NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
9493 | 1o1w | 5347 | cing | recoord | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 HT1 MET 1 -20.820 1.507 2.073 2 2H MET 1 HT2 MET 1 -22.017 1.154 0.932 3 3H MET 1 HT3 MET 1 -22.156 2.532 1.902 4 HA MET 1 HA MET 1 -20.134 2.039 -0.208 5 1HB MET 1 HB2 MET 1 -21.236 3.998 -1.267 6 2HB MET 1 HB1 MET 1 -22.309 2.617 -1.088 7 1HG MET 1 HG2 MET 1 -23.766 3.923 -0.072 8 2HG MET 1 HG1 MET 1 -22.612 4.152 1.239 9 1HE MET 1 HE1 MET 1 -24.030 5.278 -2.037 10 2HE MET 1 HE2 MET 1 -23.780 7.024 -2.068 11 3HE MET 1 HE3 MET 1 -24.892 6.313 -0.897 12 H ASN 2 HN ASN 2 -21.179 4.022 2.500 13 HA ASN 2 HA ASN 2 -20.177 5.707 3.663 14 1HB ASN 2 HB2 ASN 2 -18.471 3.657 3.670 15 2HB ASN 2 HB1 ASN 2 -17.469 4.817 2.802 16 1HD2 ASN 2 HD21 ASN 2 -16.531 6.448 3.880 17 2HD2 ASN 2 HD22 ASN 2 -16.670 6.697 5.586 18 H GLU 3 HN GLU 3 -17.684 6.983 3.181 19 HA GLU 3 HA GLU 3 -18.440 9.128 1.650 20 1HB GLU 3 HB2 GLU 3 -16.003 8.180 2.917 21 2HB GLU 3 HB1 GLU 3 -15.676 9.107 1.459 22 1HG GLU 3 HG2 GLU 3 -15.666 10.660 3.213 23 2HG GLU 3 HG1 GLU 3 -17.213 10.876 2.395 24 H LEU 4 HN LEU 4 -15.894 6.824 0.593 25 HA LEU 4 HA LEU 4 -16.971 7.043 -2.119 26 1HB LEU 4 HB2 LEU 4 -14.588 8.276 -1.186 27 2HB LEU 4 HB1 LEU 4 -14.128 6.985 -2.274 28 HG LEU 4 HG LEU 4 -14.297 8.679 -3.784 29 1HD1 LEU 4 HD11 LEU 4 -15.953 7.002 -4.457 30 2HD1 LEU 4 HD12 LEU 4 -16.405 8.624 -4.980 31 3HD1 LEU 4 HD13 LEU 4 -17.201 7.895 -3.585 32 1HD2 LEU 4 HD21 LEU 4 -15.903 10.560 -3.584 33 2HD2 LEU 4 HD22 LEU 4 -14.791 10.426 -2.222 34 3HD2 LEU 4 HD23 LEU 4 -16.458 9.872 -2.058 35 H TYR 5 HN TYR 5 -16.501 4.968 0.188 36 HA TYR 5 HA TYR 5 -16.496 2.669 -1.302 37 1HB TYR 5 HB2 TYR 5 -14.208 1.758 -0.880 38 2HB TYR 5 HB1 TYR 5 -14.224 3.108 -2.007 39 HD1 TYR 5 HD1 TYR 5 -13.131 5.187 -1.472 40 HD2 TYR 5 HD2 TYR 5 -13.314 2.039 1.385 41 HE1 TYR 5 HE1 TYR 5 -11.431 6.347 -0.100 42 HE2 TYR 5 HE2 TYR 5 -11.626 3.178 2.761 43 HH TYR 5 HH TYR 5 -10.831 5.614 3.063 44 H GLN 6 HN GLN 6 -15.622 0.731 0.249 45 HA GLN 6 HA GLN 6 -17.095 1.184 2.682 46 1HB GLN 6 HB2 GLN 6 -15.965 -1.213 1.321 47 2HB GLN 6 HB1 GLN 6 -16.401 -1.317 3.025 48 1HG GLN 6 HG2 GLN 6 -18.436 -1.838 2.249 49 2HG GLN 6 HG1 GLN 6 -18.589 -0.096 1.994 50 1HE2 GLN 6 HE21 GLN 6 -16.625 -0.114 -0.159 51 2HE2 GLN 6 HE22 GLN 6 -17.443 -0.756 -1.537 52 H LEU 7 HN LEU 7 -16.148 2.173 4.290 53 HA LEU 7 HA LEU 7 -13.384 2.338 4.724 54 1HB LEU 7 HB2 LEU 7 -15.659 3.516 5.781 55 2HB LEU 7 HB1 LEU 7 -14.964 2.657 7.141 56 HG LEU 7 HG LEU 7 -12.972 4.177 5.649 57 1HD1 LEU 7 HD11 LEU 7 -15.229 5.668 6.982 58 2HD1 LEU 7 HD12 LEU 7 -14.863 5.664 5.257 59 3HD1 LEU 7 HD13 LEU 7 -13.723 6.377 6.399 60 1HD2 LEU 7 HD21 LEU 7 -12.027 4.083 7.649 61 2HD2 LEU 7 HD22 LEU 7 -13.447 3.235 8.260 62 3HD2 LEU 7 HD23 LEU 7 -13.359 4.994 8.358 63 H GLU 8 HN GLU 8 -12.279 0.490 4.931 64 HA GLU 8 HA GLU 8 -13.099 -1.388 7.051 65 1HB GLU 8 HB2 GLU 8 -12.943 -2.211 4.654 66 2HB GLU 8 HB1 GLU 8 -11.204 -1.982 4.780 67 1HG GLU 8 HG2 GLU 8 -12.025 -4.306 5.213 68 2HG GLU 8 HG1 GLU 8 -11.011 -3.612 6.478 69 H LYS 9 HN LYS 9 -9.895 -1.201 5.567 70 HA LYS 9 HA LYS 9 -7.831 -0.835 6.435 71 1HB LYS 9 HB2 LYS 9 -9.220 1.081 8.308 72 2HB LYS 9 HB1 LYS 9 -7.533 1.113 7.810 73 1HG LYS 9 HG2 LYS 9 -8.147 2.561 6.244 74 2HG LYS 9 HG1 LYS 9 -8.925 1.209 5.423 75 1HD LYS 9 HD2 LYS 9 -10.884 1.788 7.104 76 2HD LYS 9 HD1 LYS 9 -10.120 3.379 7.060 77 1HE LYS 9 HE2 LYS 9 -10.787 1.882 4.546 78 2HE LYS 9 HE1 LYS 9 -11.982 2.888 5.362 79 1HZ LYS 9 HZ1 LYS 9 -9.767 3.661 3.724 80 2HZ LYS 9 HZ2 LYS 9 -9.777 4.477 5.206 81 3HZ LYS 9 HZ3 LYS 9 -11.127 4.554 4.191 82 H GLU 10 HN GLU 10 -10.145 -2.375 8.135 83 HA GLU 10 HA GLU 10 -8.237 -3.265 10.172 84 1HB GLU 10 HB2 GLU 10 -10.093 -3.281 11.850 85 2HB GLU 10 HB1 GLU 10 -9.624 -1.667 11.335 86 1HG GLU 10 HG2 GLU 10 -11.526 -1.716 9.730 87 2HG GLU 10 HG1 GLU 10 -12.035 -3.231 10.471 88 HA PRO 11 HA PRO 11 -9.443 -7.518 9.646 89 1HB PRO 11 HB2 PRO 11 -11.418 -7.810 11.700 90 2HB PRO 11 HB1 PRO 11 -9.748 -8.383 11.711 91 1HG PRO 11 HG2 PRO 11 -10.907 -5.923 12.878 92 2HG PRO 11 HG1 PRO 11 -9.476 -6.840 13.380 93 1HD PRO 11 HD2 PRO 11 -9.238 -4.470 12.172 94 2HD PRO 11 HD1 PRO 11 -8.112 -5.797 11.799 95 H ILE 12 HN ILE 12 -10.655 -8.036 7.962 96 HA ILE 12 HA ILE 12 -13.268 -6.793 7.603 97 HB ILE 12 HB ILE 12 -11.957 -8.691 5.673 98 1HG1 ILE 12 HG12 ILE 12 -11.495 -5.713 5.876 99 2HG1 ILE 12 HG11 ILE 12 -10.324 -6.939 6.340 100 1HG2 ILE 12 HG21 ILE 12 -13.208 -6.664 4.294 101 2HG2 ILE 12 HG22 ILE 12 -14.263 -6.914 5.686 102 3HG2 ILE 12 HG23 ILE 12 -13.879 -8.263 4.617 103 1HD1 ILE 12 HD11 ILE 12 -10.343 -5.737 3.958 104 2HD1 ILE 12 HD12 ILE 12 -11.388 -7.110 3.596 105 3HD1 ILE 12 HD13 ILE 12 -9.755 -7.381 4.204 106 H VAL 13 HN VAL 13 -15.168 -7.929 7.361 107 HA VAL 13 HA VAL 13 -15.670 -10.143 8.925 108 HB VAL 13 HB VAL 13 -17.477 -8.741 8.193 109 1HG1 VAL 13 HG11 VAL 13 -16.252 -8.647 5.788 110 2HG1 VAL 13 HG12 VAL 13 -17.918 -8.139 6.071 111 3HG1 VAL 13 HG13 VAL 13 -17.584 -9.748 5.432 112 1HG2 VAL 13 HG21 VAL 13 -18.993 -10.389 8.201 113 2HG2 VAL 13 HG22 VAL 13 -17.606 -11.476 8.264 114 3HG2 VAL 13 HG23 VAL 13 -18.363 -11.101 6.716 115 H GLY 14 HN GLY 14 -14.596 -10.003 5.587 116 1HA GLY 14 HA2 GLY 14 -13.464 -12.517 5.511 117 2HA GLY 14 HA1 GLY 14 -15.120 -12.741 4.971 118 H ALA 15 HN ALA 15 -12.140 -10.953 4.320 119 HA ALA 15 HA ALA 15 -12.961 -10.776 1.488 120 1HB ALA 15 HB1 ALA 15 -11.310 -8.807 3.061 121 2HB ALA 15 HB2 ALA 15 -12.984 -8.591 2.550 122 3HB ALA 15 HB3 ALA 15 -11.699 -8.691 1.347 123 H GLU 16 HN GLU 16 -11.195 -10.683 -0.051 124 HA GLU 16 HA GLU 16 -9.369 -12.778 0.163 125 1HB GLU 16 HB2 GLU 16 -10.251 -11.144 -1.857 126 2HB GLU 16 HB1 GLU 16 -8.574 -10.645 -1.688 127 1HG GLU 16 HG2 GLU 16 -8.460 -12.318 -3.270 128 2HG GLU 16 HG1 GLU 16 -8.041 -13.157 -1.777 129 H THR 17 HN THR 17 -7.066 -12.793 0.371 130 HA THR 17 HA THR 17 -6.063 -10.588 2.013 131 HB THR 17 HB THR 17 -4.557 -12.013 3.058 132 HG1 THR 17 HG1 THR 17 -3.655 -13.714 2.096 133 1HG2 THR 17 HG21 THR 17 -6.052 -13.255 4.165 134 2HG2 THR 17 HG22 THR 17 -6.358 -14.271 2.757 135 3HG2 THR 17 HG23 THR 17 -7.239 -12.756 2.960 136 H PHE 18 HN PHE 18 -4.543 -9.305 1.345 137 HA PHE 18 HA PHE 18 -2.905 -10.062 -0.972 138 1HB PHE 18 HB2 PHE 18 -4.604 -7.628 -0.557 139 2HB PHE 18 HB1 PHE 18 -3.161 -7.534 -1.538 140 HD1 PHE 18 HD1 PHE 18 -5.893 -10.055 -1.239 141 HD2 PHE 18 HD2 PHE 18 -3.666 -7.445 -3.749 142 HE1 PHE 18 HE1 PHE 18 -7.158 -10.862 -3.186 143 HE2 PHE 18 HE2 PHE 18 -4.926 -8.244 -5.702 144 HZ PHE 18 HZ PHE 18 -6.675 -9.956 -5.423 145 H TYR 19 HN TYR 19 -0.905 -8.896 -1.169 146 HA TYR 19 HA TYR 19 0.057 -7.785 1.389 147 1HB TYR 19 HB2 TYR 19 1.320 -9.689 1.241 148 2HB TYR 19 HB1 TYR 19 1.228 -9.746 -0.511 149 HD1 TYR 19 HD1 TYR 19 2.619 -7.798 -1.758 150 HD2 TYR 19 HD2 TYR 19 3.330 -9.163 2.225 151 HE1 TYR 19 HE1 TYR 19 4.936 -6.978 -1.880 152 HE2 TYR 19 HE2 TYR 19 5.637 -8.328 2.104 153 HH TYR 19 HH TYR 19 7.090 -7.091 0.917 154 H VAL 20 HN VAL 20 1.551 -6.059 1.303 155 HA VAL 20 HA VAL 20 2.235 -4.885 -1.241 156 HB VAL 20 HB VAL 20 1.166 -2.698 0.227 157 1HG1 VAL 20 HG11 VAL 20 0.974 -2.103 -1.880 158 2HG1 VAL 20 HG12 VAL 20 -0.396 -3.201 -2.040 159 3HG1 VAL 20 HG13 VAL 20 1.234 -3.763 -2.413 160 1HG2 VAL 20 HG21 VAL 20 -0.577 -5.093 0.162 161 2HG2 VAL 20 HG22 VAL 20 -1.312 -3.549 -0.265 162 3HG2 VAL 20 HG23 VAL 20 -0.536 -3.751 1.305 163 H ASP 21 HN ASP 21 4.255 -4.188 -1.071 164 HA ASP 21 HA ASP 21 5.148 -2.556 1.078 165 1HB ASP 21 HB2 ASP 21 5.339 -4.558 2.356 166 2HB ASP 21 HB1 ASP 21 6.062 -5.431 1.009 167 H GLY 22 HN GLY 22 6.743 -1.283 0.371 168 1HA GLY 22 HA2 GLY 22 8.466 -2.239 -1.811 169 2HA GLY 22 HA1 GLY 22 7.617 -0.710 -1.982 170 H ALA 23 HN ALA 23 10.513 -1.315 -1.914 171 HA ALA 23 HA ALA 23 11.256 0.330 0.426 172 1HB ALA 23 HB1 ALA 23 12.328 -1.712 0.768 173 2HB ALA 23 HB2 ALA 23 13.570 -0.721 0.005 174 3HB ALA 23 HB3 ALA 23 12.692 -1.919 -0.945 175 H ALA 24 HN ALA 24 11.650 2.316 -0.122 176 HA ALA 24 HA ALA 24 13.332 2.895 -2.429 177 1HB ALA 24 HB1 ALA 24 11.595 4.977 -2.558 178 2HB ALA 24 HB2 ALA 24 10.511 3.661 -2.103 179 3HB ALA 24 HB3 ALA 24 11.491 3.531 -3.564 180 H ASN 25 HN ASN 25 14.936 4.189 -1.810 181 HA ASN 25 HA ASN 25 15.323 5.096 0.752 182 1HB ASN 25 HB2 ASN 25 16.987 4.960 -1.208 183 2HB ASN 25 HB1 ASN 25 16.432 6.578 -1.624 184 1HD2 ASN 25 HD21 ASN 25 16.373 8.077 0.378 185 2HD2 ASN 25 HD22 ASN 25 17.800 8.052 1.351 186 H ARG 26 HN ARG 26 14.112 6.414 1.888 187 HA ARG 26 HA ARG 26 12.236 8.245 0.889 188 1HB ARG 26 HB2 ARG 26 12.564 7.132 3.248 189 2HB ARG 26 HB1 ARG 26 13.464 8.609 3.581 190 1HG ARG 26 HG2 ARG 26 10.670 8.626 2.487 191 2HG ARG 26 HG1 ARG 26 11.020 8.592 4.215 192 1HD ARG 26 HD2 ARG 26 11.514 10.748 2.221 193 2HD ARG 26 HD1 ARG 26 10.761 10.845 3.810 194 HE ARG 26 HE ARG 26 13.435 10.111 4.157 195 1HH1 ARG 26 HH11 ARG 26 11.564 12.843 3.074 196 2HH1 ARG 26 HH12 ARG 26 12.751 14.010 3.552 197 1HH2 ARG 26 HH21 ARG 26 15.004 11.640 4.789 198 2HH2 ARG 26 HH22 ARG 26 14.707 13.326 4.525 199 H GLU 27 HN GLU 27 15.412 8.791 2.354 200 HA GLU 27 HA GLU 27 15.520 11.514 2.406 201 1HB GLU 27 HB2 GLU 27 17.263 10.178 3.359 202 2HB GLU 27 HB1 GLU 27 17.676 9.504 1.796 203 1HG GLU 27 HG2 GLU 27 18.750 11.434 1.099 204 2HG GLU 27 HG1 GLU 27 17.902 12.445 2.269 205 H THR 28 HN THR 28 15.557 9.461 -0.344 206 HA THR 28 HA THR 28 16.101 11.777 -2.081 207 HB THR 28 HB THR 28 16.580 8.929 -2.909 208 HG1 THR 28 HG1 THR 28 18.830 9.413 -2.331 209 1HG2 THR 28 HG21 THR 28 17.003 11.586 -4.029 210 2HG2 THR 28 HG22 THR 28 16.941 10.019 -4.834 211 3HG2 THR 28 HG23 THR 28 18.441 10.569 -4.090 212 H LYS 29 HN LYS 29 13.798 9.624 -1.038 213 HA LYS 29 HA LYS 29 11.777 8.895 -1.788 214 1HB LYS 29 HB2 LYS 29 11.923 11.475 -3.358 215 2HB LYS 29 HB1 LYS 29 10.460 10.546 -3.056 216 1HG LYS 29 HG2 LYS 29 10.159 11.742 -1.217 217 2HG LYS 29 HG1 LYS 29 11.601 10.981 -0.539 218 1HD LYS 29 HD2 LYS 29 12.831 12.827 -1.962 219 2HD LYS 29 HD1 LYS 29 11.279 13.654 -1.818 220 1HE LYS 29 HE2 LYS 29 12.711 12.521 0.567 221 2HE LYS 29 HE1 LYS 29 13.045 14.144 -0.037 222 1HZ LYS 29 HZ1 LYS 29 11.019 14.905 0.616 223 2HZ LYS 29 HZ2 LYS 29 11.235 13.712 1.794 224 3HZ LYS 29 HZ3 LYS 29 10.256 13.406 0.449 225 H LEU 30 HN LEU 30 13.087 7.204 -2.893 226 HA LEU 30 HA LEU 30 12.096 6.749 -5.505 227 1HB LEU 30 HB2 LEU 30 13.650 8.143 -6.478 228 2HB LEU 30 HB1 LEU 30 14.847 7.860 -5.229 229 HG LEU 30 HG LEU 30 14.152 5.643 -7.114 230 1HD1 LEU 30 HD11 LEU 30 15.176 6.524 -8.897 231 2HD1 LEU 30 HD12 LEU 30 16.430 7.290 -7.921 232 3HD1 LEU 30 HD13 LEU 30 14.864 8.077 -8.120 233 1HD2 LEU 30 HD21 LEU 30 16.473 5.012 -6.702 234 2HD2 LEU 30 HD22 LEU 30 15.592 5.193 -5.183 235 3HD2 LEU 30 HD23 LEU 30 16.704 6.457 -5.717 236 H GLY 31 HN GLY 31 12.521 4.633 -6.236 237 1HA GLY 31 HA2 GLY 31 14.343 2.803 -5.544 238 2HA GLY 31 HA1 GLY 31 13.331 2.831 -4.108 239 H LYS 32 HN LYS 32 12.422 0.846 -4.247 240 HA LYS 32 HA LYS 32 10.823 0.280 -6.652 241 1HB LYS 32 HB2 LYS 32 11.703 -1.905 -4.816 242 2HB LYS 32 HB1 LYS 32 11.339 -1.970 -6.535 243 1HG LYS 32 HG2 LYS 32 13.549 -2.052 -6.814 244 2HG LYS 32 HG1 LYS 32 13.517 -0.321 -6.476 245 1HD LYS 32 HD2 LYS 32 15.164 -1.199 -5.043 246 2HD LYS 32 HD1 LYS 32 13.746 -0.954 -4.022 247 1HE LYS 32 HE2 LYS 32 14.178 -3.064 -3.364 248 2HE LYS 32 HE1 LYS 32 13.317 -3.487 -4.842 249 1HZ LYS 32 HZ1 LYS 32 15.764 -3.198 -5.802 250 2HZ LYS 32 HZ2 LYS 32 15.188 -4.670 -5.199 251 3HZ LYS 32 HZ3 LYS 32 16.154 -3.679 -4.227 252 H ALA 33 HN ALA 33 8.937 -1.115 -6.266 253 HA ALA 33 HA ALA 33 7.843 -1.389 -3.648 254 1HB ALA 33 HB1 ALA 33 6.982 0.907 -5.341 255 2HB ALA 33 HB2 ALA 33 7.201 0.815 -3.594 256 3HB ALA 33 HB3 ALA 33 5.787 0.078 -4.345 257 H GLY 34 HN GLY 34 6.805 -3.273 -3.788 258 1HA GLY 34 HA2 GLY 34 5.149 -3.760 -6.177 259 2HA GLY 34 HA1 GLY 34 6.313 -4.971 -5.671 260 H TYR 35 HN TYR 35 4.335 -6.276 -5.675 261 HA TYR 35 HA TYR 35 3.419 -6.595 -2.984 262 1HB TYR 35 HB2 TYR 35 1.365 -5.676 -3.023 263 2HB TYR 35 HB1 TYR 35 1.956 -4.760 -4.403 264 HD1 TYR 35 HD1 TYR 35 1.337 -5.432 -6.684 265 HD2 TYR 35 HD2 TYR 35 -0.263 -7.424 -3.290 266 HE1 TYR 35 HE1 TYR 35 -0.418 -6.413 -8.098 267 HE2 TYR 35 HE2 TYR 35 -2.024 -8.410 -4.691 268 HH TYR 35 HH TYR 35 -3.158 -7.942 -6.826 269 H VAL 36 HN VAL 36 1.887 -8.411 -2.754 270 HA VAL 36 HA VAL 36 1.860 -10.221 -5.042 271 HB VAL 36 HB VAL 36 3.813 -10.942 -3.778 272 1HG1 VAL 36 HG11 VAL 36 2.076 -10.503 -1.508 273 2HG1 VAL 36 HG12 VAL 36 3.832 -10.638 -1.578 274 3HG1 VAL 36 HG13 VAL 36 2.840 -12.091 -1.460 275 1HG2 VAL 36 HG21 VAL 36 3.098 -12.868 -4.666 276 2HG2 VAL 36 HG22 VAL 36 1.435 -12.604 -4.142 277 3HG2 VAL 36 HG23 VAL 36 2.618 -13.268 -3.016 278 H THR 37 HN THR 37 -0.135 -10.812 -5.402 279 HA THR 37 HA THR 37 -2.080 -10.644 -3.220 280 HB THR 37 HB THR 37 -2.989 -9.649 -5.133 281 HG1 THR 37 HG1 THR 37 -4.321 -11.802 -5.882 282 1HG2 THR 37 HG21 THR 37 -3.110 -11.184 -7.279 283 2HG2 THR 37 HG22 THR 37 -1.647 -11.872 -6.572 284 3HG2 THR 37 HG23 THR 37 -1.716 -10.152 -6.959 285 H ASN 38 HN ASN 38 -3.702 -12.319 -2.950 286 HA ASN 38 HA ASN 38 -2.580 -14.814 -2.401 287 1HB ASN 38 HB2 ASN 38 -4.705 -15.481 -1.725 288 2HB ASN 38 HB1 ASN 38 -4.790 -13.729 -1.573 289 1HD2 ASN 38 HD21 ASN 38 -5.138 -12.979 -4.185 290 2HD2 ASN 38 HD22 ASN 38 -6.664 -13.559 -4.755 291 H ARG 39 HN ARG 39 -3.159 -13.583 -5.433 292 HA ARG 39 HA ARG 39 -3.826 -16.164 -6.646 293 1HB ARG 39 HB2 ARG 39 -3.359 -13.606 -8.158 294 2HB ARG 39 HB1 ARG 39 -4.338 -14.994 -8.618 295 1HG ARG 39 HG2 ARG 39 -6.001 -14.424 -6.964 296 2HG ARG 39 HG1 ARG 39 -5.001 -13.092 -6.381 297 1HD ARG 39 HD2 ARG 39 -5.578 -11.743 -8.091 298 2HD ARG 39 HD1 ARG 39 -5.567 -13.059 -9.264 299 HE ARG 39 HE ARG 39 -7.827 -12.053 -7.814 300 1HH1 ARG 39 HH11 ARG 39 -6.490 -14.840 -9.423 301 2HH1 ARG 39 HH12 ARG 39 -8.034 -15.558 -9.740 302 1HH2 ARG 39 HH21 ARG 39 -9.864 -12.989 -8.226 303 2HH2 ARG 39 HH22 ARG 39 -9.952 -14.505 -9.059 304 H GLY 40 HN GLY 40 -1.179 -14.975 -5.437 305 1HA GLY 40 HA2 GLY 40 1.050 -15.390 -5.774 306 2HA GLY 40 HA1 GLY 40 0.578 -16.474 -7.074 307 H ARG 41 HN ARG 41 0.117 -12.946 -6.673 308 HA ARG 41 HA ARG 41 1.495 -12.650 -9.268 309 1HB ARG 41 HB2 ARG 41 -0.550 -11.720 -9.706 310 2HB ARG 41 HB1 ARG 41 -0.785 -11.206 -8.050 311 1HG ARG 41 HG2 ARG 41 0.134 -9.180 -8.399 312 2HG ARG 41 HG1 ARG 41 1.386 -9.821 -9.467 313 1HD ARG 41 HD2 ARG 41 -1.461 -9.746 -10.381 314 2HD ARG 41 HD1 ARG 41 -0.486 -8.277 -10.426 315 HE ARG 41 HE ARG 41 0.883 -9.260 -12.059 316 1HH1 ARG 41 HH11 ARG 41 -1.700 -11.360 -11.039 317 2HH1 ARG 41 HH12 ARG 41 -1.540 -12.431 -12.391 318 1HH2 ARG 41 HH21 ARG 41 1.105 -10.664 -13.845 319 2HH2 ARG 41 HH22 ARG 41 0.057 -12.035 -13.988 320 H GLN 42 HN GLN 42 3.068 -11.014 -9.539 321 HA GLN 42 HA GLN 42 3.891 -9.562 -7.134 322 1HB GLN 42 HB2 GLN 42 5.479 -11.635 -8.580 323 2HB GLN 42 HB1 GLN 42 6.324 -10.250 -7.906 324 1HG GLN 42 HG2 GLN 42 4.439 -11.789 -6.189 325 2HG GLN 42 HG1 GLN 42 6.043 -12.439 -6.524 326 1HE2 GLN 42 HE21 GLN 42 4.227 -9.925 -4.988 327 2HE2 GLN 42 HE22 GLN 42 5.522 -9.281 -4.037 328 H LYS 43 HN LYS 43 4.209 -7.487 -7.624 329 HA LYS 43 HA LYS 43 5.315 -6.815 -10.271 330 1HB LYS 43 HB2 LYS 43 3.802 -4.588 -9.414 331 2HB LYS 43 HB1 LYS 43 3.513 -5.615 -10.811 332 1HG LYS 43 HG2 LYS 43 2.534 -6.812 -8.365 333 2HG LYS 43 HG1 LYS 43 1.829 -5.220 -8.669 334 1HD LYS 43 HD2 LYS 43 2.001 -7.183 -10.907 335 2HD LYS 43 HD1 LYS 43 0.747 -7.386 -9.683 336 1HE LYS 43 HE2 LYS 43 1.180 -4.752 -11.051 337 2HE LYS 43 HE1 LYS 43 0.194 -6.013 -11.787 338 1HZ LYS 43 HZ1 LYS 43 -1.018 -4.323 -10.400 339 2HZ LYS 43 HZ2 LYS 43 -0.293 -5.020 -9.040 340 3HZ LYS 43 HZ3 LYS 43 -1.324 -5.942 -10.013 341 H VAL 44 HN VAL 44 6.071 -4.429 -10.241 342 HA VAL 44 HA VAL 44 7.022 -3.444 -7.707 343 HB VAL 44 HB VAL 44 8.693 -5.238 -8.435 344 1HG1 VAL 44 HG11 VAL 44 10.219 -3.497 -10.116 345 2HG1 VAL 44 HG12 VAL 44 8.625 -3.758 -10.824 346 3HG1 VAL 44 HG13 VAL 44 9.652 -5.136 -10.433 347 1HG2 VAL 44 HG21 VAL 44 9.415 -2.403 -7.790 348 2HG2 VAL 44 HG22 VAL 44 10.659 -3.642 -7.958 349 3HG2 VAL 44 HG23 VAL 44 9.401 -3.817 -6.734 350 H VAL 45 HN VAL 45 7.761 -1.279 -7.829 351 HA VAL 45 HA VAL 45 7.819 0.013 -10.445 352 HB VAL 45 HB VAL 45 6.265 1.815 -9.639 353 1HG1 VAL 45 HG11 VAL 45 4.833 -0.816 -9.770 354 2HG1 VAL 45 HG12 VAL 45 5.675 -0.153 -11.172 355 3HG1 VAL 45 HG13 VAL 45 4.348 0.745 -10.433 356 1HG2 VAL 45 HG21 VAL 45 4.678 0.355 -7.847 357 2HG2 VAL 45 HG22 VAL 45 5.634 1.798 -7.508 358 3HG2 VAL 45 HG23 VAL 45 6.336 0.199 -7.266 359 H THR 46 HN THR 46 8.613 2.223 -10.372 360 HA THR 46 HA THR 46 10.531 2.569 -8.197 361 HB THR 46 HB THR 46 11.673 4.161 -9.582 362 HG1 THR 46 HG1 THR 46 10.307 4.046 -11.874 363 1HG2 THR 46 HG21 THR 46 12.623 2.469 -10.674 364 2HG2 THR 46 HG22 THR 46 11.293 2.452 -11.832 365 3HG2 THR 46 HG23 THR 46 11.199 1.475 -10.367 366 H LEU 47 HN LEU 47 10.579 4.300 -6.846 367 HA LEU 47 HA LEU 47 8.146 5.908 -6.754 368 1HB LEU 47 HB2 LEU 47 10.343 5.377 -4.779 369 2HB LEU 47 HB1 LEU 47 9.176 6.666 -4.523 370 HG LEU 47 HG LEU 47 8.352 4.848 -3.288 371 1HD1 LEU 47 HD11 LEU 47 6.349 5.388 -4.105 372 2HD1 LEU 47 HD12 LEU 47 6.507 3.969 -5.140 373 3HD1 LEU 47 HD13 LEU 47 6.973 5.558 -5.745 374 1HD2 LEU 47 HD21 LEU 47 9.107 3.184 -5.670 375 2HD2 LEU 47 HD22 LEU 47 8.005 2.596 -4.426 376 3HD2 LEU 47 HD23 LEU 47 9.657 3.039 -4.000 377 H THR 48 HN THR 48 8.063 8.107 -6.775 378 HA THR 48 HA THR 48 10.539 9.592 -7.277 379 HB THR 48 HB THR 48 8.750 10.845 -8.964 380 HG1 THR 48 HG1 THR 48 8.476 8.498 -10.165 381 1HG2 THR 48 HG21 THR 48 10.348 8.849 -10.347 382 2HG2 THR 48 HG22 THR 48 11.267 9.706 -9.110 383 3HG2 THR 48 HG23 THR 48 10.456 10.608 -10.390 384 H ASP 49 HN ASP 49 10.590 11.055 -5.703 385 HA ASP 49 HA ASP 49 10.014 12.753 -4.312 386 1HB ASP 49 HB2 ASP 49 7.487 13.138 -5.908 387 2HB ASP 49 HB1 ASP 49 8.404 14.342 -5.007 388 H THR 50 HN THR 50 8.605 9.910 -4.359 389 HA THR 50 HA THR 50 6.366 10.449 -2.577 390 HB THR 50 HB THR 50 5.816 8.148 -2.729 391 HG1 THR 50 HG1 THR 50 8.370 7.764 -3.938 392 1HG2 THR 50 HG21 THR 50 6.755 8.238 -5.482 393 2HG2 THR 50 HG22 THR 50 6.018 9.755 -4.967 394 3HG2 THR 50 HG23 THR 50 5.109 8.249 -4.850 395 H THR 51 HN THR 51 6.415 10.224 -0.414 396 HA THR 51 HA THR 51 8.877 10.007 0.966 397 HB THR 51 HB THR 51 6.519 9.378 2.588 398 HG1 THR 51 HG1 THR 51 5.322 11.107 2.091 399 1HG2 THR 51 HG21 THR 51 8.847 10.266 3.255 400 2HG2 THR 51 HG22 THR 51 7.429 10.950 4.047 401 3HG2 THR 51 HG23 THR 51 8.227 11.838 2.748 402 H ASN 52 HN ASN 52 9.175 8.376 2.803 403 HA ASN 52 HA ASN 52 9.561 5.853 1.782 404 1HB ASN 52 HB2 ASN 52 9.907 5.078 4.061 405 2HB ASN 52 HB1 ASN 52 10.609 6.681 3.871 406 1HD2 ASN 52 HD21 ASN 52 8.969 8.484 4.404 407 2HD2 ASN 52 HD22 ASN 52 8.089 8.267 5.875 408 H GLN 53 HN GLN 53 6.893 6.937 3.863 409 HA GLN 53 HA GLN 53 5.487 4.492 3.773 410 1HB GLN 53 HB2 GLN 53 4.871 7.276 4.623 411 2HB GLN 53 HB1 GLN 53 3.517 6.188 4.340 412 1HG GLN 53 HG2 GLN 53 3.827 5.210 6.294 413 2HG GLN 53 HG1 GLN 53 5.506 4.851 5.898 414 1HE2 GLN 53 HE21 GLN 53 3.368 7.334 7.176 415 2HE2 GLN 53 HE22 GLN 53 4.547 8.097 8.174 416 H LYS 54 HN LYS 54 5.606 7.278 1.667 417 HA LYS 54 HA LYS 54 3.259 6.624 0.187 418 1HB LYS 54 HB2 LYS 54 5.398 8.622 -0.025 419 2HB LYS 54 HB1 LYS 54 4.807 8.044 -1.582 420 1HG LYS 54 HG2 LYS 54 3.366 9.772 -1.269 421 2HG LYS 54 HG1 LYS 54 2.456 8.500 -0.452 422 1HD LYS 54 HD2 LYS 54 4.396 10.235 1.043 423 2HD LYS 54 HD1 LYS 54 2.739 10.762 0.743 424 1HE LYS 54 HE2 LYS 54 2.784 8.059 1.737 425 2HE LYS 54 HE1 LYS 54 3.663 9.134 2.824 426 1HZ LYS 54 HZ1 LYS 54 0.943 9.746 1.818 427 2HZ LYS 54 HZ2 LYS 54 1.772 10.493 3.090 428 3HZ LYS 54 HZ3 LYS 54 1.219 8.904 3.259 429 H THR 55 HN THR 55 6.560 5.551 0.165 430 HA THR 55 HA THR 55 6.649 4.483 -2.452 431 HB THR 55 HB THR 55 8.555 3.274 -1.825 432 HG1 THR 55 HG1 THR 55 8.909 2.883 0.546 433 1HG2 THR 55 HG21 THR 55 8.261 5.897 -0.763 434 2HG2 THR 55 HG22 THR 55 9.725 5.099 -1.337 435 3HG2 THR 55 HG23 THR 55 9.246 4.952 0.354 436 H GLU 56 HN GLU 56 5.456 3.397 0.626 437 HA GLU 56 HA GLU 56 4.667 0.788 -0.333 438 1HB GLU 56 HB2 GLU 56 3.422 1.809 2.133 439 2HB GLU 56 HB1 GLU 56 4.261 0.291 1.841 440 1HG GLU 56 HG2 GLU 56 5.945 2.708 1.878 441 2HG GLU 56 HG1 GLU 56 5.207 2.252 3.412 442 H LEU 57 HN LEU 57 3.400 3.972 -0.126 443 HA LEU 57 HA LEU 57 0.627 3.358 -0.285 444 1HB LEU 57 HB2 LEU 57 2.007 5.611 0.220 445 2HB LEU 57 HB1 LEU 57 1.680 5.869 -1.479 446 HG LEU 57 HG LEU 57 -0.486 6.387 -1.116 447 1HD1 LEU 57 HD11 LEU 57 -1.726 5.291 0.931 448 2HD1 LEU 57 HD12 LEU 57 -0.441 4.094 0.776 449 3HD1 LEU 57 HD13 LEU 57 -1.513 4.416 -0.587 450 1HD2 LEU 57 HD21 LEU 57 -0.491 6.780 1.685 451 2HD2 LEU 57 HD22 LEU 57 -0.252 7.972 0.407 452 3HD2 LEU 57 HD23 LEU 57 1.134 7.127 1.096 453 H GLN 58 HN GLN 58 3.143 4.131 -2.641 454 HA GLN 58 HA GLN 58 1.519 4.056 -4.933 455 1HB GLN 58 HB2 GLN 58 3.703 5.042 -5.095 456 2HB GLN 58 HB1 GLN 58 4.475 3.572 -4.516 457 1HG GLN 58 HG2 GLN 58 4.690 4.024 -6.974 458 2HG GLN 58 HG1 GLN 58 4.064 2.434 -6.540 459 1HE2 GLN 58 HE21 GLN 58 2.351 1.783 -7.615 460 2HE2 GLN 58 HE22 GLN 58 1.205 2.792 -8.422 461 H ALA 59 HN ALA 59 3.555 1.642 -3.333 462 HA ALA 59 HA ALA 59 2.962 -0.545 -4.990 463 1HB ALA 59 HB1 ALA 59 4.608 -1.272 -3.650 464 2HB ALA 59 HB2 ALA 59 3.333 -1.650 -2.492 465 3HB ALA 59 HB3 ALA 59 4.201 -0.119 -2.380 466 H ILE 60 HN ILE 60 1.316 0.923 -2.261 467 HA ILE 60 HA ILE 60 -0.570 -1.030 -1.659 468 HB ILE 60 HB ILE 60 -0.384 1.893 -1.282 469 1HG1 ILE 60 HG12 ILE 60 -1.702 0.058 0.647 470 2HG1 ILE 60 HG11 ILE 60 -0.007 -0.244 0.283 471 1HG2 ILE 60 HG21 ILE 60 -2.604 1.705 -2.363 472 2HG2 ILE 60 HG22 ILE 60 -2.690 2.245 -0.686 473 3HG2 ILE 60 HG23 ILE 60 -3.091 0.578 -1.098 474 1HD1 ILE 60 HD11 ILE 60 -0.755 2.538 0.927 475 2HD1 ILE 60 HD12 ILE 60 0.691 1.621 1.346 476 3HD1 ILE 60 HD13 ILE 60 -0.805 1.365 2.242 477 H TYR 61 HN TYR 61 -0.609 1.509 -4.103 478 HA TYR 61 HA TYR 61 -3.152 1.098 -5.160 479 1HB TYR 61 HB2 TYR 61 -2.212 2.979 -6.063 480 2HB TYR 61 HB1 TYR 61 -0.600 2.283 -6.103 481 HD1 TYR 61 HD1 TYR 61 -3.660 2.884 -7.961 482 HD2 TYR 61 HD2 TYR 61 0.085 0.857 -8.022 483 HE1 TYR 61 HE1 TYR 61 -3.862 2.591 -10.395 484 HE2 TYR 61 HE2 TYR 61 -0.111 0.560 -10.454 485 HH TYR 61 HH TYR 61 -1.237 1.256 -12.310 486 H LEU 62 HN LEU 62 -0.177 -0.698 -5.547 487 HA LEU 62 HA LEU 62 -0.927 -2.212 -7.828 488 1HB LEU 62 HB2 LEU 62 0.899 -3.163 -5.618 489 2HB LEU 62 HB1 LEU 62 0.882 -3.678 -7.298 490 HG LEU 62 HG LEU 62 1.624 -0.888 -6.418 491 1HD1 LEU 62 HD11 LEU 62 3.118 -2.981 -5.794 492 2HD1 LEU 62 HD12 LEU 62 3.825 -1.466 -6.355 493 3HD1 LEU 62 HD13 LEU 62 3.619 -2.811 -7.477 494 1HD2 LEU 62 HD21 LEU 62 1.021 -2.058 -8.958 495 2HD2 LEU 62 HD22 LEU 62 2.717 -1.582 -8.916 496 3HD2 LEU 62 HD23 LEU 62 1.459 -0.393 -8.576 497 H ALA 63 HN ALA 63 -0.976 -3.081 -4.364 498 HA ALA 63 HA ALA 63 -2.237 -5.571 -4.716 499 1HB ALA 63 HB1 ALA 63 -1.346 -5.471 -2.631 500 2HB ALA 63 HB2 ALA 63 -2.993 -4.985 -2.228 501 3HB ALA 63 HB3 ALA 63 -1.735 -3.763 -2.424 502 H LEU 64 HN LEU 64 -3.396 -2.346 -4.709 503 HA LEU 64 HA LEU 64 -6.175 -3.070 -4.282 504 1HB LEU 64 HB2 LEU 64 -4.607 -0.594 -4.490 505 2HB LEU 64 HB1 LEU 64 -6.202 -0.497 -5.213 506 HG LEU 64 HG LEU 64 -6.281 -1.704 -2.570 507 1HD1 LEU 64 HD11 LEU 64 -4.643 -0.409 -1.703 508 2HD1 LEU 64 HD12 LEU 64 -5.944 0.781 -1.659 509 3HD1 LEU 64 HD13 LEU 64 -4.772 0.801 -2.978 510 1HD2 LEU 64 HD21 LEU 64 -7.684 0.717 -2.658 511 2HD2 LEU 64 HD22 LEU 64 -8.331 -0.910 -2.871 512 3HD2 LEU 64 HD23 LEU 64 -7.814 0.024 -4.275 513 H GLN 65 HN GLN 65 -3.985 -2.772 -6.892 514 HA GLN 65 HA GLN 65 -5.819 -2.110 -8.951 515 1HB GLN 65 HB2 GLN 65 -3.036 -3.156 -8.826 516 2HB GLN 65 HB1 GLN 65 -3.912 -3.337 -10.341 517 1HG GLN 65 HG2 GLN 65 -3.850 -0.682 -8.993 518 2HG GLN 65 HG1 GLN 65 -2.444 -1.233 -9.904 519 1HE2 GLN 65 HE21 GLN 65 -5.216 0.500 -10.103 520 2HE2 GLN 65 HE22 GLN 65 -5.495 0.414 -11.806 521 H ASP 66 HN ASP 66 -4.400 -5.241 -7.980 522 HA ASP 66 HA ASP 66 -6.414 -6.584 -9.637 523 1HB ASP 66 HB2 ASP 66 -3.923 -7.669 -8.311 524 2HB ASP 66 HB1 ASP 66 -5.032 -8.615 -9.297 525 H SER 67 HN SER 67 -6.490 -5.396 -6.719 526 HA SER 67 HA SER 67 -6.978 -7.430 -4.894 527 1HB SER 67 HB2 SER 67 -8.444 -5.729 -3.745 528 2HB SER 67 HB1 SER 67 -6.825 -5.159 -4.142 529 HG SER 67 HG SER 67 -8.722 -4.730 -6.094 530 H GLY 68 HN GLY 68 -9.442 -5.642 -6.773 531 1HA GLY 68 HA2 GLY 68 -11.182 -6.879 -7.949 532 2HA GLY 68 HA1 GLY 68 -11.114 -8.071 -6.667 533 H LEU 69 HN LEU 69 -12.440 -7.870 -4.990 534 HA LEU 69 HA LEU 69 -14.166 -5.513 -4.913 535 1HB LEU 69 HB2 LEU 69 -14.507 -8.352 -4.607 536 2HB LEU 69 HB1 LEU 69 -15.086 -7.520 -3.203 537 HG LEU 69 HG LEU 69 -16.008 -7.101 -6.046 538 1HD1 LEU 69 HD11 LEU 69 -17.188 -8.476 -3.662 539 2HD1 LEU 69 HD12 LEU 69 -16.986 -9.076 -5.308 540 3HD1 LEU 69 HD13 LEU 69 -18.206 -7.851 -4.960 541 1HD2 LEU 69 HD21 LEU 69 -16.004 -5.214 -4.024 542 2HD2 LEU 69 HD22 LEU 69 -17.632 -5.889 -3.975 543 3HD2 LEU 69 HD23 LEU 69 -17.008 -5.198 -5.473 544 H GLU 70 HN GLU 70 -13.575 -7.828 -2.360 545 HA GLU 70 HA GLU 70 -12.505 -5.660 -0.684 546 1HB GLU 70 HB2 GLU 70 -13.345 -7.227 1.208 547 2HB GLU 70 HB1 GLU 70 -14.513 -6.238 0.341 548 1HG GLU 70 HG2 GLU 70 -15.073 -8.154 -1.074 549 2HG GLU 70 HG1 GLU 70 -13.922 -9.147 -0.167 550 H VAL 71 HN VAL 71 -10.444 -5.893 -0.168 551 HA VAL 71 HA VAL 71 -9.374 -8.608 0.153 552 HB VAL 71 HB VAL 71 -7.266 -7.934 -0.886 553 1HG1 VAL 71 HG11 VAL 71 -7.979 -8.440 -2.975 554 2HG1 VAL 71 HG12 VAL 71 -9.192 -7.161 -2.989 555 3HG1 VAL 71 HG13 VAL 71 -9.522 -8.682 -2.159 556 1HG2 VAL 71 HG21 VAL 71 -8.646 -5.397 -1.731 557 2HG2 VAL 71 HG22 VAL 71 -6.956 -5.844 -1.964 558 3HG2 VAL 71 HG23 VAL 71 -7.562 -5.496 -0.345 559 H ASN 72 HN ASN 72 -7.136 -8.480 1.155 560 HA ASN 72 HA ASN 72 -7.236 -6.628 3.430 561 1HB ASN 72 HB2 ASN 72 -6.122 -9.406 3.081 562 2HB ASN 72 HB1 ASN 72 -5.544 -8.362 4.377 563 1HD2 ASN 72 HD21 ASN 72 -8.735 -9.019 2.971 564 2HD2 ASN 72 HD22 ASN 72 -9.501 -9.420 4.467 565 H ILE 73 HN ILE 73 -6.014 -4.889 2.907 566 HA ILE 73 HA ILE 73 -3.599 -5.350 1.346 567 HB ILE 73 HB ILE 73 -5.199 -2.890 1.958 568 1HG1 ILE 73 HG12 ILE 73 -4.754 -4.691 -0.282 569 2HG1 ILE 73 HG11 ILE 73 -6.023 -3.497 -0.047 570 1HG2 ILE 73 HG21 ILE 73 -3.537 -1.439 1.131 571 2HG2 ILE 73 HG22 ILE 73 -2.526 -2.777 0.586 572 3HG2 ILE 73 HG23 ILE 73 -2.718 -2.463 2.310 573 1HD1 ILE 73 HD11 ILE 73 -3.286 -3.004 -1.189 574 2HD1 ILE 73 HD12 ILE 73 -4.499 -1.760 -0.891 575 3HD1 ILE 73 HD13 ILE 73 -4.814 -3.033 -2.069 576 H VAL 74 HN VAL 74 -2.073 -6.034 2.571 577 HA VAL 74 HA VAL 74 -1.483 -4.833 5.169 578 HB VAL 74 HB VAL 74 0.137 -7.007 3.864 579 1HG1 VAL 74 HG11 VAL 74 0.315 -5.632 6.289 580 2HG1 VAL 74 HG12 VAL 74 1.201 -7.081 5.814 581 3HG1 VAL 74 HG13 VAL 74 -0.317 -7.227 6.699 582 1HG2 VAL 74 HG21 VAL 74 -1.935 -8.021 3.706 583 2HG2 VAL 74 HG22 VAL 74 -2.555 -7.216 5.148 584 3HG2 VAL 74 HG23 VAL 74 -1.396 -8.536 5.305 585 H THR 75 HN THR 75 -0.385 -2.951 5.042 586 HA THR 75 HA THR 75 2.061 -2.946 3.411 587 HB THR 75 HB THR 75 0.552 -0.393 3.440 588 HG1 THR 75 HG1 THR 75 -1.057 -1.092 2.234 589 1HG2 THR 75 HG21 THR 75 1.771 0.044 1.569 590 2HG2 THR 75 HG22 THR 75 1.681 -1.617 0.984 591 3HG2 THR 75 HG23 THR 75 2.822 -1.192 2.259 592 H ASP 76 HN ASP 76 3.780 -1.971 4.365 593 HA ASP 76 HA ASP 76 3.363 -0.975 7.056 594 1HB ASP 76 HB2 ASP 76 6.032 -0.838 5.726 595 2HB ASP 76 HB1 ASP 76 5.629 -1.281 7.383 596 H SER 77 HN SER 77 2.385 0.975 6.926 597 HA SER 77 HA SER 77 3.985 3.222 6.215 598 1HB SER 77 HB2 SER 77 3.337 3.011 3.992 599 2HB SER 77 HB1 SER 77 1.743 2.381 4.409 600 HG SER 77 HG SER 77 1.152 4.455 5.073 601 H GLN 78 HN GLN 78 3.613 4.346 8.050 602 HA GLN 78 HA GLN 78 1.015 4.266 9.293 603 1HB GLN 78 HB2 GLN 78 2.185 6.071 10.800 604 2HB GLN 78 HB1 GLN 78 2.614 4.370 10.931 605 1HG GLN 78 HG2 GLN 78 4.320 5.328 8.985 606 2HG GLN 78 HG1 GLN 78 4.234 6.643 10.156 607 1HE2 GLN 78 HE21 GLN 78 6.206 4.380 9.364 608 2HE2 GLN 78 HE22 GLN 78 6.742 3.790 10.896 609 H TYR 79 HN TYR 79 2.386 6.025 6.801 610 HA TYR 79 HA TYR 79 0.983 8.512 7.277 611 1HB TYR 79 HB2 TYR 79 3.083 7.698 5.575 612 2HB TYR 79 HB1 TYR 79 1.749 8.149 4.518 613 HD1 TYR 79 HD1 TYR 79 0.525 10.431 5.408 614 HD2 TYR 79 HD2 TYR 79 4.602 9.369 6.006 615 HE1 TYR 79 HE1 TYR 79 1.095 12.806 5.701 616 HE2 TYR 79 HE2 TYR 79 5.182 11.740 6.302 617 HH TYR 79 HH TYR 79 2.893 14.142 6.818 618 H ALA 80 HN ALA 80 0.755 5.813 4.959 619 HA ALA 80 HA ALA 80 -1.679 6.589 3.778 620 1HB ALA 80 HB1 ALA 80 -0.051 4.696 3.083 621 2HB ALA 80 HB2 ALA 80 -1.780 4.429 2.866 622 3HB ALA 80 HB3 ALA 80 -0.942 3.710 4.240 623 H LEU 81 HN LEU 81 -0.790 4.790 6.618 624 HA LEU 81 HA LEU 81 -3.177 3.802 7.559 625 1HB LEU 81 HB2 LEU 81 -0.843 3.611 8.544 626 2HB LEU 81 HB1 LEU 81 -1.097 5.195 9.246 627 HG LEU 81 HG LEU 81 -2.981 2.934 9.843 628 1HD1 LEU 81 HD11 LEU 81 -1.408 2.933 12.004 629 2HD1 LEU 81 HD12 LEU 81 -0.203 3.345 10.782 630 3HD1 LEU 81 HD13 LEU 81 -1.142 1.859 10.629 631 1HD2 LEU 81 HD21 LEU 81 -2.388 5.639 10.907 632 2HD2 LEU 81 HD22 LEU 81 -2.834 4.389 12.069 633 3HD2 LEU 81 HD23 LEU 81 -3.930 4.796 10.747 634 H GLY 82 HN GLY 82 -1.865 7.067 7.759 635 1HA GLY 82 HA2 GLY 82 -4.108 8.086 9.261 636 2HA GLY 82 HA1 GLY 82 -2.760 9.017 8.631 637 H ILE 83 HN ILE 83 -2.920 8.529 5.910 638 HA ILE 83 HA ILE 83 -5.257 10.111 5.264 639 HB ILE 83 HB ILE 83 -3.601 9.248 3.013 640 1HG1 ILE 83 HG12 ILE 83 -1.880 9.313 4.830 641 2HG1 ILE 83 HG11 ILE 83 -1.624 10.527 3.581 642 1HG2 ILE 83 HG21 ILE 83 -3.921 12.075 3.846 643 2HG2 ILE 83 HG22 ILE 83 -5.367 11.182 3.382 644 3HG2 ILE 83 HG23 ILE 83 -4.029 11.344 2.245 645 1HD1 ILE 83 HD11 ILE 83 -1.720 10.929 6.328 646 2HD1 ILE 83 HD12 ILE 83 -3.237 11.588 5.714 647 3HD1 ILE 83 HD13 ILE 83 -1.699 12.161 5.068 648 H ILE 84 HN ILE 84 -3.832 7.166 3.823 649 HA ILE 84 HA ILE 84 -5.884 6.483 2.142 650 HB ILE 84 HB ILE 84 -3.520 5.305 2.843 651 1HG1 ILE 84 HG12 ILE 84 -4.780 5.380 0.636 652 2HG1 ILE 84 HG11 ILE 84 -3.879 3.900 0.953 653 1HG2 ILE 84 HG21 ILE 84 -4.825 4.127 4.686 654 2HG2 ILE 84 HG22 ILE 84 -3.834 3.123 3.628 655 3HG2 ILE 84 HG23 ILE 84 -5.580 3.194 3.395 656 1HD1 ILE 84 HD11 ILE 84 -5.725 2.650 0.899 657 2HD1 ILE 84 HD12 ILE 84 -6.482 4.049 0.138 658 3HD1 ILE 84 HD13 ILE 84 -6.643 3.796 1.876 659 H GLN 85 HN GLN 85 -5.837 6.224 5.590 660 HA GLN 85 HA GLN 85 -8.134 4.446 5.677 661 1HB GLN 85 HB2 GLN 85 -6.377 4.317 7.418 662 2HB GLN 85 HB1 GLN 85 -6.757 5.962 7.906 663 1HG GLN 85 HG2 GLN 85 -9.096 5.150 8.382 664 2HG GLN 85 HG1 GLN 85 -8.472 3.515 8.167 665 1HE2 GLN 85 HE21 GLN 85 -8.444 2.670 10.133 666 2HE2 GLN 85 HE22 GLN 85 -7.689 3.373 11.519 667 H ALA 86 HN ALA 86 -7.364 7.820 5.866 668 HA ALA 86 HA ALA 86 -10.049 8.581 6.665 669 1HB ALA 86 HB1 ALA 86 -8.966 10.932 6.302 670 2HB ALA 86 HB2 ALA 86 -7.463 10.010 6.356 671 3HB ALA 86 HB3 ALA 86 -8.571 9.972 7.727 672 H GLN 87 HN GLN 87 -10.212 7.247 4.309 673 HA GLN 87 HA GLN 87 -10.625 7.442 2.017 674 1HB GLN 87 HB2 GLN 87 -12.384 9.677 3.044 675 2HB GLN 87 HB1 GLN 87 -12.681 8.620 1.670 676 1HG GLN 87 HG2 GLN 87 -13.997 7.524 3.103 677 2HG GLN 87 HG1 GLN 87 -12.486 6.804 3.654 678 1HE2 GLN 87 HE21 GLN 87 -11.363 8.018 5.409 679 2HE2 GLN 87 HE22 GLN 87 -12.346 8.702 6.655 680 HA PRO 88 HA PRO 88 -8.076 11.229 1.399 681 1HB PRO 88 HB2 PRO 88 -5.865 10.154 0.393 682 2HB PRO 88 HB1 PRO 88 -6.203 10.090 2.132 683 1HG PRO 88 HG2 PRO 88 -6.655 7.983 0.048 684 2HG PRO 88 HG1 PRO 88 -5.872 7.832 1.633 685 1HD PRO 88 HD2 PRO 88 -8.494 7.182 1.203 686 2HD PRO 88 HD1 PRO 88 -7.887 7.766 2.764 687 H ASP 89 HN ASP 89 -10.147 9.906 -0.262 688 HA ASP 89 HA ASP 89 -9.435 9.402 -2.877 689 1HB ASP 89 HB2 ASP 89 -11.872 10.933 -2.857 690 2HB ASP 89 HB1 ASP 89 -11.653 9.209 -3.126 691 H GLN 90 HN GLN 90 -9.340 12.361 -1.173 692 HA GLN 90 HA GLN 90 -8.163 13.726 -3.397 693 1HB GLN 90 HB2 GLN 90 -10.069 15.608 -2.897 694 2HB GLN 90 HB1 GLN 90 -10.118 14.476 -4.243 695 1HG GLN 90 HG2 GLN 90 -12.250 14.624 -3.021 696 2HG GLN 90 HG1 GLN 90 -11.568 13.000 -3.023 697 1HE2 GLN 90 HE21 GLN 90 -11.420 11.980 -1.130 698 2HE2 GLN 90 HE22 GLN 90 -11.543 12.733 0.422 699 H SER 91 HN SER 91 -7.839 13.008 -0.450 700 HA SER 91 HA SER 91 -7.293 15.726 0.543 701 1HB SER 91 HB2 SER 91 -7.732 13.244 2.209 702 2HB SER 91 HB1 SER 91 -7.587 14.903 2.792 703 HG SER 91 HG SER 91 -9.768 14.239 2.652 704 H GLU 92 HN GLU 92 -5.380 16.192 1.539 705 HA GLU 92 HA GLU 92 -3.123 16.194 1.746 706 1HB GLU 92 HB2 GLU 92 -4.177 14.373 3.426 707 2HB GLU 92 HB1 GLU 92 -3.054 13.354 2.538 708 1HG GLU 92 HG2 GLU 92 -1.615 14.027 4.118 709 2HG GLU 92 HG1 GLU 92 -1.451 15.438 3.073 710 H SER 93 HN SER 93 -1.808 13.323 1.604 711 HA SER 93 HA SER 93 -0.233 13.570 -0.532 712 1HB SER 93 HB2 SER 93 -1.024 11.426 1.185 713 2HB SER 93 HB1 SER 93 -0.888 10.813 -0.461 714 HG SER 93 HG SER 93 1.215 11.886 -0.496 715 H GLU 94 HN GLU 94 -0.161 13.044 -2.673 716 HA GLU 94 HA GLU 94 -2.688 13.082 -4.069 717 1HB GLU 94 HB2 GLU 94 -1.373 13.408 -6.059 718 2HB GLU 94 HB1 GLU 94 -0.718 14.429 -4.788 719 1HG GLU 94 HG2 GLU 94 1.274 13.515 -5.019 720 2HG GLU 94 HG1 GLU 94 0.611 11.906 -4.740 721 H LEU 95 HN LEU 95 -0.202 10.782 -3.298 722 HA LEU 95 HA LEU 95 -0.721 8.825 -5.231 723 1HB LEU 95 HB2 LEU 95 0.996 9.125 -3.108 724 2HB LEU 95 HB1 LEU 95 -0.051 7.815 -2.577 725 HG LEU 95 HG LEU 95 0.574 6.459 -4.462 726 1HD1 LEU 95 HD11 LEU 95 0.806 7.661 -6.364 727 2HD1 LEU 95 HD12 LEU 95 2.511 7.592 -5.922 728 3HD1 LEU 95 HD13 LEU 95 1.560 9.028 -5.542 729 1HD2 LEU 95 HD21 LEU 95 2.385 7.345 -2.523 730 2HD2 LEU 95 HD22 LEU 95 3.287 7.311 -4.038 731 3HD2 LEU 95 HD23 LEU 95 2.466 5.858 -3.467 732 H VAL 96 HN VAL 96 -1.839 9.026 -1.871 733 HA VAL 96 HA VAL 96 -3.497 6.829 -1.822 734 HB VAL 96 HB VAL 96 -4.910 8.379 -0.219 735 1HG1 VAL 96 HG11 VAL 96 -2.489 8.087 1.197 736 2HG1 VAL 96 HG12 VAL 96 -2.606 6.740 0.065 737 3HG1 VAL 96 HG13 VAL 96 -3.905 7.035 1.220 738 1HG2 VAL 96 HG21 VAL 96 -2.988 10.193 -1.210 739 2HG2 VAL 96 HG22 VAL 96 -2.610 9.892 0.486 740 3HG2 VAL 96 HG23 VAL 96 -4.214 10.465 0.029 741 H ASN 97 HN ASN 97 -4.005 9.946 -3.304 742 HA ASN 97 HA ASN 97 -6.790 9.900 -3.585 743 1HB ASN 97 HB2 ASN 97 -4.536 11.265 -4.955 744 2HB ASN 97 HB1 ASN 97 -6.042 11.165 -5.857 745 1HD2 ASN 97 HD21 ASN 97 -5.438 11.582 -2.395 746 2HD2 ASN 97 HD22 ASN 97 -6.268 13.091 -2.260 747 H GLN 98 HN GLN 98 -4.254 8.862 -5.846 748 HA GLN 98 HA GLN 98 -5.958 7.728 -7.781 749 1HB GLN 98 HB2 GLN 98 -3.360 8.273 -7.757 750 2HB GLN 98 HB1 GLN 98 -3.245 6.584 -7.289 751 1HG GLN 98 HG2 GLN 98 -3.914 7.790 -9.876 752 2HG GLN 98 HG1 GLN 98 -3.115 6.265 -9.498 753 1HE2 GLN 98 HE21 GLN 98 -4.312 4.413 -9.329 754 2HE2 GLN 98 HE22 GLN 98 -5.980 4.319 -9.771 755 H ILE 99 HN ILE 99 -4.467 6.450 -4.878 756 HA ILE 99 HA ILE 99 -5.026 3.722 -5.277 757 HB ILE 99 HB ILE 99 -4.380 5.407 -2.893 758 1HG1 ILE 99 HG12 ILE 99 -2.812 3.046 -3.148 759 2HG1 ILE 99 HG11 ILE 99 -2.979 3.755 -4.750 760 1HG2 ILE 99 HG21 ILE 99 -5.530 4.073 -1.528 761 2HG2 ILE 99 HG22 ILE 99 -4.318 2.846 -1.899 762 3HG2 ILE 99 HG23 ILE 99 -5.833 2.890 -2.801 763 1HD1 ILE 99 HD11 ILE 99 -1.489 5.309 -4.263 764 2HD1 ILE 99 HD12 ILE 99 -1.222 4.511 -2.713 765 3HD1 ILE 99 HD13 ILE 99 -2.410 5.808 -2.843 766 H ILE 100 HN ILE 100 -6.881 6.325 -3.782 767 HA ILE 100 HA ILE 100 -8.940 4.634 -2.786 768 HB ILE 100 HB ILE 100 -8.855 7.603 -3.254 769 1HG1 ILE 100 HG12 ILE 100 -7.417 7.009 -1.469 770 2HG1 ILE 100 HG11 ILE 100 -8.907 7.555 -0.706 771 1HG2 ILE 100 HG21 ILE 100 -11.087 7.495 -3.235 772 2HG2 ILE 100 HG22 ILE 100 -10.913 7.165 -1.510 773 3HG2 ILE 100 HG23 ILE 100 -11.096 5.832 -2.652 774 1HD1 ILE 100 HD11 ILE 100 -8.981 4.716 -1.173 775 2HD1 ILE 100 HD12 ILE 100 -9.150 5.615 0.335 776 3HD1 ILE 100 HD13 ILE 100 -7.548 5.171 -0.253 777 H GLU 101 HN GLU 101 -8.713 6.763 -5.622 778 HA GLU 101 HA GLU 101 -11.241 6.521 -6.639 779 1HB GLU 101 HB2 GLU 101 -8.577 7.001 -7.782 780 2HB GLU 101 HB1 GLU 101 -9.742 6.343 -8.926 781 1HG GLU 101 HG2 GLU 101 -10.722 8.557 -7.260 782 2HG GLU 101 HG1 GLU 101 -9.440 8.970 -8.399 783 H GLN 102 HN GLN 102 -8.582 4.225 -6.858 784 HA GLN 102 HA GLN 102 -9.991 2.337 -8.465 785 1HB GLN 102 HB2 GLN 102 -7.364 2.600 -7.315 786 2HB GLN 102 HB1 GLN 102 -7.999 0.996 -6.973 787 1HG GLN 102 HG2 GLN 102 -6.638 1.244 -9.078 788 2HG GLN 102 HG1 GLN 102 -8.216 0.478 -9.250 789 1HE2 GLN 102 HE21 GLN 102 -7.683 3.922 -8.856 790 2HE2 GLN 102 HE22 GLN 102 -8.225 4.379 -10.431 791 H LEU 103 HN LEU 103 -9.565 2.924 -5.055 792 HA LEU 103 HA LEU 103 -10.742 0.515 -4.107 793 1HB LEU 103 HB2 LEU 103 -9.373 2.567 -2.954 794 2HB LEU 103 HB1 LEU 103 -11.009 2.945 -2.454 795 HG LEU 103 HG LEU 103 -9.635 0.305 -1.947 796 1HD1 LEU 103 HD11 LEU 103 -9.550 2.856 -0.544 797 2HD1 LEU 103 HD12 LEU 103 -8.522 1.433 -0.377 798 3HD1 LEU 103 HD13 LEU 103 -10.064 1.513 0.476 799 1HD2 LEU 103 HD21 LEU 103 -11.742 -0.377 -1.621 800 2HD2 LEU 103 HD22 LEU 103 -12.371 1.271 -1.617 801 3HD2 LEU 103 HD23 LEU 103 -11.679 0.587 -0.146 802 H ILE 104 HN ILE 104 -11.965 3.466 -5.386 803 HA ILE 104 HA ILE 104 -14.549 3.429 -4.222 804 HB ILE 104 HB ILE 104 -13.654 4.657 -6.836 805 1HG1 ILE 104 HG12 ILE 104 -13.995 5.951 -4.123 806 2HG1 ILE 104 HG11 ILE 104 -12.445 5.462 -4.800 807 1HG2 ILE 104 HG21 ILE 104 -16.075 5.350 -5.184 808 2HG2 ILE 104 HG22 ILE 104 -16.114 4.291 -6.593 809 3HG2 ILE 104 HG23 ILE 104 -15.640 5.980 -6.772 810 1HD1 ILE 104 HD11 ILE 104 -14.138 7.779 -5.425 811 2HD1 ILE 104 HD12 ILE 104 -13.368 6.995 -6.803 812 3HD1 ILE 104 HD13 ILE 104 -12.384 7.601 -5.471 813 H LYS 105 HN LYS 105 -13.244 2.243 -7.302 814 HA LYS 105 HA LYS 105 -15.769 1.197 -8.159 815 1HB LYS 105 HB2 LYS 105 -14.077 -0.045 -9.798 816 2HB LYS 105 HB1 LYS 105 -14.542 1.633 -10.021 817 1HG LYS 105 HG2 LYS 105 -12.506 2.428 -9.256 818 2HG LYS 105 HG1 LYS 105 -12.127 0.925 -8.410 819 1HD LYS 105 HD2 LYS 105 -12.451 0.857 -11.372 820 2HD LYS 105 HD1 LYS 105 -10.967 1.534 -10.698 821 1HE LYS 105 HE2 LYS 105 -10.229 -0.577 -10.653 822 2HE LYS 105 HE1 LYS 105 -11.276 -0.769 -9.248 823 1HZ LYS 105 HZ1 LYS 105 -12.228 -2.385 -10.426 824 2HZ LYS 105 HZ2 LYS 105 -11.531 -1.882 -11.883 825 3HZ LYS 105 HZ3 LYS 105 -12.959 -1.159 -11.335 826 H LYS 106 HN LYS 106 -14.204 0.200 -5.603 827 HA LYS 106 HA LYS 106 -14.825 -2.622 -6.143 828 1HB LYS 106 HB2 LYS 106 -12.869 -3.391 -4.953 829 2HB LYS 106 HB1 LYS 106 -12.376 -2.332 -6.267 830 1HG LYS 106 HG2 LYS 106 -12.055 -0.509 -4.687 831 2HG LYS 106 HG1 LYS 106 -12.565 -1.560 -3.365 832 1HD LYS 106 HD2 LYS 106 -10.224 -1.624 -3.288 833 2HD LYS 106 HD1 LYS 106 -10.677 -3.116 -4.115 834 1HE LYS 106 HE2 LYS 106 -9.959 -0.595 -5.590 835 2HE LYS 106 HE1 LYS 106 -8.757 -1.794 -5.118 836 1HZ LYS 106 HZ1 LYS 106 -9.261 -2.569 -7.170 837 2HZ LYS 106 HZ2 LYS 106 -10.835 -1.948 -7.162 838 3HZ LYS 106 HZ3 LYS 106 -10.483 -3.373 -6.320 839 H GLU 107 HN GLU 107 -14.173 -3.626 -3.603 840 HA GLU 107 HA GLU 107 -16.389 -2.488 -2.096 841 1HB GLU 107 HB2 GLU 107 -16.566 -4.833 -2.367 842 2HB GLU 107 HB1 GLU 107 -14.905 -5.117 -1.862 843 1HG GLU 107 HG2 GLU 107 -15.786 -5.596 0.128 844 2HG GLU 107 HG1 GLU 107 -15.997 -3.857 0.319 845 H LYS 108 HN LYS 108 -13.449 -4.010 -0.743 846 HA LYS 108 HA LYS 108 -12.666 -1.519 0.510 847 1HB LYS 108 HB2 LYS 108 -12.972 -2.357 2.816 848 2HB LYS 108 HB1 LYS 108 -14.498 -2.178 1.959 849 1HG LYS 108 HG2 LYS 108 -14.640 -4.540 1.584 850 2HG LYS 108 HG1 LYS 108 -13.020 -4.786 2.237 851 1HD LYS 108 HD2 LYS 108 -14.024 -5.200 4.185 852 2HD LYS 108 HD1 LYS 108 -14.332 -3.462 4.271 853 1HE LYS 108 HE2 LYS 108 -16.248 -5.039 2.675 854 2HE LYS 108 HE1 LYS 108 -16.260 -5.344 4.412 855 1HZ LYS 108 HZ1 LYS 108 -17.511 -3.542 4.599 856 2HZ LYS 108 HZ2 LYS 108 -17.284 -3.118 2.977 857 3HZ LYS 108 HZ3 LYS 108 -16.174 -2.609 4.146 858 H VAL 109 HN VAL 109 -10.653 -1.579 1.538 859 HA VAL 109 HA VAL 109 -9.185 -4.120 1.355 860 HB VAL 109 HB VAL 109 -7.121 -2.953 0.758 861 1HG1 VAL 109 HG11 VAL 109 -8.616 -1.831 -1.420 862 2HG1 VAL 109 HG12 VAL 109 -9.367 -3.344 -0.914 863 3HG1 VAL 109 HG13 VAL 109 -7.664 -3.315 -1.370 864 1HG2 VAL 109 HG21 VAL 109 -8.688 -0.444 0.228 865 2HG2 VAL 109 HG22 VAL 109 -6.945 -0.661 0.383 866 3HG2 VAL 109 HG23 VAL 109 -7.975 -0.745 1.811 867 H TYR 110 HN TYR 110 -8.358 -4.737 3.233 868 HA TYR 110 HA TYR 110 -8.499 -2.959 5.498 869 1HB TYR 110 HB2 TYR 110 -9.083 -5.026 6.244 870 2HB TYR 110 HB1 TYR 110 -8.143 -5.850 5.013 871 HD1 TYR 110 HD1 TYR 110 -6.228 -6.990 5.629 872 HD2 TYR 110 HD2 TYR 110 -7.729 -3.945 8.184 873 HE1 TYR 110 HE1 TYR 110 -4.570 -7.619 7.328 874 HE2 TYR 110 HE2 TYR 110 -6.082 -4.551 9.896 875 HH TYR 110 HH TYR 110 -3.828 -7.260 9.399 876 H LEU 111 HN LEU 111 -6.961 -1.436 5.564 877 HA LEU 111 HA LEU 111 -4.219 -2.142 4.833 878 1HB LEU 111 HB2 LEU 111 -5.825 0.193 4.535 879 2HB LEU 111 HB1 LEU 111 -4.449 0.599 5.543 880 HG LEU 111 HG LEU 111 -3.581 -0.935 3.266 881 1HD1 LEU 111 HD11 LEU 111 -5.170 -0.211 1.822 882 2HD1 LEU 111 HD12 LEU 111 -4.100 1.188 1.753 883 3HD1 LEU 111 HD13 LEU 111 -5.539 1.229 2.773 884 1HD2 LEU 111 HD21 LEU 111 -2.089 0.945 2.974 885 2HD2 LEU 111 HD22 LEU 111 -2.188 0.520 4.683 886 3HD2 LEU 111 HD23 LEU 111 -3.063 1.923 4.070 887 H ALA 112 HN ALA 112 -2.783 -2.623 6.353 888 HA ALA 112 HA ALA 112 -3.049 -1.287 8.954 889 1HB ALA 112 HB1 ALA 112 -3.241 -3.156 10.217 890 2HB ALA 112 HB2 ALA 112 -2.389 -4.171 9.053 891 3HB ALA 112 HB3 ALA 112 -4.069 -3.716 8.765 892 H TRP 113 HN TRP 113 -1.225 -1.124 10.209 893 HA TRP 113 HA TRP 113 1.289 -2.239 9.388 894 1HB TRP 113 HB2 TRP 113 1.280 -0.346 7.887 895 2HB TRP 113 HB1 TRP 113 0.827 0.744 9.195 896 HD1 TRP 113 HD1 TRP 113 2.914 2.257 9.420 897 HE1 TRP 113 HE1 TRP 113 5.417 1.849 9.865 898 HE3 TRP 113 HE3 TRP 113 2.987 -2.843 9.047 899 HZ2 TRP 113 HZ2 TRP 113 7.188 -0.352 10.034 900 HZ3 TRP 113 HZ3 TRP 113 5.121 -4.021 9.364 901 HH2 TRP 113 HH2 TRP 113 7.175 -2.799 9.846 902 H VAL 114 HN VAL 114 2.561 -2.527 11.102 903 HA VAL 114 HA VAL 114 1.920 -1.094 13.596 904 HB VAL 114 HB VAL 114 2.878 -3.939 13.236 905 1HG1 VAL 114 HG11 VAL 114 2.564 -4.013 15.763 906 2HG1 VAL 114 HG12 VAL 114 2.611 -2.250 15.704 907 3HG1 VAL 114 HG13 VAL 114 4.000 -3.188 15.156 908 1HG2 VAL 114 HG21 VAL 114 0.659 -4.237 13.007 909 2HG2 VAL 114 HG22 VAL 114 0.269 -2.684 13.747 910 3HG2 VAL 114 HG23 VAL 114 0.653 -4.073 14.762 911 HA PRO 115 HA PRO 115 5.925 0.808 13.644 912 1HB PRO 115 HB2 PRO 115 5.994 -0.416 16.383 913 2HB PRO 115 HB1 PRO 115 6.472 1.206 15.870 914 1HG PRO 115 HG2 PRO 115 4.106 0.769 17.037 915 2HG PRO 115 HG1 PRO 115 4.289 1.955 15.732 916 1HD PRO 115 HD2 PRO 115 2.948 -0.673 15.705 917 2HD PRO 115 HD1 PRO 115 2.718 0.724 14.635 918 H ALA 116 HN ALA 116 7.358 -0.176 12.382 919 HA ALA 116 HA ALA 116 9.411 -1.769 13.238 920 1HB ALA 116 HB1 ALA 116 8.694 -3.960 12.010 921 2HB ALA 116 HB2 ALA 116 7.059 -3.382 12.329 922 3HB ALA 116 HB3 ALA 116 8.167 -3.676 13.669 923 H HIS 117 HN HIS 117 8.988 -3.513 10.619 924 HA HIS 117 HA HIS 117 8.865 -1.803 8.427 925 1HB HIS 117 HB2 HIS 117 11.400 -1.697 9.820 926 2HB HIS 117 HB1 HIS 117 11.613 -2.289 8.177 927 HD1 HIS 117 HD1 HIS 117 8.823 -0.197 7.875 928 HD2 HIS 117 HD2 HIS 117 12.879 0.529 8.404 929 HE1 HIS 117 HE1 HIS 117 9.187 2.172 7.113 930 HE2 HIS 117 HE2 HIS 117 11.620 2.629 7.573 931 H LYS 118 HN LYS 118 9.150 -4.739 9.842 932 HA LYS 118 HA LYS 118 9.499 -6.084 7.247 933 1HB LYS 118 HB2 LYS 118 10.512 -7.998 8.582 934 2HB LYS 118 HB1 LYS 118 11.510 -6.562 8.393 935 1HG LYS 118 HG2 LYS 118 9.795 -6.883 10.817 936 2HG LYS 118 HG1 LYS 118 11.347 -7.716 10.705 937 1HD LYS 118 HD2 LYS 118 12.522 -5.651 10.471 938 2HD LYS 118 HD1 LYS 118 11.015 -4.749 10.282 939 1HE LYS 118 HE2 LYS 118 10.444 -5.011 12.537 940 2HE LYS 118 HE1 LYS 118 11.599 -6.323 12.769 941 1HZ LYS 118 HZ1 LYS 118 12.788 -3.830 11.938 942 2HZ LYS 118 HZ2 LYS 118 13.254 -4.896 13.165 943 3HZ LYS 118 HZ3 LYS 118 12.034 -3.760 13.452 944 H GLY 119 HN GLY 119 7.026 -5.285 8.520 945 1HA GLY 119 HA2 GLY 119 5.919 -7.953 9.149 946 2HA GLY 119 HA1 GLY 119 5.331 -6.474 9.886 947 H ILE 120 HN ILE 120 5.519 -8.288 6.865 948 HA ILE 120 HA ILE 120 3.046 -6.946 6.010 949 HB ILE 120 HB ILE 120 4.775 -7.850 3.816 950 1HG1 ILE 120 HG12 ILE 120 5.769 -5.289 4.309 951 2HG1 ILE 120 HG11 ILE 120 5.846 -6.096 5.870 952 1HG2 ILE 120 HG21 ILE 120 3.474 -6.445 2.691 953 2HG2 ILE 120 HG22 ILE 120 3.884 -5.106 3.763 954 3HG2 ILE 120 HG23 ILE 120 2.568 -6.202 4.186 955 1HD1 ILE 120 HD11 ILE 120 7.786 -6.220 4.032 956 2HD1 ILE 120 HD12 ILE 120 6.845 -7.638 3.570 957 3HD1 ILE 120 HD13 ILE 120 7.478 -7.496 5.210 958 H GLY 121 HN GLY 121 2.641 -8.388 3.658 959 1HA GLY 121 HA2 GLY 121 1.389 -10.706 4.591 960 2HA GLY 121 HA1 GLY 121 1.730 -10.357 2.902 961 H GLY 122 HN GLY 122 3.700 -11.103 1.983 962 1HA GLY 122 HA2 GLY 122 4.830 -13.391 3.459 963 2HA GLY 122 HA1 GLY 122 4.764 -13.256 1.708 964 H ASN 123 HN ASN 123 6.620 -12.740 4.498 965 HA ASN 123 HA ASN 123 8.665 -11.336 2.906 966 1HB ASN 123 HB2 ASN 123 7.510 -10.107 4.908 967 2HB ASN 123 HB1 