2.949 5.543 695 HE1 MET 113 HE1 MET 113 -0.650 -0.610 4.037 696 HE2 MET 113 HE2 MET 113 -1.220 -1.410 2.572 697 HE3 MET 113 HE3 MET 113 0.420 -1.698 3.152 698 H THR 114 HN THR 114 -0.665 -3.169 10.402 699 HA THR 114 HA THR 114 -0.928 -6.009 11.159 700 HB THR 114 HB THR 114 -0.480 -3.680 13.033 701 HG1 THR 114 HG1 THR 114 1.590 -4.626 13.291 702 H LEU 115 HN LEU 115 -2.932 -6.693 11.361 703 HA LEU 115 HA LEU 115 -4.975 -4.959 12.512 704 HG LEU 115 HG LEU 115 -7.389 -4.856 9.698 705 HB2 LEU 115 HB2 LEU 115 -5.046 -4.774 9.984 706 HB3 LEU 115 HB1 LEU 115 -5.474 -6.471 9.946 707 H GLY 116 HN GLY 116 -5.771 -6.089 14.168 708 HA2 GLY 116 HA2 GLY 116 -6.619 -7.841 15.395 709 HA3 GLY 116 HA1 GLY 116 -6.914 -8.657 13.867 710 H ASP 117 HN ASP 117 -3.852 -7.588 15.284 711 HA ASP 117 HA ASP 117 -1.983 -8.688 15.931 712 HB2 ASP 117 HB2 ASP 117 -3.894 -11.009 16.229 713 HB3 ASP 117 HB1 ASP 117 -2.204 -11.057 16.723 714 H ILE 118 HN ILE 118 -3.425 -9.078 13.090 715 HA ILE 118 HA ILE 118 -1.812 -11.262 12.061 716 HB ILE 118 HB ILE 118 -3.558 -9.366 10.488 717 H VAL 119 HN VAL 119 -0.010 -11.066 10.812 718 HA VAL 119 HA VAL 119 1.091 -8.354 10.562 719 HB VAL 119 HB VAL 119 2.622 -10.940 10.346 720 H TYR 120 HN TYR 120 1.587 -7.487 8.663 721 HA TYR 120 HA TYR 120 1.407 -9.172 6.251 722 HD1 TYR 120 HD2 TYR 120 1.711 -5.603 4.560 723 HD2 TYR 120 HD1 TYR 120 -1.196 -8.707 4.409 724 HE1 TYR 120 HE2 TYR 120 1.606 -5.380 2.112 725 HE2 TYR 120 HE1 TYR 120 -1.305 -8.494 1.962 726 HH TYR 120 HH TYR 120 -0.830 -6.835 0.233 727 HB2 TYR 120 HB2 TYR 120 -0.593 -7.739 6.501 728 HB3 TYR 120 HB1 TYR 120 0.441 -6.321 6.585 729 H LYS 121 HN LYS 121 3.281 -9.213 5.182 730 HA LYS 121 HA LYS 121 4.996 -6.824 5.265 731 HB2 LYS 121 HB2 LYS 121 5.935 -8.536 6.737 732 HB3 LYS 121 HB1 LYS 121 5.898 -9.705 5.424 733 HG2 LYS 121 HG2 LYS 121 7.524 -8.394 4.183 734 HG3 LYS 121 HG1 LYS 121 7.534 -7.176 5.458 735 HD2 LYS 121 HD2 LYS 121 9.460 -8.602 5.713 736 HD3 LYS 121 HD1 LYS 121 8.339 -8.905 7.042 737 HE2 LYS 121 HE2 LYS 121 7.529 -10.907 5.938 738 HE3 LYS 121 HE1 LYS 121 8.555 -10.580 4.541 739 HZ1 LYS 121 HZ1 LYS 121 9.528 -11.140 7.291 740 HZ2 LYS 121 HZ2 LYS 121 10.499 -10.864 5.934 741 HZ3 LYS 121 HZ3 LYS 121 9.525 -12.245 6.009 742 H ARG 122 HN ARG 122 5.453 -6.037 3.328 743 HA ARG 122 HA ARG 122 5.208 -7.823 1.001 744 HE ARG 122 HE ARG 122 4.464 -3.123 0.234 745 HB2 ARG 122 HB2 ARG 122 3.562 -6.152 0.773 746 HB3 ARG 122 HB1 ARG 122 4.646 -4.884 1.325 747 HG2 ARG 122 HG2 ARG 122 5.913 -5.035 -0.736 748 HG3 ARG 122 HG1 ARG 122 4.896 -6.373 -1.282 749 HD2 ARG 122 HD2 ARG 122 4.288 -4.166 -2.264 750 HD3 ARG 122 HD1 ARG 122 2.974 -4.952 -1.391 751 HH11 ARG 122 HH11 ARG 122 1.885 -3.401 -2.094 752 HH12 ARG 122 HH12 ARG 122 1.088 -1.954 -1.574 753 HH21 ARG 122 HH21 ARG 122 3.422 -1.216 0.921 754 HH22 ARG 122 HH22 ARG 122 1.962 -0.712 0.139 755 H VAL 123 HN VAL 123 7.005 -8.293 -0.037 756 HA VAL 123 HA VAL 123 9.393 -6.641 0.409 757 HB VAL 123 HB VAL 123 9.196 -9.440 -0.719 758 H SER 124 HN SER 124 9.967 -5.279 -1.156 759 HA SER 124 HA SER 124 9.380 -6.021 -3.938 760 HG SER 124 HG SER 124 8.415 -2.615 -2.128 761 HB2 SER 124 HB2 SER 124 8.776 -3.722 -4.456 762 HB3 SER 124 HB1 SER 124 7.755 -4.321 -3.151 763 H LYS 125 HN LYS 125 10.954 -5.608 -5.413 764 HA LYS 125 HA LYS 125 13.427 -4.378 -4.388 765 HB2 LYS 125 HB2 LYS 125 14.622 -5.829 -6.037 766 HB3 LYS 125 HB1 LYS 125 13.817 -6.713 -4.750 767 HG2 LYS 125 HG2 LYS 125 13.140 -7.990 -6.467 768 HG3 LYS 125 HG1 LYS 125 11.869 -6.771 -6.572 769 HD2 LYS 125 HD2 LYS 125 12.712 -7.110 -8.776 770 HD3 LYS 125 HD1 LYS 125 13.316 -5.548 -8.221 771 HE2 LYS 125 HE2 LYS 125 15.461 -6.566 -7.662 772 HE3 LYS 125 HE1 LYS 125 14.857 -8.141 -8.173 773 HZ1 LYS 125 HZ1 LYS 125 15.157 -5.765 -9.931 774 HZ2 LYS 125 HZ2 LYS 125 14.616 -7.293 -10.416 775 HZ3 LYS 125 HZ3 LYS 125 16.209 -7.089 -9.885 776 H ARG 126 HN ARG 126 14.550 -2.963 -5.692 777 HA ARG 126 HA ARG 126 12.996 -1.472 -7.553 778 HE ARG 126 HE ARG 126 17.540 -0.085 -7.793 779 HB2 ARG 126 HB2 ARG 126 14.707 -0.469 -6.060 780 HB3 ARG 126 HB1 ARG 126 15.959 -1.290 -6.981 781 HG2 ARG 126 HG2 ARG 126 15.326 -0.035 -8.974 782 HG3 ARG 126 HG1 ARG 126 14.059 0.783 -8.058 783 HD2 ARG 126 HD2 ARG 126 16.014 2.205 -8.226 784 HD3 ARG 126 HD1 ARG 126 15.770 1.708 -6.553 785 HH11 ARG 126 HH11 ARG 126 17.401 3.220 -6.691 786 HH12 ARG 126 HH12 ARG 126 19.104 3.323 -6.386 787 HH21 ARG 126 HH21 ARG 126 19.781 0.045 -7.390 788 HH22 ARG 126 HH22 ARG 126 20.456 1.521 -6.783 789 H ILE 127 HN ILE 127 12.953 -1.513 -9.726 790 HA ILE 127 HA ILE 127 14.868 -3.271 -11.113 791 HB ILE 127 HB ILE 127 13.038 -3.783 -12.744 792 H9 OLA 128 HH1 OLA 128 -6.005 -8.128 -5.095 793 H10 OLA 128 HI1 OLA 128 -5.993 -6.813 -3.020 794 H21 OLA 128 HA1 OLA 128 -9.092 -10.415 -11.969 795 H22 OLA 128 HA2 OLA 128 -8.757 -11.695 -10.804 796 H31 OLA 128 HB1 OLA 128 -9.675 -9.421 -9.373 797 H32 OLA 128 HB2 OLA 128 -8.085 -10.185 -9.326 798 H41 OLA 128 HC1 OLA 128 -8.991 -7.770 -10.767 799 H42 OLA 128 HC2 OLA 128 -7.864 -8.819 -11.631 800 H51 OLA 128 HD1 OLA 128 -6.456 -8.754 -9.493 801 H52 OLA 128 HD2 OLA 128 -6.489 -7.301 -10.495 802 H61 OLA 128 HE1 OLA 128 -8.653 -7.140 -8.671 803 H62 OLA 128 HE2 OLA 128 -7.214 -6.122 -8.760 804 H71 OLA 128 HF1 OLA 128 -7.646 -8.607 -7.127 805 H72 OLA 128 HF2 OLA 128 -6.035 -7.963 -7.447 806 H81 OLA 128 HG1 OLA 128 -6.862 -5.765 -6.518 807 H82 OLA 128 HG2 OLA 128 -8.302 -6.633 -5.980 808 H111 OLA 128 HJ1 OLA 128 -6.729 -4.453 -4.400 809 H112 OLA 128 HJ2 OLA 128 -8.247 -5.324 -4.163 810 H121 OLA 128 HK1 OLA 128 -8.314 -4.587 -2.068 811 H122 OLA 128 HK2 OLA 128 -6.824 -5.469 -1.728 812 H131 OLA 128 HL1 OLA 128 -5.922 -3.234 -3.047 813 H132 OLA 128 HL2 OLA 128 -5.929 -3.465 -1.296 814 H141 OLA 128 HM1 OLA 128 -7.472 -1.883 -1.013 815 H142 OLA 128 HM2 OLA 128 -8.511 -2.584 -2.256 816 H151 OLA 128 HN1 OLA 128 -8.034 -0.835 -3.544 817 H152 OLA 128 HN2 OLA 128 -6.373 -1.423 -3.636 818 H161 OLA 128 HP1 OLA 128 -5.945 0.644 -2.799 819 H162 OLA 128 HP2 OLA 128 -6.239 -0.194 -1.274 820 H171 OLA 128 HQ1 OLA 128 -7.961 1.156 -0.835 821 H172 OLA 128 HQ2 OLA 128 -8.735 0.702 -2.362 822 H181 OLA 128 HR1 OLA 128 -7.839 3.201 -1.755 823 H182 OLA 128 HR2 OLA 128 -6.470 2.538 -2.648 824 H183 OLA 128 HR3 OLA 128 -8.070 2.585 -3.390 825 H9 OLA 129 HH1 OLA 129 -0.260 4.379 -0.022 826 H10 OLA 129 HI1 OLA 129 -2.704 4.590 0.028 827 H21 OLA 129 HA1 OLA 129 5.915 1.292 0.040 828 H22 OLA 129 HA2 OLA 129 6.640 2.626 -0.856 829 H31 OLA 129 HB1 OLA 129 5.076 3.950 0.001 830 H32 OLA 129 HB2 OLA 129 3.890 3.080 -0.974 831 H41 OLA 129 HC1 OLA 129 4.705 1.832 1.585 832 H42 OLA 129 HC2 OLA 129 3.132 1.858 0.786 833 H51 OLA 129 HD1 OLA 129 3.944 3.404 2.963 834 H52 OLA 129 HD2 OLA 129 3.932 4.512 1.590 835 H61 OLA 129 HE1 OLA 129 1.726 3.476 3.075 836 H62 OLA 129 HE2 OLA 129 1.603 2.921 1.403 837 H71 OLA 129 HF1 OLA 129 2.104 5.793 2.156 838 H72 OLA 129 HF2 OLA 129 1.671 5.150 0.571 839 H81 OLA 129 HG1 OLA 129 -0.184 4.618 2.828 840 H82 OLA 129 HG2 OLA 129 -0.125 6.262 2.185 841 H111 OLA 129 HJ1 OLA 129 -2.168 6.199 2.509 842 H112 OLA 129 HJ2 OLA 129 -3.722 5.931 1.721 843 H121 OLA 129 HK1 OLA 129 -2.392 3.551 2.866 844 H122 OLA 129 HK2 OLA 129 -3.023 4.735 4.014 845 H131 OLA 129 HL1 OLA 129 -5.002 4.379 2.039 846 H132 OLA 129 HL2 OLA 129 -5.056 3.886 3.733 847 H141 OLA 129 HM1 OLA 129 -5.128 1.774 3.035 848 H142 OLA 129 HM2 OLA 129 -3.468 1.971 2.465 849 H151 OLA 129 HN1 OLA 129 -4.880 3.116 0.436 850 H152 OLA 129 HN2 OLA 129 -5.980 1.836 0.954 851 H161 OLA 129 HP1 OLA 129 -4.716 0.273 -0.000 852 H162 OLA 129 HP2 OLA 129 -3.271 0.863 0.822 853 H171 OLA 129 HQ1 OLA 129 -3.920 1.068 -1.925 854 H172 OLA 129 HQ2 OLA 129 -3.960 2.705 -1.249 855 H181 OLA 129 HR1 OLA 129 -1.740 2.754 -1.019 856 H182 OLA 129 HR2 OLA 129 -1.704 1.305 -2.024 857 H183 OLA 129 HR3 OLA 129 -1.709 1.159 -0.267 Start of MODEL 10 1 HA MET 1 HA MET 1 16.628 12.871 -1.995 2 H1 MET 1 HT1 MET 1 17.839 12.331 0.011 3 H2 MET 1 HT2 MET 1 17.895 10.701 -0.434 4 H3 MET 1 HT3 MET 1 16.409 11.434 -0.099 5 HB2 MET 1 HB2 MET 1 18.486 12.400 -3.612 6 HB3 MET 1 HB1 MET 1 19.003 13.132 -2.101 7 HG2 MET 1 HG2 MET 1 20.590 11.486 -2.530 8 HG3 MET 1 HG1 MET 1 19.529 10.770 -1.320 9 HE1 MET 1 HE1 MET 1 21.590 9.116 -3.126 10 HE2 MET 1 HE2 MET 1 20.609 7.713 -3.547 11 HE3 MET 1 HE3 MET 1 20.555 8.368 -1.910 12 H ASN 2 HN ASN 2 16.676 9.600 -1.210 13 HA ASN 2 HA ASN 2 15.677 8.775 -3.840 14 HB2 ASN 2 HB2 ASN 2 15.824 6.453 -2.831 15 HB3 ASN 2 HB1 ASN 2 17.357 7.294 -3.037 16 H PHE 3 HN PHE 3 13.570 9.174 -4.066 17 HA PHE 3 HA PHE 3 11.745 8.100 -2.042 18 HD1 PHE 3 HD2 PHE 3 10.782 9.776 0.172 19 HD2 PHE 3 HD1 PHE 3 13.506 11.808 -2.390 20 HE1 PHE 3 HE2 PHE 3 11.940 10.694 2.139 21 HE2 PHE 3 HE1 PHE 3 14.671 12.728 -0.428 22 HZ PHE 3 HZ PHE 3 13.887 12.173 1.840 23 HB2 PHE 3 HB2 PHE 3 11.491 10.859 -3.259 24 HB3 PHE 3 HB1 PHE 3 10.306 10.095 -2.203 25 H SER 4 HN SER 4 12.238 9.291 -5.319 26 HA SER 4 HA SER 4 9.783 7.963 -6.201 27 HG SER 4 HG SER 4 12.492 9.228 -8.158 28 HB2 SER 4 HB2 SER 4 10.179 9.129 -8.349 29 HB3 SER 4 HB1 SER 4 10.114 10.252 -6.990 30 H GLY 5 HN GLY 5 9.792 6.081 -7.252 31 HA2 GLY 5 HA2 GLY 5 11.843 5.205 -8.984 32 HA3 GLY 5 HA1 GLY 5 12.061 4.461 -7.409 33 H LYS 6 HN LYS 6 11.638 2.872 -9.563 34 HA LYS 6 HA LYS 6 8.815 2.070 -9.380 35 HB2 LYS 6 HB2 LYS 6 9.807 2.592 -11.643 36 HB3 LYS 6 HB1 LYS 6 10.845 1.190 -11.438 37 HG2 LYS 6 HG2 LYS 6 7.884 0.896 -11.200 38 HG3 LYS 6 HG1 LYS 6 8.641 0.990 -12.790 39 HD2 LYS 6 HD2 LYS 6 10.135 -0.890 -12.108 40 HD3 LYS 6 HD1 LYS 6 9.191 -1.033 -10.623 41 HE2 LYS 6 HE2 LYS 6 8.187 -1.381 -13.445 42 HE3 LYS 6 HE1 LYS 6 8.416 -2.649 -12.243 43 HZ1 LYS 6 HZ1 LYS 6 6.101 -2.012 -12.395 44 HZ2 LYS 6 HZ2 LYS 6 6.485 -0.403 -12.047 45 HZ3 LYS 6 HZ3 LYS 6 6.715 -1.597 -10.874 46 H TYR 7 HN TYR 7 8.387 0.418 -8.088 47 HA TYR 7 HA TYR 7 10.462 -1.635 -7.678 48 HD1 TYR 7 HD2 TYR 7 11.884 -0.083 -6.313 49 HD2 TYR 7 HD1 TYR 7 8.118 1.014 -4.662 50 HE1 TYR 7 HE2 TYR 7 12.821 2.084 -5.625 51 HE2 TYR 7 HE1 TYR 7 9.048 3.183 -3.968 52 HH TYR 7 HH TYR 7 12.042 4.340 -5.078 53 HB2 TYR 7 HB2 TYR 7 8.323 -1.050 -5.651 54 HB3 TYR 7 HB1 TYR 7 9.900 -1.798 -5.413 55 H GLN 8 HN GLN 8 9.759 -3.809 -7.455 56 HA GLN 8 HA GLN 8 7.026 -4.323 -8.412 57 HB2 GLN 8 HB2 GLN 8 8.615 -4.668 -10.242 58 HB3 GLN 8 HB1 GLN 8 9.560 -5.752 -9.230 59 HG2 GLN 8 HG2 GLN 8 8.199 -6.981 -10.821 60 HG3 GLN 8 HG1 GLN 8 7.720 -7.330 -9.165 61 H VAL 9 HN VAL 9 5.895 -5.721 -7.231 62 HA VAL 9 HA VAL 9 6.939 -6.764 -4.807 63 HB VAL 9 HB VAL 9 4.352 -7.328 -6.254 64 H GLN 10 HN GLN 10 7.672 -8.772 -4.301 65 HA GLN 10 HA GLN 10 7.943 -10.673 -6.527 66 HB2 GLN 10 HB2 GLN 10 9.619 -10.490 -4.020 67 HB3 GLN 10 HB1 GLN 10 9.907 -11.544 -5.396 68 HG2 GLN 10 HG2 GLN 10 10.258 -9.554 -6.808 69 HG3 GLN 10 HG1 GLN 10 10.055 -8.540 -5.382 70 H SER 11 HN SER 11 7.207 -10.435 -3.067 71 HA SER 11 HA SER 11 5.403 -12.659 -3.238 72 HG SER 11 HG SER 11 7.057 -14.887 -3.410 73 HB2 SER 11 HB2 SER 11 7.941 -12.962 -1.614 74 HB3 SER 11 HB1 SER 11 6.550 -14.043 -1.521 75 H GLN 12 HN GLN 12 4.338 -13.116 -1.161 76 HA GLN 12 HA GLN 12 4.575 -11.039 0.878 77 HB2 GLN 12 HB2 GLN 12 2.826 -10.500 -1.019 78 HB3 GLN 12 HB1 GLN 12 1.835 -11.669 -0.160 79 HG2 GLN 12 HG2 GLN 12 3.022 -9.179 1.046 80 HG3 GLN 12 HG1 GLN 12 1.360 -9.357 0.489 81 H GLU 13 HN GLU 13 4.245 -11.853 2.894 82 HA GLU 13 HA GLU 13 3.458 -14.661 3.079 83 HB2 GLU 13 HB2 GLU 13 4.277 -14.465 5.439 84 HB3 GLU 13 HB1 GLU 13 5.501 -14.143 4.218 85 HG2 GLU 13 HG2 GLU 13 5.134 -11.718 4.557 86 HG3 GLU 13 HG1 GLU 13 4.009 -12.105 5.858 87 H ASN 14 HN ASN 14 1.548 -15.294 3.776 88 HA ASN 14 HA ASN 14 -0.443 -15.385 4.879 89 HB2 ASN 14 HB2 ASN 14 -0.735 -14.244 6.799 90 HB3 ASN 14 HB1 ASN 14 0.913 -13.692 6.531 91 H PHE 15 HN PHE 15 -2.576 -14.776 4.407 92 HA PHE 15 HA PHE 15 -3.191 -12.360 