NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
11722 | 1rxl | 5947 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLU 1 H GLU 1 -20.707 -2.176 -4.840 2 HA GLU 1 HA GLU 1 -21.484 0.018 -6.656 3 1HB GLU 1 HB2 GLU 1 -20.176 0.116 -3.936 4 2HB GLU 1 HB1 GLU 1 -20.115 1.446 -5.085 5 1HG GLU 1 HG2 GLU 1 -22.578 1.535 -5.059 6 2HG GLU 1 HG1 GLU 1 -22.582 0.275 -3.827 7 H GLU 2 HN GLU 2 -19.840 0.762 -7.922 8 HA GLU 2 HA GLU 2 -17.449 -0.933 -7.967 9 1HB GLU 2 HB2 GLU 2 -18.863 -0.741 -10.040 10 2HB GLU 2 HB1 GLU 2 -18.423 0.959 -10.100 11 1HG GLU 2 HG2 GLU 2 -17.078 -0.431 -11.606 12 2HG GLU 2 HG1 GLU 2 -16.109 0.417 -10.404 13 H CYS 3 HN CYS 3 -15.913 -0.090 -6.772 14 HA CYS 3 HA CYS 3 -15.753 2.763 -6.352 15 1HB CYS 3 HB2 CYS 3 -14.308 0.405 -5.173 16 2HB CYS 3 HB1 CYS 3 -13.785 2.057 -4.860 17 H GLN 4 HN GLN 4 -14.934 3.820 -8.036 18 HA GLN 4 HA GLN 4 -12.540 2.872 -9.368 19 1HB GLN 4 HB2 GLN 4 -14.186 5.392 -9.666 20 2HB GLN 4 HB1 GLN 4 -12.745 5.051 -10.614 21 1HG GLN 4 HG2 GLN 4 -15.229 3.353 -10.578 22 2HG GLN 4 HG1 GLN 4 -14.825 4.544 -11.814 23 1HE2 GLN 4 HE21 GLN 4 -14.112 1.415 -10.504 24 2HE2 GLN 4 HE22 GLN 4 -13.107 0.870 -11.806 25 H VAL 5 HN VAL 5 -10.663 3.109 -8.369 26 HA VAL 5 HA VAL 5 -10.344 5.392 -6.556 27 HB VAL 5 HB VAL 5 -10.216 3.292 -5.365 28 1HG1 VAL 5 HG11 VAL 5 -7.968 2.562 -7.230 29 2HG1 VAL 5 HG12 VAL 5 -9.576 1.838 -7.210 30 3HG1 VAL 5 HG13 VAL 5 -8.499 1.629 -5.830 31 1HG2 VAL 5 HG21 VAL 5 -8.765 5.104 -4.623 32 2HG2 VAL 5 HG22 VAL 5 -7.480 4.514 -5.678 33 3HG2 VAL 5 HG23 VAL 5 -8.029 3.532 -4.319 34 H ARG 6 HN ARG 6 -8.932 6.873 -7.010 35 HA ARG 6 HA ARG 6 -7.129 6.558 -9.262 36 1HB ARG 6 HB2 ARG 6 -7.698 8.918 -7.453 37 2HB ARG 6 HB1 ARG 6 -6.637 8.965 -8.856 38 1HG ARG 6 HG2 ARG 6 -9.578 8.315 -8.939 39 2HG ARG 6 HG1 ARG 6 -8.873 9.893 -9.302 40 1HD ARG 6 HD2 ARG 6 -8.299 7.318 -10.766 41 2HD ARG 6 HD1 ARG 6 -9.341 8.621 -11.339 42 HE ARG 6 HE ARG 6 -7.069 9.944 -10.981 43 1HH1 ARG 6 HH11 ARG 6 -7.611 6.804 -12.446 44 2HH1 ARG 6 HH12 ARG 6 -6.275 6.954 -13.551 45 1HH2 ARG 6 HH21 ARG 6 -5.332 10.146 -12.431 46 2HH2 ARG 6 HH22 ARG 6 -4.992 8.861 -13.553 47 H VAL 7 HN VAL 7 -5.328 5.457 -8.822 48 HA VAL 7 HA VAL 7 -3.849 6.127 -6.370 49 HB VAL 7 HB VAL 7 -3.532 3.650 -8.083 50 1HG1 VAL 7 HG11 VAL 7 -2.197 2.810 -6.196 51 2HG1 VAL 7 HG12 VAL 7 -2.367 4.373 -5.395 52 3HG1 VAL 7 HG13 VAL 7 -1.492 4.254 -6.921 53 1HG2 VAL 7 HG21 VAL 7 -5.690 3.606 -6.995 54 2HG2 VAL 7 HG22 VAL 7 -4.950 4.002 -5.444 55 3HG2 VAL 7 HG23 VAL 7 -4.608 2.452 -6.215 56 H GLY 8 HN GLY 8 -2.079 7.313 -6.626 57 1HA GLY 8 HA2 GLY 8 -1.165 7.881 -9.326 58 2HA GLY 8 HA1 GLY 8 -0.706 8.742 -7.869 59 H ASP 9 HN ASP 9 0.651 7.200 -10.229 60 HA ASP 9 HA ASP 9 2.380 5.328 -8.933 61 1HB ASP 9 HB2 ASP 9 2.772 6.867 -11.515 62 2HB ASP 9 HB1 ASP 9 3.738 5.494 -10.992 63 H LEU 10 HN LEU 10 3.961 5.838 -7.530 64 HA LEU 10 HA LEU 10 5.013 8.590 -7.631 65 1HB LEU 10 HB2 LEU 10 4.724 6.827 -5.199 66 2HB LEU 10 HB1 LEU 10 5.329 8.472 -5.215 67 HG LEU 10 HG LEU 10 2.504 7.585 -5.792 68 1HD1 LEU 10 HD11 LEU 10 1.987 8.882 -3.778 69 2HD1 LEU 10 HD12 LEU 10 3.708 9.193 -3.547 70 3HD1 LEU 10 HD13 LEU 10 3.087 7.547 -3.441 71 1HD2 LEU 10 HD21 LEU 10 1.985 9.979 -5.973 72 2HD2 LEU 10 HD22 LEU 10 3.099 9.457 -7.236 73 3HD2 LEU 10 HD23 LEU 10 3.703 10.357 -5.845 74 H THR 11 HN THR 11 6.904 8.206 -8.810 75 HA THR 11 HA THR 11 8.817 6.411 -7.489 76 HB THR 11 HB THR 11 8.675 6.039 -9.887 77 HG1 THR 11 HG1 THR 11 11.060 7.230 -8.916 78 1HG2 THR 11 HG21 THR 11 9.479 8.931 -10.219 79 2HG2 THR 11 HG22 THR 11 7.906 8.239 -10.615 80 3HG2 THR 11 HG23 THR 11 9.340 7.742 -11.516 81 H VAL 12 HN VAL 12 10.058 7.279 -6.021 82 HA VAL 12 HA VAL 12 11.172 9.952 -6.290 83 HB VAL 12 HB VAL 12 9.346 9.279 -3.961 84 1HG1 VAL 12 HG11 VAL 12 11.235 10.605 -3.228 85 2HG1 VAL 12 HG12 VAL 12 9.769 11.585 -3.217 86 3HG1 VAL 12 HG13 VAL 12 10.945 11.774 -4.517 87 1HG2 VAL 12 HG21 VAL 12 8.989 11.344 -6.129 88 2HG2 VAL 12 HG22 VAL 12 7.940 11.128 -4.727 89 3HG2 VAL 12 HG23 VAL 12 8.059 9.858 -5.944 90 H ALA 13 HN ALA 13 12.936 10.281 -4.826 91 HA ALA 13 HA ALA 13 14.123 7.752 -4.010 92 1HB ALA 13 HB1 ALA 13 15.408 9.288 -5.416 93 2HB ALA 13 HB2 ALA 13 16.208 8.993 -3.872 94 3HB ALA 13 HB3 ALA 13 15.340 10.506 -4.142 95 H LYS 14 HN LYS 14 14.031 7.038 -1.990 96 HA LYS 14 HA LYS 14 14.530 8.913 0.183 97 1HB LYS 14 HB2 LYS 14 12.470 6.790 0.663 98 2HB LYS 14 HB1 LYS 14 12.818 8.220 1.612 99 1HG LYS 14 HG2 LYS 14 10.894 8.902 0.685 100 2HG LYS 14 HG1 LYS 14 11.984 9.409 -0.607 101 1HD LYS 14 HD2 LYS 14 11.555 7.309 -1.789 102 2HD LYS 14 HD1 LYS 14 10.452 6.814 -0.500 103 1HE LYS 14 HE2 LYS 14 8.999 8.670 -0.971 104 2HE LYS 14 HE1 LYS 14 10.150 9.295 -2.156 105 1HZ LYS 14 HZ1 LYS 14 8.323 8.123 -3.224 106 2HZ LYS 14 HZ2 LYS 14 8.688 6.715 -2.360 107 3HZ LYS 14 HZ3 LYS 14 9.787 7.317 -3.498 108 H THR 15 HN THR 15 14.886 7.621 2.278 109 HA THR 15 HA THR 15 16.232 5.075 1.702 110 HB THR 15 HB THR 15 16.964 5.771 4.255 111 HG1 THR 15 HG1 THR 15 17.472 8.156 2.920 112 1HG2 THR 15 HG21 THR 15 18.435 4.903 2.507 113 2HG2 THR 15 HG22 THR 15 19.136 6.320 3.284 114 3HG2 THR 15 HG23 THR 15 18.394 6.466 1.691 115 H ARG 16 HN ARG 16 15.855 3.301 3.155 116 HA ARG 16 HA ARG 16 13.147 3.358 4.233 117 1HB ARG 16 HB2 ARG 16 15.024 0.989 4.195 118 2HB ARG 16 HB1 ARG 16 13.281 0.974 4.447 119 1HG ARG 16 HG2 ARG 16 13.345 0.308 2.276 120 2HG ARG 16 HG1 ARG 16 13.285 2.056 2.036 121 1HD ARG 16 HD2 ARG 16 15.846 1.954 2.037 122 2HD ARG 16 HD1 ARG 16 15.648 0.217 1.833 123 HE ARG 16 HE ARG 16 14.576 0.654 -0.266 124 1HH1 ARG 16 HH11 ARG 16 16.304 3.291 1.189 125 2HH1 ARG 16 HH12 ARG 16 16.324 4.272 -0.242 126 1HH2 ARG 16 HH21 ARG 16 14.644 1.913 -2.225 127 2HH2 ARG 16 HH22 ARG 16 15.405 3.470 -2.191 128 H GLY 17 HN GLY 17 16.198 4.011 5.265 129 1HA GLY 17 HA2 GLY 17 15.781 3.247 8.039 130 2HA GLY 17 HA1 GLY 17 17.166 4.121 7.390 131 H GLN 18 HN GLN 18 15.511 6.028 5.949 132 HA GLN 18 HA GLN 18 14.922 7.949 7.932 133 1HB GLN 18 HB2 GLN 18 15.445 8.535 5.586 134 2HB GLN 18 HB1 GLN 18 13.938 7.786 5.069 135 1HG GLN 18 HG2 GLN 18 13.710 10.191 5.171 136 2HG GLN 18 HG1 GLN 18 12.681 9.419 6.377 137 1HE2 GLN 18 HE21 GLN 18 12.574 11.218 7.701 138 2HE2 GLN 18 HE22 GLN 18 13.936 11.787 8.611 139 H LEU 19 HN LEU 19 13.050 5.572 6.176 140 HA LEU 19 HA LEU 19 10.541 6.089 7.361 141 1HB LEU 19 HB2 LEU 19 11.733 3.503 6.348 142 2HB LEU 19 HB1 LEU 19 10.047 3.722 6.771 143 HG LEU 19 HG LEU 19 11.453 5.217 4.553 144 1HD1 LEU 19 HD11 LEU 19 10.222 3.743 3.043 145 2HD1 LEU 19 HD12 LEU 19 9.604 2.837 4.424 146 3HD1 LEU 19 HD13 LEU 19 11.331 2.828 4.065 147 1HD2 LEU 19 HD21 LEU 19 9.537 6.402 5.505 148 2HD2 LEU 19 HD22 LEU 19 8.537 4.966 5.288 149 3HD2 LEU 19 HD23 LEU 19 9.177 5.816 3.881 150 H THR 20 HN THR 20 10.649 6.374 9.548 151 HA THR 20 HA THR 20 11.992 4.322 11.140 152 HB THR 20 HB THR 20 12.834 6.527 11.590 153 HG1 THR 20 HG1 THR 20 12.872 5.704 13.538 154 1HG2 THR 20 HG21 THR 20 11.400 8.342 12.430 155 2HG2 THR 20 HG22 THR 20 9.980 7.337 12.138 156 3HG2 THR 20 HG23 THR 20 10.980 7.865 10.785 157 H ASP 21 HN ASP 21 10.087 3.045 10.480 158 HA ASP 21 HA ASP 21 8.154 1.969 10.902 159 1HB ASP 21 HB2 ASP 21 8.816 1.841 13.229 160 2HB ASP 21 HB1 ASP 21 8.238 3.479 13.525 161 H ALA 22 HN ALA 22 7.281 4.949 12.608 162 HA ALA 22 HA ALA 22 5.003 5.176 10.803 163 1HB ALA 22 HB1 ALA 22 4.524 5.177 13.197 164 2HB ALA 22 HB2 ALA 22 4.057 6.706 12.451 165 3HB ALA 22 HB3 ALA 22 5.538 6.606 13.403 166 H ALA 23 HN ALA 23 6.451 5.906 9.083 167 HA ALA 23 HA ALA 23 6.625 8.821 9.120 168 1HB ALA 23 HB1 ALA 23 8.847 8.830 8.122 169 2HB ALA 23 HB2 ALA 23 8.912 7.071 8.214 170 3HB ALA 23 HB3 ALA 23 8.880 8.031 9.694 171 HA PRO 24 HA PRO 24 4.636 7.497 5.262 172 1HB PRO 24 HB2 PRO 24 3.129 9.706 4.954 173 2HB PRO 24 HB1 PRO 24 2.684 8.414 6.075 174 1HG PRO 24 HG2 PRO 24 4.002 11.043 6.642 175 2HG PRO 24 HG1 PRO 24 2.718 10.217 7.543 176 1HD PRO 24 HD2 PRO 24 5.349 10.160 8.283 177 2HD PRO 24 HD1 PRO 24 4.200 8.867 8.657 178 H ILE 25 HN ILE 25 6.423 7.616 3.900 179 HA ILE 25 HA ILE 25 6.994 10.313 2.846 180 HB ILE 25 HB ILE 25 8.866 7.979 2.511 181 1HG1 ILE 25 HG12 ILE 25 8.724 9.957 4.795 182 2HG1 ILE 25 HG11 ILE 25 8.501 8.212 4.906 183 1HG2 ILE 25 HG21 ILE 25 9.267 10.977 2.517 184 2HG2 ILE 25 HG22 ILE 25 9.206 9.948 1.087 185 3HG2 ILE 25 HG23 ILE 25 10.524 9.771 2.244 186 1HD1 ILE 25 HD11 ILE 25 10.836 7.872 4.295 187 2HD1 ILE 25 HD12 ILE 25 10.690 8.896 5.724 188 3HD1 ILE 25 HD13 ILE 25 11.059 9.617 4.157 189 H GLY 26 HN GLY 26 5.103 7.891 2.201 190 1HA GLY 26 HA2 GLY 26 5.283 8.472 -0.678 191 2HA GLY 26 HA1 GLY 26 4.964 6.832 -0.127 192 HA PRO 27 HA PRO 27 1.002 9.277 1.185 193 1HB PRO 27 HB2 PRO 27 0.851 11.887 0.374 194 2HB PRO 27 HB1 PRO 27 1.409 11.383 1.974 195 1HG PRO 27 HG2 PRO 27 3.012 12.125 -0.448 196 2HG PRO 27 HG1 PRO 27 3.277 12.573 1.248 197 1HD PRO 27 HD2 PRO 27 4.700 10.621 0.077 198 2HD PRO 27 HD1 PRO 27 4.203 10.519 1.776 199 H VAL 28 HN VAL 28 -0.036 8.072 -0.298 200 HA VAL 28 HA VAL 28 -0.100 8.880 -3.093 201 HB VAL 28 HB VAL 28 -1.537 6.585 -1.740 202 1HG1 VAL 28 HG11 VAL 28 -1.759 5.684 -4.008 203 2HG1 VAL 28 HG12 VAL 28 -1.005 7.139 -4.657 204 3HG1 VAL 28 HG13 VAL 28 -2.567 7.243 -3.845 205 1HG2 VAL 28 HG21 VAL 28 0.225 5.153 -2.648 206 2HG2 VAL 28 HG22 VAL 28 0.884 6.343 -1.524 207 3HG2 VAL 28 HG23 VAL 28 1.067 6.575 -3.262 208 H THR 29 HN THR 29 -1.609 10.201 -3.870 209 HA THR 29 HA THR 29 -3.803 11.053 -2.228 210 HB THR 29 HB THR 29 -4.365 12.320 -4.453 211 HG1 THR 29 HG1 THR 29 -2.756 12.351 -5.931 212 1HG2 THR 29 HG21 THR 29 -1.870 12.899 -2.846 213 2HG2 THR 29 HG22 THR 29 -3.511 13.394 -2.430 214 3HG2 THR 29 HG23 THR 29 -2.726 14.060 -3.861 215 H VAL 30 HN VAL 30 -5.115 9.288 -1.955 216 HA VAL 30 HA VAL 30 -6.097 7.853 -4.291 217 HB VAL 30 HB VAL 30 -6.300 7.364 -1.329 218 1HG1 VAL 30 HG11 VAL 30 -7.646 5.371 -1.807 219 2HG1 VAL 30 HG12 VAL 30 -7.766 5.859 -3.498 220 3HG1 VAL 30 HG13 VAL 30 -8.503 6.851 -2.240 221 1HG2 VAL 30 HG21 VAL 30 -5.210 5.247 -1.961 222 2HG2 VAL 30 HG22 VAL 30 -4.265 6.649 -2.465 223 3HG2 VAL 30 HG23 VAL 30 -5.221 5.758 -3.651 224 H GLN 31 HN GLN 31 -7.807 8.534 -5.278 225 HA GLN 31 HA GLN 31 -9.982 9.766 -3.732 226 1HB GLN 31 HB2 GLN 31 -9.018 11.227 -5.464 227 2HB GLN 31 HB1 GLN 31 -9.362 10.010 -6.685 228 1HG GLN 31 HG2 GLN 31 -11.744 10.266 -6.291 229 2HG GLN 31 HG1 GLN 31 -11.420 11.438 -5.014 230 1HE2 GLN 31 HE21 GLN 31 -9.195 12.625 -6.500 231 2HE2 GLN 31 HE22 GLN 31 -9.910 13.591 -7.748 232 H ALA 32 HN ALA 32 -11.789 8.609 -3.543 233 HA ALA 32 HA ALA 32 -12.086 6.247 -5.280 234 1HB ALA 32 HB1 ALA 32 -13.159 5.112 -3.408 235 2HB ALA 32 HB2 ALA 32 -12.938 6.545 -2.404 236 3HB ALA 32 HB3 ALA 32 -11.532 5.646 -2.978 237 H LEU 33 HN LEU 33 -13.711 6.436 -6.638 238 HA LEU 33 HA LEU 33 -15.860 8.306 -6.197 239 1HB LEU 33 HB2 LEU 33 -15.230 6.358 -8.407 240 2HB LEU 33 HB1 LEU 33 -16.736 7.249 -8.363 241 HG LEU 33 HG LEU 33 -15.428 9.375 -8.406 242 1HD1 LEU 33 HD11 LEU 33 -13.085 7.562 -8.971 243 2HD1 LEU 33 HD12 LEU 33 -13.310 8.535 -7.516 244 3HD1 LEU 33 HD13 LEU 33 -13.091 9.322 -9.080 245 1HD2 LEU 33 HD21 LEU 33 -16.410 8.455 -10.426 246 2HD2 LEU 33 HD22 LEU 33 -14.970 7.474 -10.696 247 3HD2 LEU 33 HD23 LEU 33 -14.866 9.232 -10.781 248 H GLY 34 HN GLY 34 -17.611 7.861 -5.049 249 1HA GLY 34 HA2 GLY 34 -19.582 6.718 -4.554 250 2HA GLY 34 HA1 GLY 34 -18.952 5.311 -5.398 251 H CYS 35 HN CYS 35 -18.791 3.656 -4.086 252 HA CYS 35 HA CYS 35 -18.267 2.331 -2.319 253 1HB CYS 35 HB2 CYS 35 -16.581 4.627 -1.310 254 2HB CYS 35 HB1 CYS 35 -16.424 2.928 -0.887 255 H ASN 36 HN ASN 36 -20.530 4.242 -2.192 256 HA ASN 36 HA ASN 36 -20.707 5.758 0.110 257 1HB ASN 36 HB2 ASN 36 -22.906 4.277 -1.343 258 2HB ASN 36 HB1 ASN 36 -23.188 5.497 -0.107 259 1HD2 ASN 36 HD21 ASN 36 -22.118 4.881 -3.355 260 2HD2 ASN 36 HD22 ASN 36 -22.167 6.535 -3.889 261 H ALA 37 HN ALA 37 -21.541 2.341 -0.306 262 HA ALA 37 HA ALA 37 -21.637 2.130 2.641 263 1HB ALA 37 HB1 ALA 37 -23.141 0.223 2.356 264 2HB ALA 37 HB2 ALA 37 -23.082 0.432 0.606 265 3HB ALA 37 HB3 ALA 37 -23.809 1.679 1.620 266 H ARG 38 HN ARG 38 -19.290 1.942 0.824 267 HA ARG 38 HA ARG 38 -18.635 -0.909 1.174 268 1HB ARG 38 HB2 ARG 38 -18.994 0.077 -1.224 269 2HB ARG 38 HB1 ARG 38 -17.418 0.811 -0.955 270 1HG ARG 38 HG2 ARG 38 -17.141 -1.216 -2.195 271 2HG ARG 38 HG1 ARG 38 -16.464 -1.431 -0.580 272 1HD ARG 38 HD2 ARG 38 -19.260 -2.296 -1.274 273 2HD ARG 38 HD1 ARG 38 -17.864 -3.339 -1.533 274 HE ARG 38 HE ARG 38 -17.474 -2.943 0.969 275 1HH1 ARG 38 HH11 ARG 38 -20.624 -3.161 -0.552 276 2HH1 ARG 38 HH12 ARG 38 -21.424 -3.717 0.888 277 1HH2 ARG 38 HH21 ARG 38 -18.510 -3.697 2.852 278 2HH2 ARG 38 HH22 ARG 38 -20.215 -4.051 2.822 279 H GLN 39 HN GLN 39 -16.629 -1.431 1.960 280 HA GLN 39 HA GLN 39 -14.964 0.665 3.032 281 1HB GLN 39 HB2 GLN 39 -14.422 -2.311 2.886 282 2HB GLN 39 HB1 GLN 39 -13.566 -1.143 3.880 283 1HG GLN 39 HG2 GLN 39 -14.932 -1.981 5.464 284 2HG GLN 39 HG1 GLN 39 -16.021 -0.752 4.828 285 1HE2 GLN 39 HE21 GLN 39 -16.615 -3.253 6.193 286 2HE2 GLN 39 HE22 GLN 39 -17.626 -4.168 5.123 287 H VAL 40 HN VAL 40 -12.822 1.079 2.361 288 HA VAL 40 HA VAL 40 -12.224 0.204 -0.384 289 HB VAL 40 HB VAL 40 -11.245 2.677 1.066 290 1HG1 VAL 40 HG11 VAL 40 -10.745 1.760 -1.768 291 2HG1 VAL 40 HG12 VAL 40 -9.556 1.795 -0.466 292 3HG1 VAL 40 HG13 VAL 40 -10.234 3.303 -1.080 293 1HG2 VAL 40 HG21 VAL 40 -13.601 2.809 0.389 294 2HG2 VAL 40 HG22 VAL 40 -13.142 2.409 -1.265 295 3HG2 VAL 40 HG23 VAL 40 -12.595 3.921 -0.540 296 H ALA 41 HN ALA 41 -10.387 -0.956 -0.709 297 HA ALA 41 HA ALA 41 -8.488 -1.185 1.496 298 1HB ALA 41 HB1 ALA 41 -9.755 -3.510 0.060 299 2HB ALA 41 HB2 ALA 41 -10.080 -3.023 1.724 300 3HB ALA 41 HB3 ALA 41 -8.479 -3.614 1.275 301 H LEU 42 HN LEU 42 -6.419 -1.487 0.872 302 HA LEU 42 HA LEU 42 -5.919 -1.397 -2.018 303 1HB LEU 42 HB2 LEU 42 -3.945 -0.865 0.188 304 2HB LEU 42 HB1 LEU 42 -3.844 -0.372 -1.494 305 HG LEU 42 HG LEU 42 -5.876 0.669 0.473 306 1HD1 LEU 42 HD11 LEU 42 -4.563 2.744 0.437 307 2HD1 LEU 42 HD12 LEU 42 -3.336 1.939 -0.541 308 3HD1 LEU 42 HD13 LEU 42 -3.648 1.393 1.107 309 1HD2 LEU 42 HD21 LEU 42 -6.622 0.725 -1.854 310 2HD2 LEU 42 HD22 LEU 42 -5.151 1.584 -2.311 311 3HD2 LEU 42 HD23 LEU 42 -6.324 2.352 -1.240 312 H LYS 43 HN LYS 43 -4.360 -2.758 -2.954 313 HA LYS 43 HA LYS 43 -3.372 -4.973 -1.294 314 1HB LYS 43 HB2 LYS 43 -4.424 -5.409 -4.099 315 2HB LYS 43 HB1 LYS 43 -3.935 -6.630 -2.936 316 1HG LYS 43 HG2 LYS 43 -6.247 -6.773 -2.882 317 2HG LYS 43 HG1 LYS 43 -5.892 -5.712 -1.517 318 1HD LYS 43 HD2 LYS 43 -6.298 -3.758 -2.987 319 2HD LYS 43 HD1 LYS 43 -6.768 -4.868 -4.276 320 1HE LYS 43 HE2 LYS 43 -8.647 -3.870 -2.936 321 2HE LYS 43 HE1 LYS 43 -8.634 -5.635 -3.058 322 1HZ LYS 43 HZ1 LYS 43 -7.585 -4.075 -0.766 323 2HZ LYS 43 HZ2 LYS 43 -7.662 -5.762 -0.875 324 3HZ LYS 43 HZ3 LYS 43 -9.087 -4.852 -0.805 325 H ALA 44 HN ALA 44 -1.394 -5.835 -2.057 326 HA ALA 44 HA ALA 44 0.054 -4.038 -3.818 327 1HB ALA 44 HB1 ALA 44 1.186 -4.759 -1.818 328 2HB ALA 44 HB2 ALA 44 2.008 -5.437 -3.225 329 3HB ALA 44 HB3 ALA 44 0.945 -6.452 -2.247 330 H ASP 45 HN ASP 45 1.228 -4.855 -5.665 331 HA ASP 45 HA ASP 45 -0.307 -6.893 -7.070 332 1HB ASP 45 HB2 ASP 45 0.482 -4.613 -8.065 333 2HB ASP 45 HB1 ASP 45 2.035 -5.423 -8.253 334 H THR 46 HN THR 46 1.228 -8.303 -8.557 335 HA THR 46 HA THR 46 2.141 -10.306 -6.941 336 HB THR 46 HB THR 46 3.297 -11.091 -9.055 337 HG1 THR 46 HG1 THR 46 2.080 -8.706 -10.061 338 1HG2 THR 46 HG21 THR 46 1.025 -11.768 -8.474 339 2HG2 THR 46 HG22 THR 46 1.171 -11.513 -10.213 340 3HG2 THR 46 HG23 THR 46 0.391 -10.294 -9.205 341 H ASP 47 HN ASP 47 3.928 -7.492 -7.959 342 HA ASP 47 HA ASP 47 6.544 -8.553 -7.779 343 1HB ASP 47 HB2 ASP 47 5.687 -5.686 -7.320 344 2HB ASP 47 HB1 ASP 47 7.308 -6.242 -7.723 345 H ASN 48 HN ASN 48 4.383 -7.103 -5.402 346 HA ASN 48 HA ASN 48 6.365 -7.702 -3.320 347 1HB ASN 48 HB2 ASN 48 5.827 -5.608 -2.166 348 2HB ASN 48 HB1 ASN 48 6.460 -5.277 -3.775 349 1HD2 ASN 48 HD21 ASN 48 4.767 -3.700 -1.957 350 2HD2 ASN 48 HD22 ASN 48 3.354 -3.299 -2.870 351 H PHE 49 HN PHE 49 3.712 -8.862 -4.357 352 HA PHE 49 HA PHE 49 2.402 -9.027 -1.711 353 1HB PHE 49 HB2 PHE 49 1.089 -7.860 -3.523 354 2HB PHE 49 HB1 PHE 49 1.079 -9.370 -4.407 355 HD1 PHE 49 HD1 PHE 49 0.019 -7.877 -1.149 356 HD2 PHE 49 HD2 PHE 49 -0.668 -10.845 -4.127 357 HE1 PHE 49 HE1 PHE 49 -2.119 -8.445 -0.088 358 HE2 PHE 49 HE2 PHE 49 -2.807 -11.422 -3.057 359 HZ PHE 49 HZ PHE 49 -3.550 -10.207 -1.046 360 H GLU 50 HN GLU 50 3.273 -10.881 -0.943 361 HA GLU 50 HA GLU 50 3.199 -13.233 -2.698 362 1HB GLU 50 HB2 GLU 50 4.738 -14.231 -0.887 363 2HB GLU 50 HB1 GLU 50 5.410 -13.039 -1.987 364 1HG GLU 50 HG2 GLU 50 5.178 -11.316 -0.284 365 2HG GLU 50 HG1 GLU 50 4.456 -12.487 0.814 366 H GLN 51 HN GLN 51 1.215 -13.992 -2.501 367 HA GLN 51 HA GLN 51 -0.435 -15.308 -1.693 368 1HB GLN 51 HB2 GLN 51 1.308 -16.531 -0.448 369 2HB GLN 51 HB1 GLN 51 1.137 -15.399 0.887 370 1HG GLN 51 HG2 GLN 51 -0.043 -17.456 1.352 371 2HG GLN 51 HG1 GLN 51 -1.176 -16.114 1.203 372 1HE2 GLN 51 HE21 GLN 51 -2.899 -17.448 0.726 373 2HE2 GLN 51 HE22 GLN 51 -3.052 -18.261 -0.796 374 H GLY 52 HN GLY 52 0.673 -12.983 0.745 375 1HA GLY 52 HA2 GLY 52 -1.606 -11.373 0.607 376 2HA GLY 52 HA1 GLY 52 -1.850 -12.523 1.918 377 H LYS 53 HN LYS 53 1.199 -11.123 0.889 378 HA LYS 53 HA LYS 53 1.225 -9.367 3.242 379 1HB LYS 53 HB2 LYS 53 3.621 -10.982 2.372 380 2HB LYS 53 HB1 LYS 53 3.494 -9.960 3.784 381 1HG LYS 53 HG2 LYS 53 1.919 -12.491 3.401 382 2HG LYS 53 HG1 LYS 53 3.463 -12.402 4.248 383 1HD LYS 53 HD2 LYS 53 2.381 -10.651 5.730 384 2HD LYS 53 HD1 LYS 53 0.844 -11.126 5.004 385 1HE LYS 53 HE2 LYS 53 1.128 -12.310 7.078 386 2HE LYS 53 HE1 LYS 53 1.270 -13.455 5.747 387 1HZ LYS 53 HZ1 LYS 53 3.666 -12.198 6.938 388 2HZ LYS 53 HZ2 LYS 53 3.558 -13.642 6.054 389 3HZ LYS 53 HZ3 LYS 53 2.969 -13.572 7.640 390 H PHE 54 HN PHE 54 1.984 -7.343 2.712 391 HA PHE 54 HA PHE 54 3.400 -7.138 0.157 392 1HB PHE 54 HB2 PHE 54 2.606 -4.727 0.100 393 2HB PHE 54 HB1 PHE 54 1.424 -5.979 -0.222 394 HD1 PHE 54 HD1 PHE 54 -0.593 -5.039 0.306 395 HD2 PHE 54 HD2 PHE 54 2.627 -4.670 3.069 396 HE1 PHE 54 HE1 PHE 54 -2.125 -4.025 1.944 397 HE2 PHE 54 HE2 PHE 54 1.095 -3.662 4.714 398 HZ PHE 54 HZ PHE 54 -1.280 -3.347 4.151 399 H PHE 55 HN PHE 55 5.047 -5.627 -0.078 400 HA PHE 55 HA PHE 55 6.307 -4.492 2.252 401 1HB PHE 55 HB2 PHE 55 8.409 -5.878 1.894 402 2HB PHE 55 HB1 PHE 55 7.065 -6.739 2.628 403 HD1 PHE 55 HD1 PHE 55 9.341 -6.563 -0.144 404 HD2 PHE 55 HD2 PHE 55 5.695 -8.287 1.204 405 HE1 PHE 55 HE1 PHE 55 9.502 -8.281 -1.902 406 HE2 PHE 55 HE2 PHE 55 5.848 -10.003 -0.546 407 HZ PHE 55 HZ PHE 55 7.752 -10.005 -2.098 408 H LEU 56 HN LEU 56 8.637 -3.791 1.560 409 HA LEU 56 HA LEU 56 8.530 -2.652 -1.130 410 1HB LEU 56 HB2 LEU 56 10.720 -2.306 0.917 411 2HB LEU 56 HB1 LEU 56 10.397 -1.309 -0.482 412 HG LEU 56 HG LEU 56 8.599 -1.495 1.932 413 1HD1 LEU 56 HD11 LEU 56 10.746 -0.441 2.461 414 2HD1 LEU 56 HD12 LEU 56 9.419 0.722 2.492 415 3HD1 LEU 56 HD13 LEU 56 10.521 0.678 1.115 416 1HD2 LEU 56 HD21 LEU 56 7.505 0.462 0.953 417 2HD2 LEU 56 HD22 LEU 56 7.398 -0.941 -0.109 418 3HD2 LEU 56 HD23 LEU 56 8.557 0.341 -0.456 419 H ILE 57 HN ILE 57 9.245 -3.989 -2.702 420 HA ILE 57 HA ILE 57 11.547 -5.704 -2.070 421 HB ILE 57 HB ILE 57 9.550 -6.925 -2.860 422 1HG1 ILE 57 HG12 ILE 57 10.678 -8.190 -4.703 423 2HG1 ILE 57 HG11 ILE 57 11.917 -6.940 -4.739 424 1HG2 ILE 57 HG21 ILE 57 8.813 -6.734 -5.178 425 2HG2 ILE 57 HG22 ILE 57 9.934 -5.393 -5.421 426 3HG2 ILE 57 HG23 ILE 57 8.587 -5.225 -4.295 427 1HD1 ILE 57 HD11 ILE 57 12.501 -7.467 -2.423 428 2HD1 ILE 57 HD12 ILE 57 12.676 -8.861 -3.489 429 3HD1 ILE 57 HD13 ILE 57 11.281 -8.742 -2.415 430 H SER 58 HN SER 58 13.372 -5.605 -3.315 431 HA SER 58 HA SER 58 13.799 -3.090 -4.632 432 1HB SER 58 HB2 SER 58 15.513 -4.065 -3.154 433 2HB SER 58 HB1 SER 58 15.666 -5.442 -4.242 434 HG SER 58 HG SER 58 16.066 -2.784 -5.128 435 H ASP 59 HN ASP 59 14.616 -2.846 -6.758 436 HA ASP 59 HA ASP 59 13.293 -4.153 -8.804 437 1HB ASP 59 HB2 ASP 59 14.265 -2.002 -9.183 438 2HB ASP 59 HB1 ASP 59 15.875 -2.587 -8.782 439 H ASN 60 HN ASN 60 16.238 -5.050 -7.171 440 HA ASN 60 HA ASN 60 16.601 -7.262 -9.076 441 1HB ASN 60 HB2 ASN 60 18.582 -5.996 -7.176 442 2HB ASN 60 HB1 ASN 60 18.910 -7.451 -8.112 443 1HD2 ASN 60 HD21 ASN 60 18.608 -4.024 -8.173 444 2HD2 ASN 60 HD22 ASN 60 19.105 -3.787 -9.809 445 H ASN 61 HN ASN 61 14.882 -6.861 -6.522 446 HA ASN 61 HA ASN 61 14.119 -8.091 -4.771 447 1HB ASN 61 HB2 ASN 61 15.076 -10.241 -6.650 448 2HB ASN 61 HB1 ASN 61 14.237 -10.617 -5.149 449 1HD2 ASN 61 HD21 ASN 61 12.471 -11.522 -6.172 450 2HD2 ASN 61 HD22 ASN 61 11.320 -10.572 -7.057 451 H ARG 62 HN ARG 62 16.817 -7.127 -4.401 452 HA ARG 62 HA ARG 62 18.343 -9.263 -3.237 453 1HB ARG 62 HB2 ARG 62 19.904 -7.463 -2.529 454 2HB ARG 62 HB1 ARG 62 19.558 -7.456 -4.251 455 1HG ARG 62 HG2 ARG 62 18.400 -5.486 -4.157 456 2HG ARG 62 HG1 ARG 62 17.933 -5.715 -2.469 457 1HD ARG 62 HD2 ARG 62 20.754 -5.163 -3.376 458 2HD ARG 62 HD1 ARG 62 19.629 -3.910 -2.850 459 HE ARG 62 HE ARG 62 19.572 -5.071 -0.673 460 1HH1 ARG 62 HH11 ARG 62 22.245 -5.666 -2.839 461 2HH1 ARG 62 HH12 ARG 62 23.346 -6.103 -1.572 462 1HH2 ARG 62 HH21 ARG 62 21.014 -5.677 1.008 463 2HH2 ARG 62 HH22 ARG 62 22.652 -6.100 0.613 464 H ASP 63 HN ASP 63 16.014 -6.985 -2.074 465 HA ASP 63 HA ASP 63 16.248 -8.047 0.620 466 1HB ASP 63 HB2 ASP 63 17.824 -6.053 0.429 467 2HB ASP 63 HB1 ASP 63 16.401 -5.058 0.157 468 H LYS 64 HN LYS 64 14.301 -7.999 1.689 469 HA LYS 64 HA LYS 64 12.125 -6.451 0.468 470 1HB LYS 64 HB2 LYS 64 10.571 -8.245 0.687 471 2HB LYS 64 HB1 LYS 64 11.980 -8.908 -0.118 472 1HG LYS 64 HG2 LYS 64 11.803 -10.565 1.364 473 2HG LYS 64 HG1 LYS 64 12.530 -9.433 2.505 474 1HD LYS 64 HD2 LYS 64 10.607 -10.253 3.604 475 2HD LYS 64 HD1 LYS 64 10.150 -8.659 3.007 476 1HE LYS 64 HE2 LYS 64 8.364 -10.226 2.586 477 2HE LYS 64 HE1 LYS 64 9.076 -9.704 1.061 478 1HZ LYS 64 HZ1 LYS 64 9.588 -12.286 2.446 479 2HZ LYS 64 HZ2 LYS 64 10.354 -11.784 1.021 480 3HZ LYS 64 HZ3 LYS 64 8.679 -12.064 1.028 481 H LEU 65 HN LEU 65 10.956 -5.280 1.880 482 HA LEU 65 HA LEU 65 11.068 -5.986 4.713 483 1HB LEU 65 HB2 LEU 65 11.522 -3.663 5.355 484 2HB LEU 65 HB1 LEU 65 12.839 -4.402 4.479 485 HG LEU 65 HG LEU 65 10.882 -2.647 3.041 486 1HD1 LEU 65 HD11 LEU 65 11.664 -1.399 5.003 487 2HD1 LEU 65 HD12 LEU 65 12.316 -0.739 3.502 488 3HD1 LEU 65 HD13 LEU 65 13.332 -1.737 4.545 489 1HD2 LEU 65 HD21 LEU 65 12.826 -2.238 1.610 490 2HD2 LEU 65 HD22 LEU 65 12.458 -3.958 1.713 491 3HD2 LEU 65 HD23 LEU 65 13.802 -3.289 2.635 492 H TYR 66 HN TYR 66 9.166 -5.857 5.670 493 HA TYR 66 HA TYR 66 6.885 -5.321 4.068 494 1HB TYR 66 HB2 TYR 66 7.077 -5.902 7.028 495 2HB TYR 66 HB1 TYR 66 5.593 -5.910 6.086 496 HD1 TYR 66 HD1 TYR 66 8.743 -7.682 6.753 497 HD2 TYR 66 HD2 TYR 66 5.076 -7.746 4.588 498 HE1 TYR 66 HE1 TYR 66 9.108 -10.048 6.215 499 HE2 TYR 66 HE2 TYR 66 5.437 -10.115 4.045 500 HH TYR 66 HH TYR 66 7.739 -12.021 5.610 501 H VAL 67 HN VAL 67 5.372 -3.747 4.184 502 HA VAL 67 HA VAL 67 5.855 -1.466 5.969 503 HB VAL 67 HB VAL 67 5.166 0.057 4.106 504 1HG1 VAL 67 HG11 VAL 67 7.726 -1.487 3.725 505 2HG1 VAL 67 HG12 VAL 67 7.484 -0.110 4.799 506 3HG1 VAL 67 HG13 VAL 67 7.380 0.105 3.053 507 1HG2 VAL 67 HG21 VAL 67 5.703 -2.374 2.398 508 2HG2 VAL 67 HG22 VAL 67 5.429 -0.737 1.801 509 3HG2 VAL 67 HG23 VAL 67 4.138 -1.597 2.639 510 H ASN 68 HN ASN 68 3.905 0.029 5.928 511 HA ASN 68 HA ASN 68 1.435 -1.457 5.381 512 1HB ASN 68 HB2 ASN 68 0.434 -0.399 7.437 513 2HB ASN 68 HB1 ASN 68 1.664 -1.614 7.760 514 1HD2 ASN 68 HD21 ASN 68 3.589 -1.009 8.691 515 2HD2 ASN 68 HD22 ASN 68 3.851 0.550 9.382 516 H ILE 69 HN ILE 69 0.020 -0.377 4.199 517 HA ILE 69 HA ILE 69 0.582 2.386 3.505 518 HB ILE 69 HB ILE 69 -1.867 0.981 2.523 519 1HG1 ILE 69 HG12 ILE 69 0.904 0.420 1.437 520 2HG1 ILE 69 HG11 ILE 69 -0.025 -0.705 2.419 521 1HG2 ILE 69 HG21 ILE 69 -1.389 3.286 1.868 522 2HG2 ILE 69 HG22 ILE 69 -1.340 2.202 0.477 523 3HG2 ILE 69 HG23 ILE 69 0.162 2.781 1.198 524 1HD1 ILE 69 HD11 ILE 69 -1.751 -0.779 0.693 525 2HD1 ILE 69 HD12 ILE 69 -0.175 -1.275 0.072 526 3HD1 ILE 69 HD13 ILE 69 -0.804 0.332 -0.296 527 H ARG 70 HN ARG 70 0.116 3.450 5.403 528 HA ARG 70 HA ARG 70 -2.578 3.089 6.520 529 1HB ARG 70 HB2 ARG 70 -1.036 2.422 8.145 530 2HB ARG 70 HB1 ARG 70 0.101 3.688 7.730 531 1HG ARG 70 HG2 ARG 70 -1.222 5.336 8.848 532 2HG ARG 70 HG1 ARG 70 -2.536 4.181 9.092 533 1HD ARG 70 HD2 ARG 70 -0.852 4.687 11.032 534 2HD ARG 70 HD1 ARG 70 -1.412 3.040 10.747 535 HE ARG 70 HE ARG 70 0.829 3.130 9.267 536 1HH1 ARG 70 HH11 ARG 70 0.223 4.097 12.590 537 2HH1 ARG 70 HH12 ARG 70 1.828 3.677 13.119 538 1HH2 ARG 70 HH21 ARG 70 2.916 2.583 9.982 539 2HH2 ARG 70 HH22 ARG 70 3.351 2.820 11.645 540 HA PRO 71 HA PRO 71 -3.710 7.173 5.268 541 1HB PRO 71 HB2 PRO 71 -5.015 7.302 7.939 542 2HB PRO 71 HB1 PRO 71 -5.680 7.615 6.332 543 1HG PRO 71 HG2 PRO 71 -6.246 5.359 7.649 544 2HG PRO 71 HG1 PRO 71 -6.036 5.381 5.888 545 1HD PRO 71 HD2 PRO 71 -4.197 4.383 8.006 546 2HD PRO 71 HD1 PRO 71 -4.441 3.796 6.350 547 H MET 72 HN MET 72 -2.736 9.081 5.422 548 HA MET 72 HA MET 72 -0.583 9.505 7.148 549 1HB MET 72 HB2 MET 72 -0.947 10.626 4.931 550 2HB MET 72 HB1 MET 72 -2.166 11.635 5.695 551 1HG MET 72 HG2 MET 72 0.665 11.543 6.681 552 2HG MET 72 HG1 MET 72 0.162 12.610 5.374 553 1HE MET 72 HE1 MET 72 -2.394 14.969 7.153 554 2HE MET 72 HE2 MET 72 -2.780 13.479 6.292 555 3HE MET 72 HE3 MET 72 -1.563 14.579 5.647 556 H ASP 73 HN ASP 73 -3.705 11.189 7.118 557 HA ASP 73 HA ASP 73 -4.201 10.862 9.870 558 1HB ASP 73 HB2 ASP 73 -2.436 12.535 10.174 559 2HB ASP 73 HB1 ASP 73 -3.252 13.618 9.049 560 H ASN 74 HN ASN 74 -6.288 10.457 9.529 561 HA ASN 74 HA ASN 74 -8.143 12.424 8.854 562 1HB ASN 74 HB2 ASN 74 -8.896 11.508 6.610 563 2HB ASN 74 HB1 ASN 74 -7.397 12.428 6.608 564 1HD2 ASN 74 HD21 ASN 74 -6.475 11.544 4.839 565 2HD2 ASN 74 HD22 ASN 74 -5.999 9.881 4.728 566 H SER 75 HN SER 75 -7.381 9.003 9.022 567 HA SER 75 HA SER 75 -9.800 8.477 10.461 568 1HB SER 75 HB2 SER 75 -10.606 6.745 8.792 569 2HB SER 75 HB1 SER 75 -10.799 8.423 8.281 570 HG SER 75 HG SER 75 -8.547 7.979 7.333 571 H ALA 76 HN ALA 76 -10.025 5.956 10.678 572 HA ALA 76 HA ALA 76 -7.334 4.810 11.010 573 1HB ALA 76 HB1 ALA 76 -9.834 4.256 12.608 574 2HB ALA 76 HB2 ALA 76 -8.432 5.179 13.149 575 3HB ALA 76 HB3 ALA 76 -8.280 3.451 12.827 576 H TRP 77 HN TRP 77 -6.895 2.969 9.978 577 HA TRP 77 HA TRP 77 -9.105 1.568 8.622 578 1HB TRP 77 HB2 TRP 77 -6.322 2.226 7.683 579 2HB TRP 77 HB1 TRP 77 -7.221 0.891 6.975 580 HD1 TRP 77 HD1 TRP 77 -8.844 4.302 7.833 581 HE1 TRP 77 HE1 TRP 77 -9.642 5.378 5.623 582 HE3 TRP 77 HE3 TRP 77 -6.860 0.946 4.519 583 HZ2 TRP 77 HZ2 TRP 77 -9.445 4.865 2.863 584 HZ3 TRP 77 HZ3 TRP 77 -7.215 1.316 2.113 585 HH2 TRP 77 HH2 TRP 77 -8.476 3.237 1.307 586 H THR 78 HN THR 78 -8.946 -0.708 8.474 587 HA THR 78 HA THR 78 -7.520 -1.962 10.642 588 HB THR 78 HB THR 78 -9.237 -3.166 8.457 589 HG1 THR 78 HG1 THR 78 -9.773 -2.422 11.160 590 1HG2 THR 78 HG21 THR 78 -9.348 -5.146 9.905 591 2HG2 THR 78 HG22 THR 78 -8.204 -4.395 11.019 592 3HG2 THR 78 HG23 THR 78 -7.696 -4.821 9.383 593 H THR 79 HN THR 79 -5.449 -2.503 10.464 594 HA THR 79 HA THR 79 -4.276 -2.728 7.828 595 HB THR 79 HB THR 79 -3.047 -1.375 9.368 596 HG1 THR 79 HG1 THR 79 -1.884 -2.898 7.927 597 1HG2 THR 79 HG21 THR 79 -3.818 -2.338 11.478 598 2HG2 THR 79 HG22 THR 79 -2.057 -2.252 11.431 599 3HG2 THR 79 HG23 THR 79 -2.871 -3.794 11.170 600 H ASP 80 HN ASP 80 -4.383 -4.551 6.824 601 HA ASP 80 HA ASP 80 -3.433 -6.967 8.216 602 1HB ASP 80 HB2 ASP 80 -5.715 -7.113 7.110 603 2HB ASP 80 HB1 ASP 80 -4.908 -6.840 5.569 604 H ASN 81 HN ASN 81 -1.947 -8.310 6.733 605 HA ASN 81 HA ASN 81 -0.017 -6.425 5.684 606 1HB ASN 81 HB2 ASN 81 0.383 -8.708 7.029 607 2HB ASN 81 HB1 ASN 81 0.458 -9.344 5.392 608 1HD2 ASN 81 HD21 ASN 81 1.526 -6.760 4.379 609 2HD2 ASN 81 HD22 ASN 81 3.192 -6.745 4.857 610 H GLY 82 HN GLY 82 -2.540 -8.368 4.451 611 1HA GLY 82 HA2 GLY 82 -1.406 -8.288 1.746 612 2HA GLY 82 HA1 GLY 82 -2.804 -9.225 2.250 613 H VAL 83 HN VAL 83 -4.112 -7.084 3.639 614 HA VAL 83 HA VAL 83 -4.743 -5.265 1.424 615 HB VAL 83 HB VAL 83 -7.148 -5.445 1.943 616 1HG1 VAL 83 HG11 VAL 83 -5.837 -8.048 1.159 617 2HG1 VAL 83 HG12 VAL 83 -6.251 -6.716 0.080 618 3HG1 VAL 83 HG13 VAL 83 -7.528 -7.634 0.880 619 1HG2 VAL 83 HG21 VAL 83 -6.997 -6.235 4.241 620 2HG2 VAL 83 HG22 VAL 83 -6.311 -7.763 3.687 621 3HG2 VAL 83 HG23 VAL 83 -7.973 -7.340 3.273 622 H PHE 84 HN PHE 84 -5.835 -3.303 2.096 623 HA PHE 84 HA PHE 84 -5.613 -2.737 4.968 624 1HB PHE 84 HB2 PHE 84 -3.684 -1.880 3.239 625 2HB PHE 84 HB1 PHE 84 -4.811 -0.533 3.160 626 HD1 PHE 84 HD1 PHE 84 -5.659 0.282 5.563 627 HD2 PHE 84 HD2 PHE 84 -2.036 -1.802 4.785 628 HE1 PHE 84 HE1 PHE 84 -4.693 1.172 7.646 629 HE2 PHE 84 HE2 PHE 84 -1.069 -0.917 6.860 630 HZ PHE 84 HZ PHE 84 -2.398 0.575 8.296 631 H TYR 85 HN TYR 85 -7.711 -2.360 5.461 632 HA TYR 85 HA TYR 85 -9.194 -0.545 3.701 633 1HB TYR 85 HB2 TYR 85 -11.203 -1.917 3.798 634 2HB TYR 85 HB1 TYR 85 -9.891 -2.804 3.046 635 HD1 TYR 85 HD1 TYR 85 -12.542 -3.066 5.237 636 HD2 TYR 85 HD2 TYR 85 -8.475 -4.249 4.857 637 HE1 TYR 85 HE1 TYR 85 -12.955 -4.953 6.761 638 HE2 TYR 85 HE2 TYR 85 -8.878 -6.144 6.379 639 HH TYR 85 HH TYR 85 -10.495 -6.759 8.185 640 H LYS 86 HN LYS 86 -10.661 0.748 4.656 641 HA LYS 86 HA LYS 86 -10.422 1.126 7.476 642 1HB LYS 86 HB2 LYS 86 -12.133 2.908 7.118 643 2HB LYS 86 HB1 LYS 86 -10.713 3.073 6.104 644 1HG LYS 86 HG2 LYS 86 -11.875 2.405 4.174 645 2HG LYS 86 HG1 LYS 86 -13.225 1.761 5.113 646 1HD LYS 86 HD2 LYS 86 -13.722 4.055 5.890 647 2HD LYS 86 HD1 LYS 86 -12.436 4.658 4.850 648 1HE LYS 86 HE2 LYS 86 -14.653 3.008 3.687 649 2HE LYS 86 HE1 LYS 86 -14.903 4.719 4.042 650 1HZ LYS 86 HZ1 LYS 86 -12.800 3.611 2.280 651 2HZ LYS 86 HZ2 LYS 86 -13.024 5.248 2.642 652 3HZ LYS 86 HZ3 LYS 86 -14.211 4.406 1.780 653 H ASN 87 HN ASN 87 -12.014 0.857 9.048 654 HA ASN 87 HA ASN 87 -13.937 -1.231 8.612 655 1HB ASN 87 HB2 ASN 87 -12.744 -0.853 10.788 656 2HB ASN 87 HB1 ASN 87 -13.653 0.639 10.985 657 1HD2 ASN 87 HD21 ASN 87 -13.770 -2.829 11.056 658 2HD2 ASN 87 HD22 ASN 87 -15.328 -2.957 11.806 659 H ASP 88 HN ASP 88 -13.807 2.099 8.207 660 HA ASP 88 HA ASP 88 -16.606 2.693 8.433 661 1HB ASP 88 HB2 ASP 88 -14.965 4.439 8.830 662 2HB ASP 88 HB1 ASP 88 -14.283 4.219 7.223 663 H VAL 89 HN VAL 89 -17.970 3.270 6.657 664 HA VAL 89 HA VAL 89 -17.083 2.210 4.061 665 HB VAL 89 HB VAL 89 -19.418 1.587 3.543 666 1HG1 VAL 89 HG11 VAL 89 -17.898 -0.100 4.401 667 2HG1 VAL 89 HG12 VAL 89 -19.537 -0.392 4.974 668 3HG1 VAL 89 HG13 VAL 89 -18.340 0.316 6.057 669 1HG2 VAL 89 HG21 VAL 89 -19.956 2.270 6.437 670 2HG2 VAL 89 HG22 VAL 89 -21.081 1.460 5.347 671 3HG2 VAL 89 HG23 VAL 89 -20.589 3.124 5.031 672 H GLY 90 HN GLY 90 -17.275 3.538 2.355 673 1HA GLY 90 HA2 GLY 90 -18.879 5.456 1.567 674 2HA GLY 90 HA1 GLY 90 -18.161 6.268 2.953 675 H SER 91 HN SER 91 -17.847 7.460 0.568 676 HA SER 91 HA SER 91 -15.475 6.775 -0.792 677 1HB SER 91 HB2 SER 91 -15.550 9.205 -1.538 678 2HB SER 91 HB1 SER 91 -16.999 8.262 -1.882 679 HG SER 91 HG SER 91 -17.892 9.173 0.077 680 H TRP 92 HN TRP 92 -13.419 6.995 -0.202 681 HA TRP 92 HA TRP 92 -12.878 8.165 2.411 682 1HB TRP 92 HB2 TRP 92 -12.136 5.847 1.821 683 2HB TRP 92 HB1 TRP 92 -11.002 6.589 0.680 684 HD1 TRP 92 HD1 TRP 92 -11.806 6.656 4.469 685 HE1 TRP 92 HE1 TRP 92 -9.625 7.232 5.711 686 HE3 TRP 92 HE3 TRP 92 -8.831 7.421 0.437 687 HZ2 TRP 92 HZ2 TRP 92 -6.956 7.925 5.020 688 HZ3 TRP 92 HZ3 TRP 92 -6.515 8.045 0.782 689 HH2 TRP 92 HH2 TRP 92 -5.567 8.285 3.025 690 H GLY 93 HN GLY 93 -11.619 8.267 -0.861 691 1HA GLY 93 HA2 GLY 93 -10.047 9.707 -1.824 692 2HA GLY 93 HA1 GLY 93 -11.374 10.792 -1.514 693 H GLY 94 HN GLY 94 -8.267 9.659 -0.327 694 1HA GLY 94 HA2 GLY 94 -7.686 12.290 0.693 695 2HA GLY 94 HA1 GLY 94 -7.849 11.072 1.950 696 H THR 95 HN THR 95 -5.655 11.232 2.557 697 HA THR 95 HA THR 95 -3.801 10.126 0.560 698 HB THR 95 HB THR 95 -2.001 11.399 1.844 699 HG1 THR 95 HG1 THR 95 -2.624 13.008 3.185 700 1HG2 THR 95 HG21 THR 95 -4.082 12.947 0.298 701 2HG2 THR 95 HG22 THR 95 -2.710 12.072 -0.382 702 3HG2 THR 95 HG23 THR 95 -2.438 13.495 0.623 703 H ILE 96 HN ILE 96 -3.005 8.233 1.058 704 HA ILE 96 HA ILE 96 -2.484 7.594 3.882 705 HB ILE 96 HB ILE 96 -2.158 5.213 3.081 706 1HG1 ILE 96 HG12 ILE 96 -2.134 6.135 0.608 707 2HG1 ILE 96 HG11 ILE 96 -2.721 4.520 0.978 708 1HG2 ILE 96 HG21 ILE 96 -4.906 6.418 2.863 709 2HG2 ILE 96 HG22 ILE 96 -4.125 5.810 4.322 710 3HG2 ILE 96 HG23 ILE 96 -4.568 4.696 3.027 711 1HD1 ILE 96 HD11 ILE 96 -4.434 6.958 0.577 712 2HD1 ILE 96 HD12 ILE 96 -5.009 5.327 0.919 713 3HD1 ILE 96 HD13 ILE 96 -4.174 5.667 -0.595 714 H GLY 97 HN GLY 97 -0.403 6.167 4.071 715 1HA GLY 97 HA2 GLY 97 1.582 7.019 2.089 716 2HA GLY 97 HA1 GLY 97 1.826 7.478 3.768 717 H ILE 98 HN ILE 98 3.603 5.898 2.253 718 HA ILE 98 HA ILE 98 3.326 3.217 3.298 719 HB ILE 98 HB ILE 98 5.369 4.563 1.546 720 1HG1 ILE 98 HG12 ILE 98 4.816 2.548 0.106 721 2HG1 ILE 98 HG11 ILE 98 3.545 2.178 1.274 722 1HG2 ILE 98 HG21 ILE 98 6.656 3.237 3.149 723 2HG2 ILE 98 HG22 ILE 98 6.711 2.517 1.542 724 3HG2 ILE 98 HG23 ILE 98 5.669 1.824 2.783 725 1HD1 ILE 98 HD11 ILE 98 2.658 3.329 -0.672 726 2HD1 ILE 98 HD12 ILE 98 3.748 4.687 -0.381 727 3HD1 ILE 98 HD13 ILE 98 2.475 4.312 0.780 728 H TYR 99 HN TYR 99 3.707 2.913 5.348 729 HA TYR 99 HA TYR 99 6.040 4.190 6.610 730 1HB TYR 99 HB2 TYR 99 3.806 2.712 8.022 731 2HB TYR 99 HB1 TYR 99 5.028 3.745 8.741 732 HD1 TYR 99 HD1 TYR 99 4.469 5.904 9.311 733 HD2 TYR 99 HD2 TYR 99 2.151 3.913 6.365 734 HE1 TYR 99 HE1 TYR 99 2.884 7.774 9.310 735 HE2 TYR 99 HE2 TYR 99 0.569 5.789 6.343 736 HH TYR 99 HH TYR 99 -0.161 7.597 7.904 737 H VAL 100 HN VAL 100 7.772 2.852 6.959 738 HA VAL 100 HA VAL 100 7.577 0.089 6.257 739 HB VAL 100 HB VAL 100 9.690 1.454 6.017 740 1HG1 VAL 100 HG11 VAL 100 9.708 2.566 8.159 741 2HG1 VAL 100 HG12 VAL 100 11.162 1.578 7.991 742 3HG1 VAL 100 HG13 VAL 100 9.824 1.018 8.995 743 1HG2 VAL 100 HG21 VAL 100 9.869 -1.132 7.551 744 2HG2 VAL 100 HG22 VAL 100 11.172 -0.407 6.611 745 3HG2 VAL 100 HG23 VAL 100 9.704 -0.960 5.804 746 H ASP 101 HN ASP 101 7.404 -1.681 7.585 747 HA ASP 101 HA ASP 101 6.068 -1.217 10.047 748 1HB ASP 101 HB2 ASP 101 5.652 -3.149 8.489 749 2HB ASP 101 HB1 ASP 101 7.165 -3.851 9.054 750 H GLY 102 HN GLY 102 7.319 -0.223 11.554 751 1HA GLY 102 HA2 GLY 102 8.547 -0.307 13.491 752 2HA GLY 102 HA1 GLY 102 8.913 -1.985 13.136 753 H GLN 103 HN GLN 103 9.732 0.441 10.765 754 HA GLN 103 HA GLN 103 11.736 0.889 9.763 755 1HB GLN 103 HB2 GLN 103 11.865 2.278 11.881 756 2HB GLN 103 HB1 GLN 103 12.855 0.990 12.547 757 1HG GLN 103 HG2 GLN 103 14.456 1.304 10.698 758 2HG GLN 103 HG1 GLN 103 13.504 2.690 10.165 759 1HE2 GLN 103 HE21 GLN 103 15.594 1.428 12.635 760 2HE2 GLN 103 HE22 GLN 103 15.967 2.942 13.384 761 H GLN 104 HN GLN 104 12.487 -0.821 8.660 762 HA GLN 104 HA GLN 104 13.080 -3.287 9.926 763 1HB GLN 104 HB2 GLN 104 13.371 -2.276 7.109 764 2HB GLN 104 HB1 GLN 104 13.878 -3.897 7.573 765 1HG GLN 104 HG2 GLN 104 11.104 -2.806 7.975 766 2HG GLN 104 HG1 GLN 104 11.602 -3.766 6.585 767 1HE2 GLN 104 HE21 GLN 104 9.612 -4.280 8.688 768 2HE2 GLN 104 HE22 GLN 104 10.053 -5.803 9.381 769 H THR 105 HN THR 105 15.136 -1.054 8.071 770 HA THR 105 HA THR 105 17.488 -1.393 9.530 771 HB THR 105 HB THR 105 17.260 -3.316 7.196 772 HG1 THR 105 HG1 THR 105 16.905 -3.663 9.834 773 1HG2 THR 105 HG21 THR 105 19.410 -2.212 7.162 774 2HG2 THR 105 HG22 THR 105 19.598 -3.888 7.680 775 3HG2 THR 105 HG23 THR 105 19.653 -2.587 8.868 776 H ASN 106 HN ASN 106 16.378 -1.432 6.153 777 HA ASN 106 HA ASN 106 16.963 -0.286 4.299 778 1HB ASN 106 HB2 ASN 106 16.727 1.801 5.582 779 2HB ASN 106 HB1 ASN 106 18.379 1.632 6.165 780 1HD2 ASN 106 HD21 ASN 106 20.077 2.085 4.791 781 2HD2 ASN 106 HD22 ASN 106 19.870 2.908 3.276 782 H THR 107 HN THR 107 18.134 -2.231 3.911 783 HA THR 107 HA THR 107 20.999 -2.219 4.338 784 HB THR 107 HB THR 107 19.711 -4.163 2.480 785 HG1 THR 107 HG1 THR 107 18.439 -5.030 3.946 786 1HG2 THR 107 HG21 THR 107 22.082 -4.352 3.063 787 2HG2 THR 107 HG22 THR 107 21.172 -5.740 3.661 788 3HG2 THR 107 HG23 THR 107 21.657 -4.459 4.772 789 HA PRO 108 HA PRO 108 22.339 0.481 1.168 790 1HB PRO 108 HB2 PRO 108 23.805 -1.963 0.255 791 2HB PRO 108 HB1 PRO 108 24.391 -0.306 0.442 792 1HG PRO 108 HG2 PRO 108 24.696 -2.331 2.318 793 2HG PRO 108 HG1 PRO 108 24.829 -0.598 2.651 794 1HD PRO 108 HD2 PRO 108 22.862 -2.396 3.645 795 2HD PRO 108 HD1 PRO 108 22.896 -0.633 3.834 796 HA PRO 109 HA PRO 109 19.299 -1.292 -1.742 797 1HB PRO 109 HB2 PRO 109 17.940 1.203 -1.765 798 2HB PRO 109 HB1 PRO 109 17.468 -0.278 -0.934 799 1HG PRO 109 HG2 PRO 109 18.242 2.077 0.308 800 2HG PRO 109 HG1 PRO 109 18.231 0.478 1.066 801 1HD PRO 109 HD2 PRO 109 20.513 2.013 -0.089 802 2HD PRO 109 HD1 PRO 109 20.456 0.944 1.333 803 H GLY 110 HN GLY 110 18.003 0.418 -3.429 804 1HA GLY 110 HA2 GLY 110 19.737 2.052 -4.969 805 2HA GLY 110 HA1 GLY 110 19.556 0.456 -5.696 806 H ASN 111 HN ASN 111 17.436 -0.276 -6.245 807 HA ASN 111 HA ASN 111 15.405 1.851 -6.381 808 1HB ASN 111 HB2 ASN 111 16.510 1.283 -8.615 809 2HB ASN 111 HB1 ASN 111 15.738 -0.294 -8.484 810 1HD2 ASN 111 HD21 ASN 111 15.266 3.093 -8.987 811 2HD2 ASN 111 HD22 ASN 111 13.625 3.005 -9.507 812 H TYR 112 HN TYR 112 13.382 1.274 -5.771 813 HA TYR 112 HA TYR 112 12.881 -1.556 -5.139 814 1HB TYR 112 HB2 TYR 112 12.484 0.889 -3.468 815 2HB TYR 112 HB1 TYR 112 11.334 -0.427 -3.297 816 HD1 TYR 112 HD1 TYR 112 11.789 -2.115 -1.789 817 HD2 TYR 112 HD2 TYR 112 15.015 0.198 -3.302 818 HE1 TYR 112 HE1 TYR 112 13.325 -3.265 -0.255 819 HE2 TYR 112 HE2 TYR 112 16.561 -0.951 -1.780 820 HH TYR 112 HH TYR 112 15.595 -3.709 0.102 821 H THR 113 HN THR 113 10.851 -2.329 -5.580 822 HA THR 113 HA THR 113 9.051 -0.495 -7.021 823 HB THR 113 HB THR 113 9.695 -3.359 -7.741 824 HG1 THR 113 HG1 THR 113 10.921 -2.540 -9.332 825 1HG2 THR 113 HG21 THR 113 7.367 -2.789 -8.228 826 2HG2 THR 113 HG22 THR 113 8.292 -2.957 -9.719 827 3HG2 THR 113 HG23 THR 113 7.892 -1.354 -9.108 828 H LEU 114 HN LEU 114 7.264 -0.313 -5.824 829 HA LEU 114 HA LEU 114 6.077 -2.795 -4.808 830 1HB LEU 114 HB2 LEU 114 5.058 -1.335 -2.975 831 2HB LEU 114 HB1 LEU 114 6.747 -1.778 -2.824 832 HG LEU 114 HG LEU 114 6.115 0.826 -4.109 833 1HD1 LEU 114 HD11 LEU 114 5.942 1.928 -1.943 834 2HD1 LEU 114 HD12 LEU 114 6.004 0.364 -1.132 835 3HD1 LEU 114 HD13 LEU 114 4.630 0.770 -2.158 836 1HD2 LEU 114 HD21 LEU 114 8.251 -0.103 -2.196 837 2HD2 LEU 114 HD22 LEU 114 8.163 1.492 -2.942 838 3HD2 LEU 114 HD23 LEU 114 8.423 0.064 -3.943 839 H THR 115 HN THR 115 4.846 -2.976 -6.649 840 HA THR 115 HA THR 115 3.171 -0.900 -7.634 841 HB THR 115 HB THR 115 2.703 -3.837 -8.112 842 HG1 THR 115 HG1 THR 115 4.511 -3.982 -9.259 843 1HG2 THR 115 HG21 THR 115 2.083 -3.052 -10.350 844 2HG2 THR 115 HG22 THR 115 2.485 -1.398 -9.885 845 3HG2 THR 115 HG23 THR 115 1.136 -2.229 -9.109 846 H LEU 116 HN LEU 116 1.263 -0.238 -6.813 847 HA LEU 116 HA LEU 116 -0.058 -2.016 -4.869 848 1HB LEU 116 HB2 LEU 116 -0.123 0.995 -5.062 849 2HB LEU 116 HB1 LEU 116 -1.015 0.042 -3.892 850 HG LEU 116 HG LEU 116 1.992 0.235 -4.090 851 1HD1 LEU 116 HD11 LEU 116 0.056 1.345 -2.064 852 2HD1 LEU 116 HD12 LEU 116 0.975 2.274 -3.250 853 3HD1 LEU 116 HD13 LEU 116 1.816 1.418 -1.956 854 1HD2 LEU 116 HD21 LEU 116 0.262 -1.205 -2.082 855 2HD2 LEU 116 HD22 LEU 116 2.017 -1.044 -2.014 856 3HD2 LEU 116 HD23 LEU 116 1.267 -1.966 -3.315 857 H THR 117 HN THR 117 -1.912 -2.844 -5.469 858 HA THR 117 HA THR 117 -3.280 -1.770 -7.815 859 HB THR 117 HB THR 117 -3.929 -4.288 -6.271 860 HG1 THR 117 HG1 THR 117 -1.743 -3.813 -7.636 861 1HG2 THR 117 HG21 THR 117 -4.602 -3.385 -9.076 862 2HG2 THR 117 HG22 THR 117 -5.726 -3.529 -7.724 863 3HG2 THR 117 HG23 THR 117 -4.975 -4.971 -8.404 864 H GLY 118 HN GLY 118 -4.938 -0.443 -7.580 865 1HA GLY 118 HA2 GLY 118 -6.143 0.016 -5.015 866 2HA GLY 118 HA1 GLY 118 -6.584 0.785 -6.534 867 H GLY 119 HN GLY 119 -8.501 -0.010 -4.716 868 1HA GLY 119 HA2 GLY 119 -10.398 -1.203 -6.246 869 2HA GLY 119 HA1 GLY 119 -9.580 -2.558 -5.479 870 H TYR 120 HN TYR 120 -12.070 -2.504 -4.841 871 HA TYR 120 HA TYR 120 -12.155 -1.140 -2.244 872 1HB TYR 120 HB2 TYR 120 -14.589 -1.303 -2.315 873 2HB TYR 120 HB1 TYR 120 -13.976 -0.442 -3.717 874 HD1 TYR 120 HD1 TYR 120 -15.695 -3.444 -2.538 875 HD2 TYR 120 HD2 TYR 120 -14.142 -1.431 -5.965 876 HE1 TYR 120 HE1 TYR 120 -17.017 -4.909 -3.999 877 HE2 TYR 120 HE2 TYR 120 -15.467 -2.900 -7.428 878 HH TYR 120 HH TYR 120 -16.575 -5.005 -7.425 879 H TRP 121 HN TRP 121 -13.824 -2.427 -0.798 880 HA TRP 121 HA TRP 121 -13.164 -5.273 -0.840 881 1HB TRP 121 HB2 TRP 121 -11.406 -4.350 0.486 882 2HB TRP 121 HB1 TRP 121 -12.519 -3.300 1.351 883 HD1 TRP 121 HD1 TRP 121 -14.300 -4.617 2.982 884 HE1 TRP 121 HE1 TRP 121 -13.897 -6.643 4.496 885 HE3 TRP 121 HE3 TRP 121 -10.055 -6.472 0.772 886 HZ2 TRP 121 HZ2 TRP 121 -12.069 -8.724 4.720 887 HZ3 TRP 121 HZ3 TRP 121 -9.061 -8.512 1.756 888 HH2 TRP 121 HH2 TRP 121 -10.053 -9.602 3.662 889 H ALA 122 HN ALA 122 -14.753 -6.561 0.220 890 HA ALA 122 HA ALA 122 -17.074 -5.109 1.250 891 1HB ALA 122 HB1 ALA 122 -17.290 -7.104 -0.995 892 2HB ALA 122 HB2 ALA 122 -17.405 -5.352 -1.177 893 3HB ALA 122 HB3 ALA 122 -18.617 -6.224 -0.237 894 H LYS 123 HN LYS 123 -15.692 -6.353 3.023 895 HA LYS 123 HA LYS 123 -17.540 -7.838 4.369 896 1HB LYS 123 HB2 LYS 123 -16.991 -9.569 2.532 897 2HB LYS 123 HB1 LYS 123 -15.480 -9.806 3.398 898 1HG LYS 123 HG2 LYS 123 -16.997 -11.492 4.110 899 2HG LYS 123 HG1 LYS 123 -16.814 -10.346 5.437 900 1HD LYS 123 HD2 LYS 123 -19.079 -10.157 3.467 901 2HD LYS 123 HD1 LYS 123 -19.175 -11.178 4.899 902 1HE LYS 123 HE2 LYS 123 -18.642 -8.206 4.923 903 2HE LYS 123 HE1 LYS 123 -20.215 -8.949 5.202 904 1HZ LYS 123 HZ1 LYS 123 -19.027 -8.350 7.260 905 2HZ LYS 123 HZ2 LYS 123 -17.805 -9.463 6.873 906 3HZ LYS 123 HZ3 LYS 123 -19.385 -10.005 7.164 907 H ASP 124 HN ASP 124 -14.915 -9.724 4.959 908 HA ASP 124 HA ASP 124 -13.207 -7.899 6.298 909 1HB ASP 124 HB2 ASP 124 -13.696 -8.541 8.617 910 2HB ASP 124 HB1 ASP 124 -15.095 -7.787 7.863 911 H ASN 125 HN ASN 125 -11.346 -8.764 6.023 912 HA ASN 125 HA ASN 125 -9.562 -10.112 6.026 913 1HB ASN 125 HB2 ASN 125 -9.922 -10.409 8.308 914 2HB ASN 125 HB1 ASN 125 -11.223 -11.562 8.043 915 1HD2 ASN 125 HD21 ASN 125 -7.767 -11.054 7.845 916 2HD2 ASN 125 HD22 ASN 125 -7.321 -12.734 7.864 917 H LYS 126 HN LYS 126 -12.544 -11.820 5.322 918 HA LYS 126 HA LYS 126 -11.387 -14.187 4.345 919 1HB LYS 126 HB2 LYS 126 -13.541 -14.651 3.341 920 2HB LYS 126 HB1 LYS 126 -13.764 -13.980 4.947 921 1HG LYS 126 HG2 LYS 126 -15.304 -12.710 3.932 922 2HG LYS 126 HG1 LYS 126 -13.918 -11.733 3.445 923 1HD LYS 126 HD2 LYS 126 -13.797 -12.888 1.324 924 2HD LYS 126 HD1 LYS 126 -15.083 -13.993 1.816 925 1HE LYS 126 HE2 LYS 126 -16.649 -12.136 1.933 926 2HE LYS 126 HE1 LYS 126 -15.369 -11.006 1.489 927 1HZ LYS 126 HZ1 LYS 126 -15.152 -12.314 -0.626 928 2HZ LYS 126 HZ2 LYS 126 -16.624 -11.487 -0.455 929 3HZ LYS 126 HZ3 LYS 126 -16.557 -13.160 -0.185 930 H GLN 127 HN GLN 127 -10.967 -11.176 3.204 931 HA GLN 127 HA GLN 127 -9.921 -10.328 1.409 932 1HB GLN 127 HB2 GLN 127 -9.685 -13.228 0.679 933 2HB GLN 127 HB1 GLN 127 -9.166 -11.965 -0.430 934 1HG GLN 127 HG2 GLN 127 -7.694 -11.083 1.375 935 2HG GLN 127 HG1 GLN 127 -8.121 -12.503 2.337 936 1HE2 GLN 127 HE21 GLN 127 -7.395 -14.530 1.687 937 2HE2 GLN 127 HE22 GLN 127 -6.101 -14.726 0.553 938 H GLY 128 HN GLY 128 -12.610 -10.184 1.575 939 1HA GLY 128 HA2 GLY 128 -13.720 -10.659 -1.040 940 2HA GLY 128 HA1 GLY 128 -14.468 -9.738 0.261 941 H PHE 129 HN PHE 129 -11.565 -9.528 -1.775 942 HA PHE 129 HA PHE 129 -11.970 -6.619 -1.879 943 1HB PHE 129 HB2 PHE 129 -9.599 -6.452 -2.375 944 2HB PHE 129 HB1 PHE 129 -9.811 -7.463 -0.955 945 HD1 PHE 129 HD1 PHE 129 -9.383 -9.868 -1.069 946 HD2 PHE 129 HD2 PHE 129 -8.708 -7.336 -4.426 947 HE1 PHE 129 HE1 PHE 129 -8.012 -11.622 -2.114 948 HE2 PHE 129 HE2 PHE 129 -7.343 -9.091 -5.476 949 HZ PHE 129 HZ PHE 129 -6.992 -11.237 -4.322 950 H THR 130 HN THR 130 -11.981 -5.564 -3.883 951 HA THR 130 HA THR 130 -11.838 -7.277 -6.272 952 HB THR 130 HB THR 130 -13.802 -5.002 -5.969 953 HG1 THR 130 HG1 THR 130 -14.245 -7.819 -5.667 954 1HG2 THR 130 HG21 THR 130 -13.551 -7.241 -7.982 955 2HG2 THR 130 HG22 THR 130 -13.209 -5.534 -8.265 956 3HG2 THR 130 HG23 THR 130 -14.859 -6.058 -7.934 957 HA PRO 131 HA PRO 131 -8.775 -4.093 -7.205 958 1HB PRO 131 HB2 PRO 131 -8.627 -5.644 -9.721 959 2HB PRO 131 HB1 PRO 131 -7.340 -5.212 -8.590 960 1HG PRO 131 HG2 PRO 131 -8.255 -7.716 -8.750 961 2HG PRO 131 HG1 PRO 131 -7.788 -7.004 -7.194 962 1HD PRO 131 HD2 PRO 131 -10.523 -7.412 -8.351 963 2HD PRO 131 HD1 PRO 131 -9.958 -7.655 -6.684 964 H SER 132 HN SER 132 -9.430 -2.177 -7.892 965 HA SER 132 HA SER 132 -10.962 -1.918 -10.355 966 1HB SER 132 HB2 SER 132 -11.956 -0.949 -7.662 967 2HB SER 132 HB1 SER 132 -12.668 -0.490 -9.206 968 HG SER 132 HG SER 132 -13.869 -2.180 -8.746 969 H GLY 133 HN GLY 133 -10.947 0.241 -11.199 970 1HA GLY 133 HA2 GLY 133 -10.296 2.477 -11.298 971 2HA GLY 133 HA1 GLY 133 -9.511 2.292 -9.734 972 H THR 134 HN THR 134 -7.399 2.588 -9.834 973 HA THR 134 HA THR 134 -5.975 1.751 -12.275 974 HB THR 134 HB THR 134 -5.407 4.219 -10.624 975 HG1 THR 134 HG1 THR 134 -7.290 4.521 -11.827 976 1HG2 THR 134 HG21 THR 134 -3.906 4.817 -12.487 977 2HG2 THR 134 HG22 THR 134 -4.232 3.253 -13.234 978 3HG2 THR 134 HG23 THR 134 -3.401 3.333 -11.679 979 H THR 135 HN THR 135 -4.020 0.763 -12.010 980 HA THR 135 HA THR 135 -3.182 0.090 -9.297 981 HB THR 135 HB THR 135 -1.931 -0.826 -11.893 982 HG1 THR 135 HG1 THR 135 -4.118 -1.439 -11.916 983 1HG2 THR 135 HG21 THR 135 -1.178 -2.728 -10.544 984 2HG2 THR 135 HG22 THR 135 -1.957 -2.030 -9.122 985 3HG2 THR 135 HG23 THR 135 -0.595 -1.202 -9.879 986 H GLY 136 HN GLY 136 -1.819 1.455 -8.322 987 1HA GLY 136 HA2 GLY 136 -0.129 3.196 -9.970 988 2HA GLY 136 HA1 GLY 136 -0.521 3.443 -8.274 989 H THR 137 HN THR 137 1.976 2.871 -10.182 990 HA THR 137 HA THR 137 3.216 0.789 -8.546 991 HB THR 137 HB THR 137 4.369 2.212 -10.957 992 HG1 THR 137 HG1 THR 137 2.373 0.951 -11.327 993 1HG2 THR 137 HG21 THR 137 5.840 0.231 -11.061 994 2HG2 THR 137 HG22 THR 137 5.116 -0.368 -9.568 995 3HG2 THR 137 HG23 THR 137 6.045 1.131 -9.558 996 H THR 138 HN THR 138 3.755 1.726 -6.620 997 HA THR 138 HA THR 138 5.120 4.257 -6.532 998 HB THR 138 HB THR 138 4.848 2.226 -4.306 999 HG1 THR 138 HG1 THR 138 2.777 2.736 -4.708 1000 1HG2 THR 138 HG21 THR 138 5.133 4.182 -2.848 1001 2HG2 THR 138 HG22 THR 138 5.354 5.205 -4.267 1002 3HG2 THR 138 HG23 THR 138 6.531 3.947 -3.895 1003 H LYS 139 HN LYS 139 7.207 4.504 -6.943 1004 HA LYS 139 HA LYS 139 8.943 2.137 -6.734 1005 1HB LYS 139 HB2 LYS 139 8.559 2.943 -9.056 1006 2HB LYS 139 HB1 LYS 139 9.256 4.492 -8.608 1007 1HG LYS 139 HG2 LYS 139 11.401 3.536 -8.283 1008 2HG LYS 139 HG1 LYS 139 10.755 1.897 -8.378 1009 1HD LYS 139 HD2 LYS 139 10.613 3.858 -10.659 1010 2HD LYS 139 HD1 LYS 139 11.949 2.731 -10.442 1011 1HE LYS 139 HE2 LYS 139 9.059 1.911 -10.669 1012 2HE LYS 139 HE1 LYS 139 10.187 1.947 -12.023 1013 1HZ LYS 139 HZ1 LYS 139 10.524 0.301 -9.569 1014 2HZ LYS 139 HZ2 LYS 139 11.546 0.304 -10.915 1015 3HZ LYS 139 HZ3 LYS 139 9.961 -0.273 -11.061 1016 H LEU 140 HN LEU 140 10.424 2.228 -5.274 1017 HA LEU 140 HA LEU 140 10.991 4.824 -4.029 1018 1HB LEU 140 HB2 LEU 140 9.979 3.659 -2.366 1019 2HB LEU 140 HB1 LEU 140 10.475 2.098 -2.976 1020 HG LEU 140 HG LEU 140 12.758 2.545 -2.063 1021 1HD1 LEU 140 HD11 LEU 140 11.408 4.917 -0.790 1022 2HD1 LEU 140 HD12 LEU 140 12.653 4.980 -2.038 1023 3HD1 LEU 140 HD13 LEU 140 13.036 4.337 -0.442 1024 1HD2 LEU 140 HD21 LEU 140 10.491 2.663 -0.084 1025 2HD2 LEU 140 HD22 LEU 140 12.141 2.146 0.261 1026 3HD2 LEU 140 HD23 LEU 140 11.136 1.205 -0.842 1027 H THR 141 HN THR 141 12.710 5.446 -5.184 1028 HA THR 141 HA THR 141 15.059 3.751 -5.473 1029 HB THR 141 HB THR 141 14.773 6.653 -6.285 1030 HG1 THR 141 HG1 THR 141 13.539 6.057 -7.897 1031 1HG2 THR 141 HG21 THR 141 16.444 6.063 -7.978 1032 2HG2 THR 141 HG22 THR 141 16.478 4.405 -7.376 1033 3HG2 THR 141 HG23 THR 141 17.044 5.726 -6.353 1034 H VAL 142 HN VAL 142 17.062 4.204 -4.382 1035 HA VAL 142 HA VAL 142 16.823 6.252 -2.281 1036 HB VAL 142 HB VAL 142 17.480 4.059 -1.454 1037 1HG1 VAL 142 HG11 VAL 142 18.598 3.164 -3.403 1038 2HG1 VAL 142 HG12 VAL 142 19.682 3.110 -2.013 1039 3HG1 VAL 142 HG13 VAL 142 19.886 4.356 -3.244 1040 1HG2 VAL 142 HG21 VAL 142 19.496 4.722 -0.214 1041 2HG2 VAL 142 HG22 VAL 142 18.292 6.009 -0.267 1042 3HG2 VAL 142 HG23 VAL 142 19.708 6.084 -1.315 1043 H THR 143 HN THR 143 17.772 8.132 -2.504 1044 HA THR 143 HA THR 143 20.327 8.426 -3.806 1045 HB THR 143 HB THR 143 17.934 9.895 -4.955 1046 HG1 THR 143 HG1 THR 143 18.888 7.480 -5.534 1047 1HG2 THR 143 HG21 THR 143 20.846 9.928 -5.761 1048 2HG2 THR 143 HG22 THR 143 19.986 11.235 -4.946 1049 3HG2 THR 143 HG23 THR 143 19.536 10.771 -6.588 Start of MODEL 2 1 H GLU 1 H GLU 1 -23.566 2.735 -9.136 2 HA GLU 1 HA GLU 1 -21.805 2.643 -7.550 3 1HB GLU 1 HB2 GLU 1 -23.136 -0.047 -7.919 4 2HB GLU 1 HB1 GLU 1 -22.328 0.484 -6.452 5 1HG GLU 1 HG2 GLU 1 -23.949 2.265 -6.177 6 2HG GLU 1 HG1 GLU 1 -24.743 1.792 -7.681 7 H GLU 2 HN GLU 2 -19.797 2.846 -8.580 8 HA GLU 2 HA GLU 2 -18.216 0.420 -8.422 9 1HB GLU 2 HB2 GLU 2 -18.909 0.552 -10.813 10 2HB GLU 2 HB1 GLU 2 -18.194 2.153 -10.887 11 1HG GLU 2 HG2 GLU 2 -16.002 1.187 -10.358 12 2HG GLU 2 HG1 GLU 2 -16.727 -0.421 -10.385 13 H CYS 3 HN CYS 3 -17.050 1.235 -6.776 14 HA CYS 3 HA CYS 3 -16.191 3.992 -6.851 15 1HB CYS 3 HB2 CYS 3 -17.016 2.907 -4.736 16 2HB CYS 3 HB1 CYS 3 -15.531 1.959 -4.724 17 H GLN 4 HN GLN 4 -14.639 4.270 -8.309 18 HA GLN 4 HA GLN 4 -12.383 2.456 -8.427 19 1HB GLN 4 HB2 GLN 4 -13.067 4.973 -9.941 20 2HB GLN 4 HB1 GLN 4 -11.550 4.110 -10.154 21 1HG GLN 4 HG2 GLN 4 -12.848 2.098 -10.793 22 2HG GLN 4 HG1 GLN 4 -14.316 3.073 -10.710 23 1HE2 GLN 4 HE21 GLN 4 -14.709 2.666 -12.907 24 2HE2 GLN 4 HE22 GLN 4 -13.814 3.492 -14.143 25 H VAL 5 HN VAL 5 -10.380 2.843 -7.683 26 HA VAL 5 HA VAL 5 -9.965 5.345 -6.192 27 HB VAL 5 HB VAL 5 -9.836 3.483 -4.676 28 1HG1 VAL 5 HG11 VAL 5 -7.860 2.247 -6.582 29 2HG1 VAL 5 HG12 VAL 5 -9.505 1.691 -6.271 30 3HG1 VAL 5 HG13 VAL 5 -8.292 1.613 -4.994 31 1HG2 VAL 5 HG21 VAL 5 -7.051 4.389 -5.398 32 2HG2 VAL 5 HG22 VAL 5 -7.523 3.642 -3.873 33 3HG2 VAL 5 HG23 VAL 5 -8.173 5.220 -4.318 34 H ARG 6 HN ARG 6 -8.521 6.716 -7.017 35 HA ARG 6 HA ARG 6 -6.802 5.763 -9.170 36 1HB ARG 6 HB2 ARG 6 -7.637 8.540 -8.348 37 2HB ARG 6 HB1 ARG 6 -6.414 8.230 -9.576 38 1HG ARG 6 HG2 ARG 6 -8.080 6.922 -10.848 39 2HG ARG 6 HG1 ARG 6 -9.294 7.366 -9.650 40 1HD ARG 6 HD2 ARG 6 -9.069 9.695 -10.210 41 2HD ARG 6 HD1 ARG 6 -7.724 9.342 -11.298 42 HE ARG 6 HE ARG 6 -9.876 7.819 -12.161 43 1HH1 ARG 6 HH11 ARG 6 -9.110 11.237 -11.862 44 2HH1 ARG 6 HH12 ARG 6 -10.142 11.695 -13.188 45 1HH2 ARG 6 HH21 ARG 6 -11.178 8.414 -13.896 46 2HH2 ARG 6 HH22 ARG 6 -11.301 10.088 -14.359 47 H VAL 7 HN VAL 7 -5.009 4.937 -8.454 48 HA VAL 7 HA VAL 7 -3.510 6.312 -6.331 49 HB VAL 7 HB VAL 7 -3.094 3.531 -7.458 50 1HG1 VAL 7 HG11 VAL 7 -1.043 4.516 -6.565 51 2HG1 VAL 7 HG12 VAL 7 -1.612 3.199 -5.539 52 3HG1 VAL 7 HG13 VAL 7 -1.867 4.874 -5.048 53 1HG2 VAL 7 HG21 VAL 7 -4.007 2.753 -5.297 54 2HG2 VAL 7 HG22 VAL 7 -5.191 3.629 -6.268 55 3HG2 VAL 7 HG23 VAL 7 -4.413 4.422 -4.897 56 H GLY 8 HN GLY 8 -1.960 7.633 -7.023 57 1HA GLY 8 HA2 GLY 8 -1.024 7.538 -9.743 58 2HA GLY 8 HA1 GLY 8 -0.528 8.684 -8.506 59 H ASP 9 HN ASP 9 1.087 7.206 -10.449 60 HA ASP 9 HA ASP 9 2.532 5.190 -9.022 61 1HB ASP 9 HB2 ASP 9 3.370 6.746 -11.481 62 2HB ASP 9 HB1 ASP 9 4.113 5.265 -10.889 63 H LEU 10 HN LEU 10 3.770 5.649 -7.336 64 HA LEU 10 HA LEU 10 4.891 8.329 -7.061 65 1HB LEU 10 HB2 LEU 10 4.663 6.023 -5.138 66 2HB LEU 10 HB1 LEU 10 5.467 7.531 -4.750 67 HG LEU 10 HG LEU 10 2.542 7.234 -5.441 68 1HD1 LEU 10 HD11 LEU 10 3.137 6.246 -3.284 69 2HD1 LEU 10 HD12 LEU 10 2.158 7.698 -3.087 70 3HD1 LEU 10 HD13 LEU 10 3.897 7.761 -2.802 71 1HD2 LEU 10 HD21 LEU 10 4.109 9.630 -4.483 72 2HD2 LEU 10 HD22 LEU 10 2.365 9.562 -4.721 73 3HD2 LEU 10 HD23 LEU 10 3.449 9.409 -6.104 74 H THR 11 HN THR 11 6.652 8.252 -8.501 75 HA THR 11 HA THR 11 8.797 6.395 -7.787 76 HB THR 11 HB THR 11 8.843 8.574 -9.888 77 HG1 THR 11 HG1 THR 11 7.397 6.392 -9.896 78 1HG2 THR 11 HG21 THR 11 10.704 7.283 -10.819 79 2HG2 THR 11 HG22 THR 11 10.565 6.119 -9.501 80 3HG2 THR 11 HG23 THR 11 11.052 7.780 -9.164 81 H VAL 12 HN VAL 12 10.065 6.957 -6.133 82 HA VAL 12 HA VAL 12 10.647 9.810 -5.711 83 HB VAL 12 HB VAL 12 10.103 7.960 -3.392 84 1HG1 VAL 12 HG11 VAL 12 9.827 10.038 -2.152 85 2HG1 VAL 12 HG12 VAL 12 10.144 10.961 -3.621 86 3HG1 VAL 12 HG13 VAL 12 11.411 9.954 -2.923 87 1HG2 VAL 12 HG21 VAL 12 8.041 8.069 -4.700 88 2HG2 VAL 12 HG22 VAL 12 8.124 9.831 -4.694 89 3HG2 VAL 12 HG23 VAL 12 7.875 8.955 -3.184 90 H ALA 13 HN ALA 13 12.671 10.256 -4.927 91 HA ALA 13 HA ALA 13 14.516 7.981 -4.765 92 1HB ALA 13 HB1 ALA 13 15.092 10.928 -5.072 93 2HB ALA 13 HB2 ALA 13 15.073 9.741 -6.377 94 3HB ALA 13 HB3 ALA 13 16.285 9.630 -5.100 95 H LYS 14 HN LYS 14 14.364 7.247 -2.706 96 HA LYS 14 HA LYS 14 15.179 9.024 -0.535 97 1HB LYS 14 HB2 LYS 14 12.581 7.475 -0.579 98 2HB LYS 14 HB1 LYS 14 13.323 8.033 0.909 99 1HG LYS 14 HG2 LYS 14 12.608 9.928 -1.303 100 2HG LYS 14 HG1 LYS 14 11.434 9.423 -0.088 101 1HD LYS 14 HD2 LYS 14 12.255 11.363 0.848 102 2HD LYS 14 HD1 LYS 14 13.298 10.153 1.595 103 1HE LYS 14 HE2 LYS 14 14.974 10.590 -0.186 104 2HE LYS 14 HE1 LYS 14 13.945 11.895 -0.774 105 1HZ LYS 14 HZ1 LYS 14 15.612 12.829 0.629 106 2HZ LYS 14 HZ2 LYS 14 15.292 11.717 1.861 107 3HZ LYS 14 HZ3 LYS 14 14.145 12.907 1.483 108 H THR 15 HN THR 15 15.445 7.696 1.532 109 HA THR 15 HA THR 15 16.419 4.997 0.890 110 HB THR 15 HB THR 15 17.615 5.181 3.100 111 HG1 THR 15 HG1 THR 15 17.639 7.115 4.153 112 1HG2 THR 15 HG21 THR 15 18.793 5.617 1.007 113 2HG2 THR 15 HG22 THR 15 19.367 6.693 2.280 114 3HG2 THR 15 HG23 THR 15 18.263 7.298 1.046 115 H ARG 16 HN ARG 16 16.131 3.408 2.841 116 HA ARG 16 HA ARG 16 13.314 3.554 3.606 117 1HB ARG 16 HB2 ARG 16 15.282 1.303 4.133 118 2HB ARG 16 HB1 ARG 16 13.551 1.262 4.459 119 1HG ARG 16 HG2 ARG 16 13.763 0.069 2.474 120 2HG ARG 16 HG1 ARG 16 13.268 1.681 1.947 121 1HD ARG 16 HD2 ARG 16 15.777 2.163 1.699 122 2HD ARG 16 HD1 ARG 16 15.983 0.417 1.790 123 HE ARG 16 HE ARG 16 14.708 0.227 -0.222 124 1HH1 ARG 16 HH11 ARG 16 15.659 3.451 0.660 125 2HH1 ARG 16 HH12 ARG 16 15.473 4.117 -0.931 126 1HH2 ARG 16 HH21 ARG 16 14.458 1.079 -2.375 127 2HH2 ARG 16 HH22 ARG 16 14.785 2.756 -2.661 128 H GLY 17 HN GLY 17 16.400 4.208 4.823 129 1HA GLY 17 HA2 GLY 17 15.916 4.056 7.603 130 2HA GLY 17 HA1 GLY 17 17.100 5.097 6.822 131 H GLN 18 HN GLN 18 14.959 6.328 5.166 132 HA GLN 18 HA GLN 18 14.141 8.499 6.723 133 1HB GLN 18 HB2 GLN 18 14.109 8.674 4.330 134 2HB GLN 18 HB1 GLN 18 13.030 7.296 4.180 135 1HG GLN 18 HG2 GLN 18 11.750 9.241 3.749 136 2HG GLN 18 HG1 GLN 18 11.276 8.639 5.337 137 1HE2 GLN 18 HE21 GLN 18 11.821 9.800 7.172 138 2HE2 GLN 18 HE22 GLN 18 12.351 11.447 7.099 139 H LEU 19 HN LEU 19 12.802 5.342 6.237 140 HA LEU 19 HA LEU 19 10.333 6.032 7.634 141 1HB LEU 19 HB2 LEU 19 10.997 3.314 6.553 142 2HB LEU 19 HB1 LEU 19 9.424 4.052 6.795 143 HG LEU 19 HG LEU 19 11.393 4.869 4.655 144 1HD1 LEU 19 HD11 LEU 19 9.851 3.780 3.104 145 2HD1 LEU 19 HD12 LEU 19 8.878 3.218 4.463 146 3HD1 LEU 19 HD13 LEU 19 10.528 2.629 4.257 147 1HD2 LEU 19 HD21 LEU 19 8.520 5.649 5.115 148 2HD2 LEU 19 HD22 LEU 19 9.519 6.130 3.742 149 3HD2 LEU 19 HD23 LEU 19 9.927 6.682 5.369 150 H THR 20 HN THR 20 10.649 6.035 9.778 151 HA THR 20 HA THR 20 12.158 3.825 10.963 152 HB THR 20 HB THR 20 13.157 5.903 11.601 153 HG1 THR 20 HG1 THR 20 11.529 4.905 13.719 154 1HG2 THR 20 HG21 THR 20 11.297 7.410 11.115 155 2HG2 THR 20 HG22 THR 20 11.944 7.701 12.730 156 3HG2 THR 20 HG23 THR 20 10.433 6.812 12.532 157 H ASP 21 HN ASP 21 10.232 2.588 10.483 158 HA ASP 21 HA ASP 21 8.346 1.485 11.027 159 1HB ASP 21 HB2 ASP 21 9.118 1.275 13.289 160 2HB ASP 21 HB1 ASP 21 8.677 2.941 13.654 161 H ALA 22 HN ALA 22 7.592 4.471 12.807 162 HA ALA 22 HA ALA 22 5.278 4.762 11.024 163 1HB ALA 22 HB1 ALA 22 4.777 4.576 13.412 164 2HB ALA 22 HB2 ALA 22 4.290 6.142 12.768 165 3HB ALA 22 HB3 ALA 22 5.760 6.004 13.734 166 H ALA 23 HN ALA 23 7.166 5.496 9.591 167 HA ALA 23 HA ALA 23 6.896 8.398 9.433 168 1HB ALA 23 HB1 ALA 23 9.099 8.052 10.460 169 2HB ALA 23 HB2 ALA 23 9.253 8.692 8.824 170 3HB ALA 23 HB3 ALA 23 9.551 6.981 9.135 171 HA PRO 24 HA PRO 24 5.963 6.797 5.384 172 1HB PRO 24 HB2 PRO 24 4.379 8.790 4.638 173 2HB PRO 24 HB1 PRO 24 3.892 7.694 5.934 174 1HG PRO 24 HG2 PRO 24 4.974 10.472 6.098 175 2HG PRO 24 HG1 PRO 24 3.709 9.703 7.073 176 1HD PRO 24 HD2 PRO 24 6.393 9.996 7.812 177 2HD PRO 24 HD1 PRO 24 5.225 8.898 8.562 178 H ILE 25 HN ILE 25 6.277 7.400 3.192 179 HA ILE 25 HA ILE 25 8.089 9.683 2.740 180 HB ILE 25 HB ILE 25 8.563 8.270 0.555 181 1HG1 ILE 25 HG12 ILE 25 7.938 6.133 2.592 182 2HG1 ILE 25 HG11 ILE 25 6.958 6.511 1.181 183 1HG2 ILE 25 HG21 ILE 25 10.266 9.021 2.089 184 2HG2 ILE 25 HG22 ILE 25 10.550 7.332 1.664 185 3HG2 ILE 25 HG23 ILE 25 9.842 7.744 3.228 186 1HD1 ILE 25 HD11 ILE 25 8.808 5.871 -0.277 187 2HD1 ILE 25 HD12 ILE 25 8.338 4.551 0.796 188 3HD1 ILE 25 HD13 ILE 25 9.788 5.493 1.140 189 H GLY 26 HN GLY 26 5.754 7.606 1.029 190 1HA GLY 26 HA2 GLY 26 4.932 9.984 -0.507 191 2HA GLY 26 HA1 GLY 26 4.935 8.351 -1.157 192 HA PRO 27 HA PRO 27 0.992 8.942 1.492 193 1HB PRO 27 HB2 PRO 27 0.122 11.492 1.698 194 2HB PRO 27 HB1 PRO 27 1.204 10.762 2.890 195 1HG PRO 27 HG2 PRO 27 1.807 12.681 0.695 196 2HG PRO 27 HG1 PRO 27 2.539 12.546 2.301 197 1HD PRO 27 HD2 PRO 27 3.652 11.589 -0.066 198 2HD PRO 27 HD1 PRO 27 4.111 11.077 1.564 199 H VAL 28 HN VAL 28 -0.087 8.022 -0.195 200 HA VAL 28 HA VAL 28 -0.635 9.419 -2.644 201 HB VAL 28 HB VAL 28 -2.034 6.934 -1.657 202 1HG1 VAL 28 HG11 VAL 28 -2.311 6.455 -4.041 203 2HG1 VAL 28 HG12 VAL 28 -1.512 7.977 -4.434 204 3HG1 VAL 28 HG13 VAL 28 -3.058 7.987 -3.585 205 1HG2 VAL 28 HG21 VAL 28 0.580 7.114 -3.144 206 2HG2 VAL 28 HG22 VAL 28 -0.335 5.633 -2.870 207 3HG2 VAL 28 HG23 VAL 28 0.339 6.516 -1.502 208 H THR 29 HN THR 29 -2.258 10.808 -2.989 209 HA THR 29 HA THR 29 -4.281 11.138 -0.966 210 HB THR 29 HB THR 29 -3.393 13.158 -1.904 211 HG1 THR 29 HG1 THR 29 -5.837 12.789 -1.559 212 1HG2 THR 29 HG21 THR 29 -4.392 12.220 -4.594 213 2HG2 THR 29 HG22 THR 29 -2.703 12.334 -4.101 214 3HG2 THR 29 HG23 THR 29 -3.682 13.795 -4.246 215 H VAL 30 HN VAL 30 -5.317 9.162 -1.084 216 HA VAL 30 HA VAL 30 -6.458 8.100 -3.457 217 HB VAL 30 HB VAL 30 -7.112 7.558 -0.556 218 1HG1 VAL 30 HG11 VAL 30 -8.994 6.941 -1.963 219 2HG1 VAL 30 HG12 VAL 30 -8.180 5.498 -1.361 220 3HG1 VAL 30 HG13 VAL 30 -7.924 6.027 -3.025 221 1HG2 VAL 30 HG21 VAL 30 -5.774 5.521 -0.898 222 2HG2 VAL 30 HG22 VAL 30 -4.822 6.985 -1.149 223 3HG2 VAL 30 HG23 VAL 30 -5.396 6.056 -2.534 224 H GLN 31 HN GLN 31 -8.042 9.044 -4.534 225 HA GLN 31 HA GLN 31 -10.246 10.229 -3.006 226 1HB GLN 31 HB2 GLN 31 -10.844 11.437 -5.065 227 2HB GLN 31 HB1 GLN 31 -9.216 11.822 -4.528 228 1HG GLN 31 HG2 GLN 31 -8.350 10.213 -6.211 229 2HG GLN 31 HG1 GLN 31 -9.998 10.016 -6.803 230 1HE2 GLN 31 HE21 GLN 31 -10.586 12.866 -6.242 231 2HE2 GLN 31 HE22 GLN 31 -9.835 13.749 -7.526 232 H ALA 32 HN ALA 32 -12.234 9.372 -3.179 233 HA ALA 32 HA ALA 32 -12.393 6.853 -4.668 234 1HB ALA 32 HB1 ALA 32 -12.723 6.724 -2.244 235 2HB ALA 32 HB2 ALA 32 -14.168 6.232 -3.125 236 3HB ALA 32 HB3 ALA 32 -14.092 7.827 -2.374 237 H LEU 33 HN LEU 33 -13.722 6.649 -6.366 238 HA LEU 33 HA LEU 33 -15.628 8.832 -6.876 239 1HB LEU 33 HB2 LEU 33 -14.442 6.834 -8.805 240 2HB LEU 33 HB1 LEU 33 -15.509 8.155 -9.230 241 HG LEU 33 HG LEU 33 -12.717 8.447 -8.119 242 1HD1 LEU 33 HD11 LEU 33 -12.155 9.271 -10.349 243 2HD1 LEU 33 HD12 LEU 33 -13.799 8.925 -10.892 244 3HD1 LEU 33 HD13 LEU 33 -12.734 7.606 -10.406 245 1HD2 LEU 33 HD21 LEU 33 -14.204 10.271 -7.438 246 2HD2 LEU 33 HD22 LEU 33 -14.640 10.540 -9.125 247 3HD2 LEU 33 HD23 LEU 33 -12.984 10.818 -8.587 248 H GLY 34 HN GLY 34 -17.634 8.291 -6.239 249 1HA GLY 34 HA2 GLY 34 -19.651 7.194 -6.213 250 2HA GLY 34 HA1 GLY 34 -19.047 6.226 -7.548 251 H CYS 35 HN CYS 35 -18.396 6.560 -4.052 252 HA CYS 35 HA CYS 35 -17.880 3.706 -3.885 253 1HB CYS 35 HB2 CYS 35 -17.167 6.045 -2.350 254 2HB CYS 35 HB1 CYS 35 -17.825 4.792 -1.306 255 H ASN 36 HN ASN 36 -19.797 5.866 -1.807 256 HA ASN 36 HA ASN 36 -21.779 5.662 -0.754 257 1HB ASN 36 HB2 ASN 36 -22.302 3.425 -2.714 258 2HB ASN 36 HB1 ASN 36 -23.501 4.109 -1.626 259 1HD2 ASN 36 HD21 ASN 36 -23.582 3.958 -4.474 260 2HD2 ASN 36 HD22 ASN 36 -23.689 5.583 -5.068 261 H ALA 37 HN ALA 37 -20.736 2.353 -1.529 262 HA ALA 37 HA ALA 37 -20.661 1.722 1.320 263 1HB ALA 37 HB1 ALA 37 -22.928 1.116 0.621 264 2HB ALA 37 HB2 ALA 37 -21.982 -0.322 1.011 265 3HB ALA 37 HB3 ALA 37 -22.265 0.116 -0.673 266 H ARG 38 HN ARG 38 -18.399 1.919 0.586 267 HA ARG 38 HA ARG 38 -17.402 -0.693 -0.246 268 1HB ARG 38 HB2 ARG 38 -17.485 0.588 -2.301 269 2HB ARG 38 HB1 ARG 38 -16.659 1.934 -1.533 270 1HG ARG 38 HG2 ARG 38 -15.210 -0.630 -1.530 271 2HG ARG 38 HG1 ARG 38 -15.447 0.128 -3.106 272 1HD ARG 38 HD2 ARG 38 -14.517 2.236 -2.134 273 2HD ARG 38 HD1 ARG 38 -14.132 1.333 -0.672 274 HE ARG 38 HE ARG 38 -12.702 -0.082 -2.178 275 1HH1 ARG 38 HH11 ARG 38 -13.457 3.242 -2.962 276 2HH1 ARG 38 HH12 ARG 38 -12.008 3.494 -3.877 277 1HH2 ARG 38 HH21 ARG 38 -10.765 0.249 -3.379 278 2HH2 ARG 38 HH22 ARG 38 -10.482 1.795 -4.115 279 H GLN 39 HN GLN 39 -15.731 -1.350 1.003 280 HA GLN 39 HA GLN 39 -14.509 0.543 2.821 281 1HB GLN 39 HB2 GLN 39 -13.758 -2.361 2.516 282 2HB GLN 39 HB1 GLN 39 -13.603 -1.335 3.937 283 1HG GLN 39 HG2 GLN 39 -16.119 -1.227 3.986 284 2HG GLN 39 HG1 GLN 39 -16.112 -2.496 2.765 285 1HE2 GLN 39 HE21 GLN 39 -13.867 -2.186 5.439 286 2HE2 GLN 39 HE22 GLN 39 -14.363 -3.632 6.263 287 H VAL 40 HN VAL 40 -12.986 1.789 1.973 288 HA VAL 40 HA VAL 40 -11.583 1.229 -0.400 289 HB VAL 40 HB VAL 40 -10.770 3.174 1.771 290 1HG1 VAL 40 HG11 VAL 40 -9.664 4.383 -0.053 291 2HG1 VAL 40 HG12 VAL 40 -10.137 3.114 -1.181 292 3HG1 VAL 40 HG13 VAL 40 -9.016 2.753 0.130 293 1HG2 VAL 40 HG21 VAL 40 -12.596 3.593 -0.597 294 2HG2 VAL 40 HG22 VAL 40 -12.031 4.854 0.500 295 3HG2 VAL 40 HG23 VAL 40 -13.077 3.566 1.099 296 H ALA 41 HN ALA 41 -10.161 -0.377 -0.599 297 HA ALA 41 HA ALA 41 -8.255 -0.864 1.550 298 1HB ALA 41 HB1 ALA 41 -9.978 -2.609 1.552 299 2HB ALA 41 HB2 ALA 41 -8.405 -3.253 1.081 300 3HB ALA 41 HB3 ALA 41 -9.635 -2.943 -0.146 301 H LEU 42 HN LEU 42 -6.188 -1.092 0.902 302 HA LEU 42 HA LEU 42 -5.693 -0.900 -1.980 303 1HB LEU 42 HB2 LEU 42 -3.789 -0.402 0.308 304 2HB LEU 42 HB1 LEU 42 -3.495 -0.064 -1.388 305 HG LEU 42 HG LEU 42 -5.538 1.311 0.359 306 1HD1 LEU 42 HD11 LEU 42 -3.257 1.944 0.897 307 2HD1 LEU 42 HD12 LEU 42 -4.092 3.266 0.082 308 3HD1 LEU 42 HD13 LEU 42 -2.932 2.277 -0.804 309 1HD2 LEU 42 HD21 LEU 42 -6.284 1.121 -1.969 310 2HD2 LEU 42 HD22 LEU 42 -4.766 1.830 -2.515 311 3HD2 LEU 42 HD23 LEU 42 -5.890 2.789 -1.554 312 H LYS 43 HN LYS 43 -4.870 -2.570 -3.044 313 HA LYS 43 HA LYS 43 -3.628 -4.742 -1.492 314 1HB LYS 43 HB2 LYS 43 -4.874 -4.860 -4.252 315 2HB LYS 43 HB1 LYS 43 -4.079 -6.201 -3.444 316 1HG LYS 43 HG2 LYS 43 -6.300 -6.646 -3.073 317 2HG LYS 43 HG1 LYS 43 -5.836 -5.808 -1.591 318 1HD LYS 43 HD2 LYS 43 -6.604 -3.761 -3.286 319 2HD LYS 43 HD1 LYS 43 -7.756 -5.051 -3.642 320 1HE LYS 43 HE2 LYS 43 -7.128 -3.907 -0.930 321 2HE LYS 43 HE1 LYS 43 -8.591 -3.622 -1.869 322 1HZ LYS 43 HZ1 LYS 43 -7.725 -6.290 -0.912 323 2HZ LYS 43 HZ2 LYS 43 -9.196 -5.900 -1.654 324 3HZ LYS 43 HZ3 LYS 43 -8.844 -5.308 -0.110 325 H ALA 44 HN ALA 44 -1.684 -5.618 -2.305 326 HA ALA 44 HA ALA 44 -0.251 -3.755 -4.043 327 1HB ALA 44 HB1 ALA 44 1.771 -4.986 -3.252 328 2HB ALA 44 HB2 ALA 44 0.718 -5.898 -2.169 329 3HB ALA 44 HB3 ALA 44 0.874 -4.149 -1.987 330 H ASP 45 HN ASP 45 1.030 -4.564 -5.744 331 HA ASP 45 HA ASP 45 -0.222 -6.661 -7.238 332 1HB ASP 45 HB2 ASP 45 0.796 -4.639 -8.281 333 2HB ASP 45 HB1 ASP 45 2.383 -5.207 -7.767 334 H THR 46 HN THR 46 0.788 -8.662 -7.880 335 HA THR 46 HA THR 46 1.788 -10.049 -5.669 336 HB THR 46 HB THR 46 0.562 -11.132 -7.525 337 HG1 THR 46 HG1 THR 46 2.916 -12.045 -6.391 338 1HG2 THR 46 HG21 THR 46 3.177 -10.857 -9.020 339 2HG2 THR 46 HG22 THR 46 1.663 -10.047 -9.423 340 3HG2 THR 46 HG23 THR 46 1.785 -11.800 -9.551 341 H ASP 47 HN ASP 47 3.484 -8.159 -7.975 342 HA ASP 47 HA ASP 47 6.002 -9.438 -7.877 343 1HB ASP 47 HB2 ASP 47 5.244 -7.638 -9.506 344 2HB ASP 47 HB1 ASP 47 5.542 -6.472 -8.221 345 H ASN 48 HN ASN 48 4.314 -7.370 -5.692 346 HA ASN 48 HA ASN 48 6.560 -7.483 -3.808 347 1HB ASN 48 HB2 ASN 48 5.978 -5.146 -3.092 348 2HB ASN 48 HB1 ASN 48 6.660 -5.240 -4.714 349 1HD2 ASN 48 HD21 ASN 48 3.911 -4.442 -2.819 350 2HD2 ASN 48 HD22 ASN 48 2.940 -3.823 -4.113 351 H PHE 49 HN PHE 49 4.063 -8.984 -4.187 352 HA PHE 49 HA PHE 49 2.952 -8.641 -1.495 353 1HB PHE 49 HB2 PHE 49 1.423 -7.470 -3.016 354 2HB PHE 49 HB1 PHE 49 1.309 -8.895 -4.026 355 HD1 PHE 49 HD1 PHE 49 0.285 -7.345 -0.878 356 HD2 PHE 49 HD2 PHE 49 -0.119 -10.745 -3.406 357 HE1 PHE 49 HE1 PHE 49 -1.644 -8.103 0.450 358 HE2 PHE 49 HE2 PHE 49 -2.046 -11.499 -2.093 359 HZ PHE 49 HZ PHE 49 -2.958 -10.069 -0.319 360 H GLU 50 HN GLU 50 3.709 -10.510 -0.663 361 HA GLU 50 HA GLU 50 3.312 -12.978 -2.214 362 1HB GLU 50 HB2 GLU 50 5.182 -12.368 0.075 363 2HB GLU 50 HB1 GLU 50 4.926 -13.985 -0.563 364 1HG GLU 50 HG2 GLU 50 5.681 -13.155 -2.782 365 2HG GLU 50 HG1 GLU 50 6.089 -11.622 -2.009 366 H GLN 51 HN GLN 51 1.630 -14.118 -1.707 367 HA GLN 51 HA GLN 51 0.044 -15.254 -0.581 368 1HB GLN 51 HB2 GLN 51 1.705 -14.612 1.860 369 2HB GLN 51 HB1 GLN 51 0.352 -15.734 1.828 370 1HG GLN 51 HG2 GLN 51 1.556 -17.105 0.178 371 2HG GLN 51 HG1 GLN 51 2.925 -16.000 0.287 372 1HE2 GLN 51 HE21 GLN 51 2.547 -15.617 3.172 373 2HE2 GLN 51 HE22 GLN 51 3.131 -17.065 3.922 374 H GLY 52 HN GLY 52 0.937 -12.449 1.432 375 1HA GLY 52 HA2 GLY 52 -1.445 -11.049 0.961 376 2HA GLY 52 HA1 GLY 52 -1.645 -11.988 2.439 377 H LYS 53 HN LYS 53 1.451 -10.687 1.430 378 HA LYS 53 HA LYS 53 1.163 -8.517 3.374 379 1HB LYS 53 HB2 LYS 53 3.009 -10.736 3.350 380 2HB LYS 53 HB1 LYS 53 3.868 -9.234 3.174 381 1HG LYS 53 HG2 LYS 53 3.756 -9.861 5.505 382 2HG LYS 53 HG1 LYS 53 2.801 -8.402 5.236 383 1HD LYS 53 HD2 LYS 53 0.758 -9.646 5.276 384 2HD LYS 53 HD1 LYS 53 1.632 -11.181 5.314 385 1HE LYS 53 HE2 LYS 53 1.737 -9.071 7.467 386 2HE LYS 53 HE1 LYS 53 0.719 -10.508 7.516 387 1HZ LYS 53 HZ1 LYS 53 2.747 -10.815 8.785 388 2HZ LYS 53 HZ2 LYS 53 3.692 -10.492 7.415 389 3HZ LYS 53 HZ3 LYS 53 2.713 -11.877 7.461 390 H PHE 54 HN PHE 54 1.727 -6.546 2.554 391 HA PHE 54 HA PHE 54 3.051 -6.536 -0.046 392 1HB PHE 54 HB2 PHE 54 2.496 -3.996 0.094 393 2HB PHE 54 HB1 PHE 54 1.255 -5.157 -0.327 394 HD1 PHE 54 HD1 PHE 54 -0.793 -4.366 0.436 395 HD2 PHE 54 HD2 PHE 54 2.639 -4.050 2.927 396 HE1 PHE 54 HE1 PHE 54 -2.200 -3.510 2.267 397 HE2 PHE 54 HE2 PHE 54 1.242 -3.187 4.756 398 HZ PHE 54 HZ PHE 54 -1.290 -2.795 4.278 399 H PHE 55 HN PHE 55 4.921 -5.533 -0.461 400 HA PHE 55 HA PHE 55 6.435 -4.267 1.650 401 1HB PHE 55 HB2 PHE 55 8.234 -5.967 1.605 402 2HB PHE 55 HB1 PHE 55 6.723 -6.633 2.204 403 HD1 PHE 55 HD1 PHE 55 9.197 -6.716 -0.456 404 HD2 PHE 55 HD2 PHE 55 5.433 -8.210 0.850 405 HE1 PHE 55 HE1 PHE 55 9.331 -8.516 -2.131 406 HE2 PHE 55 HE2 PHE 55 5.561 -10.012 -0.817 407 HZ PHE 55 HZ PHE 55 7.513 -10.165 -2.312 408 H LEU 56 HN LEU 56 8.717 -3.783 0.818 409 HA LEU 56 HA LEU 56 8.651 -2.991 -1.971 410 1HB LEU 56 HB2 LEU 56 10.875 -2.821 0.065 411 2HB LEU 56 HB1 LEU 56 10.973 -2.205 -1.559 412 HG LEU 56 HG LEU 56 9.001 -0.697 -0.930 413 1HD1 LEU 56 HD11 LEU 56 9.922 -1.499 1.820 414 2HD1 LEU 56 HD12 LEU 56 8.343 -1.838 1.109 415 3HD1 LEU 56 HD13 LEU 56 8.822 -0.173 1.446 416 1HD2 LEU 56 HD21 LEU 56 11.280 0.086 -1.268 417 2HD2 LEU 56 HD22 LEU 56 11.680 -0.336 0.397 418 3HD2 LEU 56 HD23 LEU 56 10.509 0.941 0.068 419 H ILE 57 HN ILE 57 9.466 -4.190 -3.635 420 HA ILE 57 HA ILE 57 11.099 -6.508 -2.873 421 HB ILE 57 HB ILE 57 9.061 -7.033 -4.193 422 1HG1 ILE 57 HG12 ILE 57 10.191 -8.464 -5.871 423 2HG1 ILE 57 HG11 ILE 57 11.688 -7.583 -5.589 424 1HG2 ILE 57 HG21 ILE 57 8.912 -5.050 -5.574 425 2HG2 ILE 57 HG22 ILE 57 8.993 -6.490 -6.588 426 3HG2 ILE 57 HG23 ILE 57 10.420 -5.473 -6.386 427 1HD1 ILE 57 HD11 ILE 57 11.691 -9.692 -4.407 428 2HD1 ILE 57 HD12 ILE 57 10.201 -9.249 -3.574 429 3HD1 ILE 57 HD13 ILE 57 11.687 -8.348 -3.265 430 H SER 58 HN SER 58 13.109 -6.741 -3.577 431 HA SER 58 HA SER 58 14.531 -4.399 -4.256 432 1HB SER 58 HB2 SER 58 15.376 -6.261 -2.833 433 2HB SER 58 HB1 SER 58 15.503 -7.258 -4.279 434 HG SER 58 HG SER 58 17.280 -5.569 -3.302 435 H ASP 59 HN ASP 59 16.396 -4.792 -6.009 436 HA ASP 59 HA ASP 59 15.197 -4.334 -8.472 437 1HB ASP 59 HB2 ASP 59 17.388 -3.501 -8.111 438 2HB ASP 59 HB1 ASP 59 18.013 -5.101 -7.728 439 H ASN 60 HN ASN 60 16.685 -7.309 -7.237 440 HA ASN 60 HA ASN 60 15.458 -8.734 -9.507 441 1HB ASN 60 HB2 ASN 60 17.880 -8.946 -9.536 442 2HB ASN 60 HB1 ASN 60 17.889 -9.454 -7.852 443 1HD2 ASN 60 HD21 ASN 60 15.632 -10.512 -10.353 444 2HD2 ASN 60 HD22 ASN 60 16.138 -12.168 -10.337 445 H ASN 61 HN ASN 61 16.528 -9.423 -6.186 446 HA ASN 61 HA ASN 61 14.067 -10.077 -5.089 447 1HB ASN 61 HB2 ASN 61 14.203 -12.569 -5.044 448 2HB ASN 61 HB1 ASN 61 13.954 -11.937 -6.666 449 1HD2 ASN 61 HD21 ASN 61 14.795 -13.651 -7.751 450 2HD2 ASN 61 HD22 ASN 61 16.469 -14.084 -7.701 451 H ARG 62 HN ARG 62 16.637 -8.878 -4.536 452 HA ARG 62 HA ARG 62 18.246 -10.654 -2.982 453 1HB ARG 62 HB2 ARG 62 18.350 -7.635 -3.112 454 2HB ARG 62 HB1 ARG 62 19.617 -8.700 -2.518 455 1HG ARG 62 HG2 ARG 62 18.613 -8.568 -5.355 456 2HG ARG 62 HG1 ARG 62 20.112 -7.860 -4.752 457 1HD ARG 62 HD2 ARG 62 20.883 -10.115 -4.116 458 2HD ARG 62 HD1 ARG 62 19.406 -10.790 -4.804 459 HE ARG 62 HE ARG 62 20.730 -9.209 -6.735 460 1HH1 ARG 62 HH11 ARG 62 20.903 -12.321 -5.132 461 2HH1 ARG 62 HH12 ARG 62 21.875 -13.041 -6.377 462 1HH2 ARG 62 HH21 ARG 62 21.979 -10.164 -8.381 463 2HH2 ARG 62 HH22 ARG 62 22.505 -11.817 -8.216 464 H ASP 63 HN ASP 63 16.019 -8.016 -2.236 465 HA ASP 63 HA ASP 63 15.957 -8.871 0.562 466 1HB ASP 63 HB2 ASP 63 15.848 -5.982 0.380 467 2HB ASP 63 HB1 ASP 63 16.888 -6.993 1.376 468 H LYS 64 HN LYS 64 14.094 -8.193 1.706 469 HA LYS 64 HA LYS 64 12.043 -6.764 0.200 470 1HB LYS 64 HB2 LYS 64 10.319 -8.352 0.652 471 2HB LYS 64 HB1 LYS 64 11.651 -9.240 -0.066 472 1HG LYS 64 HG2 LYS 64 11.612 -10.641 1.647 473 2HG LYS 64 HG1 LYS 64 12.031 -9.310 2.730 474 1HD LYS 64 HD2 LYS 64 10.015 -10.273 3.568 475 2HD LYS 64 HD1 LYS 64 9.582 -8.742 2.809 476 1HE LYS 64 HE2 LYS 64 7.973 -10.425 2.181 477 2HE LYS 64 HE1 LYS 64 8.924 -9.965 0.770 478 1HZ LYS 64 HZ1 LYS 64 10.307 -11.969 1.196 479 2HZ LYS 64 HZ2 LYS 64 8.701 -12.312 0.777 480 3HZ LYS 64 HZ3 LYS 64 9.201 -12.433 2.397 481 H LEU 65 HN LEU 65 10.811 -5.439 1.453 482 HA LEU 65 HA LEU 65 10.922 -5.741 4.352 483 1HB LEU 65 HB2 LEU 65 11.345 -3.335 4.661 484 2HB LEU 65 HB1 LEU 65 12.693 -4.209 3.971 485 HG LEU 65 HG LEU 65 10.831 -2.747 2.149 486 1HD1 LEU 65 HD11 LEU 65 11.365 -1.161 3.927 487 2HD1 LEU 65 HD12 LEU 65 12.180 -0.732 2.422 488 3HD1 LEU 65 HD13 LEU 65 13.084 -1.506 3.724 489 1HD2 LEU 65 HD21 LEU 65 12.557 -4.178 1.187 490 2HD2 LEU 65 HD22 LEU 65 13.796 -3.324 2.109 491 3HD2 LEU 65 HD23 LEU 65 12.894 -2.481 0.850 492 H TYR 66 HN TYR 66 8.963 -5.566 5.204 493 HA TYR 66 HA TYR 66 6.751 -5.143 3.451 494 1HB TYR 66 HB2 TYR 66 6.726 -5.505 6.451 495 2HB TYR 66 HB1 TYR 66 5.360 -5.700 5.361 496 HD1 TYR 66 HD1 TYR 66 8.429 -7.209 6.634 497 HD2 TYR 66 HD2 TYR 66 5.190 -7.689 3.909 498 HE1 TYR 66 HE1 TYR 66 8.980 -9.588 6.400 499 HE2 TYR 66 HE2 TYR 66 5.742 -10.065 3.675 500 HH TYR 66 HH TYR 66 7.756 -11.698 5.777 501 H VAL 67 HN VAL 67 5.032 -3.640 3.705 502 HA VAL 67 HA VAL 67 5.882 -1.104 4.949 503 HB VAL 67 HB VAL 67 4.505 0.064 3.256 504 1HG1 VAL 67 HG11 VAL 67 6.685 -1.697 2.158 505 2HG1 VAL 67 HG12 VAL 67 6.892 -0.128 2.939 506 3HG1 VAL 67 HG13 VAL 67 6.062 -0.240 1.387 507 1HG2 VAL 67 HG21 VAL 67 3.813 -1.136 1.233 508 2HG2 VAL 67 HG22 VAL 67 2.979 -1.734 2.668 509 3HG2 VAL 67 HG23 VAL 67 4.310 -2.659 1.974 510 H ASN 68 HN ASN 68 4.176 0.308 5.653 511 HA ASN 68 HA ASN 68 1.626 -1.045 6.262 512 1HB ASN 68 HB2 ASN 68 3.065 0.961 8.029 513 2HB ASN 68 HB1 ASN 68 1.523 0.197 8.380 514 1HD2 ASN 68 HD21 ASN 68 2.420 -2.441 7.436 515 2HD2 ASN 68 HD22 ASN 68 3.486 -3.036 8.664 516 H ILE 69 HN ILE 69 -0.053 0.002 5.333 517 HA ILE 69 HA ILE 69 0.424 2.710 4.322 518 HB ILE 69 HB ILE 69 -2.134 1.251 3.801 519 1HG1 ILE 69 HG12 ILE 69 -0.374 -0.439 3.367 520 2HG1 ILE 69 HG11 ILE 69 -1.181 0.076 1.892 521 1HG2 ILE 69 HG21 ILE 69 -1.981 2.439 1.670 522 2HG2 ILE 69 HG22 ILE 69 -0.404 3.074 2.137 523 3HG2 ILE 69 HG23 ILE 69 -1.846 3.543 3.037 524 1HD1 ILE 69 HD11 ILE 69 0.715 1.528 1.380 525 2HD1 ILE 69 HD12 ILE 69 1.172 -0.169 1.524 526 3HD1 ILE 69 HD13 ILE 69 1.528 0.955 2.838 527 H ARG 70 HN ARG 70 0.203 3.895 6.276 528 HA ARG 70 HA ARG 70 -2.287 3.523 7.763 529 1HB ARG 70 HB2 ARG 70 0.084 5.274 8.422 530 2HB ARG 70 HB1 ARG 70 -1.294 4.962 9.467 531 1HG ARG 70 HG2 ARG 70 0.803 2.999 8.584 532 2HG ARG 70 HG1 ARG 70 0.544 3.636 10.208 533 1HD ARG 70 HD2 ARG 70 -1.289 1.823 8.649 534 2HD ARG 70 HD1 ARG 70 -0.351 1.406 10.082 535 HE ARG 70 HE ARG 70 -2.469 3.451 10.214 536 1HH1 ARG 70 HH11 ARG 70 -1.052 0.439 11.294 537 2HH1 ARG 70 HH12 ARG 70 -2.181 0.224 12.601 538 1HH2 ARG 70 HH21 ARG 70 -4.001 3.147 11.881 539 2HH2 ARG 70 HH22 ARG 70 -3.895 1.744 12.902 540 HA PRO 71 HA PRO 71 -4.309 7.029 5.812 541 1HB PRO 71 HB2 PRO 71 -5.651 7.064 8.450 542 2HB PRO 71 HB1 PRO 71 -6.351 7.070 6.831 543 1HG PRO 71 HG2 PRO 71 -6.349 4.892 8.418 544 2HG PRO 71 HG1 PRO 71 -6.283 4.796 6.651 545 1HD PRO 71 HD2 PRO 71 -4.172 4.260 8.640 546 2HD PRO 71 HD1 PRO 71 -4.327 3.681 6.972 547 H MET 72 HN MET 72 -3.700 9.090 5.825 548 HA MET 72 HA MET 72 -2.058 10.094 7.956 549 1HB MET 72 HB2 MET 72 -1.658 10.614 5.537 550 2HB MET 72 HB1 MET 72 -3.144 11.557 5.538 551 1HG MET 72 HG2 MET 72 -2.207 13.081 7.168 552 2HG MET 72 HG1 MET 72 -0.734 12.115 7.250 553 1HE MET 72 HE1 MET 72 0.873 14.076 6.714 554 2HE MET 72 HE2 MET 72 -0.510 15.170 6.757 555 3HE MET 72 HE3 MET 72 0.623 15.233 5.408 556 H ASP 73 HN ASP 73 -3.621 9.929 9.659 557 HA ASP 73 HA ASP 73 -4.968 10.885 11.221 558 1HB ASP 73 HB2 ASP 73 -4.745 13.300 9.422 559 2HB ASP 73 HB1 ASP 73 -5.568 13.313 10.977 560 H ASN 74 HN ASN 74 -6.080 9.577 8.713 561 HA ASN 74 HA ASN 74 -8.757 10.798 8.816 562 1HB ASN 74 HB2 ASN 74 -7.187 9.788 6.491 563 2HB ASN 74 HB1 ASN 74 -8.941 9.665 6.451 564 1HD2 ASN 74 HD21 ASN 74 -6.220 11.844 6.502 565 2HD2 ASN 74 HD22 ASN 74 -7.099 13.262 6.042 566 H SER 75 HN SER 75 -9.875 9.565 10.120 567 HA SER 75 HA SER 75 -11.276 7.936 10.753 568 1HB SER 75 HB2 SER 75 -12.091 6.343 9.073 569 2HB SER 75 HB1 SER 75 -12.022 7.983 8.434 570 HG SER 75 HG SER 75 -9.689 6.735 7.991 571 H ALA 76 HN ALA 76 -11.563 5.396 10.773 572 HA ALA 76 HA ALA 76 -9.002 4.314 11.729 573 1HB ALA 76 HB1 ALA 76 -10.341 2.789 13.088 574 2HB ALA 76 HB2 ALA 76 -11.819 3.469 12.410 575 3HB ALA 76 HB3 ALA 76 -10.769 4.469 13.416 576 H TRP 77 HN TRP 77 -8.058 2.864 10.491 577 HA TRP 77 HA TRP 77 -9.700 1.326 8.590 578 1HB TRP 77 HB2 TRP 77 -6.850 2.295 8.470 579 2HB TRP 77 HB1 TRP 77 -7.413 0.991 7.433 580 HD1 TRP 77 HD1 TRP 77 -9.429 4.185 8.244 581 HE1 TRP 77 HE1 TRP 77 -9.865 5.443 6.038 582 HE3 TRP 77 HE3 TRP 77 -6.632 1.292 5.098 583 HZ2 TRP 77 HZ2 TRP 77 -9.103 5.238 3.332 584 HZ3 TRP 77 HZ3 TRP 77 -6.530 1.895 2.716 585 HH2 TRP 77 HH2 TRP 77 -7.738 3.831 1.853 586 H THR 78 HN THR 78 -9.348 -0.886 8.370 587 HA THR 78 HA THR 78 -8.210 -2.216 10.674 588 HB THR 78 HB THR 78 -9.450 -3.395 8.173 589 HG1 THR 78 HG1 THR 78 -10.501 -2.291 10.492 590 1HG2 THR 78 HG21 THR 78 -9.694 -5.427 9.530 591 2HG2 THR 78 HG22 THR 78 -8.850 -4.638 10.863 592 3HG2 THR 78 HG23 THR 78 -7.998 -4.977 9.357 593 H THR 79 HN THR 79 -6.122 -2.627 10.777 594 HA THR 79 HA THR 79 -4.552 -2.283 8.369 595 HB THR 79 HB THR 79 -3.796 -1.003 10.205 596 HG1 THR 79 HG1 THR 79 -2.093 -3.255 9.801 597 1HG2 THR 79 HG21 THR 79 -3.625 -3.555 11.806 598 2HG2 THR 79 HG22 THR 79 -4.798 -2.259 12.035 599 3HG2 THR 79 HG23 THR 79 -3.088 -1.964 12.349 600 H ASP 80 HN ASP 80 -5.005 -4.195 7.285 601 HA ASP 80 HA ASP 80 -3.542 -6.523 8.299 602 1HB ASP 80 HB2 ASP 80 -5.479 -6.104 6.044 603 2HB ASP 80 HB1 ASP 80 -4.318 -7.424 5.934 604 H ASN 81 HN ASN 81 -1.746 -7.349 7.084 605 HA ASN 81 HA ASN 81 -0.244 -5.115 5.988 606 1HB ASN 81 HB2 ASN 81 0.490 -7.187 7.616 607 2HB ASN 81 HB1 ASN 81 1.074 -7.734 6.047 608 1HD2 ASN 81 HD21 ASN 81 2.580 -6.390 4.907 609 2HD2 ASN 81 HD22 ASN 81 3.562 -5.255 5.765 610 H GLY 82 HN GLY 82 -2.406 -6.972 4.659 611 1HA GLY 82 HA2 GLY 82 -0.940 -7.123 2.103 612 2HA GLY 82 HA1 GLY 82 -2.144 -8.318 2.569 613 H VAL 83 HN VAL 83 -3.825 -6.222 3.804 614 HA VAL 83 HA VAL 83 -4.642 -4.616 1.508 615 HB VAL 83 HB VAL 83 -7.024 -5.173 1.844 616 1HG1 VAL 83 HG11 VAL 83 -7.004 -7.418 0.849 617 2HG1 VAL 83 HG12 VAL 83 -5.302 -7.581 1.282 618 3HG1 VAL 83 HG13 VAL 83 -5.801 -6.358 0.113 619 1HG2 VAL 83 HG21 VAL 83 -6.007 -7.307 3.720 620 2HG2 VAL 83 HG22 VAL 83 -7.673 -7.134 3.171 621 3HG2 VAL 83 HG23 VAL 83 -6.943 -5.883 4.176 622 H PHE 84 HN PHE 84 -5.412 -2.593 2.135 623 HA PHE 84 HA PHE 84 -5.687 -2.254 5.049 624 1HB PHE 84 HB2 PHE 84 -3.705 -1.129 3.490 625 2HB PHE 84 HB1 PHE 84 -4.906 0.159 3.590 626 HD1 PHE 84 HD1 PHE 84 -5.785 0.729 5.947 627 HD2 PHE 84 HD2 PHE 84 -2.209 -1.456 5.216 628 HE1 PHE 84 HE1 PHE 84 -4.992 1.277 8.208 629 HE2 PHE 84 HE2 PHE 84 -1.406 -0.905 7.473 630 HZ PHE 84 HZ PHE 84 -2.799 0.459 8.974 631 H TYR 85 HN TYR 85 -7.751 -1.895 5.484 632 HA TYR 85 HA TYR 85 -9.289 -0.202 3.654 633 1HB TYR 85 HB2 TYR 85 -11.201 -1.777 3.731 634 2HB TYR 85 HB1 TYR 85 -9.810 -2.449 2.906 635 HD1 TYR 85 HD1 TYR 85 -12.355 -3.181 5.102 636 HD2 TYR 85 HD2 TYR 85 -8.175 -3.801 4.606 637 HE1 TYR 85 HE1 TYR 85 -12.480 -5.178 6.542 638 HE2 TYR 85 HE2 TYR 85 -8.290 -5.799 6.037 639 HH TYR 85 HH TYR 85 -9.686 -6.762 7.746 640 H LYS 86 HN LYS 86 -10.722 1.112 4.631 641 HA LYS 86 HA LYS 86 -10.912 1.121 7.480 642 1HB LYS 86 HB2 LYS 86 -12.523 2.937 7.192 643 2HB LYS 86 HB1 LYS 86 -11.089 3.212 6.223 644 1HG LYS 86 HG2 LYS 86 -12.213 2.742 4.219 645 2HG LYS 86 HG1 LYS 86 -13.581 2.009 5.064 646 1HD LYS 86 HD2 LYS 86 -14.196 4.161 5.996 647 2HD LYS 86 HD1 LYS 86 -12.782 4.909 5.256 648 1HE LYS 86 HE2 LYS 86 -13.665 4.501 3.049 649 2HE LYS 86 HE1 LYS 86 -15.024 3.596 3.715 650 1HZ LYS 86 HZ1 LYS 86 -15.966 5.532 4.601 651 2HZ LYS 86 HZ2 LYS 86 -15.423 6.014 3.072 652 3HZ LYS 86 HZ3 LYS 86 -14.535 6.424 4.455 653 H ASN 87 HN ASN 87 -12.573 0.443 8.745 654 HA ASN 87 HA ASN 87 -14.157 -1.722 7.880 655 1HB ASN 87 HB2 ASN 87 -13.459 -1.361 10.234 656 2HB ASN 87 HB1 ASN 87 -14.533 0.028 10.325 657 1HD2 ASN 87 HD21 ASN 87 -15.264 -3.010 8.690 658 2HD2 ASN 87 HD22 ASN 87 -16.545 -3.470 9.753 659 H ASP 88 HN ASP 88 -14.652 1.695 7.928 660 HA ASP 88 HA ASP 88 -17.484 1.701 7.620 661 1HB ASP 88 HB2 ASP 88 -15.505 3.840 6.786 662 2HB ASP 88 HB1 ASP 88 -17.234 4.053 7.054 663 H VAL 89 HN VAL 89 -18.687 2.093 5.728 664 HA VAL 89 HA VAL 89 -17.247 1.504 3.235 665 HB VAL 89 HB VAL 89 -19.392 0.671 2.320 666 1HG1 VAL 89 HG11 VAL 89 -19.419 -1.452 3.544 667 2HG1 VAL 89 HG12 VAL 89 -18.460 -0.716 4.828 668 3HG1 VAL 89 HG13 VAL 89 -17.778 -0.898 3.212 669 1HG2 VAL 89 HG21 VAL 89 -21.249 0.150 3.825 670 2HG2 VAL 89 HG22 VAL 89 -20.934 1.886 3.784 671 3HG2 VAL 89 HG23 VAL 89 -20.393 0.924 5.161 672 H GLY 90 HN GLY 90 -17.113 3.124 1.838 673 1HA GLY 90 HA2 GLY 90 -18.890 4.620 0.612 674 2HA GLY 90 HA1 GLY 90 -18.907 5.417 2.179 675 H SER 91 HN SER 91 -18.284 7.180 0.554 676 HA SER 91 HA SER 91 -15.802 7.338 -0.651 677 1HB SER 91 HB2 SER 91 -16.133 9.846 -0.347 678 2HB SER 91 HB1 SER 91 -17.434 8.979 -1.164 679 HG SER 91 HG SER 91 -17.619 9.200 1.612 680 H TRP 92 HN TRP 92 -13.819 8.127 -0.042 681 HA TRP 92 HA TRP 92 -13.383 8.551 2.836 682 1HB TRP 92 HB2 TRP 92 -12.628 6.286 2.061 683 2HB TRP 92 HB1 TRP 92 -11.459 7.113 1.022 684 HD1 TRP 92 HD1 TRP 92 -12.348 6.770 4.758 685 HE1 TRP 92 HE1 TRP 92 -10.216 7.182 6.129 686 HE3 TRP 92 HE3 TRP 92 -9.206 8.011 0.949 687 HZ2 TRP 92 HZ2 TRP 92 -7.532 7.927 5.636 688 HZ3 TRP 92 HZ3 TRP 92 -6.903 8.578 1.479 689 HH2 TRP 92 HH2 TRP 92 -6.059 8.528 3.769 690 H GLY 93 HN GLY 93 -11.894 8.861 -0.336 691 1HA GLY 93 HA2 GLY 93 -10.397 10.426 -1.167 692 2HA GLY 93 HA1 GLY 93 -11.735 11.470 -0.767 693 H GLY 94 HN GLY 94 -8.586 10.336 0.187 694 1HA GLY 94 HA2 GLY 94 -8.098 12.798 1.609 695 2HA GLY 94 HA1 GLY 94 -8.141 11.379 2.647 696 H THR 95 HN THR 95 -6.099 10.972 3.186 697 HA THR 95 HA THR 95 -4.215 10.388 1.040 698 HB THR 95 HB THR 95 -2.468 11.526 2.719 699 HG1 THR 95 HG1 THR 95 -4.879 13.036 3.012 700 1HG2 THR 95 HG21 THR 95 -2.497 13.506 1.270 701 2HG2 THR 95 HG22 THR 95 -4.072 13.021 0.643 702 3HG2 THR 95 HG23 THR 95 -2.653 12.018 0.340 703 H ILE 96 HN ILE 96 -3.122 8.570 1.393 704 HA ILE 96 HA ILE 96 -2.750 7.660 4.168 705 HB ILE 96 HB ILE 96 -2.600 5.300 3.034 706 1HG1 ILE 96 HG12 ILE 96 -4.501 5.196 1.269 707 2HG1 ILE 96 HG11 ILE 96 -4.161 6.906 1.034 708 1HG2 ILE 96 HG21 ILE 96 -4.173 5.728 4.742 709 2HG2 ILE 96 HG22 ILE 96 -5.055 4.984 3.407 710 3HG2 ILE 96 HG23 ILE 96 -5.164 6.724 3.678 711 1HD1 ILE 96 HD11 ILE 96 -1.869 6.375 0.440 712 2HD1 ILE 96 HD12 ILE 96 -3.017 5.526 -0.596 713 3HD1 ILE 96 HD13 ILE 96 -2.193 4.661 0.701 714 H GLY 97 HN GLY 97 -0.705 6.727 4.635 715 1HA GLY 97 HA2 GLY 97 1.309 7.410 2.583 716 2HA GLY 97 HA1 GLY 97 1.546 7.710 4.299 717 H ILE 98 HN ILE 98 3.164 6.137 2.433 718 HA ILE 98 HA ILE 98 2.827 3.456 3.526 719 HB ILE 98 HB ILE 98 4.627 4.517 1.347 720 1HG1 ILE 98 HG12 ILE 98 2.346 2.539 1.330 721 2HG1 ILE 98 HG11 ILE 98 2.224 4.215 0.814 722 1HG2 ILE 98 HG21 ILE 98 4.448 1.701 2.411 723 2HG2 ILE 98 HG22 ILE 98 5.820 2.791 2.600 724 3HG2 ILE 98 HG23 ILE 98 5.366 2.215 0.997 725 1HD1 ILE 98 HD11 ILE 98 2.400 2.764 -1.102 726 2HD1 ILE 98 HD12 ILE 98 3.892 2.066 -0.473 727 3HD1 ILE 98 HD13 ILE 98 3.853 3.756 -0.973 728 H TYR 99 HN TYR 99 3.666 3.109 5.401 729 HA TYR 99 HA TYR 99 6.228 4.320 6.176 730 1HB TYR 99 HB2 TYR 99 4.246 2.785 7.886 731 2HB TYR 99 HB1 TYR 99 5.621 3.719 8.456 732 HD1 TYR 99 HD1 TYR 99 5.101 5.761 9.442 733 HD2 TYR 99 HD2 TYR 99 2.570 4.281 6.369 734 HE1 TYR 99 HE1 TYR 99 3.651 7.728 9.695 735 HE2 TYR 99 HE2 TYR 99 1.112 6.240 6.612 736 HH TYR 99 HH TYR 99 2.008 8.999 8.370 737 H VAL 100 HN VAL 100 7.869 2.845 7.097 738 HA VAL 100 HA VAL 100 7.725 0.210 5.878 739 HB VAL 100 HB VAL 100 9.853 1.619 5.881 740 1HG1 VAL 100 HG11 VAL 100 11.313 1.387 7.824 741 2HG1 VAL 100 HG12 VAL 100 10.001 0.613 8.715 742 3HG1 VAL 100 HG13 VAL 100 9.852 2.296 8.208 743 1HG2 VAL 100 HG21 VAL 100 9.984 -1.211 6.899 744 2HG2 VAL 100 HG22 VAL 100 11.283 -0.343 6.080 745 3HG2 VAL 100 HG23 VAL 100 9.791 -0.715 5.219 746 H ASP 101 HN ASP 101 7.378 -1.653 6.949 747 HA ASP 101 HA ASP 101 5.993 -1.536 9.390 748 1HB ASP 101 HB2 ASP 101 5.635 -3.285 7.683 749 2HB ASP 101 HB1 ASP 101 7.215 -3.961 8.064 750 H GLY 102 HN GLY 102 7.078 -0.759 11.119 751 1HA GLY 102 HA2 GLY 102 8.204 -1.035 13.093 752 2HA GLY 102 HA1 GLY 102 8.599 -2.664 12.577 753 H GLN 103 HN GLN 103 9.525 0.069 10.611 754 HA GLN 103 HA GLN 103 11.553 0.744 9.855 755 1HB GLN 103 HB2 GLN 103 11.676 1.671 12.156 756 2HB GLN 103 HB1 GLN 103 12.490 0.200 12.675 757 1HG GLN 103 HG2 GLN 103 14.318 0.670 11.117 758 2HG GLN 103 HG1 GLN 103 13.505 2.153 10.621 759 1HE2 GLN 103 HE21 GLN 103 15.182 3.469 11.293 760 2HE2 GLN 103 HE22 GLN 103 15.526 3.754 12.963 761 H GLN 104 HN GLN 104 12.201 -0.708 8.376 762 HA GLN 104 HA GLN 104 13.107 -3.330 9.181 763 1HB GLN 104 HB2 GLN 104 12.643 -2.035 6.504 764 2HB GLN 104 HB1 GLN 104 13.348 -3.641 6.663 765 1HG GLN 104 HG2 GLN 104 10.693 -2.878 7.853 766 2HG GLN 104 HG1 GLN 104 10.874 -3.564 6.240 767 1HE2 GLN 104 HE21 GLN 104 9.576 -4.547 8.738 768 2HE2 GLN 104 HE22 GLN 104 10.255 -6.118 9.003 769 H THR 105 HN THR 105 14.597 -0.601 9.428 770 HA THR 105 HA THR 105 16.763 -0.183 9.954 771 HB THR 105 HB THR 105 17.419 -2.960 8.950 772 HG1 THR 105 HG1 THR 105 16.738 -3.721 10.862 773 1HG2 THR 105 HG21 THR 105 19.253 -2.833 10.562 774 2HG2 THR 105 HG22 THR 105 18.762 -1.195 10.998 775 3HG2 THR 105 HG23 THR 105 19.365 -1.532 9.375 776 H ASN 106 HN ASN 106 15.617 -0.674 6.906 777 HA ASN 106 HA ASN 106 16.241 -0.090 4.818 778 1HB ASN 106 HB2 ASN 106 16.817 2.055 5.785 779 2HB ASN 106 HB1 ASN 106 18.371 1.439 6.313 780 1HD2 ASN 106 HD21 ASN 106 20.026 1.203 4.813 781 2HD2 ASN 106 HD22 ASN 106 19.966 1.943 3.247 782 H THR 107 HN THR 107 16.681 -2.196 4.288 783 HA THR 107 HA THR 107 19.239 -3.419 4.659 784 HB THR 107 HB THR 107 17.215 -4.302 2.611 785 HG1 THR 107 HG1 THR 107 16.393 -5.486 4.674 786 1HG2 THR 107 HG21 THR 107 19.292 -5.597 2.854 787 2HG2 THR 107 HG22 THR 107 17.882 -6.539 3.339 788 3HG2 THR 107 HG23 THR 107 18.939 -5.837 4.564 789 HA PRO 108 HA PRO 108 21.909 -1.705 1.597 790 1HB PRO 108 HB2 PRO 108 22.151 -4.333 0.337 791 2HB PRO 108 HB1 PRO 108 23.374 -3.364 1.156 792 1HG PRO 108 HG2 PRO 108 21.780 -5.563 2.200 793 2HG PRO 108 HG1 PRO 108 23.182 -4.762 2.925 794 1HD PRO 108 HD2 PRO 108 20.665 -4.554 3.938 795 2HD PRO 108 HD1 PRO 108 21.876 -3.262 4.090 796 HA PRO 109 HA PRO 109 18.484 -1.711 -1.352 797 1HB PRO 109 HB2 PRO 109 17.921 0.884 -1.255 798 2HB PRO 109 HB1 PRO 109 17.555 -0.186 0.102 799 1HG PRO 109 HG2 PRO 109 19.746 1.804 -0.202 800 2HG PRO 109 HG1 PRO 109 18.859 1.323 1.253 801 1HD PRO 109 HD2 PRO 109 21.399 0.395 0.433 802 2HD PRO 109 HD1 PRO 109 20.391 -0.264 1.745 803 H GLY 110 HN GLY 110 17.924 0.206 -3.059 804 1HA GLY 110 HA2 GLY 110 19.874 1.413 -4.592 805 2HA GLY 110 HA1 GLY 110 19.747 -0.247 -5.178 806 H ASN 111 HN ASN 111 17.567 -1.016 -5.722 807 HA ASN 111 HA ASN 111 15.659 1.113 -6.393 808 1HB ASN 111 HB2 ASN 111 17.035 0.335 -8.405 809 2HB ASN 111 HB1 ASN 111 16.219 -1.218 -8.234 810 1HD2 ASN 111 HD21 ASN 111 15.983 2.034 -9.256 811 2HD2 ASN 111 HD22 ASN 111 14.384 1.951 -9.922 812 H TYR 112 HN TYR 112 13.648 0.638 -5.653 813 HA TYR 112 HA TYR 112 13.003 -2.194 -5.217 814 1HB TYR 112 HB2 TYR 112 12.581 0.067 -3.271 815 2HB TYR 112 HB1 TYR 112 11.658 -1.428 -3.190 816 HD1 TYR 112 HD1 TYR 112 12.624 -3.435 -2.377 817 HD2 TYR 112 HD2 TYR 112 15.035 0.025 -2.881 818 HE1 TYR 112 HE1 TYR 112 14.413 -4.501 -1.085 819 HE2 TYR 112 HE2 TYR 112 16.841 -1.038 -1.588 820 HH TYR 112 HH TYR 112 17.005 -2.869 0.194 821 H THR 113 HN THR 113 11.019 -2.826 -5.737 822 HA THR 113 HA THR 113 9.219 -0.791 -6.867 823 HB THR 113 HB THR 113 9.425 -3.740 -7.514 824 HG1 THR 113 HG1 THR 113 11.154 -2.792 -8.456 825 1HG2 THR 113 HG21 THR 113 7.149 -2.871 -7.817 826 2HG2 THR 113 HG22 THR 113 7.900 -3.228 -9.371 827 3HG2 THR 113 HG23 THR 113 7.777 -1.559 -8.814 828 H LEU 114 HN LEU 114 7.338 -0.494 -5.870 829 HA LEU 114 HA LEU 114 6.067 -2.758 -4.569 830 1HB LEU 114 HB2 LEU 114 5.371 -1.174 -2.675 831 2HB LEU 114 HB1 LEU 114 6.983 -1.861 -2.639 832 HG LEU 114 HG LEU 114 6.596 0.833 -3.845 833 1HD1 LEU 114 HD11 LEU 114 5.390 0.932 -1.716 834 2HD1 LEU 114 HD12 LEU 114 6.875 1.880 -1.660 835 3HD1 LEU 114 HD13 LEU 114 6.811 0.296 -0.887 836 1HD2 LEU 114 HD21 LEU 114 8.823 -0.402 -2.240 837 2HD2 LEU 114 HD22 LEU 114 8.844 1.198 -2.981 838 3HD2 LEU 114 HD23 LEU 114 8.779 -0.242 -3.996 839 H THR 115 HN THR 115 4.692 -2.805 -6.274 840 HA THR 115 HA THR 115 3.176 -0.452 -7.029 841 HB THR 115 HB THR 115 2.969 -3.279 -8.085 842 HG1 THR 115 HG1 THR 115 4.485 -2.671 -9.606 843 1HG2 THR 115 HG21 THR 115 2.127 -0.624 -9.258 844 2HG2 THR 115 HG22 THR 115 1.051 -1.885 -8.655 845 3HG2 THR 115 HG23 THR 115 2.040 -2.179 -10.085 846 H LEU 116 HN LEU 116 1.081 -0.095 -6.545 847 HA LEU 116 HA LEU 116 -0.296 -2.128 -4.917 848 1HB LEU 116 HB2 LEU 116 -0.146 0.840 -4.647 849 2HB LEU 116 HB1 LEU 116 -1.546 -0.015 -4.035 850 HG LEU 116 HG LEU 116 0.112 -1.411 -2.667 851 1HD1 LEU 116 HD11 LEU 116 1.923 0.897 -3.358 852 2HD1 LEU 116 HD12 LEU 116 2.137 -0.775 -3.875 853 3HD1 LEU 116 HD13 LEU 116 2.247 -0.363 -2.164 854 1HD2 LEU 116 HD21 LEU 116 0.214 0.266 -0.904 855 2HD2 LEU 116 HD22 LEU 116 -1.359 0.268 -1.700 856 3HD2 LEU 116 HD23 LEU 116 -0.182 1.526 -2.073 857 H THR 117 HN THR 117 -1.947 -2.968 -5.938 858 HA THR 117 HA THR 117 -3.215 -1.562 -8.140 859 HB THR 117 HB THR 117 -3.734 -4.352 -7.085 860 HG1 THR 117 HG1 THR 117 -1.828 -3.266 -8.828 861 1HG2 THR 117 HG21 THR 117 -4.761 -4.736 -9.276 862 2HG2 THR 117 HG22 THR 117 -4.463 -3.055 -9.718 863 3HG2 THR 117 HG23 THR 117 -5.587 -3.438 -8.413 864 H GLY 118 HN GLY 118 -4.831 -0.231 -7.703 865 1HA GLY 118 HA2 GLY 118 -6.194 -0.188 -5.221 866 2HA GLY 118 HA1 GLY 118 -6.624 0.735 -6.654 867 H GLY 119 HN GLY 119 -8.245 -0.777 -4.662 868 1HA GLY 119 HA2 GLY 119 -10.178 -1.782 -6.460 869 2HA GLY 119 HA1 GLY 119 -9.304 -3.120 -5.722 870 H TYR 120 HN TYR 120 -11.869 -3.166 -5.156 871 HA TYR 120 HA TYR 120 -12.088 -1.821 -2.565 872 1HB TYR 120 HB2 TYR 120 -14.446 -2.153 -2.618 873 2HB TYR 120 HB1 TYR 120 -13.969 -1.511 -4.179 874 HD1 TYR 120 HD1 TYR 120 -15.102 -4.559 -2.404 875 HD2 TYR 120 HD2 TYR 120 -14.402 -2.722 -6.185 876 HE1 TYR 120 HE1 TYR 120 -16.371 -6.347 -3.507 877 HE2 TYR 120 HE2 TYR 120 -15.667 -4.518 -7.292 878 HH TYR 120 HH TYR 120 -16.431 -6.724 -6.945 879 H TRP 121 HN TRP 121 -13.646 -3.316 -1.123 880 HA TRP 121 HA TRP 121 -12.696 -6.044 -1.042 881 1HB TRP 121 HB2 TRP 121 -10.866 -5.135 0.127 882 2HB TRP 121 HB1 TRP 121 -11.851 -3.908 0.912 883 HD1 TRP 121 HD1 TRP 121 -13.591 -4.877 2.812 884 HE1 TRP 121 HE1 TRP 121 -13.265 -6.765 4.516 885 HE3 TRP 121 HE3 TRP 121 -9.629 -7.272 0.634 886 HZ2 TRP 121 HZ2 TRP 121 -11.575 -8.930 4.898 887 HZ3 TRP 121 HZ3 TRP 121 -8.725 -9.265 1.799 888 HH2 TRP 121 HH2 TRP 121 -9.693 -10.062 3.845 889 H ALA 122 HN ALA 122 -14.120 -7.341 0.099 890 HA ALA 122 HA ALA 122 -16.286 -5.987 1.554 891 1HB ALA 122 HB1 ALA 122 -17.094 -6.880 -0.582 892 2HB ALA 122 HB2 ALA 122 -17.829 -7.705 0.793 893 3HB ALA 122 HB3 ALA 122 -16.535 -8.487 -0.116 894 H LYS 123 HN LYS 123 -16.971 -6.925 3.438 895 HA LYS 123 HA LYS 123 -17.027 -8.212 5.293 896 1HB LYS 123 HB2 LYS 123 -17.029 -10.100 3.544 897 2HB LYS 123 HB1 LYS 123 -15.329 -10.291 3.938 898 1HG LYS 123 HG2 LYS 123 -16.458 -11.896 5.222 899 2HG LYS 123 HG1 LYS 123 -16.061 -10.597 6.347 900 1HD LYS 123 HD2 LYS 123 -18.727 -10.784 4.968 901 2HD LYS 123 HD1 LYS 123 -18.401 -11.591 6.499 902 1HE LYS 123 HE2 LYS 123 -17.868 -9.433 7.521 903 2HE LYS 123 HE1 LYS 123 -18.182 -8.626 5.985 904 1HZ LYS 123 HZ1 LYS 123 -20.473 -9.435 6.097 905 2HZ LYS 123 HZ2 LYS 123 -20.091 -8.452 7.427 906 3HZ LYS 123 HZ3 LYS 123 -20.159 -10.137 7.608 907 H ASP 124 HN ASP 124 -14.526 -10.084 5.728 908 HA ASP 124 HA ASP 124 -12.360 -8.252 6.070 909 1HB ASP 124 HB2 ASP 124 -12.264 -8.428 8.557 910 2HB ASP 124 HB1 ASP 124 -13.644 -7.505 7.974 911 H ASN 125 HN ASN 125 -10.501 -9.309 6.079 912 HA ASN 125 HA ASN 125 -8.896 -10.892 6.275 913 1HB ASN 125 HB2 ASN 125 -9.693 -11.102 8.546 914 2HB ASN 125 HB1 ASN 125 -10.881 -12.290 8.036 915 1HD2 ASN 125 HD21 ASN 125 -10.148 -13.972 9.230 916 2HD2 ASN 125 HD22 ASN 125 -8.614 -14.737 8.977 917 H LYS 126 HN LYS 126 -12.084 -12.269 5.613 918 HA LYS 126 HA LYS 126 -11.210 -14.696 4.476 919 1HB LYS 126 HB2 LYS 126 -13.467 -14.912 3.643 920 2HB LYS 126 HB1 LYS 126 -13.520 -14.227 5.258 921 1HG LYS 126 HG2 LYS 126 -14.962 -12.783 4.330 922 2HG LYS 126 HG1 LYS 126 -13.501 -11.968 3.764 923 1HD LYS 126 HD2 LYS 126 -13.632 -13.206 1.655 924 2HD LYS 126 HD1 LYS 126 -15.086 -14.029 2.223 925 1HE LYS 126 HE2 LYS 126 -16.124 -11.745 2.472 926 2HE LYS 126 HE1 LYS 126 -14.730 -11.111 1.611 927 1HZ LYS 126 HZ1 LYS 126 -16.725 -13.053 0.588 928 2HZ LYS 126 HZ2 LYS 126 -15.299 -12.660 -0.229 929 3HZ LYS 126 HZ3 LYS 126 -16.472 -11.467 0.044 930 H GLN 127 HN GLN 127 -10.726 -11.650 3.436 931 HA GLN 127 HA GLN 127 -9.889 -10.678 1.613 932 1HB GLN 127 HB2 GLN 127 -8.526 -12.869 1.627 933 2HB GLN 127 HB1 GLN 127 -9.550 -13.337 0.272 934 1HG GLN 127 HG2 GLN 127 -8.837 -11.403 -0.985 935 2HG GLN 127 HG1 GLN 127 -7.890 -10.828 0.384 936 1HE2 GLN 127 HE21 GLN 127 -7.013 -13.589 1.018 937 2HE2 GLN 127 HE22 GLN 127 -5.789 -13.950 -0.143 938 H GLY 128 HN GLY 128 -12.159 -9.984 1.441 939 1HA GLY 128 HA2 GLY 128 -13.503 -11.066 -0.909 940 2HA GLY 128 HA1 GLY 128 -14.175 -9.888 0.214 941 H PHE 129 HN PHE 129 -11.100 -9.921 -1.527 942 HA PHE 129 HA PHE 129 -11.404 -7.106 -2.032 943 1HB PHE 129 HB2 PHE 129 -9.116 -7.127 -2.456 944 2HB PHE 129 HB1 PHE 129 -9.279 -8.437 -1.307 945 HD1 PHE 129 HD1 PHE 129 -9.658 -10.809 -2.387 946 HD2 PHE 129 HD2 PHE 129 -7.887 -7.487 -4.376 947 HE1 PHE 129 HE1 PHE 129 -8.554 -12.345 -3.962 948 HE2 PHE 129 HE2 PHE 129 -6.782 -9.017 -5.952 949 HZ PHE 129 HZ PHE 129 -7.117 -11.435 -5.763 950 H THR 130 HN THR 130 -11.298 -6.149 -4.122 951 HA THR 130 HA THR 130 -11.172 -7.842 -6.473 952 HB THR 130 HB THR 130 -13.592 -6.072 -6.036 953 HG1 THR 130 HG1 THR 130 -13.122 -8.672 -5.385 954 1HG2 THR 130 HG21 THR 130 -12.887 -7.934 -8.309 955 2HG2 THR 130 HG22 THR 130 -12.853 -6.172 -8.370 956 3HG2 THR 130 HG23 THR 130 -14.385 -7.016 -8.150 957 HA PRO 131 HA PRO 131 -8.776 -4.216 -7.621 958 1HB PRO 131 HB2 PRO 131 -9.090 -5.407 -10.328 959 2HB PRO 131 HB1 PRO 131 -7.621 -4.921 -9.473 960 1HG PRO 131 HG2 PRO 131 -8.249 -7.497 -9.745 961 2HG PRO 131 HG1 PRO 131 -7.525 -6.884 -8.246 962 1HD PRO 131 HD2 PRO 131 -10.370 -7.602 -8.825 963 2HD PRO 131 HD1 PRO 131 -9.418 -7.869 -7.350 964 H SER 132 HN SER 132 -9.496 -2.233 -8.082 965 HA SER 132 HA SER 132 -11.488 -1.754 -10.118 966 1HB SER 132 HB2 SER 132 -12.110 -1.076 -7.229 967 2HB SER 132 HB1 SER 132 -13.111 -0.688 -8.628 968 HG SER 132 HG SER 132 -12.624 -3.291 -8.693 969 H GLY 133 HN GLY 133 -10.427 -0.171 -11.168 970 1HA GLY 133 HA2 GLY 133 -10.171 2.285 -11.100 971 2HA GLY 133 HA1 GLY 133 -9.415 2.073 -9.528 972 H THR 134 HN THR 134 -7.325 2.495 -9.660 973 HA THR 134 HA THR 134 -5.879 1.635 -12.077 974 HB THR 134 HB THR 134 -4.285 3.566 -11.407 975 HG1 THR 134 HG1 THR 134 -6.683 4.287 -10.037 976 1HG2 THR 134 HG21 THR 134 -7.038 4.170 -12.500 977 2HG2 THR 134 HG22 THR 134 -5.664 3.579 -13.432 978 3HG2 THR 134 HG23 THR 134 -5.608 5.182 -12.698 979 H THR 135 HN THR 135 -3.718 0.939 -11.819 980 HA THR 135 HA THR 135 -3.010 0.174 -9.072 981 HB THR 135 HB THR 135 -3.238 -1.763 -10.518 982 HG1 THR 135 HG1 THR 135 -0.763 -2.311 -10.486 983 1HG2 THR 135 HG21 THR 135 -1.161 -0.469 -12.286 984 2HG2 THR 135 HG22 THR 135 -2.856 -0.751 -12.690 985 3HG2 THR 135 HG23 THR 135 -1.765 -2.119 -12.457 986 H GLY 136 HN GLY 136 -1.525 1.404 -8.157 987 1HA GLY 136 HA2 GLY 136 0.089 3.148 -9.879 988 2HA GLY 136 HA1 GLY 136 -0.239 3.404 -8.171 989 H THR 137 HN THR 137 2.184 2.860 -10.161 990 HA THR 137 HA THR 137 3.510 0.754 -8.643 991 HB THR 137 HB THR 137 4.458 2.318 -11.056 992 HG1 THR 137 HG1 THR 137 2.703 0.892 -11.504 993 1HG2 THR 137 HG21 THR 137 6.195 0.591 -11.238 994 2HG2 THR 137 HG22 THR 137 5.631 -0.130 -9.730 995 3HG2 THR 137 HG23 THR 137 6.334 1.488 -9.725 996 H THR 138 HN THR 138 4.112 1.592 -6.672 997 HA THR 138 HA THR 138 5.501 4.115 -6.531 998 HB THR 138 HB THR 138 5.292 1.987 -4.388 999 HG1 THR 138 HG1 THR 138 3.259 2.576 -4.372 1000 1HG2 THR 138 HG21 THR 138 5.922 4.934 -4.246 1001 2HG2 THR 138 HG22 THR 138 7.052 3.612 -3.963 1002 3HG2 THR 138 HG23 THR 138 5.703 3.870 -2.858 1003 H LYS 139 HN LYS 139 7.450 4.256 -7.354 1004 HA LYS 139 HA LYS 139 9.275 1.954 -7.132 1005 1HB LYS 139 HB2 LYS 139 8.688 2.678 -9.459 1006 2HB LYS 139 HB1 LYS 139 9.390 4.250 -9.106 1007 1HG LYS 139 HG2 LYS 139 11.061 3.114 -10.262 1008 2HG LYS 139 HG1 LYS 139 11.537 2.980 -8.572 1009 1HD LYS 139 HD2 LYS 139 11.836 0.851 -9.705 1010 2HD LYS 139 HD1 LYS 139 10.560 0.722 -8.492 1011 1HE LYS 139 HE2 LYS 139 8.860 0.770 -10.137 1012 2HE LYS 139 HE1 LYS 139 9.986 1.296 -11.386 1013 1HZ LYS 139 HZ1 LYS 139 9.453 -1.038 -11.635 1014 2HZ LYS 139 HZ2 LYS 139 9.992 -1.367 -10.059 1015 3HZ LYS 139 HZ3 LYS 139 11.092 -0.853 -11.242 1016 H LEU 140 HN LEU 140 10.591 2.192 -5.555 1017 HA LEU 140 HA LEU 140 11.345 4.900 -4.750 1018 1HB LEU 140 HB2 LEU 140 10.195 3.917 -2.980 1019 2HB LEU 140 HB1 LEU 140 10.924 2.345 -3.242 1020 HG LEU 140 HG LEU 140 13.059 3.205 -2.413 1021 1HD1 LEU 140 HD11 LEU 140 12.780 5.550 -3.023 1022 2HD1 LEU 140 HD12 LEU 140 13.160 5.384 -1.308 1023 3HD1 LEU 140 HD13 LEU 140 11.504 5.722 -1.817 1024 1HD2 LEU 140 HD21 LEU 140 10.709 3.599 -0.572 1025 2HD2 LEU 140 HD22 LEU 140 12.388 3.473 -0.046 1026 3HD2 LEU 140 HD23 LEU 140 11.610 2.108 -0.846 1027 H THR 141 HN THR 141 13.186 5.413 -5.644 1028 HA THR 141 HA THR 141 15.379 3.469 -5.772 1029 HB THR 141 HB THR 141 15.200 6.233 -7.007 1030 HG1 THR 141 HG1 THR 141 13.889 4.065 -7.677 1031 1HG2 THR 141 HG21 THR 141 17.064 5.482 -8.399 1032 2HG2 THR 141 HG22 THR 141 17.080 3.931 -7.560 1033 3HG2 THR 141 HG23 THR 141 17.497 5.408 -6.690 1034 H VAL 142 HN VAL 142 17.376 3.908 -4.756 1035 HA VAL 142 HA VAL 142 17.098 5.377 -2.318 1036 HB VAL 142 HB VAL 142 19.499 3.997 -3.500 1037 1HG1 VAL 142 HG11 VAL 142 20.164 5.696 -1.857 1038 2HG1 VAL 142 HG12 VAL 142 20.438 4.064 -1.249 1039 3HG1 VAL 142 HG13 VAL 142 19.049 4.991 -0.685 1040 1HG2 VAL 142 HG21 VAL 142 17.630 2.519 -3.080 1041 2HG2 VAL 142 HG22 VAL 142 17.491 3.139 -1.435 1042 3HG2 VAL 142 HG23 VAL 142 18.923 2.231 -1.916 1043 H THR 143 HN THR 143 17.610 7.360 -1.864 1044 HA THR 143 HA THR 143 19.947 8.619 -2.971 1045 HB THR 143 HB THR 143 17.229 9.905 -3.349 1046 HG1 THR 143 HG1 THR 143 18.433 8.224 -4.891 1047 1HG2 THR 143 HG21 THR 143 18.927 11.545 -2.692 1048 2HG2 THR 143 HG22 THR 143 18.464 11.755 -4.382 1049 3HG2 THR 143 HG23 THR 143 19.990 10.966 -3.976 Start of MODEL 3 1 H GLU 1 H GLU 1 -20.759 -2.245 -4.528 2 HA GLU 1 HA GLU 1 -22.050 -0.678 -6.678 3 1HB GLU 1 HB2 GLU 1 -20.886 0.099 -4.011 4 2HB GLU 1 HB1 GLU 1 -21.063 1.258 -5.323 5 1HG GLU 1 HG2 GLU 1 -23.275 -0.298 -3.999 6 2HG GLU 1 HG1 GLU 1 -22.926 1.419 -3.795 7 H GLU 2 HN GLU 2 -20.476 1.015 -7.467 8 HA GLU 2 HA GLU 2 -18.052 -0.398 -8.271 9 1HB GLU 2 HB2 GLU 2 -19.398 0.488 -10.073 10 2HB GLU 2 HB1 GLU 2 -19.413 2.085 -9.338 11 1HG GLU 2 HG2 GLU 2 -16.975 2.227 -9.682 12 2HG GLU 2 HG1 GLU 2 -17.027 0.666 -10.501 13 H CYS 3 HN CYS 3 -16.193 0.048 -7.329 14 HA CYS 3 HA CYS 3 -15.879 2.694 -6.086 15 1HB CYS 3 HB2 CYS 3 -15.295 -0.011 -5.040 16 2HB CYS 3 HB1 CYS 3 -14.089 1.229 -4.702 17 H GLN 4 HN GLN 4 -14.761 3.773 -7.583 18 HA GLN 4 HA GLN 4 -12.503 2.514 -8.907 19 1HB GLN 4 HB2 GLN 4 -13.493 5.369 -9.058 20 2HB GLN 4 HB1 GLN 4 -12.282 4.639 -10.102 21 1HG GLN 4 HG2 GLN 4 -15.151 3.758 -9.930 22 2HG GLN 4 HG1 GLN 4 -14.507 4.861 -11.142 23 1HE2 GLN 4 HE21 GLN 4 -15.030 3.539 -12.836 24 2HE2 GLN 4 HE22 GLN 4 -14.209 2.046 -13.161 25 H VAL 5 HN VAL 5 -10.732 2.293 -7.713 26 HA VAL 5 HA VAL 5 -10.001 4.417 -5.849 27 HB VAL 5 HB VAL 5 -8.742 1.697 -6.283 28 1HG1 VAL 5 HG11 VAL 5 -7.112 3.306 -5.467 29 2HG1 VAL 5 HG12 VAL 5 -7.531 2.156 -4.197 30 3HG1 VAL 5 HG13 VAL 5 -8.208 3.784 -4.171 31 1HG2 VAL 5 HG21 VAL 5 -10.519 2.706 -4.060 32 2HG2 VAL 5 HG22 VAL 5 -9.777 1.108 -4.150 33 3HG2 VAL 5 HG23 VAL 5 -10.997 1.580 -5.333 34 H ARG 6 HN ARG 6 -8.885 6.018 -6.655 35 HA ARG 6 HA ARG 6 -7.318 5.661 -9.058 36 1HB ARG 6 HB2 ARG 6 -7.922 8.090 -7.374 37 2HB ARG 6 HB1 ARG 6 -6.894 8.131 -8.801 38 1HG ARG 6 HG2 ARG 6 -9.799 7.337 -8.731 39 2HG ARG 6 HG1 ARG 6 -9.148 8.867 -9.323 40 1HD ARG 6 HD2 ARG 6 -7.927 7.693 -11.068 41 2HD ARG 6 HD1 ARG 6 -8.505 6.146 -10.454 42 HE ARG 6 HE ARG 6 -10.547 8.052 -11.229 43 1HH1 ARG 6 HH11 ARG 6 -8.576 5.319 -12.151 44 2HH1 ARG 6 HH12 ARG 6 -9.624 4.820 -13.443 45 1HH2 ARG 6 HH21 ARG 6 -11.961 7.388 -12.918 46 2HH2 ARG 6 HH22 ARG 6 -11.578 5.962 -13.838 47 H VAL 7 HN VAL 7 -5.545 4.520 -8.630 48 HA VAL 7 HA VAL 7 -3.649 5.736 -6.743 49 HB VAL 7 HB VAL 7 -4.263 3.494 -5.996 50 1HG1 VAL 7 HG11 VAL 7 -3.741 1.506 -7.296 51 2HG1 VAL 7 HG12 VAL 7 -3.287 2.524 -8.662 52 3HG1 VAL 7 HG13 VAL 7 -4.953 2.515 -8.087 53 1HG2 VAL 7 HG21 VAL 7 -1.985 4.256 -5.595 54 2HG2 VAL 7 HG22 VAL 7 -1.475 3.572 -7.140 55 3HG2 VAL 7 HG23 VAL 7 -2.032 2.512 -5.844 56 H GLY 8 HN GLY 8 -2.119 6.803 -7.753 57 1HA GLY 8 HA2 GLY 8 -1.517 6.085 -10.537 58 2HA GLY 8 HA1 GLY 8 -1.208 7.648 -9.794 59 H ASP 9 HN ASP 9 0.888 7.170 -10.911 60 HA ASP 9 HA ASP 9 2.621 5.443 -9.305 61 1HB ASP 9 HB2 ASP 9 4.264 5.689 -11.108 62 2HB ASP 9 HB1 ASP 9 2.728 5.113 -11.744 63 H LEU 10 HN LEU 10 4.369 6.239 -8.231 64 HA LEU 10 HA LEU 10 4.980 9.065 -8.399 65 1HB LEU 10 HB2 LEU 10 4.820 9.402 -5.961 66 2HB LEU 10 HB1 LEU 10 3.265 9.102 -6.709 67 HG LEU 10 HG LEU 10 4.747 6.840 -5.418 68 1HD1 LEU 10 HD11 LEU 10 4.727 8.645 -3.765 69 2HD1 LEU 10 HD12 LEU 10 3.628 7.344 -3.307 70 3HD1 LEU 10 HD13 LEU 10 2.989 8.836 -3.995 71 1HD2 LEU 10 HD21 LEU 10 2.767 6.315 -6.733 72 2HD2 LEU 10 HD22 LEU 10 1.823 7.479 -5.804 73 3HD2 LEU 10 HD23 LEU 10 2.458 6.035 -5.018 74 H THR 11 HN THR 11 7.085 9.346 -8.316 75 HA THR 11 HA THR 11 8.736 7.148 -7.274 76 HB THR 11 HB THR 11 9.541 9.298 -9.240 77 HG1 THR 11 HG1 THR 11 7.997 7.917 -10.184 78 1HG2 THR 11 HG21 THR 11 11.459 7.831 -9.665 79 2HG2 THR 11 HG22 THR 11 10.884 6.718 -8.423 80 3HG2 THR 11 HG23 THR 11 11.407 8.343 -7.977 81 H VAL 12 HN VAL 12 9.614 7.531 -5.363 82 HA VAL 12 HA VAL 12 10.364 10.301 -4.678 83 HB VAL 12 HB VAL 12 9.374 8.194 -2.742 84 1HG1 VAL 12 HG11 VAL 12 9.315 10.035 -1.127 85 2HG1 VAL 12 HG12 VAL 12 10.005 11.115 -2.339 86 3HG1 VAL 12 HG13 VAL 12 10.948 9.752 -1.733 87 1HG2 VAL 12 HG21 VAL 12 7.361 9.573 -2.527 88 2HG2 VAL 12 HG22 VAL 12 7.557 8.961 -4.170 89 3HG2 VAL 12 HG23 VAL 12 7.959 10.637 -3.800 90 H ALA 13 HN ALA 13 12.504 10.490 -4.491 91 HA ALA 13 HA ALA 13 14.109 8.100 -4.050 92 1HB ALA 13 HB1 ALA 13 14.937 10.912 -4.761 93 2HB ALA 13 HB2 ALA 13 14.769 9.553 -5.874 94 3HB ALA 13 HB3 ALA 13 16.021 9.527 -4.632 95 H LYS 14 HN LYS 14 13.998 7.604 -1.945 96 HA LYS 14 HA LYS 14 15.352 9.390 -0.074 97 1HB LYS 14 HB2 LYS 14 12.661 8.112 0.488 98 2HB LYS 14 HB1 LYS 14 13.668 8.887 1.699 99 1HG LYS 14 HG2 LYS 14 12.448 10.252 -0.692 100 2HG LYS 14 HG1 LYS 14 11.835 10.320 0.961 101 1HD LYS 14 HD2 LYS 14 13.911 11.388 1.688 102 2HD LYS 14 HD1 LYS 14 14.538 11.303 0.041 103 1HE LYS 14 HE2 LYS 14 12.569 12.679 -0.681 104 2HE LYS 14 HE1 LYS 14 12.171 12.893 1.024 105 1HZ LYS 14 HZ1 LYS 14 14.697 13.739 -0.295 106 2HZ LYS 14 HZ2 LYS 14 14.344 13.932 1.351 107 3HZ LYS 14 HZ3 LYS 14 13.436 14.763 0.184 108 H THR 15 HN THR 15 15.351 7.972 2.172 109 HA THR 15 HA THR 15 16.470 5.373 1.413 110 HB THR 15 HB THR 15 17.355 5.429 3.800 111 HG1 THR 15 HG1 THR 15 17.229 7.340 4.910 112 1HG2 THR 15 HG21 THR 15 18.236 7.658 1.960 113 2HG2 THR 15 HG22 THR 15 18.753 5.976 1.848 114 3HG2 THR 15 HG23 THR 15 19.190 6.941 3.257 115 H ARG 16 HN ARG 16 15.976 3.501 2.892 116 HA ARG 16 HA ARG 16 13.114 3.501 3.460 117 1HB ARG 16 HB2 ARG 16 15.062 1.194 3.684 118 2HB ARG 16 HB1 ARG 16 13.312 1.089 3.802 119 1HG ARG 16 HG2 ARG 16 13.619 0.411 1.650 120 2HG ARG 16 HG1 ARG 16 13.412 2.144 1.399 121 1HD ARG 16 HD2 ARG 16 15.935 2.319 1.555 122 2HD ARG 16 HD1 ARG 16 15.966 0.565 1.448 123 HE ARG 16 HE ARG 16 15.400 0.697 -0.773 124 1HH1 ARG 16 HH11 ARG 16 15.066 3.819 0.718 125 2HH1 ARG 16 HH12 ARG 16 14.995 4.695 -0.775 126 1HH2 ARG 16 HH21 ARG 16 15.273 1.835 -2.788 127 2HH2 ARG 16 HH22 ARG 16 15.092 3.556 -2.769 128 H GLY 17 HN GLY 17 16.161 3.532 5.115 129 1HA GLY 17 HA2 GLY 17 15.257 2.825 7.706 130 2HA GLY 17 HA1 GLY 17 16.670 3.810 7.345 131 H GLN 18 HN GLN 18 15.093 5.746 5.860 132 HA GLN 18 HA GLN 18 14.544 7.720 7.686 133 1HB GLN 18 HB2 GLN 18 14.759 8.069 5.269 134 2HB GLN 18 HB1 GLN 18 13.249 7.216 4.997 135 1HG GLN 18 HG2 GLN 18 12.643 9.437 4.808 136 2HG GLN 18 HG1 GLN 18 12.198 9.037 6.468 137 1HE2 GLN 18 HE21 GLN 18 13.290 9.961 8.164 138 2HE2 GLN 18 HE22 GLN 18 14.426 11.248 7.968 139 H LEU 19 HN LEU 19 12.502 5.103 6.619 140 HA LEU 19 HA LEU 19 10.043 6.313 7.306 141 1HB LEU 19 HB2 LEU 19 10.657 3.418 6.786 142 2HB LEU 19 HB1 LEU 19 9.060 4.145 6.809 143 HG LEU 19 HG LEU 19 11.261 4.681 4.821 144 1HD1 LEU 19 HD11 LEU 19 9.648 3.833 3.198 145 2HD1 LEU 19 HD12 LEU 19 8.502 3.513 4.500 146 3HD1 LEU 19 HD13 LEU 19 10.022 2.623 4.425 147 1HD2 LEU 19 HD21 LEU 19 9.675 6.213 3.756 148 2HD2 LEU 19 HD22 LEU 19 10.152 6.755 5.364 149 3HD2 LEU 19 HD23 LEU 19 8.577 6.005 5.119 150 H THR 20 HN THR 20 12.333 4.604 9.140 151 HA THR 20 HA THR 20 12.326 3.817 11.313 152 HB THR 20 HB THR 20 10.930 6.446 11.799 153 HG1 THR 20 HG1 THR 20 12.537 6.899 10.309 154 1HG2 THR 20 HG21 THR 20 12.431 6.549 13.731 155 2HG2 THR 20 HG22 THR 20 13.138 4.999 13.272 156 3HG2 THR 20 HG23 THR 20 11.450 5.083 13.778 157 H ASP 21 HN ASP 21 10.394 2.370 10.381 158 HA ASP 21 HA ASP 21 8.589 1.143 10.881 159 1HB ASP 21 HB2 ASP 21 9.216 1.162 13.217 160 2HB ASP 21 HB1 ASP 21 8.500 2.758 13.436 161 H ALA 22 HN ALA 22 7.778 4.463 12.015 162 HA ALA 22 HA ALA 22 5.666 4.446 9.995 163 1HB ALA 22 HB1 ALA 22 3.978 5.242 11.562 164 2HB ALA 22 HB2 ALA 22 5.136 5.122 12.887 165 3HB ALA 22 HB3 ALA 22 4.599 3.664 12.051 166 H ALA 23 HN ALA 23 7.518 5.834 9.215 167 HA ALA 23 HA ALA 23 6.690 8.604 9.751 168 1HB ALA 23 HB1 ALA 23 8.917 8.265 10.736 169 2HB ALA 23 HB2 ALA 23 8.976 9.380 9.369 170 3HB ALA 23 HB3 ALA 23 9.520 7.713 9.173 171 HA PRO 24 HA PRO 24 5.730 7.538 5.483 172 1HB PRO 24 HB2 PRO 24 3.972 9.558 5.069 173 2HB PRO 24 HB1 PRO 24 3.554 8.081 5.940 174 1HG PRO 24 HG2 PRO 24 4.315 10.770 7.013 175 2HG PRO 24 HG1 PRO 24 3.031 9.673 7.556 176 1HD PRO 24 HD2 PRO 24 5.414 9.879 8.826 177 2HD PRO 24 HD1 PRO 24 4.494 8.363 8.762 178 H ILE 25 HN ILE 25 7.222 7.977 4.004 179 HA ILE 25 HA ILE 25 8.289 10.630 3.646 180 HB ILE 25 HB ILE 25 9.193 9.524 1.468 181 1HG1 ILE 25 HG12 ILE 25 8.544 7.075 3.098 182 2HG1 ILE 25 HG11 ILE 25 7.737 7.547 1.618 183 1HG2 ILE 25 HG21 ILE 25 10.553 10.204 3.370 184 2HG2 ILE 25 HG22 ILE 25 11.116 8.670 2.709 185 3HG2 ILE 25 HG23 ILE 25 10.168 8.694 4.196 186 1HD1 ILE 25 HD11 ILE 25 9.363 5.816 1.178 187 2HD1 ILE 25 HD12 ILE 25 10.635 6.811 1.886 188 3HD1 ILE 25 HD13 ILE 25 9.845 7.324 0.396 189 H GLY 26 HN GLY 26 6.538 8.465 1.407 190 1HA GLY 26 HA2 GLY 26 5.524 10.896 0.073 191 2HA GLY 26 HA1 GLY 26 5.976 9.433 -0.793 192 HA PRO 27 HA PRO 27 1.685 8.870 1.383 193 1HB PRO 27 HB2 PRO 27 0.176 11.126 1.163 194 2HB PRO 27 HB1 PRO 27 1.103 10.712 2.609 195 1HG PRO 27 HG2 PRO 27 1.746 12.640 0.427 196 2HG PRO 27 HG1 PRO 27 2.062 12.762 2.166 197 1HD PRO 27 HD2 PRO 27 3.965 12.083 0.320 198 2HD PRO 27 HD1 PRO 27 4.017 11.570 2.016 199 H VAL 28 HN VAL 28 0.717 7.693 -0.105 200 HA VAL 28 HA VAL 28 0.439 8.543 -2.837 201 HB VAL 28 HB VAL 28 -0.812 6.147 -1.474 202 1HG1 VAL 28 HG11 VAL 28 -0.272 6.696 -4.393 203 2HG1 VAL 28 HG12 VAL 28 -1.851 6.732 -3.608 204 3HG1 VAL 28 HG13 VAL 28 -0.960 5.216 -3.726 205 1HG2 VAL 28 HG21 VAL 28 1.613 6.101 -1.217 206 2HG2 VAL 28 HG22 VAL 28 1.812 6.342 -2.954 207 3HG2 VAL 28 HG23 VAL 28 1.077 4.857 -2.347 208 H THR 29 HN THR 29 -1.157 9.775 -3.576 209 HA THR 29 HA THR 29 -3.378 10.490 -1.961 210 HB THR 29 HB THR 29 -2.931 11.019 -4.902 211 HG1 THR 29 HG1 THR 29 -2.272 12.852 -2.846 212 1HG2 THR 29 HG21 THR 29 -5.181 11.486 -4.080 213 2HG2 THR 29 HG22 THR 29 -4.322 12.969 -4.500 214 3HG2 THR 29 HG23 THR 29 -4.501 12.500 -2.809 215 H VAL 30 HN VAL 30 -4.818 8.892 -1.579 216 HA VAL 30 HA VAL 30 -5.665 7.160 -3.781 217 HB VAL 30 HB VAL 30 -6.422 7.034 -0.856 218 1HG1 VAL 30 HG11 VAL 30 -6.794 5.028 -3.078 219 2HG1 VAL 30 HG12 VAL 30 -8.063 5.977 -2.307 220 3HG1 VAL 30 HG13 VAL 30 -7.182 4.764 -1.379 221 1HG2 VAL 30 HG21 VAL 30 -4.046 6.657 -1.106 222 2HG2 VAL 30 HG22 VAL 30 -4.336 5.491 -2.396 223 3HG2 VAL 30 HG23 VAL 30 -4.850 5.128 -0.749 224 H GLN 31 HN GLN 31 -7.285 7.889 -4.957 225 HA GLN 31 HA GLN 31 -9.401 9.466 -3.677 226 1HB GLN 31 HB2 GLN 31 -8.829 9.032 -6.616 227 2HB GLN 31 HB1 GLN 31 -10.082 10.073 -5.958 228 1HG GLN 31 HG2 GLN 31 -7.117 10.446 -5.598 229 2HG GLN 31 HG1 GLN 31 -8.145 11.340 -6.714 230 1HE2 GLN 31 HE21 GLN 31 -9.660 12.810 -5.885 231 2HE2 GLN 31 HE22 GLN 31 -9.485 13.474 -4.286 232 H ALA 32 HN ALA 32 -11.428 8.670 -3.498 233 HA ALA 32 HA ALA 32 -11.940 6.030 -4.691 234 1HB ALA 32 HB1 ALA 32 -11.625 5.849 -2.273 235 2HB ALA 32 HB2 ALA 32 -13.283 5.465 -2.734 236 3HB ALA 32 HB3 ALA 32 -12.907 7.031 -2.014 237 H LEU 33 HN LEU 33 -13.319 6.324 -6.305 238 HA LEU 33 HA LEU 33 -15.501 8.270 -5.934 239 1HB LEU 33 HB2 LEU 33 -14.119 7.387 -8.469 240 2HB LEU 33 HB1 LEU 33 -15.583 8.346 -8.447 241 HG LEU 33 HG LEU 33 -14.230 10.053 -7.078 242 1HD1 LEU 33 HD11 LEU 33 -12.339 8.611 -6.539 243 2HD1 LEU 33 HD12 LEU 33 -11.819 10.023 -7.460 244 3HD1 LEU 33 HD13 LEU 33 -11.960 8.455 -8.255 245 1HD2 LEU 33 HD21 LEU 33 -14.943 10.414 -9.378 246 2HD2 LEU 33 HD22 LEU 33 -13.535 9.529 -9.964 247 3HD2 LEU 33 HD23 LEU 33 -13.322 11.059 -9.112 248 H GLY 34 HN GLY 34 -17.543 7.608 -6.124 249 1HA GLY 34 HA2 GLY 34 -19.302 6.284 -7.006 250 2HA GLY 34 HA1 GLY 34 -18.127 5.046 -7.430 251 H CYS 35 HN CYS 35 -17.207 5.854 -4.470 252 HA CYS 35 HA CYS 35 -18.455 3.503 -3.338 253 1HB CYS 35 HB2 CYS 35 -16.406 5.383 -2.153 254 2HB CYS 35 HB1 CYS 35 -16.902 3.841 -1.471 255 H ASN 36 HN ASN 36 -20.594 4.121 -2.985 256 HA ASN 36 HA ASN 36 -21.030 6.299 -1.089 257 1HB ASN 36 HB2 ASN 36 -22.968 4.580 -2.655 258 2HB ASN 36 HB1 ASN 36 -23.474 5.782 -1.473 259 1HD2 ASN 36 HD21 ASN 36 -24.557 7.024 -2.980 260 2HD2 ASN 36 HD22 ASN 36 -23.738 7.947 -4.192 261 H ALA 37 HN ALA 37 -20.676 2.928 -1.178 262 HA ALA 37 HA ALA 37 -20.908 2.649 1.635 263 1HB ALA 37 HB1 ALA 37 -22.778 1.071 1.700 264 2HB ALA 37 HB2 ALA 37 -23.064 1.334 -0.021 265 3HB ALA 37 HB3 ALA 37 -23.299 2.654 1.123 266 H ARG 38 HN ARG 38 -18.800 1.897 1.176 267 HA ARG 38 HA ARG 38 -18.636 -0.932 0.782 268 1HB ARG 38 HB2 ARG 38 -18.732 0.092 -1.578 269 2HB ARG 38 HB1 ARG 38 -17.155 0.785 -1.210 270 1HG ARG 38 HG2 ARG 38 -16.782 -1.182 -2.471 271 2HG ARG 38 HG1 ARG 38 -16.319 -1.538 -0.808 272 1HD ARG 38 HD2 ARG 38 -19.059 -2.200 -1.833 273 2HD ARG 38 HD1 ARG 38 -17.698 -3.281 -2.116 274 HE ARG 38 HE ARG 38 -17.473 -3.191 0.432 275 1HH1 ARG 38 HH11 ARG 38 -20.518 -2.982 -1.298 276 2HH1 ARG 38 HH12 ARG 38 -21.437 -3.707 -0.008 277 1HH2 ARG 38 HH21 ARG 38 -18.691 -4.122 2.120 278 2HH2 ARG 38 HH22 ARG 38 -20.410 -4.331 1.930 279 H GLN 39 HN GLN 39 -16.643 -1.760 1.531 280 HA GLN 39 HA GLN 39 -14.931 0.067 2.953 281 1HB GLN 39 HB2 GLN 39 -14.537 -2.892 2.428 282 2HB GLN 39 HB1 GLN 39 -13.622 -1.904 3.548 283 1HG GLN 39 HG2 GLN 39 -15.119 -3.180 4.834 284 2HG GLN 39 HG1 GLN 39 -15.726 -1.529 4.830 285 1HE2 GLN 39 HE21 GLN 39 -17.749 -2.374 5.452 286 2HE2 GLN 39 HE22 GLN 39 -18.810 -3.099 4.292 287 H VAL 40 HN VAL 40 -13.212 1.057 2.102 288 HA VAL 40 HA VAL 40 -12.232 0.233 -0.523 289 HB VAL 40 HB VAL 40 -11.489 2.653 1.139 290 1HG1 VAL 40 HG11 VAL 40 -10.466 3.500 -0.923 291 2HG1 VAL 40 HG12 VAL 40 -10.850 1.981 -1.733 292 3HG1 VAL 40 HG13 VAL 40 -9.705 2.000 -0.390 293 1HG2 VAL 40 HG21 VAL 40 -13.817 2.722 0.418 294 2HG2 VAL 40 HG22 VAL 40 -13.320 2.418 -1.247 295 3HG2 VAL 40 HG23 VAL 40 -12.855 3.921 -0.449 296 H ALA 41 HN ALA 41 -10.403 -0.920 -0.753 297 HA ALA 41 HA ALA 41 -8.683 -1.228 1.600 298 1HB ALA 41 HB1 ALA 41 -10.075 -3.230 1.109 299 2HB ALA 41 HB2 ALA 41 -8.339 -3.530 1.031 300 3HB ALA 41 HB3 ALA 41 -9.270 -3.351 -0.456 301 H LEU 42 HN LEU 42 -6.513 -1.325 1.275 302 HA LEU 42 HA LEU 42 -5.544 -0.516 -1.375 303 1HB LEU 42 HB2 LEU 42 -4.013 -0.513 1.220 304 2HB LEU 42 HB1 LEU 42 -3.643 0.377 -0.248 305 HG LEU 42 HG LEU 42 -6.096 0.913 1.419 306 1HD1 LEU 42 HD11 LEU 42 -4.873 2.859 2.294 307 2HD1 LEU 42 HD12 LEU 42 -3.406 2.265 1.514 308 3HD1 LEU 42 HD13 LEU 42 -4.162 1.327 2.802 309 1HD2 LEU 42 HD21 LEU 42 -6.086 3.047 0.204 310 2HD2 LEU 42 HD22 LEU 42 -6.242 1.667 -0.884 311 3HD2 LEU 42 HD23 LEU 42 -4.695 2.499 -0.730 312 H LYS 43 HN LYS 43 -4.660 -2.075 -2.591 313 HA LYS 43 HA LYS 43 -3.498 -4.420 -1.235 314 1HB LYS 43 HB2 LYS 43 -4.764 -4.429 -3.983 315 2HB LYS 43 HB1 LYS 43 -4.193 -5.818 -3.076 316 1HG LYS 43 HG2 LYS 43 -6.518 -5.911 -2.890 317 2HG LYS 43 HG1 LYS 43 -5.976 -5.211 -1.360 318 1HD LYS 43 HD2 LYS 43 -6.681 -3.069 -1.950 319 2HD LYS 43 HD1 LYS 43 -6.719 -3.450 -3.671 320 1HE LYS 43 HE2 LYS 43 -8.540 -4.836 -1.754 321 2HE LYS 43 HE1 LYS 43 -8.938 -3.232 -2.371 322 1HZ LYS 43 HZ1 LYS 43 -8.484 -5.684 -3.983 323 2HZ LYS 43 HZ2 LYS 43 -8.730 -4.144 -4.635 324 3HZ LYS 43 HZ3 LYS 43 -9.962 -4.890 -3.746 325 H ALA 44 HN ALA 44 -1.650 -5.330 -2.201 326 HA ALA 44 HA ALA 44 -0.249 -3.505 -4.018 327 1HB ALA 44 HB1 ALA 44 0.920 -3.951 -1.942 328 2HB ALA 44 HB2 ALA 44 1.797 -4.651 -3.303 329 3HB ALA 44 HB3 ALA 44 0.836 -5.687 -2.247 330 H ASP 45 HN ASP 45 0.975 -4.424 -5.753 331 HA ASP 45 HA ASP 45 -0.443 -6.520 -7.117 332 1HB ASP 45 HB2 ASP 45 0.544 -4.598 -8.329 333 2HB ASP 45 HB1 ASP 45 2.151 -5.141 -7.853 334 H THR 46 HN THR 46 0.520 -8.519 -7.831 335 HA THR 46 HA THR 46 1.552 -9.984 -5.702 336 HB THR 46 HB THR 46 0.287 -11.062 -7.458 337 HG1 THR 46 HG1 THR 46 2.872 -11.932 -6.842 338 1HG2 THR 46 HG21 THR 46 1.064 -9.745 -9.363 339 2HG2 THR 46 HG22 THR 46 1.240 -11.471 -9.678 340 3HG2 THR 46 HG23 THR 46 2.652 -10.505 -9.251 341 H ASP 47 HN ASP 47 3.246 -8.017 -7.933 342 HA ASP 47 HA ASP 47 5.749 -9.311 -7.986 343 1HB ASP 47 HB2 ASP 47 4.697 -7.053 -9.123 344 2HB ASP 47 HB1 ASP 47 5.808 -6.367 -7.940 345 H ASN 48 HN ASN 48 4.197 -7.259 -5.633 346 HA ASN 48 HA ASN 48 6.458 -7.639 -3.796 347 1HB ASN 48 HB2 ASN 48 6.129 -5.314 -2.975 348 2HB ASN 48 HB1 ASN 48 6.659 -5.358 -4.652 349 1HD2 ASN 48 HD21 ASN 48 4.248 -4.358 -2.476 350 2HD2 ASN 48 HD22 ASN 48 3.168 -3.659 -3.632 351 H PHE 49 HN PHE 49 3.798 -8.883 -4.201 352 HA PHE 49 HA PHE 49 2.697 -8.479 -1.497 353 1HB PHE 49 HB2 PHE 49 1.279 -7.333 -3.170 354 2HB PHE 49 HB1 PHE 49 1.140 -8.827 -4.071 355 HD1 PHE 49 HD1 PHE 49 0.130 -7.063 -1.012 356 HD2 PHE 49 HD2 PHE 49 -0.483 -10.491 -3.465 357 HE1 PHE 49 HE1 PHE 49 -1.864 -7.648 0.303 358 HE2 PHE 49 HE2 PHE 49 -2.480 -11.065 -2.166 359 HZ PHE 49 HZ PHE 49 -3.382 -9.484 -0.550 360 H GLU 50 HN GLU 50 3.438 -10.339 -0.591 361 HA GLU 50 HA GLU 50 3.198 -12.853 -2.075 362 1HB GLU 50 HB2 GLU 50 4.546 -12.168 0.536 363 2HB GLU 50 HB1 GLU 50 4.384 -13.812 -0.055 364 1HG GLU 50 HG2 GLU 50 5.675 -13.196 -2.050 365 2HG GLU 50 HG1 GLU 50 5.891 -11.577 -1.387 366 H GLN 51 HN GLN 51 1.095 -13.469 -2.002 367 HA GLN 51 HA GLN 51 -0.726 -14.557 -1.158 368 1HB GLN 51 HB2 GLN 51 0.717 -15.850 0.274 369 2HB GLN 51 HB1 GLN 51 0.886 -14.508 1.397 370 1HG GLN 51 HG2 GLN 51 -1.675 -14.733 1.671 371 2HG GLN 51 HG1 GLN 51 -1.437 -16.333 0.969 372 1HE2 GLN 51 HE21 GLN 51 -2.294 -15.538 3.647 373 2HE2 GLN 51 HE22 GLN 51 -1.178 -16.269 4.747 374 H GLY 52 HN GLY 52 0.422 -12.259 1.286 375 1HA GLY 52 HA2 GLY 52 -1.761 -10.485 0.992 376 2HA GLY 52 HA1 GLY 52 -2.028 -11.549 2.372 377 H LYS 53 HN LYS 53 1.111 -10.422 1.268 378 HA LYS 53 HA LYS 53 1.163 -8.408 3.381 379 1HB LYS 53 HB2 LYS 53 2.723 -10.817 3.212 380 2HB LYS 53 HB1 LYS 53 3.762 -9.439 3.006 381 1HG LYS 53 HG2 LYS 53 3.799 -9.927 5.301 382 2HG LYS 53 HG1 LYS 53 2.743 -8.522 5.142 383 1HD LYS 53 HD2 LYS 53 0.785 -9.917 5.305 384 2HD LYS 53 HD1 LYS 53 1.777 -11.376 5.294 385 1HE LYS 53 HE2 LYS 53 1.748 -9.245 7.431 386 2HE LYS 53 HE1 LYS 53 1.025 -10.848 7.549 387 1HZ LYS 53 HZ1 LYS 53 3.149 -10.788 8.663 388 2HZ LYS 53 HZ2 LYS 53 3.923 -10.251 7.257 389 3HZ LYS 53 HZ3 LYS 53 3.245 -11.806 7.310 390 H PHE 54 HN PHE 54 1.922 -6.467 2.620 391 HA PHE 54 HA PHE 54 3.249 -6.513 0.001 392 1HB PHE 54 HB2 PHE 54 2.754 -3.947 0.122 393 2HB PHE 54 HB1 PHE 54 1.497 -5.074 -0.346 394 HD1 PHE 54 HD1 PHE 54 -0.589 -4.531 0.481 395 HD2 PHE 54 HD2 PHE 54 2.851 -3.721 2.845 396 HE1 PHE 54 HE1 PHE 54 -2.030 -3.634 2.267 397 HE2 PHE 54 HE2 PHE 54 1.417 -2.812 4.628 398 HZ PHE 54 HZ PHE 54 -1.116 -2.697 4.225 399 H PHE 55 HN PHE 55 5.167 -5.511 -0.357 400 HA PHE 55 HA PHE 55 6.576 -4.298 1.881 401 1HB PHE 55 HB2 PHE 55 8.557 -5.845 1.403 402 2HB PHE 55 HB1 PHE 55 7.215 -6.540 2.293 403 HD1 PHE 55 HD1 PHE 55 8.863 -6.370 -0.981 404 HD2 PHE 55 HD2 PHE 55 5.978 -8.363 1.422 405 HE1 PHE 55 HE1 PHE 55 8.723 -8.161 -2.651 406 HE2 PHE 55 HE2 PHE 55 5.830 -10.166 -0.246 407 HZ PHE 55 HZ PHE 55 7.180 -10.099 -2.252 408 H LEU 56 HN LEU 56 8.692 -3.442 1.236 409 HA LEU 56 HA LEU 56 8.736 -2.405 -1.478 410 1HB LEU 56 HB2 LEU 56 10.912 -2.149 0.599 411 2HB LEU 56 HB1 LEU 56 10.604 -1.103 -0.769 412 HG LEU 56 HG LEU 56 8.672 -1.328 1.519 413 1HD1 LEU 56 HD11 LEU 56 10.836 -0.652 2.417 414 2HD1 LEU 56 HD12 LEU 56 9.693 0.692 2.432 415 3HD1 LEU 56 HD13 LEU 56 10.952 0.617 1.199 416 1HD2 LEU 56 HD21 LEU 56 7.952 0.861 0.715 417 2HD2 LEU 56 HD22 LEU 56 7.814 -0.365 -0.546 418 3HD2 LEU 56 HD23 LEU 56 9.152 0.784 -0.574 419 H ILE 57 HN ILE 57 9.533 -3.724 -3.072 420 HA ILE 57 HA ILE 57 11.598 -5.652 -2.269 421 HB ILE 57 HB ILE 57 9.641 -6.737 -3.186 422 1HG1 ILE 57 HG12 ILE 57 10.706 -8.002 -5.048 423 2HG1 ILE 57 HG11 ILE 57 12.001 -6.810 -5.076 424 1HG2 ILE 57 HG21 ILE 57 8.782 -4.921 -4.560 425 2HG2 ILE 57 HG22 ILE 57 8.914 -6.416 -5.485 426 3HG2 ILE 57 HG23 ILE 57 10.115 -5.144 -5.694 427 1HD1 ILE 57 HD11 ILE 57 12.655 -8.815 -3.871 428 2HD1 ILE 57 HD12 ILE 57 11.302 -8.598 -2.760 429 3HD1 ILE 57 HD13 ILE 57 12.610 -7.416 -2.797 430 H SER 58 HN SER 58 13.565 -5.455 -2.958 431 HA SER 58 HA SER 58 14.295 -3.196 -4.592 432 1HB SER 58 HB2 SER 58 15.550 -3.608 -2.553 433 2HB SER 58 HB1 SER 58 15.949 -5.239 -3.088 434 HG SER 58 HG SER 58 17.510 -3.343 -3.399 435 H ASP 59 HN ASP 59 15.578 -3.293 -6.432 436 HA ASP 59 HA ASP 59 15.121 -5.284 -8.332 437 1HB ASP 59 HB2 ASP 59 15.864 -2.976 -8.843 438 2HB ASP 59 HB1 ASP 59 17.443 -3.348 -8.162 439 H ASN 60 HN ASN 60 17.687 -4.869 -5.974 440 HA ASN 60 HA ASN 60 19.259 -7.088 -6.909 441 1HB ASN 60 HB2 ASN 60 19.351 -5.469 -4.355 442 2HB ASN 60 HB1 ASN 60 20.492 -6.754 -4.735 443 1HD2 ASN 60 HD21 ASN 60 22.026 -6.430 -6.332 444 2HD2 ASN 60 HD22 ASN 60 22.378 -4.861 -6.971 445 H ASN 61 HN ASN 61 16.434 -6.784 -5.139 446 HA ASN 61 HA ASN 61 15.190 -8.100 -3.776 447 1HB ASN 61 HB2 ASN 61 15.569 -9.514 -5.920 448 2HB ASN 61 HB1 ASN 61 16.630 -10.489 -4.908 449 1HD2 ASN 61 HD21 ASN 61 14.125 -11.204 -6.219 450 2HD2 ASN 61 HD22 ASN 61 13.057 -11.741 -4.957 451 H ARG 62 HN ARG 62 17.801 -7.205 -2.747 452 HA ARG 62 HA ARG 62 18.601 -9.321 -0.946 453 1HB ARG 62 HB2 ARG 62 19.379 -6.405 -1.091 454 2HB ARG 62 HB1 ARG 62 20.016 -7.528 0.097 455 1HG ARG 62 HG2 ARG 62 20.298 -7.908 -2.873 456 2HG ARG 62 HG1 ARG 62 21.499 -7.104 -1.862 457 1HD ARG 62 HD2 ARG 62 22.178 -9.383 -2.168 458 2HD ARG 62 HD1 ARG 62 21.655 -9.180 -0.498 459 HE ARG 62 HE ARG 62 19.675 -10.406 -1.009 460 1HH1 ARG 62 HH11 ARG 62 22.123 -10.409 -3.507 461 2HH1 ARG 62 HH12 ARG 62 21.441 -11.767 -4.361 462 1HH2 ARG 62 HH21 ARG 62 18.761 -12.192 -2.120 463 2HH2 ARG 62 HH22 ARG 62 19.525 -12.775 -3.568 464 H ASP 63 HN ASP 63 16.729 -6.367 -0.864 465 HA ASP 63 HA ASP 63 15.761 -7.105 1.805 466 1HB ASP 63 HB2 ASP 63 16.694 -4.487 0.755 467 2HB ASP 63 HB1 ASP 63 15.302 -4.470 1.832 468 H LYS 64 HN LYS 64 13.710 -7.606 1.841 469 HA LYS 64 HA LYS 64 11.897 -5.939 0.268 470 1HB LYS 64 HB2 LYS 64 10.320 -7.888 0.122 471 2HB LYS 64 HB1 LYS 64 11.771 -8.031 -0.849 472 1HG LYS 64 HG2 LYS 64 11.762 -10.115 -0.011 473 2HG LYS 64 HG1 LYS 64 12.580 -9.336 1.344 474 1HD LYS 64 HD2 LYS 64 10.879 -9.748 2.732 475 2HD LYS 64 HD1 LYS 64 9.691 -9.158 1.562 476 1HE LYS 64 HE2 LYS 64 9.427 -11.567 2.218 477 2HE LYS 64 HE1 LYS 64 9.587 -11.288 0.487 478 1HZ LYS 64 HZ1 LYS 64 11.930 -11.973 2.156 479 2HZ LYS 64 HZ2 LYS 64 11.743 -12.124 0.475 480 3HZ LYS 64 HZ3 LYS 64 10.921 -13.175 1.516 481 H LEU 65 HN LEU 65 11.154 -4.600 1.699 482 HA LEU 65 HA LEU 65 10.911 -5.494 4.483 483 1HB LEU 65 HB2 LEU 65 10.640 -2.630 3.841 484 2HB LEU 65 HB1 LEU 65 11.504 -3.404 5.149 485 HG LEU 65 HG LEU 65 12.457 -3.242 2.312 486 1HD1 LEU 65 HD11 LEU 65 12.400 -1.045 3.348 487 2HD1 LEU 65 HD12 LEU 65 14.060 -1.598 3.133 488 3HD1 LEU 65 HD13 LEU 65 13.308 -1.665 4.727 489 1HD2 LEU 65 HD21 LEU 65 13.345 -5.184 3.445 490 2HD2 LEU 65 HD22 LEU 65 13.812 -4.195 4.828 491 3HD2 LEU 65 HD23 LEU 65 14.614 -3.971 3.273 492 H TYR 66 HN TYR 66 8.960 -5.884 5.231 493 HA TYR 66 HA TYR 66 6.646 -5.389 3.678 494 1HB TYR 66 HB2 TYR 66 6.871 -6.202 6.586 495 2HB TYR 66 HB1 TYR 66 5.415 -6.311 5.605 496 HD1 TYR 66 HD1 TYR 66 8.824 -7.664 6.061 497 HD2 TYR 66 HD2 TYR 66 5.058 -8.178 4.133 498 HE1 TYR 66 HE1 TYR 66 9.487 -9.926 5.377 499 HE2 TYR 66 HE2 TYR 66 5.723 -10.437 3.443 500 HH TYR 66 HH TYR 66 7.741 -11.748 3.078 501 H VAL 67 HN VAL 67 5.441 -3.644 3.573 502 HA VAL 67 HA VAL 67 6.108 -1.427 5.365 503 HB VAL 67 HB VAL 67 4.967 -0.006 3.651 504 1HG1 VAL 67 HG11 VAL 67 6.860 -0.109 2.075 505 2HG1 VAL 67 HG12 VAL 67 7.356 -1.633 2.811 506 3HG1 VAL 67 HG13 VAL 67 7.365 -0.149 3.764 507 1HG2 VAL 67 HG21 VAL 67 4.689 -0.964 1.398 508 2HG2 VAL 67 HG22 VAL 67 3.597 -1.695 2.577 509 3HG2 VAL 67 HG23 VAL 67 5.039 -2.565 2.052 510 H ASN 68 HN ASN 68 4.388 0.094 5.849 511 HA ASN 68 HA ASN 68 1.719 -1.140 5.986 512 1HB ASN 68 HB2 ASN 68 3.169 0.526 8.051 513 2HB ASN 68 HB1 ASN 68 1.416 0.371 8.049 514 1HD2 ASN 68 HD21 ASN 68 3.546 -0.505 9.942 515 2HD2 ASN 68 HD22 ASN 68 3.269 -2.202 10.175 516 H ILE 69 HN ILE 69 0.604 -0.107 4.427 517 HA ILE 69 HA ILE 69 0.983 2.762 4.091 518 HB ILE 69 HB ILE 69 -1.118 2.179 2.455 519 1HG1 ILE 69 HG12 ILE 69 0.716 -0.216 2.340 520 2HG1 ILE 69 HG11 ILE 69 -0.897 -0.242 3.044 521 1HG2 ILE 69 HG21 ILE 69 0.510 2.232 0.639 522 2HG2 ILE 69 HG22 ILE 69 1.807 1.938 1.794 523 3HG2 ILE 69 HG23 ILE 69 0.880 3.437 1.873 524 1HD1 ILE 69 HD11 ILE 69 -0.258 0.409 0.176 525 2HD1 ILE 69 HD12 ILE 69 -1.866 0.292 0.889 526 3HD1 ILE 69 HD13 ILE 69 -0.849 -1.143 0.769 527 H ARG 70 HN ARG 70 0.250 3.418 6.073 528 HA ARG 70 HA ARG 70 -2.567 2.905 6.683 529 1HB ARG 70 HB2 ARG 70 -0.840 2.378 8.412 530 2HB ARG 70 HB1 ARG 70 -0.392 4.074 8.435 531 1HG ARG 70 HG2 ARG 70 -2.381 4.713 9.466 532 2HG ARG 70 HG1 ARG 70 -3.191 3.200 9.047 533 1HD ARG 70 HD2 ARG 70 -0.863 3.454 10.954 534 2HD ARG 70 HD1 ARG 70 -2.555 3.310 11.437 535 HE ARG 70 HE ARG 70 -2.373 1.123 10.035 536 1HH1 ARG 70 HH11 ARG 70 0.069 2.431 12.184 537 2HH1 ARG 70 HH12 ARG 70 0.759 0.879 12.553 538 1HH2 ARG 70 HH21 ARG 70 -1.459 -0.921 10.497 539 2HH2 ARG 70 HH22 ARG 70 -0.108 -1.029 11.593 540 HA PRO 71 HA PRO 71 -3.496 6.769 4.934 541 1HB PRO 71 HB2 PRO 71 -5.856 7.290 6.169 542 2HB PRO 71 HB1 PRO 71 -5.681 6.085 4.892 543 1HG PRO 71 HG2 PRO 71 -5.692 5.687 7.864 544 2HG PRO 71 HG1 PRO 71 -6.567 4.779 6.613 545 1HD PRO 71 HD2 PRO 71 -4.296 3.831 7.661 546 2HD PRO 71 HD1 PRO 71 -4.659 3.634 5.931 547 H MET 72 HN MET 72 -3.389 8.936 5.323 548 HA MET 72 HA MET 72 -2.037 9.648 7.731 549 1HB MET 72 HB2 MET 72 -1.551 10.609 5.450 550 2HB MET 72 HB1 MET 72 -3.050 11.520 5.593 551 1HG MET 72 HG2 MET 72 -1.157 12.901 6.183 552 2HG MET 72 HG1 MET 72 -2.189 12.634 7.588 553 1HE MET 72 HE1 MET 72 1.372 12.820 9.193 554 2HE MET 72 HE2 MET 72 -0.276 13.448 9.221 555 3HE MET 72 HE3 MET 72 0.764 13.759 7.831 556 H ASP 73 HN ASP 73 -3.622 9.136 9.278 557 HA ASP 73 HA ASP 73 -4.917 9.842 10.996 558 1HB ASP 73 HB2 ASP 73 -4.994 12.405 9.423 559 2HB ASP 73 HB1 ASP 73 -5.903 12.197 10.915 560 H ASN 74 HN ASN 74 -6.271 10.618 7.825 561 HA ASN 74 HA ASN 74 -8.922 10.901 8.648 562 1HB ASN 74 HB2 ASN 74 -7.747 10.236 5.961 563 2HB ASN 74 HB1 ASN 74 -9.473 10.463 6.209 564 1HD2 ASN 74 HD21 ASN 74 -6.401 11.984 5.930 565 2HD2 ASN 74 HD22 ASN 74 -6.970 13.618 5.989 566 H SER 75 HN SER 75 -10.094 9.485 9.626 567 HA SER 75 HA SER 75 -11.610 7.813 9.789 568 1HB SER 75 HB2 SER 75 -11.898 7.891 7.374 569 2HB SER 75 HB1 SER 75 -10.480 6.877 7.144 570 HG SER 75 HG SER 75 -11.595 5.194 8.207 571 H ALA 76 HN ALA 76 -11.788 5.574 10.374 572 HA ALA 76 HA ALA 76 -9.248 4.476 11.320 573 1HB ALA 76 HB1 ALA 76 -10.630 3.033 12.733 574 2HB ALA 76 HB2 ALA 76 -12.085 3.706 12.000 575 3HB ALA 76 HB3 ALA 76 -11.028 4.734 12.968 576 H TRP 77 HN TRP 77 -8.282 2.976 10.154 577 HA TRP 77 HA TRP 77 -9.925 1.277 8.390 578 1HB TRP 77 HB2 TRP 77 -7.008 2.076 8.159 579 2HB TRP 77 HB1 TRP 77 -7.808 0.924 7.099 580 HD1 TRP 77 HD1 TRP 77 -8.957 4.498 8.171 581 HE1 TRP 77 HE1 TRP 77 -9.406 5.844 6.020 582 HE3 TRP 77 HE3 TRP 77 -7.585 0.998 4.713 583 HZ2 TRP 77 HZ2 TRP 77 -9.205 5.468 3.231 584 HZ3 TRP 77 HZ3 TRP 77 -7.741 1.568 2.331 585 HH2 TRP 77 HH2 TRP 77 -8.532 3.758 1.604 586 H THR 78 HN THR 78 -9.671 -0.917 8.471 587 HA THR 78 HA THR 78 -8.353 -1.999 10.808 588 HB THR 78 HB THR 78 -9.819 -3.450 8.590 589 HG1 THR 78 HG1 THR 78 -10.732 -1.824 10.532 590 1HG2 THR 78 HG21 THR 78 -8.356 -4.903 9.923 591 2HG2 THR 78 HG22 THR 78 -10.056 -5.246 10.244 592 3HG2 THR 78 HG23 THR 78 -9.110 -4.310 11.402 593 H THR 79 HN THR 79 -6.272 -2.399 10.769 594 HA THR 79 HA THR 79 -4.856 -2.350 8.252 595 HB THR 79 HB THR 79 -4.028 -1.025 10.104 596 HG1 THR 79 HG1 THR 79 -2.373 -3.158 9.233 597 1HG2 THR 79 HG21 THR 79 -4.753 -2.427 11.971 598 2HG2 THR 79 HG22 THR 79 -3.038 -2.035 12.096 599 3HG2 THR 79 HG23 THR 79 -3.539 -3.633 11.540 600 H ASP 80 HN ASP 80 -4.578 -4.055 7.109 601 HA ASP 80 HA ASP 80 -3.458 -6.435 8.430 602 1HB ASP 80 HB2 ASP 80 -5.632 -6.922 7.295 603 2HB ASP 80 HB1 ASP 80 -4.946 -6.334 5.783 604 H ASN 81 HN ASN 81 -1.657 -7.419 7.132 605 HA ASN 81 HA ASN 81 -0.062 -5.205 6.161 606 1HB ASN 81 HB2 ASN 81 0.575 -7.424 7.625 607 2HB ASN 81 HB1 ASN 81 1.130 -7.885 6.020 608 1HD2 ASN 81 HD21 ASN 81 2.685 -6.523 4.968 609 2HD2 ASN 81 HD22 ASN 81 3.727 -5.505 5.894 610 H GLY 82 HN GLY 82 -2.250 -7.135 4.718 611 1HA GLY 82 HA2 GLY 82 -0.833 -6.945 2.135 612 2HA GLY 82 HA1 GLY 82 -1.959 -8.242 2.513 613 H VAL 83 HN VAL 83 -3.837 -6.473 3.877 614 HA VAL 83 HA VAL 83 -4.690 -4.737 1.670 615 HB VAL 83 HB VAL 83 -7.058 -5.312 2.126 616 1HG1 VAL 83 HG11 VAL 83 -5.335 -7.637 1.284 617 2HG1 VAL 83 HG12 VAL 83 -5.897 -6.326 0.247 618 3HG1 VAL 83 HG13 VAL 83 -7.056 -7.456 0.948 619 1HG2 VAL 83 HG21 VAL 83 -5.896 -7.559 3.779 620 2HG2 VAL 83 HG22 VAL 83 -7.594 -7.372 3.342 621 3HG2 VAL 83 HG23 VAL 83 -6.819 -6.187 4.393 622 H PHE 84 HN PHE 84 -5.882 -2.913 2.304 623 HA PHE 84 HA PHE 84 -5.888 -2.391 5.193 624 1HB PHE 84 HB2 PHE 84 -3.966 -1.350 3.510 625 2HB PHE 84 HB1 PHE 84 -5.178 -0.075 3.524 626 HD1 PHE 84 HD1 PHE 84 -5.975 0.747 5.830 627 HD2 PHE 84 HD2 PHE 84 -2.433 -1.528 5.217 628 HE1 PHE 84 HE1 PHE 84 -5.092 1.546 7.986 629 HE2 PHE 84 HE2 PHE 84 -1.546 -0.737 7.366 630 HZ PHE 84 HZ PHE 84 -2.875 0.800 8.753 631 H TYR 85 HN TYR 85 -8.035 -2.189 5.552 632 HA TYR 85 HA TYR 85 -9.505 -0.492 3.672 633 1HB TYR 85 HB2 TYR 85 -11.401 -2.000 3.628 634 2HB TYR 85 HB1 TYR 85 -9.957 -2.819 3.065 635 HD1 TYR 85 HD1 TYR 85 -12.752 -3.028 5.205 636 HD2 TYR 85 HD2 TYR 85 -8.689 -4.243 4.847 637 HE1 TYR 85 HE1 TYR 85 -13.151 -4.821 6.845 638 HE2 TYR 85 HE2 TYR 85 -9.079 -6.045 6.482 639 HH TYR 85 HH TYR 85 -10.561 -6.690 8.190 640 H LYS 86 HN LYS 86 -10.859 0.873 4.495 641 HA LYS 86 HA LYS 86 -10.938 1.249 7.323 642 1HB LYS 86 HB2 LYS 86 -12.406 3.163 6.797 643 2HB LYS 86 HB1 LYS 86 -10.927 3.179 5.847 644 1HG LYS 86 HG2 LYS 86 -12.243 2.119 3.983 645 2HG LYS 86 HG1 LYS 86 -13.692 2.434 4.940 646 1HD LYS 86 HD2 LYS 86 -13.020 4.845 5.000 647 2HD LYS 86 HD1 LYS 86 -11.736 4.453 3.855 648 1HE LYS 86 HE2 LYS 86 -13.531 5.268 2.559 649 2HE LYS 86 HE1 LYS 86 -13.549 3.516 2.348 650 1HZ LYS 86 HZ1 LYS 86 -15.309 3.383 4.002 651 2HZ LYS 86 HZ2 LYS 86 -15.756 4.378 2.709 652 3HZ LYS 86 HZ3 LYS 86 -15.299 5.071 4.186 653 H ASN 87 HN ASN 87 -12.561 0.823 8.733 654 HA ASN 87 HA ASN 87 -14.506 -1.127 7.962 655 1HB ASN 87 HB2 ASN 87 -15.265 -1.008 10.283 656 2HB ASN 87 HB1 ASN 87 -13.512 -1.102 10.226 657 1HD2 ASN 87 HD21 ASN 87 -16.254 0.872 10.990 658 2HD2 ASN 87 HD22 ASN 87 -15.373 2.118 11.808 659 H ASP 88 HN ASP 88 -14.344 2.263 8.035 660 HA ASP 88 HA ASP 88 -17.112 2.877 7.970 661 1HB ASP 88 HB2 ASP 88 -15.573 4.618 8.452 662 2HB ASP 88 HB1 ASP 88 -14.646 4.325 6.992 663 H VAL 89 HN VAL 89 -18.508 2.877 6.321 664 HA VAL 89 HA VAL 89 -17.534 1.684 3.813 665 HB VAL 89 HB VAL 89 -19.893 1.156 3.307 666 1HG1 VAL 89 HG11 VAL 89 -18.527 -0.477 4.466 667 2HG1 VAL 89 HG12 VAL 89 -20.195 -0.562 5.030 668 3HG1 VAL 89 HG13 VAL 89 -18.967 0.227 6.020 669 1HG2 VAL 89 HG21 VAL 89 -21.613 1.407 5.054 670 2HG2 VAL 89 HG22 VAL 89 -21.010 2.966 4.491 671 3HG2 VAL 89 HG23 VAL 89 -20.465 2.317 6.037 672 H GLY 90 HN GLY 90 -17.292 2.910 2.066 673 1HA GLY 90 HA2 GLY 90 -18.789 4.516 0.677 674 2HA GLY 90 HA1 GLY 90 -18.520 5.582 2.051 675 H SER 91 HN SER 91 -17.477 7.087 0.667 676 HA SER 91 HA SER 91 -15.108 6.310 -0.766 677 1HB SER 91 HB2 SER 91 -15.062 8.823 -1.244 678 2HB SER 91 HB1 SER 91 -16.471 7.941 -1.833 679 HG SER 91 HG SER 91 -17.618 9.254 -0.687 680 H TRP 92 HN TRP 92 -13.356 8.305 -0.415 681 HA TRP 92 HA TRP 92 -12.841 8.823 2.364 682 1HB TRP 92 HB2 TRP 92 -12.077 6.446 2.020 683 2HB TRP 92 HB1 TRP 92 -10.888 7.072 0.882 684 HD1 TRP 92 HD1 TRP 92 -11.832 7.463 4.624 685 HE1 TRP 92 HE1 TRP 92 -9.669 8.027 5.912 686 HE3 TRP 92 HE3 TRP 92 -8.618 7.771 0.689 687 HZ2 TRP 92 HZ2 TRP 92 -6.966 8.541 5.319 688 HZ3 TRP 92 HZ3 TRP 92 -6.285 8.312 1.130 689 HH2 TRP 92 HH2 TRP 92 -5.457 8.681 3.392 690 H GLY 93 HN GLY 93 -11.220 8.510 -0.742 691 1HA GLY 93 HA2 GLY 93 -9.684 9.869 -1.819 692 2HA GLY 93 HA1 GLY 93 -10.920 11.072 -1.540 693 H GLY 94 HN GLY 94 -7.792 9.895 -0.600 694 1HA GLY 94 HA2 GLY 94 -7.090 12.425 0.534 695 2HA GLY 94 HA1 GLY 94 -7.291 11.197 1.776 696 H THR 95 HN THR 95 -5.178 10.977 2.407 697 HA THR 95 HA THR 95 -3.366 9.877 0.382 698 HB THR 95 HB THR 95 -1.500 11.074 1.681 699 HG1 THR 95 HG1 THR 95 -2.135 12.920 2.802 700 1HG2 THR 95 HG21 THR 95 -3.443 12.658 -0.001 701 2HG2 THR 95 HG22 THR 95 -2.098 11.682 -0.594 702 3HG2 THR 95 HG23 THR 95 -1.783 13.135 0.355 703 H ILE 96 HN ILE 96 -2.136 8.188 0.987 704 HA ILE 96 HA ILE 96 -2.160 7.370 3.829 705 HB ILE 96 HB ILE 96 -1.712 5.044 2.921 706 1HG1 ILE 96 HG12 ILE 96 -2.736 6.249 0.360 707 2HG1 ILE 96 HG11 ILE 96 -1.037 5.906 0.658 708 1HG2 ILE 96 HG21 ILE 96 -4.342 6.358 2.248 709 2HG2 ILE 96 HG22 ILE 96 -3.897 5.606 3.781 710 3HG2 ILE 96 HG23 ILE 96 -4.077 4.617 2.333 711 1HD1 ILE 96 HD11 ILE 96 -1.599 3.526 0.925 712 2HD1 ILE 96 HD12 ILE 96 -2.024 4.156 -0.669 713 3HD1 ILE 96 HD13 ILE 96 -3.280 3.905 0.545 714 H GLY 97 HN GLY 97 -0.150 6.678 4.714 715 1HA GLY 97 HA2 GLY 97 2.132 7.682 3.136 716 2HA GLY 97 HA1 GLY 97 2.049 7.661 4.891 717 H ILE 98 HN ILE 98 3.960 6.459 2.808 718 HA ILE 98 HA ILE 98 3.714 3.643 3.538 719 HB ILE 98 HB ILE 98 5.412 5.091 1.516 720 1HG1 ILE 98 HG12 ILE 98 3.416 2.850 1.317 721 2HG1 ILE 98 HG11 ILE 98 3.057 4.538 0.989 722 1HG2 ILE 98 HG21 ILE 98 5.600 2.178 2.293 723 2HG2 ILE 98 HG22 ILE 98 6.835 3.406 2.575 724 3HG2 ILE 98 HG23 ILE 98 6.416 2.936 0.927 725 1HD1 ILE 98 HD11 ILE 98 4.975 2.792 -0.542 726 2HD1 ILE 98 HD12 ILE 98 4.657 4.496 -0.868 727 3HD1 ILE 98 HD13 ILE 98 3.372 3.304 -1.068 728 H TYR 99 HN TYR 99 4.679 2.937 5.258 729 HA TYR 99 HA TYR 99 7.422 3.773 5.765 730 1HB TYR 99 HB2 TYR 99 6.502 3.343 8.323 731 2HB TYR 99 HB1 TYR 99 6.818 4.910 7.597 732 HD1 TYR 99 HD1 TYR 99 5.002 6.409 7.061 733 HD2 TYR 99 HD2 TYR 99 4.206 2.473 8.459 734 HE1 TYR 99 HE1 TYR 99 2.629 6.997 7.374 735 HE2 TYR 99 HE2 TYR 99 1.847 3.052 8.779 736 HH TYR 99 HH TYR 99 0.488 5.099 9.145 737 H VAL 100 HN VAL 100 8.475 2.237 7.358 738 HA VAL 100 HA VAL 100 8.025 -0.449 6.286 739 HB VAL 100 HB VAL 100 10.209 0.341 8.174 740 1HG1 VAL 100 HG11 VAL 100 10.031 -1.696 5.962 741 2HG1 VAL 100 HG12 VAL 100 9.972 -2.018 7.695 742 3HG1 VAL 100 HG13 VAL 100 11.453 -1.402 6.963 743 1HG2 VAL 100 HG21 VAL 100 10.190 2.025 6.447 744 2HG2 VAL 100 HG22 VAL 100 10.214 0.772 5.202 745 3HG2 VAL 100 HG23 VAL 100 11.597 0.972 6.280 746 H ASP 101 HN ASP 101 7.004 -2.005 7.490 747 HA ASP 101 HA ASP 101 6.156 -1.523 10.156 748 1HB ASP 101 HB2 ASP 101 4.970 -3.048 8.597 749 2HB ASP 101 HB1 ASP 101 6.328 -4.165 8.683 750 H GLY 102 HN GLY 102 7.804 -1.113 11.568 751 1HA GLY 102 HA2 GLY 102 9.113 -2.174 13.283 752 2HA GLY 102 HA1 GLY 102 9.598 -3.378 12.107 753 H GLN 103 HN GLN 103 9.924 -0.838 10.270 754 HA GLN 103 HA GLN 103 11.695 0.314 9.432 755 1HB GLN 103 HB2 GLN 103 11.710 1.547 11.532 756 2HB GLN 103 HB1 GLN 103 12.692 0.298 12.286 757 1HG GLN 103 HG2 GLN 103 14.520 0.813 10.737 758 2HG GLN 103 HG1 GLN 103 13.527 2.069 9.996 759 1HE2 GLN 103 HE21 GLN 103 14.942 3.729 10.527 760 2HE2 GLN 103 HE22 GLN 103 15.161 4.278 12.152 761 H GLN 104 HN GLN 104 13.098 -0.593 8.113 762 HA GLN 104 HA GLN 104 14.446 -3.031 9.018 763 1HB GLN 104 HB2 GLN 104 13.447 -2.111 6.353 764 2HB GLN 104 HB1 GLN 104 14.675 -3.362 6.444 765 1HG GLN 104 HG2 GLN 104 11.961 -3.459 7.738 766 2HG GLN 104 HG1 GLN 104 12.444 -4.309 6.272 767 1HE2 GLN 104 HE21 GLN 104 15.094 -4.963 7.266 768 2HE2 GLN 104 HE22 GLN 104 14.880 -6.214 8.446 769 H THR 105 HN THR 105 15.129 0.188 8.255 770 HA THR 105 HA THR 105 17.080 1.312 8.593 771 HB THR 105 HB THR 105 18.581 -1.272 8.959 772 HG1 THR 105 HG1 THR 105 17.543 -1.671 10.773 773 1HG2 THR 105 HG21 THR 105 19.821 0.043 10.608 774 2HG2 THR 105 HG22 THR 105 18.765 1.424 10.314 775 3HG2 THR 105 HG23 THR 105 19.833 0.844 9.037 776 H ASN 106 HN ASN 106 16.256 -0.262 6.083 777 HA ASN 106 HA ASN 106 16.923 -0.706 4.006 778 1HB ASN 106 HB2 ASN 106 17.782 1.242 2.817 779 2HB ASN 106 HB1 ASN 106 16.425 1.585 3.838 780 1HD2 ASN 106 HD21 ASN 106 19.854 1.439 4.803 781 2HD2 ASN 106 HD22 ASN 106 19.944 3.119 5.234 782 H THR 107 HN THR 107 18.139 -2.467 4.037 783 HA THR 107 HA THR 107 21.025 -2.341 4.268 784 HB THR 107 HB THR 107 19.537 -4.687 3.123 785 HG1 THR 107 HG1 THR 107 18.254 -4.565 4.808 786 1HG2 THR 107 HG21 THR 107 21.801 -4.496 5.111 787 2HG2 THR 107 HG22 THR 107 21.979 -4.801 3.384 788 3HG2 THR 107 HG23 THR 107 21.154 -5.979 4.407 789 HA PRO 108 HA PRO 108 22.703 -1.014 0.489 790 1HB PRO 108 HB2 PRO 108 22.768 -3.890 -0.348 791 2HB PRO 108 HB1 PRO 108 24.000 -2.637 -0.542 792 1HG PRO 108 HG2 PRO 108 23.851 -4.485 1.571 793 2HG PRO 108 HG1 PRO 108 24.852 -3.025 1.527 794 1HD PRO 108 HD2 PRO 108 22.731 -3.496 3.300 795 2HD PRO 108 HD1 PRO 108 23.452 -1.908 2.951 796 HA PRO 109 HA PRO 109 18.488 -1.417 -1.288 797 1HB PRO 109 HB2 PRO 109 18.660 1.507 -1.470 798 2HB PRO 109 HB1 PRO 109 17.476 0.502 -0.629 799 1HG PRO 109 HG2 PRO 109 19.267 1.948 0.731 800 2HG PRO 109 HG1 PRO 109 18.780 0.334 1.279 801 1HD PRO 109 HD2 PRO 109 21.228 1.128 -0.278 802 2HD PRO 109 HD1 PRO 109 21.102 0.103 1.172 803 H GLY 110 HN GLY 110 17.722 0.609 -3.030 804 1HA GLY 110 HA2 GLY 110 19.206 1.208 -5.218 805 2HA GLY 110 HA1 GLY 110 18.790 -0.494 -5.438 806 H ASN 111 HN ASN 111 17.358 -0.261 -7.116 807 HA ASN 111 HA ASN 111 15.101 1.532 -6.850 808 1HB ASN 111 HB2 ASN 111 15.872 -0.543 -8.899 809 2HB ASN 111 HB1 ASN 111 14.300 0.250 -8.931 810 1HD2 ASN 111 HD21 ASN 111 14.706 1.237 -10.896 811 2HD2 ASN 111 HD22 ASN 111 15.815 2.555 -11.051 812 H TYR 112 HN TYR 112 13.371 1.093 -5.701 813 HA TYR 112 HA TYR 112 12.692 -1.724 -5.203 814 1HB TYR 112 HB2 TYR 112 12.193 0.760 -3.581 815 2HB TYR 112 HB1 TYR 112 11.245 -0.702 -3.329 816 HD1 TYR 112 HD1 TYR 112 11.963 -2.115 -1.653 817 HD2 TYR 112 HD2 TYR 112 14.844 0.280 -3.661 818 HE1 TYR 112 HE1 TYR 112 13.720 -3.009 -0.192 819 HE2 TYR 112 HE2 TYR 112 16.611 -0.618 -2.206 820 HH TYR 112 HH TYR 112 16.895 -1.701 -0.097 821 H THR 113 HN THR 113 11.020 -2.501 -6.197 822 HA THR 113 HA THR 113 9.191 -0.626 -7.532 823 HB THR 113 HB THR 113 9.864 -3.489 -8.193 824 HG1 THR 113 HG1 THR 113 11.298 -1.385 -8.612 825 1HG2 THR 113 HG21 THR 113 8.663 -3.074 -10.303 826 2HG2 THR 113 HG22 THR 113 8.218 -1.468 -9.729 827 3HG2 THR 113 HG23 THR 113 7.596 -2.901 -8.910 828 H LEU 114 HN LEU 114 7.575 -0.369 -6.071 829 HA LEU 114 HA LEU 114 6.139 -2.810 -5.299 830 1HB LEU 114 HB2 LEU 114 5.270 -1.461 -3.340 831 2HB LEU 114 HB1 LEU 114 6.949 -1.963 -3.270 832 HG LEU 114 HG LEU 114 6.371 0.735 -4.361 833 1HD1 LEU 114 HD11 LEU 114 6.241 0.048 -1.431 834 2HD1 LEU 114 HD12 LEU 114 4.922 0.674 -2.422 835 3HD1 LEU 114 HD13 LEU 114 6.333 1.680 -2.092 836 1HD2 LEU 114 HD21 LEU 114 8.654 -0.106 -4.295 837 2HD2 LEU 114 HD22 LEU 114 8.515 -0.381 -2.560 838 3HD2 LEU 114 HD23 LEU 114 8.461 1.261 -3.199 839 H THR 115 HN THR 115 4.437 -2.980 -6.565 840 HA THR 115 HA THR 115 3.065 -0.565 -7.491 841 HB THR 115 HB THR 115 2.589 -3.430 -8.353 842 HG1 THR 115 HG1 THR 115 4.151 -1.468 -9.709 843 1HG2 THR 115 HG21 THR 115 0.770 -1.844 -8.865 844 2HG2 THR 115 HG22 THR 115 1.574 -2.418 -10.325 845 3HG2 THR 115 HG23 THR 115 1.924 -0.806 -9.702 846 H LEU 116 HN LEU 116 0.951 -0.124 -7.005 847 HA LEU 116 HA LEU 116 -0.344 -1.882 -5.022 848 1HB LEU 116 HB2 LEU 116 -0.502 1.116 -5.309 849 2HB LEU 116 HB1 LEU 116 -1.439 0.173 -4.167 850 HG LEU 116 HG LEU 116 1.574 0.403 -4.172 851 1HD1 LEU 116 HD11 LEU 116 0.527 2.502 -3.548 852 2HD1 LEU 116 HD12 LEU 116 1.255 1.732 -2.139 853 3HD1 LEU 116 HD13 LEU 116 -0.491 1.666 -2.377 854 1HD2 LEU 116 HD21 LEU 116 1.427 -0.704 -1.995 855 2HD2 LEU 116 HD22 LEU 116 0.796 -1.729 -3.285 856 3HD2 LEU 116 HD23 LEU 116 -0.315 -0.886 -2.206 857 H THR 117 HN THR 117 -2.254 -2.689 -5.595 858 HA THR 117 HA THR 117 -3.513 -1.642 -8.033 859 HB THR 117 HB THR 117 -3.934 -4.329 -6.707 860 HG1 THR 117 HG1 THR 117 -2.063 -3.375 -8.564 861 1HG2 THR 117 HG21 THR 117 -4.951 -4.943 -8.856 862 2HG2 THR 117 HG22 THR 117 -4.708 -3.298 -9.443 863 3HG2 THR 117 HG23 THR 117 -5.813 -3.602 -8.104 864 H GLY 118 HN GLY 118 -5.290 -0.481 -7.808 865 1HA GLY 118 HA2 GLY 118 -6.493 -0.139 -5.234 866 2HA GLY 118 HA1 GLY 118 -6.990 0.634 -6.731 867 H GLY 119 HN GLY 119 -8.801 -0.272 -4.853 868 1HA GLY 119 HA2 GLY 119 -10.803 -1.338 -6.234 869 2HA GLY 119 HA1 GLY 119 -9.882 -2.783 -5.835 870 H TYR 120 HN TYR 120 -12.439 -2.563 -4.939 871 HA TYR 120 HA TYR 120 -12.306 -1.548 -2.219 872 1HB TYR 120 HB2 TYR 120 -14.699 -1.997 -2.114 873 2HB TYR 120 HB1 TYR 120 -14.313 -1.064 -3.555 874 HD1 TYR 120 HD1 TYR 120 -15.462 -4.300 -2.278 875 HD2 TYR 120 HD2 TYR 120 -14.577 -2.031 -5.770 876 HE1 TYR 120 HE1 TYR 120 -16.676 -5.939 -3.643 877 HE2 TYR 120 HE2 TYR 120 -15.787 -3.672 -7.144 878 HH TYR 120 HH TYR 120 -16.530 -5.953 -7.075 879 H TRP 121 HN TRP 121 -13.515 -3.000 -0.604 880 HA TRP 121 HA TRP 121 -12.768 -5.828 -0.904 881 1HB TRP 121 HB2 TRP 121 -11.030 -5.115 0.507 882 2HB TRP 121 HB1 TRP 121 -12.035 -3.909 1.303 883 HD1 TRP 121 HD1 TRP 121 -13.950 -4.954 3.000 884 HE1 TRP 121 HE1 TRP 121 -13.801 -6.963 4.588 885 HE3 TRP 121 HE3 TRP 121 -9.876 -7.320 0.977 886 HZ2 TRP 121 HZ2 TRP 121 -12.194 -9.200 4.956 887 HZ3 TRP 121 HZ3 TRP 121 -9.113 -9.412 2.057 888 HH2 TRP 121 HH2 TRP 121 -10.252 -10.319 3.982 889 H ALA 122 HN ALA 122 -14.167 -7.266 0.260 890 HA ALA 122 HA ALA 122 -16.493 -6.032 1.556 891 1HB ALA 122 HB1 ALA 122 -16.636 -8.339 -0.381 892 2HB ALA 122 HB2 ALA 122 -17.133 -6.680 -0.715 893 3HB ALA 122 HB3 ALA 122 -17.989 -7.628 0.500 894 H LYS 123 HN LYS 123 -17.218 -7.011 3.335 895 HA LYS 123 HA LYS 123 -17.575 -8.450 5.034 896 1HB LYS 123 HB2 LYS 123 -16.107 -10.471 3.341 897 2HB LYS 123 HB1 LYS 123 -16.959 -10.827 4.838 898 1HG LYS 123 HG2 LYS 123 -18.132 -9.898 2.229 899 2HG LYS 123 HG1 LYS 123 -18.401 -11.435 3.052 900 1HD LYS 123 HD2 LYS 123 -19.578 -10.313 4.845 901 2HD LYS 123 HD1 LYS 123 -19.210 -8.738 4.140 902 1HE LYS 123 HE2 LYS 123 -20.477 -9.465 2.100 903 2HE LYS 123 HE1 LYS 123 -20.984 -10.891 3.004 904 1HZ LYS 123 HZ1 LYS 123 -22.663 -9.168 3.089 905 2HZ LYS 123 HZ2 LYS 123 -21.552 -8.068 3.745 906 3HZ LYS 123 HZ3 LYS 123 -22.025 -9.431 4.638 907 H ASP 124 HN ASP 124 -15.410 -10.591 5.687 908 HA ASP 124 HA ASP 124 -13.241 -8.807 6.447 909 1HB ASP 124 HB2 ASP 124 -13.413 -9.158 8.797 910 2HB ASP 124 HB1 ASP 124 -15.005 -8.657 8.243 911 H ASN 125 HN ASN 125 -11.398 -9.764 6.119 912 HA ASN 125 HA ASN 125 -9.677 -11.223 6.162 913 1HB ASN 125 HB2 ASN 125 -10.234 -11.551 8.454 914 2HB ASN 125 HB1 ASN 125 -11.498 -12.700 8.042 915 1HD2 ASN 125 HD21 ASN 125 -10.961 -14.798 7.562 916 2HD2 ASN 125 HD22 ASN 125 -9.368 -15.438 7.797 917 H LYS 126 HN LYS 126 -12.753 -12.416 5.205 918 HA LYS 126 HA LYS 126 -11.936 -14.939 4.191 919 1HB LYS 126 HB2 LYS 126 -14.134 -15.035 3.200 920 2HB LYS 126 HB1 LYS 126 -14.267 -14.349 4.812 921 1HG LYS 126 HG2 LYS 126 -15.533 -12.798 3.826 922 2HG LYS 126 HG1 LYS 126 -14.003 -12.106 3.285 923 1HD LYS 126 HD2 LYS 126 -14.158 -13.387 1.204 924 2HD LYS 126 HD1 LYS 126 -15.682 -14.090 1.746 925 1HE LYS 126 HE2 LYS 126 -16.644 -11.815 1.845 926 2HE LYS 126 HE1 LYS 126 -15.133 -11.178 1.194 927 1HZ LYS 126 HZ1 LYS 126 -17.034 -13.027 -0.148 928 2HZ LYS 126 HZ2 LYS 126 -15.501 -12.657 -0.765 929 3HZ LYS 126 HZ3 LYS 126 -16.666 -11.433 -0.596 930 H GLN 127 HN GLN 127 -11.107 -11.947 3.228 931 HA GLN 127 HA GLN 127 -10.096 -11.063 1.415 932 1HB GLN 127 HB2 GLN 127 -8.920 -13.194 1.176 933 2HB GLN 127 HB1 GLN 127 -10.279 -13.864 0.284 934 1HG GLN 127 HG2 GLN 127 -9.922 -12.157 -1.463 935 2HG GLN 127 HG1 GLN 127 -8.502 -11.601 -0.581 936 1HE2 GLN 127 HE21 GLN 127 -8.692 -12.683 -3.275 937 2HE2 GLN 127 HE22 GLN 127 -7.636 -14.067 -3.303 938 H GLY 128 HN GLY 128 -12.134 -9.858 1.249 939 1HA GLY 128 HA2 GLY 128 -13.691 -10.725 -1.079 940 2HA GLY 128 HA1 GLY 128 -14.272 -9.631 0.163 941 H PHE 129 HN PHE 129 -11.062 -9.334 -1.243 942 HA PHE 129 HA PHE 129 -11.853 -6.660 -2.036 943 1HB PHE 129 HB2 PHE 129 -9.448 -6.242 -2.433 944 2HB PHE 129 HB1 PHE 129 -9.796 -6.758 -0.802 945 HD1 PHE 129 HD1 PHE 129 -8.813 -8.743 0.091 946 HD2 PHE 129 HD2 PHE 129 -8.339 -7.765 -4.023 947 HE1 PHE 129 HE1 PHE 129 -7.113 -10.507 -0.125 948 HE2 PHE 129 HE2 PHE 129 -6.630 -9.520 -4.243 949 HZ PHE 129 HZ PHE 129 -5.877 -10.760 -2.239 950 H THR 130 HN THR 130 -12.333 -6.081 -4.018 951 HA THR 130 HA THR 130 -11.479 -7.805 -6.250 952 HB THR 130 HB THR 130 -13.863 -5.938 -6.103 953 HG1 THR 130 HG1 THR 130 -13.575 -8.758 -5.869 954 1HG2 THR 130 HG21 THR 130 -12.974 -6.130 -8.379 955 2HG2 THR 130 HG22 THR 130 -14.534 -6.939 -8.237 956 3HG2 THR 130 HG23 THR 130 -13.046 -7.889 -8.265 957 HA PRO 131 HA PRO 131 -8.941 -4.342 -7.544 958 1HB PRO 131 HB2 PRO 131 -8.670 -5.147 -10.163 959 2HB PRO 131 HB1 PRO 131 -7.686 -5.747 -8.824 960 1HG PRO 131 HG2 PRO 131 -10.077 -6.987 -10.127 961 2HG PRO 131 HG1 PRO 131 -8.576 -7.753 -9.576 962 1HD PRO 131 HD2 PRO 131 -10.846 -7.905 -8.153 963 2HD PRO 131 HD1 PRO 131 -9.259 -7.788 -7.365 964 H SER 132 HN SER 132 -9.712 -2.383 -7.979 965 HA SER 132 HA SER 132 -11.428 -1.895 -10.247 966 1HB SER 132 HB2 SER 132 -12.440 -1.357 -7.439 967 2HB SER 132 HB1 SER 132 -13.236 -0.838 -8.923 968 HG SER 132 HG SER 132 -12.749 -3.459 -9.083 969 H GLY 133 HN GLY 133 -10.768 -0.050 -11.123 970 1HA GLY 133 HA2 GLY 133 -10.387 2.372 -10.747 971 2HA GLY 133 HA1 GLY 133 -9.412 1.903 -9.361 972 H THR 134 HN THR 134 -7.282 2.013 -9.719 973 HA THR 134 HA THR 134 -6.311 1.101 -12.343 974 HB THR 134 HB THR 134 -4.450 2.813 -12.101 975 HG1 THR 134 HG1 THR 134 -4.479 4.048 -10.397 976 1HG2 THR 134 HG21 THR 134 -7.257 3.845 -12.498 977 2HG2 THR 134 HG22 THR 134 -6.241 3.093 -13.728 978 3HG2 THR 134 HG23 THR 134 -5.783 4.649 -13.035 979 H THR 135 HN THR 135 -3.798 0.794 -12.161 980 HA THR 135 HA THR 135 -3.093 -0.164 -9.480 981 HB THR 135 HB THR 135 -3.504 -2.101 -10.910 982 HG1 THR 135 HG1 THR 135 -1.347 -3.054 -10.713 983 1HG2 THR 135 HG21 THR 135 -1.319 -1.038 -12.699 984 2HG2 THR 135 HG22 THR 135 -3.036 -1.111 -13.095 985 3HG2 THR 135 HG23 THR 135 -2.122 -2.602 -12.856 986 H GLY 136 HN GLY 136 -1.728 1.293 -8.726 987 1HA GLY 136 HA2 GLY 136 -0.007 2.734 -10.629 988 2HA GLY 136 HA1 GLY 136 -0.512 3.328 -9.053 989 H THR 137 HN THR 137 2.184 2.950 -10.319 990 HA THR 137 HA THR 137 3.334 0.976 -8.488 991 HB THR 137 HB THR 137 4.625 2.364 -10.850 992 HG1 THR 137 HG1 THR 137 3.394 0.913 -11.844 993 1HG2 THR 137 HG21 THR 137 5.588 0.074 -9.130 994 2HG2 THR 137 HG22 THR 137 6.253 1.705 -9.151 995 3HG2 THR 137 HG23 THR 137 6.394 0.677 -10.577 996 H THR 138 HN THR 138 4.062 1.728 -6.623 997 HA THR 138 HA THR 138 4.985 4.473 -6.379 998 HB THR 138 HB THR 138 5.064 2.299 -4.275 999 HG1 THR 138 HG1 THR 138 2.923 3.356 -5.401 1000 1HG2 THR 138 HG21 THR 138 6.439 4.266 -3.805 1001 2HG2 THR 138 HG22 THR 138 5.048 4.198 -2.722 1002 3HG2 THR 138 HG23 THR 138 5.048 5.314 -4.087 1003 H LYS 139 HN LYS 139 6.996 4.905 -7.052 1004 HA LYS 139 HA LYS 139 8.959 2.728 -7.005 1005 1HB LYS 139 HB2 LYS 139 8.508 3.904 -9.167 1006 2HB LYS 139 HB1 LYS 139 9.130 5.379 -8.441 1007 1HG LYS 139 HG2 LYS 139 11.307 4.365 -8.157 1008 2HG LYS 139 HG1 LYS 139 10.698 2.831 -8.780 1009 1HD LYS 139 HD2 LYS 139 10.869 5.432 -10.304 1010 2HD LYS 139 HD1 LYS 139 11.936 4.039 -10.500 1011 1HE LYS 139 HE2 LYS 139 10.041 2.681 -11.222 1012 2HE LYS 139 HE1 LYS 139 8.962 4.059 -11.003 1013 1HZ LYS 139 HZ1 LYS 139 10.264 5.251 -12.691 1014 2HZ LYS 139 HZ2 LYS 139 9.543 3.845 -13.304 1015 3HZ LYS 139 HZ3 LYS 139 11.201 3.858 -12.944 1016 H LEU 140 HN LEU 140 10.042 2.635 -5.275 1017 HA LEU 140 HA LEU 140 10.876 5.098 -3.940 1018 1HB LEU 140 HB2 LEU 140 9.727 3.713 -2.428 1019 2HB LEU 140 HB1 LEU 140 10.521 2.263 -3.012 1020 HG LEU 140 HG LEU 140 12.623 3.029 -2.020 1021 1HD1 LEU 140 HD11 LEU 140 12.296 5.425 -2.091 1022 2HD1 LEU 140 HD12 LEU 140 12.592 4.919 -0.427 1023 3HD1 LEU 140 HD13 LEU 140 10.953 5.303 -0.955 1024 1HD2 LEU 140 HD21 LEU 140 11.171 1.551 -0.763 1025 2HD2 LEU 140 HD22 LEU 140 10.301 2.938 -0.106 1026 3HD2 LEU 140 HD23 LEU 140 11.993 2.677 0.319 1027 H THR 141 HN THR 141 12.638 5.695 -5.070 1028 HA THR 141 HA THR 141 14.796 3.756 -5.468 1029 HB THR 141 HB THR 141 14.665 6.598 -6.501 1030 HG1 THR 141 HG1 THR 141 13.800 5.727 -8.401 1031 1HG2 THR 141 HG21 THR 141 16.255 4.178 -7.371 1032 2HG2 THR 141 HG22 THR 141 16.887 5.599 -6.540 1033 3HG2 THR 141 HG23 THR 141 16.260 5.744 -8.183 1034 H VAL 142 HN VAL 142 16.821 4.057 -4.509 1035 HA VAL 142 HA VAL 142 16.910 5.879 -2.260 1036 HB VAL 142 HB VAL 142 17.877 3.631 -2.047 1037 1HG1 VAL 142 HG11 VAL 142 19.879 4.576 -4.094 1038 2HG1 VAL 142 HG12 VAL 142 18.686 3.294 -4.304 1039 3HG1 VAL 142 HG13 VAL 142 20.008 3.089 -3.154 1040 1HG2 VAL 142 HG21 VAL 142 20.030 4.280 -1.040 1041 2HG2 VAL 142 HG22 VAL 142 18.715 5.370 -0.596 1042 3HG2 VAL 142 HG23 VAL 142 19.892 5.859 -1.814 1043 H THR 143 HN THR 143 18.239 7.664 -2.068 1044 HA THR 143 HA THR 143 18.666 9.173 -4.391 1045 HB THR 143 HB THR 143 20.180 10.488 -2.593 1046 HG1 THR 143 HG1 THR 143 20.025 8.962 -0.951 1047 1HG2 THR 143 HG21 THR 143 18.137 11.693 -1.945 1048 2HG2 THR 143 HG22 THR 143 17.158 10.392 -2.624 1049 3HG2 THR 143 HG23 THR 143 18.182 11.371 -3.677 Start of MODEL 4 1 H GLU 1 H GLU 1 -22.357 3.836 -8.588 2 HA GLU 1 HA GLU 1 -23.015 2.132 -10.917 3 1HB GLU 1 HB2 GLU 1 -22.264 4.481 -11.449 4 2HB GLU 1 HB1 GLU 1 -20.766 4.131 -10.600 5 1HG GLU 1 HG2 GLU 1 -20.352 3.868 -12.916 6 2HG GLU 1 HG1 GLU 1 -20.389 2.256 -12.201 7 H GLU 2 HN GLU 2 -20.036 3.172 -9.347 8 HA GLU 2 HA GLU 2 -19.558 0.833 -7.860 9 1HB GLU 2 HB2 GLU 2 -19.242 -0.182 -10.098 10 2HB GLU 2 HB1 GLU 2 -18.033 1.037 -10.475 11 1HG GLU 2 HG2 GLU 2 -16.983 -1.059 -9.858 12 2HG GLU 2 HG1 GLU 2 -16.612 0.198 -8.682 13 H CYS 3 HN CYS 3 -17.462 0.939 -6.815 14 HA CYS 3 HA CYS 3 -16.577 3.703 -6.585 15 1HB CYS 3 HB2 CYS 3 -17.087 2.454 -4.541 16 2HB CYS 3 HB1 CYS 3 -15.862 1.262 -4.949 17 H GLN 4 HN GLN 4 -15.094 4.315 -7.973 18 HA GLN 4 HA GLN 4 -12.953 2.463 -8.725 19 1HB GLN 4 HB2 GLN 4 -14.051 3.605 -10.574 20 2HB GLN 4 HB1 GLN 4 -13.733 5.169 -9.831 21 1HG GLN 4 HG2 GLN 4 -11.308 4.711 -10.038 22 2HG GLN 4 HG1 GLN 4 -11.698 3.233 -10.911 23 1HE2 GLN 4 HE21 GLN 4 -13.963 4.451 -12.298 24 2HE2 GLN 4 HE22 GLN 4 -13.274 5.485 -13.507 25 H VAL 5 HN VAL 5 -10.950 2.698 -7.923 26 HA VAL 5 HA VAL 5 -10.518 4.952 -6.077 27 HB VAL 5 HB VAL 5 -9.116 2.267 -6.157 28 1HG1 VAL 5 HG11 VAL 5 -9.009 4.472 -4.111 29 2HG1 VAL 5 HG12 VAL 5 -7.722 4.028 -5.231 30 3HG1 VAL 5 HG13 VAL 5 -8.229 2.898 -3.975 31 1HG2 VAL 5 HG21 VAL 5 -11.253 3.265 -4.279 32 2HG2 VAL 5 HG22 VAL 5 -10.396 1.731 -4.144 33 3HG2 VAL 5 HG23 VAL 5 -11.458 2.031 -5.519 34 H ARG 6 HN ARG 6 -8.817 6.322 -6.421 35 HA ARG 6 HA ARG 6 -7.332 5.923 -8.898 36 1HB ARG 6 HB2 ARG 6 -8.325 8.092 -8.628 37 2HB ARG 6 HB1 ARG 6 -7.548 8.314 -7.063 38 1HG ARG 6 HG2 ARG 6 -6.174 9.566 -8.387 39 2HG ARG 6 HG1 ARG 6 -5.356 8.008 -8.490 40 1HD ARG 6 HD2 ARG 6 -7.237 9.219 -10.512 41 2HD ARG 6 HD1 ARG 6 -5.503 8.970 -10.692 42 HE ARG 6 HE ARG 6 -7.402 6.722 -10.433 43 1HH1 ARG 6 HH11 ARG 6 -4.761 8.335 -12.091 44 2HH1 ARG 6 HH12 ARG 6 -4.483 7.010 -13.188 45 1HH2 ARG 6 HH21 ARG 6 -7.029 4.989 -11.857 46 2HH2 ARG 6 HH22 ARG 6 -5.785 5.111 -13.065 47 H VAL 7 HN VAL 7 -5.740 4.504 -8.546 48 HA VAL 7 HA VAL 7 -3.589 5.414 -6.759 49 HB VAL 7 HB VAL 7 -4.415 2.536 -7.250 50 1HG1 VAL 7 HG11 VAL 7 -2.504 1.900 -5.858 51 2HG1 VAL 7 HG12 VAL 7 -2.006 3.588 -5.760 52 3HG1 VAL 7 HG13 VAL 7 -1.975 2.750 -7.311 53 1HG2 VAL 7 HG21 VAL 7 -4.682 2.456 -4.816 54 2HG2 VAL 7 HG22 VAL 7 -5.726 3.683 -5.535 55 3HG2 VAL 7 HG23 VAL 7 -4.243 4.161 -4.710 56 H GLY 8 HN GLY 8 -1.956 6.049 -7.983 57 1HA GLY 8 HA2 GLY 8 -1.479 4.620 -10.517 58 2HA GLY 8 HA1 GLY 8 -1.408 6.373 -10.407 59 H ASP 9 HN ASP 9 0.712 6.567 -11.016 60 HA ASP 9 HA ASP 9 2.733 5.042 -9.561 61 1HB ASP 9 HB2 ASP 9 3.289 4.947 -11.780 62 2HB ASP 9 HB1 ASP 9 2.676 6.560 -12.128 63 H LEU 10 HN LEU 10 4.283 5.903 -8.315 64 HA LEU 10 HA LEU 10 4.586 8.760 -8.025 65 1HB LEU 10 HB2 LEU 10 4.304 8.632 -5.529 66 2HB LEU 10 HB1 LEU 10 2.822 8.511 -6.458 67 HG LEU 10 HG LEU 10 4.043 5.921 -5.805 68 1HD1 LEU 10 HD11 LEU 10 2.903 7.665 -3.619 69 2HD1 LEU 10 HD12 LEU 10 4.586 7.161 -3.761 70 3HD1 LEU 10 HD13 LEU 10 3.328 5.960 -3.469 71 1HD2 LEU 10 HD21 LEU 10 1.732 5.367 -5.286 72 2HD2 LEU 10 HD22 LEU 10 1.841 6.176 -6.850 73 3HD2 LEU 10 HD23 LEU 10 1.276 7.064 -5.435 74 H THR 11 HN THR 11 6.672 9.158 -7.815 75 HA THR 11 HA THR 11 8.407 6.984 -6.836 76 HB THR 11 HB THR 11 9.118 9.156 -8.819 77 HG1 THR 11 HG1 THR 11 7.945 6.663 -9.106 78 1HG2 THR 11 HG21 THR 11 11.041 8.327 -7.553 79 2HG2 THR 11 HG22 THR 11 11.114 7.784 -9.229 80 3HG2 THR 11 HG23 THR 11 10.606 6.667 -7.963 81 H VAL 12 HN VAL 12 9.278 7.413 -4.917 82 HA VAL 12 HA VAL 12 9.919 10.220 -4.280 83 HB VAL 12 HB VAL 12 9.117 8.123 -2.258 84 1HG1 VAL 12 HG11 VAL 12 8.951 10.048 -0.731 85 2HG1 VAL 12 HG12 VAL 12 9.555 11.098 -2.014 86 3HG1 VAL 12 HG13 VAL 12 10.586 9.827 -1.357 87 1HG2 VAL 12 HG21 VAL 12 7.198 8.684 -3.659 88 2HG2 VAL 12 HG22 VAL 12 7.479 10.401 -3.370 89 3HG2 VAL 12 HG23 VAL 12 7.005 9.350 -2.038 90 H ALA 13 HN ALA 13 12.014 10.525 -4.158 91 HA ALA 13 HA ALA 13 13.816 8.272 -3.954 92 1HB ALA 13 HB1 ALA 13 14.231 10.056 -5.575 93 2HB ALA 13 HB2 ALA 13 15.566 9.891 -4.433 94 3HB ALA 13 HB3 ALA 13 14.414 11.213 -4.255 95 H LYS 14 HN LYS 14 14.221 7.477 -2.023 96 HA LYS 14 HA LYS 14 15.604 8.957 -0.069 97 1HB LYS 14 HB2 LYS 14 13.840 8.339 1.792 98 2HB LYS 14 HB1 LYS 14 13.716 9.851 0.917 99 1HG LYS 14 HG2 LYS 14 11.545 8.906 1.069 100 2HG LYS 14 HG1 LYS 14 12.079 8.762 -0.605 101 1HD LYS 14 HD2 LYS 14 12.840 6.406 0.037 102 2HD LYS 14 HD1 LYS 14 11.856 6.624 1.487 103 1HE LYS 14 HE2 LYS 14 10.877 6.908 -1.342 104 2HE LYS 14 HE1 LYS 14 10.634 5.484 -0.324 105 1HZ LYS 14 HZ1 LYS 14 9.419 6.902 1.243 106 2HZ LYS 14 HZ2 LYS 14 8.688 6.875 -0.279 107 3HZ LYS 14 HZ3 LYS 14 9.594 8.219 0.195 108 H THR 15 HN THR 15 15.801 7.523 2.022 109 HA THR 15 HA THR 15 16.354 4.810 1.060 110 HB THR 15 HB THR 15 17.763 4.627 3.109 111 HG1 THR 15 HG1 THR 15 17.377 7.432 3.411 112 1HG2 THR 15 HG21 THR 15 18.762 5.323 0.991 113 2HG2 THR 15 HG22 THR 15 19.543 6.126 2.353 114 3HG2 THR 15 HG23 THR 15 18.383 7.006 1.357 115 H ARG 16 HN ARG 16 16.187 3.111 2.881 116 HA ARG 16 HA ARG 16 13.544 3.243 4.071 117 1HB ARG 16 HB2 ARG 16 15.634 1.077 4.398 118 2HB ARG 16 HB1 ARG 16 13.906 0.953 4.740 119 1HG ARG 16 HG2 ARG 16 13.410 0.467 2.621 120 2HG ARG 16 HG1 ARG 16 14.488 1.710 1.985 121 1HD ARG 16 HD2 ARG 16 16.233 0.284 1.763 122 2HD ARG 16 HD1 ARG 16 15.773 -0.675 3.154 123 HE ARG 16 HE ARG 16 14.514 -0.866 0.513 124 1HH1 ARG 16 HH11 ARG 16 15.552 -2.324 3.516 125 2HH1 ARG 16 HH12 ARG 16 14.979 -3.905 3.108 126 1HH2 ARG 16 HH21 ARG 16 13.719 -2.968 -0.025 127 2HH2 ARG 16 HH22 ARG 16 13.945 -4.273 1.090 128 H GLY 17 HN GLY 17 16.592 4.278 4.816 129 1HA GLY 17 HA2 GLY 17 16.408 3.921 7.698 130 2HA GLY 17 HA1 GLY 17 17.726 4.683 6.820 131 H GLN 18 HN GLN 18 15.748 6.318 5.281 132 HA GLN 18 HA GLN 18 15.441 8.538 7.024 133 1HB GLN 18 HB2 GLN 18 15.591 8.690 4.528 134 2HB GLN 18 HB1 GLN 18 13.979 7.995 4.430 135 1HG GLN 18 HG2 GLN 18 13.857 10.380 4.174 136 2HG GLN 18 HG1 GLN 18 13.095 9.907 5.690 137 1HE2 GLN 18 HE21 GLN 18 15.793 11.515 4.217 138 2HE2 GLN 18 HE22 GLN 18 16.377 12.292 5.655 139 H LEU 19 HN LEU 19 13.536 5.782 6.195 140 HA LEU 19 HA LEU 19 11.134 6.596 7.527 141 1HB LEU 19 HB2 LEU 19 12.096 3.780 6.969 142 2HB LEU 19 HB1 LEU 19 10.450 4.286 7.302 143 HG LEU 19 HG LEU 19 11.926 5.230 4.852 144 1HD1 LEU 19 HD11 LEU 19 10.847 3.448 3.613 145 2HD1 LEU 19 HD12 LEU 19 10.140 2.814 5.100 146 3HD1 LEU 19 HD13 LEU 19 11.887 2.773 4.866 147 1HD2 LEU 19 HD21 LEU 19 9.964 6.510 5.458 148 2HD2 LEU 19 HD22 LEU 19 9.010 5.034 5.589 149 3HD2 LEU 19 HD23 LEU 19 9.629 5.547 4.020 150 H THR 20 HN THR 20 10.381 5.520 9.542 151 HA THR 20 HA THR 20 12.381 4.420 11.304 152 HB THR 20 HB THR 20 11.022 6.988 12.164 153 HG1 THR 20 HG1 THR 20 13.253 6.598 10.607 154 1HG2 THR 20 HG21 THR 20 13.324 5.395 13.313 155 2HG2 THR 20 HG22 THR 20 11.697 5.510 13.987 156 3HG2 THR 20 HG23 THR 20 12.736 6.934 13.942 157 H ASP 21 HN ASP 21 10.596 2.933 10.575 158 HA ASP 21 HA ASP 21 8.724 1.721 10.856 159 1HB ASP 21 HB2 ASP 21 9.520 1.535 13.190 160 2HB ASP 21 HB1 ASP 21 8.601 2.982 13.600 161 H ALA 22 HN ALA 22 7.594 4.362 12.917 162 HA ALA 22 HA ALA 22 5.316 4.676 11.146 163 1HB ALA 22 HB1 ALA 22 4.912 4.510 13.549 164 2HB ALA 22 HB2 ALA 22 4.365 6.063 12.915 165 3HB ALA 22 HB3 ALA 22 5.878 5.960 13.816 166 H ALA 23 HN ALA 23 6.725 5.558 9.450 167 HA ALA 23 HA ALA 23 6.683 8.465 9.571 168 1HB ALA 23 HB1 ALA 23 8.955 8.716 8.734 169 2HB ALA 23 HB2 ALA 23 9.188 6.970 8.791 170 3HB ALA 23 HB3 ALA 23 8.965 7.876 10.286 171 HA PRO 24 HA PRO 24 5.166 7.009 5.567 172 1HB PRO 24 HB2 PRO 24 3.268 8.864 5.245 173 2HB PRO 24 HB1 PRO 24 3.063 7.518 6.374 174 1HG PRO 24 HG2 PRO 24 3.772 10.367 6.931 175 2HG PRO 24 HG1 PRO 24 2.727 9.269 7.849 176 1HD PRO 24 HD2 PRO 24 5.371 9.855 8.462 177 2HD PRO 24 HD1 PRO 24 4.473 8.439 9.041 178 H ILE 25 HN ILE 25 6.704 7.446 4.078 179 HA ILE 25 HA ILE 25 7.048 10.271 3.298 180 HB ILE 25 HB ILE 25 9.071 8.113 2.712 181 1HG1 ILE 25 HG12 ILE 25 8.872 9.901 5.143 182 2HG1 ILE 25 HG11 ILE 25 8.755 8.142 5.128 183 1HG2 ILE 25 HG21 ILE 25 9.282 11.119 2.927 184 2HG2 ILE 25 HG22 ILE 25 9.241 10.190 1.428 185 3HG2 ILE 25 HG23 ILE 25 10.602 10.017 2.536 186 1HD1 ILE 25 HD11 ILE 25 11.200 9.768 4.445 187 2HD1 ILE 25 HD12 ILE 25 11.093 8.008 4.410 188 3HD1 ILE 25 HD13 ILE 25 10.923 8.871 5.939 189 H GLY 26 HN GLY 26 5.053 8.266 2.464 190 1HA GLY 26 HA2 GLY 26 5.273 8.949 -0.358 191 2HA GLY 26 HA1 GLY 26 5.073 7.244 0.019 192 HA PRO 27 HA PRO 27 0.950 9.277 1.614 193 1HB PRO 27 HB2 PRO 27 0.621 11.913 0.862 194 2HB PRO 27 HB1 PRO 27 1.143 11.378 2.463 195 1HG PRO 27 HG2 PRO 27 2.787 12.352 0.157 196 2HG PRO 27 HG1 PRO 27 2.963 12.700 1.887 197 1HD PRO 27 HD2 PRO 27 4.556 10.930 0.654 198 2HD PRO 27 HD1 PRO 27 3.997 10.670 2.318 199 H VAL 28 HN VAL 28 0.176 7.943 0.003 200 HA VAL 28 HA VAL 28 -0.071 8.838 -2.731 201 HB VAL 28 HB VAL 28 -1.428 6.485 -1.393 202 1HG1 VAL 28 HG11 VAL 28 -2.444 7.114 -3.507 203 2HG1 VAL 28 HG12 VAL 28 -1.575 5.587 -3.672 204 3HG1 VAL 28 HG13 VAL 28 -0.866 7.076 -4.296 205 1HG2 VAL 28 HG21 VAL 28 0.403 5.115 -2.279 206 2HG2 VAL 28 HG22 VAL 28 0.985 6.310 -1.119 207 3HG2 VAL 28 HG23 VAL 28 1.215 6.574 -2.847 208 H THR 29 HN THR 29 -1.700 10.058 -3.505 209 HA THR 29 HA THR 29 -3.904 10.753 -1.802 210 HB THR 29 HB THR 29 -3.390 11.598 -4.658 211 HG1 THR 29 HG1 THR 29 -1.927 12.088 -2.472 212 1HG2 THR 29 HG21 THR 29 -4.667 13.574 -3.987 213 2HG2 THR 29 HG22 THR 29 -4.919 12.860 -2.396 214 3HG2 THR 29 HG23 THR 29 -5.611 12.097 -3.825 215 H VAL 30 HN VAL 30 -5.210 8.969 -1.631 216 HA VAL 30 HA VAL 30 -6.162 7.677 -4.072 217 HB VAL 30 HB VAL 30 -6.331 6.962 -1.155 218 1HG1 VAL 30 HG11 VAL 30 -7.757 5.070 -1.714 219 2HG1 VAL 30 HG12 VAL 30 -7.858 5.616 -3.387 220 3HG1 VAL 30 HG13 VAL 30 -8.569 6.588 -2.100 221 1HG2 VAL 30 HG21 VAL 30 -5.369 5.472 -3.607 222 2HG2 VAL 30 HG22 VAL 30 -5.281 4.893 -1.943 223 3HG2 VAL 30 HG23 VAL 30 -4.342 6.303 -2.438 224 H GLN 31 HN GLN 31 -7.818 8.547 -5.012 225 HA GLN 31 HA GLN 31 -9.962 9.743 -3.426 226 1HB GLN 31 HB2 GLN 31 -9.512 9.838 -6.417 227 2HB GLN 31 HB1 GLN 31 -10.702 10.765 -5.508 228 1HG GLN 31 HG2 GLN 31 -8.914 11.941 -4.347 229 2HG GLN 31 HG1 GLN 31 -7.713 10.996 -5.223 230 1HE2 GLN 31 HE21 GLN 31 -9.274 11.094 -7.719 231 2HE2 GLN 31 HE22 GLN 31 -9.049 12.698 -8.336 232 H ALA 32 HN ALA 32 -11.775 8.656 -3.111 233 HA ALA 32 HA ALA 32 -12.199 6.161 -4.578 234 1HB ALA 32 HB1 ALA 32 -12.132 6.043 -2.126 235 2HB ALA 32 HB2 ALA 32 -13.696 5.543 -2.771 236 3HB ALA 32 HB3 ALA 32 -13.510 7.141 -2.045 237 H LEU 33 HN LEU 33 -13.165 6.773 -6.449 238 HA LEU 33 HA LEU 33 -15.333 8.711 -6.430 239 1HB LEU 33 HB2 LEU 33 -13.649 8.825 -8.196 240 2HB LEU 33 HB1 LEU 33 -14.017 7.181 -8.678 241 HG LEU 33 HG LEU 33 -16.332 7.959 -9.268 242 1HD1 LEU 33 HD11 LEU 33 -15.096 10.678 -8.864 243 2HD1 LEU 33 HD12 LEU 33 -16.405 9.974 -7.914 244 3HD1 LEU 33 HD13 LEU 33 -16.660 10.360 -9.615 245 1HD2 LEU 33 HD21 LEU 33 -15.639 8.980 -11.377 246 2HD2 LEU 33 HD22 LEU 33 -14.610 7.611 -10.955 247 3HD2 LEU 33 HD23 LEU 33 -14.029 9.258 -10.714 248 H GLY 34 HN GLY 34 -17.309 8.010 -5.908 249 1HA GLY 34 HA2 GLY 34 -19.297 6.893 -6.598 250 2HA GLY 34 HA1 GLY 34 -18.310 5.631 -7.319 251 H CYS 35 HN CYS 35 -17.095 6.411 -4.327 252 HA CYS 35 HA CYS 35 -18.154 3.986 -3.160 253 1HB CYS 35 HB2 CYS 35 -15.877 5.737 -2.677 254 2HB CYS 35 HB1 CYS 35 -16.689 5.265 -1.189 255 H ASN 36 HN ASN 36 -20.272 4.307 -2.708 256 HA ASN 36 HA ASN 36 -20.968 6.564 -0.959 257 1HB ASN 36 HB2 ASN 36 -22.670 4.725 -2.657 258 2HB ASN 36 HB1 ASN 36 -23.351 5.857 -1.494 259 1HD2 ASN 36 HD21 ASN 36 -24.446 6.927 -3.158 260 2HD2 ASN 36 HD22 ASN 36 -23.620 8.008 -4.234 261 H ALA 37 HN ALA 37 -20.959 3.073 -1.202 262 HA ALA 37 HA ALA 37 -21.304 2.898 1.697 263 1HB ALA 37 HB1 ALA 37 -22.988 1.146 1.512 264 2HB ALA 37 HB2 ALA 37 -22.976 1.301 -0.245 265 3HB ALA 37 HB3 ALA 37 -23.558 2.634 0.754 266 H ARG 38 HN ARG 38 -18.998 2.596 0.071 267 HA ARG 38 HA ARG 38 -18.567 -0.314 0.184 268 1HB ARG 38 HB2 ARG 38 -18.619 0.725 -2.123 269 2HB ARG 38 HB1 ARG 38 -17.161 1.602 -1.667 270 1HG ARG 38 HG2 ARG 38 -16.360 -0.235 -2.831 271 2HG ARG 38 HG1 ARG 38 -16.174 -0.701 -1.139 272 1HD ARG 38 HD2 ARG 38 -17.135 -2.606 -1.968 273 2HD ARG 38 HD1 ARG 38 -18.585 -1.710 -1.513 274 HE ARG 38 HE ARG 38 -17.887 -1.087 -4.173 275 1HH1 ARG 38 HH11 ARG 38 -19.307 -3.671 -2.262 276 2HH1 ARG 38 HH12 ARG 38 -20.090 -4.402 -3.631 277 1HH2 ARG 38 HH21 ARG 38 -18.902 -2.061 -5.964 278 2HH2 ARG 38 HH22 ARG 38 -19.870 -3.492 -5.720 279 H GLN 39 HN GLN 39 -16.623 -1.073 0.988 280 HA GLN 39 HA GLN 39 -14.985 0.822 2.471 281 1HB GLN 39 HB2 GLN 39 -14.914 -2.204 2.331 282 2HB GLN 39 HB1 GLN 39 -13.936 -1.217 3.409 283 1HG GLN 39 HG2 GLN 39 -15.854 -0.500 4.615 284 2HG GLN 39 HG1 GLN 39 -16.941 -1.214 3.428 285 1HE2 GLN 39 HE21 GLN 39 -15.343 -3.635 3.168 286 2HE2 GLN 39 HE22 GLN 39 -15.627 -4.555 4.602 287 H VAL 40 HN VAL 40 -13.035 1.484 1.753 288 HA VAL 40 HA VAL 40 -12.088 0.450 -0.816 289 HB VAL 40 HB VAL 40 -11.258 2.901 0.754 290 1HG1 VAL 40 HG11 VAL 40 -9.904 3.501 -1.201 291 2HG1 VAL 40 HG12 VAL 40 -10.306 1.956 -1.950 292 3HG1 VAL 40 HG13 VAL 40 -9.349 1.996 -0.469 293 1HG2 VAL 40 HG21 VAL 40 -12.761 2.606 -1.843 294 2HG2 VAL 40 HG22 VAL 40 -12.273 4.132 -1.105 295 3HG2 VAL 40 HG23 VAL 40 -13.446 3.096 -0.293 296 H ALA 41 HN ALA 41 -10.291 -0.767 -0.988 297 HA ALA 41 HA ALA 41 -8.699 -1.138 1.430 298 1HB ALA 41 HB1 ALA 41 -10.306 -2.947 1.325 299 2HB ALA 41 HB2 ALA 41 -8.678 -3.552 1.013 300 3HB ALA 41 HB3 ALA 41 -9.806 -3.321 -0.325 301 H LEU 42 HN LEU 42 -6.579 -1.566 1.123 302 HA LEU 42 HA LEU 42 -5.568 -1.082 -1.581 303 1HB LEU 42 HB2 LEU 42 -4.064 -1.030 1.036 304 2HB LEU 42 HB1 LEU 42 -3.535 -0.364 -0.500 305 HG LEU 42 HG LEU 42 -5.901 0.635 1.085 306 1HD1 LEU 42 HD11 LEU 42 -4.495 2.558 1.633 307 2HD1 LEU 42 HD12 LEU 42 -3.131 1.807 0.805 308 3HD1 LEU 42 HD13 LEU 42 -3.798 1.064 2.259 309 1HD2 LEU 42 HD21 LEU 42 -4.505 1.776 -1.337 310 2HD2 LEU 42 HD22 LEU 42 -5.821 2.541 -0.446 311 3HD2 LEU 42 HD23 LEU 42 -6.104 1.031 -1.314 312 H LYS 43 HN LYS 43 -4.104 -2.445 -2.547 313 HA LYS 43 HA LYS 43 -3.265 -4.881 -1.171 314 1HB LYS 43 HB2 LYS 43 -4.653 -4.943 -3.867 315 2HB LYS 43 HB1 LYS 43 -3.882 -6.312 -3.086 316 1HG LYS 43 HG2 LYS 43 -6.131 -6.654 -2.674 317 2HG LYS 43 HG1 LYS 43 -5.558 -5.895 -1.187 318 1HD LYS 43 HD2 LYS 43 -6.290 -3.692 -2.209 319 2HD LYS 43 HD1 LYS 43 -7.128 -4.658 -3.430 320 1HE LYS 43 HE2 LYS 43 -8.474 -3.927 -1.401 321 2HE LYS 43 HE1 LYS 43 -8.534 -5.636 -1.845 322 1HZ LYS 43 HZ1 LYS 43 -8.212 -5.205 0.564 323 2HZ LYS 43 HZ2 LYS 43 -6.691 -4.547 0.200 324 3HZ LYS 43 HZ3 LYS 43 -7.015 -6.174 -0.136 325 H ALA 44 HN ALA 44 -1.424 -5.814 -2.095 326 HA ALA 44 HA ALA 44 -0.103 -4.165 -4.123 327 1HB ALA 44 HB1 ALA 44 1.929 -5.463 -3.482 328 2HB ALA 44 HB2 ALA 44 0.969 -6.228 -2.213 329 3HB ALA 44 HB3 ALA 44 1.245 -4.485 -2.184 330 H ASP 45 HN ASP 45 1.029 -5.304 -5.831 331 HA ASP 45 HA ASP 45 -0.537 -7.511 -6.885 332 1HB ASP 45 HB2 ASP 45 0.266 -5.626 -8.335 333 2HB ASP 45 HB1 ASP 45 1.917 -6.162 -8.050 334 H THR 46 HN THR 46 0.630 -9.518 -7.652 335 HA THR 46 HA THR 46 1.927 -10.724 -5.484 336 HB THR 46 HB THR 46 0.693 -12.047 -7.099 337 HG1 THR 46 HG1 THR 46 3.441 -12.619 -6.719 338 1HG2 THR 46 HG21 THR 46 1.599 -12.528 -9.323 339 2HG2 THR 46 HG22 THR 46 2.914 -11.388 -9.037 340 3HG2 THR 46 HG23 THR 46 1.250 -10.810 -9.131 341 H ASP 47 HN ASP 47 3.188 -8.655 -7.805 342 HA ASP 47 HA ASP 47 5.867 -9.334 -7.998 343 1HB ASP 47 HB2 ASP 47 5.250 -7.538 -9.309 344 2HB ASP 47 HB1 ASP 47 4.268 -6.821 -8.044 345 H ASN 48 HN ASN 48 4.126 -7.761 -5.349 346 HA ASN 48 HA ASN 48 6.428 -8.245 -3.605 347 1HB ASN 48 HB2 ASN 48 6.286 -6.001 -2.617 348 2HB ASN 48 HB1 ASN 48 6.647 -5.884 -4.336 349 1HD2 ASN 48 HD21 ASN 48 5.014 -5.242 -5.763 350 2HD2 ASN 48 HD22 ASN 48 3.654 -4.323 -5.198 351 H PHE 49 HN PHE 49 3.695 -9.360 -4.036 352 HA PHE 49 HA PHE 49 2.598 -8.947 -1.328 353 1HB PHE 49 HB2 PHE 49 1.238 -7.892 -3.158 354 2HB PHE 49 HB1 PHE 49 1.017 -9.489 -3.843 355 HD1 PHE 49 HD1 PHE 49 0.296 -7.403 -0.885 356 HD2 PHE 49 HD2 PHE 49 -0.701 -10.893 -3.100 357 HE1 PHE 49 HE1 PHE 49 -1.664 -7.754 0.561 358 HE2 PHE 49 HE2 PHE 49 -2.666 -11.244 -1.669 359 HZ PHE 49 HZ PHE 49 -3.321 -9.517 -0.044 360 H GLU 50 HN GLU 50 3.108 -10.780 -0.274 361 HA GLU 50 HA GLU 50 2.653 -13.333 -1.664 362 1HB GLU 50 HB2 GLU 50 4.550 -12.615 0.570 363 2HB GLU 50 HB1 GLU 50 4.181 -14.277 0.129 364 1HG GLU 50 HG2 GLU 50 5.385 -12.211 -1.703 365 2HG GLU 50 HG1 GLU 50 6.265 -13.502 -0.880 366 H GLN 51 HN GLN 51 0.713 -14.051 -1.165 367 HA GLN 51 HA GLN 51 -1.021 -14.912 0.024 368 1HB GLN 51 HB2 GLN 51 0.542 -15.945 1.559 369 2HB GLN 51 HB1 GLN 51 0.756 -14.430 2.425 370 1HG GLN 51 HG2 GLN 51 -1.726 -14.539 2.941 371 2HG GLN 51 HG1 GLN 51 -1.672 -16.196 2.346 372 1HE2 GLN 51 HE21 GLN 51 -2.239 -15.078 5.017 373 2HE2 GLN 51 HE22 GLN 51 -1.128 -15.865 6.093 374 H GLY 52 HN GLY 52 0.380 -12.246 1.879 375 1HA GLY 52 HA2 GLY 52 -1.717 -10.437 1.454 376 2HA GLY 52 HA1 GLY 52 -2.021 -11.296 2.963 377 H LYS 53 HN LYS 53 1.118 -10.451 1.619 378 HA LYS 53 HA LYS 53 1.413 -8.329 3.613 379 1HB LYS 53 HB2 LYS 53 2.922 -10.780 3.235 380 2HB LYS 53 HB1 LYS 53 3.934 -9.380 3.033 381 1HG LYS 53 HG2 LYS 53 4.148 -10.004 5.287 382 2HG LYS 53 HG1 LYS 53 3.076 -8.603 5.293 383 1HD LYS 53 HD2 LYS 53 1.204 -9.872 5.788 384 2HD LYS 53 HD1 LYS 53 1.922 -11.357 5.160 385 1HE LYS 53 HE2 LYS 53 1.784 -11.451 7.579 386 2HE LYS 53 HE1 LYS 53 3.468 -11.400 7.068 387 1HZ LYS 53 HZ1 LYS 53 3.186 -9.949 8.919 388 2HZ LYS 53 HZ2 LYS 53 1.874 -9.163 8.199 389 3HZ LYS 53 HZ3 LYS 53 3.433 -8.982 7.552 390 H PHE 54 HN PHE 54 2.087 -6.416 2.661 391 HA PHE 54 HA PHE 54 3.307 -6.652 -0.002 392 1HB PHE 54 HB2 PHE 54 2.778 -4.119 -0.143 393 2HB PHE 54 HB1 PHE 54 1.496 -5.285 -0.397 394 HD1 PHE 54 HD1 PHE 54 -0.504 -4.654 0.397 395 HD2 PHE 54 HD2 PHE 54 2.973 -3.526 2.571 396 HE1 PHE 54 HE1 PHE 54 -1.916 -3.497 2.051 397 HE2 PHE 54 HE2 PHE 54 1.560 -2.378 4.229 398 HZ PHE 54 HZ PHE 54 -0.883 -2.357 3.969 399 H PHE 55 HN PHE 55 5.258 -5.804 -0.434 400 HA PHE 55 HA PHE 55 6.677 -4.437 1.715 401 1HB PHE 55 HB2 PHE 55 8.616 -6.047 1.427 402 2HB PHE 55 HB1 PHE 55 7.216 -6.665 2.278 403 HD1 PHE 55 HD1 PHE 55 9.014 -6.707 -0.944 404 HD2 PHE 55 HD2 PHE 55 6.038 -8.550 1.477 405 HE1 PHE 55 HE1 PHE 55 8.934 -8.609 -2.502 406 HE2 PHE 55 HE2 PHE 55 5.958 -10.459 -0.077 407 HZ PHE 55 HZ PHE 55 7.406 -10.493 -2.065 408 H LEU 56 HN LEU 56 8.854 -3.786 1.065 409 HA LEU 56 HA LEU 56 8.846 -2.575 -1.553 410 1HB LEU 56 HB2 LEU 56 11.095 -2.665 0.462 411 2HB LEU 56 HB1 LEU 56 10.894 -1.515 -0.843 412 HG LEU 56 HG LEU 56 8.941 -1.693 1.440 413 1HD1 LEU 56 HD11 LEU 56 10.138 0.156 2.482 414 2HD1 LEU 56 HD12 LEU 56 11.383 0.064 1.235 415 3HD1 LEU 56 HD13 LEU 56 11.164 -1.275 2.363 416 1HD2 LEU 56 HD21 LEU 56 9.616 0.521 -0.488 417 2HD2 LEU 56 HD22 LEU 56 8.379 0.564 0.768 418 3HD2 LEU 56 HD23 LEU 56 8.210 -0.538 -0.598 419 H ILE 57 HN ILE 57 9.256 -3.942 -3.243 420 HA ILE 57 HA ILE 57 11.408 -5.907 -2.867 421 HB ILE 57 HB ILE 57 9.130 -6.828 -3.436 422 1HG1 ILE 57 HG12 ILE 57 9.958 -8.355 -5.203 423 2HG1 ILE 57 HG11 ILE 57 11.343 -7.295 -5.441 424 1HG2 ILE 57 HG21 ILE 57 8.316 -6.630 -5.718 425 2HG2 ILE 57 HG22 ILE 57 9.623 -5.507 -6.094 426 3HG2 ILE 57 HG23 ILE 57 8.382 -5.057 -4.925 427 1HD1 ILE 57 HD11 ILE 57 12.069 -7.734 -3.152 428 2HD1 ILE 57 HD12 ILE 57 11.928 -9.223 -4.089 429 3HD1 ILE 57 HD13 ILE 57 10.680 -8.794 -2.918 430 H SER 58 HN SER 58 13.125 -5.899 -4.244 431 HA SER 58 HA SER 58 13.491 -3.574 -5.896 432 1HB SER 58 HB2 SER 58 15.763 -4.877 -6.273 433 2HB SER 58 HB1 SER 58 15.446 -4.056 -4.744 434 HG SER 58 HG SER 58 15.077 -5.953 -3.769 435 H ASP 59 HN ASP 59 14.407 -3.864 -8.120 436 HA ASP 59 HA ASP 59 12.709 -5.466 -9.728 437 1HB ASP 59 HB2 ASP 59 15.373 -4.357 -10.623 438 2HB ASP 59 HB1 ASP 59 13.932 -4.637 -11.593 439 H ASN 60 HN ASN 60 15.821 -5.893 -8.281 440 HA ASN 60 HA ASN 60 16.450 -8.349 -9.644 441 1HB ASN 60 HB2 ASN 60 18.174 -6.772 -8.749 442 2HB ASN 60 HB1 ASN 60 17.663 -7.198 -7.120 443 1HD2 ASN 60 HD21 ASN 60 19.310 -8.232 -9.976 444 2HD2 ASN 60 HD22 ASN 60 20.070 -9.633 -9.279 445 H ASN 61 HN ASN 61 14.595 -7.401 -6.940 446 HA ASN 61 HA ASN 61 13.270 -8.507 -5.474 447 1HB ASN 61 HB2 ASN 61 13.937 -10.979 -7.084 448 2HB ASN 61 HB1 ASN 61 12.624 -10.827 -5.925 449 1HD2 ASN 61 HD21 ASN 61 10.792 -9.634 -6.484 450 2HD2 ASN 61 HD22 ASN 61 10.463 -9.161 -8.115 451 H ARG 62 HN ARG 62 16.152 -8.213 -5.007 452 HA ARG 62 HA ARG 62 16.896 -10.639 -3.594 453 1HB ARG 62 HB2 ARG 62 19.052 -9.579 -3.224 454 2HB ARG 62 HB1 ARG 62 18.603 -9.463 -4.919 455 1HG ARG 62 HG2 ARG 62 18.005 -7.154 -4.658 456 2HG ARG 62 HG1 ARG 62 18.243 -7.248 -2.913 457 1HD ARG 62 HD2 ARG 62 20.652 -7.978 -3.543 458 2HD ARG 62 HD1 ARG 62 20.276 -7.260 -5.108 459 HE ARG 62 HE ARG 62 19.710 -5.572 -2.819 460 1HH1 ARG 62 HH11 ARG 62 22.010 -6.467 -5.302 461 2HH1 ARG 62 HH12 ARG 62 23.007 -5.059 -5.077 462 1HH2 ARG 62 HH21 ARG 62 20.989 -3.699 -2.542 463 2HH2 ARG 62 HH22 ARG 62 22.391 -3.455 -3.540 464 H ASP 63 HN ASP 63 16.251 -7.226 -2.786 465 HA ASP 63 HA ASP 63 16.162 -7.995 0.056 466 1HB ASP 63 HB2 ASP 63 16.162 -5.156 -0.951 467 2HB ASP 63 HB1 ASP 63 16.561 -5.739 0.654 468 H LYS 64 HN LYS 64 14.334 -7.625 1.252 469 HA LYS 64 HA LYS 64 12.175 -6.105 0.014 470 1HB LYS 64 HB2 LYS 64 10.502 -7.795 0.690 471 2HB LYS 64 HB1 LYS 64 11.628 -8.409 -0.507 472 1HG LYS 64 HG2 LYS 64 11.506 -10.186 0.921 473 2HG LYS 64 HG1 LYS 64 12.892 -9.329 1.594 474 1HD LYS 64 HD2 LYS 64 11.393 -8.256 3.234 475 2HD LYS 64 HD1 LYS 64 10.045 -9.191 2.586 476 1HE LYS 64 HE2 LYS 64 12.539 -10.308 3.866 477 2HE LYS 64 HE1 LYS 64 10.943 -10.224 4.607 478 1HZ LYS 64 HZ1 LYS 64 11.814 -11.906 2.329 479 2HZ LYS 64 HZ2 LYS 64 10.175 -11.643 2.677 480 3HZ LYS 64 HZ3 LYS 64 11.173 -12.404 3.821 481 H LEU 65 HN LEU 65 10.676 -5.234 1.508 482 HA LEU 65 HA LEU 65 11.107 -5.530 4.360 483 1HB LEU 65 HB2 LEU 65 12.557 -3.613 3.148 484 2HB LEU 65 HB1 LEU 65 11.042 -2.756 3.332 485 HG LEU 65 HG LEU 65 12.807 -3.828 5.504 486 1HD1 LEU 65 HD11 LEU 65 12.818 -1.466 6.198 487 2HD1 LEU 65 HD12 LEU 65 11.868 -1.063 4.769 488 3HD1 LEU 65 HD13 LEU 65 13.500 -1.709 4.590 489 1HD2 LEU 65 HD21 LEU 65 10.508 -4.306 6.131 490 2HD2 LEU 65 HD22 LEU 65 10.045 -2.644 5.762 491 3HD2 LEU 65 HD23 LEU 65 11.148 -2.976 7.097 492 H TYR 66 HN TYR 66 9.056 -5.680 5.144 493 HA TYR 66 HA TYR 66 6.824 -5.084 3.475 494 1HB TYR 66 HB2 TYR 66 6.590 -5.578 6.436 495 2HB TYR 66 HB1 TYR 66 5.463 -5.998 5.157 496 HD1 TYR 66 HD1 TYR 66 8.889 -6.822 6.393 497 HD2 TYR 66 HD2 TYR 66 5.419 -8.146 4.313 498 HE1 TYR 66 HE1 TYR 66 9.830 -9.089 6.276 499 HE2 TYR 66 HE2 TYR 66 6.361 -10.416 4.183 500 HH TYR 66 HH TYR 66 8.551 -11.512 4.263 501 H VAL 67 HN VAL 67 5.394 -3.417 3.562 502 HA VAL 67 HA VAL 67 6.156 -1.182 5.319 503 HB VAL 67 HB VAL 67 5.203 0.323 3.549 504 1HG1 VAL 67 HG11 VAL 67 7.597 0.036 3.854 505 2HG1 VAL 67 HG12 VAL 67 7.202 0.243 2.149 506 3HG1 VAL 67 HG13 VAL 67 7.580 -1.361 2.779 507 1HG2 VAL 67 HG21 VAL 67 3.873 -1.340 2.347 508 2HG2 VAL 67 HG22 VAL 67 5.347 -2.180 1.863 509 3HG2 VAL 67 HG23 VAL 67 5.023 -0.550 1.270 510 H ASN 68 HN ASN 68 4.279 0.456 5.409 511 HA ASN 68 HA ASN 68 1.675 -0.904 5.522 512 1HB ASN 68 HB2 ASN 68 3.120 0.492 7.708 513 2HB ASN 68 HB1 ASN 68 1.410 0.864 7.550 514 1HD2 ASN 68 HD21 ASN 68 2.745 -2.281 6.740 515 2HD2 ASN 68 HD22 ASN 68 2.035 -3.119 8.077 516 H ILE 69 HN ILE 69 0.545 0.102 3.937 517 HA ILE 69 HA ILE 69 0.806 2.976 3.610 518 HB ILE 69 HB ILE 69 -1.373 2.277 2.087 519 1HG1 ILE 69 HG12 ILE 69 0.600 -0.015 2.020 520 2HG1 ILE 69 HG11 ILE 69 -1.066 -0.103 2.580 521 1HG2 ILE 69 HG21 ILE 69 0.211 2.377 0.182 522 2HG2 ILE 69 HG22 ILE 69 1.543 2.322 1.335 523 3HG2 ILE 69 HG23 ILE 69 0.427 3.685 1.344 524 1HD1 ILE 69 HD11 ILE 69 -0.181 0.505 -0.231 525 2HD1 ILE 69 HD12 ILE 69 -1.850 0.391 0.326 526 3HD1 ILE 69 HD13 ILE 69 -0.811 -1.036 0.348 527 H ARG 70 HN ARG 70 0.133 3.727 5.549 528 HA ARG 70 HA ARG 70 -2.541 2.985 6.501 529 1HB ARG 70 HB2 ARG 70 -0.793 2.604 8.112 530 2HB ARG 70 HB1 ARG 70 -0.154 4.223 7.876 531 1HG ARG 70 HG2 ARG 70 -2.293 5.113 8.817 532 2HG ARG 70 HG1 ARG 70 -2.731 3.449 9.216 533 1HD ARG 70 HD2 ARG 70 -0.714 3.238 10.574 534 2HD ARG 70 HD1 ARG 70 -0.261 4.893 10.167 535 HE ARG 70 HE ARG 70 -2.615 4.142 11.787 536 1HH1 ARG 70 HH11 ARG 70 -0.151 6.452 10.840 537 2HH1 ARG 70 HH12 ARG 70 -0.485 7.536 12.157 538 1HH2 ARG 70 HH21 ARG 70 -3.031 5.566 13.530 539 2HH2 ARG 70 HH22 ARG 70 -2.111 7.031 13.677 540 HA PRO 71 HA PRO 71 -4.369 6.834 5.264 541 1HB PRO 71 HB2 PRO 71 -5.781 6.968 7.764 542 2HB PRO 71 HB1 PRO 71 -6.403 6.579 6.167 543 1HG PRO 71 HG2 PRO 71 -5.740 4.801 8.364 544 2HG PRO 71 HG1 PRO 71 -6.673 4.472 6.892 545 1HD PRO 71 HD2 PRO 71 -4.170 3.468 7.398 546 2HD PRO 71 HD1 PRO 71 -4.855 3.688 5.777 547 H MET 72 HN MET 72 -3.056 8.521 5.327 548 HA MET 72 HA MET 72 -1.654 9.214 7.748 549 1HB MET 72 HB2 MET 72 -0.476 9.318 5.604 550 2HB MET 72 HB1 MET 72 -1.625 10.507 5.009 551 1HG MET 72 HG2 MET 72 -0.881 12.089 6.707 552 2HG MET 72 HG1 MET 72 0.255 10.895 7.333 553 1HE MET 72 HE1 MET 72 2.616 13.518 5.647 554 2HE MET 72 HE2 MET 72 2.212 12.659 7.133 555 3HE MET 72 HE3 MET 72 1.102 13.863 6.481 556 H ASP 73 HN ASP 73 -3.089 9.958 9.180 557 HA ASP 73 HA ASP 73 -4.116 11.607 10.359 558 1HB ASP 73 HB2 ASP 73 -2.473 13.087 9.094 559 2HB ASP 73 HB1 ASP 73 -3.777 13.420 7.964 560 H ASN 74 HN ASN 74 -5.429 9.834 8.220 561 HA ASN 74 HA ASN 74 -7.966 11.316 8.154 562 1HB ASN 74 HB2 ASN 74 -6.626 9.861 5.905 563 2HB ASN 74 HB1 ASN 74 -8.379 9.988 5.949 564 1HD2 ASN 74 HD21 ASN 74 -5.389 11.672 5.500 565 2HD2 ASN 74 HD22 ASN 74 -6.079 13.155 4.924 566 H SER 75 HN SER 75 -8.324 10.076 10.131 567 HA SER 75 HA SER 75 -9.712 8.632 11.175 568 1HB SER 75 HB2 SER 75 -11.094 8.901 9.084 569 2HB SER 75 HB1 SER 75 -10.330 7.441 8.462 570 HG SER 75 HG SER 75 -12.229 6.820 9.417 571 H ALA 76 HN ALA 76 -10.273 6.009 10.956 572 HA ALA 76 HA ALA 76 -7.617 4.735 11.057 573 1HB ALA 76 HB1 ALA 76 -8.425 3.358 12.892 574 2HB ALA 76 HB2 ALA 76 -10.002 4.146 12.810 575 3HB ALA 76 HB3 ALA 76 -8.578 5.067 13.296 576 H TRP 77 HN TRP 77 -7.422 2.697 10.200 577 HA TRP 77 HA TRP 77 -9.778 1.629 8.782 578 1HB TRP 77 HB2 TRP 77 -6.931 1.922 7.856 579 2HB TRP 77 HB1 TRP 77 -8.015 0.754 7.119 580 HD1 TRP 77 HD1 TRP 77 -9.398 4.202 8.061 581 HE1 TRP 77 HE1 TRP 77 -9.925 5.484 5.888 582 HE3 TRP 77 HE3 TRP 77 -7.282 0.997 4.697 583 HZ2 TRP 77 HZ2 TRP 77 -9.479 5.176 3.122 584 HZ3 TRP 77 HZ3 TRP 77 -7.372 1.560 2.311 585 HH2 TRP 77 HH2 TRP 77 -8.442 3.615 1.545 586 H THR 78 HN THR 78 -9.683 -0.700 8.354 587 HA THR 78 HA THR 78 -8.496 -2.230 10.474 588 HB THR 78 HB THR 78 -9.771 -3.234 7.914 589 HG1 THR 78 HG1 THR 78 -11.031 -2.973 10.453 590 1HG2 THR 78 HG21 THR 78 -9.343 -4.573 10.590 591 2HG2 THR 78 HG22 THR 78 -8.445 -4.916 9.112 592 3HG2 THR 78 HG23 THR 78 -10.169 -5.281 9.201 593 H THR 79 HN THR 79 -6.366 -2.492 10.479 594 HA THR 79 HA THR 79 -4.920 -2.282 7.961 595 HB THR 79 HB THR 79 -4.132 -0.748 9.560 596 HG1 THR 79 HG1 THR 79 -2.521 -2.255 8.456 597 1HG2 THR 79 HG21 THR 79 -3.364 -1.366 11.812 598 2HG2 THR 79 HG22 THR 79 -3.886 -3.027 11.530 599 3HG2 THR 79 HG23 THR 79 -5.075 -1.724 11.581 600 H ASP 80 HN ASP 80 -4.673 -4.139 6.949 601 HA ASP 80 HA ASP 80 -3.312 -6.287 8.434 602 1HB ASP 80 HB2 ASP 80 -5.318 -7.071 7.261 603 2HB ASP 80 HB1 ASP 80 -4.740 -6.362 5.760 604 H ASN 81 HN ASN 81 -1.448 -7.262 7.231 605 HA ASN 81 HA ASN 81 0.263 -5.128 6.347 606 1HB ASN 81 HB2 ASN 81 0.773 -7.377 7.698 607 2HB ASN 81 HB1 ASN 81 1.089 -7.982 6.079 608 1HD2 ASN 81 HD21 ASN 81 2.154 -5.387 5.135 609 2HD2 ASN 81 HD22 ASN 81 3.702 -5.222 5.880 610 H GLY 82 HN GLY 82 -1.998 -7.000 4.784 611 1HA GLY 82 HA2 GLY 82 -0.629 -6.598 2.200 612 2HA GLY 82 HA1 GLY 82 -1.590 -8.028 2.537 613 H VAL 83 HN VAL 83 -3.708 -6.574 3.937 614 HA VAL 83 HA VAL 83 -4.749 -4.978 1.693 615 HB VAL 83 HB VAL 83 -6.991 -5.699 2.132 616 1HG1 VAL 83 HG11 VAL 83 -6.838 -8.077 1.537 617 2HG1 VAL 83 HG12 VAL 83 -5.136 -8.078 1.994 618 3HG1 VAL 83 HG13 VAL 83 -5.681 -7.099 0.635 619 1HG2 VAL 83 HG21 VAL 83 -7.542 -7.402 3.805 620 2HG2 VAL 83 HG22 VAL 83 -6.876 -5.949 4.551 621 3HG2 VAL 83 HG23 VAL 83 -5.873 -7.387 4.373 622 H PHE 84 HN PHE 84 -6.029 -3.150 2.215 623 HA PHE 84 HA PHE 84 -6.022 -2.369 5.039 624 1HB PHE 84 HB2 PHE 84 -4.106 -1.466 3.233 625 2HB PHE 84 HB1 PHE 84 -5.290 -0.168 3.263 626 HD1 PHE 84 HD1 PHE 84 -6.002 0.645 5.639 627 HD2 PHE 84 HD2 PHE 84 -2.450 -1.544 4.807 628 HE1 PHE 84 HE1 PHE 84 -4.998 1.489 7.717 629 HE2 PHE 84 HE2 PHE 84 -1.439 -0.701 6.886 630 HZ PHE 84 HZ PHE 84 -2.716 0.818 8.345 631 H TYR 85 HN TYR 85 -8.236 -2.282 5.252 632 HA TYR 85 HA TYR 85 -9.617 -0.408 3.457 633 1HB TYR 85 HB2 TYR 85 -11.610 -1.794 3.392 634 2HB TYR 85 HB1 TYR 85 -10.254 -2.701 2.748 635 HD1 TYR 85 HD1 TYR 85 -13.071 -2.927 4.772 636 HD2 TYR 85 HD2 TYR 85 -8.987 -4.124 4.630 637 HE1 TYR 85 HE1 TYR 85 -13.546 -4.736 6.379 638 HE2 TYR 85 HE2 TYR 85 -9.454 -5.939 6.222 639 HH TYR 85 HH TYR 85 -12.641 -6.857 7.105 640 H LYS 86 HN LYS 86 -11.225 0.860 4.432 641 HA LYS 86 HA LYS 86 -11.040 0.953 7.301 642 1HB LYS 86 HB2 LYS 86 -12.174 2.986 7.256 643 2HB LYS 86 HB1 LYS 86 -11.192 3.017 5.808 644 1HG LYS 86 HG2 LYS 86 -13.996 2.078 5.574 645 2HG LYS 86 HG1 LYS 86 -13.714 3.795 5.839 646 1HD LYS 86 HD2 LYS 86 -12.065 3.601 3.858 647 2HD LYS 86 HD1 LYS 86 -12.903 2.083 3.515 648 1HE LYS 86 HE2 LYS 86 -15.052 3.321 3.485 649 2HE LYS 86 HE1 LYS 86 -14.160 4.826 3.730 650 1HZ LYS 86 HZ1 LYS 86 -14.715 4.524 1.431 651 2HZ LYS 86 HZ2 LYS 86 -13.946 3.020 1.388 652 3HZ LYS 86 HZ3 LYS 86 -13.034 4.426 1.622 653 H ASN 87 HN ASN 87 -12.782 0.778 8.721 654 HA ASN 87 HA ASN 87 -14.513 -1.427 8.083 655 1HB ASN 87 HB2 ASN 87 -13.406 -1.109 10.298 656 2HB ASN 87 HB1 ASN 87 -14.424 0.302 10.567 657 1HD2 ASN 87 HD21 ASN 87 -15.369 -0.594 12.389 658 2HD2 ASN 87 HD22 ASN 87 -16.515 -1.892 12.298 659 H ASP 88 HN ASP 88 -14.688 1.919 7.816 660 HA ASP 88 HA ASP 88 -17.574 2.117 8.002 661 1HB ASP 88 HB2 ASP 88 -15.523 4.138 7.057 662 2HB ASP 88 HB1 ASP 88 -17.228 4.464 7.346 663 H VAL 89 HN VAL 89 -18.967 2.430 6.251 664 HA VAL 89 HA VAL 89 -17.804 1.680 3.659 665 HB VAL 89 HB VAL 89 -20.134 1.131 2.959 666 1HG1 VAL 89 HG11 VAL 89 -20.274 -0.958 4.250 667 2HG1 VAL 89 HG12 VAL 89 -19.080 -0.320 5.381 668 3HG1 VAL 89 HG13 VAL 89 -18.634 -0.613 3.700 669 1HG2 VAL 89 HG21 VAL 89 -21.863 0.871 4.663 670 2HG2 VAL 89 HG22 VAL 89 -21.338 2.551 4.558 671 3HG2 VAL 89 HG23 VAL 89 -20.778 1.532 5.884 672 H GLY 90 HN GLY 90 -17.588 3.167 2.155 673 1HA GLY 90 HA2 GLY 90 -19.168 4.836 0.948 674 2HA GLY 90 HA1 GLY 90 -19.037 5.699 2.474 675 H SER 91 HN SER 91 -18.028 7.475 1.647 676 HA SER 91 HA SER 91 -15.794 7.325 -0.103 677 1HB SER 91 HB2 SER 91 -15.728 9.830 0.431 678 2HB SER 91 HB1 SER 91 -17.205 9.214 -0.316 679 HG SER 91 HG SER 91 -17.555 10.611 1.530 680 H TRP 92 HN TRP 92 -13.883 8.808 0.541 681 HA TRP 92 HA TRP 92 -13.012 8.996 3.211 682 1HB TRP 92 HB2 TRP 92 -12.707 6.537 2.908 683 2HB TRP 92 HB1 TRP 92 -11.606 6.888 1.571 684 HD1 TRP 92 HD1 TRP 92 -11.842 7.253 5.405 685 HE1 TRP 92 HE1 TRP 92 -9.452 7.606 6.315 686 HE3 TRP 92 HE3 TRP 92 -9.369 7.617 0.978 687 HZ2 TRP 92 HZ2 TRP 92 -6.855 8.004 5.246 688 HZ3 TRP 92 HZ3 TRP 92 -6.966 7.990 1.004 689 HH2 TRP 92 HH2 TRP 92 -5.714 8.169 3.087 690 H GLY 93 HN GLY 93 -11.771 8.399 -0.011 691 1HA GLY 93 HA2 GLY 93 -10.033 9.428 -1.179 692 2HA GLY 93 HA1 GLY 93 -11.215 10.705 -1.116 693 H GLY 94 HN GLY 94 -8.115 9.621 -0.101 694 1HA GLY 94 HA2 GLY 94 -7.246 12.241 0.404 695 2HA GLY 94 HA1 GLY 94 -7.532 11.439 1.943 696 H THR 95 HN THR 95 -5.341 11.508 2.506 697 HA THR 95 HA THR 95 -3.464 10.215 0.676 698 HB THR 95 HB THR 95 -1.778 11.239 2.379 699 HG1 THR 95 HG1 THR 95 -2.574 12.854 3.631 700 1HG2 THR 95 HG21 THR 95 -1.817 13.369 1.156 701 2HG2 THR 95 HG22 THR 95 -3.417 12.975 0.527 702 3HG2 THR 95 HG23 THR 95 -2.023 11.997 0.069 703 H ILE 96 HN ILE 96 -2.664 8.292 1.058 704 HA ILE 96 HA ILE 96 -2.455 7.354 3.844 705 HB ILE 96 HB ILE 96 -2.203 5.017 2.697 706 1HG1 ILE 96 HG12 ILE 96 -2.367 6.163 0.386 707 2HG1 ILE 96 HG11 ILE 96 -3.241 4.661 0.649 708 1HG2 ILE 96 HG21 ILE 96 -4.862 6.379 3.044 709 2HG2 ILE 96 HG22 ILE 96 -3.947 5.488 4.261 710 3HG2 ILE 96 HG23 ILE 96 -4.640 4.638 2.880 711 1HD1 ILE 96 HD11 ILE 96 -4.450 7.407 0.795 712 2HD1 ILE 96 HD12 ILE 96 -5.301 5.874 0.961 713 3HD1 ILE 96 HD13 ILE 96 -4.559 6.309 -0.579 714 H GLY 97 HN GLY 97 -0.406 6.788 4.521 715 1HA GLY 97 HA2 GLY 97 1.682 7.497 2.564 716 2HA GLY 97 HA1 GLY 97 1.804 7.748 4.300 717 H ILE 98 HN ILE 98 3.629 6.342 2.499 718 HA ILE 98 HA ILE 98 3.427 3.593 3.384 719 HB ILE 98 HB ILE 98 5.425 5.042 1.657 720 1HG1 ILE 98 HG12 ILE 98 4.761 2.992 0.168 721 2HG1 ILE 98 HG11 ILE 98 3.379 2.888 1.262 722 1HG2 ILE 98 HG21 ILE 98 6.717 3.558 3.097 723 2HG2 ILE 98 HG22 ILE 98 6.692 2.961 1.436 724 3HG2 ILE 98 HG23 ILE 98 5.669 2.208 2.660 725 1HD1 ILE 98 HD11 ILE 98 4.118 5.286 -0.392 726 2HD1 ILE 98 HD12 ILE 98 2.717 5.139 0.673 727 3HD1 ILE 98 HD13 ILE 98 2.846 4.120 -0.761 728 H TYR 99 HN TYR 99 3.872 3.226 5.418 729 HA TYR 99 HA TYR 99 6.227 4.413 6.692 730 1HB TYR 99 HB2 TYR 99 4.170 2.537 7.897 731 2HB TYR 99 HB1 TYR 99 5.365 3.488 8.758 732 HD1 TYR 99 HD1 TYR 99 4.687 5.436 9.773 733 HD2 TYR 99 HD2 TYR 99 2.391 3.956 6.524 734 HE1 TYR 99 HE1 TYR 99 2.987 7.146 10.213 735 HE2 TYR 99 HE2 TYR 99 0.685 5.676 6.940 736 HH TYR 99 HH TYR 99 1.198 8.283 9.167 737 H VAL 100 HN VAL 100 7.855 2.965 7.539 738 HA VAL 100 HA VAL 100 7.984 0.379 6.208 739 HB VAL 100 HB VAL 100 10.076 1.567 6.264 740 1HG1 VAL 100 HG11 VAL 100 9.633 3.003 8.191 741 2HG1 VAL 100 HG12 VAL 100 11.186 2.184 8.351 742 3HG1 VAL 100 HG13 VAL 100 9.789 1.615 9.266 743 1HG2 VAL 100 HG21 VAL 100 10.127 -0.677 8.273 744 2HG2 VAL 100 HG22 VAL 100 11.512 -0.047 7.380 745 3HG2 VAL 100 HG23 VAL 100 10.199 -0.850 6.520 746 H ASP 101 HN ASP 101 7.279 -1.476 7.163 747 HA ASP 101 HA ASP 101 6.383 -1.307 9.914 748 1HB ASP 101 HB2 ASP 101 5.054 -2.515 8.127 749 2HB ASP 101 HB1 ASP 101 6.311 -3.753 8.143 750 H GLY 102 HN GLY 102 8.093 -1.245 11.260 751 1HA GLY 102 HA2 GLY 102 9.845 -2.104 12.489 752 2HA GLY 102 HA1 GLY 102 9.709 -3.597 11.567 753 H GLN 103 HN GLN 103 10.908 -0.277 11.426 754 HA GLN 103 HA GLN 103 12.260 -0.073 9.135 755 1HB GLN 103 HB2 GLN 103 13.903 1.325 10.314 756 2HB GLN 103 HB1 GLN 103 12.253 1.654 10.826 757 1HG GLN 103 HG2 GLN 103 12.832 -0.069 12.713 758 2HG GLN 103 HG1 GLN 103 14.490 0.380 12.317 759 1HE2 GLN 103 HE21 GLN 103 11.495 1.389 13.692 760 2HE2 GLN 103 HE22 GLN 103 12.065 2.880 14.368 761 H GLN 104 HN GLN 104 13.639 -1.221 8.033 762 HA GLN 104 HA GLN 104 15.175 -3.328 9.323 763 1HB GLN 104 HB2 GLN 104 14.310 -2.746 6.522 764 2HB GLN 104 HB1 GLN 104 15.688 -3.798 6.758 765 1HG GLN 104 HG2 GLN 104 13.000 -4.240 8.026 766 2HG GLN 104 HG1 GLN 104 13.504 -4.961 6.500 767 1HE2 GLN 104 HE21 GLN 104 13.316 -7.035 7.287 768 2HE2 GLN 104 HE22 GLN 104 14.431 -7.700 8.433 769 H THR 105 HN THR 105 15.763 -0.339 9.300 770 HA THR 105 HA THR 105 17.626 0.905 9.613 771 HB THR 105 HB THR 105 19.246 -1.610 9.218 772 HG1 THR 105 HG1 THR 105 18.760 -2.141 11.328 773 1HG2 THR 105 HG21 THR 105 20.715 -0.565 10.883 774 2HG2 THR 105 HG22 THR 105 19.638 0.831 10.957 775 3HG2 THR 105 HG23 THR 105 20.513 0.470 9.470 776 H ASN 106 HN ASN 106 16.780 -0.289 6.775 777 HA ASN 106 HA ASN 106 17.255 0.098 4.608 778 1HB ASN 106 HB2 ASN 106 17.458 2.453 5.313 779 2HB ASN 106 HB1 ASN 106 19.166 2.197 5.649 780 1HD2 ASN 106 HD21 ASN 106 20.615 2.230 3.996 781 2HD2 ASN 106 HD22 ASN 106 20.183 2.563 2.352 782 H THR 107 HN THR 107 18.121 -1.960 4.410 783 HA THR 107 HA THR 107 20.981 -2.330 4.507 784 HB THR 107 HB THR 107 19.561 -4.253 5.013 785 HG1 THR 107 HG1 THR 107 20.700 -4.780 2.455 786 1HG2 THR 107 HG21 THR 107 18.512 -3.993 2.193 787 2HG2 THR 107 HG22 THR 107 17.605 -3.662 3.669 788 3HG2 THR 107 HG23 THR 107 18.145 -5.304 3.314 789 HA PRO 108 HA PRO 108 22.479 -0.517 0.837 790 1HB PRO 108 HB2 PRO 108 22.963 -3.341 -0.044 791 2HB PRO 108 HB1 PRO 108 24.023 -1.932 -0.165 792 1HG PRO 108 HG2 PRO 108 24.216 -3.802 1.819 793 2HG PRO 108 HG1 PRO 108 24.741 -2.120 1.990 794 1HD PRO 108 HD2 PRO 108 22.569 -3.466 3.337 795 2HD PRO 108 HD1 PRO 108 23.141 -1.801 3.559 796 HA PRO 109 HA PRO 109 18.722 -1.435 -1.568 797 1HB PRO 109 HB2 PRO 109 17.622 0.968 -1.496 798 2HB PRO 109 HB1 PRO 109 17.684 -0.011 -0.031 799 1HG PRO 109 HG2 PRO 109 19.440 2.269 -0.846 800 2HG PRO 109 HG1 PRO 109 18.716 1.921 0.736 801 1HD PRO 109 HD2 PRO 109 21.313 1.265 -0.012 802 2HD PRO 109 HD1 PRO 109 20.402 0.520 1.320 803 H GLY 110 HN GLY 110 17.755 0.454 -3.273 804 1HA GLY 110 HA2 GLY 110 19.612 1.821 -4.860 805 2HA GLY 110 HA1 GLY 110 19.393 0.204 -5.526 806 H ASN 111 HN ASN 111 17.196 -0.480 -5.991 807 HA ASN 111 HA ASN 111 15.254 1.693 -6.275 808 1HB ASN 111 HB2 ASN 111 16.475 1.424 -8.454 809 2HB ASN 111 HB1 ASN 111 15.890 -0.240 -8.510 810 1HD2 ASN 111 HD21 ASN 111 13.884 -0.652 -9.207 811 2HD2 ASN 111 HD22 ASN 111 12.754 0.562 -9.707 812 H TYR 112 HN TYR 112 13.403 1.065 -5.408 813 HA TYR 112 HA TYR 112 12.794 -1.814 -5.413 814 1HB TYR 112 HB2 TYR 112 12.197 0.259 -3.297 815 2HB TYR 112 HB1 TYR 112 11.468 -1.347 -3.317 816 HD1 TYR 112 HD1 TYR 112 13.162 -3.362 -3.412 817 HD2 TYR 112 HD2 TYR 112 14.201 0.581 -2.209 818 HE1 TYR 112 HE1 TYR 112 15.088 -4.245 -2.186 819 HE2 TYR 112 HE2 TYR 112 16.139 -0.293 -0.991 820 HH TYR 112 HH TYR 112 16.893 -2.407 0.031 821 H THR 113 HN THR 113 11.025 -2.419 -6.348 822 HA THR 113 HA THR 113 9.211 -0.338 -7.366 823 HB THR 113 HB THR 113 10.002 -2.944 -8.677 824 HG1 THR 113 HG1 THR 113 11.497 -1.841 -9.738 825 1HG2 THR 113 HG21 THR 113 8.388 -0.628 -9.749 826 2HG2 THR 113 HG22 THR 113 7.737 -2.191 -9.257 827 3HG2 THR 113 HG23 THR 113 8.829 -2.084 -10.638 828 H LEU 114 HN LEU 114 7.593 -0.560 -5.887 829 HA LEU 114 HA LEU 114 6.515 -3.248 -5.469 830 1HB LEU 114 HB2 LEU 114 5.140 -1.850 -3.668 831 2HB LEU 114 HB1 LEU 114 6.719 -2.535 -3.334 832 HG LEU 114 HG LEU 114 6.535 0.267 -4.355 833 1HD1 LEU 114 HD11 LEU 114 6.147 -0.565 -1.481 834 2HD1 LEU 114 HD12 LEU 114 4.916 0.153 -2.520 835 3HD1 LEU 114 HD13 LEU 114 6.340 1.089 -2.065 836 1HD2 LEU 114 HD21 LEU 114 8.720 -0.820 -4.145 837 2HD2 LEU 114 HD22 LEU 114 8.404 -1.107 -2.435 838 3HD2 LEU 114 HD23 LEU 114 8.555 0.541 -3.038 839 H THR 115 HN THR 115 5.210 -3.645 -7.076 840 HA THR 115 HA THR 115 3.470 -1.714 -8.264 841 HB THR 115 HB THR 115 3.217 -4.717 -8.465 842 HG1 THR 115 HG1 THR 115 5.366 -4.254 -8.932 843 1HG2 THR 115 HG21 THR 115 2.397 -4.199 -10.727 844 2HG2 THR 115 HG22 THR 115 2.593 -2.476 -10.401 845 3HG2 THR 115 HG23 THR 115 1.413 -3.418 -9.489 846 H LEU 116 HN LEU 116 1.623 -1.005 -7.416 847 HA LEU 116 HA LEU 116 0.303 -2.673 -5.384 848 1HB LEU 116 HB2 LEU 116 0.336 0.332 -5.680 849 2HB LEU 116 HB1 LEU 116 -0.624 -0.538 -4.498 850 HG LEU 116 HG LEU 116 2.393 -0.450 -4.631 851 1HD1 LEU 116 HD11 LEU 116 1.410 1.622 -3.836 852 2HD1 LEU 116 HD12 LEU 116 2.190 0.759 -2.510 853 3HD1 LEU 116 HD13 LEU 116 0.433 0.731 -2.669 854 1HD2 LEU 116 HD21 LEU 116 1.613 -2.621 -3.841 855 2HD2 LEU 116 HD22 LEU 116 0.570 -1.828 -2.661 856 3HD2 LEU 116 HD23 LEU 116 2.322 -1.690 -2.521 857 H THR 117 HN THR 117 -1.796 -3.152 -5.574 858 HA THR 117 HA THR 117 -3.326 -1.917 -7.769 859 HB THR 117 HB THR 117 -3.389 -4.860 -7.033 860 HG1 THR 117 HG1 THR 117 -1.517 -3.830 -8.324 861 1HG2 THR 117 HG21 THR 117 -4.784 -5.083 -9.040 862 2HG2 THR 117 HG22 THR 117 -4.736 -3.334 -9.267 863 3HG2 THR 117 HG23 THR 117 -5.533 -4.018 -7.850 864 H GLY 118 HN GLY 118 -4.861 -0.780 -6.707 865 1HA GLY 118 HA2 GLY 118 -5.735 -1.659 -4.065 866 2HA GLY 118 HA1 GLY 118 -6.063 -0.098 -4.807 867 H GLY 119 HN GLY 119 -8.261 -0.413 -4.102 868 1HA GLY 119 HA2 GLY 119 -10.077 -0.682 -5.972 869 2HA GLY 119 HA1 GLY 119 -9.764 -2.380 -5.644 870 H TYR 120 HN TYR 120 -12.042 -2.401 -5.093 871 HA TYR 120 HA TYR 120 -12.589 -1.218 -2.471 872 1HB TYR 120 HB2 TYR 120 -14.958 -1.695 -2.934 873 2HB TYR 120 HB1 TYR 120 -14.243 -0.668 -4.167 874 HD1 TYR 120 HD1 TYR 120 -15.742 -3.918 -3.444 875 HD2 TYR 120 HD2 TYR 120 -13.854 -1.536 -6.427 876 HE1 TYR 120 HE1 TYR 120 -16.551 -5.456 -5.184 877 HE2 TYR 120 HE2 TYR 120 -14.658 -3.068 -8.171 878 HH TYR 120 HH TYR 120 -17.059 -5.343 -7.654 879 H TRP 121 HN TRP 121 -13.219 -2.427 -0.760 880 HA TRP 121 HA TRP 121 -12.763 -5.315 -0.980 881 1HB TRP 121 HB2 TRP 121 -11.420 -4.227 0.724 882 2HB TRP 121 HB1 TRP 121 -12.852 -3.481 1.425 883 HD1 TRP 121 HD1 TRP 121 -14.649 -5.232 2.536 884 HE1 TRP 121 HE1 TRP 121 -14.227 -7.402 3.835 885 HE3 TRP 121 HE3 TRP 121 -9.885 -6.186 0.988 886 HZ2 TRP 121 HZ2 TRP 121 -12.163 -9.260 4.150 887 HZ3 TRP 121 HZ3 TRP 121 -8.757 -8.201 1.872 888 HH2 TRP 121 HH2 TRP 121 -9.879 -9.695 3.405 889 H ALA 122 HN ALA 122 -14.457 -6.723 -0.712 890 HA ALA 122 HA ALA 122 -16.942 -5.654 0.381 891 1HB ALA 122 HB1 ALA 122 -18.262 -6.459 -1.485 892 2HB ALA 122 HB2 ALA 122 -16.801 -7.055 -2.274 893 3HB ALA 122 HB3 ALA 122 -17.039 -5.320 -2.052 894 H LYS 123 HN LYS 123 -15.498 -7.232 1.817 895 HA LYS 123 HA LYS 123 -17.266 -9.453 2.260 896 1HB LYS 123 HB2 LYS 123 -14.345 -9.948 1.611 897 2HB LYS 123 HB1 LYS 123 -15.328 -11.096 2.501 898 1HG LYS 123 HG2 LYS 123 -15.911 -10.145 -0.295 899 2HG LYS 123 HG1 LYS 123 -15.084 -11.648 0.111 900 1HD LYS 123 HD2 LYS 123 -17.026 -12.542 1.134 901 2HD LYS 123 HD1 LYS 123 -17.838 -10.975 1.119 902 1HE LYS 123 HE2 LYS 123 -18.707 -12.441 -0.631 903 2HE LYS 123 HE1 LYS 123 -17.919 -11.021 -1.315 904 1HZ LYS 123 HZ1 LYS 123 -16.733 -13.741 -1.103 905 2HZ LYS 123 HZ2 LYS 123 -15.955 -12.379 -1.746 906 3HZ LYS 123 HZ3 LYS 123 -17.321 -13.017 -2.519 907 H ASP 124 HN ASP 124 -15.037 -10.622 3.991 908 HA ASP 124 HA ASP 124 -14.332 -8.422 5.708 909 1HB ASP 124 HB2 ASP 124 -15.258 -9.552 7.763 910 2HB ASP 124 HB1 ASP 124 -16.469 -8.887 6.675 911 H ASN 125 HN ASN 125 -12.304 -8.641 5.770 912 HA ASN 125 HA ASN 125 -10.238 -9.346 6.300 913 1HB ASN 125 HB2 ASN 125 -11.674 -11.486 7.842 914 2HB ASN 125 HB1 ASN 125 -9.954 -11.134 7.946 915 1HD2 ASN 125 HD21 ASN 125 -12.263 -10.974 9.870 916 2HD2 ASN 125 HD22 ASN 125 -12.143 -9.384 10.547 917 H LYS 126 HN LYS 126 -12.331 -11.921 5.083 918 HA LYS 126 HA LYS 126 -10.451 -13.907 4.842 919 1HB LYS 126 HB2 LYS 126 -11.921 -14.988 3.212 920 2HB LYS 126 HB1 LYS 126 -12.819 -14.359 4.584 921 1HG LYS 126 HG2 LYS 126 -13.744 -12.615 3.315 922 2HG LYS 126 HG1 LYS 126 -12.574 -12.828 2.017 923 1HD LYS 126 HD2 LYS 126 -14.460 -13.795 1.124 924 2HD LYS 126 HD1 LYS 126 -13.604 -15.182 1.787 925 1HE LYS 126 HE2 LYS 126 -15.799 -13.713 3.241 926 2HE LYS 126 HE1 LYS 126 -16.075 -15.129 2.231 927 1HZ LYS 126 HZ1 LYS 126 -15.931 -15.875 4.443 928 2HZ LYS 126 HZ2 LYS 126 -14.531 -14.977 4.757 929 3HZ LYS 126 HZ3 LYS 126 -14.462 -16.319 3.715 930 H GLN 127 HN GLN 127 -11.352 -11.557 2.335 931 HA GLN 127 HA GLN 127 -9.109 -10.847 1.176 932 1HB GLN 127 HB2 GLN 127 -8.544 -13.359 1.062 933 2HB GLN 127 HB1 GLN 127 -9.735 -13.445 -0.232 934 1HG GLN 127 HG2 GLN 127 -8.414 -11.689 -1.438 935 2HG GLN 127 HG1 GLN 127 -7.177 -11.858 -0.195 936 1HE2 GLN 127 HE21 GLN 127 -7.103 -12.384 -3.085 937 2HE2 GLN 127 HE22 GLN 127 -6.594 -14.027 -3.251 938 H GLY 128 HN GLY 128 -12.101 -10.555 1.216 939 1HA GLY 128 HA2 GLY 128 -12.914 -10.848 -1.532 940 2HA GLY 128 HA1 GLY 128 -13.883 -10.199 -0.217 941 H PHE 129 HN PHE 129 -11.466 -9.473 -2.630 942 HA PHE 129 HA PHE 129 -12.333 -6.685 -2.506 943 1HB PHE 129 HB2 PHE 129 -10.024 -5.884 -2.727 944 2HB PHE 129 HB1 PHE 129 -10.257 -6.767 -1.227 945 HD1 PHE 129 HD1 PHE 129 -8.912 -8.628 -0.701 946 HD2 PHE 129 HD2 PHE 129 -8.876 -7.034 -4.648 947 HE1 PHE 129 HE1 PHE 129 -7.004 -10.073 -1.260 948 HE2 PHE 129 HE2 PHE 129 -6.959 -8.471 -5.210 949 HZ PHE 129 HZ PHE 129 -5.957 -9.925 -3.473 950 H THR 130 HN THR 130 -12.029 -5.546 -4.506 951 HA THR 130 HA THR 130 -11.045 -7.131 -6.765 952 HB THR 130 HB THR 130 -13.710 -5.695 -6.759 953 HG1 THR 130 HG1 THR 130 -13.826 -7.771 -5.834 954 1HG2 THR 130 HG21 THR 130 -13.917 -6.541 -9.082 955 2HG2 THR 130 HG22 THR 130 -12.238 -7.077 -9.009 956 3HG2 THR 130 HG23 THR 130 -12.621 -5.359 -8.898 957 HA PRO 131 HA PRO 131 -8.779 -3.344 -7.487 958 1HB PRO 131 HB2 PRO 131 -8.543 -4.569 -10.187 959 2HB PRO 131 HB1 PRO 131 -7.278 -3.963 -9.112 960 1HG PRO 131 HG2 PRO 131 -7.653 -6.579 -9.435 961 2HG PRO 131 HG1 PRO 131 -7.241 -5.904 -7.847 962 1HD PRO 131 HD2 PRO 131 -9.882 -6.853 -8.882 963 2HD PRO 131 HD1 PRO 131 -9.177 -7.023 -7.260 964 H SER 132 HN SER 132 -9.443 -1.408 -8.212 965 HA SER 132 HA SER 132 -11.216 -1.207 -10.491 966 1HB SER 132 HB2 SER 132 -12.754 -1.667 -8.625 967 2HB SER 132 HB1 SER 132 -12.096 -0.283 -7.760 968 HG SER 132 HG SER 132 -13.780 0.605 -8.732 969 H GLY 133 HN GLY 133 -9.945 0.182 -11.600 970 1HA GLY 133 HA2 GLY 133 -9.341 2.363 -12.194 971 2HA GLY 133 HA1 GLY 133 -9.822 2.900 -10.599 972 H THR 134 HN THR 134 -7.876 0.348 -10.035 973 HA THR 134 HA THR 134 -5.699 2.206 -9.409 974 HB THR 134 HB THR 134 -5.204 0.487 -7.625 975 HG1 THR 134 HG1 THR 134 -6.486 -1.166 -8.759 976 1HG2 THR 134 HG21 THR 134 -7.928 1.793 -7.577 977 2HG2 THR 134 HG22 THR 134 -6.407 2.554 -7.109 978 3HG2 THR 134 HG23 THR 134 -7.044 1.205 -6.169 979 H THR 135 HN THR 135 -4.093 1.945 -10.887 980 HA THR 135 HA THR 135 -2.715 -0.612 -10.548 981 HB THR 135 HB THR 135 -2.633 0.875 -13.187 982 HG1 THR 135 HG1 THR 135 -4.556 -0.793 -12.240 983 1HG2 THR 135 HG21 THR 135 -1.589 -1.172 -14.006 984 2HG2 THR 135 HG22 THR 135 -1.743 -1.904 -12.409 985 3HG2 THR 135 HG23 THR 135 -0.680 -0.516 -12.644 986 H GLY 136 HN GLY 136 -1.277 0.204 -9.091 987 1HA GLY 136 HA2 GLY 136 0.030 2.745 -9.820 988 2HA GLY 136 HA1 GLY 136 -0.389 2.311 -8.172 989 H THR 137 HN THR 137 2.141 3.093 -9.003 990 HA THR 137 HA THR 137 3.603 0.735 -8.109 991 HB THR 137 HB THR 137 4.629 2.449 -10.381 992 HG1 THR 137 HG1 THR 137 2.880 0.366 -10.407 993 1HG2 THR 137 HG21 THR 137 5.606 -0.172 -9.232 994 2HG2 THR 137 HG22 THR 137 6.358 1.402 -8.982 995 3HG2 THR 137 HG23 THR 137 6.321 0.691 -10.595 996 H THR 138 HN THR 138 4.125 1.538 -6.139 997 HA THR 138 HA THR 138 5.097 4.233 -5.831 998 HB THR 138 HB THR 138 5.179 1.940 -3.848 999 HG1 THR 138 HG1 THR 138 3.161 3.664 -4.681 1000 1HG2 THR 138 HG21 THR 138 5.365 3.703 -2.166 1001 2HG2 THR 138 HG22 THR 138 5.364 4.928 -3.435 1002 3HG2 THR 138 HG23 THR 138 6.704 3.788 -3.309 1003 H LYS 139 HN LYS 139 7.040 4.705 -6.633 1004 HA LYS 139 HA LYS 139 9.042 2.585 -6.748 1005 1HB LYS 139 HB2 LYS 139 8.501 3.969 -8.781 1006 2HB LYS 139 HB1 LYS 139 9.202 5.349 -7.949 1007 1HG LYS 139 HG2 LYS 139 10.787 4.339 -9.507 1008 2HG LYS 139 HG1 LYS 139 11.353 4.228 -7.842 1009 1HD LYS 139 HD2 LYS 139 11.733 2.145 -9.081 1010 2HD LYS 139 HD1 LYS 139 10.633 1.914 -7.724 1011 1HE LYS 139 HE2 LYS 139 9.796 0.710 -9.629 1012 2HE LYS 139 HE1 LYS 139 8.729 2.067 -9.287 1013 1HZ LYS 139 HZ1 LYS 139 9.126 1.854 -11.644 1014 2HZ LYS 139 HZ2 LYS 139 10.798 1.978 -11.415 1015 3HZ LYS 139 HZ3 LYS 139 9.799 3.303 -11.079 1016 H LEU 140 HN LEU 140 10.187 2.383 -5.002 1017 HA LEU 140 HA LEU 140 11.076 4.766 -3.565 1018 1HB LEU 140 HB2 LEU 140 10.330 3.409 -1.911 1019 2HB LEU 140 HB1 LEU 140 10.600 1.938 -2.822 1020 HG LEU 140 HG LEU 140 13.068 2.208 -2.323 1021 1HD1 LEU 140 HD11 LEU 140 13.675 3.649 -0.438 1022 2HD1 LEU 140 HD12 LEU 140 12.048 4.333 -0.453 1023 3HD1 LEU 140 HD13 LEU 140 13.118 4.568 -1.836 1024 1HD2 LEU 140 HD21 LEU 140 12.875 1.436 0.000 1025 2HD2 LEU 140 HD22 LEU 140 11.720 0.644 -1.073 1026 3HD2 LEU 140 HD23 LEU 140 11.181 1.931 0.006 1027 H THR 141 HN THR 141 12.820 5.580 -4.508 1028 HA THR 141 HA THR 141 15.015 3.745 -5.209 1029 HB THR 141 HB THR 141 14.548 6.466 -6.437 1030 HG1 THR 141 HG1 THR 141 13.860 3.936 -7.580 1031 1HG2 THR 141 HG21 THR 141 16.045 5.619 -8.187 1032 2HG2 THR 141 HG22 THR 141 16.199 4.092 -7.316 1033 3HG2 THR 141 HG23 THR 141 16.826 5.580 -6.604 1034 H VAL 142 HN VAL 142 17.033 4.239 -4.434 1035 HA VAL 142 HA VAL 142 17.141 6.174 -2.294 1036 HB VAL 142 HB VAL 142 18.220 3.980 -2.031 1037 1HG1 VAL 142 HG11 VAL 142 20.087 4.934 -4.201 1038 2HG1 VAL 142 HG12 VAL 142 18.943 3.595 -4.311 1039 3HG1 VAL 142 HG13 VAL 142 20.320 3.489 -3.214 1040 1HG2 VAL 142 HG21 VAL 142 20.182 6.268 -1.996 1041 2HG2 VAL 142 HG22 VAL 142 20.352 4.747 -1.118 1042 3HG2 VAL 142 HG23 VAL 142 19.041 5.856 -0.717 1043 H THR 143 HN THR 143 18.508 7.956 -2.183 1044 HA THR 143 HA THR 143 20.115 8.677 -4.488 1045 HB THR 143 HB THR 143 17.995 10.552 -3.399 1046 HG1 THR 143 HG1 THR 143 17.889 8.662 -5.304 1047 1HG2 THR 143 HG21 THR 143 20.042 11.712 -4.098 1048 2HG2 THR 143 HG22 THR 143 18.711 12.048 -5.204 1049 3HG2 THR 143 HG23 THR 143 19.970 10.900 -5.661 Start of MODEL 5 1 H GLU 1 H GLU 1 -22.223 8.539 -10.406 2 HA GLU 1 HA GLU 1 -23.340 6.445 -10.001 3 1HB GLU 1 HB2 GLU 1 -23.254 5.588 -12.321 4 2HB GLU 1 HB1 GLU 1 -23.382 7.339 -12.253 5 1HG GLU 1 HG2 GLU 1 -21.058 7.591 -12.775 6 2HG GLU 1 HG1 GLU 1 -20.801 5.852 -12.661 7 H GLU 2 HN GLU 2 -19.877 6.178 -10.352 8 HA GLU 2 HA GLU 2 -20.069 3.284 -9.855 9 1HB GLU 2 HB2 GLU 2 -19.658 3.671 -12.237 10 2HB GLU 2 HB1 GLU 2 -18.274 4.678 -11.847 11 1HG GLU 2 HG2 GLU 2 -17.070 2.793 -10.997 12 2HG GLU 2 HG1 GLU 2 -18.486 1.756 -11.176 13 H CYS 3 HN CYS 3 -18.571 2.446 -8.480 14 HA CYS 3 HA CYS 3 -17.051 4.316 -6.887 15 1HB CYS 3 HB2 CYS 3 -18.214 2.466 -5.776 16 2HB CYS 3 HB1 CYS 3 -17.312 1.303 -6.738 17 H GLN 4 HN GLN 4 -15.362 5.088 -8.038 18 HA GLN 4 HA GLN 4 -13.444 3.121 -9.102 19 1HB GLN 4 HB2 GLN 4 -13.943 5.986 -9.905 20 2HB GLN 4 HB1 GLN 4 -12.569 5.046 -10.465 21 1HG GLN 4 HG2 GLN 4 -14.188 3.409 -11.424 22 2HG GLN 4 HG1 GLN 4 -15.478 4.539 -11.008 23 1HE2 GLN 4 HE21 GLN 4 -15.644 6.481 -12.133 24 2HE2 GLN 4 HE22 GLN 4 -14.824 6.757 -13.634 25 H VAL 5 HN VAL 5 -11.460 3.063 -8.188 26 HA VAL 5 HA VAL 5 -11.010 5.042 -6.052 27 HB VAL 5 HB VAL 5 -9.791 2.284 -6.291 28 1HG1 VAL 5 HG11 VAL 5 -8.441 3.841 -5.002 29 2HG1 VAL 5 HG12 VAL 5 -9.166 2.625 -3.947 30 3HG1 VAL 5 HG13 VAL 5 -9.839 4.254 -4.010 31 1HG2 VAL 5 HG21 VAL 5 -12.127 3.212 -4.624 32 2HG2 VAL 5 HG22 VAL 5 -11.337 1.642 -4.477 33 3HG2 VAL 5 HG23 VAL 5 -12.181 2.069 -5.966 34 H ARG 6 HN ARG 6 -9.613 6.563 -6.651 35 HA ARG 6 HA ARG 6 -7.772 6.023 -8.812 36 1HB ARG 6 HB2 ARG 6 -8.209 8.553 -7.229 37 2HB ARG 6 HB1 ARG 6 -7.214 8.406 -8.672 38 1HG ARG 6 HG2 ARG 6 -9.284 7.665 -9.891 39 2HG ARG 6 HG1 ARG 6 -10.197 8.130 -8.453 40 1HD ARG 6 HD2 ARG 6 -10.230 9.946 -10.029 41 2HD ARG 6 HD1 ARG 6 -9.248 10.403 -8.637 42 HE ARG 6 HE ARG 6 -7.443 9.380 -10.405 43 1HH1 ARG 6 HH11 ARG 6 -9.848 11.920 -10.537 44 2HH1 ARG 6 HH12 ARG 6 -9.016 12.825 -11.769 45 1HH2 ARG 6 HH21 ARG 6 -6.336 10.557 -12.002 46 2HH2 ARG 6 HH22 ARG 6 -7.003 12.045 -12.605 47 H VAL 7 HN VAL 7 -6.324 4.596 -7.947 48 HA VAL 7 HA VAL 7 -4.507 5.685 -5.917 49 HB VAL 7 HB VAL 7 -4.715 2.883 -7.070 50 1HG1 VAL 7 HG11 VAL 7 -2.380 3.459 -6.584 51 2HG1 VAL 7 HG12 VAL 7 -2.991 2.259 -5.444 52 3HG1 VAL 7 HG13 VAL 7 -2.835 3.945 -4.952 53 1HG2 VAL 7 HG21 VAL 7 -5.285 3.958 -4.306 54 2HG2 VAL 7 HG22 VAL 7 -5.366 2.263 -4.791 55 3HG2 VAL 7 HG23 VAL 7 -6.484 3.435 -5.490 56 H GLY 8 HN GLY 8 -2.808 6.767 -6.676 57 1HA GLY 8 HA2 GLY 8 -2.142 6.457 -9.512 58 2HA GLY 8 HA1 GLY 8 -1.749 7.843 -8.506 59 H ASP 9 HN ASP 9 0.160 6.869 -10.092 60 HA ASP 9 HA ASP 9 1.821 5.018 -8.595 61 1HB ASP 9 HB2 ASP 9 3.337 5.149 -10.509 62 2HB ASP 9 HB1 ASP 9 1.692 4.827 -11.049 63 H LEU 10 HN LEU 10 3.979 5.533 -7.974 64 HA LEU 10 HA LEU 10 4.474 8.385 -7.454 65 1HB LEU 10 HB2 LEU 10 4.656 6.147 -5.433 66 2HB LEU 10 HB1 LEU 10 5.181 7.795 -5.156 67 HG LEU 10 HG LEU 10 2.326 6.983 -5.711 68 1HD1 LEU 10 HD11 LEU 10 3.680 7.684 -3.110 69 2HD1 LEU 10 HD12 LEU 10 3.115 6.082 -3.585 70 3HD1 LEU 10 HD13 LEU 10 1.955 7.387 -3.333 71 1HD2 LEU 10 HD21 LEU 10 3.528 9.590 -4.784 72 2HD2 LEU 10 HD22 LEU 10 1.804 9.245 -4.934 73 3HD2 LEU 10 HD23 LEU 10 2.826 9.274 -6.372 74 H THR 11 HN THR 11 6.640 8.952 -7.504 75 HA THR 11 HA THR 11 8.597 6.764 -7.455 76 HB THR 11 HB THR 11 8.803 9.141 -9.316 77 HG1 THR 11 HG1 THR 11 7.283 7.015 -9.582 78 1HG2 THR 11 HG21 THR 11 10.415 6.593 -9.112 79 2HG2 THR 11 HG22 THR 11 10.957 8.198 -8.623 80 3HG2 THR 11 HG23 THR 11 10.637 7.855 -10.323 81 H VAL 12 HN VAL 12 9.898 7.061 -5.764 82 HA VAL 12 HA VAL 12 10.544 9.824 -4.965 83 HB VAL 12 HB VAL 12 9.956 7.620 -2.985 84 1HG1 VAL 12 HG11 VAL 12 9.939 9.438 -1.357 85 2HG1 VAL 12 HG12 VAL 12 10.318 10.590 -2.638 86 3HG1 VAL 12 HG13 VAL 12 11.486 9.343 -2.199 87 1HG2 VAL 12 HG21 VAL 12 8.172 9.904 -3.821 88 2HG2 VAL 12 HG22 VAL 12 7.854 8.777 -2.503 89 3HG2 VAL 12 HG23 VAL 12 7.903 8.197 -4.168 90 H ALA 13 HN ALA 13 12.655 10.172 -4.641 91 HA ALA 13 HA ALA 13 14.444 7.846 -4.559 92 1HB ALA 13 HB1 ALA 13 16.225 9.393 -5.158 93 2HB ALA 13 HB2 ALA 13 15.102 10.749 -5.056 94 3HB ALA 13 HB3 ALA 13 14.886 9.515 -6.298 95 H LYS 14 HN LYS 14 14.569 7.189 -2.465 96 HA LYS 14 HA LYS 14 16.040 8.776 -0.614 97 1HB LYS 14 HB2 LYS 14 13.484 9.513 -0.501 98 2HB LYS 14 HB1 LYS 14 13.335 8.053 0.464 99 1HG LYS 14 HG2 LYS 14 13.624 9.876 1.951 100 2HG LYS 14 HG1 LYS 14 15.122 8.944 1.956 101 1HD LYS 14 HD2 LYS 14 15.618 11.318 1.897 102 2HD LYS 14 HD1 LYS 14 16.109 10.559 0.382 103 1HE LYS 14 HE2 LYS 14 14.039 11.355 -0.674 104 2HE LYS 14 HE1 LYS 14 13.568 12.122 0.842 105 1HZ LYS 14 HZ1 LYS 14 14.569 13.681 -0.728 106 2HZ LYS 14 HZ2 LYS 14 16.009 12.798 -0.720 107 3HZ LYS 14 HZ3 LYS 14 15.475 13.566 0.698 108 H THR 15 HN THR 15 16.232 7.615 1.521 109 HA THR 15 HA THR 15 16.709 4.808 0.981 110 HB THR 15 HB THR 15 17.917 4.823 3.112 111 HG1 THR 15 HG1 THR 15 18.045 7.038 4.138 112 1HG2 THR 15 HG21 THR 15 18.536 7.280 1.458 113 2HG2 THR 15 HG22 THR 15 19.091 5.644 1.114 114 3HG2 THR 15 HG23 THR 15 19.644 6.473 2.566 115 H ARG 16 HN ARG 16 16.189 3.203 2.749 116 HA ARG 16 HA ARG 16 13.466 3.622 3.715 117 1HB ARG 16 HB2 ARG 16 15.181 1.147 4.051 118 2HB ARG 16 HB1 ARG 16 13.455 1.286 4.386 119 1HG ARG 16 HG2 ARG 16 13.448 0.222 2.356 120 2HG ARG 16 HG1 ARG 16 13.299 1.909 1.861 121 1HD ARG 16 HD2 ARG 16 15.838 1.894 1.661 122 2HD ARG 16 HD1 ARG 16 15.729 0.142 1.780 123 HE ARG 16 HE ARG 16 14.956 0.078 -0.374 124 1HH1 ARG 16 HH11 ARG 16 14.673 3.326 0.854 125 2HH1 ARG 16 HH12 ARG 16 14.406 4.050 -0.697 126 1HH2 ARG 16 HH21 ARG 16 14.571 1.016 -2.447 127 2HH2 ARG 16 HH22 ARG 16 14.306 2.720 -2.576 128 H GLY 17 HN GLY 17 16.665 3.962 4.724 129 1HA GLY 17 HA2 GLY 17 16.358 3.667 7.524 130 2HA GLY 17 HA1 GLY 17 17.582 4.642 6.718 131 H GLN 18 HN GLN 18 15.647 6.257 5.280 132 HA GLN 18 HA GLN 18 15.047 8.274 7.139 133 1HB GLN 18 HB2 GLN 18 15.262 8.682 4.714 134 2HB GLN 18 HB1 GLN 18 13.786 7.766 4.436 135 1HG GLN 18 HG2 GLN 18 13.367 10.150 4.349 136 2HG GLN 18 HG1 GLN 18 12.513 9.410 5.702 137 1HE2 GLN 18 HE21 GLN 18 13.203 9.855 7.808 138 2HE2 GLN 18 HE22 GLN 18 14.247 11.188 8.180 139 H LEU 19 HN LEU 19 13.224 5.566 5.880 140 HA LEU 19 HA LEU 19 10.739 6.146 7.075 141 1HB LEU 19 HB2 LEU 19 12.006 3.515 6.301 142 2HB LEU 19 HB1 LEU 19 10.354 3.672 6.872 143 HG LEU 19 HG LEU 19 11.309 5.150 4.430 144 1HD1 LEU 19 HD11 LEU 19 10.372 3.312 3.097 145 2HD1 LEU 19 HD12 LEU 19 10.110 2.382 4.574 146 3HD1 LEU 19 HD13 LEU 19 11.750 2.781 4.062 147 1HD2 LEU 19 HD21 LEU 19 8.921 5.118 3.896 148 2HD2 LEU 19 HD22 LEU 19 9.219 5.893 5.452 149 3HD2 LEU 19 HD23 LEU 19 8.594 4.243 5.393 150 H THR 20 HN THR 20 10.961 6.769 9.177 151 HA THR 20 HA THR 20 12.230 4.936 11.064 152 HB THR 20 HB THR 20 11.051 7.638 11.708 153 HG1 THR 20 HG1 THR 20 12.844 7.410 9.950 154 1HG2 THR 20 HG21 THR 20 12.705 7.586 13.526 155 2HG2 THR 20 HG22 THR 20 13.248 6.000 12.983 156 3HG2 THR 20 HG23 THR 20 11.613 6.203 13.610 157 H ASP 21 HN ASP 21 10.514 3.402 10.660 158 HA ASP 21 HA ASP 21 8.498 2.401 10.825 159 1HB ASP 21 HB2 ASP 21 8.950 2.556 13.243 160 2HB ASP 21 HB1 ASP 21 8.172 4.137 13.288 161 H ALA 22 HN ALA 22 7.062 5.199 12.338 162 HA ALA 22 HA ALA 22 5.285 5.482 10.074 163 1HB ALA 22 HB1 ALA 22 4.055 7.054 11.465 164 2HB ALA 22 HB2 ALA 22 5.329 6.993 12.683 165 3HB ALA 22 HB3 ALA 22 4.368 5.553 12.337 166 H ALA 23 HN ALA 23 7.033 6.160 8.642 167 HA ALA 23 HA ALA 23 7.243 9.089 8.691 168 1HB ALA 23 HB1 ALA 23 9.426 8.150 9.303 169 2HB ALA 23 HB2 ALA 23 9.485 8.965 7.739 170 3HB ALA 23 HB3 ALA 23 9.431 7.204 7.815 171 HA PRO 24 HA PRO 24 5.168 7.835 4.858 172 1HB PRO 24 HB2 PRO 24 3.865 10.185 4.477 173 2HB PRO 24 HB1 PRO 24 3.285 8.932 5.576 174 1HG PRO 24 HG2 PRO 24 4.765 11.455 6.181 175 2HG PRO 24 HG1 PRO 24 3.427 10.696 7.064 176 1HD PRO 24 HD2 PRO 24 6.048 10.496 7.829 177 2HD PRO 24 HD1 PRO 24 4.826 9.268 8.195 178 H ILE 25 HN ILE 25 7.007 7.731 3.565 179 HA ILE 25 HA ILE 25 8.216 10.210 2.643 180 HB ILE 25 HB ILE 25 8.808 7.383 1.751 181 1HG1 ILE 25 HG12 ILE 25 9.988 9.116 3.919 182 2HG1 ILE 25 HG11 ILE 25 9.200 7.551 4.111 183 1HG2 ILE 25 HG21 ILE 25 9.565 9.069 0.161 184 2HG2 ILE 25 HG22 ILE 25 10.942 8.337 0.990 185 3HG2 ILE 25 HG23 ILE 25 10.382 9.945 1.458 186 1HD1 ILE 25 HD11 ILE 25 11.043 6.480 2.919 187 2HD1 ILE 25 HD12 ILE 25 11.611 7.356 4.340 188 3HD1 ILE 25 HD13 ILE 25 11.834 8.046 2.732 189 H GLY 26 HN GLY 26 5.980 7.798 1.508 190 1HA GLY 26 HA2 GLY 26 5.521 9.497 -0.853 191 2HA GLY 26 HA1 GLY 26 5.533 7.745 -0.981 192 HA PRO 27 HA PRO 27 1.451 8.839 1.520 193 1HB PRO 27 HB2 PRO 27 0.884 11.553 1.387 194 2HB PRO 27 HB1 PRO 27 1.508 10.717 2.813 195 1HG PRO 27 HG2 PRO 27 2.968 12.321 0.756 196 2HG PRO 27 HG1 PRO 27 3.222 12.248 2.509 197 1HD PRO 27 HD2 PRO 27 4.857 10.963 0.815 198 2HD PRO 27 HD1 PRO 27 4.402 10.254 2.379 199 H VAL 28 HN VAL 28 0.379 7.944 -0.155 200 HA VAL 28 HA VAL 28 0.120 9.416 -2.657 201 HB VAL 28 HB VAL 28 0.703 7.072 -2.870 202 1HG1 VAL 28 HG11 VAL 28 -0.233 6.188 -0.829 203 2HG1 VAL 28 HG12 VAL 28 -0.855 5.288 -2.213 204 3HG1 VAL 28 HG13 VAL 28 -1.869 6.490 -1.415 205 1HG2 VAL 28 HG21 VAL 28 -0.660 8.035 -4.629 206 2HG2 VAL 28 HG22 VAL 28 -2.129 7.592 -3.760 207 3HG2 VAL 28 HG23 VAL 28 -1.067 6.335 -4.396 208 H THR 29 HN THR 29 -1.659 10.475 -3.234 209 HA THR 29 HA THR 29 -3.877 10.611 -1.428 210 HB THR 29 HB THR 29 -3.526 12.005 -4.082 211 HG1 THR 29 HG1 THR 29 -2.626 13.714 -2.696 212 1HG2 THR 29 HG21 THR 29 -4.946 13.704 -3.036 213 2HG2 THR 29 HG22 THR 29 -5.060 12.703 -1.589 214 3HG2 THR 29 HG23 THR 29 -5.750 12.135 -3.108 215 H VAL 30 HN VAL 30 -5.066 8.764 -1.574 216 HA VAL 30 HA VAL 30 -5.895 7.759 -4.178 217 HB VAL 30 HB VAL 30 -6.356 6.768 -1.360 218 1HG1 VAL 30 HG11 VAL 30 -7.459 4.814 -2.351 219 2HG1 VAL 30 HG12 VAL 30 -7.367 5.567 -3.944 220 3HG1 VAL 30 HG13 VAL 30 -8.356 6.296 -2.679 221 1HG2 VAL 30 HG21 VAL 30 -4.821 5.655 -3.717 222 2HG2 VAL 30 HG22 VAL 30 -5.027 4.843 -2.166 223 3HG2 VAL 30 HG23 VAL 30 -4.129 6.360 -2.256 224 H GLN 31 HN GLN 31 -7.593 8.602 -5.120 225 HA GLN 31 HA GLN 31 -9.620 9.953 -3.481 226 1HB GLN 31 HB2 GLN 31 -8.249 11.115 -5.354 227 2HB GLN 31 HB1 GLN 31 -9.304 10.246 -6.458 228 1HG GLN 31 HG2 GLN 31 -10.338 12.060 -4.301 229 2HG GLN 31 HG1 GLN 31 -9.926 12.628 -5.917 230 1HE2 GLN 31 HE21 GLN 31 -11.172 11.965 -7.671 231 2HE2 GLN 31 HE22 GLN 31 -12.770 11.332 -7.454 232 H ALA 32 HN ALA 32 -11.313 8.690 -3.077 233 HA ALA 32 HA ALA 32 -12.028 6.558 -4.928 234 1HB ALA 32 HB1 ALA 32 -11.840 6.039 -2.534 235 2HB ALA 32 HB2 ALA 32 -13.466 5.737 -3.149 236 3HB ALA 32 HB3 ALA 32 -13.140 7.183 -2.193 237 H LEU 33 HN LEU 33 -13.233 7.203 -6.563 238 HA LEU 33 HA LEU 33 -15.098 9.387 -6.394 239 1HB LEU 33 HB2 LEU 33 -13.794 8.894 -8.443 240 2HB LEU 33 HB1 LEU 33 -14.629 7.362 -8.589 241 HG LEU 33 HG LEU 33 -16.774 8.625 -8.829 242 1HD1 LEU 33 HD11 LEU 33 -16.079 10.703 -7.760 243 2HD1 LEU 33 HD12 LEU 33 -16.666 10.994 -9.398 244 3HD1 LEU 33 HD13 LEU 33 -14.933 11.003 -9.066 245 1HD2 LEU 33 HD21 LEU 33 -15.586 7.734 -10.762 246 2HD2 LEU 33 HD22 LEU 33 -14.633 9.216 -10.868 247 3HD2 LEU 33 HD23 LEU 33 -16.374 9.264 -11.148 248 H GLY 34 HN GLY 34 -17.099 9.212 -5.660 