ASN 123 8.561 -11.117 5.896 968 1HD2 ASN 123 HD21 ASN 123 10.246 -10.013 6.544 969 2HD2 ASN 123 HD22 ASN 123 11.162 -8.893 5.598 970 H GLU 124 HN GLU 124 8.151 -13.501 5.677 971 HA GLU 124 HA GLU 124 9.304 -15.291 6.457 972 1HB GLU 124 HB2 GLU 124 9.137 -15.923 3.993 973 2HB GLU 124 HB1 GLU 124 10.791 -15.350 3.835 974 1HG GLU 124 HG2 GLU 124 10.464 -17.835 4.164 975 2HG GLU 124 HG1 GLU 124 11.629 -17.040 5.220 976 H GLN 125 HN GLN 125 10.225 -13.034 7.447 977 HA GLN 125 HA GLN 125 11.997 -11.945 8.376 978 1HB GLN 125 HB2 GLN 125 12.246 -14.653 8.855 979 2HB GLN 125 HB1 GLN 125 13.839 -14.207 8.261 980 1HG GLN 125 HG2 GLN 125 13.858 -14.028 10.630 981 2HG GLN 125 HG1 GLN 125 13.898 -12.396 9.961 982 1HE2 GLN 125 HE21 GLN 125 11.212 -14.650 10.437 983 2HE2 GLN 125 HE22 GLN 125 10.285 -13.607 11.455 984 H VAL 126 HN VAL 126 11.872 -11.739 5.516 985 HA VAL 126 HA VAL 126 14.482 -10.708 5.037 986 HB VAL 126 HB VAL 126 14.968 -13.076 4.598 987 1HG1 VAL 126 HG11 VAL 126 13.942 -14.259 2.753 988 2HG1 VAL 126 HG12 VAL 126 12.924 -12.864 2.390 989 3HG1 VAL 126 HG13 VAL 126 12.704 -13.749 3.900 990 1HG2 VAL 126 HG21 VAL 126 16.099 -12.770 2.539 991 2HG2 VAL 126 HG22 VAL 126 16.040 -11.187 3.314 992 3HG2 VAL 126 HG23 VAL 126 14.931 -11.565 1.995 993 H ASP 127 HN ASP 127 14.437 -9.144 3.515 994 HA ASP 127 HA ASP 127 11.869 -8.666 2.199 995 1HB ASP 127 HB2 ASP 127 13.527 -6.979 3.585 996 2HB ASP 127 HB1 ASP 127 13.967 -6.625 1.918 997 H LYS 128 HN LYS 128 15.216 -7.931 1.237 998 HA LYS 128 HA LYS 128 15.065 -9.556 -1.123 999 1HB LYS 128 HB2 LYS 128 14.221 -6.791 -1.240 1000 2HB LYS 128 HB1 LYS 128 15.623 -7.057 -2.266 1001 1HG LYS 128 HG2 LYS 128 13.589 -9.124 -2.541 1002 2HG LYS 128 HG1 LYS 128 13.018 -7.508 -2.966 1003 1HD LYS 128 HD2 LYS 128 14.606 -7.263 -4.658 1004 2HD LYS 128 HD1 LYS 128 15.628 -8.549 -4.012 1005 1HE LYS 128 HE2 LYS 128 14.572 -10.096 -5.215 1006 2HE LYS 128 HE1 LYS 128 12.993 -9.534 -4.666 1007 1HZ LYS 128 HZ1 LYS 128 12.955 -7.905 -6.390 1008 2HZ LYS 128 HZ2 LYS 128 13.324 -9.395 -7.100 1009 3HZ LYS 128 HZ3 LYS 128 14.546 -8.252 -6.848 1010 H LEU 129 HN LEU 129 16.812 -9.292 1.135 1011 HA LEU 129 HA LEU 129 19.017 -9.205 1.679 1012 1HB LEU 129 HB2 LEU 129 18.830 -10.439 -0.772 1013 2HB LEU 129 HB1 LEU 129 20.023 -9.188 -1.070 1014 HG LEU 129 HG LEU 129 20.462 -10.754 1.387 1015 1HD1 LEU 129 HD11 LEU 129 19.575 -12.365 -0.433 1016 2HD1 LEU 129 HD12 LEU 129 21.066 -12.769 0.418 1017 3HD1 LEU 129 HD13 LEU 129 21.135 -12.085 -1.206 1018 1HD2 LEU 129 HD21 LEU 129 21.956 -8.985 0.276 1019 2HD2 LEU 129 HD22 LEU 129 22.362 -10.255 -0.878 1020 3HD2 LEU 129 HD23 LEU 129 22.712 -10.476 0.837 1021 H VAL 130 HN VAL 130 18.720 -7.000 2.371 1022 HA VAL 130 HA VAL 130 19.279 -4.801 0.658 1023 HB VAL 130 HB VAL 130 19.736 -3.672 3.006 1024 1HG1 VAL 130 HG11 VAL 130 17.233 -4.430 1.621 1025 2HG1 VAL 130 HG12 VAL 130 17.890 -2.836 1.992 1026 3HG1 VAL 130 HG13 VAL 130 17.082 -3.769 3.250 1027 1HG2 VAL 130 HG21 VAL 130 19.568 -5.032 4.755 1028 2HG2 VAL 130 HG22 VAL 130 19.107 -6.378 3.713 1029 3HG2 VAL 130 HG23 VAL 130 17.872 -5.290 4.347 1030 H SER 131 HN SER 131 21.203 -4.659 -0.306 1031 HA SER 131 HA SER 131 23.617 -5.118 1.313 1032 1HB SER 131 HB2 SER 131 23.386 -6.555 -0.696 1033 2HB SER 131 HB1 SER 131 23.346 -5.107 -1.704 1034 HG SER 131 HG SER 131 25.469 -4.827 -0.248 1035 H ALA 132 HN ALA 132 22.798 -2.840 2.042 1036 HA ALA 132 HA ALA 132 23.222 -0.612 2.189 1037 1HB ALA 132 HB1 ALA 132 25.532 -1.259 0.359 1038 2HB ALA 132 HB2 ALA 132 25.553 -1.357 2.120 1039 3HB ALA 132 HB3 ALA 132 25.349 0.205 1.326 1040 H GLY 133 HN GLY 133 21.557 -1.737 -0.035 1041 1HA GLY 133 HA2 GLY 133 21.917 -0.164 -2.364 1042 2HA GLY 133 HA1 GLY 133 20.442 -1.002 -1.905 1043 H ILE 134 HN ILE 134 20.470 1.495 -3.166 1044 HA ILE 134 HA ILE 134 19.917 3.469 -1.096 1045 HB ILE 134 HB ILE 134 19.549 3.908 -4.048 1046 1HG1 ILE 134 HG12 ILE 134 21.786 2.947 -3.755 1047 2HG1 ILE 134 HG11 ILE 134 21.890 4.652 -4.173 1048 1HG2 ILE 134 HG21 ILE 134 19.014 5.505 -1.928 1049 2HG2 ILE 134 HG22 ILE 134 19.404 6.093 -3.544 1050 3HG2 ILE 134 HG23 ILE 134 20.663 5.999 -2.312 1051 1HD1 ILE 134 HD11 ILE 134 23.160 4.993 -2.398 1052 2HD1 ILE 134 HD12 ILE 134 23.012 3.292 -1.955 1053 3HD1 ILE 134 HD13 ILE 134 21.843 4.465 -1.350 1054 H ARG 135 HN ARG 135 18.171 1.551 -0.707 1055 HA ARG 135 HA ARG 135 15.646 2.712 -1.613 1056 1HB ARG 135 HB2 ARG 135 14.693 0.537 -2.119 1057 2HB ARG 135 HB1 ARG 135 16.126 0.801 -3.102 1058 1HG ARG 135 HG2 ARG 135 16.540 -0.600 -0.539 1059 2HG ARG 135 HG1 ARG 135 15.635 -1.473 -1.778 1060 1HD ARG 135 HD2 ARG 135 18.308 -0.167 -2.255 1061 2HD ARG 135 HD1 ARG 135 18.111 -1.860 -1.805 1062 HE ARG 135 HE ARG 135 16.586 -1.112 -4.119 1063 1HH1 ARG 135 HH11 ARG 135 19.709 -2.157 -2.978 1064 2HH1 ARG 135 HH12 ARG 135 20.175 -2.848 -4.496 1065 1HH2 ARG 135 HH21 ARG 135 17.193 -2.025 -6.123 1066 2HH2 ARG 135 HH22 ARG 135 18.748 -2.774 -6.281 1067 H LYS 136 HN LYS 136 17.081 2.867 0.882 1068 HA LYS 136 HA LYS 136 15.900 1.074 2.766 1069 1HB LYS 136 HB2 LYS 136 16.939 2.475 4.459 1070 2HB LYS 136 HB1 LYS 136 18.078 2.151 3.158 1071 1HG LYS 136 HG2 LYS 136 17.654 4.360 2.221 1072 2HG LYS 136 HG1 LYS 136 16.488 4.686 3.507 1073 1HD LYS 136 HD2 LYS 136 18.550 4.053 5.039 1074 2HD LYS 136 HD1 LYS 136 19.459 4.559 3.614 1075 1HE LYS 136 HE2 LYS 136 18.422 6.725 3.653 1076 2HE LYS 136 HE1 LYS 136 17.331 6.227 4.945 1077 1HZ LYS 136 HZ1 LYS 136 18.882 7.224 6.214 1078 2HZ LYS 136 HZ2 LYS 136 20.121 7.025 5.081 1079 3HZ LYS 136 HZ3 LYS 136 19.678 5.737 6.082 1080 H VAL 137 HN VAL 137 14.297 1.496 4.291 1081 HA VAL 137 HA VAL 137 12.422 3.605 3.490 1082 HB VAL 137 HB VAL 137 11.061 2.120 5.348 1083 1HG1 VAL 137 HG11 VAL 137 9.674 2.207 3.620 1084 2HG1 VAL 137 HG12 VAL 137 10.584 0.912 2.843 1085 3HG1 VAL 137 HG13 VAL 137 11.009 2.595 2.536 1086 1HG2 VAL 137 HG21 VAL 137 11.403 -0.229 4.823 1087 2HG2 VAL 137 HG22 VAL 137 12.884 0.476 5.470 1088 3HG2 VAL 137 HG23 VAL 137 12.728 0.188 3.737 1089 H LEU 138 HN LEU 138 12.186 5.355 4.705 1090 HA LEU 138 HA LEU 138 13.623 5.641 7.162 1091 1HB LEU 138 HB2 LEU 138 13.117 7.425 5.369 1092 2HB LEU 138 HB1 LEU 138 11.554 7.569 6.151 1093 HG LEU 138 HG LEU 138 13.087 7.868 8.311 1094 1HD1 LEU 138 HD11 LEU 138 14.971 7.882 6.212 1095 2HD1 LEU 138 HD12 LEU 138 15.237 8.229 7.921 1096 3HD1 LEU 138 HD13 LEU 138 14.842 9.537 6.807 1097 1HD2 LEU 138 HD21 LEU 138 12.137 9.879 8.287 1098 2HD2 LEU 138 HD22 LEU 138 11.558 9.508 6.663 1099 3HD2 LEU 138 HD23 LEU 138 13.078 10.376 6.879 Start of MODEL 2 1 1H MET 1 HT1 MET 1 -21.124 5.578 -0.311 2 2H MET 1 HT2 MET 1 -22.709 6.164 -0.382 3 3H MET 1 HT3 MET 1 -22.390 4.545 -0.752 4 HA MET 1 HA MET 1 -23.360 5.126 1.541 5 1HB MET 1 HB2 MET 1 -21.041 3.298 0.947 6 2HB MET 1 HB1 MET 1 -21.823 3.303 2.521 7 1HG MET 1 HG2 MET 1 -23.208 2.767 -0.096 8 2HG MET 1 HG1 MET 1 -22.656 1.533 1.037 9 1HE MET 1 HE1 MET 1 -23.195 1.428 3.322 10 2HE MET 1 HE2 MET 1 -24.898 1.304 3.764 11 3HE MET 1 HE3 MET 1 -23.993 2.768 4.147 12 H ASN 2 HN ASN 2 -19.798 5.168 1.305 13 HA ASN 2 HA ASN 2 -19.713 6.836 3.711 14 1HB ASN 2 HB2 ASN 2 -18.307 4.638 3.282 15 2HB ASN 2 HB1 ASN 2 -17.244 5.744 2.412 16 1HD2 ASN 2 HD21 ASN 2 -15.745 6.726 3.543 17 2HD2 ASN 2 HD22 ASN 2 -15.732 6.929 5.260 18 H GLU 3 HN GLU 3 -17.113 7.915 3.205 19 HA GLU 3 HA GLU 3 -17.708 10.349 2.065 20 1HB GLU 3 HB2 GLU 3 -15.506 9.229 3.284 21 2HB GLU 3 HB1 GLU 3 -14.920 9.555 1.659 22 1HG GLU 3 HG2 GLU 3 -16.419 11.769 2.826 23 2HG GLU 3 HG1 GLU 3 -14.967 11.336 3.728 24 H LEU 4 HN LEU 4 -16.106 7.576 0.507 25 HA LEU 4 HA LEU 4 -17.095 8.500 -2.068 26 1HB LEU 4 HB2 LEU 4 -14.361 8.818 -1.226 27 2HB LEU 4 HB1 LEU 4 -14.441 7.705 -2.570 28 HG LEU 4 HG LEU 4 -14.122 9.705 -3.656 29 1HD1 LEU 4 HD11 LEU 4 -15.980 10.068 -4.928 30 2HD1 LEU 4 HD12 LEU 4 -17.073 10.047 -3.543 31 3HD1 LEU 4 HD13 LEU 4 -16.419 8.536 -4.174 32 1HD2 LEU 4 HD21 LEU 4 -15.416 10.832 -1.281 33 2HD2 LEU 4 HD22 LEU 4 -15.745 11.695 -2.783 34 3HD2 LEU 4 HD23 LEU 4 -14.081 11.449 -2.254 35 H TYR 5 HN TYR 5 -15.808 6.016 -0.028 36 HA TYR 5 HA TYR 5 -16.788 3.989 -1.862 37 1HB TYR 5 HB2 TYR 5 -14.730 2.633 -1.492 38 2HB TYR 5 HB1 TYR 5 -14.431 4.120 -2.392 39 HD1 TYR 5 HD1 TYR 5 -13.147 5.913 -1.440 40 HD2 TYR 5 HD2 TYR 5 -13.937 2.386 0.791 41 HE1 TYR 5 HE1 TYR 5 -11.394 6.542 0.166 42 HE2 TYR 5 HE2 TYR 5 -12.197 3.007 2.412 43 HH TYR 5 HH TYR 5 -10.009 5.636 1.829 44 H GLN 6 HN GLN 6 -16.183 1.783 -0.592 45 HA GLN 6 HA GLN 6 -17.893 1.792 1.688 46 1HB GLN 6 HB2 GLN 6 -16.508 -0.666 1.474 47 2HB GLN 6 HB1 GLN 6 -18.183 -0.310 1.062 48 1HG GLN 6 HG2 GLN 6 -17.114 -1.219 -0.870 49 2HG GLN 6 HG1 GLN 6 -17.412 0.503 -1.152 50 1HE2 GLN 6 HE21 GLN 6 -15.751 0.624 -2.691 51 2HE2 GLN 6 HE22 GLN 6 -14.087 0.589 -2.227 52 H LEU 7 HN LEU 7 -17.199 2.480 3.644 53 HA LEU 7 HA LEU 7 -14.449 2.629 4.340 54 1HB LEU 7 HB2 LEU 7 -16.769 3.769 5.278 55 2HB LEU 7 HB1 LEU 7 -16.312 2.697 6.588 56 HG LEU 7 HG LEU 7 -14.528 4.824 5.391 57 1HD1 LEU 7 HD11 LEU 7 -15.032 5.372 8.075 58 2HD1 LEU 7 HD12 LEU 7 -16.603 4.950 7.393 59 3HD1 LEU 7 HD13 LEU 7 -15.651 6.248 6.674 60 1HD2 LEU 7 HD21 LEU 7 -13.888 2.528 6.875 61 2HD2 LEU 7 HD22 LEU 7 -13.773 3.888 7.992 62 3HD2 LEU 7 HD23 LEU 7 -12.842 3.896 6.493 63 H GLU 8 HN GLU 8 -13.229 0.966 4.732 64 HA GLU 8 HA GLU 8 -14.240 -1.217 6.447 65 1HB GLU 8 HB2 GLU 8 -13.844 -1.918 4.084 66 2HB GLU 8 HB1 GLU 8 -12.158 -1.446 4.260 67 1HG GLU 8 HG2 GLU 8 -12.453 -3.848 4.548 68 2HG GLU 8 HG1 GLU 8 -11.850 -3.089 6.023 69 H LYS 9 HN LYS 9 -10.958 -0.654 5.273 70 HA LYS 9 HA LYS 9 -8.983 -0.300 6.327 71 1HB LYS 9 HB2 LYS 9 -10.305 1.240 8.504 72 2HB LYS 9 HB1 LYS 9 -8.847 1.610 7.594 73 1HG LYS 9 HG2 LYS 9 -11.662 1.816 6.552 74 2HG LYS 9 HG1 LYS 9 -10.670 3.165 7.099 75 1HD LYS 9 HD2 LYS 9 -9.639 3.291 5.128 76 2HD LYS 9 HD1 LYS 9 -9.272 1.564 5.145 77 1HE LYS 9 HE2 LYS 9 -12.055 1.883 4.662 78 2HE LYS 9 HE1 LYS 9 -11.182 2.957 3.569 79 1HZ LYS 9 HZ1 LYS 9 -10.092 1.196 2.579 80 2HZ LYS 9 HZ2 LYS 9 -11.629 0.546 2.853 81 3HZ LYS 9 HZ3 LYS 9 -10.348 0.147 3.882 82 H GLU 10 HN GLU 10 -11.219 -2.240 7.641 83 HA GLU 10 HA GLU 10 -9.380 -3.119 9.748 84 1HB GLU 10 HB2 GLU 10 -11.377 -3.573 11.213 85 2HB GLU 10 HB1 GLU 10 -11.017 -1.868 10.967 86 1HG GLU 10 HG2 GLU 10 -12.719 -1.919 9.114 87 2HG GLU 10 HG1 GLU 10 -13.192 -3.502 9.720 88 HA PRO 11 HA PRO 11 -9.904 -7.368 8.640 89 1HB PRO 11 HB2 PRO 11 -11.645 -8.272 10.696 90 2HB PRO 11 HB1 PRO 11 -9.887 -8.435 10.631 91 1HG PRO 11 HG2 PRO 11 -11.554 -6.393 12.005 92 2HG PRO 11 HG1 PRO 11 -9.982 -7.065 12.480 93 1HD PRO 11 HD2 PRO 11 -10.154 -4.603 11.497 94 2HD PRO 11 HD1 PRO 11 -8.820 -5.671 10.999 95 H ILE 12 HN ILE 12 -11.107 -7.304 6.796 96 HA ILE 12 HA ILE 12 -13.862 -6.687 6.663 97 HB ILE 12 HB ILE 12 -12.246 -8.377 4.742 98 1HG1 ILE 12 HG12 ILE 12 -12.787 -5.488 4.274 99 2HG1 ILE 12 HG11 ILE 12 -11.546 -5.904 5.454 100 1HG2 ILE 12 HG21 ILE 12 -14.497 -8.648 4.171 101 2HG2 ILE 12 HG22 ILE 12 -13.929 -7.362 3.106 102 3HG2 ILE 12 HG23 ILE 12 -14.884 -6.966 4.535 103 1HD1 ILE 12 HD11 ILE 12 -11.527 -7.085 2.706 104 2HD1 ILE 12 HD12 ILE 12 -10.201 -6.912 3.854 105 3HD1 ILE 12 HD13 ILE 12 -10.843 -5.492 3.031 106 H VAL 13 HN VAL 13 -15.659 -8.029 6.636 107 HA VAL 13 HA VAL 13 -15.891 -10.174 8.269 108 HB VAL 13 HB VAL 13 -17.457 -10.022 5.696 109 1HG1 VAL 13 HG11 VAL 13 -18.022 -11.986 6.841 110 2HG1 VAL 13 HG12 VAL 13 -19.275 -10.833 7.302 111 3HG1 VAL 13 HG13 VAL 13 -17.955 -11.193 8.415 112 1HG2 VAL 13 HG21 VAL 13 -17.681 -7.842 6.452 113 2HG2 VAL 13 HG22 VAL 13 -17.596 -8.313 8.149 114 3HG2 VAL 13 HG23 VAL 13 -19.053 -8.647 7.213 115 H GLY 14 HN GLY 14 -15.109 -10.326 4.806 116 1HA GLY 14 HA2 GLY 14 -13.554 -12.683 5.111 117 2HA GLY 14 HA1 GLY 14 -15.134 -13.083 4.455 118 H ALA 15 HN ALA 15 -12.304 -11.018 3.932 119 HA ALA 15 HA ALA 15 -12.901 -11.056 1.040 120 1HB ALA 15 HB1 ALA 15 -13.055 -8.829 1.765 121 2HB ALA 15 HB2 ALA 15 -11.469 -8.965 1.007 122 3HB ALA 15 HB3 ALA 15 -11.609 -8.966 2.765 123 H GLU 16 HN GLU 16 -11.052 -11.003 -0.394 124 HA GLU 16 HA GLU 16 -9.138 -12.994 0.153 125 1HB GLU 16 HB2 GLU 16 -10.045 -11.882 -2.112 126 2HB GLU 16 HB1 GLU 16 -8.548 -10.975 -1.947 127 1HG GLU 16 HG2 GLU 16 -7.810 -12.726 -3.188 128 2HG GLU 16 HG1 GLU 16 -7.528 -13.363 -1.568 129 H THR 17 HN THR 17 -6.879 -12.820 0.522 130 HA THR 17 HA THR 17 -6.125 -10.355 1.889 131 HB THR 17 HB THR 17 -4.662 -11.513 3.215 132 HG1 THR 17 HG1 THR 17 -4.483 -13.579 1.250 133 1HG2 THR 17 HG21 THR 17 -6.385 -12.650 4.097 134 2HG2 THR 17 HG22 THR 17 -5.726 -14.043 3.237 135 3HG2 THR 17 HG23 THR 17 -7.027 -13.094 2.516 136 H PHE 18 HN PHE 18 -4.648 -9.032 1.194 137 HA PHE 18 HA PHE 18 -2.883 -9.830 -1.017 138 1HB PHE 18 HB2 PHE 18 -4.705 -7.453 -0.789 139 2HB PHE 18 HB1 PHE 18 -3.245 -7.362 -1.745 140 HD1 PHE 18 HD1 PHE 18 -5.851 -9.973 -1.320 141 HD2 PHE 18 HD2 PHE 18 -3.741 -7.426 -3.996 142 HE1 PHE 18 HE1 PHE 18 -7.034 -10.993 -3.220 143 HE2 PHE 18 HE2 PHE 18 -4.925 -8.438 -5.898 144 HZ PHE 18 HZ PHE 18 -6.587 -10.144 -5.547 145 H TYR 19 HN TYR 19 -0.894 -8.637 -1.148 146 HA TYR 19 HA TYR 19 -0.188 -7.287 1.373 147 1HB TYR 19 HB2 TYR 19 1.226 -9.045 1.587 148 2HB TYR 19 HB1 TYR 19 1.143 -9.450 -0.120 149 HD1 TYR 19 HD1 TYR 19 2.374 -7.574 -1.640 150 HD2 TYR 19 HD2 TYR 19 3.369 -8.511 2.404 151 HE1 TYR 19 HE1 TYR 19 4.620 -6.639 -1.982 152 HE2 TYR 19 HE2 TYR 19 5.614 -7.568 2.058 153 HH TYR 19 HH TYR 19 7.111 -6.899 0.477 154 H VAL 20 HN VAL 20 1.430 -5.647 1.278 155 HA VAL 20 HA VAL 20 2.171 -4.573 -1.294 156 HB VAL 20 HB VAL 20 1.215 -2.284 -0.062 157 1HG1 VAL 20 HG11 VAL 20 0.229 -3.985 -2.320 158 2HG1 VAL 20 HG12 VAL 20 1.206 -2.518 -2.387 159 3HG1 VAL 20 HG13 VAL 20 -0.496 -2.426 -1.929 160 1HG2 VAL 20 HG21 VAL 20 -0.185 -3.426 1.471 161 2HG2 VAL 20 HG22 VAL 20 -0.755 -4.540 0.228 162 3HG2 VAL 20 HG23 VAL 20 -1.234 -2.843 0.178 163 H ASP 21 HN ASP 21 4.182 -3.844 -1.139 164 HA ASP 21 HA ASP 21 5.099 -2.182 0.948 165 1HB ASP 21 HB2 ASP 21 5.232 -4.053 2.378 166 2HB ASP 21 HB1 ASP 21 5.839 -5.095 1.096 167 H GLY 22 HN GLY 22 6.814 -1.041 0.257 168 1HA GLY 22 HA2 GLY 22 8.537 -2.170 -1.830 169 2HA GLY 22 HA1 GLY 22 7.725 -0.642 -2.142 170 H ALA 23 HN ALA 23 10.604 -1.282 -1.954 171 HA ALA 23 HA ALA 23 11.321 0.495 0.293 172 1HB ALA 23 HB1 ALA 23 12.180 -1.892 0.346 173 2HB ALA 23 HB2 ALA 23 13.386 -0.616 0.511 174 3HB ALA 23 HB3 ALA 23 13.192 -1.451 -1.030 175 H ALA 24 HN ALA 24 11.753 2.438 -0.344 176 HA ALA 24 HA ALA 24 13.414 2.867 -2.711 177 1HB ALA 24 HB1 ALA 24 11.565 3.630 -3.752 178 2HB ALA 24 HB2 ALA 24 11.816 5.066 -2.758 179 3HB ALA 24 HB3 ALA 24 10.675 3.823 -2.243 180 H ASN 25 HN ASN 25 15.115 4.115 -2.231 181 HA ASN 25 HA ASN 25 15.733 4.975 0.299 182 1HB ASN 25 HB2 ASN 25 17.146 4.864 -1.934 183 2HB ASN 25 HB1 ASN 25 16.736 6.575 -2.025 184 1HD2 ASN 25 HD21 ASN 25 16.832 7.375 0.546 185 2HD2 ASN 25 HD22 ASN 25 18.431 7.193 1.176 186 H ARG 26 HN ARG 26 14.307 6.158 1.438 187 HA ARG 26 HA ARG 26 12.595 8.144 0.518 188 1HB ARG 26 HB2 ARG 26 12.410 7.048 2.716 189 2HB ARG 26 HB1 ARG 26 13.847 7.915 3.253 190 1HG ARG 26 HG2 ARG 26 12.737 10.009 3.117 191 2HG ARG 26 HG1 ARG 26 11.349 9.286 2.299 192 1HD ARG 26 HD2 ARG 26 10.495 8.422 4.225 193 2HD ARG 26 HD1 ARG 26 12.083 8.192 4.955 194 HE ARG 26 HE ARG 26 10.397 10.514 5.160 195 1HH1 ARG 26 HH11 ARG 26 13.664 9.317 5.356 196 2HH1 ARG 26 HH12 ARG 26 14.211 10.606 6.375 197 1HH2 ARG 26 HH21 ARG 26 11.112 12.217 6.498 198 2HH2 ARG 26 HH22 ARG 26 12.761 12.253 7.024 199 H GLU 27 HN GLU 27 15.859 8.406 1.802 200 HA GLU 27 HA GLU 27 16.160 11.100 2.148 201 1HB GLU 27 HB2 GLU 27 17.932 9.660 2.749 202 2HB GLU 27 HB1 GLU 27 18.039 8.992 1.133 203 1HG GLU 27 HG2 GLU 27 18.577 11.619 0.672 204 2HG GLU 27 HG1 GLU 27 19.271 11.387 2.276 205 H THR 28 HN THR 28 15.757 9.364 -0.792 206 HA THR 28 HA THR 28 16.099 11.862 -2.305 207 HB THR 28 HB THR 28 16.730 9.187 -3.504 208 HG1 THR 28 HG1 THR 28 18.089 10.352 -1.510 209 1HG2 THR 28 HG21 THR 28 17.202 12.052 -4.159 210 2HG2 THR 28 HG22 THR 28 16.700 10.726 -5.208 211 3HG2 THR 28 HG23 THR 28 18.384 10.859 -4.699 212 H LYS 29 HN LYS 29 13.911 9.713 -1.257 213 HA LYS 29 HA LYS 29 11.879 8.932 -1.941 214 1HB LYS 29 HB2 LYS 29 11.687 11.289 -3.784 215 2HB LYS 29 HB1 LYS 29 10.439 10.560 -2.784 216 1HG LYS 29 HG2 LYS 29 12.793 11.979 -1.584 217 2HG LYS 29 HG1 LYS 29 11.336 12.839 -2.087 218 1HD LYS 29 HD2 LYS 29 10.365 10.711 -0.613 219 2HD LYS 29 HD1 LYS 29 11.815 11.199 0.265 220 1HE LYS 29 HE2 LYS 29 9.637 13.096 -0.596 221 2HE LYS 29 HE1 LYS 29 9.724 12.349 1.000 222 1HZ LYS 29 HZ1 LYS 29 10.961 14.091 1.566 223 2HZ LYS 29 HZ2 LYS 29 11.168 14.588 -0.038 224 3HZ LYS 29 HZ3 LYS 29 12.202 13.425 0.626 225 H LEU 30 HN LEU 30 13.328 7.309 -3.103 226 HA LEU 30 HA LEU 30 12.211 6.812 -5.680 227 1HB LEU 30 HB2 LEU 30 13.749 8.302 -6.606 228 2HB LEU 30 HB1 LEU 30 15.011 7.855 -5.475 229 HG LEU 30 HG LEU 30 14.063 5.827 -7.457 230 1HD1 LEU 30 HD11 LEU 30 15.565 6.635 -9.138 231 2HD1 LEU 30 HD12 LEU 30 16.110 7.945 -8.090 232 3HD1 LEU 30 HD13 LEU 30 14.459 7.939 -8.707 233 1HD2 LEU 30 HD21 LEU 30 15.784 4.689 -6.637 234 2HD2 LEU 30 HD22 LEU 30 16.088 5.999 -5.496 235 3HD2 LEU 30 HD23 LEU 30 16.890 5.995 -7.069 236 H GLY 31 HN GLY 31 12.548 4.702 -6.374 237 1HA GLY 31 HA2 GLY 31 14.430 2.884 -5.790 238 2HA GLY 31 HA1 GLY 31 13.490 2.901 -4.307 239 H LYS 32 HN LYS 32 12.572 0.933 -4.388 240 HA LYS 32 HA LYS 32 10.908 0.321 -6.736 241 1HB LYS 32 HB2 LYS 32 12.096 -1.691 -4.831 242 2HB LYS 32 HB1 LYS 32 11.307 -2.007 -6.372 243 1HG LYS 32 HG2 LYS 32 13.247 -1.860 -7.425 244 2HG LYS 32 HG1 LYS 32 13.471 -0.216 -6.824 245 1HD LYS 32 HD2 LYS 32 14.873 -0.871 -5.170 246 2HD LYS 32 HD1 LYS 32 14.015 -2.390 -4.901 247 1HE LYS 32 HE2 LYS 32 16.176 -2.918 -5.770 248 2HE LYS 32 HE1 LYS 32 14.992 -3.232 -7.038 249 1HZ LYS 32 HZ1 LYS 32 16.525 -2.070 -8.217 250 2HZ LYS 32 HZ2 LYS 32 17.049 -1.161 -6.890 251 3HZ LYS 32 HZ3 LYS 32 15.600 -0.765 -7.665 252 H ALA 33 HN ALA 33 8.998 -0.958 -6.339 253 HA ALA 33 HA ALA 33 7.943 -1.275 -3.710 254 1HB ALA 33 HB1 ALA 33 7.261 0.883 -3.530 255 2HB ALA 33 HB2 ALA 33 5.899 0.270 -4.468 256 3HB ALA 33 HB3 ALA 33 7.210 1.127 -5.276 257 H GLY 34 HN GLY 34 6.849 -3.119 -3.867 258 1HA GLY 34 HA2 GLY 34 5.170 -3.534 -6.261 259 2HA GLY 34 HA1 GLY 34 6.287 -4.788 -5.747 260 H TYR 35 HN TYR 35 4.419 -6.116 -5.654 261 HA TYR 35 HA TYR 35 3.404 -6.260 -2.983 262 1HB TYR 35 HB2 TYR 35 1.294 -5.480 -3.188 263 2HB TYR 35 HB1 TYR 35 1.949 -4.580 -4.548 264 HD1 TYR 35 HD1 TYR 35 1.482 -5.283 -6.842 265 HD2 TYR 35 HD2 TYR 35 -0.193 -7.355 -3.528 266 HE1 TYR 35 HE1 TYR 35 -0.130 -6.371 -8.344 267 HE2 TYR 35 HE2 TYR 35 -1.807 -8.446 -5.021 268 HH TYR 35 HH TYR 35 -2.681 -8.465 -7.092 269 H VAL 36 HN VAL 36 1.836 -8.093 -2.737 270 HA VAL 36 HA VAL 36 2.019 -10.073 -4.858 271 HB VAL 36 HB VAL 36 3.978 -10.508 -3.397 272 1HG1 VAL 36 HG11 VAL 36 3.854 -10.524 -1.184 273 2HG1 VAL 36 HG12 VAL 36 2.591 -11.754 -1.220 274 3HG1 VAL 36 HG13 VAL 36 2.160 -10.047 -1.315 275 1HG2 VAL 36 HG21 VAL 36 3.015 -12.320 -4.669 276 2HG2 VAL 36 HG22 VAL 36 1.827 -12.620 -3.401 277 3HG2 VAL 36 HG23 VAL 36 3.538 -12.918 -3.093 278 H THR 37 HN THR 37 0.032 -10.681 -5.246 279 HA THR 37 HA THR 37 -1.975 -10.512 -3.136 280 HB THR 37 HB THR 37 -2.891 -9.619 -5.063 281 HG1 THR 37 HG1 THR 37 -3.953 -11.916 -5.911 282 1HG2 THR 37 HG21 THR 37 -1.139 -10.207 -6.619 283 2HG2 THR 37 HG22 THR 37 -2.705 -10.658 -7.293 284 3HG2 THR 37 HG23 THR 37 -1.653 -11.894 -6.603 285 H ASN 38 HN ASN 38 -3.554 -12.230 -2.858 286 HA ASN 38 HA ASN 38 -2.370 -14.667 -2.186 287 1HB ASN 38 HB2 ASN 38 -4.448 -15.317 -1.468 288 2HB ASN 38 HB1 ASN 38 -4.709 -13.579 -1.583 289 1HD2 ASN 38 HD21 ASN 38 -5.099 -13.116 -4.173 290 2HD2 ASN 38 HD22 ASN 38 -6.478 -13.977 -4.761 291 H ARG 39 HN ARG 39 -2.940 -13.551 -5.279 292 HA ARG 39 HA ARG 39 -3.447 -16.195 -6.415 293 1HB ARG 39 HB2 ARG 39 -3.015 -13.696 -8.024 294 2HB ARG 39 HB1 ARG 39 -3.956 -15.124 -8.435 295 1HG ARG 39 HG2 ARG 39 -5.760 -14.471 -7.149 296 2HG ARG 39 HG1 ARG 39 -4.784 -13.398 -6.142 297 1HD ARG 39 HD2 ARG 39 -4.788 -11.709 -7.700 298 2HD ARG 39 HD1 ARG 39 -5.029 -12.813 -9.053 299 HE ARG 39 HE ARG 39 -7.054 -11.533 -7.490 300 1HH1 ARG 39 HH11 ARG 39 -6.325 -14.349 -9.414 301 2HH1 ARG 39 HH12 ARG 39 -7.981 -14.663 -9.811 302 1HH2 ARG 39 HH21 ARG 39 -9.232 -11.940 -8.008 303 2HH2 ARG 39 HH22 ARG 39 -9.635 -13.293 -9.011 304 H GLY 40 HN GLY 40 -0.894 -14.996 -5.124 305 1HA GLY 40 HA2 GLY 40 1.358 -15.336 -5.366 306 2HA GLY 40 HA1 GLY 40 0.961 -16.472 -6.646 307 H ARG 41 HN ARG 41 0.190 -13.007 -6.571 308 HA ARG 41 HA ARG 41 1.811 -12.748 -9.019 309 1HB ARG 41 HB2 ARG 41 -0.136 -11.892 -9.762 310 2HB ARG 41 HB1 ARG 41 -0.722 -11.566 -8.145 311 1HG ARG 41 HG2 ARG 41 -0.137 -9.400 -8.249 312 2HG ARG 41 HG1 ARG 41 1.429 -9.761 -8.990 313 1HD ARG 41 HD2 ARG 41 -0.613 -8.539 -10.273 314 2HD ARG 41 HD1 ARG 41 0.641 -9.474 -11.084 315 HE ARG 41 HE ARG 41 -2.041 -10.496 -10.403 316 1HH1 ARG 41 HH11 ARG 41 0.830 -10.505 -12.380 317 2HH1 ARG 41 HH12 ARG 41 0.217 -11.684 -13.491 318 1HH2 ARG 41 HH21 ARG 41 -2.854 -12.052 -11.858 319 2HH2 ARG 41 HH22 ARG 41 -1.877 -12.563 -13.194 320 H GLN 42 HN GLN 42 3.267 -10.995 -9.286 321 HA GLN 42 HA GLN 42 3.787 -9.320 -6.966 322 1HB GLN 42 HB2 GLN 42 5.097 -11.511 -6.772 323 2HB GLN 42 HB1 GLN 42 6.050 -10.925 -8.129 324 1HG GLN 42 HG2 GLN 42 7.185 -9.472 -6.868 325 2HG GLN 42 HG1 GLN 42 5.756 -8.999 -5.949 326 1HE2 GLN 42 HE21 GLN 42 4.959 -11.357 -4.860 327 2HE2 GLN 42 HE22 GLN 42 6.166 -11.944 -3.770 328 H LYS 43 HN LYS 43 4.194 -7.316 -7.597 329 HA LYS 43 HA LYS 43 5.441 -6.899 -10.241 330 1HB LYS 43 HB2 LYS 43 3.959 -4.577 -9.485 331 2HB LYS 43 HB1 LYS 43 3.751 -5.600 -10.900 332 1HG LYS 43 HG2 LYS 43 2.614 -6.638 -8.394 333 2HG LYS 43 HG1 LYS 43 1.857 -5.183 -9.048 334 1HD LYS 43 HD2 LYS 43 2.415 -7.569 -10.778 335 2HD LYS 43 HD1 LYS 43 0.952 -7.469 -9.797 336 1HE LYS 43 HE2 LYS 43 0.020 -5.892 -11.115 337 2HE LYS 43 HE1 LYS 43 1.558 -5.082 -11.408 338 1HZ LYS 43 HZ1 LYS 43 1.940 -7.331 -12.759 339 2HZ LYS 43 HZ2 LYS 43 1.262 -5.945 -13.452 340 3HZ LYS 43 HZ3 LYS 43 0.260 -7.198 -12.917 341 H VAL 44 HN VAL 44 6.389 -4.638 -10.414 342 HA VAL 44 HA VAL 44 7.452 -3.610 -7.889 343 HB VAL 44 HB VAL 44 9.454 -3.840 -10.059 344 1HG1 VAL 44 HG11 VAL 44 10.129 -2.773 -8.060 345 2HG1 VAL 44 HG12 VAL 44 10.898 -4.361 -8.061 346 3HG1 VAL 44 HG13 VAL 44 9.474 -4.071 -7.062 347 1HG2 VAL 44 HG21 VAL 44 8.543 -6.062 -10.197 348 2HG2 VAL 44 HG22 VAL 44 8.584 -6.232 -8.442 349 3HG2 VAL 44 HG23 VAL 44 10.091 -6.134 -9.354 350 H VAL 45 HN VAL 45 7.836 -1.414 -7.923 351 HA VAL 45 HA VAL 45 7.726 -0.015 -10.497 352 HB VAL 45 HB VAL 45 6.080 1.550 -9.812 353 1HG1 VAL 45 HG11 VAL 45 5.388 -0.863 -10.469 354 2HG1 VAL 45 HG12 VAL 45 4.171 0.246 -9.836 355 3HG1 VAL 45 HG13 VAL 45 4.874 -0.985 -8.787 356 1HG2 VAL 45 HG21 VAL 45 5.255 0.470 -7.268 357 2HG2 VAL 45 HG22 VAL 45 5.694 2.123 -7.697 358 3HG2 VAL 45 HG23 VAL 45 6.945 0.975 -7.221 359 H THR 46 HN THR 46 8.333 2.310 -10.297 360 HA THR 46 HA THR 46 10.445 2.584 -8.276 361 HB THR 46 HB THR 46 11.528 4.177 -9.703 362 HG1 THR 46 HG1 THR 46 10.130 4.151 -11.938 363 1HG2 THR 46 HG21 THR 46 11.271 2.634 -11.974 364 2HG2 THR 46 HG22 THR 46 10.801 1.525 -10.687 365 3HG2 THR 46 HG23 THR 46 12.375 2.320 -10.636 366 H LEU 47 HN LEU 47 10.519 4.268 -6.892 367 HA LEU 47 HA LEU 47 8.099 5.874 -6.681 368 1HB LEU 47 HB2 LEU 47 10.409 5.366 -4.829 369 2HB LEU 47 HB1 LEU 47 9.227 6.620 -4.502 370 HG LEU 47 HG LEU 47 8.492 4.797 -3.237 371 1HD1 LEU 47 HD11 LEU 47 6.558 5.590 -4.224 372 2HD1 LEU 47 HD12 LEU 47 6.496 3.868 -4.599 373 3HD1 LEU 47 HD13 LEU 47 7.015 5.020 -5.829 374 1HD2 LEU 47 HD21 LEU 47 10.051 3.233 -4.651 375 2HD2 LEU 47 HD22 LEU 47 8.554 2.870 -5.510 376 3HD2 LEU 47 HD23 LEU 47 8.669 2.574 -3.775 377 H THR 48 HN THR 48 7.978 8.045 -6.810 378 HA THR 48 HA THR 48 10.417 9.588 -7.307 379 HB THR 48 HB THR 48 8.678 10.793 -9.042 380 HG1 THR 48 HG1 THR 48 7.163 9.285 -9.299 381 1HG2 THR 48 HG21 THR 48 11.091 10.206 -9.364 382 2HG2 THR 48 HG22 THR 48 10.088 9.959 -10.794 383 3HG2 THR 48 HG23 THR 48 10.578 8.578 -9.813 384 H ASP 49 HN ASP 49 10.408 11.122 -5.796 385 HA ASP 49 HA ASP 49 9.731 12.783 -4.398 386 1HB ASP 49 HB2 ASP 49 7.294 12.995 -6.180 387 2HB ASP 49 HB1 ASP 49 7.917 14.231 -5.092 388 H THR 50 HN THR 50 8.772 9.926 -4.209 389 HA THR 50 HA THR 50 6.438 10.324 -2.458 390 HB THR 50 HB THR 50 6.343 7.733 -2.671 391 HG1 THR 50 HG1 THR 50 8.471 8.075 -4.034 392 1HG2 THR 50 HG21 THR 50 4.776 9.487 -3.650 393 2HG2 THR 50 HG22 THR 50 4.825 7.928 -4.472 394 3HG2 THR 50 HG23 THR 50 5.686 9.310 -5.151 395 H THR 51 HN THR 51 6.827 10.258 -0.332 396 HA THR 51 HA THR 51 9.341 9.654 0.778 397 HB THR 51 HB THR 51 7.092 9.372 2.645 398 HG1 THR 51 HG1 THR 51 6.496 11.606 2.402 399 1HG2 THR 51 HG21 THR 51 9.549 9.855 3.133 400 2HG2 THR 51 HG22 THR 51 8.362 10.865 3.959 401 3HG2 THR 51 HG23 THR 51 9.229 11.489 2.556 402 H ASN 52 HN ASN 52 9.504 8.026 2.691 403 HA ASN 52 HA ASN 52 9.610 5.473 1.709 404 1HB ASN 52 HB2 ASN 52 9.910 4.697 3.984 405 2HB ASN 52 HB1 ASN 52 10.740 6.236 3.777 406 1HD2 ASN 52 HD21 ASN 52 8.914 8.104 4.127 407 2HD2 ASN 52 HD22 ASN 52 8.172 7.992 5.683 408 H GLN 53 HN GLN 53 7.047 6.698 3.888 409 HA GLN 53 HA GLN 53 5.468 4.393 3.807 410 1HB GLN 53 HB2 GLN 53 4.963 7.263 4.443 411 2HB GLN 53 HB1 GLN 53 3.575 6.210 4.206 412 1HG GLN 53 HG2 GLN 53 3.772 5.500 6.285 413 2HG GLN 53 HG1 GLN 53 5.367 4.848 5.906 414 1HE2 GLN 53 HE21 GLN 53 3.599 7.344 7.466 415 2HE2 GLN 53 HE22 GLN 53 4.951 8.174 8.153 416 H LYS 54 HN LYS 54 5.572 7.217 1.710 417 HA LYS 54 HA LYS 54 3.335 6.594 0.131 418 1HB LYS 54 HB2 LYS 54 5.728 8.338 -0.231 419 2HB LYS 54 HB1 LYS 54 4.735 7.967 -1.638 420 1HG LYS 54 HG2 LYS 54 3.711 9.872 -0.946 421 2HG LYS 54 HG1 LYS 54 2.786 8.694 -0.011 422 1HD LYS 54 HD2 LYS 54 5.264 9.809 1.195 423 2HD LYS 54 HD1 LYS 54 3.840 10.847 1.112 424 1HE LYS 54 HE2 LYS 54 3.670 8.059 2.203 425 2HE LYS 54 HE1 LYS 54 4.198 9.403 3.216 426 1HZ LYS 54 HZ1 LYS 54 1.587 9.131 1.827 427 2HZ LYS 54 HZ2 LYS 54 2.094 10.542 2.612 428 3HZ LYS 54 HZ3 LYS 54 1.862 9.119 3.497 429 H THR 55 HN THR 55 6.625 5.396 0.103 430 HA THR 55 HA THR 55 6.639 4.316 -2.502 431 HB THR 55 HB THR 55 8.486 3.003 -1.890 432 HG1 THR 55 HG1 THR 55 7.136 2.769 0.502 433 1HG2 THR 55 HG21 THR 55 9.946 4.528 -1.021 434 2HG2 THR 55 HG22 THR 55 8.859 4.991 0.287 435 3HG2 THR 55 HG23 THR 55 8.583 5.599 -1.345 436 H GLU 56 HN GLU 56 5.385 3.298 0.559 437 HA GLU 56 HA GLU 56 4.499 0.707 -0.355 438 1HB GLU 56 HB2 GLU 56 3.287 1.905 2.065 439 2HB GLU 56 HB1 GLU 56 3.966 0.300 1.823 440 1HG GLU 56 HG2 GLU 56 5.781 2.664 1.911 441 2HG GLU 56 HG1 GLU 56 5.129 2.009 3.411 442 H LEU 57 HN LEU 57 3.342 3.951 -0.289 443 HA LEU 57 HA LEU 57 0.554 3.376 -0.526 444 1HB LEU 57 HB2 LEU 57 2.275 5.749 -0.610 445 2HB LEU 57 HB1 LEU 57 0.906 5.846 -1.698 446 HG LEU 57 HG LEU 57 0.066 6.837 0.207 447 1HD1 LEU 57 HD11 LEU 57 -1.645 5.489 0.971 448 2HD1 LEU 57 HD12 LEU 57 -0.640 4.039 0.990 449 3HD1 LEU 57 HD13 LEU 57 -1.202 4.704 -0.545 450 1HD2 LEU 57 HD21 LEU 57 0.568 6.210 2.463 451 2HD2 LEU 57 HD22 LEU 57 2.082 6.320 1.565 452 3HD2 LEU 57 HD23 LEU 57 1.383 4.741 1.924 453 H GLN 58 HN GLN 58 3.155 4.125 -2.826 454 HA GLN 58 HA GLN 58 1.534 4.061 -5.133 455 1HB GLN 58 HB2 GLN 58 3.760 5.046 -5.226 456 2HB GLN 58 HB1 GLN 58 4.492 3.511 -4.781 457 1HG GLN 58 HG2 GLN 58 4.590 4.189 -7.228 458 2HG GLN 58 HG1 GLN 58 4.048 2.553 -6.863 459 1HE2 GLN 58 HE21 GLN 58 2.133 1.902 -7.618 460 2HE2 GLN 58 HE22 GLN 58 0.965 2.916 -8.391 461 H ALA 59 HN ALA 59 3.528 1.664 -3.468 462 HA ALA 59 HA ALA 59 2.947 -0.540 -5.116 463 1HB ALA 59 HB1 ALA 59 4.561 -1.292 -3.760 464 2HB ALA 59 HB2 ALA 59 3.283 -1.595 -2.582 465 3HB ALA 59 HB3 ALA 59 4.195 -0.085 -2.527 466 H ILE 60 HN ILE 60 1.314 0.984 -2.431 467 HA ILE 60 HA ILE 60 -0.603 -0.894 -1.746 468 HB ILE 60 HB ILE 60 -0.363 2.038 -1.575 469 1HG1 ILE 60 HG12 ILE 60 -0.309 -0.194 0.143 470 2HG1 ILE 60 HG11 ILE 60 -0.081 1.497 0.563 471 1HG2 ILE 60 HG21 ILE 60 -2.569 1.848 -2.643 472 2HG2 ILE 60 HG22 ILE 60 -2.668 2.474 -0.998 473 3HG2 ILE 60 HG23 ILE 60 -3.097 0.795 -1.329 474 1HD1 ILE 60 HD11 ILE 60 -1.800 0.234 1.895 475 2HD1 ILE 60 HD12 ILE 60 -2.793 0.219 0.437 476 3HD1 ILE 60 HD13 ILE 60 -2.337 1.754 1.178 477 H TYR 61 HN TYR 61 -0.687 1.585 -4.259 478 HA TYR 61 HA TYR 61 -3.220 1.118 -5.298 479 1HB TYR 61 HB2 TYR 61 -2.273 3.018 -6.168 480 2HB TYR 61 HB1 TYR 61 -0.676 2.299 -6.291 481 HD1 TYR 61 HD1 TYR 61 -3.752 3.083 -8.030 482 HD2 TYR 61 HD2 TYR 61 -0.158 0.805 -8.234 483 HE1 TYR 61 HE1 TYR 61 -4.092 2.768 -10.445 484 HE2 TYR 61 HE2 TYR 61 -0.489 0.491 -10.650 485 HH TYR 61 HH TYR 61 -3.411 1.193 -12.215 486 H LEU 62 HN LEU 62 -0.197 -0.594 -5.796 487 HA LEU 62 HA LEU 62 -0.931 -2.126 -8.041 488 1HB LEU 62 HB2 LEU 62 0.901 -3.062 -5.835 489 2HB LEU 62 HB1 LEU 62 0.918 -3.535 -7.529 490 HG LEU 62 HG LEU 62 1.595 -0.771 -6.524 491 1HD1 LEU 62 HD11 LEU 62 3.187 -2.690 -5.958 492 2HD1 LEU 62 HD12 LEU 62 3.859 -1.289 -6.792 493 3HD1 LEU 62 HD13 LEU 62 3.507 -2.765 -7.691 494 1HD2 LEU 62 HD21 LEU 62 2.420 -0.421 -8.813 495 2HD2 LEU 62 HD22 LEU 62 0.685 -0.731 -8.770 496 3HD2 LEU 62 HD23 LEU 62 1.797 -2.007 -9.266 497 H ALA 63 HN ALA 63 -0.961 -3.046 -4.591 498 HA ALA 63 HA ALA 63 -2.210 -5.552 -5.052 499 1HB ALA 63 HB1 ALA 63 -1.886 -3.889 -2.570 500 2HB ALA 63 HB2 ALA 63 -0.962 -5.308 -3.058 501 3HB ALA 63 HB3 ALA 63 -2.649 -5.479 -2.574 502 H LEU 64 HN LEU 64 -3.352 -2.339 -4.726 503 HA LEU 64 HA LEU 64 -6.086 -3.114 -4.151 504 1HB LEU 64 HB2 LEU 64 -4.534 -0.651 -4.171 505 2HB LEU 64 HB1 LEU 64 -6.101 -0.449 -4.934 506 HG LEU 64 HG LEU 64 -6.606 -1.858 -2.561 507 1HD1 LEU 64 HD11 LEU 64 -4.943 0.555 -1.914 508 2HD1 LEU 64 HD12 LEU 64 -4.259 -1.070 -1.959 509 3HD1 LEU 64 HD13 LEU 64 -5.555 -0.690 -0.826 510 1HD2 LEU 64 HD21 LEU 64 -7.160 0.879 -2.170 511 2HD2 LEU 64 HD22 LEU 64 -8.263 -0.392 -2.697 512 3HD2 LEU 64 HD23 LEU 64 -7.372 0.551 -3.890 513 H GLN 65 HN GLN 65 -4.084 -2.721 -6.860 514 HA GLN 65 HA GLN 65 -6.108 -1.991 -8.752 515 1HB GLN 65 HB2 GLN 65 -3.235 -2.635 -8.807 516 2HB GLN 65 HB1 GLN 65 -4.118 -3.070 -10.265 517 1HG GLN 65 HG2 GLN 65 -4.739 -0.396 -9.283 518 2HG GLN 65 HG1 GLN 65 -3.042 -0.618 -9.714 519 1HE2 GLN 65 HE21 GLN 65 -6.242 -0.248 -10.859 520 2HE2 GLN 65 HE22 GLN 65 -5.891 -0.324 -12.549 521 H ASP 66 HN ASP 66 -4.352 -5.039 -8.079 522 HA ASP 66 HA ASP 66 -6.180 -6.480 -9.821 523 1HB ASP 66 HB2 ASP 66 -3.955 -7.661 -8.167 524 2HB ASP 66 HB1 ASP 66 -4.706 -8.334 -9.611 525 H SER 67 HN SER 67 -6.366 -5.455 -6.718 526 HA SER 67 HA SER 67 -7.046 -7.572 -5.101 527 1HB SER 67 HB2 SER 67 -8.484 -5.996 -3.880 528 2HB SER 67 HB1 SER 67 -6.976 -5.218 -4.360 529 HG SER 67 HG SER 67 -9.576 -4.815 -5.311 530 H GLY 68 HN GLY 68 -9.274 -5.776 -7.247 531 1HA GLY 68 HA2 GLY 68 -10.910 -6.898 -8.592 532 2HA GLY 68 HA1 GLY 68 -10.922 -8.208 -7.422 533 H LEU 69 HN LEU 69 -11.766 -7.650 -5.234 534 HA LEU 69 HA LEU 69 -13.784 -5.517 -5.317 535 1HB LEU 69 HB2 LEU 69 -14.313 -8.248 -4.150 536 2HB LEU 69 HB1 LEU 69 -15.456 -6.933 -4.357 537 HG LEU 69 HG LEU 69 -14.367 -7.597 -6.917 538 1HD1 LEU 69 HD11 LEU 69 -13.857 -9.785 -6.034 539 2HD1 LEU 69 HD12 LEU 69 -15.250 -9.891 -7.110 540 3HD1 LEU 69 HD13 LEU 69 -15.483 -9.926 -5.363 541 1HD2 LEU 69 HD21 LEU 69 -16.481 -6.502 -6.623 542 2HD2 LEU 69 HD22 LEU 69 -17.099 -7.854 -5.672 543 3HD2 LEU 69 HD23 LEU 69 -16.763 -8.066 -7.390 544 H GLU 70 HN GLU 70 -13.622 -7.863 -2.765 545 HA GLU 70 HA GLU 70 -12.607 -5.774 -0.971 546 1HB GLU 70 HB2 GLU 70 -13.508 -7.306 0.831 547 2HB GLU 70 HB1 GLU 70 -14.716 -6.588 -0.228 548 1HG GLU 70 HG2 GLU 70 -14.822 -8.654 -1.513 549 2HG GLU 70 HG1 GLU 70 -13.605 -9.382 -0.454 550 H VAL 71 HN VAL 71 -10.609 -5.945 -0.194 551 HA VAL 71 HA VAL 71 -9.409 -8.591 0.106 552 HB VAL 71 HB VAL 71 -7.306 -7.874 -0.926 553 1HG1 VAL 71 HG11 VAL 71 -8.109 -7.830 -3.295 554 2HG1 VAL 71 HG12 VAL 71 -9.754 -7.690 -2.675 555 3HG1 VAL 71 HG13 VAL 71 -8.794 -9.126 -2.314 556 1HG2 VAL 71 HG21 VAL 71 -8.818 -5.429 -1.831 557 2HG2 VAL 71 HG22 VAL 71 -7.139 -5.832 -2.189 558 3HG2 VAL 71 HG23 VAL 71 -7.621 -5.450 -0.537 559 H ASN 72 HN ASN 72 -7.461 -8.579 1.397 560 HA ASN 72 HA ASN 72 -7.570 -6.546 3.488 561 1HB ASN 72 HB2 ASN 72 -6.511 -9.349 3.294 562 2HB ASN 72 HB1 ASN 72 -5.828 -8.260 4.499 563 1HD2 ASN 72 HD21 ASN 72 -9.162 -8.376 3.372 564 2HD2 ASN 72 HD22 ASN 72 -9.848 -8.841 4.888 565 H ILE 73 HN ILE 73 -6.336 -4.811 2.933 566 HA ILE 73 HA ILE 73 -3.841 -5.318 1.512 567 HB ILE 73 HB ILE 73 -5.495 -2.852 1.917 568 1HG1 ILE 73 HG12 ILE 73 -6.060 -4.176 0.009 569 2HG1 ILE 73 HG11 ILE 73 -5.178 -2.773 -0.580 570 1HG2 ILE 73 HG21 ILE 73 -3.375 -1.975 0.424 571 2HG2 ILE 73 HG22 ILE 73 -2.587 -2.963 1.655 572 3HG2 ILE 73 HG23 ILE 73 -3.634 -1.627 2.134 573 1HD1 ILE 73 HD11 ILE 73 -3.863 -4.156 -1.683 574 2HD1 ILE 73 HD12 ILE 73 -4.609 -5.555 -0.911 575 3HD1 ILE 73 HD13 ILE 73 -3.251 -4.739 -0.135 576 H VAL 74 HN VAL 74 -2.370 -5.922 2.837 577 HA VAL 74 HA VAL 74 -1.910 -4.481 5.340 578 HB VAL 74 HB VAL 74 0.007 -6.557 5.000 579 1HG1 VAL 74 HG11 VAL 74 -0.867 -7.348 7.063 580 2HG1 VAL 74 HG12 VAL 74 -2.419 -6.558 6.784 581 3HG1 VAL 74 HG13 VAL 74 -0.980 -5.588 7.098 582 1HG2 VAL 74 HG21 VAL 74 -2.821 -7.379 4.371 583 2HG2 VAL 74 HG22 VAL 74 -1.591 -8.502 4.951 584 3HG2 VAL 74 HG23 VAL 74 -1.368 -7.668 3.414 585 H THR 75 HN THR 75 -0.852 -2.667 4.906 586 HA THR 75 HA THR 75 1.653 -2.872 3.351 587 HB THR 75 HB THR 75 0.324 -0.229 3.578 588 HG1 THR 75 HG1 THR 75 -0.703 -1.301 1.418 589 1HG2 THR 75 HG21 THR 75 1.469 0.242 1.657 590 2HG2 THR 75 HG22 THR 75 1.342 -1.406 1.043 591 3HG2 THR 75 HG23 THR 75 2.510 -1.024 2.307 592 H ASP 76 HN ASP 76 3.475 -1.949 4.235 593 HA ASP 76 HA ASP 76 3.216 -1.136 7.011 594 1HB ASP 76 HB2 ASP 76 5.807 -0.929 5.528 595 2HB ASP 76 HB1 ASP 76 5.509 -1.431 7.188 596 H SER 77 HN SER 77 2.227 0.821 7.058 597 HA SER 77 HA SER 77 3.791 3.100 6.384 598 1HB SER 77 HB2 SER 77 1.672 2.217 4.535 599 2HB SER 77 HB1 SER 77 1.601 3.921 4.989 600 HG SER 77 HG SER 77 4.111 3.448 4.484 601 H GLN 78 HN GLN 78 3.513 4.246 8.196 602 HA GLN 78 HA GLN 78 0.951 4.155 9.539 603 1HB GLN 78 HB2 GLN 78 3.639 5.277 10.224 604 2HB GLN 78 HB1 GLN 78 2.216 5.842 11.092 605 1HG GLN 78 HG2 GLN 78 3.411 3.097 11.025 606 2HG GLN 78 HG1 GLN 78 3.021 4.107 12.417 607 1HE2 GLN 78 HE21 GLN 78 1.593 2.289 9.756 608 2HE2 GLN 78 HE22 GLN 78 0.134 1.873 10.575 609 H TYR 79 HN TYR 79 2.357 5.867 7.081 610 HA TYR 79 HA TYR 79 1.022 8.395 7.559 611 1HB TYR 79 HB2 TYR 79 3.181 7.641 5.968 612 2HB TYR 79 HB1 TYR 79 1.884 7.913 4.810 613 HD1 TYR 79 HD1 TYR 79 0.425 10.155 5.643 614 HD2 TYR 79 HD2 TYR 79 4.591 9.448 6.148 615 HE1 TYR 79 HE1 TYR 79 0.814 12.579 5.777 616 HE2 TYR 79 HE2 TYR 79 4.991 11.871 6.284 617 HH TYR 79 HH TYR 79 2.496 14.125 6.698 618 H ALA 80 HN ALA 80 0.801 5.664 5.274 619 HA ALA 80 HA ALA 80 -1.583 6.469 4.017 620 1HB ALA 80 HB1 ALA 80 0.085 4.459 3.543 621 2HB ALA 80 HB2 ALA 80 -1.603 4.392 3.033 622 3HB ALA 80 HB3 ALA 80 -1.093 3.569 4.508 623 H LEU 81 HN LEU 81 -0.854 4.789 6.982 624 HA LEU 81 HA LEU 81 -3.358 3.862 7.723 625 1HB LEU 81 HB2 LEU 81 -1.739 3.123 9.157 626 2HB LEU 81 HB1 LEU 81 -0.874 4.648 9.130 627 HG LEU 81 HG LEU 81 -3.259 5.219 10.470 628 1HD1 LEU 81 HD11 LEU 81 -2.086 2.661 11.543 629 2HD1 LEU 81 HD12 LEU 81 -3.602 2.765 10.648 630 3HD1 LEU 81 HD13 LEU 81 -3.440 3.579 12.204 631 1HD2 LEU 81 HD21 LEU 81 -1.428 4.898 12.453 632 2HD2 LEU 81 HD22 LEU 81 -1.544 6.317 11.413 633 3HD2 LEU 81 HD23 LEU 81 -0.388 5.040 11.036 634 H GLY 82 HN GLY 82 -1.885 7.046 8.062 635 1HA GLY 82 HA2 GLY 82 -4.170 8.126 9.460 636 2HA GLY 82 HA1 GLY 82 -2.750 9.017 8.935 637 H ILE 83 HN ILE 83 -2.796 8.523 6.179 638 HA ILE 83 HA ILE 83 -5.027 10.229 5.445 639 HB ILE 83 HB ILE 83 -3.159 9.324 3.344 640 1HG1 ILE 83 HG12 ILE 83 -1.636 9.521 5.287 641 2HG1 ILE 83 HG11 ILE 83 -1.337 10.771 4.084 642 1HG2 ILE 83 HG21 ILE 83 -3.821 11.213 2.376 643 2HG2 ILE 83 HG22 ILE 83 -3.459 12.170 3.813 644 3HG2 ILE 83 HG23 ILE 83 -5.010 11.343 3.673 645 1HD1 ILE 83 HD11 ILE 83 -1.617 12.348 5.603 646 2HD1 ILE 83 HD12 ILE 83 -1.801 11.091 6.827 647 3HD1 ILE 83 HD13 ILE 83 -3.222 11.735 6.003 648 H ILE 84 HN ILE 84 -3.593 7.299 3.982 649 HA ILE 84 HA ILE 84 -5.613 6.745 2.196 650 HB ILE 84 HB ILE 84 -3.248 5.511 2.900 651 1HG1 ILE 84 HG12 ILE 84 -4.315 5.859 0.642 652 2HG1 ILE 84 HG11 ILE 84 -3.522 4.300 0.851 653 1HG2 ILE 84 HG21 ILE 84 -5.300 3.337 3.021 654 2HG2 ILE 84 HG22 ILE 84 -4.743 4.139 4.489 655 3HG2 ILE 84 HG23 ILE 84 -3.592 3.288 3.458 656 1HD1 ILE 84 HD11 ILE 84 -6.460 4.906 0.801 657 2HD1 ILE 84 HD12 ILE 84 -5.821 3.377 1.405 658 3HD1 ILE 84 HD13 ILE 84 -5.532 3.855 -0.267 659 H GLN 85 HN GLN 85 -5.687 6.338 5.611 660 HA GLN 85 HA GLN 85 -7.942 4.493 5.487 661 1HB GLN 85 HB2 GLN 85 -6.132 4.305 7.235 662 2HB GLN 85 HB1 GLN 85 -6.747 5.797 7.936 663 1HG GLN 85 HG2 GLN 85 -8.990 4.605 8.094 664 2HG GLN 85 HG1 GLN 85 -8.097 3.124 7.751 665 1HE2 GLN 85 HE21 GLN 85 -8.314 2.126 9.676 666 2HE2 GLN 85 HE22 GLN 85 -7.677 2.731 11.163 667 H ALA 86 HN ALA 86 -7.283 7.841 5.737 668 HA ALA 86 HA ALA 86 -9.975 8.469 6.678 669 1HB ALA 86 HB1 ALA 86 -9.143 10.792 6.822 670 2HB ALA 86 HB2 ALA 86 -7.571 10.223 6.257 671 3HB ALA 86 HB3 ALA 86 -8.213 9.656 7.799 672 H GLN 87 HN GLN 87 -10.071 7.327 4.213 673 HA GLN 87 HA GLN 87 -10.496 7.695 1.958 674 1HB GLN 87 HB2 GLN 87 -12.253 9.832 3.177 675 2HB GLN 87 HB1 GLN 87 -12.524 8.974 1.666 676 1HG GLN 87 HG2 GLN 87 -13.878 7.694 2.895 677 2HG GLN 87 HG1 GLN 87 -12.386 6.910 3.409 678 1HE2 GLN 87 HE21 GLN 87 -11.324 7.928 5.340 679 2HE2 GLN 87 HE22 GLN 87 -12.360 8.442 6.623 680 HA PRO 88 HA PRO 88 -7.881 11.470 1.643 681 1HB PRO 88 HB2 PRO 88 -5.629 10.426 0.749 682 2HB PRO 88 HB1 PRO 88 -6.085 10.236 2.452 683 1HG PRO 88 HG2 PRO 88 -6.479 8.309 0.179 684 2HG PRO 88 HG1 PRO 88 -5.731 8.016 1.761 685 1HD PRO 88 HD2 PRO 88 -8.340 7.436 1.262 686 2HD PRO 88 HD1 PRO 88 -7.771 7.954 2.861 687 H ASP 89 HN ASP 89 -9.857 10.238 -0.242 688 HA ASP 89 HA ASP 89 -8.921 9.811 -2.799 689 1HB ASP 89 HB2 ASP 89 -11.317 9.646 -1.925 690 2HB ASP 89 HB1 ASP 89 -11.439 11.372 -2.249 691 H GLN 90 HN GLN 90 -8.659 12.636 -1.000 692 HA GLN 90 HA GLN 90 -7.426 14.061 -3.148 693 1HB GLN 90 HB2 GLN 90 -8.976 16.014 -3.064 694 2HB GLN 90 HB1 GLN 90 -9.709 14.577 -3.751 695 1HG GLN 90 HG2 GLN 90 -10.075 15.461 -0.907 696 2HG GLN 90 HG1 GLN 90 -11.178 15.833 -2.229 697 1HE2 GLN 90 HE21 GLN 90 -10.016 13.383 -0.066 698 2HE2 GLN 90 HE22 GLN 90 -11.187 12.181 -0.463 699 H SER 91 HN SER 91 -7.142 13.133 -0.265 700 HA SER 91 HA SER 91 -6.439 15.737 0.916 701 1HB SER 91 HB2 SER 91 -7.964 13.599 1.968 702 2HB SER 91 HB1 SER 91 -6.454 13.646 2.876 703 HG SER 91 HG SER 91 -6.887 15.701 3.504 704 H GLU 92 HN GLU 92 -4.427 16.156 1.480 705 HA GLU 92 HA GLU 92 -2.173 16.020 1.571 706 1HB GLU 92 HB2 GLU 92 -3.160 14.498 3.518 707 2HB GLU 92 HB1 GLU 92 -2.288 13.253 2.633 708 1HG GLU 92 HG2 GLU 92 -0.523 13.863 3.836 709 2HG GLU 92 HG1 GLU 92 -0.447 15.273 2.779 710 H SER 93 HN SER 93 -1.348 12.859 1.572 711 HA SER 93 HA SER 93 0.264 12.758 -0.547 712 1HB SER 93 HB2 SER 93 0.465 10.826 0.630 713 2HB SER 93 HB1 SER 93 -1.270 10.692 0.920 714 HG SER 93 HG SER 93 -1.454 10.024 -1.300 715 H GLU 94 HN GLU 94 0.257 12.291 -2.708 716 HA GLU 94 HA GLU 94 -2.229 12.791 -4.105 717 1HB GLU 94 HB2 GLU 94 -0.690 12.553 -6.153 718 2HB GLU 94 HB1 GLU 94 -0.434 13.927 -5.087 719 1HG GLU 94 HG2 GLU 94 1.130 11.464 -4.563 720 2HG GLU 94 HG1 GLU 94 1.554 12.427 -5.977 721 H LEU 95 HN LEU 95 0.010 10.136 -3.602 722 HA LEU 95 HA LEU 95 -0.923 8.319 -5.497 723 1HB LEU 95 HB2 LEU 95 -0.151 7.438 -2.743 724 2HB LEU 95 HB1 LEU 95 0.192 6.668 -4.289 725 HG LEU 95 HG LEU 95 1.521 9.144 -3.180 726 1HD1 LEU 95 HD11 LEU 95 2.214 6.279 -3.337 727 2HD1 LEU 95 HD12 LEU 95 2.682 7.500 -2.154 728 3HD1 LEU 95 HD13 LEU 95 3.499 7.424 -3.714 729 1HD2 LEU 95 HD21 LEU 95 2.836 8.143 -5.483 730 2HD2 LEU 95 HD22 LEU 95 2.083 9.720 -5.246 731 3HD2 LEU 95 HD23 LEU 95 1.136 8.378 -5.890 732 H VAL 96 HN VAL 96 -1.843 8.683 -2.104 733 HA VAL 96 HA VAL 96 -3.778 6.736 -1.930 734 HB VAL 96 HB VAL 96 -4.754 8.059 -0.100 735 1HG1 VAL 96 HG11 VAL 96 -3.106 7.213 1.118 736 2HG1 VAL 96 HG12 VAL 96 -2.089 8.590 0.699 737 3HG1 VAL 96 HG13 VAL 96 -2.074 7.144 -0.310 738 1HG2 VAL 96 HG21 VAL 96 -3.182 10.213 -1.395 739 2HG2 VAL 96 HG22 VAL 96 -3.290 10.224 0.365 740 3HG2 VAL 96 HG23 VAL 96 -4.759 10.277 -0.608 741 H ASN 97 HN ASN 97 -3.907 9.797 -3.558 742 HA ASN 97 HA ASN 97 -6.735 10.047 -3.672 743 1HB ASN 97 HB2 ASN 97 -4.585 11.161 -5.494 744 2HB ASN 97 HB1 ASN 97 -6.283 11.605 -5.582 745 1HD2 ASN 97 HD21 ASN 97 -5.564 11.074 -2.402 746 2HD2 ASN 97 HD22 ASN 97 -5.208 12.694 -1.926 747 H GLN 98 HN GLN 98 -4.295 8.685 -5.841 748 HA GLN 98 HA GLN 98 -6.192 7.861 -7.823 749 1HB GLN 98 HB2 GLN 98 -3.863 8.369 -8.399 750 2HB GLN 98 HB1 GLN 98 -3.315 7.027 -7.402 751 1HG GLN 98 HG2 GLN 98 -3.310 5.907 -9.333 752 2HG GLN 98 HG1 GLN 98 -5.041 5.754 -9.039 753 1HE2 GLN 98 HE21 GLN 98 -5.709 5.714 -11.126 754 2HE2 GLN 98 HE22 GLN 98 -5.539 7.039 -12.221 755 H ILE 99 HN ILE 99 -4.748 6.385 -4.998 756 HA ILE 99 HA ILE 99 -5.456 3.698 -5.635 757 HB ILE 99 HB ILE 99 -4.778 5.015 -3.005 758 1HG1 ILE 99 HG12 ILE 99 -3.029 2.916 -4.037 759 2HG1 ILE 99 HG11 ILE 99 -3.172 4.284 -5.139 760 1HG2 ILE 99 HG21 ILE 99 -5.595 3.242 -1.949 761 2HG2 ILE 99 HG22 ILE 99 -4.425 2.237 -2.805 762 3HG2 ILE 99 HG23 ILE 99 -6.034 2.484 -3.480 763 1HD1 ILE 99 HD11 ILE 99 -1.708 4.056 -2.675 764 2HD1 ILE 99 HD12 ILE 99 -2.815 5.427 -2.634 765 3HD1 ILE 99 HD13 ILE 99 -1.624 5.295 -3.927 766 H ILE 100 HN ILE 100 -6.851 6.133 -3.465 767 HA ILE 100 HA ILE 100 -9.000 4.706 -2.493 768 HB ILE 100 HB ILE 100 -8.689 7.635 -3.077 769 1HG1 ILE 100 HG12 ILE 100 -7.357 6.948 -1.237 770 2HG1 ILE 100 HG11 ILE 100 -8.785 7.704 -0.538 771 1HG2 ILE 100 HG21 ILE 100 -10.866 7.980 -2.894 772 2HG2 ILE 100 HG22 ILE 100 -10.857 7.217 -1.303 773 3HG2 ILE 100 HG23 ILE 100 -11.138 6.243 -2.749 774 1HD1 ILE 100 HD11 ILE 100 -9.542 5.763 0.355 775 2HD1 ILE 100 HD12 ILE 100 -7.814 5.412 0.352 776 3HD1 ILE 100 HD13 ILE 100 -8.847 4.766 -0.922 777 H GLU 101 HN GLU 101 -8.926 6.802 -5.366 778 HA GLU 101 HA GLU 101 -11.539 6.475 -6.191 779 1HB GLU 101 HB2 GLU 101 -8.986 7.177 -7.491 780 2HB GLU 101 HB1 GLU 101 -10.228 6.564 -8.576 781 1HG GLU 101 HG2 GLU 101 -11.586 8.377 -7.000 782 2HG GLU 101 HG1 GLU 101 -10.014 9.134 -7.252 783 H GLN 102 HN GLN 102 -8.743 4.388 -6.705 784 HA GLN 102 HA GLN 102 -10.129 2.526 -8.356 785 1HB GLN 102 HB2 GLN 102 -7.460 2.720 -7.113 786 2HB GLN 102 HB1 GLN 102 -8.054 1.082 -7.347 787 1HG GLN 102 HG2 GLN 102 -6.651 1.977 -9.202 788 2HG GLN 102 HG1 GLN 102 -8.241 1.389 -9.688 789 1HE2 GLN 102 HE21 GLN 102 -9.824 2.874 -10.312 790 2HE2 GLN 102 HE22 GLN 102 -9.424 4.491 -10.773 791 H LEU 103 HN LEU 103 -9.734 3.019 -4.970 792 HA LEU 103 HA LEU 103 -10.581 0.412 -4.148 793 1HB LEU 103 HB2 LEU 103 -9.210 1.755 -2.671 794 2HB LEU 103 HB1 LEU 103 -10.399 3.043 -2.677 795 HG LEU 103 HG LEU 103 -11.951 1.691 -1.403 796 1HD1 LEU 103 HD11 LEU 103 -10.326 -0.468 -2.353 797 2HD1 LEU 103 HD12 LEU 103 -11.896 -0.521 -1.553 798 3HD1 LEU 103 HD13 LEU 103 -10.417 -0.515 -0.592 799 1HD2 LEU 103 HD21 LEU 103 -10.785 1.614 0.671 800 2HD2 LEU 103 HD22 LEU 103 -10.122 2.962 -0.253 801 3HD2 LEU 103 HD23 LEU 103 -9.229 1.445 -0.142 802 H ILE 104 HN ILE 104 -12.100 3.432 -4.960 803 HA ILE 104 HA ILE 104 -14.631 3.017 -3.801 804 HB ILE 104 HB ILE 104 -14.005 4.525 -6.340 805 1HG1 ILE 104 HG12 ILE 104 -14.108 5.543 -3.489 806 2HG1 ILE 104 HG11 ILE 104 -12.629 5.255 -4.401 807 1HG2 ILE 104 HG21 ILE 104 -16.034 5.864 -5.519 808 2HG2 ILE 104 HG22 ILE 104 -16.369 4.467 -4.498 809 3HG2 ILE 104 HG23 ILE 104 -16.323 4.286 -6.251 810 1HD1 ILE 104 HD11 ILE 104 -14.771 7.246 -5.106 811 2HD1 ILE 104 HD12 ILE 104 -13.283 6.961 -6.010 812 3HD1 ILE 104 HD13 ILE 104 -13.209 7.611 -4.372 813 H LYS 105 HN LYS 105 -13.301 2.195 -6.965 814 HA LYS 105 HA LYS 105 -15.748 1.109 -7.940 815 1HB LYS 105 HB2 LYS 105 -14.565 0.557 -9.891 816 2HB LYS 105 HB1 LYS 105 -13.822 2.039 -9.316 817 1HG LYS 105 HG2 LYS 105 -11.867 0.994 -8.721 818 2HG LYS 105 HG1 LYS 105 -12.642 -0.579 -8.521 819 1HD LYS 105 HD2 LYS 105 -12.899 -0.777 -10.935 820 2HD LYS 105 HD1 LYS 105 -12.187 0.822 -11.156 821 1HE LYS 105 HE2 LYS 105 -10.638 -1.129 -11.541 822 2HE LYS 105 HE1 LYS 105 -10.070 0.087 -10.400 823 1HZ LYS 105 HZ1 LYS 105 -10.083 -1.373 -8.732 824 2HZ LYS 105 HZ2 LYS 105 -10.158 -2.569 -9.927 825 3HZ LYS 105 HZ3 LYS 105 -11.576 -2.036 -9.174 826 H LYS 106 HN LYS 106 -14.302 0.001 -5.381 827 HA LYS 106 HA LYS 106 -14.827 -2.784 -6.123 828 1HB LYS 106 HB2 LYS 106 -12.895 -3.648 -5.096 829 2HB LYS 106 HB1 LYS 106 -12.345 -2.311 -6.091 830 1HG LYS 106 HG2 LYS 106 -12.105 -0.906 -4.158 831 2HG LYS 106 HG1 LYS 106 -12.810 -2.151 -3.122 832 1HD LYS 106 HD2 LYS 106 -10.574 -2.523 -2.756 833 2HD LYS 106 HD1 LYS 106 -10.862 -3.614 -4.112 834 1HE LYS 106 HE2 LYS 106 -9.827 -0.798 -4.388 835 2HE LYS 106 HE1 LYS 106 -8.801 -2.229 -4.330 836 1HZ LYS 106 HZ1 LYS 106 -9.154 -1.637 -6.598 837 2HZ LYS 106 HZ2 LYS 106 -10.832 -1.572 -6.393 838 3HZ LYS 106 HZ3 LYS 106 -10.027 -3.056 -6.302 839 H GLU 107 HN GLU 107 -14.300 -3.977 -3.679 840 HA GLU 107 HA GLU 107 -16.631 -3.076 -2.169 841 1HB GLU 107 HB2 GLU 107 -16.159 -5.488 -2.877 842 2HB GLU 107 HB1 GLU 107 -14.918 -5.499 -1.628 843 1HG GLU 107 HG2 GLU 107 -16.472 -6.095 -0.173 844 2HG GLU 107 HG1 GLU 107 -17.224 -4.517 -0.396 845 H LYS 108 HN LYS 108 -13.153 -3.544 -1.609 846 HA LYS 108 HA LYS 108 -12.751 -1.516 0.149 847 1HB LYS 108 HB2 LYS 108 -12.793 -2.777 2.404 848 2HB LYS 108 HB1 LYS 108 -14.303 -2.147 1.762 849 1HG LYS 108 HG2 LYS 108 -14.870 -4.358 0.911 850 2HG LYS 108 HG1 LYS 108 -13.357 -4.998 1.559 851 1HD LYS 108 HD2 LYS 108 -14.795 -5.551 3.255 852 2HD LYS 108 HD1 LYS 108 -14.275 -3.954 3.798 853 1HE LYS 108 HE2 LYS 108 -16.568 -3.808 4.026 854 2HE LYS 108 HE1 LYS 108 -16.314 -3.112 2.426 855 1HZ LYS 108 HZ1 LYS 108 -17.656 -4.644 1.595 856 2HZ LYS 108 HZ2 LYS 108 -17.883 -5.322 3.126 857 3HZ LYS 108 HZ3 LYS 108 -16.629 -5.876 2.136 858 H VAL 109 HN VAL 109 -10.933 -1.762 1.658 859 HA VAL 109 HA VAL 109 -9.198 -4.044 1.222 860 HB VAL 109 HB VAL 109 -7.200 -2.681 0.761 861 1HG1 VAL 109 HG11 VAL 109 -7.793 -3.467 -1.261 862 2HG1 VAL 109 HG12 VAL 109 -8.249 -1.795 -1.589 863 3HG1 VAL 109 HG13 VAL 109 -9.474 -2.960 -1.087 864 1HG2 VAL 109 HG21 VAL 109 -8.531 -0.312 -0.225 865 2HG2 VAL 109 HG22 VAL 109 -7.185 -0.456 0.906 866 3HG2 VAL 109 HG23 VAL 109 -8.845 -0.533 1.496 867 H TYR 110 HN TYR 110 -8.545 -4.663 3.145 868 HA TYR 110 HA TYR 110 -8.867 -2.941 5.425 869 1HB TYR 110 HB2 TYR 110 -9.467 -5.090 5.964 870 2HB TYR 110 HB1 TYR 110 -8.269 -5.808 4.900 871 HD1 TYR 110 HD1 TYR 110 -6.475 -6.883 5.855 872 HD2 TYR 110 HD2 TYR 110 -8.475 -3.859 8.068 873 HE1 TYR 110 HE1 TYR 110 -5.082 -7.414 7.804 874 HE2 TYR 110 HE2 TYR 110 -7.105 -4.362 10.031 875 HH TYR 110 HH TYR 110 -5.235 -7.156 10.302 876 H LEU 111 HN LEU 111 -7.382 -1.369 5.628 877 HA LEU 111 HA LEU 111 -4.604 -1.858 4.952 878 1HB LEU 111 HB2 LEU 111 -6.278 0.390 4.944 879 2HB LEU 111 HB1 LEU 111 -5.099 0.696 6.202 880 HG LEU 111 HG LEU 111 -4.040 1.644 4.401 881 1HD1 LEU 111 HD11 LEU 111 -3.030 -1.062 3.708 882 2HD1 LEU 111 HD12 LEU 111 -2.812 -0.488 5.361 883 3HD1 LEU 111 HD13 LEU 111 -2.150 0.436 4.013 884 1HD2 LEU 111 HD21 LEU 111 -4.983 -0.577 2.596 885 2HD2 LEU 111 HD22 LEU 111 -4.225 0.944 2.125 886 3HD2 LEU 111 HD23 LEU 111 -5.844 0.946 2.825 887 H ALA 112 HN ALA 112 -3.031 -2.319 6.346 888 HA ALA 112 HA ALA 112 -3.230 -1.473 9.108 889 1HB ALA 112 HB1 ALA 112 -4.513 -3.448 9.321 890 2HB ALA 112 HB2 ALA 112 -2.916 -3.807 9.978 891 3HB ALA 112 HB3 ALA 112 -3.358 -4.384 8.371 892 H TRP 113 HN TRP 113 -1.324 -1.523 10.249 893 HA TRP 113 HA TRP 113 1.056 -2.721 9.133 894 1HB TRP 113 HB2 TRP 113 1.163 -0.637 7.940 895 2HB TRP 113 HB1 TRP 113 0.762 0.280 9.389 896 HD1 TRP 113 HD1 TRP 113 2.890 1.677 9.802 897 HE1 TRP 113 HE1 TRP 113 5.384 1.155 10.145 898 HE3 TRP 113 HE3 TRP 113 2.842 -3.322 8.703 899 HZ2 TRP 113 HZ2 TRP 113 7.103 -1.069 9.972 900 HZ3 TRP 113 HZ3 TRP 113 4.958 -4.571 8.815 901 HH2 TRP 113 HH2 TRP 113 7.045 -3.466 9.437 902 H VAL 114 HN VAL 114 2.337 -3.406 10.705 903 HA VAL 114 HA VAL 114 1.845 -2.434 13.442 904 HB VAL 114 HB VAL 114 2.908 -5.110 12.517 905 1HG1 VAL 114 HG11 VAL 114 2.668 -3.855 15.210 906 2HG1 VAL 114 HG12 VAL 114 3.944 -4.880 14.555 907 3HG1 VAL 114 HG13 VAL 114 2.408 -5.592 15.050 908 1HG2 VAL 114 HG21 VAL 114 0.485 -5.117 14.111 909 2HG2 VAL 114 HG22 VAL 114 0.826 -5.899 12.568 910 3HG2 VAL 114 HG23 VAL 114 0.292 -4.218 12.606 911 HA PRO 115 HA PRO 115 5.820 -0.448 13.596 912 1HB PRO 115 HB2 PRO 115 5.910 -1.922 16.208 913 2HB PRO 115 HB1 PRO 115 6.357 -0.249 15.852 914 1HG PRO 115 HG2 PRO 115 4.009 -0.827 16.980 915 2HG PRO 115 HG1 PRO 115 4.155 0.465 15.774 916 1HD PRO 115 HD2 PRO 115 2.902 -2.204 15.534 917 2HD PRO 115 HD1 PRO 115 2.584 -0.719 14.616 918 H ALA 116 HN ALA 116 7.269 -1.312 12.245 919 HA ALA 116 HA ALA 116 9.218 -3.127 13.067 920 1HB ALA 116 HB1 ALA 116 6.948 -4.531 12.526 921 2HB ALA 116 HB2 ALA 116 8.582 -5.185 12.422 922 3HB ALA 116 HB3 ALA 116 7.778 -4.589 10.970 923 H HIS 117 HN HIS 117 9.842 -4.332 10.576 924 HA HIS 117 HA HIS 117 9.748 -2.603 8.376 925 1HB HIS 117 HB2 HIS 117 11.579 -1.754 10.388 926 2HB HIS 117 HB1 HIS 117 12.519 -2.343 9.021 927 HD1 HIS 117 HD1 HIS 117 9.250 -0.422 8.878 928 HD2 HIS 117 HD2 HIS 117 13.252 -0.001 7.846 929 HE1 HIS 117 HE1 HIS 117 9.391 1.738 7.599 930 HE2 HIS 117 HE2 HIS 117 11.837 2.017 7.064 931 H LYS 118 HN LYS 118 9.448 -5.300 8.637 932 HA LYS 118 HA LYS 118 11.816 -6.334 7.226 933 1HB LYS 118 HB2 LYS 118 11.662 -8.429 8.339 934 2HB LYS 118 HB1 LYS 118 11.599 -7.193 9.586 935 1HG LYS 118 HG2 LYS 118 9.028 -8.199 8.496 936 2HG LYS 118 HG1 LYS 118 9.950 -9.252 9.572 937 1HD LYS 118 HD2 LYS 118 9.790 -7.765 11.360 938 2HD LYS 118 HD1 LYS 118 9.394 -6.401 10.312 939 1HE LYS 118 HE2 LYS 118 7.237 -6.774 10.670 940 2HE LYS 118 HE1 LYS 118 7.400 -8.359 9.915 941 1HZ LYS 118 HZ1 LYS 118 8.367 -8.841 12.357 942 2HZ LYS 118 HZ2 LYS 118 6.748 -9.074 11.925 943 3HZ LYS 118 HZ3 LYS 118 7.213 -7.656 12.718 944 H GLY 119 HN GLY 119 8.500 -5.769 7.160 945 1HA GLY 119 HA2 GLY 119 7.625 -6.126 4.809 946 2HA GLY 119 HA1 GLY 119 8.101 -7.800 5.050 947 H ILE 120 HN ILE 120 5.865 -8.371 4.619 948 HA ILE 120 HA ILE 120 4.373 -8.559 7.049 949 HB ILE 120 HB ILE 120 3.570 -6.408 6.580 950 1HG1 ILE 120 HG12 ILE 120 1.155 -6.844 5.886 951 2HG1 ILE 120 HG11 ILE 120 1.631 -8.524 5.663 952 1HG2 ILE 120 HG21 ILE 120 2.370 -6.583 4.017 953 2HG2 ILE 120 HG22 ILE 120 4.056 -7.079 3.880 954 3HG2 ILE 120 HG23 ILE 120 3.653 -5.506 4.569 955 1HD1 ILE 120 HD11 ILE 120 2.570 -7.994 8.168 956 2HD1 ILE 120 HD12 ILE 120 1.029 -8.767 7.794 957 3HD1 ILE 120 HD13 ILE 120 1.093 -7.032 8.107 958 H GLY 121 HN GLY 121 2.933 -8.557 3.801 959 1HA GLY 121 HA2 GLY 121 1.697 -11.038 4.126 960 2HA GLY 121 HA1 GLY 121 1.978 -10.252 2.579 961 H GLY 122 HN GLY 122 4.391 -10.396 1.876 962 1HA GLY 122 HA2 GLY 122 5.063 -13.239 1.957 963 2HA GLY 122 HA1 GLY 122 5.700 -12.051 0.828 964 H ASN 123 HN ASN 123 6.897 -10.192 2.156 965 HA ASN 123 HA ASN 123 8.943 -9.727 3.048 966 1HB ASN 123 HB2 ASN 123 9.039 -9.949 5.421 967 2HB ASN 123 HB1 ASN 123 7.352 -9.686 4.997 968 1HD2 ASN 123 HD21 ASN 123 5.868 -11.304 5.327 969 2HD2 ASN 123 HD22 ASN 123 6.225 -12.736 6.225 970 H GLU 124 HN GLU 124 8.840 -12.209 1.501 971 HA GLU 124 HA GLU 124 11.209 -13.497 2.674 972 1HB GLU 124 HB2 GLU 124 10.390 -15.675 1.754 973 2HB GLU 124 HB1 GLU 124 9.415 -15.041 3.072 974 1HG GLU 124 HG2 GLU 124 7.659 -14.461 1.657 975 2HG GLU 124 HG1 GLU 124 8.673 -14.540 0.217 976 H GLN 125 HN GLN 125 9.440 -12.446 -0.127 977 HA GLN 125 HA GLN 125 11.530 -13.358 -1.948 978 1HB GLN 125 HB2 GLN 125 8.830 -13.186 -2.250 979 2HB GLN 125 HB1 GLN 125 9.344 -11.680 -2.996 980 1HG GLN 125 HG2 GLN 125 9.977 -12.740 -4.830 981 2HG GLN 125 HG1 GLN 125 11.004 -13.833 -3.902 982 1HE2 GLN 125 HE21 GLN 125 9.765 -15.588 -2.736 983 2HE2 GLN 125 HE22 GLN 125 8.506 -16.366 -3.626 984 H VAL 126 HN VAL 126 13.287 -12.068 -1.547 985 HA VAL 126 HA VAL 126 14.638 -10.237 -1.611 986 HB VAL 126 HB VAL 126 12.593 -8.905 -3.371 987 1HG1 VAL 126 HG11 VAL 126 14.323 -7.418 -3.037 988 2HG1 VAL 126 HG12 VAL 126 14.847 -8.249 -4.502 989 3HG1 VAL 126 HG13 VAL 126 15.540 -8.691 -2.941 990 1HG2 VAL 126 HG21 VAL 126 14.103 -11.371 -3.865 991 2HG2 VAL 126 HG22 VAL 126 14.249 -10.150 -5.128 992 3HG2 VAL 126 HG23 VAL 126 12.658 -10.746 -4.658 993 H ASP 127 HN ASP 127 14.241 -9.759 0.614 994 HA ASP 127 HA ASP 127 13.295 -7.103 1.041 995 1HB ASP 127 HB2 ASP 127 11.268 -8.912 1.102 996 2HB ASP 127 HB1 ASP 127 11.771 -8.929 2.790 997 H LYS 128 HN LYS 128 14.702 -10.050 2.112 998 HA LYS 128 HA LYS 128 16.120 -8.608 4.208 999 1HB LYS 128 HB2 LYS 128 15.722 -10.649 5.744 1000 2HB LYS 128 HB1 LYS 128 14.450 -9.443 5.603 1001 1HG LYS 128 HG2 LYS 128 13.075 -11.128 5.165 1002 2HG LYS 128 HG1 LYS 128 13.866 -11.241 3.591 1003 1HD LYS 128 HD2 LYS 128 14.996 -13.116 4.150 1004 2HD LYS 128 HD1 LYS 128 15.257 -12.585 5.812 1005 1HE LYS 128 HE2 LYS 128 12.469 -13.207 5.102 1006 2HE LYS 128 HE1 LYS 128 13.576 -14.579 5.097 1007 1HZ LYS 128 HZ1 LYS 128 13.388 -14.644 7.287 1008 2HZ LYS 128 HZ2 LYS 128 12.422 -13.256 7.299 1009 3HZ LYS 128 HZ3 LYS 128 14.104 -13.114 7.396 1010 H LEU 129 HN LEU 129 16.739 -9.817 1.587 1011 HA LEU 129 HA LEU 129 18.468 -12.059 2.289 1012 1HB LEU 129 HB2 LEU 129 17.363 -10.926 -0.212 1013 2HB LEU 129 HB1 LEU 129 18.948 -11.663 -0.330 1014 HG LEU 129 HG LEU 129 16.750 -13.194 0.990 1015 1HD1 LEU 129 HD11 LEU 129 15.676 -13.777 -0.925 1016 2HD1 LEU 129 HD12 LEU 129 17.094 -13.504 -1.938 1017 3HD1 LEU 129 HD13 LEU 129 16.143 -12.134 -1.365 1018 1HD2 LEU 129 HD21 LEU 129 18.024 -15.031 -0.279 1019 2HD2 LEU 129 HD22 LEU 129 18.804 -14.288 1.117 1020 3HD2 LEU 129 HD23 LEU 129 19.270 -13.807 -0.515 1021 H VAL 130 HN VAL 130 18.669 -8.773 2.331 1022 HA VAL 130 HA VAL 130 20.351 -7.240 2.338 1023 HB VAL 130 HB VAL 130 22.326 -9.423 2.891 1024 1HG1 VAL 130 HG11 VAL 130 23.009 -7.041 2.809 1025 2HG1 VAL 130 HG12 VAL 130 23.293 -7.799 4.376 1026 3HG1 VAL 130 HG13 VAL 130 21.917 -6.718 4.155 1027 1HG2 VAL 130 HG21 VAL 130 20.072 -8.555 4.681 1028 2HG2 VAL 130 HG22 VAL 130 21.563 -9.252 5.314 1029 3HG2 VAL 130 HG23 VAL 130 20.543 -10.191 4.222 1030 H SER 131 HN SER 131 19.792 -7.770 -0.184 1031 HA SER 131 HA SER 131 22.212 -8.567 -1.597 1032 1HB SER 131 HB2 SER 131 20.837 -8.379 -3.630 1033 2HB SER 131 HB1 SER 131 20.053 -9.399 -2.424 1034 HG SER 131 HG SER 131 18.891 -7.418 -1.811 1035 H ALA 132 HN ALA 132 21.566 -5.931 -0.038 1036 HA ALA 132 HA ALA 132 22.151 -3.738 -0.157 1037 1HB ALA 132 HB1 ALA 132 24.328 -4.747 -0.733 1038 2HB ALA 132 HB2 ALA 132 24.089 -3.166 -1.476 1039 3HB ALA 132 HB3 ALA 132 23.904 -4.629 -2.441 1040 H GLY 133 HN GLY 133 22.595 -1.896 -2.003 1041 1HA GLY 133 HA2 GLY 133 21.624 -1.572 -4.394 1042 2HA GLY 133 HA1 GLY 133 20.112 -1.926 -3.572 1043 H ILE 134 HN ILE 134 19.984 0.354 -4.752 1044 HA ILE 134 HA ILE 134 20.877 2.474 -2.936 1045 HB ILE 134 HB ILE 134 19.398 3.043 -5.470 1046 1HG1 ILE 134 HG12 ILE 134 22.100 3.119 -6.159 1047 2HG1 ILE 134 HG11 ILE 134 21.914 1.595 -5.298 1048 1HG2 ILE 134 HG21 ILE 134 20.403 4.659 -3.588 1049 2HG2 ILE 134 HG22 ILE 134 20.289 5.116 -5.289 1050 3HG2 ILE 134 HG23 ILE 134 21.816 4.523 -4.636 1051 1HD1 ILE 134 HD11 ILE 134 19.879 1.253 -6.862 1052 2HD1 ILE 134 HD12 ILE 134 21.510 0.996 -7.481 1053 3HD1 ILE 134 HD13 ILE 134 20.655 2.494 -7.847 1054 H ARG 135 HN ARG 135 18.575 0.515 -2.554 1055 HA ARG 135 HA ARG 135 16.461 2.522 -2.149 1056 1HB ARG 135 HB2 ARG 135 14.857 1.033 -2.769 1057 2HB ARG 135 HB1 ARG 135 16.189 0.364 -3.697 1058 1HG ARG 135 HG2 ARG 135 15.959 -0.704 -0.979 1059 2HG ARG 135 HG1 ARG 135 14.582 -1.047 -2.024 1060 1HD ARG 135 HD2 ARG 135 15.849 -2.269 -3.518 1061 2HD ARG 135 HD1 ARG 135 17.353 -1.480 -3.047 1062 HE ARG 135 HE ARG 135 17.403 -2.848 -1.089 1063 1HH1 ARG 135 HH11 ARG 135 14.931 -3.704 -3.396 1064 2HH1 ARG 135 HH12 ARG 135 14.727 -5.308 -2.773 1065 1HH2 ARG 135 HH21 ARG 135 17.137 -4.955 -0.263 1066 2HH2 ARG 135 HH22 ARG 135 15.980 -6.019 -0.993 1067 H LYS 136 HN LYS 136 15.508 2.705 -0.161 1068 HA LYS 136 HA LYS 136 15.878 0.796 1.924 1069 1HB LYS 136 HB2 LYS 136 17.248 2.152 3.418 1070 2HB LYS 136 HB1 LYS 136 18.119 1.789 1.935 1071 1HG LYS 136 HG2 LYS 136 17.960 3.973 1.158 1072 2HG LYS 136 HG1 LYS 136 16.625 4.363 2.243 1073 1HD LYS 136 HD2 LYS 136 18.101 5.196 3.687 1074 2HD LYS 136 HD1 LYS 136 18.775 3.577 3.878 1075 1HE LYS 136 HE2 LYS 136 20.323 3.964 2.065 1076 2HE LYS 136 HE1 LYS 136 19.594 5.535 1.738 1077 1HZ LYS 136 HZ1 LYS 136 21.739 5.437 3.111 1078 2HZ LYS 136 HZ2 LYS 136 20.746 4.937 4.385 1079 3HZ LYS 136 HZ3 LYS 136 20.489 6.440 3.655 1080 H VAL 137 HN VAL 137 14.515 1.138 3.634 1081 HA VAL 137 HA VAL 137 12.605 3.335 3.297 1082 HB VAL 137 HB VAL 137 12.229 1.059 5.216 1083 1HG1 VAL 137 HG11 VAL 137 9.898 1.495 4.880 1084 2HG1 VAL 137 HG12 VAL 137 10.247 2.612 3.561 1085 3HG1 VAL 137 HG13 VAL 137 10.703 3.027 5.213 1086 1HG2 VAL 137 HG21 VAL 137 12.106 0.970 2.245 1087 2HG2 VAL 137 HG22 VAL 137 10.880 0.093 3.162 1088 3HG2 VAL 137 HG23 VAL 137 12.589 -0.278 3.394 1089 H LEU 138 HN LEU 138 12.299 4.886 4.803 1090 HA LEU 138 HA LEU 138 13.895 4.699 7.273 1091 1HB LEU 138 HB2 LEU 138 13.391 7.036 5.450 1092 2HB LEU 138 HB1 LEU 138 13.880 7.267 7.118 1093 HG LEU 138 HG LEU 138 15.553 5.457 5.461 1094 1HD1 LEU 138 HD11 LEU 138 15.309 8.411 5.034 1095 2HD1 LEU 138 HD12 LEU 138 15.390 7.116 3.840 1096 3HD1 LEU 138 HD13 LEU 138 16.831 7.567 4.749 1097 1HD2 LEU 138 HD21 LEU 138 16.894 7.503 6.972 1098 2HD2 LEU 138 HD22 LEU 138 16.959 5.750 7.155 1099 3HD2 LEU 138 HD23 LEU 138 15.702 6.676 7.974 Start of MODEL 3 1 1H MET 1 HT1 MET 1 -23.271 4.077 0.616 2 2H MET 1 HT2 MET 1 -21.677 4.642 0.631 3 3H MET 1 HT3 MET 1 -22.930 5.634 1.188 4 HA MET 1 HA MET 1 -23.369 4.060 2.991 5 1HB MET 1 HB2 MET 1 -22.463 2.106 1.770 6 2HB MET 1 HB1 MET 1 -20.842 2.758 1.954 7 1HG MET 1 HG2 MET 1 -20.863 1.297 3.688 8 2HG MET 1 HG1 MET 1 -21.489 2.728 4.506 9 1HE MET 1 HE1 MET 1 -22.237 0.543 6.314 10 2HE MET 1 HE2 MET 1 -21.672 -0.551 5.051 11 3HE MET 1 HE3 MET 1 -23.292 -0.741 5.722 12 H ASN 2 HN ASN 2 -19.865 4.214 2.462 13 HA ASN 2 HA ASN 2 -19.568 5.789 4.869 14 1HB ASN 2 HB2 ASN 2 -17.953 4.023 4.484 15 2HB ASN 2 HB1 ASN 2 -17.527 4.705 2.914 16 1HD2 ASN 2 HD21 ASN 2 -15.429 5.145 3.267 17 2HD2 ASN 2 HD22 ASN 2 -14.855 6.268 4.448 18 H GLU 3 HN GLU 3 -17.470 6.349 2.163 19 HA GLU 3 HA GLU 3 -18.571 9.046 1.820 20 1HB GLU 3 HB2 GLU 3 -16.208 8.478 3.170 21 2HB GLU 3 HB1 GLU 3 -15.670 8.932 1.558 22 1HG GLU 3 HG2 GLU 3 -15.917 11.058 2.080 23 2HG GLU 3 HG1 GLU 3 -17.641 10.793 2.338 24 H LEU 4 HN LEU 4 -16.381 6.559 0.556 25 HA LEU 4 HA LEU 4 -17.386 6.987 -2.118 26 1HB LEU 4 HB2 LEU 4 -15.144 8.393 -1.279 27 2HB LEU 4 HB1 LEU 4 -14.484 7.038 -2.168 28 HG LEU 4 HG LEU 4 -15.571 7.690 -4.177 29 1HD1 LEU 4 HD11 LEU 4 -17.033 9.816 -2.618 30 2HD1 LEU 4 HD12 LEU 4 -17.741 8.294 -3.158 31 3HD1 LEU 4 HD13 LEU 4 -17.182 9.475 -4.342 32 1HD2 LEU 4 HD21 LEU 4 -14.783 10.024 -4.476 33 2HD2 LEU 4 HD22 LEU 4 -13.585 8.963 -3.737 34 3HD2 LEU 4 HD23 LEU 4 -14.486 10.105 -2.740 35 H TYR 5 HN TYR 5 -16.960 4.892 0.082 36 HA TYR 5 HA TYR 5 -16.816 2.623 -1.453 37 1HB TYR 5 HB2 TYR 5 -14.549 1.739 -0.820 38 2HB TYR 5 HB1 TYR 5 -14.506 3.068 -1.971 39 HD1 TYR 5 HD1 TYR 5 -13.252 4.985 -1.523 40 HD2 TYR 5 HD2 TYR 5 -14.097 2.269 1.641 41 HE1 TYR 5 HE1 TYR 5 -11.707 6.220 -0.064 42 HE2 TYR 5 HE2 TYR 5 -12.535 3.495 3.124 43 HH TYR 5 HH TYR 5 -11.623 5.881 3.233 44 H GLN 6 HN GLN 6 -16.009 0.681 0.156 45 HA GLN 6 HA GLN 6 -17.715 1.052 2.450 46 1HB GLN 6 HB2 GLN 6 -16.346 -1.306 1.218 47 2HB GLN 6 HB1 GLN 6 -17.045 -1.422 2.833 48 1HG GLN 6 HG2 GLN 6 -18.903 -2.010 1.716 49 2HG GLN 6 HG1 GLN 6 -19.082 -0.267 1.501 50 1HE2 GLN 6 HE21 GLN 6 -16.707 -0.304 -0.321 51 2HE2 GLN 6 HE22 GLN 6 -17.333 -0.853 -1.831 52 H LEU 7 HN LEU 7 -17.028 1.853 4.270 53 HA LEU 7 HA LEU 7 -14.263 2.080 4.924 54 1HB LEU 7 HB2 LEU 7 -16.585 3.378 5.661 55 2HB LEU 7 HB1 LEU 7 -16.134 2.519 7.120 56 HG LEU 7 HG LEU 7 -14.477 4.558 5.629 57 1HD1 LEU 7 HD11 LEU 7 -14.731 5.180 8.343 58 2HD1 LEU 7 HD12 LEU 7 -16.340 4.682 7.817 59 3HD1 LEU 7 HD13 LEU 7 -15.504 5.990 6.979 60 1HD2 LEU 7 HD21 LEU 7 -13.380 2.425 6.820 61 2HD2 LEU 7 HD22 LEU 7 -13.568 3.477 8.223 62 3HD2 LEU 7 HD23 LEU 7 -12.638 4.025 6.827 63 H GLU 8 HN GLU 8 -13.208 0.243 5.377 64 HA GLU 8 HA GLU 8 -14.293 -1.445 7.532 65 1HB GLU 8 HB2 GLU 8 -13.999 -3.276 6.299 66 2HB GLU 8 HB1 GLU 8 -13.724 -2.216 4.927 67 1HG GLU 8 HG2 GLU 8 -11.308 -2.629 6.486 68 2HG GLU 8 HG1 GLU 8 -12.005 -4.140 5.911 69 H LYS 9 HN LYS 9 -11.111 -0.865 5.970 70 HA LYS 9 HA LYS 9 -9.060 -0.410 6.822 71 1HB LYS 9 HB2 LYS 9 -10.583 0.813 9.107 72 2HB LYS 9 HB1 LYS 9 -8.928 1.168 8.631 73 1HG LYS 9 HG2 LYS 9 -11.482 2.031 7.401 74 2HG LYS 9 HG1 LYS 9 -9.997 2.923 7.687 75 1HD LYS 9 HD2 LYS 9 -8.966 2.085 5.775 76 2HD LYS 9 HD1 LYS 9 -10.092 0.734 5.649 77 1HE LYS 9 HE2 LYS 9 -11.432 1.914 4.328 78 2HE LYS 9 HE1 LYS 9 -11.537 3.203 5.527 79 1HZ LYS 9 HZ1 LYS 9 -10.460 3.516 3.114 80 2HZ LYS 9 HZ2 LYS 9 -9.074 3.108 3.994 81 3HZ LYS 9 HZ3 LYS 9 -10.011 4.437 4.460 82 H GLU 10 HN GLU 10 -11.126 -2.457 8.534 83 HA GLU 10 HA GLU 10 -8.853 -3.594 9.989 84 1HB GLU 10 HB2 GLU 10 -10.826 -4.056 11.785 85 2HB GLU 10 HB1 GLU 10 -9.724 -2.688 11.880 86 1HG GLU 10 HG2 GLU 10 -11.304 -1.191 11.152 87 2HG GLU 10 HG1 GLU 10 -12.256 -2.433 10.341 88 HA PRO 11 HA PRO 11 -10.006 -7.832 9.196 89 1HB PRO 11 HB2 PRO 11 -11.897 -8.196 11.364 90 2HB PRO 11 HB1 PRO 11 -10.315 -8.943 11.134 91 1HG PRO 11 HG2 PRO 11 -11.050 -6.581 12.725 92 2HG PRO 11 HG1 PRO 11 -9.615 -7.613 12.849 93 1HD PRO 11 HD2 PRO 11 -9.456 -5.104 11.924 94 2HD PRO 11 HD1 PRO 11 -8.466 -6.405 11.221 95 H ILE 12 HN ILE 12 -11.203 -7.904 7.420 96 HA ILE 12 HA ILE 12 -13.880 -6.827 7.311 97 HB ILE 12 HB ILE 12 -12.484 -8.503 5.225 98 1HG1 ILE 12 HG12 ILE 12 -12.491 -5.515 5.147 99 2HG1 ILE 12 HG11 ILE 12 -11.313 -6.332 6.169 100 1HG2 ILE 12 HG21 ILE 12 -13.972 -6.820 3.827 101 2HG2 ILE 12 HG22 ILE 12 -14.923 -6.817 5.312 102 3HG2 ILE 12 HG23 ILE 12 -14.620 -8.332 4.461 103 1HD1 ILE 12 HD11 ILE 12 -11.662 -6.798 3.218 104 2HD1 ILE 12 HD12 ILE 12 -10.442 -7.530 4.261 105 3HD1 ILE 12 HD13 ILE 12 -10.418 -5.793 3.960 106 H VAL 13 HN VAL 13 -15.763 -8.006 7.040 107 HA VAL 13 HA VAL 13 -16.263 -10.237 8.494 108 HB VAL 13 HB VAL 13 -17.709 -9.903 5.886 109 1HG1 VAL 13 HG11 VAL 13 -19.241 -10.193 8.340 110 2HG1 VAL 13 HG12 VAL 13 -18.101 -11.514 8.088 111 3HG1 VAL 13 HG13 VAL 13 -19.299 -11.135 6.850 112 1HG2 VAL 13 HG21 VAL 13 -19.141 -8.239 7.320 113 2HG2 VAL 13 HG22 VAL 13 -17.718 -7.674 6.445 114 3HG2 VAL 13 HG23 VAL 13 -17.619 -7.995 8.176 115 H GLY 14 HN GLY 14 -15.160 -10.174 5.122 116 1HA GLY 14 HA2 GLY 14 -13.880 -12.673 5.299 117 2HA GLY 14 HA1 GLY 14 -15.460 -12.914 4.575 118 H ALA 15 HN ALA 15 -12.436 -11.101 4.236 119 HA ALA 15 HA ALA 15 -12.934 -10.959 1.331 120 1HB ALA 15 HB1 ALA 15 -11.013 -9.127 2.686 121 2HB ALA 15 HB2 ALA 15 -12.745 -8.812 2.815 122 3HB ALA 15 HB3 ALA 15 -11.976 -8.876 1.231 123 H GLU 16 HN GLU 16 -11.001 -11.059 -0.048 124 HA GLU 16 HA GLU 16 -9.248 -13.186 0.804 125 1HB GLU 16 HB2 GLU 16 -8.347 -13.109 -1.451 126 2HB GLU 16 HB1 GLU 16 -10.104 -13.065 -1.506 127 1HG GLU 16 HG2 GLU 16 -9.672 -10.459 -1.546 128 2HG GLU 16 HG1 GLU 16 -8.126 -10.978 -2.215 129 H THR 17 HN THR 17 -7.007 -13.105 1.116 130 HA THR 17 HA THR 17 -6.043 -10.596 2.146 131 HB THR 17 HB THR 17 -4.369 -11.741 3.185 132 HG1 THR 17 HG1 THR 17 -4.372 -13.733 1.144 133 1HG2 THR 17 HG21 THR 17 -5.598 -14.348 2.842 134 2HG2 THR 17 HG22 THR 17 -6.798 -13.084 3.110 135 3HG2 THR 17 HG23 THR 17 -5.499 -13.328 4.278 136 H PHE 18 HN PHE 18 -4.436 -9.372 1.548 137 HA PHE 18 HA PHE 18 -3.116 -9.829 -1.020 138 1HB PHE 18 HB2 PHE 18 -5.116 -7.778 -0.334 139 2HB PHE 18 HB1 PHE 18 -3.678 -7.163 -1.117 140 HD1 PHE 18 HD1 PHE 18 -6.124 -9.944 -1.486 141 HD2 PHE 18 HD2 PHE 18 -3.703 -7.028 -3.414 142 HE1 PHE 18 HE1 PHE 18 -7.068 -10.608 -3.656 143 HE2 PHE 18 HE2 PHE 18 -4.644 -7.684 -5.591 144 HZ PHE 18 HZ PHE 18 -6.329 -9.476 -5.714 145 H TYR 19 HN TYR 19 -1.120 -8.755 -1.239 146 HA TYR 19 HA TYR 19 -0.120 -7.515 1.240 147 1HB TYR 19 HB2 TYR 19 1.132 -9.469 1.124 148 2HB TYR 19 HB1 TYR 19 1.128 -9.491 -0.633 149 HD1 TYR 19 HD1 TYR 19 2.503 -7.557 -1.767 150 HD2 TYR 19 HD2 TYR 19 3.126 -8.875 2.245 151 HE1 TYR 19 HE1 TYR 19 4.756 -6.580 -1.797 152 HE2 TYR 19 HE2 TYR 19 5.376 -7.890 2.211 153 HH TYR 19 HH TYR 19 6.449 -5.780 0.637 154 H VAL 20 HN VAL 20 1.368 -5.820 1.066 155 HA VAL 20 HA VAL 20 2.132 -4.767 -1.474 156 HB VAL 20 HB VAL 20 0.262 -3.586 -1.846 157 1HG1 VAL 20 HG11 VAL 20 -1.216 -2.856 0.209 158 2HG1 VAL 20 HG12 VAL 20 -0.329 -4.155 1.007 159 3HG1 VAL 20 HG13 VAL 20 -1.280 -4.495 -0.437 160 1HG2 VAL 20 HG21 VAL 20 2.002 -2.034 -0.160 161 2HG2 VAL 20 HG22 VAL 20 0.326 -1.522 0.023 162 3HG2 VAL 20 HG23 VAL 20 1.072 -1.543 -1.571 163 H ASP 21 HN ASP 21 4.067 -3.910 -1.189 164 HA ASP 21 HA ASP 21 4.745 -2.103 0.867 165 1HB ASP 21 HB2 ASP 21 4.784 -3.960 2.359 166 2HB ASP 21 HB1 ASP 21 5.654 -4.961 1.199 167 H GLY 22 HN GLY 22 6.585 -1.003 0.370 168 1HA GLY 22 HA2 GLY 22 8.456 -2.156 -1.562 169 2HA GLY 22 HA1 GLY 22 7.659 -0.650 -1.990 170 H ALA 23 HN ALA 23 10.501 -1.144 -1.627 171 HA ALA 23 HA ALA 23 11.023 0.672 0.649 172 1HB ALA 23 HB1 ALA 23 13.360 -0.344 0.569 173 2HB ALA 23 HB2 ALA 23 12.654 -1.606 -0.440 174 3HB ALA 23 HB3 ALA 23 12.066 -1.360 1.205 175 H ALA 24 HN ALA 24 11.417 2.610 -0.015 176 HA ALA 24 HA ALA 24 13.278 3.051 -2.212 177 1HB ALA 24 HB1 ALA 24 10.988 4.910 -2.105 178 2HB ALA 24 HB2 ALA 24 10.640 3.287 -2.701 179 3HB ALA 24 HB3 ALA 24 11.869 4.272 -3.493 180 H ASN 25 HN ASN 25 14.761 4.503 -1.667 181 HA ASN 25 HA ASN 25 15.083 5.530 0.846 182 1HB ASN 25 HB2 ASN 25 16.524 5.586 -1.488 183 2HB ASN 25 HB1 ASN 25 16.109 7.284 -1.296 184 1HD2 ASN 25 HD21 ASN 25 16.300 7.892 1.203 185 2HD2 ASN 25 HD22 ASN 25 17.848 7.521 1.874 186 H ARG 26 HN ARG 26 13.966 6.987 1.975 187 HA ARG 26 HA ARG 26 11.957 8.626 0.798 188 1HB ARG 26 HB2 ARG 26 12.329 7.691 3.279 189 2HB ARG 26 HB1 ARG 26 13.000 9.306 3.488 190 1HG ARG 26 HG2 ARG 26 10.270 8.707 2.393 191 2HG ARG 26 HG1 ARG 26 10.621 9.163 4.061 192 1HD ARG 26 HD2 ARG 26 11.857 11.062 2.375 193 2HD ARG 26 HD1 ARG 26 10.207 10.830 1.797 194 HE ARG 26 HE ARG 26 10.480 11.231 4.652 195 1HH1 ARG 26 HH11 ARG 26 9.923 12.694 1.539 196 2HH1 ARG 26 HH12 ARG 26 9.154 14.101 2.195 197 1HH2 ARG 26 HH21 ARG 26 9.470 13.079 5.524 198 2HH2 ARG 26 HH22 ARG 26 8.895 14.319 4.460 199 H GLU 27 HN GLU 27 15.111 9.318 2.249 200 HA GLU 27 HA GLU 27 15.218 12.014 2.198 201 1HB GLU 27 HB2 GLU 27 17.050 10.032 2.547 202 2HB GLU 27 HB1 GLU 27 17.617 10.748 1.049 203 1HG GLU 27 HG2 GLU 27 16.971 12.741 3.056 204 2HG GLU 27 HG1 GLU 27 18.211 11.607 3.591 205 H THR 28 HN THR 28 15.624 9.865 -0.561 206 HA THR 28 HA THR 28 15.716 12.202 -2.348 207 HB THR 28 HB THR 28 16.296 9.920 -3.859 208 HG1 THR 28 HG1 THR 28 17.812 8.813 -2.675 209 1HG2 THR 28 HG21 THR 28 17.356 12.412 -3.420 210 2HG2 THR 28 HG22 THR 28 18.033 11.184 -4.489 211 3HG2 THR 28 HG23 THR 28 18.632 11.342 -2.837 212 H LYS 29 HN LYS 29 13.603 9.955 -1.167 213 HA LYS 29 HA LYS 29 11.624 9.051 -1.860 214 1HB LYS 29 HB2 LYS 29 11.567 11.441 -3.716 215 2HB LYS 29 HB1 LYS 29 10.184 10.521 -3.142 216 1HG LYS 29 HG2 LYS 29 10.035 12.231 -1.683 217 2HG LYS 29 HG1 LYS 29 11.212 11.268 -0.785 218 1HD LYS 29 HD2 LYS 29 12.929 12.689 -1.246 219 2HD LYS 29 HD1 LYS 29 12.273 13.145 -2.820 220 1HE LYS 29 HE2 LYS 29 12.154 15.056 -1.390 221 2HE LYS 29 HE1 LYS 29 10.515 14.451 -1.626 222 1HZ LYS 29 HZ1 LYS 29 10.317 14.332 0.562 223 2HZ LYS 29 HZ2 LYS 29 11.922 14.815 0.783 224 3HZ LYS 29 HZ3 LYS 29 11.551 13.175 0.617 225 H LEU 30 HN LEU 30 13.215 7.445 -2.819 226 HA LEU 30 HA LEU 30 12.381 6.823 -5.502 227 1HB LEU 30 HB2 LEU 30 14.094 8.310 -6.157 228 2HB LEU 30 HB1 LEU 30 15.182 7.732 -4.907 229 HG LEU 30 HG LEU 30 14.322 5.846 -7.064 230 1HD1 LEU 30 HD11 LEU 30 15.384 6.889 -8.709 231 2HD1 LEU 30 HD12 LEU 30 16.811 7.145 -7.705 232 3HD1 LEU 30 HD13 LEU 30 15.485 8.308 -7.666 233 1HD2 LEU 30 HD21 LEU 30 15.612 5.015 -5.159 234 2HD2 LEU 30 HD22 LEU 30 16.879 6.197 -5.497 235 3HD2 LEU 30 HD23 LEU 30 16.542 4.910 -6.656 236 H GLY 31 HN GLY 31 12.709 4.670 -6.055 237 1HA GLY 31 HA2 GLY 31 14.489 2.851 -5.205 238 2HA GLY 31 HA1 GLY 31 13.398 2.936 -3.831 239 H LYS 32 HN LYS 32 12.493 0.950 -3.942 240 HA LYS 32 HA LYS 32 11.047 0.272 -6.417 241 1HB LYS 32 HB2 LYS 32 11.665 -1.906 -4.526 242 2HB LYS 32 HB1 LYS 32 11.706 -1.894 -6.284 243 1HG LYS 32 HG2 LYS 32 13.920 -1.936 -6.088 244 2HG LYS 32 HG1 LYS 32 13.801 -0.244 -5.601 245 1HD LYS 32 HD2 LYS 32 15.021 -1.150 -3.863 246 2HD LYS 32 HD1 LYS 32 13.377 -1.243 -3.232 247 1HE LYS 32 HE2 LYS 32 14.584 -3.530 -4.744 248 2HE LYS 32 HE1 LYS 32 14.904 -3.311 -3.024 249 1HZ LYS 32 HZ1 LYS 32 12.939 -4.178 -2.542 250 2HZ LYS 32 HZ2 LYS 32 12.707 -4.530 -4.180 251 3HZ LYS 32 HZ3 LYS 32 12.134 -3.073 -3.540 252 H ALA 33 HN ALA 33 9.123 -1.048 -6.129 253 HA ALA 33 HA ALA 33 7.861 -1.279 -3.585 254 1HB ALA 33 HB1 ALA 33 7.236 0.917 -3.562 255 2HB ALA 33 HB2 ALA 33 5.885 0.234 -4.467 256 3HB ALA 33 HB3 ALA 33 7.199 1.040 -5.321 257 H GLY 34 HN GLY 34 6.791 -3.129 -3.767 258 1HA GLY 34 HA2 GLY 34 5.217 -3.620 -6.210 259 2HA GLY 34 HA1 GLY 34 6.366 -4.838 -5.678 260 H TYR 35 HN TYR 35 4.460 -6.193 -5.643 261 HA TYR 35 HA TYR 35 3.468 -6.412 -2.976 262 1HB TYR 35 HB2 TYR 35 1.343 -5.633 -3.132 263 2HB TYR 35 HB1 TYR 35 2.035 -4.630 -4.399 264 HD1 TYR 35 HD1 TYR 35 1.637 -5.172 -6.764 265 HD2 TYR 35 HD2 TYR 35 -0.208 -7.399 -3.649 266 HE1 TYR 35 HE1 TYR 35 0.026 -6.086 -8.379 267 HE2 TYR 35 HE2 TYR 35 -1.821 -8.316 -5.254 268 HH TYR 35 HH TYR 35 -2.599 -8.225 -7.343 269 H VAL 36 HN VAL 36 1.803 -8.200 -2.803 270 HA VAL 36 HA VAL 36 1.899 -10.095 -5.000 271 HB VAL 36 HB VAL 36 3.869 -10.739 -3.727 272 1HG1 VAL 36 HG11 VAL 36 3.806 -10.243 -1.542 273 2HG1 VAL 36 HG12 VAL 36 3.093 -11.848 -1.383 274 3HG1 VAL 36 HG13 VAL 36 2.055 -10.424 -1.444 275 1HG2 VAL 36 HG21 VAL 36 3.390 -12.824 -4.301 276 2HG2 VAL 36 HG22 VAL 36 1.675 -12.413 -4.350 277 3HG2 VAL 36 HG23 VAL 36 2.396 -13.009 -2.855 278 H THR 37 HN THR 37 -0.150 -10.495 -5.361 279 HA THR 37 HA THR 37 -2.091 -10.396 -3.199 280 HB THR 37 HB THR 37 -3.018 -9.399 -5.066 281 HG1 THR 37 HG1 THR 37 -3.885 -12.029 -5.630 282 1HG2 THR 37 HG21 THR 37 -1.438 -11.397 -6.564 283 2HG2 THR 37 HG22 THR 37 -1.705 -9.685 -6.890 284 3HG2 THR 37 HG23 THR 37 -2.949 -10.866 -7.302 285 H ASN 38 HN ASN 38 -3.723 -12.052 -2.925 286 HA ASN 38 HA ASN 38 -2.632 -14.574 -2.410 287 1HB ASN 38 HB2 ASN 38 -4.806 -15.253 -1.795 288 2HB ASN 38 HB1 ASN 38 -4.766 -13.523 -1.466 289 1HD2 ASN 38 HD21 ASN 38 -5.129 -12.456 -3.940 290 2HD2 ASN 38 HD22 ASN 38 -6.690 -12.881 -4.544 291 H ARG 39 HN ARG 39 -3.243 -13.295 -5.417 292 HA ARG 39 HA ARG 39 -4.013 -15.831 -6.646 293 1HB ARG 39 HB2 ARG 39 -3.423 -13.285 -8.135 294 2HB ARG 39 HB1 ARG 39 -4.461 -14.622 -8.614 295 1HG ARG 39 HG2 ARG 39 -6.186 -13.955 -7.198 296 2HG ARG 39 HG1 ARG 39 -5.122 -12.930 -6.233 297 1HD ARG 39 HD2 ARG 39 -5.635 -11.185 -7.505 298 2HD ARG 39 HD1 ARG 39 -5.018 -12.030 -8.924 299 HE ARG 39 HE ARG 39 -7.707 -12.744 -8.129 300 1HH1 ARG 39 HH11 ARG 39 -5.703 -10.706 -10.125 301 2HH1 ARG 39 HH12 ARG 39 -6.965 -10.362 -11.261 302 1HH2 ARG 39 HH21 ARG 39 -9.370 -12.299 -9.621 303 2HH2 ARG 39 HH22 ARG 39 -9.048 -11.267 -10.975 304 H GLY 40 HN GLY 40 -1.313 -14.808 -5.426 305 1HA GLY 40 HA2 GLY 40 0.889 -15.357 -5.760 306 2HA GLY 40 HA1 GLY 40 0.360 -16.385 -7.084 307 H ARG 41 HN ARG 41 -0.109 -12.879 -6.764 308 HA ARG 41 HA ARG 41 1.460 -12.596 -9.245 309 1HB ARG 41 HB2 ARG 41 -0.432 -11.591 -9.926 310 2HB ARG 41 HB1 ARG 41 -0.996 -11.329 -8.288 311 1HG ARG 41 HG2 ARG 41 -0.186 -9.212 -8.200 312 2HG ARG 41 HG1 ARG 41 1.244 -9.604 -9.164 313 1HD ARG 41 HD2 ARG 41 -1.550 -8.996 -10.097 314 2HD ARG 41 HD1 ARG 41 -0.047 -8.185 -10.528 315 HE ARG 41 HE ARG 41 -0.249 -10.966 -11.321 316 1HH1 ARG 41 HH11 ARG 41 -0.661 -7.626 -12.233 317 2HH1 ARG 41 HH12 ARG 41 -0.592 -7.951 -13.934 318 1HH2 ARG 41 HH21 ARG 41 -0.161 -11.399 -13.553 319 2HH2 ARG 41 HH22 ARG 41 -0.308 -10.095 -14.683 320 H GLN 42 HN GLN 42 2.999 -10.889 -9.448 321 HA GLN 42 HA GLN 42 3.628 -9.354 -7.064 322 1HB GLN 42 HB2 GLN 42 4.829 -11.700 -7.124 323 2HB GLN 42 HB1 GLN 42 5.906 -10.877 -8.245 324 1HG GLN 42 HG2 GLN 42 6.776 -9.524 -6.642 325 2HG GLN 42 HG1 GLN 42 5.295 -9.519 -5.685 326 1HE2 GLN 42 HE21 GLN 42 4.746 -11.863 -4.901 327 2HE2 GLN 42 HE22 GLN 42 6.059 -12.683 -4.131 328 H LYS 43 HN LYS 43 4.330 -7.382 -7.547 329 HA LYS 43 HA LYS 43 5.580 -6.913 -10.170 330 1HB LYS 43 HB2 LYS 43 4.079 -4.598 -9.346 331 2HB LYS 43 HB1 LYS 43 3.992 -5.498 -10.853 332 1HG LYS 43 HG2 LYS 43 2.650 -6.680 -8.499 333 2HG LYS 43 HG1 LYS 43 1.928 -5.232 -9.208 334 1HD LYS 43 HD2 LYS 43 2.762 -7.397 -11.056 335 2HD LYS 43 HD1 LYS 43 1.336 -7.683 -10.059 336 1HE LYS 43 HE2 LYS 43 0.119 -6.449 -11.446 337 2HE LYS 43 HE1 LYS 43 1.148 -5.058 -11.112 338 1HZ LYS 43 HZ1 LYS 43 1.042 -5.594 -13.483 339 2HZ LYS 43 HZ2 LYS 43 1.695 -7.123 -13.176 340 3HZ LYS 43 HZ3 LYS 43 2.618 -5.736 -12.882 341 H VAL 44 HN VAL 44 6.494 -4.585 -10.210 342 HA VAL 44 HA VAL 44 7.379 -3.529 -7.680 343 HB VAL 44 HB VAL 44 8.987 -5.377 -8.027 344 1HG1 VAL 44 HG11 VAL 44 8.977 -4.396 -10.709 345 2HG1 VAL 44 HG12 VAL 44 9.727 -5.854 -10.061 346 3HG1 VAL 44 HG13 VAL 44 10.620 -4.333 -10.073 347 1HG2 VAL 44 HG21 VAL 44 9.511 -2.899 -7.161 348 2HG2 VAL 44 HG22 VAL 44 10.650 -2.979 -8.505 349 3HG2 VAL 44 HG23 VAL 44 10.726 -4.177 -7.213 350 H VAL 45 HN VAL 45 7.960 -1.383 -7.848 351 HA VAL 45 HA VAL 45 8.415 -0.245 -10.507 352 HB VAL 45 HB VAL 45 6.809 1.591 -10.067 353 1HG1 VAL 45 HG11 VAL 45 5.355 0.453 -11.302 354 2HG1 VAL 45 HG12 VAL 45 4.914 -0.567 -9.932 355 3HG1 VAL 45 HG13 VAL 45 6.280 -1.009 -10.956 356 1HG2 VAL 45 HG21 VAL 45 5.114 0.286 -8.185 357 2HG2 VAL 45 HG22 VAL 45 5.893 1.864 -8.063 358 3HG2 VAL 45 HG23 VAL 45 6.730 0.421 -7.492 359 H THR 46 HN THR 46 9.114 2.036 -10.420 360 HA THR 46 HA THR 46 10.843 2.443 -8.100 361 HB THR 46 HB THR 46 12.062 4.062 -9.444 362 HG1 THR 46 HG1 THR 46 10.698 5.012 -10.826 363 1HG2 THR 46 HG21 THR 46 12.138 1.389 -9.789 364 2HG2 THR 46 HG22 THR 46 13.213 2.509 -10.624 365 3HG2 THR 46 HG23 THR 46 11.771 1.900 -11.435 366 H LEU 47 HN LEU 47 10.741 4.194 -6.792 367 HA LEU 47 HA LEU 47 8.300 5.774 -6.964 368 1HB LEU 47 HB2 LEU 47 10.343 5.399 -4.786 369 2HB LEU 47 HB1 LEU 47 9.041 6.568 -4.670 370 HG LEU 47 HG LEU 47 8.338 4.658 -3.465 371 1HD1 LEU 47 HD11 LEU 47 6.587 5.621 -4.825 372 2HD1 LEU 47 HD12 LEU 47 6.386 3.871 -4.735 373 3HD1 LEU 47 HD13 LEU 47 7.055 4.608 -6.191 374 1HD2 LEU 47 HD21 LEU 47 8.488 2.732 -5.681 375 2HD2 LEU 47 HD22 LEU 47 8.814 2.518 -3.961 376 3HD2 LEU 47 HD23 LEU 47 10.039 3.235 -5.008 377 H THR 48 HN THR 48 8.190 7.960 -7.092 378 HA THR 48 HA THR 48 10.676 9.493 -7.313 379 HB THR 48 HB THR 48 9.477 10.739 -9.272 380 HG1 THR 48 HG1 THR 48 7.622 9.105 -8.890 381 1HG2 THR 48 HG21 THR 48 10.331 8.482 -10.668 382 2HG2 THR 48 HG22 THR 48 11.265 8.467 -9.171 383 3HG2 THR 48 HG23 THR 48 11.308 9.882 -10.222 384 H ASP 49 HN ASP 49 10.513 11.091 -5.884 385 HA ASP 49 HA ASP 49 9.700 12.802 -4.624 386 1HB ASP 49 HB2 ASP 49 8.641 13.247 -7.100 387 2HB ASP 49 HB1 ASP 49 7.179 13.146 -6.121 388 H THR 50 HN THR 50 8.803 9.937 -4.319 389 HA THR 50 HA THR 50 6.306 10.387 -2.828 390 HB THR 50 HB THR 50 5.707 8.168 -3.136 391 HG1 THR 50 HG1 THR 50 8.471 7.687 -3.584 392 1HG2 THR 50 HG21 THR 50 5.470 8.095 -5.370 393 2HG2 THR 50 HG22 THR 50 7.212 8.101 -5.647 394 3HG2 THR 50 HG23 THR 50 6.361 9.618 -5.364 395 H THR 51 HN THR 51 6.218 10.068 -0.671 396 HA THR 51 HA THR 51 8.565 10.001 0.886 397 HB THR 51 HB THR 51 5.979 9.064 2.060 398 HG1 THR 51 HG1 THR 51 6.234 11.303 0.537 399 1HG2 THR 51 HG21 THR 51 8.382 10.583 2.903 400 2HG2 THR 51 HG22 THR 51 7.414 9.406 3.790 401 3HG2 THR 51 HG23 THR 51 6.849 11.067 3.626 402 H ASN 52 HN ASN 52 8.939 8.308 2.637 403 HA ASN 52 HA ASN 52 9.499 5.834 1.469 404 1HB ASN 52 HB2 ASN 52 10.043 5.051 3.706 405 2HB ASN 52 HB1 ASN 52 10.636 6.695 3.501 406 1HD2 ASN 52 HD21 ASN 52 8.780 8.349 4.087 407 2HD2 ASN 52 HD22 ASN 52 8.080 8.079 5.643 408 H GLN 53 HN GLN 53 6.895 6.837 3.638 409 HA GLN 53 HA GLN 53 5.540 4.344 3.631 410 1HB GLN 53 HB2 GLN 53 4.414 7.103 4.152 411 2HB GLN 53 HB1 GLN 53 3.679 5.576 4.616 412 1HG GLN 53 HG2 GLN 53 4.910 5.412 6.463 413 2HG GLN 53 HG1 GLN 53 6.391 5.882 5.623 414 1HE2 GLN 53 HE21 GLN 53 3.552 7.038 7.262 415 2HE2 GLN 53 HE22 GLN 53 4.114 8.636 7.580 416 H LYS 54 HN LYS 54 5.668 7.089 1.545 417 HA LYS 54 HA LYS 54 3.297 6.530 0.064 418 1HB LYS 54 HB2 LYS 54 5.650 8.342 -0.325 419 2HB LYS 54 HB1 LYS 54 4.528 8.074 -1.650 420 1HG LYS 54 HG2 LYS 54 4.271 10.036 0.192 421 2HG LYS 54 HG1 LYS 54 2.931 9.353 -0.726 422 1HD LYS 54 HD2 LYS 54 1.968 8.720 1.185 423 2HD LYS 54 HD1 LYS 54 3.358 7.687 1.520 424 1HE LYS 54 HE2 LYS 54 2.790 9.316 3.308 425 2HE LYS 54 HE1 LYS 54 4.452 9.366 2.730 426 1HZ LYS 54 HZ1 LYS 54 2.481 11.418 2.715 427 2HZ LYS 54 HZ2 LYS 54 3.080 11.156 1.156 428 3HZ LYS 54 HZ3 LYS 54 4.142 11.530 2.417 429 H THR 55 HN THR 55 6.570 5.391 0.000 430 HA THR 55 HA THR 55 6.588 4.364 -2.655 431 HB THR 55 HB THR 55 8.556 3.244 -2.116 432 HG1 THR 55 HG1 THR 55 8.843 2.932 0.401 433 1HG2 THR 55 HG21 THR 55 8.793 5.659 -1.652 434 2HG2 THR 55 HG22 THR 55 9.886 4.671 -0.682 435 3HG2 THR 55 HG23 THR 55 8.427 5.345 0.044 436 H GLU 56 HN GLU 56 5.545 3.286 0.470 437 HA GLU 56 HA GLU 56 4.737 0.658 -0.416 438 1HB GLU 56 HB2 GLU 56 3.459 1.324 2.029 439 2HB GLU 56 HB1 GLU 56 4.827 0.248 1.786 440 1HG GLU 56 HG2 GLU 56 5.676 3.001 1.760 441 2HG GLU 56 HG1 GLU 56 4.777 2.635 3.230 442 H LEU 57 HN LEU 57 3.474 3.841 -0.183 443 HA LEU 57 HA LEU 57 0.700 3.156 -0.285 444 1HB LEU 57 HB2 LEU 57 1.963 5.401 0.412 445 2HB LEU 57 HB1 LEU 57 1.679 5.792 -1.273 446 HG LEU 57 HG LEU 57 -0.033 6.449 0.671 447 1HD1 LEU 57 HD11 LEU 57 -1.789 6.004 -1.335 448 2HD1 LEU 57 HD12 LEU 57 -0.252 5.930 -2.198 449 3HD1 LEU 57 HD13 LEU 57 -0.670 7.364 -1.260 450 1HD2 LEU 57 HD21 LEU 57 -1.696 4.948 1.124 451 2HD2 LEU 57 HD22 LEU 57 -0.326 3.847 0.988 452 3HD2 LEU 57 HD23 LEU 57 -1.438 4.042 -0.368 453 H GLN 58 HN GLN 58 3.245 3.783 -2.591 454 HA GLN 58 HA GLN 58 1.519 3.953 -4.868 455 1HB GLN 58 HB2 GLN 58 3.652 4.951 -5.172 456 2HB GLN 58 HB1 GLN 58 4.491 3.549 -4.520 457 1HG GLN 58 HG2 GLN 58 4.778 3.721 -6.934 458 2HG GLN 58 HG1 GLN 58 3.907 2.254 -6.487 459 1HE2 GLN 58 HE21 GLN 58 2.086 1.834 -7.521 460 2HE2 GLN 58 HE22 GLN 58 1.163 2.958 -8.455 461 H ALA 59 HN ALA 59 3.380 1.498 -3.195 462 HA ALA 59 HA ALA 59 2.851 -0.649 -4.966 463 1HB ALA 59 HB1 ALA 59 4.452 -0.332 -2.787 464 2HB ALA 59 HB2 ALA 59 4.056 -1.890 -3.514 465 3HB ALA 59 HB3 ALA 59 3.151 -1.314 -2.116 466 H ILE 60 HN ILE 60 1.138 0.935 -2.401 467 HA ILE 60 HA ILE 60 -0.814 -0.983 -1.801 468 HB ILE 60 HB ILE 60 -0.498 1.917 -1.410 469 1HG1 ILE 60 HG12 ILE 60 -1.534 -0.422 0.187 470 2HG1 ILE 60 HG11 ILE 60 -0.031 0.464 0.404 471 1HG2 ILE 60 HG21 ILE 60 -3.297 0.808 -1.322 472 2HG2 ILE 60 HG22 ILE 60 -2.677 1.791 -2.648 473 3HG2 ILE 60 HG23 ILE 60 -2.783 2.467 -1.022 474 1HD1 ILE 60 HD11 ILE 60 -1.015 1.740 1.910 475 2HD1 ILE 60 HD12 ILE 60 -2.532 0.874 1.663 476 3HD1 ILE 60 HD13 ILE 60 -2.163 2.301 0.694 477 H TYR 61 HN TYR 61 -0.595 1.477 -4.289 478 HA TYR 61 HA TYR 61 -3.128 1.165 -5.445 479 1HB TYR 61 HB2 TYR 61 -2.060 3.044 -6.237 480 2HB TYR 61 HB1 TYR 61 -0.492 2.256 -6.302 481 HD1 TYR 61 HD1 TYR 61 -3.494 3.124 -8.131 482 HD2 TYR 61 HD2 TYR 61 0.078 0.807 -8.265 483 HE1 TYR 61 HE1 TYR 61 -3.730 2.908 -10.568 484 HE2 TYR 61 HE2 TYR 61 -0.154 0.588 -10.703 485 HH TYR 61 HH TYR 61 -2.296 2.472 -12.525 486 H LEU 62 HN LEU 62 -0.082 -0.550 -5.898 487 HA LEU 62 HA LEU 62 -0.791 -2.086 -8.148 488 1HB LEU 62 HB2 LEU 62 1.005 -3.032 -5.917 489 2HB LEU 62 HB1 LEU 62 1.070 -3.467 -7.620 490 HG LEU 62 HG LEU 62 1.686 -0.707 -6.563 491 1HD1 LEU 62 HD11 LEU 62 3.508 -2.977 -7.341 492 2HD1 LEU 62 HD12 LEU 62 3.370 -2.210 -5.760 493 3HD1 LEU 62 HD13 LEU 62 4.037 -1.309 -7.121 494 1HD2 LEU 62 HD21 LEU 62 0.957 -1.469 -9.098 495 2HD2 LEU 62 HD22 LEU 62 2.719 -1.507 -9.168 496 3HD2 LEU 62 HD23 LEU 62 1.887 -0.030 -8.682 497 H ALA 63 HN ALA 63 -0.776 -2.973 -4.710 498 HA ALA 63 HA ALA 63 -1.991 -5.485 -5.058 499 1HB ALA 63 HB1 ALA 63 -2.076 -5.617 -2.733 500 2HB ALA 63 HB2 ALA 63 -2.236 -3.870 -2.547 501 3HB ALA 63 HB3 ALA 63 -0.693 -4.567 -3.042 502 H LEU 64 HN LEU 64 -3.237 -2.271 -4.667 503 HA LEU 64 HA LEU 64 -5.957 -3.152 -4.246 504 1HB LEU 64 HB2 LEU 64 -4.505 -0.632 -4.160 505 2HB LEU 64 HB1 LEU 64 -6.066 -0.475 -4.944 506 HG LEU 64 HG LEU 64 -6.524 -1.991 -2.618 507 1HD1 LEU 64 HD11 LEU 64 -4.564 -1.387 -1.530 508 2HD1 LEU 64 HD12 LEU 64 -5.738 -0.206 -0.950 509 3HD1 LEU 64 HD13 LEU 64 -4.578 0.244 -2.201 510 1HD2 LEU 64 HD21 LEU 64 -7.477 0.332 -3.928 511 2HD2 LEU 64 HD22 LEU 64 -7.232 0.735 -2.229 512 3HD2 LEU 64 HD23 LEU 64 -8.267 -0.623 -2.673 513 H GLN 65 HN GLN 65 -3.910 -2.623 -6.897 514 HA GLN 65 HA GLN 65 -5.841 -1.847 -8.830 515 1HB GLN 65 HB2 GLN 65 -3.020 -2.680 -8.818 516 2HB GLN 65 HB1 GLN 65 -3.896 -3.118 -10.278 517 1HG GLN 65 HG2 GLN 65 -3.880 -0.335 -9.148 518 2HG GLN 65 HG1 GLN 65 -2.701 -0.907 -10.325 519 1HE2 GLN 65 HE21 GLN 65 -5.722 0.480 -9.873 520 2HE2 GLN 65 HE22 GLN 65 -6.311 0.350 -11.492 521 H ASP 66 HN ASP 66 -4.497 -4.967 -7.807 522 HA ASP 66 HA ASP 66 -6.468 -6.314 -9.526 523 1HB ASP 66 HB2 ASP 66 -3.962 -7.383 -8.213 524 2HB ASP 66 HB1 ASP 66 -5.077 -8.343 -9.182 525 H SER 67 HN SER 67 -6.635 -5.122 -6.620 526 HA SER 67 HA SER 67 -7.082 -7.233 -4.833 527 1HB SER 67 HB2 SER 67 -8.195 -4.424 -4.944 528 2HB SER 67 HB1 SER 67 -8.648 -5.553 -3.674 529 HG SER 67 HG SER 67 -6.301 -5.781 -3.342 530 H GLY 68 HN GLY 68 -9.344 -5.570 -7.016 531 1HA GLY 68 HA2 GLY 68 -11.131 -6.673 -8.122 532 2HA GLY 68 HA1 GLY 68 -11.046 -7.952 -6.927 533 H LEU 69 HN LEU 69 -12.179 -7.768 -5.037 534 HA LEU 69 HA LEU 69 -14.083 -5.550 -4.925 535 1HB LEU 69 HB2 LEU 69 -14.280 -8.406 -4.777 536 2HB LEU 69 HB1 LEU 69 -14.907 -7.690 -3.333 537 HG LEU 69 HG LEU 69 -15.830 -7.200 -6.158 538 1HD1 LEU 69 HD11 LEU 69 -16.601 -9.296 -5.194 539 2HD1 LEU 69 HD12 LEU 69 -17.935 -8.157 -5.377 540 3HD1 LEU 69 HD13 LEU 69 -17.224 -8.433 -3.787 541 1HD2 LEU 69 HD21 LEU 69 -17.364 -6.064 -3.913 542 2HD2 LEU 69 HD22 LEU 69 -17.076 -5.428 -5.533 543 3HD2 LEU 69 HD23 LEU 69 -15.837 -5.267 -4.289 544 H GLU 70 HN GLU 70 -13.661 -7.882 -2.409 545 HA GLU 70 HA GLU 70 -12.611 -5.776 -0.658 546 1HB GLU 70 HB2 GLU 70 -13.481 -7.492 1.136 547 2HB GLU 70 HB1 GLU 70 -14.592 -6.394 0.333 548 1HG GLU 70 HG2 GLU 70 -15.390 -8.094 -1.103 549 2HG GLU 70 HG1 GLU 70 -14.096 -9.194 -0.626 550 H VAL 71 HN VAL 71 -10.600 -5.981 0.019 551 HA VAL 71 HA VAL 71 -9.445 -8.663 0.300 552 HB VAL 71 HB VAL 71 -7.373 -8.005 -0.764 553 1HG1 VAL 71 HG11 VAL 71 -8.519 -8.946 -2.465 554 2HG1 VAL 71 HG12 VAL 71 -8.531 -7.302 -3.101 555 3HG1 VAL 71 HG13 VAL 71 -9.932 -7.919 -2.226 556 1HG2 VAL 71 HG21 VAL 71 -7.254 -5.840 -1.998 557 2HG2 VAL 71 HG22 VAL 71 -7.278 -5.682 -0.243 558 3HG2 VAL 71 HG23 VAL 71 -8.737 -5.352 -1.177 559 H ASN 72 HN ASN 72 -7.333 -8.601 1.433 560 HA ASN 72 HA ASN 72 -7.414 -6.632 3.607 561 1HB ASN 72 HB2 ASN 72 -6.271 -9.419 3.388 562 2HB ASN 72 HB1 ASN 72 -5.779 -8.323 4.676 563 1HD2 ASN 72 HD21 ASN 72 -8.910 -8.996 3.149 564 2HD2 ASN 72 HD22 ASN 72 -9.729 -9.399 4.616 565 H ILE 73 HN ILE 73 -6.187 -4.919 3.003 566 HA ILE 73 HA ILE 73 -3.743 -5.428 1.499 567 HB ILE 73 HB ILE 73 -5.399 -2.985 1.979 568 1HG1 ILE 73 HG12 ILE 73 -5.907 -4.408 0.083 569 2HG1 ILE 73 HG11 ILE 73 -5.268 -2.867 -0.470 570 1HG2 ILE 73 HG21 ILE 73 -2.483 -3.051 1.505 571 2HG2 ILE 73 HG22 ILE 73 -3.482 -1.816 2.273 572 3HG2 ILE 73 HG23 ILE 73 -3.420 -1.932 0.514 573 1HD1 ILE 73 HD11 ILE 73 -4.468 -4.981 -1.636 574 2HD1 ILE 73 HD12 ILE 73 -3.521 -5.277 -0.179 575 3HD1 ILE 73 HD13 ILE 73 -3.245 -3.817 -1.128 576 H VAL 74 HN VAL 74 -2.164 -6.009 2.802 577 HA VAL 74 HA VAL 74 -1.718 -4.584 5.308 578 HB VAL 74 HB VAL 74 -1.525 -6.935 5.564 579 1HG1 VAL 74 HG11 VAL 74 0.172 -6.823 3.099 580 2HG1 VAL 74 HG12 VAL 74 -1.264 -7.795 3.419 581 3HG1 VAL 74 HG13 VAL 74 0.260 -8.186 4.215 582 1HG2 VAL 74 HG21 VAL 74 1.064 -7.153 5.942 583 2HG2 VAL 74 HG22 VAL 74 0.090 -6.076 6.941 584 3HG2 VAL 74 HG23 VAL 74 1.038 -5.422 5.606 585 H THR 75 HN THR 75 -0.827 -2.664 4.920 586 HA THR 75 HA THR 75 1.689 -2.601 3.381 587 HB THR 75 HB THR 75 -0.308 -0.338 3.539 588 HG1 THR 75 HG1 THR 75 -0.492 -2.546 2.115 589 1HG2 THR 75 HG21 THR 75 2.342 -0.212 2.995 590 2HG2 THR 75 HG22 THR 75 1.144 0.895 2.326 591 3HG2 THR 75 HG23 THR 75 1.693 -0.486 1.381 592 H ASP 76 HN ASP 76 3.403 -1.800 4.484 593 HA ASP 76 HA ASP 76 2.852 -0.627 7.103 594 1HB ASP 76 HB2 ASP 76 5.664 -0.750 6.358 595 2HB ASP 76 HB1 ASP 76 4.836 -1.455 7.747 596 H SER 77 HN SER 77 2.213 1.379 6.877 597 HA SER 77 HA SER 77 4.094 3.387 6.102 598 1HB SER 77 HB2 SER 77 2.121 4.339 4.525 599 2HB SER 77 HB1 SER 77 3.449 3.353 3.910 600 HG SER 77 HG SER 77 1.654 1.660 4.764 601 H GLN 78 HN GLN 78 3.800 4.174 8.186 602 HA GLN 78 HA GLN 78 1.403 4.473 9.529 603 1HB GLN 78 HB2 GLN 78 3.946 6.082 9.685 604 2HB GLN 78 HB1 GLN 78 2.596 6.325 10.785 605 1HG GLN 78 HG2 GLN 78 3.413 4.726 12.072 606 2HG GLN 78 HG1 GLN 78 3.088 3.568 10.780 607 1HE2 GLN 78 HE21 GLN 78 4.833 3.631 9.007 608 2HE2 GLN 78 HE22 GLN 78 6.466 3.629 9.570 609 H TYR 79 HN TYR 79 2.500 6.167 6.789 610 HA TYR 79 HA TYR 79 0.854 8.505 7.237 611 1HB TYR 79 HB2 TYR 79 3.011 7.876 5.484 612 2HB TYR 79 HB1 TYR 79 1.613 8.266 4.487 613 HD1 TYR 79 HD1 TYR 79 0.239 10.379 5.793 614 HD2 TYR 79 HD2 TYR 79 4.436 9.688 5.641 615 HE1 TYR 79 HE1 TYR 79 0.643 12.777 6.160 616 HE2 TYR 79 HE2 TYR 79 4.849 12.084 6.010 617 HH TYR 79 HH TYR 79 3.607 14.244 5.646 618 H ALA 80 HN ALA 80 0.908 5.727 4.998 619 HA ALA 80 HA ALA 80 -1.555 6.221 3.762 620 1HB ALA 80 HB1 ALA 80 -0.308 3.541 4.398 621 2HB ALA 80 HB2 ALA 80 0.053 4.522 2.978 622 3HB ALA 80 HB3 ALA 80 -1.562 3.848 3.196 623 H LEU 81 HN LEU 81 -0.655 4.941 6.836 624 HA LEU 81 HA LEU 81 -3.070 3.744 7.594 625 1HB LEU 81 HB2 LEU 81 -0.849 3.492 8.732 626 2HB LEU 81 HB1 LEU 81 -1.057 5.104 9.383 627 HG LEU 81 HG LEU 81 -1.633 2.997 10.824 628 1HD1 LEU 81 HD11 LEU 81 -3.771 5.044 10.951 629 2HD1 LEU 81 HD12 LEU 81 -2.100 5.588 11.109 630 3HD1 LEU 81 HD13 LEU 81 -2.746 4.388 12.228 631 1HD2 LEU 81 HD21 LEU 81 -3.819 2.157 10.662 632 2HD2 LEU 81 HD22 LEU 81 -3.205 2.154 9.008 633 3HD2 LEU 81 HD23 LEU 81 -4.312 3.421 9.535 634 H GLY 82 HN GLY 82 -1.804 7.019 7.954 635 1HA GLY 82 HA2 GLY 82 -4.202 7.964 9.264 636 2HA GLY 82 HA1 GLY 82 -2.808 8.928 8.815 637 H ILE 83 HN ILE 83 -2.786 8.236 6.023 638 HA ILE 83 HA ILE 83 -4.882 10.022 5.151 639 HB ILE 83 HB ILE 83 -2.914 8.775 3.281 640 1HG1 ILE 83 HG12 ILE 83 -1.468 9.372 5.118 641 2HG1 ILE 83 HG11 ILE 83 -1.294 10.593 3.863 642 1HG2 ILE 83 HG21 ILE 83 -4.273 10.185 2.110 643 2HG2 ILE 83 HG22 ILE 83 -2.963 11.278 2.543 644 3HG2 ILE 83 HG23 ILE 83 -4.471 11.302 3.460 645 1HD1 ILE 83 HD11 ILE 83 -1.352 11.719 5.941 646 2HD1 ILE 83 HD12 ILE 83 -2.790 10.836 6.455 647 3HD1 ILE 83 HD13 ILE 83 -2.901 12.017 5.150 648 H ILE 84 HN ILE 84 -3.643 6.919 3.856 649 HA ILE 84 HA ILE 84 -5.715 6.416 2.107 650 HB ILE 84 HB ILE 84 -3.426 5.034 2.969 651 1HG1 ILE 84 HG12 ILE 84 -4.372 5.594 0.644 652 2HG1 ILE 84 HG11 ILE 84 -3.523 4.063 0.827 653 1HG2 ILE 84 HG21 ILE 84 -4.962 3.687 4.394 654 2HG2 ILE 84 HG22 ILE 84 -4.090 2.747 3.182 655 3HG2 ILE 84 HG23 ILE 84 -5.786 3.160 2.925 656 1HD1 ILE 84 HD11 ILE 84 -6.448 4.570 0.490 657 2HD1 ILE 84 HD12 ILE 84 -5.868 3.065 1.203 658 3HD1 ILE 84 HD13 ILE 84 -5.382 3.512 -0.432 659 H GLN 85 HN GLN 85 -5.654 5.920 5.558 660 HA GLN 85 HA GLN 85 -8.001 4.237 5.555 661 1HB GLN 85 HB2 GLN 85 -6.286 4.025 7.314 662 2HB GLN 85 HB1 GLN 85 -6.633 5.665 7.841 663 1HG GLN 85 HG2 GLN 85 -8.942 4.965 8.368 664 2HG GLN 85 HG1 GLN 85 -8.503 3.314 7.940 665 1HE2 GLN 85 HE21 GLN 85 -9.020 2.628 10.042 666 2HE2 GLN 85 HE22 GLN 85 -7.965 2.933 11.375 667 H ALA 86 HN ALA 86 -7.284 7.607 5.658 668 HA ALA 86 HA ALA 86 -10.005 8.269 6.499 669 1HB ALA 86 HB1 ALA 86 -8.678 9.640 7.733 670 2HB ALA 86 HB2 ALA 86 -8.907 10.668 6.319 671 3HB ALA 86 HB3 ALA 86 -7.427 9.725 6.492 672 H GLN 87 HN GLN 87 -10.460 7.219 4.236 673 HA GLN 87 HA GLN 87 -10.735 7.494 1.905 674 1HB GLN 87 HB2 GLN 87 -12.370 9.788 3.010 675 2HB GLN 87 HB1 GLN 87 -12.685 8.852 1.562 676 1HG GLN 87 HG2 GLN 87 -14.212 8.188 3.277 677 2HG GLN 87 HG1 GLN 87 -13.104 6.867 2.937 678 1HE2 GLN 87 HE21 GLN 87 -12.004 9.566 4.849 679 2HE2 GLN 87 HE22 GLN 87 -12.003 8.740 6.363 680 HA PRO 88 HA PRO 88 -7.964 11.181 1.458 681 1HB PRO 88 HB2 PRO 88 -5.766 10.050 0.519 682 2HB PRO 88 HB1 PRO 88 -6.173 9.963 2.243 683 1HG PRO 88 HG2 PRO 88 -6.641 7.921 0.093 684 2HG PRO 88 HG1 PRO 88 -5.897 7.703 1.688 685 1HD PRO 88 HD2 PRO 88 -8.525 7.149 1.214 686 2HD PRO 88 HD1 PRO 88 -7.938 7.719 2.789 687 H ASP 89 HN ASP 89 -9.973 9.872 -0.391 688 HA ASP 89 HA ASP 89 -8.937 9.600 -2.975 689 1HB ASP 89 HB2 ASP 89 -11.444 10.640 -3.417 690 2HB ASP 89 HB1 ASP 89 -11.085 8.939 -3.150 691 H GLN 90 HN GLN 90 -9.020 12.283 -1.015 692 HA GLN 90 HA GLN 90 -8.037 14.018 -3.050 693 1HB GLN 90 HB2 GLN 90 -9.989 15.717 -2.361 694 2HB GLN 90 HB1 GLN 90 -10.120 14.633 -3.740 695 1HG GLN 90 HG2 GLN 90 -12.131 14.724 -2.256 696 2HG GLN 90 HG1 GLN 90 -11.477 13.112 -2.540 697 1HE2 GLN 90 HE21 GLN 90 -11.088 11.865 -0.817 698 2HE2 GLN 90 HE22 GLN 90 -11.022 12.424 0.818 699 H SER 