3.023 93 HD1 PHE 15 HD1 PHE 15 -4.109 -11.437 0.900 94 HD2 PHE 15 HD2 PHE 15 -0.693 -13.873 0.196 95 HE1 PHE 15 HE1 PHE 15 -3.147 -9.671 -0.517 96 HE2 PHE 15 HE2 PHE 15 0.277 -12.111 -1.220 97 HZ PHE 15 HZ PHE 15 -0.951 -10.006 -1.578 98 HB2 PHE 15 HB2 PHE 15 -2.369 -14.688 1.506 99 HB3 PHE 15 HB1 PHE 15 -3.991 -14.165 1.062 100 H GLU 16 HN GLU 16 -4.180 -15.723 3.584 101 HA GLU 16 HA GLU 16 -6.940 -15.298 3.259 102 HB2 GLU 16 HB2 GLU 16 -5.564 -17.412 4.925 103 HB3 GLU 16 HB1 GLU 16 -7.233 -17.455 4.372 104 HG2 GLU 16 HG2 GLU 16 -4.793 -17.473 2.608 105 HG3 GLU 16 HG1 GLU 16 -5.789 -18.869 3.012 106 HA PRO 17 HA PRO 17 -7.231 -14.840 8.058 107 HB2 PRO 17 HB2 PRO 17 -4.569 -14.016 8.954 108 HB3 PRO 17 HB1 PRO 17 -5.603 -15.310 9.564 109 HG2 PRO 17 HG2 PRO 17 -3.325 -15.806 8.204 110 HG3 PRO 17 HG1 PRO 17 -4.744 -16.866 8.101 111 HD2 PRO 17 HD2 PRO 17 -3.804 -14.767 6.177 112 HD3 PRO 17 HD1 PRO 17 -4.433 -16.394 5.848 113 H PHE 18 HN PHE 18 -4.718 -12.768 6.629 114 HA PHE 18 HA PHE 18 -5.371 -10.400 7.960 115 HD1 PHE 18 HD1 PHE 18 -3.192 -8.654 8.055 116 HD2 PHE 18 HD2 PHE 18 -4.834 -8.705 4.131 117 HE1 PHE 18 HE1 PHE 18 -2.955 -6.209 7.931 118 HE2 PHE 18 HE2 PHE 18 -4.599 -6.259 3.998 119 HZ PHE 18 HZ PHE 18 -3.647 -5.008 5.887 120 HB2 PHE 18 HB2 PHE 18 -3.292 -10.734 6.665 121 HB3 PHE 18 HB1 PHE 18 -4.229 -10.724 5.175 122 H MET 19 HN MET 19 -6.395 -11.516 4.739 123 HA MET 19 HA MET 19 -8.116 -9.342 4.215 124 HB2 MET 19 HB2 MET 19 -8.071 -12.136 3.086 125 HB3 MET 19 HB1 MET 19 -9.037 -10.817 2.441 126 HG2 MET 19 HG2 MET 19 -6.035 -10.839 2.643 127 HG3 MET 19 HG1 MET 19 -6.962 -11.177 1.183 128 HE1 MET 19 HE1 MET 19 -5.545 -7.704 0.238 129 HE2 MET 19 HE2 MET 19 -5.868 -9.349 -0.307 130 HE3 MET 19 HE3 MET 19 -4.731 -9.063 1.011 131 H LYS 20 HN LYS 20 -8.673 -12.509 5.695 132 HA LYS 20 HA LYS 20 -11.468 -12.478 5.739 133 HB2 LYS 20 HB2 LYS 20 -9.333 -13.928 7.072 134 HB3 LYS 20 HB1 LYS 20 -10.700 -13.666 8.144 135 HG2 LYS 20 HG2 LYS 20 -10.830 -15.805 6.944 136 HG3 LYS 20 HG1 LYS 20 -12.195 -14.743 6.596 137 HD2 LYS 20 HD2 LYS 20 -11.093 -14.064 4.496 138 HD3 LYS 20 HD1 LYS 20 -9.780 -15.190 4.842 139 HE2 LYS 20 HE2 LYS 20 -11.329 -17.056 4.777 140 HE3 LYS 20 HE1 LYS 20 -12.678 -15.952 4.514 141 HZ1 LYS 20 HZ1 LYS 20 -11.908 -17.002 2.460 142 HZ2 LYS 20 HZ2 LYS 20 -10.381 -16.302 2.664 143 HZ3 LYS 20 HZ3 LYS 20 -11.734 -15.321 2.404 144 H ALA 21 HN ALA 21 -9.117 -11.198 8.038 145 HA ALA 21 HA ALA 21 -11.016 -10.233 9.915 146 HB1 ALA 21 HB1 ALA 21 -9.141 -8.980 10.871 147 HB2 ALA 21 HB2 ALA 21 -8.164 -9.364 9.454 148 HB3 ALA 21 HB3 ALA 21 -8.696 -10.653 10.533 149 H MET 22 HN MET 22 -10.001 -9.116 6.867 150 HA MET 22 HA MET 22 -10.801 -6.357 7.375 151 HB2 MET 22 HB2 MET 22 -8.801 -6.633 6.061 152 HB3 MET 22 HB1 MET 22 -9.619 -7.725 4.953 153 HG2 MET 22 HG2 MET 22 -9.384 -5.606 3.892 154 HG3 MET 22 HG1 MET 22 -11.087 -5.850 4.271 155 HE1 MET 22 HE1 MET 22 -7.791 -3.958 5.182 156 HE2 MET 22 HE2 MET 22 -8.142 -4.798 6.693 157 HE3 MET 22 HE3 MET 22 -8.268 -3.040 6.609 158 H GLY 23 HN GLY 23 -11.420 -8.418 4.549 159 HA2 GLY 23 HA2 GLY 23 -14.036 -9.013 4.691 160 HA3 GLY 23 HA1 GLY 23 -14.082 -7.300 4.300 161 H LEU 24 HN LEU 24 -11.738 -9.702 3.180 162 HA LEU 24 HA LEU 24 -12.722 -9.251 0.444 163 HG LEU 24 HG LEU 24 -10.615 -10.294 -1.218 164 HB2 LEU 24 HB2 LEU 24 -10.441 -8.303 1.040 165 HB3 LEU 24 HB1 LEU 24 -9.892 -9.962 1.179 166 HA PRO 25 HA PRO 25 -13.480 -13.622 0.421 167 HB2 PRO 25 HB2 PRO 25 -13.954 -13.939 -2.218 168 HB3 PRO 25 HB1 PRO 25 -15.110 -13.144 -1.141 169 HG2 PRO 25 HG2 PRO 25 -13.088 -11.916 -2.981 170 HG3 PRO 25 HG1 PRO 25 -14.790 -11.479 -2.747 171 HD2 PRO 25 HD2 PRO 25 -12.774 -10.116 -1.584 172 HD3 PRO 25 HD1 PRO 25 -14.353 -10.324 -0.799 173 H GLU 26 HN GLU 26 -12.205 -15.342 0.311 174 HA GLU 26 HA GLU 26 -9.539 -15.294 -0.333 175 HB2 GLU 26 HB2 GLU 26 -9.591 -17.740 -0.303 176 HB3 GLU 26 HB1 GLU 26 -10.538 -17.066 1.012 177 HG2 GLU 26 HG2 GLU 26 -11.735 -18.004 -1.579 178 HG3 GLU 26 HG1 GLU 26 -11.554 -19.030 -0.158 179 H ASP 27 HN ASP 27 -12.241 -15.976 -2.477 180 HA ASP 27 HA ASP 27 -10.873 -17.146 -4.598 181 HB2 ASP 27 HB2 ASP 27 -13.307 -17.033 -4.519 182 HB3 ASP 27 HB1 ASP 27 -13.255 -15.279 -4.675 183 H LEU 28 HN LEU 28 -11.492 -13.704 -3.972 184 HA LEU 28 HA LEU 28 -10.088 -12.782 -6.259 185 HG LEU 28 HG LEU 28 -11.541 -10.842 -6.722 186 HB2 LEU 28 HB2 LEU 28 -11.190 -11.515 -3.796 187 HB3 LEU 28 HB1 LEU 28 -10.057 -10.602 -4.773 188 H ILE 29 HN ILE 29 -9.171 -13.378 -2.921 189 HA ILE 29 HA ILE 29 -6.706 -12.061 -2.863 190 HB ILE 29 HB ILE 29 -7.419 -14.620 -1.431 191 H GLN 30 HN GLN 30 -7.457 -15.436 -3.678 192 HA GLN 30 HA GLN 30 -4.852 -16.325 -4.084 193 HB2 GLN 30 HB2 GLN 30 -7.368 -17.246 -5.480 194 HB3 GLN 30 HB1 GLN 30 -5.858 -18.143 -5.385 195 HG2 GLN 30 HG2 GLN 30 -7.747 -17.466 -3.147 196 HG3 GLN 30 HG1 GLN 30 -7.326 -19.061 -3.772 197 H LYS 31 HN LYS 31 -7.097 -14.788 -6.351 198 HA LYS 31 HA LYS 31 -5.421 -15.064 -8.626 199 HB2 LYS 31 HB2 LYS 31 -7.852 -13.474 -7.957 200 HB3 LYS 31 HB1 LYS 31 -6.922 -13.013 -9.377 201 HG2 LYS 31 HG2 LYS 31 -8.652 -14.465 -10.095 202 HG3 LYS 31 HG1 LYS 31 -7.144 -15.378 -10.171 203 HD2 LYS 31 HD2 LYS 31 -7.697 -16.321 -7.924 204 HD3 LYS 31 HD1 LYS 31 -9.272 -15.537 -8.045 205 HE2 LYS 31 HE2 LYS 31 -9.440 -17.859 -8.719 206 HE3 LYS 31 HE1 LYS 31 -9.734 -16.800 -10.097 207 HZ1 LYS 31 HZ1 LYS 31 -7.498 -17.198 -10.867 208 HZ2 LYS 31 HZ2 LYS 31 -8.290 -18.677 -10.652 209 HZ3 LYS 31 HZ3 LYS 31 -7.156 -18.154 -9.514 210 H GLY 32 HN GLY 32 -5.665 -12.687 -6.076 211 HA2 GLY 32 HA2 GLY 32 -4.110 -10.676 -7.391 212 HA3 GLY 32 HA1 GLY 32 -4.532 -10.719 -5.686 213 H LYS 33 HN LYS 33 -3.371 -13.009 -4.804 214 HA LYS 33 HA LYS 33 -0.669 -12.243 -4.529 215 HB2 LYS 33 HB2 LYS 33 -0.408 -14.327 -3.268 216 HB3 LYS 33 HB1 LYS 33 -1.862 -13.467 -2.783 217 HG2 LYS 33 HG2 LYS 33 -3.176 -14.976 -4.257 218 HG3 LYS 33 HG1 LYS 33 -1.698 -15.892 -4.556 219 HD2 LYS 33 HD2 LYS 33 -2.904 -15.412 -1.832 220 HD3 LYS 33 HD1 LYS 33 -3.132 -16.878 -2.787 221 HE2 LYS 33 HE2 LYS 33 -0.720 -17.280 -2.747 222 HE3 LYS 33 HE1 LYS 33 -0.486 -15.810 -1.803 223 HZ1 LYS 33 HZ1 LYS 33 -2.022 -18.203 -0.942 224 HZ2 LYS 33 HZ2 LYS 33 -1.827 -16.787 -0.037 225 HZ3 LYS 33 HZ3 LYS 33 -0.486 -17.756 -0.387 226 H ASP 34 HN ASP 34 -2.300 -14.502 -6.643 227 HA ASP 34 HA ASP 34 -0.051 -15.957 -7.512 228 HB2 ASP 34 HB2 ASP 34 -2.383 -16.674 -7.913 229 HB3 ASP 34 HB1 ASP 34 -2.590 -15.335 -9.038 230 H ILE 35 HN ILE 35 -1.082 -12.755 -8.154 231 HA ILE 35 HA ILE 35 0.802 -12.558 -10.413 232 HB ILE 35 HB ILE 35 -1.460 -10.661 -9.777 233 H LYS 36 HN LYS 36 2.587 -11.390 -10.126 234 HA LYS 36 HA LYS 36 3.286 -10.249 -7.659 235 HB2 LYS 36 HB2 LYS 36 4.466 -9.781 -10.405 236 HB3 LYS 36 HB1 LYS 36 5.212 -9.278 -8.896 237 HG2 LYS 36 HG2 LYS 36 5.515 -11.536 -8.203 238 HG3 LYS 36 HG1 LYS 36 4.548 -12.136 -9.550 239 HD2 LYS 36 HD2 LYS 36 6.214 -11.350 -11.130 240 HD3 LYS 36 HD1 LYS 36 7.165 -10.656 -9.816 241 HE2 LYS 36 HE2 LYS 36 7.546 -12.860 -8.887 242 HE3 LYS 36 HE1 LYS 36 6.508 -13.584 -10.114 243 HZ1 LYS 36 HZ1 LYS 36 8.064 -12.896 -11.812 244 HZ2 LYS 36 HZ2 LYS 36 8.865 -13.823 -10.644 245 HZ3 LYS 36 HZ3 LYS 36 9.047 -12.142 -10.658 246 H GLY 37 HN GLY 37 2.792 -8.356 -6.766 247 HA2 GLY 37 HA2 GLY 37 1.089 -6.493 -8.080 248 HA3 GLY 37 HA1 GLY 37 1.825 -6.285 -6.499 249 H VAL 38 HN VAL 38 1.498 -4.225 -8.391 250 HA VAL 38 HA VAL 38 4.309 -3.643 -9.067 251 HB VAL 38 HB VAL 38 1.909 -2.537 -10.527 252 H SER 39 HN SER 39 5.143 -1.779 -8.279 253 HA SER 39 HA SER 39 3.293 0.211 -7.172 254 HG SER 39 HG SER 39 5.953 -1.974 -5.475 255 HB2 SER 39 HB2 SER 39 4.718 0.440 -5.167 256 HB3 SER 39 HB1 SER 39 4.021 -1.174 -5.299 257 H GLU 40 HN GLU 40 3.740 2.211 -7.751 258 HA GLU 40 HA GLU 40 6.496 2.959 -8.435 259 HB2 GLU 40 HB2 GLU 40 5.239 2.494 -10.529 260 HB3 GLU 40 HB1 GLU 40 4.059 3.714 -10.069 261 HG2 GLU 40 HG2 GLU 40 5.913 5.382 -10.065 262 HG3 GLU 40 HG1 GLU 40 6.959 4.123 -10.719 263 H ILE 41 HN ILE 41 7.104 4.891 -7.572 264 HA ILE 41 HA ILE 41 4.967 6.575 -6.433 265 HB ILE 41 HB ILE 41 7.676 6.270 -5.160 266 H VAL 42 HN VAL 42 4.937 8.558 -7.206 267 HA VAL 42 HA VAL 42 7.400 9.689 -8.351 268 HB VAL 42 HB VAL 42 4.542 10.563 -8.818 269 H HIS 43 HN HIS 43 8.419 11.062 -7.032 270 HA HIS 43 HA HIS 43 6.830 12.552 -5.063 271 HD1 HIS 43 HD1 HIS 43 11.068 13.751 -4.062 272 HD2 HIS 43 HD2 HIS 43 7.337 13.252 -2.304 273 HE1 HIS 43 HE1 HIS 43 11.007 15.373 -2.141 274 HE2 HIS 43 HE2 HIS 43 8.741 15.051 -1.087 275 HB2 HIS 43 HB2 HIS 43 8.577 11.184 -4.087 276 HB3 HIS 43 HB1 HIS 43 9.786 11.922 -5.130 277 H GLU 44 HN GLU 44 6.396 14.589 -5.473 278 HA GLU 44 HA GLU 44 8.393 16.249 -6.839 279 HB2 GLU 44 HB2 GLU 44 5.440 16.218 -7.495 280 HB3 GLU 44 HB1 GLU 44 6.628 17.321 -8.175 281 HG2 GLU 44 HG2 GLU 44 7.797 15.401 -9.177 282 HG3 GLU 44 HG1 GLU 44 6.545 14.336 -8.539 283 H GLY 45 HN GLY 45 8.953 17.570 -5.194 284 HA2 GLY 45 HA2 GLY 45 8.767 19.255 -3.641 285 HA3 GLY 45 HA1 GLY 45 7.171 19.577 -4.306 286 H LYS 46 HN LYS 46 5.359 18.738 -3.307 287 HA LYS 46 HA LYS 46 5.818 17.229 -0.823 288 HB2 LYS 46 HB2 LYS 46 3.957 19.570 -1.231 289 HB3 LYS 46 HB1 LYS 46 3.906 18.515 0.173 290 HG2 LYS 46 HG2 LYS 46 6.316 20.115 -0.652 291 HG3 LYS 46 HG1 LYS 46 5.125 20.646 0.538 292 HD2 LYS 46 HD2 LYS 46 6.683 18.074 0.763 293 HD3 LYS 46 HD1 LYS 46 7.195 19.594 1.497 294 HE2 LYS 46 HE2 LYS 46 5.112 19.673 2.780 295 HE3 LYS 46 HE1 LYS 46 4.599 18.156 2.043 296 HZ1 LYS 46 HZ1 LYS 46 5.541 17.823 4.249 297 HZ2 LYS 46 HZ2 LYS 46 7.006 18.508 3.748 298 HZ3 LYS 46 HZ3 LYS 46 6.477 17.053 3.068 299 H LYS 47 HN LYS 47 4.100 17.608 -3.738 300 HA LYS 47 HA LYS 47 1.914 15.856 -2.935 301 HB2 LYS 47 HB2 LYS 47 2.536 17.355 -5.476 302 HB3 LYS 47 HB1 LYS 47 1.229 16.183 -5.374 303 HG2 LYS 47 HG2 LYS 47 1.461 18.563 -3.551 304 HG3 LYS 47 HG1 LYS 47 0.562 18.578 -5.068 305 HD2 LYS 47 HD2 LYS 47 0.044 16.588 -2.868 306 HD3 LYS 47 HD1 LYS 47 -0.795 18.136 -2.984 307 HE2 LYS 47 HE2 LYS 47 -0.766 16.005 -5.120 308 HE3 LYS 47 HE1 LYS 47 -2.080 16.280 -3.977 309 HZ1 LYS 47 HZ1 LYS 47 -2.490 17.324 -6.133 310 HZ2 LYS 47 HZ2 LYS 47 -1.096 18.266 -5.955 311 HZ3 LYS 47 HZ3 LYS 47 -2.398 18.474 -4.896 312 H VAL 48 HN VAL 48 2.270 13.753 -2.915 313 HA VAL 48 HA VAL 48 4.105 12.603 -4.908 314 HB VAL 48 HB VAL 48 4.713 12.276 -2.512 315 H LYS 49 HN LYS 49 3.466 10.893 -6.172 316 HA LYS 49 HA LYS 49 0.616 10.172 -5.998 317 HB2 LYS 49 HB2 LYS 49 2.377 10.337 -8.450 318 HB3 LYS 49 HB1 LYS 49 0.704 9.793 -8.440 319 HG2 LYS 49 HG2 LYS 49 0.077 12.037 -7.520 320 HG3 LYS 49 HG1 LYS 49 1.739 12.544 -7.818 321 HD2 LYS 49 HD2 LYS 49 1.499 12.171 -10.172 322 HD3 LYS 49 HD1 LYS 49 -0.082 11.423 -9.941 323 HE2 LYS 49 HE2 LYS 49 -0.396 13.673 -10.731 324 HE3 LYS 49 HE1 LYS 49 -0.920 13.576 -9.048 325 HZ1 LYS 49 HZ1 LYS 49 1.188 14.542 -8.372 326 HZ2 LYS 49 HZ2 LYS 49 0.384 15.566 -9.452 327 HZ3 LYS 49 HZ3 LYS 49 1.693 14.637 -9.986 328 H LEU 50 HN LEU 50 0.186 8.134 -5.553 329 HA LEU 50 HA LEU 50 2.306 6.130 -5.945 330 HG LEU 50 HG LEU 50 0.579 3.844 -4.649 331 HB2 LEU 50 HB2 LEU 50 1.688 6.456 -3.614 332 HB3 LEU 50 HB1 LEU 50 0.001 6.173 -3.996 333 H THR 51 HN THR 51 1.984 4.644 -7.451 334 HA THR 51 HA THR 51 -0.784 4.101 -8.308 335 HB THR 51 HB THR 51 1.724 3.984 -9.997 336 HG1 THR 51 HG1 THR 51 -0.048 5.671 -10.972 337 H ILE 52 HN ILE 52 -1.480 2.099 -8.075 338 HA ILE 52 HA ILE 52 0.460 -0.108 -7.924 339 HB ILE 52 HB ILE 52 -2.010 0.137 -6.199 340 H THR 53 HN THR 53 -0.002 -1.710 -9.342 341 HA THR 53 HA THR 53 -2.673 -1.676 -10.568 342 HB THR 53 HB THR 53 -0.116 -2.899 -11.618 343 HG1 THR 53 HG1 THR 53 0.196 -1.022 -12.543 344 H TYR 54 HN TYR 54 -4.043 -3.279 -10.255 345 HA TYR 54 HA TYR 54 -3.028 -5.865 -9.284 346 HD1 TYR 54 HD2 TYR 54 -2.859 -6.722 -7.155 347 HD2 TYR 54 HD1 TYR 54 -4.879 -3.031 -6.530 348 HE1 TYR 54 HE2 TYR 