249 1HA GLY 34 HA2 GLY 34 -19.212 8.369 -5.317 250 2HA GLY 34 HA1 GLY 34 -18.830 7.091 -6.457 251 H CYS 35 HN CYS 35 -18.942 5.157 -5.643 252 HA CYS 35 HA CYS 35 -18.811 3.364 -4.278 253 1HB CYS 35 HB2 CYS 35 -17.123 5.100 -2.460 254 2HB CYS 35 HB1 CYS 35 -17.247 3.344 -2.410 255 H ASN 36 HN ASN 36 -19.039 6.217 -2.142 256 HA ASN 36 HA ASN 36 -20.698 7.017 -0.844 257 1HB ASN 36 HB2 ASN 36 -22.350 4.981 -2.321 258 2HB ASN 36 HB1 ASN 36 -23.027 6.126 -1.168 259 1HD2 ASN 36 HD21 ASN 36 -23.534 5.827 -4.018 260 2HD2 ASN 36 HD22 ASN 36 -23.156 7.354 -4.736 261 H ALA 37 HN ALA 37 -20.802 3.463 -0.900 262 HA ALA 37 HA ALA 37 -20.501 3.402 1.976 263 1HB ALA 37 HB1 ALA 37 -22.927 2.150 0.675 264 2HB ALA 37 HB2 ALA 37 -22.937 3.548 1.752 265 3HB ALA 37 HB3 ALA 37 -22.450 1.967 2.363 266 H ARG 38 HN ARG 38 -18.499 2.552 1.162 267 HA ARG 38 HA ARG 38 -18.575 -0.317 0.799 268 1HB ARG 38 HB2 ARG 38 -18.827 0.879 -1.479 269 2HB ARG 38 HB1 ARG 38 -17.144 1.335 -1.267 270 1HG ARG 38 HG2 ARG 38 -17.510 -0.664 -2.690 271 2HG ARG 38 HG1 ARG 38 -16.440 -0.929 -1.316 272 1HD ARG 38 HD2 ARG 38 -18.114 -2.756 -1.756 273 2HD ARG 38 HD1 ARG 38 -18.110 -2.107 -0.119 274 HE ARG 38 HE ARG 38 -20.130 -0.869 -0.704 275 1HH1 ARG 38 HH11 ARG 38 -19.185 -3.434 -2.890 276 2HH1 ARG 38 HH12 ARG 38 -20.802 -3.780 -3.406 277 1HH2 ARG 38 HH21 ARG 38 -22.274 -1.325 -1.352 278 2HH2 ARG 38 HH22 ARG 38 -22.566 -2.555 -2.552 279 H GLN 39 HN GLN 39 -16.635 -1.310 1.372 280 HA GLN 39 HA GLN 39 -14.726 0.313 2.815 281 1HB GLN 39 HB2 GLN 39 -14.933 -2.663 2.316 282 2HB GLN 39 HB1 GLN 39 -13.671 -1.922 3.292 283 1HG GLN 39 HG2 GLN 39 -15.150 -1.300 4.966 284 2HG GLN 39 HG1 GLN 39 -16.555 -1.448 3.915 285 1HE2 GLN 39 HE21 GLN 39 -17.604 -2.750 5.400 286 2HE2 GLN 39 HE22 GLN 39 -17.171 -4.404 5.654 287 H VAL 40 HN VAL 40 -13.096 1.289 1.790 288 HA VAL 40 HA VAL 40 -12.095 0.305 -0.743 289 HB VAL 40 HB VAL 40 -11.118 2.621 0.943 290 1HG1 VAL 40 HG11 VAL 40 -10.547 1.896 -1.929 291 2HG1 VAL 40 HG12 VAL 40 -9.405 1.823 -0.585 292 3HG1 VAL 40 HG13 VAL 40 -10.033 3.381 -1.128 293 1HG2 VAL 40 HG21 VAL 40 -12.969 2.604 -1.442 294 2HG2 VAL 40 HG22 VAL 40 -12.349 4.041 -0.631 295 3HG2 VAL 40 HG23 VAL 40 -13.432 2.945 0.227 296 H ALA 41 HN ALA 41 -10.361 -1.002 -0.968 297 HA ALA 41 HA ALA 41 -8.727 -1.556 1.392 298 1HB ALA 41 HB1 ALA 41 -10.433 -3.307 1.016 299 2HB ALA 41 HB2 ALA 41 -8.786 -3.914 0.811 300 3HB ALA 41 HB3 ALA 41 -9.785 -3.559 -0.604 301 H LEU 42 HN LEU 42 -6.575 -1.768 1.020 302 HA LEU 42 HA LEU 42 -5.651 -1.316 -1.730 303 1HB LEU 42 HB2 LEU 42 -3.943 -1.214 0.744 304 2HB LEU 42 HB1 LEU 42 -3.660 -0.452 -0.813 305 HG LEU 42 HG LEU 42 -5.827 0.338 1.127 306 1HD1 LEU 42 HD11 LEU 42 -3.169 1.629 0.526 307 2HD1 LEU 42 HD12 LEU 42 -3.641 0.850 2.036 308 3HD1 LEU 42 HD13 LEU 42 -4.443 2.332 1.520 309 1HD2 LEU 42 HD21 LEU 42 -4.848 1.687 -1.390 310 2HD2 LEU 42 HD22 LEU 42 -6.104 2.287 -0.307 311 3HD2 LEU 42 HD23 LEU 42 -6.366 0.805 -1.226 312 H LYS 43 HN LYS 43 -4.654 -2.888 -2.821 313 HA LYS 43 HA LYS 43 -3.592 -5.177 -1.307 314 1HB LYS 43 HB2 LYS 43 -5.022 -5.150 -3.966 315 2HB LYS 43 HB1 LYS 43 -4.012 -6.495 -3.466 316 1HG LYS 43 HG2 LYS 43 -6.250 -7.072 -2.959 317 2HG LYS 43 HG1 LYS 43 -5.451 -6.701 -1.433 318 1HD LYS 43 HD2 LYS 43 -6.422 -4.280 -2.024 319 2HD LYS 43 HD1 LYS 43 -7.624 -5.284 -2.842 320 1HE LYS 43 HE2 LYS 43 -6.795 -5.436 0.046 321 2HE LYS 43 HE1 LYS 43 -8.332 -4.839 -0.581 322 1HZ LYS 43 HZ1 LYS 43 -7.315 -7.618 -0.782 323 2HZ LYS 43 HZ2 LYS 43 -8.765 -7.065 -1.456 324 3HZ LYS 43 HZ3 LYS 43 -8.565 -7.080 0.223 325 H ALA 44 HN ALA 44 -1.692 -6.114 -2.129 326 HA ALA 44 HA ALA 44 -0.110 -4.197 -3.664 327 1HB ALA 44 HB1 ALA 44 0.818 -4.738 -1.523 328 2HB ALA 44 HB2 ALA 44 1.835 -5.450 -2.777 329 3HB ALA 44 HB3 ALA 44 0.714 -6.462 -1.867 330 H ASP 45 HN ASP 45 1.246 -4.901 -5.325 331 HA ASP 45 HA ASP 45 0.064 -6.875 -7.032 332 1HB ASP 45 HB2 ASP 45 1.054 -4.787 -7.912 333 2HB ASP 45 HB1 ASP 45 2.633 -5.298 -7.324 334 H THR 46 HN THR 46 1.093 -8.775 -7.817 335 HA THR 46 HA THR 46 2.029 -10.376 -5.743 336 HB THR 46 HB THR 46 0.846 -11.263 -7.687 337 HG1 THR 46 HG1 THR 46 3.366 -12.299 -6.952 338 1HG2 THR 46 HG21 THR 46 1.889 -9.924 -9.445 339 2HG2 THR 46 HG22 THR 46 2.030 -11.646 -9.802 340 3HG2 THR 46 HG23 THR 46 3.422 -10.757 -9.183 341 H ASP 47 HN ASP 47 3.870 -8.267 -7.766 342 HA ASP 47 HA ASP 47 6.359 -9.642 -7.571 343 1HB ASP 47 HB2 ASP 47 5.904 -7.841 -9.234 344 2HB ASP 47 HB1 ASP 47 5.896 -6.668 -7.920 345 H ASN 48 HN ASN 48 4.605 -7.462 -5.495 346 HA ASN 48 HA ASN 48 6.754 -7.675 -3.493 347 1HB ASN 48 HB2 ASN 48 6.145 -5.435 -2.674 348 2HB ASN 48 HB1 ASN 48 6.647 -5.361 -4.358 349 1HD2 ASN 48 HD21 ASN 48 4.107 -4.885 -2.116 350 2HD2 ASN 48 HD22 ASN 48 2.954 -4.233 -3.225 351 H PHE 49 HN PHE 49 4.224 -9.188 -4.108 352 HA PHE 49 HA PHE 49 3.073 -9.158 -1.404 353 1HB PHE 49 HB2 PHE 49 1.606 -7.820 -2.874 354 2HB PHE 49 HB1 PHE 49 1.489 -9.171 -3.977 355 HD1 PHE 49 HD1 PHE 49 0.368 -7.791 -0.773 356 HD2 PHE 49 HD2 PHE 49 0.069 -11.052 -3.500 357 HE1 PHE 49 HE1 PHE 49 -1.703 -8.520 0.318 358 HE2 PHE 49 HE2 PHE 49 -1.996 -11.794 -2.387 359 HZ PHE 49 HZ PHE 49 -2.888 -10.515 -0.476 360 H GLU 50 HN GLU 50 3.703 -11.140 -0.732 361 HA GLU 50 HA GLU 50 3.333 -13.392 -2.585 362 1HB GLU 50 HB2 GLU 50 5.050 -13.188 -0.107 363 2HB GLU 50 HB1 GLU 50 4.866 -14.637 -1.085 364 1HG GLU 50 HG2 GLU 50 5.759 -13.340 -3.024 365 2HG GLU 50 HG1 GLU 50 6.116 -12.030 -1.899 366 H GLN 51 HN GLN 51 1.395 -14.236 -2.320 367 HA GLN 51 HA GLN 51 -0.284 -15.456 -1.415 368 1HB GLN 51 HB2 GLN 51 1.413 -16.685 -0.151 369 2HB GLN 51 HB1 GLN 51 1.376 -15.457 1.108 370 1HG GLN 51 HG2 GLN 51 -0.858 -16.034 1.707 371 2HG GLN 51 HG1 GLN 51 -1.006 -17.110 0.321 372 1HE2 GLN 51 HE21 GLN 51 0.391 -16.674 3.478 373 2HE2 GLN 51 HE22 GLN 51 0.820 -18.339 3.731 374 H GLY 52 HN GLY 52 0.884 -13.089 0.985 375 1HA GLY 52 HA2 GLY 52 -1.416 -11.496 0.883 376 2HA GLY 52 HA1 GLY 52 -1.621 -12.652 2.193 377 H LYS 53 HN LYS 53 1.502 -11.385 1.270 378 HA LYS 53 HA LYS 53 1.424 -9.432 3.457 379 1HB LYS 53 HB2 LYS 53 3.755 -11.253 2.840 380 2HB LYS 53 HB1 LYS 53 3.723 -10.007 4.074 381 1HG LYS 53 HG2 LYS 53 1.945 -12.438 4.076 382 2HG LYS 53 HG1 LYS 53 3.467 -12.309 4.957 383 1HD LYS 53 HD2 LYS 53 2.566 -10.420 6.232 384 2HD LYS 53 HD1 LYS 53 1.050 -10.539 5.339 385 1HE LYS 53 HE2 LYS 53 0.686 -12.776 6.230 386 2HE LYS 53 HE1 LYS 53 2.221 -12.699 7.091 387 1HZ LYS 53 HZ1 LYS 53 1.363 -10.866 8.405 388 2HZ LYS 53 HZ2 LYS 53 0.348 -12.216 8.543 389 3HZ LYS 53 HZ3 LYS 53 -0.109 -10.914 7.565 390 H PHE 54 HN PHE 54 2.268 -7.479 2.852 391 HA PHE 54 HA PHE 54 3.624 -7.443 0.260 392 1HB PHE 54 HB2 PHE 54 2.873 -5.023 0.131 393 2HB PHE 54 HB1 PHE 54 1.653 -6.267 -0.059 394 HD1 PHE 54 HD1 PHE 54 -0.287 -5.182 0.506 395 HD2 PHE 54 HD2 PHE 54 3.052 -4.921 3.127 396 HE1 PHE 54 HE1 PHE 54 -1.701 -4.069 2.183 397 HE2 PHE 54 HE2 PHE 54 1.642 -3.816 4.814 398 HZ PHE 54 HZ PHE 54 -0.737 -3.388 4.342 399 H PHE 55 HN PHE 55 5.329 -6.087 -0.121 400 HA PHE 55 HA PHE 55 6.629 -4.702 2.054 401 1HB PHE 55 HB2 PHE 55 8.752 -6.096 1.690 402 2HB PHE 55 HB1 PHE 55 7.464 -6.846 2.626 403 HD1 PHE 55 HD1 PHE 55 8.903 -6.682 -0.806 404 HD2 PHE 55 HD2 PHE 55 6.609 -8.915 2.004 405 HE1 PHE 55 HE1 PHE 55 8.905 -8.607 -2.336 406 HE2 PHE 55 HE2 PHE 55 6.609 -10.842 0.474 407 HZ PHE 55 HZ PHE 55 7.758 -10.688 -1.702 408 H LEU 56 HN LEU 56 8.759 -3.796 1.278 409 HA LEU 56 HA LEU 56 8.579 -2.875 -1.462 410 1HB LEU 56 HB2 LEU 56 10.948 -2.426 0.332 411 2HB LEU 56 HB1 LEU 56 10.315 -1.390 -0.926 412 HG LEU 56 HG LEU 56 8.976 -1.849 1.739 413 1HD1 LEU 56 HD11 LEU 56 10.638 0.468 0.761 414 2HD1 LEU 56 HD12 LEU 56 11.097 -0.689 2.010 415 3HD1 LEU 56 HD13 LEU 56 9.744 0.410 2.280 416 1HD2 LEU 56 HD21 LEU 56 8.419 0.113 -0.482 417 2HD2 LEU 56 HD22 LEU 56 7.628 0.097 1.093 418 3HD2 LEU 56 HD23 LEU 56 7.407 -1.254 -0.016 419 H ILE 57 HN ILE 57 9.360 -4.148 -3.091 420 HA ILE 57 HA ILE 57 11.539 -5.990 -2.380 421 HB ILE 57 HB ILE 57 9.568 -7.173 -3.139 422 1HG1 ILE 57 HG12 ILE 57 10.569 -8.458 -5.005 423 2HG1 ILE 57 HG11 ILE 57 11.786 -7.199 -5.193 424 1HG2 ILE 57 HG21 ILE 57 8.715 -6.947 -5.423 425 2HG2 ILE 57 HG22 ILE 57 9.814 -5.593 -5.687 426 3HG2 ILE 57 HG23 ILE 57 8.526 -5.462 -4.490 427 1HD1 ILE 57 HD11 ILE 57 11.391 -8.930 -2.762 428 2HD1 ILE 57 HD12 ILE 57 12.602 -7.659 -2.935 429 3HD1 ILE 57 HD13 ILE 57 12.671 -9.090 -3.965 430 H SER 58 HN SER 58 13.446 -5.426 -2.996 431 HA SER 58 HA SER 58 14.063 -3.316 -4.738 432 1HB SER 58 HB2 SER 58 16.393 -4.305 -4.612 433 2HB SER 58 HB1 SER 58 15.634 -3.982 -3.049 434 HG SER 58 HG SER 58 15.061 -6.470 -4.025 435 H ASP 59 HN ASP 59 14.984 -3.298 -6.812 436 HA ASP 59 HA ASP 59 13.967 -5.195 -8.670 437 1HB ASP 59 HB2 ASP 59 15.061 -3.899 -10.356 438 2HB ASP 59 HB1 ASP 59 14.479 -2.761 -9.146 439 H ASN 60 HN ASN 60 16.894 -4.941 -6.870 440 HA ASN 60 HA ASN 60 18.225 -7.030 -8.410 441 1HB ASN 60 HB2 ASN 60 19.067 -5.319 -6.074 442 2HB ASN 60 HB1 ASN 60 20.020 -6.697 -6.606 443 1HD2 ASN 60 HD21 ASN 60 18.907 -3.498 -7.413 444 2HD2 ASN 60 HD22 ASN 60 20.033 -3.223 -8.692 445 H ASN 61 HN ASN 61 15.745 -7.320 -6.673 446 HA ASN 61 HA ASN 61 15.013 -8.378 -4.741 447 1HB ASN 61 HB2 ASN 61 14.775 -10.759 -5.204 448 2HB ASN 61 HB1 ASN 61 14.458 -9.794 -6.633 449 1HD2 ASN 61 HD21 ASN 61 15.181 -12.612 -6.285 450 2HD2 ASN 61 HD22 ASN 61 16.598 -12.856 -7.249 451 H ARG 62 HN ARG 62 16.716 -7.452 -3.369 452 HA ARG 62 HA ARG 62 18.520 -9.546 -2.354 453 1HB ARG 62 HB2 ARG 62 19.979 -7.600 -1.604 454 2HB ARG 62 HB1 ARG 62 19.931 -7.936 -3.327 455 1HG ARG 62 HG2 ARG 62 18.518 -6.074 -3.737 456 2HG ARG 62 HG1 ARG 62 18.242 -5.828 -2.013 457 1HD ARG 62 HD2 ARG 62 20.951 -5.630 -3.304 458 2HD ARG 62 HD1 ARG 62 19.879 -4.248 -3.083 459 HE ARG 62 HE ARG 62 20.140 -4.467 -0.728 460 1HH1 ARG 62 HH11 ARG 62 22.222 -6.578 -2.596 461 2HH1 ARG 62 HH12 ARG 62 23.343 -6.835 -1.290 462 1HH2 ARG 62 HH21 ARG 62 21.618 -4.788 0.966 463 2HH2 ARG 62 HH22 ARG 62 23.000 -5.819 0.736 464 H ASP 63 HN ASP 63 16.577 -6.712 -1.456 465 HA ASP 63 HA ASP 63 16.353 -7.803 1.252 466 1HB ASP 63 HB2 ASP 63 18.185 -6.105 1.237 467 2HB ASP 63 HB1 ASP 63 17.028 -4.908 0.665 468 H LYS 64 HN LYS 64 14.386 -7.441 2.206 469 HA LYS 64 HA LYS 64 12.456 -5.863 0.658 470 1HB LYS 64 HB2 LYS 64 10.742 -7.625 1.161 471 2HB LYS 64 HB1 LYS 64 11.997 -8.117 0.037 472 1HG LYS 64 HG2 LYS 64 11.884 -9.971 1.350 473 2HG LYS 64 HG1 LYS 64 13.121 -9.066 2.220 474 1HD LYS 64 HD2 LYS 64 11.377 -8.203 3.739 475 2HD LYS 64 HD1 LYS 64 10.182 -9.187 2.892 476 1HE LYS 64 HE2 LYS 64 10.837 -10.363 4.863 477 2HE LYS 64 HE1 LYS 64 11.528 -11.200 3.476 478 1HZ LYS 64 HZ1 LYS 64 13.652 -10.153 3.929 479 2HZ LYS 64 HZ2 LYS 64 13.112 -10.991 5.300 480 3HZ LYS 64 HZ3 LYS 64 12.992 -9.301 5.237 481 H LEU 65 HN LEU 65 11.001 -4.687 1.809 482 HA LEU 65 HA LEU 65 11.146 -4.885 4.747 483 1HB LEU 65 HB2 LEU 65 11.193 -2.375 3.077 484 2HB LEU 65 HB1 LEU 65 10.936 -2.390 4.809 485 HG LEU 65 HG LEU 65 13.231 -3.582 4.913 486 1HD1 LEU 65 HD11 LEU 65 14.766 -2.938 3.109 487 2HD1 LEU 65 HD12 LEU 65 13.406 -2.291 2.193 488 3HD1 LEU 65 HD13 LEU 65 13.493 -4.016 2.539 489 1HD2 LEU 65 HD21 LEU 65 12.964 -0.675 4.174 490 2HD2 LEU 65 HD22 LEU 65 14.381 -1.405 4.931 491 3HD2 LEU 65 HD23 LEU 65 12.841 -1.370 5.790 492 H TYR 66 HN TYR 66 9.193 -5.255 5.575 493 HA TYR 66 HA TYR 66 6.807 -4.949 4.050 494 1HB TYR 66 HB2 TYR 66 7.121 -5.402 7.029 495 2HB TYR 66 HB1 TYR 66 5.641 -5.626 6.101 496 HD1 TYR 66 HD1 TYR 66 9.019 -6.940 6.726 497 HD2 TYR 66 HD2 TYR 66 5.281 -7.633 4.807 498 HE1 TYR 66 HE1 TYR 66 9.673 -9.267 6.299 499 HE2 TYR 66 HE2 TYR 66 5.933 -9.963 4.375 500 HH TYR 66 HH TYR 66 8.680 -11.399 5.858 501 H VAL 67 HN VAL 67 5.432 -3.280 3.938 502 HA VAL 67 HA VAL 67 5.791 -1.048 5.817 503 HB VAL 67 HB VAL 67 5.252 0.517 3.934 504 1HG1 VAL 67 HG11 VAL 67 7.797 -1.076 3.659 505 2HG1 VAL 67 HG12 VAL 67 7.523 0.244 4.797 506 3HG1 VAL 67 HG13 VAL 67 7.528 0.562 3.061 507 1HG2 VAL 67 HG21 VAL 67 4.302 -1.101 2.371 508 2HG2 VAL 67 HG22 VAL 67 5.870 -1.898 2.232 509 3HG2 VAL 67 HG23 VAL 67 5.664 -0.248 1.645 510 H ASN 68 HN ASN 68 3.990 -0.505 6.824 511 HA ASN 68 HA ASN 68 1.476 -1.556 5.784 512 1HB ASN 68 HB2 ASN 68 0.586 -0.667 8.054 513 2HB ASN 68 HB1 ASN 68 1.583 -2.112 8.040 514 1HD2 ASN 68 HD21 ASN 68 2.753 1.222 7.739 515 2HD2 ASN 68 HD22 ASN 68 3.631 1.216 9.239 516 H ILE 69 HN ILE 69 0.146 -0.371 4.667 517 HA ILE 69 HA ILE 69 0.728 2.431 4.275 518 HB ILE 69 HB ILE 69 -1.674 1.093 3.090 519 1HG1 ILE 69 HG12 ILE 69 1.162 0.701 2.111 520 2HG1 ILE 69 HG11 ILE 69 0.176 -0.540 2.872 521 1HG2 ILE 69 HG21 ILE 69 0.336 3.074 2.018 522 2HG2 ILE 69 HG22 ILE 69 -1.255 3.465 2.667 523 3HG2 ILE 69 HG23 ILE 69 -1.115 2.521 1.184 524 1HD1 ILE 69 HD11 ILE 69 -0.390 0.825 0.252 525 2HD1 ILE 69 HD12 ILE 69 -1.413 -0.392 1.017 526 3HD1 ILE 69 HD13 ILE 69 0.210 -0.818 0.472 527 H ARG 70 HN ARG 70 0.173 3.299 6.318 528 HA ARG 70 HA ARG 70 -2.587 3.002 7.210 529 1HB ARG 70 HB2 ARG 70 -0.237 4.446 8.460 530 2HB ARG 70 HB1 ARG 70 -1.844 4.371 9.161 531 1HG ARG 70 HG2 ARG 70 -1.662 1.976 9.411 532 2HG ARG 70 HG1 ARG 70 -0.093 1.986 8.602 533 1HD ARG 70 HD2 ARG 70 0.118 1.862 11.053 534 2HD ARG 70 HD1 ARG 70 0.853 3.321 10.390 535 HE ARG 70 HE ARG 70 -1.885 3.506 11.407 536 1HH1 ARG 70 HH11 ARG 70 1.534 4.119 11.921 537 2HH1 ARG 70 HH12 ARG 70 1.262 5.366 13.102 538 1HH2 ARG 70 HH21 ARG 70 -2.243 5.141 12.955 539 2HH2 ARG 70 HH22 ARG 70 -0.885 5.923 13.718 540 HA PRO 71 HA PRO 71 -3.689 6.709 5.093 541 1HB PRO 71 HB2 PRO 71 -6.017 7.233 6.374 542 2HB PRO 71 HB1 PRO 71 -5.859 6.002 5.129 543 1HG PRO 71 HG2 PRO 71 -5.881 5.682 8.098 544 2HG PRO 71 HG1 PRO 71 -6.654 4.681 6.851 545 1HD PRO 71 HD2 PRO 71 -4.326 3.980 8.064 546 2HD PRO 71 HD1 PRO 71 -4.710 3.539 6.387 547 H MET 72 HN MET 72 -3.242 8.800 5.384 548 HA MET 72 HA MET 72 -2.004 9.460 7.891 549 1HB MET 72 HB2 MET 72 -1.099 10.031 5.571 550 2HB MET 72 HB1 MET 72 -2.332 11.287 5.518 551 1HG MET 72 HG2 MET 72 -1.389 12.391 7.421 552 2HG MET 72 HG1 MET 72 -0.255 11.071 7.682 553 1HE MET 72 HE1 MET 72 0.625 14.101 7.594 554 2HE MET 72 HE2 MET 72 2.093 13.985 6.620 555 3HE MET 72 HE3 MET 72 1.738 12.754 7.832 556 H ASP 73 HN ASP 73 -3.655 9.619 9.361 557 HA ASP 73 HA ASP 73 -5.046 10.784 10.726 558 1HB ASP 73 HB2 ASP 73 -4.606 13.057 8.776 559 2HB ASP 73 HB1 ASP 73 -5.393 13.203 10.344 560 H ASN 74 HN ASN 74 -6.185 9.127 8.678 561 HA ASN 74 HA ASN 74 -8.761 10.489 8.398 562 1HB ASN 74 HB2 ASN 74 -7.164 9.325 6.152 563 2HB ASN 74 HB1 ASN 74 -8.917 9.408 6.054 564 1HD2 ASN 74 HD21 ASN 74 -5.961 11.131 5.848 565 2HD2 ASN 74 HD22 ASN 74 -6.636 12.672 5.451 566 H SER 75 HN SER 75 -10.148 9.331 9.453 567 HA SER 75 HA SER 75 -11.624 7.682 9.919 568 1HB SER 75 HB2 SER 75 -10.472 6.269 7.510 569 2HB SER 75 HB1 SER 75 -12.056 6.007 8.239 570 HG SER 75 HG SER 75 -11.939 8.573 7.744 571 H ALA 76 HN ALA 76 -11.627 4.975 9.795 572 HA ALA 76 HA ALA 76 -9.195 4.141 11.238 573 1HB ALA 76 HB1 ALA 76 -10.590 2.646 12.588 574 2HB ALA 76 HB2 ALA 76 -12.029 3.277 11.790 575 3HB ALA 76 HB3 ALA 76 -11.050 4.335 12.803 576 H TRP 77 HN TRP 77 -8.120 2.733 10.072 577 HA TRP 77 HA TRP 77 -9.593 1.023 8.190 578 1HB TRP 77 HB2 TRP 77 -6.765 2.079 8.139 579 2HB TRP 77 HB1 TRP 77 -7.335 0.816 7.055 580 HD1 TRP 77 HD1 TRP 77 -9.063 4.182 7.985 581 HE1 TRP 77 HE1 TRP 77 -9.554 5.439 5.790 582 HE3 TRP 77 HE3 TRP 77 -6.917 0.918 4.695 583 HZ2 TRP 77 HZ2 TRP 77 -9.084 5.081 3.030 584 HZ3 TRP 77 HZ3 TRP 77 -6.982 1.443 2.298 585 HH2 TRP 77 HH2 TRP 77 -8.039 3.488 1.485 586 H THR 78 HN THR 78 -9.301 -1.163 8.223 587 HA THR 78 HA THR 78 -8.015 -2.324 10.528 588 HB THR 78 HB THR 78 -9.248 -3.729 8.144 589 HG1 THR 78 HG1 THR 78 -10.372 -2.780 10.591 590 1HG2 THR 78 HG21 THR 78 -8.716 -4.680 10.966 591 2HG2 THR 78 HG22 THR 78 -7.803 -5.156 9.534 592 3HG2 THR 78 HG23 THR 78 -9.499 -5.613 9.693 593 H THR 79 HN THR 79 -5.897 -2.606 10.578 594 HA THR 79 HA THR 79 -4.393 -2.520 8.105 595 HB THR 79 HB THR 79 -3.582 -1.103 9.840 596 HG1 THR 79 HG1 THR 79 -1.855 -3.367 9.635 597 1HG2 THR 79 HG21 THR 79 -3.342 -3.562 11.574 598 2HG2 THR 79 HG22 THR 79 -4.506 -2.254 11.781 599 3HG2 THR 79 HG23 THR 79 -2.784 -1.944 12.001 600 H ASP 80 HN ASP 80 -4.077 -4.288 7.020 601 HA ASP 80 HA ASP 80 -2.957 -6.596 8.455 602 1HB ASP 80 HB2 ASP 80 -5.279 -7.084 7.643 603 2HB ASP 80 HB1 ASP 80 -4.737 -6.752 5.998 604 H ASN 81 HN ASN 81 -1.369 -7.807 7.131 605 HA ASN 81 HA ASN 81 0.160 -5.937 5.538 606 1HB ASN 81 HB2 ASN 81 0.716 -8.688 6.590 607 2HB ASN 81 HB1 ASN 81 1.746 -7.976 5.353 608 1HD2 ASN 81 HD21 ASN 81 2.974 -6.153 5.846 609 2HD2 ASN 81 HD22 ASN 81 3.317 -5.708 7.485 610 H GLY 82 HN GLY 82 -2.329 -7.946 4.813 611 1HA GLY 82 HA2 GLY 82 -1.315 -8.358 2.086 612 2HA GLY 82 HA1 GLY 82 -2.628 -9.272 2.811 613 H VAL 83 HN VAL 83 -3.886 -6.932 3.988 614 HA VAL 83 HA VAL 83 -4.757 -5.442 1.626 615 HB VAL 83 HB VAL 83 -7.086 -5.785 2.068 616 1HG1 VAL 83 HG11 VAL 83 -5.645 -8.439 2.159 617 2HG1 VAL 83 HG12 VAL 83 -6.049 -7.514 0.712 618 3HG1 VAL 83 HG13 VAL 83 -7.333 -8.210 1.702 619 1HG2 VAL 83 HG21 VAL 83 -7.914 -7.233 3.869 620 2HG2 VAL 83 HG22 VAL 83 -7.013 -5.857 4.506 621 3HG2 VAL 83 HG23 VAL 83 -6.262 -7.452 4.450 622 H PHE 84 HN PHE 84 -5.847 -3.408 2.185 623 HA PHE 84 HA PHE 84 -5.690 -2.717 5.025 624 1HB PHE 84 HB2 PHE 84 -3.623 -1.981 3.412 625 2HB PHE 84 HB1 PHE 84 -4.693 -0.599 3.206 626 HD1 PHE 84 HD1 PHE 84 -5.723 0.269 5.531 627 HD2 PHE 84 HD2 PHE 84 -2.076 -1.868 5.066 628 HE1 PHE 84 HE1 PHE 84 -4.922 1.180 7.670 629 HE2 PHE 84 HE2 PHE 84 -1.263 -0.957 7.201 630 HZ PHE 84 HZ PHE 84 -2.690 0.567 8.510 631 H TYR 85 HN TYR 85 -7.754 -2.143 5.444 632 HA TYR 85 HA TYR 85 -9.107 -0.531 3.434 633 1HB TYR 85 HB2 TYR 85 -11.043 -1.967 3.304 634 2HB TYR 85 HB1 TYR 85 -9.598 -2.830 2.816 635 HD1 TYR 85 HD1 TYR 85 -12.576 -3.180 4.546 636 HD2 TYR 85 HD2 TYR 85 -8.434 -4.094 4.906 637 HE1 TYR 85 HE1 TYR 85 -13.108 -4.954 6.173 638 HE2 TYR 85 HE2 TYR 85 -8.958 -5.871 6.512 639 HH TYR 85 HH TYR 85 -12.041 -7.081 7.002 640 H LYS 86 HN LYS 86 -10.654 0.734 4.070 641 HA LYS 86 HA LYS 86 -10.749 1.518 6.793 642 1HB LYS 86 HB2 LYS 86 -12.490 3.138 5.950 643 2HB LYS 86 HB1 LYS 86 -10.942 3.210 5.123 644 1HG LYS 86 HG2 LYS 86 -11.937 1.763 3.330 645 2HG LYS 86 HG1 LYS 86 -13.494 1.968 4.124 646 1HD LYS 86 HD2 LYS 86 -11.917 4.401 3.445 647 2HD LYS 86 HD1 LYS 86 -12.715 3.532 2.136 648 1HE LYS 86 HE2 LYS 86 -14.247 5.182 2.821 649 2HE LYS 86 HE1 LYS 86 -14.834 3.676 3.521 650 1HZ LYS 86 HZ1 LYS 86 -14.952 5.431 5.133 651 2HZ LYS 86 HZ2 LYS 86 -13.323 5.811 4.934 652 3HZ LYS 86 HZ3 LYS 86 -13.766 4.333 5.634 653 H ASN 87 HN ASN 87 -12.053 0.887 8.366 654 HA ASN 87 HA ASN 87 -13.996 -1.158 8.026 655 1HB ASN 87 HB2 ASN 87 -13.141 -1.172 10.173 656 2HB ASN 87 HB1 ASN 87 -13.071 0.583 10.271 657 1HD2 ASN 87 HD21 ASN 87 -15.142 -2.229 10.576 658 2HD2 ASN 87 HD22 ASN 87 -16.394 -1.428 11.464 659 H ASP 88 HN ASP 88 -14.110 2.326 8.254 660 HA ASP 88 HA ASP 88 -16.939 2.589 8.289 661 1HB ASP 88 HB2 ASP 88 -15.946 4.880 7.035 662 2HB ASP 88 HB1 ASP 88 -16.266 4.688 8.759 663 H VAL 89 HN VAL 89 -18.345 2.305 6.669 664 HA VAL 89 HA VAL 89 -17.266 1.790 4.011 665 HB VAL 89 HB VAL 89 -19.599 1.064 3.449 666 1HG1 VAL 89 HG11 VAL 89 -19.459 -1.041 4.699 667 2HG1 VAL 89 HG12 VAL 89 -18.279 -0.311 5.787 668 3HG1 VAL 89 HG13 VAL 89 -17.884 -0.540 4.083 669 1HG2 VAL 89 HG21 VAL 89 -21.173 0.643 5.265 670 2HG2 VAL 89 HG22 VAL 89 -20.796 2.362 5.151 671 3HG2 VAL 89 HG23 VAL 89 -20.059 1.381 6.415 672 H GLY 90 HN GLY 90 -17.134 3.359 2.578 673 1HA GLY 90 HA2 GLY 90 -19.155 4.835 1.540 674 2HA GLY 90 HA1 GLY 90 -18.633 5.802 2.912 675 H SER 91 HN SER 91 -18.268 7.300 1.029 676 HA SER 91 HA SER 91 -15.993 6.887 -0.619 677 1HB SER 91 HB2 SER 91 -16.220 9.422 -0.920 678 2HB SER 91 HB1 SER 91 -17.616 8.448 -1.392 679 HG SER 91 HG SER 91 -18.024 10.371 -0.035 680 H TRP 92 HN TRP 92 -13.941 7.960 -0.405 681 HA TRP 92 HA TRP 92 -13.279 8.755 2.336 682 1HB TRP 92 HB2 TRP 92 -12.872 6.295 1.953 683 2HB TRP 92 HB1 TRP 92 -11.632 6.776 0.790 684 HD1 TRP 92 HD1 TRP 92 -12.430 7.049 4.553 685 HE1 TRP 92 HE1 TRP 92 -10.206 7.340 5.813 686 HE3 TRP 92 HE3 TRP 92 -9.325 7.433 0.550 687 HZ2 TRP 92 HZ2 TRP 92 -7.469 7.676 5.160 688 HZ3 TRP 92 HZ3 TRP 92 -6.945 7.751 0.944 689 HH2 TRP 92 HH2 TRP 92 -6.015 7.866 3.192 690 H GLY 93 HN GLY 93 -11.677 8.156 -0.743 691 1HA GLY 93 HA2 GLY 93 -9.938 9.324 -1.756 692 2HA GLY 93 HA1 GLY 93 -11.177 10.551 -1.802 693 H GLY 94 HN GLY 94 -8.310 9.418 -0.148 694 1HA GLY 94 HA2 GLY 94 -7.730 12.119 0.707 695 2HA GLY 94 HA1 GLY 94 -8.005 10.980 2.018 696 H THR 95 HN THR 95 -5.861 11.226 2.746 697 HA THR 95 HA THR 95 -3.759 10.337 0.903 698 HB THR 95 HB THR 95 -2.269 11.349 2.762 699 HG1 THR 95 HG1 THR 95 -3.356 12.897 4.046 700 1HG2 THR 95 HG21 THR 95 -2.551 13.615 1.821 701 2HG2 THR 95 HG22 THR 95 -4.065 13.105 1.075 702 3HG2 THR 95 HG23 THR 95 -2.542 12.378 0.566 703 H ILE 96 HN ILE 96 -2.725 8.492 1.217 704 HA ILE 96 HA ILE 96 -2.649 7.329 3.915 705 HB ILE 96 HB ILE 96 -2.192 5.112 2.573 706 1HG1 ILE 96 HG12 ILE 96 -2.432 6.461 0.399 707 2HG1 ILE 96 HG11 ILE 96 -3.209 4.884 0.496 708 1HG2 ILE 96 HG21 ILE 96 -4.942 6.235 3.031 709 2HG2 ILE 96 HG22 ILE 96 -3.967 5.302 4.167 710 3HG2 ILE 96 HG23 ILE 96 -4.591 4.538 2.706 711 1HD1 ILE 96 HD11 ILE 96 -5.347 5.973 0.951 712 2HD1 ILE 96 HD12 ILE 96 -4.646 6.516 -0.573 713 3HD1 ILE 96 HD13 ILE 96 -4.558 7.549 0.851 714 H GLY 97 HN GLY 97 -0.608 6.541 4.579 715 1HA GLY 97 HA2 GLY 97 1.567 7.433 2.794 716 2HA GLY 97 HA1 GLY 97 1.619 7.575 4.545 717 H ILE 98 HN ILE 98 3.458 6.250 2.685 718 HA ILE 98 HA ILE 98 3.232 3.469 3.513 719 HB ILE 98 HB ILE 98 5.102 4.901 1.636 720 1HG1 ILE 98 HG12 ILE 98 4.306 2.968 0.154 721 2HG1 ILE 98 HG11 ILE 98 3.113 2.652 1.412 722 1HG2 ILE 98 HG21 ILE 98 6.340 2.812 1.328 723 2HG2 ILE 98 HG22 ILE 98 5.418 2.075 2.640 724 3HG2 ILE 98 HG23 ILE 98 6.501 3.427 2.974 725 1HD1 ILE 98 HD11 ILE 98 3.384 5.192 -0.178 726 2HD1 ILE 98 HD12 ILE 98 2.200 4.898 1.095 727 3HD1 ILE 98 HD13 ILE 98 2.152 3.948 -0.389 728 H TYR 99 HN TYR 99 3.938 2.945 5.421 729 HA TYR 99 HA TYR 99 6.284 4.320 6.534 730 1HB TYR 99 HB2 TYR 99 4.126 3.039 8.211 731 2HB TYR 99 HB1 TYR 99 5.341 4.213 8.702 732 HD1 TYR 99 HD1 TYR 99 5.098 6.600 7.956 733 HD2 TYR 99 HD2 TYR 99 2.006 3.736 7.427 734 HE1 TYR 99 HE1 TYR 99 3.468 8.416 7.671 735 HE2 TYR 99 HE2 TYR 99 0.374 5.551 7.135 736 HH TYR 99 HH TYR 99 0.172 7.979 7.845 737 H VAL 100 HN VAL 100 7.943 3.005 7.050 738 HA VAL 100 HA VAL 100 7.811 0.238 6.386 739 HB VAL 100 HB VAL 100 9.883 1.665 6.182 740 1HG1 VAL 100 HG11 VAL 100 9.762 2.779 8.339 741 2HG1 VAL 100 HG12 VAL 100 11.288 1.914 8.166 742 3HG1 VAL 100 HG13 VAL 100 9.999 1.238 9.164 743 1HG2 VAL 100 HG21 VAL 100 9.976 -0.761 5.996 744 2HG2 VAL 100 HG22 VAL 100 10.134 -0.901 7.746 745 3HG2 VAL 100 HG23 VAL 100 11.415 -0.139 6.805 746 H ASP 101 HN ASP 101 7.721 -1.530 7.717 747 HA ASP 101 HA ASP 101 6.541 -1.276 10.270 748 1HB ASP 101 HB2 ASP 101 6.209 -3.268 8.880 749 2HB ASP 101 HB1 ASP 101 7.924 -3.659 9.014 750 H GLY 102 HN GLY 102 7.771 -0.033 11.644 751 1HA GLY 102 HA2 GLY 102 9.382 0.446 13.205 752 2HA GLY 102 HA1 GLY 102 9.479 -1.294 13.397 753 H GLN 103 HN GLN 103 10.463 0.934 10.800 754 HA GLN 103 HA GLN 103 12.210 0.748 9.350 755 1HB GLN 103 HB2 GLN 103 14.387 1.340 10.385 756 2HB GLN 103 HB1 GLN 103 13.059 2.400 10.817 757 1HG GLN 103 HG2 GLN 103 12.908 1.398 12.996 758 2HG GLN 103 HG1 GLN 103 14.116 0.189 12.561 759 1HE2 GLN 103 HE21 GLN 103 14.360 3.520 11.556 760 2HE2 GLN 103 HE22 GLN 103 15.708 3.928 12.559 761 H GLN 104 HN GLN 104 12.097 -1.206 8.467 762 HA GLN 104 HA GLN 104 12.752 -3.651 9.588 763 1HB GLN 104 HB2 GLN 104 12.402 -2.610 6.836 764 2HB GLN 104 HB1 GLN 104 13.170 -4.184 6.998 765 1HG GLN 104 HG2 GLN 104 10.509 -3.439 8.201 766 2HG GLN 104 HG1 GLN 104 10.712 -4.267 6.656 767 1HE2 GLN 104 HE21 GLN 104 9.405 -5.116 9.138 768 2HE2 GLN 104 HE22 GLN 104 10.158 -6.610 9.572 769 H THR 105 HN THR 105 14.718 -2.175 7.002 770 HA THR 105 HA THR 105 17.125 -3.203 8.293 771 HB THR 105 HB THR 105 17.683 -4.276 5.972 772 HG1 THR 105 HG1 THR 105 16.032 -4.569 4.654 773 1HG2 THR 105 HG21 THR 105 15.740 -5.580 7.886 774 2HG2 THR 105 HG22 THR 105 17.495 -5.555 8.046 775 3HG2 THR 105 HG23 THR 105 16.745 -6.424 6.709 776 H ASN 106 HN ASN 106 16.038 -2.059 5.104 777 HA ASN 106 HA ASN 106 16.973 -0.702 3.566 778 1HB ASN 106 HB2 ASN 106 16.539 1.045 5.239 779 2HB ASN 106 HB1 ASN 106 18.078 0.708 6.006 780 1HD2 ASN 106 HD21 ASN 106 19.872 1.714 5.265 781 2HD2 ASN 106 HD22 ASN 106 19.912 2.762 3.878 782 H THR 107 HN THR 107 18.132 -3.066 3.919 783 HA THR 107 HA THR 107 20.970 -2.919 4.283 784 HB THR 107 HB THR 107 19.434 -5.041 2.764 785 HG1 THR 107 HG1 THR 107 18.540 -5.505 4.617 786 1HG2 THR 107 HG21 THR 107 21.870 -5.170 2.563 787 2HG2 THR 107 HG22 THR 107 21.244 -6.511 3.523 788 3HG2 THR 107 HG23 THR 107 22.022 -5.143 4.320 789 HA PRO 108 HA PRO 108 22.514 -0.388 1.164 790 1HB PRO 108 HB2 PRO 108 23.633 -2.920 0.018 791 2HB PRO 108 HB1 PRO 108 24.412 -1.347 0.238 792 1HG PRO 108 HG2 PRO 108 24.537 -3.504 2.030 793 2HG PRO 108 HG1 PRO 108 24.987 -1.829 2.382 794 1HD PRO 108 HD2 PRO 108 22.877 -3.254 3.572 795 2HD PRO 108 HD1 PRO 108 23.093 -1.490 3.618 796 HA PRO 109 HA PRO 109 19.105 -1.735 -1.540 797 1HB PRO 109 HB2 PRO 109 17.799 0.750 -1.194 798 2HB PRO 109 HB1 PRO 109 17.429 -0.773 -0.389 799 1HG PRO 109 HG2 PRO 109 18.418 1.510 0.852 800 2HG PRO 109 HG1 PRO 109 18.451 -0.125 1.527 801 1HD PRO 109 HD2 PRO 109 20.613 1.402 0.148 802 2HD PRO 109 HD1 PRO 109 20.713 0.274 1.518 803 H GLY 110 HN GLY 110 17.735 -0.217 -3.106 804 1HA GLY 110 HA2 GLY 110 19.172 1.745 -4.584 805 2HA GLY 110 HA1 GLY 110 19.138 0.181 -5.404 806 H ASN 111 HN ASN 111 17.443 -0.188 -6.688 807 HA ASN 111 HA ASN 111 15.092 1.515 -6.437 808 1HB ASN 111 HB2 ASN 111 16.017 1.081 -8.682 809 2HB ASN 111 HB1 ASN 111 15.720 -0.643 -8.464 810 1HD2 ASN 111 HD21 ASN 111 14.304 -0.812 -10.165 811 2HD2 ASN 111 HD22 ASN 111 12.714 -0.128 -10.136 812 H TYR 112 HN TYR 112 13.199 0.900 -5.586 813 HA TYR 112 HA TYR 112 12.797 -1.945 -4.963 814 1HB TYR 112 HB2 TYR 112 12.406 0.452 -3.195 815 2HB TYR 112 HB1 TYR 112 11.394 -0.968 -2.982 816 HD1 TYR 112 HD1 TYR 112 12.043 -2.194 -1.170 817 HD2 TYR 112 HD2 TYR 112 15.056 -0.472 -3.609 818 HE1 TYR 112 HE1 TYR 112 13.764 -3.266 0.218 819 HE2 TYR 112 HE2 TYR 112 16.785 -1.541 -2.236 820 HH TYR 112 HH TYR 112 16.039 -3.905 0.163 821 H THR 113 HN THR 113 11.026 -2.733 -5.801 822 HA THR 113 HA THR 113 9.052 -0.898 -6.921 823 HB THR 113 HB THR 113 9.203 -3.888 -7.251 824 HG1 THR 113 HG1 THR 113 10.961 -3.458 -8.346 825 1HG2 THR 113 HG21 THR 113 7.868 -1.724 -8.883 826 2HG2 THR 113 HG22 THR 113 7.058 -2.907 -7.856 827 3HG2 THR 113 HG23 THR 113 7.912 -3.437 -9.304 828 H LEU 114 HN LEU 114 7.188 -0.578 -5.936 829 HA LEU 114 HA LEU 114 5.903 -2.811 -4.602 830 1HB LEU 114 HB2 LEU 114 5.090 -1.169 -2.804 831 2HB LEU 114 HB1 LEU 114 6.714 -1.813 -2.654 832 HG LEU 114 HG LEU 114 6.393 0.786 -4.044 833 1HD1 LEU 114 HD11 LEU 114 6.253 0.487 -1.044 834 2HD1 LEU 114 HD12 LEU 114 4.925 1.002 -2.085 835 3HD1 LEU 114 HD13 LEU 114 6.369 2.006 -1.934 836 1HD2 LEU 114 HD21 LEU 114 8.414 -0.278 -2.079 837 2HD2 LEU 114 HD22 LEU 114 8.516 1.254 -2.949 838 3HD2 LEU 114 HD23 LEU 114 8.583 -0.271 -3.835 839 H THR 115 HN THR 115 4.204 -3.050 -5.835 840 HA THR 115 HA THR 115 2.944 -0.665 -6.997 841 HB THR 115 HB THR 115 2.848 -3.504 -8.051 842 HG1 THR 115 HG1 THR 115 4.552 -3.015 -9.258 843 1HG2 THR 115 HG21 THR 115 0.914 -2.124 -8.675 844 2HG2 THR 115 HG22 THR 115 1.930 -2.480 -10.071 845 3HG2 THR 115 HG23 THR 115 2.003 -0.890 -9.311 846 H LEU 116 HN LEU 116 0.944 -0.241 -6.342 847 HA LEU 116 HA LEU 116 -0.359 -2.317 -4.731 848 1HB LEU 116 HB2 LEU 116 -0.393 0.673 -4.439 849 2HB LEU 116 HB1 LEU 116 -1.421 -0.401 -3.512 850 HG LEU 116 HG LEU 116 0.351 0.105 -2.075 851 1HD1 LEU 116 HD11 LEU 116 1.613 -1.953 -1.784 852 2HD1 LEU 116 HD12 LEU 116 1.092 -2.486 -3.384 853 3HD1 LEU 116 HD13 LEU 116 -0.096 -2.264 -2.098 854 1HD2 LEU 116 HD21 LEU 116 2.249 -0.351 -4.353 855 2HD2 LEU 116 HD22 LEU 116 2.716 -0.008 -2.688 856 3HD2 LEU 116 HD23 LEU 116 1.832 1.200 -3.622 857 H THR 117 HN THR 117 -1.943 -3.195 -5.781 858 HA THR 117 HA THR 117 -3.609 -1.586 -7.579 859 HB THR 117 HB THR 117 -3.732 -4.584 -7.145 860 HG1 THR 117 HG1 THR 117 -1.679 -3.323 -8.068 861 1HG2 THR 117 HG21 THR 117 -4.720 -4.564 -9.404 862 2HG2 THR 117 HG22 THR 117 -4.611 -2.803 -9.428 863 3HG2 THR 117 HG23 THR 117 -5.668 -3.606 -8.267 864 H GLY 118 HN GLY 118 -5.199 -0.585 -6.459 865 1HA GLY 118 HA2 GLY 118 -6.146 -1.813 -3.975 866 2HA GLY 118 HA1 GLY 118 -6.404 -0.147 -4.470 867 H GLY 119 HN GLY 119 -8.616 -0.502 -3.855 868 1HA GLY 119 HA2 GLY 119 -10.398 -0.423 -5.798 869 2HA GLY 119 HA1 GLY 119 -10.170 -2.166 -5.669 870 H TYR 120 HN TYR 120 -12.544 -1.952 -5.137 871 HA TYR 120 HA TYR 120 -12.865 -1.224 -2.331 872 1HB TYR 120 HB2 TYR 120 -15.261 -1.281 -2.659 873 2HB TYR 120 HB1 TYR 120 -14.520 -0.255 -3.873 874 HD1 TYR 120 HD1 TYR 120 -16.305 -3.388 -3.265 875 HD2 TYR 120 HD2 TYR 120 -14.580 -0.861 -6.235 876 HE1 TYR 120 HE1 TYR 120 -17.464 -4.664 -5.015 877 HE2 TYR 120 HE2 TYR 120 -15.745 -2.134 -7.990 878 HH TYR 120 HH TYR 120 -16.700 -4.461 -8.266 879 H TRP 121 HN TRP 121 -13.375 -2.589 -0.818 880 HA TRP 121 HA TRP 121 -13.005 -5.426 -1.374 881 1HB TRP 121 HB2 TRP 121 -11.668 -4.463 0.403 882 2HB TRP 121 HB1 TRP 121 -13.093 -3.771 1.166 883 HD1 TRP 121 HD1 TRP 121 -14.867 -5.634 2.164 884 HE1 TRP 121 HE1 TRP 121 -14.366 -7.838 3.385 885 HE3 TRP 121 HE3 TRP 121 -10.082 -6.336 0.592 886 HZ2 TRP 121 HZ2 TRP 121 -12.229 -9.634 3.616 887 HZ3 TRP 121 HZ3 TRP 121 -8.873 -8.333 1.384 888 HH2 TRP 121 HH2 TRP 121 -9.928 -9.943 2.851 889 H ALA 122 HN ALA 122 -14.606 -6.969 -0.965 890 HA ALA 122 HA ALA 122 -17.101 -6.052 0.183 891 1HB ALA 122 HB1 ALA 122 -17.356 -5.601 -2.207 892 2HB ALA 122 HB2 ALA 122 -18.474 -6.851 -1.663 893 3HB ALA 122 HB3 ALA 122 -17.022 -7.296 -2.558 894 H LYS 123 HN LYS 123 -15.629 -7.603 1.569 895 HA LYS 123 HA LYS 123 -17.216 -9.981 1.887 896 1HB LYS 123 HB2 LYS 123 -14.301 -10.172 1.131 897 2HB LYS 123 HB1 LYS 123 -15.057 -11.409 2.121 898 1HG LYS 123 HG2 LYS 123 -15.789 -10.644 -0.697 899 2HG LYS 123 HG1 LYS 123 -15.051 -12.151 -0.153 900 1HD LYS 123 HD2 LYS 123 -17.042 -12.781 1.019 901 2HD LYS 123 HD1 LYS 123 -17.776 -11.204 0.721 902 1HE LYS 123 HE2 LYS 123 -17.619 -11.724 -1.740 903 2HE LYS 123 HE1 LYS 123 -17.163 -13.365 -1.288 904 1HZ LYS 123 HZ1 LYS 123 -19.273 -13.519 -0.047 905 2HZ LYS 123 HZ2 LYS 123 -19.504 -13.284 -1.708 906 3HZ LYS 123 HZ3 LYS 123 -19.711 -11.991 -0.634 907 H ASP 124 HN ASP 124 -14.837 -11.038 3.565 908 HA ASP 124 HA ASP 124 -14.312 -8.888 5.383 909 1HB ASP 124 HB2 ASP 124 -15.165 -10.112 7.402 910 2HB ASP 124 HB1 ASP 124 -16.418 -9.511 6.325 911 H ASN 125 HN ASN 125 -12.283 -8.998 5.284 912 HA ASN 125 HA ASN 125 -10.136 -9.571 5.519 913 1HB ASN 125 HB2 ASN 125 -10.646 -9.977 7.796 914 2HB ASN 125 HB1 ASN 125 -11.275 -11.581 7.435 915 1HD2 ASN 125 HD21 ASN 125 -8.397 -9.618 7.658 916 2HD2 ASN 125 HD22 ASN 125 -7.274 -10.927 7.767 917 H LYS 126 HN LYS 126 -12.141 -12.411 4.878 918 HA LYS 126 HA LYS 126 -10.178 -14.240 4.359 919 1HB LYS 126 HB2 LYS 126 -11.837 -15.452 2.988 920 2HB LYS 126 HB1 LYS 126 -12.489 -14.896 4.523 921 1HG LYS 126 HG2 LYS 126 -13.702 -13.137 3.465 922 2HG LYS 126 HG1 LYS 126 -12.880 -13.419 1.930 923 1HD LYS 126 HD2 LYS 126 -15.081 -14.362 1.818 924 2HD LYS 126 HD1 LYS 126 -13.891 -15.663 1.831 925 1HE LYS 126 HE2 LYS 126 -14.291 -15.990 4.232 926 2HE LYS 126 HE1 LYS 126 -15.492 -14.698 4.205 927 1HZ LYS 126 HZ1 LYS 126 -16.582 -16.819 4.073 928 2HZ LYS 126 HZ2 LYS 126 -15.635 -17.279 2.742 929 3HZ LYS 126 HZ3 LYS 126 -16.761 -16.022 2.583 930 H GLN 127 HN GLN 127 -11.676 -12.090 2.019 931 HA GLN 127 HA GLN 127 -9.814 -11.300 0.384 932 1HB GLN 127 HB2 GLN 127 -8.873 -13.566 0.105 933 2HB GLN 127 HB1 GLN 127 -10.420 -14.124 -0.531 934 1HG GLN 127 HG2 GLN 127 -10.207 -12.723 -2.459 935 2HG GLN 127 HG1 GLN 127 -8.782 -11.931 -1.792 936 1HE2 GLN 127 HE21 GLN 127 -7.606 -14.396 -0.803 937 2HE2 GLN 127 HE22 GLN 127 -7.024 -15.243 -2.196 938 H GLY 128 HN GLY 128 -11.556 -9.905 0.213 939 1HA GLY 128 HA2 GLY 128 -13.181 -10.596 -2.127 940 2HA GLY 128 HA1 GLY 128 -13.978 -9.917 -0.712 941 H PHE 129 HN PHE 129 -11.838 -9.286 -3.383 942 HA PHE 129 HA PHE 129 -12.339 -6.429 -2.995 943 1HB PHE 129 HB2 PHE 129 -9.988 -5.850 -3.319 944 2HB PHE 129 HB1 PHE 129 -10.168 -6.886 -1.907 945 HD1 PHE 129 HD1 PHE 129 -9.493 -9.284 -2.048 946 HD2 PHE 129 HD2 PHE 129 -8.679 -6.514 -5.178 947 HE1 PHE 129 HE1 PHE 129 -7.797 -10.816 -2.958 948 HE2 PHE 129 HE2 PHE 129 -6.990 -8.047 -6.097 949 HZ PHE 129 HZ PHE 129 -6.546 -10.198 -4.987 950 H THR 130 HN THR 130 -11.646 -5.197 -5.022 951 HA THR 130 HA THR 130 -10.980 -6.784 -7.334 952 HB THR 130 HB THR 130 -13.350 -7.098 -7.449 953 HG1 THR 130 HG1 THR 130 -12.901 -4.945 -9.240 954 1HG2 THR 130 HG21 THR 130 -13.609 -4.111 -7.176 955 2HG2 THR 130 HG22 THR 130 -14.060 -5.313 -5.967 956 3HG2 THR 130 HG23 THR 130 -14.934 -5.230 -7.497 957 HA PRO 131 HA PRO 131 -8.740 -3.020 -8.070 958 1HB PRO 131 HB2 PRO 131 -8.398 -4.124 -10.785 959 2HB PRO 131 HB1 PRO 131 -7.172 -3.695 -9.587 960 1HG PRO 131 HG2 PRO 131 -7.718 -6.252 -10.172 961 2HG PRO 131 HG1 PRO 131 -7.304 -5.744 -8.524 962 1HD PRO 131 HD2 PRO 131 -9.985 -6.371 -9.698 963 2HD PRO 131 HD1 PRO 131 -9.329 -6.781 -8.099 964 H SER 132 HN SER 132 -9.998 -1.264 -8.312 965 HA SER 132 HA SER 132 -11.445 -0.958 -10.842 966 1HB SER 132 HB2 SER 132 -13.039 -1.566 -9.044 967 2HB SER 132 HB1 SER 132 -12.510 -0.155 -8.137 968 HG SER 132 HG SER 132 -14.010 0.854 -9.205 969 H GLY 133 HN GLY 133 -9.846 0.379 -11.672 970 1HA GLY 133 HA2 GLY 133 -9.297 2.592 -12.218 971 2HA GLY 133 HA1 GLY 133 -9.992 3.115 -10.699 972 H THR 134 HN THR 134 -8.037 0.566 -9.970 973 HA THR 134 HA THR 134 -6.175 2.457 -8.784 974 HB THR 134 HB THR 134 -5.732 0.424 -7.301 975 HG1 THR 134 HG1 THR 134 -7.293 -1.222 -7.450 976 1HG2 THR 134 HG21 THR 134 -7.120 2.296 -6.575 977 2HG2 THR 134 HG22 THR 134 -7.813 0.768 -6.026 978 3HG2 THR 134 HG23 THR 134 -8.511 1.606 -7.413 979 H THR 135 HN THR 135 -4.322 2.663 -9.982 980 HA THR 135 HA THR 135 -2.719 0.224 -9.954 981 HB THR 135 HB THR 135 -2.679 2.161 -12.288 982 HG1 THR 135 HG1 THR 135 -4.200 -0.014 -11.779 983 1HG2 THR 135 HG21 THR 135 -0.474 1.198 -11.787 984 2HG2 THR 135 HG22 THR 135 -1.120 0.563 -13.301 985 3HG2 THR 135 HG23 THR 135 -1.170 -0.422 -11.839 986 H GLY 136 HN GLY 136 -1.582 0.876 -8.167 987 1HA GLY 136 HA2 GLY 136 -0.336 3.543 -8.299 988 2HA GLY 136 HA1 GLY 136 -0.719 2.686 -6.812 989 H THR 137 HN THR 137 1.433 2.798 -9.578 990 HA THR 137 HA THR 137 3.207 0.827 -8.449 991 HB THR 137 HB THR 137 3.862 2.742 -10.689 992 HG1 THR 137 HG1 THR 137 2.688 1.537 -12.027 993 1HG2 THR 137 HG21 THR 137 5.346 0.926 -11.415 994 2HG2 THR 137 HG22 THR 137 4.829 -0.049 -10.040 995 3HG2 THR 137 HG23 THR 137 5.731 1.442 -9.774 996 H THR 138 HN THR 138 3.893 1.580 -6.474 997 HA THR 138 HA THR 138 5.062 4.244 -6.310 998 HB THR 138 HB THR 138 4.888 2.129 -4.150 999 HG1 THR 138 HG1 THR 138 2.803 2.748 -4.852 1000 1HG2 THR 138 HG21 THR 138 5.211 4.002 -2.617 1001 2HG2 THR 138 HG22 THR 138 5.309 5.118 -3.978 1002 3HG2 THR 138 HG23 THR 138 6.560 3.896 -3.749 1003 H LYS 139 HN LYS 139 7.048 4.408 -7.134 1004 HA LYS 139 HA LYS 139 8.886 2.143 -6.796 1005 1HB LYS 139 HB2 LYS 139 8.303 3.141 -9.103 1006 2HB LYS 139 HB1 LYS 139 9.309 4.498 -8.625 1007 1HG LYS 139 HG2 LYS 139 11.247 3.181 -8.555 1008 2HG LYS 139 HG1 LYS 139 10.324 1.676 -8.566 1009 1HD LYS 139 HD2 LYS 139 10.514 3.652 -10.847 1010 2HD LYS 139 HD1 LYS 139 11.359 2.104 -10.745 1011 1HE LYS 139 HE2 LYS 139 9.158 0.969 -10.624 1012 2HE LYS 139 HE1 LYS 139 8.374 2.529 -10.859 1013 1HZ LYS 139 HZ1 LYS 139 10.147 1.116 -12.776 1014 2HZ LYS 139 HZ2 LYS 139 9.585 2.701 -12.995 1015 3HZ LYS 139 HZ3 LYS 139 8.484 1.415 -12.942 1016 H LEU 140 HN LEU 140 10.045 2.280 -5.124 1017 HA LEU 140 HA LEU 140 10.891 4.900 -4.121 1018 1HB LEU 140 HB2 LEU 140 9.615 3.790 -2.483 1019 2HB LEU 140 HB1 LEU 140 10.358 2.241 -2.817 1020 HG LEU 140 HG LEU 140 12.447 3.046 -1.824 1021 1HD1 LEU 140 HD11 LEU 140 12.440 5.127 -0.512 1022 2HD1 LEU 140 HD12 LEU 140 10.835 5.504 -1.139 1023 3HD1 LEU 140 HD13 LEU 140 12.216 5.429 -2.235 1024 1HD2 LEU 140 HD21 LEU 140 10.880 1.804 -0.465 1025 2HD2 LEU 140 HD22 LEU 140 10.017 3.288 -0.060 1026 3HD2 LEU 140 HD23 LEU 140 11.669 3.047 0.507 1027 H THR 141 HN THR 141 12.822 5.360 -4.936 1028 HA THR 141 HA THR 141 14.822 3.197 -5.137 1029 HB THR 141 HB THR 141 14.749 5.704 -6.820 1030 HG1 THR 141 HG1 THR 141 13.696 3.118 -7.461 1031 1HG2 THR 141 HG21 THR 141 16.901 4.575 -6.727 1032 2HG2 THR 141 HG22 THR 141 16.179 4.372 -8.322 1033 3HG2 THR 141 HG23 THR 141 16.144 3.046 -7.161 1034 H VAL 142 HN VAL 142 16.778 3.536 -4.154 1035 HA VAL 142 HA VAL 142 17.280 6.140 -2.918 1036 HB VAL 142 HB VAL 142 19.037 3.688 -2.860 1037 1HG1 VAL 142 HG11 VAL 142 19.020 6.151 -1.133 1038 2HG1 VAL 142 HG12 VAL 142 20.219 5.749 -2.361 1039 3HG1 VAL 142 HG13 VAL 142 20.070 4.752 -0.914 1040 1HG2 VAL 142 HG21 VAL 142 16.895 3.146 -1.861 1041 2HG2 VAL 142 HG22 VAL 142 16.999 4.578 -0.835 1042 3HG2 VAL 142 HG23 VAL 142 18.145 3.255 -0.622 1043 H THR 143 HN THR 143 18.139 7.634 -4.196 1044 HA THR 143 HA THR 143 19.508 8.700 -5.658 1045 HB THR 143 HB THR 143 21.009 6.098 -6.008 1046 HG1 THR 143 HG1 THR 143 21.830 6.439 -4.096 1047 1HG2 THR 143 HG21 THR 143 22.879 7.603 -6.609 1048 2HG2 THR 143 HG22 THR 143 21.779 8.978 -6.497 1049 3HG2 THR 143 HG23 THR 143 21.518 7.735 -7.722 Start of MODEL 6 1 H GLU 1 H GLU 1 -20.758 2.072 -6.626 2 HA GLU 1 HA GLU 1 -21.096 -0.108 -4.649 3 1HB GLU 1 HB2 GLU 1 -22.733 0.347 -6.717 4 2HB GLU 1 HB1 GLU 1 -21.444 -0.462 -7.594 5 1HG GLU 1 HG2 GLU 1 -22.973 -1.588 -5.258 6 2HG GLU 1 HG1 GLU 1 -23.203 -2.008 -6.953 7 H GLU 2 HN GLU 2 -19.707 0.616 -7.851 8 HA GLU 2 HA GLU 2 -17.384 -1.026 -7.219 9 1HB GLU 2 HB2 GLU 2 -18.490 -1.233 -9.423 10 2HB GLU 2 HB1 GLU 2 -18.118 0.452 -9.747 11 1HG GLU 2 HG2 GLU 2 -15.781 0.009 -9.798 12 2HG GLU 2 HG1 GLU 2 -16.027 -1.644 -9.236 13 H CYS 3 HN CYS 3 -15.702 -0.123 -6.278 14 HA CYS 3 HA CYS 3 -15.498 2.776 -6.202 15 1HB CYS 3 HB2 CYS 3 -14.350 0.548 -4.563 16 2HB CYS 3 HB1 CYS 3 -13.605 2.141 -4.520 17 H GLN 4 HN GLN 4 -14.408 3.669 -7.828 18 HA GLN 4 HA GLN 4 -12.063 2.363 -8.930 19 1HB GLN 4 HB2 GLN 4 -13.594 3.574 -10.439 20 2HB GLN 4 HB1 GLN 4 -13.286 5.063 -9.552 21 1HG GLN 4 HG2 GLN 4 -10.897 4.862 -10.154 22 2HG GLN 4 HG1 GLN 4 -11.304 3.475 -11.159 23 1HE2 GLN 4 HE21 GLN 4 -12.511 3.798 -13.040 24 2HE2 GLN 4 HE22 GLN 4 -12.625 5.355 -13.786 25 H VAL 5 HN VAL 5 -10.255 2.490 -7.769 26 HA VAL 5 HA VAL 5 -9.791 4.692 -5.973 27 HB VAL 5 HB VAL 5 -7.692 3.576 -5.402 28 1HG1 VAL 5 HG11 VAL 5 -9.751 2.850 -4.307 29 2HG1 VAL 5 HG12 VAL 5 -8.617 1.510 -4.490 30 3HG1 VAL 5 HG13 VAL 5 -10.004 1.645 -5.573 31 1HG2 VAL 5 HG21 VAL 5 -7.091 1.426 -6.433 32 2HG2 VAL 5 HG22 VAL 5 -7.059 2.748 -7.600 33 3HG2 VAL 5 HG23 VAL 5 -8.413 1.619 -7.585 34 H ARG 6 HN ARG 6 -8.501 6.416 -6.274 35 HA ARG 6 HA ARG 6 -7.222 6.688 -8.886 36 1HB ARG 6 HB2 ARG 6 -7.734 8.714 -6.706 37 2HB ARG 6 HB1 ARG 6 -6.876 9.065 -8.200 38 1HG ARG 6 HG2 ARG 6 -9.725 8.095 -8.045 39 2HG ARG 6 HG1 ARG 6 -9.239 9.781 -8.220 40 1HD ARG 6 HD2 ARG 6 -9.784 8.983 -10.390 41 2HD ARG 6 HD1 ARG 6 -8.029 9.118 -10.316 42 HE ARG 6 HE ARG 6 -8.986 6.497 -9.659 43 1HH1 ARG 6 HH11 ARG 6 -8.111 8.636 -12.289 44 2HH1 ARG 6 HH12 ARG 6 -7.780 7.337 -13.398 45 1HH2 ARG 6 HH21 ARG 6 -8.520 4.795 -11.111 46 2HH2 ARG 6 HH22 ARG 6 -8.008 5.163 -12.733 47 H VAL 7 HN VAL 7 -5.420 5.481 -8.738 48 HA VAL 7 HA VAL 7 -3.432 6.355 -6.756 49 HB VAL 7 HB VAL 7 -4.123 3.960 -6.530 50 1HG1 VAL 7 HG11 VAL 7 -4.577 3.453 -8.853 51 2HG1 VAL 7 HG12 VAL 7 -3.378 2.339 -8.197 52 3HG1 VAL 7 HG13 VAL 7 -2.871 3.661 -9.249 53 1HG2 VAL 7 HG21 VAL 7 -1.939 4.671 -5.749 54 2HG2 VAL 7 HG22 VAL 7 -1.264 4.429 -7.360 55 3HG2 VAL 7 HG23 VAL 7 -1.844 3.047 -6.431 56 H GLY 8 HN GLY 8 -1.419 6.934 -7.519 57 1HA GLY 8 HA2 GLY 8 -1.152 6.979 -10.452 58 2HA GLY 8 HA1 GLY 8 -0.768 8.380 -9.459 59 H ASP 9 HN ASP 9 0.741 6.364 -11.269 60 HA ASP 9 HA ASP 9 2.711 5.160 -9.623 61 1HB ASP 9 HB2 ASP 9 2.898 6.008 -12.522 62 2HB ASP 9 HB1 ASP 9 4.015 4.925 -11.701 63 H LEU 10 HN LEU 10 3.908 6.349 -8.289 64 HA LEU 10 HA LEU 10 5.000 8.874 -9.311 65 1HB LEU 10 HB2 LEU 10 5.046 9.652 -6.950 66 2HB LEU 10 HB1 LEU 10 3.441 9.393 -7.597 67 HG LEU 10 HG LEU 10 3.657 7.059 -6.412 68 1HD1 LEU 10 HD11 LEU 10 4.929 7.165 -4.341 69 2HD1 LEU 10 HD12 LEU 10 5.562 8.746 -4.797 70 3HD1 LEU 10 HD13 LEU 10 5.989 7.319 -5.743 71 1HD2 LEU 10 HD21 LEU 10 2.000 8.780 -5.905 72 2HD2 LEU 10 HD22 LEU 10 3.174 9.620 -4.893 73 3HD2 LEU 10 HD23 LEU 10 2.603 8.015 -4.437 74 H THR 11 HN THR 11 7.107 9.465 -8.664 75 HA THR 11 HA THR 11 8.760 7.167 -7.831 76 HB THR 11 HB THR 11 9.595 9.355 -9.749 77 HG1 THR 11 HG1 THR 11 7.959 7.932 -10.622 78 1HG2 THR 11 HG21 THR 11 11.438 8.301 -8.511 79 2HG2 THR 11 HG22 THR 11 11.489 7.880 -10.222 80 3HG2 THR 11 HG23 THR 11 10.885 6.714 -9.045 81 H VAL 12 HN VAL 12 9.877 7.501 -6.024 82 HA VAL 12 HA VAL 12 10.546 10.268 -5.250 83 HB VAL 12 HB VAL 12 9.620 8.133 -3.319 84 1HG1 VAL 12 HG11 VAL 12 11.156 9.696 -2.313 85 2HG1 VAL 12 HG12 VAL 12 9.524 9.982 -1.706 86 3HG1 VAL 12 HG13 VAL 12 10.212 11.057 -2.921 87 1HG2 VAL 12 HG21 VAL 12 8.105 10.545 -4.311 88 2HG2 VAL 12 HG22 VAL 12 7.562 9.417 -3.069 89 3HG2 VAL 12 HG23 VAL 12 7.762 8.869 -4.734 90 H ALA 13 HN ALA 13 12.597 10.555 -4.570 91 HA ALA 13 HA ALA 13 14.256 8.158 -4.219 92 1HB ALA 13 HB1 ALA 13 16.172 9.598 -4.630 93 2HB ALA 13 HB2 ALA 13 15.116 11.010 -4.708 94 3HB ALA 13 HB3 ALA 13 14.995 9.748 -5.934 95 H LYS 14 HN LYS 14 13.962 7.586 -2.120 96 HA LYS 14 HA LYS 14 14.995 9.401 -0.080 97 1HB LYS 14 HB2 LYS 14 12.277 8.075 0.074 98 2HB LYS 14 HB1 LYS 14 13.099 8.772 1.458 99 1HG LYS 14 HG2 LYS 14 12.360 10.337 -1.001 100 2HG LYS 14 HG1 LYS 14 11.336 10.207 0.429 101 1HD LYS 14 HD2 LYS 14 13.134 11.182 1.789 102 2HD LYS 14 HD1 LYS 14 14.133 11.335 0.340 103 1HE LYS 14 HE2 LYS 14 13.094 13.461 0.830 104 2HE LYS 14 HE1 LYS 14 12.414 12.797 -0.656 105 1HZ LYS 14 HZ1 LYS 14 11.120 12.581 2.015 106 2HZ LYS 14 HZ2 LYS 14 10.459 12.117 0.524 107 3HZ LYS 14 HZ3 LYS 14 10.732 13.757 0.855 108 H THR 15 HN THR 15 15.427 8.258 1.968 109 HA THR 15 HA THR 15 16.316 5.530 1.452 110 HB THR 15 HB THR 15 17.382 5.762 3.728 111 HG1 THR 15 HG1 THR 15 17.359 8.439 3.853 112 1HG2 THR 15 HG21 THR 15 18.646 6.185 1.680 113 2HG2 THR 15 HG22 THR 15 19.150 7.278 2.969 114 3HG2 THR 15 HG23 THR 15 18.097 7.861 1.681 115 H ARG 16 HN ARG 16 15.708 3.751 2.769 116 HA ARG 16 HA ARG 16 13.037 3.973 3.866 117 1HB ARG 16 HB2 ARG 16 14.882 1.580 3.670 118 2HB ARG 16 HB1 ARG 16 13.226 1.519 4.270 119 1HG ARG 16 HG2 ARG 16 12.620 1.081 2.182 120 2HG ARG 16 HG1 ARG 16 12.981 2.768 1.823 121 1HD ARG 16 HD2 ARG 16 14.190 1.622 0.214 122 2HD ARG 16 HD1 ARG 16 15.394 1.944 1.458 123 HE ARG 16 HE ARG 16 14.106 -0.652 0.931 124 1HH1 ARG 16 HH11 ARG 16 16.679 1.246 2.362 125 2HH1 ARG 16 HH12 ARG 16 17.659 -0.135 2.741 126 1HH2 ARG 16 HH21 ARG 16 15.380 -2.495 1.516 127 2HH2 ARG 16 HH22 ARG 16 16.915 -2.247 2.277 128 H GLY 17 HN GLY 17 15.995 4.676 5.006 129 1HA GLY 17 HA2 GLY 17 15.615 3.800 7.744 130 2HA GLY 17 HA1 GLY 17 16.910 4.829 7.141 131 H GLN 18 HN GLN 18 14.917 6.529 5.748 132 HA GLN 18 HA GLN 18 14.338 8.502 7.621 133 1HB GLN 18 HB2 GLN 18 14.314 8.940 5.237 134 2HB GLN 18 HB1 GLN 18 13.004 7.797 4.994 135 1HG GLN 18 HG2 GLN 18 12.270 10.125 4.857 136 2HG GLN 18 HG1 GLN 18 11.470 9.240 6.152 137 1HE2 GLN 18 HE21 GLN 18 10.940 11.193 7.152 138 2HE2 GLN 18 HE22 GLN 18 12.112 12.098 8.054 139 H LEU 19 HN LEU 19 12.671 5.616 6.711 140 HA LEU 19 HA LEU 19 10.325 6.251 8.292 141 1HB LEU 19 HB2 LEU 19 10.872 3.574 7.075 142 2HB LEU 19 HB1 LEU 19 9.334 4.369 7.353 143 HG LEU 19 HG LEU 19 11.339 5.095 5.217 144 1HD1 LEU 19 HD11 LEU 19 9.641 4.257 3.674 145 2HD1 LEU 19 HD12 LEU 19 8.631 3.782 5.040 146 3HD1 LEU 19 HD13 LEU 19 10.185 2.995 4.779 147 1HD2 LEU 19 HD21 LEU 19 8.622 6.235 5.849 148 2HD2 LEU 19 HD22 LEU 19 9.565 6.598 4.404 149 3HD2 LEU 19 HD23 LEU 19 10.172 7.064 5.992 150 H THR 20 HN THR 20 10.529 6.022 10.413 151 HA THR 20 HA THR 20 12.091 3.771 11.466 152 HB THR 20 HB THR 20 11.197 6.215 13.014 153 HG1 THR 20 HG1 THR 20 12.907 6.229 11.067 154 1HG2 THR 20 HG21 THR 20 13.358 4.166 13.531 155 2HG2 THR 20 HG22 THR 20 11.792 4.229 14.339 156 3HG2 THR 20 HG23 THR 20 12.955 5.535 14.568 157 H ASP 21 HN ASP 21 10.332 2.425 10.930 158 HA ASP 21 HA ASP 21 8.398 1.311 11.151 159 1HB ASP 21 HB2 ASP 21 9.066 1.079 13.528 160 2HB ASP 21 HB1 ASP 21 8.191 2.565 13.896 161 H ALA 22 HN ALA 22 7.088 3.824 13.230 162 HA ALA 22 HA ALA 22 5.054 4.320 11.236 163 1HB ALA 22 HB1 ALA 22 5.352 5.537 13.980 164 2HB ALA 22 HB2 ALA 22 4.449 4.069 13.607 165 3HB ALA 22 HB3 ALA 22 3.929 5.615 12.941 166 H ALA 23 HN ALA 23 6.696 5.182 9.757 167 HA ALA 23 HA ALA 23 6.466 8.074 9.772 168 1HB ALA 23 HB1 ALA 23 8.653 7.718 10.847 169 2HB ALA 23 HB2 ALA 23 8.823 8.464 9.256 170 3HB ALA 23 HB3 ALA 23 9.168 6.747 9.467 171 HA PRO 24 HA PRO 24 5.763 6.646 5.590 172 1HB PRO 24 HB2 PRO 24 4.282 8.679 4.764 173 2HB PRO 24 HB1 PRO 24 3.683 7.597 6.031 174 1HG PRO 24 HG2 PRO 24 4.897 10.323 6.296 175 2HG PRO 24 HG1 PRO 24 3.495 9.638 7.138 176 1HD PRO 24 HD2 PRO 24 6.076 9.755 8.170 177 2HD PRO 24 HD1 PRO 24 4.800 8.664 8.732 178 H ILE 25 HN ILE 25 6.570 7.025 3.573 179 HA ILE 25 HA ILE 25 8.500 9.205 3.264 180 HB ILE 25 HB ILE 25 8.566 7.721 0.925 181 1HG1 ILE 25 HG12 ILE 25 8.371 5.837 3.269 182 2HG1 ILE 25 HG11 ILE 25 7.099 6.058 2.085 183 1HG2 ILE 25 HG21 ILE 25 10.278 7.442 3.390 184 2HG2 ILE 25 HG22 ILE 25 10.482 8.635 2.108 185 3HG2 ILE 25 HG23 ILE 25 10.720 6.922 1.764 186 1HD1 ILE 25 HD11 ILE 25 9.874 5.035 1.515 187 2HD1 ILE 25 HD12 ILE 25 8.585 5.243 0.326 188 3HD1 ILE 25 HD13 ILE 25 8.408 4.059 1.624 189 H GLY 26 HN GLY 26 6.101 7.609 1.168 190 1HA GLY 26 HA2 GLY 26 5.511 10.267 0.038 191 2HA GLY 26 HA1 GLY 26 5.605 8.810 -0.943 192 HA PRO 27 HA PRO 27 1.377 8.815 1.753 193 1HB PRO 27 HB2 PRO 27 0.811 11.585 1.877 194 2HB PRO 27 HB1 PRO 27 1.140 10.509 3.237 195 1HG PRO 27 HG2 PRO 27 2.984 12.348 1.785 196 2HG PRO 27 HG1 PRO 27 2.953 11.908 3.505 197 1HD PRO 27 HD2 PRO 27 4.809 10.870 1.898 198 2HD PRO 27 HD1 PRO 27 4.011 9.863 3.124 199 H VAL 28 HN VAL 28 0.320 8.146 0.022 200 HA VAL 28 HA VAL 28 0.197 9.709 -2.420 201 HB VAL 28 HB VAL 28 -1.140 7.064 -1.798 202 1HG1 VAL 28 HG11 VAL 28 -0.448 8.377 -4.427 203 2HG1 VAL 28 HG12 VAL 28 -2.064 8.199 -3.742 204 3HG1 VAL 28 HG13 VAL 28 -1.151 6.772 -4.233 205 1HG2 VAL 28 HG21 VAL 28 1.558 7.552 -3.060 206 2HG2 VAL 28 HG22 VAL 28 0.760 5.988 -2.901 207 3HG2 VAL 28 HG23 VAL 28 1.270 6.869 -1.460 208 H THR 29 HN THR 29 -1.511 10.904 -3.057 209 HA THR 29 HA THR 29 -3.759 11.241 -1.299 210 HB THR 29 HB THR 29 -4.608 12.764 -3.120 211 HG1 THR 29 HG1 THR 29 -3.406 11.647 -4.823 212 1HG2 THR 29 HG21 THR 29 -2.882 14.486 -2.751 213 2HG2 THR 29 HG22 THR 29 -1.804 13.251 -2.103 214 3HG2 THR 29 HG23 THR 29 -3.305 13.641 -1.263 215 H VAL 30 HN VAL 30 -4.527 9.037 -1.315 216 HA VAL 30 HA VAL 30 -5.554 7.937 -3.786 217 HB VAL 30 HB VAL 30 -5.958 6.915 -0.977 218 1HG1 VAL 30 HG11 VAL 30 -6.211 5.537 -3.649 219 2HG1 VAL 30 HG12 VAL 30 -7.539 6.006 -2.585 220 3HG1 VAL 30 HG13 VAL 30 -6.393 4.767 -2.072 221 1HG2 VAL 30 HG21 VAL 30 -3.816 6.193 -2.979 222 2HG2 VAL 30 HG22 VAL 30 -4.093 5.381 -1.438 223 3HG2 VAL 30 HG23 VAL 30 -3.576 7.066 -1.467 224 H GLN 31 HN GLN 31 -7.358 8.615 -4.572 225 HA GLN 31 HA GLN 31 -9.542 9.439 -2.802 226 1HB GLN 31 HB2 GLN 31 -8.801 11.240 -4.217 227 2HB GLN 31 HB1 GLN 31 -8.881 10.219 -5.644 228 1HG GLN 31 HG2 GLN 31 -11.294 10.127 -5.482 229 2HG GLN 31 HG1 GLN 31 -11.248 11.068 -3.991 230 1HE2 GLN 31 HE21 GLN 31 -9.075 11.758 -6.605 231 2HE2 GLN 31 HE22 GLN 31 -9.812 13.250 -7.092 232 H ALA 32 HN ALA 32 -11.460 8.425 -2.932 233 HA ALA 32 HA ALA 32 -11.622 6.115 -4.739 234 1HB ALA 32 HB1 ALA 32 -11.709 5.594 -2.350 235 2HB ALA 32 HB2 ALA 32 -13.229 5.191 -3.149 236 3HB ALA 32 HB3 ALA 32 -13.108 6.652 -2.169 237 H LEU 33 HN LEU 33 -13.016 6.181 -6.368 238 HA LEU 33 HA LEU 33 -15.145 8.214 -6.288 239 1HB LEU 33 HB2 LEU 33 -13.789 6.983 -8.688 240 2HB LEU 33 HB1 LEU 33 -15.034 8.214 -8.736 241 HG LEU 33 HG LEU 33 -12.268 8.569 -7.576 242 1HD1 LEU 33 HD11 LEU 33 -13.500 9.633 -10.112 243 2HD1 LEU 33 HD12 LEU 33 -12.258 8.388 -10.006 244 3HD1 LEU 33 HD13 LEU 33 -11.900 10.035 -9.491 245 1HD2 LEU 33 HD21 LEU 33 -14.504 10.555 -7.970 246 2HD2 LEU 33 HD22 LEU 33 -12.873 10.934 -7.419 247 3HD2 LEU 33 HD23 LEU 33 -13.930 9.934 -6.423 248 H GLY 34 HN GLY 34 -17.151 7.484 -6.156 249 1HA GLY 34 HA2 GLY 34 -18.984 6.226 -7.004 250 2HA GLY 34 HA1 GLY 34 -17.854 4.982 -7.523 251 H CYS 35 HN CYS 35 -17.739 6.459 -4.369 252 HA CYS 35 HA CYS 35 -18.562 3.874 -3.219 253 1HB CYS 35 HB2 CYS 35 -16.525 5.753 -2.030 254 2HB CYS 35 HB1 CYS 35 -16.889 4.106 -1.527 255 H ASN 36 HN ASN 36 -20.674 4.521 -2.784 256 HA ASN 36 HA ASN 36 -20.993 6.738 -0.890 257 1HB ASN 36 HB2 ASN 36 -23.102 5.019 -2.224 258 2HB ASN 36 HB1 ASN 36 -23.412 6.426 -1.212 259 1HD2 ASN 36 HD21 ASN 36 -22.968 8.492 -2.025 260 2HD2 ASN 36 HD22 ASN 36 -22.758 8.770 -3.720 261 H ALA 37 HN ALA 37 -20.789 3.331 -1.077 262 HA ALA 37 HA ALA 37 -20.689 3.079 1.754 263 1HB ALA 37 HB1 ALA 37 -22.570 1.591 2.097 264 2HB ALA 37 HB2 ALA 37 -23.035 1.749 0.402 265 3HB ALA 37 HB3 ALA 37 -23.131 3.143 1.478 266 H ARG 38 HN ARG 38 -18.609 2.370 0.625 267 HA ARG 38 HA ARG 38 -18.637 -0.534 0.625 268 1HB ARG 38 HB2 ARG 38 -18.832 0.585 -1.787 269 2HB ARG 38 HB1 ARG 38 -17.094 0.752 -1.575 270 1HG ARG 38 HG2 ARG 38 -17.606 -1.279 -2.786 271 2HG ARG 38 HG1 ARG 38 -16.919 -1.668 -1.206 272 1HD ARG 38 HD2 ARG 38 -19.148 -2.076 -0.321 273 2HD ARG 38 HD1 ARG 38 -19.860 -1.642 -1.874 274 HE ARG 38 HE ARG 38 -18.528 -3.620 -2.750 275 1HH1 ARG 38 HH11 ARG 38 -19.736 -3.400 0.524 276 2HH1 ARG 38 HH12 ARG 38 -19.933 -5.119 0.709 277 1HH2 ARG 38 HH21 ARG 38 -18.807 -5.899 -2.529 278 2HH2 ARG 38 HH22 ARG 38 -19.413 -6.533 -1.031 279 H GLN 39 HN GLN 39 -16.664 -1.421 1.312 280 HA GLN 39 HA GLN 39 -14.777 0.405 2.480 281 1HB GLN 39 HB2 GLN 39 -14.418 -2.580 2.137 282 2HB GLN 39 HB1 GLN 39 -13.599 -1.531 3.284 283 1HG GLN 39 HG2 GLN 39 -15.124 -2.519 4.653 284 2HG GLN 39 HG1 GLN 39 -16.035 -1.095 4.151 285 1HE2 GLN 39 HE21 GLN 39 -15.695 -4.526 3.862 286 2HE2 GLN 39 HE22 GLN 39 -17.211 -4.826 3.084 287 H VAL 40 HN VAL 40 -12.907 1.093 1.626 288 HA VAL 40 HA VAL 40 -12.163 0.113 -1.040 289 HB VAL 40 HB VAL 40 -11.415 2.689 0.365 290 1HG1 VAL 40 HG11 VAL 40 -9.588 1.907 -1.054 291 2HG1 VAL 40 HG12 VAL 40 -10.355 3.337 -1.746 292 3HG1 VAL 40 HG13 VAL 40 -10.703 1.741 -2.411 293 1HG2 VAL 40 HG21 VAL 40 -13.190 2.170 -2.016 294 2HG2 VAL 40 HG22 VAL 40 -12.749 3.759 -1.393 295 3HG2 VAL 40 HG23 VAL 40 -13.719 2.664 -0.407 296 H ALA 41 HN ALA 41 -10.423 -1.170 -1.170 297 HA ALA 41 HA ALA 41 -8.632 -1.239 1.149 298 1HB ALA 41 HB1 ALA 41 -8.313 -3.593 0.747 299 2HB ALA 41 HB2 ALA 41 -9.305 -3.512 -0.706 300 3HB ALA 41 HB3 ALA 41 -10.037 -3.249 0.874 301 H LEU 42 HN LEU 42 -6.475 -1.260 0.844 302 HA LEU 42 HA LEU 42 -5.530 -0.847 -1.898 303 1HB LEU 42 HB2 LEU 42 -4.074 -0.382 0.706 304 2HB LEU 42 HB1 LEU 42 -3.516 0.068 -0.892 305 HG LEU 42 HG LEU 42 -5.918 1.226 0.512 306 1HD1 LEU 42 HD11 LEU 42 -3.226 2.435 -0.094 307 2HD1 LEU 42 HD12 LEU 42 -3.792 1.926 1.496 308 3HD1 LEU 42 HD13 LEU 42 -4.592 3.257 0.662 309 1HD2 LEU 42 HD21 LEU 42 -6.235 1.173 -1.895 310 2HD2 LEU 42 HD22 LEU 42 -4.656 1.921 -2.136 311 3HD2 LEU 42 HD23 LEU 42 -5.949 2.826 -1.349 312 H LYS 43 HN LYS 43 -4.781 -2.547 -2.880 313 HA LYS 43 HA LYS 43 -3.479 -4.681 -1.323 314 1HB LYS 43 HB2 LYS 43 -5.132 -4.738 -3.831 315 2HB LYS 43 HB1 LYS 43 -3.934 -5.986 -3.550 316 1HG LYS 43 HG2 LYS 43 -6.078 -6.790 -2.867 317 2HG LYS 43 HG1 LYS 43 -5.077 -6.557 -1.438 318 1HD LYS 43 HD2 LYS 43 -7.439 -5.804 -1.189 319 2HD LYS 43 HD1 LYS 43 -6.233 -4.560 -0.860 320 1HE LYS 43 HE2 LYS 43 -8.137 -3.732 -2.178 321 2HE LYS 43 HE1 LYS 43 -6.601 -3.570 -3.020 322 1HZ LYS 43 HZ1 LYS 43 -8.644 -5.669 -3.495 323 2HZ LYS 43 HZ2 LYS 43 -7.154 -5.565 -4.287 324 3HZ LYS 43 HZ3 LYS 43 -8.313 -4.353 -4.504 325 H ALA 44 HN ALA 44 -1.523 -5.526 -2.155 326 HA ALA 44 HA ALA 44 -0.181 -3.825 -4.106 327 1HB ALA 44 HB1 ALA 44 1.065 -4.483 -2.102 328 2HB ALA 44 HB2 ALA 44 1.824 -5.110 -3.565 329 3HB ALA 44 HB3 ALA 44 0.869 -6.180 -2.538 330 H ASP 45 HN ASP 45 0.759 -4.721 -6.030 331 HA ASP 45 HA ASP 45 -0.857 -6.775 -7.233 332 1HB ASP 45 HB2 ASP 45 0.173 -4.776 -8.452 333 2HB ASP 45 HB1 ASP 45 1.709 -5.636 -8.354 334 H THR 46 HN THR 46 0.248 -8.753 -8.253 335 HA THR 46 HA THR 46 1.045 -10.280 -6.078 336 HB THR 46 HB THR 46 1.705 -11.892 -8.047 337 HG1 THR 46 HG1 THR 46 0.104 -11.186 -9.796 338 1HG2 THR 46 HG21 THR 46 -0.650 -12.573 -8.164 339 2HG2 THR 46 HG22 THR 46 -1.118 -11.044 -7.419 340 3HG2 THR 46 HG23 THR 46 -0.163 -12.215 -6.507 341 H ASP 47 HN ASP 47 3.021 -8.449 -8.256 342 HA ASP 47 HA ASP 47 5.467 -9.831 -7.832 343 1HB ASP 47 HB2 ASP 47 4.891 -6.965 -8.605 344 2HB ASP 47 HB1 ASP 47 6.518 -7.625 -8.499 345 H ASN 48 HN ASN 48 3.719 -7.429 -6.015 346 HA ASN 48 HA ASN 48 5.913 -7.267 -4.054 347 1HB ASN 48 HB2 ASN 48 5.311 -5.108 -5.242 348 2HB ASN 48 HB1 ASN 48 3.711 -5.236 -4.516 349 1HD2 ASN 48 HD21 ASN 48 3.795 -3.467 -3.244 350 2HD2 ASN 48 HD22 ASN 48 4.918 -3.266 -1.939 351 H PHE 49 HN PHE 49 3.407 -9.037 -4.478 352 HA PHE 49 HA PHE 49 2.297 -8.730 -1.763 353 1HB PHE 49 HB2 PHE 49 0.787 -7.831 -3.545 354 2HB PHE 49 HB1 PHE 49 0.748 -9.426 -4.266 355 HD1 PHE 49 HD1 PHE 49 -0.078 -7.620 -1.110 356 HD2 PHE 49 HD2 PHE 49 -0.916 -10.898 -3.694 357 HE1 PHE 49 HE1 PHE 49 -2.113 -8.116 0.177 358 HE2 PHE 49 HE2 PHE 49 -2.945 -11.404 -2.401 359 HZ PHE 49 HZ PHE 49 -3.560 -9.998 -0.475 360 H GLU 50 HN GLU 50 3.284 -10.460 -0.825 361 HA GLU 50 HA GLU 50 3.155 -13.032 -2.233 362 1HB GLU 50 HB2 GLU 50 4.750 -12.218 0.207 363 2HB GLU 50 HB1 GLU 50 4.746 -13.830 -0.493 364 1HG GLU 50 HG2 GLU 50 5.564 -12.779 -2.628 365 2HG GLU 50 HG1 GLU 50 5.797 -11.296 -1.706 366 H GLN 51 HN GLN 51 1.231 -13.900 -1.893 367 HA GLN 51 HA GLN 51 -0.380 -15.104 -0.839 368 1HB GLN 51 HB2 GLN 51 1.187 -14.637 1.700 369 2HB GLN 51 HB1 GLN 51 -0.098 -15.813 1.474 370 1HG GLN 51 HG2 GLN 51 1.229 -17.127 0.031 371 2HG GLN 51 HG1 GLN 51 2.443 -15.857 -0.125 372 1HE2 GLN 51 HE21 GLN 51 4.111 -17.145 0.587 373 2HE2 GLN 51 HE22 GLN 51 4.270 -17.641 2.241 374 H GLY 52 HN GLY 52 0.647 -12.471 1.302 375 1HA GLY 52 HA2 GLY 52 -1.683 -10.937 1.008 376 2HA GLY 52 HA1 GLY 52 -1.870 -11.966 2.427 377 H LYS 53 HN LYS 53 1.115 -10.580 1.202 378 HA LYS 53 HA LYS 53 1.154 -8.606 3.367 379 1HB LYS 53 HB2 LYS 53 3.568 -10.269 2.660 380 2HB LYS 53 HB1 LYS 53 3.418 -9.137 3.977 381 1HG LYS 53 HG2 LYS 53 1.867 -11.710 3.803 382 2HG LYS 53 HG1 LYS 53 3.415 -11.546 4.631 383 1HD LYS 53 HD2 LYS 53 2.357 -9.727 6.016 384 2HD LYS 53 HD1 LYS 53 0.811 -10.186 5.298 385 1HE LYS 53 HE2 LYS 53 2.622 -12.054 6.824 386 2HE LYS 53 HE1 LYS 53 1.223 -11.230 7.509 387 1HZ LYS 53 HZ1 LYS 53 0.795 -13.548 6.800 388 2HZ LYS 53 HZ2 LYS 53 1.084 -13.084 5.194 389 3HZ LYS 53 HZ3 LYS 53 -0.217 -12.411 6.053 390 H PHE 54 HN PHE 54 1.860 -6.649 2.601 391 HA PHE 54 HA PHE 54 3.295 -6.709 0.049 392 1HB PHE 54 HB2 PHE 54 2.514 -4.288 -0.196 393 2HB PHE 54 HB1 PHE 54 1.355 -5.573 -0.468 394 HD1 PHE 54 HD1 PHE 54 -0.745 -4.715 0.059 395 HD2 PHE 54 HD2 PHE 54 2.541 -3.975 2.659 396 HE1 PHE 54 HE1 PHE 54 -2.262 -3.672 1.688 397 HE2 PHE 54 HE2 PHE 54 1.025 -2.920 4.289 398 HZ PHE 54 HZ PHE 54 -1.480 -2.704 3.660 399 H PHE 55 HN PHE 55 4.959 -5.237 -0.313 400 HA PHE 55 HA PHE 55 6.279 -4.180 2.054 401 1HB PHE 55 HB2 PHE 55 8.383 -5.508 1.219 402 2HB PHE 55 HB1 PHE 55 7.210 -6.296 2.255 403 HD1 PHE 55 HD1 PHE 55 9.056 -6.520 -0.741 404 HD2 PHE 55 HD2 PHE 55 5.354 -7.633 1.020 405 HE1 PHE 55 HE1 PHE 55 8.811 -8.304 -2.411 406 HE2 PHE 55 HE2 PHE 55 5.114 -9.443 -0.633 407 HZ PHE 55 HZ PHE 55 6.906 -9.791 -2.346 408 H LEU 56 HN LEU 56 8.700 -3.605 1.134 409 HA LEU 56 HA LEU 56 8.341 -2.336 -1.503 410 1HB LEU 56 HB2 LEU 56 10.074 -1.603 0.852 411 2HB LEU 56 HB1 LEU 56 10.524 -1.115 -0.754 412 HG LEU 56 HG LEU 56 8.853 0.449 -0.927 413 1HD1 LEU 56 HD11 LEU 56 6.971 -1.029 -0.498 414 2HD1 LEU 56 HD12 LEU 56 6.808 0.488 0.389 415 3HD1 LEU 56 HD13 LEU 56 7.317 -0.976 1.232 416 1HD2 LEU 56 HD21 LEU 56 9.367 0.276 2.038 417 2HD2 LEU 56 HD22 LEU 56 8.768 1.690 1.169 418 3HD2 LEU 56 HD23 LEU 56 10.393 1.081 0.849 419 H ILE 57 HN ILE 57 9.054 -3.748 -2.996 420 HA ILE 57 HA ILE 57 11.309 -5.486 -2.262 421 HB ILE 57 HB ILE 57 9.203 -6.671 -2.751 422 1HG1 ILE 57 HG12 ILE 57 10.094 -8.255 -4.440 423 2HG1 ILE 57 HG11 ILE 57 11.358 -7.092 -4.833 424 1HG2 ILE 57 HG21 ILE 57 8.305 -6.731 -5.023 425 2HG2 ILE 57 HG22 ILE 57 9.454 -5.483 -5.505 426 3HG2 ILE 57 HG23 ILE 57 8.204 -5.120 -4.313 427 1HD1 ILE 57 HD11 ILE 57 12.201 -8.835 -3.380 428 2HD1 ILE 57 HD12 ILE 57 10.965 -8.458 -2.181 429 3HD1 ILE 57 HD13 ILE 57 12.220 -7.278 -2.552 430 H SER 58 HN SER 58 13.130 -5.484 -3.408 431 HA SER 58 HA SER 58 13.608 -3.667 -5.547 432 1HB SER 58 HB2 SER 58 15.486 -4.254 -4.187 433 2HB SER 58 HB1 SER 58 15.185 -5.977 -4.389 434 HG SER 58 HG SER 58 16.074 -4.147 -6.380 435 H ASP 59 HN ASP 59 13.694 -4.076 -7.757 436 HA ASP 59 HA ASP 59 11.908 -6.057 -8.703 437 1HB ASP 59 HB2 ASP 59 12.514 -5.303 -10.946 438 2HB ASP 59 HB1 ASP 59 12.259 -3.924 -9.882 439 H ASN 60 HN ASN 60 15.230 -6.166 -7.968 440 HA ASN 60 HA ASN 60 15.784 -8.461 -9.655 441 1HB ASN 60 HB2 ASN 60 17.587 -6.896 -9.343 442 2HB ASN 60 HB1 ASN 60 17.429 -6.984 -7.593 443 1HD2 ASN 60 HD21 ASN 60 18.378 -8.753 -10.465 444 2HD2 ASN 60 HD22 ASN 60 19.434 -9.867 -9.656 445 H ASN 61 HN ASN 61 14.386 -7.874 -6.664 446 HA ASN 61 HA ASN 61 13.815 -9.100 -4.855 447 1HB ASN 61 HB2 ASN 61 12.801 -10.574 -6.550 448 2HB ASN 61 HB1 ASN 61 14.312 -11.471 -6.670 449 1HD2 ASN 61 HD21 ASN 61 13.328 -13.388 -6.035 450 2HD2 ASN 61 HD22 ASN 61 12.823 -13.676 -4.405 451 H ARG 62 HN ARG 62 15.398 -8.613 -3.447 452 HA ARG 62 HA ARG 62 17.338 -10.666 -2.857 453 1HB ARG 62 HB2 ARG 62 19.240 -8.994 -2.814 454 2HB ARG 62 HB1 ARG 62 18.682 -9.464 -4.413 455 1HG ARG 62 HG2 ARG 62 17.354 -7.379 -4.523 456 2HG ARG 62 HG1 ARG 62 18.039 -6.900 -2.970 457 1HD ARG 62 HD2 ARG 62 19.661 -7.510 -5.434 458 2HD ARG 62 HD1 ARG 62 19.166 -5.891 -4.946 459 HE ARG 62 HE ARG 62 20.432 -6.773 -2.740 460 1HH1 ARG 62 HH11 ARG 62 21.333 -6.779 -6.130 461 2HH1 ARG 62 HH12 ARG 62 23.038 -6.616 -5.811 462 1HH2 ARG 62 HH21 ARG 62 22.675 -6.558 -2.316 463 2HH2 ARG 62 HH22 ARG 62 23.792 -6.496 -3.644 464 H ASP 63 HN ASP 63 16.239 -7.389 -2.177 465 HA ASP 63 HA ASP 63 16.459 -7.948 0.702 466 1HB ASP 63 HB2 ASP 63 17.985 -6.183 0.070 467 2HB ASP 63 HB1 ASP 63 16.725 -5.348 -0.827 468 H LYS 64 HN LYS 64 14.662 -7.610 1.948 469 HA LYS 64 HA LYS 64 12.296 -6.527 0.578 470 1HB LYS 64 HB2 LYS 64 12.584 -9.168 1.663 471 2HB LYS 64 HB1 LYS 64 11.417 -8.264 2.605 472 1HG LYS 64 HG2 LYS 64 10.463 -7.684 0.232 473 2HG LYS 64 HG1 LYS 64 11.239 -9.222 -0.164 474 1HD LYS 64 HD2 LYS 64 9.442 -8.837 2.213 475 2HD LYS 64 HD1 LYS 64 8.830 -9.362 0.647 476 1HE LYS 64 HE2 LYS 64 11.004 -10.764 2.196 477 2HE LYS 64 HE1 LYS 64 9.301 -11.200 2.262 478 1HZ LYS 64 HZ1 LYS 64 11.007 -11.255 -0.174 479 2HZ LYS 64 HZ2 LYS 64 9.359 -11.679 -0.108 480 3HZ LYS 64 HZ3 LYS 64 10.510 -12.607 0.722 481 H LEU 65 HN LEU 65 10.863 -5.484 1.778 482 HA LEU 65 HA LEU 65 11.420 -4.985 4.621 483 1HB LEU 65 HB2 LEU 65 10.050 -3.220 2.587 484 2HB LEU 65 HB1 LEU 65 10.085 -2.892 4.297 485 HG LEU 65 HG LEU 65 12.600 -2.796 4.125 486 1HD1 LEU 65 HD11 LEU 65 13.537 -2.268 1.935 487 2HD1 LEU 65 HD12 LEU 65 11.974 -2.590 1.186 488 3HD1 LEU 65 HD13 LEU 65 12.861 -3.896 1.973 489 1HD2 LEU 65 HD21 LEU 65 12.570 -0.485 3.353 490 2HD2 LEU 65 HD22 LEU 65 11.183 -0.831 4.387 491 3HD2 LEU 65 HD23 LEU 65 10.977 -0.739 2.638 492 H TYR 66 HN TYR 66 9.246 -4.690 5.857 493 HA TYR 66 HA TYR 66 7.003 -5.191 4.024 494 1HB TYR 66 HB2 TYR 66 7.141 -5.846 6.961 495 2HB TYR 66 HB1 TYR 66 5.660 -5.838 6.019 496 HD1 TYR 66 HD1 TYR 66 7.863 -8.006 7.436 497 HD2 TYR 66 HD2 TYR 66 6.123 -7.174 3.647 498 HE1 TYR 66 HE1 TYR 66 8.359 -10.302 6.712 499 HE2 TYR 66 HE2 TYR 66 6.590 -9.480 2.917 500 HH TYR 66 HH TYR 66 7.797 -11.912 5.123 501 H VAL 67 HN VAL 67 5.248 -3.767 4.200 502 HA VAL 67 HA VAL 67 5.722 -1.381 5.849 503 HB VAL 67 HB VAL 67 5.083 0.071 3.970 504 1HG1 VAL 67 HG11 VAL 67 7.423 -0.228 4.508 505 2HG1 VAL 67 HG12 VAL 67 7.222 -0.079 2.762 506 3HG1 VAL 67 HG13 VAL 67 7.500 -1.664 3.485 507 1HG2 VAL 67 HG21 VAL 67 5.317 -2.443 2.318 508 2HG2 VAL 67 HG22 VAL 67 5.135 -0.812 1.675 509 3HG2 VAL 67 HG23 VAL 67 3.838 -1.535 2.629 510 H ASN 68 HN ASN 68 3.860 -0.062 6.171 511 HA ASN 68 HA ASN 68 1.339 -1.363 5.431 512 1HB ASN 68 HB2 ASN 68 0.345 -0.477 7.548 513 2HB ASN 68 HB1 ASN 68 1.559 -1.721 7.795 514 1HD2 ASN 68 HD21 ASN 68 0.517 0.424 9.543 515 2HD2 ASN 68 HD22 ASN 68 1.922 1.291 10.082 516 H ILE 69 HN ILE 69 0.456 -0.177 3.922 517 HA ILE 69 HA ILE 69 0.810 2.651 3.708 518 HB ILE 69 HB ILE 69 -1.491 2.043 2.263 519 1HG1 ILE 69 HG12 ILE 69 0.475 -0.254 2.086 520 2HG1 ILE 69 HG11 ILE 69 -1.176 -0.348 2.692 521 1HG2 ILE 69 HG21 ILE 69 1.387 2.070 1.375 522 2HG2 ILE 69 HG22 ILE 69 0.316 3.463 1.517 523 3HG2 ILE 69 HG23 ILE 69 -0.011 2.219 0.311 524 1HD1 ILE 69 HD11 ILE 69 -1.046 -1.234 0.455 525 2HD1 ILE 69 HD12 ILE 69 -0.341 0.272 -0.133 526 3HD1 ILE 69 HD13 ILE 69 -2.002 0.246 0.459 527 H ARG 70 HN ARG 70 0.034 3.884 5.274 528 HA ARG 70 HA ARG 70 -2.602 3.197 6.403 529 1HB ARG 70 HB2 ARG 70 -0.606 2.659 7.881 530 2HB ARG 70 HB1 ARG 70 -0.298 4.389 7.954 531 1HG ARG 70 HG2 ARG 70 -2.537 4.717 8.928 532 2HG ARG 70 HG1 ARG 70 -2.770 2.968 8.920 533 1HD ARG 70 HD2 ARG 70 -2.076 3.500 11.104 534 2HD ARG 70 HD1 ARG 70 -0.653 2.828 10.310 535 HE ARG 70 HE ARG 70 -0.692 5.646 10.051 536 1HH1 ARG 70 HH11 ARG 70 -0.052 3.086 12.361 537 2HH1 ARG 70 HH12 ARG 70 0.971 4.077 13.354 538 1HH2 ARG 70 HH21 ARG 70 0.646 6.960 11.378 539 2HH2 ARG 70 HH22 ARG 70 1.366 6.268 12.808 540 HA PRO 71 HA PRO 71 -3.965 7.353 5.444 541 1HB PRO 71 HB2 PRO 71 -5.112 7.015 8.191 542 2HB PRO 71 HB1 PRO 71 -5.867 7.657 6.734 543 1HG PRO 71 HG2 PRO 71 -6.403 5.190 7.531 544 2HG PRO 71 HG1 PRO 71 -6.184 5.548 5.806 545 1HD PRO 71 HD2 PRO 71 -4.351 4.167 7.702 546 2HD PRO 71 HD1 PRO 71 -4.569 3.920 5.958 547 H MET 72 HN MET 72 -2.707 9.076 5.645 548 HA MET 72 HA MET 72 -0.529 9.253 7.324 549 1HB MET 72 HB2 MET 72 -0.835 10.527 5.226 550 2HB MET 72 HB1 MET 72 -1.993 11.563 6.047 551 1HG MET 72 HG2 MET 72 -0.262 12.332 7.567 552 2HG MET 72 HG1 MET 72 0.904 11.258 6.796 553 1HE MET 72 HE1 MET 72 -1.402 14.388 6.347 554 2HE MET 72 HE2 MET 72 -1.918 13.363 5.006 555 3HE MET 72 HE3 MET 72 -1.054 14.869 4.686 556 H ASP 73 HN ASP 73 -3.568 11.109 7.652 557 HA ASP 73 HA ASP 73 -3.383 10.916 10.537 558 1HB ASP 73 HB2 ASP 73 -3.220 13.222 11.012 559 2HB ASP 73 HB1 ASP 73 -2.002 12.943 9.773 560 H ASN 74 HN ASN 74 -5.173 10.330 8.132 561 HA ASN 74 HA ASN 74 -7.385 12.153 8.429 562 1HB ASN 74 HB2 ASN 74 -7.035 9.706 6.708 563 2HB ASN 74 HB1 ASN 74 -8.462 10.729 6.671 564 1HD2 ASN 74 HD21 ASN 74 -5.146 10.393 5.771 565 2HD2 ASN 74 HD22 ASN 74 -5.041 11.808 4.779 566 H SER 75 HN SER 75 -7.636 8.605 8.254 567 HA SER 75 HA SER 75 -9.283 8.662 10.680 568 1HB SER 75 HB2 SER 75 -10.147 7.175 8.198 569 2HB SER 75 HB1 SER 75 -11.098 7.536 9.639 570 HG SER 75 HG SER 75 -11.195 9.674 9.034 571 H ALA 76 HN ALA 76 -9.868 6.324 11.303 572 HA ALA 76 HA ALA 76 -7.434 4.746 11.201 573 1HB ALA 76 HB1 ALA 76 -9.985 4.258 12.738 574 2HB ALA 76 HB2 ALA 76 -8.570 5.109 13.351 575 3HB ALA 76 HB3 ALA 76 -8.459 3.396 12.943 576 H TRP 77 HN TRP 77 -7.134 3.180 9.794 577 HA TRP 77 HA TRP 77 -9.471 1.922 8.514 578 1HB TRP 77 HB2 TRP 77 -6.656 2.418 7.602 579 2HB TRP 77 HB1 TRP 77 -7.573 1.086 6.909 580 HD1 TRP 77 HD1 TRP 77 -9.355 4.387 7.691 581 HE1 TRP 77 HE1 TRP 77 -10.069 5.468 5.454 582 HE3 TRP 77 HE3 TRP 77 -6.903 1.273 4.461 583 HZ2 TRP 77 HZ2 TRP 77 -9.633 5.048 2.699 584 HZ3 TRP 77 HZ3 TRP 77 -7.103 1.684 2.045 585 HH2 TRP 77 HH2 TRP 77 -8.439 3.531 1.183 586 H THR 78 HN THR 78 -9.412 -0.388 8.172 587 HA THR 78 HA THR 78 -8.307 -1.874 10.347 588 HB THR 78 HB THR 78 -9.482 -2.945 7.769 589 HG1 THR 78 HG1 THR 78 -10.668 -1.925 10.128 590 1HG2 THR 78 HG21 THR 78 -9.251 -4.156 10.530 591 2HG2 THR 78 HG22 THR 78 -8.284 -4.604 9.124 592 3HG2 THR 78 HG23 THR 78 -10.021 -4.909 9.134 593 H THR 79 HN THR 79 -6.318 -2.739 10.455 594 HA THR 79 HA THR 79 -4.673 -2.322 8.074 595 HB THR 79 HB THR 79 -3.982 -0.936 9.868 596 HG1 THR 79 HG1 THR 79 -2.105 -3.071 9.903 597 1HG2 THR 79 HG21 THR 79 -4.947 -2.130 11.752 598 2HG2 THR 79 HG22 THR 79 -3.236 -1.812 12.044 599 3HG2 THR 79 HG23 THR 79 -3.763 -3.425 11.562 600 H ASP 80 HN ASP 80 -4.740 -4.170 6.987 601 HA ASP 80 HA ASP 80 -3.453 -6.489 8.270 602 1HB ASP 80 HB2 ASP 80 -5.089 -6.293 5.723 603 2HB ASP 80 HB1 ASP 80 -4.193 -7.729 6.196 604 H ASN 81 HN ASN 81 -1.751 -7.545 6.849 605 HA ASN 81 HA ASN 81 -0.153 -5.401 5.734 606 1HB ASN 81 HB2 ASN 81 0.858 -7.152 7.252 607 2HB ASN 81 HB1 ASN 81 0.627 -8.313 5.965 608 1HD2 ASN 81 HD21 ASN 81 1.611 -4.992 5.310 609 2HD2 ASN 81 HD22 ASN 81 3.208 -5.389 4.816 610 H GLY 82 HN GLY 82 -2.410 -7.553 4.594 611 1HA GLY 82 HA2 GLY 82 -1.243 -7.493 1.892 612 2HA GLY 82 HA1 GLY 82 -2.461 -8.637 2.435 613 H VAL 83 HN VAL 83 -3.986 -6.508 3.798 614 HA VAL 83 HA VAL 83 -4.964 -4.990 1.494 615 HB VAL 83 HB VAL 83 -7.309 -5.472 2.094 616 1HG1 VAL 83 HG11 VAL 83 -6.232 -6.773 0.330 617 2HG1 VAL 83 HG12 VAL 83 -7.420 -7.741 1.202 618 3HG1 VAL 83 HG13 VAL 83 -5.699 -7.957 1.523 619 1HG2 VAL 83 HG21 VAL 83 -7.836 -7.338 3.600 620 2HG2 VAL 83 HG22 VAL 83 -7.005 -6.031 4.443 621 3HG2 VAL 83 HG23 VAL 83 -6.125 -7.492 3.997 622 H PHE 84 HN PHE 84 -6.045 -3.059 2.041 623 HA PHE 84 HA PHE 84 -6.031 -2.326 4.874 624 1HB PHE 84 HB2 PHE 84 -4.008 -1.514 3.158 625 2HB PHE 84 HB1 PHE 84 -5.122 -0.150 3.144 626 HD1 PHE 84 HD1 PHE 84 -5.751 0.920 5.329 627 HD2 PHE 84 HD2 PHE 84 -2.601 -1.917 4.978 628 HE1 PHE 84 HE1 PHE 84 -4.812 1.700 7.469 629 HE2 PHE 84 HE2 PHE 84 -1.659 -1.146 7.111 630 HZ PHE 84 HZ PHE 84 -2.764 0.665 8.362 631 H TYR 85 HN TYR 85 -8.067 -1.754 5.267 632 HA TYR 85 HA TYR 85 -9.460 -0.042 3.349 633 1HB TYR 85 HB2 TYR 85 -11.477 -1.479 3.385 634 2HB TYR 85 HB1 TYR 85 -10.101 -2.276 2.633 635 HD1 TYR 85 HD1 TYR 85 -12.708 -2.621 4.974 636 HD2 TYR 85 HD2 TYR 85 -8.693 -3.822 4.230 637 HE1 TYR 85 HE1 TYR 85 -13.004 -4.522 6.502 638 HE2 TYR 85 HE2 TYR 85 -8.982 -5.738 5.752 639 HH TYR 85 HH TYR 85 -12.011 -6.753 6.876 640 H LYS 86 HN LYS 86 -11.200 1.145 4.283 641 HA LYS 86 HA LYS 86 -10.754 1.616 7.059 642 1HB LYS 86 HB2 LYS 86 -12.187 3.465 6.908 643 2HB LYS 86 HB1 LYS 86 -11.343 3.411 5.377 644 1HG LYS 86 HG2 LYS 86 -13.987 2.091 5.519 645 2HG LYS 86 HG1 LYS 86 -13.949 3.852 5.584 646 1HD LYS 86 HD2 LYS 86 -12.357 3.565 3.503 647 2HD LYS 86 HD1 LYS 86 -13.187 2.009 3.366 648 1HE LYS 86 HE2 LYS 86 -15.356 3.237 3.452 649 2HE LYS 86 HE1 LYS 86 -14.450 4.752 3.411 650 1HZ LYS 86 HZ1 LYS 86 -14.572 2.671 1.303 651 2HZ LYS 86 HZ2 LYS 86 -13.513 3.992 1.266 652 3HZ LYS 86 HZ3 LYS 86 -15.188 4.247 1.230 653 H ASN 87 HN ASN 87 -12.078 1.285 8.764 654 HA ASN 87 HA ASN 87 -13.596 -1.051 8.872 655 1HB ASN 87 HB2 ASN 87 -12.658 -0.228 10.887 656 2HB ASN 87 HB1 ASN 87 -13.396 1.354 10.681 657 1HD2 ASN 87 HD21 ASN 87 -15.497 1.674 11.300 658 2HD2 ASN 87 HD22 ASN 87 -16.387 0.528 12.240 659 H ASP 88 HN ASP 88 -14.464 2.166 8.001 660 HA ASP 88 HA ASP 88 -17.321 1.633 8.256 661 1HB ASP 88 HB2 ASP 88 -15.965 3.853 8.868 662 2HB ASP 88 HB1 ASP 88 -16.285 4.215 7.172 663 H VAL 89 HN VAL 89 -18.301 3.216 6.255 664 HA VAL 89 HA VAL 89 -17.284 2.016 3.759 665 HB VAL 89 HB VAL 89 -19.624 1.872 2.934 666 1HG1 VAL 89 HG11 VAL 89 -19.092 0.285 5.436 667 2HG1 VAL 89 HG12 VAL 89 -18.532 -0.110 3.811 668 3HG1 VAL 89 HG13 VAL 89 -20.256 -0.131 4.180 669 1HG2 VAL 89 HG21 VAL 89 -20.657 3.530 4.400 670 2HG2 VAL 89 HG22 VAL 89 -20.378 2.485 5.794 671 3HG2 VAL 89 HG23 VAL 89 -21.488 1.979 4.521 672 H GLY 90 HN GLY 90 -18.945 3.321 1.999 673 1HA GLY 90 HA2 GLY 90 -19.509 5.393 1.112 674 2HA GLY 90 HA1 GLY 90 -18.944 6.145 2.598 675 H SER 91 HN SER 91 -17.838 7.728 1.393 676 HA SER 91 HA SER 91 -15.677 6.868 -0.336 677 1HB SER 91 HB2 SER 91 -16.620 9.630 0.496 678 2HB SER 91 HB1 SER 91 -15.346 9.310 -0.682 679 HG SER 91 HG SER 91 -17.834 8.077 -1.060 680 H TRP 92 HN TRP 92 -13.695 8.608 0.182 681 HA TRP 92 HA TRP 92 -13.083 8.976 2.923 682 1HB TRP 92 HB2 TRP 92 -12.797 6.492 2.730 683 2HB TRP 92 HB1 TRP 92 -11.510 6.792 1.552 684 HD1 TRP 