91 HN SER 91 -7.598 12.902 -0.249 700 HA SER 91 HA SER 91 -7.178 15.467 1.136 701 1HB SER 91 HB2 SER 91 -7.215 12.825 2.558 702 2HB SER 91 HB1 SER 91 -7.551 14.433 3.195 703 HG SER 91 HG SER 91 -9.516 13.521 2.960 704 H GLU 92 HN GLU 92 -5.273 15.881 2.173 705 HA GLU 92 HA GLU 92 -3.004 16.045 2.195 706 1HB GLU 92 HB2 GLU 92 -3.676 14.443 4.024 707 2HB GLU 92 HB1 GLU 92 -3.168 13.142 2.960 708 1HG GLU 92 HG2 GLU 92 -1.137 13.347 3.813 709 2HG GLU 92 HG1 GLU 92 -1.018 14.898 2.980 710 H SER 93 HN SER 93 -1.854 12.990 1.793 711 HA SER 93 HA SER 93 -0.231 13.468 -0.326 712 1HB SER 93 HB2 SER 93 -0.991 11.201 1.244 713 2HB SER 93 HB1 SER 93 -0.904 10.712 -0.450 714 HG SER 93 HG SER 93 1.100 11.006 1.172 715 H GLU 94 HN GLU 94 -0.175 12.947 -2.506 716 HA GLU 94 HA GLU 94 -2.719 13.168 -3.876 717 1HB GLU 94 HB2 GLU 94 -0.327 12.708 -5.516 718 2HB GLU 94 HB1 GLU 94 -1.528 13.987 -5.618 719 1HG GLU 94 HG2 GLU 94 0.388 14.081 -3.358 720 2HG GLU 94 HG1 GLU 94 1.001 14.446 -4.970 721 H LEU 95 HN LEU 95 -0.158 10.836 -3.404 722 HA LEU 95 HA LEU 95 -0.796 8.896 -5.275 723 1HB LEU 95 HB2 LEU 95 1.062 9.113 -3.357 724 2HB LEU 95 HB1 LEU 95 -0.043 8.018 -2.539 725 HG LEU 95 HG LEU 95 0.236 6.351 -4.245 726 1HD1 LEU 95 HD11 LEU 95 2.093 7.004 -6.041 727 2HD1 LEU 95 HD12 LEU 95 1.390 8.602 -5.789 728 3HD1 LEU 95 HD13 LEU 95 0.371 7.263 -6.321 729 1HD2 LEU 95 HD21 LEU 95 3.046 6.917 -4.204 730 2HD2 LEU 95 HD22 LEU 95 2.139 5.693 -3.316 731 3HD2 LEU 95 HD23 LEU 95 2.326 7.313 -2.643 732 H VAL 96 HN VAL 96 -1.865 9.080 -1.898 733 HA VAL 96 HA VAL 96 -3.518 6.883 -1.818 734 HB VAL 96 HB VAL 96 -4.880 8.346 -0.151 735 1HG1 VAL 96 HG11 VAL 96 -2.896 6.642 0.198 736 2HG1 VAL 96 HG12 VAL 96 -3.523 7.615 1.527 737 3HG1 VAL 96 HG13 VAL 96 -2.047 8.104 0.697 738 1HG2 VAL 96 HG21 VAL 96 -2.893 10.220 -1.166 739 2HG2 VAL 96 HG22 VAL 96 -2.935 10.114 0.594 740 3HG2 VAL 96 HG23 VAL 96 -4.400 10.519 -0.301 741 H ASN 97 HN ASN 97 -4.082 9.991 -3.309 742 HA ASN 97 HA ASN 97 -6.886 9.873 -3.514 743 1HB ASN 97 HB2 ASN 97 -4.755 11.265 -5.125 744 2HB ASN 97 HB1 ASN 97 -6.438 11.327 -5.629 745 1HD2 ASN 97 HD21 ASN 97 -5.126 11.373 -2.348 746 2HD2 ASN 97 HD22 ASN 97 -5.718 12.943 -1.948 747 H GLN 98 HN GLN 98 -4.311 8.839 -5.702 748 HA GLN 98 HA GLN 98 -5.908 7.884 -7.790 749 1HB GLN 98 HB2 GLN 98 -3.426 8.284 -7.836 750 2HB GLN 98 HB1 GLN 98 -3.227 6.775 -6.951 751 1HG GLN 98 HG2 GLN 98 -3.956 5.486 -8.743 752 2HG GLN 98 HG1 GLN 98 -4.707 6.863 -9.546 753 1HE2 GLN 98 HE21 GLN 98 -2.995 5.127 -10.855 754 2HE2 GLN 98 HE22 GLN 98 -1.548 5.972 -11.274 755 H ILE 99 HN ILE 99 -4.524 6.125 -5.020 756 HA ILE 99 HA ILE 99 -5.451 3.582 -5.709 757 HB ILE 99 HB ILE 99 -4.863 4.758 -2.998 758 1HG1 ILE 99 HG12 ILE 99 -3.005 2.790 -3.675 759 2HG1 ILE 99 HG11 ILE 99 -3.271 3.682 -5.171 760 1HG2 ILE 99 HG21 ILE 99 -4.702 1.868 -3.193 761 2HG2 ILE 99 HG22 ILE 99 -6.337 2.465 -3.475 762 3HG2 ILE 99 HG23 ILE 99 -5.494 2.875 -1.982 763 1HD1 ILE 99 HD11 ILE 99 -2.967 5.465 -2.930 764 2HD1 ILE 99 HD12 ILE 99 -2.070 5.391 -4.447 765 3HD1 ILE 99 HD13 ILE 99 -1.589 4.376 -3.086 766 H ILE 100 HN ILE 100 -6.894 5.921 -3.436 767 HA ILE 100 HA ILE 100 -9.110 4.473 -2.687 768 HB ILE 100 HB ILE 100 -8.908 7.447 -3.127 769 1HG1 ILE 100 HG12 ILE 100 -7.348 6.641 -1.464 770 2HG1 ILE 100 HG11 ILE 100 -8.674 7.461 -0.644 771 1HG2 ILE 100 HG21 ILE 100 -11.052 5.776 -1.843 772 2HG2 ILE 100 HG22 ILE 100 -11.213 6.914 -3.179 773 3HG2 ILE 100 HG23 ILE 100 -10.874 7.507 -1.551 774 1HD1 ILE 100 HD11 ILE 100 -8.151 5.497 0.587 775 2HD1 ILE 100 HD12 ILE 100 -8.213 4.500 -0.867 776 3HD1 ILE 100 HD13 ILE 100 -9.691 5.219 -0.228 777 H GLU 101 HN GLU 101 -8.814 6.655 -5.472 778 HA GLU 101 HA GLU 101 -11.373 6.548 -6.455 779 1HB GLU 101 HB2 GLU 101 -8.705 6.673 -7.836 780 2HB GLU 101 HB1 GLU 101 -10.197 6.634 -8.771 781 1HG GLU 101 HG2 GLU 101 -10.607 8.592 -6.826 782 2HG GLU 101 HG1 GLU 101 -8.953 8.832 -7.390 783 H GLN 102 HN GLN 102 -8.775 4.190 -6.801 784 HA GLN 102 HA GLN 102 -10.298 2.386 -8.414 785 1HB GLN 102 HB2 GLN 102 -7.771 2.000 -6.800 786 2HB GLN 102 HB1 GLN 102 -8.472 0.758 -7.828 787 1HG GLN 102 HG2 GLN 102 -7.416 3.434 -8.710 788 2HG GLN 102 HG1 GLN 102 -6.663 1.860 -8.972 789 1HE2 GLN 102 HE21 GLN 102 -8.688 4.196 -10.245 790 2HE2 GLN 102 HE22 GLN 102 -9.351 3.284 -11.554 791 H LEU 103 HN LEU 103 -9.752 2.888 -5.011 792 HA LEU 103 HA LEU 103 -10.842 0.450 -4.072 793 1HB LEU 103 HB2 LEU 103 -9.426 1.978 -2.713 794 2HB LEU 103 HB1 LEU 103 -10.744 3.132 -2.684 795 HG LEU 103 HG LEU 103 -12.132 1.500 -1.458 796 1HD1 LEU 103 HD11 LEU 103 -11.381 -0.609 -2.051 797 2HD1 LEU 103 HD12 LEU 103 -10.767 -0.422 -0.408 798 3HD1 LEU 103 HD13 LEU 103 -9.688 -0.191 -1.785 799 1HD2 LEU 103 HD21 LEU 103 -11.358 2.409 0.413 800 2HD2 LEU 103 HD22 LEU 103 -9.976 3.002 -0.509 801 3HD2 LEU 103 HD23 LEU 103 -9.879 1.452 0.327 802 H ILE 104 HN ILE 104 -12.203 3.365 -5.301 803 HA ILE 104 HA ILE 104 -14.799 3.123 -4.139 804 HB ILE 104 HB ILE 104 -14.107 4.506 -6.735 805 1HG1 ILE 104 HG12 ILE 104 -14.145 5.767 -3.990 806 2HG1 ILE 104 HG11 ILE 104 -12.668 5.213 -4.774 807 1HG2 ILE 104 HG21 ILE 104 -16.040 5.950 -6.082 808 2HG2 ILE 104 HG22 ILE 104 -16.370 4.815 -4.773 809 3HG2 ILE 104 HG23 ILE 104 -16.461 4.277 -6.450 810 1HD1 ILE 104 HD11 ILE 104 -12.527 7.258 -5.621 811 2HD1 ILE 104 HD12 ILE 104 -14.192 7.639 -5.184 812 3HD1 ILE 104 HD13 ILE 104 -13.849 6.793 -6.691 813 H LYS 105 HN LYS 105 -13.319 2.197 -7.211 814 HA LYS 105 HA LYS 105 -15.705 1.063 -8.291 815 1HB LYS 105 HB2 LYS 105 -14.450 0.532 -10.164 816 2HB LYS 105 HB1 LYS 105 -13.571 1.910 -9.518 817 1HG LYS 105 HG2 LYS 105 -11.827 0.577 -8.724 818 2HG LYS 105 HG1 LYS 105 -12.789 -0.899 -8.828 819 1HD LYS 105 HD2 LYS 105 -12.802 -0.662 -11.295 820 2HD LYS 105 HD1 LYS 105 -11.738 0.736 -11.136 821 1HE LYS 105 HE2 LYS 105 -9.952 -0.577 -10.984 822 2HE LYS 105 HE1 LYS 105 -10.675 -1.473 -9.649 823 1HZ LYS 105 HZ1 LYS 105 -10.205 -2.380 -12.218 824 2HZ LYS 105 HZ2 LYS 105 -11.885 -2.220 -12.093 825 3HZ LYS 105 HZ3 LYS 105 -11.042 -3.183 -10.986 826 H LYS 106 HN LYS 106 -14.032 0.073 -5.686 827 HA LYS 106 HA LYS 106 -14.692 -2.746 -6.230 828 1HB LYS 106 HB2 LYS 106 -12.759 -3.537 -5.103 829 2HB LYS 106 HB1 LYS 106 -12.212 -2.325 -6.252 830 1HG LYS 106 HG2 LYS 106 -11.857 -0.733 -4.534 831 2HG LYS 106 HG1 LYS 106 -12.696 -1.735 -3.347 832 1HD LYS 106 HD2 LYS 106 -10.399 -2.037 -2.909 833 2HD LYS 106 HD1 LYS 106 -10.905 -3.485 -3.782 834 1HE LYS 106 HE2 LYS 106 -9.789 -1.150 -5.279 835 2HE LYS 106 HE1 LYS 106 -8.701 -2.265 -4.451 836 1HZ LYS 106 HZ1 LYS 106 -10.609 -3.722 -5.934 837 2HZ LYS 106 HZ2 LYS 106 -8.927 -3.702 -6.103 838 3HZ LYS 106 HZ3 LYS 106 -9.873 -2.582 -6.946 839 H GLU 107 HN GLU 107 -14.035 -3.689 -3.635 840 HA GLU 107 HA GLU 107 -16.318 -2.573 -2.197 841 1HB GLU 107 HB2 GLU 107 -16.497 -4.910 -2.480 842 2HB GLU 107 HB1 GLU 107 -14.841 -5.199 -1.964 843 1HG GLU 107 HG2 GLU 107 -15.485 -5.404 0.149 844 2HG GLU 107 HG1 GLU 107 -16.330 -3.859 0.105 845 H LYS 108 HN LYS 108 -13.033 -3.746 -1.245 846 HA LYS 108 HA LYS 108 -12.471 -1.383 0.219 847 1HB LYS 108 HB2 LYS 108 -12.634 -2.384 2.511 848 2HB LYS 108 HB1 LYS 108 -14.184 -2.095 1.729 849 1HG LYS 108 HG2 LYS 108 -14.333 -4.446 1.120 850 2HG LYS 108 HG1 LYS 108 -12.763 -4.748 1.863 851 1HD LYS 108 HD2 LYS 108 -14.422 -5.441 3.417 852 2HD LYS 108 HD1 LYS 108 -13.741 -3.931 4.024 853 1HE LYS 108 HE2 LYS 108 -15.637 -2.689 3.316 854 2HE LYS 108 HE1 LYS 108 -16.257 -4.048 2.379 855 1HZ LYS 108 HZ1 LYS 108 -16.960 -5.138 4.261 856 2HZ LYS 108 HZ2 LYS 108 -17.254 -3.530 4.689 857 3HZ LYS 108 HZ3 LYS 108 -15.887 -4.326 5.284 858 H VAL 109 HN VAL 109 -10.718 -1.809 1.939 859 HA VAL 109 HA VAL 109 -8.993 -4.077 1.389 860 HB VAL 109 HB VAL 109 -6.988 -2.652 1.067 861 1HG1 VAL 109 HG11 VAL 109 -8.699 -1.890 -1.214 862 2HG1 VAL 109 HG12 VAL 109 -8.714 -3.601 -0.782 863 3HG1 VAL 109 HG13 VAL 109 -7.191 -2.804 -1.178 864 1HG2 VAL 109 HG21 VAL 109 -7.032 -0.397 0.954 865 2HG2 VAL 109 HG22 VAL 109 -8.530 -0.574 1.868 866 3HG2 VAL 109 HG23 VAL 109 -8.584 -0.360 0.118 867 H TYR 110 HN TYR 110 -8.354 -4.785 3.338 868 HA TYR 110 HA TYR 110 -8.601 -3.098 5.662 869 1HB TYR 110 HB2 TYR 110 -9.224 -5.209 6.275 870 2HB TYR 110 HB1 TYR 110 -8.158 -5.978 5.108 871 HD1 TYR 110 HD1 TYR 110 -6.183 -6.987 5.822 872 HD2 TYR 110 HD2 TYR 110 -8.136 -4.210 8.379 873 HE1 TYR 110 HE1 TYR 110 -4.626 -7.577 7.630 874 HE2 TYR 110 HE2 TYR 110 -6.594 -4.785 10.201 875 HH TYR 110 HH TYR 110 -4.911 -6.091 10.851 876 H LEU 111 HN LEU 111 -7.072 -1.600 5.964 877 HA LEU 111 HA LEU 111 -4.371 -1.977 5.079 878 1HB LEU 111 HB2 LEU 111 -5.806 0.211 5.263 879 2HB LEU 111 HB1 LEU 111 -5.182 0.249 6.901 880 HG LEU 111 HG LEU 111 -3.896 1.637 5.250 881 1HD1 LEU 111 HD11 LEU 111 -2.151 1.421 6.602 882 2HD1 LEU 111 HD12 LEU 111 -1.837 -0.224 6.050 883 3HD1 LEU 111 HD13 LEU 111 -2.998 0.064 7.346 884 1HD2 LEU 111 HD21 LEU 111 -2.702 0.733 3.510 885 2HD2 LEU 111 HD22 LEU 111 -4.143 -0.284 3.487 886 3HD2 LEU 111 HD23 LEU 111 -2.658 -0.877 4.231 887 H ALA 112 HN ALA 112 -2.625 -2.557 6.179 888 HA ALA 112 HA ALA 112 -2.581 -2.510 9.084 889 1HB ALA 112 HB1 ALA 112 -3.500 -4.787 8.041 890 2HB ALA 112 HB2 ALA 112 -2.494 -4.745 9.489 891 3HB ALA 112 HB3 ALA 112 -1.771 -5.113 7.923 892 H TRP 113 HN TRP 113 -0.690 -1.586 9.571 893 HA TRP 113 HA TRP 113 1.530 -1.807 7.693 894 1HB TRP 113 HB2 TRP 113 1.413 0.405 8.182 895 2HB TRP 113 HB1 TRP 113 0.667 0.133 9.749 896 HD1 TRP 113 HD1 TRP 113 3.887 1.130 8.194 897 HE1 TRP 113 HE1 TRP 113 5.744 1.282 9.970 898 HE3 TRP 113 HE3 TRP 113 1.491 -1.166 12.071 899 HZ2 TRP 113 HZ2 TRP 113 6.141 0.527 12.663 900 HZ3 TRP 113 HZ3 TRP 113 2.669 -1.403 14.220 901 HH2 TRP 113 HH2 TRP 113 4.947 -0.572 14.508 902 H VAL 114 HN VAL 114 3.684 -2.233 8.429 903 HA VAL 114 HA VAL 114 3.863 -3.811 10.902 904 HB VAL 114 HB VAL 114 5.042 -4.577 8.224 905 1HG1 VAL 114 HG11 VAL 114 5.329 -5.856 10.939 906 2HG1 VAL 114 HG12 VAL 114 6.606 -5.136 9.959 907 3HG1 VAL 114 HG13 VAL 114 5.810 -6.615 9.422 908 1HG2 VAL 114 HG21 VAL 114 3.547 -6.409 8.210 909 2HG2 VAL 114 HG22 VAL 114 2.576 -4.994 8.617 910 3HG2 VAL 114 HG23 VAL 114 3.062 -6.121 9.882 911 HA PRO 115 HA PRO 115 7.213 -1.105 11.958 912 1HB PRO 115 HB2 PRO 115 8.819 -3.132 13.102 913 2HB PRO 115 HB1 PRO 115 7.697 -2.061 13.943 914 1HG PRO 115 HG2 PRO 115 7.310 -4.854 13.006 915 2HG PRO 115 HG1 PRO 115 6.617 -4.032 14.415 916 1HD PRO 115 HD2 PRO 115 5.145 -4.536 12.238 917 2HD PRO 115 HD1 PRO 115 4.939 -3.029 13.159 918 H ALA 116 HN ALA 116 8.533 -0.364 10.467 919 HA ALA 116 HA ALA 116 9.814 -0.379 8.526 920 1HB ALA 116 HB1 ALA 116 11.701 0.056 9.601 921 2HB ALA 116 HB2 ALA 116 12.071 -1.667 9.552 922 3HB ALA 116 HB3 ALA 116 11.235 -0.984 10.947 923 H HIS 117 HN HIS 117 8.139 -2.346 7.926 924 HA HIS 117 HA HIS 117 7.842 -4.335 6.841 925 1HB HIS 117 HB2 HIS 117 10.612 -4.213 5.750 926 2HB HIS 117 HB1 HIS 117 9.089 -4.503 4.918 927 HD1 HIS 117 HD1 HIS 117 7.608 -1.908 5.702 928 HD2 HIS 117 HD2 HIS 117 11.540 -2.047 4.364 929 HE1 HIS 117 HE1 HIS 117 8.087 0.382 4.780 930 HE2 HIS 117 HE2 HIS 117 10.482 0.284 4.007 931 H LYS 118 HN LYS 118 8.075 -5.226 9.139 932 HA LYS 118 HA LYS 118 10.454 -6.912 9.431 933 1HB LYS 118 HB2 LYS 118 8.634 -5.580 11.268 934 2HB LYS 118 HB1 LYS 118 8.877 -7.272 11.684 935 1HG LYS 118 HG2 LYS 118 10.900 -6.862 12.496 936 2HG LYS 118 HG1 LYS 118 11.379 -5.986 11.040 937 1HD LYS 118 HD2 LYS 118 9.574 -4.314 12.406 938 2HD LYS 118 HD1 LYS 118 10.671 -4.961 13.631 939 1HE LYS 118 HE2 LYS 118 12.340 -4.316 11.522 940 2HE LYS 118 HE1 LYS 118 11.155 -3.010 11.532 941 1HZ LYS 118 HZ1 LYS 118 12.118 -3.685 14.151 942 2HZ LYS 118 HZ2 LYS 118 12.002 -2.175 13.399 943 3HZ LYS 118 HZ3 LYS 118 13.349 -3.159 13.115 944 H GLY 119 HN GLY 119 7.079 -7.082 8.708 945 1HA GLY 119 HA2 GLY 119 7.244 -9.818 7.983 946 2HA GLY 119 HA1 GLY 119 6.444 -9.658 9.538 947 H ILE 120 HN ILE 120 6.337 -8.341 6.234 948 HA ILE 120 HA ILE 120 3.557 -7.613 6.498 949 HB ILE 120 HB ILE 120 4.776 -7.773 3.801 950 1HG1 ILE 120 HG12 ILE 120 5.667 -5.314 4.851 951 2HG1 ILE 120 HG11 ILE 120 6.173 -6.544 6.004 952 1HG2 ILE 120 HG21 ILE 120 3.755 -5.484 3.673 953 2HG2 ILE 120 HG22 ILE 120 3.140 -5.745 5.305 954 3HG2 ILE 120 HG23 ILE 120 2.619 -6.797 3.988 955 1HD1 ILE 120 HD11 ILE 120 6.886 -6.302 3.104 956 2HD1 ILE 120 HD12 ILE 120 7.134 -7.792 4.017 957 3HD1 ILE 120 HD13 ILE 120 7.955 -6.308 4.507 958 H GLY 121 HN GLY 121 2.582 -8.373 3.950 959 1HA GLY 121 HA2 GLY 121 1.561 -10.932 4.484 960 2HA GLY 121 HA1 GLY 121 1.482 -10.118 2.925 961 H GLY 122 HN GLY 122 4.617 -10.059 3.378 962 1HA GLY 122 HA2 GLY 122 5.453 -12.761 3.082 963 2HA GLY 122 HA1 GLY 122 5.316 -11.979 1.513 964 H ASN 123 HN ASN 123 6.462 -10.856 4.696 965 HA ASN 123 HA ASN 123 8.489 -9.220 3.719 966 1HB ASN 123 HB2 ASN 123 7.752 -8.982 6.000 967 2HB ASN 123 HB1 ASN 123 8.234 -10.633 6.380 968 1HD2 ASN 123 HD21 ASN 123 10.116 -10.875 7.334 969 2HD2 ASN 123 HD22 ASN 123 11.417 -9.738 7.324 970 H GLU 124 HN GLU 124 8.675 -12.576 4.867 971 HA GLU 124 HA GLU 124 10.214 -14.220 4.569 972 1HB GLU 124 HB2 GLU 124 9.715 -13.805 2.187 973 2HB GLU 124 HB1 GLU 124 10.991 -12.597 2.138 974 1HG GLU 124 HG2 GLU 124 12.637 -14.337 2.671 975 2HG GLU 124 HG1 GLU 124 11.348 -15.540 2.666 976 H GLN 125 HN GLN 125 12.322 -11.857 3.044 977 HA GLN 125 HA GLN 125 14.247 -12.251 5.209 978 1HB GLN 125 HB2 GLN 125 14.753 -10.789 2.625 979 2HB GLN 125 HB1 GLN 125 15.928 -11.528 3.704 980 1HG GLN 125 HG2 GLN 125 15.284 -13.713 3.049 981 2HG GLN 125 HG1 GLN 125 13.874 -13.105 2.182 982 1HE2 GLN 125 HE21 GLN 125 14.085 -12.454 0.116 983 2HE2 GLN 125 HE22 GLN 125 15.566 -12.481 -0.772 984 H VAL 126 HN VAL 126 15.756 -9.910 4.852 985 HA VAL 126 HA VAL 126 14.006 -7.993 6.198 986 HB VAL 126 HB VAL 126 16.271 -6.797 6.590 987 1HG1 VAL 126 HG11 VAL 126 15.090 -7.789 8.401 988 2HG1 VAL 126 HG12 VAL 126 16.764 -8.334 8.511 989 3HG1 VAL 126 HG13 VAL 126 15.524 -9.416 7.875 990 1HG2 VAL 126 HG21 VAL 126 17.111 -9.129 5.115 991 2HG2 VAL 126 HG22 VAL 126 17.871 -9.079 6.704 992 3HG2 VAL 126 HG23 VAL 126 18.043 -7.713 5.602 993 H ASP 127 HN ASP 127 13.895 -8.384 3.307 994 HA ASP 127 HA ASP 127 13.801 -7.193 1.371 995 1HB ASP 127 HB2 ASP 127 13.466 -5.118 3.500 996 2HB ASP 127 HB1 ASP 127 13.625 -4.599 1.825 997 H LYS 128 HN LYS 128 16.065 -7.990 1.095 998 HA LYS 128 HA LYS 128 17.731 -5.820 0.249 999 1HB LYS 128 HB2 LYS 128 18.104 -6.657 2.871 1000 2HB LYS 128 HB1 LYS 128 19.357 -7.506 1.977 1001 1HG LYS 128 HG2 LYS 128 19.844 -5.176 0.946 1002 2HG LYS 128 HG1 LYS 128 18.957 -4.572 2.347 1003 1HD LYS 128 HD2 LYS 128 21.233 -6.518 2.610 1004 2HD LYS 128 HD1 LYS 128 21.490 -4.771 2.570 1005 1HE LYS 128 HE2 LYS 128 19.726 -6.233 4.534 1006 2HE LYS 128 HE1 LYS 128 21.359 -5.657 4.867 1007 1HZ LYS 128 HZ1 LYS 128 19.062 -4.257 5.267 1008 2HZ LYS 128 HZ2 LYS 128 19.654 -3.606 3.822 1009 3HZ LYS 128 HZ3 LYS 128 20.621 -3.601 5.210 1010 H LEU 129 HN LEU 129 20.053 -6.921 -0.290 1011 HA LEU 129 HA LEU 129 21.129 -8.252 -1.789 1012 1HB LEU 129 HB2 LEU 129 20.158 -9.868 0.217 1013 2HB LEU 129 HB1 LEU 129 19.579 -10.670 -1.230 1014 HG LEU 129 HG LEU 129 21.751 -11.544 -0.421 1015 1HD1 LEU 129 HD11 LEU 129 22.896 -10.794 -2.799 1016 2HD1 LEU 129 HD12 LEU 129 21.174 -10.566 -3.102 1017 3HD1 LEU 129 HD13 LEU 129 21.775 -12.137 -2.570 1018 1HD2 LEU 129 HD21 LEU 129 22.402 -8.957 0.070 1019 2HD2 LEU 129 HD22 LEU 129 23.256 -9.242 -1.447 1020 3HD2 LEU 129 HD23 LEU 129 23.567 -10.275 -0.052 1021 H VAL 130 HN VAL 130 19.576 -6.858 -3.237 1022 HA VAL 130 HA VAL 130 18.106 -8.737 -4.969 1023 HB VAL 130 HB VAL 130 17.379 -5.839 -4.921 1024 1HG1 VAL 130 HG11 VAL 130 16.525 -7.525 -6.606 1025 2HG1 VAL 130 HG12 VAL 130 15.300 -6.591 -5.747 1026 3HG1 VAL 130 HG13 VAL 130 15.630 -8.258 -5.275 1027 1HG2 VAL 130 HG21 VAL 130 17.255 -6.309 -2.601 1028 2HG2 VAL 130 HG22 VAL 130 16.524 -7.888 -2.889 1029 3HG2 VAL 130 HG23 VAL 130 15.608 -6.419 -3.222 1030 H SER 131 HN SER 131 18.862 -5.314 -5.440 1031 HA SER 131 HA SER 131 20.907 -5.948 -7.406 1032 1HB SER 131 HB2 SER 131 19.311 -4.068 -8.744 1033 2HB SER 131 HB1 SER 131 19.537 -5.764 -9.173 1034 HG SER 131 HG SER 131 17.391 -5.583 -8.905 1035 H ALA 132 HN ALA 132 22.480 -4.469 -7.401 1036 HA ALA 132 HA ALA 132 23.697 -2.624 -6.877 1037 1HB ALA 132 HB1 ALA 132 22.836 -0.583 -7.474 1038 2HB ALA 132 HB2 ALA 132 21.252 -0.923 -6.777 1039 3HB ALA 132 HB3 ALA 132 21.719 -1.664 -8.307 1040 H GLY 133 HN GLY 133 20.884 -1.265 -5.264 1041 1HA GLY 133 HA2 GLY 133 20.574 -1.908 -2.834 1042 2HA GLY 133 HA1 GLY 133 22.302 -1.630 -2.700 1043 H ILE 134 HN ILE 134 19.421 0.073 -3.931 1044 HA ILE 134 HA ILE 134 20.421 2.495 -2.582 1045 HB ILE 134 HB ILE 134 18.574 2.664 -4.933 1046 1HG1 ILE 134 HG12 ILE 134 21.058 3.162 -6.008 1047 2HG1 ILE 134 HG11 ILE 134 21.372 1.775 -4.969 1048 1HG2 ILE 134 HG21 ILE 134 20.766 4.584 -4.429 1049 2HG2 ILE 134 HG22 ILE 134 19.456 4.540 -3.248 1050 3HG2 ILE 134 HG23 ILE 134 19.103 4.868 -4.946 1051 1HD1 ILE 134 HD11 ILE 134 19.002 1.616 -6.723 1052 2HD1 ILE 134 HD12 ILE 134 20.157 0.370 -6.252 1053 3HD1 ILE 134 HD13 ILE 134 20.585 1.545 -7.496 1054 H ARG 135 HN ARG 135 18.848 0.643 -1.238 1055 HA ARG 135 HA ARG 135 16.216 1.956 -1.138 1056 1HB ARG 135 HB2 ARG 135 15.314 -0.074 -0.201 1057 2HB ARG 135 HB1 ARG 135 16.187 -0.471 -1.674 1058 1HG ARG 135 HG2 ARG 135 17.554 -0.676 0.972 1059 2HG ARG 135 HG1 ARG 135 16.468 -1.955 0.427 1060 1HD ARG 135 HD2 ARG 135 17.925 -2.699 -1.112 1061 2HD ARG 135 HD1 ARG 135 18.390 -1.069 -1.596 1062 HE ARG 135 HE ARG 135 19.643 -1.240 0.723 1063 1HH1 ARG 135 HH11 ARG 135 19.369 -3.600 -1.823 1064 2HH1 ARG 135 HH12 ARG 135 20.898 -4.339 -1.480 1065 1HH2 ARG 135 HH21 ARG 135 21.660 -2.205 1.182 1066 2HH2 ARG 135 HH22 ARG 135 22.199 -3.547 0.228 1067 H LYS 136 HN LYS 136 15.409 2.687 0.801 1068 HA LYS 136 HA LYS 136 16.739 2.214 3.294 1069 1HB LYS 136 HB2 LYS 136 18.320 3.818 2.526 1070 2HB LYS 136 HB1 LYS 136 17.058 4.868 1.899 1071 1HG LYS 136 HG2 LYS 136 16.885 5.938 3.832 1072 2HG LYS 136 HG1 LYS 136 16.713 4.425 4.726 1073 1HD LYS 136 HD2 LYS 136 18.810 4.554 5.465 1074 2HD LYS 136 HD1 LYS 136 19.429 4.774 3.828 1075 1HE LYS 136 HE2 LYS 136 19.124 7.129 3.942 1076 2HE LYS 136 HE1 LYS 136 18.201 7.000 5.439 1077 1HZ LYS 136 HZ1 LYS 136 20.952 7.342 5.144 1078 2HZ LYS 136 HZ2 LYS 136 20.715 5.805 5.811 1079 3HZ LYS 136 HZ3 LYS 136 20.073 7.168 6.580 1080 H VAL 137 HN VAL 137 15.183 2.180 4.765 1081 HA VAL 137 HA VAL 137 12.705 3.658 4.233 1082 HB VAL 137 HB VAL 137 12.596 1.183 4.644 1083 1HG1 VAL 137 HG11 VAL 137 13.368 1.998 7.443 1084 2HG1 VAL 137 HG12 VAL 137 14.302 0.980 6.347 1085 3HG1 VAL 137 HG13 VAL 137 12.757 0.409 6.978 1086 1HG2 VAL 137 HG21 VAL 137 10.614 1.303 6.005 1087 2HG2 VAL 137 HG22 VAL 137 10.681 2.722 4.958 1088 3HG2 VAL 137 HG23 VAL 137 11.114 2.862 6.662 1089 H LEU 138 HN LEU 138 11.742 4.963 5.816 1090 HA LEU 138 HA LEU 138 13.463 5.682 8.094 1091 1HB LEU 138 HB2 LEU 138 12.926 7.290 5.885 1092 2HB LEU 138 HB1 LEU 138 11.845 7.888 7.130 1093 HG LEU 138 HG LEU 138 14.676 7.467 7.910 1094 1HD1 LEU 138 HD11 LEU 138 13.822 9.824 6.238 1095 2HD1 LEU 138 HD12 LEU 138 14.829 8.494 5.666 1096 3HD1 LEU 138 HD13 LEU 138 15.410 9.549 6.953 1097 1HD2 LEU 138 HD21 LEU 138 14.086 8.787 9.602 1098 2HD2 LEU 138 HD22 LEU 138 12.426 8.628 9.030 1099 3HD2 LEU 138 HD23 LEU 138 13.407 10.000 8.518 Start of MODEL 4 1 1H MET 1 HT1 MET 1 -22.735 1.878 2.227 2 2H MET 1 HT2 MET 1 -23.565 2.954 3.235 3 3H MET 1 HT3 MET 1 -21.964 2.535 3.582 4 HA MET 1 HA MET 1 -21.542 3.483 1.197 5 1HB MET 1 HB2 MET 1 -24.037 4.878 2.185 6 2HB MET 1 HB1 MET 1 -23.039 5.457 0.858 7 1HG MET 1 HG2 MET 1 -23.484 3.010 -0.048 8 2HG MET 1 HG1 MET 1 -24.913 3.167 0.971 9 1HE MET 1 HE1 MET 1 -24.095 2.852 -2.128 10 2HE MET 1 HE2 MET 1 -23.422 4.395 -2.655 11 3HE MET 1 HE3 MET 1 -25.056 3.936 -3.134 12 H ASN 2 HN ASN 2 -19.679 3.800 2.483 13 HA ASN 2 HA ASN 2 -19.639 5.681 4.636 14 1HB ASN 2 HB2 ASN 2 -18.024 3.658 4.047 15 2HB ASN 2 HB1 ASN 2 -17.130 4.916 3.197 16 1HD2 ASN 2 HD21 ASN 2 -15.876 6.261 4.322 17 2HD2 ASN 2 HD22 ASN 2 -15.746 6.281 6.047 18 H GLU 3 HN GLU 3 -17.109 6.945 3.841 19 HA GLU 3 HA GLU 3 -18.095 9.347 2.846 20 1HB GLU 3 HB2 GLU 3 -15.766 8.565 3.988 21 2HB GLU 3 HB1 GLU 3 -15.247 8.782 2.323 22 1HG GLU 3 HG2 GLU 3 -16.832 11.013 3.015 23 2HG GLU 3 HG1 GLU 3 -15.682 10.740 4.324 24 H LEU 4 HN LEU 4 -15.761 7.262 1.107 25 HA LEU 4 HA LEU 4 -17.227 7.815 -1.367 26 1HB LEU 4 HB2 LEU 4 -14.685 8.885 -0.607 27 2HB LEU 4 HB1 LEU 4 -14.467 7.822 -1.979 28 HG LEU 4 HG LEU 4 -16.466 10.081 -1.929 29 1HD1 LEU 4 HD11 LEU 4 -13.937 10.246 -3.479 30 2HD1 LEU 4 HD12 LEU 4 -13.879 10.580 -1.748 31 3HD1 LEU 4 HD13 LEU 4 -14.934 11.530 -2.794 32 1HD2 LEU 4 HD21 LEU 4 -15.964 9.700 -4.498 33 2HD2 LEU 4 HD22 LEU 4 -17.183 8.757 -3.641 34 3HD2 LEU 4 HD23 LEU 4 -15.584 8.074 -3.933 35 H TYR 5 HN TYR 5 -16.698 5.440 0.477 36 HA TYR 5 HA TYR 5 -16.826 3.368 -1.252 37 1HB TYR 5 HB2 TYR 5 -14.545 2.383 -1.227 38 2HB TYR 5 HB1 TYR 5 -14.608 3.899 -2.115 39 HD1 TYR 5 HD1 TYR 5 -13.365 5.794 -1.405 40 HD2 TYR 5 HD2 TYR 5 -13.484 2.302 1.015 41 HE1 TYR 5 HE1 TYR 5 -11.518 6.683 -0.043 42 HE2 TYR 5 HE2 TYR 5 -11.628 3.178 2.389 43 HH TYR 5 HH TYR 5 -10.767 6.179 2.592 44 H GLN 6 HN GLN 6 -16.566 1.287 -0.156 45 HA GLN 6 HA GLN 6 -17.543 1.361 2.451 46 1HB GLN 6 HB2 GLN 6 -16.329 -0.892 0.874 47 2HB GLN 6 HB1 GLN 6 -17.087 -1.109 2.449 48 1HG GLN 6 HG2 GLN 6 -18.927 -1.504 1.217 49 2HG GLN 6 HG1 GLN 6 -19.021 0.259 1.178 50 1HE2 GLN 6 HE21 GLN 6 -16.538 0.182 -0.568 51 2HE2 GLN 6 HE22 GLN 6 -17.151 -0.138 -2.141 52 H LEU 7 HN LEU 7 -16.484 2.071 4.163 53 HA LEU 7 HA LEU 7 -13.660 2.066 4.414 54 1HB LEU 7 HB2 LEU 7 -15.772 3.309 5.703 55 2HB LEU 7 HB1 LEU 7 -15.124 2.240 6.932 56 HG LEU 7 HG LEU 7 -13.651 4.438 5.474 57 1HD1 LEU 7 HD11 LEU 7 -15.052 4.233 8.000 58 2HD1 LEU 7 HD12 LEU 7 -14.432 5.656 7.163 59 3HD1 LEU 7 HD13 LEU 7 -13.370 4.718 8.214 60 1HD2 LEU 7 HD21 LEU 7 -12.623 2.023 6.627 61 2HD2 LEU 7 HD22 LEU 7 -12.086 3.414 7.569 62 3HD2 LEU 7 HD23 LEU 7 -11.757 3.341 5.838 63 H GLU 8 HN GLU 8 -12.407 0.411 4.861 64 HA GLU 8 HA GLU 8 -13.057 -1.490 6.932 65 1HB GLU 8 HB2 GLU 8 -14.222 -2.395 4.938 66 2HB GLU 8 HB1 GLU 8 -12.671 -2.483 4.110 67 1HG GLU 8 HG2 GLU 8 -12.905 -4.623 4.881 68 2HG GLU 8 HG1 GLU 8 -11.945 -3.890 6.165 69 H LYS 9 HN LYS 9 -11.076 0.235 7.096 70 HA LYS 9 HA LYS 9 -8.625 -0.855 6.002 71 1HB LYS 9 HB2 LYS 9 -8.958 1.386 7.986 72 2HB LYS 9 HB1 LYS 9 -7.530 1.020 7.029 73 1HG LYS 9 HG2 LYS 9 -10.025 2.412 6.262 74 2HG LYS 9 HG1 LYS 9 -8.359 2.711 5.793 75 1HD LYS 9 HD2 LYS 9 -8.556 1.520 3.918 76 2HD LYS 9 HD1 LYS 9 -9.363 0.193 4.743 77 1HE LYS 9 HE2 LYS 9 -11.467 1.515 4.702 78 2HE LYS 9 HE1 LYS 9 -10.631 2.732 3.738 79 1HZ LYS 9 HZ1 LYS 9 -11.678 0.164 2.952 80 2HZ LYS 9 HZ2 LYS 9 -10.116 0.465 2.379 81 3HZ LYS 9 HZ3 LYS 9 -11.370 1.539 2.016 82 H GLU 10 HN GLU 10 -10.442 -2.189 8.014 83 HA GLU 10 HA GLU 10 -8.342 -3.004 9.904 84 1HB GLU 10 HB2 GLU 10 -10.679 -3.486 11.268 85 2HB GLU 10 HB1 GLU 10 -9.632 -2.099 11.528 86 1HG GLU 10 HG2 GLU 10 -10.991 -0.680 10.314 87 2HG GLU 10 HG1 GLU 10 -11.780 -2.006 9.463 88 HA PRO 11 HA PRO 11 -9.026 -7.316 9.068 89 1HB PRO 11 HB2 PRO 11 -10.692 -8.099 11.223 90 2HB PRO 11 HB1 PRO 11 -8.937 -8.287 11.109 91 1HG PRO 11 HG2 PRO 11 -10.538 -6.139 12.413 92 2HG PRO 11 HG1 PRO 11 -8.984 -6.840 12.910 93 1HD PRO 11 HD2 PRO 11 -9.052 -4.432 11.816 94 2HD PRO 11 HD1 PRO 11 -7.794 -5.586 11.312 95 H ILE 12 HN ILE 12 -10.314 -7.756 7.419 96 HA ILE 12 HA ILE 12 -13.100 -6.942 7.462 97 HB ILE 12 HB ILE 12 -11.876 -8.523 5.232 98 1HG1 ILE 12 HG12 ILE 12 -11.407 -5.601 5.846 99 2HG1 ILE 12 HG11 ILE 12 -10.188 -6.857 5.700 100 1HG2 ILE 12 HG21 ILE 12 -13.338 -6.749 4.003 101 2HG2 ILE 12 HG22 ILE 12 -14.078 -6.537 5.590 102 3HG2 ILE 12 HG23 ILE 12 -14.108 -8.117 4.807 103 1HD1 ILE 12 HD11 ILE 12 -9.949 -5.985 3.646 104 2HD1 ILE 12 HD12 ILE 12 -11.578 -5.309 3.624 105 3HD1 ILE 12 HD13 ILE 12 -11.327 -7.018 3.269 106 H VAL 13 HN VAL 13 -14.835 -8.380 7.246 107 HA VAL 13 HA VAL 13 -14.917 -10.621 8.781 108 HB VAL 13 HB VAL 13 -16.945 -9.578 8.009 109 1HG1 VAL 13 HG11 VAL 13 -16.786 -8.837 5.877 110 2HG1 VAL 13 HG12 VAL 13 -17.608 -10.361 5.545 111 3HG1 VAL 13 HG13 VAL 13 -15.861 -10.240 5.340 112 1HG2 VAL 13 HG21 VAL 13 -17.448 -11.717 8.710 113 2HG2 VAL 13 HG22 VAL 13 -16.564 -12.474 7.385 114 3HG2 VAL 13 HG23 VAL 13 -18.122 -11.705 7.080 115 H GLY 14 HN GLY 14 -14.373 -10.618 5.230 116 1HA GLY 14 HA2 GLY 14 -12.730 -12.955 5.440 117 2HA GLY 14 HA1 GLY 14 -14.317 -13.339 4.798 118 H ALA 15 HN ALA 15 -11.906 -10.753 4.277 119 HA ALA 15 HA ALA 15 -12.431 -10.832 1.404 120 1HB ALA 15 HB1 ALA 15 -12.123 -8.722 2.854 121 2HB ALA 15 HB2 ALA 15 -11.329 -8.789 1.279 122 3HB ALA 15 HB3 ALA 15 -10.401 -9.084 2.748 123 H GLU 16 HN GLU 16 -10.592 -10.887 -0.117 124 HA GLU 16 HA GLU 16 -8.818 -13.080 0.470 125 1HB GLU 16 HB2 GLU 16 -9.926 -12.490 -1.785 126 2HB GLU 16 HB1 GLU 16 -8.648 -11.294 -1.948 127 1HG GLU 16 HG2 GLU 16 -6.994 -12.890 -2.140 128 2HG GLU 16 HG1 GLU 16 -7.965 -14.138 -1.360 129 H THR 17 HN THR 17 -6.557 -12.991 0.772 130 HA THR 17 HA THR 17 -5.611 -10.450 1.771 131 HB THR 17 HB THR 17 -4.183 -11.592 3.028 132 HG1 THR 17 HG1 THR 17 -3.458 -13.002 0.656 133 1HG2 THR 17 HG21 THR 17 -6.233 -13.149 2.842 134 2HG2 THR 17 HG22 THR 17 -4.752 -13.798 3.544 135 3HG2 THR 17 HG23 THR 17 -5.178 -14.183 1.877 136 H PHE 18 HN PHE 18 -4.093 -9.174 1.111 137 HA PHE 18 HA PHE 18 -2.684 -9.712 -1.388 138 1HB PHE 18 HB2 PHE 18 -4.827 -7.746 -0.879 139 2HB PHE 18 HB1 PHE 18 -3.432 -7.119 -1.724 140 HD1 PHE 18 HD1 PHE 18 -5.990 -9.794 -1.831 141 HD2 PHE 18 HD2 PHE 18 -3.183 -7.462 -4.015 142 HE1 PHE 18 HE1 PHE 18 -6.851 -10.733 -3.936 143 HE2 PHE 18 HE2 PHE 18 -4.039 -8.391 -6.123 144 HZ PHE 18 HZ PHE 18 -5.981 -9.973 -6.067 145 H TYR 19 HN TYR 19 -0.640 -9.605 -0.653 146 HA TYR 19 HA TYR 19 0.269 -7.938 1.438 147 1HB TYR 19 HB2 TYR 19 1.674 -9.741 1.054 148 2HB TYR 19 HB1 TYR 19 1.570 -9.582 -0.693 149 HD1 TYR 19 HD1 TYR 19 2.786 -7.623 -1.775 150 HD2 TYR 19 HD2 TYR 19 3.565 -8.903 2.223 151 HE1 TYR 19 HE1 TYR 19 4.915 -6.394 -1.799 152 HE2 TYR 19 HE2 TYR 19 5.698 -7.675 2.189 153 HH TYR 19 HH TYR 19 6.464 -5.336 0.262 154 H VAL 20 HN VAL 20 1.584 -6.065 1.343 155 HA VAL 20 HA VAL 20 1.952 -4.729 -1.179 156 HB VAL 20 HB VAL 20 0.727 -2.779 0.534 157 1HG1 VAL 20 HG11 VAL 20 0.376 -3.830 -2.236 158 2HG1 VAL 20 HG12 VAL 20 0.961 -2.255 -1.700 159 3HG1 VAL 20 HG13 VAL 20 -0.754 -2.649 -1.574 160 1HG2 VAL 20 HG21 VAL 20 -0.609 -4.616 1.415 161 2HG2 VAL 20 HG22 VAL 20 -1.031 -5.113 -0.223 162 3HG2 VAL 20 HG23 VAL 20 -1.596 -3.564 0.401 163 H ASP 21 HN ASP 21 3.966 -4.073 -1.051 164 HA ASP 21 HA ASP 21 4.855 -2.221 0.858 165 1HB ASP 21 HB2 ASP 21 5.031 -3.919 2.486 166 2HB ASP 21 HB1 ASP 21 5.649 -5.087 1.324 167 H GLY 22 HN GLY 22 6.742 -1.245 0.230 168 1HA GLY 22 HA2 GLY 22 8.317 -2.509 -1.895 169 2HA GLY 22 HA1 GLY 22 7.614 -0.926 -2.198 170 H ALA 23 HN ALA 23 10.447 -1.765 -2.071 171 HA ALA 23 HA ALA 23 11.314 -0.080 0.192 172 1HB ALA 23 HB1 ALA 23 13.577 -1.366 -0.665 173 2HB ALA 23 HB2 ALA 23 12.331 -2.592 -0.906 174 3HB ALA 23 HB3 ALA 23 12.564 -1.873 0.687 175 H ALA 24 HN ALA 24 11.713 1.876 -0.431 176 HA ALA 24 HA ALA 24 13.381 2.344 -2.777 177 1HB ALA 24 HB1 ALA 24 11.344 2.861 -3.742 178 2HB ALA 24 HB2 ALA 24 11.873 4.427 -3.129 179 3HB ALA 24 HB3 ALA 24 10.674 3.487 -2.236 180 H ASN 25 HN ASN 25 15.061 3.540 -2.214 181 HA ASN 25 HA ASN 25 15.548 4.486 0.323 182 1HB ASN 25 HB2 ASN 25 17.091 4.200 -1.802 183 2HB ASN 25 HB1 ASN 25 16.762 5.918 -2.006 184 1HD2 ASN 25 HD21 ASN 25 16.628 6.612 0.722 185 2HD2 ASN 25 HD22 ASN 25 18.217 6.480 1.388 186 H ARG 26 HN ARG 26 14.541 6.010 1.447 187 HA ARG 26 HA ARG 26 12.835 7.953 0.286 188 1HB ARG 26 HB2 ARG 26 12.472 7.080 2.539 189 2HB ARG 26 HB1 ARG 26 13.984 7.798 3.076 190 1HG ARG 26 HG2 ARG 26 13.142 9.948 2.997 191 2HG ARG 26 HG1 ARG 26 11.845 9.503 1.886 192 1HD ARG 26 HD2 ARG 26 10.578 8.514 3.575 193 2HD ARG 26 HD1 ARG 26 11.965 8.359 4.651 194 HE ARG 26 HE ARG 26 10.259 10.653 4.339 195 1HH1 ARG 26 HH11 ARG 26 13.409 9.538 5.331 196 2HH1 ARG 26 HH12 ARG 26 13.693 10.884 6.384 197 1HH2 ARG 26 HH21 ARG 26 10.625 12.423 5.727 198 2HH2 ARG 26 HH22 ARG 26 12.112 12.522 6.610 199 H GLU 27 HN GLU 27 16.186 7.968 1.279 200 HA GLU 27 HA GLU 27 16.718 10.665 1.527 201 1HB GLU 27 HB2 GLU 27 18.351 8.859 1.955 202 2HB GLU 27 HB1 GLU 27 18.488 8.588 0.224 203 1HG GLU 27 HG2 GLU 27 18.955 11.338 0.706 204 2HG GLU 27 HG1 GLU 27 19.914 10.412 1.859 205 H THR 28 HN THR 28 16.153 8.781 -1.350 206 HA THR 28 HA THR 28 16.532 11.198 -3.000 207 HB THR 28 HB THR 28 18.058 9.648 -3.876 208 HG1 THR 28 HG1 THR 28 16.324 8.646 -5.635 209 1HG2 THR 28 HG21 THR 28 17.790 7.615 -2.887 210 2HG2 THR 28 HG22 THR 28 17.053 7.250 -4.447 211 3HG2 THR 28 HG23 THR 28 16.036 7.641 -3.059 212 H LYS 29 HN LYS 29 14.222 9.363 -1.568 213 HA LYS 29 HA LYS 29 11.993 9.005 -1.900 214 1HB LYS 29 HB2 LYS 29 12.435 11.426 -3.656 215 2HB LYS 29 HB1 LYS 29 10.844 10.720 -3.405 216 1HG LYS 29 HG2 LYS 29 10.608 11.804 -1.491 217 2HG LYS 29 HG1 LYS 29 12.125 11.145 -0.878 218 1HD LYS 29 HD2 LYS 29 13.366 12.953 -1.643 219 2HD LYS 29 HD1 LYS 29 12.142 13.416 -2.827 220 1HE LYS 29 HE2 LYS 29 11.708 13.579 0.148 221 2HE LYS 29 HE1 LYS 29 12.343 14.916 -0.809 222 1HZ LYS 29 HZ1 LYS 29 10.275 14.646 -2.211 223 2HZ LYS 29 HZ2 LYS 29 10.050 15.279 -0.659 224 3HZ LYS 29 HZ3 LYS 29 9.669 13.662 -0.975 225 H LEU 30 HN LEU 30 13.970 7.636 -3.465 226 HA LEU 30 HA LEU 30 12.299 6.792 -5.725 227 1HB LEU 30 HB2 LEU 30 14.057 8.323 -6.539 228 2HB LEU 30 HB1 LEU 30 15.280 7.277 -5.843 229 HG LEU 30 HG LEU 30 13.376 6.126 -7.837 230 1HD1 LEU 30 HD11 LEU 30 14.860 8.421 -8.414 231 2HD1 LEU 30 HD12 LEU 30 14.085 7.328 -9.560 232 3HD1 LEU 30 HD13 LEU 30 15.772 7.080 -9.108 233 1HD2 LEU 30 HD21 LEU 30 15.035 4.755 -6.576 234 2HD2 LEU 30 HD22 LEU 30 16.317 5.670 -7.376 235 3HD2 LEU 30 HD23 LEU 30 15.212 4.682 -8.331 236 H GLY 31 HN GLY 31 12.702 4.628 -6.465 237 1HA GLY 31 HA2 GLY 31 14.472 2.768 -5.759 238 2HA GLY 31 HA1 GLY 31 13.520 2.879 -4.288 239 H LYS 32 HN LYS 32 12.667 0.843 -4.371 240 HA LYS 32 HA LYS 32 10.958 0.217 -6.685 241 1HB LYS 32 HB2 LYS 32 12.038 -1.787 -4.715 242 2HB LYS 32 HB1 LYS 32 11.314 -2.096 -6.287 243 1HG LYS 32 HG2 LYS 32 13.278 -1.935 -7.305 244 2HG LYS 32 HG1 LYS 32 13.614 -0.379 -6.543 245 1HD LYS 32 HD2 LYS 32 15.340 -1.885 -5.879 246 2HD LYS 32 HD1 LYS 32 14.291 -1.638 -4.482 247 1HE LYS 32 HE2 LYS 32 14.914 -3.996 -4.762 248 2HE LYS 32 HE1 LYS 32 13.175 -3.749 -4.914 249 1HZ LYS 32 HZ1 LYS 32 13.701 -5.154 -6.664 250 2HZ LYS 32 HZ2 LYS 32 15.143 -4.349 -7.031 251 3HZ LYS 32 HZ3 LYS 32 13.658 -3.634 -7.408 252 H ALA 33 HN ALA 33 8.942 -0.732 -6.357 253 HA ALA 33 HA ALA 33 7.863 -1.047 -3.700 254 1HB ALA 33 HB1 ALA 33 7.510 1.425 -5.089 255 2HB ALA 33 HB2 ALA 33 6.907 0.947 -3.503 256 3HB ALA 33 HB3 ALA 33 5.953 0.608 -4.947 257 H GLY 34 HN GLY 34 6.712 -2.886 -3.814 258 1HA GLY 34 HA2 GLY 34 4.925 -3.287 -6.107 259 2HA GLY 34 HA1 GLY 34 6.164 -4.499 -5.837 260 H TYR 35 HN TYR 35 4.388 -5.990 -5.630 261 HA TYR 35 HA TYR 35 3.753 -6.384 -2.883 262 1HB TYR 35 HB2 TYR 35 1.516 -5.903 -2.749 263 2HB TYR 35 HB1 TYR 35 2.059 -4.626 -3.826 264 HD1 TYR 35 HD1 TYR 35 1.593 -4.803 -6.284 265 HD2 TYR 35 HD2 TYR 35 0.015 -7.555 -3.465 266 HE1 TYR 35 HE1 TYR 35 -0.072 -5.542 -7.948 267 HE2 TYR 35 HE2 TYR 35 -1.630 -8.315 -5.099 268 HH TYR 35 HH TYR 35 -1.870 -6.807 -8.303 269 H VAL 36 HN VAL 36 2.039 -8.163 -2.629 270 HA VAL 36 HA VAL 36 2.432 -10.211 -4.702 271 HB VAL 36 HB VAL 36 3.438 -10.301 -2.064 272 1HG1 VAL 36 HG11 VAL 36 1.193 -10.952 -1.299 273 2HG1 VAL 36 HG12 VAL 36 2.373 -12.245 -1.081 274 3HG1 VAL 36 HG13 VAL 36 1.222 -12.317 -2.416 275 1HG2 VAL 36 HG21 VAL 36 3.683 -11.721 -4.485 276 2HG2 VAL 36 HG22 VAL 36 3.377 -12.910 -3.221 277 3HG2 VAL 36 HG23 VAL 36 4.732 -11.792 -3.069 278 H THR 37 HN THR 37 0.700 -11.451 -5.183 279 HA THR 37 HA THR 37 -1.871 -10.648 -3.998 280 HB THR 37 HB THR 37 -1.249 -11.982 -6.636 281 HG1 THR 37 HG1 THR 37 -1.977 -9.898 -7.444 282 1HG2 THR 37 HG21 THR 37 -3.415 -12.284 -7.011 283 2HG2 THR 37 HG22 THR 37 -3.831 -10.702 -6.349 284 3HG2 THR 37 HG23 THR 37 -3.621 -12.080 -5.270 285 H ASN 38 HN ASN 38 -3.356 -12.262 -3.289 286 HA ASN 38 HA ASN 38 -2.336 -14.531 -2.094 287 1HB ASN 38 HB2 ASN 38 -4.514 -15.128 -1.603 288 2HB ASN 38 HB1 ASN 38 -4.714 -13.419 -1.978 289 1HD2 ASN 38 HD21 ASN 38 -4.958 -13.107 -4.487 290 2HD2 ASN 38 HD22 ASN 38 -6.176 -14.103 -5.202 291 H ARG 39 HN ARG 39 -2.860 -14.010 -5.431 292 HA ARG 39 HA ARG 39 -2.914 -16.858 -6.092 293 1HB ARG 39 HB2 ARG 39 -2.793 -14.644 -8.117 294 2HB ARG 39 HB1 ARG 39 -3.512 -16.244 -8.267 295 1HG ARG 39 HG2 ARG 39 -5.448 -15.628 -7.221 296 2HG ARG 39 HG1 ARG 39 -4.668 -14.342 -6.297 297 1HD ARG 39 HD2 ARG 39 -5.185 -12.832 -7.843 298 2HD ARG 39 HD1 ARG 39 -4.466 -13.818 -9.116 299 HE ARG 39 HE ARG 39 -7.260 -14.031 -8.200 300 1HH1 ARG 39 HH11 ARG 39 -4.799 -14.399 -10.642 301 2HH1 ARG 39 HH12 ARG 39 -5.918 -14.866 -11.881 302 1HH2 ARG 39 HH21 ARG 39 -8.738 -14.644 -9.828 303 2HH2 ARG 39 HH22 ARG 39 -8.154 -15.004 -11.418 304 H GLY 40 HN GLY 40 -0.551 -15.316 -4.960 305 1HA GLY 40 HA2 GLY 40 1.730 -15.407 -5.184 306 2HA GLY 40 HA1 GLY 40 1.475 -16.635 -6.413 307 H ARG 41 HN ARG 41 0.582 -13.172 -6.299 308 HA ARG 41 HA ARG 41 1.899 -12.877 -8.908 309 1HB ARG 41 HB2 ARG 41 -0.100 -11.945 -9.360 310 2HB ARG 41 HB1 ARG 41 -0.467 -11.680 -7.672 311 1HG ARG 41 HG2 ARG 41 0.249 -9.530 -7.710 312 2HG ARG 41 HG1 ARG 41 1.566 -9.878 -8.838 313 1HD ARG 41 HD2 ARG 41 -1.297 -9.245 -9.378 314 2HD ARG 41 HD1 ARG 41 0.157 -8.636 -10.167 315 HE ARG 41 HE ARG 41 -0.843 -11.377 -10.586 316 1HH1 ARG 41 HH11 ARG 41 0.404 -8.355 -11.794 317 2HH1 ARG 41 HH12 ARG 41 0.486 -8.898 -13.436 318 1HH2 ARG 41 HH21 ARG 41 -0.739 -12.101 -12.744 319 2HH2 ARG 41 HH22 ARG 41 -0.165 -11.028 -13.977 320 H GLN 42 HN GLN 42 3.133 -10.879 -9.288 321 HA GLN 42 HA GLN 42 4.139 -9.483 -6.955 322 1HB GLN 42 HB2 GLN 42 5.740 -11.531 -8.432 323 2HB GLN 42 HB1 GLN 42 6.555 -10.113 -7.791 324 1HG GLN 42 HG2 GLN 42 4.787 -11.720 -6.012 325 2HG GLN 42 HG1 GLN 42 6.409 -12.298 -6.391 326 1HE2 GLN 42 HE21 GLN 42 4.528 -9.860 -4.804 327 2HE2 GLN 42 HE22 GLN 42 5.819 -9.164 -3.889 328 H LYS 43 HN LYS 43 4.685 -7.457 -7.430 329 HA LYS 43 HA LYS 43 5.623 -6.806 -10.128 330 1HB LYS 43 HB2 LYS 43 4.025 -4.617 -9.441 331 2HB LYS 43 HB1 LYS 43 3.729 -5.786 -10.719 332 1HG LYS 43 HG2 LYS 43 2.875 -6.685 -8.078 333 2HG LYS 43 HG1 LYS 43 2.049 -5.229 -8.651 334 1HD LYS 43 HD2 LYS 43 2.327 -7.782 -10.238 335 2HD LYS 43 HD1 LYS 43 0.908 -7.345 -9.286 336 1HE LYS 43 HE2 LYS 43 1.636 -5.171 -11.008 337 2HE LYS 43 HE1 LYS 43 1.483 -6.654 -11.950 338 1HZ LYS 43 HZ1 LYS 43 -0.578 -5.120 -11.386 339 2HZ LYS 43 HZ2 LYS 43 -0.618 -6.094 -10.004 340 3HZ LYS 43 HZ3 LYS 43 -0.723 -6.800 -11.538 341 H VAL 44 HN VAL 44 6.427 -4.495 -10.214 342 HA VAL 44 HA VAL 44 7.270 -3.355 -7.684 343 HB VAL 44 HB VAL 44 9.696 -3.273 -8.659 344 1HG1 VAL 44 HG11 VAL 44 10.315 -5.080 -7.273 345 2HG1 VAL 44 HG12 VAL 44 8.766 -5.889 -7.508 346 3HG1 VAL 44 HG13 VAL 44 8.851 -4.405 -6.559 347 1HG2 VAL 44 HG21 VAL 44 10.330 -4.790 -10.217 348 2HG2 VAL 44 HG22 VAL 44 8.646 -4.632 -10.712 349 3HG2 VAL 44 HG23 VAL 44 9.142 -5.986 -9.697 350 H VAL 45 HN VAL 45 7.922 -1.203 -7.852 351 HA VAL 45 HA VAL 45 7.907 0.029 -10.517 352 HB VAL 45 HB VAL 45 6.420 1.784 -9.861 353 1HG1 VAL 45 HG11 VAL 45 5.598 -0.979 -9.813 354 2HG1 VAL 45 HG12 VAL 45 4.794 0.422 -10.522 355 3HG1 VAL 45 HG13 VAL 45 4.529 0.018 -8.826 356 1HG2 VAL 45 HG21 VAL 45 6.890 2.254 -7.636 357 2HG2 VAL 45 HG22 VAL 45 6.689 0.577 -7.134 358 3HG2 VAL 45 HG23 VAL 45 5.277 1.546 -7.549 359 H THR 46 HN THR 46 8.415 2.501 -10.212 360 HA THR 46 HA THR 46 10.636 2.696 -8.290 361 HB THR 46 HB THR 46 11.801 4.177 -9.776 362 HG1 THR 46 HG1 THR 46 10.633 5.295 -11.135 363 1HG2 THR 46 HG21 THR 46 10.935 2.093 -11.716 364 2HG2 THR 46 HG22 THR 46 11.640 1.559 -10.191 365 3HG2 THR 46 HG23 THR 46 12.559 2.614 -11.265 366 H LEU 47 HN LEU 47 10.585 4.292 -6.845 367 HA LEU 47 HA LEU 47 8.270 5.902 -6.563 368 1HB LEU 47 HB2 LEU 47 10.719 5.428 -5.069 369 2HB LEU 47 HB1 LEU 47 10.220 7.107 -5.011 370 HG LEU 47 HG LEU 47 7.952 6.299 -4.268 371 1HD1 LEU 47 HD11 LEU 47 7.637 4.100 -4.538 372 2HD1 LEU 47 HD12 LEU 47 8.529 3.948 -3.026 373 3HD1 LEU 47 HD13 LEU 47 9.366 3.757 -4.564 374 1HD2 LEU 47 HD21 LEU 47 9.694 7.308 -2.827 375 2HD2 LEU 47 HD22 LEU 47 10.260 5.684 -2.448 376 3HD2 LEU 47 HD23 LEU 47 8.632 6.178 -1.989 377 H THR 48 HN THR 48 7.904 8.014 -6.903 378 HA THR 48 HA THR 48 10.005 9.674 -8.083 379 HB THR 48 HB THR 48 7.978 10.552 -9.589 380 HG1 THR 48 HG1 THR 48 6.403 9.152 -9.701 381 1HG2 THR 48 HG21 THR 48 10.014 9.980 -10.616 382 2HG2 THR 48 HG22 THR 48 8.820 8.935 -11.385 383 3HG2 THR 48 HG23 THR 48 9.881 8.290 -10.133 384 H ASP 49 HN ASP 49 10.119 11.242 -6.579 385 HA ASP 49 HA ASP 49 9.526 12.947 -5.195 386 1HB ASP 49 HB2 ASP 49 8.229 13.570 -7.368 387 2HB ASP 49 HB1 ASP 49 6.806 13.048 -6.470 388 H THR 50 HN THR 50 8.481 10.003 -4.976 389 HA THR 50 HA THR 50 6.381 10.366 -2.972 390 HB THR 50 HB THR 50 6.772 7.675 -3.095 391 HG1 THR 50 HG1 THR 50 6.783 7.842 -5.724 392 1HG2 THR 50 HG21 THR 50 4.617 8.707 -3.297 393 2HG2 THR 50 HG22 THR 50 4.861 7.689 -4.716 394 3HG2 THR 50 HG23 THR 50 5.054 9.437 -4.842 395 H THR 51 HN THR 51 6.581 9.563 -0.848 396 HA THR 51 HA THR 51 9.327 9.506 0.138 397 HB THR 51 HB THR 51 7.236 9.247 2.158 398 HG1 THR 51 HG1 THR 51 7.221 11.791 1.043 399 1HG2 THR 51 HG21 THR 51 8.972 10.136 3.245 400 2HG2 THR 51 HG22 THR 51 8.597 11.664 2.449 401 3HG2 THR 51 HG23 THR 51 9.777 10.564 1.735 402 H ASN 52 HN ASN 52 9.360 8.051 2.335 403 HA ASN 52 HA ASN 52 9.636 5.421 1.479 404 1HB ASN 52 HB2 ASN 52 9.956 4.827 3.812 405 2HB ASN 52 HB1 ASN 52 10.747 6.364 3.483 406 1HD2 ASN 52 HD21 ASN 52 8.909 8.220 3.702 407 2HD2 ASN 52 HD22 ASN 52 8.155 8.210 5.256 408 H GLN 53 HN GLN 53 7.031 6.733 3.566 409 HA GLN 53 HA GLN 53 5.530 4.362 3.616 410 1HB GLN 53 HB2 GLN 53 5.151 6.414 5.057 411 2HB GLN 53 HB1 GLN 53 4.373 7.154 3.664 412 1HG GLN 53 HG2 GLN 53 3.482 4.533 4.821 413 2HG GLN 53 HG1 GLN 53 2.855 6.085 5.370 414 1HE2 GLN 53 HE21 GLN 53 1.750 7.408 3.811 415 2HE2 GLN 53 HE22 GLN 53 0.922 6.677 2.490 416 H LYS 54 HN LYS 54 5.579 7.103 1.432 417 HA LYS 54 HA LYS 54 3.453 6.414 -0.206 418 1HB LYS 54 HB2 LYS 54 5.817 8.168 -0.431 419 2HB LYS 54 HB1 LYS 54 5.086 7.666 -1.951 420 1HG LYS 54 HG2 LYS 54 3.867 9.545 -1.575 421 2HG LYS 54 HG1 LYS 54 2.863 8.387 -0.701 422 1HD LYS 54 HD2 LYS 54 5.048 9.966 0.639 423 2HD LYS 54 HD1 LYS 54 3.398 10.573 0.491 424 1HE LYS 54 HE2 LYS 54 2.958 8.083 1.490 425 2HE LYS 54 HE1 LYS 54 4.500 8.482 2.244 426 1HZ LYS 54 HZ1 LYS 54 3.590 10.222 3.399 427 2HZ LYS 54 HZ2 LYS 54 2.281 9.151 3.380 428 3HZ LYS 54 HZ3 LYS 54 2.322 10.454 2.304 429 H THR 55 HN THR 55 6.632 5.019 0.037 430 HA THR 55 HA THR 55 6.737 3.787 -2.521 431 HB THR 55 HB THR 55 8.438 2.383 -1.722 432 HG1 THR 55 HG1 THR 55 8.539 2.234 0.786 433 1HG2 THR 55 HG21 THR 55 8.402 5.049 -0.560 434 2HG2 THR 55 HG22 THR 55 9.709 4.186 -1.368 435 3HG2 THR 55 HG23 THR 55 9.407 3.921 0.350 436 H GLU 56 HN GLU 56 5.412 2.983 0.586 437 HA GLU 56 HA GLU 56 4.321 0.448 -0.224 438 1HB GLU 56 HB2 GLU 56 3.173 1.726 2.157 439 2HB GLU 56 HB1 GLU 56 3.924 0.146 1.982 440 1HG GLU 56 HG2 GLU 56 5.629 2.590 1.962 441 2HG GLU 56 HG1 GLU 56 5.010 1.972 3.490 442 H LEU 57 HN LEU 57 3.368 3.756 -0.251 443 HA LEU 57 HA LEU 57 0.540 3.383 -0.410 444 1HB LEU 57 HB2 LEU 57 2.166 5.521 -0.010 445 2HB LEU 57 HB1 LEU 57 1.742 5.753 -1.690 446 HG LEU 57 HG LEU 57 -0.495 6.175 -1.214 447 1HD1 LEU 57 HD11 LEU 57 -0.020 4.367 1.056 448 2HD1 LEU 57 HD12 LEU 57 -1.444 4.565 0.034 449 3HD1 LEU 57 HD13 LEU 57 -1.148 5.688 1.362 450 1HD2 LEU 57 HD21 LEU 57 1.471 7.373 0.552 451 2HD2 LEU 57 HD22 LEU 57 -0.156 7.408 1.231 452 3HD2 LEU 57 HD23 LEU 57 0.154 8.120 -0.352 453 H GLN 58 HN GLN 58 3.111 3.953 -2.766 454 HA GLN 58 HA GLN 58 1.478 3.920 -5.059 455 1HB GLN 58 HB2 GLN 58 3.734 4.822 -5.167 456 2HB GLN 58 HB1 GLN 58 4.416 3.275 -4.671 457 1HG GLN 58 HG2 GLN 58 4.622 3.813 -7.103 458 2HG GLN 58 HG1 GLN 58 3.875 2.259 -6.733 459 1HE2 GLN 58 HE21 GLN 58 1.934 1.825 -7.555 460 2HE2 GLN 58 HE22 GLN 58 0.926 2.952 -8.392 461 H ALA 59 HN ALA 59 3.417 1.476 -3.415 462 HA ALA 59 HA ALA 59 2.723 -0.720 -5.034 463 1HB ALA 59 HB1 ALA 59 3.708 -2.067 -3.387 464 2HB ALA 59 HB2 ALA 59 3.313 -0.933 -2.095 465 3HB ALA 59 HB3 ALA 59 4.574 -0.536 -3.261 466 H ILE 60 HN ILE 60 1.143 0.917 -2.378 467 HA ILE 60 HA ILE 60 -0.732 -1.011 -1.648 468 HB ILE 60 HB ILE 60 -0.474 1.879 -1.302 469 1HG1 ILE 60 HG12 ILE 60 -1.965 0.056 0.536 470 2HG1 ILE 60 HG11 ILE 60 -0.236 -0.195 0.311 471 1HG2 ILE 60 HG21 ILE 60 -2.586 2.067 -2.384 472 2HG2 ILE 60 HG22 ILE 60 -2.882 2.176 -0.649 473 3HG2 ILE 60 HG23 ILE 60 -3.228 0.676 -1.510 474 1HD1 ILE 60 HD11 ILE 60 -1.679 2.020 1.640 475 2HD1 ILE 60 HD12 ILE 60 -0.177 2.405 0.799 476 3HD1 ILE 60 HD13 ILE 60 -0.182 1.205 2.091 477 H TYR 61 HN TYR 61 -1.053 1.600 -4.037 478 HA TYR 61 HA TYR 61 -3.561 0.985 -5.044 479 1HB TYR 61 HB2 TYR 61 -2.923 2.871 -6.110 480 2HB TYR 61 HB1 TYR 61 -1.219 2.498 -5.915 481 HD1 TYR 61 HD1 TYR 61 -3.908 2.805 -8.206 482 HD2 TYR 61 HD2 TYR 61 -0.195 0.785 -7.623 483 HE1 TYR 61 HE1 TYR 61 -3.746 2.406 -10.625 484 HE2 TYR 61 HE2 TYR 61 -0.034 0.388 -10.041 485 HH TYR 61 HH TYR 61 -0.962 1.512 -12.162 486 H LEU 62 HN LEU 62 -0.490 -0.566 -5.536 487 HA LEU 62 HA LEU 62 -1.127 -2.060 -7.824 488 1HB LEU 62 HB2 LEU 62 1.014 -1.716 -6.019 489 2HB LEU 62 HB1 LEU 62 0.709 -3.425 -6.133 490 HG LEU 62 HG LEU 62 1.445 -1.503 -8.337 491 1HD1 LEU 62 HD11 LEU 62 3.452 -2.601 -8.475 492 2HD1 LEU 62 HD12 LEU 62 2.817 -4.082 -7.757 493 3HD1 LEU 62 HD13 LEU 62 3.132 -2.675 -6.743 494 1HD2 LEU 62 HD21 LEU 62 -0.067 -3.985 -8.517 495 2HD2 LEU 62 HD22 LEU 62 1.398 -3.993 -9.498 496 3HD2 LEU 62 HD23 LEU 62 0.194 -2.724 -9.722 497 H ALA 63 HN ALA 63 -1.092 -2.999 -4.366 498 HA ALA 63 HA ALA 63 -2.138 -5.586 -4.796 499 1HB ALA 63 HB1 ALA 63 -2.945 -5.197 -2.316 500 2HB ALA 63 HB2 ALA 63 -1.874 -3.801 -2.431 501 3HB ALA 63 HB3 ALA 63 -1.238 -5.424 -2.698 502 H LEU 64 HN LEU 64 -3.495 -2.456 -4.723 503 HA LEU 64 HA LEU 64 -6.231 -3.364 -4.357 504 1HB LEU 64 HB2 LEU 64 -4.858 -0.740 -4.606 505 2HB LEU 64 HB1 LEU 64 -6.528 -0.812 -5.134 506 HG LEU 64 HG LEU 64 -6.670 -2.035 -2.686 507 1HD1 LEU 64 HD11 LEU 64 -4.865 0.320 -2.259 508 2HD1 LEU 64 HD12 LEU 64 -4.230 -1.317 -2.410 509 3HD1 LEU 64 HD13 LEU 64 -5.355 -0.925 -1.110 510 1HD2 LEU 64 HD21 LEU 64 -8.322 -0.521 -2.961 511 2HD2 LEU 64 HD22 LEU 64 -7.275 0.630 -3.793 512 3HD2 LEU 64 HD23 LEU 64 -7.239 0.518 -2.034 513 H GLN 65 HN GLN 65 -3.998 -2.931 -6.894 514 HA GLN 65 HA GLN 65 -5.793 -2.325 -9.010 515 1HB GLN 65 HB2 GLN 65 -2.962 -3.148 -8.761 516 2HB GLN 65 HB1 GLN 65 -3.742 -3.515 -10.294 517 1HG GLN 65 HG2 GLN 65 -4.068 -0.780 -9.203 518 2HG GLN 65 HG1 GLN 65 -2.490 -1.228 -9.852 519 1HE2 GLN 65 HE21 GLN 65 -5.094 0.384 -10.658 520 2HE2 GLN 65 HE22 GLN 65 -5.216 0.028 -12.343 521 H ASP 66 HN ASP 66 -4.225 -5.411 -8.055 522 HA ASP 66 HA ASP 66 -6.102 -6.834 -9.793 523 1HB ASP 66 HB2 ASP 66 -3.645 -7.745 -8.289 524 2HB ASP 66 HB1 ASP 66 -4.706 -8.843 -9.166 525 H SER 67 HN SER 67 -6.173 -5.645 -6.802 526 HA SER 67 HA SER 67 -6.822 -7.551 -4.972 527 1HB SER 67 HB2 SER 67 -8.322 -5.871 -3.946 528 2HB SER 67 HB1 SER 67 -6.790 -5.161 -4.455 529 HG SER 67 HG SER 67 -9.352 -4.720 -5.383 530 H GLY 68 HN GLY 68 -9.246 -5.939 -7.043 531 1HA GLY 68 HA2 GLY 68 -10.864 -7.259 -8.280 532 2HA GLY 68 HA1 GLY 68 -10.803 -8.442 -6.979 533 H LEU 69 HN LEU 69 -12.230 -8.275 -5.331 534 HA LEU 69 HA LEU 69 -14.063 -5.983 -5.389 535 1HB LEU 69 HB2 LEU 69 -14.631 -8.447 -3.795 536 2HB LEU 69 HB1 LEU 69 -15.748 -7.337 -4.569 537 HG LEU 69 HG LEU 69 -15.944 -9.330 -5.775 538 1HD1 LEU 69 HD11 LEU 69 -14.028 -8.311 -7.705 539 2HD1 LEU 69 HD12 LEU 69 -15.070 -7.057 -7.033 540 3HD1 LEU 69 HD13 LEU 69 -15.781 -8.468 -7.816 541 1HD2 LEU 69 HD21 LEU 69 -14.363 -10.884 -6.098 542 2HD2 LEU 69 HD22 LEU 69 -13.506 -10.002 -4.834 543 3HD2 LEU 69 HD23 LEU 69 -13.135 -9.695 -6.532 544 H GLU 70 HN GLU 70 -13.642 -8.186 -2.725 545 HA GLU 70 HA GLU 70 -12.733 -5.951 -1.039 546 1HB GLU 70 HB2 GLU 70 -14.995 -6.757 -0.518 547 2HB GLU 70 HB1 GLU 70 -14.372 -8.386 -0.301 548 1HG GLU 70 HG2 GLU 70 -12.856 -7.220 1.476 549 2HG GLU 70 HG1 GLU 70 -14.121 -5.996 1.430 550 H VAL 71 HN VAL 71 -10.703 -6.144 -0.390 551 HA VAL 71 HA VAL 71 -9.644 -8.821 0.207 552 HB VAL 71 HB VAL 71 -7.443 -8.044 -0.794 553 1HG1 VAL 71 HG11 VAL 71 -8.457 -9.726 -2.007 554 2HG1 VAL 71 HG12 VAL 71 -8.401 -8.431 -3.204 555 3HG1 VAL 71 HG13 VAL 71 -9.899 -8.767 -2.336 556 1HG2 VAL 71 HG21 VAL 71 -8.419 -5.638 -0.920 557 2HG2 VAL 71 HG22 VAL 71 -9.096 -6.189 -2.453 558 3HG2 VAL 71 HG23 VAL 71 -7.350 -6.216 -2.198 559 