54 -1.562 -6.366 -5.098 349 HE2 TYR 54 HE1 TYR 54 -3.585 -2.664 -4.473 350 HH TYR 54 HH TYR 54 -0.842 -4.481 -3.678 351 HB2 TYR 54 HB2 TYR 54 -5.424 -4.286 -8.377 352 HB3 TYR 54 HB1 TYR 54 -5.332 -6.026 -8.136 353 H GLY 55 HN GLY 55 -3.229 -7.251 -10.943 354 HA2 GLY 55 HA2 GLY 55 -4.116 -8.348 -12.761 355 HA3 GLY 55 HA1 GLY 55 -5.622 -8.230 -11.867 356 H SER 56 HN SER 56 -3.522 -6.205 -13.904 357 HA SER 56 HA SER 56 -3.953 -4.844 -15.663 358 HG SER 56 HG SER 56 -5.100 -7.736 -16.091 359 HB2 SER 56 HB2 SER 56 -6.649 -6.211 -15.726 360 HB3 SER 56 HB1 SER 56 -5.968 -5.210 -17.008 361 H LYS 57 HN LYS 57 -5.458 -4.518 -12.755 362 HA LYS 57 HA LYS 57 -7.056 -2.196 -13.556 363 HB2 LYS 57 HB2 LYS 57 -8.148 -3.695 -12.000 364 HB3 LYS 57 HB1 LYS 57 -6.789 -3.594 -10.889 365 HG2 LYS 57 HG2 LYS 57 -7.261 -1.234 -10.500 366 HG3 LYS 57 HG1 LYS 57 -8.605 -1.308 -11.641 367 HD2 LYS 57 HD2 LYS 57 -9.504 -1.477 -9.431 368 HD3 LYS 57 HD1 LYS 57 -9.637 -3.062 -10.193 369 HE2 LYS 57 HE2 LYS 57 -7.633 -3.805 -9.017 370 HE3 LYS 57 HE1 LYS 57 -7.471 -2.215 -8.272 371 HZ1 LYS 57 HZ1 LYS 57 -9.757 -4.072 -7.885 372 HZ2 LYS 57 HZ2 LYS 57 -9.581 -2.556 -7.156 373 HZ3 LYS 57 HZ3 LYS 57 -8.508 -3.806 -6.774 374 H VAL 58 HN VAL 58 -6.508 -0.126 -13.092 375 HA VAL 58 HA VAL 58 -3.863 0.271 -11.871 376 HB VAL 58 HB VAL 58 -5.438 2.085 -13.704 377 H ILE 59 HN ILE 59 -3.698 1.218 -9.961 378 HA ILE 59 HA ILE 59 -6.005 2.734 -8.927 379 HB ILE 59 HB ILE 59 -3.965 1.195 -7.317 380 H HIS 60 HN HIS 60 -5.611 4.838 -8.836 381 HA HIS 60 HA HIS 60 -2.852 5.727 -8.267 382 HD1 HIS 60 HD1 HIS 60 -5.614 9.084 -9.362 383 HD2 HIS 60 HD2 HIS 60 -6.031 5.434 -11.304 384 HE1 HIS 60 HE1 HIS 60 -7.931 9.104 -10.341 385 HE2 HIS 60 HE2 HIS 60 -8.183 6.860 -11.460 386 HB2 HIS 60 HB2 HIS 60 -3.440 7.800 -9.536 387 HB3 HIS 60 HB1 HIS 60 -3.430 6.340 -10.517 388 H ASN 61 HN ASN 61 -2.507 7.272 -6.738 389 HA ASN 61 HA ASN 61 -4.664 8.796 -5.589 390 HB2 ASN 61 HB2 ASN 61 -3.429 6.489 -4.115 391 HB3 ASN 61 HB1 ASN 61 -4.026 7.891 -3.233 392 H GLU 62 HN GLU 62 -3.825 10.747 -5.269 393 HA GLU 62 HA GLU 62 -0.962 10.974 -4.635 394 HB2 GLU 62 HB2 GLU 62 -1.216 13.341 -5.416 395 HB3 GLU 62 HB1 GLU 62 -1.513 12.137 -6.664 396 HG2 GLU 62 HG2 GLU 62 -3.929 12.407 -6.324 397 HG3 GLU 62 HG1 GLU 62 -3.606 13.650 -5.114 398 H PHE 63 HN PHE 63 -0.263 12.130 -2.842 399 HA PHE 63 HA PHE 63 -2.226 13.509 -1.203 400 HD1 PHE 63 HD1 PHE 63 -2.265 9.717 -1.745 401 HD2 PHE 63 HD2 PHE 63 0.858 11.034 0.826 402 HE1 PHE 63 HE1 PHE 63 -1.018 7.647 -2.208 403 HE2 PHE 63 HE2 PHE 63 2.113 8.968 0.367 404 HZ PHE 63 HZ PHE 63 1.175 7.273 -1.152 405 HB2 PHE 63 HB2 PHE 63 -1.249 12.138 0.826 406 HB3 PHE 63 HB1 PHE 63 -2.605 11.526 -0.110 407 H THR 64 HN THR 64 -1.331 14.850 0.413 408 HA THR 64 HA THR 64 1.413 15.654 -0.196 409 HB THR 64 HB THR 64 -0.658 17.108 1.459 410 HG1 THR 64 HG1 THR 64 -1.174 16.873 -0.825 411 H LEU 65 HN LEU 65 3.047 15.409 1.169 412 HA LEU 65 HA LEU 65 3.010 13.723 3.350 413 HG LEU 65 HG LEU 65 4.728 14.990 0.845 414 HB2 LEU 65 HB2 LEU 65 4.950 16.005 3.102 415 HB3 LEU 65 HB1 LEU 65 5.232 14.405 3.764 416 H GLY 66 HN GLY 66 2.593 13.922 5.484 417 HA2 GLY 66 HA2 GLY 66 1.904 14.843 7.470 418 HA3 GLY 66 HA1 GLY 66 2.740 16.305 6.970 419 H GLU 67 HN GLU 67 -0.043 14.667 5.500 420 HA GLU 67 HA GLU 67 -1.848 16.755 6.379 421 HB2 GLU 67 HB2 GLU 67 -0.798 17.745 4.383 422 HB3 GLU 67 HB1 GLU 67 -1.270 16.339 3.440 423 HG2 GLU 67 HG2 GLU 67 -3.640 16.877 3.900 424 HG3 GLU 67 HG1 GLU 67 -3.110 18.343 4.726 425 H GLU 68 HN GLU 68 -4.038 16.209 6.143 426 HA GLU 68 HA GLU 68 -4.531 13.367 5.970 427 HB2 GLU 68 HB2 GLU 68 -5.618 14.749 7.696 428 HB3 GLU 68 HB1 GLU 68 -6.436 15.673 6.443 429 HG2 GLU 68 HG2 GLU 68 -7.686 13.733 5.762 430 HG3 GLU 68 HG1 GLU 68 -6.796 12.721 6.899 431 H CYS 69 HN CYS 69 -4.989 12.357 4.143 432 HA CYS 69 HA CYS 69 -6.321 13.848 1.979 433 HG CYS 69 HG CYS 69 -5.575 11.211 -0.641 434 HB2 CYS 69 HB2 CYS 69 -3.949 13.249 1.482 435 HB3 CYS 69 HB1 CYS 69 -4.379 11.551 1.666 436 H GLU 70 HN GLU 70 -7.691 12.553 0.559 437 HA GLU 70 HA GLU 70 -9.113 10.523 2.108 438 HB2 GLU 70 HB2 GLU 70 -10.403 12.397 1.162 439 HB3 GLU 70 HB1 GLU 70 -9.901 11.917 -0.452 440 HG2 GLU 70 HG2 GLU 70 -11.095 9.826 -0.242 441 HG3 GLU 70 HG1 GLU 70 -11.529 10.217 1.422 442 H LEU 71 HN LEU 71 -8.731 8.463 1.775 443 HA LEU 71 HA LEU 71 -7.841 7.570 -0.889 444 HG LEU 71 HG LEU 71 -4.738 6.773 1.018 445 HB2 LEU 71 HB2 LEU 71 -7.072 6.553 1.846 446 HB3 LEU 71 HB1 LEU 71 -6.745 5.665 0.373 447 H GLU 72 HN GLU 72 -8.733 5.651 -1.697 448 HA GLU 72 HA GLU 72 -11.312 4.969 -0.561 449 HB2 GLU 72 HB2 GLU 72 -11.808 3.930 -2.597 450 HB3 GLU 72 HB1 GLU 72 -10.784 5.279 -3.066 451 HG2 GLU 72 HG2 GLU 72 -8.852 3.683 -3.076 452 HG3 GLU 72 HG1 GLU 72 -10.017 2.382 -2.855 453 H THR 73 HN THR 73 -11.940 2.900 0.107 454 HA THR 73 HA THR 73 -9.731 1.273 1.115 455 HB THR 73 HB THR 73 -11.428 0.151 2.505 456 HG1 THR 73 HG1 THR 73 -13.548 0.686 2.361 457 H MET 74 HN MET 74 -10.456 -1.186 1.270 458 HA MET 74 HA MET 74 -10.423 -2.164 -1.383 459 HB2 MET 74 HB2 MET 74 -11.012 -3.681 1.168 460 HB3 MET 74 HB1 MET 74 -10.556 -4.390 -0.373 461 HG2 MET 74 HG2 MET 74 -8.593 -4.426 0.852 462 HG3 MET 74 HG1 MET 74 -8.417 -2.999 -0.165 463 HE1 MET 74 HE1 MET 74 -6.773 -3.764 2.529 464 HE2 MET 74 HE2 MET 74 -6.646 -2.191 3.315 465 HE3 MET 74 HE3 MET 74 -6.382 -2.332 1.577 466 H THR 75 HN THR 75 -12.941 -1.098 0.574 467 HA THR 75 HA THR 75 -14.955 -2.713 -0.829 468 HB THR 75 HB THR 75 -16.533 -2.024 0.862 469 HG1 THR 75 HG1 THR 75 -16.064 -0.465 2.350 470 H GLY 76 HN GLY 76 -13.396 0.162 -1.199 471 HA2 GLY 76 HA2 GLY 76 -13.874 1.780 -2.821 472 HA3 GLY 76 HA1 GLY 76 -15.534 1.204 -2.878 473 H GLU 77 HN GLU 77 -14.706 1.542 0.303 474 HA GLU 77 HA GLU 77 -16.314 3.902 0.600 475 HB2 GLU 77 HB2 GLU 77 -16.510 2.071 2.190 476 HB3 GLU 77 HB1 GLU 77 -14.826 2.272 2.627 477 HG2 GLU 77 HG2 GLU 77 -15.251 4.396 3.616 