H ASN 72 HN ASN 72 -7.404 -8.603 1.225 560 HA ASN 72 HA ASN 72 -7.517 -6.542 3.304 561 1HB ASN 72 HB2 ASN 72 -6.552 -9.372 3.229 562 2HB ASN 72 HB1 ASN 72 -5.782 -8.252 4.346 563 1HD2 ASN 72 HD21 ASN 72 -9.148 -7.962 3.467 564 2HD2 ASN 72 HD22 ASN 72 -9.783 -8.463 4.994 565 H ILE 73 HN ILE 73 -6.196 -4.868 2.817 566 HA ILE 73 HA ILE 73 -3.751 -5.445 1.324 567 HB ILE 73 HB ILE 73 -5.453 -3.034 1.613 568 1HG1 ILE 73 HG12 ILE 73 -5.092 -2.876 -0.746 569 2HG1 ILE 73 HG11 ILE 73 -3.695 -3.944 -0.667 570 1HG2 ILE 73 HG21 ILE 73 -2.467 -2.887 1.401 571 2HG2 ILE 73 HG22 ILE 73 -3.550 -1.964 2.441 572 3HG2 ILE 73 HG23 ILE 73 -3.508 -1.642 0.708 573 1HD1 ILE 73 HD11 ILE 73 -5.027 -5.840 -0.364 574 2HD1 ILE 73 HD12 ILE 73 -5.837 -4.899 -1.616 575 3HD1 ILE 73 HD13 ILE 73 -6.451 -4.882 0.038 576 H VAL 74 HN VAL 74 -2.303 -6.133 2.631 577 HA VAL 74 HA VAL 74 -1.765 -4.893 5.210 578 HB VAL 74 HB VAL 74 0.235 -6.785 4.725 579 1HG1 VAL 74 HG11 VAL 74 -0.627 -6.593 6.875 580 2HG1 VAL 74 HG12 VAL 74 -1.228 -8.162 6.341 581 3HG1 VAL 74 HG13 VAL 74 -2.295 -6.757 6.327 582 1HG2 VAL 74 HG21 VAL 74 -1.036 -7.599 2.790 583 2HG2 VAL 74 HG22 VAL 74 -2.433 -7.871 3.829 584 3HG2 VAL 74 HG23 VAL 74 -0.956 -8.803 4.075 585 H THR 75 HN THR 75 -0.763 -2.986 4.971 586 HA THR 75 HA THR 75 1.748 -2.982 3.433 587 HB THR 75 HB THR 75 0.082 -0.497 3.497 588 HG1 THR 75 HG1 THR 75 -1.312 -2.215 2.763 589 1HG2 THR 75 HG21 THR 75 1.357 0.133 1.697 590 2HG2 THR 75 HG22 THR 75 1.586 -1.523 1.136 591 3HG2 THR 75 HG23 THR 75 2.501 -0.926 2.519 592 H ASP 76 HN ASP 76 3.454 -2.079 4.463 593 HA ASP 76 HA ASP 76 3.043 -1.112 7.143 594 1HB ASP 76 HB2 ASP 76 5.624 -0.834 5.614 595 2HB ASP 76 HB1 ASP 76 5.388 -1.035 7.350 596 H SER 77 HN SER 77 1.976 0.777 7.186 597 HA SER 77 HA SER 77 3.325 3.101 6.179 598 1HB SER 77 HB2 SER 77 1.374 3.840 4.796 599 2HB SER 77 HB1 SER 77 2.226 2.442 4.144 600 HG SER 77 HG SER 77 -0.277 2.549 5.438 601 H GLN 78 HN GLN 78 3.276 3.968 8.229 602 HA GLN 78 HA GLN 78 0.819 4.075 9.726 603 1HB GLN 78 HB2 GLN 78 2.074 5.187 11.416 604 2HB GLN 78 HB1 GLN 78 3.119 3.941 10.748 605 1HG GLN 78 HG2 GLN 78 3.556 6.307 9.261 606 2HG GLN 78 HG1 GLN 78 3.589 6.734 10.971 607 1HE2 GLN 78 HE21 GLN 78 4.818 4.283 8.728 608 2HE2 GLN 78 HE22 GLN 78 6.367 4.123 9.475 609 H TYR 79 HN TYR 79 2.376 5.902 7.312 610 HA TYR 79 HA TYR 79 0.998 8.380 7.873 611 1HB TYR 79 HB2 TYR 79 3.154 7.541 6.117 612 2HB TYR 79 HB1 TYR 79 1.948 8.482 5.249 613 HD1 TYR 79 HD1 TYR 79 1.488 10.812 5.881 614 HD2 TYR 79 HD2 TYR 79 4.558 8.557 7.781 615 HE1 TYR 79 HE1 TYR 79 2.453 12.890 6.773 616 HE2 TYR 79 HE2 TYR 79 5.531 10.632 8.677 617 HH TYR 79 HH TYR 79 3.898 13.697 8.401 618 H ALA 80 HN ALA 80 0.924 5.831 5.347 619 HA ALA 80 HA ALA 80 -1.340 6.797 3.984 620 1HB ALA 80 HB1 ALA 80 -1.604 4.581 3.100 621 2HB ALA 80 HB2 ALA 80 -0.665 3.885 4.421 622 3HB ALA 80 HB3 ALA 80 0.126 4.903 3.217 623 H LEU 81 HN LEU 81 -0.894 4.760 6.791 624 HA LEU 81 HA LEU 81 -3.474 3.977 7.317 625 1HB LEU 81 HB2 LEU 81 -1.002 4.191 8.765 626 2HB LEU 81 HB1 LEU 81 -2.343 4.658 9.794 627 HG LEU 81 HG LEU 81 -3.406 2.520 9.498 628 1HD1 LEU 81 HD11 LEU 81 -3.124 1.298 7.669 629 2HD1 LEU 81 HD12 LEU 81 -1.416 1.075 8.049 630 3HD1 LEU 81 HD13 LEU 81 -1.932 2.466 7.093 631 1HD2 LEU 81 HD21 LEU 81 -0.981 2.891 10.778 632 2HD2 LEU 81 HD22 LEU 81 -0.756 1.400 9.863 633 3HD2 LEU 81 HD23 LEU 81 -2.091 1.540 11.007 634 H GLY 82 HN GLY 82 -1.880 7.043 7.954 635 1HA GLY 82 HA2 GLY 82 -4.131 8.137 9.390 636 2HA GLY 82 HA1 GLY 82 -2.675 8.997 8.917 637 H ILE 83 HN ILE 83 -2.822 8.432 6.101 638 HA ILE 83 HA ILE 83 -4.853 10.398 5.411 639 HB ILE 83 HB ILE 83 -3.049 9.164 3.377 640 1HG1 ILE 83 HG12 ILE 83 -1.591 9.611 5.301 641 2HG1 ILE 83 HG11 ILE 83 -1.252 10.722 3.980 642 1HG2 ILE 83 HG21 ILE 83 -3.821 12.041 3.740 643 2HG2 ILE 83 HG22 ILE 83 -4.856 10.886 2.905 644 3HG2 ILE 83 HG23 ILE 83 -3.242 11.231 2.285 645 1HD1 ILE 83 HD11 ILE 83 -1.821 12.515 5.190 646 2HD1 ILE 83 HD12 ILE 83 -1.584 11.443 6.569 647 3HD1 ILE 83 HD13 ILE 83 -3.205 11.709 5.927 648 H ILE 84 HN ILE 84 -3.826 7.290 4.005 649 HA ILE 84 HA ILE 84 -5.885 6.869 2.253 650 HB ILE 84 HB ILE 84 -3.773 5.323 3.306 651 1HG1 ILE 84 HG12 ILE 84 -4.315 5.755 0.924 652 2HG1 ILE 84 HG11 ILE 84 -4.018 4.053 1.255 653 1HG2 ILE 84 HG21 ILE 84 -4.626 3.156 3.677 654 2HG2 ILE 84 HG22 ILE 84 -6.250 3.627 3.176 655 3HG2 ILE 84 HG23 ILE 84 -5.583 4.238 4.690 656 1HD1 ILE 84 HD11 ILE 84 -6.661 5.402 0.786 657 2HD1 ILE 84 HD12 ILE 84 -6.503 3.748 1.376 658 3HD1 ILE 84 HD13 ILE 84 -5.870 4.183 -0.212 659 H GLN 85 HN GLN 85 -5.902 6.284 5.737 660 HA GLN 85 HA GLN 85 -8.402 4.894 5.763 661 1HB GLN 85 HB2 GLN 85 -6.558 6.025 7.799 662 2HB GLN 85 HB1 GLN 85 -8.228 5.784 8.284 663 1HG GLN 85 HG2 GLN 85 -8.051 3.422 7.614 664 2HG GLN 85 HG1 GLN 85 -6.351 3.685 7.223 665 1HE2 GLN 85 HE21 GLN 85 -7.206 1.787 9.059 666 2HE2 GLN 85 HE22 GLN 85 -6.667 2.248 10.633 667 H ALA 86 HN ALA 86 -7.438 8.211 5.787 668 HA ALA 86 HA ALA 86 -10.062 9.136 6.627 669 1HB ALA 86 HB1 ALA 86 -7.497 10.155 6.902 670 2HB ALA 86 HB2 ALA 86 -9.008 10.959 7.328 671 3HB ALA 86 HB3 ALA 86 -8.285 11.222 5.741 672 H GLN 87 HN GLN 87 -9.874 7.706 4.101 673 HA GLN 87 HA GLN 87 -10.385 7.953 1.845 674 1HB GLN 87 HB2 GLN 87 -12.282 9.732 3.346 675 2HB GLN 87 HB1 GLN 87 -12.351 9.646 1.590 676 1HG GLN 87 HG2 GLN 87 -13.953 8.130 2.459 677 2HG GLN 87 HG1 GLN 87 -12.631 7.189 1.784 678 1HE2 GLN 87 HE21 GLN 87 -10.851 6.733 3.486 679 2HE2 GLN 87 HE22 GLN 87 -11.438 6.132 5.000 680 HA PRO 88 HA PRO 88 -7.641 11.614 1.510 681 1HB PRO 88 HB2 PRO 88 -6.037 10.364 -0.372 682 2HB PRO 88 HB1 PRO 88 -5.691 10.448 1.353 683 1HG PRO 88 HG2 PRO 88 -6.895 8.232 -0.227 684 2HG PRO 88 HG1 PRO 88 -5.765 8.160 1.137 685 1HD PRO 88 HD2 PRO 88 -8.403 7.646 1.434 686 2HD PRO 88 HD1 PRO 88 -7.451 8.431 2.707 687 H ASP 89 HN ASP 89 -7.520 9.773 -1.448 688 HA ASP 89 HA ASP 89 -8.318 10.148 -3.506 689 1HB ASP 89 HB2 ASP 89 -10.468 9.750 -2.099 690 2HB ASP 89 HB1 ASP 89 -10.747 11.467 -2.366 691 H GLN 90 HN GLN 90 -7.988 12.759 -1.383 692 HA GLN 90 HA GLN 90 -6.994 14.512 -3.348 693 1HB GLN 90 HB2 GLN 90 -8.768 16.276 -3.184 694 2HB GLN 90 HB1 GLN 90 -9.267 14.839 -4.055 695 1HG GLN 90 HG2 GLN 90 -9.883 15.133 -1.159 696 2HG GLN 90 HG1 GLN 90 -10.874 15.910 -2.389 697 1HE2 GLN 90 HE21 GLN 90 -11.069 13.481 -0.443 698 2HE2 GLN 90 HE22 GLN 90 -11.773 12.253 -1.436 699 H SER 91 HN SER 91 -6.986 13.393 -0.439 700 HA SER 91 HA SER 91 -6.377 15.953 0.883 701 1HB SER 91 HB2 SER 91 -7.183 15.141 2.886 702 2HB SER 91 HB1 SER 91 -8.231 14.275 1.763 703 HG SER 91 HG SER 91 -5.870 13.290 2.992 704 H GLU 92 HN GLU 92 -4.416 16.274 1.741 705 HA GLU 92 HA GLU 92 -2.185 16.049 2.031 706 1HB GLU 92 HB2 GLU 92 -3.373 14.335 3.701 707 2HB GLU 92 HB1 GLU 92 -2.423 13.191 2.762 708 1HG GLU 92 HG2 GLU 92 -0.714 13.645 4.085 709 2HG GLU 92 HG1 GLU 92 -0.656 15.249 3.355 710 H SER 93 HN SER 93 -1.264 12.976 1.775 711 HA SER 93 HA SER 93 0.311 13.183 -0.419 712 1HB SER 93 HB2 SER 93 -0.594 11.070 1.305 713 2HB SER 93 HB1 SER 93 -0.560 10.486 -0.359 714 HG SER 93 HG SER 93 1.493 10.956 1.299 715 H GLU 94 HN GLU 94 0.195 12.734 -2.593 716 HA GLU 94 HA GLU 94 -2.431 12.968 -3.783 717 1HB GLU 94 HB2 GLU 94 -1.281 13.316 -5.856 718 2HB GLU 94 HB1 GLU 94 -0.422 14.219 -4.616 719 1HG GLU 94 HG2 GLU 94 0.687 11.594 -4.820 720 2HG GLU 94 HG1 GLU 94 0.612 12.334 -6.419 721 H LEU 95 HN LEU 95 -0.078 10.524 -3.174 722 HA LEU 95 HA LEU 95 -0.837 8.617 -5.103 723 1HB LEU 95 HB2 LEU 95 1.062 8.842 -3.099 724 2HB LEU 95 HB1 LEU 95 0.037 7.522 -2.560 725 HG LEU 95 HG LEU 95 0.539 6.222 -4.495 726 1HD1 LEU 95 HD11 LEU 95 0.521 7.515 -6.373 727 2HD1 LEU 95 HD12 LEU 95 2.263 7.350 -6.158 728 3HD1 LEU 95 HD13 LEU 95 1.444 8.816 -5.623 729 1HD2 LEU 95 HD21 LEU 95 2.427 5.672 -3.477 730 2HD2 LEU 95 HD22 LEU 95 2.631 7.306 -2.850 731 3HD2 LEU 95 HD23 LEU 95 3.250 6.889 -4.448 732 H VAL 96 HN VAL 96 -1.665 8.935 -1.670 733 HA VAL 96 HA VAL 96 -3.376 6.788 -1.414 734 HB VAL 96 HB VAL 96 -4.595 8.361 0.276 735 1HG1 VAL 96 HG11 VAL 96 -2.563 6.615 0.509 736 2HG1 VAL 96 HG12 VAL 96 -3.281 7.486 1.863 737 3HG1 VAL 96 HG13 VAL 96 -1.801 8.084 1.116 738 1HG2 VAL 96 HG21 VAL 96 -2.608 10.120 -0.899 739 2HG2 VAL 96 HG22 VAL 96 -2.506 10.042 0.860 740 3HG2 VAL 96 HG23 VAL 96 -4.021 10.503 0.084 741 H ASN 97 HN ASN 97 -3.828 9.754 -3.103 742 HA ASN 97 HA ASN 97 -6.673 9.754 -3.174 743 1HB ASN 97 HB2 ASN 97 -4.665 11.055 -5.028 744 2HB ASN 97 HB1 ASN 97 -6.394 11.387 -5.018 745 1HD2 ASN 97 HD21 ASN 97 -6.152 10.971 -1.959 746 2HD2 ASN 97 HD22 ASN 97 -5.629 12.520 -1.407 747 H GLN 98 HN GLN 98 -4.195 8.792 -5.540 748 HA GLN 98 HA GLN 98 -5.915 7.866 -7.532 749 1HB GLN 98 HB2 GLN 98 -3.624 8.154 -8.076 750 2HB GLN 98 HB1 GLN 98 -3.102 7.098 -6.771 751 1HG GLN 98 HG2 GLN 98 -2.995 5.445 -8.232 752 2HG GLN 98 HG1 GLN 98 -4.749 5.525 -8.386 753 1HE2 GLN 98 HE21 GLN 98 -3.644 4.618 -10.525 754 2HE2 GLN 98 HE22 GLN 98 -3.505 5.798 -11.778 755 H ILE 99 HN ILE 99 -4.728 6.311 -4.623 756 HA ILE 99 HA ILE 99 -5.580 3.684 -5.259 757 HB ILE 99 HB ILE 99 -5.031 4.981 -2.588 758 1HG1 ILE 99 HG12 ILE 99 -3.212 2.906 -3.509 759 2HG1 ILE 99 HG11 ILE 99 -3.313 4.242 -4.654 760 1HG2 ILE 99 HG21 ILE 99 -5.136 2.880 -1.553 761 2HG2 ILE 99 HG22 ILE 99 -5.168 2.025 -3.096 762 3HG2 ILE 99 HG23 ILE 99 -6.575 2.950 -2.571 763 1HD1 ILE 99 HD11 ILE 99 -1.604 4.212 -2.629 764 2HD1 ILE 99 HD12 ILE 99 -2.981 4.938 -1.801 765 3HD1 ILE 99 HD13 ILE 99 -2.317 5.702 -3.245 766 H ILE 100 HN ILE 100 -7.115 6.408 -3.621 767 HA ILE 100 HA ILE 100 -9.352 5.012 -2.637 768 HB ILE 100 HB ILE 100 -9.073 7.918 -3.385 769 1HG1 ILE 100 HG12 ILE 100 -7.662 7.534 -1.562 770 2HG1 ILE 100 HG11 ILE 100 -9.158 8.061 -0.799 771 1HG2 ILE 100 HG21 ILE 100 -11.148 7.426 -1.487 772 2HG2 ILE 100 HG22 ILE 100 -11.425 6.437 -2.923 773 3HG2 ILE 100 HG23 ILE 100 -11.252 8.186 -3.076 774 1HD1 ILE 100 HD11 ILE 100 -7.950 5.333 -0.902 775 2HD1 ILE 100 HD12 ILE 100 -9.677 5.541 -0.618 776 3HD1 ILE 100 HD13 ILE 100 -8.509 6.258 0.490 777 H GLU 101 HN GLU 101 -9.005 6.997 -5.578 778 HA GLU 101 HA GLU 101 -11.530 6.703 -6.610 779 1HB GLU 101 HB2 GLU 101 -8.860 6.831 -8.006 780 2HB GLU 101 HB1 GLU 101 -10.384 6.827 -8.888 781 1HG GLU 101 HG2 GLU 101 -10.822 8.795 -7.062 782 2HG GLU 101 HG1 GLU 101 -9.092 8.967 -7.363 783 H GLN 102 HN GLN 102 -8.841 4.440 -6.684 784 HA GLN 102 HA GLN 102 -10.202 2.516 -8.316 785 1HB GLN 102 HB2 GLN 102 -7.582 2.910 -7.543 786 2HB GLN 102 HB1 GLN 102 -8.050 1.496 -6.611 787 1HG GLN 102 HG2 GLN 102 -6.986 1.075 -8.859 788 2HG GLN 102 HG1 GLN 102 -8.504 0.239 -8.535 789 1HE2 GLN 102 HE21 GLN 102 -8.034 3.608 -9.453 790 2HE2 GLN 102 HE22 GLN 102 -8.874 3.506 -10.959 791 H LEU 103 HN LEU 103 -9.958 3.238 -4.947 792 HA LEU 103 HA LEU 103 -10.986 0.737 -3.999 793 1HB LEU 103 HB2 LEU 103 -9.528 2.439 -2.743 794 2HB LEU 103 HB1 LEU 103 -11.006 3.346 -2.503 795 HG LEU 103 HG LEU 103 -11.913 1.736 -1.064 796 1HD1 LEU 103 HD11 LEU 103 -9.920 -0.148 -2.275 797 2HD1 LEU 103 HD12 LEU 103 -11.676 -0.295 -2.190 798 3HD1 LEU 103 HD13 LEU 103 -10.702 -0.495 -0.733 799 1HD2 LEU 103 HD21 LEU 103 -9.874 3.002 -0.226 800 2HD2 LEU 103 HD22 LEU 103 -8.985 1.494 -0.441 801 3HD2 LEU 103 HD23 LEU 103 -10.348 1.564 0.678 802 H ILE 104 HN ILE 104 -12.317 3.714 -5.158 803 HA ILE 104 HA ILE 104 -14.901 3.476 -3.972 804 HB ILE 104 HB ILE 104 -14.272 4.929 -6.540 805 1HG1 ILE 104 HG12 ILE 104 -14.069 6.070 -3.747 806 2HG1 ILE 104 HG11 ILE 104 -12.681 5.539 -4.688 807 1HG2 ILE 104 HG21 ILE 104 -16.654 4.576 -5.799 808 2HG2 ILE 104 HG22 ILE 104 -16.173 6.253 -6.052 809 3HG2 ILE 104 HG23 ILE 104 -16.291 5.607 -4.415 810 1HD1 ILE 104 HD11 ILE 104 -13.021 7.964 -4.777 811 2HD1 ILE 104 HD12 ILE 104 -14.600 7.701 -5.518 812 3HD1 ILE 104 HD13 ILE 104 -13.134 7.208 -6.366 813 H LYS 105 HN LYS 105 -13.457 2.546 -7.049 814 HA LYS 105 HA LYS 105 -15.914 1.576 -8.151 815 1HB LYS 105 HB2 LYS 105 -14.634 0.928 -10.040 816 2HB LYS 105 HB1 LYS 105 -13.953 2.445 -9.473 817 1HG LYS 105 HG2 LYS 105 -11.962 1.529 -9.078 818 2HG LYS 105 HG1 LYS 105 -12.670 0.119 -8.286 819 1HD LYS 105 HD2 LYS 105 -13.341 -0.443 -10.807 820 2HD LYS 105 HD1 LYS 105 -11.903 0.529 -11.121 821 1HE LYS 105 HE2 LYS 105 -10.810 -1.415 -10.843 822 2HE LYS 105 HE1 LYS 105 -11.017 -1.078 -9.125 823 1HZ LYS 105 HZ1 LYS 105 -13.152 -2.506 -10.538 824 2HZ LYS 105 HZ2 LYS 105 -12.662 -2.625 -8.923 825 3HZ LYS 105 HZ3 LYS 105 -11.742 -3.355 -10.142 826 H LYS 106 HN LYS 106 -14.580 0.382 -5.544 827 HA LYS 106 HA LYS 106 -15.238 -2.362 -6.327 828 1HB LYS 106 HB2 LYS 106 -13.303 -3.302 -5.207 829 2HB LYS 106 HB1 LYS 106 -12.791 -2.189 -6.470 830 1HG LYS 106 HG2 LYS 106 -12.125 -0.565 -4.919 831 2HG LYS 106 HG1 LYS 106 -13.004 -1.345 -3.601 832 1HD LYS 106 HD2 LYS 106 -10.707 -1.849 -3.275 833 2HD LYS 106 HD1 LYS 106 -11.464 -3.318 -3.893 834 1HE LYS 106 HE2 LYS 106 -10.117 -3.341 -5.658 835 2HE LYS 106 HE1 LYS 106 -10.543 -1.679 -6.065 836 1HZ LYS 106 HZ1 LYS 106 -8.580 -0.999 -5.342 837 2HZ LYS 106 HZ2 LYS 106 -8.125 -2.608 -5.093 838 3HZ LYS 106 HZ3 LYS 106 -8.815 -1.722 -3.830 839 H GLU 107 HN GLU 107 -14.306 -3.398 -3.756 840 HA GLU 107 HA GLU 107 -16.612 -2.560 -2.167 841 1HB GLU 107 HB2 GLU 107 -15.913 -5.018 -2.799 842 2HB GLU 107 HB1 GLU 107 -14.809 -4.847 -1.441 843 1HG GLU 107 HG2 GLU 107 -16.735 -5.889 -0.607 844 2HG GLU 107 HG1 GLU 107 -16.795 -4.222 -0.045 845 H LYS 108 HN LYS 108 -13.666 -3.945 -0.886 846 HA LYS 108 HA LYS 108 -12.826 -1.487 0.371 847 1HB LYS 108 HB2 LYS 108 -13.138 -2.843 2.665 848 2HB LYS 108 HB1 LYS 108 -14.377 -1.769 2.020 849 1HG LYS 108 HG2 LYS 108 -15.752 -3.480 1.415 850 2HG LYS 108 HG1 LYS 108 -14.410 -4.589 1.115 851 1HD LYS 108 HD2 LYS 108 -14.728 -5.520 3.102 852 2HD LYS 108 HD1 LYS 108 -14.423 -3.969 3.883 853 1HE LYS 108 HE2 LYS 108 -17.040 -5.169 3.037 854 2HE LYS 108 HE1 LYS 108 -16.552 -4.605 4.634 855 1HZ LYS 108 HZ1 LYS 108 -17.578 -3.102 2.367 856 2HZ LYS 108 HZ2 LYS 108 -16.351 -2.351 3.259 857 3HZ LYS 108 HZ3 LYS 108 -17.778 -2.834 4.025 858 H VAL 109 HN VAL 109 -10.886 -1.703 1.594 859 HA VAL 109 HA VAL 109 -9.537 -4.292 1.400 860 HB VAL 109 HB VAL 109 -7.412 -3.259 0.788 861 1HG1 VAL 109 HG11 VAL 109 -8.560 -2.266 -1.538 862 2HG1 VAL 109 HG12 VAL 109 -9.753 -3.413 -0.928 863 3HG1 VAL 109 HG13 VAL 109 -8.096 -3.939 -1.224 864 1HG2 VAL 109 HG21 VAL 109 -7.140 -1.064 1.082 865 2HG2 VAL 109 HG22 VAL 109 -8.874 -0.823 1.302 866 3HG2 VAL 109 HG23 VAL 109 -8.177 -0.792 -0.317 867 H TYR 110 HN TYR 110 -8.456 -4.849 3.180 868 HA TYR 110 HA TYR 110 -8.645 -3.113 5.479 869 1HB TYR 110 HB2 TYR 110 -9.027 -5.283 6.140 870 2HB TYR 110 HB1 TYR 110 -7.944 -5.955 4.931 871 HD1 TYR 110 HD1 TYR 110 -6.060 -7.003 5.709 872 HD2 TYR 110 HD2 TYR 110 -7.732 -3.844 8.004 873 HE1 TYR 110 HE1 TYR 110 -4.363 -7.383 7.446 874 HE2 TYR 110 HE2 TYR 110 -6.052 -4.202 9.750 875 HH TYR 110 HH TYR 110 -3.397 -5.452 9.523 876 H LEU 111 HN LEU 111 -7.213 -1.444 5.464 877 HA LEU 111 HA LEU 111 -4.441 -1.971 4.653 878 1HB LEU 111 HB2 LEU 111 -5.891 -0.048 3.707 879 2HB LEU 111 HB1 LEU 111 -5.612 0.733 5.246 880 HG LEU 111 HG LEU 111 -3.672 1.556 4.516 881 1HD1 LEU 111 HD11 LEU 111 -2.792 -1.155 3.545 882 2HD1 LEU 111 HD12 LEU 111 -2.678 -0.631 5.226 883 3HD1 LEU 111 HD13 LEU 111 -1.783 0.227 3.973 884 1HD2 LEU 111 HD21 LEU 111 -3.637 0.166 1.915 885 2HD2 LEU 111 HD22 LEU 111 -3.501 1.884 2.294 886 3HD2 LEU 111 HD23 LEU 111 -5.083 1.106 2.281 887 H ALA 112 HN ALA 112 -3.012 -2.392 6.240 888 HA ALA 112 HA ALA 112 -3.084 -0.711 8.616 889 1HB ALA 112 HB1 ALA 112 -4.659 -2.509 9.161 890 2HB ALA 112 HB2 ALA 112 -3.252 -2.495 10.225 891 3HB ALA 112 HB3 ALA 112 -3.369 -3.689 8.931 892 H TRP 113 HN TRP 113 -1.339 -1.041 10.106 893 HA TRP 113 HA TRP 113 0.980 -2.510 9.139 894 1HB TRP 113 HB2 TRP 113 1.360 -0.301 8.173 895 2HB TRP 113 HB1 TRP 113 1.050 0.466 9.730 896 HD1 TRP 113 HD1 TRP 113 3.423 -2.428 8.711 897 HE1 TRP 113 HE1 TRP 113 5.759 -1.942 9.662 898 HE3 TRP 113 HE3 TRP 113 2.473 2.074 10.894 899 HZ2 TRP 113 HZ2 TRP 113 7.030 0.076 11.148 900 HZ3 TRP 113 HZ3 TRP 113 4.304 3.225 12.072 901 HH2 TRP 113 HH2 TRP 113 6.537 2.245 12.194 902 H VAL 114 HN VAL 114 2.571 -2.845 10.751 903 HA VAL 114 HA VAL 114 1.773 -2.256 13.514 904 HB VAL 114 HB VAL 114 2.572 -4.937 12.379 905 1HG1 VAL 114 HG11 VAL 114 3.703 -5.443 14.221 906 2HG1 VAL 114 HG12 VAL 114 2.243 -5.163 15.170 907 3HG1 VAL 114 HG13 VAL 114 3.381 -3.844 14.892 908 1HG2 VAL 114 HG21 VAL 114 0.542 -5.722 13.234 909 2HG2 VAL 114 HG22 VAL 114 0.144 -4.138 12.566 910 3HG2 VAL 114 HG23 VAL 114 0.353 -4.335 14.306 911 HA PRO 115 HA PRO 115 5.837 -0.506 13.861 912 1HB PRO 115 HB2 PRO 115 5.817 -1.952 16.481 913 2HB PRO 115 HB1 PRO 115 6.266 -0.280 16.126 914 1HG PRO 115 HG2 PRO 115 3.900 -0.866 17.214 915 2HG PRO 115 HG1 PRO 115 4.066 0.431 16.019 916 1HD PRO 115 HD2 PRO 115 2.854 -2.259 15.732 917 2HD PRO 115 HD1 PRO 115 2.495 -0.758 14.857 918 H ALA 116 HN ALA 116 7.243 -1.468 12.546 919 HA ALA 116 HA ALA 116 9.325 -2.972 13.080 920 1HB ALA 116 HB1 ALA 116 8.187 -4.798 14.068 921 2HB ALA 116 HB2 ALA 116 8.712 -5.359 12.480 922 3HB ALA 116 HB3 ALA 116 7.030 -4.893 12.740 923 H HIS 117 HN HIS 117 10.535 -3.441 11.261 924 HA HIS 117 HA HIS 117 9.195 -2.919 8.692 925 1HB HIS 117 HB2 HIS 117 11.561 -1.844 9.836 926 2HB HIS 117 HB1 HIS 117 12.052 -2.831 8.464 927 HD1 HIS 117 HD1 HIS 117 8.751 -1.222 8.137 928 HD2 HIS 117 HD2 HIS 117 12.696 -0.353 7.160 929 HE1 HIS 117 HE1 HIS 117 8.636 0.688 6.505 930 HE2 HIS 117 HE2 HIS 117 11.030 1.140 5.866 931 H LYS 118 HN LYS 118 8.501 -5.056 8.373 932 HA LYS 118 HA LYS 118 10.665 -6.933 7.691 933 1HB LYS 118 HB2 LYS 118 8.328 -8.402 8.384 934 2HB LYS 118 HB1 LYS 118 9.901 -8.420 9.165 935 1HG LYS 118 HG2 LYS 118 8.425 -7.888 10.880 936 2HG LYS 118 HG1 LYS 118 9.101 -6.328 10.407 937 1HD LYS 118 HD2 LYS 118 7.119 -5.555 9.681 938 2HD LYS 118 HD1 LYS 118 6.689 -7.093 8.928 939 1HE LYS 118 HE2 LYS 118 6.265 -6.172 11.741 940 2HE LYS 118 HE1 LYS 118 5.111 -6.885 10.616 941 1HZ LYS 118 HZ1 LYS 118 6.552 -8.964 10.822 942 2HZ LYS 118 HZ2 LYS 118 5.557 -8.569 12.132 943 3HZ LYS 118 HZ3 LYS 118 7.213 -8.231 12.197 944 H GLY 119 HN GLY 119 7.704 -5.432 6.807 945 1HA GLY 119 HA2 GLY 119 7.280 -5.354 4.381 946 2HA GLY 119 HA1 GLY 119 7.641 -7.074 4.348 947 H ILE 120 HN ILE 120 6.206 -8.343 6.006 948 HA ILE 120 HA ILE 120 4.153 -9.065 6.662 949 HB ILE 120 HB ILE 120 4.025 -6.252 6.974 950 1HG1 ILE 120 HG12 ILE 120 3.845 -7.947 8.749 951 2HG1 ILE 120 HG11 ILE 120 2.500 -6.813 8.800 952 1HG2 ILE 120 HG21 ILE 120 1.993 -5.521 6.305 953 2HG2 ILE 120 HG22 ILE 120 1.252 -7.116 6.428 954 3HG2 ILE 120 HG23 ILE 120 2.265 -6.721 5.037 955 1HD1 ILE 120 HD11 ILE 120 0.973 -8.398 8.308 956 2HD1 ILE 120 HD12 ILE 120 2.202 -9.456 9.003 957 3HD1 ILE 120 HD13 ILE 120 2.071 -9.288 7.252 958 H GLY 121 HN GLY 121 2.759 -10.282 5.553 959 1HA GLY 121 HA2 GLY 121 1.033 -10.666 3.972 960 2HA GLY 121 HA1 GLY 121 1.597 -9.293 3.031 961 H GLY 122 HN GLY 122 4.419 -10.525 3.546 962 1HA GLY 122 HA2 GLY 122 4.795 -12.979 2.454 963 2HA GLY 122 HA1 GLY 122 4.475 -11.972 1.048 964 H ASN 123 HN ASN 123 6.692 -12.636 3.669 965 HA ASN 123 HA ASN 123 8.766 -11.170 2.184 966 1HB ASN 123 HB2 ASN 123 8.037 -9.898 4.212 967 2HB ASN 123 HB1 ASN 123 8.558 -11.259 5.201 968 1HD2 ASN 123 HD21 ASN 123 9.709 -8.957 2.781 969 2HD2 ASN 123 HD22 ASN 123 11.323 -8.856 3.389 970 H GLU 124 HN GLU 124 8.625 -13.670 1.549 971 HA GLU 124 HA GLU 124 10.816 -14.944 3.032 972 1HB GLU 124 HB2 GLU 124 8.384 -16.423 2.013 973 2HB GLU 124 HB1 GLU 124 9.748 -17.118 2.878 974 1HG GLU 124 HG2 GLU 124 8.322 -14.927 4.242 975 2HG GLU 124 HG1 GLU 124 7.436 -16.438 4.043 976 H GLN 125 HN GLN 125 9.414 -14.014 0.097 977 HA GLN 125 HA GLN 125 10.791 -15.919 -1.568 978 1HB GLN 125 HB2 GLN 125 8.729 -13.957 -1.906 979 2HB GLN 125 HB1 GLN 125 9.989 -13.675 -3.099 980 1HG GLN 125 HG2 GLN 125 9.606 -16.420 -3.138 981 2HG GLN 125 HG1 GLN 125 7.985 -15.746 -2.983 982 1HE2 GLN 125 HE21 GLN 125 8.155 -13.446 -4.400 983 2HE2 GLN 125 HE22 GLN 125 8.481 -13.786 -6.061 984 H VAL 126 HN VAL 126 10.946 -12.591 -2.527 985 HA VAL 126 HA VAL 126 13.690 -12.234 -1.693 986 HB VAL 126 HB VAL 126 14.231 -11.687 -4.226 987 1HG1 VAL 126 HG11 VAL 126 15.402 -13.746 -4.376 988 2HG1 VAL 126 HG12 VAL 126 14.271 -14.544 -3.283 989 3HG1 VAL 126 HG13 VAL 126 15.363 -13.303 -2.669 990 1HG2 VAL 126 HG21 VAL 126 13.110 -12.877 -5.836 991 2HG2 VAL 126 HG22 VAL 126 11.789 -12.511 -4.728 992 3HG2 VAL 126 HG23 VAL 126 12.550 -14.102 -4.698 993 H ASP 127 HN ASP 127 12.036 -10.600 -0.727 994 HA ASP 127 HA ASP 127 11.322 -8.418 -2.478 995 1HB ASP 127 HB2 ASP 127 9.931 -9.159 -0.509 996 2HB ASP 127 HB1 ASP 127 11.179 -8.489 0.538 997 H LYS 128 HN LYS 128 13.003 -8.251 0.651 998 HA LYS 128 HA LYS 128 14.594 -6.035 -0.347 999 1HB LYS 128 HB2 LYS 128 15.286 -5.715 1.946 1000 2HB LYS 128 HB1 LYS 128 13.542 -5.935 1.897 1001 1HG LYS 128 HG2 LYS 128 13.685 -7.615 3.327 1002 2HG LYS 128 HG1 LYS 128 14.787 -8.478 2.251 1003 1HD LYS 128 HD2 LYS 128 16.544 -8.006 3.544 1004 2HD LYS 128 HD1 LYS 128 16.116 -6.295 3.611 1005 1HE LYS 128 HE2 LYS 128 16.052 -7.048 5.842 1006 2HE LYS 128 HE1 LYS 128 14.367 -6.945 5.329 1007 1HZ LYS 128 HZ1 LYS 128 14.217 -9.258 5.137 1008 2HZ LYS 128 HZ2 LYS 128 15.065 -9.015 6.581 1009 3HZ LYS 128 HZ3 LYS 128 15.895 -9.475 5.180 1010 H LEU 129 HN LEU 129 16.899 -5.958 -0.157 1011 HA LEU 129 HA LEU 129 18.153 -8.618 -0.359 1012 1HB LEU 129 HB2 LEU 129 19.478 -6.240 -1.546 1013 2HB LEU 129 HB1 LEU 129 19.472 -7.907 -2.090 1014 HG LEU 129 HG LEU 129 16.840 -6.678 -2.294 1015 1HD1 LEU 129 HD11 LEU 129 18.161 -5.544 -4.491 1016 2HD1 LEU 129 HD12 LEU 129 19.085 -5.072 -3.065 1017 3HD1 LEU 129 HD13 LEU 129 17.362 -4.706 -3.160 1018 1HD2 LEU 129 HD21 LEU 129 17.463 -7.429 -4.770 1019 2HD2 LEU 129 HD22 LEU 129 16.977 -8.580 -3.525 1020 3HD2 LEU 129 HD23 LEU 129 18.685 -8.352 -3.896 1021 H VAL 130 HN VAL 130 17.877 -7.657 2.142 1022 HA VAL 130 HA VAL 130 18.989 -7.143 4.056 1023 HB VAL 130 HB VAL 130 21.589 -7.591 2.617 1024 1HG1 VAL 130 HG11 VAL 130 22.278 -8.521 4.755 1025 2HG1 VAL 130 HG12 VAL 130 20.654 -8.284 5.400 1026 3HG1 VAL 130 HG13 VAL 130 21.643 -6.889 4.969 1027 1HG2 VAL 130 HG21 VAL 130 19.489 -9.358 2.413 1028 2HG2 VAL 130 HG22 VAL 130 20.401 -9.980 3.788 1029 3HG2 VAL 130 HG23 VAL 130 21.196 -9.758 2.229 1030 H SER 131 HN SER 131 18.248 -4.953 2.608 1031 HA SER 131 HA SER 131 18.601 -2.724 2.333 1032 1HB SER 131 HB2 SER 131 20.791 -2.891 4.387 1033 2HB SER 131 HB1 SER 131 19.608 -1.609 4.131 1034 HG SER 131 HG SER 131 18.252 -3.800 4.661 1035 H ALA 132 HN ALA 132 20.040 -4.392 0.544 1036 HA ALA 132 HA ALA 132 22.623 -3.035 0.243 1037 1HB ALA 132 HB1 ALA 132 22.207 -5.630 0.092 1038 2HB ALA 132 HB2 ALA 132 23.381 -4.832 -0.954 1039 3HB ALA 132 HB3 ALA 132 21.781 -5.238 -1.574 1040 H GLY 133 HN GLY 133 22.576 -1.233 -0.922 1041 1HA GLY 133 HA2 GLY 133 22.458 -0.395 -3.226 1042 2HA GLY 133 HA1 GLY 133 20.905 -1.208 -3.358 1043 H ILE 134 HN ILE 134 20.854 1.302 -4.103 1044 HA ILE 134 HA ILE 134 20.239 3.068 -1.894 1045 HB ILE 134 HB ILE 134 19.622 3.710 -4.756 1046 1HG1 ILE 134 HG12 ILE 134 21.882 2.750 -4.779 1047 2HG1 ILE 134 HG11 ILE 134 21.932 4.484 -5.073 1048 1HG2 ILE 134 HG21 ILE 134 20.715 5.920 -3.679 1049 2HG2 ILE 134 HG22 ILE 134 20.041 5.169 -2.233 1050 3HG2 ILE 134 HG23 ILE 134 18.994 5.540 -3.602 1051 1HD1 ILE 134 HD11 ILE 134 23.693 3.542 -3.534 1052 2HD1 ILE 134 HD12 ILE 134 22.402 3.294 -2.359 1053 3HD1 ILE 134 HD13 ILE 134 22.781 4.921 -2.922 1054 H ARG 135 HN ARG 135 18.585 1.139 -1.428 1055 HA ARG 135 HA ARG 135 15.983 2.194 -2.228 1056 1HB ARG 135 HB2 ARG 135 15.156 -0.184 -2.503 1057 2HB ARG 135 HB1 ARG 135 16.198 0.424 -3.782 1058 1HG ARG 135 HG2 ARG 135 17.593 -0.971 -1.607 1059 2HG ARG 135 HG1 ARG 135 16.497 -1.970 -2.564 1060 1HD ARG 135 HD2 ARG 135 18.681 -0.216 -3.685 1061 2HD ARG 135 HD1 ARG 135 18.802 -1.959 -3.446 1062 HE ARG 135 HE ARG 135 16.886 -2.105 -5.058 1063 1HH1 ARG 135 HH11 ARG 135 19.086 0.597 -5.087 1064 2HH1 ARG 135 HH12 ARG 135 18.830 0.954 -6.761 1065 1HH2 ARG 135 HH21 ARG 135 16.539 -1.640 -7.265 1066 2HH2 ARG 135 HH22 ARG 135 17.381 -0.316 -7.999 1067 H LYS 136 HN LYS 136 17.642 2.207 0.237 1068 HA LYS 136 HA LYS 136 16.461 0.416 2.111 1069 1HB LYS 136 HB2 LYS 136 17.479 2.006 3.810 1070 2HB LYS 136 HB1 LYS 136 18.599 1.257 2.681 1071 1HG LYS 136 HG2 LYS 136 18.256 3.424 1.297 1072 2HG LYS 136 HG1 LYS 136 17.670 4.089 2.823 1073 1HD LYS 136 HD2 LYS 136 20.024 2.734 3.471 1074 2HD LYS 136 HD1 LYS 136 20.376 3.575 1.959 1075 1HE LYS 136 HE2 LYS 136 19.334 5.628 3.069 1076 2HE LYS 136 HE1 LYS 136 19.474 4.729 4.580 1077 1HZ LYS 136 HZ1 LYS 136 21.557 5.914 2.921 1078 2HZ LYS 136 HZ2 LYS 136 21.929 4.439 3.662 1079 3HZ LYS 136 HZ3 LYS 136 21.468 5.764 4.605 1080 H VAL 137 HN VAL 137 14.361 0.486 2.557 1081 HA VAL 137 HA VAL 137 12.779 2.842 2.296 1082 HB VAL 137 HB VAL 137 11.771 0.679 1.905 1083 1HG1 VAL 137 HG11 VAL 137 12.467 -1.030 3.150 1084 2HG1 VAL 137 HG12 VAL 137 11.337 -0.466 4.382 1085 3HG1 VAL 137 HG13 VAL 137 13.026 0.037 4.439 1086 1HG2 VAL 137 HG21 VAL 137 10.726 2.580 3.832 1087 2HG2 VAL 137 HG22 VAL 137 10.042 0.969 4.046 1088 3HG2 VAL 137 HG23 VAL 137 9.920 1.778 2.485 1089 H LEU 138 HN LEU 138 11.999 4.225 3.817 1090 HA LEU 138 HA LEU 138 13.294 4.122 6.435 1091 1HB LEU 138 HB2 LEU 138 12.581 6.204 4.629 1092 2HB LEU 138 HB1 LEU 138 11.681 6.452 6.113 1093 HG LEU 138 HG LEU 138 13.788 7.693 6.122 1094 1HD1 LEU 138 HD11 LEU 138 14.415 5.647 8.125 1095 2HD1 LEU 138 HD12 LEU 138 12.752 6.232 8.157 1096 3HD1 LEU 138 HD13 LEU 138 14.091 7.370 8.319 1097 1HD2 LEU 138 HD21 LEU 138 15.207 5.040 6.126 1098 2HD2 LEU 138 HD22 LEU 138 15.913 6.654 6.044 1099 3HD2 LEU 138 HD23 LEU 138 15.000 6.020 4.675 Start of MODEL 5 1 1H MET 1 HT1 MET 1 -22.435 1.651 4.635 2 2H MET 1 HT2 MET 1 -22.934 2.000 3.058 3 3H MET 1 HT3 MET 1 -24.069 1.945 4.311 4 HA MET 1 HA MET 1 -22.970 4.192 3.379 5 1HB MET 1 HB2 MET 1 -24.935 4.057 4.784 6 2HB MET 1 HB1 MET 1 -23.971 3.528 6.155 7 1HG MET 1 HG2 MET 1 -24.143 5.692 6.733 8 2HG MET 1 HG1 MET 1 -22.759 5.856 5.654 9 1HE MET 1 HE1 MET 1 -26.941 6.638 5.595 10 2HE MET 1 HE2 MET 1 -26.276 8.268 5.698 11 3HE MET 1 HE3 MET 1 -25.744 7.025 6.831 12 H ASN 2 HN ASN 2 -20.859 4.660 3.170 13 HA ASN 2 HA ASN 2 -19.232 4.704 5.617 14 1HB ASN 2 HB2 ASN 2 -17.532 4.239 3.356 15 2HB ASN 2 HB1 ASN 2 -17.753 3.243 4.795 16 1HD2 ASN 2 HD21 ASN 2 -19.237 3.981 1.672 17 2HD2 ASN 2 HD22 ASN 2 -19.834 2.386 1.380 18 H GLU 3 HN GLU 3 -18.464 5.518 2.255 19 HA GLU 3 HA GLU 3 -18.790 8.319 2.567 20 1HB GLU 3 HB2 GLU 3 -16.496 7.352 3.779 21 2HB GLU 3 HB1 GLU 3 -15.922 7.903 2.211 22 1HG GLU 3 HG2 GLU 3 -15.850 9.954 3.022 23 2HG GLU 3 HG1 GLU 3 -17.609 9.925 3.145 24 H LEU 4 HN LEU 4 -16.212 6.465 0.970 25 HA LEU 4 HA LEU 4 -17.469 6.984 -1.628 26 1HB LEU 4 HB2 LEU 4 -15.103 8.199 -0.560 27 2HB LEU 4 HB1 LEU 4 -14.673 7.222 -1.948 28 HG LEU 4 HG LEU 4 -16.897 9.242 -2.077 29 1HD1 LEU 4 HD11 LEU 4 -15.031 10.536 -1.382 30 2HD1 LEU 4 HD12 LEU 4 -15.194 10.757 -3.124 31 3HD1 LEU 4 HD13 LEU 4 -13.950 9.684 -2.484 32 1HD2 LEU 4 HD21 LEU 4 -15.425 8.945 -4.478 33 2HD2 LEU 4 HD22 LEU 4 -17.097 8.488 -4.151 34 3HD2 LEU 4 HD23 LEU 4 -15.794 7.332 -3.867 35 H TYR 5 HN TYR 5 -16.947 4.667 0.259 36 HA TYR 5 HA TYR 5 -16.766 2.560 -1.417 37 1HB TYR 5 HB2 TYR 5 -14.422 1.751 -1.150 38 2HB TYR 5 HB1 TYR 5 -14.519 3.223 -2.107 39 HD1 TYR 5 HD1 TYR 5 -13.347 5.166 -1.460 40 HD2 TYR 5 HD2 TYR 5 -13.696 1.909 1.250 41 HE1 TYR 5 HE1 TYR 5 -11.703 6.248 0.035 42 HE2 TYR 5 HE2 TYR 5 -12.062 2.969 2.751 43 HH TYR 5 HH TYR 5 -10.471 4.591 2.884 44 H GLN 6 HN GLN 6 -16.091 0.506 -0.112 45 HA GLN 6 HA GLN 6 -17.412 0.719 2.394 46 1HB GLN 6 HB2 GLN 6 -16.108 -1.505 0.893 47 2HB GLN 6 HB1 GLN 6 -16.550 -1.742 2.584 48 1HG GLN 6 HG2 GLN 6 -18.526 -2.373 1.715 49 2HG GLN 6 HG1 GLN 6 -18.813 -0.631 1.631 50 1HE2 GLN 6 HE21 GLN 6 -16.681 -0.516 -0.500 51 2HE2 GLN 6 HE22 GLN 6 -17.503 -0.986 -1.940 52 H LEU 7 HN LEU 7 -16.529 1.652 4.075 53 HA LEU 7 HA LEU 7 -13.736 1.885 4.482 54 1HB LEU 7 HB2 LEU 7 -16.149 2.855 5.712 55 2HB LEU 7 HB1 LEU 7 -15.029 2.301 6.944 56 HG LEU 7 HG LEU 7 -13.389 3.787 5.336 57 1HD1 LEU 7 HD11 LEU 7 -15.138 4.630 3.950 58 2HD1 LEU 7 HD12 LEU 7 -14.618 5.933 5.018 59 3HD1 LEU 7 HD13 LEU 7 -16.115 5.064 5.353 60 1HD2 LEU 7 HD21 LEU 7 -13.415 3.865 7.748 61 2HD2 LEU 7 HD22 LEU 7 -14.989 4.662 7.737 62 3HD2 LEU 7 HD23 LEU 7 -13.571 5.501 7.106 63 H GLU 8 HN GLU 8 -12.720 -0.036 4.610 64 HA GLU 8 HA GLU 8 -13.585 -1.988 6.624 65 1HB GLU 8 HB2 GLU 8 -13.084 -2.762 4.321 66 2HB GLU 8 HB1 GLU 8 -11.426 -2.205 4.517 67 1HG GLU 8 HG2 GLU 8 -11.782 -4.657 4.871 68 2HG GLU 8 HG1 GLU 8 -10.975 -3.813 6.191 69 H LYS 9 HN LYS 9 -10.284 -1.310 5.552 70 HA LYS 9 HA LYS 9 -8.386 -0.721 6.638 71 1HB LYS 9 HB2 LYS 9 -9.889 0.521 8.894 72 2HB LYS 9 HB1 LYS 9 -8.445 1.083 8.065 73 1HG LYS 9 HG2 LYS 9 -11.227 1.121 6.915 74 2HG LYS 9 HG1 LYS 9 -10.401 2.500 7.637 75 1HD LYS 9 HD2 LYS 9 -9.044 2.798 5.844 76 2HD LYS 9 HD1 LYS 9 -8.960 1.071 5.488 77 1HE LYS 9 HE2 LYS 9 -11.354 1.242 4.703 78 2HE LYS 9 HE1 LYS 9 -11.183 2.993 4.821 79 1HZ LYS 9 HZ1 LYS 9 -9.907 3.077 2.989 80 2HZ LYS 9 HZ2 LYS 9 -10.638 1.596 2.621 81 3HZ LYS 9 HZ3 LYS 9 -9.103 1.627 3.329 82 H GLU 10 HN GLU 10 -10.697 -2.663 8.174 83 HA GLU 10 HA GLU 10 -8.630 -3.721 9.975 84 1HB GLU 10 HB2 GLU 10 -11.140 -4.212 11.183 85 2HB GLU 10 HB1 GLU 10 -9.845 -3.181 11.776 86 1HG GLU 10 HG2 GLU 10 -10.814 -1.263 10.960 87 2HG GLU 10 HG1 GLU 10 -11.747 -2.135 9.747 88 HA PRO 11 HA PRO 11 -9.383 -7.921 8.790 89 1HB PRO 11 HB2 PRO 11 -11.152 -8.761 10.882 90 2HB PRO 11 HB1 PRO 11 -9.433 -9.121 10.702 91 1HG PRO 11 HG2 PRO 11 -10.766 -7.027 12.314 92 2HG PRO 11 HG1 PRO 11 -9.206 -7.827 12.576 93 1HD PRO 11 HD2 PRO 11 -9.333 -5.291 11.751 94 2HD PRO 11 HD1 PRO 11 -8.096 -6.395 11.108 95 H ILE 12 HN ILE 12 -10.662 -8.458 7.179 96 HA ILE 12 HA ILE 12 -13.381 -7.425 7.056 97 HB ILE 12 HB ILE 12 -12.065 -9.119 4.946 98 1HG1 ILE 12 HG12 ILE 12 -11.735 -6.146 5.372 99 2HG1 ILE 12 HG11 ILE 12 -10.473 -7.353 5.567 100 1HG2 ILE 12 HG21 ILE 12 -13.467 -7.330 3.597 101 2HG2 ILE 12 HG22 ILE 12 -14.358 -7.236 5.116 102 3HG2 ILE 12 HG23 ILE 12 -14.220 -8.776 4.269 103 1HD1 ILE 12 HD11 ILE 12 -11.844 -7.198 2.945 104 2HD1 ILE 12 HD12 ILE 12 -10.165 -7.579 3.330 105 3HD1 ILE 12 HD13 ILE 12 -10.724 -5.906 3.374 106 H VAL 13 HN VAL 13 -15.209 -8.731 6.848 107 HA VAL 13 HA VAL 13 -15.476 -10.971 8.381 108 HB VAL 13 HB VAL 13 -17.398 -9.743 7.539 109 1HG1 VAL 13 HG11 VAL 13 -16.171 -10.130 5.029 110 2HG1 VAL 13 HG12 VAL 13 -17.642 -9.229 5.396 111 3HG1 VAL 13 HG13 VAL 13 -17.737 -10.938 4.970 112 1HG2 VAL 13 HG21 VAL 13 -17.610 -12.577 6.546 113 2HG2 VAL 13 HG22 VAL 13 -18.881 -11.565 7.234 114 3HG2 VAL 13 HG23 VAL 13 -17.573 -12.156 8.258 115 H GLY 14 HN GLY 14 -14.403 -10.820 5.037 116 1HA GLY 14 HA2 GLY 14 -12.988 -13.187 5.049 117 2HA GLY 14 HA1 GLY 14 -14.606 -13.624 4.525 118 H ALA 15 HN ALA 15 -12.094 -11.191 3.844 119 HA ALA 15 HA ALA 15 -12.857 -11.314 0.999 120 1HB ALA 15 HB1 ALA 15 -11.812 -9.138 2.738 121 2HB ALA 15 HB2 ALA 15 -13.125 -9.113 1.562 122 3HB ALA 15 HB3 ALA 15 -11.449 -9.107 1.013 123 H GLU 16 HN GLU 16 -11.115 -10.998 -0.562 124 HA GLU 16 HA GLU 16 -9.086 -12.897 -0.363 125 1HB GLU 16 HB2 GLU 16 -10.123 -11.331 -2.366 126 2HB GLU 16 HB1 GLU 16 -8.499 -10.679 -2.187 127 1HG GLU 16 HG2 GLU 16 -8.388 -12.356 -3.841 128 2HG GLU 16 HG1 GLU 16 -7.639 -13.020 -2.389 129 H THR 17 HN THR 17 -6.799 -12.692 -0.121 130 HA THR 17 HA THR 17 -6.043 -10.386 1.513 131 HB THR 17 HB THR 17 -4.425 -11.662 2.611 132 HG1 THR 17 HG1 THR 17 -3.315 -12.770 1.108 133 1HG2 THR 17 HG21 THR 17 -5.630 -13.421 3.582 134 2HG2 THR 17 HG22 THR 17 -6.475 -13.800 2.080 135 3HG2 THR 17 HG23 THR 17 -6.885 -12.338 2.979 136 H PHE 18 HN PHE 18 -4.547 -9.033 0.947 137 HA PHE 18 HA PHE 18 -2.660 -9.650 -1.204 138 1HB PHE 18 HB2 PHE 18 -4.589 -7.315 -1.146 139 2HB PHE 18 HB1 PHE 18 -3.140 -7.329 -2.121 140 HD1 PHE 18 HD1 PHE 18 -6.074 -9.557 -1.518 141 HD2 PHE 18 HD2 PHE 18 -3.390 -7.821 -4.323 142 HE1 PHE 18 HE1 PHE 18 -7.316 -10.616 -3.358 143 HE2 PHE 18 HE2 PHE 18 -4.625 -8.880 -6.167 144 HZ PHE 18 HZ PHE 18 -6.595 -10.277 -5.687 145 H TYR 19 HN TYR 19 -0.720 -9.022 -0.723 146 HA TYR 19 HA TYR 19 -0.305 -7.263 1.575 147 1HB TYR 19 HB2 TYR 19 2.119 -8.425 0.665 148 2HB TYR 19 HB1 TYR 19 1.260 -8.728 2.173 149 HD1 TYR 19 HD1 TYR 19 1.236 -9.720 -1.458 150 HD2 TYR 19 HD2 TYR 19 0.437 -10.824 2.605 151 HE1 TYR 19 HE1 TYR 19 0.718 -12.041 -2.146 152 HE2 TYR 19 HE2 TYR 19 -0.075 -13.120 1.900 153 HH TYR 19 HH TYR 19 -0.055 -14.034 -1.523 154 H VAL 20 HN VAL 20 1.358 -5.668 1.528 155 HA VAL 20 HA VAL 20 2.321 -4.866 -1.093 156 HB VAL 20 HB VAL 20 1.366 -2.489 0.157 157 1HG1 VAL 20 HG11 VAL 20 0.138 -2.282 -1.990 158 2HG1 VAL 20 HG12 VAL 20 0.656 -3.917 -2.392 159 3HG1 VAL 20 HG13 VAL 20 1.854 -2.641 -2.172 160 1HG2 VAL 20 HG21 VAL 20 -0.841 -4.467 -0.393 161 2HG2 VAL 20 HG22 VAL 20 -1.004 -2.808 0.182 162 3HG2 VAL 20 HG23 VAL 20 -0.282 -4.035 1.223 163 H ASP 21 HN ASP 21 4.311 -4.071 -0.973 164 HA ASP 21 HA ASP 21 5.227 -2.429 1.142 165 1HB ASP 21 HB2 ASP 21 5.437 -4.335 2.505 166 2HB ASP 21 HB1 ASP 21 6.011 -5.333 1.171 167 H GLY 22 HN GLY 22 6.794 -1.172 0.354 168 1HA GLY 22 HA2 GLY 22 8.543 -2.229 -1.758 169 2HA GLY 22 HA1 GLY 22 7.672 -0.726 -2.028 170 H ALA 23 HN ALA 23 10.572 -1.257 -1.916 171 HA ALA 23 HA ALA 23 11.245 0.564 0.309 172 1HB ALA 23 HB1 ALA 23 12.115 -1.878 0.343 173 2HB ALA 23 HB2 ALA 23 13.227 -0.559 0.711 174 3HB ALA 23 HB3 ALA 23 13.245 -1.309 -0.886 175 H ALA 24 HN ALA 24 11.621 2.474 -0.401 176 HA ALA 24 HA ALA 24 13.331 2.861 -2.738 177 1HB ALA 24 HB1 ALA 24 11.293 4.929 -2.354 178 2HB ALA 24 HB2 ALA 24 10.642 3.356 -2.815 179 3HB ALA 24 HB3 ALA 24 11.846 4.144 -3.834 180 H ASN 25 HN ASN 25 14.914 4.322 -2.389 181 HA ASN 25 HA ASN 25 15.642 5.118 0.127 182 1HB ASN 25 HB2 ASN 25 16.725 5.369 -2.384 183 2HB ASN 25 HB1 ASN 25 16.399 7.047 -1.964 184 1HD2 ASN 25 HD21 ASN 25 17.643 8.061 -0.503 185 2HD2 ASN 25 HD22 ASN 25 18.994 7.338 0.297 186 H ARG 26 HN ARG 26 14.441 6.236 1.490 187 HA ARG 26 HA ARG 26 12.408 8.059 0.826 188 1HB ARG 26 HB2 ARG 26 12.995 6.744 3.034 189 2HB ARG 26 HB1 ARG 26 13.840 8.238 3.433 190 1HG ARG 26 HG2 ARG 26 10.972 8.199 2.562 191 2HG ARG 26 HG1 ARG 26 11.455 8.003 4.245 192 1HD ARG 26 HD2 ARG 26 11.803 10.385 2.463 193 2HD ARG 26 HD1 ARG 26 11.010 10.287 4.034 194 HE ARG 26 HE ARG 26 13.845 9.718 4.052 195 1HH1 ARG 26 HH11 ARG 26 11.359 12.136 4.395 196 2HH1 ARG 26 HH12 ARG 26 12.358 13.218 5.305 197 1HH2 ARG 26 HH21 ARG 26 15.167 11.139 5.250 198 2HH2 ARG 26 HH22 ARG 26 14.521 12.652 5.792 199 H GLU 27 HN GLU 27 15.667 8.622 2.091 200 HA GLU 27 HA GLU 27 15.657 11.332 2.383 201 1HB GLU 27 HB2 GLU 27 17.515 10.000 3.099 202 2HB GLU 27 HB1 GLU 27 17.855 9.495 1.456 203 1HG GLU 27 HG2 GLU 27 17.925 12.393 1.888 204 2HG GLU 27 HG1 GLU 27 19.147 11.480 2.769 205 H THR 28 HN THR 28 15.523 9.551 -0.540 206 HA THR 28 HA THR 28 15.785 12.050 -2.071 207 HB THR 28 HB THR 28 16.620 9.382 -3.175 208 HG1 THR 28 HG1 THR 28 17.804 10.307 -1.164 209 1HG2 THR 28 HG21 THR 28 18.172 11.302 -4.313 210 2HG2 THR 28 HG22 THR 28 16.672 12.187 -4.037 211 3HG2 THR 28 HG23 THR 28 16.658 10.708 -4.997 212 H LYS 29 HN LYS 29 13.743 9.698 -1.105 213 HA LYS 29 HA LYS 29 11.810 8.759 -1.857 214 1HB LYS 29 HB2 LYS 29 11.736 11.513 -3.074 215 2HB LYS 29 HB1 LYS 29 10.381 10.400 -3.200 216 1HG LYS 29 HG2 LYS 29 9.676 10.960 -1.178 217 2HG LYS 29 HG1 LYS 29 11.242 10.548 -0.473 218 1HD LYS 29 HD2 LYS 29 11.196 12.761 0.053 219 2HD LYS 29 HD1 LYS 29 11.898 12.888 -1.561 220 1HE LYS 29 HE2 LYS 29 9.507 13.127 -2.404 221 2HE LYS 29 HE1 LYS 29 9.054 13.369 -0.718 222 1HZ LYS 29 HZ1 LYS 29 11.131 15.074 -1.054 223 2HZ LYS 29 HZ2 LYS 29 9.495 15.502 -1.112 224 3HZ LYS 29 HZ3 LYS 29 10.335 15.176 -2.543 225 H LEU 30 HN LEU 30 13.047 7.178 -3.070 226 HA LEU 30 HA LEU 30 12.078 6.788 -5.680 227 1HB LEU 30 HB2 LEU 30 13.544 8.464 -6.478 228 2HB LEU 30 HB1 LEU 30 14.861 7.908 -5.463 229 HG LEU 30 HG LEU 30 13.818 6.071 -7.573 230 1HD1 LEU 30 HD11 LEU 30 15.037 7.067 -9.304 231 2HD1 LEU 30 HD12 LEU 30 15.888 8.149 -8.203 232 3HD1 LEU 30 HD13 LEU 30 14.176 8.404 -8.543 233 1HD2 LEU 30 HD21 LEU 30 16.577 6.611 -6.478 234 2HD2 LEU 30 HD22 LEU 30 16.135 5.332 -7.610 235 3HD2 LEU 30 HD23 LEU 30 15.505 5.308 -5.960 236 H GLY 31 HN GLY 31 12.334 4.688 -6.288 237 1HA GLY 31 HA2 GLY 31 14.393 2.967 -5.879 238 2HA GLY 31 HA1 GLY 31 13.534 2.922 -4.349 239 H LYS 32 HN LYS 32 12.618 0.966 -4.352 240 HA LYS 32 HA LYS 32 10.965 0.226 -6.672 241 1HB LYS 32 HB2 LYS 32 11.791 -1.852 -4.723 242 2HB LYS 32 HB1 LYS 32 11.580 -1.963 -6.464 243 1HG LYS 32 HG2 LYS 32 13.744 -1.633 -6.840 244 2HG LYS 32 HG1 LYS 32 13.794 -0.235 -5.765 245 1HD LYS 32 HD2 LYS 32 14.853 -1.438 -4.223 246 2HD LYS 32 HD1 LYS 32 13.514 -2.587 -4.181 247 1HE LYS 32 HE2 LYS 32 14.689 -3.413 -6.426 248 2HE LYS 32 HE1 LYS 32 16.101 -2.725 -5.623 249 1HZ LYS 32 HZ1 LYS 32 16.176 -4.801 -4.764 250 2HZ LYS 32 HZ2 LYS 32 14.511 -5.062 -4.907 251 3HZ LYS 32 HZ3 LYS 32 15.113 -4.132 -3.630 252 H ALA 33 HN ALA 33 9.063 -1.055 -6.224 253 HA ALA 33 HA ALA 33 7.994 -1.206 -3.578 254 1HB ALA 33 HB1 ALA 33 7.029 0.931 -5.438 255 2HB ALA 33 HB2 ALA 33 7.378 1.026 -3.712 256 3HB ALA 33 HB3 ALA 33 5.930 0.193 -4.274 257 H GLY 34 HN GLY 34 7.006 -3.105 -3.598 258 1HA GLY 34 HA2 GLY 34 5.255 -3.768 -5.866 259 2HA GLY 34 HA1 GLY 34 6.528 -4.897 -5.437 260 H TYR 35 HN TYR 35 4.443 -6.146 -5.352 261 HA TYR 35 HA TYR 35 3.885 -6.716 -2.627 262 1HB TYR 35 HB2 TYR 35 1.757 -5.922 -2.360 263 2HB TYR 35 HB1 TYR 35 2.380 -4.661 -3.391 264 HD1 TYR 35 HD1 TYR 35 1.878 -4.765 -5.869 265 HD2 TYR 35 HD2 TYR 35 -0.064 -7.265 -3.036 266 HE1 TYR 35 HE1 TYR 35 0.089 -5.183 -7.485 267 HE2 TYR 35 HE2 TYR 35 -1.863 -7.696 -4.653 268 HH TYR 35 HH TYR 35 -2.185 -7.658 -7.091 269 H VAL 36 HN VAL 36 1.926 -8.386 -2.618 270 HA VAL 36 HA VAL 36 2.035 -9.869 -5.139 271 HB VAL 36 HB VAL 36 2.022 -11.558 -2.719 272 1HG1 VAL 36 HG11 VAL 36 2.848 -11.716 -5.553 273 2HG1 VAL 36 HG12 VAL 36 1.968 -12.878 -4.561 274 3HG1 VAL 36 HG13 VAL 36 3.718 -12.724 -4.396 275 1HG2 VAL 36 HG21 VAL 36 4.196 -11.315 -2.093 276 2HG2 VAL 36 HG22 VAL 36 3.884 -9.661 -2.617 277 3HG2 VAL 36 HG23 VAL 36 4.710 -10.786 -3.695 278 H THR 37 HN THR 37 0.244 -11.225 -5.568 279 HA THR 37 HA THR 37 -2.153 -10.433 -4.054 280 HB THR 37 HB THR 37 -3.460 -10.807 -5.969 281 HG1 THR 37 HG1 THR 37 -1.221 -12.179 -7.083 282 1HG2 THR 37 HG21 THR 37 -2.176 -9.682 -7.863 283 2HG2 THR 37 HG22 THR 37 -0.812 -9.621 -6.746 284 3HG2 THR 37 HG23 THR 37 -2.315 -8.790 -6.348 285 H ASN 38 HN ASN 38 -3.732 -12.033 -3.513 286 HA ASN 38 HA ASN 38 -2.744 -14.394 -2.448 287 1HB ASN 38 HB2 ASN 38 -4.931 -14.904 -1.883 288 2HB ASN 38 HB1 ASN 38 -5.031 -13.163 -2.134 289 1HD2 ASN 38 HD21 ASN 38 -5.218 -12.811 -4.735 290 2HD2 ASN 38 HD22 ASN 38 -6.597 -13.615 -5.396 291 H ARG 39 HN ARG 39 -3.026 -13.725 -5.720 292 HA ARG 39 HA ARG 39 -3.597 -16.484 -6.513 293 1HB ARG 39 HB2 ARG 39 -2.899 -14.229 -8.384 294 2HB ARG 39 HB1 ARG 39 -3.841 -15.681 -8.717 295 1HG ARG 39 HG2 ARG 39 -5.759 -14.805 -7.873 296 2HG ARG 39 HG1 ARG 39 -4.914 -13.805 -6.689 297 1HD ARG 39 HD2 ARG 39 -5.744 -12.248 -8.201 298 2HD ARG 39 HD1 ARG 39 -4.081 -12.477 -8.737 299 HE ARG 39 HE ARG 39 -4.880 -13.708 -10.591 300 1HH1 ARG 39 HH11 ARG 39 -7.427 -12.389 -8.613 301 2HH1 ARG 39 HH12 ARG 39 -8.640 -12.556 -9.838 302 1HH2 ARG 39 HH21 ARG 39 -6.472 -13.930 -12.211 303 2HH2 ARG 39 HH22 ARG 39 -8.098 -13.430 -11.882 304 H GLY 40 HN GLY 40 -1.007 -14.363 -5.955 305 1HA GLY 40 HA2 GLY 40 1.224 -15.241 -5.716 306 2HA GLY 40 HA1 GLY 40 0.888 -16.316 -7.070 307 H ARG 41 HN ARG 41 0.122 -12.876 -6.817 308 HA ARG 41 HA ARG 41 1.826 -12.457 -9.181 309 1HB ARG 41 HB2 ARG 41 -0.200 -11.733 -9.923 310 2HB ARG 41 HB1 ARG 41 -0.747 -11.277 -8.318 311 1HG ARG 41 HG2 ARG 41 0.000 -9.155 -8.523 312 2HG ARG 41 HG1 ARG 41 1.461 -9.640 -9.386 313 1HD ARG 41 HD2 ARG 41 -1.319 -9.478 -10.558 314 2HD ARG 41 HD1 ARG 41 -0.019 -8.315 -10.813 315 HE ARG 41 HE ARG 41 0.764 -10.952 -11.553 316 1HH1 ARG 41 HH11 ARG 41 -1.059 -8.180 -12.621 317 2HH1 ARG 41 HH12 ARG 41 -0.861 -8.538 -14.303 318 1HH2 ARG 41 HH21 ARG 41 1.029 -11.429 -13.764 319 2HH2 ARG 41 HH22 ARG 41 0.327 -10.384 -14.953 320 H GLN 42 HN GLN 42 3.765 -11.603 -8.689 321 HA GLN 42 HA GLN 42 3.918 -9.685 -6.469 322 1HB GLN 42 HB2 GLN 42 5.479 -11.853 -6.967 323 2HB GLN 42 HB1 GLN 42 6.415 -10.591 -7.755 324 1HG GLN 42 HG2 GLN 42 7.067 -9.697 -5.816 325 2HG GLN 42 HG1 GLN 42 5.471 -9.873 -5.087 326 1HE2 GLN 42 HE21 GLN 42 5.076 -12.564 -5.228 327 2HE2 GLN 42 HE22 GLN 42 6.236 -13.384 -4.245 328 H LYS 43 HN LYS 43 3.924 -7.575 -6.975 329 HA LYS 43 HA LYS 43 4.814 -6.806 -9.688 330 1HB LYS 43 HB2 LYS 43 3.373 -5.017 -7.740 331 2HB LYS 43 HB1 LYS 43 3.587 -4.780 -9.468 332 1HG LYS 43 HG2 LYS 43 1.941 -6.907 -8.170 333 2HG LYS 43 HG1 LYS 43 1.319 -5.431 -8.915 334 1HD LYS 43 HD2 LYS 43 2.984 -7.437 -10.428 335 2HD LYS 43 HD1 LYS 43 1.228 -7.560 -10.321 336 1HE LYS 43 HE2 LYS 43 1.162 -6.234 -12.113 337 2HE LYS 43 HE1 LYS 43 1.639 -4.928 -11.028 338 1HZ LYS 43 HZ1 LYS 43 3.008 -5.372 -13.150 339 2HZ LYS 43 HZ2 LYS 43 3.695 -6.637 -12.262 340 3HZ LYS 43 HZ3 LYS 43 3.823 -5.045 -11.705 341 H VAL 44 HN VAL 44 5.766 -4.572 -9.806 342 HA VAL 44 HA VAL 44 7.244 -3.669 -7.544 343 HB VAL 44 HB VAL 44 8.624 -5.598 -8.494 344 1HG1 VAL 44 HG11 VAL 44 9.442 -3.616 -10.595 345 2HG1 VAL 44 HG12 VAL 44 8.198 -4.829 -10.892 346 3HG1 VAL 44 HG13 VAL 44 9.838 -5.331 -10.481 347 1HG2 VAL 44 HG21 VAL 44 10.039 -4.514 -7.158 348 2HG2 VAL 44 HG22 VAL 44 9.438 -2.936 -7.667 349 3HG2 VAL 44 HG23 VAL 44 10.672 -3.759 -8.621 350 H VAL 45 HN VAL 45 7.872 -1.516 -7.771 351 HA VAL 45 HA VAL 45 7.749 -0.265 -10.408 352 HB VAL 45 HB VAL 45 6.196 1.454 -9.768 353 1HG1 VAL 45 HG11 VAL 45 5.248 -0.630 -10.662 354 2HG1 VAL 45 HG12 VAL 45 4.139 0.192 -9.565 355 3HG1 VAL 45 HG13 VAL 45 5.035 -1.224 -9.016 356 1HG2 VAL 45 HG21 VAL 45 5.680 0.107 -7.139 357 2HG2 VAL 45 HG22 VAL 45 5.256 1.739 -7.655 358 3HG2 VAL 45 HG23 VAL 45 6.937 1.334 -7.306 359 H THR 46 HN THR 46 8.228 2.171 -10.184 360 HA THR 46 HA THR 46 10.410 2.474 -8.231 361 HB THR 46 HB THR 46 11.440 4.088 -9.715 362 HG1 THR 46 HG1 THR 46 10.496 4.562 -11.727 363 1HG2 THR 46 HG21 THR 46 11.516 2.467 -11.851 364 2HG2 THR 46 HG22 THR 46 10.790 1.362 -10.685 365 3HG2 THR 46 HG23 THR 46 12.355 2.099 -10.344 366 H LEU 47 HN LEU 47 10.497 4.237 -6.936 367 HA LEU 47 HA LEU 47 8.055 5.832 -6.806 368 1HB LEU 47 HB2 LEU 47 10.318 5.394 -4.879 369 2HB LEU 47 HB1 LEU 47 9.084 6.613 -4.609 370 HG LEU 47 HG LEU 47 8.404 4.749 -3.349 371 1HD1 LEU 47 HD11 LEU 47 6.436 5.466 -4.265 372 2HD1 LEU 47 HD12 LEU 47 6.453 3.798 -4.834 373 3HD1 LEU 47 HD13 LEU 47 6.938 5.103 -5.915 374 1HD2 LEU 47 HD21 LEU 47 9.900 3.277 -5.143 375 2HD2 LEU 47 HD22 LEU 47 8.249 2.723 -5.419 376 3HD2 LEU 47 HD23 LEU 47 8.949 2.638 -3.802 377 H THR 48 HN THR 48 7.958 8.021 -6.865 378 HA THR 48 HA THR 48 10.404 9.531 -7.434 379 HB THR 48 HB THR 48 8.814 10.807 -9.144 380 HG1 THR 48 HG1 THR 48 7.603 8.356 -8.722 381 1HG2 THR 48 HG21 THR 48 9.911 8.302 -10.283 382 2HG2 THR 48 HG22 THR 48 11.036 9.332 -9.398 383 3HG2 THR 48 HG23 THR 48 10.155 9.975 -10.784 384 H ASP 49 HN ASP 49 10.445 10.945 -5.801 385 HA ASP 49 HA ASP 49 9.853 12.639 -4.401 386 1HB ASP 49 HB2 ASP 49 8.552 13.243 -6.756 387 2HB ASP 49 HB1 ASP 49 7.241 13.256 -5.581 388 H THR 50 HN THR 50 8.696 9.791 -4.312 389 HA THR 50 HA THR 50 6.392 10.261 -2.556 390 HB THR 50 HB THR 50 5.675 8.120 -2.961 391 HG1 THR 50 HG1 THR 50 7.203 6.728 -2.424 392 1HG2 THR 50 HG21 THR 50 5.372 8.282 -5.162 393 2HG2 THR 50 HG22 THR 50 7.040 7.794 -5.461 394 3HG2 THR 50 HG23 THR 50 6.650 9.497 -5.218 395 H THR 51 HN THR 51 6.633 10.193 -0.412 396 HA THR 51 HA THR 51 9.119 9.769 0.840 397 HB THR 51 HB THR 51 6.755 9.366 2.556 398 HG1 THR 51 HG1 THR 51 6.253 11.690 2.289 399 1HG2 THR 51 HG21 THR 51 9.379 10.563 2.645 400 2HG2 THR 51 HG22 THR 51 8.324 10.078 3.972 401 3HG2 THR 51 HG23 THR 51 8.158 11.681 3.253 402 H ASN 52 HN ASN 52 9.294 8.174 2.769 403 HA ASN 52 HA ASN 52 9.607 5.620 1.844 404 1HB ASN 52 HB2 ASN 52 9.687 4.892 4.201 405 2HB ASN 52 HB1 ASN 52 10.597 6.374 3.938 406 1HD2 ASN 52 HD21 ASN 52 9.009 8.384 4.151 407 2HD2 ASN 52 HD22 ASN 52 8.111 8.395 5.626 408 H GLN 53 HN GLN 53 6.893 6.698 3.890 409 HA GLN 53 HA GLN 53 5.433 4.309 3.675 410 1HB GLN 53 HB2 GLN 53 4.258 7.053 4.104 411 2HB GLN 53 HB1 GLN 53 3.611 5.511 4.648 412 1HG GLN 53 HG2 GLN 53 4.789 5.579 6.523 413 2HG GLN 53 HG1 GLN 53 6.282 5.939 5.653 414 1HE2 GLN 53 HE21 GLN 53 3.541 7.252 7.291 415 2HE2 GLN 53 HE22 GLN 53 4.104 8.875 7.421 416 H LYS 54 HN LYS 54 5.614 7.151 1.641 417 HA LYS 54 HA LYS 54 3.328 6.579 0.065 418 1HB LYS 54 HB2 LYS 54 5.601 8.455 -0.104 419 2HB LYS 54 HB1 LYS 54 4.873 7.998 -1.642 420 1HG LYS 54 HG2 LYS 54 3.430 9.647 -1.252 421 2HG