478 HG3 GLU 77 HG1 GLU 77 -16.904 4.401 3.006 479 H LYS 78 HN LYS 78 -15.677 5.947 1.066 480 HA LYS 78 HA LYS 78 -12.866 6.551 0.716 481 HB2 LYS 78 HB2 LYS 78 -15.118 8.499 1.209 482 HB3 LYS 78 HB1 LYS 78 -13.542 8.840 0.509 483 HG2 LYS 78 HG2 LYS 78 -15.713 7.167 -0.740 484 HG3 LYS 78 HG1 LYS 78 -15.261 8.808 -1.200 485 HD2 LYS 78 HD2 LYS 78 -13.383 6.449 -1.304 486 HD3 LYS 78 HD1 LYS 78 -14.332 7.012 -2.679 487 HE2 LYS 78 HE2 LYS 78 -12.365 8.711 -1.151 488 HE3 LYS 78 HE1 LYS 78 -11.990 7.858 -2.647 489 HZ1 LYS 78 HZ1 LYS 78 -14.071 9.956 -2.331 490 HZ2 LYS 78 HZ2 LYS 78 -13.703 9.142 -3.767 491 HZ3 LYS 78 HZ3 LYS 78 -12.559 10.168 -3.061 492 H VAL 79 HN VAL 79 -11.474 6.879 2.297 493 HA VAL 79 HA VAL 79 -12.470 7.711 4.937 494 HB VAL 79 HB VAL 79 -10.714 6.286 5.984 495 H LYS 80 HN LYS 80 -10.711 8.623 6.331 496 HA LYS 80 HA LYS 80 -8.907 10.238 4.664 497 HB2 LYS 80 HB2 LYS 80 -10.013 10.780 7.424 498 HB3 LYS 80 HB1 LYS 80 -8.899 11.832 6.561 499 HG2 LYS 80 HG2 LYS 80 -10.555 12.191 4.820 500 HG3 LYS 80 HG1 LYS 80 -11.669 11.095 5.637 501 HD2 LYS 80 HD2 LYS 80 -11.714 12.588 7.577 502 HD3 LYS 80 HD1 LYS 80 -10.593 13.682 6.762 503 HE2 LYS 80 HE2 LYS 80 -12.895 14.474 6.577 504 HE3 LYS 80 HE1 LYS 80 -12.233 14.060 4.997 505 HZ1 LYS 80 HZ1 LYS 80 -14.502 13.249 5.288 506 HZ2 LYS 80 HZ2 LYS 80 -14.014 12.318 6.614 507 HZ3 LYS 80 HZ3 LYS 80 -13.417 11.969 5.072 508 H ALA 81 HN ALA 81 -6.763 10.128 4.907 509 HA ALA 81 HA ALA 81 -5.616 9.004 7.341 510 HB1 ALA 81 HB1 ALA 81 -4.980 7.858 4.629 511 HB2 ALA 81 HB2 ALA 81 -6.015 7.092 5.833 512 HB3 ALA 81 HB3 ALA 81 -4.304 7.351 6.176 513 H VAL 82 HN VAL 82 -3.587 9.742 7.805 514 HA VAL 82 HA VAL 82 -2.487 11.776 5.996 515 HB VAL 82 HB VAL 82 -1.902 11.314 8.928 516 H VAL 83 HN VAL 83 -0.773 11.245 4.823 517 HA VAL 83 HA VAL 83 0.899 8.987 5.666 518 HB VAL 83 HB VAL 83 0.905 10.402 2.997 519 H LYS 84 HN LYS 84 2.716 9.445 6.705 520 HA LYS 84 HA LYS 84 4.143 11.924 6.004 521 HB2 LYS 84 HB2 LYS 84 2.865 11.801 8.284 522 HB3 LYS 84 HB1 LYS 84 4.226 10.808 8.785 523 HG2 LYS 84 HG2 LYS 84 5.727 12.686 8.060 524 HG3 LYS 84 HG1 LYS 84 4.271 13.660 7.857 525 HD2 LYS 84 HD2 LYS 84 4.876 12.257 10.440 526 HD3 LYS 84 HD1 LYS 84 5.540 13.850 10.078 527 HE2 LYS 84 HE2 LYS 84 3.551 14.191 11.332 528 HE3 LYS 84 HE1 LYS 84 3.194 14.630 9.664 529 HZ1 LYS 84 HZ1 LYS 84 2.543 11.991 10.852 530 HZ2 LYS 84 HZ2 LYS 84 2.054 12.579 9.344 531 HZ3 LYS 84 HZ3 LYS 84 1.450 13.278 10.759 532 H MET 85 HN MET 85 6.415 11.874 6.182 533 HA MET 85 HA MET 85 7.552 9.159 6.171 534 HB2 MET 85 HB2 MET 85 8.815 11.611 4.955 535 HB3 MET 85 HB1 MET 85 9.222 9.924 4.665 536 HG2 MET 85 HG2 MET 85 6.967 9.641 3.635 537 HG3 MET 85 HG1 MET 85 6.748 11.384 3.778 538 HE1 MET 85 HE1 MET 85 9.692 12.697 1.501 539 HE2 MET 85 HE2 MET 85 9.865 12.281 3.206 540 HE3 MET 85 HE3 MET 85 8.430 13.143 2.650 541 H GLU 86 HN GLU 86 8.777 8.639 7.856 542 HA GLU 86 HA GLU 86 9.548 10.556 9.819 543 HB2 GLU 86 HB2 GLU 86 8.965 8.182 10.327 544 HB3 GLU 86 HB1 GLU 86 10.451 7.684 9.532 545 HG2 GLU 86 HG2 GLU 86 10.768 7.684 11.910 546 HG3 GLU 86 HG1 GLU 86 11.743 8.961 11.188 547 H GLY 87 HN GLY 87 10.865 9.638 6.889 548 HA2 GLY 87 HA2 GLY 87 12.811 11.191 6.353 549 HA3 GLY 87 HA1 GLY 87 13.592 10.403 7.714 550 H ASP 88 HN ASP 88 15.070 9.019 7.051 551 HA ASP 88 HA ASP 88 14.718 7.673 4.484 552 HB2 ASP 88 HB2 ASP 88 17.167 7.940 6.243 553 HB3 ASP 88 HB1 ASP 88 17.125 7.146 4.672 554 H ASN 89 HN ASN 89 14.231 5.631 4.360 555 HA ASN 89 HA ASN 89 13.987 3.422 4.816 556 HB2 ASN 89 HB2 ASN 89 16.269 3.390 5.647 557 HB3 ASN 89 HB1 ASN 89 15.740 4.006 7.207 558 H LYS 90 HN LYS 90 12.912 5.892 6.822 559 HA LYS 90 HA LYS 90 10.947 4.059 8.007 560 HB2 LYS 90 HB2 LYS 90 12.427 6.277 9.411 561 HB3 LYS 90 HB1 LYS 90 10.963 5.547 10.052 562 HG2 LYS 90 HG2 LYS 90 12.528 4.332 11.147 563 HG3 LYS 90 HG1 LYS 90 12.307 3.322 9.719 564 HD2 LYS 90 HD2 LYS 90 14.268 4.332 8.684 565 HD3 LYS 90 HD1 LYS 90 14.475 5.391 10.081 566 HE2 LYS 90 HE2 LYS 90 14.657 2.380 10.067 567 HE3 LYS 90 HE1 LYS 90 16.005 3.510 10.210 568 HZ1 LYS 90 HZ1 LYS 90 15.053 4.304 12.295 569 HZ2 LYS 90 HZ2 LYS 90 15.378 2.645 12.364 570 HZ3 LYS 90 HZ3 LYS 90 13.788 3.187 12.162 571 H MET 91 HN MET 91 8.913 4.605 7.698 572 HA MET 91 HA MET 91 8.166 7.409 7.321 573 HB2 MET 91 HB2 MET 91 7.506 5.165 5.409 574 HB3 MET 91 HB1 MET 91 6.669 6.711 5.416 575 HG2 MET 91 HG2 MET 91 8.818 7.838 4.979 576 HG3 MET 91 HG1 MET 91 9.595 6.259 4.882 577 HE1 MET 91 HE1 MET 91 9.643 8.583 2.656 578 HE2 MET 91 HE2 MET 91 9.443 7.656 1.168 579 HE3 MET 91 HE3 MET 91 10.521 7.069 2.434 580 H VAL 92 HN VAL 92 6.231 7.923 8.274 581 HA VAL 92 HA VAL 92 4.755 5.665 9.467 582 HB VAL 92 HB VAL 92 4.861 8.514 10.458 583 H THR 93 HN THR 93 2.869 5.256 8.588 584 HA THR 93 HA THR 93 1.145 7.482 7.755 585 HB THR 93 HB THR 93 1.982 6.712 5.667 586 HG1 THR 93 HG1 THR 93 -0.081 5.346 5.041 587 H THR 94 HN THR 94 -0.825 7.343 8.674 588 HA THR 94 HA THR 94 -1.754 4.678 9.530 589 HB THR 94 HB THR 94 -2.897 5.874 11.456 590 HG1 THR 94 HG1 THR 94 -0.940 7.877 10.975 591 H PHE 95 HN PHE 95 -3.860 4.170 9.195 592 HA PHE 95 HA PHE 95 -5.687 6.258 8.264 593 HD1 PHE 95 HD1 PHE 95 -3.131 3.336 6.818 594 HD2 PHE 95 HD2 PHE 95 -7.336 2.772 6.493 595 HE1 PHE 95 HE1 PHE 95 -2.784 0.911 6.578 596 HE2 PHE 95 HE2 PHE 95 -6.998 0.347 6.255 597 HZ PHE 95 HZ PHE 95 -4.720 -0.587 6.296 598 HB2 PHE 95 HB2 PHE 95 -6.421 4.942 6.365 599 HB3 PHE 95 HB1 PHE 95 -4.685 5.198 6.259 600 H LYS 96 HN LYS 96 -7.711 6.056 9.033 601 HA LYS 96 HA LYS 96 -9.463 5.309 10.271 602 HB2 LYS 96 HB2 LYS 96 -8.507 2.611 9.294 603 HB3 LYS 96 HB1 LYS 96 -10.049 2.905 10.083 604 HG2 LYS 96 HG2 LYS 96 -10.708 4.382 8.250 605 HG3 LYS 96 HG1 LYS 96 -9.162 4.080 7.455 606 HD2 LYS 96 HD2 LYS 96 -10.814 2.665 6.445 607 HD3 LYS 96 HD1 LYS 96 -9.734 1.654 7.409 608 HE2 LYS 96 HE2 LYS 96 -11.380 1.652 9.232 609 HE3 LYS 96 HE1 LYS 96 -12.461 2.642 8.250 