LYS 54 HG1 LYS 54 2.680 8.541 -0.101 422 1HD LYS 54 HD2 LYS 54 4.929 10.382 0.666 423 2HD LYS 54 HD1 LYS 54 3.236 10.880 0.738 424 1HE LYS 54 HE2 LYS 54 2.728 9.227 2.356 425 2HE LYS 54 HE1 LYS 54 4.270 8.407 2.108 426 1HZ LYS 54 HZ1 LYS 54 3.675 10.833 3.626 427 2HZ LYS 54 HZ2 LYS 54 5.170 10.755 2.843 428 3HZ LYS 54 HZ3 LYS 54 4.750 9.574 3.978 429 H THR 55 HN THR 55 6.619 5.439 0.045 430 HA THR 55 HA THR 55 6.683 4.413 -2.593 431 HB THR 55 HB THR 55 8.592 3.195 -1.993 432 HG1 THR 55 HG1 THR 55 8.660 2.039 -0.224 433 1HG2 THR 55 HG21 THR 55 8.419 5.804 -1.137 434 2HG2 THR 55 HG22 THR 55 9.902 4.861 -1.269 435 3HG2 THR 55 HG23 THR 55 9.059 4.966 0.276 436 H GLU 56 HN GLU 56 5.495 3.341 0.463 437 HA GLU 56 HA GLU 56 4.684 0.729 -0.457 438 1HB GLU 56 HB2 GLU 56 3.484 1.744 2.020 439 2HB GLU 56 HB1 GLU 56 4.400 0.268 1.737 440 1HG GLU 56 HG2 GLU 56 5.897 2.822 1.730 441 2HG GLU 56 HG1 GLU 56 5.294 2.237 3.278 442 H LEU 57 HN LEU 57 3.436 3.931 -0.261 443 HA LEU 57 HA LEU 57 0.656 3.304 -0.399 444 1HB LEU 57 HB2 LEU 57 2.319 5.685 -0.425 445 2HB LEU 57 HB1 LEU 57 1.029 5.801 -1.603 446 HG LEU 57 HG LEU 57 0.036 6.770 0.222 447 1HD1 LEU 57 HD11 LEU 57 -1.726 5.456 0.766 448 2HD1 LEU 57 HD12 LEU 57 -0.715 4.067 1.163 449 3HD1 LEU 57 HD13 LEU 57 -1.049 4.462 -0.524 450 1HD2 LEU 57 HD21 LEU 57 0.342 5.572 2.554 451 2HD2 LEU 57 HD22 LEU 57 1.530 6.720 1.937 452 3HD2 LEU 57 HD23 LEU 57 1.819 4.987 1.788 453 H GLN 58 HN GLN 58 3.200 3.996 -2.738 454 HA GLN 58 HA GLN 58 1.566 4.041 -5.026 455 1HB GLN 58 HB2 GLN 58 3.844 4.908 -5.098 456 2HB GLN 58 HB1 GLN 58 4.486 3.310 -4.734 457 1HG GLN 58 HG2 GLN 58 4.578 4.091 -7.153 458 2HG GLN 58 HG1 GLN 58 3.948 2.475 -6.841 459 1HE2 GLN 58 HE21 GLN 58 1.988 1.965 -7.584 460 2HE2 GLN 58 HE22 GLN 58 0.866 3.074 -8.293 461 H ALA 59 HN ALA 59 3.516 1.493 -3.519 462 HA ALA 59 HA ALA 59 2.775 -0.607 -5.222 463 1HB ALA 59 HB1 ALA 59 3.600 -2.087 -3.537 464 2HB ALA 59 HB2 ALA 59 3.386 -0.870 -2.279 465 3HB ALA 59 HB3 ALA 59 4.625 -0.653 -3.514 466 H ILE 60 HN ILE 60 1.280 0.846 -2.407 467 HA ILE 60 HA ILE 60 -0.710 -0.997 -1.823 468 HB ILE 60 HB ILE 60 -0.346 1.900 -1.399 469 1HG1 ILE 60 HG12 ILE 60 -1.676 -0.045 0.455 470 2HG1 ILE 60 HG11 ILE 60 0.055 -0.158 0.150 471 1HG2 ILE 60 HG21 ILE 60 -2.637 2.336 -0.719 472 2HG2 ILE 60 HG22 ILE 60 -3.121 0.723 -1.244 473 3HG2 ILE 60 HG23 ILE 60 -2.577 1.909 -2.429 474 1HD1 ILE 60 HD11 ILE 60 -1.255 1.472 1.999 475 2HD1 ILE 60 HD12 ILE 60 -0.661 2.550 0.737 476 3HD1 ILE 60 HD13 ILE 60 0.458 1.478 1.577 477 H TYR 61 HN TYR 61 -0.748 1.673 -4.156 478 HA TYR 61 HA TYR 61 -3.306 1.450 -5.161 479 1HB TYR 61 HB2 TYR 61 -2.219 3.229 -6.114 480 2HB TYR 61 HB1 TYR 61 -0.688 2.374 -6.216 481 HD1 TYR 61 HD1 TYR 61 -3.703 3.353 -7.990 482 HD2 TYR 61 HD2 TYR 61 -0.285 0.805 -8.114 483 HE1 TYR 61 HE1 TYR 61 -4.063 2.984 -10.392 484 HE2 TYR 61 HE2 TYR 61 -0.638 0.443 -10.519 485 HH TYR 61 HH TYR 61 -2.731 2.330 -12.379 486 H LEU 62 HN LEU 62 -0.433 -0.435 -5.883 487 HA LEU 62 HA LEU 62 -1.537 -1.992 -7.978 488 1HB LEU 62 HB2 LEU 62 0.607 -2.871 -6.068 489 2HB LEU 62 HB1 LEU 62 0.362 -3.406 -7.721 490 HG LEU 62 HG LEU 62 1.103 -0.564 -7.056 491 1HD1 LEU 62 HD11 LEU 62 2.749 -2.407 -6.271 492 2HD1 LEU 62 HD12 LEU 62 3.360 -1.044 -7.208 493 3HD1 LEU 62 HD13 LEU 62 3.083 -2.599 -7.991 494 1HD2 LEU 62 HD21 LEU 62 1.010 -2.236 -9.544 495 2HD2 LEU 62 HD22 LEU 62 2.017 -0.793 -9.444 496 3HD2 LEU 62 HD23 LEU 62 0.271 -0.666 -9.235 497 H ALA 63 HN ALA 63 -1.026 -2.722 -4.516 498 HA ALA 63 HA ALA 63 -2.095 -5.257 -4.371 499 1HB ALA 63 HB1 ALA 63 -1.108 -4.386 -2.425 500 2HB ALA 63 HB2 ALA 63 -2.814 -4.587 -2.027 501 3HB ALA 63 HB3 ALA 63 -2.179 -2.985 -2.407 502 H LEU 64 HN LEU 64 -3.673 -2.207 -4.758 503 HA LEU 64 HA LEU 64 -6.341 -3.270 -4.298 504 1HB LEU 64 HB2 LEU 64 -5.204 -0.584 -4.959 505 2HB LEU 64 HB1 LEU 64 -6.909 -0.885 -5.231 506 HG LEU 64 HG LEU 64 -6.374 -1.782 -2.614 507 1HD1 LEU 64 HD11 LEU 64 -4.882 0.690 -3.356 508 2HD1 LEU 64 HD12 LEU 64 -4.434 -0.612 -2.254 509 3HD1 LEU 64 HD13 LEU 64 -5.639 0.581 -1.767 510 1HD2 LEU 64 HD21 LEU 64 -7.837 0.508 -3.870 511 2HD2 LEU 64 HD22 LEU 64 -7.731 0.372 -2.115 512 3HD2 LEU 64 HD23 LEU 64 -8.478 -0.920 -3.056 513 H GLN 65 HN GLN 65 -4.281 -2.343 -6.976 514 HA GLN 65 HA GLN 65 -6.069 -2.225 -9.066 515 1HB GLN 65 HB2 GLN 65 -3.197 -3.030 -8.865 516 2HB GLN 65 HB1 GLN 65 -4.037 -3.212 -10.399 517 1HG GLN 65 HG2 GLN 65 -4.225 -0.603 -8.992 518 2HG GLN 65 HG1 GLN 65 -2.712 -1.018 -9.797 519 1HE2 GLN 65 HE21 GLN 65 -5.372 0.695 -10.219 520 2HE2 GLN 65 HE22 GLN 65 -5.593 0.556 -11.927 521 H ASP 66 HN ASP 66 -4.341 -5.144 -7.930 522 HA ASP 66 HA ASP 66 -5.890 -6.816 -9.710 523 1HB ASP 66 HB2 ASP 66 -3.802 -7.432 -7.623 524 2HB ASP 66 HB1 ASP 66 -4.655 -8.686 -8.518 525 H SER 67 HN SER 67 -6.171 -5.653 -6.497 526 HA SER 67 HA SER 67 -7.636 -7.726 -5.313 527 1HB SER 67 HB2 SER 67 -7.219 -6.173 -3.708 528 2HB SER 67 HB1 SER 67 -7.305 -4.819 -4.826 529 HG SER 67 HG SER 67 -9.043 -4.762 -3.383 530 H GLY 68 HN GLY 68 -9.103 -8.647 -6.665 531 1HA GLY 68 HA2 GLY 68 -10.742 -7.536 -8.510 532 2HA GLY 68 HA1 GLY 68 -11.190 -8.945 -7.569 533 H LEU 69 HN LEU 69 -11.548 -7.861 -5.057 534 HA LEU 69 HA LEU 69 -13.378 -5.610 -5.331 535 1HB LEU 69 HB2 LEU 69 -14.298 -8.137 -3.967 536 2HB LEU 69 HB1 LEU 69 -15.244 -6.706 -4.333 537 HG LEU 69 HG LEU 69 -14.433 -7.514 -6.832 538 1HD1 LEU 69 HD11 LEU 69 -14.020 -9.725 -5.137 539 2HD1 LEU 69 HD12 LEU 69 -13.968 -9.679 -6.900 540 3HD1 LEU 69 HD13 LEU 69 -15.478 -10.060 -6.071 541 1HD2 LEU 69 HD21 LEU 69 -16.868 -7.512 -5.230 542 2HD2 LEU 69 HD22 LEU 69 -16.875 -8.729 -6.507 543 3HD2 LEU 69 HD23 LEU 69 -16.613 -7.031 -6.907 544 H GLU 70 HN GLU 70 -13.797 -7.606 -2.599 545 HA GLU 70 HA GLU 70 -12.521 -5.631 -0.901 546 1HB GLU 70 HB2 GLU 70 -13.460 -7.150 0.927 547 2HB GLU 70 HB1 GLU 70 -14.630 -6.335 -0.105 548 1HG GLU 70 HG2 GLU 70 -14.964 -8.334 -1.391 549 2HG GLU 70 HG1 GLU 70 -13.696 -9.171 -0.486 550 H VAL 71 HN VAL 71 -10.552 -5.877 -0.020 551 HA VAL 71 HA VAL 71 -9.452 -8.563 0.278 552 HB VAL 71 HB VAL 71 -7.331 -7.982 -0.759 553 1HG1 VAL 71 HG11 VAL 71 -9.681 -7.461 -2.581 554 2HG1 VAL 71 HG12 VAL 71 -9.035 -9.043 -2.145 555 3HG1 VAL 71 HG13 VAL 71 -8.061 -7.926 -3.099 556 1HG2 VAL 71 HG21 VAL 71 -7.833 -5.444 -0.298 557 2HG2 VAL 71 HG22 VAL 71 -8.467 -5.499 -1.942 558 3HG2 VAL 71 HG23 VAL 71 -6.788 -5.939 -1.629 559 H ASN 72 HN ASN 72 -7.453 -8.600 1.516 560 HA ASN 72 HA ASN 72 -7.508 -6.613 3.653 561 1HB ASN 72 HB2 ASN 72 -6.347 -9.383 3.373 562 2HB ASN 72 HB1 ASN 72 -5.852 -8.318 4.687 563 1HD2 ASN 72 HD21 ASN 72 -8.945 -9.081 3.123 564 2HD2 ASN 72 HD22 ASN 72 -9.784 -9.461 4.584 565 H ILE 73 HN ILE 73 -6.323 -4.862 3.019 566 HA ILE 73 HA ILE 73 -3.832 -5.340 1.590 567 HB ILE 73 HB ILE 73 -5.439 -2.845 2.031 568 1HG1 ILE 73 HG12 ILE 73 -4.971 -4.817 -0.120 569 2HG1 ILE 73 HG11 ILE 73 -6.393 -3.839 0.222 570 1HG2 ILE 73 HG21 ILE 73 -3.050 -2.289 2.241 571 2HG2 ILE 73 HG22 ILE 73 -3.752 -1.621 0.768 572 3HG2 ILE 73 HG23 ILE 73 -2.741 -3.064 0.688 573 1HD1 ILE 73 HD11 ILE 73 -5.133 -1.891 -0.751 574 2HD1 ILE 73 HD12 ILE 73 -5.588 -3.165 -1.882 575 3HD1 ILE 73 HD13 ILE 73 -3.929 -3.057 -1.297 576 H VAL 74 HN VAL 74 -2.300 -5.850 2.880 577 HA VAL 74 HA VAL 74 -1.809 -4.372 5.362 578 HB VAL 74 HB VAL 74 0.005 -6.588 4.585 579 1HG1 VAL 74 HG11 VAL 74 -1.381 -5.791 7.141 580 2HG1 VAL 74 HG12 VAL 74 0.294 -5.461 6.700 581 3HG1 VAL 74 HG13 VAL 74 -0.232 -7.120 6.985 582 1HG2 VAL 74 HG21 VAL 74 -2.853 -7.079 5.417 583 2HG2 VAL 74 HG22 VAL 74 -1.586 -8.304 5.351 584 3HG2 VAL 74 HG23 VAL 74 -2.123 -7.510 3.871 585 H THR 75 HN THR 75 -0.581 -2.602 5.157 586 HA THR 75 HA THR 75 1.843 -2.792 3.501 587 HB THR 75 HB THR 75 0.358 -0.212 3.419 588 HG1 THR 75 HG1 THR 75 -1.220 -1.798 2.853 589 1HG2 THR 75 HG21 THR 75 1.639 0.190 1.567 590 2HG2 THR 75 HG22 THR 75 1.684 -1.507 1.090 591 3HG2 THR 75 HG23 THR 75 2.704 -0.935 2.409 592 H ASP 76 HN ASP 76 3.612 -1.829 4.361 593 HA ASP 76 HA ASP 76 3.327 -0.680 7.000 594 1HB ASP 76 HB2 ASP 76 5.970 -0.554 5.713 595 2HB ASP 76 HB1 ASP 76 5.517 -1.202 7.286 596 H SER 77 HN SER 77 2.433 1.296 6.890 597 HA SER 77 HA SER 77 4.059 3.444 5.946 598 1HB SER 77 HB2 SER 77 1.697 4.113 4.630 599 2HB SER 77 HB1 SER 77 3.208 3.612 3.873 600 HG SER 77 HG SER 77 1.203 2.387 3.355 601 H GLN 78 HN GLN 78 3.923 4.394 7.949 602 HA GLN 78 HA GLN 78 1.555 4.547 9.469 603 1HB GLN 78 HB2 GLN 78 4.193 5.950 9.541 604 2HB GLN 78 HB1 GLN 78 2.867 6.595 10.500 605 1HG GLN 78 HG2 GLN 78 3.181 5.066 12.063 606 2HG GLN 78 HG1 GLN 78 3.050 3.761 10.882 607 1HE2 GLN 78 HE21 GLN 78 5.204 4.066 9.325 608 2HE2 GLN 78 HE22 GLN 78 6.659 3.906 10.241 609 H TYR 79 HN TYR 79 2.485 6.092 6.644 610 HA TYR 79 HA TYR 79 0.944 8.510 7.038 611 1HB TYR 79 HB2 TYR 79 3.033 7.861 5.335 612 2HB TYR 79 HB1 TYR 79 1.633 7.862 4.269 613 HD1 TYR 79 HD1 TYR 79 0.581 9.896 3.626 614 HD2 TYR 79 HD2 TYR 79 3.590 9.924 6.633 615 HE1 TYR 79 HE1 TYR 79 0.670 12.349 3.506 616 HE2 TYR 79 HE2 TYR 79 3.686 12.378 6.522 617 HH TYR 79 HH TYR 79 1.608 14.200 4.287 618 H ALA 80 HN ALA 80 0.780 5.570 5.023 619 HA ALA 80 HA ALA 80 -1.734 6.080 3.886 620 1HB ALA 80 HB1 ALA 80 -0.013 4.151 3.452 621 2HB ALA 80 HB2 ALA 80 -1.735 3.865 3.202 622 3HB ALA 80 HB3 ALA 80 -0.953 3.300 4.677 623 H LEU 81 HN LEU 81 -0.699 4.795 6.944 624 HA LEU 81 HA LEU 81 -3.089 3.848 7.976 625 1HB LEU 81 HB2 LEU 81 -0.494 4.248 8.894 626 2HB LEU 81 HB1 LEU 81 -1.487 5.222 9.962 627 HG LEU 81 HG LEU 81 -1.153 3.041 10.935 628 1HD1 LEU 81 HD11 LEU 81 -3.968 3.070 9.887 629 2HD1 LEU 81 HD12 LEU 81 -3.393 4.215 11.098 630 3HD1 LEU 81 HD13 LEU 81 -3.384 2.486 11.444 631 1HD2 LEU 81 HD21 LEU 81 -1.768 1.004 9.872 632 2HD2 LEU 81 HD22 LEU 81 -0.739 1.894 8.750 633 3HD2 LEU 81 HD23 LEU 81 -2.486 1.862 8.508 634 H GLY 82 HN GLY 82 -1.706 7.104 8.068 635 1HA GLY 82 HA2 GLY 82 -3.972 8.158 9.513 636 2HA GLY 82 HA1 GLY 82 -2.609 9.076 8.897 637 H ILE 83 HN ILE 83 -2.694 8.648 6.211 638 HA ILE 83 HA ILE 83 -5.000 10.211 5.489 639 HB ILE 83 HB ILE 83 -3.146 9.253 3.386 640 1HG1 ILE 83 HG12 ILE 83 -1.589 9.635 5.266 641 2HG1 ILE 83 HG11 ILE 83 -1.404 10.869 4.022 642 1HG2 ILE 83 HG21 ILE 83 -5.071 11.240 3.663 643 2HG2 ILE 83 HG22 ILE 83 -3.955 11.022 2.315 644 3HG2 ILE 83 HG23 ILE 83 -3.531 12.099 3.645 645 1HD1 ILE 83 HD11 ILE 83 -1.945 12.510 5.421 646 2HD1 ILE 83 HD12 ILE 83 -1.670 11.326 6.699 647 3HD1 ILE 83 HD13 ILE 83 -3.304 11.613 6.100 648 H ILE 84 HN ILE 84 -3.595 7.234 4.068 649 HA ILE 84 HA ILE 84 -5.657 6.629 2.362 650 HB ILE 84 HB ILE 84 -3.317 5.326 3.151 651 1HG1 ILE 84 HG12 ILE 84 -4.317 5.791 0.857 652 2HG1 ILE 84 HG11 ILE 84 -3.529 4.226 1.051 653 1HG2 ILE 84 HG21 ILE 84 -4.506 3.893 4.672 654 2HG2 ILE 84 HG22 ILE 84 -4.044 2.955 3.253 655 3HG2 ILE 84 HG23 ILE 84 -5.706 3.511 3.439 656 1HD1 ILE 84 HD11 ILE 84 -5.409 3.118 0.613 657 2HD1 ILE 84 HD12 ILE 84 -6.021 4.658 0.007 658 3HD1 ILE 84 HD13 ILE 84 -6.375 4.157 1.660 659 H GLN 85 HN GLN 85 -5.542 6.036 5.817 660 HA GLN 85 HA GLN 85 -7.754 4.244 5.877 661 1HB GLN 85 HB2 GLN 85 -6.079 4.545 7.733 662 2HB GLN 85 HB1 GLN 85 -6.848 6.085 8.094 663 1HG GLN 85 HG2 GLN 85 -8.981 4.863 8.463 664 2HG GLN 85 HG1 GLN 85 -8.094 3.352 8.263 665 1HE2 GLN 85 HE21 GLN 85 -8.922 2.942 10.434 666 2HE2 GLN 85 HE22 GLN 85 -8.035 3.542 11.790 667 H ALA 86 HN ALA 86 -7.376 7.715 6.029 668 HA ALA 86 HA ALA 86 -10.250 8.102 6.369 669 1HB ALA 86 HB1 ALA 86 -7.866 9.686 6.913 670 2HB ALA 86 HB2 ALA 86 -9.455 9.729 7.677 671 3HB ALA 86 HB3 ALA 86 -9.176 10.606 6.173 672 H GLN 87 HN GLN 87 -10.548 7.104 4.196 673 HA GLN 87 HA GLN 87 -10.340 7.267 1.805 674 1HB GLN 87 HB2 GLN 87 -12.356 8.720 1.211 675 2HB GLN 87 HB1 GLN 87 -12.631 7.368 2.300 676 1HG GLN 87 HG2 GLN 87 -12.070 10.077 3.415 677 2HG GLN 87 HG1 GLN 87 -13.677 9.688 2.800 678 1HE2 GLN 87 HE21 GLN 87 -11.576 9.498 5.422 679 2HE2 GLN 87 HE22 GLN 87 -12.498 8.428 6.416 680 HA PRO 88 HA PRO 88 -7.983 11.233 1.561 681 1HB PRO 88 HB2 PRO 88 -5.663 10.291 0.671 682 2HB PRO 88 HB1 PRO 88 -6.099 10.184 2.383 683 1HG PRO 88 HG2 PRO 88 -6.351 8.096 0.241 684 2HG PRO 88 HG1 PRO 88 -5.628 7.949 1.854 685 1HD PRO 88 HD2 PRO 88 -8.167 7.156 1.346 686 2HD PRO 88 HD1 PRO 88 -7.692 7.844 2.913 687 H ASP 89 HN ASP 89 -9.829 9.875 -0.367 688 HA ASP 89 HA ASP 89 -8.796 9.558 -2.911 689 1HB ASP 89 HB2 ASP 89 -11.218 9.240 -2.003 690 2HB ASP 89 HB1 ASP 89 -11.443 10.915 -2.497 691 H GLN 90 HN GLN 90 -8.912 12.371 -1.052 692 HA GLN 90 HA GLN 90 -7.803 13.943 -3.185 693 1HB GLN 90 HB2 GLN 90 -9.731 15.726 -2.460 694 2HB GLN 90 HB1 GLN 90 -9.801 14.710 -3.895 695 1HG GLN 90 HG2 GLN 90 -11.884 14.733 -2.528 696 2HG GLN 90 HG1 GLN 90 -11.208 13.131 -2.815 697 1HE2 GLN 90 HE21 GLN 90 -11.205 11.841 -1.103 698 2HE2 GLN 90 HE22 GLN 90 -11.123 12.355 0.547 699 H SER 91 HN SER 91 -7.393 12.980 -0.307 700 HA SER 91 HA SER 91 -6.820 15.614 0.876 701 1HB SER 91 HB2 SER 91 -8.264 13.457 1.944 702 2HB SER 91 HB1 SER 91 -6.723 13.465 2.800 703 HG SER 91 HG SER 91 -8.779 15.030 3.226 704 H GLU 92 HN GLU 92 -4.837 16.088 1.601 705 HA GLU 92 HA GLU 92 -2.572 16.071 1.657 706 1HB GLU 92 HB2 GLU 92 -3.564 14.293 3.465 707 2HB GLU 92 HB1 GLU 92 -2.409 13.293 2.599 708 1HG GLU 92 HG2 GLU 92 -1.959 15.341 4.576 709 2HG GLU 92 HG1 GLU 92 -0.864 14.105 3.962 710 H SER 93 HN SER 93 -1.527 12.996 1.559 711 HA SER 93 HA SER 93 0.071 13.070 -0.571 712 1HB SER 93 HB2 SER 93 -0.927 11.041 1.134 713 2HB SER 93 HB1 SER 93 -1.012 10.421 -0.515 714 HG SER 93 HG SER 93 1.114 10.584 1.007 715 H GLU 94 HN GLU 94 0.094 12.584 -2.727 716 HA GLU 94 HA GLU 94 -2.415 12.928 -4.127 717 1HB GLU 94 HB2 GLU 94 0.126 12.361 -5.577 718 2HB GLU 94 HB1 GLU 94 -1.166 13.483 -5.977 719 1HG GLU 94 HG2 GLU 94 0.544 13.997 -3.590 720 2HG GLU 94 HG1 GLU 94 1.156 14.363 -5.203 721 H LEU 95 HN LEU 95 -0.103 10.384 -3.490 722 HA LEU 95 HA LEU 95 -0.937 8.531 -5.439 723 1HB LEU 95 HB2 LEU 95 1.061 8.538 -3.684 724 2HB LEU 95 HB1 LEU 95 -0.087 7.600 -2.741 725 HG LEU 95 HG LEU 95 0.794 5.820 -3.758 726 1HD1 LEU 95 HD11 LEU 95 -0.351 5.039 -5.571 727 2HD1 LEU 95 HD12 LEU 95 -0.258 6.573 -6.433 728 3HD1 LEU 95 HD13 LEU 95 -1.399 6.375 -5.103 729 1HD2 LEU 95 HD21 LEU 95 1.887 6.482 -6.221 730 2HD2 LEU 95 HD22 LEU 95 2.749 6.290 -4.694 731 3HD2 LEU 95 HD23 LEU 95 2.196 7.886 -5.200 732 H VAL 96 HN VAL 96 -1.754 8.799 -2.009 733 HA VAL 96 HA VAL 96 -3.578 6.752 -1.792 734 HB VAL 96 HB VAL 96 -4.585 8.048 0.064 735 1HG1 VAL 96 HG11 VAL 96 -2.909 7.239 1.266 736 2HG1 VAL 96 HG12 VAL 96 -1.894 8.602 0.794 737 3HG1 VAL 96 HG13 VAL 96 -1.921 7.139 -0.191 738 1HG2 VAL 96 HG21 VAL 96 -3.030 10.232 -1.216 739 2HG2 VAL 96 HG22 VAL 96 -3.175 10.229 0.541 740 3HG2 VAL 96 HG23 VAL 96 -4.624 10.272 -0.463 741 H ASN 97 HN ASN 97 -3.857 9.740 -3.457 742 HA ASN 97 HA ASN 97 -6.695 9.957 -3.502 743 1HB ASN 97 HB2 ASN 97 -4.413 11.256 -4.838 744 2HB ASN 97 HB1 ASN 97 -5.868 11.175 -5.822 745 1HD2 ASN 97 HD21 ASN 97 -5.218 11.732 -2.377 746 2HD2 ASN 97 HD22 ASN 97 -6.119 13.201 -2.274 747 H GLN 98 HN GLN 98 -4.320 8.813 -5.881 748 HA GLN 98 HA GLN 98 -6.193 7.823 -7.750 749 1HB GLN 98 HB2 GLN 98 -4.017 8.202 -8.571 750 2HB GLN 98 HB1 GLN 98 -3.268 7.324 -7.244 751 1HG GLN 98 HG2 GLN 98 -3.555 5.306 -8.229 752 2HG GLN 98 HG1 GLN 98 -5.045 5.788 -9.035 753 1HE2 GLN 98 HE21 GLN 98 -4.684 5.376 -11.113 754 2HE2 GLN 98 HE22 GLN 98 -3.347 5.967 -12.033 755 H ILE 99 HN ILE 99 -4.705 6.489 -4.904 756 HA ILE 99 HA ILE 99 -5.294 3.765 -5.319 757 HB ILE 99 HB ILE 99 -4.781 5.382 -2.831 758 1HG1 ILE 99 HG12 ILE 99 -3.052 3.140 -3.730 759 2HG1 ILE 99 HG11 ILE 99 -3.052 4.593 -4.727 760 1HG2 ILE 99 HG21 ILE 99 -4.423 2.677 -2.216 761 2HG2 ILE 99 HG22 ILE 99 -5.997 2.786 -3.004 762 3HG2 ILE 99 HG23 ILE 99 -5.652 3.770 -1.580 763 1HD1 ILE 99 HD11 ILE 99 -1.783 5.685 -3.276 764 2HD1 ILE 99 HD12 ILE 99 -1.525 4.135 -2.479 765 3HD1 ILE 99 HD13 ILE 99 -2.799 5.214 -1.914 766 H ILE 100 HN ILE 100 -6.962 6.216 -3.343 767 HA ILE 100 HA ILE 100 -9.089 4.618 -2.525 768 HB ILE 100 HB ILE 100 -8.961 7.592 -2.957 769 1HG1 ILE 100 HG12 ILE 100 -7.505 6.854 -1.197 770 2HG1 ILE 100 HG11 ILE 100 -8.926 7.574 -0.445 771 1HG2 ILE 100 HG21 ILE 100 -11.233 5.866 -2.412 772 2HG2 ILE 100 HG22 ILE 100 -11.188 7.563 -2.886 773 3HG2 ILE 100 HG23 ILE 100 -11.015 7.118 -1.188 774 1HD1 ILE 100 HD11 ILE 100 -9.377 5.701 0.647 775 2HD1 ILE 100 HD12 ILE 100 -7.817 5.090 0.096 776 3HD1 ILE 100 HD13 ILE 100 -9.278 4.737 -0.827 777 H GLU 101 HN GLU 101 -8.815 6.733 -5.361 778 HA GLU 101 HA GLU 101 -11.383 6.511 -6.341 779 1HB GLU 101 HB2 GLU 101 -8.716 6.977 -7.562 780 2HB GLU 101 HB1 GLU 101 -10.014 6.513 -8.658 781 1HG GLU 101 HG2 GLU 101 -11.097 8.482 -6.991 782 2HG GLU 101 HG1 GLU 101 -9.484 9.049 -7.424 783 H GLN 102 HN GLN 102 -8.718 4.256 -6.457 784 HA GLN 102 HA GLN 102 -10.032 2.371 -8.165 785 1HB GLN 102 HB2 GLN 102 -7.480 2.554 -6.720 786 2HB GLN 102 HB1 GLN 102 -8.138 0.924 -6.794 787 1HG GLN 102 HG2 GLN 102 -6.606 1.343 -8.629 788 2HG GLN 102 HG1 GLN 102 -8.244 1.059 -9.219 789 1HE2 GLN 102 HE21 GLN 102 -9.440 2.816 -10.031 790 2HE2 GLN 102 HE22 GLN 102 -8.663 4.261 -10.570 791 H LEU 103 HN LEU 103 -9.788 2.984 -4.750 792 HA LEU 103 HA LEU 103 -10.854 0.541 -3.808 793 1HB LEU 103 HB2 LEU 103 -9.846 2.865 -2.671 794 2HB LEU 103 HB1 LEU 103 -11.530 2.862 -2.186 795 HG LEU 103 HG LEU 103 -9.607 0.586 -1.710 796 1HD1 LEU 103 HD11 LEU 103 -10.485 2.877 0.012 797 2HD1 LEU 103 HD12 LEU 103 -8.851 2.304 -0.321 798 3HD1 LEU 103 HD13 LEU 103 -9.926 1.355 0.706 799 1HD2 LEU 103 HD21 LEU 103 -11.344 -0.624 -1.028 800 2HD2 LEU 103 HD22 LEU 103 -12.386 0.598 -1.758 801 3HD2 LEU 103 HD23 LEU 103 -11.967 0.704 -0.048 802 H ILE 104 HN ILE 104 -12.282 3.473 -5.063 803 HA ILE 104 HA ILE 104 -14.929 3.025 -4.148 804 HB ILE 104 HB ILE 104 -14.295 4.479 -6.701 805 1HG1 ILE 104 HG12 ILE 104 -14.138 5.733 -3.961 806 2HG1 ILE 104 HG11 ILE 104 -12.716 5.145 -4.817 807 1HG2 ILE 104 HG21 ILE 104 -16.307 5.113 -4.557 808 2HG2 ILE 104 HG22 ILE 104 -16.656 4.077 -5.941 809 3HG2 ILE 104 HG23 ILE 104 -16.222 5.768 -6.192 810 1HD1 ILE 104 HD11 ILE 104 -14.104 7.631 -5.091 811 2HD1 ILE 104 HD12 ILE 104 -14.087 6.775 -6.632 812 3HD1 ILE 104 HD13 ILE 104 -12.572 7.120 -5.797 813 H LYS 105 HN LYS 105 -13.199 2.219 -7.127 814 HA LYS 105 HA LYS 105 -15.462 1.018 -8.383 815 1HB LYS 105 HB2 LYS 105 -14.043 0.504 -10.163 816 2HB LYS 105 HB1 LYS 105 -13.342 1.969 -9.492 817 1HG LYS 105 HG2 LYS 105 -11.470 0.912 -8.774 818 2HG LYS 105 HG1 LYS 105 -12.313 -0.607 -8.461 819 1HD LYS 105 HD2 LYS 105 -11.038 -1.166 -10.298 820 2HD LYS 105 HD1 LYS 105 -12.551 -0.672 -11.063 821 1HE LYS 105 HE2 LYS 105 -11.661 1.460 -11.631 822 2HE LYS 105 HE1 LYS 105 -10.232 1.198 -10.631 823 1HZ LYS 105 HZ1 LYS 105 -10.072 -0.874 -12.298 824 2HZ LYS 105 HZ2 LYS 105 -9.329 0.617 -12.589 825 3HZ LYS 105 HZ3 LYS 105 -10.815 0.260 -13.312 826 H LYS 106 HN LYS 106 -13.860 0.027 -5.706 827 HA LYS 106 HA LYS 106 -14.403 -2.801 -6.344 828 1HB LYS 106 HB2 LYS 106 -12.525 -3.519 -5.031 829 2HB LYS 106 HB1 LYS 106 -11.961 -2.351 -6.216 830 1HG LYS 106 HG2 LYS 106 -11.624 -0.701 -4.607 831 2HG LYS 106 HG1 LYS 106 -12.645 -1.519 -3.422 832 1HD LYS 106 HD2 LYS 106 -10.322 -1.777 -2.804 833 2HD LYS 106 HD1 LYS 106 -10.977 -3.340 -3.297 834 1HE LYS 106 HE2 LYS 106 -8.658 -2.692 -4.167 835 2HE LYS 106 HE1 LYS 106 -9.827 -3.312 -5.332 836 1HZ LYS 106 HZ1 LYS 106 -8.433 -1.101 -5.726 837 2HZ LYS 106 HZ2 LYS 106 -9.778 -0.427 -4.955 838 3HZ LYS 106 HZ3 LYS 106 -9.980 -1.331 -6.369 839 H GLU 107 HN GLU 107 -13.842 -3.732 -3.679 840 HA GLU 107 HA GLU 107 -16.292 -2.769 -2.412 841 1HB GLU 107 HB2 GLU 107 -16.019 -5.201 -2.830 842 2HB GLU 107 HB1 GLU 107 -14.642 -5.215 -1.739 843 1HG GLU 107 HG2 GLU 107 -15.987 -5.504 -0.013 844 2HG GLU 107 HG1 GLU 107 -16.832 -4.005 -0.396 845 H LYS 108 HN LYS 108 -13.573 -4.226 -0.705 846 HA LYS 108 HA LYS 108 -12.933 -1.697 0.592 847 1HB LYS 108 HB2 LYS 108 -13.325 -2.682 2.859 848 2HB LYS 108 HB1 LYS 108 -14.791 -2.396 1.929 849 1HG LYS 108 HG2 LYS 108 -15.028 -4.707 1.427 850 2HG LYS 108 HG1 LYS 108 -13.422 -5.071 2.060 851 1HD LYS 108 HD2 LYS 108 -14.618 -5.695 3.878 852 2HD LYS 108 HD1 LYS 108 -14.515 -3.971 4.247 853 1HE LYS 108 HE2 LYS 108 -16.697 -3.703 3.005 854 2HE LYS 108 HE1 LYS 108 -16.806 -5.463 2.983 855 1HZ LYS 108 HZ1 LYS 108 -16.967 -5.541 5.305 856 2HZ LYS 108 HZ2 LYS 108 -17.990 -4.274 4.851 857 3HZ LYS 108 HZ3 LYS 108 -16.464 -3.937 5.497 858 H VAL 109 HN VAL 109 -10.855 -1.583 1.202 859 HA VAL 109 HA VAL 109 -9.327 -4.098 1.303 860 HB VAL 109 HB VAL 109 -7.290 -2.822 0.793 861 1HG1 VAL 109 HG11 VAL 109 -8.667 -1.885 -1.519 862 2HG1 VAL 109 HG12 VAL 109 -9.451 -3.371 -0.983 863 3HG1 VAL 109 HG13 VAL 109 -7.719 -3.359 -1.322 864 1HG2 VAL 109 HG21 VAL 109 -7.474 -0.492 -0.007 865 2HG2 VAL 109 HG22 VAL 109 -7.930 -0.654 1.688 866 3HG2 VAL 109 HG23 VAL 109 -9.176 -0.475 0.453 867 H TYR 110 HN TYR 110 -8.622 -4.656 3.276 868 HA TYR 110 HA TYR 110 -8.859 -2.771 5.447 869 1HB TYR 110 HB2 TYR 110 -9.350 -4.752 6.422 870 2HB TYR 110 HB1 TYR 110 -8.592 -5.666 5.130 871 HD1 TYR 110 HD1 TYR 110 -6.655 -6.868 5.577 872 HD2 TYR 110 HD2 TYR 110 -7.753 -3.696 8.179 873 HE1 TYR 110 HE1 TYR 110 -4.820 -7.484 7.080 874 HE2 TYR 110 HE2 TYR 110 -5.925 -4.294 9.704 875 HH TYR 110 HH TYR 110 -4.508 -6.145 10.246 876 H LEU 111 HN LEU 111 -7.349 -1.223 5.468 877 HA LEU 111 HA LEU 111 -4.584 -1.949 4.842 878 1HB LEU 111 HB2 LEU 111 -6.208 0.293 4.223 879 2HB LEU 111 HB1 LEU 111 -4.888 0.853 5.233 880 HG LEU 111 HG LEU 111 -4.037 -0.942 3.081 881 1HD1 LEU 111 HD11 LEU 111 -5.727 0.061 1.775 882 2HD1 LEU 111 HD12 LEU 111 -4.232 0.906 1.375 883 3HD1 LEU 111 HD13 LEU 111 -5.408 1.658 2.454 884 1HD2 LEU 111 HD21 LEU 111 -3.086 1.338 4.601 885 2HD2 LEU 111 HD22 LEU 111 -2.739 1.490 2.878 886 3HD2 LEU 111 HD23 LEU 111 -2.180 0.074 3.769 887 H ALA 112 HN ALA 112 -3.160 -2.219 6.409 888 HA ALA 112 HA ALA 112 -3.170 -0.473 8.703 889 1HB ALA 112 HB1 ALA 112 -3.906 -1.832 10.356 890 2HB ALA 112 HB2 ALA 112 -3.373 -3.302 9.541 891 3HB ALA 112 HB3 ALA 112 -4.857 -2.498 9.029 892 H TRP 113 HN TRP 113 -1.418 -0.834 10.188 893 HA TRP 113 HA TRP 113 0.654 -2.702 9.595 894 1HB TRP 113 HB2 TRP 113 1.171 -1.140 7.811 895 2HB TRP 113 HB1 TRP 113 1.139 0.217 8.938 896 HD1 TRP 113 HD1 TRP 113 3.531 0.989 9.422 897 HE1 TRP 113 HE1 TRP 113 5.806 -0.157 9.800 898 HE3 TRP 113 HE3 TRP 113 2.121 -3.876 8.729 899 HZ2 TRP 113 HZ2 TRP 113 6.861 -2.776 9.805 900 HZ3 TRP 113 HZ3 TRP 113 3.821 -5.640 8.941 901 HH2 TRP 113 HH2 TRP 113 6.143 -5.100 9.467 902 H VAL 114 HN VAL 114 2.333 -2.697 11.126 903 HA VAL 114 HA VAL 114 1.792 -1.095 13.539 904 HB VAL 114 HB VAL 114 1.394 -3.439 13.995 905 1HG1 VAL 114 HG11 VAL 114 3.660 -3.819 12.272 906 2HG1 VAL 114 HG12 VAL 114 2.463 -4.990 12.825 907 3HG1 VAL 114 HG13 VAL 114 3.898 -4.668 13.799 908 1HG2 VAL 114 HG21 VAL 114 3.949 -2.352 15.152 909 2HG2 VAL 114 HG22 VAL 114 3.201 -3.842 15.728 910 3HG2 VAL 114 HG23 VAL 114 2.329 -2.313 15.847 911 HA PRO 115 HA PRO 115 5.520 1.176 12.614 912 1HB PRO 115 HB2 PRO 115 5.712 0.888 15.595 913 2HB PRO 115 HB1 PRO 115 6.033 2.304 14.585 914 1HG PRO 115 HG2 PRO 115 3.713 2.037 15.891 915 2HG PRO 115 HG1 PRO 115 3.787 2.761 14.275 916 1HD PRO 115 HD2 PRO 115 2.700 0.151 15.110 917 2HD PRO 115 HD1 PRO 115 2.356 1.102 13.652 918 H ALA 116 HN ALA 116 7.072 0.007 11.668 919 HA ALA 116 HA ALA 116 9.201 -1.101 13.080 920 1HB ALA 116 HB1 ALA 116 7.413 -2.845 13.567 921 2HB ALA 116 HB2 ALA 116 8.950 -3.433 12.932 922 3HB ALA 116 HB3 ALA 116 7.549 -3.299 11.868 923 H HIS 117 HN HIS 117 7.299 -1.137 10.120 924 HA HIS 117 HA HIS 117 7.859 -1.128 7.913 925 1HB HIS 117 HB2 HIS 117 9.926 0.445 9.268 926 2HB HIS 117 HB1 HIS 117 10.471 -0.236 7.739 927 HD1 HIS 117 HD1 HIS 117 6.956 0.979 8.358 928 HD2 HIS 117 HD2 HIS 117 10.375 2.116 6.273 929 HE1 HIS 117 HE1 HIS 117 6.250 2.909 6.909 930 HE2 HIS 117 HE2 HIS 117 8.356 3.641 5.734 931 H LYS 118 HN LYS 118 7.868 -3.583 8.421 932 HA LYS 118 HA LYS 118 10.462 -4.658 7.537 933 1HB LYS 118 HB2 LYS 118 8.594 -5.959 9.525 934 2HB LYS 118 HB1 LYS 118 10.106 -6.636 8.934 935 1HG LYS 118 HG2 LYS 118 11.391 -5.018 10.068 936 2HG LYS 118 HG1 LYS 118 9.975 -4.015 10.393 937 1HD LYS 118 HD2 LYS 118 9.354 -5.247 12.181 938 2HD LYS 118 HD1 LYS 118 9.840 -6.769 11.431 939 1HE LYS 118 HE2 LYS 118 12.256 -5.704 11.798 940 2HE LYS 118 HE1 LYS 118 11.402 -4.879 13.100 941 1HZ LYS 118 HZ1 LYS 118 10.607 -7.161 13.780 942 2HZ LYS 118 HZ2 LYS 118 12.249 -6.842 14.030 943 3HZ LYS 118 HZ3 LYS 118 11.765 -7.791 12.717 944 H GLY 119 HN GLY 119 7.551 -4.084 6.403 945 1HA GLY 119 HA2 GLY 119 6.333 -4.973 4.660 946 2HA GLY 119 HA1 GLY 119 7.656 -6.104 4.413 947 H ILE 120 HN ILE 120 5.677 -7.485 3.862 948 HA ILE 120 HA ILE 120 5.221 -9.242 6.064 949 HB ILE 120 HB ILE 120 3.510 -7.240 6.230 950 1HG1 ILE 120 HG12 ILE 120 2.219 -9.902 6.550 951 2HG1 ILE 120 HG11 ILE 120 3.730 -9.626 7.411 952 1HG2 ILE 120 HG21 ILE 120 1.915 -9.115 4.509 953 2HG2 ILE 120 HG22 ILE 120 2.724 -7.689 3.855 954 3HG2 ILE 120 HG23 ILE 120 1.476 -7.508 5.089 955 1HD1 ILE 120 HD11 ILE 120 1.186 -8.934 8.247 956 2HD1 ILE 120 HD12 ILE 120 1.910 -7.409 7.735 957 3HD1 ILE 120 HD13 ILE 120 2.713 -8.402 8.951 958 H GLY 121 HN GLY 121 4.251 -8.315 2.770 959 1HA GLY 121 HA2 GLY 121 3.811 -11.179 2.202 960 2HA GLY 121 HA1 GLY 121 3.080 -9.864 1.283 961 H GLY 122 HN GLY 122 5.889 -8.538 1.550 962 1HA GLY 122 HA2 GLY 122 7.063 -10.019 -0.722 963 2HA GLY 122 HA1 GLY 122 7.146 -8.273 -0.542 964 H ASN 123 HN ASN 123 7.560 -9.137 2.489 965 HA ASN 123 HA ASN 123 10.478 -9.184 2.235 966 1HB ASN 123 HB2 ASN 123 8.633 -7.885 4.017 967 2HB ASN 123 HB1 ASN 123 9.741 -8.891 4.946 968 1HD2 ASN 123 HD21 ASN 123 9.331 -6.011 3.192 969 2HD2 ASN 123 HD22 ASN 123 10.954 -5.428 3.309 970 H GLU 124 HN GLU 124 8.880 -11.574 1.814 971 HA GLU 124 HA GLU 124 9.015 -13.238 4.120 972 1HB GLU 124 HB2 GLU 124 7.620 -13.469 1.900 973 2HB GLU 124 HB1 GLU 124 9.032 -14.359 1.346 974 1HG GLU 124 HG2 GLU 124 8.673 -16.100 2.770 975 2HG GLU 124 HG1 GLU 124 7.861 -15.096 3.971 976 H GLN 125 HN GLN 125 11.091 -12.773 1.293 977 HA GLN 125 HA GLN 125 13.409 -13.607 2.746 978 1HB GLN 125 HB2 GLN 125 12.440 -15.806 2.178 979 2HB GLN 125 HB1 GLN 125 12.465 -15.367 0.476 980 1HG GLN 125 HG2 GLN 125 14.670 -15.752 0.269 981 2HG GLN 125 HG1 GLN 125 15.038 -15.139 1.881 982 1HE2 GLN 125 HE21 GLN 125 15.773 -17.633 0.355 983 2HE2 GLN 125 HE22 GLN 125 15.410 -18.923 1.446 984 H VAL 126 HN VAL 126 12.121 -13.301 -0.562 985 HA VAL 126 HA VAL 126 14.595 -12.007 -1.413 986 HB VAL 126 HB VAL 126 12.175 -12.636 -3.103 987 1HG1 VAL 126 HG11 VAL 126 15.053 -12.202 -3.889 988 2HG1 VAL 126 HG12 VAL 126 13.790 -10.975 -3.988 989 3HG1 VAL 126 HG13 VAL 126 13.680 -12.437 -4.969 990 1HG2 VAL 126 HG21 VAL 126 12.843 -14.772 -3.401 991 2HG2 VAL 126 HG22 VAL 126 13.580 -14.542 -1.816 992 3HG2 VAL 126 HG23 VAL 126 14.555 -14.367 -3.276 993 H ASP 127 HN ASP 127 14.734 -9.896 -1.010 994 HA ASP 127 HA ASP 127 12.808 -8.082 -2.100 995 1HB ASP 127 HB2 ASP 127 11.913 -8.843 0.218 996 2HB ASP 127 HB1 ASP 127 13.189 -7.818 0.870 997 H LYS 128 HN LYS 128 15.848 -8.909 -1.349 998 HA LYS 128 HA LYS 128 16.776 -6.111 -1.269 999 1HB LYS 128 HB2 LYS 128 17.257 -7.733 0.724 1000 2HB LYS 128 HB1 LYS 128 18.481 -8.398 -0.348 1001 1HG LYS 128 HG2 LYS 128 19.338 -6.013 -0.584 1002 2HG LYS 128 HG1 LYS 128 18.307 -5.632 0.796 1003 1HD LYS 128 HD2 LYS 128 19.539 -7.772 1.796 1004 2HD LYS 128 HD1 LYS 128 20.788 -7.254 0.660 1005 1HE LYS 128 HE2 LYS 128 20.671 -4.982 1.669 1006 2HE LYS 128 HE1 LYS 128 19.557 -5.622 2.876 1007 1HZ LYS 128 HZ1 LYS 128 22.088 -7.028 2.533 1008 2HZ LYS 128 HZ2 LYS 128 21.199 -6.730 3.940 1009 3HZ LYS 128 HZ3 LYS 128 22.157 -5.507 3.269 1010 H LEU 129 HN LEU 129 18.710 -5.620 -2.448 1011 HA LEU 129 HA LEU 129 18.971 -7.262 -4.855 1012 1HB LEU 129 HB2 LEU 129 18.497 -4.844 -5.085 1013 2HB LEU 129 HB1 LEU 129 20.018 -4.488 -4.287 1014 HG LEU 129 HG LEU 129 21.135 -5.785 -6.190 1015 1HD1 LEU 129 HD11 LEU 129 18.313 -5.717 -7.095 1016 2HD1 LEU 129 HD12 LEU 129 19.563 -6.933 -7.362 1017 3HD1 LEU 129 HD13 LEU 129 19.568 -5.441 -8.303 1018 1HD2 LEU 129 HD21 LEU 129 21.128 -3.309 -5.899 1019 2HD2 LEU 129 HD22 LEU 129 19.702 -3.242 -6.935 1020 3HD2 LEU 129 HD23 LEU 129 21.231 -3.840 -7.578 1021 H VAL 130 HN VAL 130 21.381 -5.194 -3.273 1022 HA VAL 130 HA VAL 130 23.273 -7.445 -3.415 1023 HB VAL 130 HB VAL 130 24.366 -4.746 -2.945 1024 1HG1 VAL 130 HG11 VAL 130 25.759 -5.729 -4.988 1025 2HG1 VAL 130 HG12 VAL 130 25.074 -7.238 -4.383 1026 3HG1 VAL 130 HG13 VAL 130 26.049 -6.223 -3.320 1027 1HG2 VAL 130 HG21 VAL 130 23.464 -3.677 -4.669 1028 2HG2 VAL 130 HG22 VAL 130 22.434 -5.070 -4.995 1029 3HG2 VAL 130 HG23 VAL 130 24.017 -4.947 -5.760 1030 H SER 131 HN SER 131 25.196 -5.987 -1.725 1031 HA SER 131 HA SER 131 24.265 -6.948 0.815 1032 1HB SER 131 HB2 SER 131 26.630 -5.515 1.245 1033 2HB SER 131 HB1 SER 131 26.478 -7.256 1.015 1034 HG SER 131 HG SER 131 26.730 -5.397 -1.112 1035 H ALA 132 HN ALA 132 24.015 -4.023 -0.844 1036 HA ALA 132 HA ALA 132 23.247 -2.650 1.641 1037 1HB ALA 132 HB1 ALA 132 24.599 -0.893 1.308 1038 2HB ALA 132 HB2 ALA 132 24.330 -0.889 -0.435 1039 3HB ALA 132 HB3 ALA 132 25.509 -1.993 0.274 1040 H GLY 133 HN GLY 133 23.256 -1.765 -1.812 1041 1HA GLY 133 HA2 GLY 133 21.512 -1.318 -3.251 1042 2HA GLY 133 HA1 GLY 133 20.428 -2.074 -2.093 1043 H ILE 134 HN ILE 134 19.810 0.234 -3.591 1044 HA ILE 134 HA ILE 134 19.978 2.434 -1.667 1045 HB ILE 134 HB ILE 134 18.615 2.688 -4.318 1046 1HG1 ILE 134 HG12 ILE 134 21.598 3.014 -4.013 1047 2HG1 ILE 134 HG11 ILE 134 20.877 1.511 -4.579 1048 1HG2 ILE 134 HG21 ILE 134 18.977 4.929 -4.072 1049 2HG2 ILE 134 HG22 ILE 134 20.456 4.701 -3.140 1050 3HG2 ILE 134 HG23 ILE 134 18.886 4.450 -2.378 1051 1HD1 ILE 134 HD11 ILE 134 19.796 3.693 -6.067 1052 2HD1 ILE 134 HD12 ILE 134 20.745 2.317 -6.631 1053 3HD1 ILE 134 HD13 ILE 134 21.557 3.783 -6.078 1054 H ARG 135 HN ARG 135 18.501 0.943 -0.327 1055 HA ARG 135 HA ARG 135 15.738 1.771 -0.850 1056 1HB ARG 135 HB2 ARG 135 14.888 -0.422 -0.218 1057 2HB ARG 135 HB1 ARG 135 15.953 -0.548 -1.612 1058 1HG ARG 135 HG2 ARG 135 17.009 -1.013 1.147 1059 2HG ARG 135 HG1 ARG 135 16.135 -2.285 0.290 1060 1HD ARG 135 HD2 ARG 135 18.831 -1.204 -0.155 1061 2HD ARG 135 HD1 ARG 135 18.184 -2.810 -0.485 1062 HE ARG 135 HE ARG 135 17.920 -0.471 -2.253 1063 1HH1 ARG 135 HH11 ARG 135 17.840 -3.913 -1.715 1064 2HH1 ARG 135 HH12 ARG 135 17.737 -4.303 -3.399 1065 1HH2 ARG 135 HH21 ARG 135 17.788 -0.976 -4.471 1066 2HH2 ARG 135 HH22 ARG 135 17.710 -2.634 -4.967 1067 H LYS 136 HN LYS 136 17.257 3.176 0.855 1068 HA LYS 136 HA LYS 136 17.351 2.270 3.516 1069 1HB LYS 136 HB2 LYS 136 17.090 5.125 2.561 1070 2HB LYS 136 HB1 LYS 136 17.684 4.597 4.129 1071 1HG LYS 136 HG2 LYS 136 19.234 3.297 2.150 1072 2HG LYS 136 HG1 LYS 136 19.132 5.006 1.724 1073 1HD LYS 136 HD2 LYS 136 19.635 4.458 4.569 1074 2HD LYS 136 HD1 LYS 136 20.926 3.965 3.472 1075 1HE LYS 136 HE2 LYS 136 20.536 6.357 2.459 1076 2HE LYS 136 HE1 LYS 136 19.852 6.686 4.050 1077 1HZ LYS 136 HZ1 LYS 136 21.907 6.988 4.776 1078 2HZ LYS 136 HZ2 LYS 136 22.566 6.521 3.291 1079 3HZ LYS 136 HZ3 LYS 136 22.245 5.357 4.475 1080 H VAL 137 HN VAL 137 15.644 1.622 4.645 1081 HA VAL 137 HA VAL 137 13.034 2.826 4.194 1082 HB VAL 137 HB VAL 137 12.170 1.091 5.697 1083 1HG1 VAL 137 HG11 VAL 137 12.262 -0.589 4.149 1084 2HG1 VAL 137 HG12 VAL 137 13.996 -0.405 3.888 1085 3HG1 VAL 137 HG13 VAL 137 12.870 0.751 3.177 1086 1HG2 VAL 137 HG21 VAL 137 15.085 0.504 6.091 1087 2HG2 VAL 137 HG22 VAL 137 13.862 -0.744 6.331 1088 3HG2 VAL 137 HG23 VAL 137 13.822 0.728 7.302 1089 H LEU 138 HN LEU 138 11.925 4.060 5.648 1090 HA LEU 138 HA LEU 138 13.309 4.724 8.162 1091 1HB LEU 138 HB2 LEU 138 12.417 6.457 5.980 1092 2HB LEU 138 HB1 LEU 138 11.841 6.972 7.555 1093 HG LEU 138 HG LEU 138 14.732 6.317 7.284 1094 1HD1 LEU 138 HD11 LEU 138 14.899 7.686 5.505 1095 2HD1 LEU 138 HD12 LEU 138 14.777 8.951 6.727 1096 3HD1 LEU 138 HD13 LEU 138 13.347 8.462 5.820 1097 1HD2 LEU 138 HD21 LEU 138 14.952 7.584 9.144 1098 2HD2 LEU 138 HD22 LEU 138 13.248 7.178 9.338 1099 3HD2 LEU 138 HD23 LEU 138 13.710 8.732 8.644 Start of MODEL 6 1 1H MET 1 HT1 MET 1 -22.381 5.135 7.891 2 2H MET 1 HT2 MET 1 -22.977 3.664 7.307 3 3H MET 1 HT3 MET 1 -24.002 5.003 7.424 4 HA MET 1 HA MET 1 -22.899 4.282 5.157 5 1HB MET 1 HB2 MET 1 -23.113 6.725 4.511 6 2HB MET 1 HB1 MET 1 -24.523 6.013 5.285 7 1HG MET 1 HG2 MET 1 -24.501 7.706 6.704 8 2HG MET 1 HG1 MET 1 -23.011 7.046 7.376 9 1HE MET 1 HE1 MET 1 -23.570 11.054 5.930 10 2HE MET 1 HE2 MET 1 -24.720 9.813 6.428 11 3HE MET 1 HE3 MET 1 -24.307 10.000 4.723 12 H ASN 2 HN ASN 2 -21.219 5.106 3.746 13 HA ASN 2 HA ASN 2 -18.702 5.416 5.182 14 1HB ASN 2 HB2 ASN 2 -17.756 5.133 2.798 15 2HB ASN 2 HB1 ASN 2 -18.535 3.739 3.547 16 1HD2 ASN 2 HD21 ASN 2 -18.549 5.931 0.948 17 2HD2 ASN 2 HD22 ASN 2 -19.953 5.331 0.141 18 H GLU 3 HN GLU 3 -17.550 6.634 2.648 19 HA GLU 3 HA GLU 3 -18.527 9.385 3.027 20 1HB GLU 3 HB2 GLU 3 -16.138 8.492 3.982 21 2HB GLU 3 HB1 GLU 3 -15.668 9.071 2.391 22 1HG GLU 3 HG2 GLU 3 -15.647 11.145 3.134 23 2HG GLU 3 HG1 GLU 3 -17.350 11.021 3.578 24 H LEU 4 HN LEU 4 -16.267 7.552 0.970 25 HA LEU 4 HA LEU 4 -17.626 8.642 -1.397 26 1HB LEU 4 HB2 LEU 4 -15.124 9.443 -0.516 27 2HB LEU 4 HB1 LEU 4 -14.766 8.268 -1.767 28 HG LEU 4 HG LEU 4 -16.591 9.728 -3.082 29 1HD1 LEU 4 HD11 LEU 4 -15.487 11.485 -0.935 30 2HD1 LEU 4 HD12 LEU 4 -17.126 11.393 -1.580 31 3HD1 LEU 4 HD13 LEU 4 -15.848 12.158 -2.525 32 1HD2 LEU 4 HD21 LEU 4 -14.626 11.028 -3.990 33 2HD2 LEU 4 HD22 LEU 4 -14.464 9.271 -4.009 34 3HD2 LEU 4 HD23 LEU 4 -13.640 10.219 -2.771 35 H TYR 5 HN TYR 5 -16.221 6.032 0.245 36 HA TYR 5 HA TYR 5 -17.004 4.178 -1.799 37 1HB TYR 5 HB2 TYR 5 -14.788 3.100 -1.958 38 2HB TYR 5 HB1 TYR 5 -14.756 4.748 -2.576 39 HD1 TYR 5 HD1 TYR 5 -13.594 6.507 -1.370 40 HD2 TYR 5 HD2 TYR 5 -13.603 2.501 0.060 41 HE1 TYR 5 HE1 TYR 5 -11.706 7.037 0.122 42 HE2 TYR 5 HE2 TYR 5 -11.735 3.016 1.571 43 HH TYR 5 HH TYR 5 -9.984 4.592 1.858 44 H GLN 6 HN GLN 6 -16.016 1.886 -0.919 45 HA GLN 6 HA GLN 6 -17.439 1.259 1.386 46 1HB GLN 6 HB2 GLN 6 -15.876 -0.774 1.345 47 2HB GLN 6 HB1 GLN 6 -16.888 -0.482 -0.072 48 1HG GLN 6 HG2 GLN 6 -14.200 0.754 -0.006 49 2HG GLN 6 HG1 GLN 6 -14.310 -0.981 -0.282 50 1HE2 GLN 6 HE21 GLN 6 -13.805 1.645 -1.840 51 2HE2 GLN 6 HE22 GLN 6 -14.646 1.360 -3.319 52 H LEU 7 HN LEU 7 -16.987 2.162 3.373 53 HA LEU 7 HA LEU 7 -14.256 2.796 4.067 54 1HB LEU 7 HB2 LEU 7 -16.840 3.634 4.934 55 2HB LEU 7 HB1 LEU 7 -15.946 3.052 6.328 56 HG LEU 7 HG LEU 7 -14.455 4.863 4.533 57 1HD1 LEU 7 HD11 LEU 7 -17.015 5.628 5.797 58 2HD1 LEU 7 HD12 LEU 7 -16.196 6.299 4.386 59 3HD1 LEU 7 HD13 LEU 7 -15.665 6.743 6.009 60 1HD2 LEU 7 HD21 LEU 7 -14.318 3.883 7.184 61 2HD2 LEU 7 HD22 LEU 7 -14.514 5.633 7.273 62 3HD2 LEU 7 HD23 LEU 7 -13.183 4.941 6.346 63 H GLU 8 HN GLU 8 -13.115 0.980 4.287 64 HA GLU 8 HA GLU 8 -14.006 -1.021 6.263 65 1HB GLU 8 HB2 GLU 8 -13.538 -1.765 3.904 66 2HB GLU 8 HB1 GLU 8 -11.857 -1.326 4.161 67 1HG GLU 8 HG2 GLU 8 -12.236 -3.714 4.477 68 2HG GLU 8 HG1 GLU 8 -11.674 -2.936 5.956 69 H LYS 9 HN LYS 9 -10.736 -0.363 5.079 70 HA LYS 9 HA LYS 9 -8.789 0.143 6.118 71 1HB LYS 9 HB2 LYS 9 -10.171 1.577 8.326 72 2HB LYS 9 HB1 LYS 9 -8.771 2.055 7.379 73 1HG LYS 9 HG2 LYS 9 -11.596 2.039 6.343 74 2HG LYS 9 HG1 LYS 9 -10.782 3.455 7.006 75 1HD LYS 9 HD2 LYS 9 -9.743 3.840 5.076 76 2HD LYS 9 HD1 LYS 9 -9.155 2.178 5.000 77 1HE LYS 9 HE2 LYS 9 -11.748 1.802 4.361 78 2HE LYS 9 HE1 LYS 9 -11.501 3.425 3.717 79 1HZ LYS 9 HZ1 LYS 9 -9.615 1.235 3.107 80 2HZ LYS 9 HZ2 LYS 9 -9.867 2.680 2.263 81 3HZ LYS 9 HZ3 LYS 9 -11.026 1.451 2.199 82 H GLU 10 HN GLU 10 -11.006 -1.830 7.557 83 HA GLU 10 HA GLU 10 -9.039 -2.732 9.536 84 1HB GLU 10 HB2 GLU 10 -10.955 -3.142 11.132 85 2HB GLU 10 HB1 GLU 10 -10.552 -1.449 10.867 86 1HG GLU 10 HG2 GLU 10 -12.365 -1.457 9.108 87 2HG GLU 10 HG1 GLU 10 -12.868 -3.001 9.789 88 HA PRO 11 HA PRO 11 -9.781 -6.982 8.513 89 1HB PRO 11 HB2 PRO 11 -11.519 -7.820 10.601 90 2HB PRO 11 HB1 PRO 11 -9.773 -8.070 10.489 91 1HG PRO 11 HG2 PRO 11 -11.297 -5.979 11.944 92 2HG PRO 11 HG1 PRO 11 -9.731 -6.713 12.339 93 1HD PRO 11 HD2 PRO 11 -9.869 -4.226 11.389 94 2HD PRO 11 HD1 PRO 11 -8.576 -5.325 10.857 95 H ILE 12 HN ILE 12 -11.016 -7.402 6.842 96 HA ILE 12 HA ILE 12 -13.731 -6.467 6.653 97 HB ILE 12 HB ILE 12 -12.180 -8.269 4.785 98 1HG1 ILE 12 HG12 ILE 12 -12.636 -5.311 4.472 99 2HG1 ILE 12 HG11 ILE 12 -11.245 -5.938 5.352 100 1HG2 ILE 12 HG21 ILE 12 -14.760 -6.753 4.498 101 2HG2 ILE 12 HG22 ILE 12 -14.474 -8.479 4.275 102 3HG2 ILE 12 HG23 ILE 12 -13.828 -7.321 3.112 103 1HD1 ILE 12 HD11 ILE 12 -11.878 -6.713 2.520 104 2HD1 ILE 12 HD12 ILE 12 -10.381 -6.977 3.414 105 3HD1 ILE 12 HD13 ILE 12 -10.852 -5.343 2.947 106 H VAL 13 HN VAL 13 -15.575 -7.750 6.526 107 HA VAL 13 HA VAL 13 -15.907 -9.834 8.262 108 HB VAL 13 HB VAL 13 -17.689 -10.287 6.061 109 1HG1 VAL 13 HG11 VAL 13 -18.064 -9.051 8.782 110 2HG1 VAL 13 HG12 VAL 13 -18.235 -10.756 8.365 111 3HG1 VAL 13 HG13 VAL 13 -19.369 -9.570 7.718 112 1HG2 VAL 13 HG21 VAL 13 -18.699 -8.113 5.812 113 2HG2 VAL 13 HG22 VAL 13 -16.998 -8.018 5.355 114 3HG2 VAL 13 HG23 VAL 13 -17.525 -7.403 6.921 115 H GLY 14 HN GLY 14 -14.732 -9.999 4.960 116 1HA GLY 14 HA2 GLY 14 -13.514 -12.485 5.285 117 2HA GLY 14 HA1 GLY 14 -15.094 -12.785 4.583 118 H ALA 15 HN ALA 15 -12.071 -11.003 4.104 119 HA ALA 15 HA ALA 15 -12.556 -11.117 1.192 120 1HB ALA 15 HB1 ALA 15 -11.982 -8.975 0.979 121 2HB ALA 15 HB2 ALA 15 -10.587 -9.154 2.044 122 3HB ALA 15 HB3 ALA 15 -12.187 -8.861 2.728 123 H GLU 16 HN GLU 16 -10.576 -11.252 -0.137 124 HA GLU 16 HA GLU 16 -8.803 -13.277 0.891 125 1HB GLU 16 HB2 GLU 16 -7.904 -13.396 -1.333 126 2HB GLU 16 HB1 GLU 16 -9.652 -13.255 -1.459 127 1HG GLU 16 HG2 GLU 16 -9.104 -10.698 -1.670 128 2HG GLU 16 HG1 GLU 16 -7.530 -11.305 -2.179 129 H THR 17 HN THR 17 -6.566 -13.110 1.252 130 HA THR 17 HA THR 17 -5.735 -10.512 2.146 131 HB THR 17 HB THR 17 -4.047 -11.501 3.306 132 HG1 THR 17 HG1 THR 17 -2.625 -12.649 2.244 133 1HG2 THR 17 HG21 THR 17 -6.390 -12.858 3.386 134 2HG2 THR 17 HG22 THR 17 -5.008 -13.216 4.423 135 3HG2 THR 17 HG23 THR 17 -5.280 -14.161 2.958 136 H PHE 18 HN PHE 18 -4.232 -9.246 1.559 137 HA PHE 18 HA PHE 18 -2.703 -9.688 -0.885 138 1HB PHE 18 HB2 PHE 18 -4.877 -7.729 -0.426 139 2HB PHE 18 HB1 PHE 18 -3.433 -7.102 -1.190 140 HD1 PHE 18 HD1 PHE 18 -5.699 -10.048 -1.479 141 HD2 PHE 18 HD2 PHE 18 -3.397 -7.087 -3.484 142 HE1 PHE 18 HE1 PHE 18 -6.512 -10.888 -3.641 143 HE2 PHE 18 HE2 PHE 18 -4.204 -7.922 -5.651 144 HZ PHE 18 HZ PHE 18 -5.767 -9.825 -5.733 145 H TYR 19 HN TYR 19 -0.710 -8.748 -0.817 146 HA TYR 19 HA TYR 19 -0.071 -7.156 1.569 147 1HB TYR 19 HB2 TYR 19 2.244 -8.440 0.489 148 2HB TYR 19 HB1 TYR 19 1.517 -8.632 2.086 149 HD1 TYR 19 HD1 TYR 19 1.243 -9.774 -1.455 150 HD2 TYR 19 HD2 TYR 19 0.429 -10.605 2.663 151 HE1 TYR 19 HE1 TYR 19 0.454 -12.056 -2.020 152 HE2 TYR 19 HE2 TYR 19 -0.333 -12.865 2.086 153 HH TYR 19 HH TYR 19 -0.684 -13.876 -1.255 154 H VAL 20 HN VAL 20 1.598 -5.585 1.407 155 HA VAL 20 HA VAL 20 2.457 -4.812 -1.256 156 HB VAL 20 HB VAL 20 1.577 -2.391 -0.101 157 1HG1 VAL 20 HG11 VAL 20 0.609 -3.986 -2.450 158 2HG1 VAL 20 HG12 VAL 20 1.840 -2.720 -2.438 159 3HG1 VAL 20 HG13 VAL 20 0.154 -2.314 -2.120 160 1HG2 VAL 20 HG21 VAL 20 -0.697 -4.357 -0.288 161 2HG2 VAL 20 HG22 VAL 20 -0.778 -2.659 0.182 162 3HG2 VAL 20 HG23 VAL 20 0.023 -3.827 1.232 163 H ASP 21 HN ASP 21 4.475 -4.072 -1.176 164 HA ASP 21 HA ASP 21 5.463 -2.348 0.822 165 1HB ASP 21 HB2 ASP 21 5.450 -4.291 2.249 166 2HB ASP 21 HB1 ASP 21 6.278 -5.250 1.026 167 H GLY 22 HN GLY 22 7.140 -1.247 -0.016 168 1HA GLY 22 HA2 GLY 22 8.705 -2.541 -2.156 169 2HA GLY 22 HA1 GLY 22 8.107 -0.898 -2.321 170 H ALA 23 HN ALA 23 10.819 -1.626 -2.550 171 HA ALA 23 HA ALA 23 11.955 -0.252 -0.192 172 1HB ALA 23 HB1 ALA 23 12.499 -2.846 -0.914 173 2HB ALA 23 HB2 ALA 23 13.529 -1.816 0.081 174 3HB ALA 23 HB3 ALA 23 13.824 -1.947 -1.653 175 H ALA 24 HN ALA 24 12.514 1.638 -0.677 176 HA ALA 24 HA ALA 24 14.106 2.171 -3.052 177 1HB ALA 24 HB1 ALA 24 12.759 4.379 -3.194 178 2HB ALA 24 HB2 ALA 24 11.523 3.494 -2.298 179 3HB ALA 24 HB3 ALA 24 12.057 2.912 -3.875 180 H ASN 25 HN ASN 25 15.409 4.081 -2.790 181 HA ASN 25 HA ASN 25 16.266 4.397 -0.080 182 1HB ASN 25 HB2 ASN 25 18.031 4.333 -1.629 183 2HB ASN 25 HB1 ASN 25 17.228 5.444 -2.729 184 1HD2 ASN 25 HD21 ASN 25 17.556 7.583 -2.529 185 2HD2 ASN 25 HD22 ASN 25 18.586 8.304 -1.345 186 H ARG 26 HN ARG 26 15.571 5.848 1.315 187 HA ARG 26 HA ARG 26 13.615 7.817 0.769 188 1HB ARG 26 HB2 ARG 26 14.289 6.614 2.980 189 2HB ARG 26 HB1 ARG 26 15.417 7.956 3.153 190 1HG ARG 26 HG2 ARG 26 13.801 9.370 3.733 191 2HG ARG 26 HG1 ARG 26 12.749 8.807 2.430 192 1HD ARG 26 HD2 ARG 26 11.600 7.456 3.790 193 2HD ARG 26 HD1 ARG 26 13.062 6.857 4.571 194 HE ARG 26 HE ARG 26 11.310 8.880 5.546 195 1HH1 ARG 26 HH11 ARG 26 14.646 7.877 5.477 196 2HH1 ARG 26 HH12 ARG 26 15.043 8.650 6.976 197 1HH2 ARG 26 HH21 ARG 26 11.822 9.896 7.520 198 2HH2 ARG 26 HH22 ARG 26 13.438 9.797 8.136 199 H GLU 27 HN GLU 27 17.085 8.024 1.343 200 HA GLU 27 HA GLU 27 17.570 10.670 1.596 201 1HB GLU 27 HB2 GLU 27 19.378 9.179 1.743 202 2HB GLU 27 HB1 GLU 27 19.049 8.491 0.167 203 1HG GLU 27 HG2 GLU 27 19.603 10.965 -0.612 204 2HG GLU 27 HG1 GLU 27 20.518 10.958 0.895 205 H THR 28 HN THR 28 16.559 9.009 -1.288 206 HA THR 28 HA THR 28 16.530 11.586 -2.698 207 HB THR 28 HB THR 28 17.079 9.050 -4.184 208 HG1 THR 28 HG1 THR 28 19.389 10.191 -3.808 209 1HG2 THR 28 HG21 THR 28 18.454 10.806 -5.500 210 2HG2 THR 28 HG22 THR 28 17.499 11.982 -4.598 211 3HG2 THR 28 HG23 THR 28 16.698 10.813 -5.648 212 H LYS 29 HN LYS 29 14.618 9.304 -1.438 213 HA LYS 29 HA LYS 29 12.551 8.422 -1.885 214 1HB LYS 29 HB2 LYS 29 12.213 11.034 -3.372 215 2HB LYS 29 HB1 LYS 29 10.921 10.015 -2.750 216 1HG LYS 29 HG2 LYS 29 10.963 11.231 -0.903 217 2HG LYS 29 HG1 LYS 29 12.547 10.535 -0.549 218 1HD LYS 29 HD2 LYS 29 13.430 12.404 -2.125 219 2HD LYS 29 HD1 LYS 29 11.869 13.164 -1.812 220 1HE LYS 29 HE2 LYS 29 12.380 12.866 0.655 221 2HE LYS 29 HE1 LYS 29 14.024 12.456 0.165 222 1HZ LYS 29 HZ1 LYS 29 12.749 14.964 -0.732 223 2HZ LYS 29 HZ2 LYS 29 14.396 14.586 -0.643 224 3HZ LYS 29 HZ3 LYS 29 13.515 14.868 0.773 225 H LEU 30 HN LEU 30 13.838 6.925 -3.316 226 HA LEU 30 HA LEU 30 12.448 6.614 -5.818 227 1HB LEU 30 HB2 LEU 30 14.030 8.188 -6.646 228 2HB LEU 30 HB1 LEU 30 15.350 7.420 -5.783 229 HG LEU 30 HG LEU 30 13.909 5.868 -7.893 230 1HD1 LEU 30 HD11 LEU 30 16.265 7.428 -8.748 231 2HD1 LEU 30 HD12 LEU 30 14.753 8.318 -8.573 232 3HD1 LEU 30 HD13 LEU 30 14.839 6.929 -9.657 233 1HD2 LEU 30 HD21 LEU 30 16.743 5.948 -6.862 234 2HD2 LEU 30 HD22 LEU 30 16.184 4.919 -8.182 235 3HD2 LEU 30 HD23 LEU 30 15.535 4.699 -6.554 236 H GLY 31 HN GLY 31 12.670 4.552 -6.687 237 1HA GLY 31 HA2 GLY 31 14.523 2.654 -6.416 238 2HA GLY 31 HA1 GLY 31 13.774 2.609 -4.828 239 H LYS 32 HN LYS 32 12.789 0.696 -4.870 240 HA LYS 32 HA LYS 32 10.893 0.163 -7.057 241 1HB LYS 32 HB2 LYS 32 11.950 -1.978 -5.256 242 2HB LYS 32 HB1 LYS 32 11.337 -2.112 -6.899 243 1HG LYS 32 HG2 LYS 32 13.481 -2.244 -7.497 244 2HG LYS 32 HG1 LYS 32 13.523 -0.500 -7.230 245 1HD LYS 32 HD2 LYS 32 14.962 -0.754 -5.554 246 2HD LYS 32 HD1 LYS 32 13.859 -1.859 -4.731 247 1HE LYS 32 HE2 LYS 32 16.068 -2.865 -5.194 248 2HE LYS 32 HE1 LYS 32 14.738 -3.732 -5.963 249 1HZ LYS 32 HZ1 LYS 32 16.751 -3.340 -7.381 250 2HZ LYS 32 HZ2 LYS 32 16.357 -1.696 -7.382 251 3HZ LYS 32 HZ3 LYS 32 15.287 -2.822 -8.051 252 H ALA 33 HN ALA 33 8.996 -1.083 -6.502 253 HA ALA 33 HA ALA 33 8.163 -1.345 -3.786 254 1HB ALA 33 HB1 ALA 33 7.142 0.936 -5.420 255 2HB ALA 33 HB2 ALA 33 7.600 0.896 -3.718 256 3HB ALA 33 HB3 ALA 33 6.088 0.155 -4.243 257 H GLY 34 HN GLY 34 7.110 -3.224 -3.822 258 1HA GLY 34 HA2 GLY 34 5.173 -3.679 -5.991 259 2HA GLY 34 HA1 GLY 34 6.412 -4.888 -5.699 260 H TYR 35 HN TYR 35 4.402 -6.159 -5.491 261 HA TYR 35 HA TYR 35 3.916 -6.697 -2.753 262 1HB TYR 35 HB2 TYR 35 1.796 -5.906 -2.453 263 2HB TYR 35 HB1 TYR 35 2.382 -4.669 -3.533 264 HD1 TYR 35 HD1 TYR 35 1.754 -4.771 -5.961 265 HD2 TYR 35 HD2 TYR 35 0.016 -7.347 -3.068 266 HE1 TYR 35 HE1 TYR 35 -0.079 -5.281 -7.515 267 HE2 TYR 35 HE2 TYR 35 -1.815 -7.865 -4.610 268 HH TYR 35 HH TYR 35 -2.762 -7.387 -6.567 269 H VAL 36 HN VAL 36 1.983 -8.372 -2.674 270 HA VAL 36 HA VAL 36 1.953 -9.893 -5.166 271 HB VAL 36 HB VAL 36 3.593 -11.200 -4.336 272 1HG1 VAL 36 HG11 VAL 36 3.048 -11.396 -1.494 273 2HG1 VAL 36 HG12 VAL 36 3.293 -9.734 -2.033 274 3HG1 VAL 36 HG13 VAL 36 4.528 -10.952 -2.345 275 1HG2 VAL 36 HG21 VAL 36 2.201 -12.966 -4.481 276 2HG2 VAL 36 HG22 VAL 36 1.033 -12.285 -3.350 277 3HG2 VAL 36 HG23 VAL 36 2.504 -13.044 -2.745 278 H THR 37 HN THR 37 0.207 -11.559 -5.203 279 HA THR 37 HA THR 37 -2.020 -10.723 -3.447 280 HB THR 37 HB THR 37 -3.527 -10.751 -5.183 281 HG1 THR 37 HG1 THR 37 -3.480 -12.563 -6.277 282 1HG2 THR 37 HG21 THR 37 -2.129 -9.995 -7.336 283 2HG2 THR 37 HG22 