610 HZ1 LYS 96 HZ1 LYS 96 -11.519 -0.083 7.532 611 HZ2 LYS 96 HZ2 LYS 96 -12.607 0.859 6.647 612 HZ3 LYS 96 HZ3 LYS 96 -13.040 0.284 8.176 613 H GLY 97 HN GLY 97 -7.672 2.352 10.882 614 HA2 GLY 97 HA2 GLY 97 -6.825 3.285 13.516 615 HA3 GLY 97 HA1 GLY 97 -8.000 1.978 13.482 616 H ILE 98 HN ILE 98 -6.135 1.721 10.782 617 HA ILE 98 HA ILE 98 -4.600 -0.471 11.927 618 HB ILE 98 HB ILE 98 -4.928 0.391 9.048 619 H LYS 99 HN LYS 99 -2.390 -0.559 12.024 620 HA LYS 99 HA LYS 99 -0.998 1.986 11.649 621 HB2 LYS 99 HB2 LYS 99 -0.913 0.132 13.679 622 HB3 LYS 99 HB1 LYS 99 0.526 -0.271 12.746 623 HG2 LYS 99 HG2 LYS 99 -0.135 2.445 13.874 624 HG3 LYS 99 HG1 LYS 99 1.025 1.297 14.545 625 HD2 LYS 99 HD2 LYS 99 2.298 1.417 12.419 626 HD3 LYS 99 HD1 LYS 99 1.177 2.660 11.858 627 HE2 LYS 99 HE2 LYS 99 3.018 2.820 14.238 628 HE3 LYS 99 HE1 LYS 99 3.167 3.709 12.724 629 HZ1 LYS 99 HZ1 LYS 99 2.217 5.103 14.425 630 HZ2 LYS 99 HZ2 LYS 99 0.978 3.989 14.712 631 HZ3 LYS 99 HZ3 LYS 99 1.054 4.805 13.232 632 H SER 100 HN SER 100 0.146 2.330 9.877 633 HA SER 100 HA SER 100 1.295 0.013 8.473 634 HG SER 100 HG SER 100 0.562 0.848 5.389 635 HB2 SER 100 HB2 SER 100 -0.549 0.966 7.179 636 HB3 SER 100 HB1 SER 100 0.202 2.559 7.258 637 H VAL 101 HN VAL 101 3.425 0.001 8.451 638 HA VAL 101 HA VAL 101 4.863 2.574 8.550 639 HB VAL 101 HB VAL 101 5.747 -0.070 9.723 640 H THR 102 HN THR 102 6.045 2.980 6.798 641 HA THR 102 HA THR 102 6.793 0.709 5.077 642 HB THR 102 HB THR 102 6.353 3.594 4.290 643 HG1 THR 102 HG1 THR 102 4.365 2.730 4.523 644 H GLU 103 HN GLU 103 8.873 0.261 4.855 645 HA GLU 103 HA GLU 103 10.856 2.178 5.798 646 HB2 GLU 103 HB2 GLU 103 10.852 -0.777 5.279 647 HB3 GLU 103 HB1 GLU 103 12.365 0.100 5.388 648 HG2 GLU 103 HG2 GLU 103 11.772 0.855 7.636 649 HG3 GLU 103 HG1 GLU 103 10.252 -0.031 7.522 650 H PHE 104 HN PHE 104 12.145 3.282 4.423 651 HA PHE 104 HA PHE 104 11.965 2.540 1.575 652 HD1 PHE 104 HD1 PHE 104 9.498 4.115 1.622 653 HD2 PHE 104 HD2 PHE 104 12.994 5.577 -0.315 654 HE1 PHE 104 HE1 PHE 104 8.205 4.457 -0.444 655 HE2 PHE 104 HE2 PHE 104 11.707 5.922 -2.383 656 HZ PHE 104 HZ PHE 104 9.301 5.356 -2.445 657 HB2 PHE 104 HB2 PHE 104 11.539 5.004 2.875 658 HB3 PHE 104 HB1 PHE 104 13.038 5.176 1.967 659 H ASN 105 HN ASN 105 13.664 1.592 0.770 660 HA ASN 105 HA ASN 105 16.341 2.427 1.661 661 HB2 ASN 105 HB2 ASN 105 15.177 -0.292 1.397 662 HB3 ASN 105 HB1 ASN 105 16.839 -0.088 0.856 663 H GLY 106 HN GLY 106 18.006 2.308 0.060 664 HA2 GLY 106 HA2 GLY 106 17.037 3.007 -2.565 665 HA3 GLY 106 HA1 GLY 106 18.707 3.009 -2.032 666 H ASP 107 HN ASP 107 16.353 0.350 -2.050 667 HA ASP 107 HA ASP 107 17.377 -0.917 -4.355 668 HB2 ASP 107 HB2 ASP 107 19.363 -1.262 -2.976 669 HB3 ASP 107 HB1 ASP 107 18.381 -1.999 -1.714 670 H THR 108 HN THR 108 15.872 -1.371 -1.186 671 HA THR 108 HA THR 108 13.760 -2.930 -2.491 672 HB THR 108 HB THR 108 15.141 -3.850 0.037 673 HG1 THR 108 HG1 THR 108 16.253 -5.139 -1.231 674 H ILE 109 HN ILE 109 11.824 -2.186 -1.956 675 HA ILE 109 HA ILE 109 11.556 -0.592 0.503 676 HB ILE 109 HB ILE 109 10.033 -0.524 -2.098 677 H THR 110 HN THR 110 10.499 -1.472 2.148 678 HA THR 110 HA THR 110 8.608 -3.667 1.591 679 HB THR 110 HB THR 110 10.172 -3.237 4.141 680 HG1 THR 110 HG1 THR 110 11.704 -4.418 3.266 681 H ASN 111 HN ASN 111 6.609 -3.631 2.494 682 HA ASN 111 HA ASN 111 5.901 -1.225 4.037 683 HB2 ASN 111 HB2 ASN 111 4.839 -1.368 1.804 684 HB3 ASN 111 HB1 ASN 111 4.119 -2.907 2.262 685 H THR 112 HN THR 112 4.711 -1.439 5.912 686 HA THR 112 HA THR 112 4.270 -4.206 6.838 687 HB THR 112 HB THR 112 4.757 -1.934 8.742 688 HG1 THR 112 HG1 THR 112 6.790 -1.886 8.170 689 H MET 113 HN MET 113 2.203 -4.693 7.086 690 HA MET 113 HA MET 113 0.355 -2.600 8.025 691 HB2 MET 113 HB2 MET 113 -0.098 -4.732 5.941 692 HB3 MET 113 HB1 MET 113 -1.426 -3.902 6.741 693 HG2 MET 113 HG2 MET 113 -0.544 -1.758 5.916 694 HG3 MET 113 HG1 MET 113 0.721 -2.634 5.060 695 HE1 MET 113 HE1 MET 113 -1.291 -0.549 3.718 696 HE2 MET 113 HE2 MET 113 -1.712 -1.378 2.221 697 HE3 MET 113 HE3 MET 113 -0.043 -1.382 2.791 698 H THR 114 HN THR 114 -0.501 -3.052 9.944 699 HA THR 114 HA THR 114 -0.821 -5.883 10.697 700 HB THR 114 HB THR 114 0.045 -3.643 12.536 701 HG1 THR 114 HG1 THR 114 1.896 -4.214 11.603 702 H LEU 115 HN LEU 115 -2.844 -6.406 11.122 703 HA LEU 115 HA LEU 115 -4.645 -4.362 12.239 704 HG LEU 115 HG LEU 115 -6.911 -4.192 11.495 705 HB2 LEU 115 HB2 LEU 115 -5.029 -4.827 9.782 706 HB3 LEU 115 HB1 LEU 115 -5.466 -6.457 10.236 707 H GLY 116 HN GLY 116 -5.220 -4.976 14.213 708 HA2 GLY 116 HA2 GLY 116 -6.076 -6.297 15.903 709 HA3 GLY 116 HA1 GLY 116 -6.351 -7.559 14.711 710 H ASP 117 HN ASP 117 -4.375 -8.754 13.986 711 HA ASP 117 HA ASP 117 -2.060 -8.752 15.662 712 HB2 ASP 117 HB2 ASP 117 -2.362 -10.972 16.646 713 HB3 ASP 117 HB1 ASP 117 -3.646 -9.887 17.168 714 H ILE 118 HN ILE 118 -3.183 -8.900 12.803 715 HA ILE 118 HA ILE 118 -1.674 -11.240 11.860 716 HB ILE 118 HB ILE 118 -3.430 -9.574 10.090 717 H VAL 119 HN VAL 119 0.074 -11.015 10.532 718 HA VAL 119 HA VAL 119 1.015 -8.268 10.095 719 HB VAL 119 HB VAL 119 2.470 -9.714 11.460 720 H TYR 120 HN TYR 120 1.528 -7.486 8.177 721 HA TYR 120 HA TYR 120 1.399 -9.263 5.835 722 HD1 TYR 120 HD2 TYR 120 1.276 -5.911 3.814 723 HD2 TYR 120 HD1 TYR 120 -1.367 -9.219 4.236 724 HE1 TYR 120 HE2 TYR 120 0.971 -5.970 1.374 725 HE2 TYR 120 HE1 TYR 120 -1.680 -9.288 1.799 726 HH TYR 120 HH TYR 120 0.298 -7.546 -0.361 727 HB2 TYR 120 HB2 TYR 120 -0.726 -7.964 6.143 728 HB3 TYR 120 HB1 TYR 120 0.209 -6.482 5.996 729 H LYS 121 HN LYS 121 3.269 -9.154 4.754 730 HA LYS 121 HA LYS 121 4.739 -6.601 4.744 731 HB2 LYS 121 HB2 LYS 121 5.958 -9.362 4.898 732 HB3 LYS 121 HB1 LYS 121 6.845 -7.847 4.817 733 HG2 LYS 121 HG2 LYS 121 5.935 -7.197 6.976 734 HG3 LYS 121 HG1 LYS 121 5.030 -8.703 7.064 735 HD2 LYS 121 HD2 LYS 121 7.364 -9.767 6.712 736 HD3 LYS 121 HD1 LYS 121 7.968 -8.214 7.266 737 HE2 LYS 121 HE2 LYS 121 