THR 37 -0.887 -9.795 -6.102 284 3HG2 THR 37 HG23 THR 37 -2.420 -8.933 -5.959 285 H ASN 38 HN ASN 38 -3.636 -12.331 -2.954 286 HA ASN 38 HA ASN 38 -2.607 -14.814 -2.204 287 1HB ASN 38 HB2 ASN 38 -4.730 -15.319 -1.459 288 2HB ASN 38 HB1 ASN 38 -4.855 -13.569 -1.590 289 1HD2 ASN 38 HD21 ASN 38 -5.318 -13.027 -4.107 290 2HD2 ASN 38 HD22 ASN 38 -6.740 -13.813 -4.695 291 H ARG 39 HN ARG 39 -3.256 -13.732 -5.316 292 HA ARG 39 HA ARG 39 -3.862 -16.376 -6.408 293 1HB ARG 39 HB2 ARG 39 -3.478 -13.842 -7.994 294 2HB ARG 39 HB1 ARG 39 -4.362 -15.293 -8.454 295 1HG ARG 39 HG2 ARG 39 -6.220 -14.710 -7.278 296 2HG ARG 39 HG1 ARG 39 -5.306 -13.801 -6.070 297 1HD ARG 39 HD2 ARG 39 -5.963 -11.956 -7.131 298 2HD ARG 39 HD1 ARG 39 -4.861 -12.419 -8.428 299 HE ARG 39 HE ARG 39 -6.668 -13.023 -9.714 300 1HH1 ARG 39 HH11 ARG 39 -7.698 -12.502 -6.426 301 2HH1 ARG 39 HH12 ARG 39 -9.386 -12.564 -6.808 302 1HH2 ARG 39 HH21 ARG 39 -8.890 -13.106 -10.226 303 2HH2 ARG 39 HH22 ARG 39 -10.064 -12.908 -8.968 304 H GLY 40 HN GLY 40 -1.186 -15.184 -5.295 305 1HA GLY 40 HA2 GLY 40 1.026 -15.687 -5.671 306 2HA GLY 40 HA1 GLY 40 0.511 -16.685 -7.022 307 H ARG 41 HN ARG 41 -0.074 -13.208 -6.588 308 HA ARG 41 HA ARG 41 1.341 -12.758 -9.122 309 1HB ARG 41 HB2 ARG 41 -0.685 -11.733 -9.414 310 2HB ARG 41 HB1 ARG 41 -0.883 -11.398 -7.705 311 1HG ARG 41 HG2 ARG 41 0.179 -9.369 -7.836 312 2HG ARG 41 HG1 ARG 41 1.215 -9.870 -9.173 313 1HD ARG 41 HD2 ARG 41 -1.119 -8.338 -9.311 314 2HD ARG 41 HD1 ARG 41 -0.191 -8.998 -10.656 315 HE ARG 41 HE ARG 41 -2.389 -10.495 -9.382 316 1HH1 ARG 41 HH11 ARG 41 -0.760 -9.259 -12.207 317 2HH1 ARG 41 HH12 ARG 41 -1.818 -10.056 -13.322 318 1HH2 ARG 41 HH21 ARG 41 -3.785 -11.547 -10.847 319 2HH2 ARG 41 HH22 ARG 41 -3.537 -11.356 -12.550 320 H GLN 42 HN GLN 42 2.772 -10.877 -9.301 321 HA GLN 42 HA GLN 42 3.735 -9.756 -6.794 322 1HB GLN 42 HB2 GLN 42 5.145 -11.824 -8.269 323 2HB GLN 42 HB1 GLN 42 6.105 -10.356 -8.143 324 1HG GLN 42 HG2 GLN 42 6.570 -10.742 -6.012 325 2HG GLN 42 HG1 GLN 42 4.873 -11.018 -5.621 326 1HE2 GLN 42 HE21 GLN 42 4.348 -12.980 -4.982 327 2HE2 GLN 42 HE22 GLN 42 5.255 -14.422 -5.270 328 H LYS 43 HN LYS 43 3.776 -7.617 -7.124 329 HA LYS 43 HA LYS 43 4.443 -6.709 -9.864 330 1HB LYS 43 HB2 LYS 43 3.060 -5.014 -7.803 331 2HB LYS 43 HB1 LYS 43 3.198 -4.725 -9.531 332 1HG LYS 43 HG2 LYS 43 1.551 -6.774 -8.126 333 2HG LYS 43 HG1 LYS 43 0.985 -5.406 -9.087 334 1HD LYS 43 HD2 LYS 43 2.764 -7.318 -10.472 335 2HD LYS 43 HD1 LYS 43 1.173 -7.939 -10.025 336 1HE LYS 43 HE2 LYS 43 0.757 -5.370 -11.090 337 2HE LYS 43 HE1 LYS 43 1.905 -6.167 -12.163 338 1HZ LYS 43 HZ1 LYS 43 -0.707 -7.302 -11.319 339 2HZ LYS 43 HZ2 LYS 43 0.381 -8.003 -12.408 340 3HZ LYS 43 HZ3 LYS 43 -0.405 -6.561 -12.810 341 H VAL 44 HN VAL 44 5.256 -4.424 -9.879 342 HA VAL 44 HA VAL 44 6.910 -3.611 -7.707 343 HB VAL 44 HB VAL 44 8.952 -3.598 -9.446 344 1HG1 VAL 44 HG11 VAL 44 8.150 -5.797 -7.558 345 2HG1 VAL 44 HG12 VAL 44 9.200 -4.419 -7.234 346 3HG1 VAL 44 HG13 VAL 44 9.739 -5.703 -8.316 347 1HG2 VAL 44 HG21 VAL 44 7.149 -5.804 -10.312 348 2HG2 VAL 44 HG22 VAL 44 8.892 -6.073 -10.338 349 3HG2 VAL 44 HG23 VAL 44 8.190 -4.752 -11.272 350 H VAL 45 HN VAL 45 7.721 -1.477 -7.971 351 HA VAL 45 HA VAL 45 7.263 -0.079 -10.479 352 HB VAL 45 HB VAL 45 5.850 1.643 -9.588 353 1HG1 VAL 45 HG11 VAL 45 4.524 -0.085 -10.435 354 2HG1 VAL 45 HG12 VAL 45 3.824 0.270 -8.854 355 3HG1 VAL 45 HG13 VAL 45 4.863 -1.140 -9.062 356 1HG2 VAL 45 HG21 VAL 45 6.798 0.691 -7.072 357 2HG2 VAL 45 HG22 VAL 45 5.034 0.663 -7.067 358 3HG2 VAL 45 HG23 VAL 45 5.891 2.161 -7.432 359 H THR 46 HN THR 46 7.849 2.351 -10.136 360 HA THR 46 HA THR 46 10.214 2.452 -8.385 361 HB THR 46 HB THR 46 11.189 4.119 -9.858 362 HG1 THR 46 HG1 THR 46 9.104 3.696 -11.728 363 1HG2 THR 46 HG21 THR 46 12.077 2.323 -10.851 364 2HG2 THR 46 HG22 THR 46 10.814 2.465 -12.074 365 3HG2 THR 46 HG23 THR 46 10.579 1.409 -10.682 366 H LEU 47 HN LEU 47 10.384 4.038 -6.925 367 HA LEU 47 HA LEU 47 8.052 5.734 -6.558 368 1HB LEU 47 HB2 LEU 47 10.445 5.164 -4.825 369 2HB LEU 47 HB1 LEU 47 9.207 6.333 -4.393 370 HG LEU 47 HG LEU 47 8.403 4.542 -3.247 371 1HD1 LEU 47 HD11 LEU 47 6.461 3.920 -4.213 372 2HD1 LEU 47 HD12 LEU 47 7.247 3.368 -5.690 373 3HD1 LEU 47 HD13 LEU 47 6.946 5.087 -5.442 374 1HD2 LEU 47 HD21 LEU 47 9.271 2.492 -3.389 375 2HD2 LEU 47 HD22 LEU 47 10.363 3.179 -4.592 376 3HD2 LEU 47 HD23 LEU 47 8.892 2.352 -5.105 377 H THR 48 HN THR 48 7.939 7.836 -6.841 378 HA THR 48 HA THR 48 10.382 9.403 -7.237 379 HB THR 48 HB THR 48 8.399 10.370 -9.058 380 HG1 THR 48 HG1 THR 48 8.346 8.518 -10.456 381 1HG2 THR 48 HG21 THR 48 11.213 9.745 -8.969 382 2HG2 THR 48 HG22 THR 48 10.356 10.903 -9.986 383 3HG2 THR 48 HG23 THR 48 10.509 9.224 -10.499 384 H ASP 49 HN ASP 49 10.294 11.059 -5.869 385 HA ASP 49 HA ASP 49 9.534 12.766 -4.575 386 1HB ASP 49 HB2 ASP 49 8.405 13.280 -6.913 387 2HB ASP 49 HB1 ASP 49 6.928 12.876 -6.042 388 H THR 50 HN THR 50 8.790 9.895 -4.141 389 HA THR 50 HA THR 50 6.521 10.320 -2.301 390 HB THR 50 HB THR 50 5.893 8.011 -2.560 391 HG1 THR 50 HG1 THR 50 8.405 7.825 -3.698 392 1HG2 THR 50 HG21 THR 50 6.378 9.421 -5.179 393 2HG2 THR 50 HG22 THR 50 4.901 9.400 -4.216 394 3HG2 THR 50 HG23 THR 50 5.435 7.937 -5.044 395 H THR 51 HN THR 51 6.911 9.955 -0.174 396 HA THR 51 HA THR 51 9.580 9.193 0.604 397 HB THR 51 HB THR 51 7.858 9.281 2.872 398 HG1 THR 51 HG1 THR 51 6.805 11.178 2.587 399 1HG2 THR 51 HG21 THR 51 9.735 10.215 3.613 400 2HG2 THR 51 HG22 THR 51 9.405 11.646 2.637 401 3HG2 THR 51 HG23 THR 51 10.348 10.317 1.963 402 H ASN 52 HN ASN 52 9.493 7.797 2.802 403 HA ASN 52 HA ASN 52 9.392 5.180 2.071 404 1HB ASN 52 HB2 ASN 52 10.369 5.033 4.065 405 2HB ASN 52 HB1 ASN 52 9.811 6.649 4.473 406 1HD2 ASN 52 HD21 ASN 52 7.846 6.890 5.561 407 2HD2 ASN 52 HD22 ASN 52 7.196 5.599 6.513 408 H GLN 53 HN GLN 53 6.845 6.750 4.039 409 HA GLN 53 HA GLN 53 5.118 4.523 3.959 410 1HB GLN 53 HB2 GLN 53 4.605 7.452 4.462 411 2HB GLN 53 HB1 GLN 53 3.348 6.230 4.581 412 1HG GLN 53 HG2 GLN 53 3.983 5.676 6.625 413 2HG GLN 53 HG1 GLN 53 5.655 5.453 6.110 414 1HE2 GLN 53 HE21 GLN 53 3.317 7.737 7.338 415 2HE2 GLN 53 HE22 GLN 53 4.459 8.900 7.904 416 H LYS 54 HN LYS 54 5.705 7.142 1.782 417 HA LYS 54 HA LYS 54 3.334 6.806 0.228 418 1HB LYS 54 HB2 LYS 54 5.841 8.410 -0.085 419 2HB LYS 54 HB1 LYS 54 4.753 8.203 -1.457 420 1HG LYS 54 HG2 LYS 54 3.774 10.052 -0.653 421 2HG LYS 54 HG1 LYS 54 2.995 8.931 0.465 422 1HD LYS 54 HD2 LYS 54 5.657 10.112 1.163 423 2HD LYS 54 HD1 LYS 54 4.182 11.069 1.373 424 1HE LYS 54 HE2 LYS 54 3.340 8.899 2.586 425 2HE LYS 54 HE1 LYS 54 5.068 8.598 2.776 426 1HZ LYS 54 HZ1 LYS 54 4.238 9.782 4.676 427 2HZ LYS 54 HZ2 LYS 54 3.594 11.002 3.699 428 3HZ LYS 54 HZ3 LYS 54 5.270 10.801 3.804 429 H THR 55 HN THR 55 6.489 5.352 0.240 430 HA THR 55 HA THR 55 6.473 4.396 -2.439 431 HB THR 55 HB THR 55 8.239 2.897 -1.805 432 HG1 THR 55 HG1 THR 55 8.607 3.185 0.750 433 1HG2 THR 55 HG21 THR 55 9.819 4.448 -1.298 434 2HG2 THR 55 HG22 THR 55 8.891 5.113 0.047 435 3HG2 THR 55 HG23 THR 55 8.476 5.547 -1.612 436 H GLU 56 HN GLU 56 5.336 3.283 0.643 437 HA GLU 56 HA GLU 56 4.345 0.765 -0.336 438 1HB GLU 56 HB2 GLU 56 3.287 1.867 2.195 439 2HB GLU 56 HB1 GLU 56 3.941 0.270 1.850 440 1HG GLU 56 HG2 GLU 56 5.896 2.463 1.807 441 2HG GLU 56 HG1 GLU 56 5.168 2.129 3.376 442 H LEU 57 HN LEU 57 3.356 4.029 -0.060 443 HA LEU 57 HA LEU 57 0.534 3.673 -0.170 444 1HB LEU 57 HB2 LEU 57 2.144 5.797 0.297 445 2HB LEU 57 HB1 LEU 57 1.741 6.092 -1.381 446 HG LEU 57 HG LEU 57 0.246 7.321 0.094 447 1HD1 LEU 57 HD11 LEU 57 -1.313 7.045 -1.446 448 2HD1 LEU 57 HD12 LEU 57 -1.788 5.510 -0.719 449 3HD1 LEU 57 HD13 LEU 57 -0.533 5.549 -1.958 450 1HD2 LEU 57 HD21 LEU 57 0.283 5.978 2.062 451 2HD2 LEU 57 HD22 LEU 57 -0.404 4.600 1.203 452 3HD2 LEU 57 HD23 LEU 57 -1.381 6.041 1.482 453 H GLN 58 HN GLN 58 3.076 4.256 -2.563 454 HA GLN 58 HA GLN 58 1.357 4.292 -4.809 455 1HB GLN 58 HB2 GLN 58 3.558 5.248 -5.033 456 2HB GLN 58 HB1 GLN 58 4.319 3.741 -4.541 457 1HG GLN 58 HG2 GLN 58 4.440 4.233 -6.986 458 2HG GLN 58 HG1 GLN 58 3.728 2.673 -6.577 459 1HE2 GLN 58 HE21 GLN 58 1.776 2.192 -7.348 460 2HE2 GLN 58 HE22 GLN 58 0.722 3.292 -8.165 461 H ALA 59 HN ALA 59 3.484 1.831 -3.390 462 HA ALA 59 HA ALA 59 2.824 -0.312 -5.035 463 1HB ALA 59 HB1 ALA 59 4.439 0.047 -2.836 464 2HB ALA 59 HB2 ALA 59 4.151 -1.487 -3.657 465 3HB ALA 59 HB3 ALA 59 3.200 -1.055 -2.236 466 H ILE 60 HN ILE 60 1.229 1.081 -2.240 467 HA ILE 60 HA ILE 60 -0.666 -0.856 -1.642 468 HB ILE 60 HB ILE 60 -0.520 2.083 -1.300 469 1HG1 ILE 60 HG12 ILE 60 -1.809 0.196 0.621 470 2HG1 ILE 60 HG11 ILE 60 -0.084 0.031 0.321 471 1HG2 ILE 60 HG21 ILE 60 -2.832 2.414 -0.744 472 2HG2 ILE 60 HG22 ILE 60 -3.209 0.732 -1.113 473 3HG2 ILE 60 HG23 ILE 60 -2.725 1.832 -2.404 474 1HD1 ILE 60 HD11 ILE 60 -1.416 2.580 1.194 475 2HD1 ILE 60 HD12 ILE 60 0.315 2.275 1.056 476 3HD1 ILE 60 HD13 ILE 60 -0.634 1.433 2.281 477 H TYR 61 HN TYR 61 -0.853 1.776 -4.003 478 HA TYR 61 HA TYR 61 -3.354 1.343 -5.069 479 1HB TYR 61 HB2 TYR 61 -2.366 3.218 -5.947 480 2HB TYR 61 HB1 TYR 61 -0.791 2.456 -6.076 481 HD1 TYR 61 HD1 TYR 61 -3.830 3.353 -7.825 482 HD2 TYR 61 HD2 TYR 61 -0.341 0.908 -8.007 483 HE1 TYR 61 HE1 TYR 61 -4.187 3.021 -10.233 484 HE2 TYR 61 HE2 TYR 61 -0.689 0.586 -10.417 485 HH TYR 61 HH TYR 61 -2.025 0.959 -12.151 486 H LEU 62 HN LEU 62 -0.349 -0.402 -5.645 487 HA LEU 62 HA LEU 62 -1.315 -1.939 -7.839 488 1HB LEU 62 HB2 LEU 62 0.793 -2.936 -5.957 489 2HB LEU 62 HB1 LEU 62 0.642 -3.205 -7.682 490 HG LEU 62 HG LEU 62 1.295 -0.508 -6.507 491 1HD1 LEU 62 HD11 LEU 62 3.116 -2.735 -7.381 492 2HD1 LEU 62 HD12 LEU 62 3.086 -1.898 -5.830 493 3HD1 LEU 62 HD13 LEU 62 3.633 -1.052 -7.278 494 1HD2 LEU 62 HD21 LEU 62 0.867 -1.589 -9.189 495 2HD2 LEU 62 HD22 LEU 62 2.360 -0.667 -9.016 496 3HD2 LEU 62 HD23 LEU 62 0.813 0.076 -8.615 497 H ALA 63 HN ALA 63 -0.958 -2.699 -4.366 498 HA ALA 63 HA ALA 63 -1.981 -5.280 -4.365 499 1HB ALA 63 HB1 ALA 63 -1.328 -4.876 -2.259 500 2HB ALA 63 HB2 ALA 63 -2.973 -4.285 -2.027 501 3HB ALA 63 HB3 ALA 63 -1.669 -3.150 -2.380 502 H LEU 64 HN LEU 64 -3.513 -2.244 -4.767 503 HA LEU 64 HA LEU 64 -6.203 -3.251 -4.362 504 1HB LEU 64 HB2 LEU 64 -4.960 -0.610 -4.932 505 2HB LEU 64 HB1 LEU 64 -6.643 -0.837 -5.369 506 HG LEU 64 HG LEU 64 -6.180 -1.765 -2.677 507 1HD1 LEU 64 HD11 LEU 64 -4.626 -0.287 -2.042 508 2HD1 LEU 64 HD12 LEU 64 -5.950 0.877 -2.082 509 3HD1 LEU 64 HD13 LEU 64 -4.863 0.729 -3.464 510 1HD2 LEU 64 HD21 LEU 64 -8.151 -0.682 -2.278 511 2HD2 LEU 64 HD22 LEU 64 -8.271 -0.891 -4.025 512 3HD2 LEU 64 HD23 LEU 64 -7.763 0.660 -3.355 513 H GLN 65 HN GLN 65 -4.067 -2.438 -7.013 514 HA GLN 65 HA GLN 65 -5.828 -2.271 -9.125 515 1HB GLN 65 HB2 GLN 65 -2.990 -3.198 -8.912 516 2HB GLN 65 HB1 GLN 65 -3.832 -3.292 -10.453 517 1HG GLN 65 HG2 GLN 65 -3.015 -0.893 -8.881 518 2HG GLN 65 HG1 GLN 65 -2.764 -1.256 -10.586 519 1HE2 GLN 65 HE21 GLN 65 -4.239 -0.594 -12.054 520 2HE2 GLN 65 HE22 GLN 65 -5.668 0.297 -11.665 521 H ASP 66 HN ASP 66 -4.222 -5.255 -7.955 522 HA ASP 66 HA ASP 66 -6.043 -6.798 -9.650 523 1HB ASP 66 HB2 ASP 66 -3.432 -7.398 -8.323 524 2HB ASP 66 HB1 ASP 66 -4.510 -8.725 -8.745 525 H SER 67 HN SER 67 -6.323 -5.528 -6.726 526 HA SER 67 HA SER 67 -6.862 -7.532 -4.900 527 1HB SER 67 HB2 SER 67 -7.838 -5.888 -3.635 528 2HB SER 67 HB1 SER 67 -7.061 -4.856 -4.832 529 HG SER 67 HG SER 67 -9.160 -5.140 -6.012 530 H GLY 68 HN GLY 68 -8.864 -6.333 -7.540 531 1HA GLY 68 HA2 GLY 68 -10.524 -7.528 -8.669 532 2HA GLY 68 HA1 GLY 68 -10.481 -8.742 -7.398 533 H LEU 69 HN LEU 69 -11.298 -7.896 -5.213 534 HA LEU 69 HA LEU 69 -13.468 -5.959 -5.518 535 1HB LEU 69 HB2 LEU 69 -13.941 -8.595 -4.139 536 2HB LEU 69 HB1 LEU 69 -15.124 -7.384 -4.601 537 HG LEU 69 HG LEU 69 -13.577 -8.657 -6.793 538 1HD1 LEU 69 HD11 LEU 69 -14.369 -10.424 -5.044 539 2HD1 LEU 69 HD12 LEU 69 -14.655 -10.686 -6.765 540 3HD1 LEU 69 HD13 LEU 69 -15.960 -10.101 -5.733 541 1HD2 LEU 69 HD21 LEU 69 -16.434 -8.542 -7.071 542 2HD2 LEU 69 HD22 LEU 69 -15.182 -7.732 -8.014 543 3HD2 LEU 69 HD23 LEU 69 -15.803 -6.983 -6.541 544 H GLU 70 HN GLU 70 -13.274 -8.146 -2.836 545 HA GLU 70 HA GLU 70 -12.334 -5.931 -1.152 546 1HB GLU 70 HB2 GLU 70 -13.270 -7.633 0.668 547 2HB GLU 70 HB1 GLU 70 -14.316 -6.497 -0.168 548 1HG GLU 70 HG2 GLU 70 -15.506 -8.127 -1.078 549 2HG GLU 70 HG1 GLU 70 -14.059 -8.957 -1.649 550 H VAL 71 HN VAL 71 -10.355 -6.077 -0.329 551 HA VAL 71 HA VAL 71 -9.210 -8.731 0.167 552 HB VAL 71 HB VAL 71 -7.087 -8.139 -0.833 553 1HG1 VAL 71 HG11 VAL 71 -8.538 -7.404 -3.185 554 2HG1 VAL 71 HG12 VAL 71 -9.484 -8.570 -2.261 555 3HG1 VAL 71 HG13 VAL 71 -7.838 -8.964 -2.757 556 1HG2 VAL 71 HG21 VAL 71 -7.415 -5.657 -0.373 557 2HG2 VAL 71 HG22 VAL 71 -8.311 -5.609 -1.891 558 3HG2 VAL 71 HG23 VAL 71 -6.615 -6.096 -1.882 559 H ASN 72 HN ASN 72 -7.268 -8.664 1.481 560 HA ASN 72 HA ASN 72 -7.441 -6.564 3.509 561 1HB ASN 72 HB2 ASN 72 -6.158 -9.303 3.470 562 2HB ASN 72 HB1 ASN 72 -5.887 -8.149 4.772 563 1HD2 ASN 72 HD21 ASN 72 -8.687 -7.149 4.446 564 2HD2 ASN 72 HD22 ASN 72 -9.669 -8.331 5.235 565 H ILE 73 HN ILE 73 -6.196 -4.845 2.937 566 HA ILE 73 HA ILE 73 -3.687 -5.370 1.550 567 HB ILE 73 HB ILE 73 -5.345 -2.905 1.898 568 1HG1 ILE 73 HG12 ILE 73 -4.337 -4.633 -0.333 569 2HG1 ILE 73 HG11 ILE 73 -5.977 -4.084 -0.009 570 1HG2 ILE 73 HG21 ILE 73 -2.498 -2.952 0.891 571 2HG2 ILE 73 HG22 ILE 73 -3.028 -2.250 2.419 572 3HG2 ILE 73 HG23 ILE 73 -3.581 -1.560 0.893 573 1HD1 ILE 73 HD11 ILE 73 -5.426 -2.851 -1.852 574 2HD1 ILE 73 HD12 ILE 73 -3.738 -2.681 -1.371 575 3HD1 ILE 73 HD13 ILE 73 -4.986 -1.739 -0.556 576 H VAL 74 HN VAL 74 -2.185 -5.922 2.926 577 HA VAL 74 HA VAL 74 -1.762 -4.382 5.382 578 HB VAL 74 HB VAL 74 -1.629 -6.623 5.983 579 1HG1 VAL 74 HG11 VAL 74 -1.616 -8.105 4.326 580 2HG1 VAL 74 HG12 VAL 74 0.144 -7.995 4.381 581 3HG1 VAL 74 HG13 VAL 74 -0.767 -7.005 3.246 582 1HG2 VAL 74 HG21 VAL 74 0.536 -6.965 6.754 583 2HG2 VAL 74 HG22 VAL 74 0.478 -5.220 6.501 584 3HG2 VAL 74 HG23 VAL 74 1.269 -6.259 5.313 585 H THR 75 HN THR 75 -0.645 -2.598 5.022 586 HA THR 75 HA THR 75 1.849 -2.807 3.458 587 HB THR 75 HB THR 75 0.478 -0.179 3.480 588 HG1 THR 75 HG1 THR 75 -1.311 -0.987 2.686 589 1HG2 THR 75 HG21 THR 75 1.697 0.166 1.603 590 2HG2 THR 75 HG22 THR 75 1.430 -1.469 0.999 591 3HG2 THR 75 HG23 THR 75 2.652 -1.176 2.234 592 H ASP 76 HN ASP 76 3.639 -1.910 4.397 593 HA ASP 76 HA ASP 76 3.313 -0.903 7.094 594 1HB ASP 76 HB2 ASP 76 5.866 -1.060 5.473 595 2HB ASP 76 HB1 ASP 76 5.719 -0.956 7.224 596 H SER 77 HN SER 77 2.376 1.091 7.018 597 HA SER 77 HA SER 77 4.032 3.293 6.278 598 1HB SER 77 HB2 SER 77 2.055 4.206 4.764 599 2HB SER 77 HB1 SER 77 3.330 3.194 4.082 600 HG SER 77 HG SER 77 0.782 2.315 4.977 601 H GLN 78 HN GLN 78 3.743 4.428 8.133 602 HA GLN 78 HA GLN 78 1.271 4.388 9.555 603 1HB GLN 78 HB2 GLN 78 3.922 5.601 9.923 604 2HB GLN 78 HB1 GLN 78 2.594 6.554 10.574 605 1HG GLN 78 HG2 GLN 78 2.318 5.175 12.291 606 2HG GLN 78 HG1 GLN 78 2.344 3.747 11.253 607 1HE2 GLN 78 HE21 GLN 78 4.992 4.410 10.191 608 2HE2 GLN 78 HE22 GLN 78 6.115 4.009 11.439 609 H TYR 79 HN TYR 79 2.333 6.039 6.840 610 HA TYR 79 HA TYR 79 0.700 8.398 7.229 611 1HB TYR 79 HB2 TYR 79 2.915 7.926 5.669 612 2HB TYR 79 HB1 TYR 79 1.608 7.856 4.493 613 HD1 TYR 79 HD1 TYR 79 0.876 9.834 3.528 614 HD2 TYR 79 HD2 TYR 79 2.844 9.989 7.297 615 HE1 TYR 79 HE1 TYR 79 0.817 12.292 3.451 616 HE2 TYR 79 HE2 TYR 79 2.790 12.447 7.230 617 HH TYR 79 HH TYR 79 1.891 14.189 4.389 618 H ALA 80 HN ALA 80 0.743 5.534 5.081 619 HA ALA 80 HA ALA 80 -1.695 5.969 3.798 620 1HB ALA 80 HB1 ALA 80 0.141 3.867 3.958 621 2HB ALA 80 HB2 ALA 80 -1.297 3.937 2.939 622 3HB ALA 80 HB3 ALA 80 -1.380 3.182 4.530 623 H LEU 81 HN LEU 81 -0.873 4.802 6.955 624 HA LEU 81 HA LEU 81 -3.367 3.875 7.811 625 1HB LEU 81 HB2 LEU 81 -1.689 3.232 9.227 626 2HB LEU 81 HB1 LEU 81 -0.854 4.767 9.095 627 HG LEU 81 HG LEU 81 -3.012 5.584 10.463 628 1HD1 LEU 81 HD11 LEU 81 -3.194 3.696 12.277 629 2HD1 LEU 81 HD12 LEU 81 -2.787 2.651 10.916 630 3HD1 LEU 81 HD13 LEU 81 -4.220 3.677 10.842 631 1HD2 LEU 81 HD21 LEU 81 -1.386 6.129 11.872 632 2HD2 LEU 81 HD22 LEU 81 -0.294 5.067 10.984 633 3HD2 LEU 81 HD23 LEU 81 -1.202 4.444 12.363 634 H GLY 82 HN GLY 82 -1.865 7.062 7.893 635 1HA GLY 82 HA2 GLY 82 -4.075 8.250 9.311 636 2HA GLY 82 HA1 GLY 82 -2.675 9.089 8.664 637 H ILE 83 HN ILE 83 -2.850 8.484 5.955 638 HA ILE 83 HA ILE 83 -5.129 10.139 5.259 639 HB ILE 83 HB ILE 83 -3.517 9.282 2.997 640 1HG1 ILE 83 HG12 ILE 83 -1.793 9.149 4.822 641 2HG1 ILE 83 HG11 ILE 83 -1.433 10.353 3.586 642 1HG2 ILE 83 HG21 ILE 83 -3.573 12.085 3.929 643 2HG2 ILE 83 HG22 ILE 83 -5.126 11.343 3.551 644 3HG2 ILE 83 HG23 ILE 83 -3.862 11.414 2.323 645 1HD1 ILE 83 HD11 ILE 83 -0.918 11.306 5.693 646 2HD1 ILE 83 HD12 ILE 83 -2.474 10.823 6.369 647 3HD1 ILE 83 HD13 ILE 83 -2.401 12.075 5.129 648 H ILE 84 HN ILE 84 -3.752 7.155 3.800 649 HA ILE 84 HA ILE 84 -5.836 6.539 2.135 650 HB ILE 84 HB ILE 84 -3.640 5.031 3.312 651 1HG1 ILE 84 HG12 ILE 84 -4.666 5.805 0.754 652 2HG1 ILE 84 HG11 ILE 84 -3.087 5.135 1.140 653 1HG2 ILE 84 HG21 ILE 84 -4.561 2.795 2.797 654 2HG2 ILE 84 HG22 ILE 84 -6.150 3.529 2.583 655 3HG2 ILE 84 HG23 ILE 84 -5.361 3.578 4.160 656 1HD1 ILE 84 HD11 ILE 84 -3.997 3.752 -0.517 657 2HD1 ILE 84 HD12 ILE 84 -5.566 3.676 0.290 658 3HD1 ILE 84 HD13 ILE 84 -4.172 2.856 0.993 659 H GLN 85 HN GLN 85 -5.577 5.759 5.587 660 HA GLN 85 HA GLN 85 -7.931 4.199 5.730 661 1HB GLN 85 HB2 GLN 85 -6.332 4.125 7.536 662 2HB GLN 85 HB1 GLN 85 -6.508 5.852 7.824 663 1HG GLN 85 HG2 GLN 85 -8.129 5.465 9.267 664 2HG GLN 85 HG1 GLN 85 -9.074 4.644 8.024 665 1HE2 GLN 85 HE21 GLN 85 -9.490 3.703 10.417 666 2HE2 GLN 85 HE22 GLN 85 -8.668 2.213 10.704 667 H ALA 86 HN ALA 86 -7.276 7.633 6.168 668 HA ALA 86 HA ALA 86 -10.100 8.238 6.510 669 1HB ALA 86 HB1 ALA 86 -9.221 9.817 7.816 670 2HB ALA 86 HB2 ALA 86 -8.714 10.635 6.337 671 3HB ALA 86 HB3 ALA 86 -7.605 9.541 7.164 672 H GLN 87 HN GLN 87 -10.866 7.611 4.475 673 HA GLN 87 HA GLN 87 -10.489 7.728 2.042 674 1HB GLN 87 HB2 GLN 87 -12.395 9.704 1.789 675 2HB GLN 87 HB1 GLN 87 -12.701 7.983 1.962 676 1HG GLN 87 HG2 GLN 87 -14.027 9.378 3.487 677 2HG GLN 87 HG1 GLN 87 -12.999 8.218 4.327 678 1HE2 GLN 87 HE21 GLN 87 -11.670 8.929 5.827 679 2HE2 GLN 87 HE22 GLN 87 -11.260 10.580 6.103 680 HA PRO 88 HA PRO 88 -7.940 11.480 1.697 681 1HB PRO 88 HB2 PRO 88 -5.726 10.410 0.708 682 2HB PRO 88 HB1 PRO 88 -6.128 10.226 2.422 683 1HG PRO 88 HG2 PRO 88 -6.551 8.291 0.168 684 2HG PRO 88 HG1 PRO 88 -5.858 7.996 1.773 685 1HD PRO 88 HD2 PRO 88 -8.483 7.486 1.150 686 2HD PRO 88 HD1 PRO 88 -7.929 7.884 2.785 687 H ASP 89 HN ASP 89 -9.964 10.276 -0.161 688 HA ASP 89 HA ASP 89 -9.198 9.884 -2.748 689 1HB ASP 89 HB2 ASP 89 -11.432 11.670 -2.833 690 2HB ASP 89 HB1 ASP 89 -11.413 9.926 -3.066 691 H GLN 90 HN GLN 90 -8.924 12.756 -0.920 692 HA GLN 90 HA GLN 90 -7.437 14.063 -2.993 693 1HB GLN 90 HB2 GLN 90 -9.078 16.143 -2.633 694 2HB GLN 90 HB1 GLN 90 -9.327 14.958 -3.910 695 1HG GLN 90 HG2 GLN 90 -11.360 15.605 -2.560 696 2HG GLN 90 HG1 GLN 90 -11.044 13.879 -2.729 697 1HE2 GLN 90 HE21 GLN 90 -10.935 12.673 -0.936 698 2HE2 GLN 90 HE22 GLN 90 -10.842 13.296 0.674 699 H SER 91 HN SER 91 -7.098 13.135 -0.247 700 HA SER 91 HA SER 91 -6.570 15.699 1.098 701 1HB SER 91 HB2 SER 91 -7.962 13.420 2.017 702 2HB SER 91 HB1 SER 91 -6.446 13.479 2.915 703 HG SER 91 HG SER 91 -8.107 14.707 3.913 704 H GLU 92 HN GLU 92 -4.624 16.093 2.010 705 HA GLU 92 HA GLU 92 -2.354 16.124 2.017 706 1HB GLU 92 HB2 GLU 92 -3.198 14.486 3.857 707 2HB GLU 92 HB1 GLU 92 -2.444 13.260 2.847 708 1HG GLU 92 HG2 GLU 92 -0.501 13.715 3.788 709 2HG GLU 92 HG1 GLU 92 -0.573 15.340 3.107 710 H SER 93 HN SER 93 -1.449 12.960 1.721 711 HA SER 93 HA SER 93 0.216 13.204 -0.394 712 1HB SER 93 HB2 SER 93 0.625 11.201 0.565 713 2HB SER 93 HB1 SER 93 -1.070 10.942 0.980 714 HG SER 93 HG SER 93 -0.093 10.711 -1.667 715 H GLU 94 HN GLU 94 0.234 12.601 -2.565 716 HA GLU 94 HA GLU 94 -2.230 13.173 -3.972 717 1HB GLU 94 HB2 GLU 94 -0.846 13.258 -5.958 718 2HB GLU 94 HB1 GLU 94 -0.068 14.165 -4.669 719 1HG GLU 94 HG2 GLU 94 1.533 12.471 -4.311 720 2HG GLU 94 HG1 GLU 94 0.643 11.320 -5.306 721 H LEU 95 HN LEU 95 -0.046 10.474 -3.463 722 HA LEU 95 HA LEU 95 -1.049 8.673 -5.355 723 1HB LEU 95 HB2 LEU 95 -0.109 7.817 -2.642 724 2HB LEU 95 HB1 LEU 95 0.105 7.003 -4.189 725 HG LEU 95 HG LEU 95 1.428 9.449 -4.488 726 1HD1 LEU 95 HD11 LEU 95 1.968 10.122 -2.436 727 2HD1 LEU 95 HD12 LEU 95 3.033 8.719 -2.369 728 3HD1 LEU 95 HD13 LEU 95 1.402 8.619 -1.707 729 1HD2 LEU 95 HD21 LEU 95 2.997 7.073 -3.700 730 2HD2 LEU 95 HD22 LEU 95 3.146 8.117 -5.114 731 3HD2 LEU 95 HD23 LEU 95 1.895 6.876 -5.062 732 H VAL 96 HN VAL 96 -1.858 9.067 -1.932 733 HA VAL 96 HA VAL 96 -3.698 7.048 -1.633 734 HB VAL 96 HB VAL 96 -4.783 8.553 0.083 735 1HG1 VAL 96 HG11 VAL 96 -2.803 8.592 1.568 736 2HG1 VAL 96 HG12 VAL 96 -1.800 8.175 0.179 737 3HG1 VAL 96 HG13 VAL 96 -3.034 7.049 0.744 738 1HG2 VAL 96 HG21 VAL 96 -3.235 10.513 -1.359 739 2HG2 VAL 96 HG22 VAL 96 -2.863 10.532 0.365 740 3HG2 VAL 96 HG23 VAL 96 -4.527 10.742 -0.180 741 H ASN 97 HN ASN 97 -4.027 10.096 -3.288 742 HA ASN 97 HA ASN 97 -6.858 10.192 -3.414 743 1HB ASN 97 HB2 ASN 97 -4.722 11.407 -5.181 744 2HB ASN 97 HB1 ASN 97 -6.438 11.722 -5.389 745 1HD2 ASN 97 HD21 ASN 97 -5.230 11.281 -2.192 746 2HD2 ASN 97 HD22 ASN 97 -5.302 12.939 -1.713 747 H GLN 98 HN GLN 98 -4.404 9.176 -5.769 748 HA GLN 98 HA GLN 98 -6.152 8.255 -7.751 749 1HB GLN 98 HB2 GLN 98 -3.497 8.595 -7.614 750 2HB GLN 98 HB1 GLN 98 -3.559 6.854 -7.388 751 1HG GLN 98 HG2 GLN 98 -4.557 8.438 -9.737 752 2HG GLN 98 HG1 GLN 98 -3.234 7.272 -9.692 753 1HE2 GLN 98 HE21 GLN 98 -6.423 7.726 -10.475 754 2HE2 GLN 98 HE22 GLN 98 -6.926 6.074 -10.547 755 H ILE 99 HN ILE 99 -4.937 6.713 -4.855 756 HA ILE 99 HA ILE 99 -5.682 4.062 -5.566 757 HB ILE 99 HB ILE 99 -4.867 5.401 -3.020 758 1HG1 ILE 99 HG12 ILE 99 -3.577 2.924 -3.532 759 2HG1 ILE 99 HG11 ILE 99 -3.665 3.798 -5.057 760 1HG2 ILE 99 HG21 ILE 99 -5.085 3.081 -1.956 761 2HG2 ILE 99 HG22 ILE 99 -6.228 2.738 -3.255 762 3HG2 ILE 99 HG23 ILE 99 -6.550 4.049 -2.121 763 1HD1 ILE 99 HD11 ILE 99 -1.599 4.290 -3.926 764 2HD1 ILE 99 HD12 ILE 99 -2.480 4.807 -2.486 765 3HD1 ILE 99 HD13 ILE 99 -2.612 5.733 -3.981 766 H ILE 100 HN ILE 100 -7.209 6.583 -3.602 767 HA ILE 100 HA ILE 100 -9.394 5.146 -2.684 768 HB ILE 100 HB ILE 100 -9.121 8.061 -3.355 769 1HG1 ILE 100 HG12 ILE 100 -7.811 7.691 -1.491 770 2HG1 ILE 100 HG11 ILE 100 -9.361 8.044 -0.729 771 1HG2 ILE 100 HG21 ILE 100 -11.444 6.609 -2.112 772 2HG2 ILE 100 HG22 ILE 100 -11.439 7.557 -3.598 773 3HG2 ILE 100 HG23 ILE 100 -11.222 8.357 -2.039 774 1HD1 ILE 100 HD11 ILE 100 -8.354 5.262 -1.283 775 2HD1 ILE 100 HD12 ILE 100 -9.756 5.725 -0.321 776 3HD1 ILE 100 HD13 ILE 100 -8.131 6.110 0.246 777 H GLU 101 HN GLU 101 -9.264 7.248 -5.551 778 HA GLU 101 HA GLU 101 -11.804 6.787 -6.522 779 1HB GLU 101 HB2 GLU 101 -9.174 7.403 -7.816 780 2HB GLU 101 HB1 GLU 101 -10.551 7.008 -8.839 781 1HG GLU 101 HG2 GLU 101 -11.388 8.912 -6.900 782 2HG GLU 101 HG1 GLU 101 -9.895 9.483 -7.645 783 H GLN 102 HN GLN 102 -8.891 4.861 -6.794 784 HA GLN 102 HA GLN 102 -10.017 2.871 -8.490 785 1HB GLN 102 HB2 GLN 102 -7.462 3.526 -7.581 786 2HB GLN 102 HB1 GLN 102 -7.791 1.955 -6.863 787 1HG GLN 102 HG2 GLN 102 -6.713 1.533 -8.906 788 2HG GLN 102 HG1 GLN 102 -8.417 1.163 -9.169 789 1HE2 GLN 102 HE21 GLN 102 -9.693 2.661 -10.351 790 2HE2 GLN 102 HE22 GLN 102 -8.960 3.748 -11.475 791 H LEU 103 HN LEU 103 -9.912 3.446 -5.082 792 HA LEU 103 HA LEU 103 -10.549 0.809 -4.224 793 1HB LEU 103 HB2 LEU 103 -9.950 3.273 -3.003 794 2HB LEU 103 HB1 LEU 103 -11.560 2.852 -2.453 795 HG LEU 103 HG LEU 103 -9.538 0.698 -2.311 796 1HD1 LEU 103 HD11 LEU 103 -9.051 1.875 0.059 797 2HD1 LEU 103 HD12 LEU 103 -9.215 3.300 -0.969 798 3HD1 LEU 103 HD13 LEU 103 -8.020 2.064 -1.360 799 1HD2 LEU 103 HD21 LEU 103 -11.873 0.442 -1.551 800 2HD2 LEU 103 HD22 LEU 103 -11.593 1.700 -0.349 801 3HD2 LEU 103 HD23 LEU 103 -10.698 0.184 -0.261 802 H ILE 104 HN ILE 104 -12.460 3.727 -4.866 803 HA ILE 104 HA ILE 104 -14.965 2.795 -4.119 804 HB ILE 104 HB ILE 104 -14.667 4.511 -6.557 805 1HG1 ILE 104 HG12 ILE 104 -14.267 5.462 -3.711 806 2HG1 ILE 104 HG11 ILE 104 -12.983 5.289 -4.903 807 1HG2 ILE 104 HG21 ILE 104 -16.551 5.706 -5.203 808 2HG2 ILE 104 HG22 ILE 104 -16.641 4.166 -4.346 809 3HG2 ILE 104 HG23 ILE 104 -16.902 4.222 -6.090 810 1HD1 ILE 104 HD11 ILE 104 -13.812 7.612 -4.584 811 2HD1 ILE 104 HD12 ILE 104 -15.358 7.096 -5.261 812 3HD1 ILE 104 HD13 ILE 104 -13.896 7.027 -6.246 813 H LYS 105 HN LYS 105 -13.134 2.271 -7.076 814 HA LYS 105 HA LYS 105 -15.293 1.090 -8.512 815 1HB LYS 105 HB2 LYS 105 -13.828 0.849 -10.260 816 2HB LYS 105 HB1 LYS 105 -13.045 2.136 -9.358 817 1HG LYS 105 HG2 LYS 105 -11.199 0.923 -9.329 818 2HG LYS 105 HG1 LYS 105 -12.029 -0.258 -8.315 819 1HD LYS 105 HD2 LYS 105 -12.966 -1.138 -10.583 820 2HD LYS 105 HD1 LYS 105 -11.595 -0.268 -11.274 821 1HE LYS 105 HE2 LYS 105 -10.597 -2.283 -10.933 822 2HE LYS 105 HE1 LYS 105 -10.295 -1.554 -9.356 823 1HZ LYS 105 HZ1 LYS 105 -11.412 -3.943 -9.679 824 2HZ LYS 105 HZ2 LYS 105 -12.806 -2.987 -9.629 825 3HZ LYS 105 HZ3 LYS 105 -11.712 -2.954 -8.340 826 H LYS 106 HN LYS 106 -13.992 -0.114 -5.782 827 HA LYS 106 HA LYS 106 -14.446 -2.859 -6.735 828 1HB LYS 106 HB2 LYS 106 -12.658 -3.564 -5.006 829 2HB LYS 106 HB1 LYS 106 -12.142 -2.958 -6.571 830 1HG LYS 106 HG2 LYS 106 -11.856 -0.711 -5.486 831 2HG LYS 106 HG1 LYS 106 -12.117 -1.516 -3.939 832 1HD LYS 106 HD2 LYS 106 -9.761 -1.369 -4.284 833 2HD LYS 106 HD1 LYS 106 -10.231 -3.054 -4.514 834 1HE LYS 106 HE2 LYS 106 -9.150 -2.960 -6.463 835 2HE LYS 106 HE1 LYS 106 -10.482 -1.958 -7.039 836 1HZ LYS 106 HZ1 LYS 106 -8.704 -0.624 -7.492 837 2HZ LYS 106 HZ2 LYS 106 -7.799 -1.158 -6.167 838 3HZ LYS 106 HZ3 LYS 106 -9.076 -0.074 -5.936 839 H GLU 107 HN GLU 107 -13.705 -3.818 -3.965 840 HA GLU 107 HA GLU 107 -16.317 -3.217 -2.742 841 1HB GLU 107 HB2 GLU 107 -15.704 -5.585 -3.398 842 2HB GLU 107 HB1 GLU 107 -14.492 -5.528 -2.121 843 1HG GLU 107 HG2 GLU 107 -16.202 -6.500 -0.982 844 2HG GLU 107 HG1 GLU 107 -16.567 -4.806 -0.662 845 H LYS 108 HN LYS 108 -12.871 -3.481 -1.974 846 HA LYS 108 HA LYS 108 -12.534 -1.486 -0.217 847 1HB LYS 108 HB2 LYS 108 -12.793 -2.583 2.076 848 2HB LYS 108 HB1 LYS 108 -14.270 -2.066 1.281 849 1HG LYS 108 HG2 LYS 108 -14.861 -4.262 0.715 850 2HG LYS 108 HG1 LYS 108 -13.257 -4.882 1.118 851 1HD LYS 108 HD2 LYS 108 -14.211 -5.446 3.074 852 2HD LYS 108 HD1 LYS 108 -14.002 -3.739 3.472 853 1HE LYS 108 HE2 LYS 108 -16.473 -4.932 2.217 854 2HE LYS 108 HE1 LYS 108 -16.284 -4.576 3.935 855 1HZ LYS 108 HZ1 LYS 108 -17.091 -2.848 1.887 856 2HZ LYS 108 HZ2 LYS 108 -15.611 -2.281 2.481 857 3HZ LYS 108 HZ3 LYS 108 -16.914 -2.506 3.536 858 H VAL 109 HN VAL 109 -10.827 -1.773 1.455 859 HA VAL 109 HA VAL 109 -9.156 -4.132 1.193 860 HB VAL 109 HB VAL 109 -7.083 -2.859 0.793 861 1HG1 VAL 109 HG11 VAL 109 -7.287 -3.188 -1.412 862 2HG1 VAL 109 HG12 VAL 109 -8.595 -2.013 -1.564 863 3HG1 VAL 109 HG13 VAL 109 -8.949 -3.665 -1.059 864 1HG2 VAL 109 HG21 VAL 109 -8.886 -0.517 0.146 865 2HG2 VAL 109 HG22 VAL 109 -7.124 -0.561 0.085 866 3HG2 VAL 109 HG23 VAL 109 -7.954 -0.679 1.636 867 H TYR 110 HN TYR 110 -8.239 -4.632 3.089 868 HA TYR 110 HA TYR 110 -8.709 -2.848 5.335 869 1HB TYR 110 HB2 TYR 110 -9.352 -4.945 5.983 870 2HB TYR 110 HB1 TYR 110 -8.203 -5.743 4.922 871 HD1 TYR 110 HD1 TYR 110 -6.478 -6.892 5.904 872 HD2 TYR 110 HD2 TYR 110 -8.221 -3.642 8.008 873 HE1 TYR 110 HE1 TYR 110 -5.004 -7.354 7.800 874 HE2 TYR 110 HE2 TYR 110 -6.767 -4.082 9.933 875 HH TYR 110 HH TYR 110 -4.304 -6.649 9.813 876 H LEU 111 HN LEU 111 -7.185 -1.302 5.556 877 HA LEU 111 HA LEU 111 -4.402 -1.882 4.948 878 1HB LEU 111 HB2 LEU 111 -5.560 0.247 4.266 879 2HB LEU 111 HB1 LEU 111 -5.580 0.699 5.959 880 HG LEU 111 HG LEU 111 -2.922 0.121 5.548 881 1HD1 LEU 111 HD11 LEU 111 -4.140 0.744 2.982 882 2HD1 LEU 111 HD12 LEU 111 -2.540 0.102 3.354 883 3HD1 LEU 111 HD13 LEU 111 -2.827 1.840 3.411 884 1HD2 LEU 111 HD21 LEU 111 -2.947 2.775 5.175 885 2HD2 LEU 111 HD22 LEU 111 -3.220 2.010 6.741 886 3HD2 LEU 111 HD23 LEU 111 -4.591 2.540 5.767 887 H ALA 112 HN ALA 112 -2.935 -2.453 6.396 888 HA ALA 112 HA ALA 112 -3.281 -1.613 9.187 889 1HB ALA 112 HB1 ALA 112 -4.251 -3.921 8.820 890 2HB ALA 112 HB2 ALA 112 -3.043 -3.769 10.096 891 3HB ALA 112 HB3 ALA 112 -2.597 -4.464 8.537 892 H TRP 113 HN TRP 113 -1.412 -1.421 10.385 893 HA TRP 113 HA TRP 113 1.137 -2.294 9.424 894 1HB TRP 113 HB2 TRP 113 1.063 -0.423 7.980 895 2HB TRP 113 HB1 TRP 113 0.360 0.610 9.220 896 HD1 TRP 113 HD1 TRP 113 2.102 2.421 9.685 897 HE1 TRP 113 HE1 TRP 113 4.621 2.471 10.199 898 HE3 TRP 113 HE3 TRP 113 3.161 -2.549 9.081 899 HZ2 TRP 113 HZ2 TRP 113 6.772 0.653 10.330 900 HZ3 TRP 113 HZ3 TRP 113 5.476 -3.307 9.419 901 HH2 TRP 113 HH2 TRP 113 7.242 -1.739 10.031 902 H VAL 114 HN VAL 114 2.447 -2.617 11.105 903 HA VAL 114 HA VAL 114 1.792 -1.304 13.664 904 HB VAL 114 HB VAL 114 2.967 -4.044 13.156 905 1HG1 VAL 114 HG11 VAL 114 3.990 -2.864 15.109 906 2HG1 VAL 114 HG12 VAL 114 3.137 -4.353 15.518 907 3HG1 VAL 114 HG13 VAL 114 2.383 -2.789 15.833 908 1HG2 VAL 114 HG21 VAL 114 0.790 -4.563 13.027 909 2HG2 VAL 114 HG22 VAL 114 0.283 -3.035 13.746 910 3HG2 VAL 114 HG23 VAL 114 0.801 -4.367 14.780 911 HA PRO 115 HA PRO 115 5.603 0.963 13.667 912 1HB PRO 115 HB2 PRO 115 6.255 0.007 16.316 913 2HB PRO 115 HB1 PRO 115 5.715 1.610 15.823 914 1HG PRO 115 HG2 PRO 115 4.164 -0.619 16.947 915 2HG PRO 115 HG1 PRO 115 3.770 1.106 16.886 916 1HD PRO 115 HD2 PRO 115 2.474 -0.720 15.381 917 2HD PRO 115 HD1 PRO 115 2.781 0.932 14.800 918 H ALA 116 HN ALA 116 7.819 0.657 13.500 919 HA ALA 116 HA ALA 116 9.809 -0.413 13.208 920 1HB ALA 116 HB1 ALA 116 8.461 -2.142 15.107 921 2HB ALA 116 HB2 ALA 116 10.162 -1.686 15.000 922 3HB ALA 116 HB3 ALA 116 9.548 -3.034 14.041 923 H HIS 117 HN HIS 117 10.351 -0.841 11.196 924 HA HIS 117 HA HIS 117 8.819 -1.765 9.156 925 1HB HIS 117 HB2 HIS 117 11.668 -1.444 9.620 926 2HB HIS 117 HB1 HIS 117 11.342 -2.790 8.533 927 HD1 HIS 117 HD1 HIS 117 8.658 -0.761 7.752 928 HD2 HIS 117 HD2 HIS 117 12.743 -0.375 7.059 929 HE1 HIS 117 HE1 HIS 117 8.867 0.844 5.829 930 HE2 HIS 117 HE2 HIS 117 11.344 1.042 5.410 931 H LYS 118 HN LYS 118 8.061 -3.665 8.398 932 HA LYS 118 HA LYS 118 9.025 -6.132 9.684 933 1HB LYS 118 HB2 LYS 118 6.303 -5.034 9.543 934 2HB LYS 118 HB1 LYS 118 6.424 -6.724 9.078 935 1HG LYS 118 HG2 LYS 118 6.758 -7.396 11.179 936 2HG LYS 118 HG1 LYS 118 7.890 -6.087 11.517 937 1HD LYS 118 HD2 LYS 118 5.469 -4.787 11.314 938 2HD LYS 118 HD1 LYS 118 5.043 -6.304 12.109 939 1HE LYS 118 HE2 LYS 118 6.519 -4.003 13.126 940 2HE LYS 118 HE1 LYS 118 5.661 -5.274 13.996 941 1HZ LYS 118 HZ1 LYS 118 8.447 -5.313 12.993 942 2HZ LYS 118 HZ2 LYS 118 7.641 -6.722 13.466 943 3HZ LYS 118 HZ3 LYS 118 7.908 -5.484 14.587 944 H GLY 119 HN GLY 119 8.058 -4.504 6.796 945 1HA GLY 119 HA2 GLY 119 8.899 -5.253 4.678 946 2HA GLY 119 HA1 GLY 119 8.797 -6.906 5.262 947 H ILE 120 HN ILE 120 7.532 -7.755 3.671 948 HA ILE 120 HA ILE 120 4.960 -6.469 3.090 949 HB ILE 120 HB ILE 120 5.657 -8.931 1.631 950 1HG1 ILE 120 HG12 ILE 120 7.067 -6.657 0.470 951 2HG1 ILE 120 HG11 ILE 120 7.732 -7.139 2.027 952 1HG2 ILE 120 HG21 ILE 120 4.048 -8.066 0.373 953 2HG2 ILE 120 HG22 ILE 120 5.161 -6.780 -0.098 954 3HG2 ILE 120 HG23 ILE 120 4.089 -6.556 1.286 955 1HD1 ILE 120 HD11 ILE 120 8.625 -9.004 1.192 956 2HD1 ILE 120 HD12 ILE 120 8.393 -8.228 -0.375 957 3HD1 ILE 120 HD13 ILE 120 7.194 -9.374 0.227 958 H GLY 121 HN GLY 121 3.435 -8.538 2.288 959 1HA GLY 121 HA2 GLY 121 2.559 -9.664 4.768 960 2HA GLY 121 HA1 GLY 121 1.863 -9.954 3.175 961 H GLY 122 HN GLY 122 4.622 -10.710 2.206 962 1HA GLY 122 HA2 GLY 122 4.526 -13.483 3.198 963 2HA GLY 122 HA1 GLY 122 5.111 -12.995 1.614 964 H ASN 123 HN ASN 123 6.101 -10.979 4.183 965 HA ASN 123 HA ASN 123 8.827 -11.988 3.926 966 1HB ASN 123 HB2 ASN 123 8.008 -9.476 3.820 967 2HB ASN 123 HB1 ASN 123 8.143 -9.588 5.572 968 1HD2 ASN 123 HD21 ASN 123 9.676 -7.855 4.061 969 2HD2 ASN 123 HD22 ASN 123 11.329 -8.352 4.140 970 H GLU 124 HN GLU 124 10.153 -12.430 5.748 971 HA GLU 124 HA GLU 124 8.636 -13.503 8.008 972 1HB GLU 124 HB2 GLU 124 11.474 -13.975 7.087 973 2HB GLU 124 HB1 GLU 124 10.786 -14.679 8.545 974 1HG GLU 124 HG2 GLU 124 8.986 -15.270 6.484 975 2HG GLU 124 HG1 GLU 124 10.595 -15.565 5.828 976 H GLN 125 HN GLN 125 11.996 -12.406 8.037 977 HA GLN 125 HA GLN 125 11.311 -10.661 10.305 978 1HB GLN 125 HB2 GLN 125 13.256 -12.668 10.059 979 2HB GLN 125 HB1 GLN 125 14.146 -11.154 10.009 980 1HG GLN 125 HG2 GLN 125 12.329 -10.833 12.086 981 2HG GLN 125 HG1 GLN 125 12.905 -12.492 12.239 982 1HE2 GLN 125 HE21 GLN 125 13.776 -9.133 12.308 983 2HE2 GLN 125 HE22 GLN 125 15.336 -9.340 13.021 984 H VAL 126 HN VAL 126 14.295 -10.598 8.431 985 HA VAL 126 HA VAL 126 14.101 -7.749 8.121 986 HB VAL 126 HB VAL 126 16.235 -7.980 6.843 987 1HG1 VAL 126 HG11 VAL 126 16.343 -7.567 9.202 988 2HG1 VAL 126 HG12 VAL 126 17.578 -8.758 8.789 989 3HG1 VAL 126 HG13 VAL 126 16.078 -9.274 9.559 990 1HG2 VAL 126 HG21 VAL 126 16.396 -10.835 7.673 991 2HG2 VAL 126 HG22 VAL 126 17.221 -9.990 6.363 992 3HG2 VAL 126 HG23 VAL 126 15.522 -10.431 6.196 993 H ASP 127 HN ASP 127 14.833 -6.910 5.816 994 HA ASP 127 HA ASP 127 12.684 -7.635 4.027 995 1HB ASP 127 HB2 ASP 127 14.201 -5.308 4.520 996 2HB ASP 127 HB1 ASP 127 14.568 -5.787 2.866 997 H LYS 128 HN LYS 128 14.025 -7.042 1.562 998 HA LYS 128 HA LYS 128 14.854 -9.608 0.806 999 1HB LYS 128 HB2 LYS 128 14.628 -6.984 -0.446 1000 2HB LYS 128 HB1 LYS 128 15.985 -7.911 -1.072 1001 1HG LYS 128 HG2 LYS 128 14.634 -9.561 -1.940 1002 2HG LYS 128 HG1 LYS 128 13.304 -9.199 -0.837 1003 1HD LYS 128 HD2 LYS 128 12.411 -7.718 -2.252 1004 2HD LYS 128 HD1 LYS 128 13.971 -6.947 -2.551 1005 1HE LYS 128 HE2 LYS 128 14.332 -9.229 -3.912 1006 2HE LYS 128 HE1 LYS 128 12.581 -9.082 -4.053 1007 1HZ LYS 128 HZ1 LYS 128 12.877 -7.588 -5.639 1008 2HZ LYS 128 HZ2 LYS 128 14.556 -7.717 -5.491 1009 3HZ LYS 128 HZ3 LYS 128 13.712 -6.577 -4.569 1010 H LEU 129 HN LEU 129 16.895 -6.684 0.824 1011 HA LEU 129 HA LEU 129 19.133 -6.394 1.112 1012 1HB LEU 129 HB2 LEU 129 18.444 -8.460 3.170 1013 2HB LEU 129 HB1 LEU 129 20.111 -7.958 2.957 1014 HG LEU 129 HG LEU 129 19.112 -5.545 3.235 1015 1HD1 LEU 129 HD11 LEU 129 16.782 -6.921 3.428 1016 2HD1 LEU 129 HD12 LEU 129 17.060 -5.315 4.101 1017 3HD1 LEU 129 HD13 LEU 129 17.221 -6.740 5.126 1018 1HD2 LEU 129 HD21 LEU 129 19.747 -7.575 5.337 1019 2HD2 LEU 129 HD22 LEU 129 19.276 -5.938 5.792 1020 3HD2 LEU 129 HD23 LEU 129 20.700 -6.198 4.785 1021 H VAL 130 HN VAL 130 19.633 -7.090 -1.019 1022 HA VAL 130 HA VAL 130 21.153 -9.602 -1.055 1023 HB VAL 130 HB VAL 130 20.330 -9.642 -3.585 1024 1HG1 VAL 130 HG11 VAL 130 18.842 -10.745 -1.208 1025 2HG1 VAL 130 HG12 VAL 130 20.140 -11.521 -2.116 1026 3HG1 VAL 130 HG13 VAL 130 18.569 -11.258 -2.873 1027 1HG2 VAL 130 HG21 VAL 130 17.919 -8.542 -2.146 1028 2HG2 VAL 130 HG22 VAL 130 18.033 -9.007 -3.844 1029 3HG2 VAL 130 HG23 VAL 130 18.927 -7.606 -3.251 1030 H SER 131 HN SER 131 23.185 -8.992 -1.350 1031 HA SER 131 HA SER 131 25.047 -8.006 -2.192 1032 1HB SER 131 HB2 SER 131 23.200 -7.772 -4.564 1033 2HB SER 131 HB1 SER 131 24.871 -7.213 -4.623 1034 HG SER 131 HG SER 131 24.789 -9.330 -5.347 1035 H ALA 132 HN ALA 132 23.037 -5.839 -4.076 1036 HA ALA 132 HA ALA 132 23.015 -3.729 -2.148 1037 1HB ALA 132 HB1 ALA 132 24.534 -2.635 -4.321 1038 2HB ALA 132 HB2 ALA 132 25.386 -4.012 -3.621 1039 3HB ALA 132 HB3 ALA 132 24.907 -2.659 -2.597 1040 H GLY 133 HN GLY 133 22.739 -1.526 -3.668 1041 1HA GLY 133 HA2 GLY 133 21.599 -1.211 -5.991 1042 2HA GLY 133 HA1 GLY 133 20.340 -2.170 -5.230 1043 H ILE 134 HN ILE 134 22.191 0.065 -3.338 1044 HA ILE 134 HA ILE 134 21.409 1.714 -1.938 1045 HB ILE 134 HB ILE 134 22.305 2.890 -3.898 1046 1HG1 ILE 134 HG12 ILE 134 20.778 5.010 -3.597 1047 2HG1 ILE 134 HG11 ILE 134 20.023 4.037 -2.339 1048 1HG2 ILE 134 HG21 ILE 134 20.965 2.193 -5.696 1049 2HG2 ILE 134 HG22 ILE 134 20.619 3.911 -5.494 1050 3HG2 ILE 134 HG23 ILE 134 19.479 2.704 -4.895 1051 1HD1 ILE 134 HD11 ILE 134 22.097 3.856 -1.158 1052 2HD1 ILE 134 HD12 ILE 134 21.789 5.556 -1.515 1053 3HD1 ILE 134 HD13 ILE 134 22.963 4.652 -2.471 1054 H ARG 135 HN ARG 135 19.597 -0.015 -1.477 1055 HA ARG 135 HA ARG 135 17.050 1.434 -1.694 1056 1HB ARG 135 HB2 ARG 135 15.996 -0.935 -1.751 1057 2HB ARG 135 HB1 ARG 135 16.662 -0.264 -3.233 1058 1HG ARG 135 HG2 ARG 135 18.469 -1.688 -3.228 1059 2HG ARG 135 HG1 ARG 135 18.378 -1.965 -1.489 1060 1HD ARG 135 HD2 ARG 135 16.920 -3.658 -1.713 1061 2HD ARG 135 HD1 ARG 135 16.005 -2.828 -2.971 1062 HE ARG 135 HE ARG 135 18.428 -3.638 -4.082 1063 1HH1 ARG 135 HH11 ARG 135 15.550 -5.074 -2.746 1064 2HH1 ARG 135 HH12 ARG 135 15.655 -6.503 -3.718 1065 1HH2 ARG 135 HH21 ARG 135 18.574 -5.515 -5.371 1066 2HH2 ARG 135 HH22 ARG 135 17.374 -6.754 -5.210 1067 H LYS 136 HN LYS 136 17.510 2.208 0.438 1068 HA LYS 136 HA LYS 136 17.386 0.167 2.553 1069 1HB LYS 136 HB2 LYS 136 17.981 2.187 4.032 1070 2HB LYS 136 HB1 LYS 136 19.237 1.544 2.984 1071 1HG LYS 136 HG2 LYS 136 19.506 3.545 2.070 1072 2HG LYS 136 HG1 LYS 136 17.824 3.535 1.536 1073 1HD LYS 136 HD2 LYS 136 17.501 4.147 4.143 1074 2HD LYS 136 HD1 LYS 136 19.080 4.878 3.839 1075 1HE LYS 136 HE2 LYS 136 17.924 5.863 1.731 1076 2HE LYS 136 HE1 LYS 136 16.429 5.501 2.596 1077 1HZ LYS 136 HZ1 LYS 136 17.279 7.785 2.949 1078 2HZ LYS 136 HZ2 LYS 136 18.638 7.136 3.720 1079 3HZ LYS 136 HZ3 LYS 136 17.100 6.905 4.383 1080 H VAL 137 HN VAL 137 16.526 2.629 4.286 1081 HA VAL 137 HA VAL 137 13.829 1.988 4.485 1082 HB VAL 137 HB VAL 137 15.148 3.267 6.202 1083 1HG1 VAL 137 HG11 VAL 137 14.811 5.442 4.170 1084 2HG1 VAL 137 HG12 VAL 137 16.264 4.947 5.037 1085 3HG1 VAL 137 HG13 VAL 137 14.984 5.814 5.885 1086 1HG2 VAL 137 HG21 VAL 137 13.236 4.756 6.850 1087 2HG2 VAL 137 HG22 VAL 137 12.796 3.082 6.516 1088 3HG2 VAL 137 HG23 VAL 137 12.476 4.335 5.316 1089 H LEU 138 HN LEU 138 11.947 3.056 3.787 1090 HA LEU 138 HA LEU 138 10.708 4.587 2.531 1091 1HB LEU 138 HB2 LEU 138 12.657 6.044 2.115 1092 2HB LEU 138 HB1 LEU 138 13.186 4.960 0.847 1093 HG LEU 138 HG LEU 138 10.503 5.749 0.289 1094 1HD1 LEU 138 HD11 LEU 138 10.594 7.736 1.438 1095 2HD1 LEU 138 HD12 LEU 138 11.207 8.215 -0.143 1096 3HD1 LEU 138 HD13 LEU 138 12.325 7.925 1.187 1097 1HD2 LEU 138 HD21 LEU 138 11.549 5.328 -1.642 1098 2HD2 LEU 138 HD22 LEU 138 13.136 5.704 -0.972 1099 3HD2 LEU 138 HD23 LEU 138 12.089 7.004 -1.541 Start of MODEL 7 1 1H MET 1 HT1 MET 1 -23.974 6.765 -0.130 2 2H MET 1 HT2 MET 1 -23.572 5.337 -0.941 3 3H MET 1 HT3 MET 1 -22.467 6.615 -0.885 4 HA MET 1 HA MET 1 -23.140 6.003 1.743 5 1HB MET 1 HB2 MET 1 -22.428 3.615 0.029 6 2HB MET 1 HB1 MET 1 -22.364 3.624 1.787 7 1HG MET 1 HG2 MET 1 -24.907 4.533 1.226 8 2HG MET 1 HG1 MET 1 -24.626 3.292 0.007 9 1HE MET 1 HE1 MET 1 -26.953 2.887 2.605 10 2HE MET 1 HE2 MET 1 -26.710 1.168 2.298 11 3HE MET 1 HE3 MET 1 -26.691 2.314 0.958 12 H ASN 2 HN ASN 2 -21.297 6.036 3.000 13 HA ASN 2 HA ASN 2 -19.160 6.537 3.574 14 1HB ASN 2 HB2 ASN 2 -18.354 5.195 0.985 15 2HB ASN 2 HB1 ASN 2 -17.351 5.448 2.406 16 1HD2 ASN 2 HD21 ASN 2 -19.296 3.343 0.758 17 2HD2 ASN 2 HD22 ASN 2 -19.576 2.180 2.007 18 H GLU 3 HN GLU 3 -17.032 7.562 2.622 19 HA GLU 3 HA GLU 3 -17.812 10.086 1.557 20 1HB GLU 3 HB2 GLU 3 -15.675 9.181 3.024 21 2HB GLU 3 HB1 GLU 3 -14.950 9.438 1.444 22 1HG GLU 3 HG2 GLU 3 -16.665 11.629 2.337 23 2HG GLU 3 HG1 GLU 3 -15.260 11.340 3.363 24 H LEU 4 HN LEU 4 -15.935 7.348 0.278 25 HA LEU 4 HA LEU 4 -16.830 7.899 -2.392 26 1HB LEU 4 HB2 LEU 4 -14.623 9.285 -1.547 27 2HB LEU 4 HB1 LEU 4 -13.906 7.892 -2.329 28 HG LEU 4 HG LEU 4 -15.091 8.420 -4.409 29 1HD1 LEU 4 HD11 LEU 4 -16.073 10.861 -4.389 30 2HD1 LEU 4 HD12 LEU 4 -16.356 10.490 -2.688 31 3HD1 LEU 4 HD13 LEU 4 -17.065 9.472 -3.942 32 1HD2 LEU 4 HD21 LEU 4 -13.839 10.398 -5.012 33 2HD2 LEU 4 HD22 LEU 4 -12.857 9.366 -3.972 34 3HD2 LEU 4 HD23 LEU 4 -13.619 10.812 -3.312 35 H TYR 5 HN TYR 5 -16.361 5.759 -0.199 36 HA TYR 5 HA TYR 5 -16.355 3.505 -1.740 37 1HB TYR 5 HB2 TYR 5 -14.098 2.554 -1.382 38 2HB TYR 5 HB1 TYR 5 -14.042 3.994 -2.391 39 HD1 TYR 5 HD1 TYR 5 -13.105 6.084 -1.520 40 HD2 TYR 5 HD2 TYR 5 -13.096 2.508 0.771 41 HE1 TYR 5 HE1 TYR 5 -11.440 7.086 0.002 42 HE2 TYR 5 HE2 TYR 5 -11.436 3.490 2.311 43 HH TYR 5 HH TYR 5 -10.758 5.890 3.001 44 H GLN 6 HN GLN 6 -16.401 1.606 -0.430 45 HA GLN 6 HA GLN 6 -17.561 2.006 2.048 46 1HB GLN 6 HB2 GLN 6 -16.331 -0.445 0.835 47 2HB GLN 6 HB1 GLN 6 -17.208 -0.455 2.359 48 1HG GLN 6 HG2 GLN 6 -18.936 -0.969 0.993 49 2HG GLN 6 HG1 GLN 6 -19.019 0.789 0.866 50 1HE2 GLN 6 HE21 GLN 6 -16.330 0.356 -0.704 51 2HE2 GLN 6 HE22 GLN 6 -16.900 0.072 -2.306 52 H LEU 7 HN LEU 7 -16.500 3.070 3.600 53 HA LEU 7 HA LEU 7 -13.758 2.931 4.143 54 1HB LEU 7 HB2 LEU 7 -16.158 3.922 5.574 55 2HB LEU 7 HB1 LEU 7 -14.729 3.624 6.547 56 HG LEU 7 HG LEU 7 -13.775 5.072 4.373 57 1HD1 LEU 7 HD11 LEU 7 -15.415 6.318 3.551 58 2HD1 LEU 7 HD12 LEU 7 -15.656 7.023 5.149 59 3HD1 LEU 7 HD13 LEU 7 -16.567 5.590 4.670 60 1HD2 LEU 7 HD21 LEU 7 -14.410 6.746 6.636 61 2HD2 LEU 7 HD22 LEU 7 -12.842 6.190 6.051 62 3HD2 LEU 7 HD23 LEU 7 -13.779 5.182 7.154 63 H GLU 8 HN GLU 8 -12.848 1.012 4.430 64 HA GLU 8 HA GLU 8 -14.039 -0.803 6.396 65 1HB GLU 8 HB2 GLU 8 -13.067 -2.609 5.239 66 2HB GLU 8 HB1 GLU 8 -13.714 -1.538 4.001 67 1HG GLU 8 HG2 GLU 8 -10.817 -1.695 4.813 68 2HG GLU 8 HG1 GLU 8 -11.532 -2.498 3.416 69 H LYS 9 HN LYS 9 -10.731 -0.103 5.293 70 HA LYS 9 HA LYS 9 -8.776 0.174 6.310 71 1HB LYS 9 HB2 LYS 9 -10.554 1.128 8.548 72 2HB LYS 9 HB1 LYS 9 -8.808 1.366 8.467 73 1HG LYS 9 HG2 LYS 9 -9.487 3.340 7.570 74 2HG LYS 9 HG1 LYS 9 -9.423 2.381 6.105 75 1HD LYS 9 HD2 LYS 9 -11.959 1.912 7.006 76 2HD LYS 9 HD1 LYS 9 -11.698 3.602 7.452 77 1HE LYS 9 HE2 LYS 9 -11.514 2.339 4.737 78 2HE LYS 9 HE1 LYS 9 -12.575 3.644 5.258 79 1HZ LYS 9 HZ1 LYS 9 -10.395 4.897 5.671 80 2HZ LYS 9 HZ2 LYS 9 -10.929 4.725 4.077 81 3HZ LYS 9 HZ3 LYS 9 -9.691 3.734 4.665 82 H GLU 10 HN GLU 10 -10.669 -0.812 9.124 83 HA GLU 10 HA GLU 10 -9.203 -3.336 9.122 84 1HB GLU 10 HB2 GLU 10 -9.251 -1.414 11.408 85 2HB GLU 10 HB1 GLU 10 -8.680 -3.080 11.524 86 1HG GLU 10 HG2 GLU 10 -7.215 -2.457 9.507 87 2HG GLU 10 HG1 GLU 10 -7.536 -0.792 10.006 88 HA PRO 11 HA PRO 11 -13.410 -4.309 10.648 89 1HB PRO 11 HB2 PRO 11 -14.733 -4.384 8.298 90 2HB PRO 11 HB1 PRO 11 -14.421 -2.867 9.156 91 1HG PRO 11 HG2 PRO 11 -13.343 -3.730 6.617 92 2HG PRO 11 HG1 PRO 11 -13.077 -2.194 7.458 93 1HD PRO 11 HD2 PRO 11 -11.411 -4.670 7.484 94 2HD PRO 11 HD1 PRO 11 -10.919 -2.963 7.652 95 H ILE 12 HN ILE 12 -12.910 -5.405 7.355 96 HA ILE 12 HA ILE 12 -14.065 -7.819 7.389 97 HB ILE 12 HB ILE 12 -11.883 -8.144 5.658 98 1HG1 ILE 12 HG12 ILE 12 -12.948 -5.318 5.456 99 2HG1 ILE 12 HG11 ILE 12 -11.392 -5.696 6.209 100 1HG2 ILE 12 HG21 ILE 12 -13.888 -8.829 4.821 101 2HG2 ILE 12 HG22 ILE 12 -13.769 -7.258 4.027 102 3HG2 ILE 12 HG23 ILE 12 -14.758 -7.441 5.474 103 1HD1 ILE 12 HD11 ILE 12 -10.991 -6.906 3.902 104 2HD1 ILE 12 HD12 ILE 12 -10.731 -5.172 4.098 105 3HD1 ILE 12 HD13 ILE 12 -12.218 -5.763 3.358 106 H VAL 13 HN VAL 13 -13.449 -9.911 7.485 107 HA VAL 13 HA VAL 13 -10.856 -10.593 8.649 108 HB VAL 13 HB VAL 13 -12.561 -10.284 10.498 109 1HG1 VAL 13 HG11 VAL 13 -13.760 -12.889 10.151 110 2HG1 VAL 13 HG12 VAL 13 -14.169 -11.806 8.821 111 3HG1 VAL 13 HG13 VAL 13 -14.520 -11.333 10.484 112 1HG2 VAL 13 HG21 VAL 13 -11.875 -13.109 10.741 113 2HG2 VAL 13 HG22 VAL 13 -11.375 -11.732 11.722 114 3HG2 VAL 13 HG23 VAL 13 -10.526 -12.100 10.221 115 H GLY 14 HN GLY 14 -12.791 -10.971 6.177 116 1HA GLY 14 HA2 GLY 14 -12.005 -13.771 5.755 117 2HA GLY 14 HA1 GLY 14 -13.684 -13.319 5.506 118 H ALA 15 HN ALA 15 -12.201 -10.630 4.588 119 HA ALA 15 HA ALA 15 -12.597 -11.019 1.819 120 1HB ALA 15 HB1 ALA 15 -10.800 -8.892 2.951 121 2HB ALA 15 HB2 ALA 15 -12.546 -8.834 3.184 122 3HB ALA 15 HB3 ALA 15 -11.874 -8.812 1.556 123 H GLU 16 HN GLU 16 -11.004 -10.983 0.112 124 HA GLU 16 HA GLU 16 -8.941 -12.850 0.373 125 1HB GLU 16 HB2 GLU 16 -10.130 -11.732 -1.740 126 2HB GLU 16 HB1 GLU 16 -8.689 -10.724 -1.703 127 1HG GLU 16 HG2 GLU 16 -7.268 -12.544 -2.069 128 2HG GLU 16 HG1 GLU 16 -8.522 -13.715 -1.663 129 H THR 17 HN THR 17 -6.627 -12.577 0.517 130 HA THR 17 HA THR 17 -5.895 -10.030 1.764 131 HB THR 17 HB THR 17 -4.513 -11.057 3.240 132 HG1 THR 17 HG1 THR 17 -4.131 -13.265 1.471 133 1HG2 THR 17 HG21 THR 17 -5.717 -12.686 4.246 134 2HG2 THR 17 HG22 THR 17 -5.785 -13.683 2.794 135 3HG2 THR 17 HG23 THR 17 -6.895 -12.327 2.983 136 H PHE 18 HN PHE 18 -4.388 -8.813 1.000 137 HA PHE 18 HA PHE 18 -2.640 -9.787 -1.142 138 1HB PHE 18 HB2 PHE 18 -4.301 -7.265 -1.095 139 2HB PHE 18 HB1 PHE 18 -2.945 -7.501 -2.169 140 HD1 PHE 18 HD1 PHE 18 -5.828 -9.589 -1.144 141 HD2 PHE 18 HD2 PHE 18 -3.610 -7.872 -4.337 142 HE1 PHE 18 HE1 PHE 18 -7.303 -10.706 -2.765 143 HE2 PHE 18 HE2 PHE 18 -5.085 -8.973 -5.964 144 