6.024 -9.971 8.759 738 HE3 LYS 121 HE1 LYS 121 7.752 -9.856 9.092 739 HZ1 LYS 121 HZ1 LYS 121 6.478 -8.470 10.598 740 HZ2 LYS 121 HZ2 LYS 121 5.798 -7.627 9.298 741 HZ3 LYS 121 HZ3 LYS 121 7.457 -7.509 9.607 742 H ARG 122 HN ARG 122 5.268 -5.852 2.799 743 HA ARG 122 HA ARG 122 5.058 -7.685 0.503 744 HE ARG 122 HE ARG 122 3.929 -3.148 0.083 745 HB2 ARG 122 HB2 ARG 122 3.422 -6.107 0.087 746 HB3 ARG 122 HB1 ARG 122 4.314 -4.813 0.874 747 HG2 ARG 122 HG2 ARG 122 5.825 -4.684 -1.029 748 HG3 ARG 122 HG1 ARG 122 4.969 -6.016 -1.809 749 HD2 ARG 122 HD2 ARG 122 4.311 -3.770 -2.650 750 HD3 ARG 122 HD1 ARG 122 2.970 -4.705 -1.988 751 HH11 ARG 122 HH11 ARG 122 2.535 -2.620 -3.069 752 HH12 ARG 122 HH12 ARG 122 1.797 -1.115 -2.630 753 HH21 ARG 122 HH21 ARG 122 2.955 -1.169 0.666 754 HH22 ARG 122 HH22 ARG 122 2.033 -0.293 -0.510 755 H VAL 123 HN VAL 123 6.890 -8.154 -0.496 756 HA VAL 123 HA VAL 123 9.227 -6.431 -0.051 757 HB VAL 123 HB VAL 123 9.181 -9.259 -1.114 758 H SER 124 HN SER 124 9.849 -5.138 -1.652 759 HA SER 124 HA SER 124 9.357 -5.989 -4.421 760 HG SER 124 HG SER 124 8.668 -2.109 -3.536 761 HB2 SER 124 HB2 SER 124 8.770 -3.665 -5.019 762 HB3 SER 124 HB1 SER 124 7.640 -4.343 -3.848 763 H LYS 125 HN LYS 125 11.034 -5.770 -5.763 764 HA LYS 125 HA LYS 125 13.428 -4.412 -4.731 765 HB2 LYS 125 HB2 LYS 125 14.684 -5.823 -6.329 766 HB3 LYS 125 HB1 LYS 125 13.774 -6.773 -5.164 767 HG2 LYS 125 HG2 LYS 125 13.068 -7.926 -6.926 768 HG3 LYS 125 HG1 LYS 125 12.000 -6.553 -7.226 769 HD2 LYS 125 HD2 LYS 125 13.136 -7.050 -9.268 770 HD3 LYS 125 HD1 LYS 125 13.816 -5.552 -8.628 771 HE2 LYS 125 HE2 LYS 125 15.714 -6.787 -7.724 772 HE3 LYS 125 HE1 LYS 125 15.028 -8.297 -8.318 773 HZ1 LYS 125 HZ1 LYS 125 16.736 -7.465 -9.802 774 HZ2 LYS 125 HZ2 LYS 125 15.898 -6.011 -10.003 775 HZ3 LYS 125 HZ3 LYS 125 15.232 -7.454 -10.578 776 H ARG 126 HN ARG 126 14.298 -2.728 -5.791 777 HA ARG 126 HA ARG 126 12.792 -1.451 -7.841 778 HE ARG 126 HE ARG 126 16.979 0.634 -7.198 779 HB2 ARG 126 HB2 ARG 126 14.090 -0.223 -6.123 780 HB3 ARG 126 HB1 ARG 126 15.576 -0.812 -6.853 781 HG2 ARG 126 HG2 ARG 126 15.062 0.379 -8.907 782 HG3 ARG 126 HG1 ARG 126 13.539 0.939 -8.215 783 HD2 ARG 126 HD2 ARG 126 15.214 2.685 -8.069 784 HD3 ARG 126 HD1 ARG 126 14.790 2.114 -6.456 785 HH11 ARG 126 HH11 ARG 126 16.256 4.021 -6.815 786 HH12 ARG 126 HH12 ARG 126 17.879 4.450 -6.393 787 HH21 ARG 126 HH21 ARG 126 19.116 1.189 -6.642 788 HH22 ARG 126 HH22 ARG 126 19.506 2.840 -6.292 789 H ILE 127 HN ILE 127 13.257 -1.149 -9.994 790 HA ILE 127 HA ILE 127 15.515 -2.657 -11.115 791 HB ILE 127 HB ILE 127 14.053 -3.373 -13.003 792 H9 OLA 128 HH1 OLA 128 -5.067 -8.679 -4.992 793 H10 OLA 128 HI1 OLA 128 -4.653 -8.041 -2.658 794 H21 OLA 128 HA1 OLA 128 -10.847 -8.343 -10.866 795 H22 OLA 128 HA2 OLA 128 -10.066 -8.481 -12.441 796 H31 OLA 128 HB1 OLA 128 -8.456 -9.508 -10.224 797 H32 OLA 128 HB2 OLA 128 -8.007 -8.438 -11.553 798 H41 OLA 128 HC1 OLA 128 -9.625 -7.540 -9.177 799 H42 OLA 128 HC2 OLA 128 -8.878 -6.532 -10.416 800 H51 OLA 128 HD1 OLA 128 -6.932 -8.251 -9.142 801 H52 OLA 128 HD2 OLA 128 -6.935 -6.494 -9.324 802 H61 OLA 128 HE1 OLA 128 -8.820 -7.578 -7.335 803 H62 OLA 128 HE2 OLA 128 -7.789 -6.148 -7.264 804 H71 OLA 128 HF1 OLA 128 -7.080 -9.005 -6.681 805 H72 OLA 128 HF2 OLA 128 -5.841 -7.803 -7.049 806 H81 OLA 128 HG1 OLA 128 -6.850 -6.391 -5.204 807 H82 OLA 128 HG2 OLA 128 -7.782 -7.820 -4.750 808 H111 OLA 128 HJ1 OLA 128 -7.395 -6.849 -2.859 809 H112 OLA 128 HJ2 OLA 128 -6.363 -6.933 -1.431 810 H121 OLA 128 HK1 OLA 128 -4.962 -5.289 -3.161 811 H122 OLA 128 HK2 OLA 128 -6.645 -4.814 -3.398 812 H131 OLA 128 HL1 OLA 128 -5.518 -5.137 -0.641 813 H132 OLA 128 HL2 OLA 128 -6.914 -4.195 -1.167 814 H141 OLA 128 HM1 OLA 128 -4.767 -3.125 -2.578 815 H142 OLA 128 HM2 OLA 128 -4.137 -3.416 -0.956 816 H151 OLA 128 HN1 OLA 128 -5.054 -1.427 -0.468 817 H152 OLA 128 HN2 OLA 128 -6.571 -2.325 -0.410 818 H161 OLA 128 HP1 OLA 128 -5.691 -1.380 -3.071 819 H162 OLA 128 HP2 OLA 128 -6.218 -0.144 -1.927 820 H171 OLA 128 HQ1 OLA 128 -8.299 -1.557 -1.571 821 H172 OLA 128 HQ2 OLA 128 -7.786 -2.486 -2.990 822 H181 OLA 128 HR1 OLA 128 -7.553 0.101 -3.857 823 H182 OLA 128 HR2 OLA 128 -8.927 -0.960 -4.167 824 H183 OLA 128 HR3 OLA 128 -8.978 0.175 -2.819 825 H9 OLA 129 HH1 OLA 129 -0.378 5.907 0.473 826 H10 OLA 129 HI1 OLA 129 -2.647 6.722 0.910 827 H21 OLA 129 HA1 OLA 129 6.012 2.801 -0.267 828 H22 OLA 129 HA2 OLA 129 5.050 3.177 -1.698 829 H31 OLA 129 HB1 OLA 129 3.157 3.486 -0.507 830 H32 OLA 129 HB2 OLA 129 3.542 2.199 0.637 831 H41 OLA 129 HC1 OLA 129 5.317 4.528 0.794 832 H42 OLA 129 HC2 OLA 129 4.528 3.612 2.080 833 H51 OLA 129 HD1 OLA 129 3.861 6.111 1.585 834 H52 OLA 129 HD2 OLA 129 2.859 5.364 0.339 835 H61 OLA 129 HE1 OLA 129 2.026 5.755 2.857 836 H62 OLA 129 HE2 OLA 129 2.744 4.152 3.033 837 H71 OLA 129 HF1 OLA 129 1.070 4.452 0.652 838 H72 OLA 129 HF2 OLA 129 1.107 3.164 1.858 839 H81 OLA 129 HG1 OLA 129 -0.837 3.954 2.606 840 H82 OLA 129 HG2 OLA 129 0.057 5.348 3.215 841 H111 OLA 129 HJ1 OLA 129 -2.183 5.279 3.549 842 H112 OLA 129 HJ2 OLA 129 -3.298 6.619 3.285 843 H121 OLA 129 HK1 OLA 129 -4.858 5.024 3.077 844 H122 OLA 129 HK2 OLA 129 -4.182 4.789 1.464 845 H131 OLA 129 HL1 OLA 129 -4.468 2.791 3.205 846 H132 OLA 129 HL2 OLA 129 -2.875 3.360 3.709 847 H141 OLA 129 HM1 OLA 129 -2.290 1.832 2.098 848 H142 OLA 129 HM2 OLA 129 -2.387 3.305 1.130 849 H151 OLA 129 HN1 OLA 129 -4.786 2.661 0.635 850 H152 OLA 129 HN2 OLA 129 -4.415 1.092 1.350 851 H161 OLA 129 HP1 OLA 129 -3.963 0.622 -0.835 852 H162 OLA 129 HP2 OLA 129 -2.378 1.212 -0.334 853 H171 OLA 129 HQ1 OLA 129 -3.926 3.461 -1.115 854 H172 OLA 129 HQ2 OLA 129 -2.491 2.790 -1.906 855 H181 OLA 129 HR1 OLA 129 -5.191 1.570 -2.336 856 H182 OLA 129 HR2 OLA 129 -3.754 1.483 -3.356 857 H183 OLA 129 HR3 OLA 129 -4.679 2.982 -3.261
Contact the webmaster for help, if required. Thursday, May 23, 2024 6:54:11 PM GMT (wattos1)