HZ PHE 18 HZ PHE 18 -6.940 -10.298 -5.240 145 H TYR 19 HN TYR 19 -0.564 -9.255 -0.857 146 HA TYR 19 HA TYR 19 0.148 -7.607 1.423 147 1HB TYR 19 HB2 TYR 19 1.658 -9.268 1.549 148 2HB TYR 19 HB1 TYR 19 1.439 -9.720 -0.138 149 HD1 TYR 19 HD1 TYR 19 2.598 -8.084 -1.898 150 HD2 TYR 19 HD2 TYR 19 3.646 -8.363 2.226 151 HE1 TYR 19 HE1 TYR 19 4.829 -7.162 -2.396 152 HE2 TYR 19 HE2 TYR 19 5.868 -7.431 1.733 153 HH TYR 19 HH TYR 19 7.299 -7.415 -0.967 154 H VAL 20 HN VAL 20 1.726 -5.915 1.279 155 HA VAL 20 HA VAL 20 2.338 -4.787 -1.295 156 HB VAL 20 HB VAL 20 1.323 -2.521 -0.182 157 1HG1 VAL 20 HG11 VAL 20 -0.023 -4.453 -2.055 158 2HG1 VAL 20 HG12 VAL 20 1.116 -3.178 -2.491 159 3HG1 VAL 20 HG13 VAL 20 -0.472 -2.762 -1.848 160 1HG2 VAL 20 HG21 VAL 20 -0.421 -4.829 0.620 161 2HG2 VAL 20 HG22 VAL 20 -1.084 -3.218 0.344 162 3HG2 VAL 20 HG23 VAL 20 0.132 -3.468 1.596 163 H ASP 21 HN ASP 21 4.348 -4.056 -1.153 164 HA ASP 21 HA ASP 21 5.224 -2.370 0.967 165 1HB ASP 21 HB2 ASP 21 5.397 -4.372 2.256 166 2HB ASP 21 HB1 ASP 21 6.163 -5.238 0.927 167 H GLY 22 HN GLY 22 6.785 -1.090 0.242 168 1HA GLY 22 HA2 GLY 22 8.629 -2.054 -1.816 169 2HA GLY 22 HA1 GLY 22 7.679 -0.613 -2.152 170 H ALA 23 HN ALA 23 10.615 -1.000 -1.867 171 HA ALA 23 HA ALA 23 11.092 0.862 0.380 172 1HB ALA 23 HB1 ALA 23 13.354 -0.632 -0.821 173 2HB ALA 23 HB2 ALA 23 12.215 -1.545 0.169 174 3HB ALA 23 HB3 ALA 23 13.068 -0.161 0.854 175 H ALA 24 HN ALA 24 11.302 2.834 -0.270 176 HA ALA 24 HA ALA 24 12.977 3.430 -2.586 177 1HB ALA 24 HB1 ALA 24 10.127 3.842 -2.395 178 2HB ALA 24 HB2 ALA 24 11.203 4.065 -3.774 179 3HB ALA 24 HB3 ALA 24 10.975 5.374 -2.613 180 H ASN 25 HN ASN 25 14.439 4.926 -2.116 181 HA ASN 25 HA ASN 25 14.880 5.936 0.390 182 1HB ASN 25 HB2 ASN 25 16.103 6.145 -2.113 183 2HB ASN 25 HB1 ASN 25 15.766 7.810 -1.652 184 1HD2 ASN 25 HD21 ASN 25 16.375 8.358 0.632 185 2HD2 ASN 25 HD22 ASN 25 17.894 7.755 1.195 186 H ARG 26 HN ARG 26 13.609 7.189 1.580 187 HA ARG 26 HA ARG 26 11.567 8.856 0.500 188 1HB ARG 26 HB2 ARG 26 11.416 7.757 2.708 189 2HB ARG 26 HB1 ARG 26 12.712 8.801 3.289 190 1HG ARG 26 HG2 ARG 26 11.341 10.759 2.908 191 2HG ARG 26 HG1 ARG 26 10.048 9.743 2.261 192 1HD ARG 26 HD2 ARG 26 9.554 8.841 4.344 193 2HD ARG 26 HD1 ARG 26 11.135 9.252 5.006 194 HE ARG 26 HE ARG 26 9.659 11.583 4.321 195 1HH1 ARG 26 HH11 ARG 26 9.943 9.083 6.733 196 2HH1 ARG 26 HH12 ARG 26 9.296 10.062 8.007 197 1HH2 ARG 26 HH21 ARG 26 8.806 12.875 5.991 198 2HH2 ARG 26 HH22 ARG 26 8.648 12.217 7.586 199 H GLU 27 HN GLU 27 14.676 9.486 2.047 200 HA GLU 27 HA GLU 27 14.661 12.214 2.279 201 1HB GLU 27 HB2 GLU 27 16.461 10.878 3.140 202 2HB GLU 27 HB1 GLU 27 16.897 10.340 1.531 203 1HG GLU 27 HG2 GLU 27 18.107 12.179 1.106 204 2HG GLU 27 HG1 GLU 27 16.955 13.246 1.907 205 H THR 28 HN THR 28 14.692 10.337 -0.578 206 HA THR 28 HA THR 28 15.036 12.773 -2.186 207 HB THR 28 HB THR 28 15.999 10.068 -3.088 208 HG1 THR 28 HG1 THR 28 17.543 10.311 -1.665 209 1HG2 THR 28 HG21 THR 28 17.523 11.667 -4.436 210 2HG2 THR 28 HG22 THR 28 16.331 12.897 -4.016 211 3HG2 THR 28 HG23 THR 28 15.843 11.475 -4.936 212 H LYS 29 HN LYS 29 12.981 10.417 -1.254 213 HA LYS 29 HA LYS 29 11.093 9.441 -2.067 214 1HB LYS 29 HB2 LYS 29 10.851 11.794 -3.923 215 2HB LYS 29 HB1 LYS 29 9.574 10.897 -3.114 216 1HG LYS 29 HG2 LYS 29 9.548 12.484 -1.570 217 2HG LYS 29 HG1 LYS 29 11.143 11.930 -1.055 218 1HD LYS 29 HD2 LYS 29 12.228 13.506 -2.490 219 2HD LYS 29 HD1 LYS 29 10.700 13.940 -3.258 220 1HE LYS 29 HE2 LYS 29 10.978 14.282 -0.311 221 2HE LYS 29 HE1 LYS 29 11.761 15.447 -1.378 222 1HZ LYS 29 HZ1 LYS 29 9.510 15.643 -2.490 223 2HZ LYS 29 HZ2 LYS 29 9.653 16.323 -0.948 224 3HZ LYS 29 HZ3 LYS 29 8.878 14.832 -1.146 225 H LEU 30 HN LEU 30 12.318 7.741 -3.066 226 HA LEU 30 HA LEU 30 11.572 7.174 -5.699 227 1HB LEU 30 HB2 LEU 30 13.051 8.772 -6.568 228 2HB LEU 30 HB1 LEU 30 14.294 8.395 -5.391 229 HG LEU 30 HG LEU 30 13.534 6.277 -7.346 230 1HD1 LEU 30 HD11 LEU 30 15.666 8.081 -8.246 231 2HD1 LEU 30 HD12 LEU 30 14.036 8.749 -8.337 232 3HD1 LEU 30 HD13 LEU 30 14.418 7.242 -9.168 233 1HD2 LEU 30 HD21 LEU 30 15.128 5.727 -5.629 234 2HD2 LEU 30 HD22 LEU 30 16.099 7.149 -6.020 235 3HD2 LEU 30 HD23 LEU 30 15.971 5.824 -7.178 236 H GLY 31 HN GLY 31 12.019 5.065 -6.270 237 1HA GLY 31 HA2 GLY 31 14.039 3.414 -5.578 238 2HA GLY 31 HA1 GLY 31 13.042 3.404 -4.134 239 H LYS 32 HN LYS 32 12.308 1.354 -4.197 240 HA LYS 32 HA LYS 32 10.795 0.522 -6.581 241 1HB LYS 32 HB2 LYS 32 11.461 -1.629 -4.748 242 2HB LYS 32 HB1 LYS 32 11.742 -1.506 -6.480 243 1HG LYS 32 HG2 LYS 32 13.498 -0.246 -4.382 244 2HG LYS 32 HG1 LYS 32 13.805 -1.811 -5.134 245 1HD LYS 32 HD2 LYS 32 13.375 0.543 -6.903 246 2HD LYS 32 HD1 LYS 32 14.910 0.417 -6.041 247 1HE LYS 32 HE2 LYS 32 14.582 -0.640 -8.437 248 2HE LYS 32 HE1 LYS 32 15.571 -1.430 -7.211 249 1HZ LYS 32 HZ1 LYS 32 12.706 -2.063 -7.632 250 2HZ LYS 32 HZ2 LYS 32 13.832 -2.931 -6.717 251 3HZ LYS 32 HZ3 LYS 32 13.958 -2.898 -8.403 252 H ALA 33 HN ALA 33 8.935 -0.813 -6.240 253 HA ALA 33 HA ALA 33 7.777 -1.149 -3.659 254 1HB ALA 33 HB1 ALA 33 5.731 0.263 -4.204 255 2HB ALA 33 HB2 ALA 33 6.735 1.050 -5.423 256 3HB ALA 33 HB3 ALA 33 7.189 1.127 -3.720 257 H GLY 34 HN GLY 34 6.807 -3.063 -3.839 258 1HA GLY 34 HA2 GLY 34 5.283 -3.607 -6.310 259 2HA GLY 34 HA1 GLY 34 6.407 -4.798 -5.678 260 H TYR 35 HN TYR 35 4.425 -6.107 -5.781 261 HA TYR 35 HA TYR 35 3.306 -6.296 -3.146 262 1HB TYR 35 HB2 TYR 35 1.262 -5.416 -3.418 263 2HB TYR 35 HB1 TYR 35 1.904 -4.644 -4.863 264 HD1 TYR 35 HD1 TYR 35 1.399 -5.553 -7.080 265 HD2 TYR 35 HD2 TYR 35 -0.247 -7.301 -3.571 266 HE1 TYR 35 HE1 TYR 35 -0.235 -6.756 -8.455 267 HE2 TYR 35 HE2 TYR 35 -1.888 -8.517 -4.940 268 HH TYR 35 HH TYR 35 -1.617 -8.962 -8.168 269 H VAL 36 HN VAL 36 1.852 -8.135 -2.911 270 HA VAL 36 HA VAL 36 2.005 -10.090 -5.057 271 HB VAL 36 HB VAL 36 2.938 -11.830 -3.820 272 1HG1 VAL 36 HG11 VAL 36 4.400 -9.606 -4.257 273 2HG1 VAL 36 HG12 VAL 36 5.061 -11.131 -3.669 274 3HG1 VAL 36 HG13 VAL 36 4.666 -9.843 -2.531 275 1HG2 VAL 36 HG21 VAL 36 3.046 -10.326 -1.245 276 2HG2 VAL 36 HG22 VAL 36 3.072 -12.065 -1.530 277 3HG2 VAL 36 HG23 VAL 36 1.568 -11.164 -1.715 278 H THR 37 HN THR 37 0.102 -11.043 -5.371 279 HA THR 37 HA THR 37 -1.940 -10.667 -3.287 280 HB THR 37 HB THR 37 -2.655 -9.927 -5.493 281 HG1 THR 37 HG1 THR 37 -4.018 -12.365 -5.076 282 1HG2 THR 37 HG21 THR 37 -1.770 -11.040 -7.232 283 2HG2 THR 37 HG22 THR 37 -3.114 -12.155 -6.997 284 3HG2 THR 37 HG23 THR 37 -1.539 -12.514 -6.293 285 H ASN 38 HN ASN 38 -3.473 -12.371 -2.846 286 HA ASN 38 HA ASN 38 -2.196 -14.779 -2.122 287 1HB ASN 38 HB2 ASN 38 -4.271 -15.473 -1.278 288 2HB ASN 38 HB1 ASN 38 -4.332 -13.718 -1.160 289 1HD2 ASN 38 HD21 ASN 38 -4.852 -13.099 -3.821 290 2HD2 ASN 38 HD22 ASN 38 -6.441 -13.650 -4.217 291 H ARG 39 HN ARG 39 -2.831 -13.833 -5.177 292 HA ARG 39 HA ARG 39 -3.682 -16.457 -6.165 293 1HB ARG 39 HB2 ARG 39 -3.094 -14.075 -7.901 294 2HB ARG 39 HB1 ARG 39 -4.197 -15.414 -8.200 295 1HG ARG 39 HG2 ARG 39 -5.820 -14.552 -6.743 296 2HG ARG 39 HG1 ARG 39 -4.677 -13.432 -6.000 297 1HD ARG 39 HD2 ARG 39 -4.808 -11.939 -7.722 298 2HD ARG 39 HD1 ARG 39 -5.163 -13.185 -8.917 299 HE ARG 39 HE ARG 39 -7.119 -12.075 -7.012 300 1HH1 ARG 39 HH11 ARG 39 -6.323 -13.611 -10.038 301 2HH1 ARG 39 HH12 ARG 39 -7.950 -13.575 -10.632 302 1HH2 ARG 39 HH21 ARG 39 -9.262 -12.021 -7.786 303 2HH2 ARG 39 HH22 ARG 39 -9.621 -12.670 -9.351 304 H GLY 40 HN GLY 40 -0.940 -14.527 -5.678 305 1HA GLY 40 HA2 GLY 40 1.257 -15.464 -5.808 306 2HA GLY 40 HA1 GLY 40 0.715 -16.446 -7.164 307 H ARG 41 HN ARG 41 0.252 -12.971 -6.586 308 HA ARG 41 HA ARG 41 1.566 -12.504 -9.183 309 1HB ARG 41 HB2 ARG 41 -0.615 -11.593 -9.228 310 2HB ARG 41 HB1 ARG 41 -0.432 -10.884 -7.633 311 1HG ARG 41 HG2 ARG 41 0.300 -8.981 -8.500 312 2HG ARG 41 HG1 ARG 41 1.567 -9.819 -9.394 313 1HD ARG 41 HD2 ARG 41 -1.273 -9.826 -10.362 314 2HD ARG 41 HD1 ARG 41 -0.196 -8.476 -10.714 315 HE ARG 41 HE ARG 41 1.250 -10.069 -11.871 316 1HH1 ARG 41 HH11 ARG 41 -2.028 -11.045 -11.199 317 2HH1 ARG 41 HH12 ARG 41 -2.070 -12.231 -12.460 318 1HH2 ARG 41 HH21 ARG 41 1.203 -11.630 -13.533 319 2HH2 ARG 41 HH22 ARG 41 -0.233 -12.564 -13.786 320 H GLN 42 HN GLN 42 3.131 -10.843 -9.425 321 HA GLN 42 HA GLN 42 4.105 -9.523 -7.022 322 1HB GLN 42 HB2 GLN 42 5.251 -11.884 -7.604 323 2HB GLN 42 HB1 GLN 42 6.223 -10.838 -8.630 324 1HG GLN 42 HG2 GLN 42 7.374 -10.059 -6.903 325 2HG GLN 42 HG1 GLN 42 5.910 -9.740 -5.973 326 1HE2 GLN 42 HE21 GLN 42 4.868 -12.259 -5.726 327 2HE2 GLN 42 HE22 GLN 42 5.928 -13.237 -4.776 328 H LYS 43 HN LYS 43 4.359 -7.456 -7.552 329 HA LYS 43 HA LYS 43 5.397 -6.804 -10.234 330 1HB LYS 43 HB2 LYS 43 3.730 -4.759 -8.902 331 2HB LYS 43 HB1 LYS 43 3.842 -5.186 -10.602 332 1HG LYS 43 HG2 LYS 43 2.439 -6.911 -8.592 333 2HG LYS 43 HG1 LYS 43 1.633 -5.603 -9.465 334 1HD LYS 43 HD2 LYS 43 3.192 -7.630 -11.004 335 2HD LYS 43 HD1 LYS 43 1.595 -8.065 -10.391 336 1HE LYS 43 HE2 LYS 43 0.515 -6.588 -11.760 337 2HE LYS 43 HE1 LYS 43 1.880 -5.473 -11.814 338 1HZ LYS 43 HZ1 LYS 43 2.735 -7.805 -13.027 339 2HZ LYS 43 HZ2 LYS 43 2.378 -6.333 -13.779 340 3HZ LYS 43 HZ3 LYS 43 1.182 -7.521 -13.638 341 H VAL 44 HN VAL 44 6.245 -4.510 -10.289 342 HA VAL 44 HA VAL 44 7.364 -3.516 -7.807 343 HB VAL 44 HB VAL 44 9.085 -4.646 -10.011 344 1HG1 VAL 44 HG11 VAL 44 10.353 -2.801 -9.835 345 2HG1 VAL 44 HG12 VAL 44 10.876 -3.510 -8.307 346 3HG1 VAL 44 HG13 VAL 44 9.592 -2.301 -8.324 347 1HG2 VAL 44 HG21 VAL 44 10.142 -5.138 -7.457 348 2HG2 VAL 44 HG22 VAL 44 9.363 -6.288 -8.543 349 3HG2 VAL 44 HG23 VAL 44 8.406 -5.426 -7.338 350 H VAL 45 HN VAL 45 7.765 -1.322 -7.897 351 HA VAL 45 HA VAL 45 7.722 0.010 -10.504 352 HB VAL 45 HB VAL 45 6.031 1.587 -9.896 353 1HG1 VAL 45 HG11 VAL 45 5.507 -1.053 -10.380 354 2HG1 VAL 45 HG12 VAL 45 4.313 0.245 -10.394 355 3HG1 VAL 45 HG13 VAL 45 4.537 -0.733 -8.943 356 1HG2 VAL 45 HG21 VAL 45 6.693 0.830 -7.244 357 2HG2 VAL 45 HG22 VAL 45 4.968 0.543 -7.478 358 3HG2 VAL 45 HG23 VAL 45 5.646 2.143 -7.783 359 H THR 46 HN THR 46 8.176 2.384 -10.287 360 HA THR 46 HA THR 46 10.209 2.782 -8.202 361 HB THR 46 HB THR 46 11.333 4.315 -9.625 362 HG1 THR 46 HG1 THR 46 9.696 4.120 -11.826 363 1HG2 THR 46 HG21 THR 46 12.121 2.334 -10.415 364 2HG2 THR 46 HG22 THR 46 11.302 2.863 -11.883 365 3HG2 THR 46 HG23 THR 46 10.512 1.722 -10.796 366 H LEU 47 HN LEU 47 10.120 4.508 -6.864 367 HA LEU 47 HA LEU 47 7.611 5.971 -6.805 368 1HB LEU 47 HB2 LEU 47 9.889 5.691 -4.872 369 2HB LEU 47 HB1 LEU 47 8.621 6.879 -4.628 370 HG LEU 47 HG LEU 47 8.053 4.990 -3.311 371 1HD1 LEU 47 HD11 LEU 47 6.064 5.772 -4.169 372 2HD1 LEU 47 HD12 LEU 47 6.013 4.074 -4.640 373 3HD1 LEU 47 HD13 LEU 47 6.466 5.304 -5.821 374 1HD2 LEU 47 HD21 LEU 47 7.811 2.998 -5.420 375 2HD2 LEU 47 HD22 LEU 47 8.538 2.872 -3.818 376 3HD2 LEU 47 HD23 LEU 47 9.471 3.531 -5.160 377 H THR 48 HN THR 48 7.346 8.137 -6.922 378 HA THR 48 HA THR 48 9.668 9.831 -7.483 379 HB THR 48 HB THR 48 7.849 10.901 -9.207 380 HG1 THR 48 HG1 THR 48 7.675 8.285 -10.059 381 1HG2 THR 48 HG21 THR 48 9.768 8.733 -10.036 382 2HG2 THR 48 HG22 THR 48 10.298 10.337 -9.530 383 3HG2 THR 48 HG23 THR 48 9.272 10.156 -10.953 384 H ASP 49 HN ASP 49 9.570 11.295 -5.903 385 HA ASP 49 HA ASP 49 8.817 12.944 -4.533 386 1HB ASP 49 HB2 ASP 49 7.615 13.497 -6.890 387 2HB ASP 49 HB1 ASP 49 6.195 13.245 -5.880 388 H THR 50 HN THR 50 8.128 10.102 -4.144 389 HA THR 50 HA THR 50 5.671 10.363 -2.538 390 HB THR 50 HB THR 50 5.186 8.149 -2.871 391 HG1 THR 50 HG1 THR 50 7.121 7.281 -2.066 392 1HG2 THR 50 HG21 THR 50 6.866 8.773 -5.303 393 2HG2 THR 50 HG22 THR 50 5.185 9.246 -5.064 394 3HG2 THR 50 HG23 THR 50 5.610 7.540 -5.202 395 H THR 51 HN THR 51 5.728 10.025 -0.372 396 HA THR 51 HA THR 51 8.220 10.094 0.994 397 HB THR 51 HB THR 51 5.864 9.204 2.542 398 HG1 THR 51 HG1 THR 51 5.869 11.578 0.988 399 1HG2 THR 51 HG21 THR 51 7.796 9.955 3.724 400 2HG2 THR 51 HG22 THR 51 6.560 11.198 3.909 401 3HG2 THR 51 HG23 THR 51 7.882 11.434 2.766 402 H ASN 52 HN ASN 52 8.864 8.456 2.677 403 HA ASN 52 HA ASN 52 9.355 5.979 1.574 404 1HB ASN 52 HB2 ASN 52 10.189 5.293 3.665 405 2HB ASN 52 HB1 ASN 52 10.402 7.040 3.665 406 1HD2 ASN 52 HD21 ASN 52 8.290 8.177 4.502 407 2HD2 ASN 52 HD22 ASN 52 7.705 7.559 6.006 408 H GLN 53 HN GLN 53 6.805 6.799 3.912 409 HA GLN 53 HA GLN 53 5.622 4.233 3.877 410 1HB GLN 53 HB2 GLN 53 4.779 6.941 4.825 411 2HB GLN 53 HB1 GLN 53 3.581 5.655 4.725 412 1HG GLN 53 HG2 GLN 53 4.351 4.649 6.553 413 2HG GLN 53 HG1 GLN 53 6.030 4.802 6.035 414 1HE2 GLN 53 HE21 GLN 53 3.373 6.830 7.198 415 2HE2 GLN 53 HE22 GLN 53 4.331 7.793 8.255 416 H LYS 54 HN LYS 54 5.360 7.044 1.837 417 HA LYS 54 HA LYS 54 2.950 6.237 0.534 418 1HB LYS 54 HB2 LYS 54 4.840 8.441 0.278 419 2HB LYS 54 HB1 LYS 54 4.309 7.827 -1.287 420 1HG LYS 54 HG2 LYS 54 2.640 9.302 -0.977 421 2HG LYS 54 HG1 LYS 54 1.937 7.972 -0.054 422 1HD LYS 54 HD2 LYS 54 3.588 10.215 1.116 423 2HD LYS 54 HD1 LYS 54 1.818 10.137 1.133 424 1HE LYS 54 HE2 LYS 54 3.729 8.200 2.443 425 2HE LYS 54 HE1 LYS 54 2.716 9.392 3.258 426 1HZ LYS 54 HZ1 LYS 54 1.270 7.721 3.429 427 2HZ LYS 54 HZ2 LYS 54 2.032 6.790 2.241 428 3HZ LYS 54 HZ3 LYS 54 0.932 7.995 1.795 429 H THR 55 HN THR 55 6.322 5.468 0.208 430 HA THR 55 HA THR 55 6.300 4.497 -2.440 431 HB THR 55 HB THR 55 8.328 3.423 -1.987 432 HG1 THR 55 HG1 THR 55 8.713 2.322 -0.185 433 1HG2 THR 55 HG21 THR 55 9.655 4.949 -0.760 434 2HG2 THR 55 HG22 THR 55 8.298 5.421 0.263 435 3HG2 THR 55 HG23 THR 55 8.331 5.900 -1.434 436 H GLU 56 HN GLU 56 5.394 3.227 0.661 437 HA GLU 56 HA GLU 56 4.720 0.596 -0.303 438 1HB GLU 56 HB2 GLU 56 3.465 1.534 2.196 439 2HB GLU 56 HB1 GLU 56 4.393 0.073 1.885 440 1HG GLU 56 HG2 GLU 56 5.978 2.530 1.837 441 2HG GLU 56 HG1 GLU 56 5.228 2.178 3.392 442 H LEU 57 HN LEU 57 3.241 3.695 -0.011 443 HA LEU 57 HA LEU 57 0.508 2.937 -0.151 444 1HB LEU 57 HB2 LEU 57 1.843 5.291 0.225 445 2HB LEU 57 HB1 LEU 57 1.294 5.481 -1.426 446 HG LEU 57 HG LEU 57 -0.530 6.375 -0.474 447 1HD1 LEU 57 HD11 LEU 57 -1.474 3.765 0.558 448 2HD1 LEU 57 HD12 LEU 57 -1.122 3.886 -1.166 449 3HD1 LEU 57 HD13 LEU 57 -2.307 4.965 -0.428 450 1HD2 LEU 57 HD21 LEU 57 0.655 5.233 1.934 451 2HD2 LEU 57 HD22 LEU 57 -1.102 5.369 1.988 452 3HD2 LEU 57 HD23 LEU 57 -0.118 6.797 1.673 453 H GLN 58 HN GLN 58 2.910 3.913 -2.571 454 HA GLN 58 HA GLN 58 1.264 3.738 -4.818 455 1HB GLN 58 HB2 GLN 58 3.416 4.800 -5.015 456 2HB GLN 58 HB1 GLN 58 4.244 3.339 -4.490 457 1HG GLN 58 HG2 GLN 58 4.378 3.826 -6.938 458 2HG GLN 58 HG1 GLN 58 3.770 2.224 -6.521 459 1HE2 GLN 58 HE21 GLN 58 2.031 1.586 -7.566 460 2HE2 GLN 58 HE22 GLN 58 0.859 2.607 -8.321 461 H ALA 59 HN ALA 59 3.196 1.405 -3.051 462 HA ALA 59 HA ALA 59 2.831 -0.817 -4.734 463 1HB ALA 59 HB1 ALA 59 2.945 -1.535 -1.932 464 2HB ALA 59 HB2 ALA 59 4.150 -0.311 -2.335 465 3HB ALA 59 HB3 ALA 59 4.115 -1.839 -3.216 466 H ILE 60 HN ILE 60 0.975 0.544 -2.071 467 HA ILE 60 HA ILE 60 -0.933 -1.433 -1.686 468 HB ILE 60 HB ILE 60 -1.166 1.567 -1.530 469 1HG1 ILE 60 HG12 ILE 60 -1.138 -0.556 0.620 470 2HG1 ILE 60 HG11 ILE 60 0.271 0.365 0.107 471 1HG2 ILE 60 HG21 ILE 60 -3.271 -0.503 -1.244 472 2HG2 ILE 60 HG22 ILE 60 -3.391 1.165 -1.804 473 3HG2 ILE 60 HG23 ILE 60 -3.264 0.821 -0.079 474 1HD1 ILE 60 HD11 ILE 60 -1.741 1.048 2.011 475 2HD1 ILE 60 HD12 ILE 60 -1.714 2.247 0.719 476 3HD1 ILE 60 HD13 ILE 60 -0.241 1.888 1.620 477 H TYR 61 HN TYR 61 -0.895 1.214 -4.036 478 HA TYR 61 HA TYR 61 -3.328 0.862 -5.283 479 1HB TYR 61 HB2 TYR 61 -2.104 2.709 -6.016 480 2HB TYR 61 HB1 TYR 61 -0.632 1.772 -6.235 481 HD1 TYR 61 HD1 TYR 61 -3.761 2.860 -7.751 482 HD2 TYR 61 HD2 TYR 61 -0.297 0.438 -8.289 483 HE1 TYR 61 HE1 TYR 61 -4.233 2.727 -10.158 484 HE2 TYR 61 HE2 TYR 61 -0.765 0.303 -10.699 485 HH TYR 61 HH TYR 61 -2.550 2.260 -12.343 486 H LEU 62 HN LEU 62 -0.307 -0.896 -5.774 487 HA LEU 62 HA LEU 62 -1.058 -2.439 -7.987 488 1HB LEU 62 HB2 LEU 62 0.695 -3.522 -5.802 489 2HB LEU 62 HB1 LEU 62 0.802 -3.785 -7.538 490 HG LEU 62 HG LEU 62 1.470 -1.211 -6.117 491 1HD1 LEU 62 HD11 LEU 62 3.053 -3.156 -5.833 492 2HD1 LEU 62 HD12 LEU 62 3.740 -1.692 -6.537 493 3HD1 LEU 62 HD13 LEU 62 3.335 -3.060 -7.572 494 1HD2 LEU 62 HD21 LEU 62 2.531 -1.097 -8.647 495 2HD2 LEU 62 HD22 LEU 62 1.068 -0.276 -8.104 496 3HD2 LEU 62 HD23 LEU 62 0.954 -1.839 -8.911 497 H ALA 63 HN ALA 63 -1.133 -3.318 -4.532 498 HA ALA 63 HA ALA 63 -2.315 -5.828 -4.835 499 1HB ALA 63 HB1 ALA 63 -1.700 -5.689 -2.682 500 2HB ALA 63 HB2 ALA 63 -3.302 -4.996 -2.434 501 3HB ALA 63 HB3 ALA 63 -1.905 -3.939 -2.635 502 H LEU 64 HN LEU 64 -3.619 -2.624 -4.802 503 HA LEU 64 HA LEU 64 -6.374 -3.379 -4.556 504 1HB LEU 64 HB2 LEU 64 -4.824 -0.912 -4.904 505 2HB LEU 64 HB1 LEU 64 -6.384 -0.889 -5.705 506 HG LEU 64 HG LEU 64 -6.504 -1.856 -2.937 507 1HD1 LEU 64 HD11 LEU 64 -4.985 0.528 -3.552 508 2HD1 LEU 64 HD12 LEU 64 -5.220 -0.296 -2.011 509 3HD1 LEU 64 HD13 LEU 64 -6.401 0.890 -2.564 510 1HD2 LEU 64 HD21 LEU 64 -8.001 0.525 -3.684 511 2HD2 LEU 64 HD22 LEU 64 -8.578 -1.045 -3.125 512 3HD2 LEU 64 HD23 LEU 64 -8.214 -0.797 -4.833 513 H GLN 65 HN GLN 65 -4.123 -2.930 -7.165 514 HA GLN 65 HA GLN 65 -5.882 -2.582 -9.299 515 1HB GLN 65 HB2 GLN 65 -3.114 -3.684 -9.042 516 2HB GLN 65 HB1 GLN 65 -3.950 -3.793 -10.585 517 1HG GLN 65 HG2 GLN 65 -3.495 -1.234 -9.066 518 2HG GLN 65 HG1 GLN 65 -2.476 -1.819 -10.382 519 1HE2 GLN 65 HE21 GLN 65 -5.425 -0.289 -9.517 520 2HE2 GLN 65 HE22 GLN 65 -5.980 0.046 -11.118 521 H ASP 66 HN ASP 66 -4.616 -5.596 -7.880 522 HA ASP 66 HA ASP 66 -6.548 -7.069 -9.547 523 1HB ASP 66 HB2 ASP 66 -3.991 -7.986 -8.233 524 2HB ASP 66 HB1 ASP 66 -5.129 -9.075 -9.019 525 H SER 67 HN SER 67 -6.766 -5.734 -6.722 526 HA SER 67 HA SER 67 -7.147 -7.746 -4.815 527 1HB SER 67 HB2 SER 67 -8.166 -4.946 -5.125 528 2HB SER 67 HB1 SER 67 -8.921 -5.983 -3.920 529 HG SER 67 HG SER 67 -7.118 -4.771 -3.121 530 H GLY 68 HN GLY 68 -9.822 -6.016 -6.461 531 1HA GLY 68 HA2 GLY 68 -11.406 -7.440 -7.757 532 2HA GLY 68 HA1 GLY 68 -11.315 -8.569 -6.414 533 H LEU 69 HN LEU 69 -12.778 -8.402 -4.833 534 HA LEU 69 HA LEU 69 -14.630 -6.131 -4.908 535 1HB LEU 69 HB2 LEU 69 -15.129 -8.490 -3.168 536 2HB LEU 69 HB1 LEU 69 -16.263 -7.536 -4.116 537 HG LEU 69 HG LEU 69 -14.315 -9.369 -5.476 538 1HD1 LEU 69 HD11 LEU 69 -16.241 -10.230 -3.622 539 2HD1 LEU 69 HD12 LEU 69 -15.322 -11.208 -4.765 540 3HD1 LEU 69 HD13 LEU 69 -16.899 -10.567 -5.224 541 1HD2 LEU 69 HD21 LEU 69 -15.686 -9.165 -7.313 542 2HD2 LEU 69 HD22 LEU 69 -15.844 -7.566 -6.588 543 3HD2 LEU 69 HD23 LEU 69 -17.106 -8.772 -6.344 544 H GLU 70 HN GLU 70 -14.010 -8.248 -2.206 545 HA GLU 70 HA GLU 70 -13.122 -5.935 -0.622 546 1HB GLU 70 HB2 GLU 70 -13.902 -7.664 1.273 547 2HB GLU 70 HB1 GLU 70 -14.998 -6.513 0.520 548 1HG GLU 70 HG2 GLU 70 -15.880 -8.161 -0.930 549 2HG GLU 70 HG1 GLU 70 -14.638 -9.326 -0.461 550 H VAL 71 HN VAL 71 -11.063 -6.005 -0.079 551 HA VAL 71 HA VAL 71 -9.783 -8.618 0.324 552 HB VAL 71 HB VAL 71 -7.726 -7.709 -0.729 553 1HG1 VAL 71 HG11 VAL 71 -10.014 -7.612 -2.680 554 2HG1 VAL 71 HG12 VAL 71 -9.502 -9.114 -1.912 555 3HG1 VAL 71 HG13 VAL 71 -8.378 -8.218 -2.933 556 1HG2 VAL 71 HG21 VAL 71 -7.614 -5.656 -1.710 557 2HG2 VAL 71 HG22 VAL 71 -8.756 -5.297 -0.415 558 3HG2 VAL 71 HG23 VAL 71 -9.343 -5.596 -2.051 559 H ASN 72 HN ASN 72 -7.513 -8.244 1.211 560 HA ASN 72 HA ASN 72 -7.618 -6.246 3.355 561 1HB ASN 72 HB2 ASN 72 -6.971 -9.152 3.363 562 2HB ASN 72 HB1 ASN 72 -5.972 -8.119 4.381 563 1HD2 ASN 72 HD21 ASN 72 -9.332 -7.427 3.697 564 2HD2 ASN 72 HD22 ASN 72 -9.924 -7.716 5.301 565 H ILE 73 HN ILE 73 -6.254 -4.680 2.724 566 HA ILE 73 HA ILE 73 -3.825 -5.383 1.273 567 HB ILE 73 HB ILE 73 -5.314 -2.822 1.698 568 1HG1 ILE 73 HG12 ILE 73 -4.447 -4.576 -0.557 569 2HG1 ILE 73 HG11 ILE 73 -6.024 -3.867 -0.238 570 1HG2 ILE 73 HG21 ILE 73 -3.498 -1.530 0.765 571 2HG2 ILE 73 HG22 ILE 73 -2.489 -2.971 0.647 572 3HG2 ILE 73 HG23 ILE 73 -2.942 -2.340 2.229 573 1HD1 ILE 73 HD11 ILE 73 -3.605 -2.546 -1.418 574 2HD1 ILE 73 HD12 ILE 73 -5.013 -1.646 -0.854 575 3HD1 ILE 73 HD13 ILE 73 -5.180 -2.814 -2.165 576 H VAL 74 HN VAL 74 -2.380 -6.088 2.593 577 HA VAL 74 HA VAL 74 -1.822 -4.820 5.157 578 HB VAL 74 HB VAL 74 -0.005 -6.959 4.327 579 1HG1 VAL 74 HG11 VAL 74 -0.625 -5.838 6.651 580 2HG1 VAL 74 HG12 VAL 74 -0.086 -7.513 6.533 581 3HG1 VAL 74 HG13 VAL 74 -1.805 -7.148 6.678 582 1HG2 VAL 74 HG21 VAL 74 -2.957 -7.540 4.571 583 2HG2 VAL 74 HG22 VAL 74 -1.684 -8.762 4.610 584 3HG2 VAL 74 HG23 VAL 74 -1.940 -7.800 3.153 585 H THR 75 HN THR 75 -0.757 -2.955 4.877 586 HA THR 75 HA THR 75 1.755 -3.073 3.324 587 HB THR 75 HB THR 75 0.503 -0.418 3.594 588 HG1 THR 75 HG1 THR 75 -0.627 -1.594 1.461 589 1HG2 THR 75 HG21 THR 75 1.660 0.014 1.693 590 2HG2 THR 75 HG22 THR 75 1.299 -1.559 0.983 591 3HG2 THR 75 HG23 THR 75 2.573 -1.412 2.193 592 H ASP 76 HN ASP 76 3.512 -1.889 4.129 593 HA ASP 76 HA ASP 76 3.171 -1.158 6.946 594 1HB ASP 76 HB2 ASP 76 5.847 -1.063 5.640 595 2HB ASP 76 HB1 ASP 76 5.411 -1.553 7.275 596 H SER 77 HN SER 77 2.252 0.804 6.883 597 HA SER 77 HA SER 77 3.931 3.005 6.281 598 1HB SER 77 HB2 SER 77 3.325 2.860 4.030 599 2HB SER 77 HB1 SER 77 1.686 2.333 4.407 600 HG SER 77 HG SER 77 1.335 4.386 3.956 601 H GLN 78 HN GLN 78 3.548 3.825 8.313 602 HA GLN 78 HA GLN 78 0.936 3.887 9.437 603 1HB GLN 78 HB2 GLN 78 1.884 5.017 11.278 604 2HB GLN 78 HB1 GLN 78 3.113 3.893 10.718 605 1HG GLN 78 HG2 GLN 78 3.634 6.232 9.323 606 2HG GLN 78 HG1 GLN 78 3.203 6.772 10.944 607 1HE2 GLN 78 HE21 GLN 78 5.396 4.791 9.072 608 2HE2 GLN 78 HE22 GLN 78 6.643 4.702 10.266 609 H TYR 79 HN TYR 79 2.278 5.594 6.957 610 HA TYR 79 HA TYR 79 0.983 8.136 7.462 611 1HB TYR 79 HB2 TYR 79 3.085 7.371 5.818 612 2HB TYR 79 HB1 TYR 79 1.761 7.637 4.689 613 HD1 TYR 79 HD1 TYR 79 0.565 9.875 4.748 614 HD2 TYR 79 HD2 TYR 79 4.251 9.185 6.757 615 HE1 TYR 79 HE1 TYR 79 0.950 12.299 4.862 616 HE2 TYR 79 HE2 TYR 79 4.645 11.609 6.877 617 HH TYR 79 HH TYR 79 3.983 13.630 5.931 618 H ALA 80 HN ALA 80 0.626 5.377 5.245 619 HA ALA 80 HA ALA 80 -1.760 6.159 4.000 620 1HB ALA 80 HB1 ALA 80 -1.496 3.300 4.747 621 2HB ALA 80 HB2 ALA 80 -0.187 3.978 3.778 622 3HB ALA 80 HB3 ALA 80 -1.845 4.028 3.180 623 H LEU 81 HN LEU 81 -0.998 4.552 6.985 624 HA LEU 81 HA LEU 81 -3.483 3.922 8.003 625 1HB LEU 81 HB2 LEU 81 -1.129 3.489 8.929 626 2HB LEU 81 HB1 LEU 81 -1.234 5.094 9.624 627 HG LEU 81 HG LEU 81 -3.370 3.095 10.234 628 1HD1 LEU 81 HD11 LEU 81 -1.613 1.732 10.828 629 2HD1 LEU 81 HD12 LEU 81 -1.842 2.653 12.315 630 3HD1 LEU 81 HD13 LEU 81 -0.546 3.087 11.198 631 1HD2 LEU 81 HD21 LEU 81 -2.284 5.615 11.378 632 2HD2 LEU 81 HD22 LEU 81 -2.962 4.423 12.488 633 3HD2 LEU 81 HD23 LEU 81 -3.957 5.086 11.190 634 H GLY 82 HN GLY 82 -1.755 6.970 7.902 635 1HA GLY 82 HA2 GLY 82 -3.751 8.394 9.432 636 2HA GLY 82 HA1 GLY 82 -2.325 9.081 8.674 637 H ILE 83 HN ILE 83 -2.607 8.631 6.030 638 HA ILE 83 HA ILE 83 -4.889 10.299 5.400 639 HB ILE 83 HB ILE 83 -3.579 9.708 3.010 640 1HG1 ILE 83 HG12 ILE 83 -1.270 10.676 4.074 641 2HG1 ILE 83 HG11 ILE 83 -1.739 9.480 5.275 642 1HG2 ILE 83 HG21 ILE 83 -2.552 12.114 3.918 643 2HG2 ILE 83 HG22 ILE 83 -4.105 11.949 4.739 644 3HG2 ILE 83 HG23 ILE 83 -4.026 11.877 2.978 645 1HD1 ILE 83 HD11 ILE 83 -2.082 8.305 2.738 646 2HD1 ILE 83 HD12 ILE 83 -0.896 7.908 3.981 647 3HD1 ILE 83 HD13 ILE 83 -0.510 9.102 2.744 648 H ILE 84 HN ILE 84 -3.546 7.325 3.916 649 HA ILE 84 HA ILE 84 -5.639 6.728 2.250 650 HB ILE 84 HB ILE 84 -3.322 5.421 2.991 651 1HG1 ILE 84 HG12 ILE 84 -4.480 5.670 0.739 652 2HG1 ILE 84 HG11 ILE 84 -3.673 4.130 1.024 653 1HG2 ILE 84 HG21 ILE 84 -5.506 3.396 3.332 654 2HG2 ILE 84 HG22 ILE 84 -4.809 4.242 4.712 655 3HG2 ILE 84 HG23 ILE 84 -3.784 3.242 3.683 656 1HD1 ILE 84 HD11 ILE 84 -6.308 3.791 1.913 657 2HD1 ILE 84 HD12 ILE 84 -5.559 3.121 0.464 658 3HD1 ILE 84 HD13 ILE 84 -6.412 4.662 0.384 659 H GLN 85 HN GLN 85 -5.668 6.659 5.655 660 HA GLN 85 HA GLN 85 -7.958 4.870 5.838 661 1HB GLN 85 HB2 GLN 85 -6.076 4.977 7.555 662 2HB GLN 85 HB1 GLN 85 -6.744 6.525 8.051 663 1HG GLN 85 HG2 GLN 85 -8.818 5.477 8.685 664 2HG GLN 85 HG1 GLN 85 -8.251 3.924 8.073 665 1HE2 GLN 85 HE21 GLN 85 -6.644 2.805 9.201 666 2HE2 GLN 85 HE22 GLN 85 -6.292 3.150 10.857 667 H ALA 86 HN ALA 86 -7.168 8.258 5.921 668 HA ALA 86 HA ALA 86 -9.899 9.018 6.584 669 1HB ALA 86 HB1 ALA 86 -9.060 11.262 6.816 670 2HB ALA 86 HB2 ALA 86 -7.502 10.776 6.147 671 3HB ALA 86 HB3 ALA 86 -8.023 10.147 7.710 672 H GLN 87 HN GLN 87 -9.898 7.755 4.177 673 HA GLN 87 HA GLN 87 -10.174 8.023 1.882 674 1HB GLN 87 HB2 GLN 87 -11.918 10.255 2.955 675 2HB GLN 87 HB1 GLN 87 -12.118 9.422 1.418 676 1HG GLN 87 HG2 GLN 87 -13.604 8.192 2.540 677 2HG GLN 87 HG1 GLN 87 -12.183 7.336 3.137 678 1HE2 GLN 87 HE21 GLN 87 -11.174 8.442 5.118 679 2HE2 GLN 87 HE22 GLN 87 -12.286 8.922 6.352 680 HA PRO 88 HA PRO 88 -7.427 11.707 1.520 681 1HB PRO 88 HB2 PRO 88 -5.167 10.559 0.738 682 2HB PRO 88 HB1 PRO 88 -5.688 10.458 2.430 683 1HG PRO 88 HG2 PRO 88 -6.018 8.438 0.236 684 2HG PRO 88 HG1 PRO 88 -5.403 8.201 1.883 685 1HD PRO 88 HD2 PRO 88 -7.995 7.692 1.167 686 2HD PRO 88 HD1 PRO 88 -7.517 8.180 2.805 687 H ASP 89 HN ASP 89 -9.350 10.412 -0.378 688 HA ASP 89 HA ASP 89 -8.286 9.957 -2.898 689 1HB ASP 89 HB2 ASP 89 -10.734 11.246 -3.356 690 2HB ASP 89 HB1 ASP 89 -10.448 9.515 -3.246 691 H GLN 90 HN GLN 90 -8.342 12.858 -1.163 692 HA GLN 90 HA GLN 90 -7.155 14.288 -3.338 693 1HB GLN 90 HB2 GLN 90 -9.027 16.159 -2.937 694 2HB GLN 90 HB1 GLN 90 -9.162 14.930 -4.188 695 1HG GLN 90 HG2 GLN 90 -11.217 15.333 -2.787 696 2HG GLN 90 HG1 GLN 90 -10.686 13.660 -2.933 697 1HE2 GLN 90 HE21 GLN 90 -10.447 12.523 -1.127 698 2HE2 GLN 90 HE22 GLN 90 -10.386 13.176 0.472 699 H SER 91 HN SER 91 -7.084 13.544 -0.303 700 HA SER 91 HA SER 91 -6.389 16.243 0.646 701 1HB SER 91 HB2 SER 91 -8.055 14.273 1.805 702 2HB SER 91 HB1 SER 91 -6.603 14.361 2.802 703 HG SER 91 HG SER 91 -8.264 15.870 3.402 704 H GLU 92 HN GLU 92 -4.378 16.657 1.276 705 HA GLU 92 HA GLU 92 -2.162 16.432 1.659 706 1HB GLU 92 HB2 GLU 92 -3.304 14.922 3.495 707 2HB GLU 92 HB1 GLU 92 -2.512 13.630 2.606 708 1HG GLU 92 HG2 GLU 92 -0.867 14.077 4.084 709 2HG GLU 92 HG1 GLU 92 -0.432 15.255 2.847 710 H SER 93 HN SER 93 -1.248 13.357 1.622 711 HA SER 93 HA SER 93 0.342 13.362 -0.548 712 1HB SER 93 HB2 SER 93 0.703 11.542 0.822 713 2HB SER 93 HB1 SER 93 -1.016 11.150 0.943 714 HG SER 93 HG SER 93 -0.866 10.474 -1.288 715 H GLU 94 HN GLU 94 0.276 12.927 -2.691 716 HA GLU 94 HA GLU 94 -2.311 13.038 -3.985 717 1HB GLU 94 HB2 GLU 94 -0.782 14.410 -5.073 718 2HB GLU 94 HB1 GLU 94 0.537 13.265 -4.885 719 1HG GLU 94 HG2 GLU 94 0.114 12.291 -6.839 720 2HG GLU 94 HG1 GLU 94 -1.622 12.234 -6.537 721 H LEU 95 HN LEU 95 0.232 10.716 -3.403 722 HA LEU 95 HA LEU 95 -0.364 8.770 -5.290 723 1HB LEU 95 HB2 LEU 95 1.361 9.005 -3.175 724 2HB LEU 95 HB1 LEU 95 0.265 7.753 -2.617 725 HG LEU 95 HG LEU 95 0.822 6.335 -4.477 726 1HD1 LEU 95 HD11 LEU 95 1.105 7.494 -6.402 727 2HD1 LEU 95 HD12 LEU 95 2.805 7.345 -5.960 728 3HD1 LEU 95 HD13 LEU 95 1.929 8.835 -5.605 729 1HD2 LEU 95 HD21 LEU 95 3.556 7.222 -3.963 730 2HD2 LEU 95 HD22 LEU 95 2.780 5.674 -3.624 731 3HD2 LEU 95 HD23 LEU 95 2.580 7.025 -2.508 732 H VAL 96 HN VAL 96 -1.515 9.020 -1.951 733 HA VAL 96 HA VAL 96 -3.237 6.869 -1.913 734 HB VAL 96 HB VAL 96 -4.588 8.391 -0.280 735 1HG1 VAL 96 HG11 VAL 96 -1.749 7.794 0.472 736 2HG1 VAL 96 HG12 VAL 96 -2.941 6.521 0.213 737 3HG1 VAL 96 HG13 VAL 96 -3.195 7.723 1.479 738 1HG2 VAL 96 HG21 VAL 96 -2.252 10.069 -1.016 739 2HG2 VAL 96 HG22 VAL 96 -2.801 10.076 0.660 740 3HG2 VAL 96 HG23 VAL 96 -3.907 10.541 -0.633 741 H ASN 97 HN ASN 97 -3.619 9.937 -3.497 742 HA ASN 97 HA ASN 97 -6.430 9.965 -3.731 743 1HB ASN 97 HB2 ASN 97 -4.220 11.162 -5.399 744 2HB ASN 97 HB1 ASN 97 -5.902 11.311 -5.884 745 1HD2 ASN 97 HD21 ASN 97 -4.599 11.387 -2.609 746 2HD2 ASN 97 HD22 ASN 97 -5.065 13.014 -2.275 747 H GLN 98 HN GLN 98 -3.862 8.676 -5.773 748 HA GLN 98 HA GLN 98 -5.573 7.605 -7.779 749 1HB GLN 98 HB2 GLN 98 -2.851 7.992 -7.478 750 2HB GLN 98 HB1 GLN 98 -3.009 6.243 -7.440 751 1HG GLN 98 HG2 GLN 98 -3.570 8.152 -9.646 752 2HG GLN 98 HG1 GLN 98 -2.700 6.618 -9.667 753 1HE2 GLN 98 HE21 GLN 98 -4.002 4.661 -9.425 754 2HE2 GLN 98 HE22 GLN 98 -5.597 4.635 -10.090 755 H ILE 99 HN ILE 99 -4.287 6.390 -4.759 756 HA ILE 99 HA ILE 99 -4.935 3.648 -5.228 757 HB ILE 99 HB ILE 99 -4.135 5.218 -2.797 758 1HG1 ILE 99 HG12 ILE 99 -2.550 2.924 -3.204 759 2HG1 ILE 99 HG11 ILE 99 -2.837 3.605 -4.802 760 1HG2 ILE 99 HG21 ILE 99 -5.833 3.052 -2.604 761 2HG2 ILE 99 HG22 ILE 99 -4.785 3.669 -1.329 762 3HG2 ILE 99 HG23 ILE 99 -4.236 2.348 -2.359 763 1HD1 ILE 99 HD11 ILE 99 -2.163 5.663 -2.903 764 2HD1 ILE 99 HD12 ILE 99 -1.397 5.245 -4.437 765 3HD1 ILE 99 HD13 ILE 99 -0.930 4.404 -2.958 766 H ILE 100 HN ILE 100 -6.572 6.370 -3.729 767 HA ILE 100 HA ILE 100 -8.682 4.873 -2.567 768 HB ILE 100 HB ILE 100 -8.441 7.778 -3.309 769 1HG1 ILE 100 HG12 ILE 100 -7.134 7.277 -1.390 770 2HG1 ILE 100 HG11 ILE 100 -8.624 7.984 -0.774 771 1HG2 ILE 100 HG21 ILE 100 -10.595 7.799 -1.746 772 2HG2 ILE 100 HG22 ILE 100 -10.812 6.212 -2.488 773 3HG2 ILE 100 HG23 ILE 100 -10.695 7.649 -3.503 774 1HD1 ILE 100 HD11 ILE 100 -9.120 6.156 0.383 775 2HD1 ILE 100 HD12 ILE 100 -7.468 5.631 0.057 776 3HD1 ILE 100 HD13 ILE 100 -8.786 5.096 -0.985 777 H GLU 101 HN GLU 101 -8.586 6.925 -5.470 778 HA GLU 101 HA GLU 101 -11.100 6.517 -6.443 779 1HB GLU 101 HB2 GLU 101 -8.467 6.854 -7.855 780 2HB GLU 101 HB1 GLU 101 -9.965 6.680 -8.763 781 1HG GLU 101 HG2 GLU 101 -10.314 8.647 -6.717 782 2HG GLU 101 HG1 GLU 101 -8.868 9.017 -7.653 783 H GLN 102 HN GLN 102 -8.293 4.398 -6.801 784 HA GLN 102 HA GLN 102 -9.606 2.489 -8.427 785 1HB GLN 102 HB2 GLN 102 -7.048 2.852 -7.929 786 2HB GLN 102 HB1 GLN 102 -7.352 1.725 -6.614 787 1HG GLN 102 HG2 GLN 102 -6.486 0.669 -8.679 788 2HG GLN 102 HG1 GLN 102 -8.029 0.018 -8.133 789 1HE2 GLN 102 HE21 GLN 102 -7.556 3.065 -9.811 790 2HE2 GLN 102 HE22 GLN 102 -8.397 2.619 -11.253 791 H LEU 103 HN LEU 103 -9.324 2.988 -4.999 792 HA LEU 103 HA LEU 103 -10.378 0.458 -4.209 793 1HB LEU 103 HB2 LEU 103 -9.006 1.801 -2.699 794 2HB LEU 103 HB1 LEU 103 -10.198 3.085 -2.730 795 HG LEU 103 HG LEU 103 -11.756 1.800 -1.468 796 1HD1 LEU 103 HD11 LEU 103 -9.895 -0.552 -1.436 797 2HD1 LEU 103 HD12 LEU 103 -11.138 -0.369 -2.673 798 3HD1 LEU 103 HD13 LEU 103 -11.595 -0.478 -0.974 799 1HD2 LEU 103 HD21 LEU 103 -8.960 1.531 -0.380 800 2HD2 LEU 103 HD22 LEU 103 -10.421 1.249 0.566 801 3HD2 LEU 103 HD23 LEU 103 -10.100 2.848 -0.104 802 H ILE 104 HN ILE 104 -11.719 3.439 -5.305 803 HA ILE 104 HA ILE 104 -14.304 3.250 -4.183 804 HB ILE 104 HB ILE 104 -13.637 4.472 -6.860 805 1HG1 ILE 104 HG12 ILE 104 -13.392 5.684 -4.098 806 2HG1 ILE 104 HG11 ILE 104 -12.070 5.341 -5.209 807 1HG2 ILE 104 HG21 ILE 104 -15.865 4.746 -6.818 808 2HG2 ILE 104 HG22 ILE 104 -15.508 6.057 -5.694 809 3HG2 ILE 104 HG23 ILE 104 -15.969 4.470 -5.078 810 1HD1 ILE 104 HD11 ILE 104 -13.182 7.753 -4.941 811 2HD1 ILE 104 HD12 ILE 104 -14.201 7.104 -6.226 812 3HD1 ILE 104 HD13 ILE 104 -12.454 7.185 -6.443 813 H LYS 105 HN LYS 105 -12.912 2.135 -7.235 814 HA LYS 105 HA LYS 105 -15.329 1.069 -8.264 815 1HB LYS 105 HB2 LYS 105 -14.069 0.283 -10.054 816 2HB LYS 105 HB1 LYS 105 -13.150 1.678 -9.505 817 1HG LYS 105 HG2 LYS 105 -11.367 0.437 -8.989 818 2HG LYS 105 HG1 LYS 105 -12.346 -0.814 -8.219 819 1HD LYS 105 HD2 LYS 105 -13.011 -1.370 -10.698 820 2HD LYS 105 HD1 LYS 105 -11.494 -0.547 -11.065 821 1HE LYS 105 HE2 LYS 105 -10.340 -2.075 -9.492 822 2HE LYS 105 HE1 LYS 105 -11.861 -2.938 -9.263 823 1HZ LYS 105 HZ1 LYS 105 -11.117 -2.616 -12.023 824 2HZ LYS 105 HZ2 LYS 105 -11.627 -3.999 -11.196 825 3HZ LYS 105 HZ3 LYS 105 -10.004 -3.527 -11.133 826 H LYS 106 HN LYS 106 -13.989 0.079 -5.501 827 HA LYS 106 HA LYS 106 -14.927 -2.658 -5.960 828 1HB LYS 106 HB2 LYS 106 -13.030 -3.691 -4.913 829 2HB LYS 106 HB1 LYS 106 -12.462 -2.686 -6.239 830 1HG LYS 106 HG2 LYS 106 -11.651 -1.031 -4.757 831 2HG LYS 106 HG1 LYS 106 -12.476 -1.766 -3.379 832 1HD LYS 106 HD2 LYS 106 -10.172 -2.351 -3.217 833 2HD LYS 106 HD1 LYS 106 -11.042 -3.798 -3.729 834 1HE LYS 106 HE2 LYS 106 -9.871 -1.983 -5.789 835 2HE LYS 106 HE1 LYS 106 -8.813 -3.086 -4.911 836 1HZ LYS 106 HZ1 LYS 106 -9.433 -4.664 -6.310 837 2HZ LYS 106 HZ2 LYS 106 -10.556 -3.644 -7.059 838 3HZ LYS 106 HZ3 LYS 106 -11.014 -4.565 -5.716 839 H GLU 107 HN GLU 107 -15.050 -3.896 -3.844 840 HA GLU 107 HA GLU 107 -16.753 -2.503 -2.095 841 1HB GLU 107 HB2 GLU 107 -16.889 -4.931 -2.422 842 2HB GLU 107 HB1 GLU 107 -15.317 -5.142 -1.662 843 1HG GLU 107 HG2 GLU 107 -16.516 -5.541 0.176 844 2HG GLU 107 HG1 GLU 107 -16.639 -3.786 0.269 845 H LYS 108 HN LYS 108 -13.407 -3.705 -1.468 846 HA LYS 108 HA LYS 108 -12.671 -1.384 -0.060 847 1HB LYS 108 HB2 LYS 108 -12.691 -2.463 2.263 848 2HB LYS 108 HB1 LYS 108 -14.221 -1.877 1.628 849 1HG LYS 108 HG2 LYS 108 -14.933 -4.079 1.088 850 2HG LYS 108 HG1 LYS 108 -13.331 -4.741 1.413 851 1HD LYS 108 HD2 LYS 108 -13.726 -4.892 3.612 852 2HD LYS 108 HD1 LYS 108 -14.456 -3.287 3.675 853 1HE LYS 108 HE2 LYS 108 -16.478 -4.403 2.532 854 2HE LYS 108 HE1 LYS 108 -15.742 -5.921 3.045 855 1HZ LYS 108 HZ1 LYS 108 -17.448 -4.578 4.544 856 2HZ LYS 108 HZ2 LYS 108 -16.017 -3.848 5.074 857 3HZ LYS 108 HZ3 LYS 108 -16.209 -5.524 5.204 858 H VAL 109 HN VAL 109 -10.782 -1.682 1.372 859 HA VAL 109 HA VAL 109 -9.185 -4.080 0.908 860 HB VAL 109 HB VAL 109 -7.143 -2.820 0.407 861 1HG1 VAL 109 HG11 VAL 109 -8.689 -1.701 -1.763 862 2HG1 VAL 109 HG12 VAL 109 -9.279 -3.307 -1.336 863 3HG1 VAL 109 HG13 VAL 109 -7.583 -3.075 -1.761 864 1HG2 VAL 109 HG21 VAL 109 -8.005 -0.339 -0.500 865 2HG2 VAL 109 HG22 VAL 109 -7.084 -0.658 0.970 866 3HG2 VAL 109 HG23 VAL 109 -8.843 -0.543 1.038 867 H TYR 110 HN TYR 110 -8.519 -4.720 2.860 868 HA TYR 110 HA TYR 110 -8.792 -2.984 5.132 869 1HB TYR 110 HB2 TYR 110 -9.435 -5.171 5.566 870 2HB TYR 110 HB1 TYR 110 -8.121 -5.854 4.626 871 HD1 TYR 110 HD1 TYR 110 -6.009 -6.271 5.596 872 HD2 TYR 110 HD2 TYR 110 -9.078 -4.463 7.888 873 HE1 TYR 110 HE1 TYR 110 -4.713 -6.707 7.632 874 HE2 TYR 110 HE2 TYR 110 -7.809 -4.866 9.949 875 HH TYR 110 HH TYR 110 -5.863 -6.773 10.563 876 H LEU 111 HN LEU 111 -7.270 -1.415 5.295 877 HA LEU 111 HA LEU 111 -4.494 -2.098 4.703 878 1HB LEU 111 HB2 LEU 111 -6.052 0.159 4.219 879 2HB LEU 111 HB1 LEU 111 -4.934 0.650 5.479 880 HG LEU 111 HG LEU 111 -3.609 -0.816 3.342 881 1HD1 LEU 111 HD11 LEU 111 -5.472 1.344 2.634 882 2HD1 LEU 111 HD12 LEU 111 -4.796 0.051 1.644 883 3HD1 LEU 111 HD13 LEU 111 -3.844 1.498 1.975 884 1HD2 LEU 111 HD21 LEU 111 -2.339 1.474 3.405 885 2HD2 LEU 111 HD22 LEU 111 -2.178 0.320 4.729 886 3HD2 LEU 111 HD23 LEU 111 -3.257 1.704 4.892 887 H ALA 112 HN ALA 112 -3.011 -2.440 6.208 888 HA ALA 112 HA ALA 112 -3.206 -1.108 8.774 889 1HB ALA 112 HB1 ALA 112 -3.063 -3.337 10.010 890 2HB ALA 112 HB2 ALA 112 -3.679 -4.054 8.522 891 3HB ALA 112 HB3 ALA 112 -4.635 -2.845 9.380 892 H TRP 113 HN TRP 113 -1.387 -1.325 10.126 893 HA TRP 113 HA TRP 113 0.952 -2.717 9.094 894 1HB TRP 113 HB2 TRP 113 1.171 -0.469 8.116 895 2HB TRP 113 HB1 TRP 113 0.987 0.251 9.714 896 HD1 TRP 113 HD1 TRP 113 3.248 -2.652 8.565 897 HE1 TRP 113 HE1 TRP 113 5.663 -2.157 9.275 898 HE3 TRP 113 HE3 TRP 113 2.541 1.960 10.582 899 HZ2 TRP 113 HZ2 TRP 113 7.082 -0.087 10.533 900 HZ3 TRP 113 HZ3 TRP 113 4.480 3.145 11.529 901 HH2 TRP 113 HH2 TRP 113 6.706 2.143 11.501 902 H VAL 114 HN VAL 114 2.631 -2.953 10.661 903 HA VAL 114 HA VAL 114 1.843 -2.431 13.447 904 HB VAL 114 HB VAL 114 1.445 -4.790 13.042 905 1HG1 VAL 114 HG11 VAL 114 2.878 -5.070 11.086 906 2HG1 VAL 114 HG12 VAL 114 3.213 -6.301 12.304 907 3HG1 VAL 114 HG13 VAL 114 4.309 -4.933 12.107 908 1HG2 VAL 114 HG21 VAL 114 2.145 -4.808 15.178 909 2HG2 VAL 114 HG22 VAL 114 3.609 -3.893 14.816 910 3HG2 VAL 114 HG23 VAL 114 3.558 -5.630 14.515 911 HA PRO 115 HA PRO 115 5.665 -0.200 13.835 912 1HB PRO 115 HB2 PRO 115 5.880 -1.859 16.323 913 2HB PRO 115 HB1 PRO 115 6.175 -0.129 16.099 914 1HG PRO 115 HG2 PRO 115 3.890 -1.005 17.169 915 2HG PRO 115 HG1 PRO 115 3.922 0.392 16.079 916 1HD PRO 115 HD2 PRO 115 2.899 -2.342 15.606 917 2HD PRO 115 HD1 PRO 115 2.455 -0.817 14.816 918 H ALA 116 HN ALA 116 7.167 -0.841 12.425 919 HA ALA 116 HA ALA 116 9.342 -2.388 13.022 920 1HB ALA 116 HB1 ALA 116 7.874 -4.144 11.166 921 2HB ALA 116 HB2 ALA 116 7.299 -4.149 12.833 922 3HB ALA 116 HB3 ALA 116 8.979 -4.549 12.479 923 H HIS 117 HN HIS 117 9.435 -3.742 10.315 924 HA HIS 117 HA HIS 117 8.978 -2.113 8.164 925 1HB HIS 117 HB2 HIS 117 10.934 -0.908 9.830 926 2HB HIS 117 HB1 HIS 117 11.769 -1.496 8.395 927 HD1 HIS 117 HD1 HIS 117 8.490 0.364 8.989 928 HD2 HIS 117 HD2 HIS 117 11.846 0.452 6.538 929 HE1 HIS 117 HE1 HIS 117 8.134 2.305 7.432 930 HE2 HIS 117 HE2 HIS 117 10.141 2.293 5.910 931 H LYS 118 HN LYS 118 9.141 -4.833 8.665 932 HA LYS 118 HA LYS 118 11.323 -5.614 6.852 933 1HB LYS 118 HB2 LYS 118 11.715 -7.625 8.101 934 2HB LYS 118 HB1 LYS 118 11.792 -6.266 9.213 935 1HG LYS 118 HG2 LYS 118 9.307 -7.912 8.859 936 2HG LYS 118 HG1 LYS 118 10.573 -8.333 10.012 937 1HD LYS 118 HD2 LYS 118 10.222 -6.370 11.269 938 2HD LYS 118 HD1 LYS 118 9.277 -5.617 9.982 939 1HE LYS 118 HE2 LYS 118 7.823 -6.367 11.777 940 2HE LYS 118 HE1 LYS 118 7.519 -7.294 10.308 941 1HZ LYS 118 HZ1 LYS 118 7.593 -8.706 12.273 942 2HZ LYS 118 HZ2 LYS 118 9.175 -8.205 12.598 943 3HZ LYS 118 HZ3 LYS 118 8.842 -9.096 11.200 944 H GLY 119 HN GLY 119 8.587 -4.998 6.159 945 1HA GLY 119 HA2 GLY 119 7.262 -5.947 4.460 946 2HA GLY 119 HA1 GLY 119 7.934 -7.525 4.848 947 H ILE 120 HN ILE 120 5.537 -8.063 4.598 948 HA ILE 120 HA ILE 120 4.460 -8.431 7.194 949 HB ILE 120 HB ILE 120 3.855 -6.026 6.686 950 1HG1 ILE 120 HG12 ILE 120 1.324 -7.530 7.095 951 2HG1 ILE 120 HG11 ILE 120 2.648 -7.872 8.205 952 1HG2 ILE 120 HG21 ILE 120 3.235 -6.529 4.295 953 2HG2 ILE 120 HG22 ILE 120 2.087 -5.538 5.195 954 3HG2 ILE 120 HG23 ILE 120 1.750 -7.247 4.920 955 1HD1 ILE 120 HD11 ILE 120 1.770 -5.065 7.663 956 2HD1 ILE 120 HD12 ILE 120 2.662 -5.704 9.043 957 3HD1 ILE 120 HD13 ILE 120 0.949 -6.074 8.851 958 H GLY 121 HN GLY 121 3.793 -8.500 3.713 959 1HA GLY 121 HA2 GLY 121 1.952 -10.749 4.191 960 2HA GLY 121 HA1 GLY 121 2.027 -9.797 2.716 961 H GLY 122 HN GLY 122 5.003 -9.947 2.688 962 1HA GLY 122 HA2 GLY 122 5.482 -12.800 2.282 963 2HA GLY 122 HA1 GLY 122 5.575 -11.772 0.860 964 H ASN 123 HN ASN 123 6.795 -11.810 4.213 965 HA ASN 123 HA ASN 123 9.286 -10.608 3.261 966 1HB ASN 123 HB2 ASN 123 9.740 -10.578 5.828 967 2HB ASN 123 HB1 ASN 123 8.595 -9.432 5.141 968 1HD2 ASN 123 HD21 ASN 123 7.369 -9.148 6.933 969 2HD2 ASN 123 HD22 ASN 123 6.396 -10.389 7.639 970 H GLU 124 HN GLU 124 11.179 -11.664 3.195 971 HA GLU 124 HA GLU 124 11.693 -14.037 4.715 972 1HB GLU 124 HB2 GLU 124 12.096 -15.458 2.659 973 2HB GLU 124 HB1 GLU 124 10.412 -15.157 3.063 974 1HG GLU 124 HG2 GLU 124 10.509 -13.253 1.386 975 2HG GLU 124 HG1 GLU 124 12.043 -13.946 0.857 976 H GLN 125 HN GLN 125 12.626 -12.094 1.899 977 HA GLN 125 HA GLN 125 15.187 -11.507 2.952 978 1HB GLN 125 HB2 GLN 125 16.581 -12.707 1.341 979 2HB GLN 125 HB1 GLN 125 15.649 -13.831 2.321 980 1HG GLN 125 HG2 GLN 125 14.036 -13.377 0.124 981 2HG GLN 125 HG1 GLN 125 15.666 -13.435 -0.546 982 1HE2 GLN 125 HE21 GLN 125 13.657 -15.329 -1.067 983 2HE2 GLN 125 HE22 GLN 125 14.167 -16.848 -0.422 984 H VAL 126 HN VAL 126 12.810 -11.410 0.487 985 HA VAL 126 HA VAL 126 14.130 -9.872 -1.460 986 HB VAL 126 HB VAL 126 11.845 -11.067 -1.599 987 1HG1 VAL 126 HG11 VAL 126 9.915 -9.969 -0.978 988 2HG1 VAL 126 HG12 VAL 126 10.701 -8.390 -0.931 989 3HG1 VAL 126 HG13 VAL 126 11.001 -9.563 0.351 990 1HG2 VAL 126 HG21 VAL 126 11.178 -8.771 -3.045 991 2HG2 VAL 126 HG22 VAL 126 12.061 -10.184 -3.627 992 3HG2 VAL 126 HG23 VAL 126 12.940 -8.795 -2.986 993 H ASP 127 HN ASP 127 13.531 -7.591 -2.019 994 HA ASP 127 HA ASP 127 13.631 -5.371 -1.561 995 1HB ASP 127 HB2 ASP 127 11.633 -6.455 0.258 996 2HB ASP 127 HB1 ASP 127 12.405 -5.011 0.907 997 H LYS 128 HN LYS 128 15.863 -5.291 -1.285 998 HA LYS 128 HA LYS 128 17.042 -5.735 1.309 999 1HB LYS 128 HB2 LYS 128 18.261 -4.527 -1.181 1000 2HB LYS 128 HB1 LYS 128 19.138 -5.068 0.244 1001 1HG LYS 128 HG2 LYS 128 17.925 -7.346 -0.307 1002 2HG LYS 128 HG1 LYS 128 17.879 -6.650 -1.927 1003 1HD LYS 128 HD2 LYS 128 20.107 -6.852 -2.214 1004 2HD LYS 128 HD1 LYS 128 20.462 -6.422 -0.540 1005 1HE LYS 128 HE2 LYS 128 20.529 -8.565 0.117 1006 2HE LYS 128 HE1 LYS 128 19.123 -9.004 -0.851 1007 1HZ LYS 128 HZ1 LYS 128 21.843 -9.466 -1.396 1008 2HZ LYS 128 HZ2 LYS 128 21.212 -8.474 -2.611 1009 3HZ LYS 128 HZ3 LYS 128 20.490 -9.967 -2.281 1010 H LEU 129 HN LEU 129 18.460 -4.029 2.283 1011 HA LEU 129 HA LEU 129 17.870 -1.280 1.779 1012 1HB LEU 129 HB2 LEU 129 16.864 -0.872 4.050 1013 2HB LEU 129 HB1 LEU 129 15.824 -1.676 2.891 1014 HG LEU 129 HG LEU 129 17.359 -3.482 4.643 1015 1HD1 LEU 129 HD11 LEU 129 16.933 -2.120 6.432 1016 2HD1 LEU 129 HD12 LEU 129 15.442 -3.059 6.387 1017 3HD1 LEU 129 HD13 LEU 129 15.480 -1.433 5.705 1018 1HD2 LEU 129 HD21 LEU 129 15.601 -4.136 2.969 1019 2HD2 LEU 129 HD22 LEU 129 14.415 -3.363 4.021 1020 3HD2 LEU 129 HD23 LEU 129 15.345 -4.743 4.605 1021 H VAL 130 HN VAL 130 19.683 -3.745 3.085 1022 HA VAL 130 HA VAL 130 21.461 -1.815 4.422 1023 HB VAL 130 HB VAL 130 21.473 -4.648 5.346 1024 1HG1 VAL 130 HG11 VAL 130 21.796 -2.048 6.839 1025 2HG1 VAL 130 HG12 VAL 130 23.123 -2.951 6.108 1026 3HG1 VAL 130 HG13 VAL 130 22.187 -3.668 7.419 1027 1HG2 VAL 130 HG21 VAL 130 19.642 -2.832 6.795 1028 2HG2 VAL 130 HG22 VAL 130 19.565 -4.580 6.570 1029 3HG2 VAL 130 HG23 VAL 130 19.056 -3.500 5.271 1030 H SER 131 HN SER 131 22.222 -1.896 2.066 1031 HA SER 131 HA SER 131 24.535 -3.633 1.980 1032 1HB SER 131 HB2 SER 131 22.549 -4.841 0.858 1033 2HB SER 131 HB1 SER 131 22.727 -3.650 -0.431 1034 HG SER 131 HG SER 131 25.050 -4.922 0.393 1035 H ALA 132 HN ALA 132 22.976 -2.034 -0.757 1036 HA ALA 132 HA ALA 132 24.503 0.366 -0.556 1037 1HB ALA 132 HB1 ALA 132 25.758 -0.137 -2.760 1038 2HB ALA 132 HB2 ALA 132 25.483 -1.828 -2.340 1039 3HB ALA 132 HB3 ALA 132 26.394 -0.785 -1.247 1040 H GLY 133 HN GLY 133 21.809 -0.011 -0.855 1041 1HA GLY 133 HA2 GLY 133 21.366 0.902 -3.631 1042 2HA GLY 133 HA1 GLY 133 20.229 -0.158 -2.811 1043 H ILE 134 HN ILE 134 20.105 2.661 -3.949 1044 HA ILE 134 HA ILE 134 19.527 4.292 -1.632 1045 HB ILE 134 HB ILE 134 18.653 5.906 -3.435 1046 1HG1 ILE 134 HG12 ILE 134 20.249 4.127 -5.275 1047 2HG1 ILE 134 HG11 ILE 134 18.499 3.988 -5.134 1048 1HG2 ILE 134 HG21 ILE 134 21.239 6.064 -4.249 1049 2HG2 ILE 134 HG22 ILE 134 21.397 5.095 -2.784 1050 3HG2 ILE 134 HG23 ILE 134 20.633 6.683 -2.713 1051 1HD1 ILE 134 HD11 ILE 134 19.901 5.644 -6.842 1052 2HD1 ILE 134 HD12 ILE 134 19.321 6.722 -5.573 1053 3HD1 ILE 134 HD13 ILE 134 18.178 5.725 -6.473 1054 H ARG 135 HN ARG 135 17.985 2.258 -1.205 1055 HA ARG 135 HA ARG 135 15.289 3.144 -1.981 1056 1HB ARG 135 HB2 ARG 135 14.559 0.945 -2.358 1057 2HB ARG 135 HB1 ARG 135 16.131 1.015 -3.142 1058 1HG ARG 135 HG2 ARG 135 15.977 0.073 -0.322 1059 2HG ARG 135 HG1 ARG 135 15.462 -1.010 -1.620 1060 1HD ARG 135 HD2 ARG 135 18.066 0.400 -1.905 1061 2HD ARG 135 HD1 ARG 135 17.967 -0.945 -0.769 1062 HE ARG 135 HE ARG 135 17.573 -2.404 -2.561 1063 1HH1 ARG 135 HH11 ARG 135 17.963 0.894 -3.625 1064 2HH1 ARG 135 HH12 ARG 135 18.222 0.462 -5.282 1065 1HH2 ARG 135 HH21 ARG 135 17.915 -2.978 -4.737 1066 2HH2 ARG 135 HH22 ARG 135 18.195 -1.739 -5.915 1067 H LYS 136 HN LYS 136 17.190 3.306 0.476 1068 HA LYS 136 HA LYS 136 15.929 1.821 2.534 1069 1HB LYS 136 HB2 LYS 136 17.245 3.112 4.070 1070 2HB LYS 136 HB1 LYS 136 18.247 2.731 2.675 1071 1HG LYS 136 HG2 LYS 136 17.560 5.042 1.799 1072 2HG LYS 136 HG1 LYS 136 17.030 5.352 3.453 1073 1HD LYS 136 HD2 LYS 136 19.589 4.220 3.657 1074 2HD LYS 136 HD1 LYS 136 19.682 5.403 2.351 1075 1HE LYS 136 HE2 LYS 136 18.188 6.400 4.629 1076 2HE LYS 136 HE1 LYS 136 19.828 5.924 5.069 1077 1HZ LYS 136 HZ1 LYS 136 18.992 7.919 3.048 1078 2HZ LYS 136 HZ2 LYS 136 20.563 7.294 3.103 1079 3HZ LYS 136 HZ3 LYS 136 19.952 8.161 4.421 1080 H VAL 137 HN VAL 137 15.204 3.267 4.545 1081 HA VAL 137 HA VAL 137 13.078 5.028 3.529 1082 HB VAL 137 HB VAL 137 11.822 4.355 5.624 1083 1HG1 VAL 137 HG11 VAL 137 11.349 1.984 4.636 1084 2HG1 VAL 137 HG12 VAL 137 12.409 2.529 3.337 1085 3HG1 VAL 137 HG13 VAL 137 10.938 3.427 3.710 1086 1HG2 VAL 137 HG21 VAL 137 12.516 2.613 6.957 1087 2HG2 VAL 137 HG22 VAL 137 14.059 3.372 6.568 1088 3HG2 VAL 137 HG23 VAL 137 13.548 1.922 5.704 1089 H LEU 138 HN LEU 138 12.150 6.321 5.570 1090 HA LEU 138 HA LEU 138 14.245 7.253 7.342 1091 1HB LEU 138 HB2 LEU 138 13.781 8.585 4.911 1092 2HB LEU 138 HB1 LEU 138 13.023 9.573 6.146 1093 HG LEU 138 HG LEU 138 15.905 8.672 6.191 1094 1HD1 LEU 138 HD11 LEU 138 16.250 10.302 4.720 1095 2HD1 LEU 138 HD12 LEU 138 15.799 11.432 5.997 1096 3HD1 LEU 138 HD13 LEU 138 14.585 10.869 4.848 1097 1HD2 LEU 138 HD21 LEU 138 16.184 9.915 8.127 1098 2HD2 LEU 138 HD22 LEU 138 14.610 9.157 8.379 1099 3HD2 LEU 138 HD23 LEU 138 14.705 10.843 7.866
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