92 HD1 TRP 92 -12.294 7.084 5.277 685 HE1 TRP 92 HE1 TRP 92 -10.096 7.516 6.540 686 HE3 TRP 92 HE3 TRP 92 -9.203 7.751 1.284 687 HZ2 TRP 92 HZ2 TRP 92 -7.408 8.059 5.900 688 HZ3 TRP 92 HZ3 TRP 92 -6.855 8.242 1.679 689 HH2 TRP 92 HH2 TRP 92 -5.954 8.392 3.950 690 H GLY 93 HN GLY 93 -11.681 8.338 -0.221 691 1HA GLY 93 HA2 GLY 93 -9.691 9.257 -1.141 692 2HA GLY 93 HA1 GLY 93 -10.904 10.486 -1.374 693 H GLY 94 HN GLY 94 -8.006 9.586 0.274 694 1HA GLY 94 HA2 GLY 94 -7.602 12.354 1.074 695 2HA GLY 94 HA1 GLY 94 -7.642 11.175 2.379 696 H THR 95 HN THR 95 -5.647 10.694 3.040 697 HA THR 95 HA THR 95 -3.569 10.335 0.997 698 HB THR 95 HB THR 95 -2.024 11.278 2.929 699 HG1 THR 95 HG1 THR 95 -3.838 13.211 3.444 700 1HG2 THR 95 HG21 THR 95 -2.127 13.481 1.862 701 2HG2 THR 95 HG22 THR 95 -3.657 13.044 1.101 702 3HG2 THR 95 HG23 THR 95 -2.178 12.190 0.661 703 H ILE 96 HN ILE 96 -2.553 8.471 1.116 704 HA ILE 96 HA ILE 96 -2.436 7.031 3.703 705 HB ILE 96 HB ILE 96 -2.088 5.557 1.137 706 1HG1 ILE 96 HG12 ILE 96 -4.214 7.110 1.145 707 2HG1 ILE 96 HG11 ILE 96 -4.321 5.452 0.563 708 1HG2 ILE 96 HG21 ILE 96 -1.765 4.441 3.278 709 2HG2 ILE 96 HG22 ILE 96 -3.139 3.762 2.404 710 3HG2 ILE 96 HG23 ILE 96 -3.412 4.869 3.750 711 1HD1 ILE 96 HD11 ILE 96 -5.103 6.433 3.295 712 2HD1 ILE 96 HD12 ILE 96 -5.195 4.762 2.737 713 3HD1 ILE 96 HD13 ILE 96 -6.199 6.000 1.983 714 H GLY 97 HN GLY 97 -0.405 6.536 4.391 715 1HA GLY 97 HA2 GLY 97 1.775 7.250 2.536 716 2HA GLY 97 HA1 GLY 97 1.832 7.515 4.271 717 H ILE 98 HN ILE 98 3.672 6.012 2.559 718 HA ILE 98 HA ILE 98 3.295 3.280 3.469 719 HB ILE 98 HB ILE 98 5.391 4.566 1.718 720 1HG1 ILE 98 HG12 ILE 98 4.569 2.722 0.152 721 2HG1 ILE 98 HG11 ILE 98 3.253 2.490 1.308 722 1HG2 ILE 98 HG21 ILE 98 6.453 2.367 1.489 723 2HG2 ILE 98 HG22 ILE 98 5.388 1.730 2.743 724 3HG2 ILE 98 HG23 ILE 98 6.562 2.985 3.136 725 1HD1 ILE 98 HD11 ILE 98 2.542 4.798 0.944 726 2HD1 ILE 98 HD12 ILE 98 2.564 3.882 -0.563 727 3HD1 ILE 98 HD13 ILE 98 3.859 5.025 -0.207 728 H TYR 99 HN TYR 99 3.765 2.884 5.507 729 HA TYR 99 HA TYR 99 6.176 4.078 6.691 730 1HB TYR 99 HB2 TYR 99 3.982 2.535 8.108 731 2HB TYR 99 HB1 TYR 99 5.257 3.485 8.853 732 HD1 TYR 99 HD1 TYR 99 4.707 5.599 9.644 733 HD2 TYR 99 HD2 TYR 99 2.381 3.928 6.506 734 HE1 TYR 99 HE1 TYR 99 3.219 7.554 9.711 735 HE2 TYR 99 HE2 TYR 99 0.881 5.871 6.572 736 HH TYR 99 HH TYR 99 0.211 7.638 8.016 737 H VAL 100 HN VAL 100 7.831 2.707 7.386 738 HA VAL 100 HA VAL 100 7.715 0.002 6.354 739 HB VAL 100 HB VAL 100 9.778 1.423 6.147 740 1HG1 VAL 100 HG11 VAL 100 10.081 0.816 9.083 741 2HG1 VAL 100 HG12 VAL 100 9.773 2.404 8.381 742 3HG1 VAL 100 HG13 VAL 100 11.292 1.571 8.048 743 1HG2 VAL 100 HG21 VAL 100 9.840 -0.983 5.813 744 2HG2 VAL 100 HG22 VAL 100 10.078 -1.231 7.544 745 3HG2 VAL 100 HG23 VAL 100 11.323 -0.423 6.588 746 H ASP 101 HN ASP 101 7.532 -1.832 7.549 747 HA ASP 101 HA ASP 101 6.575 -1.531 10.248 748 1HB ASP 101 HB2 ASP 101 5.557 -3.164 8.701 749 2HB ASP 101 HB1 ASP 101 7.083 -4.049 8.649 750 H GLY 102 HN GLY 102 7.956 -1.245 11.867 751 1HA GLY 102 HA2 GLY 102 9.569 -1.822 13.404 752 2HA GLY 102 HA1 GLY 102 9.832 -3.302 12.497 753 H GLN 103 HN GLN 103 10.141 -0.041 11.237 754 HA GLN 103 HA GLN 103 11.819 0.952 10.078 755 1HB GLN 103 HB2 GLN 103 13.638 1.695 11.481 756 2HB GLN 103 HB1 GLN 103 12.117 1.745 12.353 757 1HG GLN 103 HG2 GLN 103 12.699 -0.223 13.598 758 2HG GLN 103 HG1 GLN 103 14.157 -0.450 12.631 759 1HE2 GLN 103 HE21 GLN 103 15.891 0.957 12.900 760 2HE2 GLN 103 HE22 GLN 103 16.056 1.941 14.320 761 H GLN 104 HN GLN 104 12.531 -0.072 8.325 762 HA GLN 104 HA GLN 104 14.248 -2.296 8.262 763 1HB GLN 104 HB2 GLN 104 13.012 -1.601 6.291 764 2HB GLN 104 HB1 GLN 104 13.847 -0.056 6.265 765 1HG GLN 104 HG2 GLN 104 14.732 -1.482 4.551 766 2HG GLN 104 HG1 GLN 104 15.957 -1.224 5.789 767 1HE2 GLN 104 HE21 GLN 104 13.812 -3.519 4.313 768 2HE2 GLN 104 HE22 GLN 104 14.515 -4.932 5.010 769 H THR 105 HN THR 105 14.791 1.073 8.822 770 HA THR 105 HA THR 105 16.607 2.300 9.408 771 HB THR 105 HB THR 105 18.179 -0.259 9.731 772 HG1 THR 105 HG1 THR 105 16.493 -0.775 10.972 773 1HG2 THR 105 HG21 THR 105 19.219 0.979 11.583 774 2HG2 THR 105 HG22 THR 105 18.188 2.367 11.233 775 3HG2 THR 105 HG23 THR 105 19.396 1.847 10.058 776 H ASN 106 HN ASN 106 16.159 0.957 6.700 777 HA ASN 106 HA ASN 106 16.944 1.097 4.604 778 1HB ASN 106 HB2 ASN 106 17.239 3.487 5.285 779 2HB ASN 106 HB1 ASN 106 18.922 3.119 5.649 780 1HD2 ASN 106 HD21 ASN 106 20.359 3.218 4.056 781 2HD2 ASN 106 HD22 ASN 106 19.976 3.387 2.368 782 H THR 107 HN THR 107 17.710 -0.960 4.463 783 HA THR 107 HA THR 107 20.577 -1.386 4.809 784 HB THR 107 HB THR 107 18.498 -3.354 3.806 785 HG1 THR 107 HG1 THR 107 17.907 -3.624 5.824 786 1HG2 THR 107 HG21 THR 107 20.130 -5.043 4.554 787 2HG2 THR 107 HG22 THR 107 21.251 -3.754 4.989 788 3HG2 THR 107 HG23 THR 107 20.797 -3.996 3.303 789 HA PRO 108 HA PRO 108 21.855 0.303 0.984 790 1HB PRO 108 HB2 PRO 108 23.075 -2.437 0.790 791 2HB PRO 108 HB1 PRO 108 23.766 -0.873 0.324 792 1HG PRO 108 HG2 PRO 108 24.321 -1.987 2.700 793 2HG PRO 108 HG1 PRO 108 24.149 -0.234 2.509 794 1HD PRO 108 HD2 PRO 108 22.411 -2.119 3.922 795 2HD PRO 108 HD1 PRO 108 22.440 -0.346 3.999 796 HA PRO 109 HA PRO 109 18.821 -1.780 -1.662 797 1HB PRO 109 HB2 PRO 109 17.174 0.362 -1.851 798 2HB PRO 109 HB1 PRO 109 17.151 -0.750 -0.483 799 1HG PRO 109 HG2 PRO 109 18.016 2.021 -0.568 800 2HG PRO 109 HG1 PRO 109 17.738 0.985 0.832 801 1HD PRO 109 HD2 PRO 109 20.253 1.659 -0.499 802 2HD PRO 109 HD1 PRO 109 19.973 0.920 1.100 803 H GLY 110 HN GLY 110 17.451 -0.112 -3.431 804 1HA GLY 110 HA2 GLY 110 19.154 1.607 -4.923 805 2HA GLY 110 HA1 GLY 110 19.003 0.030 -5.692 806 H ASN 111 HN ASN 111 17.268 -0.357 -6.925 807 HA ASN 111 HA ASN 111 15.067 1.584 -6.866 808 1HB ASN 111 HB2 ASN 111 16.378 0.054 -8.969 809 2HB ASN 111 HB1 ASN 111 14.628 -0.134 -9.010 810 1HD2 ASN 111 HD21 ASN 111 13.331 1.640 -9.445 811 2HD2 ASN 111 HD22 ASN 111 13.975 3.110 -10.113 812 H TYR 112 HN TYR 112 13.407 1.019 -5.627 813 HA TYR 112 HA TYR 112 12.707 -1.826 -5.464 814 1HB TYR 112 HB2 TYR 112 12.251 0.429 -3.508 815 2HB TYR 112 HB1 TYR 112 11.335 -1.071 -3.426 816 HD1 TYR 112 HD1 TYR 112 12.174 -1.680 -1.253 817 HD2 TYR 112 HD2 TYR 112 14.854 -1.005 -4.471 818 HE1 TYR 112 HE1 TYR 112 13.979 -2.718 0.035 819 HE2 TYR 112 HE2 TYR 112 16.678 -2.028 -3.202 820 HH TYR 112 HH TYR 112 17.284 -2.614 -1.005 821 H THR 113 HN THR 113 10.748 -2.519 -5.998 822 HA THR 113 HA THR 113 9.014 -0.584 -7.386 823 HB THR 113 HB THR 113 9.498 -3.485 -8.049 824 HG1 THR 113 HG1 THR 113 11.031 -1.419 -8.561 825 1HG2 THR 113 HG21 THR 113 8.280 -2.991 -10.124 826 2HG2 THR 113 HG22 THR 113 7.986 -1.349 -9.554 827 3HG2 THR 113 HG23 THR 113 7.270 -2.719 -8.705 828 H LEU 114 HN LEU 114 7.462 -0.293 -5.831 829 HA LEU 114 HA LEU 114 6.104 -2.717 -4.879 830 1HB LEU 114 HB2 LEU 114 5.107 -1.113 -3.140 831 2HB LEU 114 HB1 LEU 114 6.772 -1.624 -2.943 832 HG LEU 114 HG LEU 114 6.282 0.911 -4.395 833 1HD1 LEU 114 HD11 LEU 114 6.132 2.157 -2.287 834 2HD1 LEU 114 HD12 LEU 114 6.042 0.634 -1.402 835 3HD1 LEU 114 HD13 LEU 114 4.748 1.088 -2.511 836 1HD2 LEU 114 HD21 LEU 114 8.327 0.061 -2.348 837 2HD2 LEU 114 HD22 LEU 114 8.334 1.569 -3.264 838 3HD2 LEU 114 HD23 LEU 114 8.548 0.029 -4.098 839 H THR 115 HN THR 115 4.790 -3.027 -6.599 840 HA THR 115 HA THR 115 3.112 -0.930 -7.636 841 HB THR 115 HB THR 115 2.693 -3.836 -8.244 842 HG1 THR 115 HG1 THR 115 4.458 -3.369 -9.896 843 1HG2 THR 115 HG21 THR 115 2.741 -1.366 -9.983 844 2HG2 THR 115 HG22 THR 115 1.287 -2.102 -9.307 845 3HG2 THR 115 HG23 THR 115 2.260 -2.989 -10.480 846 H LEU 116 HN LEU 116 1.128 -0.425 -6.895 847 HA LEU 116 HA LEU 116 -0.152 -2.308 -5.020 848 1HB LEU 116 HB2 LEU 116 -0.282 0.705 -5.097 849 2HB LEU 116 HB1 LEU 116 -1.179 -0.307 -3.983 850 HG LEU 116 HG LEU 116 1.836 -0.128 -4.101 851 1HD1 LEU 116 HD11 LEU 116 -0.125 1.104 -2.166 852 2HD1 LEU 116 HD12 LEU 116 0.865 1.968 -3.342 853 3HD1 LEU 116 HD13 LEU 116 1.631 1.119 -1.999 854 1HD2 LEU 116 HD21 LEU 116 1.739 -1.337 -1.972 855 2HD2 LEU 116 HD22 LEU 116 1.035 -2.280 -3.283 856 3HD2 LEU 116 HD23 LEU 116 -0.014 -1.463 -2.123 857 H THR 117 HN THR 117 -1.802 -3.287 -5.978 858 HA THR 117 HA THR 117 -3.315 -1.951 -8.072 859 HB THR 117 HB THR 117 -3.623 -4.770 -7.009 860 HG1 THR 117 HG1 THR 117 -2.323 -5.323 -8.837 861 1HG2 THR 117 HG21 THR 117 -4.546 -3.491 -9.590 862 2HG2 THR 117 HG22 THR 117 -5.580 -3.919 -8.227 863 3HG2 THR 117 HG23 THR 117 -4.760 -5.183 -9.140 864 H GLY 118 HN GLY 118 -4.877 -0.635 -7.407 865 1HA GLY 118 HA2 GLY 118 -6.056 -0.832 -4.810 866 2HA GLY 118 HA1 GLY 118 -6.484 0.319 -6.062 867 H GLY 119 HN GLY 119 -8.538 -0.449 -4.706 868 1HA GLY 119 HA2 GLY 119 -10.450 -1.273 -6.371 869 2HA GLY 119 HA1 GLY 119 -9.760 -2.811 -5.862 870 H TYR 120 HN TYR 120 -12.104 -2.973 -5.113 871 HA TYR 120 HA TYR 120 -12.348 -1.721 -2.471 872 1HB TYR 120 HB2 TYR 120 -14.720 -2.198 -2.518 873 2HB TYR 120 HB1 TYR 120 -14.265 -1.333 -3.975 874 HD1 TYR 120 HD1 TYR 120 -15.316 -4.590 -2.615 875 HD2 TYR 120 HD2 TYR 120 -14.542 -2.336 -6.147 876 HE1 TYR 120 HE1 TYR 120 -16.371 -6.353 -3.966 877 HE2 TYR 120 HE2 TYR 120 -15.605 -4.089 -7.503 878 HH TYR 120 HH TYR 120 -17.476 -6.571 -6.178 879 H TRP 121 HN TRP 121 -13.944 -3.366 -1.136 880 HA TRP 121 HA TRP 121 -12.646 -5.985 -1.037 881 1HB TRP 121 HB2 TRP 121 -11.157 -4.793 0.346 882 2HB TRP 121 HB1 TRP 121 -12.434 -3.787 1.016 883 HD1 TRP 121 HD1 TRP 121 -14.026 -4.943 2.850 884 HE1 TRP 121 HE1 TRP 121 -13.571 -6.836 4.519 885 HE3 TRP 121 HE3 TRP 121 -9.866 -6.886 0.709 886 HZ2 TRP 121 HZ2 TRP 121 -11.683 -8.876 4.875 887 HZ3 TRP 121 HZ3 TRP 121 -8.781 -8.826 1.784 888 HH2 TRP 121 HH2 TRP 121 -9.678 -9.791 3.815 889 H ALA 122 HN ALA 122 -13.876 -7.515 0.161 890 HA ALA 122 HA ALA 122 -16.475 -6.576 1.137 891 1HB ALA 122 HB1 ALA 122 -16.002 -9.095 -0.450 892 2HB ALA 122 HB2 ALA 122 -16.782 -7.628 -1.046 893 3HB ALA 122 HB3 ALA 122 -17.542 -8.576 0.233 894 H LYS 123 HN LYS 123 -17.223 -7.463 2.981 895 HA LYS 123 HA LYS 123 -17.417 -8.670 4.868 896 1HB LYS 123 HB2 LYS 123 -15.702 -10.580 3.324 897 2HB LYS 123 HB1 LYS 123 -16.111 -10.887 5.009 898 1HG LYS 123 HG2 LYS 123 -17.926 -10.751 2.630 899 2HG LYS 123 HG1 LYS 123 -17.753 -12.037 3.829 900 1HD LYS 123 HD2 LYS 123 -18.656 -10.440 5.538 901 2HD LYS 123 HD1 LYS 123 -19.004 -9.322 4.219 902 1HE LYS 123 HE2 LYS 123 -21.021 -10.458 4.625 903 2HE LYS 123 HE1 LYS 123 -20.346 -11.207 3.177 904 1HZ LYS 123 HZ1 LYS 123 -19.522 -13.022 4.527 905 2HZ LYS 123 HZ2 LYS 123 -21.189 -12.846 4.753 906 3HZ LYS 123 HZ3 LYS 123 -20.113 -12.286 5.934 907 H ASP 124 HN ASP 124 -15.206 -10.256 6.128 908 HA ASP 124 HA ASP 124 -13.431 -8.004 6.772 909 1HB ASP 124 HB2 ASP 124 -14.969 -9.692 8.737 910 2HB ASP 124 HB1 ASP 124 -13.572 -8.727 9.197 911 H ASN 125 HN ASN 125 -11.527 -8.595 6.233 912 HA ASN 125 HA ASN 125 -9.520 -9.598 6.164 913 1HB ASN 125 HB2 ASN 125 -10.438 -11.071 8.626 914 2HB ASN 125 HB1 ASN 125 -8.777 -10.844 8.090 915 1HD2 ASN 125 HD21 ASN 125 -7.801 -8.814 8.318 916 2HD2 ASN 125 HD22 ASN 125 -8.485 -7.581 9.315 917 H LYS 126 HN LYS 126 -12.245 -11.507 5.703 918 HA LYS 126 HA LYS 126 -10.943 -14.030 5.373 919 1HB LYS 126 HB2 LYS 126 -13.055 -14.805 4.479 920 2HB LYS 126 HB1 LYS 126 -13.347 -13.825 5.905 921 1HG LYS 126 HG2 LYS 126 -14.967 -12.998 4.551 922 2HG LYS 126 HG1 LYS 126 -13.646 -11.918 4.099 923 1HD LYS 126 HD2 LYS 126 -13.139 -13.394 2.185 924 2HD LYS 126 HD1 LYS 126 -14.516 -14.410 2.624 925 1HE LYS 126 HE2 LYS 126 -16.008 -12.485 2.316 926 2HE LYS 126 HE1 LYS 126 -14.625 -11.492 1.849 927 1HZ LYS 126 HZ1 LYS 126 -14.265 -13.014 -0.034 928 2HZ LYS 126 HZ2 LYS 126 -15.794 -12.295 -0.101 929 3HZ LYS 126 HZ3 LYS 126 -15.637 -13.903 0.411 930 H GLN 127 HN GLN 127 -10.715 -11.279 3.692 931 HA GLN 127 HA GLN 127 -9.796 -10.681 1.726 932 1HB GLN 127 HB2 GLN 127 -8.334 -12.644 1.900 933 2HB GLN 127 HB1 GLN 127 -9.574 -13.635 1.145 934 1HG GLN 127 HG2 GLN 127 -9.419 -12.220 -0.874 935 2HG GLN 127 HG1 GLN 127 -8.093 -11.336 -0.116 936 1HE2 GLN 127 HE21 GLN 127 -6.603 -11.964 -1.688 937 2HE2 GLN 127 HE22 GLN 127 -5.987 -13.576 -1.792 938 H GLY 128 HN GLY 128 -11.832 -9.764 1.264 939 1HA GLY 128 HA2 GLY 128 -13.178 -11.192 -0.932 940 2HA GLY 128 HA1 GLY 128 -14.008 -10.084 0.155 941 H PHE 129 HN PHE 129 -10.813 -9.608 -1.265 942 HA PHE 129 HA PHE 129 -11.649 -6.937 -1.946 943 1HB PHE 129 HB2 PHE 129 -9.364 -6.441 -2.330 944 2HB PHE 129 HB1 PHE 129 -9.377 -7.539 -0.968 945 HD1 PHE 129 HD1 PHE 129 -8.204 -9.580 -1.039 946 HD2 PHE 129 HD2 PHE 129 -8.717 -7.299 -4.592 947 HE1 PHE 129 HE1 PHE 129 -6.613 -11.048 -2.203 948 HE2 PHE 129 HE2 PHE 129 -7.125 -8.763 -5.759 949 HZ PHE 129 HZ PHE 129 -5.985 -10.567 -4.538 950 H THR 130 HN THR 130 -11.577 -6.013 -4.004 951 HA THR 130 HA THR 130 -11.266 -7.841 -6.284 952 HB THR 130 HB THR 130 -13.450 -5.757 -6.039 953 HG1 THR 130 HG1 THR 130 -13.436 -8.031 -4.885 954 1HG2 THR 130 HG21 THR 130 -12.915 -7.841 -8.161 955 2HG2 THR 130 HG22 THR 130 -12.724 -6.098 -8.342 956 3HG2 THR 130 HG23 THR 130 -14.328 -6.787 -8.093 957 HA PRO 131 HA PRO 131 -8.631 -4.472 -7.606 958 1HB PRO 131 HB2 PRO 131 -8.274 -5.307 -10.176 959 2HB PRO 131 HB1 PRO 131 -7.403 -5.982 -8.797 960 1HG PRO 131 HG2 PRO 131 -9.782 -7.065 -10.243 961 2HG PRO 131 HG1 PRO 131 -8.364 -7.926 -9.616 962 1HD PRO 131 HD2 PRO 131 -10.756 -7.893 -8.332 963 2HD PRO 131 HD1 PRO 131 -9.204 -8.007 -7.479 964 H SER 132 HN SER 132 -9.606 -2.583 -7.847 965 HA SER 132 HA SER 132 -11.321 -2.148 -10.174 966 1HB SER 132 HB2 SER 132 -12.072 -1.195 -7.399 967 2HB SER 132 HB1 SER 132 -13.027 -1.047 -8.872 968 HG SER 132 HG SER 132 -13.053 -3.394 -8.909 969 H GLY 133 HN GLY 133 -10.149 -0.698 -11.253 970 1HA GLY 133 HA2 GLY 133 -9.710 1.780 -11.208 971 2HA GLY 133 HA1 GLY 133 -8.858 1.452 -9.699 972 H THR 134 HN THR 134 -6.757 1.642 -10.029 973 HA THR 134 HA THR 134 -5.573 0.291 -12.355 974 HB THR 134 HB THR 134 -4.679 2.999 -11.335 975 HG1 THR 134 HG1 THR 134 -6.283 2.335 -13.610 976 1HG2 THR 134 HG21 THR 134 -3.411 3.103 -13.426 977 2HG2 THR 134 HG22 THR 134 -4.007 1.504 -13.876 978 3HG2 THR 134 HG23 THR 134 -2.939 1.686 -12.483 979 H THR 135 HN THR 135 -3.314 -0.325 -12.004 980 HA THR 135 HA THR 135 -2.680 -0.616 -9.166 981 HB THR 135 HB THR 135 -2.591 -2.672 -10.518 982 HG1 THR 135 HG1 THR 135 -1.146 -3.161 -9.089 983 1HG2 THR 135 HG21 THR 135 -1.915 -1.779 -12.672 984 2HG2 THR 135 HG22 THR 135 -0.780 -3.020 -12.141 985 3HG2 THR 135 HG23 THR 135 -0.347 -1.317 -12.010 986 H GLY 136 HN GLY 136 -1.550 0.965 -8.306 987 1HA GLY 136 HA2 GLY 136 0.068 2.684 -10.021 988 2HA GLY 136 HA1 GLY 136 -0.385 3.003 -8.353 989 H THR 137 HN THR 137 2.142 2.310 -10.309 990 HA THR 137 HA THR 137 3.585 0.586 -8.485 991 HB THR 137 HB THR 137 4.714 2.066 -10.864 992 HG1 THR 137 HG1 THR 137 2.936 0.885 -11.607 993 1HG2 THR 137 HG21 THR 137 6.349 1.020 -9.381 994 2HG2 THR 137 HG22 THR 137 6.279 0.172 -10.926 995 3HG2 THR 137 HG23 THR 137 5.495 -0.518 -9.506 996 H THR 138 HN THR 138 4.026 1.631 -6.594 997 HA THR 138 HA THR 138 4.927 4.368 -6.562 998 HB THR 138 HB THR 138 5.071 2.363 -4.294 999 HG1 THR 138 HG1 THR 138 2.909 2.979 -5.457 1000 1HG2 THR 138 HG21 THR 138 4.934 4.379 -2.887 1001 2HG2 THR 138 HG22 THR 138 4.962 5.382 -4.337 1002 3HG2 THR 138 HG23 THR 138 6.362 4.394 -3.921 1003 H LYS 139 HN LYS 139 6.895 4.837 -7.284 1004 HA LYS 139 HA LYS 139 8.897 2.706 -7.259 1005 1HB LYS 139 HB2 LYS 139 8.213 3.899 -9.393 1006 2HB LYS 139 HB1 LYS 139 9.013 5.325 -8.747 1007 1HG LYS 139 HG2 LYS 139 11.134 4.293 -8.821 1008 2HG LYS 139 HG1 LYS 139 10.427 2.699 -9.102 1009 1HD LYS 139 HD2 LYS 139 10.355 5.049 -10.994 1010 2HD LYS 139 HD1 LYS 139 11.339 3.594 -11.166 1011 1HE LYS 139 HE2 LYS 139 9.340 2.231 -11.355 1012 2HE LYS 139 HE1 LYS 139 8.322 3.647 -11.102 1013 1HZ LYS 139 HZ1 LYS 139 10.137 3.181 -13.406 1014 2HZ LYS 139 HZ2 LYS 139 9.214 4.582 -13.158 1015 3HZ LYS 139 HZ3 LYS 139 8.444 3.092 -13.424 1016 H LEU 140 HN LEU 140 10.107 2.671 -5.601 1017 HA LEU 140 HA LEU 140 10.971 5.186 -4.386 1018 1HB LEU 140 HB2 LEU 140 9.857 3.991 -2.744 1019 2HB LEU 140 HB1 LEU 140 10.451 2.444 -3.308 1020 HG LEU 140 HG LEU 140 12.649 2.932 -2.391 1021 1HD1 LEU 140 HD11 LEU 140 12.651 5.366 -2.640 1022 2HD1 LEU 140 HD12 LEU 140 13.005 4.906 -0.975 1023 3HD1 LEU 140 HD13 LEU 140 11.400 5.499 -1.404 1024 1HD2 LEU 140 HD21 LEU 140 11.014 1.813 -0.989 1025 2HD2 LEU 140 HD22 LEU 140 10.429 3.373 -0.411 1026 3HD2 LEU 140 HD23 LEU 140 12.069 2.849 -0.028 1027 H THR 141 HN THR 141 12.841 5.789 -5.170 1028 HA THR 141 HA THR 141 14.957 3.789 -5.615 1029 HB THR 141 HB THR 141 14.923 6.634 -6.642 1030 HG1 THR 141 HG1 THR 141 13.782 4.280 -7.702 1031 1HG2 THR 141 HG21 THR 141 17.111 5.515 -6.567 1032 2HG2 THR 141 HG22 THR 141 16.584 5.800 -8.226 1033 3HG2 THR 141 HG23 THR 141 16.459 4.186 -7.524 1034 H VAL 142 HN VAL 142 16.500 3.739 -4.076 1035 HA VAL 142 HA VAL 142 16.430 5.879 -2.096 1036 HB VAL 142 HB VAL 142 17.857 3.235 -1.941 1037 1HG1 VAL 142 HG11 VAL 142 17.161 5.244 0.188 1038 2HG1 VAL 142 HG12 VAL 142 18.773 4.922 -0.455 1039 3HG1 VAL 142 HG13 VAL 142 17.919 3.676 0.458 1040 1HG2 VAL 142 HG21 VAL 142 15.460 2.908 -2.186 1041 2HG2 VAL 142 HG22 VAL 142 15.160 4.034 -0.863 1042 3HG2 VAL 142 HG23 VAL 142 15.981 2.504 -0.550 1043 H THR 143 HN THR 143 17.768 7.485 -2.305 1044 HA THR 143 HA THR 143 20.597 6.971 -2.369 1045 HB THR 143 HB THR 143 19.378 8.796 -4.464 1046 HG1 THR 143 HG1 THR 143 19.933 6.151 -4.492 1047 1HG2 THR 143 HG21 THR 143 21.501 9.644 -3.607 1048 2HG2 THR 143 HG22 THR 143 21.698 9.042 -5.252 1049 3HG2 THR 143 HG23 THR 143 22.258 8.076 -3.886 Start of MODEL 7 1 H GLU 1 H GLU 1 -20.726 2.668 -11.776 2 HA GLU 1 HA GLU 1 -19.799 4.634 -10.739 3 1HB GLU 1 HB2 GLU 1 -21.466 5.460 -8.806 4 2HB GLU 1 HB1 GLU 1 -21.357 6.237 -10.376 5 1HG GLU 1 HG2 GLU 1 -23.671 5.933 -9.732 6 2HG GLU 1 HG1 GLU 1 -23.295 4.959 -11.150 7 H GLU 2 HN GLU 2 -18.647 2.767 -10.152 8 HA GLU 2 HA GLU 2 -19.347 1.790 -7.468 9 1HB GLU 2 HB2 GLU 2 -18.248 -0.305 -7.987 10 2HB GLU 2 HB1 GLU 2 -19.512 0.017 -9.169 11 1HG GLU 2 HG2 GLU 2 -17.820 0.845 -10.729 12 2HG GLU 2 HG1 GLU 2 -16.580 0.460 -9.540 13 H CYS 3 HN CYS 3 -17.275 1.008 -6.305 14 HA CYS 3 HA CYS 3 -15.682 3.295 -5.964 15 1HB CYS 3 HB2 CYS 3 -15.320 0.469 -4.983 16 2HB CYS 3 HB1 CYS 3 -14.241 1.785 -4.538 17 H GLN 4 HN GLN 4 -14.813 3.800 -8.008 18 HA GLN 4 HA GLN 4 -12.679 2.106 -8.997 19 1HB GLN 4 HB2 GLN 4 -14.118 3.468 -10.533 20 2HB GLN 4 HB1 GLN 4 -13.467 4.924 -9.796 21 1HG GLN 4 HG2 GLN 4 -11.210 4.195 -10.521 22 2HG GLN 4 HG1 GLN 4 -11.970 2.871 -11.400 23 1HE2 GLN 4 HE21 GLN 4 -10.367 5.000 -12.484 24 2HE2 GLN 4 HE22 GLN 4 -11.367 5.857 -13.605 25 H VAL 5 HN VAL 5 -10.913 2.060 -7.744 26 HA VAL 5 HA VAL 5 -10.179 4.453 -6.244 27 HB VAL 5 HB VAL 5 -8.936 1.694 -6.194 28 1HG1 VAL 5 HG11 VAL 5 -7.867 2.436 -4.125 29 2HG1 VAL 5 HG12 VAL 5 -8.578 4.038 -4.325 30 3HG1 VAL 5 HG13 VAL 5 -7.387 3.449 -5.488 31 1HG2 VAL 5 HG21 VAL 5 -10.912 2.984 -4.312 32 2HG2 VAL 5 HG22 VAL 5 -10.118 1.430 -4.055 33 3HG2 VAL 5 HG23 VAL 5 -11.234 1.638 -5.406 34 H ARG 6 HN ARG 6 -8.980 5.889 -7.260 35 HA ARG 6 HA ARG 6 -7.247 4.978 -9.417 36 1HB ARG 6 HB2 ARG 6 -8.107 7.767 -8.636 37 2HB ARG 6 HB1 ARG 6 -7.038 7.388 -9.981 38 1HG ARG 6 HG2 ARG 6 -8.919 5.919 -10.859 39 2HG ARG 6 HG1 ARG 6 -9.948 6.727 -9.674 40 1HD ARG 6 HD2 ARG 6 -8.345 8.106 -11.825 41 2HD ARG 6 HD1 ARG 6 -10.070 7.755 -11.912 42 HE ARG 6 HE ARG 6 -9.645 9.210 -9.586 43 1HH1 ARG 6 HH11 ARG 6 -9.277 9.668 -13.034 44 2HH1 ARG 6 HH12 ARG 6 -9.621 11.372 -12.975 45 1HH2 ARG 6 HH21 ARG 6 -10.086 11.478 -9.509 46 2HH2 ARG 6 HH22 ARG 6 -10.073 12.398 -10.985 47 H VAL 7 HN VAL 7 -5.504 4.146 -8.465 48 HA VAL 7 HA VAL 7 -3.870 5.916 -6.789 49 HB VAL 7 HB VAL 7 -3.489 2.973 -7.406 50 1HG1 VAL 7 HG11 VAL 7 -1.390 4.128 -6.926 51 2HG1 VAL 7 HG12 VAL 7 -1.817 3.015 -5.628 52 3HG1 VAL 7 HG13 VAL 7 -2.070 4.747 -5.422 53 1HG2 VAL 7 HG21 VAL 7 -5.473 3.335 -6.041 54 2HG2 VAL 7 HG22 VAL 7 -4.530 4.297 -4.904 55 3HG2 VAL 7 HG23 VAL 7 -4.194 2.576 -5.092 56 H GLY 8 HN GLY 8 -2.418 7.094 -7.878 57 1HA GLY 8 HA2 GLY 8 -1.734 6.313 -10.602 58 2HA GLY 8 HA1 GLY 8 -1.409 7.872 -9.856 59 H ASP 9 HN ASP 9 0.411 6.234 -11.372 60 HA ASP 9 HA ASP 9 2.293 5.077 -9.565 61 1HB ASP 9 HB2 ASP 9 3.767 4.890 -11.464 62 2HB ASP 9 HB1 ASP 9 2.142 4.462 -11.986 63 H LEU 10 HN LEU 10 4.175 5.934 -8.761 64 HA LEU 10 HA LEU 10 4.965 8.634 -9.375 65 1HB LEU 10 HB2 LEU 10 4.699 9.553 -7.161 66 2HB LEU 10 HB1 LEU 10 3.141 9.010 -7.747 67 HG LEU 10 HG LEU 10 4.745 7.196 -5.993 68 1HD1 LEU 10 HD11 LEU 10 3.008 9.463 -5.021 69 2HD1 LEU 10 HD12 LEU 10 4.760 9.350 -4.839 70 3HD1 LEU 10 HD13 LEU 10 3.712 8.195 -4.016 71 1HD2 LEU 10 HD21 LEU 10 1.786 7.677 -6.306 72 2HD2 LEU 10 HD22 LEU 10 2.540 6.436 -5.306 73 3HD2 LEU 10 HD23 LEU 10 2.700 6.371 -7.061 74 H THR 11 HN THR 11 7.056 9.098 -8.641 75 HA THR 11 HA THR 11 8.432 6.791 -7.452 76 HB THR 11 HB THR 11 9.269 7.359 -9.692 77 HG1 THR 11 HG1 THR 11 10.678 6.833 -7.658 78 1HG2 THR 11 HG21 THR 11 8.782 9.756 -9.708 79 2HG2 THR 11 HG22 THR 11 10.479 9.454 -10.081 80 3HG2 THR 11 HG23 THR 11 10.016 10.021 -8.477 81 H VAL 12 HN VAL 12 9.468 7.007 -5.581 82 HA VAL 12 HA VAL 12 9.540 9.685 -4.343 83 HB VAL 12 HB VAL 12 9.248 7.015 -2.940 84 1HG1 VAL 12 HG11 VAL 12 9.107 9.821 -1.848 85 2HG1 VAL 12 HG12 VAL 12 10.429 8.679 -1.603 86 3HG1 VAL 12 HG13 VAL 12 8.833 8.338 -0.934 87 1HG2 VAL 12 HG21 VAL 12 7.199 9.174 -3.425 88 2HG2 VAL 12 HG22 VAL 12 6.962 7.746 -2.419 89 3HG2 VAL 12 HG23 VAL 12 7.217 7.570 -4.155 90 H ALA 13 HN ALA 13 11.526 10.395 -3.822 91 HA ALA 13 HA ALA 13 13.737 8.455 -3.924 92 1HB ALA 13 HB1 ALA 13 13.778 11.446 -4.313 93 2HB ALA 13 HB2 ALA 13 13.884 10.227 -5.582 94 3HB ALA 13 HB3 ALA 13 15.182 10.382 -4.397 95 H LYS 14 HN LYS 14 14.134 7.748 -1.922 96 HA LYS 14 HA LYS 14 15.192 9.429 0.075 97 1HB LYS 14 HB2 LYS 14 12.301 9.021 0.156 98 2HB LYS 14 HB1 LYS 14 13.096 8.488 1.631 99 1HG LYS 14 HG2 LYS 14 13.886 10.618 2.125 100 2HG LYS 14 HG1 LYS 14 13.671 11.187 0.468 101 1HD LYS 14 HD2 LYS 14 11.413 10.436 2.323 102 2HD LYS 14 HD1 LYS 14 11.993 12.085 2.073 103 1HE LYS 14 HE2 LYS 14 10.868 10.264 -0.056 104 2HE LYS 14 HE1 LYS 14 10.016 11.605 0.709 105 1HZ LYS 14 HZ1 LYS 14 12.516 11.884 -0.877 106 2HZ LYS 14 HZ2 LYS 14 11.585 13.143 -0.228 107 3HZ LYS 14 HZ3 LYS 14 10.958 12.179 -1.474 108 H THR 15 HN THR 15 15.072 8.095 2.309 109 HA THR 15 HA THR 15 16.145 5.457 1.607 110 HB THR 15 HB THR 15 17.234 5.588 3.856 111 HG1 THR 15 HG1 THR 15 17.147 7.594 4.947 112 1HG2 THR 15 HG21 THR 15 17.807 7.934 2.038 113 2HG2 THR 15 HG22 THR 15 18.451 6.304 1.844 114 3HG2 THR 15 HG23 THR 15 18.905 7.270 3.247 115 H ARG 16 HN ARG 16 15.836 3.743 3.325 116 HA ARG 16 HA ARG 16 13.049 3.718 4.204 117 1HB ARG 16 HB2 ARG 16 15.133 1.532 4.492 118 2HB ARG 16 HB1 ARG 16 13.411 1.383 4.849 119 1HG ARG 16 HG2 ARG 16 13.647 0.357 2.777 120 2HG ARG 16 HG1 ARG 16 13.041 1.965 2.386 121 1HD ARG 16 HD2 ARG 16 15.462 2.642 2.054 122 2HD ARG 16 HD1 ARG 16 15.848 0.926 2.115 123 HE ARG 16 HE ARG 16 14.430 0.659 0.147 124 1HH1 ARG 16 HH11 ARG 16 15.617 3.835 0.935 125 2HH1 ARG 16 HH12 ARG 16 15.363 4.492 -0.647 126 1HH2 ARG 16 HH21 ARG 16 14.121 1.498 -1.989 127 2HH2 ARG 16 HH22 ARG 16 14.537 3.145 -2.320 128 H GLY 17 HN GLY 17 16.044 4.629 5.322 129 1HA GLY 17 HA2 GLY 17 15.826 3.935 8.077 130 2HA GLY 17 HA1 GLY 17 16.903 5.144 7.390 131 H GLN 18 HN GLN 18 14.518 6.439 6.103 132 HA GLN 18 HA GLN 18 13.764 8.339 8.004 133 1HB GLN 18 HB2 GLN 18 12.159 7.367 5.629 134 2HB GLN 18 HB1 GLN 18 11.900 8.871 6.496 135 1HG GLN 18 HG2 GLN 18 14.301 8.143 4.841 136 2HG GLN 18 HG1 GLN 18 13.016 9.280 4.410 137 1HE2 GLN 18 HE21 GLN 18 12.868 11.248 5.596 138 2HE2 GLN 18 HE22 GLN 18 14.253 11.897 6.418 139 H LEU 19 HN LEU 19 12.391 5.275 7.064 140 HA LEU 19 HA LEU 19 9.983 5.641 8.583 141 1HB LEU 19 HB2 LEU 19 10.822 2.992 7.498 142 2HB LEU 19 HB1 LEU 19 9.222 3.707 7.592 143 HG LEU 19 HG LEU 19 11.368 4.569 5.649 144 1HD1 LEU 19 HD11 LEU 19 10.028 3.439 3.955 145 2HD1 LEU 19 HD12 LEU 19 8.926 2.860 5.201 146 3HD1 LEU 19 HD13 LEU 19 10.598 2.302 5.176 147 1HD2 LEU 19 HD21 LEU 19 8.451 5.287 5.878 148 2HD2 LEU 19 HD22 LEU 19 9.514 5.754 4.552 149 3HD2 LEU 19 HD23 LEU 19 9.822 6.353 6.183 150 H THR 20 HN THR 20 10.421 5.740 10.704 151 HA THR 20 HA THR 20 11.764 3.478 11.974 152 HB THR 20 HB THR 20 11.345 5.116 14.036 153 HG1 THR 20 HG1 THR 20 11.936 7.217 12.443 154 1HG2 THR 20 HG21 THR 20 13.542 4.364 13.294 155 2HG2 THR 20 HG22 THR 20 13.570 6.095 13.634 156 3HG2 THR 20 HG23 THR 20 13.510 5.524 11.967 157 H ASP 21 HN ASP 21 9.879 2.232 11.329 158 HA ASP 21 HA ASP 21 7.908 1.192 11.633 159 1HB ASP 21 HB2 ASP 21 8.053 2.587 14.302 160 2HB ASP 21 HB1 ASP 21 6.689 1.570 13.852 161 H ALA 22 HN ALA 22 6.788 3.983 13.469 162 HA ALA 22 HA ALA 22 4.772 4.394 11.403 163 1HB ALA 22 HB1 ALA 22 4.014 4.179 13.710 164 2HB ALA 22 HB2 ALA 22 3.615 5.765 13.050 165 3HB ALA 22 HB3 ALA 22 4.972 5.590 14.163 166 H ALA 23 HN ALA 23 6.713 5.187 10.110 167 HA ALA 23 HA ALA 23 6.558 8.106 10.141 168 1HB ALA 23 HB1 ALA 23 8.939 8.353 9.702 169 2HB ALA 23 HB2 ALA 23 9.163 6.609 9.837 170 3HB ALA 23 HB3 ALA 23 8.680 7.548 11.250 171 HA PRO 24 HA PRO 24 5.887 6.877 5.873 172 1HB PRO 24 HB2 PRO 24 4.302 8.898 5.211 173 2HB PRO 24 HB1 PRO 24 3.752 7.660 6.346 174 1HG PRO 24 HG2 PRO 24 4.727 10.430 6.893 175 2HG PRO 24 HG1 PRO 24 3.417 9.525 7.673 176 1HD PRO 24 HD2 PRO 24 6.032 9.800 8.647 177 2HD PRO 24 HD1 PRO 24 4.841 8.606 9.186 178 H ILE 25 HN ILE 25 6.691 7.498 3.892 179 HA ILE 25 HA ILE 25 8.250 9.998 3.830 180 HB ILE 25 HB ILE 25 9.437 8.790 1.869 181 1HG1 ILE 25 HG12 ILE 25 8.419 6.441 3.465 182 2HG1 ILE 25 HG11 ILE 25 7.958 6.865 1.821 183 1HG2 ILE 25 HG21 ILE 25 10.510 9.509 3.925 184 2HG2 ILE 25 HG22 ILE 25 11.120 7.933 3.415 185 3HG2 ILE 25 HG23 ILE 25 9.956 8.044 4.734 186 1HD1 ILE 25 HD11 ILE 25 10.718 6.070 2.704 187 2HD1 ILE 25 HD12 ILE 25 10.229 6.470 1.058 188 3HD1 ILE 25 HD13 ILE 25 9.566 5.042 1.852 189 H GLY 26 HN GLY 26 6.569 7.761 1.593 190 1HA GLY 26 HA2 GLY 26 5.944 10.130 -0.051 191 2HA GLY 26 HA1 GLY 26 6.166 8.511 -0.695 192 HA PRO 27 HA PRO 27 1.711 8.914 1.356 193 1HB PRO 27 HB2 PRO 27 1.327 11.755 0.640 194 2HB PRO 27 HB1 PRO 27 0.801 10.875 2.077 195 1HG PRO 27 HG2 PRO 27 2.825 12.626 2.173 196 2HG PRO 27 HG1 PRO 27 2.822 11.145 3.150 197 1HD PRO 27 HD2 PRO 27 4.328 11.759 0.636 198 2HD PRO 27 HD1 PRO 27 4.834 10.827 2.058 199 H VAL 28 HN VAL 28 0.441 8.024 -0.107 200 HA VAL 28 HA VAL 28 0.632 8.896 -2.897 201 HB VAL 28 HB VAL 28 -0.652 6.397 -1.773 202 1HG1 VAL 28 HG11 VAL 28 0.044 7.157 -4.605 203 2HG1 VAL 28 HG12 VAL 28 -1.579 7.057 -3.922 204 3HG1 VAL 28 HG13 VAL 28 -0.600 5.600 -4.086 205 1HG2 VAL 28 HG21 VAL 28 1.321 5.210 -2.594 206 2HG2 VAL 28 HG22 VAL 28 1.754 6.400 -1.366 207 3HG2 VAL 28 HG23 VAL 28 2.049 6.745 -3.070 208 H THR 29 HN THR 29 -0.956 10.016 -3.809 209 HA THR 29 HA THR 29 -3.314 10.705 -2.387 210 HB THR 29 HB THR 29 -2.762 11.146 -5.321 211 HG1 THR 29 HG1 THR 29 -0.967 11.904 -4.131 212 1HG2 THR 29 HG21 THR 29 -4.330 12.693 -3.276 213 2HG2 THR 29 HG22 THR 29 -5.005 11.682 -4.551 214 3HG2 THR 29 HG23 THR 29 -4.115 13.147 -4.965 215 H VAL 30 HN VAL 30 -4.718 9.073 -2.048 216 HA VAL 30 HA VAL 30 -5.430 7.316 -4.299 217 HB VAL 30 HB VAL 30 -5.973 6.994 -1.340 218 1HG1 VAL 30 HG11 VAL 30 -6.708 4.727 -1.927 219 2HG1 VAL 30 HG12 VAL 30 -6.505 5.108 -3.638 220 3HG1 VAL 30 HG13 VAL 30 -7.720 5.958 -2.683 221 1HG2 VAL 30 HG21 VAL 30 -4.011 5.608 -3.170 222 2HG2 VAL 30 HG22 VAL 30 -4.345 5.141 -1.503 223 3HG2 VAL 30 HG23 VAL 30 -3.623 6.713 -1.851 224 H GLN 31 HN GLN 31 -7.183 7.918 -5.372 225 HA GLN 31 HA GLN 31 -9.354 9.181 -3.852 226 1HB GLN 31 HB2 GLN 31 -8.508 10.728 -5.477 227 2HB GLN 31 HB1 GLN 31 -8.578 9.516 -6.749 228 1HG GLN 31 HG2 GLN 31 -10.925 9.575 -6.823 229 2HG GLN 31 HG1 GLN 31 -11.029 10.450 -5.298 230 1HE2 GLN 31 HE21 GLN 31 -8.667 11.313 -7.701 231 2HE2 GLN 31 HE22 GLN 31 -9.411 12.810 -8.174 232 H ALA 32 HN ALA 32 -10.755 7.664 -3.345 233 HA ALA 32 HA ALA 32 -11.488 5.598 -5.269 234 1HB ALA 32 HB1 ALA 32 -12.741 4.598 -3.428 235 2HB ALA 32 HB2 ALA 32 -12.370 5.987 -2.407 236 3HB ALA 32 HB3 ALA 32 -11.075 4.920 -2.948 237 H LEU 33 HN LEU 33 -12.958 6.166 -6.717 238 HA LEU 33 HA LEU 33 -14.957 8.197 -6.000 239 1HB LEU 33 HB2 LEU 33 -13.366 8.470 -7.977 240 2HB LEU 33 HB1 LEU 33 -14.257 7.177 -8.752 241 HG LEU 33 HG LEU 33 -14.834 9.561 -9.418 242 1HD1 LEU 33 HD11 LEU 33 -16.257 7.674 -10.000 243 2HD1 LEU 33 HD12 LEU 33 -17.223 9.095 -9.602 244 3HD1 LEU 33 HD13 LEU 33 -17.060 7.783 -8.434 245 1HD2 LEU 33 HD21 LEU 33 -14.847 10.553 -7.203 246 2HD2 LEU 33 HD22 LEU 33 -16.193 9.514 -6.729 247 3HD2 LEU 33 HD23 LEU 33 -16.421 10.740 -7.977 248 H GLY 34 HN GLY 34 -17.046 7.630 -5.776 249 1HA GLY 34 HA2 GLY 34 -19.037 6.617 -6.532 250 2HA GLY 34 HA1 GLY 34 -18.077 5.407 -7.365 251 H CYS 35 HN CYS 35 -17.512 6.236 -4.013 252 HA CYS 35 HA CYS 35 -18.225 3.498 -3.325 253 1HB CYS 35 HB2 CYS 35 -16.600 5.596 -1.919 254 2HB CYS 35 HB1 CYS 35 -17.145 4.141 -1.090 255 H ASN 36 HN ASN 36 -18.554 6.519 -1.443 256 HA ASN 36 HA ASN 36 -20.273 7.394 -0.256 257 1HB ASN 36 HB2 ASN 36 -21.659 7.204 -2.233 258 2HB ASN 36 HB1 ASN 36 -21.983 5.508 -1.891 259 1HD2 ASN 36 HD21 ASN 36 -23.503 4.966 -0.362 260 2HD2 ASN 36 HD22 ASN 36 -24.552 6.130 0.375 261 H ALA 37 HN ALA 37 -20.484 3.851 -0.480 262 HA ALA 37 HA ALA 37 -20.334 3.676 2.401 263 1HB ALA 37 HB1 ALA 37 -22.331 2.277 2.641 264 2HB ALA 37 HB2 ALA 37 -22.730 2.563 0.946 265 3HB ALA 37 HB3 ALA 37 -22.737 3.903 2.093 266 H ARG 38 HN ARG 38 -18.324 2.807 1.617 267 HA ARG 38 HA ARG 38 -18.419 -0.068 1.308 268 1HB ARG 38 HB2 ARG 38 -18.605 0.883 -1.018 269 2HB ARG 38 HB1 ARG 38 -17.028 1.621 -0.775 270 1HG ARG 38 HG2 ARG 38 -16.499 -0.287 -1.942 271 2HG ARG 38 HG1 ARG 38 -16.251 -0.801 -0.273 272 1HD ARG 38 HD2 ARG 38 -18.783 -1.263 -1.840 273 2HD ARG 38 HD1 ARG 38 -17.484 -2.442 -1.692 274 HE ARG 38 HE ARG 38 -17.960 -2.247 0.806 275 1HH1 ARG 38 HH11 ARG 38 -20.386 -1.777 -1.663 276 2HH1 ARG 38 HH12 ARG 38 -21.689 -2.383 -0.679 277 1HH2 ARG 38 HH21 ARG 38 -19.663 -3.016 2.119 278 2HH2 ARG 38 HH22 ARG 38 -21.274 -3.080 1.477 279 H GLN 39 HN GLN 39 -16.472 -1.046 1.974 280 HA GLN 39 HA GLN 39 -14.487 0.688 3.164 281 1HB GLN 39 HB2 GLN 39 -14.593 -2.342 2.992 282 2HB GLN 39 HB1 GLN 39 -13.465 -1.400 3.962 283 1HG GLN 39 HG2 GLN 39 -15.240 -0.550 5.335 284 2HG GLN 39 HG1 GLN 39 -16.454 -1.302 4.308 285 1HE2 GLN 39 HE21 GLN 39 -14.944 -3.764 4.013 286 2HE2 GLN 39 HE22 GLN 39 -15.095 -4.606 5.516 287 H VAL 40 HN VAL 40 -12.464 1.054 2.339 288 HA VAL 40 HA VAL 40 -12.000 0.068 -0.399 289 HB VAL 40 HB VAL 40 -11.095 2.657 0.882 290 1HG1 VAL 40 HG11 VAL 40 -10.165 3.225 -1.312 291 2HG1 VAL 40 HG12 VAL 40 -10.596 1.624 -1.911 292 3HG1 VAL 40 HG13 VAL 40 -9.386 1.793 -0.638 293 1HG2 VAL 40 HG21 VAL 40 -12.531 3.713 -0.808 294 2HG2 VAL 40 HG22 VAL 40 -13.452 2.665 0.271 295 3HG2 VAL 40 HG23 VAL 40 -13.047 2.118 -1.358 296 H ALA 41 HN ALA 41 -10.209 -1.113 -0.742 297 HA ALA 41 HA ALA 41 -8.309 -1.352 1.478 298 1HB ALA 41 HB1 ALA 41 -9.175 -3.508 -0.437 299 2HB ALA 41 HB2 ALA 41 -9.812 -3.300 1.191 300 3HB ALA 41 HB3 ALA 41 -8.109 -3.696 0.958 301 H LEU 42 HN LEU 42 -6.158 -1.733 0.962 302 HA LEU 42 HA LEU 42 -5.380 -1.039 -1.775 303 1HB LEU 42 HB2 LEU 42 -3.667 -1.164 0.706 304 2HB LEU 42 HB1 LEU 42 -3.234 -0.455 -0.840 305 HG LEU 42 HG LEU 42 -5.467 0.579 0.899 306 1HD1 LEU 42 HD11 LEU 42 -3.361 0.784 2.079 307 2HD1 LEU 42 HD12 LEU 42 -3.925 2.364 1.535 308 3HD1 LEU 42 HD13 LEU 42 -2.627 1.544 0.668 309 1HD2 LEU 42 HD21 LEU 42 -5.296 2.564 -0.508 310 2HD2 LEU 42 HD22 LEU 42 -5.651 1.135 -1.478 311 3HD2 LEU 42 HD23 LEU 42 -4.017 1.797 -1.449 312 H LYS 43 HN LYS 43 -5.270 -2.840 -2.962 313 HA LYS 43 HA LYS 43 -4.045 -5.241 -1.813 314 1HB LYS 43 HB2 LYS 43 -5.826 -4.761 -4.174 315 2HB LYS 43 HB1 LYS 43 -4.787 -6.170 -4.162 316 1HG LYS 43 HG2 LYS 43 -7.036 -6.702 -3.393 317 2HG LYS 43 HG1 LYS 43 -5.840 -6.966 -2.126 318 1HD LYS 43 HD2 LYS 43 -7.829 -5.919 -1.215 319 2HD LYS 43 HD1 LYS 43 -6.460 -4.815 -1.120 320 1HE LYS 43 HE2 LYS 43 -8.338 -3.560 -1.833 321 2HE LYS 43 HE1 LYS 43 -7.275 -3.752 -3.224 322 1HZ LYS 43 HZ1 LYS 43 -9.540 -4.099 -3.881 323 2HZ LYS 43 HZ2 LYS 43 -9.774 -5.258 -2.674 324 3HZ LYS 43 HZ3 LYS 43 -8.727 -5.582 -3.966 325 H ALA 44 HN ALA 44 -1.998 -5.683 -2.243 326 HA ALA 44 HA ALA 44 -0.580 -4.005 -4.124 327 1HB ALA 44 HB1 ALA 44 1.424 -5.167 -3.256 328 2HB ALA 44 HB2 ALA 44 0.368 -6.170 -2.258 329 3HB ALA 44 HB3 ALA 44 0.440 -4.430 -1.991 330 H ASP 45 HN ASP 45 0.859 -4.894 -5.748 331 HA ASP 45 HA ASP 45 -0.450 -7.038 -7.207 332 1HB ASP 45 HB2 ASP 45 0.247 -4.939 -8.352 333 2HB ASP 45 HB1 ASP 45 1.925 -5.332 -7.993 334 H THR 46 HN THR 46 0.765 -8.852 -8.072 335 HA THR 46 HA THR 46 1.906 -10.305 -6.010 336 HB THR 46 HB THR 46 0.791 -11.230 -8.061 337 HG1 THR 46 HG1 THR 46 3.338 -12.414 -7.558 338 1HG2 THR 46 HG21 THR 46 2.051 -9.977 -9.752 339 2HG2 THR 46 HG22 THR 46 2.163 -11.715 -10.017 340 3HG2 THR 46 HG23 THR 46 3.517 -10.847 -9.299 341 H ASP 47 HN ASP 47 3.485 -8.115 -8.187 342 HA ASP 47 HA ASP 47 6.106 -9.086 -8.133 343 1HB ASP 47 HB2 ASP 47 4.878 -6.394 -8.459 344 2HB ASP 47 HB1 ASP 47 6.605 -6.465 -8.123 345 H ASN 48 HN ASN 48 4.310 -7.249 -5.751 346 HA ASN 48 HA ASN 48 6.545 -7.562 -3.859 347 1HB ASN 48 HB2 ASN 48 6.040 -5.345 -2.947 348 2HB ASN 48 HB1 ASN 48 6.435 -5.218 -4.658 349 1HD2 ASN 48 HD21 ASN 48 4.062 -4.746 -2.245 350 2HD2 ASN 48 HD22 ASN 48 2.850 -4.052 -3.265 351 H PHE 49 HN PHE 49 3.878 -8.883 -4.512 352 HA PHE 49 HA PHE 49 2.744 -8.869 -1.796 353 1HB PHE 49 HB2 PHE 49 1.372 -7.494 -3.331 354 2HB PHE 49 HB1 PHE 49 1.218 -8.861 -4.407 355 HD1 PHE 49 HD1 PHE 49 0.319 -7.649 -1.006 356 HD2 PHE 49 HD2 PHE 49 -0.547 -10.334 -4.199 357 HE1 PHE 49 HE1 PHE 49 -1.840 -8.175 0.018 358 HE2 PHE 49 HE2 PHE 49 -2.705 -10.879 -3.154 359 HZ PHE 49 HZ PHE 49 -3.365 -9.786 -1.046 360 H GLU 50 HN GLU 50 3.444 -10.832 -1.155 361 HA GLU 50 HA GLU 50 3.316 -13.068 -3.022 362 1HB GLU 50 HB2 GLU 50 4.578 -12.744 -0.304 363 2HB GLU 50 HB1 GLU 50 4.495 -14.292 -1.135 364 1HG GLU 50 HG2 GLU 50 5.781 -11.836 -2.299 365 2HG GLU 50 HG1 GLU 50 6.654 -13.069 -1.389 366 H GLN 51 HN GLN 51 1.190 -13.525 -3.161 367 HA GLN 51 HA GLN 51 -0.702 -14.679 -2.712 368 1HB GLN 51 HB2 GLN 51 0.637 -15.455 -0.119 369 2HB GLN 51 HB1 GLN 51 -0.803 -16.199 -0.799 370 1HG GLN 51 HG2 GLN 51 1.965 -16.230 -1.980 371 2HG GLN 51 HG1 GLN 51 1.127 -17.579 -1.217 372 1HE2 GLN 51 HE21 GLN 51 1.394 -15.598 -4.058 373 2HE2 GLN 51 HE22 GLN 51 0.389 -16.573 -5.076 374 H GLY 52 HN GLY 52 0.436 -13.036 0.226 375 1HA GLY 52 HA2 GLY 52 -1.782 -11.265 0.260 376 2HA GLY 52 HA1 GLY 52 -2.002 -12.551 1.445 377 H LYS 53 HN LYS 53 1.092 -11.228 0.509 378 HA LYS 53 HA LYS 53 1.184 -9.528 2.896 379 1HB LYS 53 HB2 LYS 53 3.386 -11.406 2.001 380 2HB LYS 53 HB1 LYS 53 3.537 -10.214 3.279 381 1HG LYS 53 HG2 LYS 53 1.624 -12.535 3.328 382 2HG LYS 53 HG1 LYS 53 3.206 -12.511 4.111 383 1HD LYS 53 HD2 LYS 53 2.538 -10.716 5.548 384 2HD LYS 53 HD1 LYS 53 1.018 -10.519 4.674 385 1HE LYS 53 HE2 LYS 53 1.842 -12.932 6.285 386 2HE LYS 53 HE1 LYS 53 0.677 -11.703 6.776 387 1HZ LYS 53 HZ1 LYS 53 -0.600 -13.453 5.952 388 2HZ LYS 53 HZ2 LYS 53 0.426 -13.719 4.629 389 3HZ LYS 53 HZ3 LYS 53 -0.564 -12.342 4.669 390 H PHE 54 HN PHE 54 2.003 -7.525 2.390 391 HA PHE 54 HA PHE 54 3.386 -7.374 -0.181 392 1HB PHE 54 HB2 PHE 54 2.566 -4.997 -0.338 393 2HB PHE 54 HB1 PHE 54 1.375 -6.265 -0.551 394 HD1 PHE 54 HD1 PHE 54 -0.702 -5.634 0.244 395 HD2 PHE 54 HD2 PHE 54 2.783 -4.455 2.383 396 HE1 PHE 54 HE1 PHE 54 -2.112 -4.592 1.967 397 HE2 PHE 54 HE2 PHE 54 1.375 -3.404 4.106 398 HZ PHE 54 HZ PHE 54 -1.171 -3.367 3.747 399 H PHE 55 HN PHE 55 5.190 -6.379 -0.394 400 HA PHE 55 HA PHE 55 6.313 -4.785 1.781 401 1HB PHE 55 HB2 PHE 55 8.478 -6.003 1.562 402 2HB PHE 55 HB1 PHE 55 7.203 -7.032 2.195 403 HD1 PHE 55 HD1 PHE 55 9.631 -6.556 -0.411 404 HD2 PHE 55 HD2 PHE 55 6.083 -8.652 0.645 405 HE1 PHE 55 HE1 PHE 55 10.082 -8.195 -2.188 406 HE2 PHE 55 HE2 PHE 55 6.530 -10.301 -1.132 407 HZ PHE 55 HZ PHE 55 8.552 -10.046 -2.567 408 H LEU 56 HN LEU 56 8.617 -4.027 0.845 409 HA LEU 56 HA LEU 56 8.157 -3.172 -1.930 410 1HB LEU 56 HB2 LEU 56 10.369 -2.194 -0.143 411 2HB LEU 56 HB1 LEU 56 9.685 -1.411 -1.553 412 HG LEU 56 HG LEU 56 8.474 -1.636 1.194 413 1HD1 LEU 56 HD11 LEU 56 9.234 0.720 -0.517 414 2HD1 LEU 56 HD12 LEU 56 10.112 0.133 0.894 415 3HD1 LEU 56 HD13 LEU 56 8.490 0.800 1.079 416 1HD2 LEU 56 HD21 LEU 56 6.721 -2.041 -0.448 417 2HD2 LEU 56 HD22 LEU 56 7.188 -0.578 -1.315 418 3HD2 LEU 56 HD23 LEU 56 6.527 -0.463 0.315 419 H ILE 57 HN ILE 57 9.355 -4.071 -3.544 420 HA ILE 57 HA ILE 57 11.507 -5.879 -2.682 421 HB ILE 57 HB ILE 57 9.677 -7.027 -3.827 422 1HG1 ILE 57 HG12 ILE 57 11.011 -8.151 -5.607 423 2HG1 ILE 57 HG11 ILE 57 12.229 -6.893 -5.447 424 1HG2 ILE 57 HG21 ILE 57 10.337 -5.295 -6.202 425 2HG2 ILE 57 HG22 ILE 57 8.874 -5.199 -5.220 426 3HG2 ILE 57 HG23 ILE 57 9.197 -6.641 -6.184 427 1HD1 ILE 57 HD11 ILE 57 12.878 -8.902 -4.256 428 2HD1 ILE 57 HD12 ILE 57 11.400 -8.828 -3.296 429 3HD1 ILE 57 HD13 ILE 57 12.622 -7.566 -3.134 430 H SER 58 HN SER 58 13.500 -5.672 -3.420 431 HA SER 58 HA SER 58 14.195 -3.195 -4.724 432 1HB SER 58 HB2 SER 58 15.513 -3.857 -2.805 433 2HB SER 58 HB1 SER 58 15.864 -5.424 -3.529 434 HG SER 58 HG SER 58 17.303 -3.260 -3.725 435 H ASP 59 HN ASP 59 15.352 -3.006 -6.638 436 HA ASP 59 HA ASP 59 14.867 -4.831 -8.719 437 1HB ASP 59 HB2 ASP 59 15.287 -2.550 -9.273 438 2HB ASP 59 HB1 ASP 59 16.820 -2.550 -8.410 439 H ASN 60 HN ASN 60 17.384 -4.589 -6.353 440 HA ASN 60 HA ASN 60 19.214 -6.387 -7.633 441 1HB ASN 60 HB2 ASN 60 19.005 -5.497 -4.748 442 2HB ASN 60 HB1 ASN 60 20.335 -6.439 -5.413 443 1HD2 ASN 60 HD21 ASN 60 21.765 -5.461 -6.859 444 2HD2 ASN 60 HD22 ASN 60 21.901 -3.740 -6.973 445 H ASN 61 HN ASN 61 16.291 -6.755 -6.024 446 HA ASN 61 HA ASN 61 15.048 -8.519 -5.338 447 1HB ASN 61 HB2 ASN 61 17.087 -10.084 -6.927 448 2HB ASN 61 HB1 ASN 61 15.614 -10.773 -6.259 449 1HD2 ASN 61 HD21 ASN 61 14.059 -8.335 -6.841 450 2HD2 ASN 61 HD22 ASN 61 13.777 -8.371 -8.549 451 H ARG 62 HN ARG 62 17.507 -7.677 -3.744 452 HA ARG 62 HA ARG 62 18.164 -10.189 -2.407 453 1HB ARG 62 HB2 ARG 62 19.350 -7.423 -2.264 454 2HB ARG 62 HB1 ARG 62 19.793 -8.694 -1.135 455 1HG ARG 62 HG2 ARG 62 20.017 -9.081 -4.098 456 2HG ARG 62 HG1 ARG 62 21.296 -8.309 -3.160 457 1HD ARG 62 HD2 ARG 62 21.762 -10.675 -3.441 458 2HD ARG 62 HD1 ARG 62 21.455 -10.303 -1.747 459 HE ARG 62 HE ARG 62 19.071 -11.137 -2.393 460 1HH1 ARG 62 HH11 ARG 62 22.126 -12.437 -3.498 461 2HH1 ARG 62 HH12 ARG 62 21.515 -14.058 -3.678 462 1HH2 ARG 62 HH21 ARG 62 18.265 -13.256 -2.603 463 2HH2 ARG 62 HH22 ARG 62 19.318 -14.514 -3.177 464 H ASP 63 HN ASP 63 17.528 -6.888 -1.268 465 HA ASP 63 HA ASP 63 16.339 -8.078 1.133 466 1HB ASP 63 HB2 ASP 63 17.845 -5.568 0.612 467 2HB ASP 63 HB1 ASP 63 16.627 -5.546 1.886 468 H LYS 64 HN LYS 64 14.555 -7.003 2.146 469 HA LYS 64 HA LYS 64 12.844 -5.440 0.391 470 1HB LYS 64 HB2 LYS 64 10.908 -6.968 0.904 471 2HB LYS 64 HB1 LYS 64 12.106 -7.622 -0.195 472 1HG LYS 64 HG2 LYS 64 11.585 -9.409 1.182 473 2HG LYS 64 HG1 LYS 64 13.084 -8.791 1.869 474 1HD LYS 64 HD2 LYS 64 10.753 -7.524 3.057 475 2HD LYS 64 HD1 LYS 64 10.708 -9.284 3.222 476 1HE LYS 64 HE2 LYS 64 12.925 -9.279 4.214 477 2HE LYS 64 HE1 LYS 64 13.043 -7.535 3.993 478 1HZ LYS 64 HZ1 LYS 64 11.149 -8.969 5.781 479 2HZ LYS 64 HZ2 LYS 64 11.133 -7.295 5.510 480 3HZ LYS 64 HZ3 LYS 64 12.471 -8.020 6.250 481 H LEU 65 HN LEU 65 10.756 -4.875 1.645 482 HA LEU 65 HA LEU 65 10.932 -5.051 4.506 483 1HB LEU 65 HB2 LEU 65 10.875 -2.687 4.971 484 2HB LEU 65 HB1 LEU 65 12.323 -3.106 4.085 485 HG LEU 65 HG LEU 65 9.979 -2.038 2.572 486 1HD1 LEU 65 HD11 LEU 65 10.764 0.240 2.958 487 2HD1 LEU 65 HD12 LEU 65 11.966 -0.360 4.100 488 3HD1 LEU 65 HD13 LEU 65 10.248 -0.514 4.470 489 1HD2 LEU 65 HD21 LEU 65 11.752 -1.131 1.159 490 2HD2 LEU 65 HD22 LEU 65 11.941 -2.872 1.370 491 3HD2 LEU 65 HD23 LEU 65 12.968 -1.756 2.271 492 H TYR 66 HN TYR 66 8.950 -5.372 5.254 493 HA TYR 66 HA TYR 66 6.674 -5.048 3.542 494 1HB TYR 66 HB2 TYR 66 6.841 -5.714 6.493 495 2HB TYR 66 HB1 TYR 66 5.369 -5.775 5.530 496 HD1 TYR 66 HD1 TYR 66 8.644 -7.351 6.111 497 HD2 TYR 66 HD2 TYR 66 4.940 -7.612 4.027 498 HE1 TYR 66 HE1 TYR 66 9.162 -9.671 5.490 499 HE2 TYR 66 HE2 TYR 66 5.451 -9.934 3.405 500 HH TYR 66 HH TYR 66 7.429 -11.378 3.126 501 H VAL 67 HN VAL 67 4.978 -3.554 3.774 502 HA VAL 67 HA VAL 67 5.700 -1.178 5.354 503 HB VAL 67 HB VAL 67 4.664 0.200 3.546 504 1HG1 VAL 67 HG11 VAL 67 7.061 0.069 3.801 505 2HG1 VAL 67 HG12 VAL 67 6.648 0.096 2.086 506 3HG1 VAL 67 HG13 VAL 67 7.110 -1.421 2.859 507 1HG2 VAL 67 HG21 VAL 67 4.846 -2.380 1.991 508 2HG2 VAL 67 HG22 VAL 67 4.514 -0.795 1.297 509 3HG2 VAL 67 HG23 VAL 67 3.367 -1.521 2.424 510 H ASN 68 HN ASN 68 4.022 0.152 6.029 511 HA ASN 68 HA ASN 68 1.324 -1.021 5.872 512 1HB ASN 68 HB2 ASN 68 2.762 0.330 8.131 513 2HB ASN 68 HB1 ASN 68 1.020 0.532 8.000 514 1HD2 ASN 68 HD21 ASN 68 2.540 -2.416 6.956 515 2HD2 ASN 68 HD22 ASN 68 1.978 -3.402 8.268 516 H ILE 69 HN ILE 69 0.196 0.101 4.446 517 HA ILE 69 HA ILE 69 0.891 2.889 3.964 518 HB ILE 69 HB ILE 69 -1.341 1.692 2.442 519 1HG1 ILE 69 HG12 ILE 69 1.507 0.756 2.031 520 2HG1 ILE 69 HG11 ILE 69 0.198 -0.239 2.655 521 1HG2 ILE 69 HG21 ILE 69 1.143 3.224 1.683 522 2HG2 ILE 69 HG22 ILE 69 -0.464 3.904 1.941 523 3HG2 ILE 69 HG23 ILE 69 -0.175 2.811 0.588 524 1HD1 ILE 69 HD11 ILE 69 -0.979 -0.014 0.531 525 2HD1 ILE 69 HD12 ILE 69 0.629 -0.703 0.314 526 3HD1 ILE 69 HD13 ILE 69 0.332 0.988 -0.090 527 H ARG 70 HN ARG 70 0.069 3.854 5.817 528 HA ARG 70 HA ARG 70 -2.827 3.554 6.251 529 1HB ARG 70 HB2 ARG 70 -1.379 2.727 8.114 530 2HB ARG 70 HB1 ARG 70 -0.720 4.349 8.281 531 1HG ARG 70 HG2 ARG 70 -2.831 5.215 8.973 532 2HG ARG 70 HG1 ARG 70 -3.644 3.701 8.576 533 1HD ARG 70 HD2 ARG 70 -3.356 3.824 10.953 534 2HD ARG 70 HD1 ARG 70 -2.292 2.573 10.317 535 HE ARG 70 HE ARG 70 -0.999 5.120 10.584 536 1HH1 ARG 70 HH11 ARG 70 -1.956 2.221 12.306 537 2HH1 ARG 70 HH12 ARG 70 -0.722 2.388 13.525 538 1HH2 ARG 70 HH21 ARG 70 0.612 5.347 12.170 539 2HH2 ARG 70 HH22 ARG 70 0.759 4.159 13.437 540 HA PRO 71 HA PRO 71 -3.581 7.757 5.094 541 1HB PRO 71 HB2 PRO 71 -5.021 7.748 7.716 542 2HB PRO 71 HB1 PRO 71 -5.538 8.379 6.149 543 1HG PRO 71 HG2 PRO 71 -6.441 6.037 7.030 544 2HG PRO 71 HG1 PRO 71 -6.044 6.273 5.319 545 1HD PRO 71 HD2 PRO 71 -4.582 4.754 7.403 546 2HD PRO 71 HD1 PRO 71 -4.632 4.507 5.646 547 H MET 72 HN MET 72 -2.570 9.620 5.422 548 HA MET 72 HA MET 72 -0.585 9.960 7.379 549 1HB MET 72 HB2 MET 72 -0.688 11.173 5.197 550 2HB MET 72 HB1 MET 72 -2.053 12.103 5.816 551 1HG MET 72 HG2 MET 72 -0.573 12.948 7.629 552 2HG MET 72 HG1 MET 72 0.776 12.127 6.844 553 1HE MET 72 HE1 MET 72 -2.280 14.001 5.189 554 2HE MET 72 HE2 MET 72 -1.604 15.616 4.989 555 3HE MET 72 HE3 MET 72 -1.884 14.973 6.606 556 H ASP 73 HN ASP 73 -3.760 11.512 7.053 557 HA ASP 73 HA ASP 73 -4.311 11.052 9.857 558 1HB ASP 73 HB2 ASP 73 -3.854 13.773 8.742 559 2HB ASP 73 HB1 ASP 73 -5.235 13.573 9.814 560 H ASN 74 HN ASN 74 -6.185 9.965 9.645 561 HA ASN 74 HA ASN 74 -8.474 11.121 8.417 562 1HB ASN 74 HB2 ASN 74 -6.733 9.714 6.672 563 2HB ASN 74 HB1 ASN 74 -8.169 8.719 6.893 564 1HD2 ASN 74 HD21 ASN 74 -6.870 11.628 5.596 565 2HD2 ASN 74 HD22 ASN 74 -8.290 12.133 4.745 566 H SER 75 HN SER 75 -9.895 8.827 7.786 567 HA SER 75 HA SER 75 -10.783 7.933 10.270 568 1HB SER 75 HB2 SER 75 -11.868 6.096 8.733 569 2HB SER 75 HB1 SER 75 -12.374 7.781 8.597 570 HG SER 75 HG SER 75 -11.826 7.599 6.585 571 H ALA 76 HN ALA 76 -10.994 5.565 10.835 572 HA ALA 76 HA ALA 76 -8.323 4.552 11.203 573 1HB ALA 76 HB1 ALA 76 -10.958 3.410 12.118 574 2HB ALA 76 HB2 ALA 76 -9.961 4.544 13.030 575 3HB ALA 76 HB3 ALA 76 -9.355 2.927 12.674 576 H TRP 77 HN TRP 77 -7.357 3.228 9.881 577 HA TRP 77 HA TRP 77 -8.964 1.453 8.169 578 1HB TRP 77 HB2 TRP 77 -6.169 2.569 7.864 579 2HB TRP 77 HB1 TRP 77 -6.761 1.230 6.888 580 HD1 TRP 77 HD1 TRP 77 -8.564 4.584 7.739 581 HE1 TRP 77 HE1 TRP 77 -9.241 5.685 5.501 582 HE3 TRP 77 HE3 TRP 77 -6.468 1.219 4.510 583 HZ2 TRP 77 HZ2 TRP 77 -8.912 5.183 2.742 584 HZ3 TRP 77 HZ3 TRP 77 -6.692 1.603 2.093 585 HH2 TRP 77 HH2 TRP 77 -7.888 3.539 1.230 586 H THR 78 HN THR 78 -8.791 -0.693 8.385 587 HA THR 78 HA THR 78 -7.307 -1.800 10.580 588 HB THR 78 HB THR 78 -8.786 -3.262 8.375 589 HG1 THR 78 HG1 THR 78 -10.565 -3.220 9.855 590 1HG2 THR 78 HG21 THR 78 -8.013 -4.089 11.177 591 2HG2 THR 78 HG22 THR 78 -7.327 -4.711 9.676 592 3HG2 THR 78 HG23 THR 78 -9.013 -5.035 10.077 593 H THR 79 HN THR 79 -5.216 -2.311 10.462 594 HA THR 79 HA THR 79 -3.932 -2.401 7.868 595 HB THR 79 HB THR 79 -2.798 -1.018 9.403 596 HG1 THR 79 HG1 THR 79 -0.764 -2.005 9.453 597 1HG2 THR 79 HG21 THR 79 -3.719 -1.820 11.498 598 2HG2 THR 79 HG22 THR 79 -1.958 -1.813 11.593 599 3HG2 THR 79 HG23 THR 79 -2.821 -3.330 11.349 600 H ASP 80 HN ASP 80 -3.804 -4.213 6.828 601 HA ASP 80 HA ASP 80 -2.747 -6.559 8.252 602 1HB ASP 80 HB2 ASP 80 -5.174 -6.844 7.521 603 2HB ASP 80 HB1 ASP 80 -4.608 -6.703 5.860 604 H ASN 81 HN ASN 81 -1.385 -7.925 6.756 605 HA ASN 81 HA ASN 81 0.195 -6.131 5.126 606 1HB ASN 81 HB2 ASN 81 0.593 -8.952 6.053 607 2HB ASN 81 HB1 ASN 81 1.603 -8.268 4.786 608 1HD2 ASN 81 HD21 ASN 81 2.997 -6.576 5.264 609 2HD2 ASN 81 HD22 ASN 81 3.466 -6.218 6.891 610 H GLY 82 HN GLY 82 -2.427 -8.129 4.550 611 1HA GLY 82 HA2 GLY 82 -1.619 -8.514 1.760 612 2HA GLY 82 HA1 GLY 82 -2.984 -9.295 2.535 613 H VAL 83 HN VAL 83 -3.952 -6.880 3.784 614 HA VAL 83 HA VAL 83 -4.760 -5.249 1.500 615 HB VAL 83 HB VAL 83 -7.138 -5.348 2.205 616 1HG1 VAL 83 HG11 VAL 83 -7.638 -7.554 1.250 617 2HG1 VAL 83 HG12 VAL 83 -5.945 -8.011 1.437 618 3HG1 VAL 83 HG13 VAL 83 -6.391 -6.711 0.332 619 1HG2 VAL 83 HG21 VAL 83 -7.882 -7.187 3.662 620 2HG2 VAL 83 HG22 VAL 83 -6.832 -6.050 4.511 621 3HG2 VAL 83 HG23 VAL 83 -6.198 -7.605 3.973 622 H PHE 84 HN PHE 84 -5.648 -3.209 2.119 623 HA PHE 84 HA PHE 84 -5.384 -2.532 4.955 624 1HB PHE 84 HB2 PHE 84 -3.335 -1.939 3.305 625 2HB PHE 84 HB1 PHE 84 -4.348 -0.532 3.002 626 HD1 PHE 84 HD1 PHE 84 -5.330 0.540 5.242 627 HD2 PHE 84 HD2 PHE 84 -1.758 -1.753 4.963 628 HE1 PHE 84 HE1 PHE 84 -4.490 1.611 7.289 629 HE2 PHE 84 HE2 PHE 84 -0.910 -0.685 7.012 630 HZ PHE 84 HZ PHE 84 -2.259 0.931 8.203 631 H TYR 85 HN TYR 85 -7.400 -1.882 5.435 632 HA TYR 85 HA TYR 85 -8.792 -0.157 3.532 633 1HB TYR 85 HB2 TYR 85 -10.813 -1.525 3.594 634 2HB TYR 85 HB1 TYR 85 -9.460 -2.435 2.944 635 HD1 TYR 85 HD1 TYR 85 -12.181 -2.553 5.139 636 HD2 TYR 85 HD2 TYR 85 -8.149 -3.872 4.768 637 HE1 TYR 85 HE1 TYR 85 -12.621 -4.359 6.760 638 HE2 TYR 85 HE2 TYR 85 -8.582 -5.679 6.377 639 HH TYR 85 HH TYR 85 -10.191 -6.146 8.242 640 H LYS 86 HN LYS 86 -10.253 1.220 4.413 641 HA LYS 86 HA LYS 86 -10.152 1.631 7.231 642 1HB LYS 86 HB2 LYS 86 -11.679 3.465 6.870 643 2HB LYS 86 HB1 LYS 86 -10.430 3.502 5.640 644 1HG LYS 86 HG2 LYS 86 -11.956 2.617 3.999 645 2HG LYS 86 HG1 LYS 86 -13.209 2.412 5.227 646 1HD LYS 86 HD2 LYS 86 -13.144 4.865 5.624 647 2HD LYS 86 HD1 LYS 86 -12.002 5.015 4.289 648 1HE LYS 86 HE2 LYS 86 -14.819 3.942 4.092 649 2HE LYS 86 HE1 LYS 86 -14.290 5.549 3.597 650 1HZ LYS 86 HZ1 LYS 86 -13.433 2.967 2.426 651 2HZ LYS 86 HZ2 LYS 86 -12.797 4.474 1.994 652 3HZ LYS 86 HZ3 LYS 86 -14.429 4.130 1.701 653 H ASN 87 HN ASN 87 -11.675 1.215 8.767 654 HA ASN 87 HA ASN 87 -13.487 -0.934 8.168 655 1HB ASN 87 HB2 ASN 87 -14.110 -0.697 10.610 656 2HB ASN 87 HB1 ASN 87 -12.435 -1.094 10.279 657 1HD2 ASN 87 HD21 ASN 87 -13.799 2.140 9.946 658 2HD2 ASN 87 HD22 ASN 87 -12.899 2.832 11.245 659 H ASP 88 HN ASP 88 -13.642 2.315 7.791 660 HA ASP 88 HA ASP 88 -16.458 2.650 8.385 661 1HB ASP 88 HB2 ASP 88 -14.476 4.491 7.020 662 2HB ASP 88 HB1 ASP 88 -16.139 4.916 7.420 663 H VAL 89 HN VAL 89 -18.082 2.769 6.884 664 HA VAL 89 HA VAL 89 -17.375 1.841 4.200 665 HB VAL 89 HB VAL 89 -19.879 1.482 3.951 666 1HG1 VAL 89 HG11 VAL 89 -18.338 -0.351 4.347 667 2HG1 VAL 89 HG12 VAL 89 -19.841 -0.617 5.230 668 3HG1 VAL 89 HG13 VAL 89 -18.403 -0.058 6.085 669 1HG2 VAL 89 HG21 VAL 89 -20.666 2.914 5.747 670 2HG2 VAL 89 HG22 VAL 89 -19.802 1.938 6.934 671 3HG2 VAL 89 HG23 VAL 89 -21.160 1.248 6.046 672 H GLY 90 HN GLY 90 -16.948 3.435 2.860 673 1HA GLY 90 HA2 GLY 90 -18.858 5.078 1.766 674 2HA GLY 90 HA1 GLY 90 -18.125 6.038 3.042 675 H SER 91 HN SER 91 -17.530 7.404 1.164 676 HA SER 91 HA SER 91 -15.398 6.437 -0.507 677 1HB SER 91 HB2 SER 91 -16.446 9.250 -0.083 678 2HB SER 91 HB1 SER 91 -15.363 8.732 -1.378 679 HG SER 91 HG SER 91 -17.223 8.481 -2.383 680 H TRP 92 HN TRP 92 -13.433 8.262 -0.522 681 HA TRP 92 HA TRP 92 -12.586 8.852 2.174 682 1HB TRP 92 HB2 TRP 92 -12.138 6.382 1.775 683 2HB TRP 92 HB1 TRP 92 -10.922 6.902 0.602 684 HD1 TRP 92 HD1 TRP 92 -11.698 7.061 4.364 685 HE1 TRP 92 HE1 TRP 92 -9.504 7.558 5.612 686 HE3 TRP 92 HE3 TRP 92 -8.689 7.816 0.347 687 HZ2 TRP 92 HZ2 TRP 92 -6.826 8.186 4.938 688 HZ3 TRP 92 HZ3 TRP 92 -6.345 8.366 0.717 689 HH2 TRP 92 HH2 TRP 92 -5.412 8.545 2.965 690 H GLY 93 HN GLY 93 -11.179 8.259 -1.007 691 1HA GLY 93 HA2 GLY 93 -9.542 9.453 -2.161 692 2HA GLY 93 HA1 GLY 93 -10.824 10.636 -2.120 693 H GLY 94 HN GLY 94 -7.777 9.651 -0.688 694 1HA GLY 94 HA2 GLY 94 -7.189 12.386 0.001 695 2HA GLY 94 HA1 GLY 94 -7.412 11.349 1.403 696 H THR 95 HN THR 95 -5.251 11.600 2.054 697 HA THR 95 HA THR 95 -3.293 10.329 0.270 698 HB THR 95 HB THR 95 -1.623 11.710 1.724 699 HG1 THR 95 HG1 THR 95 -3.133 13.844 1.925 700 1HG2 THR 95 HG21 THR 95 -3.367 12.983 -0.389 701 2HG2 THR 95 HG22 THR 95 -1.924 12.010 -0.672 702 3HG2 THR 95 HG23 THR 95 -1.789 13.576 0.128 703 H ILE 96 HN ILE 96 -2.484 8.508 0.929 704 HA ILE 96 HA ILE 96 -2.368 7.886 3.806 705 HB ILE 96 HB ILE 96 -1.944 5.516 2.984 706 1HG1 ILE 96 HG12 ILE 96 -2.938 6.730 0.403 707 2HG1 ILE 96 HG11 ILE 96 -1.299 6.162 0.699 708 1HG2 ILE 96 HG21 ILE 96 -4.596 6.791 2.321 709 2HG2 ILE 96 HG22 ILE 96 -4.092 6.186 3.899 710 3HG2 ILE 96 HG23 ILE 96 -4.317 5.066 2.555 711 1HD1 ILE 96 HD11 ILE 96 -3.789 4.475 0.672 712 2HD1 ILE 96 HD12 ILE 96 -2.160 3.892 1.010 713 3HD1 ILE 96 HD13 ILE 96 -2.552 4.540 -0.583 714 H GLY 97 HN GLY 97 -0.365 7.055 4.641 715 1HA GLY 97 HA2 GLY 97 1.938 7.842 2.965 716 2HA GLY 97 HA1 GLY 97 1.907 7.937 4.721 717 H ILE 98 HN ILE 98 3.805 6.504 2.954 718 HA ILE 98 HA ILE 98 3.192 3.746 3.671 719 HB ILE 98 HB ILE 98 5.349 4.938 1.926 720 1HG1 ILE 98 HG12 ILE 98 3.070 3.039 1.375 721 2HG1 ILE 98 HG11 ILE 98 3.067 4.758 0.999 722 1HG2 ILE 98 HG21 ILE 98 6.122 2.671 1.479 723 2HG2 ILE 98 HG22 ILE 98 4.974 2.032 2.654 724 3HG2 ILE 98 HG23 ILE 98 6.302 3.062 3.189 725 1HD1 ILE 98 HD11 ILE 98 3.510 3.436 -0.980 726 2HD1 ILE 98 HD12 ILE 98 4.901 2.692 -0.193 727 3HD1 ILE 98 HD13 ILE 98 4.915 4.418 -0.561 728 H TYR 99 HN TYR 99 3.678 3.162 5.610 729 HA TYR 99 HA TYR 99 6.117 4.167 6.909 730 1HB TYR 99 HB2 TYR 99 3.906 2.554 8.202 731 2HB TYR 99 HB1 TYR 99 5.143 3.515 8.996 732 HD1 TYR 99 HD1 TYR 99 4.743 5.775 9.545 733 HD2 TYR 99 HD2 TYR 99 2.081 3.765 6.915 734 HE1 TYR 99 HE1 TYR 99 3.199 7.680 9.663 735 HE2 TYR 99 HE2 TYR 99 0.526 5.665 7.031 736 HH TYR 99 HH TYR 99 1.404 8.678 8.487 737 H VAL 100 HN VAL 100 7.575 2.605 7.846 738 HA VAL 100 HA VAL 100 7.609 0.092 6.409 739 HB VAL 100 HB VAL 100 9.702 1.403 6.879 740 1HG1 VAL 100 HG11 VAL 100 9.229 2.046 9.178 741 2HG1 VAL 100 HG12 VAL 100 10.747 1.155 9.073 742 3HG1 VAL 100 HG13 VAL 100 9.294 0.355 9.675 743 1HG2 VAL 100 HG21 VAL 100 9.770 -0.934 6.200 744 2HG2 VAL 100 HG22 VAL 100 9.627 -1.437 7.885 745 3HG2 VAL 100 HG23 VAL 100 11.064 -0.571 7.343 746 H ASP 101 HN ASP 101 7.134 -1.894 7.262 747 HA ASP 101 HA ASP 101 5.815 -2.043 9.809 748 1HB ASP 101 HB2 ASP 101 5.133 -3.511 7.955 749 2HB ASP 101 HB1 ASP 101 6.729 -4.258 7.952 750 H GLY 102 HN GLY 102 7.427 -1.242 11.194 751 1HA GLY 102 HA2 GLY 102 9.048 -1.641 12.823 752 2HA GLY 102 HA1 GLY 102 9.390 -3.190 12.065 753 H GLN 103 HN GLN 103 10.545 -0.127 12.626 754 HA GLN 103 HA GLN 103 11.851 0.973 10.617 755 1HB GLN 103 HB2 GLN 103 12.149 1.493 13.027 756 2HB GLN 103 HB1 GLN 103 13.264 0.140 13.151 757 1HG GLN 103 HG2 GLN 103 14.445 1.446 11.166 758 2HG GLN 103 HG1 GLN 103 13.631 2.808 11.934 759 1HE2 GLN 103 HE21 GLN 103 14.104 3.250 14.156 760 2HE2 GLN 103 HE22 GLN 103 15.624 2.761 14.836 761 H GLN 104 HN GLN 104 12.651 0.040 8.843 762 HA GLN 104 HA GLN 104 14.048 -2.467 8.894 763 1HB GLN 104 HB2 GLN 104 12.555 -1.618 7.022 764 2HB GLN 104 HB1 GLN 104 13.860 -0.523 6.589 765 1HG GLN 104 HG2 GLN 104 14.015 -2.384 5.151 766 2HG GLN 104 HG1 GLN 104 15.329 -2.532 6.318 767 1HE2 GLN 104 HE21 GLN 104 15.509 -4.742 5.999 768 2HE2 GLN 104 HE22 GLN 104 14.335 -5.866 6.590 769 H THR 105 HN THR 105 14.926 0.747 9.379 770 HA THR 105 HA THR 105 16.897 1.804 9.766 771 HB THR 105 HB THR 105 18.329 -0.847 9.580 772 HG1 THR 105 HG1 THR 105 16.778 0.161 11.766 773 1HG2 THR 105 HG21 THR 105 19.702 0.117 11.370 774 2HG2 THR 105 HG22 THR 105 18.711 1.577 11.347 775 3HG2 THR 105 HG23 THR 105 19.698 1.157 9.946 776 H ASN 106 HN ASN 106 15.970 0.882 6.978 777 HA ASN 106 HA ASN 106 16.594 1.054 4.810 778 1HB ASN 106 HB2 ASN 106 17.228 3.343 5.542 779 2HB ASN 106 HB1 ASN 106 18.856 2.761 5.869 780 1HD2 ASN 106 HD21 ASN 106 20.257 2.433 4.181 781 2HD2 ASN 106 HD22 ASN 106 19.908 2.901 2.552 782 H THR 107 HN THR 107 17.078 -1.218 4.914 783 HA THR 107 HA THR 107 19.821 -2.053 5.127 784 HB THR 107 HB THR 107 17.963 -3.561 5.767 785 HG1 THR 107 HG1 THR 107 18.721 -5.292 4.017 786 1HG2 THR 107 HG21 THR 107 17.301 -3.555 2.821 787 2HG2 THR 107 HG22 THR 107 16.303 -2.902 4.121 788 3HG2 THR 107 HG23 THR 107 16.599 -4.638 4.024 789 HA PRO 108 HA PRO 108 21.774 -1.093 1.355 790 1HB PRO 108 HB2 PRO 108 21.616 -4.036 0.807 791 2HB PRO 108 HB1 PRO 108 22.964 -2.923 0.556 792 1HG PRO 108 HG2 PRO 108 22.759 -4.522 2.744 793 2HG PRO 108 HG1 PRO 108 23.578 -2.952 2.761 794 1HD PRO 108 HD2 PRO 108 21.128 -3.734 4.100 795 2HD PRO 108 HD1 PRO 108 22.037 -2.219 4.245 796 HA PRO 109 HA PRO 109 18.017 -1.425 -1.163 797 1HB PRO 109 HB2 PRO 109 17.352 1.151 -1.149 798 2HB PRO 109 HB1 PRO 109 17.130 0.148 0.287 799 1HG PRO 109 HG2 PRO 109 19.128 2.258 -0.241 800 2HG PRO 109 HG1 PRO 109 18.486 1.676 1.302 801 1HD PRO 109 HD2 PRO 109 20.951 0.937 0.005 802 2HD PRO 109 HD1 PRO 109 20.314 0.380 1.568 803 H GLY 110 HN GLY 110 17.338 0.643 -2.783 804 1HA GLY 110 HA2 GLY 110 19.245 1.863 -4.372 805 2HA GLY 110 HA1 GLY 110 18.945 0.274 -5.076 806 H ASN 111 HN ASN 111 16.996 -0.187 -5.995 807 HA ASN 111 HA ASN 111 14.991 1.971 -6.005 808 1HB ASN 111 HB2 ASN 111 16.202 1.756 -8.198 809 2HB ASN 111 HB1 ASN 111 15.593 0.107 -8.315 810 1HD2 ASN 111 HD21 ASN 111 14.414 0.486 -10.152 811 2HD2 ASN 111 HD22 ASN 111 12.989 1.458 -10.168 812 H TYR 112 HN TYR 112 13.148 1.318 -5.099 813 HA TYR 112 HA TYR 112 12.624 -1.566 -4.977 814 1HB TYR 112 HB2 TYR 112 12.029 0.650 -3.046 815 2HB TYR 112 HB1 TYR 112 11.045 -0.808 -3.045 816 HD1 TYR 112 HD1 TYR 112 11.729 -2.646 -1.776 817 HD2 TYR 112 HD2 TYR 112 14.604 0.278 -2.896 818 HE1 TYR 112 HE1 TYR 112 13.411 -3.769 -0.379 819 HE2 TYR 112 HE2 TYR 112 16.294 -0.841 -1.511 820 HH TYR 112 HH TYR 112 16.418 -2.338 0.383 821 H THR 113 HN THR 113 10.912 -2.344 -5.873 822 HA THR 113 HA THR 113 9.062 -0.474 -7.171 823 HB THR 113 HB THR 113 9.738 -3.342 -7.829 824 HG1 THR 113 HG1 THR 113 11.135 -1.224 -8.292 825 1HG2 THR 113 HG21 THR 113 8.044 -1.344 -9.348 826 2HG2 THR 113 HG22 THR 113 7.439 -2.751 -8.475 827 3HG2 THR 113 HG23 THR 113 8.461 -2.969 -9.894 828 H LEU 114 HN LEU 114 7.102 -0.337 -6.331 829 HA LEU 114 HA LEU 114 5.847 -2.752 -5.269 830 1HB LEU 114 HB2 LEU 114 4.764 -1.180 -3.523 831 2HB LEU 114 HB1 LEU 114 6.381 -1.791 -3.238 832 HG LEU 114 HG LEU 114 6.150 0.856 -4.576 833 1HD1 LEU 114 HD11 LEU 114 5.906 1.987 -2.414 834 2HD1 LEU 114 HD12 LEU 114 5.655 0.427 -1.630 835 3HD1 LEU 114 HD13 LEU 114 4.480 1.021 -2.803 836 1HD2 LEU 114 HD21 LEU 114 8.118 1.315 -3.176 837 2HD2 LEU 114 HD22 LEU 114 8.334 -0.113 -4.187 838 3HD2 LEU 114 HD23 LEU 114 7.977 -0.295 -2.471 839 H THR 115 HN THR 115 3.960 -3.086 -6.173 840 HA THR 115 HA THR 115 2.751 -0.879 -7.695 841 HB THR 115 HB THR 115 2.423 -3.815 -8.332 842 HG1 THR 115 HG1 THR 115 4.120 -3.600 -9.780 843 1HG2 THR 115 HG21 THR 115 1.838 -2.932 -10.562 844 2HG2 THR 115 HG22 THR 115 2.034 -1.289 -9.949 845 3HG2 THR 115 HG23 THR 115 0.761 -2.325 -9.304 846 H LEU 116 HN LEU 116 0.681 -0.377 -7.245 847 HA LEU 116 HA LEU 116 -0.691 -2.125 -5.321 848 1HB LEU 116 HB2 LEU 116 -0.512 0.880 -5.345 849 2HB LEU 116 HB1 LEU 116 -1.634 -0.010 -4.335 850 HG LEU 116 HG LEU 116 0.159 0.541 -2.925 851 1HD1 LEU 116 HD11 LEU 116 -0.531 -1.776 -2.695 852 2HD1 LEU 116 HD12 LEU 116 1.176 -1.565 -2.309 853 3HD1 LEU 116 HD13 LEU 116 0.701 -2.259 -3.860 854 1HD2 LEU 116 HD21 LEU 116 2.035 -0.383 -5.081 855 2HD2 LEU 116 HD22 LEU 116 2.517 0.113 -3.459 856 3HD2 LEU 116 HD23 LEU 116 1.768 1.278 -4.551 857 H THR 117 HN THR 117 -2.563 -2.851 -6.036 858 HA THR 117 HA THR 117 -3.783 -1.563 -8.357 859 HB THR 117 HB THR 117 -4.475 -4.214 -7.076 860 HG1 THR 117 HG1 THR 117 -2.293 -3.588 -8.362 861 1HG2 THR 117 HG21 THR 117 -5.143 -3.059 -9.788 862 2HG2 THR 117 HG22 THR 117 -6.271 -3.285 -8.450 863 3HG2 THR 117 HG23 THR 117 -5.545 -4.685 -9.238 864 H GLY 118 HN GLY 118 -5.363 -0.156 -8.041 865 1HA GLY 118 HA2 GLY 118 -6.656 0.229 -5.554 866 2HA GLY 118 HA1 GLY 118 -7.132 0.952 -7.084 867 H GLY 119 HN GLY 119 -8.705 -0.234 -4.862 868 1HA GLY 119 HA2 GLY 119 -10.838 -1.226 -6.264 869 2HA GLY 119 HA1 GLY 119 -9.874 -2.642 -5.861 870 H TYR 120 HN TYR 120 -12.503 -2.158 -4.907 871 HA TYR 120 HA TYR 120 -12.146 -1.208 -2.190 872 1HB TYR 120 HB2 TYR 120 -14.579 -1.433 -1.967 873 2HB TYR 120 HB1 TYR 120 -14.138 -0.437 -3.345 874 HD1 TYR 120 HD1 TYR 120 -15.645 -3.586 -2.262 875 HD2 TYR 120 HD2 TYR 120 -14.567 -1.209 -5.641 876 HE1 TYR 120 HE1 TYR 120 -17.029 -5.014 -3.699 877 HE2 TYR 120 HE2 TYR 120 -15.962 -2.641 -7.080 878 HH TYR 120 HH TYR 120 -18.132 -5.021 -5.773 879 H TRP 121 HN TRP 121 -13.780 -2.616 -0.695 880 HA TRP 121 HA TRP 121 -12.948 -5.403 -0.848 881 1HB TRP 121 HB2 TRP 121 -11.140 -4.629 0.396 882 2HB TRP 121 HB1 TRP 121 -12.084 -3.369 1.177 883 HD1 TRP 121 HD1 TRP 121 -13.932 -4.365 3.005 884 HE1 TRP 121 HE1 TRP 121 -13.589 -6.191 4.767 885 HE3 TRP 121 HE3 TRP 121 -9.873 -6.681 0.985 886 HZ2 TRP 121 HZ2 TRP 121 -11.833 -8.296 5.247 887 HZ3 TRP 121 HZ3 TRP 121 -8.918 -8.601 2.192 888 HH2 TRP 121 HH2 TRP 121 -9.882 -9.389 4.262 889 H ALA 122 HN ALA 122 -14.193 -6.791 0.468 890 HA ALA 122 HA ALA 122 -16.619 -5.613 1.613 891 1HB ALA 122 HB1 ALA 122 -16.477 -8.148 -0.012 892 2HB ALA 122 HB2 ALA 122 -17.135 -6.606 -0.560 893 3HB ALA 122 HB3 ALA 122 -17.923 -7.486 0.753 894 H LYS 123 HN LYS 123 -17.403 -6.569 3.435 895 HA LYS 123 HA LYS 123 -17.512 -7.668 5.374 896 1HB LYS 123 HB2 LYS 123 -17.476 -9.665 3.770 897 2HB LYS 123 HB1 LYS 123 -15.801 -9.877 4.280 898 1HG LYS 123 HG2 LYS 123 -16.390 -10.386 6.459 899 2HG LYS 123 HG1 LYS 123 -17.972 -9.625 6.314 900 1HD LYS 123 HD2 LYS 123 -18.685 -11.431 4.812 901 2HD LYS 123 HD1 LYS 123 -17.106 -12.199 5.007 902 1HE LYS 123 HE2 LYS 123 -18.873 -13.162 6.467 903 2HE LYS 123 HE1 LYS 123 -17.486 -12.527 7.353 904 1HZ LYS 123 HZ1 LYS 123 -19.548 -11.880 8.412 905 2HZ LYS 123 HZ2 LYS 123 -20.100 -11.157 6.984 906 3HZ LYS 123 HZ3 LYS 123 -18.763 -10.506 7.800 907 H ASP 124 HN ASP 124 -15.207 -9.495 6.349 908 HA ASP 124 HA ASP 124 -13.310 -7.359 7.002 909 1HB ASP 124 HB2 ASP 124 -14.879 -8.955 9.033 910 2HB ASP 124 HB1 ASP 124 -13.460 -7.994 9.430 911 H ASN 125 HN ASN 125 -11.402 -8.031 6.676 912 HA ASN 125 HA ASN 125 -9.538 -9.265 6.385 913 1HB ASN 125 HB2 ASN 125 -10.247 -9.161 9.033 914 2HB ASN 125 HB1 ASN 125 -9.821 -10.849 8.786 915 1HD2 ASN 125 HD21 ASN 125 -7.716 -11.367 8.107 916 2HD2 ASN 125 HD22 ASN 125 -6.407 -10.253 8.305 917 H LYS 126 HN LYS 126 -12.203 -10.824 5.666 918 HA LYS 126 HA LYS 126 -11.047 -13.494 5.633 919 1HB LYS 126 HB2 LYS 126 -13.196 -14.181 4.600 920 2HB LYS 126 HB1 LYS 126 -13.383 -13.420 6.168 921 1HG LYS 126 HG2 LYS 126 -15.118 -12.555 4.891 922 2HG LYS 126 HG1 LYS 126 -13.896 -11.282 4.871 923 1HD LYS 126 HD2 LYS 126 -13.405 -11.601 2.657 924 2HD LYS 126 HD1 LYS 126 -13.864 -13.305 2.689 925 1HE LYS 126 HE2 LYS 126 -15.894 -11.125 3.021 926 2HE LYS 126 HE1 LYS 126 -15.376 -11.659 1.419 927 1HZ LYS 126 HZ1 LYS 126 -16.072 -13.906 1.974 928 2HZ LYS 126 HZ2 LYS 126 -17.372 -12.826 2.146 929 3HZ LYS 126 HZ3 LYS 126 -16.561 -13.408 3.521 930 H GLN 127 HN GLN 127 -10.690 -10.812 3.956 931 HA GLN 127 HA GLN 127 -9.765 -10.236 2.010 932 1HB GLN 127 HB2 GLN 127 -9.349 -13.188 1.825 933 2HB GLN 127 HB1 GLN 127 -9.026 -12.164 0.429 934 1HG GLN 127 HG2 GLN 127 -7.514 -10.799 1.804 935 2HG GLN 127 HG1 GLN 127 -7.785 -11.901 3.157 936 1HE2 GLN 127 HE21 GLN 127 -7.564 -12.963 -0.156 937 2HE2 GLN 127 HE22 GLN 127 -6.054 -13.783 -0.004 938 H GLY 128 HN GLY 128 -12.397 -9.969 2.133 939 1HA GLY 128 HA2 GLY 128 -13.382 -10.769 -0.485 940 2HA GLY 128 HA1 GLY 128 -14.219 -9.746 0.695 941 H PHE 129 HN PHE 129 -11.978 -9.778 -1.981 942 HA PHE 129 HA PHE 129 -11.929 -6.847 -1.809 943 1HB PHE 129 HB2 PHE 129 -9.519 -6.817 -2.370 944 2HB PHE 129 HB1 PHE 129 -9.833 -7.596 -0.826 945 HD1 PHE 129 HD1 PHE 129 -9.559 -10.022 -0.587 946 HD2 PHE 129 HD2 PHE 129 -8.603 -8.024 -4.220 947 HE1 PHE 129 HE1 PHE 129 -8.289 -11.992 -1.331 948 HE2 PHE 129 HE2 PHE 129 -7.332 -9.991 -4.971 949 HZ PHE 129 HZ PHE 129 -7.142 -11.961 -3.513 950 H THR 130 HN THR 130 -12.190 -5.835 -3.709 951 HA THR 130 HA THR 130 -12.192 -7.494 -6.149 952 HB THR 130 HB THR 130 -13.794 -4.967 -5.686 953 HG1 THR 130 HG1 THR 130 -14.422 -7.704 -5.215 954 1HG2 THR 130 HG21 THR 130 -13.424 -5.545 -8.036 955 2HG2 THR 130 HG22 THR 130 -15.115 -5.782 -7.590 956 3HG2 THR 130 HG23 THR 130 -14.040 -7.173 -7.739 957 HA PRO 131 HA PRO 131 -9.167 -4.490 -7.645 958 1HB PRO 131 HB2 PRO 131 -9.341 -5.775 -10.230 959 2HB PRO 131 HB1 PRO 131 -8.017 -5.833 -9.066 960 1HG PRO 131 HG2 PRO 131 -9.589 -7.985 -9.698 961 2HG PRO 131 HG1 PRO 131 -8.736 -7.801 -8.155 962 1HD PRO 131 HD2 PRO 131 -11.617 -7.298 -8.806 963 2HD PRO 131 HD1 PRO 131 -10.898 -8.025 -7.351 964 H SER 132 HN SER 132 -10.144 -2.545 -7.908 965 HA SER 132 HA SER 132 -11.715 -2.087 -10.311 966 1HB SER 132 HB2 SER 132 -12.788 -1.399 -7.562 967 2HB SER 132 HB1 SER 132 -13.576 -1.062 -9.100 968 HG SER 132 HG SER 132 -13.647 -3.357 -9.435 969 H GLY 133 HN GLY 133 -10.241 -0.655 -11.107 970 1HA GLY 133 HA2 GLY 133 -10.314 1.937 -10.880 971 2HA GLY 133 HA1 GLY 133 -9.450 1.586 -9.390 972 H THR 134 HN THR 134 -7.518 2.437 -9.818 973 HA THR 134 HA THR 134 -6.228 1.853 -12.385 974 HB THR 134 HB THR 134 -5.190 3.750 -10.295 975 HG1 THR 134 HG1 THR 134 -7.134 4.341 -12.312 976 1HG2 THR 134 HG21 THR 134 -3.735 3.247 -12.195 977 2HG2 THR 134 HG22 THR 134 -4.286 4.921 -12.251 978 3HG2 THR 134 HG23 THR 134 -5.018 3.716 -13.310 979 H THR 135 HN THR 135 -4.282 0.769 -12.513 980 HA THR 135 HA THR 135 -3.250 -0.413 -10.041 981 HB THR 135 HB THR 135 -2.310 -0.908 -12.877 982 HG1 THR 135 HG1 THR 135 -4.635 -1.487 -12.065 983 1HG2 THR 135 HG21 THR 135 -1.397 -2.979 -11.928 984 2HG2 THR 135 HG22 THR 135 -1.965 -2.496 -10.329 985 3HG2 THR 135 HG23 THR 135 -0.711 -1.556 -11.142 986 H GLY 136 HN GLY 136 -2.135 1.182 -9.015 987 1HA GLY 136 HA2 GLY 136 -0.353 2.896 -10.581 988 2HA GLY 136 HA1 GLY 136 -0.849 3.162 -8.915 989 H THR 137 HN THR 137 1.814 3.276 -9.922 990 HA THR 137 HA THR 137 2.978 1.040 -8.407 991 HB THR 137 HB THR 137 4.284 2.398 -10.772 992 HG1 THR 137 HG1 THR 137 2.296 0.709 -10.843 993 1HG2 THR 137 HG21 THR 137 4.974 -0.134 -9.272 994 2HG2 THR 137 HG22 THR 137 5.831 1.403 -9.144 995 3HG2 THR 137 HG23 THR 137 5.839 0.513 -10.667 996 H THR 138 HN THR 138 3.747 1.831 -6.550 997 HA THR 138 HA THR 138 4.906 4.510 -6.502 998 HB THR 138 HB THR 138 4.887 2.602 -4.154 999 HG1 THR 138 HG1 THR 138 2.740 3.763 -5.430 1000 1HG2 THR 138 HG21 THR 138 4.783 5.611 -4.399 1001 2HG2 THR 138 HG22 THR 138 6.184 4.650 -3.918 1002 3HG2 THR 138 HG23 THR 138 4.754 4.706 -2.886 1003 H LYS 139 HN LYS 139 7.008 4.781 -6.926 1004 HA LYS 139 HA LYS 139 8.745 2.411 -6.673 1005 1HB LYS 139 HB2 LYS 139 8.316 2.966 -9.001 1006 2HB LYS 139 HB1 LYS 139 8.820 4.624 -8.721 1007 1HG LYS 139 HG2 LYS 139 11.080 4.000 -8.466 1008 2HG LYS 139 HG1 LYS 139 10.665 2.288 -8.329 1009 1HD LYS 139 HD2 LYS 139 11.592 2.875 -10.547 1010 2HD LYS 139 HD1 LYS 139 9.950 2.233 -10.637 1011 1HE LYS 139 HE2 LYS 139 9.144 4.621 -10.675 1012 2HE LYS 139 HE1 LYS 139 10.827 5.106 -10.872 1013 1HZ LYS 139 HZ1 LYS 139 9.704 4.964 -12.993 1014 2HZ LYS 139 HZ2 LYS 139 9.298 3.343 -12.709 1015 3HZ LYS 139 HZ3 LYS 139 10.924 3.787 -12.902 1016 H LEU 140 HN LEU 140 10.018 2.585 -5.083 1017 HA LEU 140 HA LEU 140 10.755 5.241 -4.104 1018 1HB LEU 140 HB2 LEU 140 9.599 4.048 -2.446 1019 2HB LEU 140 HB1 LEU 140 10.448 2.554 -2.799 1020 HG LEU 140 HG LEU 140 12.520 3.596 -1.909 1021 1HD1 LEU 140 HD11 LEU 140 10.639 5.779 -1.025 1022 2HD1 LEU 140 HD12 LEU 140 11.941 5.936 -2.205 1023 3HD1 LEU 140 HD13 LEU 140 12.318 5.607 -0.514 1024 1HD2 LEU 140 HD21 LEU 140 11.206 2.098 -0.532 1025 2HD2 LEU 140 HD22 LEU 140 10.174 3.436 -0.025 1026 3HD2 LEU 140 HD23 LEU 140 11.872 3.401 0.454 1027 H THR 141 HN THR 141 12.616 5.863 -4.914 1028 HA THR 141 HA THR 141 14.841 3.949 -5.112 1029 HB THR 141 HB THR 141 14.745 6.723 -6.308 1030 HG1 THR 141 HG1 THR 141 13.756 4.260 -7.354 1031 1HG2 THR 141 HG21 THR 141 16.309 4.246 -7.051 1032 2HG2 THR 141 HG22 THR 141 16.944 5.629 -6.160 1033 3HG2 THR 141 HG23 THR 141 16.424 5.820 -7.835 1034 H VAL 142 HN VAL 142 16.809 4.419 -4.066 1035 HA VAL 142 HA VAL 142 16.538 6.330 -1.883 1036 HB VAL 142 HB VAL 142 17.361 4.141 -1.276 1037 1HG1 VAL 142 HG11 VAL 142 18.405 3.469 -3.353 1038 2HG1 VAL 142 HG12 VAL 142 19.561 3.333 -2.027 1039 3HG1 VAL 142 HG13 VAL 142 19.659 4.692 -3.149 1040 1HG2 VAL 142 HG21 VAL 142 18.151 6.017 0.039 1041 2HG2 VAL 142 HG22 VAL 142 19.513 6.241 -1.059 1042 3HG2 VAL 142 HG23 VAL 142 19.405 4.781 -0.074 1043 H THR 143 HN THR 143 17.440 8.243 -1.824 1044 HA THR 143 HA THR 143 19.720 8.830 -3.568 1045 HB THR 143 HB THR 143 18.744 11.136 -3.901 1046 HG1 THR 143 HG1 THR 143 17.162 10.909 -2.184 1047 1HG2 THR 143 HG21 THR 143 17.204 10.456 -5.696 1048 2HG2 THR 143 HG22 THR 143 17.181 8.816 -5.046 1049 3HG2 THR 143 HG23 THR 143 18.677 9.485 -5.697 Start of MODEL 8 1 H GLU 1 H GLU 1 -23.735 3.195 -11.396 2 HA GLU 1 HA GLU 1 -21.489 3.899 -11.994 3 1HB GLU 1 HB2 GLU 1 -22.399 3.952 -9.132 4 2HB GLU 1 HB1 GLU 1 -20.930 4.781 -9.633 5 1HG GLU 1 HG2 GLU 1 -23.682 5.261 -10.756 6 2HG GLU 1 HG1 GLU 1 -22.855 6.283 -9.579 7 H GLU 2 HN GLU 2 -19.355 4.074 -10.324 8 HA GLU 2 HA GLU 2 -18.383 1.299 -10.270 9 1HB GLU 2 HB2 GLU 2 -17.666 2.489 -12.329 10 2HB GLU 2 HB1 GLU 2 -16.890 3.707 -11.328 11 1HG GLU 2 HG2 GLU 2 -15.371 2.027 -10.437 12 2HG GLU 2 HG1 GLU 2 -16.161 0.789 -11.413 13 H CYS 3 HN CYS 3 -17.012 0.770 -8.643 14 HA CYS 3 HA CYS 3 -16.356 2.854 -6.676 15 1HB CYS 3 HB2 CYS 3 -17.501 0.889 -5.759 16 2HB CYS 3 HB1 CYS 3 -16.287 -0.172 -6.457 17 H GLN 4 HN GLN 4 -14.607 3.806 -7.607 18 HA GLN 4 HA GLN 4 -12.448 2.052 -8.553 19 1HB GLN 4 HB2 GLN 4 -13.234 3.327 -10.367 20 2HB GLN 4 HB1 GLN 4 -13.350 4.790 -9.403 21 1HG GLN 4 HG2 GLN 4 -10.926 4.917 -9.280 22 2HG GLN 4 HG1 GLN 4 -10.795 3.425 -10.209 23 1HE2 GLN 4 HE21 GLN 4 -12.973 4.071 -12.002 24 2HE2 GLN 4 HE22 GLN 4 -12.382 5.316 -13.054 25 H VAL 5 HN VAL 5 -10.763 1.907 -7.284 26 HA VAL 5 HA VAL 5 -10.094 4.092 -5.469 27 HB VAL 5 HB VAL 5 -8.637 1.455 -5.799 28 1HG1 VAL 5 HG11 VAL 5 -7.800 1.936 -3.545 29 2HG1 VAL 5 HG12 VAL 5 -8.652 3.481 -3.567 30 3HG1 VAL 5 HG13 VAL 5 -7.336 3.182 -4.702 31 1HG2 VAL 5 HG21 VAL 5 -9.904 0.662 -3.861 32 2HG2 VAL 5 HG22 VAL 5 -10.970 1.037 -5.215 33 3HG2 VAL 5 HG23 VAL 5 -10.840 2.157 -3.861 34 H ARG 6 HN ARG 6 -8.942 5.703 -6.293 35 HA ARG 6 HA ARG 6 -7.295 5.256 -8.643 36 1HB ARG 6 HB2 ARG 6 -8.286 7.685 -7.210 37 2HB ARG 6 HB1 ARG 6 -6.919 7.821 -8.307 38 1HG ARG 6 HG2 ARG 6 -8.300 6.851 -10.102 39 2HG ARG 6 HG1 ARG 6 -9.672 6.821 -8.991 40 1HD ARG 6 HD2 ARG 6 -9.731 9.175 -8.842 41 2HD ARG 6 HD1 ARG 6 -8.149 9.339 -9.606 42 HE ARG 6 HE ARG 6 -9.756 8.079 -11.459 43 1HH1 ARG 6 HH11 ARG 6 -9.850 11.130 -9.713 44 2HH1 ARG 6 HH12 ARG 6 -10.571 11.997 -11.039 45 1HH2 ARG 6 HH21 ARG 6 -10.691 9.217 -13.181 46 2HH2 ARG 6 HH22 ARG 6 -11.048 10.912 -13.008 47 H VAL 7 HN VAL 7 -5.374 4.445 -8.308 48 HA VAL 7 HA VAL 7 -3.601 5.836 -6.414 49 HB VAL 7 HB VAL 7 -3.402 2.921 -7.223 50 1HG1 VAL 7 HG11 VAL 7 -1.810 4.529 -5.224 51 2HG1 VAL 7 HG12 VAL 7 -1.233 3.934 -6.781 52 3HG1 VAL 7 HG13 VAL 7 -1.658 2.794 -5.505 53 1HG2 VAL 7 HG21 VAL 7 -4.286 4.137 -4.608 54 2HG2 VAL 7 HG22 VAL 7 -3.993 2.420 -4.886 55 3HG2 VAL 7 HG23 VAL 7 -5.297 3.243 -5.742 56 H GLY 8 HN GLY 8 -2.203 7.023 -7.556 57 1HA GLY 8 HA2 GLY 8 -1.543 6.213 -10.293 58 2HA GLY 8 HA1 GLY 8 -1.247 7.792 -9.581 59 H ASP 9 HN ASP 9 0.833 7.011 -10.864 60 HA ASP 9 HA ASP 9 2.585 5.546 -9.031 61 1HB ASP 9 HB2 ASP 9 4.102 5.248 -10.834 62 2HB ASP 9 HB1 ASP 9 2.503 4.938 -11.498 63 H LEU 10 HN LEU 10 4.509 6.421 -8.289 64 HA LEU 10 HA LEU 10 5.233 9.143 -8.873 65 1HB LEU 10 HB2 LEU 10 4.992 10.013 -6.624 66 2HB LEU 10 HB1 LEU 10 3.433 9.487 -7.225 67 HG LEU 10 HG LEU 10 5.093 7.734 -5.430 68 1HD1 LEU 10 HD11 LEU 10 4.801 9.854 -4.275 69 2HD1 LEU 10 HD12 LEU 10 3.792 8.604 -3.543 70 3HD1 LEU 10 HD13 LEU 10 3.070 9.811 -4.607 71 1HD2 LEU 10 HD21 LEU 10 2.135 7.881 -6.005 72 2HD2 LEU 10 HD22 LEU 10 2.905 6.768 -4.873 73 3HD2 LEU 10 HD23 LEU 10 3.251 6.650 -6.599 74 H THR 11 HN THR 11 7.331 9.628 -8.137 75 HA THR 11 HA THR 11 8.784 7.294 -7.089 76 HB THR 11 HB THR 11 9.863 9.428 -8.941 77 HG1 THR 11 HG1 THR 11 8.321 7.916 -9.900 78 1HG2 THR 11 HG21 THR 11 11.080 6.843 -7.945 79 2HG2 THR 11 HG22 THR 11 11.586 8.473 -7.498 80 3HG2 THR 11 HG23 THR 11 11.793 7.907 -9.155 81 H VAL 12 HN VAL 12 9.485 7.587 -5.106 82 HA VAL 12 HA VAL 12 10.362 10.285 -4.287 83 HB VAL 12 HB VAL 12 9.555 8.088 -2.387 84 1HG1 VAL 12 HG11 VAL 12 9.901 11.061 -2.042 85 2HG1 VAL 12 HG12 VAL 12 10.973 9.799 -1.437 86 3HG1 VAL 12 HG13 VAL 12 9.338 9.949 -0.793 87 1HG2 VAL 12 HG21 VAL 12 7.617 8.636 -3.775 88 2HG2 VAL 12 HG22 VAL 12 7.827 10.346 -3.394 89 3HG2 VAL 12 HG23 VAL 12 7.399 9.205 -2.119 90 H ALA 13 HN ALA 13 12.501 10.371 -4.418 91 HA ALA 13 HA ALA 13 14.093 7.969 -4.211 92 1HB ALA 13 HB1 ALA 13 14.581 9.659 -5.912 93 2HB ALA 13 HB2 ALA 13 15.956 9.393 -4.838 94 3HB ALA 13 HB3 ALA 13 14.946 10.825 -4.640 95 H LYS 14 HN LYS 14 14.156 7.252 -2.136 96 HA LYS 14 HA LYS 14 15.638 8.848 -0.214 97 1HB LYS 14 HB2 LYS 14 12.840 7.842 0.349 98 2HB LYS 14 HB1 LYS 14 13.956 8.378 1.597 99 1HG LYS 14 HG2 LYS 14 12.908 10.080 -0.657 100 2HG LYS 14 HG1 LYS 14 12.328 10.100 1.011 101 1HD LYS 14 HD2 LYS 14 14.376 10.958 1.813 102 2HD LYS 14 HD1 LYS 14 15.199 10.621 0.288 103 1HE LYS 14 HE2 LYS 14 13.692 12.272 -0.810 104 2HE LYS 14 HE1 LYS 14 13.055 12.680 0.785 105 1HZ LYS 14 HZ1 LYS 14 15.191 13.437 1.478 106 2HZ LYS 14 HZ2 LYS 14 14.846 14.189 -0.007 107 3HZ LYS 14 HZ3 LYS 14 15.928 12.881 0.053 108 H THR 15 HN THR 15 15.762 7.475 1.927 109 HA THR 15 HA THR 15 16.470 4.739 1.154 110 HB THR 15 HB THR 15 17.720 4.702 3.312 111 HG1 THR 15 HG1 THR 15 17.898 7.296 3.816 112 1HG2 THR 15 HG21 THR 15 18.421 7.001 1.484 113 2HG2 THR 15 HG22 THR 15 18.875 5.313 1.248 114 3HG2 THR 15 HG23 THR 15 19.521 6.217 2.619 115 H ARG 16 HN ARG 16 16.067 3.063 2.931 116 HA ARG 16 HA ARG 16 13.296 3.320 3.857 117 1HB ARG 16 HB2 ARG 16 15.201 0.972 4.139 118 2HB ARG 16 HB1 ARG 16 13.484 0.960 4.524 119 1HG ARG 16 HG2 ARG 16 13.508 -0.055 2.455 120 2HG ARG 16 HG1 ARG 16 13.188 1.630 2.032 121 1HD ARG 16 HD2 ARG 16 15.724 1.859 1.762 122 2HD ARG 16 HD1 ARG 16 15.760 0.099 1.778 123 HE ARG 16 HE ARG 16 14.497 0.106 -0.236 124 1HH1 ARG 16 HH11 ARG 16 15.688 3.210 0.776 125 2HH1 ARG 16 HH12 ARG 16 15.429 3.986 -0.754 126 1HH2 ARG 16 HH21 ARG 16 14.176 1.102 -2.305 127 2HH2 ARG 16 HH22 ARG 16 14.573 2.773 -2.508 128 H GLY 17 HN GLY 17 16.403 3.887 4.941 129 1HA GLY 17 HA2 GLY 17 15.907 3.478 7.753 130 2HA GLY 17 HA1 GLY 17 17.315 4.257 7.037 131 H GLN 18 HN GLN 18 15.582 6.000 5.415 132 HA GLN 18 HA GLN 18 15.300 8.245 7.070 133 1HB GLN 18 HB2 GLN 18 15.524 8.326 4.615 134 2HB GLN 18 HB1 GLN 18 13.944 7.583 4.441 135 1HG GLN 18 HG2 GLN 18 13.832 9.961 4.025 136 2HG GLN 18 HG1 GLN 18 12.907 9.538 5.467 137 1HE2 GLN 18 HE21 GLN 18 13.600 10.228 7.459 138 2HE2 GLN 18 HE22 GLN 18 14.826 11.437 7.657 139 H LEU 19 HN LEU 19 13.225 5.582 6.368 140 HA LEU 19 HA LEU 19 10.755 6.644 7.212 141 1HB LEU 19 HB2 LEU 19 11.768 3.801 7.112 142 2HB LEU 19 HB1 LEU 19 10.127 4.229 7.529 143 HG LEU 19 HG LEU 19 10.632 3.416 5.129 144 1HD1 LEU 19 HD11 LEU 19 9.042 5.937 5.593 145 2HD1 LEU 19 HD12 LEU 19 8.481 4.290 5.880 146 3HD1 LEU 19 HD13 LEU 19 8.851 4.823 4.240 147 1HD2 LEU 19 HD21 LEU 19 11.433 6.304 4.835 148 2HD2 LEU 19 HD22 LEU 19 11.143 5.164 3.521 149 3HD2 LEU 19 HD23 LEU 19 12.489 4.906 4.633 150 H THR 20 HN THR 20 13.069 4.549 8.794 151 HA THR 20 HA THR 20 13.486 4.026 10.979 152 HB THR 20 HB THR 20 12.333 6.729 11.694 153 HG1 THR 20 HG1 THR 20 14.406 6.175 10.021 154 1HG2 THR 20 HG21 THR 20 14.056 6.693 13.431 155 2HG2 THR 20 HG22 THR 20 14.624 5.128 12.849 156 3HG2 THR 20 HG23 THR 20 13.016 5.273 13.558 157 H ASP 21 HN ASP 21 11.304 2.919 10.034 158 HA ASP 21 HA ASP 21 9.504 1.718 10.676 159 1HB ASP 21 HB2 ASP 21 10.377 1.741 12.991 160 2HB ASP 21 HB1 ASP 21 9.556 3.273 13.272 161 H ALA 22 HN ALA 22 8.717 4.784 12.325 162 HA ALA 22 HA ALA 22 6.380 4.878 10.549 163 1HB ALA 22 HB1 ALA 22 5.850 4.485 12.910 164 2HB ALA 22 HB2 ALA 22 5.178 6.005 12.317 165 3HB ALA 22 HB3 ALA 22 6.624 6.016 13.325 166 H ALA 23 HN ALA 23 7.539 6.072 8.950 167 HA ALA 23 HA ALA 23 7.010 8.892 9.398 168 1HB ALA 23 HB1 ALA 23 9.644 7.990 8.236 169 2HB ALA 23 HB2 ALA 23 9.425 8.680 9.845 170 3HB ALA 23 HB3 ALA 23 9.089 9.656 8.412 171 HA PRO 24 HA PRO 24 5.160 7.810 5.444 172 1HB PRO 24 HB2 PRO 24 3.828 10.161 5.134 173 2HB PRO 24 HB1 PRO 24 3.247 8.860 6.182 174 1HG PRO 24 HG2 PRO 24 4.759 11.344 6.908 175 2HG PRO 24 HG1 PRO 24 3.362 10.611 7.719 176 1HD PRO 24 HD2 PRO 24 5.885 10.285 8.625 177 2HD PRO 24 HD1 PRO 24 4.657 9.015 8.773 178 H ILE 25 HN ILE 25 7.061 7.804 4.229 179 HA ILE 25 HA ILE 25 8.277 10.338 3.491 180 HB ILE 25 HB ILE 25 9.022 7.524 2.705 181 1HG1 ILE 25 HG12 ILE 25 9.221 7.896 5.098 182 2HG1 ILE 25 HG11 ILE 25 10.811 7.820 4.361 183 1HG2 ILE 25 HG21 ILE 25 11.168 8.509 2.032 184 2HG2 ILE 25 HG22 ILE 25 10.529 10.116 2.376 185 3HG2 ILE 25 HG23 ILE 25 9.826 9.145 1.081 186 1HD1 ILE 25 HD11 ILE 25 10.681 9.568 6.052 187 2HD1 ILE 25 HD12 ILE 25 9.379 10.339 5.149 188 3HD1 ILE 25 HD13 ILE 25 10.997 10.240 4.452 189 H GLY 26 HN GLY 26 6.597 7.652 1.858 190 1HA GLY 26 HA2 GLY 26 6.233 9.510 -0.400 191 2HA GLY 26 HA1 GLY 26 6.422 7.781 -0.625 192 HA PRO 27 HA PRO 27 1.925 8.270 1.426 193 1HB PRO 27 HB2 PRO 27 1.280 11.009 1.418 194 2HB PRO 27 HB1 PRO 27 1.614 10.021 2.843 195 1HG PRO 27 HG2 PRO 27 3.436 11.830 1.319 196 2HG PRO 27 HG1 PRO 27 3.337 11.548 3.069 197 1HD PRO 27 HD2 PRO 27 5.307 10.438 1.679 198 2HD PRO 27 HD1 PRO 27 4.454 9.500 2.918 199 H VAL 28 HN VAL 28 0.648 7.715 -0.210 200 HA VAL 28 HA VAL 28 0.708 9.324 -2.662 201 HB VAL 28 HB VAL 28 1.323 7.009 -3.053 202 1HG1 VAL 28 HG11 VAL 28 -0.249 5.167 -2.633 203 2HG1 VAL 28 HG12 VAL 28 -1.329 6.295 -1.812 204 3HG1 VAL 28 HG13 VAL 28 0.271 5.961 -1.146 205 1HG2 VAL 28 HG21 VAL 28 -1.469 7.537 -4.068 206 2HG2 VAL 28 HG22 VAL 28 -0.308 6.405 -4.760 207 3HG2 VAL 28 HG23 VAL 28 0.022 8.136 -4.792 208 H THR 29 HN THR 29 -1.135 10.194 -3.495 209 HA THR 29 HA THR 29 -3.348 10.424 -1.666 210 HB THR 29 HB THR 29 -2.680 12.461 -2.708 211 HG1 THR 29 HG1 THR 29 -4.839 12.588 -2.524 212 1HG2 THR 29 HG21 THR 29 -2.748 12.828 -5.132 213 2HG2 THR 29 HG22 THR 29 -3.154 11.129 -5.378 214 3HG2 THR 29 HG23 THR 29 -1.587 11.573 -4.701 215 H VAL 30 HN VAL 30 -4.606 8.734 -1.574 216 HA VAL 30 HA VAL 30 -5.440 7.325 -3.995 217 HB VAL 30 HB VAL 30 -5.866 6.752 -1.051 218 1HG1 VAL 30 HG11 VAL 30 -7.823 5.999 -2.296 219 2HG1 VAL 30 HG12 VAL 30 -6.864 4.616 -1.770 220 3HG1 VAL 30 HG13 VAL 30 -6.791 5.152 -3.448 221 1HG2 VAL 30 HG21 VAL 30 -3.608 6.323 -1.843 222 2HG2 VAL 30 HG22 VAL 30 -4.235 5.358 -3.181 223 3HG2 VAL 30 HG23 VAL 30 -4.438 4.798 -1.520 224 H GLN 31 HN GLN 31 -7.176 8.095 -5.009 225 HA GLN 31 HA GLN 31 -9.218 9.503 -3.450 226 1HB GLN 31 HB2 GLN 31 -8.234 10.593 -5.488 227 2HB GLN 31 HB1 GLN 31 -8.962 9.320 -6.457 228 1HG GLN 31 HG2 GLN 31 -11.183 10.012 -5.634 229 2HG GLN 31 HG1 GLN 31 -10.417 11.338 -4.761 230 1HE2 GLN 31 HE21 GLN 31 -11.492 12.928 -5.904 231 2HE2 GLN 31 HE22 GLN 31 -11.142 13.275 -7.564 232 H ALA 32 HN ALA 32 -11.099 8.564 -3.002 233 HA ALA 32 HA ALA 32 -11.662 5.963 -4.207 234 1HB ALA 32 HB1 ALA 32 -12.932 7.298 -1.816 235 2HB ALA 32 HB2 ALA 32 -11.680 6.057 -1.768 236 3HB ALA 32 HB3 ALA 32 -13.282 5.670 -2.395 237 H LEU 33 HN LEU 33 -12.532 6.422 -6.154 238 HA LEU 33 HA LEU 33 -14.560 8.446 -6.479 239 1HB LEU 33 HB2 LEU 33 -12.773 7.774 -8.177 240 2HB LEU 33 HB1 LEU 33 -13.724 6.334 -8.457 241 HG LEU 33 HG LEU 33 -14.862 9.096 -8.843 242 1HD1 LEU 33 HD11 LEU 33 -12.878 8.872 -10.253 243 2HD1 LEU 33 HD12 LEU 33 -14.352 8.849 -11.220 244 3HD1 LEU 33 HD13 LEU 33 -13.495 7.346 -10.883 245 1HD2 LEU 33 HD21 LEU 33 -16.486 7.279 -8.668 246 2HD2 LEU 33 HD22 LEU 33 -15.634 6.387 -9.926 247 3HD2 LEU 33 HD23 LEU 33 -16.428 7.913 -10.313 248 H GLY 34 HN GLY 34 -16.592 8.097 -5.908 249 1HA GLY 34 HA2 GLY 34 -18.617 7.006 -5.621 250 2HA GLY 34 HA1 GLY 34 -17.955 5.636 -6.505 251 H CYS 35 HN CYS 35 -18.270 3.921 -5.251 252 HA CYS 35 HA CYS 35 -17.871 2.415 -3.596 253 1HB CYS 35 HB2 CYS 35 -15.842 4.481 -2.725 254 2HB CYS 35 HB1 CYS 35 -15.941 2.850 -2.077 255 H ASN 36 HN ASN 36 -19.858 4.622 -3.266 256 HA ASN 36 HA ASN 36 -19.728 5.781 -0.716 257 1HB ASN 36 HB2 ASN 36 -21.201 6.505 -2.630 258 2HB ASN 36 HB1 ASN 36 -22.275 5.173 -2.217 259 1HD2 ASN 36 HD21 ASN 36 -20.486 7.184 0.044 260 2HD2 ASN 36 HD22 ASN 36 -21.869 7.914 0.785 261 H ALA 37 HN ALA 37 -20.941 2.655 -1.705 262 HA ALA 37 HA ALA 37 -21.645 2.129 1.110 263 1HB ALA 37 HB1 ALA 37 -23.252 0.468 0.308 264 2HB ALA 37 HB2 ALA 37 -22.831 0.861 -1.359 265 3HB ALA 37 HB3 ALA 37 -23.613 2.069 -0.339 266 H ARG 38 HN ARG 38 -19.042 1.892 -0.255 267 HA ARG 38 HA ARG 38 -18.694 -1.033 -0.169 268 1HB ARG 38 HB2 ARG 38 -18.621 0.125 -2.468 269 2HB ARG 38 HB1 ARG 38 -17.092 0.805 -1.933 270 1HG ARG 38 HG2 ARG 38 -16.346 -1.026 -3.049 271 2HG ARG 38 HG1 ARG 38 -16.532 -1.716 -1.436 272 1HD ARG 38 HD2 ARG 38 -18.606 -1.858 -3.617 273 2HD ARG 38 HD1 ARG 38 -17.454 -3.136 -3.254 274 HE ARG 38 HE ARG 38 -19.494 -2.212 -1.328 275 1HH1 ARG 38 HH11 ARG 38 -17.657 -4.740 -2.895 276 2HH1 ARG 38 HH12 ARG 38 -18.470 -6.028 -2.072 277 1HH2 ARG 38 HH21 ARG 38 -20.578 -3.923 -0.224 278 2HH2 ARG 38 HH22 ARG 38 -20.117 -5.572 -0.553 279 H GLN 39 HN GLN 39 -16.659 -1.799 0.557 280 HA GLN 39 HA GLN 39 -15.186 0.034 2.276 281 1HB GLN 39 HB2 GLN 39 -15.142 -2.970 1.928 282 2HB GLN 39 HB1 GLN 39 -14.014 -2.109 2.966 283 1HG GLN 39 HG2 GLN 39 -15.724 -1.416 4.427 284 2HG GLN 39 HG1 GLN 39 -16.987 -1.868 3.284 285 1HE2 GLN 39 HE21 GLN 39 -15.780 -4.390 2.588 286 2HE2 GLN 39 HE22 GLN 39 -16.009 -5.445 3.939 287 H VAL 40 HN VAL 40 -13.215 0.801 1.767 288 HA VAL 40 HA VAL 40 -12.164 0.054 -0.872 289 HB VAL 40 HB VAL 40 -11.663 2.538 0.780 290 1HG1 VAL 40 HG11 VAL 40 -10.522 3.398 -1.224 291 2HG1 VAL 40 HG12 VAL 40 -10.696 1.818 -1.987 292 3HG1 VAL 40 HG13 VAL 40 -9.704 1.995 -0.540 293 1HG2 VAL 40 HG21 VAL 40 -12.939 3.691 -0.968 294 2HG2 VAL 40 HG22 VAL 40 -13.910 2.470 -0.147 295 3HG2 VAL 40 HG23 VAL 40 -13.255 2.144 -1.752 296 H ALA 41 HN ALA 41 -10.461 -1.253 -0.882 297 HA ALA 41 HA ALA 41 -8.584 -1.168 1.360 298 1HB ALA 41 HB1 ALA 41 -8.076 -3.484 0.905 299 2HB ALA 41 HB2 ALA 41 -9.135 -3.470 -0.506 300 3HB ALA 41 HB3 ALA 41 -9.820 -3.302 1.108 301 H LEU 42 HN LEU 42 -6.344 -1.743 0.740 302 HA LEU 42 HA LEU 42 -5.716 -0.987 -2.031 303 1HB LEU 42 HB2 LEU 42 -4.128 -0.530 0.496 304 2HB LEU 42 HB1 LEU 42 -3.521 -0.224 -1.123 305 HG LEU 42 HG LEU 42 -6.031 1.101 -0.139 306 1HD1 LEU 42 HD11 LEU 42 -4.305 1.648 1.482 307 2HD1 LEU 42 HD12 LEU 42 -4.649 3.047 0.463 308 3HD1 LEU 42 HD13 LEU 42 -3.194 2.088 0.183 309 1HD2 LEU 42 HD21 LEU 42 -3.991 1.836 -2.237 310 2HD2 LEU 42 HD22 LEU 42 -5.438 2.760 -1.831 311 3HD2 LEU 42 HD23 LEU 42 -5.589 1.150 -2.536 312 H LYS 43 HN LYS 43 -5.251 -2.783 -3.115 313 HA LYS 43 HA LYS 43 -3.762 -4.886 -1.713 314 1HB LYS 43 HB2 LYS 43 -5.394 -5.087 -4.252 315 2HB LYS 43 HB1 LYS 43 -4.567 -6.421 -3.446 316 1HG LYS 43 HG2 LYS 43 -6.608 -4.737 -2.090 317 2HG LYS 43 HG1 LYS 43 -7.047 -6.193 -2.989 318 1HD LYS 43 HD2 LYS 43 -6.038 -7.569 -1.433 319 2HD LYS 43 HD1 LYS 43 -4.928 -6.306 -0.886 320 1HE LYS 43 HE2 LYS 43 -6.639 -6.796 0.797 321 2HE LYS 43 HE1 LYS 43 -6.758 -5.138 0.205 322 1HZ LYS 43 HZ1 LYS 43 -8.570 -5.810 -1.229 323 2HZ LYS 43 HZ2 LYS 43 -8.931 -6.195 0.378 324 3HZ LYS 43 HZ3 LYS 43 -8.447 -7.410 -0.695 325 H ALA 44 HN ALA 44 -1.767 -5.053 -2.105 326 HA ALA 44 HA ALA 44 -0.462 -3.539 -4.126 327 1HB ALA 44 HB1 ALA 44 0.627 -3.939 -2.013 328 2HB ALA 44 HB2 ALA 44 1.578 -4.660 -3.312 329 3HB ALA 44 HB3 ALA 44 0.576 -5.680 -2.279 330 H ASP 45 HN ASP 45 0.841 -4.382 -5.816 331 HA ASP 45 HA ASP 45 -0.445 -6.470 -7.291 332 1HB ASP 45 HB2 ASP 45 0.653 -4.482 -8.346 333 2HB ASP 45 HB1 ASP 45 2.214 -5.122 -7.835 334 H THR 46 HN THR 46 0.656 -8.448 -8.018 335 HA THR 46 HA THR 46 1.441 -9.918 -5.777 336 HB THR 46 HB THR 46 0.360 -10.825 -7.852 337 HG1 THR 46 HG1 THR 46 2.434 -11.991 -6.400 338 1HG2 THR 46 HG21 THR 46 3.192 -10.779 -8.893 339 2HG2 THR 46 HG22 THR 46 1.826 -9.868 -9.535 340 3HG2 THR 46 HG23 THR 46 1.842 -11.627 -9.649 341 H ASP 47 HN ASP 47 3.348 -8.003 -7.908 342 HA ASP 47 HA ASP 47 5.860 -9.242 -7.587 343 1HB ASP 47 HB2 ASP 47 5.018 -6.420 -8.172 344 2HB ASP 47 HB1 ASP 47 6.716 -6.816 -7.931 345 H ASN 48 HN ASN 48 4.075 -6.979 -5.581 346 HA ASN 48 HA ASN 48 6.155 -7.251 -3.512 347 1HB ASN 48 HB2 ASN 48 5.621 -4.928 -2.794 348 2HB ASN 48 HB1 ASN 48 6.305 -4.990 -4.413 349 1HD2 ASN 48 HD21 ASN 48 3.754 -3.935 -2.501 350 2HD2 ASN 48 HD22 ASN 48 2.724 -3.362 -3.767 351 H PHE 49 HN PHE 49 3.506 -8.544 -4.173 352 HA PHE 49 HA PHE 49 2.378 -8.361 -1.457 353 1HB PHE 49 HB2 PHE 49 0.834 -7.348 -3.129 354 2HB PHE 49 HB1 PHE 49 0.846 -8.846 -4.035 355 HD1 PHE 49 HD1 PHE 49 -0.673 -6.986 -1.381 356 HD2 PHE 49 HD2 PHE 49 -0.165 -10.926 -2.938 357 HE1 PHE 49 HE1 PHE 49 -2.592 -7.764 -0.057 358 HE2 PHE 49 HE2 PHE 49 -2.092 -11.686 -1.638 359 HZ PHE 49 HZ PHE 49 -3.391 -10.103 -0.309 360 H GLU 50 HN GLU 50 3.081 -10.181 -0.501 361 HA GLU 50 HA GLU 50 3.153 -12.657 -2.084 362 1HB GLU 50 HB2 GLU 50 4.710 -13.512 -0.348 363 2HB GLU 50 HB1 GLU 50 5.326 -12.092 -1.178 364 1HG GLU 50 HG2 GLU 50 4.912 -10.704 0.691 365 2HG GLU 50 HG1 GLU 50 3.925 -11.933 1.474 366 H GLN 51 HN GLN 51 1.279 -13.706 -1.852 367 HA GLN 51 HA GLN 51 -0.307 -15.027 -0.891 368 1HB GLN 51 HB2 GLN 51 1.441 -15.875 0.594 369 2HB GLN 51 HB1 GLN 51 1.210 -14.507 1.672 370 1HG GLN 51 HG2 GLN 51 -1.168 -15.305 1.971 371 2HG GLN 51 HG1 GLN 51 -0.676 -16.780 1.140 372 1HE2 GLN 51 HE21 GLN 51 1.466 -15.013 3.257 373 2HE2 GLN 51 HE22 GLN 51 1.478 -16.179 4.538 374 H GLY 52 HN GLY 52 0.466 -12.385 1.341 375 1HA GLY 52 HA2 GLY 52 -1.918 -10.960 0.910 376 2HA GLY 52 HA1 GLY 52 -2.093 -11.949 2.361 377 H LYS 53 HN LYS 53 0.907 -10.570 1.217 378 HA LYS 53 HA LYS 53 0.875 -8.576 3.387 379 1HB LYS 53 HB2 LYS 53 3.461 -9.862 2.627 380 2HB LYS 53 HB1 LYS 53 2.976 -9.171 4.165 381 1HG LYS 53 HG2 LYS 53 1.867 -11.773 3.153 382 2HG LYS 53 HG1 LYS 53 3.360 -11.673 4.081 383 1HD LYS 53 HD2 LYS 53 2.152 -10.646 5.932 384 2HD LYS 53 HD1 LYS 53 0.655 -10.702 4.995 385 1HE LYS 53 HE2 LYS 53 0.775 -12.552 6.589 386 2HE LYS 53 HE1 LYS 53 0.779 -13.135 4.926 387 1HZ LYS 53 HZ1 LYS 53 3.118 -12.909 6.740 388 2HZ LYS 53 HZ2 LYS 53 3.228 -13.316 5.098 389 3HZ LYS 53 HZ3 LYS 53 2.404 -14.339 6.171 390 H PHE 54 HN PHE 54 1.516 -6.545 2.639 391 HA PHE 54 HA PHE 54 2.918 -6.548 0.063 392 1HB PHE 54 HB2 PHE 54 2.325 -4.041 0.036 393 2HB PHE 54 HB1 PHE 54 1.086 -5.215 -0.358 394 HD1 PHE 54 HD1 PHE 54 -0.944 -4.441 0.258 395 HD2 PHE 54 HD2 PHE 54 2.340 -3.821 2.888 396 HE1 PHE 54 HE1 PHE 54 -2.455 -3.391 1.888 397 HE2 PHE 54 HE2 PHE 54 0.832 -2.779 4.526 398 HZ PHE 54 HZ PHE 54 -1.565 -2.560 4.027 399 H PHE 55 HN PHE 55 4.786 -5.496 -0.243 400 HA PHE 55 HA PHE 55 6.121 -4.247 2.026 401 1HB PHE 55 HB2 PHE 55 8.100 -5.766 1.741 402 2HB PHE 55 HB1 PHE 55 6.687 -6.578 2.395 403 HD1 PHE 55 HD1 PHE 55 8.964 -6.304 -0.431 404 HD2 PHE 55 HD2 PHE 55 5.418 -8.137 1.027 405 HE1 PHE 55 HE1 PHE 55 9.107 -7.990 -2.221 406 HE2 PHE 55 HE2 PHE 55 5.555 -9.829 -0.760 407 HZ PHE 55 HZ PHE 55 7.420 -9.698 -2.433 408 H LEU 56 HN LEU 56 8.390 -3.571 1.328 409 HA LEU 56 HA LEU 56 8.354 -2.472 -1.367 410 1HB LEU 56 HB2 LEU 56 10.619 -2.300 0.612 411 2HB LEU 56 HB1 LEU 56 10.255 -1.216 -0.716 412 HG LEU 56 HG LEU 56 8.539 -1.470 1.750 413 1HD1 LEU 56 HD11 LEU 56 10.638 0.586 1.073 414 2HD1 LEU 56 HD12 LEU 56 10.762 -0.642 2.332 415 3HD1 LEU 56 HD13 LEU 56 9.550 0.635 2.461 416 1HD2 LEU 56 HD21 LEU 56 8.620 0.586 -0.453 417 2HD2 LEU 56 HD22 LEU 56 7.581 0.634 0.972 418 3HD2 LEU 56 HD23 LEU 56 7.375 -0.642 -0.228 419 H ILE 57 HN ILE 57 9.117 -3.723 -3.034 420 HA ILE 57 HA ILE 57 11.074 -5.800 -2.321 421 HB ILE 57 HB ILE 57 9.061 -6.737 -3.313 422 1HG1 ILE 57 HG12 ILE 57 10.093 -7.987 -5.202 423 2HG1 ILE 57 HG11 ILE 57 11.444 -6.858 -5.177 424 1HG2 ILE 57 HG21 ILE 57 8.438 -6.285 -5.638 425 2HG2 ILE 57 HG22 ILE 57 9.675 -5.030 -5.715 426 3HG2 ILE 57 HG23 ILE 57 8.303 -4.850 -4.622 427 1HD1 ILE 57 HD11 ILE 57 10.648 -8.734 -2.962 428 2HD1 ILE 57 HD12 ILE 57 11.974 -7.571 -2.892 429 3HD1 ILE 57 HD13 ILE 57 12.032 -8.905 -4.046 430 H SER 58 HN SER 58 13.054 -5.688 -3.010 431 HA SER 58 HA SER 58 14.063 -3.509 -4.490 432 1HB SER 58 HB2 SER 58 16.175 -4.896 -4.487 433 2HB SER 58 HB1 SER 58 15.466 -4.654 -2.887 434 HG SER 58 HG SER 58 14.394 -6.831 -4.026 435 H ASP 59 HN ASP 59 14.231 -3.225 -6.644 436 HA ASP 59 HA ASP 59 13.134 -5.075 -8.489 437 1HB ASP 59 HB2 ASP 59 13.739 -3.521 -10.180 438 2HB ASP 59 HB1 ASP 59 13.347 -2.549 -8.766 439 H ASN 60 HN ASN 60 16.334 -4.420 -7.321 440 HA ASN 60 HA ASN 60 17.822 -6.032 -9.089 441 1HB ASN 60 HB2 ASN 60 18.827 -4.338 -7.618 442 2HB ASN 60 HB1 ASN 60 18.357 -5.273 -6.206 443 1HD2 ASN 60 HD21 ASN 60 20.476 -5.108 -8.954 444 2HD2 ASN 60 HD22 ASN 60 21.632 -6.262 -8.386 445 H ASN 61 HN ASN 61 15.563 -6.800 -6.734 446 HA ASN 61 HA ASN 61 14.837 -8.677 -5.715 447 1HB ASN 61 HB2 ASN 61 14.870 -9.471 -8.112 448 2HB ASN 61 HB1 ASN 61 16.440 -10.194 -7.783 449 1HD2 ASN 61 HD21 ASN 61 13.969 -11.471 -8.582 450 2HD2 ASN 61 HD22 ASN 61 13.593 -12.623 -7.343 451 H ARG 62 HN ARG 62 16.073 -8.119 -3.873 452 HA ARG 62 HA ARG 62 17.985 -10.218 -3.231 453 1HB ARG 62 HB2 ARG 62 19.458 -8.524 -2.068 454 2HB ARG 62 HB1 ARG 62 19.514 -8.518 -3.823 455 1HG ARG 62 HG2 ARG 62 18.201 -6.539 -3.940 456 2HG ARG 62 HG1 ARG 62 17.825 -6.617 -2.218 457 1HD ARG 62 HD2 ARG 62 19.561 -4.937 -2.791 458 2HD ARG 62 HD1 ARG 62 20.098 -6.152 -1.635 459 HE ARG 62 HE ARG 62 20.786 -6.981 -4.233 460 1HH1 ARG 62 HH11 ARG 62 21.612 -4.479 -1.932 461 2HH1 ARG 62 HH12 ARG 62 23.280 -4.405 -2.417 462 1HH2 ARG 62 HH21 ARG 62 22.974 -6.883 -4.890 463 2HH2 ARG 62 HH22 ARG 62 24.046 -5.758 -4.103 464 H ASP 63 HN ASP 63 15.946 -7.546 -2.067 465 HA ASP 63 HA ASP 63 15.413 -9.112 0.330 466 1HB ASP 63 HB2 ASP 63 17.386 -7.269 0.506 467 2HB ASP 63 HB1 ASP 63 15.990 -6.269 0.898 468 H LYS 64 HN LYS 64 13.848 -7.773 1.794 469 HA LYS 64 HA LYS 64 12.006 -6.070 0.400 470 1HB LYS 64 HB2 LYS 64 10.104 -7.563 0.388 471 2HB LYS 64 HB1 LYS 64 11.410 -8.284 -0.535 472 1HG LYS 64 HG2 LYS 64 10.787 -10.114 0.626 473 2HG LYS 64 HG1 LYS 64 11.886 -9.434 1.825 474 1HD LYS 64 HD2 LYS 64 9.908 -8.299 2.876 475 2HD LYS 64 HD1 LYS 64 8.876 -9.186 1.754 476 1HE LYS 64 HE2 LYS 64 10.797 -10.500 3.667 477 2HE LYS 64 HE1 LYS 64 9.090 -10.231 4.014 478 1HZ LYS 64 HZ1 LYS 64 8.524 -11.595 2.088 479 2HZ LYS 64 HZ2 LYS 64 9.467 -12.463 3.196 480 3HZ LYS 64 HZ3 LYS 64 10.172 -11.870 1.778 481 H LEU 65 HN LEU 65 10.675 -4.974 1.832 482 HA LEU 65 HA LEU 65 10.503 -5.961 4.570 483 1HB LEU 65 HB2 LEU 65 11.040 -3.790 5.514 484 2HB LEU 65 HB1 LEU 65 12.365 -4.448 4.582 485 HG LEU 65 HG LEU 65 10.509 -2.407 3.396 486 1HD1 LEU 65 HD11 LEU 65 13.021 -1.893 4.992 487 2HD1 LEU 65 HD12 LEU 65 11.378 -1.466 5.472 488 3HD1 LEU 65 HD13 LEU 65 12.116 -0.689 4.072 489 1HD2 LEU 65 HD21 LEU 65 13.380 -3.153 2.835 490 2HD2 LEU 65 HD22 LEU 65 12.439 -1.930 1.981 491 3HD2 LEU 65 HD23 LEU 65 11.984 -3.629 1.870 492 H TYR 66 HN TYR 66 8.568 -5.631 5.527 493 HA TYR 66 HA TYR 66 6.422 -4.926 3.778 494 1HB TYR 66 HB2 TYR 66 6.157 -5.367 6.747 495 2HB TYR 66 HB1 TYR 66 4.959 -5.638 5.492 496 HD1 TYR 66 HD1 TYR 66 7.573 -7.091 7.449 497 HD2 TYR 66 HD2 TYR 66 5.357 -7.550 3.848 498 HE1 TYR 66 HE1 TYR 66 8.240 -9.451 7.349 499 HE2 TYR 66 HE2 TYR 66 6.019 -9.917 3.741 500 HH TYR 66 HH TYR 66 7.550 -11.511 6.383 501 H VAL 67 HN VAL 67 5.080 -3.179 3.826 502 HA VAL 67 HA VAL 67 5.626 -1.093 5.799 503 HB VAL 67 HB VAL 67 5.367 0.636 3.986 504 1HG1 VAL 67 HG11 VAL 67 7.533 0.134 4.969 505 2HG1 VAL 67 HG12 VAL 67 7.700 0.480 3.247 506 3HG1 VAL 67 HG13 VAL 67 7.764 -1.187 3.822 507 1HG2 VAL 67 HG21 VAL 67 5.874 -0.048 1.685 508 2HG2 VAL 67 HG22 VAL 67 4.381 -0.782 2.269 509 3HG2 VAL 67 HG23 VAL 67 5.861 -1.738 2.187 510 H ASN 68 HN ASN 68 3.852 -0.232 6.654 511 HA ASN 68 HA ASN 68 1.320 -1.145 5.527 512 1HB ASN 68 HB2 ASN 68 0.309 -0.493 7.676 513 2HB ASN 68 HB1 ASN 68 1.626 -1.636 7.894 514 1HD2 ASN 68 HD21 ASN 68 0.415 0.292 9.753 515 2HD2 ASN 68 HD22 ASN 68 1.727 1.289 10.303 516 H ILE 69 HN ILE 69 0.388 0.120 4.151 517 HA ILE 69 HA ILE 69 0.835 2.949 4.074 518 HB ILE 69 HB ILE 69 -1.390 2.452 2.484 519 1HG1 ILE 69 HG12 ILE 69 0.551 0.144 2.236 520 2HG1 ILE 69 HG11 ILE 69 -1.071 0.021 2.917 521 1HG2 ILE 69 HG21 ILE 69 0.202 2.653 0.624 522 2HG2 ILE 69 HG22 ILE 69 1.534 2.413 1.757 523 3HG2 ILE 69 HG23 ILE 69 0.507 3.839 1.894 524 1HD1 ILE 69 HD11 ILE 69 -1.024 -0.782 0.635 525 2HD1 ILE 69 HD12 ILE 69 -0.376 0.762 0.083 526 3HD1 ILE 69 HD13 ILE 69 -2.006 0.678 0.748 527 H ARG 70 HN ARG 70 0.167 3.629 6.095 528 HA ARG 70 HA ARG 70 -2.652 3.265 6.800 529 1HB ARG 70 HB2 ARG 70 -0.749 2.843 8.456 530 2HB ARG 70 HB1 ARG 70 -0.497 4.583 8.457 531 1HG ARG 70 HG2 ARG 70 -3.129 4.506 8.984 532 2HG ARG 70 HG1 ARG 70 -2.630 2.972 9.698 533 1HD ARG 70 HD2 ARG 70 -2.412 4.486 11.452 534 2HD ARG 70 HD1 ARG 70 -0.769 4.343 10.825 535 HE ARG 70 HE ARG 70 -2.002 6.474 9.508 536 1HH1 ARG 70 HH11 ARG 70 -0.920 5.633 12.739 537 2HH1 ARG 70 HH12 ARG 70 -0.692 7.290 13.220 538 1HH2 ARG 70 HH21 ARG 70 -1.717 8.652 10.162 539 2HH2 ARG 70 HH22 ARG 70 -1.154 8.995 11.773 540 HA PRO 71 HA PRO 71 -3.956 7.280 5.380 541 1HB PRO 71 HB2 PRO 71 -5.127 7.361 8.131 542 2HB PRO 71 HB1 PRO 71 -5.852 7.790 6.582 543 1HG PRO 71 HG2 PRO 71 -6.405 5.458 7.758 544 2HG PRO 71 HG1 PRO 71 -6.252 5.591 5.997 545 1HD PRO 71 HD2 PRO 71 -4.416 4.361 7.964 546 2HD PRO 71 HD1 PRO 71 -4.625 4.009 6.238 547 H MET 72 HN MET 72 -3.033 9.229 5.432 548 HA MET 72 HA MET 72 -0.861 9.774 7.131 549 1HB MET 72 HB2 MET 72 -1.082 10.746 4.884 550 2HB MET 72 HB1 MET 72 -2.470 11.683 5.422 551 1HG MET 72 HG2 MET 72 -0.497 13.068 5.336 552 2HG MET 72 HG1 MET 72 -1.042 12.882 7.003 553 1HE MET 72 HE1 MET 72 2.808 13.109 7.480 554 2HE MET 72 HE2 MET 72 1.232 13.711 7.999 555 3HE MET 72 HE3 MET 72 1.796 14.015 6.356 556 H ASP 73 HN ASP 73 -4.029 11.397 6.943 557 HA ASP 73 HA ASP 73 -4.221 11.542 9.807 558 1HB ASP 73 HB2 ASP 73 -2.737 13.450 9.369 559 2HB ASP 73 HB1 ASP 73 -3.903 14.098 8.220 560 H ASN 74 HN ASN 74 -6.229 10.670 9.811 561 HA ASN 74 HA ASN 74 -8.371 12.459 9.493 562 1HB ASN 74 HB2 ASN 74 -9.689 11.065 7.780 563 2HB ASN 74 HB1 ASN 74 -8.451 12.155 7.173 564 1HD2 ASN 74 HD21 ASN 74 -6.705 11.339 6.125 565 2HD2 ASN 74 HD22 ASN 74 -6.531 9.671 5.717 566 H SER 75 HN SER 75 -8.720 9.022 8.779 567 HA SER 75 HA SER 75 -9.829 8.645 11.478 568 1HB SER 75 HB2 SER 75 -10.988 7.654 8.860 569 2HB SER 75 HB1 SER 75 -11.596 7.228 10.459 570 HG SER 75 HG SER 75 -11.343 9.931 9.685 571 H ALA 76 HN ALA 76 -10.386 6.035 11.487 572 HA ALA 76 HA ALA 76 -7.720 4.863 11.191 573 1HB ALA 76 HB1 ALA 76 -8.430 3.233 12.854 574 2HB ALA 76 HB2 ALA 76 -10.048 3.937 12.871 575 3HB ALA 76 HB3 ALA 76 -8.669 4.876 13.448 576 H TRP 77 HN TRP 77 -7.348 3.068 10.034 577 HA TRP 77 HA TRP 77 -9.605 1.858 8.576 578 1HB TRP 77 HB2 TRP 77 -6.742 2.343 7.816 579 2HB TRP 77 HB1 TRP 77 -7.658 1.070 7.033 580 HD1 TRP 77 HD1 TRP 77 -9.161 4.540 7.842 581 HE1 TRP 77 HE1 TRP 77 -9.771 5.684 5.603 582 HE3 TRP 77 HE3 TRP 77 -7.149 1.131 4.609 583 HZ2 TRP 77 HZ2 TRP 77 -9.431 5.191 2.852 584 HZ3 TRP 77 HZ3 TRP 77 -7.334 1.545 2.191 585 HH2 TRP 77 HH2 TRP 77 -8.450 3.534 1.333 586 H THR 78 HN THR 78 -9.634 -0.433 8.384 587 HA THR 78 HA THR 78 -8.485 -1.904 10.540 588 HB THR 78 HB THR 78 -9.752 -2.962 8.001 589 HG1 THR 78 HG1 THR 78 -10.939 -2.323 10.529 590 1HG2 THR 78 HG21 THR 78 -8.535 -4.670 9.247 591 2HG2 THR 78 HG22 THR 78 -10.273 -4.933 9.386 592 3HG2 THR 78 HG23 THR 78 -9.380 -4.217 10.727 593 H THR 79 HN THR 79 -6.459 -2.608 10.643 594 HA THR 79 HA THR 79 -4.848 -2.397 8.226 595 HB THR 79 HB THR 79 -3.997 -1.064 9.984 596 HG1 THR 79 HG1 THR 79 -2.482 -3.469 9.760 597 1HG2 THR 79 HG21 THR 79 -5.109 -2.119 11.877 598 2HG2 THR 79 HG22 THR 79 -3.382 -1.952 12.190 599 3HG2 THR 79 HG23 THR 79 -4.048 -3.521 11.737 600 H ASP 80 HN ASP 80 -4.482 -4.153 7.116 601 HA ASP 80 HA ASP 80 -3.562 -6.546 8.570 602 1HB ASP 80 HB2 ASP 80 -5.737 -6.376 6.760 603 2HB ASP 80 HB1 ASP 80 -4.439 -7.198 5.902 604 H ASN 81 HN ASN 81 -1.977 -7.845 7.150 605 HA ASN 81 HA ASN 81 0.110 -5.993 6.570 606 1HB ASN 81 HB2 ASN 81 0.133 -8.528 7.405 607 2HB ASN 81 HB1 ASN 81 0.388 -8.816 5.687 608 1HD2 ASN 81 HD21 ASN 81 1.881 -6.209 5.414 609 2HD2 ASN 81 HD22 ASN 81 3.426 -6.533 6.112 610 H GLY 82 HN GLY 82 -2.260 -7.542 4.586 611 1HA GLY 82 HA2 GLY 82 -1.092 -6.176 2.252 612 2HA GLY 82 HA1 GLY 82 -1.569 -7.867 2.117 613 H VAL 83 HN VAL 83 -3.434 -5.991 4.215 614 HA VAL 83 HA VAL 83 -5.424 -5.343 2.176 615 HB VAL 83 HB VAL 83 -6.025 -6.895 4.710 616 1HG1 VAL 83 HG11 VAL 83 -7.738 -5.246 4.301 617 2HG1 VAL 83 HG12 VAL 83 -8.360 -6.857 3.949 618 3HG1 VAL 83 HG13 VAL 83 -7.895 -5.783 2.630 619 1HG2 VAL 83 HG21 VAL 83 -6.836 -8.657 3.238 620 2HG2 VAL 83 HG22 VAL 83 -5.141 -8.300 2.898 621 3HG2 VAL 83 HG23 VAL 83 -6.404 -7.696 1.824 622 H PHE 84 HN PHE 84 -6.118 -3.267 2.505 623 HA PHE 84 HA PHE 84 -6.054 -2.249 5.247 624 1HB PHE 84 HB2 PHE 84 -4.026 -1.639 3.454 625 2HB PHE 84 HB1 PHE 84 -5.117 -0.265 3.316 626 HD1 PHE 84 HD1 PHE 84 -5.672 1.072 5.326 627 HD2 PHE 84 HD2 PHE 84 -2.671 -1.939 5.370 628 HE1 PHE 84 HE1 PHE 84 -4.748 2.034 7.388 629 HE2 PHE 84 HE2 PHE 84 -1.734 -0.979 7.431 630 HZ PHE 84 HZ PHE 84 -2.762 0.986 8.452 631 H TYR 85 HN TYR 85 -8.124 -1.798 5.533 632 HA TYR 85 HA TYR 85 -9.458 -0.069 3.618 633 1HB TYR 85 HB2 TYR 85 -11.421 -1.484 3.418 634 2HB TYR 85 HB1 TYR 85 -10.001 -2.337 2.845 635 HD1 TYR 85 HD1 TYR 85 -12.944 -2.795 4.494 636 HD2 TYR 85 HD2 TYR 85 -8.807 -3.692 4.979 637 HE1 TYR 85 HE1 TYR 85 -13.526 -4.687 5.953 638 HE2 TYR 85 HE2 TYR 85 -9.385 -5.588 6.432 639 HH TYR 85 HH TYR 85 -11.283 -6.282 7.892 640 H LYS 86 HN LYS 86 -10.987 1.228 4.534 641 HA LYS 86 HA LYS 86 -10.993 1.334 7.393 642 1HB LYS 86 HB2 LYS 86 -12.285 3.320 7.221 643 2HB LYS 86 HB1 LYS 86 -11.054 3.385 5.979 644 1HG LYS 86 HG2 LYS 86 -13.949 2.695 5.542 645 2HG LYS 86 HG1 LYS 86 -13.211 4.265 5.243 646 1HD LYS 86 HD2 LYS 86 -11.631 2.994 3.669 647 2HD LYS 86 HD1 LYS 86 -12.806 1.681 3.776 648 1HE LYS 86 HE2 LYS 86 -13.112 4.407 2.597 649 2HE LYS 86 HE1 LYS 86 -13.519 2.842 1.903 650 1HZ LYS 86 HZ1 LYS 86 -15.299 2.714 3.662 651 2HZ LYS 86 HZ2 LYS 86 -15.536 3.876 2.446 652 3HZ LYS 86 HZ3 LYS 86 -14.998 4.352 3.976 653 H ASN 87 HN ASN 87 -12.568 0.833 8.783 654 HA ASN 87 HA ASN 87 -14.194 -1.373 8.193 655 1HB ASN 87 HB2 ASN 87 -13.321 -0.747 10.450 656 2HB ASN 87 HB1 ASN 87 -14.474 0.578 10.492 657 1HD2 ASN 87 HD21 ASN 87 -15.081 -2.670 9.238 658 2HD2 ASN 87 HD22 ASN 87 -16.242 -3.101 10.454 659 H ASP 88 HN ASP 88 -14.767 2.033 8.090 660 HA ASP 88 HA ASP 88 -17.618 1.920 7.888 661 1HB ASP 88 HB2 ASP 88 -15.695 4.124 7.086 662 2HB ASP 88 HB1 ASP 88 -17.440 4.290 7.256 663 H VAL 89 HN VAL 89 -18.880 1.754 6.079 664 HA VAL 89 HA VAL 89 -17.516 1.366 3.529 665 HB VAL 89 HB VAL 89 -19.735 0.762 2.620 666 1HG1 VAL 89 HG11 VAL 89 -19.996 -1.344 3.849 667 2HG1 VAL 89 HG12 VAL 89 -18.972 -0.713 5.139 668 3HG1 VAL 89 HG13 VAL 89 -18.301 -0.973 3.527 669 1HG2 VAL 89 HG21 VAL 89 -20.695 1.176 5.453 670 2HG2 VAL 89 HG22 VAL 89 -21.629 0.438 4.153 671 3HG2 VAL 89 HG23 VAL 89 -21.153 2.132 4.043 672 H GLY 90 HN GLY 90 -17.546 2.788 1.875 673 1HA GLY 90 HA2 GLY 90 -19.056 4.775 1.064 674 2HA GLY 90 HA1 GLY 90 -18.496 5.464 2.584 675 H SER 91 HN SER 91 -17.678 7.080 0.928 676 HA SER 91 HA SER 91 -15.390 6.321 -0.603 677 1HB SER 91 HB2 SER 91 -16.389 9.094 0.105 678 2HB SER 91 HB1 SER 91 -15.302 8.666 -1.217 679 HG SER 91 HG SER 91 -17.018 7.484 -2.163 680 H TRP 92 HN TRP 92 -13.504 8.116 -0.218 681 HA TRP 92 HA TRP 92 -12.919 8.690 2.523 682 1HB TRP 92 HB2 TRP 92 -12.426 6.251 2.423 683 2HB TRP 92 HB1 TRP 92 -11.206 6.602 1.193 684 HD1 TRP 92 HD1 TRP 92 -11.936 7.222 4.926 685 HE1 TRP 92 HE1 TRP 92 -9.700 7.804 6.076 686 HE3 TRP 92 HE3 TRP 92 -8.957 7.428 0.811 687 HZ2 TRP 92 HZ2 TRP 92 -7.037 8.286 5.310 688 HZ3 TRP 92 HZ3 TRP 92 -6.599 7.965 1.099 689 HH2 TRP 92 HH2 TRP 92 -5.640 8.378 3.298 690 H GLY 93 HN GLY 93 -11.328 7.993 -0.523 691 1HA GLY 93 HA2 GLY 93 -9.580 9.093 -1.604 692 2HA GLY 93 HA1 GLY 93 -10.828 10.306 -1.684 693 H GLY 94 HN GLY 94 -7.799 9.402 -0.337 694 1HA GLY 94 HA2 GLY 94 -7.144 12.095 0.293 695 2HA GLY 94 HA1 GLY 94 -7.457 11.171 1.758 696 H THR 95 HN THR 95 -5.143 11.707 2.161 697 HA THR 95 HA THR 95 -3.309 10.091 0.553 698 HB THR 95 HB THR 95 -1.555 11.385 1.920 699 HG1 THR 95 HG1 THR 95 -2.779 13.569 2.414 700 1HG2 THR 95 HG21 THR 95 -1.698 13.318 0.430 701 2HG2 THR 95 HG22 THR 95 -3.363 12.897 0.028 702 3HG2 THR 95 HG23 THR 95 -2.044 11.825 -0.445 703 H ILE 96 HN ILE 96 -2.578 8.212 1.301 704 HA ILE 96 HA ILE 96 -2.319 7.901 4.204 705 HB ILE 96 HB ILE 96 -2.352 5.551 4.033 706 1HG1 ILE 96 HG12 ILE 96 -0.972 5.382 1.970 707 2HG1 ILE 96 HG11 ILE 96 -2.325 4.275 2.027 708 1HG2 ILE 96 HG21 ILE 96 -4.554 6.517 3.950 709 2HG2 ILE 96 HG22 ILE 96 -4.505 5.047 2.982 710 3HG2 ILE 96 HG23 ILE 96 -4.476 6.623 2.193 711 1HD1 ILE 96 HD11 ILE 96 -2.316 5.014 -0.154 712 2HD1 ILE 96 HD12 ILE 96 -1.941 6.668 0.305 713 3HD1 ILE 96 HD13 ILE 96 -3.551 6.015 0.607 714 H GLY 97 HN GLY 97 -0.290 6.731 4.883 715 1HA GLY 97 HA2 GLY 97 1.887 7.585 3.077 716 2HA GLY 97 HA1 GLY 97 1.966 7.740 4.825 717 H ILE 98 HN ILE 98 3.782 6.368 3.032 718 HA ILE 98 HA ILE 98 3.455 3.578 3.778 719 HB ILE 98 HB ILE 98 5.500 5.013 2.089 720 1HG1 ILE 98 HG12 ILE 98 4.726 3.169 0.458 721 2HG1 ILE 98 HG11 ILE 98 3.394 2.932 1.589 722 1HG2 ILE 98 HG21 ILE 98 5.604 2.138 2.979 723 2HG2 ILE 98 HG22 ILE 98 6.743 3.415 3.411 724 3HG2 ILE 98 HG23 ILE 98 6.629 2.864 1.740 725 1HD1 ILE 98 HD11 ILE 98 4.041 5.490 0.150 726 2HD1 ILE 98 HD12 ILE 98 2.700 5.240 1.270 727 3HD1 ILE 98 HD13 ILE 98 2.749 4.362 -0.261 728 H TYR 99 HN TYR 99 4.004 3.026 5.766 729 HA TYR 99 HA TYR 99 6.462 4.190 6.912 730 1HB TYR 99 HB2 TYR 99 4.356 2.805 8.570 731 2HB TYR 99 HB1 TYR 99 5.596 3.934 9.089 732 HD1 TYR 99 HD1 TYR 99 5.098 6.214 9.350 733 HD2 TYR 99 HD2 TYR 99 2.402 3.730 7.198 734 HE1 TYR 99 HE1 TYR 99 3.477 8.055 9.271 735 HE2 TYR 99 HE2 TYR 99 0.769 5.565 7.124 736 HH TYR 99 HH TYR 99 1.581 8.784 8.021 737 H VAL 100 HN VAL 100 8.036 2.730 7.588 738 HA VAL 100 HA VAL 100 7.850 0.041 6.603 739 HB VAL 100 HB VAL 100 9.978 1.306 8.345 740 1HG1 VAL 100 HG11 VAL 100 11.380 -0.592 7.689 741 2HG1 VAL 100 HG12 VAL 100 10.016 -1.298 6.822 742 3HG1 VAL 100 HG13 VAL 100 9.950 -1.123 8.574 743 1HG2 VAL 100 HG21 VAL 100 11.286 1.456 6.305 744 2HG2 VAL 100 HG22 VAL 100 9.778 2.358 6.155 745 3HG2 VAL 100 HG23 VAL 100 9.942 0.780 5.379 746 H ASP 101 HN ASP 101 6.973 -1.635 7.670 747 HA ASP 101 HA ASP 101 6.291 -1.381 10.461 748 1HB ASP 101 HB2 ASP 101 4.875 -2.626 8.765 749 2HB ASP 101 HB1 ASP 101 6.117 -3.875 8.755 750 H GLY 102 HN GLY 102 8.272 -1.130 11.482 751 1HA GLY 102 HA2 GLY 102 10.002 -2.109 12.733 752 2HA GLY 102 HA1 GLY 102 9.865 -3.560 11.748 753 H GLN 103 HN GLN 103 11.053 -0.248 11.806 754 HA GLN 103 HA GLN 103 12.340 0.143 9.492 755 1HB GLN 103 HB2 GLN 103 14.171 1.275 10.851 756 2HB GLN 103 HB1 GLN 103 12.524 1.819 11.129 757 1HG GLN 103 HG2 GLN 103 12.392 0.597 13.178 758 2HG GLN 103 HG1 GLN 103 13.940 -0.184 12.870 759 1HE2 GLN 103 HE21 GLN 103 15.205 2.245 11.882 760 2HE2 GLN 103 HE22 GLN 103 15.496 3.226 13.277 761 H GLN 104 HN GLN 104 13.571 -1.060 8.262 762 HA GLN 104 HA GLN 104 15.323 -3.073 9.401 763 1HB GLN 104 HB2 GLN 104 13.865 -3.521 7.383 764 2HB GLN 104 HB1 GLN 104 14.873 -2.396 6.486 765 1HG GLN 104 HG2 GLN 104 16.751 -3.796 6.621 766 2HG GLN 104 HG1 GLN 104 16.022 -4.788 7.881 767 1HE2 GLN 104 HE21 GLN 104 13.441 -4.948 6.589 768 2HE2 GLN 104 HE22 GLN 104 13.643 -6.018 5.240 769 H THR 105 HN THR 105 15.569 0.100 9.064 770 HA THR 105 HA THR 105 17.270 1.597 9.095 771 HB THR 105 HB THR 105 19.125 -0.775 9.404 772 HG1 THR 105 HG1 THR 105 17.812 -1.125 11.079 773 1HG2 THR 105 HG21 THR 105 20.219 1.417 9.096 774 2HG2 THR 105 HG22 THR 105 20.480 0.775 10.717 775 3HG2 THR 105 HG23 THR 105 19.296 2.056 10.456 776 H ASN 106 HN ASN 106 16.454 0.183 6.575 777 HA ASN 106 HA ASN 106 16.854 0.444 4.367 778 1HB ASN 106 HB2 ASN 106 17.487 2.749 4.932 779 2HB ASN 106 HB1 ASN 106 19.137 2.222 5.244 780 1HD2 ASN 106 HD21 ASN 106 20.479 1.728 3.533 781 2HD2 ASN 106 HD22 ASN 106 20.093 2.147 1.901 782 H THR 107 HN THR 107 17.360 -1.694 4.042 783 HA THR 107 HA THR 107 20.041 -2.674 4.124 784 HB THR 107 HB THR 107 18.503 -4.149 2.254 785 HG1 THR 107 HG1 THR 107 16.715 -4.515 3.987 786 1HG2 THR 107 HG21 THR 107 20.107 -5.076 3.861 787 2HG2 THR 107 HG22 THR 107 18.541 -5.878 3.974 788 3HG2 THR 107 HG23 THR 107 19.009 -4.682 5.182 789 HA PRO 108 HA PRO 108 21.985 -1.007 0.570 790 1HB PRO 108 HB2 PRO 108 22.651 -3.474 -0.676 791 2HB PRO 108 HB1 PRO 108 23.680 -2.482 0.358 792 1HG PRO 108 HG2 PRO 108 22.057 -4.874 1.042 793 2HG PRO 108 HG1 PRO 108 23.577 -4.298 1.753 794 1HD PRO 108 HD2 PRO 108 21.261 -4.044 3.060 795 2HD PRO 108 HD1 PRO 108 22.495 -2.766 3.127 796 HA PRO 109 HA PRO 109 18.368 -1.768 -2.010 797 1HB PRO 109 HB2 PRO 109 17.461 0.754 -2.040 798 2HB PRO 109 HB1 PRO 109 17.302 -0.282 -0.619 799 1HG PRO 109 HG2 PRO 109 19.071 2.031 -1.058 800 2HG PRO 109 HG1 PRO 109 18.503 1.323 0.456 801 1HD PRO 109 HD2 PRO 109 21.038 0.915 -0.862 802 2HD PRO 109 HD1 PRO 109 20.476 0.248 0.697 803 H GLY 110 HN GLY 110 17.382 -0.095 -3.729 804 1HA GLY 110 HA2 GLY 110 19.214 1.272 -5.426 805 2HA GLY 110 HA1 GLY 110 18.727 -0.287 -6.097 806 H ASN 111 HN ASN 111 16.667 -0.561 -6.869 807 HA ASN 111 HA ASN 111 14.803 1.681 -6.451 808 1HB ASN 111 HB2 ASN 111 15.402 1.259 -8.851 809 2HB ASN 111 HB1 ASN 111 14.714 -0.356 -8.691 810 1HD2 ASN 111 HD21 ASN 111 13.123 -0.008 -10.208 811 2HD2 ASN 111 HD22 ASN 111 11.783 1.047 -9.932 812 H TYR 112 HN TYR 112 13.139 1.235 -5.162 813 HA TYR 112 HA TYR 112 12.500 -1.594 -4.720 814 1HB TYR 112 HB2 TYR 112 12.637 0.733 -2.888 815 2HB TYR 112 HB1 TYR 112 11.343 -0.425 -2.590 816 HD1 TYR 112 HD1 TYR 112 11.822 -2.166 -1.145 817 HD2 TYR 112 HD2 TYR 112 15.003 -0.443 -3.372 818 HE1 TYR 112 HE1 TYR 112 13.423 -3.626 0.018 819 HE2 TYR 112 HE2 TYR 112 16.611 -1.904 -2.219 820 HH TYR 112 HH TYR 112 16.829 -3.198 -0.240 821 H THR 113 HN THR 113 10.782 -2.258 -5.622 822 HA THR 113 HA THR 113 8.860 -0.332 -6.674 823 HB THR 113 HB THR 113 9.221 -3.277 -7.261 824 HG1 THR 113 HG1 THR 113 10.727 -1.225 -7.957 825 1HG2 THR 113 HG21 THR 113 6.962 -2.484 -7.779 826 2HG2 THR 113 HG22 THR 113 7.861 -2.818 -9.259 827 3HG2 THR 113 HG23 THR 113 7.635 -1.152 -8.721 828 H LEU 114 HN LEU 114 6.819 -0.208 -5.965 829 HA LEU 114 HA LEU 114 5.596 -2.500 -4.685 830 1HB LEU 114 HB2 LEU 114 4.644 -0.976 -2.881 831 2HB LEU 114 HB1 LEU 114 6.310 -1.486 -2.704 832 HG LEU 114 HG LEU 114 5.788 1.124 -4.026 833 1HD1 LEU 114 HD11 LEU 114 5.619 0.672 -1.047 834 2HD1 LEU 114 HD12 LEU 114 4.300 1.192 -2.095 835 3HD1 LEU 114 HD13 LEU 114 5.692 2.244 -1.842 836 1HD2 LEU 114 HD21 LEU 114 7.882 0.167 -2.082 837 2HD2 LEU 114 HD22 LEU 114 7.857 1.730 -2.897 838 3HD2 LEU 114 HD23 LEU 114 8.061 0.253 -3.834 839 H THR 115 HN THR 115 4.287 -2.685 -6.436 840 HA THR 115 HA THR 115 2.772 -0.430 -7.417 841 HB THR 115 HB THR 115 2.559 -3.358 -8.152 842 HG1 THR 115 HG1 THR 115 4.139 -3.009 -9.565 843 1HG2 THR 115 HG21 THR 115 0.579 -2.038 -8.768 844 2HG2 THR 115 HG22 THR 115 1.485 -2.545 -10.193 845 3HG2 THR 115 HG23 THR 115 1.613 -0.885 -9.612 846 H LEU 116 HN LEU 116 0.703 0.029 -6.955 847 HA LEU 116 HA LEU 116 -0.748 -1.812 -5.171 848 1HB LEU 116 HB2 LEU 116 -0.791 1.191 -5.314 849 2HB LEU 116 HB1 LEU 116 -1.909 0.249 -4.346 850 HG LEU 116 HG LEU 116 1.088 0.335 -3.975 851 1HD1 LEU 116 HD11 LEU 116 0.020 2.440 -3.369 852 2HD1 LEU 116 HD12 LEU 116 0.589 1.581 -1.938 853 3HD1 LEU 116 HD13 LEU 116 -1.127 1.573 -2.349 854 1HD2 LEU 116 HD21 LEU 116 0.122 -1.809 -3.316 855 2HD2 LEU 116 HD22 LEU 116 -1.063 -0.973 -2.314 856 3HD2 LEU 116 HD23 LEU 116 0.651 -0.889 -1.908 857 H THR 117 HN THR 117 -2.467 -2.688 -6.095 858 HA THR 117 HA THR 117 -3.554 -1.472 -8.512 859 HB THR 117 HB THR 117 -4.265 -4.125 -7.241 860 HG1 THR 117 HG1 THR 117 -2.045 -3.352 -8.546 861 1HG2 THR 117 HG21 THR 117 -4.705 -3.066 -10.037 862 2HG2 THR 117 HG22 THR 117 -5.950 -3.246 -8.802 863 3HG2 THR 117 HG23 THR 117 -5.145 -4.673 -9.456 864 H GLY 118 HN GLY 118 -5.061 0.032 -8.173 865 1HA GLY 118 HA2 GLY 118 -6.600 0.373 -5.876 866 2HA GLY 118 HA1 GLY 118 -7.017 0.999 -7.468 867 H GLY 119 HN GLY 119 -8.108 -0.879 -5.022 868 1HA GLY 119 HA2 GLY 119 -10.222 -1.978 -6.605 869 2HA GLY 119 HA1 GLY 119 -9.093 -3.204 -6.043 870 H TYR 120 HN TYR 120 -11.936 -2.700 -5.351 871 HA TYR 120 HA TYR 120 -11.757 -1.741 -2.624 872 1HB TYR 120 HB2 TYR 120 -14.219 -1.969 -2.596 873 2HB TYR 120 HB1 TYR 120 -13.644 -0.942 -3.902 874 HD1 TYR 120 HD1 TYR 120 -15.156 -4.187 -3.068 875 HD2 TYR 120 HD2 TYR 120 -13.971 -1.567 -6.208 876 HE1 TYR 120 HE1 TYR 120 -16.412 -5.560 -4.675 877 HE2 TYR 120 HE2 TYR 120 -15.233 -2.929 -7.822 878 HH TYR 120 HH TYR 120 -17.465 -5.322 -6.879 879 H TRP 121 HN TRP 121 -13.197 -3.019 -1.043 880 HA TRP 121 HA TRP 121 -12.432 -5.850 -1.228 881 1HB TRP 121 HB2 TRP 121 -10.909 -5.008 0.330 882 2HB TRP 121 HB1 TRP 121 -12.061 -3.854 0.987 883 HD1 TRP 121 HD1 TRP 121 -14.109 -5.030 2.444 884 HE1 TRP 121 HE1 TRP 121 -13.970 -6.950 4.137 885 HE3 TRP 121 HE3 TRP 121 -9.641 -7.076 1.009 886 HZ2 TRP 121 HZ2 TRP 121 -12.227 -9.011 4.785 887 HZ3 TRP 121 HZ3 TRP 121 -8.828 -9.045 2.265 888 HH2 TRP 121 HH2 TRP 121 -10.093 -9.977 4.100 889 H ALA 122 HN ALA 122 -13.834 -7.329 -0.294 890 HA ALA 122 HA ALA 122 -16.472 -6.309 0.516 891 1HB ALA 122 HB1 ALA 122 -17.513 -8.206 -0.616 892 2HB ALA 122 HB2 ALA 122 -15.932 -8.748 -1.178 893 3HB ALA 122 HB3 ALA 122 -16.596 -7.217 -1.753 894 H LYS 123 HN LYS 123 -17.505 -7.433 2.128 895 HA LYS 123 HA LYS 123 -17.821 -8.707 3.969 896 1HB LYS 123 HB2 LYS 123 -17.001 -10.529 2.247 897 2HB LYS 123 HB1 LYS 123 -15.573 -10.548 3.270 898 1HG LYS 123 HG2 LYS 123 -17.020 -12.285 4.003 899 2HG LYS 123 HG1 LYS 123 -17.064 -11.006 5.218 900 1HD LYS 123 HD2 LYS 123 -19.101 -11.045 3.030 901 2HD LYS 123 HD1 LYS 123 -19.280 -12.131 4.408 902 1HE LYS 123 HE2 LYS 123 -18.929 -9.146 4.645 903 2HE LYS 123 HE1 LYS 123 -20.496 -9.952 4.617 904 1HZ LYS 123 HZ1 LYS 123 -18.361 -10.234 6.662 905 2HZ LYS 123 HZ2 LYS 123 -19.712 -11.253 6.577 906 3HZ LYS 123 HZ3 LYS 123 -19.919 -9.597 6.870 907 H ASP 124 HN ASP 124 -15.372 -10.214 5.160 908 HA ASP 124 HA ASP 124 -13.593 -8.084 5.880 909 1HB ASP 124 HB2 ASP 124 -14.118 -8.138 8.311 910 2HB ASP 124 HB1 ASP 124 -15.411 -7.458 7.331 911 H ASN 125 HN ASN 125 -11.705 -8.870 6.183 912 HA ASN 125 HA ASN 125 -9.926 -10.151 6.626 913 1HB ASN 125 HB2 ASN 125 -11.791 -11.526 8.529 914 2HB ASN 125 HB1 ASN 125 -10.051 -11.777 8.458 915 1HD2 ASN 125 HD21 ASN 125 -8.667 -10.173 9.178 916 2HD2 ASN 125 HD22 ASN 125 -9.221 -8.824 10.113 917 H LYS 126 HN LYS 126 -12.759 -11.884 5.585 918 HA LYS 126 HA LYS 126 -11.491 -14.389 5.164 919 1HB LYS 126 HB2 LYS 126 -13.477 -15.014 3.955 920 2HB LYS 126 HB1 LYS 126 -13.937 -14.099 5.381 921 1HG LYS 126 HG2 LYS 126 -15.289 -13.049 3.933 922 2HG LYS 126 HG1 LYS 126 -13.837 -12.111 3.569 923 1HD LYS 126 HD2 LYS 126 -13.342 -13.561 1.684 924 2HD LYS 126 HD1 LYS 126 -14.720 -14.589 2.081 925 1HE LYS 126 HE2 LYS 126 -16.206 -12.635 1.732 926 2HE LYS 126 HE1 LYS 126 -14.802 -11.706 1.206 927 1HZ LYS 126 HZ1 LYS 126 -16.079 -12.615 -0.646 928 2HZ LYS 126 HZ2 LYS 126 -15.796 -14.192 -0.087 929 3HZ LYS 126 HZ3 LYS 126 -14.500 -13.238 -0.622 930 H GLN 127 HN GLN 127 -10.959 -11.530 3.708 931 HA GLN 127 HA GLN 127 -9.642 -10.881 2.003 932 1HB GLN 127 HB2 GLN 127 -8.388 -13.021 2.438 933 2HB GLN 127 HB1 GLN 127 -9.359 -13.770 1.177 934 1HG GLN 127 HG2 GLN 127 -8.499 -12.138 -0.437 935 2HG GLN 127 HG1 GLN 127 -7.507 -11.421 0.830 936 1HE2 GLN 127 HE21 GLN 127 -7.922 -14.104 -1.311 937 2HE2 GLN 127 HE22 GLN 127 -6.376 -14.830 -1.028 938 H GLY 128 HN GLY 128 -12.110 -10.348 1.572 939 1HA GLY 128 HA2 GLY 128 -12.697 -11.263 -1.155 940 2HA GLY 128 HA1 GLY 128 -13.797 -10.369 -0.106 941 H PHE 129 HN PHE 129 -11.664 -10.091 -2.683 942 HA PHE 129 HA PHE 129 -11.844 -7.176 -2.407 943 1HB PHE 129 HB2 PHE 129 -9.580 -6.902 -3.311 944 2HB PHE 129 HB1 PHE 129 -9.543 -7.821 -1.814 945 HD1 PHE 129 HD1 PHE 129 -9.109 -10.257 -1.872 946 HD2 PHE 129 HD2 PHE 129 -8.861 -7.844 -5.368 947 HE1 PHE 129 HE1 PHE 129 -7.836 -12.030 -3.000 948 HE2 PHE 129 HE2 PHE 129 -7.589 -9.619 -6.506 949 HZ PHE 129 HZ PHE 129 -7.075 -11.714 -5.322 950 H THR 130 HN THR 130 -11.621 -6.056 -4.509 951 HA THR 130 HA THR 130 -11.720 -7.675 -6.917 952 HB THR 130 HB THR 130 -13.962 -5.734 -6.303 953 HG1 THR 130 HG1 THR 130 -13.661 -8.451 -5.876 954 1HG2 THR 130 HG21 THR 130 -14.956 -6.622 -8.377 955 2HG2 THR 130 HG22 THR 130 -13.509 -7.597 -8.643 956 3HG2 THR 130 HG23 THR 130 -13.405 -5.835 -8.679 957 HA PRO 131 HA PRO 131 -9.136 -4.081 -7.683 958 1HB PRO 131 HB2 PRO 131 -8.614 -5.390 -10.256 959 2HB PRO 131 HB1 PRO 131 -7.489 -4.961 -8.963 960 1HG PRO 131 HG2 PRO 131 -8.168 -7.520 -9.492 961 2HG PRO 131 HG1 PRO 131 -7.790 -6.951 -7.855 962 1HD PRO 131 HD2 PRO 131 -10.454 -7.485 -9.112 963 2HD PRO 131 HD1 PRO 131 -9.898 -7.820 -7.458 964 H SER 132 HN SER 132 -10.102 -2.281 -8.226 965 HA SER 132 HA SER 132 -11.139 -1.872 -10.873 966 1HB SER 132 HB2 SER 132 -13.082 -2.813 -9.552 967 2HB SER 132 HB1 SER 132 -12.972 -1.389 -8.525 968 HG SER 132 HG SER 132 -13.011 -0.563 -11.052 969 H GLY 133 HN GLY 133 -9.986 -0.115 -11.352 970 1HA GLY 133 HA2 GLY 133 -10.244 2.399 -10.546 971 2HA GLY 133 HA1 GLY 133 -9.263 1.746 -9.239 972 H THR 134 HN THR 134 -7.349 2.703 -9.576 973 HA THR 134 HA THR 134 -6.155 2.458 -12.259 974 HB THR 134 HB THR 134 -5.232 4.358 -10.110 975 HG1 THR 134 HG1 THR 134 -7.188 4.823 -12.150 976 1HG2 THR 134 HG21 THR 134 -3.689 3.975 -11.966 977 2HG2 THR 134 HG22 THR 134 -4.337 5.613 -12.026 978 3HG2 THR 134 HG23 THR 134 -4.958 4.378 -13.121 979 H THR 135 HN THR 135 -4.208 1.451 -12.490 980 HA THR 135 HA THR 135 -3.142 0.082 -10.134 981 HB THR 135 HB THR 135 -2.320 -0.268 -13.028 982 HG1 THR 135 HG1 THR 135 -4.636 -0.753 -12.402 983 1HG2 THR 135 HG21 THR 135 -0.707 -1.102 -11.369 984 2HG2 THR 135 HG22 THR 135 -1.458 -2.425 -12.262 985 3HG2 THR 135 HG23 THR 135 -1.983 -2.062 -10.619 986 H GLY 136 HN GLY 136 -1.861 1.488 -9.031 987 1HA GLY 136 HA2 GLY 136 0.071 3.067 -10.606 988 2HA GLY 136 HA1 GLY 136 -0.613 3.584 -9.073 989 H THR 137 HN THR 137 2.156 2.743 -10.320 990 HA THR 137 HA THR 137 3.021 0.955 -8.183 991 HB THR 137 HB THR 137 4.548 2.020 -10.573 992 HG1 THR 137 HG1 THR 137 3.749 -0.673 -10.200 993 1HG2 THR 137 HG21 THR 137 6.214 0.308 -10.022 994 2HG2 THR 137 HG22 THR 137 5.288 -0.136 -8.588 995 3HG2 THR 137 HG23 THR 137 6.028 1.461 -8.699 996 H THR 138 HN THR 138 3.597 1.924 -6.318 997 HA THR 138 HA THR 138 4.647 4.607 -6.291 998 HB THR 138 HB THR 138 4.680 2.624 -3.998 999 HG1 THR 138 HG1 THR 138 2.569 3.752 -5.259 1000 1HG2 THR 138 HG21 THR 138 4.626 5.642 -4.073 1001 2HG2 THR 138 HG22 THR 138 6.025 4.646 -3.677 1002 3HG2 THR 138 HG23 THR 138 4.614 4.646 -2.618 1003 H LYS 139 HN LYS 139 6.691 5.073 -6.744 1004 HA LYS 139 HA LYS 139 8.590 2.837 -6.857 1005 1HB LYS 139 HB2 LYS 139 8.059 4.025 -8.969 1006 2HB LYS 139 HB1 LYS 139 8.659 5.515 -8.262 1007 1HG LYS 139 HG2 LYS 139 10.752 5.020 -8.789 1008 2HG LYS 139 HG1 LYS 139 10.623 3.403 -8.093 1009 1HD LYS 139 HD2 LYS 139 11.151 3.381 -10.514 1010 2HD LYS 139 HD1 LYS 139 9.640 2.556 -10.129 1011 1HE LYS 139 HE2 LYS 139 9.291 3.875 -12.093 1012 2HE LYS 139 HE1 LYS 139 8.421 4.632 -10.762 1013 1HZ LYS 139 HZ1 LYS 139 11.075 5.496 -11.781 1014 2HZ LYS 139 HZ2 LYS 139 10.192 6.246 -10.543 1015 3HZ LYS 139 HZ3 LYS 139 9.600 6.252 -12.129 1016 H LEU 140 HN LEU 140 9.750 2.700 -5.129 1017 HA LEU 140 HA LEU 140 10.726 5.153 -3.863 1018 1HB LEU 140 HB2 LEU 140 9.605 3.984 -2.213 1019 2HB LEU 140 HB1 LEU 140 10.053 2.419 -2.846 1020 HG LEU 140 HG LEU 140 12.364 2.813 -2.023 1021 1HD1 LEU 140 HD11 LEU 140 12.747 4.585 -0.393 1022 2HD1 LEU 140 HD12 LEU 140 11.127 5.216 -0.693 1023 3HD1 LEU 140 HD13 LEU 140 12.337 5.243 -1.976 1024 1HD2 LEU 140 HD21 LEU 140 10.790 1.497 -0.730 1025 2HD2 LEU 140 HD22 LEU 140 10.171 2.959 0.037 1026 3HD2 LEU 140 HD23 LEU 140 11.829 2.439 0.339 1027 H THR 141 HN THR 141 12.503 5.599 -5.052 1028 HA THR 141 HA THR 141 14.528 3.503 -5.422 1029 HB THR 141 HB THR 141 14.489 6.267 -6.659 1030 HG1 THR 141 HG1 THR 141 13.325 3.820 -7.549 1031 1HG2 THR 141 HG21 THR 141 15.944 5.209 -8.350 1032 2HG2 THR 141 HG22 THR 141 15.910 3.710 -7.418 1033 3HG2 THR 141 HG23 THR 141 16.651 5.157 -6.736 1034 H VAL 142 HN VAL 142 16.654 3.804 -4.610 1035 HA VAL 142 HA VAL 142 16.793 5.679 -2.399 1036 HB VAL 142 HB VAL 142 17.674 3.412 -2.093 1037 1HG1 VAL 142 HG11 VAL 142 19.787 2.739 -3.141 1038 2HG1 VAL 142 HG12 VAL 142 19.748 4.197 -4.134 1039 3HG1 VAL 142 HG13 VAL 142 18.500 2.965 -4.327 1040 1HG2 VAL 142 HG21 VAL 142 19.792 5.548 -1.933 1041 2HG2 VAL 142 HG22 VAL 142 19.809 4.014 -1.061 1042 3HG2 VAL 142 HG23 VAL 142 18.556 5.209 -0.720 1043 H THR 143 HN THR 143 17.840 7.560 -2.365 1044 HA THR 143 HA THR 143 19.985 8.124 -4.220 1045 HB THR 143 HB THR 143 17.551 9.929 -4.143 1046 HG1 THR 143 HG1 THR 143 18.006 7.736 -5.589 1047 1HG2 THR 143 HG21 THR 143 18.706 11.144 -5.949 1048 2HG2 THR 143 HG22 THR 143 20.095 10.074 -5.770 1049 3HG2 THR 143 HG23 THR 143 19.641 11.156 -4.454 Start of MODEL 9 1 H GLU 1 H GLU 1 -22.267 0.868 -10.898 2 HA GLU 1 HA GLU 1 -22.033 0.901 -8.487 3 1HB GLU 1 HB2 GLU 1 -20.481 -0.722 -7.444 4 2HB GLU 1 HB1 GLU 1 -21.955 -1.478 -8.025 5 1HG GLU 1 HG2 GLU 1 -19.358 -1.503 -9.543 6 2HG GLU 1 HG1 GLU 1 -19.856 -2.771 -8.424 7 H GLU 2 HN GLU 2 -20.449 2.218 -7.804 8 HA GLU 2 HA GLU 2 -18.025 2.392 -9.458 9 1HB GLU 2 HB2 GLU 2 -19.729 4.228 -9.929 10 2HB GLU 2 HB1 GLU 2 -19.443 4.788 -8.286 11 1HG GLU 2 HG2 GLU 2 -18.049 6.131 -9.553 12 2HG GLU 2 HG1 GLU 2 -16.964 4.867 -8.972 13 H CYS 3 HN CYS 3 -16.225 2.345 -8.297 14 HA CYS 3 HA CYS 3 -15.944 3.685 -5.809 15 1HB CYS 3 HB2 CYS 3 -17.104 1.547 -5.091 16 2HB CYS 3 HB1 CYS 3 -15.703 0.667 -5.693 17 H GLN 4 HN GLN 4 -14.524 4.489 -7.549 18 HA GLN 4 HA GLN 4 -12.399 2.718 -8.404 19 1HB GLN 4 HB2 GLN 4 -12.868 5.621 -9.084 20 2HB GLN 4 HB1 GLN 4 -11.716 4.547 -9.862 21 1HG GLN 4 HG2 GLN 4 -14.712 4.447 -9.989 22 2HG GLN 4 HG1 GLN 4 -13.569 4.722 -11.303 23 1HE2 GLN 4 HE21 GLN 4 -12.335 2.966 -12.078 24 2HE2 GLN 4 HE22 GLN 4 -12.854 1.332 -11.826 25 H VAL 5 HN VAL 5 -10.771 2.426 -7.070 26 HA VAL 5 HA VAL 5 -9.871 4.517 -5.294 27 HB VAL 5 HB VAL 5 -8.617 1.827 -5.896 28 1HG1 VAL 5 HG11 VAL 5 -7.026 3.402 -4.940 29 2HG1 VAL 5 HG12 VAL 5 -7.439 2.145 -3.774 30 3HG1 VAL 5 HG13 VAL 5 -8.147 3.753 -3.625 31 1HG2 VAL 5 HG21 VAL 5 -10.438 2.643 -3.635 32 2HG2 VAL 5 HG22 VAL 5 -9.662 1.070 -3.822 33 3HG2 VAL 5 HG23 VAL 5 -10.878 1.600 -4.986 34 H ARG 6 HN ARG 6 -8.771 6.158 -6.131 35 HA ARG 6 HA ARG 6 -7.381 5.844 -8.631 36 1HB ARG 6 HB2 ARG 6 -8.658 7.886 -8.212 37 2HB ARG 6 HB1 ARG 6 -7.627 8.266 -6.839 38 1HG ARG 6 HG2 ARG 6 -5.795 8.765 -8.195 39 2HG ARG 6 HG1 ARG 6 -6.482 7.925 -9.586 40 1HD ARG 6 HD2 ARG 6 -6.567 10.369 -9.836 41 2HD ARG 6 HD1 ARG 6 -8.170 9.642 -9.831 42 HE ARG 6 HE ARG 6 -8.499 10.505 -7.624 43 1HH1 ARG 6 HH11 ARG 6 -5.601 11.661 -9.216 44 2HH1 ARG 6 HH12 ARG 6 -5.503 13.107 -8.250 45 1HH2 ARG 6 HH21 ARG 6 -8.387 12.427 -6.383 46 2HH2 ARG 6 HH22 ARG 6 -7.085 13.543 -6.656 47 H VAL 7 HN VAL 7 -5.757 4.467 -8.234 48 HA VAL 7 HA VAL 7 -3.583 5.386 -6.490 49 HB VAL 7 HB VAL 7 -2.641 3.058 -7.032 50 1HG1 VAL 7 HG11 VAL 7 -3.989 1.985 -5.303 51 2HG1 VAL 7 HG12 VAL 7 -5.213 3.245 -5.466 52 3HG1 VAL 7 HG13 VAL 7 -3.608 3.648 -4.855 53 1HG2 VAL 7 HG21 VAL 7 -5.480 2.668 -7.933 54 2HG2 VAL 7 HG22 VAL 7 -4.308 1.379 -7.660 55 3HG2 VAL 7 HG23 VAL 7 -4.034 2.565 -8.935 56 H GLY 8 HN GLY 8 -1.540 5.776 -7.345 57 1HA GLY 8 HA2 GLY 8 -1.341 5.687 -10.274 58 2HA GLY 8 HA1 GLY 8 -1.101 7.217 -9.444 59 H ASP 9 HN ASP 9 0.835 6.210 -11.057 60 HA ASP 9 HA ASP 9 2.867 4.941 -9.446 61 1HB ASP 9 HB2 ASP 9 2.768 5.998 -12.263 62 2HB ASP 9 HB1 ASP 9 4.305 5.584 -11.511 63 H LEU 10 HN LEU 10 4.384 5.935 -8.300 64 HA LEU 10 HA LEU 10 5.078 8.696 -8.877 65 1HB LEU 10 HB2 LEU 10 4.841 9.404 -6.543 66 2HB LEU 10 HB1 LEU 10 3.301 8.955 -7.245 67 HG LEU 10 HG LEU 10 4.792 6.919 -5.648 68 1HD1 LEU 10 HD11 LEU 10 3.113 9.139 -4.479 69 2HD1 LEU 10 HD12 LEU 10 4.852 8.940 -4.267 70 3HD1 LEU 10 HD13 LEU 10 3.740 7.744 -3.599 71 1HD2 LEU 10 HD21 LEU 10 2.531 6.196 -5.095 72 2HD2 LEU 10 HD22 LEU 10 2.751 6.295 -6.843 73 3HD2 LEU 10 HD23 LEU 10 1.865 7.562 -5.992 74 H THR 11 HN THR 11 7.162 9.150 -8.456 75 HA THR 11 HA THR 11 8.776 6.925 -7.422 76 HB THR 11 HB THR 11 9.696 9.315 -9.036 77 HG1 THR 11 HG1 THR 11 8.631 8.200 -10.541 78 1HG2 THR 11 HG21 THR 11 11.461 8.275 -7.682 79 2HG2 THR 11 HG22 THR 11 11.719 7.978 -9.403 80 3HG2 THR 11 HG23 THR 11 11.067 6.701 -8.376 81 H VAL 12 HN VAL 12 9.615 7.085 -5.474 82 HA VAL 12 HA VAL 12 10.012 9.766 -4.302 83 HB VAL 12 HB VAL 12 9.390 7.214 -2.803 84 1HG1 VAL 12 HG11 VAL 12 10.736 8.776 -1.516 85 2HG1 VAL 12 HG12 VAL 12 9.096 8.692 -0.867 86 3HG1 VAL 12 HG13 VAL 12 9.586 10.070 -1.854 87 1HG2 VAL 12 HG21 VAL 12 7.593 9.553 -3.440 88 2HG2 VAL 12 HG22 VAL 12 7.192 8.233 -2.342 89 3HG2 VAL 12 HG23 VAL 12 7.437 7.909 -4.058 90 H ALA 13 HN ALA 13 12.120 10.191 -4.315 91 HA ALA 13 HA ALA 13 14.044 8.011 -4.053 92 1HB ALA 13 HB1 ALA 13 14.509 10.943 -4.599 93 2HB ALA 13 HB2 ALA 13 14.403 9.673 -5.818 94 3HB ALA 13 HB3 ALA 13 15.726 9.668 -4.653 95 H LYS 14 HN LYS 14 14.235 7.395 -1.958 96 HA LYS 14 HA LYS 14 15.477 9.194 -0.114 97 1HB LYS 14 HB2 LYS 14 12.819 9.505 -0.056 98 2HB LYS 14 HB1 LYS 14 12.927 8.095 0.983 99 1HG LYS 14 HG2 LYS 14 12.939 9.910 2.438 100 2HG LYS 14 HG1 LYS 14 14.627 9.414 2.332 101 1HD LYS 14 HD2 LYS 14 14.496 11.822 2.217 102 2HD LYS 14 HD1 LYS 14 14.996 11.195 0.644 103 1HE LYS 14 HE2 LYS 14 12.755 11.458 -0.221 104 2HE LYS 14 HE1 LYS 14 12.163 11.943 1.368 105 1HZ LYS 14 HZ1 LYS 14 12.498 13.857 -0.047 106 2HZ LYS 14 HZ2 LYS 14 14.124 13.446 -0.290 107 3HZ LYS 14 HZ3 LYS 14 13.584 13.902 1.254 108 H THR 15 HN THR 15 15.907 8.122 1.992 109 HA THR 15 HA THR 15 16.582 5.327 1.522 110 HB THR 15 HB THR 15 17.877 5.514 3.610 111 HG1 THR 15 HG1 THR 15 17.126 8.263 3.683 112 1HG2 THR 15 HG21 THR 15 19.516 7.189 2.874 113 2HG2 THR 15 HG22 THR 15 18.337 7.835 1.731 114 3HG2 THR 15 HG23 THR 15 18.955 6.196 1.529 115 H ARG 16 HN ARG 16 16.048 3.650 3.112 116 HA ARG 16 HA ARG 16 13.485 4.006 4.370 117 1HB ARG 16 HB2 ARG 16 15.363 1.689 4.829 118 2HB ARG 16 HB1 ARG 16 13.634 1.733 5.132 119 1HG ARG 16 HG2 ARG 16 13.643 0.548 3.186 120 2HG ARG 16 HG1 ARG 16 13.557 2.191 2.525 121 1HD ARG 16 HD2 ARG 16 15.513 1.919 1.492 122 2HD ARG 16 HD1 ARG 16 16.289 1.524 3.018 123 HE ARG 16 HE ARG 16 15.464 -0.307 0.960 124 1HH1 ARG 16 HH11 ARG 16 16.031 0.031 4.415 125 2HH1 ARG 16 HH12 ARG 16 16.445 -1.635 4.647 126 1HH2 ARG 16 HH21 ARG 16 16.061 -2.514 1.286 127 2HH2 ARG 16 HH22 ARG 16 16.457 -3.075 2.876 128 H GLY 17 HN GLY 17 16.504 5.018 5.159 129 1HA GLY 17 HA2 GLY 17 16.376 4.724 8.014 130 2HA GLY 17 HA1 GLY 17 17.442 5.806 7.119 131 H GLN 18 HN GLN 18 15.104 6.874 5.633 132 HA GLN 18 HA GLN 18 14.131 8.907 7.335 133 1HB GLN 18 HB2 GLN 18 14.063 9.350 5.018 134 2HB GLN 18 HB1 GLN 18 13.301 7.809 4.658 135 1HG GLN 18 HG2 GLN 18 11.711 9.563 4.333 136 2HG GLN 18 HG1 GLN 18 11.237 8.614 5.737 137 1HE2 GLN 18 HE21 GLN 18 12.462 11.668 4.623 138 2HE2 GLN 18 HE22 GLN 18 12.168 12.544 6.082 139 H LEU 19 HN LEU 19 12.777 5.886 6.136 140 HA LEU 19 HA LEU 19 10.348 6.103 7.601 141 1HB LEU 19 HB2 LEU 19 11.457 3.514 6.567 142 2HB LEU 19 HB1 LEU 19 9.782 4.022 6.714 143 HG LEU 19 HG LEU 19 11.718 5.186 4.716 144 1HD1 LEU 19 HD11 LEU 19 10.521 3.853 3.055 145 2HD1 LEU 19 HD12 LEU 19 9.576 3.094 4.336 146 3HD1 LEU 19 HD13 LEU 19 11.317 2.824 4.248 147 1HD2 LEU 19 HD21 LEU 19 8.726 5.398 5.005 148 2HD2 LEU 19 HD22 LEU 19 9.689 6.081 3.694 149 3HD2 LEU 19 HD23 LEU 19 9.894 6.673 5.343 150 H THR 20 HN THR 20 10.860 6.373 9.751 151 HA THR 20 HA THR 20 12.337 4.275 11.108 152 HB THR 20 HB THR 20 11.608 5.990 13.086 153 HG1 THR 20 HG1 THR 20 12.098 7.619 10.794 154 1HG2 THR 20 HG21 THR 20 13.866 6.942 12.868 155 2HG2 THR 20 HG22 THR 20 13.989 6.273 11.243 156 3HG2 THR 20 HG23 THR 20 13.882 5.195 12.633 157 H ASP 21 HN ASP 21 10.563 2.837 10.475 158 HA ASP 21 HA ASP 21 8.689 1.631 10.796 159 1HB ASP 21 HB2 ASP 21 9.378 1.486 13.146 160 2HB ASP 21 HB1 ASP 21 8.569 3.014 13.487 161 H ALA 22 HN ALA 22 7.395 4.233 12.768 162 HA ALA 22 HA ALA 22 5.320 4.620 10.775 163 1HB ALA 22 HB1 ALA 22 5.583 5.855 13.512 164 2HB ALA 22 HB2 ALA 22 4.693 4.378 13.136 165 3HB ALA 22 HB3 ALA 22 4.169 5.921 12.460 166 H ALA 23 HN ALA 23 7.258 5.458 9.456 167 HA ALA 23 HA ALA 23 6.985 8.372 9.464 168 1HB ALA 23 HB1 ALA 23 9.629 6.953 9.143 169 2HB ALA 23 HB2 ALA 23 9.140 7.924 10.532 170 3HB ALA 23 HB3 ALA 23 9.352 8.684 8.954 171 HA PRO 24 HA PRO 24 6.110 7.095 5.303 172 1HB PRO 24 HB2 PRO 24 4.661 9.232 4.638 173 2HB PRO 24 HB1 PRO 24 4.056 8.043 5.796 174 1HG PRO 24 HG2 PRO 24 5.226 10.746 6.285 175 2HG PRO 24 HG1 PRO 24 3.891 9.934 7.121 176 1HD PRO 24 HD2 PRO 24 6.528 10.061 8.019 177 2HD PRO 24 HD1 PRO 24 5.303 8.915 8.580 178 H ILE 25 HN ILE 25 6.831 7.546 3.284 179 HA ILE 25 HA ILE 25 8.764 9.733 2.983 180 HB ILE 25 HB ILE 25 9.033 8.357 0.688 181 1HG1 ILE 25 HG12 ILE 25 8.276 6.281 2.756 182 2HG1 ILE 25 HG11 ILE 25 7.274 6.749 1.389 183 1HG2 ILE 25 HG21 ILE 25 10.330 7.654 3.314 184 2HG2 ILE 25 HG22 ILE 25 10.826 8.941 2.213 185 3HG2 ILE 25 HG23 ILE 25 10.958 7.255 1.714 186 1HD1 ILE 25 HD11 ILE 25 9.997 5.479 1.214 187 2HD1 ILE 25 HD12 ILE 25 8.980 5.938 -0.152 188 3HD1 ILE 25 HD13 ILE 25 8.451 4.670 0.955 189 H GLY 26 HN GLY 26 6.325 8.103 0.939 190 1HA GLY 26 HA2 GLY 26 5.681 10.755 -0.170 191 2HA GLY 26 HA1 GLY 26 5.896 9.350 -1.204 192 HA PRO 27 HA PRO 27 1.613 9.144 1.309 193 1HB PRO 27 HB2 PRO 27 1.149 12.058 0.924 194 2HB PRO 27 HB1 PRO 27 0.670 11.008 2.263 195 1HG PRO 27 HG2 PRO 27 2.693 12.743 2.505 196 2HG PRO 27 HG1 PRO 27 2.731 11.153 3.289 197 1HD PRO 27 HD2 PRO 27 4.180 12.099 0.865 198 2HD PRO 27 HD1 PRO 27 4.689 10.945 2.107 199 H VAL 28 HN VAL 28 0.519 8.214 -0.279 200 HA VAL 28 HA VAL 28 0.490 9.331 -2.954 201 HB VAL 28 HB VAL 28 -0.929 6.860 -1.930 202 1HG1 VAL 28 HG11 VAL 28 -0.193 7.730 -4.726 203 2HG1 VAL 28 HG12 VAL 28 -1.816 7.666 -4.038 204 3HG1 VAL 28 HG13 VAL 28 -0.908 6.177 -4.294 205 1HG2 VAL 28 HG21 VAL 28 0.967 5.588 -2.819 206 2HG2 VAL 28 HG22 VAL 28 1.466 6.680 -1.528 207 3HG2 VAL 28 HG23 VAL 28 1.794 7.096 -3.209 208 H THR 29 HN THR 29 -1.163 10.449 -3.848 209 HA THR 29 HA THR 29 -3.407 11.193 -2.232 210 HB THR 29 HB THR 29 -4.171 12.308 -4.408 211 HG1 THR 29 HG1 THR 29 -3.045 11.235 -5.967 212 1HG2 THR 29 HG21 THR 29 -3.037 13.531 -2.624 213 2HG2 THR 29 HG22 THR 29 -2.500 14.097 -4.204 214 3HG2 THR 29 HG23 THR 29 -1.470 13.025 -3.255 215 H VAL 30 HN VAL 30 -4.366 9.178 -1.798 216 HA VAL 30 HA VAL 30 -5.484 7.684 -4.044 217 HB VAL 30 HB VAL 30 -5.657 7.070 -1.093 218 1HG1 VAL 30 HG11 VAL 30 -6.213 5.374 -3.521 219 2HG1 VAL 30 HG12 VAL 30 -7.395 5.985 -2.365 220 3HG1 VAL 30 HG13 VAL 30 -6.201 4.791 -1.858 221 1HG2 VAL 30 HG21 VAL 30 -3.717 6.028 -3.163 222 2HG2 VAL 30 HG22 VAL 30 -3.873 5.416 -1.517 223 3HG2 VAL 30 HG23 VAL 30 -3.328 7.069 -1.794 224 H GLN 31 HN GLN 31 -7.381 8.283 -4.755 225 HA GLN 31 HA GLN 31 -9.339 9.385 -2.866 226 1HB GLN 31 HB2 GLN 31 -8.668 10.962 -4.627 227 2HB GLN 31 HB1 GLN 31 -9.137 9.793 -5.855 228 1HG GLN 31 HG2 GLN 31 -11.456 9.916 -5.073 229 2HG GLN 31 HG1 GLN 31 -10.976 11.116 -3.873 230 1HE2 GLN 31 HE21 GLN 31 -12.330 12.670 -4.720 231 2HE2 GLN 31 HE22 GLN 31 -11.999 13.475 -6.223 232 H ALA 32 HN ALA 32 -11.261 8.384 -2.654 233 HA ALA 32 HA ALA 32 -11.741 6.000 -4.293 234 1HB ALA 32 HB1 ALA 32 -13.007 6.828 -1.679 235 2HB ALA 32 HB2 ALA 32 -11.702 5.657 -1.864 236 3HB ALA 32 HB3 ALA 32 -13.294 5.314 -2.538 237 H LEU 33 HN LEU 33 -12.821 6.600 -6.080 238 HA LEU 33 HA LEU 33 -14.741 8.762 -5.998 239 1HB LEU 33 HB2 LEU 33 -13.227 8.429 -7.928 240 2HB LEU 33 HB1 LEU 33 -14.008 6.895 -8.256 241 HG LEU 33 HG LEU 33 -16.134 8.095 -8.678 242 1HD1 LEU 33 HD11 LEU 33 -14.429 10.563 -8.387 243 2HD1 LEU 33 HD12 LEU 33 -15.738 10.068 -7.314 244 3HD1 LEU 33 HD13 LEU 33 -16.087 10.522 -8.982 245 1HD2 LEU 33 HD21 LEU 33 -13.793 9.035 -10.329 246 2HD2 LEU 33 HD22 LEU 33 -15.482 9.019 -10.838 247 3HD2 LEU 33 HD23 LEU 33 -14.642 7.501 -10.518 248 H GLY 34 HN GLY 34 -16.707 8.418 -5.229 249 1HA GLY 34 HA2 GLY 34 -18.870 7.528 -5.359 250 2HA GLY 34 HA1 GLY 34 -18.233 6.145 -6.232 251 H CYS 35 HN CYS 35 -18.302 4.336 -5.187 252 HA CYS 35 HA CYS 35 -18.213 2.752 -3.591 253 1HB CYS 35 HB2 CYS 35 -16.995 4.866 -1.806 254 2HB CYS 35 HB1 CYS 35 -16.964 3.126 -1.537 255 H ASN 36 HN ASN 36 -18.850 5.632 -1.605 256 HA ASN 36 HA ASN 36 -20.566 6.293 -0.312 257 1HB ASN 36 HB2 ASN 36 -22.097 4.561 -2.234 258 2HB ASN 36 HB1 ASN 36 -22.896 5.412 -0.917 259 1HD2 ASN 36 HD21 ASN 36 -21.340 5.705 -3.990 260 2HD2 ASN 36 HD22 ASN 36 -21.686 7.389 -4.235 261 H ALA 37 HN ALA 37 -21.009 2.794 -0.830 262 HA ALA 37 HA ALA 37 -21.090 2.500 2.103 263 1HB ALA 37 HB1 ALA 37 -22.874 1.063 0.133 264 2HB ALA 37 HB2 ALA 37 -23.373 2.350 1.231 265 3HB ALA 37 HB3 ALA 37 -22.832 0.802 1.875 266 H ARG 38 HN ARG 38 -18.795 2.195 0.588 267 HA ARG 38 HA ARG 38 -18.466 -0.727 0.492 268 1HB ARG 38 HB2 ARG 38 -18.586 0.368 -1.771 269 2HB ARG 38 HB1 ARG 38 -17.116 1.241 -1.351 270 1HG ARG 38 HG2 ARG 38 -16.658 -0.708 -2.744 271 2HG ARG 38 HG1 ARG 38 -15.899 -0.840 -1.157 272 1HD ARG 38 HD2 ARG 38 -16.876 -2.958 -1.773 273 2HD ARG 38 HD1 ARG 38 -17.760 -2.270 -0.414 274 HE ARG 38 HE ARG 38 -19.196 -1.434 -2.552 275 1HH1 ARG 38 HH11 ARG 38 -17.988 -4.573 -1.572 276 2HH1 ARG 38 HH12 ARG 38 -19.303 -5.457 -2.291 277 1HH2 ARG 38 HH21 ARG 38 -20.938 -2.594 -3.499 278 2HH2 ARG 38 HH22 ARG 38 -20.990 -4.324 -3.359 279 H GLN 39 HN GLN 39 -16.507 -1.560 1.168 280 HA GLN 39 HA GLN 39 -14.853 0.184 2.787 281 1HB GLN 39 HB2 GLN 39 -14.779 -2.811 2.310 282 2HB GLN 39 HB1 GLN 39 -13.712 -1.943 3.407 283 1HG GLN 39 HG2 GLN 39 -15.336 -1.568 4.950 284 2HG GLN 39 HG1 GLN 39 -16.630 -1.559 3.755 285 1HE2 GLN 39 HE21 GLN 39 -16.327 -2.968 6.328 286 2HE2 GLN 39 HE22 GLN 39 -16.578 -4.640 5.963 287 H VAL 40 HN VAL 40 -13.052 1.095 2.063 288 HA VAL 40 HA VAL 40 -11.998 0.324 -0.542 289 HB VAL 40 HB VAL 40 -11.176 2.609 1.265 290 1HG1 VAL 40 HG11 VAL 40 -9.408 1.996 -0.268 291 2HG1 VAL 40 HG12 VAL 40 -10.130 3.523 -0.775 292 3HG1 VAL 40 HG13 VAL 40 -10.532 2.032 -1.626 293 1HG2 VAL 40 HG21 VAL 40 -12.459 4.026 -0.299 294 2HG2 VAL 40 HG22 VAL 40 -13.476 2.881 0.572 295 3HG2 VAL 40 HG23 VAL 40 -13.041 2.569 -1.108 296 H ALA 41 HN ALA 41 -10.316 -1.038 -0.699 297 HA ALA 41 HA ALA 41 -8.529 -1.333 1.603 298 1HB ALA 41 HB1 ALA 41 -9.330 -3.499 -0.335 299 2HB ALA 41 HB2 ALA 41 -10.068 -3.261 1.247 300 3HB ALA 41 HB3 ALA 41 -8.359 -3.679 1.128 301 H LEU 42 HN LEU 42 -6.348 -1.581 1.156 302 HA LEU 42 HA LEU 42 -5.587 -0.958 -1.600 303 1HB LEU 42 HB2 LEU 42 -4.155 -0.657 1.028 304 2HB LEU 42 HB1 LEU 42 -3.282 -0.608 -0.492 305 HG LEU 42 HG LEU 42 -4.830 1.271 -1.182 306 1HD1 LEU 42 HD11 LEU 42 -6.581 0.871 0.487 307 2HD1 LEU 42 HD12 LEU 42 -5.954 2.516 0.561 308 3HD1 LEU 42 HD13 LEU 42 -5.452 1.327 1.766 309 1HD2 LEU 42 HD21 LEU 42 -3.568 2.954 0.064 310 2HD2 LEU 42 HD22 LEU 42 -2.529 1.655 -0.521 311 3HD2 LEU 42 HD23 LEU 42 -3.007 1.705 1.175 312 H LYS 43 HN LYS 43 -5.395 -2.743 -2.744 313 HA LYS 43 HA LYS 43 -4.057 -5.084 -1.606 314 1HB LYS 43 HB2 LYS 43 -5.743 -4.609 -4.040 315 2HB LYS 43 HB1 LYS 43 -4.648 -5.975 -4.009 316 1HG LYS 43 HG2 LYS 43 -6.915 -6.625 -3.401 317 2HG LYS 43 HG1 LYS 43 -5.796 -6.875 -2.062 318 1HD LYS 43 HD2 LYS 43 -7.152 -4.264 -2.109 319 2HD LYS 43 HD1 LYS 43 -8.200 -5.661 -1.848 320 1HE LYS 43 HE2 LYS 43 -5.738 -4.955 -0.258 321 2HE LYS 43 HE1 LYS 43 -7.409 -4.761 0.270 322 1HZ LYS 43 HZ1 LYS 43 -7.713 -7.110 0.242 323 2HZ LYS 43 HZ2 LYS 43 -6.297 -6.790 1.118 324 3HZ LYS 43 HZ3 LYS 43 -6.197 -7.361 -0.467 325 H ALA 44 HN ALA 44 -2.212 -5.970 -2.645 326 HA ALA 44 HA ALA 44 -0.796 -4.039 -4.343 327 1HB ALA 44 HB1 ALA 44 0.309 -4.410 -2.208 328 2HB ALA 44 HB2 ALA 44 1.284 -5.043 -3.535 329 3HB ALA 44 HB3 ALA 44 0.353 -6.145 -2.518 330 H ASP 45 HN ASP 45 0.534 -4.904 -6.019 331 HA ASP 45 HA ASP 45 -0.710 -7.125 -7.383 332 1HB ASP 45 HB2 ASP 45 0.094 -5.050 -8.547 333 2HB ASP 45 HB1 ASP 45 1.743 -5.511 -8.139 334 H THR 46 HN THR 46 0.504 -9.064 -8.038 335 HA THR 46 HA THR 46 1.815 -10.253 -5.878 336 HB THR 46 HB THR 46 0.697 -11.543 -7.677 337 HG1 THR 46 HG1 THR 46 3.196 -12.085 -6.619 338 1HG2 THR 46 HG21 THR 46 1.534 -10.334 -9.622 339 2HG2 THR 46 HG22 THR 46 1.936 -12.049 -9.736 340 3HG2 THR 46 HG23 THR 46 3.174 -10.880 -9.274 341 H ASP 47 HN ASP 47 3.061 -8.099 -8.182 342 HA ASP 47 HA ASP 47 5.767 -8.729 -8.313 343 1HB ASP 47 HB2 ASP 47 4.816 -6.969 -9.654 344 2HB ASP 47 HB1 ASP 47 4.332 -6.069 -8.223 345 H ASN 48 HN ASN 48 3.937 -7.117 -5.749 346 HA ASN 48 HA ASN 48 6.260 -7.479 -3.977 347 1HB ASN 48 HB2 ASN 48 5.869 -5.339 -2.899 348 2HB ASN 48 HB1 ASN 48 6.110 -5.067 -4.622 349 1HD2 ASN 48 HD21 ASN 48 4.687 -3.567 -2.465 350 2HD2 ASN 48 HD22 ASN 48 3.107 -3.277 -3.106 351 H PHE 49 HN PHE 49 3.620 -8.853 -4.508 352 HA PHE 49 HA PHE 49 2.522 -8.719 -1.773 353 1HB PHE 49 HB2 PHE 49 1.039 -7.681 -3.494 354 2HB PHE 49 HB1 PHE 49 0.990 -9.216 -4.336 355 HD1 PHE 49 HD1 PHE 49 -0.116 -7.375 -1.371 356 HD2 PHE 49 HD2 PHE 49 -0.417 -11.005 -3.572 357 HE1 PHE 49 HE1 PHE 49 -2.038 -8.046 0.005 358 HE2 PHE 49 HE2 PHE 49 -2.342 -11.683 -2.200 359 HZ PHE 49 HZ PHE 49 -3.306 -10.113 -0.595 360 H GLU 50 HN GLU 50 3.383 -10.519 -0.880 361 HA GLU 50 HA GLU 50 3.314 -13.004 -2.435 362 1HB GLU 50 HB2 GLU 50 4.872 -13.892 -0.699 363 2HB GLU 50 HB1 GLU 50 5.507 -12.516 -1.586 364 1HG GLU 50 HG2 GLU 50 4.936 -11.057 0.307 365 2HG GLU 50 HG1 GLU 50 4.351 -12.459 1.190 366 H GLN 51 HN GLN 51 1.438 -13.974 -2.225 367 HA GLN 51 HA GLN 51 -0.216 -15.243 -1.348 368 1HB GLN 51 HB2 GLN 51 1.574 -16.102 0.184 369 2HB GLN 51 HB1 GLN 51 1.100 -14.880 1.351 370 1HG GLN 51 HG2 GLN 51 -0.920 -16.824 0.312 371 2HG GLN 51 HG1 GLN 51 0.213 -17.307 1.570 372 1HE2 GLN 51 HE21 GLN 51 0.281 -14.685 2.820 373 2HE2 GLN 51 HE22 GLN 51 -1.234 -14.501 3.641 374 H GLY 52 HN GLY 52 0.559 -12.644 0.967 375 1HA GLY 52 HA2 GLY 52 -1.835 -11.230 0.429 376 2HA GLY 52 HA1 GLY 52 -2.030 -12.196 1.887 377 H LYS 53 HN LYS 53 0.920 -10.646 0.758 378 HA LYS 53 HA LYS 53 0.744 -8.590 2.822 379 1HB LYS 53 HB2 LYS 53 3.072 -10.502 2.610 380 2HB LYS 53 HB1 LYS 53 2.958 -9.142 3.711 381 1HG LYS 53 HG2 LYS 53 1.042 -11.463 3.771 382 2HG LYS 53 HG1 LYS 53 2.522 -11.398 4.730 383 1HD LYS 53 HD2 LYS 53 1.756 -9.479 5.922 384 2HD LYS 53 HD1 LYS 53 0.398 -9.267 4.816 385 1HE LYS 53 HE2 LYS 53 0.598 -11.845 6.276 386 2HE LYS 53 HE1 LYS 53 0.131 -10.419 7.200 387 1HZ LYS 53 HZ1 LYS 53 -1.270 -10.748 4.687 388 2HZ LYS 53 HZ2 LYS 53 -1.875 -10.341 6.221 389 3HZ LYS 53 HZ3 LYS 53 -1.575 -11.964 5.825 390 H PHE 54 HN PHE 54 1.792 -6.728 2.233 391 HA PHE 54 HA PHE 54 3.304 -6.835 -0.278 392 1HB PHE 54 HB2 PHE 54 2.650 -4.363 -0.467 393 2HB PHE 54 HB1 PHE 54 1.443 -5.593 -0.793 394 HD1 PHE 54 HD1 PHE 54 -0.672 -4.813 -0.194 395 HD2 PHE 54 HD2 PHE 54 2.653 -3.973 2.333 396 HE1 PHE 54 HE1 PHE 54 -2.175 -3.729 1.431 397 HE2 PHE 54 HE2 PHE 54 1.149 -2.896 3.959 398 HZ PHE 54 HZ PHE 54 -1.363 -2.754 3.398 399 H PHE 55 HN PHE 55 5.056 -5.426 -0.583 400 HA PHE 55 HA PHE 55 6.358 -4.274 1.722 401 1HB PHE 55 HB2 PHE 55 8.340 -5.863 1.443 402 2HB PHE 55 HB1 PHE 55 6.908 -6.532 2.219 403 HD1 PHE 55 HD1 PHE 55 8.937 -6.496 -0.828 404 HD2 PHE 55 HD2 PHE 55 5.623 -8.270 1.162 405 HE1 PHE 55 HE1 PHE 55 8.924 -8.311 -2.479 406 HE2 PHE 55 HE2 PHE 55 5.604 -10.092 -0.492 407 HZ PHE 55 HZ PHE 55 7.161 -10.099 -2.330 408 H LEU 56 HN LEU 56 8.725 -3.726 1.100 409 HA LEU 56 HA LEU 56 8.841 -2.518 -1.528 410 1HB LEU 56 HB2 LEU 56 11.142 -2.853 0.393 411 2HB LEU 56 HB1 LEU 56 10.937 -1.639 -0.843 412 HG LEU 56 HG LEU 56 9.192 -1.770 1.603 413 1HD1 LEU 56 HD11 LEU 56 11.674 -0.118 1.149 414 2HD1 LEU 56 HD12 LEU 56 11.532 -1.475 2.267 415 3HD1 LEU 56 HD13 LEU 56 10.590 -0.007 2.537 416 1HD2 LEU 56 HD21 LEU 56 9.758 0.419 -0.388 417 2HD2 LEU 56 HD22 LEU 56 8.710 0.549 1.024 418 3HD2 LEU 56 HD23 LEU 56 8.280 -0.540 -0.297 419 H ILE 57 HN ILE 57 9.315 -3.810 -3.294 420 HA ILE 57 HA ILE 57 11.089 -6.095 -2.766 421 HB ILE 57 HB ILE 57 8.947 -6.744 -3.771 422 1HG1 ILE 57 HG12 ILE 57 9.860 -8.049 -5.678 423 2HG1 ILE 57 HG11 ILE 57 11.324 -7.077 -5.611 424 1HG2 ILE 57 HG21 ILE 57 8.430 -4.745 -5.034 425 2HG2 ILE 57 HG22 ILE 57 8.406 -6.161 -6.085 426 3HG2 ILE 57 HG23 ILE 57 9.783 -5.060 -6.121 427 1HD1 ILE 57 HD11 ILE 57 11.667 -9.202 -4.522 428 2HD1 ILE 57 HD12 ILE 57 10.301 -8.899 -3.450 429 3HD1 ILE 57 HD13 ILE 57 11.746 -7.894 -3.341 430 H SER 58 HN SER 58 13.086 -5.987 -3.374 431 HA SER 58 HA SER 58 14.058 -3.649 -4.689 432 1HB SER 58 HB2 SER 58 15.293 -4.704 -2.852 433 2HB SER 58 HB1 SER 58 15.499 -6.162 -3.817 434 HG SER 58 HG SER 58 16.675 -3.627 -4.140 435 H ASP 59 HN ASP 59 15.011 -3.442 -6.663 436 HA ASP 59 HA ASP 59 14.428 -5.184 -8.791 437 1HB ASP 59 HB2 ASP 59 14.961 -2.946 -9.346 438 2HB ASP 59 HB1 ASP 59 16.448 -2.980 -8.404 439 H ASN 60 HN ASN 60 16.995 -5.053 -6.468 440 HA ASN 60 HA ASN 60 18.682 -6.961 -7.818 441 1HB ASN 60 HB2 ASN 60 19.479 -5.104 -6.284 442 2HB ASN 60 HB1 ASN 60 18.839 -6.046 -4.942 443 1HD2 ASN 60 HD21 ASN 60 20.388 -7.374 -7.803 444 2HD2 ASN 60 HD22 ASN 60 21.779 -7.994 -6.977 445 H ASN 61 HN ASN 61 16.108 -6.975 -5.538 446 HA ASN 61 HA ASN 61 14.807 -8.603 -4.665 447 1HB ASN 61 HB2 ASN 61 15.036 -9.501 -7.030 448 2HB ASN 61 HB1 ASN 61 16.274 -10.586 -6.407 449 1HD2 ASN 61 HD21 ASN 61 15.064 -12.414 -6.917 450 2HD2 ASN 61 HD22 ASN 61 13.658 -12.867 -6.015 451 H ARG 62 HN ARG 62 17.632 -8.067 -3.634 452 HA ARG 62 HA ARG 62 18.056 -10.563 -2.161 453 1HB ARG 62 HB2 ARG 62 19.713 -8.052 -2.382 454 2HB ARG 62 HB1 ARG 62 20.082 -9.348 -1.252 455 1HG ARG 62 HG2 ARG 62 20.297 -10.905 -3.141 456 2HG ARG 62 HG1 ARG 62 19.990 -9.564 -4.250 457 1HD ARG 62 HD2 ARG 62 21.972 -8.412 -3.442 458 2HD ARG 62 HD1 ARG 62 22.256 -9.692 -2.263 459 HE ARG 62 HE ARG 62 22.592 -11.190 -4.239 460 1HH1 ARG 62 HH11 ARG 62 22.972 -7.731 -4.611 461 2HH1 ARG 62 HH12 ARG 62 24.191 -7.862 -5.846 462 1HH2 ARG 62 HH21 ARG 62 24.215 -11.370 -5.851 463 2HH2 ARG 62 HH22 ARG 62 24.885 -9.929 -6.547 464 H ASP 63 HN ASP 63 16.287 -7.806 -1.859 465 HA ASP 63 HA ASP 63 16.106 -8.076 1.036 466 1HB ASP 63 HB2 ASP 63 17.760 -6.349 0.852 467 2HB ASP 63 HB1 ASP 63 16.829 -5.512 -0.385 468 H LYS 64 HN LYS 64 14.125 -7.618 1.860 469 HA LYS 64 HA LYS 64 12.287 -5.967 0.371 470 1HB LYS 64 HB2 LYS 64 10.436 -7.574 0.426 471 2HB LYS 64 HB1 LYS 64 11.765 -8.163 -0.553 472 1HG LYS 64 HG2 LYS 64 11.281 -10.074 0.558 473 2HG LYS 64 HG1 LYS 64 12.400 -9.377 1.729 474 1HD LYS 64 HD2 LYS 64 10.573 -8.546 3.061 475 2HD LYS 64 HD1 LYS 64 9.402 -9.041 1.839 476 1HE LYS 64 HE2 LYS 64 11.218 -10.951 3.301 477 2HE LYS 64 HE1 LYS 64 9.579 -10.566 3.822 478 1HZ LYS 64 HZ1 LYS 64 10.299 -11.756 1.194 479 2HZ LYS 64 HZ2 LYS 64 8.727 -11.445 1.751 480 3HZ LYS 64 HZ3 LYS 64 9.685 -12.614 2.516 481 H LEU 65 HN LEU 65 11.196 -4.680 1.705 482 HA LEU 65 HA LEU 65 10.926 -5.472 4.532 483 1HB LEU 65 HB2 LEU 65 11.633 -2.852 3.318 484 2HB LEU 65 HB1 LEU 65 10.649 -2.857 4.767 485 HG LEU 65 HG LEU 65 12.873 -2.564 5.455 486 1HD1 LEU 65 HD11 LEU 65 12.167 -5.460 5.860 487 2HD1 LEU 65 HD12 LEU 65 11.582 -4.104 6.825 488 3HD1 LEU 65 HD13 LEU 65 13.296 -4.521 6.838 489 1HD2 LEU 65 HD21 LEU 65 13.598 -4.962 3.787 490 2HD2 LEU 65 HD22 LEU 65 14.697 -4.074 4.846 491 3HD2 LEU 65 HD23 LEU 65 14.002 -3.283 3.431 492 H TYR 66 HN TYR 66 8.893 -5.532 5.329 493 HA TYR 66 HA TYR 66 6.711 -5.163 3.546 494 1HB TYR 66 HB2 TYR 66 6.796 -5.633 6.531 495 2HB TYR 66 HB1 TYR 66 5.306 -5.567 5.594 496 HD1 TYR 66 HD1 TYR 66 8.374 -7.483 6.229 497 HD2 TYR 66 HD2 TYR 66 4.659 -7.386 4.160 498 HE1 TYR 66 HE1 TYR 66 8.613 -9.869 5.706 499 HE2 TYR 66 HE2 TYR 66 4.890 -9.780 3.631 500 HH TYR 66 HH TYR 66 7.095 -11.795 5.166 501 H VAL 67 HN VAL 67 5.069 -3.606 3.599 502 HA VAL 67 HA VAL 67 5.885 -1.094 4.908 503 HB VAL 67 HB VAL 67 4.849 0.134 3.050 504 1HG1 VAL 67 HG11 VAL 67 6.946 -1.849 2.196 505 2HG1 VAL 67 HG12 VAL 67 7.230 -0.303 2.996 506 3HG1 VAL 67 HG13 VAL 67 6.561 -0.343 1.365 507 1HG2 VAL 67 HG21 VAL 67 4.495 -2.594 1.816 508 2HG2 VAL 67 HG22 VAL 67 4.280 -1.064 0.967 509 3HG2 VAL 67 HG23 VAL 67 3.215 -1.486 2.311 510 H ASN 68 HN ASN 68 4.310 0.220 5.742 511 HA ASN 68 HA ASN 68 1.603 -0.932 5.860 512 1HB ASN 68 HB2 ASN 68 3.087 0.797 7.854 513 2HB ASN 68 HB1 ASN 68 1.351 0.528 7.932 514 1HD2 ASN 68 HD21 ASN 68 4.492 -0.889 8.332 515 2HD2 ASN 68 HD22 ASN 68 3.966 -2.325 9.150 516 H ILE 69 HN ILE 69 0.398 0.075 4.408 517 HA ILE 69 HA ILE 69 0.856 2.894 3.822 518 HB ILE 69 HB ILE 69 -1.426 1.950 2.422 519 1HG1 ILE 69 HG12 ILE 69 0.925 0.049 2.277 520 2HG1 ILE 69 HG11 ILE 69 -0.676 -0.334 2.900 521 1HG2 ILE 69 HG21 ILE 69 1.400 2.468 1.514 522 2HG2 ILE 69 HG22 ILE 69 0.102 3.655 1.633 523 3HG2 ILE 69 HG23 ILE 69 -0.004 2.347 0.455 524 1HD1 ILE 69 HD11 ILE 69 -0.376 -1.223 0.672 525 2HD1 ILE 69 HD12 ILE 69 -0.005 0.388 0.058 526 3HD1 ILE 69 HD13 ILE 69 -1.617 0.028 0.676 527 H ARG 70 HN ARG 70 -0.117 4.322 5.116 528 HA ARG 70 HA ARG 70 -2.616 3.457 6.423 529 1HB ARG 70 HB2 ARG 70 -0.376 5.001 7.743 530 2HB ARG 70 HB1 ARG 70 -1.876 4.489 8.502 531 1HG ARG 70 HG2 ARG 70 -1.226 2.148 8.202 532 2HG ARG 70 HG1 ARG 70 0.284 2.671 7.454 533 1HD ARG 70 HD2 ARG 70 0.783 2.159 9.713 534 2HD ARG 70 HD1 ARG 70 0.785 3.916 9.581 535 HE ARG 70 HE ARG 70 -1.771 3.198 10.361 536 1HH1 ARG 70 HH11 ARG 70 1.484 2.982 11.628 537 2HH1 ARG 70 HH12 ARG 70 0.981 2.934 13.286 538 1HH2 ARG 70 HH21 ARG 70 -2.453 3.110 12.547 539 2HH2 ARG 70 HH22 ARG 70 -1.262 2.975 13.814 540 HA PRO 71 HA PRO 71 -4.411 7.264 5.080 541 1HB PRO 71 HB2 PRO 71 -5.831 7.172 7.683 542 2HB PRO 71 HB1 PRO 71 -6.489 7.257 6.044 543 1HG PRO 71 HG2 PRO 71 -6.612 5.001 7.454 544 2HG PRO 71 HG1 PRO 71 -6.298 4.976 5.708 545 1HD PRO 71 HD2 PRO 71 -4.395 4.618 7.987 546 2HD PRO 71 HD1 PRO 71 -4.457 3.779 6.422 547 H MET 72 HN MET 72 -3.919 9.383 5.338 548 HA MET 72 HA MET 72 -2.005 10.126 7.291 549 1HB MET 72 HB2 MET 72 -2.056 11.113 5.044 550 2HB MET 72 HB1 MET 72 -3.605 11.864 5.406 551 1HG MET 72 HG2 MET 72 -2.524 13.167 7.193 552 2HG MET 72 HG1 MET 72 -0.974 12.457 6.742 553 1HE MET 72 HE1 MET 72 -1.518 15.615 6.910 554 2HE MET 72 HE2 MET 72 -0.668 16.154 5.461 555 3HE MET 72 HE3 MET 72 0.039 14.904 6.486 556 H ASP 73 HN ASP 73 -3.256 9.510 9.190 557 HA ASP 73 HA ASP 73 -4.249 10.079 11.151 558 1HB ASP 73 HB2 ASP 73 -2.575 11.967 10.762 559 2HB ASP 73 HB1 ASP 73 -3.951 12.947 10.267 560 H ASN 74 HN ASN 74 -6.131 9.381 9.287 561 HA ASN 74 HA ASN 74 -8.266 11.363 9.715 562 1HB ASN 74 HB2 ASN 74 -7.627 9.639 7.393 563 2HB ASN 74 HB1 ASN 74 -9.329 9.877 7.758 564 1HD2 ASN 74 HD21 ASN 74 -6.352 11.450 6.818 565 2HD2 ASN 74 HD22 ASN 74 -7.079 12.908 6.243 566 H SER 75 HN SER 75 -8.663 8.016 8.672 567 HA SER 75 HA SER 75 -10.378 7.634 11.028 568 1HB SER 75 HB2 SER 75 -11.605 7.808 8.856 569 2HB SER 75 HB1 SER 75 -10.727 6.389 8.285 570 HG SER 75 HG SER 75 -12.507 5.487 9.093 571 H ALA 76 HN ALA 76 -10.733 5.289 11.554 572 HA ALA 76 HA ALA 76 -8.140 4.013 11.778 573 1HB ALA 76 HB1 ALA 76 -9.569 4.194 13.759 574 2HB ALA 76 HB2 ALA 76 -9.241 2.508 13.352 575 3HB ALA 76 HB3 ALA 76 -10.804 3.223 12.957 576 H TRP 77 HN TRP 77 -7.489 2.722 10.229 577 HA TRP 77 HA TRP 77 -9.452 1.161 8.705 578 1HB TRP 77 HB2 TRP 77 -6.639 2.059 8.100 579 2HB TRP 77 HB1 TRP 77 -7.441 0.813 7.155 580 HD1 TRP 77 HD1 TRP 77 -8.990 4.194 8.332 581 HE1 TRP 77 HE1 TRP 77 -9.743 5.481 6.215 582 HE3 TRP 77 HE3 TRP 77 -7.265 0.969 4.775 583 HZ2 TRP 77 HZ2 TRP 77 -9.604 5.150 3.412 584 HZ3 TRP 77 HZ3 TRP 77 -7.615 1.512 2.410 585 HH2 TRP 77 HH2 TRP 77 -8.758 3.565 1.738 586 H THR 78 HN THR 78 -9.414 -1.025 8.724 587 HA THR 78 HA THR 78 -7.979 -2.471 10.686 588 HB THR 78 HB THR 78 -9.251 -3.611 8.189 589 HG1 THR 78 HG1 THR 78 -10.590 -3.217 10.672 590 1HG2 THR 78 HG21 THR 78 -8.867 -4.742 10.967 591 2HG2 THR 78 HG22 THR 78 -7.947 -5.194 9.532 592 3HG2 THR 78 HG23 THR 78 -9.671 -5.557 9.626 593 H THR 79 HN THR 79 -5.974 -3.347 10.600 594 HA THR 79 HA THR 79 -4.500 -2.825 8.114 595 HB THR 79 HB THR 79 -3.763 -1.417 9.916 596 HG1 THR 79 HG1 THR 79 -1.899 -3.510 9.388 597 1HG2 THR 79 HG21 THR 79 -2.751 -2.322 11.964 598 2HG2 THR 79 HG22 THR 79 -3.237 -3.945 11.476 599 3HG2 THR 79 HG23 THR 79 -4.463 -2.727 11.833 600 H ASP 80 HN ASP 80 -4.539 -4.689 7.039 601 HA ASP 80 HA ASP 80 -2.764 -6.734 8.206 602 1HB ASP 80 HB2 ASP 80 -4.874 -7.827 7.700 603 2HB ASP 80 HB1 ASP 80 -4.935 -7.073 6.109 604 H ASN 81 HN ASN 81 -0.990 -7.341 6.843 605 HA ASN 81 HA ASN 81 -0.138 -5.144 5.234 606 1HB ASN 81 HB2 ASN 81 1.105 -7.739 6.019 607 2HB ASN 81 HB1 ASN 81 1.799 -6.832 4.680 608 1HD2 ASN 81 HD21 ASN 81 2.678 -4.784 5.072 609 2HD2 ASN 81 HD22 ASN 81 3.130 -4.285 6.665 610 H GLY 82 HN GLY 82 -2.274 -7.481 4.423 611 1HA GLY 82 HA2 GLY 82 -1.613 -6.998 1.584 612 2HA GLY 82 HA1 GLY 82 -2.259 -8.539 2.134 613 H VAL 83 HN VAL 83 -3.827 -6.722 4.113 614 HA VAL 83 HA VAL 83 -5.901 -5.780 2.247 615 HB VAL 83 HB VAL 83 -6.419 -7.280 4.827 616 1HG1 VAL 83 HG11 VAL 83 -8.772 -7.172 4.161 617 2HG1 VAL 83 HG12 VAL 83 -8.325 -6.189 2.768 618 3HG1 VAL 83 HG13 VAL 83 -8.078 -5.569 4.399 619 1HG2 VAL 83 HG21 VAL 83 -6.873 -8.154 1.976 620 2HG2 VAL 83 HG22 VAL 83 -7.361 -9.043 3.420 621 3HG2 VAL 83 HG23 VAL 83 -5.649 -8.790 3.076 622 H PHE 84 HN PHE 84 -6.147 -3.614 2.581 623 HA PHE 84 HA PHE 84 -5.948 -2.680 5.361 624 1HB PHE 84 HB2 PHE 84 -3.919 -2.220 3.634 625 2HB PHE 84 HB1 PHE 84 -4.947 -0.844 3.246 626 HD1 PHE 84 HD1 PHE 84 -5.748 0.591 5.256 627 HD2 PHE 84 HD2 PHE 84 -2.462 -2.109 5.414 628 HE1 PHE 84 HE1 PHE 84 -4.865 1.783 7.220 629 HE2 PHE 84 HE2 PHE 84 -1.575 -0.922 7.376 630 HZ PHE 84 HZ PHE 84 -2.775 1.026 8.284 631 H TYR 85 HN TYR 85 -8.066 -2.283 5.678 632 HA TYR 85 HA TYR 85 -9.378 -0.474 3.793 633 1HB TYR 85 HB2 TYR 85 -11.349 -1.824 3.614 634 2HB TYR 85 HB1 TYR 85 -9.968 -2.822 3.185 635 HD1 TYR 85 HD1 TYR 85 -12.916 -2.641 5.086 636 HD2 TYR 85 HD2 TYR 85 -8.994 -4.281 5.139 637 HE1 TYR 85 HE1 TYR 85 -13.662 -4.347 6.694 638 HE2 TYR 85 HE2 TYR 85 -9.729 -5.994 6.749 639 HH TYR 85 HH TYR 85 -13.064 -6.486 7.507 640 H LYS 86 HN LYS 86 -11.103 0.691 4.638 641 HA LYS 86 HA LYS 86 -10.829 1.175 7.468 642 1HB LYS 86 HB2 LYS 86 -12.301 3.110 7.026 643 2HB LYS 86 HB1 LYS 86 -10.881 3.079 5.993 644 1HG LYS 86 HG2 LYS 86 -12.414 1.970 4.258 645 2HG LYS 86 HG1 LYS 86 -13.736 2.547 5.276 646 1HD LYS 86 HD2 LYS 86 -12.484 4.824 5.145 647 2HD LYS 86 HD1 LYS 86 -11.709 4.114 3.729 648 1HE LYS 86 HE2 LYS 86 -13.619 5.402 3.039 649 2HE LYS 86 HE1 LYS 86 -13.955 3.689 2.765 650 1HZ LYS 86 HZ1 LYS 86 -14.833 5.186 5.172 651 2HZ LYS 86 HZ2 LYS 86 -15.309 3.629 4.697 652 3HZ LYS 86 HZ3 LYS 86 -15.799 4.976 3.794 653 H ASN 87 HN ASN 87 -12.427 0.993 9.004 654 HA ASN 87 HA ASN 87 -14.351 -1.063 8.637 655 1HB ASN 87 HB2 ASN 87 -13.291 -0.536 10.828 656 2HB ASN 87 HB1 ASN 87 -14.183 0.981 10.867 657 1HD2 ASN 87 HD21 ASN 87 -16.365 0.966 11.322 658 2HD2 ASN 87 HD22 ASN 87 -17.195 -0.443 11.905 659 H ASP 88 HN ASP 88 -14.436 2.433 8.546 660 HA ASP 88 HA ASP 88 -17.250 2.701 8.281 661 1HB ASP 88 HB2 ASP 88 -16.491 4.930 7.104 662 2HB ASP 88 HB1 ASP 88 -16.268 4.726 8.841 663 H VAL 89 HN VAL 89 -18.534 2.761 6.482 664 HA VAL 89 HA VAL 89 -17.258 1.752 4.038 665 HB VAL 89 HB VAL 89 -19.534 1.130 3.286 666 1HG1 VAL 89 HG11 VAL 89 -18.099 -0.492 4.405 667 2HG1 VAL 89 HG12 VAL 89 -19.795 -0.773 4.798 668 3HG1 VAL 89 HG13 VAL 89 -18.736 0.009 5.971 669 1HG2 VAL 89 HG21 VAL 89 -20.364 1.976 6.066 670 2HG2 VAL 89 HG22 VAL 89 -21.380 1.118 4.907 671 3HG2 VAL 89 HG23 VAL 89 -20.834 2.759 4.557 672 H GLY 90 HN GLY 90 -17.177 2.907 2.232 673 1HA GLY 90 HA2 GLY 90 -18.647 4.579 0.918 674 2HA GLY 90 HA1 GLY 90 -18.349 5.603 2.317 675 H SER 91 HN SER 91 -17.419 7.024 0.617 676 HA SER 91 HA SER 91 -14.844 6.202 -0.407 677 1HB SER 91 HB2 SER 91 -14.810 8.503 -1.379 678 2HB SER 91 HB1 SER 91 -16.243 7.584 -1.835 679 HG SER 91 HG SER 91 -17.378 9.120 -0.990 680 H TRP 92 HN TRP 92 -12.905 6.800 0.403 681 HA TRP 92 HA TRP 92 -12.917 8.363 2.881 682 1HB TRP 92 HB2 TRP 92 -11.919 6.132 3.042 683 2HB TRP 92 HB1 TRP 92 -10.789 6.539 1.745 684 HD1 TRP 92 HD1 TRP 92 -11.570 7.337 5.406 685 HE1 TRP 92 HE1 TRP 92 -9.492 8.376 6.470 686 HE3 TRP 92 HE3 TRP 92 -8.662 7.746 1.239 687 HZ2 TRP 92 HZ2 TRP 92 -6.918 9.267 5.642 688 HZ3 TRP 92 HZ3 TRP 92 -6.427 8.706 1.450 689 HH2 TRP 92 HH2 TRP 92 -5.563 9.449 3.609 690 H GLY 93 HN GLY 93 -10.897 7.854 0.043 691 1HA GLY 93 HA2 GLY 93 -9.551 9.233 -1.198 692 2HA GLY 93 HA1 GLY 93 -10.911 10.316 -1.120 693 H GLY 94 HN GLY 94 -7.685 9.962 -0.523 694 1HA GLY 94 HA2 GLY 94 -7.306 12.585 0.366 695 2HA GLY 94 HA1 GLY 94 -7.271 11.539 1.780 696 H THR 95 HN THR 95 -5.198 11.338 2.339 697 HA THR 95 HA THR 95 -3.304 10.502 0.254 698 HB THR 95 HB THR 95 -1.566 11.556 1.883 699 HG1 THR 95 HG1 THR 95 -2.410 13.235 3.132 700 1HG2 THR 95 HG21 THR 95 -1.764 13.717 0.752 701 2HG2 THR 95 HG22 THR 95 -3.401 13.309 0.241 702 3HG2 THR 95 HG23 THR 95 -2.029 12.390 -0.379 703 H ILE 96 HN ILE 96 -2.302 8.623 0.582 704 HA ILE 96 HA ILE 96 -2.405 7.429 3.284 705 HB ILE 96 HB ILE 96 -1.907 5.914 0.724 706 1HG1 ILE 96 HG12 ILE 96 -4.158 7.066 0.760 707 2HG1 ILE 96 HG11 ILE 96 -4.214 5.312 0.614 708 1HG2 ILE 96 HG21 ILE 96 -2.567 3.983 2.068 709 2HG2 ILE 96 HG22 ILE 96 -2.754 5.041 3.468 710 3HG2 ILE 96 HG23 ILE 96 -1.163 4.815 2.739 711 1HD1 ILE 96 HD11 ILE 96 -5.907 6.107 2.141 712 2HD1 ILE 96 HD12 ILE 96 -4.681 6.910 3.119 713 3HD1 ILE 96 HD13 ILE 96 -4.707 5.149 3.005 714 H GLY 97 HN GLY 97 -0.528 7.145 4.302 715 1HA GLY 97 HA2 GLY 97 1.904 7.888 2.843 716 2HA GLY 97 HA1 GLY 97 1.719 7.848 4.591 717 H ILE 98 HN ILE 98 3.620 6.544 2.559 718 HA ILE 98 HA ILE 98 3.254 3.759 3.308 719 HB ILE 98 HB ILE 98 5.322 5.128 1.588 720 1HG1 ILE 98 HG12 ILE 98 4.403 3.457 -0.110 721 2HG1 ILE 98 HG11 ILE 98 3.112 3.152 1.045 722 1HG2 ILE 98 HG21 ILE 98 5.238 2.215 2.360 723 2HG2 ILE 98 HG22 ILE 98 6.454 3.390 2.862 724 3HG2 ILE 98 HG23 ILE 98 6.316 2.933 1.164 725 1HD1 ILE 98 HD11 ILE 98 3.740 5.810 -0.220 726 2HD1 ILE 98 HD12 ILE 98 2.427 5.479 0.911 727 3HD1 ILE 98 HD13 ILE 98 2.429 4.723 -0.683 728 H TYR 99 HN TYR 99 3.813 3.228 5.272 729 HA TYR 99 HA TYR 99 6.242 4.400 6.458 730 1HB TYR 99 HB2 TYR 99 4.030 2.897 7.883 731 2HB TYR 99 HB1 TYR 99 5.344 3.801 8.622 732 HD1 TYR 99 HD1 TYR 99 5.111 6.097 9.094 733 HD2 TYR 99 HD2 TYR 99 2.226 4.168 6.640 734 HE1 TYR 99 HE1 TYR 99 3.666 8.076 9.248 735 HE2 TYR 99 HE2 TYR 99 0.778 6.150 6.778 736 HH TYR 99 HH TYR 99 1.862 9.135 8.007 737 H VAL 100 HN VAL 100 7.871 2.973 7.157 738 HA VAL 100 HA VAL 100 7.799 0.368 5.938 739 HB VAL 100 HB VAL 100 9.889 1.757 6.094 740 1HG1 VAL 100 HG11 VAL 100 11.175 1.695 8.161 741 2HG1 VAL 100 HG12 VAL 100 9.836 0.887 8.976 742 3HG1 VAL 100 HG13 VAL 100 9.643 2.538 8.382 743 1HG2 VAL 100 HG21 VAL 100 11.367 -0.150 6.555 744 2HG2 VAL 100 HG22 VAL 100 9.997 -0.599 5.538 745 3HG2 VAL 100 HG23 VAL 100 10.002 -1.026 7.250 746 H ASP 101 HN ASP 101 7.537 -1.594 6.942 747 HA ASP 101 HA ASP 101 6.363 -1.586 9.569 748 1HB ASP 101 HB2 ASP 101 5.706 -3.168 7.713 749 2HB ASP 101 HB1 ASP 101 7.251 -3.980 7.951 750 H GLY 102 HN GLY 102 7.925 -0.835 10.978 751 1HA GLY 102 HA2 GLY 102 9.721 -1.023 12.413 752 2HA GLY 102 HA1 GLY 102 9.985 -2.651 11.800 753 H GLN 103 HN GLN 103 11.092 0.549 11.803 754 HA GLN 103 HA GLN 103 12.305 0.967 9.410 755 1HB GLN 103 HB2 GLN 103 13.858 2.403 10.508 756 2HB GLN 103 HB1 GLN 103 12.324 2.511 11.351 757 1HG GLN 103 HG2 GLN 103 14.658 0.864 12.290 758 2HG GLN 103 HG1 GLN 103 14.299 2.499 12.837 759 1HE2 GLN 103 HE21 GLN 103 13.448 -0.838 13.034 760 2HE2 GLN 103 HE22 GLN 103 12.296 -0.686 14.318 761 H GLN 104 HN GLN 104 13.777 0.017 8.217 762 HA GLN 104 HA GLN 104 15.360 -2.159 9.308 763 1HB GLN 104 HB2 GLN 104 14.193 -2.323 7.100 764 2HB GLN 104 HB1 GLN 104 15.268 -1.078 6.484 765 1HG GLN 104 HG2 GLN 104 16.029 -3.258 5.789 766 2HG GLN 104 HG1 GLN 104 17.190 -2.537 6.902 767 1HE2 GLN 104 HE21 GLN 104 18.066 -4.508 7.495 768 2HE2 GLN 104 HE22 GLN 104 17.211 -5.650 8.477 769 H THR 105 HN THR 105 15.667 1.058 9.320 770 HA THR 105 HA THR 105 17.364 2.520 9.685 771 HB THR 105 HB THR 105 19.177 0.135 10.087 772 HG1 THR 105 HG1 THR 105 17.645 -0.450 11.477 773 1HG2 THR 105 HG21 THR 105 20.230 2.347 10.226 774 2HG2 THR 105 HG22 THR 105 20.178 1.572 11.811 775 3HG2 THR 105 HG23 THR 105 19.027 2.849 11.414 776 H ASN 106 HN ASN 106 16.914 1.334 6.981 777 HA ASN 106 HA ASN 106 17.739 1.387 4.868 778 1HB ASN 106 HB2 ASN 106 18.150 3.717 5.273 779 2HB ASN 106 HB1 ASN 106 19.618 3.363 6.171 780 1HD2 ASN 106 HD21 ASN 106 18.173 3.621 3.030 781 2HD2 ASN 106 HD22 ASN 106 19.640 3.580 2.124 782 H THR 107 HN THR 107 18.392 -0.728 4.705 783 HA THR 107 HA THR 107 21.236 -1.288 5.160 784 HB THR 107 HB THR 107 19.496 -2.882 6.096 785 HG1 THR 107 HG1 THR 107 20.982 -4.348 5.900 786 1HG2 THR 107 HG21 THR 107 18.411 -4.440 4.548 787 2HG2 THR 107 HG22 THR 107 19.049 -3.524 3.182 788 3HG2 THR 107 HG23 THR 107 17.881 -2.780 4.275 789 HA PRO 108 HA PRO 108 22.823 -0.693 1.131 790 1HB PRO 108 HB2 PRO 108 22.759 -3.675 0.873 791 2HB PRO 108 HB1 PRO 108 24.041 -2.541 0.438 792 1HG PRO 108 HG2 PRO 108 23.954 -3.969 2.795 793 2HG PRO 108 HG1 PRO 108 24.858 -2.467 2.558 794 1HD PRO 108 HD2 PRO 108 22.610 -2.908 4.272 795 2HD PRO 108 HD1 PRO 108 23.470 -1.383 3.981 796 HA PRO 109 HA PRO 109 18.839 -1.470 -0.903 797 1HB PRO 109 HB2 PRO 109 17.960 1.055 -0.893 798 2HB PRO 109 HB1 PRO 109 17.980 0.071 0.574 799 1HG PRO 109 HG2 PRO 109 19.655 2.372 -0.144 800 2HG PRO 109 HG1 PRO 109 19.360 1.653 1.445 801 1HD PRO 109 HD2 PRO 109 21.605 1.225 -0.369 802 2HD PRO 109 HD1 PRO 109 21.412 0.710 1.323 803 H GLY 110 HN GLY 110 17.665 0.119 -2.571 804 1HA GLY 110 HA2 GLY 110 19.197 1.553 -4.449 805 2HA GLY 110 HA1 GLY 110 18.925 -0.088 -5.033 806 H ASN 111 HN ASN 111 17.250 -0.170 -6.378 807 HA ASN 111 HA ASN 111 14.982 1.620 -5.982 808 1HB ASN 111 HB2 ASN 111 15.818 1.329 -8.265 809 2HB ASN 111 HB1 ASN 111 15.554 -0.407 -8.158 810 1HD2 ASN 111 HD21 ASN 111 14.169 -0.414 -9.921 811 2HD2 ASN 111 HD22 ASN 111 12.552 0.207 -9.819 812 H TYR 112 HN TYR 112 13.284 1.035 -4.816 813 HA TYR 112 HA TYR 112 12.649 -1.829 -4.601 814 1HB TYR 112 HB2 TYR 112 12.166 0.383 -2.589 815 2HB TYR 112 HB1 TYR 112 11.465 -1.227 -2.471 816 HD1 TYR 112 HD1 TYR 112 12.967 -3.210 -2.226 817 HD2 TYR 112 HD2 TYR 112 14.416 0.774 -1.884 818 HE1 TYR 112 HE1 TYR 112 15.002 -4.040 -1.132 819 HE2 TYR 112 HE2 TYR 112 16.451 -0.052 -0.811 820 HH TYR 112 HH TYR 112 17.248 -3.397 -0.686 821 H THR 113 HN THR 113 10.835 -2.449 -5.464 822 HA THR 113 HA THR 113 8.996 -0.388 -6.431 823 HB THR 113 HB THR 113 9.133 -3.296 -7.230 824 HG1 THR 113 HG1 THR 113 11.031 -1.688 -7.610 825 1HG2 THR 113 HG21 THR 113 7.030 -2.143 -7.778 826 2HG2 THR 113 HG22 THR 113 7.951 -2.542 -9.228 827 3HG2 THR 113 HG23 THR 113 7.945 -0.889 -8.617 828 H LEU 114 HN LEU 114 6.898 -0.338 -5.821 829 HA LEU 114 HA LEU 114 5.743 -2.665 -4.514 830 1HB LEU 114 HB2 LEU 114 4.591 -0.870 -2.937 831 2HB LEU 114 HB1 LEU 114 6.090 -1.664 -2.511 832 HG LEU 114 HG LEU 114 6.200 0.968 -3.922 833 1HD1 LEU 114 HD11 LEU 114 4.604 1.328 -2.116 834 2HD1 LEU 114 HD12 LEU 114 6.144 2.104 -1.742 835 3HD1 LEU 114 HD13 LEU 114 5.715 0.578 -0.970 836 1HD2 LEU 114 HD21 LEU 114 8.238 1.209 -2.615 837 2HD2 LEU 114 HD22 LEU 114 8.258 -0.283 -3.554 838 3HD2 LEU 114 HD23 LEU 114 7.919 -0.336 -1.824 839 H THR 115 HN THR 115 4.469 -3.055 -6.236 840 HA THR 115 HA THR 115 2.937 -0.922 -7.462 841 HB THR 115 HB THR 115 2.951 -3.877 -8.119 842 HG1 THR 115 HG1 THR 115 4.947 -3.323 -8.706 843 1HG2 THR 115 HG21 THR 115 2.028 -1.476 -9.712 844 2HG2 THR 115 HG22 THR 115 0.984 -2.691 -8.971 845 3HG2 THR 115 HG23 THR 115 2.065 -3.143 -10.289 846 H LEU 116 HN LEU 116 1.032 -0.346 -6.706 847 HA LEU 116 HA LEU 116 -0.471 -2.234 -5.043 848 1HB LEU 116 HB2 LEU 116 -0.734 0.741 -5.411 849 2HB LEU 116 HB1 LEU 116 -1.736 -0.219 -4.341 850 HG LEU 116 HG LEU 116 1.243 0.202 -4.073 851 1HD1 LEU 116 HD11 LEU 116 0.665 1.488 -2.092 852 2HD1 LEU 116 HD12 LEU 116 -1.051 1.223 -2.406 853 3HD1 LEU 116 HD13 LEU 116 -0.089 2.183 -3.529 854 1HD2 LEU 116 HD21 LEU 116 1.053 -1.005 -1.980 855 2HD2 LEU 116 HD22 LEU 116 0.508 -2.023 -3.313 856 3HD2 LEU 116 HD23 LEU 116 -0.672 -1.251 -2.251 857 H THR 117 HN THR 117 -2.513 -2.857 -5.529 858 HA THR 117 HA THR 117 -3.532 -2.068 -8.174 859 HB THR 117 HB THR 117 -4.283 -4.518 -6.560 860 HG1 THR 117 HG1 THR 117 -2.016 -4.078 -7.765 861 1HG2 THR 117 HG21 THR 117 -5.196 -5.313 -8.700 862 2HG2 THR 117 HG22 THR 117 -4.764 -3.776 -9.450 863 3HG2 THR 117 HG23 THR 117 -5.980 -3.822 -8.173 864 H GLY 118 HN GLY 118 -4.999 -0.506 -7.988 865 1HA GLY 118 HA2 GLY 118 -6.422 0.060 -5.598 866 2HA GLY 118 HA1 GLY 118 -6.734 0.767 -7.178 867 H GLY 119 HN GLY 119 -8.278 -0.723 -4.838 868 1HA GLY 119 HA2 GLY 119 -10.391 -1.614 -6.523 869 2HA GLY 119 HA1 GLY 119 -9.516 -2.972 -5.828 870 H TYR 120 HN TYR 120 -12.137 -2.686 -5.234 871 HA TYR 120 HA TYR 120 -12.157 -1.481 -2.563 872 1HB TYR 120 HB2 TYR 120 -14.576 -1.536 -2.652 873 2HB TYR 120 HB1 TYR 120 -13.960 -0.746 -4.096 874 HD1 TYR 120 HD1 TYR 120 -15.601 -3.751 -2.778 875 HD2 TYR 120 HD2 TYR 120 -14.288 -1.723 -6.293 876 HE1 TYR 120 HE1 TYR 120 -16.913 -5.303 -4.159 877 HE2 TYR 120 HE2 TYR 120 -15.602 -3.273 -7.674 878 HH TYR 120 HH TYR 120 -16.506 -5.598 -7.487 879 H TRP 121 HN TRP 121 -13.311 -2.658 -0.894 880 HA TRP 121 HA TRP 121 -12.876 -5.563 -1.137 881 1HB TRP 121 HB2 TRP 121 -11.187 -4.797 0.316 882 2HB TRP 121 HB1 TRP 121 -12.242 -3.619 1.079 883 HD1 TRP 121 HD1 TRP 121 -14.206 -4.712 2.670 884 HE1 TRP 121 HE1 TRP 121 -14.071 -6.713 4.261 885 HE3 TRP 121 HE3 TRP 121 -10.058 -6.967 0.758 886 HZ2 TRP 121 HZ2 TRP 121 -12.423 -8.927 4.670 887 HZ3 TRP 121 HZ3 TRP 121 -9.266 -9.045 1.851 888 HH2 TRP 121 HH2 TRP 121 -10.424 -9.992 3.748 889 H ALA 122 HN ALA 122 -14.339 -6.894 -0.021 890 HA ALA 122 HA ALA 122 -16.745 -5.642 1.078 891 1HB ALA 122 HB1 ALA 122 -18.163 -7.261 -0.050 892 2HB ALA 122 HB2 ALA 122 -16.751 -7.983 -0.824 893 3HB ALA 122 HB3 ALA 122 -17.234 -6.336 -1.228 894 H LYS 123 HN LYS 123 -17.418 -6.561 2.914 895 HA LYS 123 HA LYS 123 -17.913 -8.088 4.524 896 1HB LYS 123 HB2 LYS 123 -16.195 -10.001 2.949 897 2HB LYS 123 HB1 LYS 123 -17.111 -10.422 4.390 898 1HG LYS 123 HG2 LYS 123 -18.247 -9.465 1.769 899 2HG LYS 123 HG1 LYS 123 -18.306 -11.112 2.401 900 1HD LYS 123 HD2 LYS 123 -19.696 -10.384 4.246 901 2HD LYS 123 HD1 LYS 123 -19.564 -8.705 3.719 902 1HE LYS 123 HE2 LYS 123 -20.695 -9.284 1.621 903 2HE LYS 123 HE1 LYS 123 -20.836 -10.955 2.163 904 1HZ LYS 123 HZ1 LYS 123 -22.881 -9.689 2.515 905 2HZ LYS 123 HZ2 LYS 123 -22.050 -8.613 3.524 906 3HZ LYS 123 HZ3 LYS 123 -22.225 -10.237 3.982 907 H ASP 124 HN ASP 124 -15.727 -10.064 5.446 908 HA ASP 124 HA ASP 124 -13.693 -8.150 6.249 909 1HB ASP 124 HB2 ASP 124 -14.004 -8.454 8.633 910 2HB ASP 124 HB1 ASP 124 -15.492 -7.853 7.913 911 H ASN 125 HN ASN 125 -11.862 -9.048 5.919 912 HA ASN 125 HA ASN 125 -10.041 -10.343 6.091 913 1HB ASN 125 HB2 ASN 125 -10.525 -10.340 8.437 914 2HB ASN 125 HB1 ASN 125 -11.626 -11.699 8.256 915 1HD2 ASN 125 HD21 ASN 125 -8.301 -10.682 8.307 916 2HD2 ASN 125 HD22 ASN 125 -7.612 -12.261 8.464 917 H LYS 126 HN LYS 126 -13.013 -11.894 5.377 918 HA LYS 126 HA LYS 126 -12.038 -14.475 4.766 919 1HB LYS 126 HB2 LYS 126 -14.173 -14.810 3.666 920 2HB LYS 126 HB1 LYS 126 -14.403 -13.972 5.191 921 1HG LYS 126 HG2 LYS 126 -15.738 -12.648 3.975 922 2HG LYS 126 HG1 LYS 126 -14.225 -11.872 3.499 923 1HD LYS 126 HD2 LYS 126 -14.123 -13.180 1.486 924 2HD LYS 126 HD1 LYS 126 -15.513 -14.144 1.990 925 1HE LYS 126 HE2 LYS 126 -16.874 -12.058 1.967 926 2HE LYS 126 HE1 LYS 126 -15.484 -11.216 1.284 927 1HZ LYS 126 HZ1 LYS 126 -15.564 -12.721 -0.619 928 2HZ LYS 126 HZ2 LYS 126 -17.043 -11.911 -0.430 929 3HZ LYS 126 HZ3 LYS 126 -16.898 -13.527 0.051 930 H GLN 127 HN GLN 127 -11.273 -11.656 3.381 931 HA GLN 127 HA GLN 127 -10.206 -11.013 1.513 932 1HB GLN 127 HB2 GLN 127 -8.950 -13.097 1.582 933 2HB GLN 127 HB1 GLN 127 -10.262 -13.943 0.774 934 1HG GLN 127 HG2 GLN 127 -9.932 -12.580 -1.218 935 2HG GLN 127 HG1 GLN 127 -8.628 -11.709 -0.413 936 1HE2 GLN 127 HE21 GLN 127 -7.160 -12.344 -2.020 937 2HE2 GLN 127 HE22 GLN 127 -6.532 -13.948 -2.100 938 H GLY 128 HN GLY 128 -12.525 -10.125 1.387 939 1HA GLY 128 HA2 GLY 128 -13.506 -10.869 -1.290 940 2HA GLY 128 HA1 GLY 128 -14.442 -9.996 -0.069 941 H PHE 129 HN PHE 129 -12.073 -9.691 -2.609 942 HA PHE 129 HA PHE 129 -12.570 -6.828 -2.457 943 1HB PHE 129 HB2 PHE 129 -10.208 -6.240 -2.786 944 2HB PHE 129 HB1 PHE 129 -10.461 -7.073 -1.260 945 HD1 PHE 129 HD1 PHE 129 -9.338 -9.084 -0.766 946 HD2 PHE 129 HD2 PHE 129 -9.148 -7.449 -4.691 947 HE1 PHE 129 HE1 PHE 129 -7.523 -10.645 -1.328 948 HE2 PHE 129 HE2 PHE 129 -7.340 -9.015 -5.261 949 HZ PHE 129 HZ PHE 129 -6.523 -10.615 -3.576 950 H THR 130 HN THR 130 -12.480 -5.787 -4.442 951 HA THR 130 HA THR 130 -11.866 -7.445 -6.792 952 HB THR 130 HB THR 130 -14.255 -5.596 -6.593 953 HG1 THR 130 HG1 THR 130 -15.406 -7.688 -6.736 954 1HG2 THR 130 HG21 THR 130 -13.373 -5.790 -8.856 955 2HG2 THR 130 HG22 THR 130 -14.913 -6.641 -8.726 956 3HG2 THR 130 HG23 THR 130 -13.400 -7.549 -8.735 957 HA PRO 131 HA PRO 131 -9.285 -3.839 -7.468 958 1HB PRO 131 HB2 PRO 131 -8.849 -5.144 -10.083 959 2HB PRO 131 HB1 PRO 131 -7.673 -4.652 -8.858 960 1HG PRO 131 HG2 PRO 131 -8.267 -7.230 -9.257 961 2HG PRO 131 HG1 PRO 131 -7.928 -6.594 -7.637 962 1HD PRO 131 HD2 PRO 131 -10.556 -7.258 -8.906 963 2HD PRO 131 HD1 PRO 131 -10.010 -7.529 -7.238 964 H SER 132 HN SER 132 -9.985 -1.945 -8.123 965 HA SER 132 HA SER 132 -11.281 -1.589 -10.676 966 1HB SER 132 HB2 SER 132 -13.084 -2.171 -8.925 967 2HB SER 132 HB1 SER 132 -12.725 -0.589 -8.239 968 HG SER 132 HG SER 132 -13.802 0.318 -9.797 969 H GLY 133 HN GLY 133 -9.678 -0.243 -11.300 970 1HA GLY 133 HA2 GLY 133 -9.580 2.414 -10.827 971 2HA GLY 133 HA1 GLY 133 -8.586 1.755 -9.532 972 H THR 134 HN THR 134 -6.467 1.543 -9.977 973 HA THR 134 HA THR 134 -5.686 0.758 -12.682 974 HB THR 134 HB THR 134 -3.725 2.538 -12.216 975 HG1 THR 134 HG1 THR 134 -4.313 3.909 -10.721 976 1HG2 THR 134 HG21 THR 134 -5.027 2.400 -14.270 977 2HG2 THR 134 HG22 THR 134 -4.902 4.077 -13.734 978 3HG2 THR 134 HG23 THR 134 -6.397 3.176 -13.474 979 H THR 135 HN THR 135 -3.287 0.220 -12.743 980 HA THR 135 HA THR 135 -2.443 -0.975 -10.221 981 HB THR 135 HB THR 135 -0.574 -1.429 -12.325 982 HG1 THR 135 HG1 THR 135 -1.866 -1.361 -14.003 983 1HG2 THR 135 HG21 THR 135 -1.215 -3.771 -11.987 984 2HG2 THR 135 HG22 THR 135 -2.636 -3.253 -11.078 985 3HG2 THR 135 HG23 THR 135 -1.020 -2.939 -10.443 986 H GLY 136 HN GLY 136 -1.597 0.666 -9.012 987 1HA GLY 136 HA2 GLY 136 0.139 2.627 -10.337 988 2HA GLY 136 HA1 GLY 136 -0.610 2.816 -8.759 989 H THR 137 HN THR 137 2.236 2.186 -10.341 990 HA THR 137 HA THR 137 3.348 0.520 -8.236 991 HB THR 137 HB THR 137 4.607 1.669 -10.735 992 HG1 THR 137 HG1 THR 137 3.963 -1.037 -10.067 993 1HG2 THR 137 HG21 THR 137 6.290 1.398 -8.983 994 2HG2 THR 137 HG22 THR 137 6.504 0.193 -10.251 995 3HG2 THR 137 HG23 THR 137 5.759 -0.264 -8.720 996 H THR 138 HN THR 138 3.688 1.599 -6.388 997 HA THR 138 HA THR 138 4.788 4.263 -6.345 998 HB THR 138 HB THR 138 4.696 2.298 -4.045 999 HG1 THR 138 HG1 THR 138 2.641 3.454 -5.417 1000 1HG2 THR 138 HG21 THR 138 4.580 5.318 -4.130 1001 2HG2 THR 138 HG22 THR 138 6.000 4.360 -3.705 1002 3HG2 THR 138 HG23 THR 138 4.564 4.314 -2.680 1003 H LYS 139 HN LYS 139 6.907 4.693 -6.609 1004 HA LYS 139 HA LYS 139 8.730 2.384 -6.454 1005 1HB LYS 139 HB2 LYS 139 8.329 3.331 -8.724 1006 2HB LYS 139 HB1 LYS 139 9.007 4.855 -8.170 1007 1HG LYS 139 HG2 LYS 139 11.154 3.824 -7.801 1008 2HG LYS 139 HG1 LYS 139 10.498 2.240 -8.217 1009 1HD LYS 139 HD2 LYS 139 10.645 4.619 -10.066 1010 2HD LYS 139 HD1 LYS 139 11.743 3.238 -10.083 1011 1HE LYS 139 HE2 LYS 139 9.938 1.753 -10.672 1012 2HE LYS 139 HE1 LYS 139 8.761 3.054 -10.506 1013 1HZ LYS 139 HZ1 LYS 139 10.941 2.916 -12.521 1014 2HZ LYS 139 HZ2 LYS 139 9.854 4.205 -12.339 1015 3HZ LYS 139 HZ3 LYS 139 9.284 2.685 -12.818 1016 H LEU 140 HN LEU 140 9.816 2.435 -4.682 1017 HA LEU 140 HA LEU 140 10.769 4.978 -3.606 1018 1HB LEU 140 HB2 LEU 140 9.753 3.840 -1.876 1019 2HB LEU 140 HB1 LEU 140 10.245 2.269 -2.466 1020 HG LEU 140 HG LEU 140 12.540 2.708 -1.689 1021 1HD1 LEU 140 HD11 LEU 140 12.552 5.142 -1.858 1022 2HD1 LEU 140 HD12 LEU 140 12.979 4.629 -0.225 1023 3HD1 LEU 140 HD13 LEU 140 11.364 5.249 -0.559 1024 1HD2 LEU 140 HD21 LEU 140 12.097 2.523 0.696 1025 2HD2 LEU 140 HD22 LEU 140 10.957 1.552 -0.236 1026 3HD2 LEU 140 HD23 LEU 140 10.448 3.098 0.443 1027 H THR 141 HN THR 141 12.559 5.521 -4.675 1028 HA THR 141 HA THR 141 14.668 3.495 -4.990 1029 HB THR 141 HB THR 141 14.426 6.159 -6.409 1030 HG1 THR 141 HG1 THR 141 13.216 3.759 -6.853 1031 1HG2 THR 141 HG21 THR 141 16.726 5.342 -6.242 1032 2HG2 THR 141 HG22 THR 141 16.143 5.227 -7.903 1033 3HG2 THR 141 HG23 THR 141 16.230 3.781 -6.896 1034 H VAL 142 HN VAL 142 16.290 3.619 -3.599 1035 HA VAL 142 HA VAL 142 16.375 5.816 -1.739 1036 HB VAL 142 HB VAL 142 18.175 3.414 -1.941 1037 1HG1 VAL 142 HG11 VAL 142 19.245 5.184 -0.705 1038 2HG1 VAL 142 HG12 VAL 142 18.726 3.919 0.409 1039 3HG1 VAL 142 HG13 VAL 142 17.798 5.411 0.276 1040 1HG2 VAL 142 HG21 VAL 142 15.858 2.771 -1.584 1041 2HG2 VAL 142 HG22 VAL 142 15.745 3.890 -0.226 1042 3HG2 VAL 142 HG23 VAL 142 16.809 2.489 -0.126 1043 H THR 143 HN THR 143 17.270 7.647 -2.377 1044 HA THR 143 HA THR 143 20.080 7.643 -3.055 1045 HB THR 143 HB THR 143 18.077 9.005 -4.879 1046 HG1 THR 143 HG1 THR 143 19.046 6.507 -4.885 1047 1HG2 THR 143 HG21 THR 143 21.093 8.844 -5.016 1048 2HG2 THR 143 HG22 THR 143 20.148 10.285 -4.635 1049 3HG2 THR 143 HG23 THR 143 20.048 9.563 -6.241 Start of MODEL 10 1 H GLU 1 H GLU 1 -22.591 -1.001 -5.098 2 HA GLU 1 HA GLU 1 -21.133 0.830 -5.474 3 1HB GLU 1 HB2 GLU 1 -19.891 -1.426 -3.890 4 2HB GLU 1 HB1 GLU 1 -19.294 0.228 -3.857 5 1HG GLU 1 HG2 GLU 1 -22.060 -0.635 -3.056 6 2HG GLU 1 HG1 GLU 1 -20.732 -0.300 -1.945 7 H GLU 2 HN GLU 2 -20.188 1.363 -7.369 8 HA GLU 2 HA GLU 2 -17.936 -0.233 -8.344 9 1HB GLU 2 HB2 GLU 2 -19.565 0.660 -10.012 10 2HB GLU 2 HB1 GLU 2 -19.127 2.285 -9.505 11 1HG GLU 2 HG2 GLU 2 -16.771 1.770 -10.168 12 2HG GLU 2 HG1 GLU 2 -17.372 0.271 -10.873 13 H CYS 3 HN CYS 3 -16.259 0.146 -7.020 14 HA CYS 3 HA CYS 3 -15.719 2.937 -6.295 15 1HB CYS 3 HB2 CYS 3 -16.103 1.166 -4.484 16 2HB CYS 3 HB1 CYS 3 -14.513 0.554 -4.917 17 H GLN 4 HN GLN 4 -14.515 3.676 -7.875 18 HA GLN 4 HA GLN 4 -12.310 2.131 -8.942 19 1HB GLN 4 HB2 GLN 4 -13.656 3.411 -10.480 20 2HB GLN 4 HB1 GLN 4 -13.408 4.877 -9.545 21 1HG GLN 4 HG2 GLN 4 -11.051 4.876 -10.129 22 2HG GLN 4 HG1 GLN 4 -11.262 3.368 -11.021 23 1HE2 GLN 4 HE21 GLN 4 -10.545 4.329 -12.924 24 2HE2 GLN 4 HE22 GLN 4 -11.527 5.434 -13.826 25 H VAL 5 HN VAL 5 -10.528 2.046 -7.768 26 HA VAL 5 HA VAL 5 -9.755 4.394 -6.180 27 HB VAL 5 HB VAL 5 -8.821 1.520 -5.997 28 1HG1 VAL 5 HG11 VAL 5 -7.652 2.224 -3.956 29 2HG1 VAL 5 HG12 VAL 5 -8.092 3.899 -4.290 30 3HG1 VAL 5 HG13 VAL 5 -7.018 3.031 -5.389 31 1HG2 VAL 5 HG21 VAL 5 -10.557 3.171 -4.163 32 2HG2 VAL 5 HG22 VAL 5 -9.995 1.531 -3.839 33 3HG2 VAL 5 HG23 VAL 5 -11.091 1.836 -5.186 34 H ARG 6 HN ARG 6 -8.400 5.699 -7.180 35 HA ARG 6 HA ARG 6 -6.549 4.640 -9.167 36 1HB ARG 6 HB2 ARG 6 -7.053 7.502 -8.341 37 2HB ARG 6 HB1 ARG 6 -6.081 6.976 -9.706 38 1HG ARG 6 HG2 ARG 6 -8.068 6.042 -10.769 39 2HG ARG 6 HG1 ARG 6 -9.047 6.564 -9.397 40 1HD ARG 6 HD2 ARG 6 -7.470 8.367 -11.230 41 2HD ARG 6 HD1 ARG 6 -9.215 8.127 -11.276 42 HE ARG 6 HE ARG 6 -8.019 9.130 -8.796 43 1HH1 ARG 6 HH11 ARG 6 -9.884 9.747 -11.697 44 2HH1 ARG 6 HH12 ARG 6 -10.560 11.234 -11.093 45 1HH2 ARG 6 HH21 ARG 6 -8.844 11.115 -8.031 46 2HH2 ARG 6 HH22 ARG 6 -9.951 12.018 -9.020 47 H VAL 7 HN VAL 7 -4.712 3.861 -8.365 48 HA VAL 7 HA VAL 7 -3.494 5.074 -6.023 49 HB VAL 7 HB VAL 7 -2.520 2.774 -7.732 50 1HG1 VAL 7 HG11 VAL 7 -1.043 2.274 -5.836 51 2HG1 VAL 7 HG12 VAL 7 -1.616 3.724 -5.012 52 3HG1 VAL 7 HG13 VAL 7 -0.710 3.865 -6.518 53 1HG2 VAL 7 HG21 VAL 7 -4.622 2.206 -6.682 54 2HG2 VAL 7 HG22 VAL 7 -4.026 2.765 -5.119 55 3HG2 VAL 7 HG23 VAL 7 -3.308 1.345 -5.879 56 H GLY 8 HN GLY 8 -2.259 6.799 -6.270 57 1HA GLY 8 HA2 GLY 8 -1.453 7.792 -8.786 58 2HA GLY 8 HA1 GLY 8 -0.935 8.404 -7.223 59 H ASP 9 HN ASP 9 0.022 6.873 -10.024 60 HA ASP 9 HA ASP 9 2.256 5.397 -9.019 61 1HB ASP 9 HB2 ASP 9 1.164 5.036 -11.248 62 2HB ASP 9 HB1 ASP 9 1.866 6.555 -11.788 63 H LEU 10 HN LEU 10 3.790 6.420 -7.916 64 HA LEU 10 HA LEU 10 4.919 8.874 -9.026 65 1HB LEU 10 HB2 LEU 10 5.004 9.825 -6.695 66 2HB LEU 10 HB1 LEU 10 3.419 9.756 -7.436 67 HG LEU 10 HG LEU 10 3.159 7.529 -6.119 68 1HD1 LEU 10 HD11 LEU 10 5.334 8.869 -4.516 69 2HD1 LEU 10 HD12 LEU 10 5.463 7.330 -5.368 70 3HD1 LEU 10 HD13 LEU 10 4.369 7.488 -3.994 71 1HD2 LEU 10 HD21 LEU 10 3.148 10.190 -4.705 72 2HD2 LEU 10 HD22 LEU 10 2.263 8.745 -4.217 73 3HD2 LEU 10 HD23 LEU 10 1.860 9.556 -5.727 74 H THR 11 HN THR 11 7.041 9.358 -8.307 75 HA THR 11 HA THR 11 8.455 7.027 -7.200 76 HB THR 11 HB THR 11 9.484 9.017 -9.234 77 HG1 THR 11 HG1 THR 11 7.945 6.912 -9.580 78 1HG2 THR 11 HG21 THR 11 10.763 6.538 -8.075 79 2HG2 THR 11 HG22 THR 11 11.269 8.204 -7.789 80 3HG2 THR 11 HG23 THR 11 11.417 7.499 -9.399 81 H VAL 12 HN VAL 12 9.452 7.395 -5.338 82 HA VAL 12 HA VAL 12 10.145 10.175 -4.643 83 HB VAL 12 HB VAL 12 8.215 9.328 -3.330 84 1HG1 VAL 12 HG11 VAL 12 10.168 7.281 -2.299 85 2HG1 VAL 12 HG12 VAL 12 8.734 6.968 -3.278 86 3HG1 VAL 12 HG13 VAL 12 8.563 7.588 -1.635 87 1HG2 VAL 12 HG21 VAL 12 9.101 9.894 -1.102 88 2HG2 VAL 12 HG22 VAL 12 9.642 11.017 -2.350 89 3HG2 VAL 12 HG23 VAL 12 10.739 9.776 -1.744 90 H ALA 13 HN ALA 13 12.159 10.509 -3.714 91 HA ALA 13 HA ALA 13 13.912 8.147 -3.680 92 1HB ALA 13 HB1 ALA 13 15.773 9.671 -4.068 93 2HB ALA 13 HB2 ALA 13 14.666 11.043 -4.042 94 3HB ALA 13 HB3 ALA 13 14.546 9.838 -5.324 95 H LYS 14 HN LYS 14 13.854 7.412 -1.627 96 HA LYS 14 HA LYS 14 14.900 9.196 0.445 97 1HB LYS 14 HB2 LYS 14 12.454 7.473 0.903 98 2HB LYS 14 HB1 LYS 14 13.269 8.451 2.107 99 1HG LYS 14 HG2 LYS 14 11.907 9.561 -0.336 100 2HG LYS 14 HG1 LYS 14 11.161 9.430 1.256 101 1HD LYS 14 HD2 LYS 14 12.983 10.853 2.165 102 2HD LYS 14 HD1 LYS 14 13.592 11.058 0.521 103 1HE LYS 14 HE2 LYS 14 11.457 12.050 -0.140 104 2HE LYS 14 HE1 LYS 14 10.852 11.851 1.504 105 1HZ LYS 14 HZ1 LYS 14 13.034 13.627 0.572 106 2HZ LYS 14 HZ2 LYS 14 12.778 13.277 2.209 107 3HZ LYS 14 HZ3 LYS 14 11.571 14.068 1.317 108 H THR 15 HN THR 15 15.385 7.915 2.453 109 HA THR 15 HA THR 15 16.378 5.240 1.789 110 HB THR 15 HB THR 15 17.500 5.643 4.152 111 HG1 THR 15 HG1 THR 15 17.475 8.325 3.245 112 1HG2 THR 15 HG21 THR 15 18.445 7.014 1.630 113 2HG2 THR 15 HG22 THR 15 18.726 5.325 2.061 114 3HG2 THR 15 HG23 THR 15 19.452 6.613 3.022 115 H ARG 16 HN ARG 16 16.031 3.526 3.370 116 HA ARG 16 HA ARG 16 13.323 3.717 4.403 117 1HB ARG 16 HB2 ARG 16 15.158 1.313 4.338 118 2HB ARG 16 HB1 ARG 16 13.436 1.299 4.695 119 1HG ARG 16 HG2 ARG 16 13.293 0.722 2.513 120 2HG ARG 16 HG1 ARG 16 13.372 2.474 2.290 121 1HD ARG 16 HD2 ARG 16 15.088 1.991 0.901 122 2HD ARG 16 HD1 ARG 16 16.007 1.860 2.399 123 HE ARG 16 HE ARG 16 14.893 -0.385 0.860 124 1HH1 ARG 16 HH11 ARG 16 17.143 0.908 3.201 125 2HH1 ARG 16 HH12 ARG 16 18.031 -0.577 3.362 126 1HH2 ARG 16 HH21 ARG 16 16.044 -2.374 1.113 127 2HH2 ARG 16 HH22 ARG 16 17.414 -2.425 2.187 128 H GLY 17 HN GLY 17 16.289 4.426 5.579 129 1HA GLY 17 HA2 GLY 17 15.920 3.394 8.261 130 2HA GLY 17 HA1 GLY 17 17.239 4.414 7.703 131 H GLN 18 HN GLN 18 15.262 6.326 6.507 132 HA GLN 18 HA GLN 18 14.971 7.944 8.870 133 1HB GLN 18 HB2 GLN 18 14.248 9.709 7.382 134 2HB GLN 18 HB1 GLN 18 15.689 8.940 6.734 135 1HG GLN 18 HG2 GLN 18 14.368 7.723 5.124 136 2HG GLN 18 HG1 GLN 18 12.884 8.345 5.844 137 1HE2 GLN 18 HE21 GLN 18 15.733 9.160 3.997 138 2HE2 GLN 18 HE22 GLN 18 15.119 10.637 3.335 139 H LEU 19 HN LEU 19 13.177 5.526 7.655 140 HA LEU 19 HA LEU 19 10.566 6.665 7.790 141 1HB LEU 19 HB2 LEU 19 11.393 3.768 7.746 142 2HB LEU 19 HB1 LEU 19 9.765 4.376 7.487 143 HG LEU 19 HG LEU 19 12.155 4.820 5.694 144 1HD1 LEU 19 HD11 LEU 19 11.187 2.591 5.523 145 2HD1 LEU 19 HD12 LEU 19 10.861 3.536 4.071 146 3HD1 LEU 19 HD13 LEU 19 9.590 3.295 5.268 147 1HD2 LEU 19 HD21 LEU 19 10.609 5.991 4.217 148 2HD2 LEU 19 HD22 LEU 19 10.754 6.810 5.772 149 3HD2 LEU 19 HD23 LEU 19 9.330 5.831 5.420 150 H THR 20 HN THR 20 12.700 5.133 9.977 151 HA THR 20 HA THR 20 12.456 4.297 12.113 152 HB THR 20 HB THR 20 13.152 6.568 12.433 153 HG1 THR 20 HG1 THR 20 11.060 5.893 14.252 154 1HG2 THR 20 HG21 THR 20 11.432 7.766 11.189 155 2HG2 THR 20 HG22 THR 20 11.563 8.410 12.828 156 3HG2 THR 20 HG23 THR 20 10.228 7.337 12.406 157 H ASP 21 HN ASP 21 10.505 2.996 11.046 158 HA ASP 21 HA ASP 21 8.747 1.718 11.676 159 1HB ASP 21 HB2 ASP 21 8.632 3.572 14.048 160 2HB ASP 21 HB1 ASP 21 7.456 2.293 13.788 161 H ALA 22 HN ALA 22 8.137 5.211 11.999 162 HA ALA 22 HA ALA 22 5.860 4.877 10.212 163 1HB ALA 22 HB1 ALA 22 5.572 6.188 12.908 164 2HB ALA 22 HB2 ALA 22 4.905 4.624 12.439 165 3HB ALA 22 HB3 ALA 22 4.332 6.099 11.657 166 H ALA 23 HN ALA 23 7.181 6.020 8.722 167 HA ALA 23 HA ALA 23 6.763 8.899 9.054 168 1HB ALA 23 HB1 ALA 23 9.295 7.732 7.915 169 2HB ALA 23 HB2 ALA 23 9.142 8.475 9.506 170 3HB ALA 23 HB3 ALA 23 8.900 9.445 8.053 171 HA PRO 24 HA PRO 24 4.765 7.856 5.148 172 1HB PRO 24 HB2 PRO 24 3.503 10.264 4.923 173 2HB PRO 24 HB1 PRO 24 2.894 8.934 5.915 174 1HG PRO 24 HG2 PRO 24 4.457 11.350 6.743 175 2HG PRO 24 HG1 PRO 24 3.058 10.598 7.532 176 1HD PRO 24 HD2 PRO 24 5.575 10.187 8.408 177 2HD PRO 24 HD1 PRO 24 4.336 8.925 8.487 178 H ILE 25 HN ILE 25 6.509 7.821 3.782 179 HA ILE 25 HA ILE 25 7.634 10.391 2.946 180 HB ILE 25 HB ILE 25 9.305 8.946 1.711 181 1HG1 ILE 25 HG12 ILE 25 9.494 6.661 3.004 182 2HG1 ILE 25 HG11 ILE 25 7.767 6.854 3.194 183 1HG2 ILE 25 HG21 ILE 25 9.876 10.117 3.734 184 2HG2 ILE 25 HG22 ILE 25 10.605 8.511 3.770 185 3HG2 ILE 25 HG23 ILE 25 9.156 8.844 4.720 186 1HD1 ILE 25 HD11 ILE 25 9.281 6.731 0.598 187 2HD1 ILE 25 HD12 ILE 25 7.545 6.995 0.753 188 3HD1 ILE 25 HD13 ILE 25 8.255 5.471 1.284 189 H GLY 26 HN GLY 26 5.612 7.831 1.811 190 1HA GLY 26 HA2 GLY 26 5.451 9.255 -0.764 191 2HA GLY 26 HA1 GLY 26 5.431 7.502 -0.689 192 HA PRO 27 HA PRO 27 1.137 8.759 1.319 193 1HB PRO 27 HB2 PRO 27 0.733 11.524 1.159 194 2HB PRO 27 HB1 PRO 27 1.085 10.611 2.627 195 1HG PRO 27 HG2 PRO 27 2.933 12.158 0.869 196 2HG PRO 27 HG1 PRO 27 2.925 12.006 2.637 197 1HD PRO 27 HD2 PRO 27 4.706 10.654 1.164 198 2HD PRO 27 HD1 PRO 27 3.937 9.906 2.578 199 H VAL 28 HN VAL 28 0.104 7.967 -0.378 200 HA VAL 28 HA VAL 28 0.122 9.328 -2.954 201 HB VAL 28 HB VAL 28 -1.121 6.697 -2.126 202 1HG1 VAL 28 HG11 VAL 28 -0.657 7.836 -4.874 203 2HG1 VAL 28 HG12 VAL 28 -2.218 7.673 -4.069 204 3HG1 VAL 28 HG13 VAL 28 -1.298 6.233 -4.508 205 1HG2 VAL 28 HG21 VAL 28 1.462 7.250 -3.578 206 2HG2 VAL 28 HG22 VAL 28 0.760 5.656 -3.304 207 3HG2 VAL 28 HG23 VAL 28 1.300 6.628 -1.935 208 H THR 29 HN THR 29 -1.624 10.345 -3.832 209 HA THR 29 HA THR 29 -3.890 10.929 -2.170 210 HB THR 29 HB THR 29 -4.685 12.063 -4.366 211 HG1 THR 29 HG1 THR 29 -3.396 11.348 -5.938 212 1HG2 THR 29 HG21 THR 29 -2.184 12.971 -2.942 213 2HG2 THR 29 HG22 THR 29 -3.845 13.304 -2.454 214 3HG2 THR 29 HG23 THR 29 -3.211 13.994 -3.947 215 H VAL 30 HN VAL 30 -5.136 9.154 -1.834 216 HA VAL 30 HA VAL 30 -6.075 7.669 -4.194 217 HB VAL 30 HB VAL 30 -6.237 6.967 -1.260 218 1HG1 VAL 30 HG11 VAL 30 -7.118 5.387 -3.672 219 2HG1 VAL 30 HG12 VAL 30 -8.168 6.104 -2.451 220 3HG1 VAL 30 HG13 VAL 30 -7.078 4.787 -2.014 221 1HG2 VAL 30 HG21 VAL 30 -4.653 5.188 -1.843 222 2HG2 VAL 30 HG22 VAL 30 -3.985 6.784 -2.174 223 3HG2 VAL 30 HG23 VAL 30 -4.590 5.789 -3.498 224 H GLN 31 HN GLN 31 -7.882 8.421 -4.982 225 HA GLN 31 HA GLN 31 -9.963 9.427 -3.176 226 1HB GLN 31 HB2 GLN 31 -8.927 10.785 -5.198 227 2HB GLN 31 HB1 GLN 31 -10.032 9.808 -6.150 228 1HG GLN 31 HG2 GLN 31 -10.845 11.582 -3.858 229 2HG GLN 31 HG1 GLN 31 -10.924 12.029 -5.558 230 1HE2 GLN 31 HE21 GLN 31 -12.469 11.075 -6.882 231 2HE2 GLN 31 HE22 GLN 31 -13.842 10.248 -6.229 232 H ALA 32 HN ALA 32 -11.314 7.818 -2.682 233 HA ALA 32 HA ALA 32 -11.723 5.589 -4.446 234 1HB ALA 32 HB1 ALA 32 -11.648 5.246 -2.031 235 2HB ALA 32 HB2 ALA 32 -13.199 4.733 -2.694 236 3HB ALA 32 HB3 ALA 32 -13.072 6.269 -1.837 237 H LEU 33 HN LEU 33 -12.696 6.339 -6.275 238 HA LEU 33 HA LEU 33 -15.031 8.045 -6.085 239 1HB LEU 33 HB2 LEU 33 -13.180 8.332 -7.782 240 2HB LEU 33 HB1 LEU 33 -13.755 6.872 -8.558 241 HG LEU 33 HG LEU 33 -15.588 9.223 -8.164 242 1HD1 LEU 33 HD11 LEU 33 -13.606 10.077 -9.296 243 2HD1 LEU 33 HD12 LEU 33 -14.974 9.984 -10.407 244 3HD1 LEU 33 HD13 LEU 33 -13.700 8.764 -10.471 245 1HD2 LEU 33 HD21 LEU 33 -16.570 7.071 -8.823 246 2HD2 LEU 33 HD22 LEU 33 -15.493 7.018 -10.220 247 3HD2 LEU 33 HD23 LEU 33 -16.719 8.279 -10.098 248 H GLY 34 HN GLY 34 -16.943 7.153 -5.695 249 1HA GLY 34 HA2 GLY 34 -18.743 5.866 -6.745 250 2HA GLY 34 HA1 GLY 34 -17.560 4.605 -7.052 251 H CYS 35 HN CYS 35 -16.470 5.232 -4.257 252 HA CYS 35 HA CYS 35 -18.051 3.304 -2.864 253 1HB CYS 35 HB2 CYS 35 -15.605 4.888 -2.266 254 2HB CYS 35 HB1 CYS 35 -16.527 4.288 -0.895 255 H ASN 36 HN ASN 36 -20.063 3.878 -2.342 256 HA ASN 36 HA ASN 36 -20.460 6.434 -0.924 257 1HB ASN 36 HB2 ASN 36 -22.456 4.596 -2.269 258 2HB ASN 36 HB1 ASN 36 -22.899 6.017 -1.329 259 1HD2 ASN 36 HD21 ASN 36 -21.525 4.850 -4.290 260 2HD2 ASN 36 HD22 ASN 36 -21.546 6.361 -5.133 261 H ALA 37 HN ALA 37 -21.038 2.978 -0.827 262 HA ALA 37 HA ALA 37 -20.935 3.086 2.094 263 1HB ALA 37 HB1 ALA 37 -23.327 3.075 1.574 264 2HB ALA 37 HB2 ALA 37 -22.834 1.556 2.321 265 3HB ALA 37 HB3 ALA 37 -23.110 1.634 0.581 266 H ARG 38 HN ARG 38 -18.773 2.398 1.145 267 HA ARG 38 HA ARG 38 -18.657 -0.509 1.015 268 1HB ARG 38 HB2 ARG 38 -18.916 0.349 -1.329 269 2HB ARG 38 HB1 ARG 38 -17.429 1.258 -1.102 270 1HG ARG 38 HG2 ARG 38 -17.260 -0.929 -2.364 271 2HG ARG 38 HG1 ARG 38 -16.112 -0.670 -1.050 272 1HD ARG 38 HD2 ARG 38 -17.056 -2.956 -1.091 273 2HD ARG 38 HD1 ARG 38 -17.375 -2.096 0.410 274 HE ARG 38 HE ARG 38 -19.613 -1.646 -1.060 275 1HH1 ARG 38 HH11 ARG 38 -17.834 -4.524 -0.188 276 2HH1 ARG 38 HH12 ARG 38 -19.245 -5.537 -0.088 277 1HH2 ARG 38 HH21 ARG 38 -21.493 -2.964 -0.934 278 2HH2 ARG 38 HH22 ARG 38 -21.327 -4.650 -0.534 279 H GLN 39 HN GLN 39 -16.650 -1.364 1.577 280 HA GLN 39 HA GLN 39 -14.890 0.383 3.063 281 1HB GLN 39 HB2 GLN 39 -14.615 -2.588 2.556 282 2HB GLN 39 HB1 GLN 39 -13.841 -1.647 3.827 283 1HG GLN 39 HG2 GLN 39 -15.970 -1.251 4.889 284 2HG GLN 39 HG1 GLN 39 -16.808 -2.077 3.578 285 1HE2 GLN 39 HE21 GLN 39 -16.691 -4.323 3.434 286 2HE2 GLN 39 HE22 GLN 39 -16.164 -5.304 4.753 287 H VAL 40 HN VAL 40 -13.069 1.232 2.278 288 HA VAL 40 HA VAL 40 -12.208 0.511 -0.416 289 HB VAL 40 HB VAL 40 -11.143 2.725 1.345 290 1HG1 VAL 40 HG11 VAL 40 -11.008 2.279 -1.633 291 2HG1 VAL 40 HG12 VAL 40 -9.674 2.124 -0.489 292 3HG1 VAL 40 HG13 VAL 40 -10.405 3.702 -0.785 293 1HG2 VAL 40 HG21 VAL 40 -13.538 3.029 1.030 294 2HG2 VAL 40 HG22 VAL 40 -13.339 2.862 -0.714 295 3HG2 VAL 40 HG23 VAL 40 -12.627 4.238 0.127 296 H ALA 41 HN ALA 41 -10.429 -0.714 -0.777 297 HA ALA 41 HA ALA 41 -8.669 -1.255 1.506 298 1HB ALA 41 HB1 ALA 41 -9.531 -3.206 -0.627 299 2HB ALA 41 HB2 ALA 41 -10.181 -3.140 1.011 300 3HB ALA 41 HB3 ALA 41 -8.485 -3.550 0.751 301 H LEU 42 HN LEU 42 -6.518 -1.295 1.124 302 HA LEU 42 HA LEU 42 -5.622 -0.604 -1.581 303 1HB LEU 42 HB2 LEU 42 -3.945 -0.583 0.920 304 2HB LEU 42 HB1 LEU 42 -3.658 0.267 -0.587 305 HG LEU 42 HG LEU 42 -5.955 0.908 1.247 306 1HD1 LEU 42 HD11 LEU 42 -3.874 1.287 2.431 307 2HD1 LEU 42 HD12 LEU 42 -4.631 2.821 1.992 308 3HD1 LEU 42 HD13 LEU 42 -3.254 2.217 1.068 309 1HD2 LEU 42 HD21 LEU 42 -6.032 2.990 -0.027 310 2HD2 LEU 42 HD22 LEU 42 -6.253 1.591 -1.078 311 3HD2 LEU 42 HD23 LEU 42 -4.699 2.425 -1.036 312 H LYS 43 HN LYS 43 -5.017 -2.283 -2.774 313 HA LYS 43 HA LYS 43 -3.856 -4.629 -1.429 314 1HB LYS 43 HB2 LYS 43 -5.552 -4.347 -3.877 315 2HB LYS 43 HB1 LYS 43 -4.431 -5.689 -3.768 316 1HG LYS 43 HG2 LYS 43 -6.583 -6.429 -3.064 317 2HG LYS 43 HG1 LYS 43 -5.523 -6.373 -1.658 318 1HD LYS 43 HD2 LYS 43 -7.765 -5.512 -1.166 319 2HD LYS 43 HD1 LYS 43 -6.522 -4.281 -0.951 320 1HE LYS 43 HE2 LYS 43 -8.551 -3.440 -2.067 321 2HE LYS 43 HE1 LYS 43 -7.099 -3.264 -3.049 322 1HZ LYS 43 HZ1 LYS 43 -9.155 -5.380 -3.355 323 2HZ LYS 43 HZ2 LYS 43 -7.761 -5.228 -4.297 324 3HZ LYS 43 HZ3 LYS 43 -8.962 -4.038 -4.366 325 H ALA 44 HN ALA 44 -2.048 -5.617 -2.340 326 HA ALA 44 HA ALA 44 -0.466 -3.872 -4.076 327 1HB ALA 44 HB1 ALA 44 1.442 -5.244 -3.371 328 2HB ALA 44 HB2 ALA 44 0.357 -6.229 -2.388 329 3HB ALA 44 HB3 ALA 44 0.598 -4.524 -1.999 330 H ASP 45 HN ASP 45 0.923 -5.016 -5.691 331 HA ASP 45 HA ASP 45 -0.631 -7.070 -7.079 332 1HB ASP 45 HB2 ASP 45 0.141 -5.143 -8.404 333 2HB ASP 45 HB1 ASP 45 1.808 -5.509 -7.973 334 H THR 46 HN THR 46 0.513 -8.971 -7.921 335 HA THR 46 HA THR 46 1.751 -10.447 -5.934 336 HB THR 46 HB THR 46 0.639 -11.452 -7.873 337 HG1 THR 46 HG1 THR 46 2.618 -12.430 -6.647 338 1HG2 THR 46 HG21 THR 46 1.427 -9.955 -9.621 339 2HG2 THR 46 HG22 THR 46 1.814 -11.628 -10.025 340 3HG2 THR 46 HG23 THR 46 3.073 -10.554 -9.416 341 H ASP 47 HN ASP 47 3.135 -8.155 -8.061 342 HA ASP 47 HA ASP 47 5.818 -8.834 -8.137 343 1HB ASP 47 HB2 ASP 47 5.379 -7.016 -9.429 344 2HB ASP 47 HB1 ASP 47 4.203 -6.359 -8.302 345 H ASN 48 HN ASN 48 3.979 -7.326 -5.519 346 HA ASN 48 HA ASN 48 6.274 -7.787 -3.738 347 1HB ASN 48 HB2 ASN 48 5.828 -5.641 -2.589 348 2HB ASN 48 HB1 ASN 48 6.321 -5.404 -4.261 349 1HD2 ASN 48 HD21 ASN 48 4.747 -4.824 -5.798 350 2HD2 ASN 48 HD22 ASN 48 3.280 -4.036 -5.302 351 H PHE 49 HN PHE 49 3.537 -8.967 -4.368 352 HA PHE 49 HA PHE 49 2.414 -8.918 -1.636 353 1HB PHE 49 HB2 PHE 49 1.001 -7.884 -3.444 354 2HB PHE 49 HB1 PHE 49 0.971 -9.441 -4.245 355 HD1 PHE 49 HD1 PHE 49 -0.161 -7.592 -1.254 356 HD2 PHE 49 HD2 PHE 49 -0.569 -11.100 -3.634 357 HE1 PHE 49 HE1 PHE 49 -2.262 -8.128 -0.109 358 HE2 PHE 49 HE2 PHE 49 -2.663 -11.652 -2.468 359 HZ PHE 49 HZ PHE 49 -3.521 -10.154 -0.708 360 H GLU 50 HN GLU 50 3.275 -10.732 -0.741 361 HA GLU 50 HA GLU 50 3.239 -13.193 -2.333 362 1HB GLU 50 HB2 GLU 50 4.788 -14.112 -0.650 363 2HB GLU 50 HB1 GLU 50 5.417 -12.657 -1.405 364 1HG GLU 50 HG2 GLU 50 4.885 -11.355 0.548 365 2HG GLU 50 HG1 GLU 50 4.082 -12.735 1.292 366 H GLN 51 HN GLN 51 1.266 -14.031 -2.172 367 HA GLN 51 HA GLN 51 -0.433 -15.266 -1.315 368 1HB GLN 51 HB2 GLN 51 1.239 -16.386 0.082 369 2HB GLN 51 HB1 GLN 51 1.106 -15.115 1.284 370 1HG GLN 51 HG2 GLN 51 -1.221 -15.725 1.682 371 2HG GLN 51 HG1 GLN 51 -1.087 -17.008 0.478 372 1HE2 GLN 51 HE21 GLN 51 -0.145 -15.934 3.644 373 2HE2 GLN 51 HE22 GLN 51 0.420 -17.468 4.219 374 H GLY 52 HN GLY 52 0.581 -12.820 1.029 375 1HA GLY 52 HA2 GLY 52 -1.729 -11.232 0.776 376 2HA GLY 52 HA1 GLY 52 -1.912 -12.296 2.170 377 H LYS 53 HN LYS 53 1.058 -10.923 0.927 378 HA LYS 53 HA LYS 53 1.231 -9.067 3.198 379 1HB LYS 53 HB2 LYS 53 3.537 -10.785 2.259 380 2HB LYS 53 HB1 LYS 53 3.514 -9.705 3.642 381 1HG LYS 53 HG2 LYS 53 1.677 -12.061 3.514 382 2HG LYS 53 HG1 LYS 53 3.354 -12.244 4.029 383 1HD LYS 53 HD2 LYS 53 1.328 -10.387 5.276 384 2HD LYS 53 HD1 LYS 53 1.818 -11.953 5.928 385 1HE LYS 53 HE2 LYS 53 4.183 -11.060 5.948 386 2HE LYS 53 HE1 LYS 53 3.495 -9.474 5.601 387 1HZ LYS 53 HZ1 LYS 53 3.078 -11.145 8.014 388 2HZ LYS 53 HZ2 LYS 53 2.106 -9.807 7.655 389 3HZ LYS 53 HZ3 LYS 53 3.772 -9.599 7.922 390 H PHE 54 HN PHE 54 1.909 -7.065 2.495 391 HA PHE 54 HA PHE 54 3.354 -7.015 -0.051 392 1HB PHE 54 HB2 PHE 54 2.591 -4.570 -0.175 393 2HB PHE 54 HB1 PHE 54 1.421 -5.828 -0.526 394 HD1 PHE 54 HD1 PHE 54 -0.636 -5.009 -0.019 395 HD2 PHE 54 HD2 PHE 54 2.541 -4.379 2.739 396 HE1 PHE 54 HE1 PHE 54 -2.222 -3.990 1.560 397 HE2 PHE 54 HE2 PHE 54 0.956 -3.370 4.330 398 HZ PHE 54 HZ PHE 54 -1.425 -3.172 3.739 399 H PHE 55 HN PHE 55 5.024 -5.478 -0.330 400 HA PHE 55 HA PHE 55 6.265 -4.338 2.015 401 1HB PHE 55 HB2 PHE 55 8.389 -5.704 1.584 402 2HB PHE 55 HB1 PHE 55 7.090 -6.524 2.403 403 HD1 PHE 55 HD1 PHE 55 8.779 -6.123 -0.839 404 HD2 PHE 55 HD2 PHE 55 6.083 -8.455 1.479 405 HE1 PHE 55 HE1 PHE 55 8.843 -7.888 -2.546 406 HE2 PHE 55 HE2 PHE 55 6.145 -10.229 -0.227 407 HZ PHE 55 HZ PHE 55 7.527 -9.944 -2.243 408 H LEU 56 HN LEU 56 8.534 -3.541 1.390 409 HA LEU 56 HA LEU 56 8.472 -2.256 -1.199 410 1HB LEU 56 HB2 LEU 56 10.807 -2.378 0.715 411 2HB LEU 56 HB1 LEU 56 10.537 -1.219 -0.564 412 HG LEU 56 HG LEU 56 8.814 -1.419 1.900 413 1HD1 LEU 56 HD11 LEU 56 11.068 0.485 1.281 414 2HD1 LEU 56 HD12 LEU 56 11.090 -0.787 2.502 415 3HD1 LEU 56 HD13 LEU 56 9.988 0.579 2.672 416 1HD2 LEU 56 HD21 LEU 56 8.035 0.795 1.190 417 2HD2 LEU 56 HD22 LEU 56 7.683 -0.440 -0.017 418 3HD2 LEU 56 HD23 LEU 56 9.027 0.672 -0.263 419 H ILE 57 HN ILE 57 8.915 -3.475 -2.961 420 HA ILE 57 HA ILE 57 10.931 -5.590 -2.663 421 HB ILE 57 HB ILE 57 8.738 -6.421 -3.405 422 1HG1 ILE 57 HG12 ILE 57 9.492 -7.620 -5.442 423 2HG1 ILE 57 HG11 ILE 57 10.862 -6.520 -5.559 424 1HG2 ILE 57 HG21 ILE 57 7.912 -4.439 -4.524 425 2HG2 ILE 57 HG22 ILE 57 7.855 -5.829 -5.609 426 3HG2 ILE 57 HG23 ILE 57 9.128 -4.622 -5.785 427 1HD1 ILE 57 HD11 ILE 57 10.322 -8.494 -3.353 428 2HD1 ILE 57 HD12 ILE 57 11.642 -7.327 -3.360 429 3HD1 ILE 57 HD13 ILE 57 11.578 -8.591 -4.587 430 H SER 58 HN SER 58 12.812 -5.362 -3.619 431 HA SER 58 HA SER 58 13.447 -3.109 -5.234 432 1HB SER 58 HB2 SER 58 15.113 -4.201 -3.782 433 2HB SER 58 HB1 SER 58 14.981 -5.680 -4.730 434 HG SER 58 HG SER 58 16.765 -4.096 -5.190 435 H ASP 59 HN ASP 59 14.020 -3.111 -7.466 436 HA ASP 59 HA ASP 59 12.381 -4.644 -9.154 437 1HB ASP 59 HB2 ASP 59 13.249 -2.502 -9.888 438 2HB ASP 59 HB1 ASP 59 14.903 -3.098 -9.789 439 H ASN 60 HN ASN 60 15.634 -5.137 -7.970 440 HA ASN 60 HA ASN 60 16.158 -7.385 -9.704 441 1HB ASN 60 HB2 ASN 60 17.635 -6.244 -7.331 442 2HB ASN 60 HB1 ASN 60 18.171 -7.687 -8.183 443 1HD2 ASN 60 HD21 ASN 60 17.327 -6.726 -10.785 444 2HD2 ASN 60 HD22 ASN 60 18.467 -5.508 -11.245 445 H ASN 61 HN ASN 61 14.180 -6.964 -7.172 446 HA ASN 61 HA ASN 61 13.272 -8.232 -5.520 447 1HB ASN 61 HB2 ASN 61 12.214 -10.299 -6.431 448 2HB ASN 61 HB1 ASN 61 11.950 -8.856 -7.398 449 1HD2 ASN 61 HD21 ASN 61 12.966 -8.677 -9.414 450 2HD2 ASN 61 HD22 ASN 61 13.608 -10.058 -10.233 451 H ARG 62 HN ARG 62 15.633 -8.292 -4.629 452 HA ARG 62 HA ARG 62 16.033 -11.110 -3.875 453 1HB ARG 62 HB2 ARG 62 18.439 -10.539 -3.486 454 2HB ARG 62 HB1 ARG 62 17.957 -10.516 -5.179 455 1HG ARG 62 HG2 ARG 62 17.800 -8.066 -5.074 456 2HG ARG 62 HG1 ARG 62 18.321 -8.118 -3.389 457 1HD ARG 62 HD2 ARG 62 20.220 -7.588 -4.742 458 2HD ARG 62 HD1 ARG 62 20.418 -9.231 -4.138 459 HE ARG 62 HE ARG 62 19.184 -9.330 -6.659 460 1HH1 ARG 62 HH11 ARG 62 22.282 -8.609 -5.190 461 2HH1 ARG 62 HH12 ARG 62 23.190 -8.991 -6.629 462 1HH2 ARG 62 HH21 ARG 62 20.359 -9.818 -8.542 463 2HH2 ARG 62 HH22 ARG 62 22.097 -9.664 -8.541 464 H ASP 63 HN ASP 63 15.253 -8.011 -2.953 465 HA ASP 63 HA ASP 63 15.655 -8.599 -0.127 466 1HB ASP 63 HB2 ASP 63 16.194 -6.107 0.066 467 2HB ASP 63 HB1 ASP 63 17.459 -7.140 -0.562 468 H LYS 64 HN LYS 64 14.164 -7.524 1.277 469 HA LYS 64 HA LYS 64 12.013 -5.960 0.141 470 1HB LYS 64 HB2 LYS 64 10.227 -7.454 0.558 471 2HB LYS 64 HB1 LYS 64 11.438 -8.414 -0.280 472 1HG LYS 64 HG2 LYS 64 12.066 -9.540 1.685 473 2HG LYS 64 HG1 LYS 64 11.243 -8.369 2.716 474 1HD LYS 64 HD2 LYS 64 9.845 -10.246 2.716 475 2HD LYS 64 HD1 LYS 64 9.100 -9.131 1.571 476 1HE LYS 64 HE2 LYS 64 9.052 -11.294 0.581 477 2HE LYS 64 HE1 LYS 64 10.287 -10.362 -0.264 478 1HZ LYS 64 HZ1 LYS 64 10.703 -12.456 1.798 479 2HZ LYS 64 HZ2 LYS 64 11.942 -11.445 1.243 480 3HZ LYS 64 HZ3 LYS 64 11.171 -12.505 0.169 481 H LEU 65 HN LEU 65 10.714 -4.946 1.733 482 HA LEU 65 HA LEU 65 11.150 -5.673 4.528 483 1HB LEU 65 HB2 LEU 65 10.868 -2.765 4.047 484 2HB LEU 65 HB1 LEU 65 11.684 -3.606 5.340 485 HG LEU 65 HG LEU 65 12.793 -3.325 2.572 486 1HD1 LEU 65 HD11 LEU 65 13.361 -1.656 5.008 487 2HD1 LEU 65 HD12 LEU 65 12.466 -1.128 3.583 488 3HD1 LEU 65 HD13 LEU 65 14.178 -1.530 3.450 489 1HD2 LEU 65 HD21 LEU 65 13.770 -5.163 3.833 490 2HD2 LEU 65 HD22 LEU 65 14.057 -4.090 5.202 491 3HD2 LEU 65 HD23 LEU 65 14.933 -3.844 3.692 492 H TYR 66 HN TYR 66 9.198 -5.856 5.466 493 HA TYR 66 HA TYR 66 6.894 -5.426 3.870 494 1HB TYR 66 HB2 TYR 66 7.175 -6.166 6.775 495 2HB TYR 66 HB1 TYR 66 5.659 -6.195 5.883 496 HD1 TYR 66 HD1 TYR 66 8.719 -7.944 6.619 497 HD2 TYR 66 HD2 TYR 66 5.395 -7.796 3.979 498 HE1 TYR 66 HE1 TYR 66 9.239 -10.221 5.856 499 HE2 TYR 66 HE2 TYR 66 5.900 -10.081 3.206 500 HH TYR 66 HH TYR 66 8.210 -12.101 4.815 501 H VAL 67 HN VAL 67 5.458 -3.855 3.844 502 HA VAL 67 HA VAL 67 5.725 -1.649 5.771 503 HB VAL 67 HB VAL 67 5.214 -0.053 3.951 504 1HG1 VAL 67 HG11 VAL 67 7.440 -0.052 2.935 505 2HG1 VAL 67 HG12 VAL 67 7.705 -1.692 3.524 506 3HG1 VAL 67 HG13 VAL 67 7.510 -0.364 4.668 507 1HG2 VAL 67 HG21 VAL 67 4.141 -1.568 2.380 508 2HG2 VAL 67 HG22 VAL 67 5.661 -2.428 2.142 509 3HG2 VAL 67 HG23 VAL 67 5.504 -0.753 1.614 510 H ASN 68 HN ASN 68 3.751 -0.177 5.558 511 HA ASN 68 HA ASN 68 1.412 -1.421 4.439 512 1HB ASN 68 HB2 ASN 68 0.168 -0.927 6.701 513 2HB ASN 68 HB1 ASN 68 0.995 -2.454 6.446 514 1HD2 ASN 68 HD21 ASN 68 1.341 -2.888 8.546 515 2HD2 ASN 68 HD22 ASN 68 2.442 -2.007 9.549 516 H ILE 69 HN ILE 69 0.097 0.018 3.611 517 HA ILE 69 HA ILE 69 0.992 2.753 3.617 518 HB ILE 69 HB ILE 69 -1.521 2.273 2.227 519 1HG1 ILE 69 HG12 ILE 69 0.884 0.628 1.402 520 2HG1 ILE 69 HG11 ILE 69 -0.575 -0.028 2.138 521 1HG2 ILE 69 HG21 ILE 69 1.231 3.107 1.317 522 2HG2 ILE 69 HG22 ILE 69 -0.069 4.184 1.823 523 3HG2 ILE 69 HG23 ILE 69 -0.244 3.219 0.357 524 1HD1 ILE 69 HD11 ILE 69 -1.873 0.746 0.214 525 2HD1 ILE 69 HD12 ILE 69 -0.587 -0.366 -0.254 526 3HD1 ILE 69 HD13 ILE 69 -0.396 1.367 -0.523 527 H ARG 70 HN ARG 70 0.525 3.502 5.665 528 HA ARG 70 HA ARG 70 -2.163 3.237 6.727 529 1HB ARG 70 HB2 ARG 70 0.119 4.802 7.932 530 2HB ARG 70 HB1 ARG 70 -1.292 4.147 8.751 531 1HG ARG 70 HG2 ARG 70 -0.482 1.909 8.483 532 2HG ARG 70 HG1 ARG 70 0.849 2.468 7.467 533 1HD ARG 70 HD2 ARG 70 1.624 3.836 9.432 534 2HD ARG 70 HD1 ARG 70 0.425 2.984 10.404 535 HE ARG 70 HE ARG 70 2.043 1.116 9.036 536 1HH1 ARG 70 HH11 ARG 70 2.216 3.439 11.663 537 2HH1 ARG 70 HH12 ARG 70 3.431 2.542 12.536 538 1HH2 ARG 70 HH21 ARG 70 3.650 -0.042 10.172 539 2HH2 ARG 70 HH22 ARG 70 4.258 0.582 11.671 540 HA PRO 71 HA PRO 71 -3.752 7.127 5.202 541 1HB PRO 71 HB2 PRO 71 -4.996 7.108 7.917 542 2HB PRO 71 HB1 PRO 71 -5.731 7.412 6.345 543 1HG PRO 71 HG2 PRO 71 -6.094 5.082 7.553 544 2HG PRO 71 HG1 PRO 71 -5.834 5.158 5.800 545 1HD PRO 71 HD2 PRO 71 -3.956 4.331 7.961 546 2HD PRO 71 HD1 PRO 71 -4.113 3.716 6.304 547 H MET 72 HN MET 72 -2.651 8.998 5.233 548 HA MET 72 HA MET 72 -0.838 9.575 7.376 549 1HB MET 72 HB2 MET 72 -0.300 10.066 5.003 550 2HB MET 72 HB1 MET 72 -1.573 11.279 4.987 551 1HG MET 72 HG2 MET 72 -0.392 12.602 6.620 552 2HG MET 72 HG1 MET 72 0.843 11.355 6.783 553 1HE MET 72 HE1 MET 72 2.744 13.189 6.352 554 2HE MET 72 HE2 MET 72 1.487 14.419 6.213 555 3HE MET 72 HE3 MET 72 2.733 14.287 4.972 556 H ASP 73 HN ASP 73 -2.326 9.747 9.114 557 HA ASP 73 HA ASP 73 -3.407 10.922 10.723 558 1HB ASP 73 HB2 ASP 73 -2.452 13.264 9.075 559 2HB ASP 73 HB1 ASP 73 -3.232 13.428 10.644 560 H ASN 74 HN ASN 74 -4.801 10.160 8.160 561 HA ASN 74 HA ASN 74 -6.865 12.197 7.964 562 1HB ASN 74 HB2 ASN 74 -6.035 9.874 6.319 563 2HB ASN 74 HB1 ASN 74 -7.737 10.321 6.265 564 1HD2 ASN 74 HD21 ASN 74 -4.471 11.392 5.615 565 2HD2 ASN 74 HD22 ASN 74 -4.907 12.708 4.580 566 H SER 75 HN SER 75 -6.683 8.710 8.680 567 HA SER 75 HA SER 75 -8.709 8.882 10.659 568 1HB SER 75 HB2 SER 75 -9.967 9.023 8.395 569 2HB SER 75 HB1 SER 75 -9.557 7.317 8.222 570 HG SER 75 HG SER 75 -11.155 6.890 9.501 571 H ALA 76 HN ALA 76 -9.498 6.443 11.076 572 HA ALA 76 HA ALA 76 -7.012 4.897 11.227 573 1HB ALA 76 HB1 ALA 76 -8.088 5.428 13.363 574 2HB ALA 76 HB2 ALA 76 -8.050 3.690 13.069 575 3HB ALA 76 HB3 ALA 76 -9.546 4.591 12.833 576 H TRP 77 HN TRP 77 -6.760 3.162 10.031 577 HA TRP 77 HA TRP 77 -9.144 1.918 8.813 578 1HB TRP 77 HB2 TRP 77 -6.398 2.469 7.729 579 2HB TRP 77 HB1 TRP 77 -7.360 1.158 7.061 580 HD1 TRP 77 HD1 TRP 77 -8.927 4.557 8.034 581 HE1 TRP 77 HE1 TRP 77 -9.806 5.684 5.873 582 HE3 TRP 77 HE3 TRP 77 -7.063 1.276 4.598 583 HZ2 TRP 77 HZ2 TRP 77 -9.701 5.223 3.096 584 HZ3 TRP 77 HZ3 TRP 77 -7.494 1.688 2.214 585 HH2 TRP 77 HH2 TRP 77 -8.783 3.621 1.479 586 H THR 78 HN THR 78 -8.930 -0.407 8.376 587 HA THR 78 HA THR 78 -7.627 -1.803 10.543 588 HB THR 78 HB THR 78 -9.142 -2.962 8.192 589 HG1 THR 78 HG1 THR 78 -10.108 -2.176 10.770 590 1HG2 THR 78 HG21 THR 78 -7.794 -4.577 9.460 591 2HG2 THR 78 HG22 THR 78 -9.520 -4.858 9.692 592 3HG2 THR 78 HG23 THR 78 -8.576 -4.060 10.952 593 H THR 79 HN THR 79 -5.558 -2.394 10.418 594 HA THR 79 HA THR 79 -4.289 -2.302 7.795 595 HB THR 79 HB THR 79 -3.230 -0.847 9.319 596 HG1 THR 79 HG1 THR 79 -1.667 -3.228 9.183 597 1HG2 THR 79 HG21 THR 79 -3.038 -3.162 11.247 598 2HG2 THR 79 HG22 THR 79 -4.054 -1.732 11.421 599 3HG2 THR 79 HG23 THR 79 -2.299 -1.578 11.482 600 H ASP 80 HN ASP 80 -4.317 -4.165 6.793 601 HA ASP 80 HA ASP 80 -3.059 -6.455 8.153 602 1HB ASP 80 HB2 ASP 80 -5.070 -6.385 5.892 603 2HB ASP 80 HB1 ASP 80 -4.095 -7.809 6.238 604 H ASN 81 HN ASN 81 -1.626 -7.743 6.650 605 HA ASN 81 HA ASN 81 -0.031 -5.859 5.119 606 1HB ASN 81 HB2 ASN 81 0.400 -8.695 5.995 607 2HB ASN 81 HB1 ASN 81 1.416 -7.981 4.747 608 1HD2 ASN 81 HD21 ASN 81 2.850 -6.323 5.296 609 2HD2 ASN 81 HD22 ASN 81 3.263 -5.990 6.945 610 H GLY 82 HN GLY 82 -2.588 -7.902 4.467 611 1HA GLY 82 HA2 GLY 82 -1.752 -8.278 1.685 612 2HA GLY 82 HA1 GLY 82 -3.112 -9.079 2.460 613 H VAL 83 HN VAL 83 -4.152 -6.699 3.676 614 HA VAL 83 HA VAL 83 -4.931 -5.072 1.381 615 HB VAL 83 HB VAL 83 -7.323 -5.213 2.027 616 1HG1 VAL 83 HG11 VAL 83 -6.089 -7.881 1.357 617 2HG1 VAL 83 HG12 VAL 83 -6.504 -6.609 0.207 618 3HG1 VAL 83 HG13 VAL 83 -7.776 -7.434 1.108 619 1HG2 VAL 83 HG21 VAL 83 -8.085 -6.995 3.520 620 2HG2 VAL 83 HG22 VAL 83 -7.028 -5.860 4.361 621 3HG2 VAL 83 HG23 VAL 83 -6.410 -7.433 3.855 622 H PHE 84 HN PHE 84 -5.908 -3.040 2.027 623 HA PHE 84 HA PHE 84 -5.584 -2.409 4.877 624 1HB PHE 84 HB2 PHE 84 -3.708 -1.617 3.083 625 2HB PHE 84 HB1 PHE 84 -4.845 -0.280 2.950 626 HD1 PHE 84 HD1 PHE 84 -5.602 0.775 5.221 627 HD2 PHE 84 HD2 PHE 84 -2.091 -1.564 4.692 628 HE1 PHE 84 HE1 PHE 84 -4.622 1.787 7.240 629 HE2 PHE 84 HE2 PHE 84 -1.107 -0.557 6.701 630 HZ PHE 84 HZ PHE 84 -2.373 1.120 7.984 631 H TYR 85 HN TYR 85 -7.720 -2.182 5.337 632 HA TYR 85 HA TYR 85 -9.226 -0.344 3.622 633 1HB TYR 85 HB2 TYR 85 -11.154 -1.789 3.558 634 2HB TYR 85 HB1 TYR 85 -9.761 -2.658 2.940 635 HD1 TYR 85 HD1 TYR 85 -12.595 -3.000 4.877 636 HD2 TYR 85 HD2 TYR 85 -8.454 -3.988 4.916 637 HE1 TYR 85 HE1 TYR 85 -13.045 -4.814 6.480 638 HE2 TYR 85 HE2 TYR 85 -8.897 -5.809 6.513 639 HH TYR 85 HH TYR 85 -10.451 -6.633 7.977 640 H LYS 86 HN LYS 86 -10.800 0.844 4.585 641 HA LYS 86 HA LYS 86 -10.502 1.194 7.416 642 1HB LYS 86 HB2 LYS 86 -12.141 3.027 7.129 643 2HB LYS 86 HB1 LYS 86 -10.773 3.156 6.041 644 1HG LYS 86 HG2 LYS 86 -12.047 2.537 4.174 645 2HG LYS 86 HG1 LYS 86 -13.363 1.920 5.175 646 1HD LYS 86 HD2 LYS 86 -13.904 4.155 5.912 647 2HD LYS 86 HD1 LYS 86 -12.515 4.810 5.047 648 1HE LYS 86 HE2 LYS 86 -13.491 4.420 2.958 649 2HE LYS 86 HE1 LYS 86 -14.698 3.311 3.616 650 1HZ LYS 86 HZ1 LYS 86 -15.804 5.130 4.669 651 2HZ LYS 86 HZ2 LYS 86 -15.559 5.550 3.048 652 3HZ LYS 86 HZ3 LYS 86 -14.575 6.216 4.253 653 H ASN 87 HN ASN 87 -12.063 0.918 8.987 654 HA ASN 87 HA ASN 87 -13.937 -1.197 8.593 655 1HB ASN 87 HB2 ASN 87 -12.816 -0.823 10.753 656 2HB ASN 87 HB1 ASN 87 -13.609 0.739 10.904 657 1HD2 ASN 87 HD21 ASN 87 -14.049 -2.719 10.979 658 2HD2 ASN 87 HD22 ASN 87 -15.574 -2.703 11.796 659 H ASP 88 HN ASP 88 -13.991 2.225 8.344 660 HA ASP 88 HA ASP 88 -16.810 2.634 8.473 661 1HB ASP 88 HB2 ASP 88 -14.743 4.321 7.043 662 2HB ASP 88 HB1 ASP 88 -16.350 4.831 7.540 663 H VAL 89 HN VAL 89 -18.127 3.313 6.608 664 HA VAL 89 HA VAL 89 -17.220 2.077 4.092 665 HB VAL 89 HB VAL 89 -19.599 1.634 3.539 666 1HG1 VAL 89 HG11 VAL 89 -18.569 0.304 6.041 667 2HG1 VAL 89 HG12 VAL 89 -18.188 -0.148 4.380 668 3HG1 VAL 89 HG13 VAL 89 -19.832 -0.336 4.988 669 1HG2 VAL 89 HG21 VAL 89 -20.099 2.333 6.433 670 2HG2 VAL 89 HG22 VAL 89 -21.276 1.629 5.326 671 3HG2 VAL 89 HG23 VAL 89 -20.653 3.253 5.036 672 H GLY 90 HN GLY 90 -17.418 3.252 2.253 673 1HA GLY 90 HA2 GLY 90 -18.871 4.921 1.075 674 2HA GLY 90 HA1 GLY 90 -18.703 5.906 2.521 675 H SER 91 HN SER 91 -17.863 7.564 1.114 676 HA SER 91 HA SER 91 -15.513 7.187 -0.408 677 1HB SER 91 HB2 SER 91 -16.723 9.749 0.667 678 2HB SER 91 HB1 SER 91 -15.522 9.629 -0.618 679 HG SER 91 HG SER 91 -17.592 8.035 -1.210 680 H TRP 92 HN TRP 92 -13.533 8.499 0.023 681 HA TRP 92 HA TRP 92 -12.856 8.979 2.800 682 1HB TRP 92 HB2 TRP 92 -12.475 6.528 2.473 683 2HB TRP 92 HB1 TRP 92 -11.272 6.944 1.247 684 HD1 TRP 92 HD1 TRP 92 -11.910 7.360 5.033 685 HE1 TRP 92 HE1 TRP 92 -9.640 7.787 6.169 686 HE3 TRP 92 HE3 TRP 92 -9.000 7.627 0.870 687 HZ2 TRP 92 HZ2 TRP 92 -6.956 8.199 5.365 688 HZ3 TRP 92 HZ3 TRP 92 -6.619 8.046 1.119 689 HH2 TRP 92 HH2 TRP 92 -5.593 8.318 3.323 690 H GLY 93 HN GLY 93 -11.591 8.500 -0.421 691 1HA GLY 93 HA2 GLY 93 -9.790 9.546 -1.497 692 2HA GLY 93 HA1 GLY 93 -10.986 10.812 -1.444 693 H GLY 94 HN GLY 94 -7.982 9.629 -0.156 694 1HA GLY 94 HA2 GLY 94 -7.239 12.294 0.645 695 2HA GLY 94 HA1 GLY 94 -7.424 11.186 1.997 696 H THR 95 HN THR 95 -5.232 11.234 2.556 697 HA THR 95 HA THR 95 -3.376 10.234 0.510 698 HB THR 95 HB THR 95 -1.605 11.274 2.044 699 HG1 THR 95 HG1 THR 95 -2.503 13.063 3.295 700 1HG2 THR 95 HG21 THR 95 -2.225 12.224 -0.127 701 2HG2 THR 95 HG22 THR 95 -1.922 13.500 1.054 702 3HG2 THR 95 HG23 THR 95 -3.578 13.071 0.623 703 H ILE 96 HN ILE 96 -2.584 8.278 0.773 704 HA ILE 96 HA ILE 96 -2.236 7.220 3.508 705 HB ILE 96 HB ILE 96 -2.053 4.958 2.259 706 1HG1 ILE 96 HG12 ILE 96 -3.951 6.076 0.286 707 2HG1 ILE 96 HG11 ILE 96 -2.254 6.472 0.031 708 1HG2 ILE 96 HG21 ILE 96 -4.469 4.613 2.425 709 2HG2 ILE 96 HG22 ILE 96 -4.712 6.358 2.511 710 3HG2 ILE 96 HG23 ILE 96 -3.845 5.523 3.802 711 1HD1 ILE 96 HD11 ILE 96 -1.743 4.062 0.051 712 2HD1 ILE 96 HD12 ILE 96 -2.856 4.522 -1.237 713 3HD1 ILE 96 HD13 ILE 96 -3.466 3.725 0.213 714 H GLY 97 HN GLY 97 -0.170 6.700 4.132 715 1HA GLY 97 HA2 GLY 97 1.893 7.326 2.118 716 2HA GLY 97 HA1 GLY 97 2.057 7.636 3.840 717 H ILE 98 HN ILE 98 3.937 6.234 2.282 718 HA ILE 98 HA ILE 98 3.621 3.452 3.055 719 HB ILE 98 HB ILE 98 5.717 4.891 1.436 720 1HG1 ILE 98 HG12 ILE 98 5.052 3.085 -0.223 721 2HG1 ILE 98 HG11 ILE 98 3.742 2.684 0.880 722 1HG2 ILE 98 HG21 ILE 98 6.923 3.338 2.851 723 2HG2 ILE 98 HG22 ILE 98 6.898 2.747 1.189 724 3HG2 ILE 98 HG23 ILE 98 5.826 2.034 2.395 725 1HD1 ILE 98 HD11 ILE 98 2.800 4.895 0.603 726 2HD1 ILE 98 HD12 ILE 98 3.001 4.101 -0.958 727 3HD1 ILE 98 HD13 ILE 98 4.139 5.349 -0.452 728 H TYR 99 HN TYR 99 4.053 2.952 5.060 729 HA TYR 99 HA TYR 99 6.445 4.103 6.355 730 1HB TYR 99 HB2 TYR 99 4.179 2.735 7.822 731 2HB TYR 99 HB1 TYR 99 5.439 3.760 8.488 732 HD1 TYR 99 HD1 TYR 99 4.806 5.867 9.176 733 HD2 TYR 99 HD2 TYR 99 2.630 4.024 6.029 734 HE1 TYR 99 HE1 TYR 99 3.309 7.809 9.078 735 HE2 TYR 99 HE2 TYR 99 1.122 5.958 5.930 736 HH TYR 99 HH TYR 99 1.812 8.901 7.499 737 H VAL 100 HN VAL 100 8.083 2.625 6.596 738 HA VAL 100 HA VAL 100 7.794 -0.124 5.970 739 HB VAL 100 HB VAL 100 9.989 1.050 5.944 740 1HG1 VAL 100 HG11 VAL 100 11.245 1.343 8.024 741 2HG1 VAL 100 HG12 VAL 100 9.819 0.874 8.949 742 3HG1 VAL 100 HG13 VAL 100 9.799 2.352 7.988 743 1HG2 VAL 100 HG21 VAL 100 9.841 -1.404 7.687 744 2HG2 VAL 100 HG22 VAL 100 11.288 -0.817 6.869 745 3HG2 VAL 100 HG23 VAL 100 9.904 -1.365 5.924 746 H ASP 101 HN ASP 101 6.941 -1.741 7.181 747 HA ASP 101 HA ASP 101 5.828 -1.072 9.745 748 1HB ASP 101 HB2 ASP 101 4.672 -2.600 8.137 749 2HB ASP 101 HB1 ASP 101 5.940 -3.792 8.421 750 H GLY 102 HN GLY 102 7.510 -0.622 11.060 751 1HA GLY 102 HA2 GLY 102 9.034 -1.281 12.709 752 2HA GLY 102 HA1 GLY 102 9.158 -2.861 11.936 753 H GLN 103 HN GLN 103 10.689 0.055 12.434 754 HA GLN 103 HA GLN 103 11.960 0.659 10.055 755 1HB GLN 103 HB2 GLN 103 13.878 1.453 11.537 756 2HB GLN 103 HB1 GLN 103 12.294 2.156 11.830 757 1HG GLN 103 HG2 GLN 103 11.973 0.800 13.765 758 2HG GLN 103 HG1 GLN 103 13.426 -0.135 13.416 759 1HE2 GLN 103 HE21 GLN 103 15.415 0.720 13.847 760 2HE2 GLN 103 HE22 GLN 103 15.639 2.146 14.808 761 H GLN 104 HN GLN 104 13.096 -0.527 8.741 762 HA GLN 104 HA GLN 104 14.253 -3.016 9.687 763 1HB GLN 104 HB2 GLN 104 13.611 -1.939 6.946 764 2HB GLN 104 HB1 GLN 104 14.486 -3.443 7.177 765 1HG GLN 104 HG2 GLN 104 11.724 -2.850 8.217 766 2HG GLN 104 HG1 GLN 104 12.101 -3.801 6.783 767 1HE2 GLN 104 HE21 GLN 104 11.100 -5.628 7.594 768 2HE2 GLN 104 HE22 GLN 104 11.786 -6.578 8.861 769 H THR 105 HN THR 105 15.411 -0.200 9.949 770 HA THR 105 HA THR 105 17.521 0.486 10.430 771 HB THR 105 HB THR 105 18.527 -2.131 9.309 772 HG1 THR 105 HG1 THR 105 17.255 -1.489 11.736 773 1HG2 THR 105 HG21 THR 105 19.673 -0.214 11.341 774 2HG2 THR 105 HG22 THR 105 20.259 -0.459 9.696 775 3HG2 THR 105 HG23 THR 105 20.381 -1.761 10.880 776 H ASN 106 HN ASN 106 16.682 -0.576 7.285 777 HA ASN 106 HA ASN 106 17.210 0.119 5.207 778 1HB ASN 106 HB2 ASN 106 17.182 2.416 6.094 779 2HB ASN 106 HB1 ASN 106 18.867 2.255 6.566 780 1HD2 ASN 106 HD21 ASN 106 20.456 2.330 5.003 781 2HD2 ASN 106 HD22 ASN 106 20.150 2.881 3.388 782 H THR 107 HN THR 107 18.197 -1.827 4.901 783 HA THR 107 HA THR 107 21.128 -1.929 5.083 784 HB THR 107 HB THR 107 19.870 -3.770 6.194 785 HG1 THR 107 HG1 THR 107 20.983 -5.518 5.072 786 1HG2 THR 107 HG21 THR 107 17.915 -3.836 4.736 787 2HG2 THR 107 HG22 THR 107 18.673 -5.426 4.846 788 3HG2 THR 107 HG23 THR 107 18.913 -4.432 3.409 789 HA PRO 108 HA PRO 108 22.384 -1.246 0.956 790 1HB PRO 108 HB2 PRO 108 22.298 -4.212 0.572 791 2HB PRO 108 HB1 PRO 108 23.536 -3.051 0.078 792 1HG PRO 108 HG2 PRO 108 23.575 -4.576 2.426 793 2HG PRO 108 HG1 PRO 108 24.573 -3.153 2.096 794 1HD PRO 108 HD2 PRO 108 22.589 -3.372 4.086 795 2HD PRO 108 HD1 PRO 108 23.355 -1.869 3.529 796 HA PRO 109 HA PRO 109 18.113 -1.751 -0.617 797 1HB PRO 109 HB2 PRO 109 18.251 1.066 -1.251 798 2HB PRO 109 HB1 PRO 109 17.217 0.244 -0.082 799 1HG PRO 109 HG2 PRO 109 19.207 1.940 0.647 800 2HG PRO 109 HG1 PRO 109 18.679 0.581 1.643 801 1HD PRO 109 HD2 PRO 109 21.040 0.765 -0.191 802 2HD PRO 109 HD1 PRO 109 20.915 0.092 1.450 803 H GLY 110 HN GLY 110 17.500 0.273 -2.544 804 1HA GLY 110 HA2 GLY 110 19.004 0.343 -4.825 805 2HA GLY 110 HA1 GLY 110 18.192 -1.227 -4.857 806 H ASN 111 HN ASN 111 17.108 -0.251 -6.783 807 HA ASN 111 HA ASN 111 15.202 1.840 -6.233 808 1HB ASN 111 HB2 ASN 111 16.359 1.410 -8.474 809 2HB ASN 111 HB1 ASN 111 15.287 0.033 -8.665 810 1HD2 ASN 111 HD21 ASN 111 12.986 1.389 -7.456 811 2HD2 ASN 111 HD22 ASN 111 12.449 2.526 -8.636 812 H TYR 112 HN TYR 112 13.642 1.244 -4.812 813 HA TYR 112 HA TYR 112 12.443 -1.387 -4.969 814 1HB TYR 112 HB2 TYR 112 12.153 0.924 -3.061 815 2HB TYR 112 HB1 TYR 112 10.983 -0.392 -3.064 816 HD1 TYR 112 HD1 TYR 112 11.789 -2.729 -2.565 817 HD2 TYR 112 HD2 TYR 112 14.261 0.691 -2.098 818 HE1 TYR 112 HE1 TYR 112 13.279 -4.011 -1.110 819 HE2 TYR 112 HE2 TYR 112 15.771 -0.595 -0.649 820 HH TYR 112 HH TYR 112 15.528 -2.612 0.867 821 H THR 113 HN THR 113 10.626 -1.865 -5.972 822 HA THR 113 HA THR 113 8.949 0.342 -6.951 823 HB THR 113 HB THR 113 9.708 -2.067 -8.608 824 HG1 THR 113 HG1 THR 113 11.561 -1.004 -8.747 825 1HG2 THR 113 HG21 THR 113 8.802 -0.755 -10.463 826 2HG2 THR 113 HG22 THR 113 8.418 0.560 -9.354 827 3HG2 THR 113 HG23 THR 113 7.586 -0.987 -9.207 828 H LEU 114 HN LEU 114 7.257 -0.034 -5.625 829 HA LEU 114 HA LEU 114 6.242 -2.777 -5.419 830 1HB LEU 114 HB2 LEU 114 4.828 -1.552 -3.532 831 2HB LEU 114 HB1 LEU 114 6.423 -2.217 -3.238 832 HG LEU 114 HG LEU 114 6.190 0.646 -4.057 833 1HD1 LEU 114 HD11 LEU 114 5.766 -0.370 -1.249 834 2HD1 LEU 114 HD12 LEU 114 4.524 0.354 -2.272 835 3HD1 LEU 114 HD13 LEU 114 5.903 1.319 -1.739 836 1HD2 LEU 114 HD21 LEU 114 8.040 -0.839 -2.199 837 2HD2 LEU 114 HD22 LEU 114 8.169 0.861 -2.647 838 3HD2 LEU 114 HD23 LEU 114 8.393 -0.394 -3.868 839 H THR 115 HN THR 115 4.838 -3.158 -6.924 840 HA THR 115 HA THR 115 3.133 -1.137 -8.055 841 HB THR 115 HB THR 115 2.746 -4.077 -8.502 842 HG1 THR 115 HG1 THR 115 5.014 -3.767 -8.587 843 1HG2 THR 115 HG21 THR 115 2.322 -3.337 -10.801 844 2HG2 THR 115 HG22 THR 115 2.696 -1.676 -10.338 845 3HG2 THR 115 HG23 THR 115 1.284 -2.485 -9.657 846 H LEU 116 HN LEU 116 1.219 -0.521 -7.220 847 HA LEU 116 HA LEU 116 -0.152 -2.354 -5.367 848 1HB LEU 116 HB2 LEU 116 -0.369 0.640 -5.675 849 2HB LEU 116 HB1 LEU 116 -1.332 -0.318 -4.569 850 HG LEU 116 HG LEU 116 1.674 -0.075 -4.455 851 1HD1 LEU 116 HD11 LEU 116 0.586 2.039 -3.924 852 2HD1 LEU 116 HD12 LEU 116 1.285 1.307 -2.480 853 3HD1 LEU 116 HD13 LEU 116 -0.454 1.220 -2.758 854 1HD2 LEU 116 HD21 LEU 116 0.815 -2.191 -3.567 855 2HD2 LEU 116 HD22 LEU 116 -0.288 -1.299 -2.517 856 3HD2 LEU 116 HD23 LEU 116 1.455 -1.158 -2.288 857 H THR 117 HN THR 117 -2.361 -2.747 -5.583 858 HA THR 117 HA THR 117 -3.496 -1.998 -8.200 859 HB THR 117 HB THR 117 -4.042 -4.567 -6.701 860 HG1 THR 117 HG1 THR 117 -1.854 -3.954 -7.968 861 1HG2 THR 117 HG21 THR 117 -5.842 -3.837 -8.208 862 2HG2 THR 117 HG22 THR 117 -5.049 -5.294 -8.806 863 3HG2 THR 117 HG23 THR 117 -4.683 -3.729 -9.533 864 H GLY 118 HN GLY 118 -5.032 -0.525 -7.851 865 1HA GLY 118 HA2 GLY 118 -6.324 -0.193 -5.337 866 2HA GLY 118 HA1 GLY 118 -6.697 0.670 -6.820 867 H GLY 119 HN GLY 119 -8.646 -0.149 -5.001 868 1HA GLY 119 HA2 GLY 119 -10.707 -0.990 -6.445 869 2HA GLY 119 HA1 GLY 119 -9.900 -2.521 -6.128 870 H TYR 120 HN TYR 120 -12.456 -2.156 -5.232 871 HA TYR 120 HA TYR 120 -12.288 -1.286 -2.471 872 1HB TYR 120 HB2 TYR 120 -14.704 -1.586 -2.393 873 2HB TYR 120 HB1 TYR 120 -14.246 -0.628 -3.791 874 HD1 TYR 120 HD1 TYR 120 -15.811 -3.698 -2.643 875 HD2 TYR 120 HD2 TYR 120 -14.381 -1.608 -6.063 876 HE1 TYR 120 HE1 TYR 120 -17.069 -5.229 -4.100 877 HE2 TYR 120 HE2 TYR 120 -15.642 -3.128 -7.526 878 HH TYR 120 HH TYR 120 -16.576 -5.368 -7.475 879 H TRP 121 HN TRP 121 -13.981 -2.869 -1.143 880 HA TRP 121 HA TRP 121 -12.853 -5.564 -1.280 881 1HB TRP 121 HB2 TRP 121 -11.384 -4.602 0.270 882 2HB TRP 121 HB1 TRP 121 -12.627 -3.560 0.948 883 HD1 TRP 121 HD1 TRP 121 -14.545 -4.936 2.418 884 HE1 TRP 121 HE1 TRP 121 -14.216 -6.846 4.088 885 HE3 TRP 121 HE3 TRP 121 -9.936 -6.519 0.908 886 HZ2 TRP 121 HZ2 TRP 121 -12.274 -8.745 4.689 887 HZ3 TRP 121 HZ3 TRP 121 -8.924 -8.410 2.132 888 HH2 TRP 121 HH2 TRP 121 -10.069 -9.493 3.953 889 H ALA 122 HN ALA 122 -14.165 -7.170 -0.356 890 HA ALA 122 HA ALA 122 -16.804 -6.322 0.641 891 1HB ALA 122 HB1 ALA 122 -17.824 -8.208 -0.505 892 2HB ALA 122 HB2 ALA 122 -16.252 -8.695 -1.139 893 3HB ALA 122 HB3 ALA 122 -16.978 -7.176 -1.661 894 H LYS 123 HN LYS 123 -17.695 -7.587 2.272 895 HA LYS 123 HA LYS 123 -17.821 -9.002 4.049 896 1HB LYS 123 HB2 LYS 123 -16.448 -10.497 2.090 897 2HB LYS 123 HB1 LYS 123 -15.573 -10.727 3.596 898 1HG LYS 123 HG2 LYS 123 -18.545 -11.085 3.411 899 2HG LYS 123 HG1 LYS 123 -17.414 -12.388 3.045 900 1HD LYS 123 HD2 LYS 123 -16.445 -12.148 5.298 901 2HD LYS 123 HD1 LYS 123 -17.631 -10.889 5.656 902 1HE LYS 123 HE2 LYS 123 -19.436 -12.438 5.459 903 2HE LYS 123 HE1 LYS 123 -18.368 -13.690 4.831 904 1HZ LYS 123 HZ1 LYS 123 -18.903 -14.052 7.159 905 2HZ LYS 123 HZ2 LYS 123 -18.250 -12.546 7.571 906 3HZ LYS 123 HZ3 LYS 123 -17.243 -13.765 6.962 907 H ASP 124 HN ASP 124 -15.288 -10.363 5.104 908 HA ASP 124 HA ASP 124 -13.492 -8.202 5.651 909 1HB ASP 124 HB2 ASP 124 -13.777 -8.124 8.066 910 2HB ASP 124 HB1 ASP 124 -15.296 -7.721 7.273 911 H ASN 125 HN ASN 125 -11.518 -8.921 5.974 912 HA ASN 125 HA ASN 125 -9.721 -10.170 6.484 913 1HB ASN 125 HB2 ASN 125 -10.581 -10.359 8.655 914 2HB ASN 125 HB1 ASN 125 -11.738 -11.593 8.180 915 1HD2 ASN 125 HD21 ASN 125 -11.106 -13.705 8.116 916 2HD2 ASN 125 HD22 ASN 125 -9.545 -14.256 8.630 917 H LYS 126 HN LYS 126 -12.491 -11.966 5.335 918 HA LYS 126 HA LYS 126 -11.102 -14.298 4.542 919 1HB LYS 126 HB2 LYS 126 -13.092 -14.854 3.312 920 2HB LYS 126 HB1 LYS 126 -13.560 -14.140 4.848 921 1HG LYS 126 HG2 LYS 126 -14.940 -12.891 3.624 922 2HG LYS 126 HG1 LYS 126 -13.498 -11.960 3.204 923 1HD LYS 126 HD2 LYS 126 -13.169 -13.413 1.241 924 2HD LYS 126 HD1 LYS 126 -14.653 -14.275 1.650 925 1HE LYS 126 HE2 LYS 126 -15.826 -12.045 1.504 926 2HE LYS 126 HE1 LYS 126 -14.341 -11.404 0.806 927 1HZ LYS 126 HZ1 LYS 126 -15.853 -12.057 -0.942 928 2HZ LYS 126 HZ2 LYS 126 -15.969 -13.625 -0.314 929 3HZ LYS 126 HZ3 LYS 126 -14.500 -13.076 -0.954 930 H GLN 127 HN GLN 127 -10.777 -11.232 3.490 931 HA GLN 127 HA GLN 127 -9.642 -10.239 1.826 932 1HB GLN 127 HB2 GLN 127 -8.132 -12.258 2.117 933 2HB GLN 127 HB1 GLN 127 -8.970 -12.972 0.745 934 1HG GLN 127 HG2 GLN 127 -8.284 -11.082 -0.653 935 2HG GLN 127 HG1 GLN 127 -7.427 -10.384 0.720 936 1HE2 GLN 127 HE21 GLN 127 -7.448 -12.899 -1.670 937 2HE2 GLN 127 HE22 GLN 127 -5.806 -13.399 -1.449 938 H GLY 128 HN GLY 128 -12.165 -10.040 1.419 939 1HA GLY 128 HA2 GLY 128 -12.871 -11.064 -1.206 940 2HA GLY 128 HA1 GLY 128 -13.884 -10.076 -0.162 941 H PHE 129 HN PHE 129 -10.647 -9.651 -1.520 942 HA PHE 129 HA PHE 129 -11.164 -6.843 -1.872 943 1HB PHE 129 HB2 PHE 129 -8.841 -6.667 -2.410 944 2HB PHE 129 HB1 PHE 129 -8.947 -7.888 -1.151 945 HD1 PHE 129 HD1 PHE 129 -8.941 -10.343 -1.885 946 HD2 PHE 129 HD2 PHE 129 -7.760 -7.139 -4.427 947 HE1 PHE 129 HE1 PHE 129 -7.708 -11.928 -3.305 948 HE2 PHE 129 HE2 PHE 129 -6.526 -8.721 -5.851 949 HZ PHE 129 HZ PHE 129 -6.515 -11.101 -5.322 950 H THR 130 HN THR 130 -11.519 -5.781 -3.795 951 HA THR 130 HA THR 130 -11.607 -7.438 -6.237 952 HB THR 130 HB THR 130 -13.253 -4.971 -5.618 953 HG1 THR 130 HG1 THR 130 -13.570 -7.430 -4.736 954 1HG2 THR 130 HG21 THR 130 -12.848 -5.301 -8.012 955 2HG2 THR 130 HG22 THR 130 -14.538 -5.607 -7.603 956 3HG2 THR 130 HG23 THR 130 -13.440 -6.958 -7.886 957 HA PRO 131 HA PRO 131 -8.717 -4.358 -7.841 958 1HB PRO 131 HB2 PRO 131 -8.927 -5.602 -10.429 959 2HB PRO 131 HB1 PRO 131 -7.594 -5.700 -9.280 960 1HG PRO 131 HG2 PRO 131 -9.212 -7.817 -9.957 961 2HG PRO 131 HG1 PRO 131 -8.306 -7.695 -8.437 962 1HD PRO 131 HD2 PRO 131 -11.199 -7.139 -8.977 963 2HD PRO 131 HD1 PRO 131 -10.442 -7.920 -7.572 964 H SER 132 HN SER 132 -9.632 -2.403 -8.145 965 HA SER 132 HA SER 132 -11.187 -1.917 -10.536 966 1HB SER 132 HB2 SER 132 -12.366 -1.346 -7.802 967 2HB SER 132 HB1 SER 132 -13.071 -0.867 -9.345 968 HG SER 132 HG SER 132 -12.581 -3.472 -9.456 969 H GLY 133 HN GLY 133 -9.993 -0.305 -11.347 970 1HA GLY 133 HA2 GLY 133 -9.977 2.241 -10.916 971 2HA GLY 133 HA1 GLY 133 -9.035 1.782 -9.504 972 H THR 134 HN THR 134 -6.973 2.237 -9.825 973 HA THR 134 HA THR 134 -5.815 1.624 -12.463 974 HB THR 134 HB THR 134 -4.931 3.907 -10.694 975 HG1 THR 134 HG1 THR 134 -6.114 4.834 -12.862 976 1HG2 THR 134 HG21 THR 134 -3.272 3.087 -12.312 977 2HG2 THR 134 HG22 THR 134 -3.832 4.706 -12.728 978 3HG2 THR 134 HG23 THR 134 -4.439 3.309 -13.616 979 H THR 135 HN THR 135 -3.758 0.719 -12.458 980 HA THR 135 HA THR 135 -2.840 -0.323 -9.895 981 HB THR 135 HB THR 135 -1.646 -0.866 -12.621 982 HG1 THR 135 HG1 THR 135 -3.043 -2.887 -12.269 983 1HG2 THR 135 HG21 THR 135 -0.894 -2.952 -11.567 984 2HG2 THR 135 HG22 THR 135 -1.638 -2.452 -10.049 985 3HG2 THR 135 HG23 THR 135 -0.279 -1.540 -10.707 986 H GLY 136 HN GLY 136 -1.847 1.343 -8.862 987 1HA GLY 136 HA2 GLY 136 0.009 3.054 -10.326 988 2HA GLY 136 HA1 GLY 136 -0.572 3.311 -8.685 989 H THR 137 HN THR 137 2.138 2.829 -10.262 990 HA THR 137 HA THR 137 3.248 0.794 -8.491 991 HB THR 137 HB THR 137 4.949 2.248 -10.452 992 HG1 THR 137 HG1 THR 137 3.233 1.934 -11.788 993 1HG2 THR 137 HG21 THR 137 5.862 0.431 -9.103 994 2HG2 THR 137 HG22 THR 137 5.835 -0.015 -10.810 995 3HG2 THR 137 HG23 THR 137 4.616 -0.659 -9.709 996 H THR 138 HN THR 138 3.698 1.602 -6.513 997 HA THR 138 HA THR 138 4.653 4.297 -6.156 998 HB THR 138 HB THR 138 4.628 2.062 -4.116 999 HG1 THR 138 HG1 THR 138 2.572 3.409 -5.299 1000 1HG2 THR 138 HG21 THR 138 4.560 5.068 -3.814 1001 2HG2 THR 138 HG22 THR 138 5.956 4.035 -3.508 1002 3HG2 THR 138 HG23 THR 138 4.515 3.895 -2.499 1003 H LYS 139 HN LYS 139 6.682 4.768 -6.742 1004 HA LYS 139 HA LYS 139 8.683 2.620 -6.590 1005 1HB LYS 139 HB2 LYS 139 8.193 3.680 -8.815 1006 2HB LYS 139 HB1 LYS 139 8.824 5.190 -8.175 1007 1HG LYS 139 HG2 LYS 139 11.000 4.231 -7.897 1008 2HG LYS 139 HG1 LYS 139 10.404 2.633 -8.349 1009 1HD LYS 139 HD2 LYS 139 10.475 5.068 -10.136 1010 2HD LYS 139 HD1 LYS 139 11.606 3.718 -10.195 1011 1HE LYS 139 HE2 LYS 139 10.187 3.063 -11.847 1012 2HE LYS 139 HE1 LYS 139 9.354 2.337 -10.474 1013 1HZ LYS 139 HZ1 LYS 139 7.982 4.417 -10.390 1014 2HZ LYS 139 HZ2 LYS 139 7.739 3.469 -11.767 1015 3HZ LYS 139 HZ3 LYS 139 8.678 4.876 -11.865 1016 H LEU 140 HN LEU 140 9.764 2.654 -4.844 1017 HA LEU 140 HA LEU 140 10.536 5.195 -3.616 1018 1HB LEU 140 HB2 LEU 140 9.489 3.873 -2.004 1019 2HB LEU 140 HB1 LEU 140 10.201 2.390 -2.606 1020 HG LEU 140 HG LEU 140 12.359 3.031 -1.675 1021 1HD1 LEU 140 HD11 LEU 140 10.914 5.456 -0.602 1022 2HD1 LEU 140 HD12 LEU 140 12.151 5.464 -1.859 1023 3HD1 LEU 140 HD13 LEU 140 12.570 4.984 -0.214 1024 1HD2 LEU 140 HD21 LEU 140 10.103 3.216 0.312 1025 2HD2 LEU 140 HD22 LEU 140 11.784 2.840 0.693 1026 3HD2 LEU 140 HD23 LEU 140 10.837 1.734 -0.302 1027 H THR 141 HN THR 141 12.293 5.837 -4.695 1028 HA THR 141 HA THR 141 14.396 3.890 -5.293 1029 HB THR 141 HB THR 141 14.184 6.764 -6.210 1030 HG1 THR 141 HG1 THR 141 12.508 5.078 -6.881 1031 1HG2 THR 141 HG21 THR 141 15.839 4.445 -7.215 1032 2HG2 THR 141 HG22 THR 141 16.444 5.836 -6.314 1033 3HG2 THR 141 HG23 THR 141 15.782 6.055 -7.934 1034 H VAL 142 HN VAL 142 16.106 3.769 -3.993 1035 HA VAL 142 HA VAL 142 16.368 5.584 -1.835 1036 HB VAL 142 HB VAL 142 18.269 4.176 -1.221 1037 1HG1 VAL 142 HG11 VAL 142 15.791 2.698 -2.034 1038 2HG1 VAL 142 HG12 VAL 142 16.045 3.571 -0.522 1039 3HG1 VAL 142 HG13 VAL 142 16.984 2.119 -0.872 1040 1HG2 VAL 142 HG21 VAL 142 19.164 3.635 -3.408 1041 2HG2 VAL 142 HG22 VAL 142 17.702 2.722 -3.787 1042 3HG2 VAL 142 HG23 VAL 142 18.788 2.159 -2.518 1043 H THR 143 HN THR 143 17.264 7.498 -1.976 1044 HA THR 143 HA THR 143 19.788 7.855 -3.350 1045 HB THR 143 HB THR 143 17.406 9.590 -4.053 1046 HG1 THR 143 HG1 THR 143 18.203 7.227 -5.049 1047 1HG2 THR 143 HG21 THR 143 20.237 9.557 -5.111 1048 2HG2 THR 143 HG22 THR 143 19.528 10.802 -4.082 1049 3HG2 THR 143 HG23 THR 143 18.925 10.565 -5.722 Start of MODEL 11 1 H GLU 1 H GLU 1 -20.650 0.805 -13.565 2 HA GLU 1 HA GLU 1 -19.738 3.101 -11.943 3 1HB GLU 1 HB2 GLU 1 -22.017 1.176 -11.450 4 2HB GLU 1 HB1 GLU 1 -21.553 2.537 -10.436 5 1HG GLU 1 HG2 GLU 1 -22.848 2.562 -13.132 6 2HG GLU 1 HG1 GLU 1 -23.396 3.306 -11.628 7 H GLU 2 HN GLU 2 -18.378 2.644 -10.351 8 HA GLU 2 HA GLU 2 -17.988 0.089 -9.198 9 1HB GLU 2 HB2 GLU 2 -15.866 -0.511 -10.191 10 2HB GLU 2 HB1 GLU 2 -17.073 -0.357 -11.464 11 1HG GLU 2 HG2 GLU 2 -16.243 1.974 -11.835 12 2HG GLU 2 HG1 GLU 2 -14.942 1.597 -10.714 13 H CYS 3 HN CYS 3 -16.156 0.089 -7.701 14 HA CYS 3 HA CYS 3 -15.681 2.689 -6.576 15 1HB CYS 3 HB2 CYS 3 -14.803 -0.092 -5.831 16 2HB CYS 3 HB1 CYS 3 -14.162 1.324 -5.009 17 H GLN 4 HN GLN 4 -14.497 3.790 -8.183 18 HA GLN 4 HA GLN 4 -11.940 2.671 -8.989 19 1HB GLN 4 HB2 GLN 4 -13.253 5.318 -9.634 20 2HB GLN 4 HB1 GLN 4 -11.691 4.809 -10.264 21 1HG GLN 4 HG2 GLN 4 -12.786 2.871 -11.323 22 2HG GLN 4 HG1 GLN 4 -14.342 3.473 -10.751 23 1HE2 GLN 4 HE21 GLN 4 -13.351 3.012 -13.472 24 2HE2 GLN 4 HE22 GLN 4 -13.514 4.528 -14.292 25 H VAL 5 HN VAL 5 -10.375 2.720 -7.539 26 HA VAL 5 HA VAL 5 -10.062 5.103 -5.852 27 HB VAL 5 HB VAL 5 -8.734 2.396 -5.595 28 1HG1 VAL 5 HG11 VAL 5 -8.716 4.760 -3.717 29 2HG1 VAL 5 HG12 VAL 5 -7.360 4.209 -4.698 30 3HG1 VAL 5 HG13 VAL 5 -7.987 3.185 -3.407 31 1HG2 VAL 5 HG21 VAL 5 -11.001 3.619 -4.026 32 2HG2 VAL 5 HG22 VAL 5 -10.196 2.097 -3.644 33 3HG2 VAL 5 HG23 VAL 5 -11.113 2.257 -5.142 34 H ARG 6 HN ARG 6 -8.666 6.560 -6.495 35 HA ARG 6 HA ARG 6 -6.819 5.970 -8.628 36 1HB ARG 6 HB2 ARG 6 -8.054 8.062 -8.670 37 2HB ARG 6 HB1 ARG 6 -7.370 8.528 -7.119 38 1HG ARG 6 HG2 ARG 6 -5.152 8.646 -8.106 39 2HG ARG 6 HG1 ARG 6 -5.802 8.119 -9.660 40 1HD ARG 6 HD2 ARG 6 -6.569 10.638 -8.195 41 2HD ARG 6 HD1 ARG 6 -5.477 10.549 -9.575 42 HE ARG 6 HE ARG 6 -7.657 9.420 -10.598 43 1HH1 ARG 6 HH11 ARG 6 -7.275 12.345 -8.694 44 2HH1 ARG 6 HH12 ARG 6 -8.674 13.127 -9.372 45 1HH2 ARG 6 HH21 ARG 6 -9.484 10.444 -11.514 46 2HH2 ARG 6 HH22 ARG 6 -9.929 12.047 -11.003 47 H VAL 7 HN VAL 7 -5.036 4.910 -8.092 48 HA VAL 7 HA VAL 7 -3.292 6.170 -6.077 49 HB VAL 7 HB VAL 7 -3.200 3.290 -7.021 50 1HG1 VAL 7 HG11 VAL 7 -1.538 2.991 -5.241 51 2HG1 VAL 7 HG12 VAL 7 -1.606 4.718 -4.892 52 3HG1 VAL 7 HG13 VAL 7 -1.000 4.156 -6.451 53 1HG2 VAL 7 HG21 VAL 7 -4.124 4.431 -4.384 54 2HG2 VAL 7 HG22 VAL 7 -3.923 2.716 -4.743 55 3HG2 VAL 7 HG23 VAL 7 -5.138 3.661 -5.603 56 H GLY 8 HN GLY 8 -1.678 7.269 -7.021 57 1HA GLY 8 HA2 GLY 8 -1.152 6.731 -9.854 58 2HA GLY 8 HA1 GLY 8 -0.796 8.228 -9.009 59 H ASP 9 HN ASP 9 0.814 6.328 -10.688 60 HA ASP 9 HA ASP 9 2.845 5.142 -9.152 61 1HB ASP 9 HB2 ASP 9 3.089 6.415 -11.889 62 2HB ASP 9 HB1 ASP 9 4.231 5.287 -11.174 63 H LEU 10 HN LEU 10 4.887 5.907 -8.498 64 HA LEU 10 HA LEU 10 5.579 8.670 -8.928 65 1HB LEU 10 HB2 LEU 10 5.609 9.370 -6.624 66 2HB LEU 10 HB1 LEU 10 3.992 8.847 -7.046 67 HG LEU 10 HG LEU 10 5.890 6.997 -5.633 68 1HD1 LEU 10 HD11 LEU 10 4.916 7.725 -3.516 69 2HD1 LEU 10 HD12 LEU 10 4.013 8.984 -4.357 70 3HD1 LEU 10 HD13 LEU 10 5.776 9.045 -4.309 71 1HD2 LEU 10 HD21 LEU 10 2.882 7.182 -5.740 72 2HD2 LEU 10 HD22 LEU 10 3.808 5.986 -4.833 73 3HD2 LEU 10 HD23 LEU 10 3.881 6.010 -6.596 74 H THR 11 HN THR 11 7.701 8.781 -9.149 75 HA THR 11 HA THR 11 9.348 6.771 -7.775 76 HB THR 11 HB THR 11 10.130 8.474 -10.148 77 HG1 THR 11 HG1 THR 11 8.415 6.662 -10.314 78 1HG2 THR 11 HG21 THR 11 11.435 6.053 -8.894 79 2HG2 THR 11 HG22 THR 11 12.022 7.713 -8.796 80 3HG2 THR 11 HG23 THR 11 11.989 6.880 -10.350 81 H VAL 12 HN VAL 12 10.308 7.459 -6.024 82 HA VAL 12 HA VAL 12 11.383 10.171 -5.857 83 HB VAL 12 HB VAL 12 9.505 9.042 -3.760 84 1HG1 VAL 12 HG11 VAL 12 9.715 11.225 -2.676 85 2HG1 VAL 12 HG12 VAL 12 10.881 11.722 -3.902 86 3HG1 VAL 12 HG13 VAL 12 11.273 10.408 -2.792 87 1HG2 VAL 12 HG21 VAL 12 8.006 10.905 -4.356 88 2HG2 VAL 12 HG22 VAL 12 8.231 9.766 -5.683 89 3HG2 VAL 12 HG23 VAL 12 9.076 11.313 -5.698 90 H ALA 13 HN ALA 13 13.095 10.339 -4.335 91 HA ALA 13 HA ALA 13 14.308 7.745 -3.771 92 1HB ALA 13 HB1 ALA 13 15.501 10.506 -3.604 93 2HB ALA 13 HB2 ALA 13 15.591 9.432 -5.000 94 3HB ALA 13 HB3 ALA 13 16.372 8.976 -3.485 95 H LYS 14 HN LYS 14 14.302 6.855 -1.802 96 HA LYS 14 HA LYS 14 14.757 8.556 0.508 97 1HB LYS 14 HB2 LYS 14 12.718 6.424 0.950 98 2HB LYS 14 HB1 LYS 14 13.000 7.897 1.850 99 1HG LYS 14 HG2 LYS 14 10.991 8.349 0.882 100 2HG LYS 14 HG1 LYS 14 12.092 9.046 -0.309 101 1HD LYS 14 HD2 LYS 14 11.955 6.980 -1.624 102 2HD LYS 14 HD1 LYS 14 10.823 6.314 -0.443 103 1HE LYS 14 HE2 LYS 14 9.221 8.033 -0.941 104 2HE LYS 14 HE1 LYS 14 10.384 8.844 -1.994 105 1HZ LYS 14 HZ1 LYS 14 9.246 6.139 -2.455 106 2HZ LYS 14 HZ2 LYS 14 10.340 6.938 -3.469 107 3HZ LYS 14 HZ3 LYS 14 8.775 7.549 -3.263 108 H THR 15 HN THR 15 15.339 7.234 2.448 109 HA THR 15 HA THR 15 16.370 4.560 1.740 110 HB THR 15 HB THR 15 17.892 4.776 3.645 111 HG1 THR 15 HG1 THR 15 17.861 7.185 4.448 112 1HG2 THR 15 HG21 THR 15 17.983 7.234 1.887 113 2HG2 THR 15 HG22 THR 15 18.686 5.661 1.505 114 3HG2 THR 15 HG23 THR 15 19.323 6.610 2.850 115 H ARG 16 HN ARG 16 16.064 2.891 3.527 116 HA ARG 16 HA ARG 16 13.465 3.199 4.732 117 1HB ARG 16 HB2 ARG 16 15.468 1.007 5.311 118 2HB ARG 16 HB1 ARG 16 13.754 1.015 5.735 119 1HG ARG 16 HG2 ARG 16 13.582 -0.238 3.892 120 2HG ARG 16 HG1 ARG 16 13.548 1.334 3.090 121 1HD ARG 16 HD2 ARG 16 15.712 1.131 2.313 122 2HD ARG 16 HD1 ARG 16 16.171 -0.015 3.570 123 HE ARG 16 HE ARG 16 14.644 -0.609 1.143 124 1HH1 ARG 16 HH11 ARG 16 16.494 -1.730 3.909 125 2HH1 ARG 16 HH12 ARG 16 16.293 -3.408 3.522 126 1HH2 ARG 16 HH21 ARG 16 14.336 -2.854 0.708 127 2HH2 ARG 16 HH22 ARG 16 15.097 -4.043 1.727 128 H GLY 17 HN GLY 17 16.361 4.451 5.523 129 1HA GLY 17 HA2 GLY 17 15.999 4.372 8.415 130 2HA GLY 17 HA1 GLY 17 17.280 5.212 7.544 131 H GLN 18 HN GLN 18 15.442 6.420 5.664 132 HA GLN 18 HA GLN 18 14.530 8.743 6.957 133 1HB GLN 18 HB2 GLN 18 14.972 8.664 4.559 134 2HB GLN 18 HB1 GLN 18 13.722 7.454 4.336 135 1HG GLN 18 HG2 GLN 18 12.006 8.992 4.628 136 2HG GLN 18 HG1 GLN 18 13.066 10.163 5.415 137 1HE2 GLN 18 HE21 GLN 18 11.307 10.534 3.141 138 2HE2 GLN 18 HE22 GLN 18 12.308 11.063 1.836 139 H LEU 19 HN LEU 19 13.147 5.643 6.295 140 HA LEU 19 HA LEU 19 10.551 6.164 7.349 141 1HB LEU 19 HB2 LEU 19 12.142 3.662 6.821 142 2HB LEU 19 HB1 LEU 19 10.538 3.620 7.515 143 HG LEU 19 HG LEU 19 10.658 3.144 5.072 144 1HD1 LEU 19 HD11 LEU 19 8.698 4.506 4.509 145 2HD1 LEU 19 HD12 LEU 19 9.012 5.522 5.916 146 3HD1 LEU 19 HD13 LEU 19 8.580 3.825 6.133 147 1HD2 LEU 19 HD21 LEU 19 12.348 4.748 4.417 148 2HD2 LEU 19 HD22 LEU 19 11.272 6.076 4.854 149 3HD2 LEU 19 HD23 LEU 19 10.854 5.002 3.516 150 H THR 20 HN THR 20 9.937 6.154 9.436 151 HA THR 20 HA THR 20 11.838 5.204 11.459 152 HB THR 20 HB THR 20 11.935 7.693 11.233 153 HG1 THR 20 HG1 THR 20 12.493 7.385 13.230 154 1HG2 THR 20 HG21 THR 20 9.071 7.588 12.179 155 2HG2 THR 20 HG22 THR 20 9.634 8.158 10.609 156 3HG2 THR 20 HG23 THR 20 10.058 9.046 12.072 157 H ASP 21 HN ASP 21 9.921 3.696 10.444 158 HA ASP 21 HA ASP 21 8.182 2.333 10.895 159 1HB ASP 21 HB2 ASP 21 8.847 2.474 13.306 160 2HB ASP 21 HB1 ASP 21 7.733 3.830 13.478 161 H ALA 22 HN ALA 22 7.123 5.393 12.365 162 HA ALA 22 HA ALA 22 4.924 5.429 10.433 163 1HB ALA 22 HB1 ALA 22 3.906 7.132 11.870 164 2HB ALA 22 HB2 ALA 22 5.325 7.105 12.917 165 3HB ALA 22 HB3 ALA 22 4.296 5.678 12.791 166 H ALA 23 HN ALA 23 6.190 6.080 8.643 167 HA ALA 23 HA ALA 23 6.757 8.945 8.618 168 1HB ALA 23 HB1 ALA 23 8.738 6.878 7.667 169 2HB ALA 23 HB2 ALA 23 8.906 7.896 9.097 170 3HB ALA 23 HB3 ALA 23 8.901 8.627 7.492 171 HA PRO 24 HA PRO 24 4.384 7.891 4.865 172 1HB PRO 24 HB2 PRO 24 3.308 10.398 4.660 173 2HB PRO 24 HB1 PRO 24 2.592 9.096 5.617 174 1HG PRO 24 HG2 PRO 24 4.255 11.409 6.502 175 2HG PRO 24 HG1 PRO 24 2.860 10.658 7.298 176 1HD PRO 24 HD2 PRO 24 5.428 10.197 8.062 177 2HD PRO 24 HD1 PRO 24 4.140 8.997 8.241 178 H ILE 25 HN ILE 25 6.408 7.738 3.841 179 HA ILE 25 HA ILE 25 7.778 10.089 2.895 180 HB ILE 25 HB ILE 25 9.090 8.338 1.582 181 1HG1 ILE 25 HG12 ILE 25 7.570 6.475 3.409 182 2HG1 ILE 25 HG11 ILE 25 7.175 6.711 1.706 183 1HG2 ILE 25 HG21 ILE 25 10.319 7.605 3.566 184 2HG2 ILE 25 HG22 ILE 25 8.970 8.097 4.589 185 3HG2 ILE 25 HG23 ILE 25 9.881 9.310 3.688 186 1HD1 ILE 25 HD11 ILE 25 8.481 4.703 1.989 187 2HD1 ILE 25 HD12 ILE 25 9.758 5.616 2.795 188 3HD1 ILE 25 HD13 ILE 25 9.412 5.903 1.090 189 H GLY 26 HN GLY 26 5.197 8.134 1.812 190 1HA GLY 26 HA2 GLY 26 5.187 9.593 -0.726 191 2HA GLY 26 HA1 GLY 26 5.119 7.838 -0.783 192 HA PRO 27 HA PRO 27 0.884 9.242 1.059 193 1HB PRO 27 HB2 PRO 27 0.866 12.155 0.865 194 2HB PRO 27 HB1 PRO 27 0.511 11.129 2.255 195 1HG PRO 27 HG2 PRO 27 2.731 12.675 2.093 196 2HG PRO 27 HG1 PRO 27 2.680 11.146 2.988 197 1HD PRO 27 HD2 PRO 27 3.817 11.718 0.279 198 2HD PRO 27 HD1 PRO 27 4.446 10.676 1.569 199 H VAL 28 HN VAL 28 -0.111 8.519 -0.727 200 HA VAL 28 HA VAL 28 0.028 9.965 -3.235 201 HB VAL 28 HB VAL 28 -1.550 7.479 -2.540 202 1HG1 VAL 28 HG11 VAL 28 -2.376 8.627 -4.537 203 2HG1 VAL 28 HG12 VAL 28 -1.615 7.091 -4.952 204 3HG1 VAL 28 HG13 VAL 28 -0.753 8.606 -5.225 205 1HG2 VAL 28 HG21 VAL 28 1.178 7.728 -3.806 206 2HG2 VAL 28 HG22 VAL 28 0.274 6.229 -3.590 207 3HG2 VAL 28 HG23 VAL 28 0.839 7.129 -2.183 208 H THR 29 HN THR 29 -1.623 11.091 -4.189 209 HA THR 29 HA THR 29 -3.729 12.102 -2.560 210 HB THR 29 HB THR 29 -4.533 13.103 -4.762 211 HG1 THR 29 HG1 THR 29 -3.357 11.367 -5.985 212 1HG2 THR 29 HG21 THR 29 -3.122 14.366 -3.232 213 2HG2 THR 29 HG22 THR 29 -2.648 14.692 -4.898 214 3HG2 THR 29 HG23 THR 29 -1.680 13.605 -3.901 215 H VAL 30 HN VAL 30 -5.166 10.617 -1.890 216 HA VAL 30 HA VAL 30 -6.057 8.528 -3.667 217 HB VAL 30 HB VAL 30 -7.119 9.051 -0.897 218 1HG1 VAL 30 HG11 VAL 30 -7.516 6.618 -0.931 219 2HG1 VAL 30 HG12 VAL 30 -6.891 6.543 -2.579 220 3HG1 VAL 30 HG13 VAL 30 -8.368 7.440 -2.238 221 1HG2 VAL 30 HG21 VAL 30 -5.395 7.470 -0.107 222 2HG2 VAL 30 HG22 VAL 30 -4.714 8.972 -0.726 223 3HG2 VAL 30 HG23 VAL 30 -4.655 7.507 -1.708 224 H GLN 31 HN GLN 31 -8.023 8.206 -4.395 225 HA GLN 31 HA GLN 31 -10.178 10.096 -3.966 226 1HB GLN 31 HB2 GLN 31 -8.629 10.943 -5.843 227 2HB GLN 31 HB1 GLN 31 -9.182 9.565 -6.775 228 1HG GLN 31 HG2 GLN 31 -11.039 11.644 -5.654 229 2HG GLN 31 HG1 GLN 31 -10.300 11.764 -7.248 230 1HE2 GLN 31 HE21 GLN 31 -12.728 10.273 -5.327 231 2HE2 GLN 31 HE22 GLN 31 -13.502 9.399 -6.604 232 H ALA 32 HN ALA 32 -11.855 8.780 -3.606 233 HA ALA 32 HA ALA 32 -11.873 6.162 -4.965 234 1HB ALA 32 HB1 ALA 32 -13.002 5.242 -3.009 235 2HB ALA 32 HB2 ALA 32 -12.945 6.818 -2.222 236 3HB ALA 32 HB3 ALA 32 -11.448 5.950 -2.566 237 H LEU 33 HN LEU 33 -13.258 6.381 -6.588 238 HA LEU 33 HA LEU 33 -15.694 7.922 -6.334 239 1HB LEU 33 HB2 LEU 33 -14.452 7.840 -8.459 240 2HB LEU 33 HB1 LEU 33 -14.724 6.110 -8.548 241 HG LEU 33 HG LEU 33 -17.193 6.586 -8.627 242 1HD1 LEU 33 HD11 LEU 33 -17.887 8.841 -9.268 243 2HD1 LEU 33 HD12 LEU 33 -16.234 9.413 -9.041 244 3HD1 LEU 33 HD13 LEU 33 -17.157 8.817 -7.662 245 1HD2 LEU 33 HD21 LEU 33 -15.912 6.040 -10.627 246 2HD2 LEU 33 HD22 LEU 33 -15.499 7.741 -10.837 247 3HD2 LEU 33 HD23 LEU 33 -17.176 7.216 -10.987 248 H GLY 34 HN GLY 34 -17.483 7.129 -5.442 249 1HA GLY 34 HA2 GLY 34 -19.280 5.618 -5.305 250 2HA GLY 34 HA1 GLY 34 -18.248 4.367 -5.986 251 H CYS 35 HN CYS 35 -18.605 2.823 -4.450 252 HA CYS 35 HA CYS 35 -18.366 1.680 -2.506 253 1HB CYS 35 HB2 CYS 35 -16.154 3.672 -2.374 254 2HB CYS 35 HB1 CYS 35 -16.517 2.740 -0.928 255 H ASN 36 HN ASN 36 -20.373 3.722 -2.628 256 HA ASN 36 HA ASN 36 -20.463 5.460 -0.451 257 1HB ASN 36 HB2 ASN 36 -22.010 5.505 -2.401 258 2HB ASN 36 HB1 ASN 36 -22.808 4.070 -1.770 259 1HD2 ASN 36 HD21 ASN 36 -24.250 4.258 -0.120 260 2HD2 ASN 36 HD22 ASN 36 -24.749 5.781 0.542 261 H ALA 37 HN ALA 37 -21.205 2.057 -0.657 262 HA ALA 37 HA ALA 37 -21.261 1.987 2.276 263 1HB ALA 37 HB1 ALA 37 -22.973 0.264 2.247 264 2HB ALA 37 HB2 ALA 37 -23.044 0.335 0.486 265 3HB ALA 37 HB3 ALA 37 -23.563 1.721 1.448 266 H ARG 38 HN ARG 38 -18.919 1.642 1.164 267 HA ARG 38 HA ARG 38 -18.474 -1.256 1.200 268 1HB ARG 38 HB2 ARG 38 -18.648 -0.338 -1.167 269 2HB ARG 38 HB1 ARG 38 -17.172 0.552 -0.825 270 1HG ARG 38 HG2 ARG 38 -16.549 -1.399 -1.996 271 2HG ARG 38 HG1 ARG 38 -16.080 -1.641 -0.311 272 1HD ARG 38 HD2 ARG 38 -17.089 -3.657 -1.154 273 2HD ARG 38 HD1 ARG 38 -18.157 -2.927 0.043 274 HE ARG 38 HE ARG 38 -19.228 -1.933 -2.146 275 1HH1 ARG 38 HH11 ARG 38 -18.024 -5.159 -1.585 276 2HH1 ARG 38 HH12 ARG 38 -19.105 -5.914 -2.714 277 1HH2 ARG 38 HH21 ARG 38 -20.674 -2.900 -3.627 278 2HH2 ARG 38 HH22 ARG 38 -20.637 -4.621 -3.874 279 H GLN 39 HN GLN 39 -16.377 -1.893 1.862 280 HA GLN 39 HA GLN 39 -14.937 0.132 3.376 281 1HB GLN 39 HB2 GLN 39 -14.431 -2.848 3.298 282 2HB GLN 39 HB1 GLN 39 -13.918 -1.702 4.531 283 1HG GLN 39 HG2 GLN 39 -16.230 -1.353 5.199 284 2HG GLN 39 HG1 GLN 39 -16.776 -2.458 3.942 285 1HE2 GLN 39 HE21 GLN 39 -17.752 -3.871 5.319 286 2HE2 GLN 39 HE22 GLN 39 -16.873 -4.882 6.422 287 H VAL 40 HN VAL 40 -13.862 1.235 1.777 288 HA VAL 40 HA VAL 40 -12.446 0.215 -0.386 289 HB VAL 40 HB VAL 40 -11.772 2.684 1.231 290 1HG1 VAL 40 HG11 VAL 40 -10.731 3.499 -0.836 291 2HG1 VAL 40 HG12 VAL 40 -11.045 1.942 -1.600 292 3HG1 VAL 40 HG13 VAL 40 -9.939 2.046 -0.231 293 1HG2 VAL 40 HG21 VAL 40 -13.548 2.350 -1.183 294 2HG2 VAL 40 HG22 VAL 40 -13.101 3.890 -0.447 295 3HG2 VAL 40 HG23 VAL 40 -14.074 2.731 0.458 296 H ALA 41 HN ALA 41 -10.437 -0.672 -0.653 297 HA ALA 41 HA ALA 41 -8.628 -0.782 1.617 298 1HB ALA 41 HB1 ALA 41 -9.601 -3.258 0.201 299 2HB ALA 41 HB2 ALA 41 -10.099 -2.747 1.816 300 3HB ALA 41 HB3 ALA 41 -8.418 -3.185 1.508 301 H LEU 42 HN LEU 42 -6.503 -1.220 1.055 302 HA LEU 42 HA LEU 42 -5.920 -0.942 -1.811 303 1HB LEU 42 HB2 LEU 42 -3.917 -0.717 0.413 304 2HB LEU 42 HB1 LEU 42 -3.853 -0.016 -1.194 305 HG LEU 42 HG LEU 42 -5.794 0.825 0.940 306 1HD1 LEU 42 HD11 LEU 42 -4.393 2.828 1.173 307 2HD1 LEU 42 HD12 LEU 42 -3.211 2.115 0.074 308 3HD1 LEU 42 HD13 LEU 42 -3.532 1.359 1.636 309 1HD2 LEU 42 HD21 LEU 42 -6.124 2.786 -0.520 310 2HD2 LEU 42 HD22 LEU 42 -6.602 1.276 -1.297 311 3HD2 LEU 42 HD23 LEU 42 -5.072 2.042 -1.724 312 H LYS 43 HN LYS 43 -4.267 -2.255 -2.759 313 HA LYS 43 HA LYS 43 -3.441 -4.625 -1.241 314 1HB LYS 43 HB2 LYS 43 -4.456 -4.850 -4.084 315 2HB LYS 43 HB1 LYS 43 -3.999 -6.156 -3.005 316 1HG LYS 43 HG2 LYS 43 -6.294 -6.279 -2.971 317 2HG LYS 43 HG1 LYS 43 -5.959 -5.292 -1.546 318 1HD LYS 43 HD2 LYS 43 -6.343 -3.261 -2.922 319 2HD LYS 43 HD1 LYS 43 -6.810 -4.302 -4.269 320 1HE LYS 43 HE2 LYS 43 -8.703 -3.362 -2.918 321 2HE LYS 43 HE1 LYS 43 -8.697 -5.122 -3.086 322 1HZ LYS 43 HZ1 LYS 43 -9.174 -4.440 -0.826 323 2HZ LYS 43 HZ2 LYS 43 -7.709 -3.599 -0.746 324 3HZ LYS 43 HZ3 LYS 43 -7.708 -5.283 -0.896 325 H ALA 44 HN ALA 44 -1.447 -5.477 -1.964 326 HA ALA 44 HA ALA 44 0.075 -3.726 -3.703 327 1HB ALA 44 HB1 ALA 44 1.188 -4.624 -1.741 328 2HB ALA 44 HB2 ALA 44 1.957 -5.231 -3.209 329 3HB ALA 44 HB3 ALA 44 0.868 -6.269 -2.291 330 H ASP 45 HN ASP 45 1.143 -4.516 -5.597 331 HA ASP 45 HA ASP 45 -0.573 -6.110 -7.233 332 1HB ASP 45 HB2 ASP 45 0.784 -4.222 -8.107 333 2HB ASP 45 HB1 ASP 45 2.242 -5.154 -7.783 334 H THR 46 HN THR 46 0.275 -8.031 -8.462 335 HA THR 46 HA THR 46 0.714 -10.087 -6.654 336 HB THR 46 HB THR 46 -0.341 -10.431 -8.818 337 HG1 THR 46 HG1 THR 46 1.874 -11.973 -8.039 338 1HG2 THR 46 HG21 THR 46 1.015 -10.611 -10.866 339 2HG2 THR 46 HG22 THR 46 2.419 -10.028 -9.969 340 3HG2 THR 46 HG23 THR 46 1.022 -8.977 -10.203 341 H ASP 47 HN ASP 47 3.082 -8.085 -8.229 342 HA ASP 47 HA ASP 47 5.256 -9.940 -7.847 343 1HB ASP 47 HB2 ASP 47 5.082 -7.082 -8.744 344 2HB ASP 47 HB1 ASP 47 6.640 -7.815 -8.375 345 H ASN 48 HN ASN 48 3.602 -7.737 -5.879 346 HA ASN 48 HA ASN 48 5.804 -7.741 -3.907 347 1HB ASN 48 HB2 ASN 48 3.751 -5.569 -4.416 348 2HB ASN 48 HB1 ASN 48 4.908 -5.551 -3.091 349 1HD2 ASN 48 HD21 ASN 48 7.076 -5.276 -3.515 350 2HD2 ASN 48 HD22 ASN 48 7.627 -4.575 -5.005 351 H PHE 49 HN PHE 49 3.138 -9.263 -4.556 352 HA PHE 49 HA PHE 49 2.079 -9.197 -1.815 353 1HB PHE 49 HB2 PHE 49 0.615 -7.884 -3.299 354 2HB PHE 49 HB1 PHE 49 0.460 -9.264 -4.373 355 HD1 PHE 49 HD1 PHE 49 -0.349 -7.991 -1.005 356 HD2 PHE 49 HD2 PHE 49 -1.149 -10.927 -3.976 357 HE1 PHE 49 HE1 PHE 49 -2.354 -8.690 0.234 358 HE2 PHE 49 HE2 PHE 49 -3.154 -11.636 -2.742 359 HZ PHE 49 HZ PHE 49 -3.765 -10.510 -0.636 360 H GLU 50 HN GLU 50 2.610 -11.145 -1.038 361 HA GLU 50 HA GLU 50 1.744 -13.476 -2.594 362 1HB GLU 50 HB2 GLU 50 3.720 -14.741 -1.848 363 2HB GLU 50 HB1 GLU 50 4.161 -13.370 -2.851 364 1HG GLU 50 HG2 GLU 50 4.853 -12.116 -0.922 365 2HG GLU 50 HG1 GLU 50 4.276 -13.387 0.155 366 H GLN 51 HN GLN 51 0.367 -14.671 -1.503 367 HA GLN 51 HA GLN 51 -0.880 -15.552 0.172 368 1HB GLN 51 HB2 GLN 51 1.796 -15.473 1.569 369 2HB GLN 51 HB1 GLN 51 0.389 -16.333 2.180 370 1HG GLN 51 HG2 GLN 51 0.362 -17.675 0.104 371 2HG GLN 51 HG1 GLN 51 1.846 -16.867 -0.396 372 1HE2 GLN 51 HE21 GLN 51 1.184 -17.707 2.921 373 2HE2 GLN 51 HE22 GLN 51 2.352 -18.980 3.038 374 H GLY 52 HN GLY 52 -1.013 -12.764 -0.040 375 1HA GLY 52 HA2 GLY 52 -2.075 -11.068 1.085 376 2HA GLY 52 HA1 GLY 52 -2.261 -12.164 2.447 377 H LYS 53 HN LYS 53 0.807 -11.252 1.002 378 HA LYS 53 HA LYS 53 1.333 -9.434 3.254 379 1HB LYS 53 HB2 LYS 53 3.358 -11.347 2.080 380 2HB LYS 53 HB1 LYS 53 3.593 -10.272 3.446 381 1HG LYS 53 HG2 LYS 53 1.683 -12.598 3.408 382 2HG LYS 53 HG1 LYS 53 3.308 -12.632 4.095 383 1HD LYS 53 HD2 LYS 53 2.670 -10.857 5.664 384 2HD LYS 53 HD1 LYS 53 1.041 -10.850 4.985 385 1HE LYS 53 HE2 LYS 53 2.371 -13.210 6.309 386 2HE LYS 53 HE1 LYS 53 1.190 -12.148 7.075 387 1HZ LYS 53 HZ1 LYS 53 -0.487 -12.874 5.582 388 2HZ LYS 53 HZ2 LYS 53 0.276 -14.269 6.178 389 3HZ LYS 53 HZ3 LYS 53 0.626 -13.711 4.617 390 H PHE 54 HN PHE 54 2.209 -7.511 2.617 391 HA PHE 54 HA PHE 54 3.240 -7.401 -0.122 392 1HB PHE 54 HB2 PHE 54 2.628 -4.929 -0.054 393 2HB PHE 54 HB1 PHE 54 1.332 -6.095 -0.234 394 HD1 PHE 54 HD1 PHE 54 -0.477 -4.712 0.522 395 HD2 PHE 54 HD2 PHE 54 2.985 -5.253 2.940 396 HE1 PHE 54 HE1 PHE 54 -1.648 -3.692 2.430 397 HE2 PHE 54 HE2 PHE 54 1.823 -4.231 4.855 398 HZ PHE 54 HZ PHE 54 -0.602 -3.317 4.456 399 H PHE 55 HN PHE 55 5.079 -6.310 -0.588 400 HA PHE 55 HA PHE 55 6.625 -5.049 1.513 401 1HB PHE 55 HB2 PHE 55 8.540 -6.645 1.212 402 2HB PHE 55 HB1 PHE 55 7.144 -7.383 1.991 403 HD1 PHE 55 HD1 PHE 55 9.232 -7.296 -0.988 404 HD2 PHE 55 HD2 PHE 55 5.773 -9.011 0.805 405 HE1 PHE 55 HE1 PHE 55 9.188 -9.034 -2.734 406 HE2 PHE 55 HE2 PHE 55 5.729 -10.752 -0.931 407 HZ PHE 55 HZ PHE 55 7.438 -10.765 -2.703 408 H LEU 56 HN LEU 56 8.593 -4.094 0.663 409 HA LEU 56 HA LEU 56 8.480 -3.460 -2.154 410 1HB LEU 56 HB2 LEU 56 10.665 -2.255 -1.592 411 2HB LEU 56 HB1 LEU 56 9.197 -1.650 -0.867 412 HG LEU 56 HG LEU 56 9.942 -3.221 1.130 413 1HD1 LEU 56 HD11 LEU 56 11.871 -4.164 0.020 414 2HD1 LEU 56 HD12 LEU 56 12.379 -3.187 1.399 415 3HD1 LEU 56 HD13 LEU 56 12.540 -2.553 -0.239 416 1HD2 LEU 56 HD21 LEU 56 11.164 -0.523 0.570 417 2HD2 LEU 56 HD22 LEU 56 11.033 -1.290 2.153 418 3HD2 LEU 56 HD23 LEU 56 9.577 -0.819 1.278 419 H ILE 57 HN ILE 57 9.926 -4.147 -3.740 420 HA ILE 57 HA ILE 57 11.709 -6.328 -2.895 421 HB ILE 57 HB ILE 57 9.683 -7.108 -4.160 422 1HG1 ILE 57 HG12 ILE 57 11.015 -8.563 -5.722 423 2HG1 ILE 57 HG11 ILE 57 12.421 -7.570 -5.364 424 1HG2 ILE 57 HG21 ILE 57 9.470 -5.245 -5.713 425 2HG2 ILE 57 HG22 ILE 57 9.621 -6.775 -6.578 426 3HG2 ILE 57 HG23 ILE 57 11.001 -5.684 -6.466 427 1HD1 ILE 57 HD11 ILE 57 12.448 -9.600 -4.055 428 2HD1 ILE 57 HD12 ILE 57 10.866 -9.209 -3.381 429 3HD1 ILE 57 HD13 ILE 57 12.258 -8.193 -3.008 430 H SER 58 HN SER 58 13.677 -6.537 -3.991 431 HA SER 58 HA SER 58 14.644 -3.992 -5.052 432 1HB SER 58 HB2 SER 58 16.913 -5.195 -4.560 433 2HB SER 58 HB1 SER 58 15.965 -4.554 -3.222 434 HG SER 58 HG SER 58 15.403 -6.548 -2.616 435 H ASP 59 HN ASP 59 16.565 -4.247 -6.576 436 HA ASP 59 HA ASP 59 15.912 -5.399 -9.002 437 1HB ASP 59 HB2 ASP 59 18.734 -5.049 -7.964 438 2HB ASP 59 HB1 ASP 59 18.217 -5.053 -9.645 439 H ASN 60 HN ASN 60 17.741 -6.721 -6.317 440 HA ASN 60 HA ASN 60 18.506 -9.101 -7.773 441 1HB ASN 60 HB2 ASN 60 18.890 -8.832 -4.823 442 2HB ASN 60 HB1 ASN 60 19.964 -9.528 -6.031 443 1HD2 ASN 60 HD21 ASN 60 21.354 -8.203 -7.163 444 2HD2 ASN 60 HD22 ASN 60 21.666 -6.564 -6.686 445 H ASN 61 HN ASN 61 15.828 -8.111 -5.994 446 HA ASN 61 HA ASN 61 14.116 -9.115 -4.898 447 1HB ASN 61 HB2 ASN 61 15.091 -11.555 -6.407 448 2HB ASN 61 HB1 ASN 61 13.602 -11.505 -5.469 449 1HD2 ASN 61 HD21 ASN 61 15.214 -10.440 -8.342 450 2HD2 ASN 61 HD22 ASN 61 13.812 -9.834 -9.153 451 H ARG 62 HN ARG 62 16.948 -9.126 -3.842 452 HA ARG 62 HA ARG 62 17.046 -11.485 -2.183 453 1HB ARG 62 HB2 ARG 62 19.088 -10.762 -3.253 454 2HB ARG 62 HB1 ARG 62 18.908 -9.142 -2.590 455 1HG ARG 62 HG2 ARG 62 20.375 -9.938 -1.105 456 2HG ARG 62 HG1 ARG 62 18.898 -10.494 -0.329 457 1HD ARG 62 HD2 ARG 62 20.769 -12.099 -2.062 458 2HD ARG 62 HD1 ARG 62 20.473 -12.305 -0.338 459 HE ARG 62 HE ARG 62 18.219 -13.070 -0.919 460 1HH1 ARG 62 HH11 ARG 62 20.640 -12.974 -3.445 461 2HH1 ARG 62 HH12 ARG 62 19.880 -14.206 -4.412 462 1HH2 ARG 62 HH21 ARG 62 17.200 -14.702 -2.187 463 2HH2 ARG 62 HH22 ARG 62 17.916 -15.182 -3.690 464 H ASP 63 HN ASP 63 16.982 -7.940 -1.792 465 HA ASP 63 HA ASP 63 16.342 -8.324 1.044 466 1HB ASP 63 HB2 ASP 63 18.239 -6.772 0.334 467 2HB ASP 63 HB1 ASP 63 16.996 -5.702 -0.308 468 H LYS 64 HN LYS 64 14.425 -7.768 1.860 469 HA LYS 64 HA LYS 64 12.569 -6.183 0.289 470 1HB LYS 64 HB2 LYS 64 10.749 -7.863 0.610 471 2HB LYS 64 HB1 LYS 64 12.025 -8.405 -0.468 472 1HG LYS 64 HG2 LYS 64 11.660 -10.277 0.796 473 2HG LYS 64 HG1 LYS 64 12.995 -9.523 1.667 474 1HD LYS 64 HD2 LYS 64 11.191 -8.428 3.116 475 2HD LYS 64 HD1 LYS 64 10.074 -9.595 2.399 476 1HE LYS 64 HE2 LYS 64 12.492 -10.110 4.116 477 2HE LYS 64 HE1 LYS 64 10.818 -10.571 4.416 478 1HZ LYS 64 HZ1 LYS 64 10.969 -12.104 2.524 479 2HZ LYS 64 HZ2 LYS 64 12.095 -12.479 3.735 480 3HZ LYS 64 HZ3 LYS 64 12.605 -11.693 2.324 481 H LEU 65 HN LEU 65 10.809 -5.377 1.540 482 HA LEU 65 HA LEU 65 10.858 -5.789 4.405 483 1HB LEU 65 HB2 LEU 65 12.489 -4.107 4.281 484 2HB LEU 65 HB1 LEU 65 11.599 -3.197 3.083 485 HG LEU 65 HG LEU 65 9.867 -2.784 4.886 486 1HD1 LEU 65 HD11 LEU 65 10.667 -2.961 7.201 487 2HD1 LEU 65 HD12 LEU 65 12.105 -3.807 6.630 488 3HD1 LEU 65 HD13 LEU 65 10.514 -4.539 6.431 489 1HD2 LEU 65 HD21 LEU 65 12.659 -1.701 5.191 490 2HD2 LEU 65 HD22 LEU 65 11.206 -0.973 5.873 491 3HD2 LEU 65 HD23 LEU 65 11.399 -1.083 4.124 492 H TYR 66 HN TYR 66 8.912 -5.517 5.280 493 HA TYR 66 HA TYR 66 6.700 -5.194 3.479 494 1HB TYR 66 HB2 TYR 66 6.822 -5.677 6.459 495 2HB TYR 66 HB1 TYR 66 5.348 -5.742 5.491 496 HD1 TYR 66 HD1 TYR 66 8.662 -7.358 6.003 497 HD2 TYR 66 HD2 TYR 66 4.764 -7.709 4.312 498 HE1 TYR 66 HE1 TYR 66 9.075 -9.734 5.543 499 HE2 TYR 66 HE2 TYR 66 5.177 -10.088 3.848 500 HH TYR 66 HH TYR 66 7.778 -11.802 5.194 501 H VAL 67 HN VAL 67 5.442 -3.452 3.237 502 HA VAL 67 HA VAL 67 5.890 -1.169 5.038 503 HB VAL 67 HB VAL 67 5.504 0.308 3.015 504 1HG1 VAL 67 HG11 VAL 67 7.714 -0.020 4.023 505 2HG1 VAL 67 HG12 VAL 67 7.823 0.171 2.273 506 3HG1 VAL 67 HG13 VAL 67 7.970 -1.431 2.997 507 1HG2 VAL 67 HG21 VAL 67 6.002 -0.668 0.815 508 2HG2 VAL 67 HG22 VAL 67 4.549 -1.370 1.529 509 3HG2 VAL 67 HG23 VAL 67 6.066 -2.270 1.551 510 H ASN 68 HN ASN 68 4.115 -0.185 5.785 511 HA ASN 68 HA ASN 68 1.551 -1.369 4.982 512 1HB ASN 68 HB2 ASN 68 2.222 0.237 7.462 513 2HB ASN 68 HB1 ASN 68 0.694 -0.571 7.135 514 1HD2 ASN 68 HD21 ASN 68 2.488 -0.928 9.373 515 2HD2 ASN 68 HD22 ASN 68 2.971 -2.591 9.370 516 H ILE 69 HN ILE 69 0.232 -0.221 3.762 517 HA ILE 69 HA ILE 69 0.735 2.585 3.268 518 HB ILE 69 HB ILE 69 -1.745 1.578 2.139 519 1HG1 ILE 69 HG12 ILE 69 0.793 0.094 1.413 520 2HG1 ILE 69 HG11 ILE 69 -0.546 -0.590 2.322 521 1HG2 ILE 69 HG21 ILE 69 -0.699 2.360 0.061 522 2HG2 ILE 69 HG22 ILE 69 0.825 2.580 0.922 523 3HG2 ILE 69 HG23 ILE 69 -0.580 3.558 1.352 524 1HD1 ILE 69 HD11 ILE 69 -0.668 0.401 -0.516 525 2HD1 ILE 69 HD12 ILE 69 -2.006 -0.302 0.394 526 3HD1 ILE 69 HD13 ILE 69 -0.597 -1.284 -0.004 527 H ARG 70 HN ARG 70 0.220 3.617 5.192 528 HA ARG 70 HA ARG 70 -2.430 3.109 6.347 529 1HB ARG 70 HB2 ARG 70 -0.255 4.758 7.624 530 2HB ARG 70 HB1 ARG 70 -1.600 3.935 8.399 531 1HG ARG 70 HG2 ARG 70 -0.568 1.776 7.918 532 2HG ARG 70 HG1 ARG 70 0.774 2.594 7.117 533 1HD ARG 70 HD2 ARG 70 0.986 3.858 9.390 534 2HD ARG 70 HD1 ARG 70 0.072 2.489 10.019 535 HE ARG 70 HE ARG 70 2.414 1.812 8.454 536 1HH1 ARG 70 HH11 ARG 70 1.055 2.333 11.638 537 2HH1 ARG 70 HH12 ARG 70 2.393 1.585 12.466 538 1HH2 ARG 70 HH21 ARG 70 4.186 0.829 9.559 539 2HH2 ARG 70 HH22 ARG 70 4.147 0.726 11.294 540 HA PRO 71 HA PRO 71 -4.140 6.984 4.941 541 1HB PRO 71 HB2 PRO 71 -5.122 7.134 7.752 542 2HB PRO 71 HB1 PRO 71 -6.010 7.342 6.239 543 1HG PRO 71 HG2 PRO 71 -6.224 5.091 7.651 544 2HG PRO 71 HG1 PRO 71 -6.196 5.064 5.877 545 1HD PRO 71 HD2 PRO 71 -4.077 4.296 7.819 546 2HD PRO 71 HD1 PRO 71 -4.425 3.645 6.205 547 H MET 72 HN MET 72 -3.429 9.042 4.922 548 HA MET 72 HA MET 72 -1.321 9.834 6.708 549 1HB MET 72 HB2 MET 72 -1.284 10.511 4.342 550 2HB MET 72 HB1 MET 72 -2.781 11.405 4.567 551 1HG MET 72 HG2 MET 72 -0.915 12.918 4.533 552 2HG MET 72 HG1 MET 72 -1.636 12.895 6.142 553 1HE MET 72 HE1 MET 72 1.244 14.112 5.518 554 2HE MET 72 HE2 MET 72 2.160 13.496 6.892 555 3HE MET 72 HE3 MET 72 0.518 14.091 7.124 556 H ASP 73 HN ASP 73 -2.574 9.578 8.642 557 HA ASP 73 HA ASP 73 -4.067 10.080 10.282 558 1HB ASP 73 HB2 ASP 73 -2.272 11.771 10.588 559 2HB ASP 73 HB1 ASP 73 -3.223 12.907 9.631 560 H ASN 74 HN ASN 74 -6.016 9.441 9.365 561 HA ASN 74 HA ASN 74 -7.764 11.614 8.514 562 1HB ASN 74 HB2 ASN 74 -6.472 10.342 6.556 563 2HB ASN 74 HB1 ASN 74 -7.787 9.195 6.782 564 1HD2 ASN 74 HD21 ASN 74 -6.841 12.229 5.561 565 2HD2 ASN 74 HD22 ASN 74 -8.367 12.711 4.903 566 H SER 75 HN SER 75 -7.786 8.048 8.409 567 HA SER 75 HA SER 75 -9.912 8.008 10.412 568 1HB SER 75 HB2 SER 75 -10.173 6.478 7.811 569 2HB SER 75 HB1 SER 75 -11.382 6.652 9.085 570 HG SER 75 HG SER 75 -11.444 8.912 8.572 571 H ALA 76 HN ALA 76 -10.317 5.728 11.162 572 HA ALA 76 HA ALA 76 -7.764 4.373 11.435 573 1HB ALA 76 HB1 ALA 76 -10.432 3.777 12.708 574 2HB ALA 76 HB2 ALA 76 -9.125 4.720 13.426 575 3HB ALA 76 HB3 ALA 76 -8.902 3.000 13.110 576 H TRP 77 HN TRP 77 -7.212 3.102 9.819 577 HA TRP 77 HA TRP 77 -9.225 1.386 8.553 578 1HB TRP 77 HB2 TRP 77 -6.476 2.292 7.707 579 2HB TRP 77 HB1 TRP 77 -7.289 0.947 6.916 580 HD1 TRP 77 HD1 TRP 77 -8.977 4.316 7.907 581 HE1 TRP 77 HE1 TRP 77 -9.870 5.411 5.735 582 HE3 TRP 77 HE3 TRP 77 -7.105 1.005 4.505 583 HZ2 TRP 77 HZ2 TRP 77 -9.770 4.913 2.963 584 HZ3 TRP 77 HZ3 TRP 77 -7.544 1.380 2.116 585 HH2 TRP 77 HH2 TRP 77 -8.845 3.301 1.361 586 H THR 78 HN THR 78 -9.123 -0.801 8.708 587 HA THR 78 HA THR 78 -7.534 -2.009 10.737 588 HB THR 78 HB THR 78 -9.066 -3.410 8.534 589 HG1 THR 78 HG1 THR 78 -9.965 -2.318 11.023 590 1HG2 THR 78 HG21 THR 78 -7.600 -4.846 9.874 591 2HG2 THR 78 HG22 THR 78 -9.300 -5.194 10.193 592 3HG2 THR 78 HG23 THR 78 -8.360 -4.249 11.347 593 H THR 79 HN THR 79 -5.438 -2.506 10.530 594 HA THR 79 HA THR 79 -4.324 -2.529 7.841 595 HB THR 79 HB THR 79 -3.227 -1.000 9.302 596 HG1 THR 79 HG1 THR 79 -1.951 -2.981 8.092 597 1HG2 THR 79 HG21 THR 79 -2.709 -3.324 11.159 598 2HG2 THR 79 HG22 THR 79 -3.795 -1.969 11.463 599 3HG2 THR 79 HG23 THR 79 -2.057 -1.696 11.347 600 H ASP 80 HN ASP 80 -4.517 -4.450 6.947 601 HA ASP 80 HA ASP 80 -3.182 -6.714 8.272 602 1HB ASP 80 HB2 ASP 80 -5.174 -6.540 6.017 603 2HB ASP 80 HB1 ASP 80 -4.096 -7.927 6.123 604 H ASN 81 HN ASN 81 -1.636 -7.945 6.853 605 HA ASN 81 HA ASN 81 0.021 -6.013 5.453 606 1HB ASN 81 HB2 ASN 81 0.446 -8.780 6.473 607 2HB ASN 81 HB1 ASN 81 1.462 -8.221 5.149 608 1HD2 ASN 81 HD21 ASN 81 2.778 -6.389 5.468 609 2HD2 ASN 81 HD22 ASN 81 3.275 -5.916 7.053 610 H GLY 82 HN GLY 82 -2.562 -7.704 4.536 611 1HA GLY 82 HA2 GLY 82 -1.493 -8.078 1.812 612 2HA GLY 82 HA1 GLY 82 -2.846 -8.997 2.462 613 H VAL 83 HN VAL 83 -4.196 -6.877 3.698 614 HA VAL 83 HA VAL 83 -4.850 -5.096 1.469 615 HB VAL 83 HB VAL 83 -7.251 -5.278 2.027 616 1HG1 VAL 83 HG11 VAL 83 -5.948 -7.888 1.242 617 2HG1 VAL 83 HG12 VAL 83 -6.350 -6.556 0.157 618 3HG1 VAL 83 HG13 VAL 83 -7.636 -7.457 0.962 619 1HG2 VAL 83 HG21 VAL 83 -6.366 -7.585 3.763 620 2HG2 VAL 83 HG22 VAL 83 -8.037 -7.172 3.378 621 3HG2 VAL 83 HG23 VAL 83 -7.050 -6.058 4.322 622 H PHE 84 HN PHE 84 -5.946 -3.148 2.139 623 HA PHE 84 HA PHE 84 -5.647 -2.555 4.999 624 1HB PHE 84 HB2 PHE 84 -3.824 -1.687 3.167 625 2HB PHE 84 HB1 PHE 84 -4.986 -0.370 3.111 626 HD1 PHE 84 HD1 PHE 84 -5.661 0.654 5.411 627 HD2 PHE 84 HD2 PHE 84 -2.176 -1.698 4.757 628 HE1 PHE 84 HE1 PHE 84 -4.628 1.625 7.424 629 HE2 PHE 84 HE2 PHE 84 -1.140 -0.733 6.767 630 HZ PHE 84 HZ PHE 84 -2.368 0.929 8.103 631 H TYR 85 HN TYR 85 -7.815 -2.457 5.427 632 HA TYR 85 HA TYR 85 -9.403 -0.635 3.744 633 1HB TYR 85 HB2 TYR 85 -11.386 -2.077 4.107 634 2HB TYR 85 HB1 TYR 85 -10.147 -2.880 3.162 635 HD1 TYR 85 HD1 TYR 85 -12.525 -3.430 5.522 636 HD2 TYR 85 HD2 TYR 85 -8.384 -4.178 4.900 637 HE1 TYR 85 HE1 TYR 85 -12.646 -5.351 7.058 638 HE2 TYR 85 HE2 TYR 85 -8.495 -6.109 6.422 639 HH TYR 85 HH TYR 85 -9.892 -6.935 8.280 640 H LYS 86 HN LYS 86 -10.776 0.716 4.772 641 HA LYS 86 HA LYS 86 -10.474 1.069 7.587 642 1HB LYS 86 HB2 LYS 86 -12.244 2.792 7.332 643 2HB LYS 86 HB1 LYS 86 -10.907 3.009 6.216 644 1HG LYS 86 HG2 LYS 86 -12.177 2.290 4.376 645 2HG LYS 86 HG1 LYS 86 -13.435 1.605 5.410 646 1HD LYS 86 HD2 LYS 86 -14.013 3.858 6.185 647 2HD LYS 86 HD1 LYS 86 -12.764 4.534 5.142 648 1HE LYS 86 HE2 LYS 86 -14.992 2.842 4.043 649 2HE LYS 86 HE1 LYS 86 -15.177 4.581 4.295 650 1HZ LYS 86 HZ1 LYS 86 -14.509 4.124 2.051 651 2HZ LYS 86 HZ2 LYS 86 -13.149 3.262 2.583 652 3HZ LYS 86 HZ3 LYS 86 -13.255 4.927 2.860 653 H ASN 87 HN ASN 87 -11.912 0.577 9.211 654 HA ASN 87 HA ASN 87 -13.759 -1.580 8.700 655 1HB ASN 87 HB2 ASN 87 -12.234 -1.086 10.812 656 2HB ASN 87 HB1 ASN 87 -13.626 -0.138 11.326 657 1HD2 ASN 87 HD21 ASN 87 -12.434 -3.314 10.576 658 2HD2 ASN 87 HD22 ASN 87 -13.723 -4.199 11.326 659 H ASP 88 HN ASP 88 -14.497 0.492 7.212 660 HA ASP 88 HA ASP 88 -16.987 1.483 8.329 661 1HB ASP 88 HB2 ASP 88 -15.477 3.221 9.028 662 2HB ASP 88 HB1 ASP 88 -14.708 3.274 7.443 663 H VAL 89 HN VAL 89 -18.372 2.339 6.669 664 HA VAL 89 HA VAL 89 -17.551 1.469 3.980 665 HB VAL 89 HB VAL 89 -19.925 1.002 3.476 666 1HG1 VAL 89 HG11 VAL 89 -18.839 -0.466 5.877 667 2HG1 VAL 89 HG12 VAL 89 -18.460 -0.803 4.187 668 3HG1 VAL 89 HG13 VAL 89 -20.096 -1.060 4.792 669 1HG2 VAL 89 HG21 VAL 89 -21.552 0.836 5.307 670 2HG2 VAL 89 HG22 VAL 89 -20.983 2.492 5.098 671 3HG2 VAL 89 HG23 VAL 89 -20.362 1.509 6.423 672 H GLY 90 HN GLY 90 -17.448 3.000 2.490 673 1HA GLY 90 HA2 GLY 90 -19.147 4.890 1.711 674 2HA GLY 90 HA1 GLY 90 -18.462 5.656 3.137 675 H SER 91 HN SER 91 -18.131 7.028 0.947 676 HA SER 91 HA SER 91 -15.777 6.361 -0.534 677 1HB SER 91 HB2 SER 91 -16.065 8.851 -1.247 678 2HB SER 91 HB1 SER 91 -17.301 7.687 -1.728 679 HG SER 91 HG SER 91 -17.645 8.966 0.731 680 H TRP 92 HN TRP 92 -13.709 6.755 0.029 681 HA TRP 92 HA TRP 92 -13.295 8.218 2.535 682 1HB TRP 92 HB2 TRP 92 -12.569 5.808 2.342 683 2HB TRP 92 HB1 TRP 92 -11.311 6.376 1.232 684 HD1 TRP 92 HD1 TRP 92 -12.510 7.076 4.856 685 HE1 TRP 92 HE1 TRP 92 -10.457 7.742 6.260 686 HE3 TRP 92 HE3 TRP 92 -8.980 6.974 1.179 687 HZ2 TRP 92 HZ2 TRP 92 -7.687 8.155 5.831 688 HZ3 TRP 92 HZ3 TRP 92 -6.677 7.535 1.743 689 HH2 TRP 92 HH2 TRP 92 -6.028 8.102 4.026 690 H GLY 93 HN GLY 93 -12.053 8.013 -0.783 691 1HA GLY 93 HA2 GLY 93 -10.519 9.324 -1.921 692 2HA GLY 93 HA1 GLY 93 -11.280 10.659 -1.066 693 H GLY 94 HN GLY 94 -9.685 11.889 -0.173 694 1HA GLY 94 HA2 GLY 94 -8.305 12.410 1.597 695 2HA GLY 94 HA1 GLY 94 -8.383 10.729 2.084 696 H THR 95 HN THR 95 -6.266 10.470 2.540 697 HA THR 95 HA THR 95 -4.468 10.164 0.292 698 HB THR 95 HB THR 95 -2.698 11.402 1.863 699 HG1 THR 95 HG1 THR 95 -4.823 13.183 2.240 700 1HG2 THR 95 HG21 THR 95 -3.127 11.949 -0.484 701 2HG2 THR 95 HG22 THR 95 -2.968 13.411 0.490 702 3HG2 THR 95 HG23 THR 95 -4.566 12.856 -0.014 703 H ILE 96 HN ILE 96 -3.175 8.428 0.590 704 HA ILE 96 HA ILE 96 -2.685 7.511 3.340 705 HB ILE 96 HB ILE 96 -2.465 5.160 2.282 706 1HG1 ILE 96 HG12 ILE 96 -4.297 4.927 0.444 707 2HG1 ILE 96 HG11 ILE 96 -3.977 6.630 0.146 708 1HG2 ILE 96 HG21 ILE 96 -4.140 5.623 3.904 709 2HG2 ILE 96 HG22 ILE 96 -4.899 4.737 2.582 710 3HG2 ILE 96 HG23 ILE 96 -5.130 6.482 2.725 711 1HD1 ILE 96 HD11 ILE 96 -1.969 4.402 -0.011 712 2HD1 ILE 96 HD12 ILE 96 -1.647 6.109 -0.318 713 3HD1 ILE 96 HD13 ILE 96 -2.740 5.214 -1.372 714 H GLY 97 HN GLY 97 -0.623 6.485 3.688 715 1HA GLY 97 HA2 GLY 97 1.333 7.104 1.569 716 2HA GLY 97 HA1 GLY 97 1.587 7.674 3.211 717 H ILE 98 HN ILE 98 3.488 6.158 2.027 718 HA ILE 98 HA ILE 98 3.151 3.419 2.936 719 HB ILE 98 HB ILE 98 5.392 4.805 1.455 720 1HG1 ILE 98 HG12 ILE 98 4.798 3.018 -0.272 721 2HG1 ILE 98 HG11 ILE 98 3.353 2.712 0.682 722 1HG2 ILE 98 HG21 ILE 98 6.386 3.192 2.962 723 2HG2 ILE 98 HG22 ILE 98 6.494 2.618 1.298 724 3HG2 ILE 98 HG23 ILE 98 5.283 1.942 2.386 725 1HD1 ILE 98 HD11 ILE 98 4.087 5.314 -0.640 726 2HD1 ILE 98 HD12 ILE 98 2.640 5.020 0.324 727 3HD1 ILE 98 HD13 ILE 98 2.876 4.161 -1.198 728 H TYR 99 HN TYR 99 3.456 3.045 5.025 729 HA TYR 99 HA TYR 99 5.700 4.374 6.401 730 1HB TYR 99 HB2 TYR 99 3.304 3.008 7.656 731 2HB TYR 99 HB1 TYR 99 4.543 3.932 8.490 732 HD1 TYR 99 HD1 TYR 99 3.946 6.064 9.179 733 HD2 TYR 99 HD2 TYR 99 2.060 4.438 5.743 734 HE1 TYR 99 HE1 TYR 99 2.595 8.104 8.957 735 HE2 TYR 99 HE2 TYR 99 0.703 6.465 5.514 736 HH TYR 99 HH TYR 99 1.384 9.324 7.159 737 H VAL 100 HN VAL 100 7.392 3.067 6.837 738 HA VAL 100 HA VAL 100 7.575 0.384 6.120 739 HB VAL 100 HB VAL 100 9.535 1.804 6.492 740 1HG1 VAL 100 HG11 VAL 100 10.345 2.296 8.712 741 2HG1 VAL 100 HG12 VAL 100 8.956 1.479 9.424 742 3HG1 VAL 100 HG13 VAL 100 8.725 2.965 8.504 743 1HG2 VAL 100 HG21 VAL 100 10.950 0.152 7.566 744 2HG2 VAL 100 HG22 VAL 100 9.771 -0.632 6.513 745 3HG2 VAL 100 HG23 VAL 100 9.530 -0.634 8.260 746 H ASP 101 HN ASP 101 7.149 -1.543 7.163 747 HA ASP 101 HA ASP 101 5.788 -1.422 9.730 748 1HB ASP 101 HB2 ASP 101 4.963 -2.947 7.942 749 2HB ASP 101 HB1 ASP 101 6.478 -3.838 8.030 750 H GLY 102 HN GLY 102 7.485 -0.687 11.039 751 1HA GLY 102 HA2 GLY 102 9.211 -1.063 12.544 752 2HA GLY 102 HA1 GLY 102 9.405 -2.680 11.875 753 H GLN 103 HN GLN 103 10.520 0.563 11.846 754 HA GLN 103 HA GLN 103 11.752 0.970 9.477 755 1HB GLN 103 HB2 GLN 103 13.412 2.329 10.629 756 2HB GLN 103 HB1 GLN 103 11.822 2.574 11.333 757 1HG GLN 103 HG2 GLN 103 13.841 0.691 12.522 758 2HG GLN 103 HG1 GLN 103 13.780 2.402 12.931 759 1HE2 GLN 103 HE21 GLN 103 10.901 2.587 12.827 760 2HE2 GLN 103 HE22 GLN 103 10.305 1.781 14.238 761 H GLN 104 HN GLN 104 13.067 -0.155 8.241 762 HA GLN 104 HA GLN 104 14.525 -2.399 9.232 763 1HB GLN 104 HB2 GLN 104 13.462 -2.224 6.963 764 2HB GLN 104 HB1 GLN 104 14.725 -1.088 6.517 765 1HG GLN 104 HG2 GLN 104 15.183 -3.340 5.695 766 2HG GLN 104 HG1 GLN 104 16.412 -2.804 6.841 767 1HE2 GLN 104 HE21 GLN 104 16.564 -3.791 8.835 768 2HE2 GLN 104 HE22 GLN 104 15.735 -5.263 9.220 769 H THR 105 HN THR 105 15.146 0.835 9.381 770 HA THR 105 HA THR 105 16.928 2.035 10.109 771 HB THR 105 HB THR 105 18.511 -0.519 10.376 772 HG1 THR 105 HG1 THR 105 16.203 -0.412 11.340 773 1HG2 THR 105 HG21 THR 105 18.428 2.014 12.023 774 2HG2 THR 105 HG22 THR 105 19.662 1.618 10.827 775 3HG2 THR 105 HG23 THR 105 19.498 0.638 12.285 776 H ASN 106 HN ASN 106 16.593 1.198 7.274 777 HA ASN 106 HA ASN 106 17.579 1.519 5.273 778 1HB ASN 106 HB2 ASN 106 18.110 3.716 6.094 779 2HB ASN 106 HB1 ASN 106 19.513 3.112 6.953 780 1HD2 ASN 106 HD21 ASN 106 18.695 2.066 3.710 781 2HD2 ASN 106 HD22 ASN 106 20.027 2.839 2.931 782 H THR 107 HN THR 107 17.936 -0.861 5.621 783 HA THR 107 HA THR 107 20.686 -1.697 5.552 784 HB THR 107 HB THR 107 18.325 -3.276 4.521 785 HG1 THR 107 HG1 THR 107 19.128 -2.938 7.246 786 1HG2 THR 107 HG21 THR 107 20.539 -4.284 4.252 787 2HG2 THR 107 HG22 THR 107 19.585 -5.178 5.438 788 3HG2 THR 107 HG23 THR 107 20.851 -4.072 5.976 789 HA PRO 108 HA PRO 108 22.190 -0.592 1.586 790 1HB PRO 108 HB2 PRO 108 22.155 -3.511 1.006 791 2HB PRO 108 HB1 PRO 108 23.459 -2.339 0.810 792 1HG PRO 108 HG2 PRO 108 23.091 -4.088 2.987 793 2HG PRO 108 HG1 PRO 108 24.223 -2.731 2.902 794 1HD PRO 108 HD2 PRO 108 22.011 -2.941 4.618 795 2HD PRO 108 HD1 PRO 108 22.927 -1.461 4.271 796 HA PRO 109 HA PRO 109 18.221 -1.116 -0.538 797 1HB PRO 109 HB2 PRO 109 17.782 1.517 -0.994 798 2HB PRO 109 HB1 PRO 109 17.394 0.727 0.533 799 1HG PRO 109 HG2 PRO 109 19.570 2.598 -0.110 800 2HG PRO 109 HG1 PRO 109 18.825 2.231 1.450 801 1HD PRO 109 HD2 PRO 109 21.300 1.249 0.426 802 2HD PRO 109 HD1 PRO 109 20.502 0.816 1.954 803 H GLY 110 HN GLY 110 17.458 0.179 -2.609 804 1HA GLY 110 HA2 GLY 110 19.420 0.879 -4.540 805 2HA GLY 110 HA1 GLY 110 18.888 -0.783 -4.751 806 H ASN 111 HN ASN 111 17.405 -0.907 -6.290 807 HA ASN 111 HA ASN 111 15.355 1.187 -6.443 808 1HB ASN 111 HB2 ASN 111 16.478 0.385 -8.559 809 2HB ASN 111 HB1 ASN 111 15.727 -1.187 -8.289 810 1HD2 ASN 111 HD21 ASN 111 15.269 2.075 -9.278 811 2HD2 ASN 111 HD22 ASN 111 13.637 1.907 -9.828 812 H TYR 112 HN TYR 112 13.713 0.854 -5.072 813 HA TYR 112 HA TYR 112 12.834 -1.915 -4.668 814 1HB TYR 112 HB2 TYR 112 12.636 0.521 -2.910 815 2HB TYR 112 HB1 TYR 112 11.662 -0.915 -2.614 816 HD1 TYR 112 HD1 TYR 112 13.136 -3.193 -2.716 817 HD2 TYR 112 HD2 TYR 112 14.606 0.683 -1.796 818 HE1 TYR 112 HE1 TYR 112 14.965 -4.197 -1.440 819 HE2 TYR 112 HE2 TYR 112 16.459 -0.317 -0.526 820 HH TYR 112 HH TYR 112 16.925 -2.456 0.666 821 H THR 113 HN THR 113 11.346 -2.406 -6.024 822 HA THR 113 HA THR 113 9.358 -0.419 -6.830 823 HB THR 113 HB THR 113 9.987 -3.152 -7.966 824 HG1 THR 113 HG1 THR 113 11.623 -1.540 -8.327 825 1HG2 THR 113 HG21 THR 113 7.650 -2.505 -8.348 826 2HG2 THR 113 HG22 THR 113 8.572 -2.486 -9.850 827 3HG2 THR 113 HG23 THR 113 8.185 -0.971 -9.034 828 H LEU 114 HN LEU 114 7.508 -0.419 -5.727 829 HA LEU 114 HA LEU 114 6.314 -3.011 -5.072 830 1HB LEU 114 HB2 LEU 114 5.355 -1.921 -2.992 831 2HB LEU 114 HB1 LEU 114 7.051 -2.349 -2.949 832 HG LEU 114 HG LEU 114 6.397 0.421 -3.763 833 1HD1 LEU 114 HD11 LEU 114 6.202 1.126 -1.413 834 2HD1 LEU 114 HD12 LEU 114 6.147 -0.567 -0.925 835 3HD1 LEU 114 HD13 LEU 114 4.854 0.108 -1.918 836 1HD2 LEU 114 HD21 LEU 114 8.402 0.914 -2.477 837 2HD2 LEU 114 HD22 LEU 114 8.708 -0.380 -3.637 838 3HD2 LEU 114 HD23 LEU 114 8.477 -0.762 -1.933 839 H THR 115 HN THR 115 4.847 -3.000 -6.684 840 HA THR 115 HA THR 115 3.357 -0.661 -7.387 841 HB THR 115 HB THR 115 2.656 -3.500 -8.136 842 HG1 THR 115 HG1 THR 115 4.313 -3.536 -9.477 843 1HG2 THR 115 HG21 THR 115 2.236 -0.846 -9.522 844 2HG2 THR 115 HG22 THR 115 0.995 -1.803 -8.711 845 3HG2 THR 115 HG23 THR 115 1.775 -2.421 -10.168 846 H LEU 116 HN LEU 116 1.504 0.044 -6.518 847 HA LEU 116 HA LEU 116 0.052 -1.779 -4.713 848 1HB LEU 116 HB2 LEU 116 0.310 1.222 -4.581 849 2HB LEU 116 HB1 LEU 116 -0.652 0.245 -3.487 850 HG LEU 116 HG LEU 116 2.358 0.158 -3.758 851 1HD1 LEU 116 HD11 LEU 116 0.606 1.217 -1.546 852 2HD1 LEU 116 HD12 LEU 116 1.545 2.189 -2.679 853 3HD1 LEU 116 HD13 LEU 116 2.367 1.136 -1.527 854 1HD2 LEU 116 HD21 LEU 116 2.291 -1.324 -1.817 855 2HD2 LEU 116 HD22 LEU 116 1.432 -2.031 -3.185 856 3HD2 LEU 116 HD23 LEU 116 0.528 -1.306 -1.855 857 H THR 117 HN THR 117 -2.005 -2.193 -5.228 858 HA THR 117 HA THR 117 -3.161 -0.648 -7.450 859 HB THR 117 HB THR 117 -3.946 -3.428 -6.561 860 HG1 THR 117 HG1 THR 117 -1.684 -2.809 -7.608 861 1HG2 THR 117 HG21 THR 117 -4.466 -1.895 -9.116 862 2HG2 THR 117 HG22 THR 117 -5.650 -2.237 -7.854 863 3HG2 THR 117 HG23 THR 117 -4.959 -3.558 -8.796 864 H GLY 118 HN GLY 118 -4.871 0.579 -7.045 865 1HA GLY 118 HA2 GLY 118 -6.144 0.566 -4.468 866 2HA GLY 118 HA1 GLY 118 -6.554 1.595 -5.834 867 H GLY 119 HN GLY 119 -8.431 0.290 -4.125 868 1HA GLY 119 HA2 GLY 119 -10.266 -0.657 -5.968 869 2HA GLY 119 HA1 GLY 119 -9.433 -2.070 -5.332 870 H TYR 120 HN TYR 120 -11.758 -2.455 -4.694 871 HA TYR 120 HA TYR 120 -12.192 -1.227 -2.064 872 1HB TYR 120 HB2 TYR 120 -14.549 -1.765 -2.258 873 2HB TYR 120 HB1 TYR 120 -14.036 -0.823 -3.648 874 HD1 TYR 120 HD1 TYR 120 -15.228 -4.087 -2.489 875 HD2 TYR 120 HD2 TYR 120 -13.996 -1.808 -5.876 876 HE1 TYR 120 HE1 TYR 120 -16.237 -5.760 -3.981 877 HE2 TYR 120 HE2 TYR 120 -15.000 -3.482 -7.369 878 HH TYR 120 HH TYR 120 -15.735 -5.743 -7.406 879 H TRP 121 HN TRP 121 -13.654 -2.853 -0.727 880 HA TRP 121 HA TRP 121 -12.659 -5.574 -0.935 881 1HB TRP 121 HB2 TRP 121 -10.967 -4.802 0.464 882 2HB TRP 121 HB1 TRP 121 -12.013 -3.629 1.253 883 HD1 TRP 121 HD1 TRP 121 -13.878 -4.729 2.949 884 HE1 TRP 121 HE1 TRP 121 -13.623 -6.680 4.587 885 HE3 TRP 121 HE3 TRP 121 -9.735 -6.944 0.922 886 HZ2 TRP 121 HZ2 TRP 121 -11.902 -8.840 4.974 887 HZ3 TRP 121 HZ3 TRP 121 -8.861 -8.970 2.037 888 HH2 TRP 121 HH2 TRP 121 -9.930 -9.886 3.993 889 H ALA 122 HN ALA 122 -14.013 -7.075 0.092 890 HA ALA 122 HA ALA 122 -16.480 -5.986 1.261 891 1HB ALA 122 HB1 ALA 122 -16.891 -6.827 -0.998 892 2HB ALA 122 HB2 ALA 122 -17.728 -7.797 0.215 893 3HB ALA 122 HB3 ALA 122 -16.248 -8.400 -0.530 894 H LYS 123 HN LYS 123 -17.335 -7.051 2.983 895 HA LYS 123 HA LYS 123 -17.504 -8.303 4.837 896 1HB LYS 123 HB2 LYS 123 -17.051 -10.157 2.924 897 2HB LYS 123 HB1 LYS 123 -15.657 -10.444 3.957 898 1HG LYS 123 HG2 LYS 123 -18.309 -10.236 5.269 899 2HG LYS 123 HG1 LYS 123 -17.980 -11.680 4.314 900 1HD LYS 123 HD2 LYS 123 -16.198 -12.320 5.682 901 2HD LYS 123 HD1 LYS 123 -16.033 -10.705 6.377 902 1HE LYS 123 HE2 LYS 123 -18.485 -12.395 6.783 903 2HE LYS 123 HE1 LYS 123 -17.084 -12.495 7.849 904 1HZ LYS 123 HZ1 LYS 123 -18.554 -9.976 7.285 905 2HZ LYS 123 HZ2 LYS 123 -17.335 -10.212 8.437 906 3HZ LYS 123 HZ3 LYS 123 -18.848 -10.961 8.633 907 H ASP 124 HN ASP 124 -14.999 -10.121 5.533 908 HA ASP 124 HA ASP 124 -12.950 -8.185 5.995 909 1HB ASP 124 HB2 ASP 124 -13.008 -8.139 8.419 910 2HB ASP 124 HB1 ASP 124 -14.546 -7.566 7.786 911 H ASN 125 HN ASN 125 -11.033 -9.073 6.399 912 HA ASN 125 HA ASN 125 -9.366 -10.576 6.563 913 1HB ASN 125 HB2 ASN 125 -11.396 -12.205 8.055 914 2HB ASN 125 HB1 ASN 125 -9.688 -12.599 7.930 915 1HD2 ASN 125 HD21 ASN 125 -12.061 -10.600 9.430 916 2HD2 ASN 125 HD22 ASN 125 -10.989 -9.808 10.536 917 H LYS 126 HN LYS 126 -12.388 -12.066 5.505 918 HA LYS 126 HA LYS 126 -11.318 -14.420 4.431 919 1HB LYS 126 HB2 LYS 126 -13.450 -14.718 3.357 920 2HB LYS 126 HB1 LYS 126 -13.706 -14.044 4.959 921 1HG LYS 126 HG2 LYS 126 -15.052 -12.595 3.932 922 2HG LYS 126 HG1 LYS 126 -13.567 -11.795 3.410 923 1HD LYS 126 HD2 LYS 126 -13.587 -13.201 1.365 924 2HD LYS 126 HD1 LYS 126 -15.138 -13.872 1.877 925 1HE LYS 126 HE2 LYS 126 -16.004 -11.513 1.935 926 2HE LYS 126 HE1 LYS 126 -14.507 -11.023 1.149 927 1HZ LYS 126 HZ1 LYS 126 -16.477 -12.959 0.052 928 2HZ LYS 126 HZ2 LYS 126 -15.033 -12.494 -0.706 929 3HZ LYS 126 HZ3 LYS 126 -16.272 -11.359 -0.467 930 H GLN 127 HN GLN 127 -10.729 -11.374 3.404 931 HA GLN 127 HA GLN 127 -9.742 -10.458 1.613 932 1HB GLN 127 HB2 GLN 127 -9.336 -13.353 0.926 933 2HB GLN 127 HB1 GLN 127 -8.829 -12.075 -0.172 934 1HG GLN 127 HG2 GLN 127 -7.377 -11.142 1.513 935 2HG GLN 127 HG1 GLN 127 -7.943 -12.323 2.694 936 1HE2 GLN 127 HE21 GLN 127 -7.240 -14.447 2.560 937 2HE2 GLN 127 HE22 GLN 127 -5.886 -14.914 1.586 938 H GLY 128 HN GLY 128 -12.111 -9.811 1.441 939 1HA GLY 128 HA2 GLY 128 -13.239 -10.676 -1.103 940 2HA GLY 128 HA1 GLY 128 -14.002 -9.593 0.058 941 H PHE 129 HN PHE 129 -10.761 -9.463 -1.333 942 HA PHE 129 HA PHE 129 -11.087 -6.620 -1.731 943 1HB PHE 129 HB2 PHE 129 -8.696 -6.633 -2.254 944 2HB PHE 129 HB1 PHE 129 -8.993 -7.560 -0.793 945 HD1 PHE 129 HD1 PHE 129 -8.922 -10.048 -0.881 946 HD2 PHE 129 HD2 PHE 129 -7.716 -7.624 -4.166 947 HE1 PHE 129 HE1 PHE 129 -7.724 -11.964 -1.850 948 HE2 PHE 129 HE2 PHE 129 -6.514 -9.539 -5.138 949 HZ PHE 129 HZ PHE 129 -6.494 -11.699 -3.981 950 H THR 130 HN THR 130 -10.866 -5.545 -3.740 951 HA THR 130 HA THR 130 -10.597 -7.161 -6.154 952 HB THR 130 HB THR 130 -12.920 -5.265 -5.745 953 HG1 THR 130 HG1 THR 130 -12.643 -7.856 -5.144 954 1HG2 THR 130 HG21 THR 130 -12.076 -5.246 -8.047 955 2HG2 THR 130 HG22 THR 130 -13.658 -6.022 -7.954 956 3HG2 THR 130 HG23 THR 130 -12.201 -7.004 -8.109 957 HA PRO 131 HA PRO 131 -8.159 -3.516 -7.123 958 1HB PRO 131 HB2 PRO 131 -7.706 -4.821 -9.700 959 2HB PRO 131 HB1 PRO 131 -6.545 -4.452 -8.421 960 1HG PRO 131 HG2 PRO 131 -7.304 -6.979 -9.020 961 2HG PRO 131 HG1 PRO 131 -6.850 -6.479 -7.382 962 1HD PRO 131 HD2 PRO 131 -9.579 -6.863 -8.562 963 2HD PRO 131 HD1 PRO 131 -8.970 -7.327 -6.956 964 H SER 132 HN SER 132 -9.278 -1.739 -7.669 965 HA SER 132 HA SER 132 -10.581 -1.591 -10.251 966 1HB SER 132 HB2 SER 132 -12.718 -0.742 -9.154 967 2HB SER 132 HB1 SER 132 -12.409 -2.470 -8.993 968 HG SER 132 HG SER 132 -12.125 -0.422 -7.068 969 H GLY 133 HN GLY 133 -10.217 0.346 -11.121 970 1HA GLY 133 HA2 GLY 133 -10.439 2.785 -10.830 971 2HA GLY 133 HA1 GLY 133 -9.612 2.583 -9.293 972 H THR 134 HN THR 134 -7.514 3.003 -9.271 973 HA THR 134 HA THR 134 -6.001 2.699 -11.780 974 HB THR 134 HB THR 134 -5.611 4.976 -9.834 975 HG1 THR 134 HG1 THR 134 -7.505 4.634 -11.743 976 1HG2 THR 134 HG21 THR 134 -4.322 5.965 -11.676 977 2HG2 THR 134 HG22 THR 134 -4.609 4.521 -12.647 978 3HG2 THR 134 HG23 THR 134 -3.646 4.415 -11.174 979 H THR 135 HN THR 135 -4.056 1.713 -11.567 980 HA THR 135 HA THR 135 -3.208 0.991 -8.856 981 HB THR 135 HB THR 135 -3.531 -0.870 -10.464 982 HG1 THR 135 HG1 THR 135 -1.797 -1.913 -9.715 983 1HG2 THR 135 HG21 THR 135 -1.231 0.382 -11.971 984 2HG2 THR 135 HG22 THR 135 -2.901 0.281 -12.528 985 3HG2 THR 135 HG23 THR 135 -1.956 -1.191 -12.308 986 H GLY 136 HN GLY 136 -1.162 1.499 -8.096 987 1HA GLY 136 HA2 GLY 136 0.388 3.341 -9.797 988 2HA GLY 136 HA1 GLY 136 -0.028 3.771 -8.143 989 H THR 137 HN THR 137 2.371 2.655 -10.038 990 HA THR 137 HA THR 137 3.524 0.704 -8.271 991 HB THR 137 HB THR 137 4.987 2.257 -10.407 992 HG1 THR 137 HG1 THR 137 3.206 1.440 -11.453 993 1HG2 THR 137 HG21 THR 137 5.320 -0.553 -9.348 994 2HG2 THR 137 HG22 THR 137 6.337 0.827 -8.934 995 3HG2 THR 137 HG23 THR 137 6.315 0.212 -10.589 996 H THR 138 HN THR 138 4.044 1.456 -6.271 997 HA THR 138 HA THR 138 5.171 4.078 -5.910 998 HB THR 138 HB THR 138 4.978 1.794 -3.930 999 HG1 THR 138 HG1 THR 138 3.029 3.104 -5.028 1000 1HG2 THR 138 HG21 THR 138 5.180 3.567 -2.239 1001 2HG2 THR 138 HG22 THR 138 5.392 4.760 -3.523 1002 3HG2 THR 138 HG23 THR 138 6.604 3.502 -3.278 1003 H LYS 139 HN LYS 139 7.161 4.426 -6.620 1004 HA LYS 139 HA LYS 139 9.100 2.239 -6.513 1005 1HB LYS 139 HB2 LYS 139 8.733 3.368 -8.669 1006 2HB LYS 139 HB1 LYS 139 9.227 4.889 -7.952 1007 1HG LYS 139 HG2 LYS 139 11.117 4.175 -9.088 1008 2HG LYS 139 HG1 LYS 139 11.433 3.709 -7.416 1009 1HD LYS 139 HD2 LYS 139 12.047 1.923 -8.961 1010 2HD LYS 139 HD1 LYS 139 10.712 1.426 -7.920 1011 1HE LYS 139 HE2 LYS 139 9.139 1.629 -9.651 1012 2HE LYS 139 HE1 LYS 139 10.232 2.591 -10.644 1013 1HZ LYS 139 HZ1 LYS 139 9.961 0.258 -11.393 1014 2HZ LYS 139 HZ2 LYS 139 10.708 -0.262 -9.961 1015 3HZ LYS 139 HZ3 LYS 139 11.567 0.689 -11.071 1016 H LEU 140 HN LEU 140 10.248 2.129 -4.800 1017 HA LEU 140 HA LEU 140 11.089 4.571 -3.426 1018 1HB LEU 140 HB2 LEU 140 10.118 3.188 -1.844 1019 2HB LEU 140 HB1 LEU 140 10.694 1.722 -2.610 1020 HG LEU 140 HG LEU 140 12.965 2.211 -1.789 1021 1HD1 LEU 140 HD11 LEU 140 12.838 4.622 -1.639 1022 2HD1 LEU 140 HD12 LEU 140 13.279 3.930 -0.078 1023 3HD1 LEU 140 HD13 LEU 140 11.634 4.497 -0.357 1024 1HD2 LEU 140 HD21 LEU 140 10.844 2.169 0.349 1025 2HD2 LEU 140 HD22 LEU 140 12.531 1.700 0.557 1026 3HD2 LEU 140 HD23 LEU 140 11.480 0.766 -0.510 1027 H THR 141 HN THR 141 12.783 5.213 -4.697 1028 HA THR 141 HA THR 141 14.997 3.322 -5.062 1029 HB THR 141 HB THR 141 14.668 6.036 -6.361 1030 HG1 THR 141 HG1 THR 141 14.135 4.497 -8.225 1031 1HG2 THR 141 HG21 THR 141 16.951 5.147 -6.348 1032 2HG2 THR 141 HG22 THR 141 16.289 5.148 -7.983 1033 3HG2 THR 141 HG23 THR 141 16.377 3.642 -7.068 1034 H VAL 142 HN VAL 142 17.046 3.835 -4.230 1035 HA VAL 142 HA VAL 142 17.053 6.031 -2.300 1036 HB VAL 142 HB VAL 142 17.813 3.873 -1.471 1037 1HG1 VAL 142 HG11 VAL 142 19.930 2.885 -2.264 1038 2HG1 VAL 142 HG12 VAL 142 19.988 4.090 -3.552 1039 3HG1 VAL 142 HG13 VAL 142 18.682 2.903 -3.511 1040 1HG2 VAL 142 HG21 VAL 142 19.945 4.577 -0.488 1041 2HG2 VAL 142 HG22 VAL 142 18.754 5.876 -0.472 1042 3HG2 VAL 142 HG23 VAL 142 20.051 5.884 -1.666 1043 H THR 143 HN THR 143 18.278 7.815 -2.504 1044 HA THR 143 HA THR 143 20.300 7.946 -4.601 1045 HB THR 143 HB THR 143 18.080 9.995 -4.350 1046 HG1 THR 143 HG1 THR 143 18.129 7.676 -5.628 1047 1HG2 THR 143 HG21 THR 143 20.219 10.985 -5.020 1048 2HG2 THR 143 HG22 THR 143 19.075 10.988 -6.361 1049 3HG2 THR 143 HG23 THR 143 20.372 9.794 -6.312 Start of MODEL 12 1 H GLU 1 H GLU 1 -18.054 4.802 -11.306 2 HA GLU 1 HA GLU 1 -20.599 3.602 -12.231 3 1HB GLU 1 HB2 GLU 1 -17.764 2.555 -12.393 4 2HB GLU 1 HB1 GLU 1 -19.200 1.597 -12.726 5 1HG GLU 1 HG2 GLU 1 -19.765 3.059 -14.581 6 2HG GLU 1 HG1 GLU 1 -18.351 4.058 -14.238 7 H GLU 2 HN GLU 2 -17.772 2.353 -10.547 8 HA GLU 2 HA GLU 2 -19.491 1.623 -8.275 9 1HB GLU 2 HB2 GLU 2 -17.881 -0.258 -7.945 10 2HB GLU 2 HB1 GLU 2 -18.758 -0.346 -9.468 11 1HG GLU 2 HG2 GLU 2 -16.764 0.793 -10.517 12 2HG GLU 2 HG1 GLU 2 -15.908 0.470 -9.012 13 H CYS 3 HN CYS 3 -17.579 0.926 -6.439 14 HA CYS 3 HA CYS 3 -16.394 3.372 -5.612 15 1HB CYS 3 HB2 CYS 3 -16.997 1.608 -4.012 16 2HB CYS 3 HB1 CYS 3 -15.808 0.539 -4.741 17 H GLN 4 HN GLN 4 -15.178 4.111 -7.320 18 HA GLN 4 HA GLN 4 -13.016 2.444 -8.355 19 1HB GLN 4 HB2 GLN 4 -14.044 5.146 -9.229 20 2HB GLN 4 HB1 GLN 4 -12.811 4.208 -10.064 21 1HG GLN 4 HG2 GLN 4 -14.393 2.482 -10.573 22 2HG GLN 4 HG1 GLN 4 -15.623 3.267 -9.588 23 1HE2 GLN 4 HE21 GLN 4 -13.873 3.333 -12.586 24 2HE2 GLN 4 HE22 GLN 4 -14.904 4.476 -13.391 25 H VAL 5 HN VAL 5 -11.029 2.630 -7.589 26 HA VAL 5 HA VAL 5 -10.419 4.937 -5.891 27 HB VAL 5 HB VAL 5 -8.959 2.303 -6.102 28 1HG1 VAL 5 HG11 VAL 5 -7.531 4.111 -5.336 29 2HG1 VAL 5 HG12 VAL 5 -7.879 2.995 -4.016 30 3HG1 VAL 5 HG13 VAL 5 -8.714 4.546 -4.104 31 1HG2 VAL 5 HG21 VAL 5 -11.213 1.995 -5.228 32 2HG2 VAL 5 HG22 VAL 5 -10.932 3.257 -4.030 33 3HG2 VAL 5 HG23 VAL 5 -10.013 1.754 -3.961 34 H ARG 6 HN ARG 6 -9.339 6.504 -6.822 35 HA ARG 6 HA ARG 6 -7.702 6.067 -9.150 36 1HB ARG 6 HB2 ARG 6 -8.982 8.122 -8.978 37 2HB ARG 6 HB1 ARG 6 -8.195 8.526 -7.461 38 1HG ARG 6 HG2 ARG 6 -6.124 8.930 -8.545 39 2HG ARG 6 HG1 ARG 6 -6.710 8.245 -10.060 40 1HD ARG 6 HD2 ARG 6 -7.737 10.751 -8.732 41 2HD ARG 6 HD1 ARG 6 -6.676 10.687 -10.139 42 HE ARG 6 HE ARG 6 -8.713 9.281 -11.056 43 1HH1 ARG 6 HH11 ARG 6 -8.703 12.283 -9.249 44 2HH1 ARG 6 HH12 ARG 6 -10.218 12.831 -9.897 45 1HH2 ARG 6 HH21 ARG 6 -10.726 9.985 -11.905 46 2HH2 ARG 6 HH22 ARG 6 -11.373 11.525 -11.407 47 H VAL 7 HN VAL 7 -5.825 5.083 -8.884 48 HA VAL 7 HA VAL 7 -4.114 5.902 -6.625 49 HB VAL 7 HB VAL 7 -3.964 3.299 -8.162 50 1HG1 VAL 7 HG11 VAL 7 -2.464 2.598 -6.362 51 2HG1 VAL 7 HG12 VAL 7 -2.600 4.194 -5.625 52 3HG1 VAL 7 HG13 VAL 7 -1.837 4.013 -7.205 53 1HG2 VAL 7 HG21 VAL 7 -6.029 3.396 -6.871 54 2HG2 VAL 7 HG22 VAL 7 -5.116 3.831 -5.426 55 3HG2 VAL 7 HG23 VAL 7 -4.899 2.242 -6.163 56 H GLY 8 HN GLY 8 -2.381 7.039 -7.167 57 1HA GLY 8 HA2 GLY 8 -1.609 7.167 -9.986 58 2HA GLY 8 HA1 GLY 8 -1.145 8.307 -8.733 59 H ASP 9 HN ASP 9 0.756 7.458 -10.417 60 HA ASP 9 HA ASP 9 2.219 5.298 -9.086 61 1HB ASP 9 HB2 ASP 9 2.820 6.813 -11.635 62 2HB ASP 9 HB1 ASP 9 3.780 5.482 -11.000 63 H LEU 10 HN LEU 10 3.755 5.733 -7.649 64 HA LEU 10 HA LEU 10 4.691 8.511 -7.474 65 1HB LEU 10 HB2 LEU 10 4.542 6.356 -5.380 66 2HB LEU 10 HB1 LEU 10 5.302 7.914 -5.125 67 HG LEU 10 HG LEU 10 2.378 7.381 -5.630 68 1HD1 LEU 10 HD11 LEU 10 3.134 6.904 -3.370 69 2HD1 LEU 10 HD12 LEU 10 2.110 8.341 -3.400 70 3HD1 LEU 10 HD13 LEU 10 3.860 8.507 -3.263 71 1HD2 LEU 10 HD21 LEU 10 2.988 9.420 -6.789 72 2HD2 LEU 10 HD22 LEU 10 3.830 10.012 -5.358 73 3HD2 LEU 10 HD23 LEU 10 2.079 9.811 -5.329 74 H THR 11 HN THR 11 6.668 8.883 -8.170 75 HA THR 11 HA THR 11 8.720 6.822 -7.673 76 HB THR 11 HB THR 11 8.880 9.147 -9.611 77 HG1 THR 11 HG1 THR 11 7.395 7.629 -10.399 78 1HG2 THR 11 HG21 THR 11 10.673 6.746 -9.213 79 2HG2 THR 11 HG22 THR 11 11.053 8.408 -8.761 80 3HG2 THR 11 HG23 THR 11 10.864 7.977 -10.462 81 H VAL 12 HN VAL 12 9.852 7.250 -5.895 82 HA VAL 12 HA VAL 12 10.649 10.006 -5.314 83 HB VAL 12 HB VAL 12 9.478 8.276 -3.131 84 1HG1 VAL 12 HG11 VAL 12 11.037 9.987 -2.397 85 2HG1 VAL 12 HG12 VAL 12 9.398 10.401 -1.894 86 3HG1 VAL 12 HG13 VAL 12 10.130 11.220 -3.274 87 1HG2 VAL 12 HG21 VAL 12 7.673 8.767 -4.687 88 2HG2 VAL 12 HG22 VAL 12 8.076 10.483 -4.638 89 3HG2 VAL 12 HG23 VAL 12 7.468 9.678 -3.190 90 H ALA 13 HN ALA 13 12.542 10.149 -4.055 91 HA ALA 13 HA ALA 13 13.992 7.598 -3.810 92 1HB ALA 13 HB1 ALA 13 15.116 10.361 -4.248 93 2HB ALA 13 HB2 ALA 13 14.930 9.118 -5.485 94 3HB ALA 13 HB3 ALA 13 16.043 8.866 -4.140 95 H LYS 14 HN LYS 14 14.846 7.030 -1.907 96 HA LYS 14 HA LYS 14 15.780 8.708 0.105 97 1HB LYS 14 HB2 LYS 14 14.090 8.526 1.840 98 2HB LYS 14 HB1 LYS 14 13.388 9.310 0.438 99 1HG LYS 14 HG2 LYS 14 12.362 7.163 -0.214 100 2HG LYS 14 HG1 LYS 14 13.027 6.433 1.249 101 1HD LYS 14 HD2 LYS 14 10.797 7.003 1.770 102 2HD LYS 14 HD1 LYS 14 11.802 8.234 2.540 103 1HE LYS 14 HE2 LYS 14 10.036 9.410 1.527 104 2HE LYS 14 HE1 LYS 14 11.425 9.631 0.459 105 1HZ LYS 14 HZ1 LYS 14 9.306 7.600 0.046 106 2HZ LYS 14 HZ2 LYS 14 10.572 7.977 -1.012 107 3HZ LYS 14 HZ3 LYS 14 9.348 9.108 -0.716 108 H THR 15 HN THR 15 16.305 7.510 2.086 109 HA THR 15 HA THR 15 16.850 4.730 1.507 110 HB THR 15 HB THR 15 18.057 4.737 3.654 111 HG1 THR 15 HG1 THR 15 18.247 6.981 4.609 112 1HG2 THR 15 HG21 THR 15 18.691 7.117 1.908 113 2HG2 THR 15 HG22 THR 15 19.265 5.467 1.670 114 3HG2 THR 15 HG23 THR 15 19.793 6.391 3.077 115 H ARG 16 HN ARG 16 16.284 3.033 3.076 116 HA ARG 16 HA ARG 16 13.586 3.329 4.075 117 1HB ARG 16 HB2 ARG 16 15.526 1.018 4.312 118 2HB ARG 16 HB1 ARG 16 13.855 0.979 4.857 119 1HG ARG 16 HG2 ARG 16 13.652 -0.037 2.818 120 2HG ARG 16 HG1 ARG 16 13.339 1.640 2.379 121 1HD ARG 16 HD2 ARG 16 14.961 1.447 0.860 122 2HD ARG 16 HD1 ARG 16 16.099 1.374 2.202 123 HE ARG 16 HE ARG 16 14.988 -0.933 0.746 124 1HH1 ARG 16 HH11 ARG 16 17.371 0.514 2.838 125 2HH1 ARG 16 HH12 ARG 16 18.359 -0.913 2.929 126 1HH2 ARG 16 HH21 ARG 16 16.289 -2.865 0.909 127 2HH2 ARG 16 HH22 ARG 16 17.750 -2.810 1.850 128 H GLY 17 HN GLY 17 16.487 4.299 5.137 129 1HA GLY 17 HA2 GLY 17 15.953 3.840 7.972 130 2HA GLY 17 HA1 GLY 17 17.427 4.522 7.291 131 H GLN 18 HN GLN 18 15.666 6.214 5.501 132 HA GLN 18 HA GLN 18 15.319 8.498 7.169 133 1HB GLN 18 HB2 GLN 18 15.770 8.531 4.677 134 2HB GLN 18 HB1 GLN 18 14.110 8.003 4.436 135 1HG GLN 18 HG2 GLN 18 13.315 10.035 5.545 136 2HG GLN 18 HG1 GLN 18 14.981 10.562 5.750 137 1HE2 GLN 18 HE21 GLN 18 12.363 10.163 3.551 138 2HE2 GLN 18 HE22 GLN 18 13.075 11.010 2.219 139 H LEU 19 HN LEU 19 13.430 5.808 6.214 140 HA LEU 19 HA LEU 19 10.949 6.830 7.309 141 1HB LEU 19 HB2 LEU 19 11.648 4.010 6.486 142 2HB LEU 19 HB1 LEU 19 10.041 4.659 6.750 143 HG LEU 19 HG LEU 19 11.890 5.528 4.525 144 1HD1 LEU 19 HD11 LEU 19 10.394 4.267 3.057 145 2HD1 LEU 19 HD12 LEU 19 9.504 3.681 4.464 146 3HD1 LEU 19 HD13 LEU 19 11.190 3.215 4.227 147 1HD2 LEU 19 HD21 LEU 19 9.917 6.641 3.633 148 2HD2 LEU 19 HD22 LEU 19 10.291 7.243 5.249 149 3HD2 LEU 19 HD23 LEU 19 8.968 6.101 5.018 150 H THR 20 HN THR 20 10.615 6.812 9.440 151 HA THR 20 HA THR 20 12.208 4.979 11.088 152 HB THR 20 HB THR 20 11.802 6.679 12.924 153 HG1 THR 20 HG1 THR 20 10.107 7.867 12.024 154 1HG2 THR 20 HG21 THR 20 13.944 6.516 11.767 155 2HG2 THR 20 HG22 THR 20 13.558 8.200 12.122 156 3HG2 THR 20 HG23 THR 20 13.346 7.573 10.487 157 H ASP 21 HN ASP 21 10.578 3.386 10.729 158 HA ASP 21 HA ASP 21 8.770 2.135 11.225 159 1HB ASP 21 HB2 ASP 21 9.413 2.405 13.552 160 2HB ASP 21 HB1 ASP 21 8.577 3.954 13.632 161 H ALA 22 HN ALA 22 7.435 5.094 12.605 162 HA ALA 22 HA ALA 22 5.340 4.984 10.552 163 1HB ALA 22 HB1 ALA 22 4.543 4.674 12.860 164 2HB ALA 22 HB2 ALA 22 3.882 6.129 12.113 165 3HB ALA 22 HB3 ALA 22 5.195 6.257 13.284 166 H ALA 23 HN ALA 23 6.629 6.108 9.077 167 HA ALA 23 HA ALA 23 6.312 8.986 9.358 168 1HB ALA 23 HB1 ALA 23 8.946 7.730 8.571 169 2HB ALA 23 HB2 ALA 23 8.622 8.606 10.067 170 3HB ALA 23 HB3 ALA 23 8.570 9.453 8.521 171 HA PRO 24 HA PRO 24 4.840 7.331 5.347 172 1HB PRO 24 HB2 PRO 24 2.792 9.075 5.077 173 2HB PRO 24 HB1 PRO 24 2.683 7.620 6.080 174 1HG PRO 24 HG2 PRO 24 3.274 10.439 6.920 175 2HG PRO 24 HG1 PRO 24 2.139 9.278 7.637 176 1HD PRO 24 HD2 PRO 24 4.579 9.691 8.689 177 2HD PRO 24 HD1 PRO 24 3.823 8.080 8.679 178 H ILE 25 HN ILE 25 6.657 8.018 4.214 179 HA ILE 25 HA ILE 25 6.588 10.818 3.298 180 HB ILE 25 HB ILE 25 9.006 9.051 3.031 181 1HG1 ILE 25 HG12 ILE 25 8.212 10.743 5.407 182 2HG1 ILE 25 HG11 ILE 25 8.322 8.986 5.388 183 1HG2 ILE 25 HG21 ILE 25 10.164 11.219 3.080 184 2HG2 ILE 25 HG22 ILE 25 8.619 12.040 3.306 185 3HG2 ILE 25 HG23 ILE 25 8.947 11.178 1.802 186 1HD1 ILE 25 HD11 ILE 25 10.721 9.130 5.011 187 2HD1 ILE 25 HD12 ILE 25 10.257 10.003 6.470 188 3HD1 ILE 25 HD13 ILE 25 10.622 10.891 4.992 189 H GLY 26 HN GLY 26 5.202 8.308 2.346 190 1HA GLY 26 HA2 GLY 26 5.600 9.073 -0.455 191 2HA GLY 26 HA1 GLY 26 5.521 7.362 -0.055 192 HA PRO 27 HA PRO 27 1.109 8.989 1.224 193 1HB PRO 27 HB2 PRO 27 1.256 11.769 0.210 194 2HB PRO 27 HB1 PRO 27 0.453 11.126 1.648 195 1HG PRO 27 HG2 PRO 27 2.736 12.506 1.834 196 2HG PRO 27 HG1 PRO 27 2.399 11.124 2.894 197 1HD PRO 27 HD2 PRO 27 4.213 11.300 0.534 198 2HD PRO 27 HD1 PRO 27 4.389 10.370 2.028 199 H VAL 28 HN VAL 28 0.096 7.854 -0.254 200 HA VAL 28 HA VAL 28 0.140 8.599 -3.064 201 HB VAL 28 HB VAL 28 -1.459 6.387 -1.758 202 1HG1 VAL 28 HG11 VAL 28 -0.570 6.793 -4.611 203 2HG1 VAL 28 HG12 VAL 28 -2.205 7.018 -3.990 204 3HG1 VAL 28 HG13 VAL 28 -1.479 5.410 -3.999 205 1HG2 VAL 28 HG21 VAL 28 1.315 6.246 -2.934 206 2HG2 VAL 28 HG22 VAL 28 0.345 4.859 -2.439 207 3HG2 VAL 28 HG23 VAL 28 0.882 6.033 -1.237 208 H THR 29 HN THR 29 -1.431 9.769 -4.019 209 HA THR 29 HA THR 29 -3.550 10.839 -2.423 210 HB THR 29 HB THR 29 -4.222 11.839 -4.732 211 HG1 THR 29 HG1 THR 29 -2.932 11.390 -6.352 212 1HG2 THR 29 HG21 THR 29 -3.183 13.114 -2.921 213 2HG2 THR 29 HG22 THR 29 -2.520 13.591 -4.483 214 3HG2 THR 29 HG23 THR 29 -1.592 12.537 -3.416 215 H VAL 30 HN VAL 30 -4.851 9.131 -1.846 216 HA VAL 30 HA VAL 30 -5.944 7.382 -3.909 217 HB VAL 30 HB VAL 30 -6.357 7.339 -0.915 218 1HG1 VAL 30 HG11 VAL 30 -7.015 5.263 -3.001 219 2HG1 VAL 30 HG12 VAL 30 -8.178 6.266 -2.136 220 3HG1 VAL 30 HG13 VAL 30 -7.214 5.080 -1.258 221 1HG2 VAL 30 HG21 VAL 30 -4.784 5.466 -0.910 222 2HG2 VAL 30 HG22 VAL 30 -4.028 6.938 -1.521 223 3HG2 VAL 30 HG23 VAL 30 -4.529 5.673 -2.643 224 H GLN 31 HN GLN 31 -7.716 7.999 -4.908 225 HA GLN 31 HA GLN 31 -9.717 9.536 -3.407 226 1HB GLN 31 HB2 GLN 31 -8.772 10.830 -5.238 227 2HB GLN 31 HB1 GLN 31 -9.152 9.543 -6.375 228 1HG GLN 31 HG2 GLN 31 -11.499 9.907 -6.100 229 2HG GLN 31 HG1 GLN 31 -11.213 11.049 -4.786 230 1HE2 GLN 31 HE21 GLN 31 -12.605 11.392 -7.350 231 2HE2 GLN 31 HE22 GLN 31 -11.821 12.722 -8.130 232 H ALA 32 HN ALA 32 -11.356 8.325 -2.826 233 HA ALA 32 HA ALA 32 -12.029 5.933 -4.364 234 1HB ALA 32 HB1 ALA 32 -13.347 5.292 -2.397 235 2HB ALA 32 HB2 ALA 32 -12.934 6.824 -1.627 236 3HB ALA 32 HB3 ALA 32 -11.672 5.642 -1.971 237 H LEU 33 HN LEU 33 -13.325 6.437 -6.008 238 HA LEU 33 HA LEU 33 -15.370 8.507 -5.674 239 1HB LEU 33 HB2 LEU 33 -13.625 8.164 -7.657 240 2HB LEU 33 HB1 LEU 33 -14.864 7.088 -8.251 241 HG LEU 33 HG LEU 33 -15.401 9.983 -7.585 242 1HD1 LEU 33 HD11 LEU 33 -15.246 10.421 -9.980 243 2HD1 LEU 33 HD12 LEU 33 -14.737 8.754 -10.259 244 3HD1 LEU 33 HD13 LEU 33 -13.707 9.850 -9.339 245 1HD2 LEU 33 HD21 LEU 33 -17.367 9.650 -9.005 246 2HD2 LEU 33 HD22 LEU 33 -17.372 8.541 -7.632 247 3HD2 LEU 33 HD23 LEU 33 -16.917 7.959 -9.236 248 H GLY 34 HN GLY 34 -17.417 7.953 -5.283 249 1HA GLY 34 HA2 GLY 34 -19.454 6.956 -5.668 250 2HA GLY 34 HA1 GLY 34 -18.691 6.006 -6.928 251 H CYS 35 HN CYS 35 -17.471 5.875 -3.661 252 HA CYS 35 HA CYS 35 -18.126 3.071 -3.528 253 1HB CYS 35 HB2 CYS 35 -16.921 4.803 -1.364 254 2HB CYS 35 HB1 CYS 35 -16.850 3.046 -1.485 255 H ASN 36 HN ASN 36 -18.673 5.660 -1.157 256 HA ASN 36 HA ASN 36 -20.447 6.358 0.021 257 1HB ASN 36 HB2 ASN 36 -21.942 4.861 -2.110 258 2HB ASN 36 HB1 ASN 36 -22.756 5.777 -0.847 259 1HD2 ASN 36 HD21 ASN 36 -23.647 7.297 -2.213 260 2HD2 ASN 36 HD22 ASN 36 -22.698 8.477 -3.061 261 H ALA 37 HN ALA 37 -20.766 2.864 -0.674 262 HA ALA 37 HA ALA 37 -21.410 2.492 2.174 263 1HB ALA 37 HB1 ALA 37 -23.187 0.924 1.629 264 2HB ALA 37 HB2 ALA 37 -22.915 1.192 -0.093 265 3HB ALA 37 HB3 ALA 37 -23.515 2.506 0.920 266 H ARG 38 HN ARG 38 -18.954 2.017 0.618 267 HA ARG 38 HA ARG 38 -18.692 -0.876 1.100 268 1HB ARG 38 HB2 ARG 38 -18.933 -0.247 -1.367 269 2HB ARG 38 HB1 ARG 38 -17.376 0.553 -1.209 270 1HG ARG 38 HG2 ARG 38 -16.916 -1.545 -2.144 271 2HG ARG 38 HG1 ARG 38 -16.454 -1.681 -0.447 272 1HD ARG 38 HD2 ARG 38 -19.144 -2.555 -1.476 273 2HD ARG 38 HD1 ARG 38 -17.749 -3.629 -1.463 274 HE ARG 38 HE ARG 38 -17.781 -2.969 1.071 275 1HH1 ARG 38 HH11 ARG 38 -20.497 -3.721 -1.015 276 2HH1 ARG 38 HH12 ARG 38 -21.486 -4.317 0.291 277 1HH2 ARG 38 HH21 ARG 38 -19.077 -3.767 2.776 278 2HH2 ARG 38 HH22 ARG 38 -20.685 -4.332 2.433 279 H GLN 39 HN GLN 39 -16.452 -1.545 1.528 280 HA GLN 39 HA GLN 39 -14.830 0.563 2.704 281 1HB GLN 39 HB2 GLN 39 -13.340 -1.665 3.063 282 2HB GLN 39 HB1 GLN 39 -14.595 -1.147 4.179 283 1HG GLN 39 HG2 GLN 39 -15.349 -2.931 1.925 284 2HG GLN 39 HG1 GLN 39 -14.474 -3.615 3.295 285 1HE2 GLN 39 HE21 GLN 39 -15.596 -1.815 5.222 286 2HE2 GLN 39 HE22 GLN 39 -17.231 -2.318 5.482 287 H VAL 40 HN VAL 40 -12.876 1.180 1.928 288 HA VAL 40 HA VAL 40 -12.137 0.281 -0.746 289 HB VAL 40 HB VAL 40 -10.968 2.515 0.934 290 1HG1 VAL 40 HG11 VAL 40 -10.009 3.309 -1.179 291 2HG1 VAL 40 HG12 VAL 40 -10.637 1.878 -1.995 292 3HG1 VAL 40 HG13 VAL 40 -9.408 1.711 -0.739 293 1HG2 VAL 40 HG21 VAL 40 -12.250 4.039 -0.484 294 2HG2 VAL 40 HG22 VAL 40 -13.308 2.948 0.412 295 3HG2 VAL 40 HG23 VAL 40 -12.991 2.660 -1.299 296 H ALA 41 HN ALA 41 -10.227 -0.845 -1.136 297 HA ALA 41 HA ALA 41 -8.647 -1.566 1.216 298 1HB ALA 41 HB1 ALA 41 -9.591 -3.427 -0.958 299 2HB ALA 41 HB2 ALA 41 -10.178 -3.389 0.707 300 3HB ALA 41 HB3 ALA 41 -8.508 -3.856 0.370 301 H LEU 42 HN LEU 42 -6.521 -1.505 0.941 302 HA LEU 42 HA LEU 42 -5.477 -0.939 -1.746 303 1HB LEU 42 HB2 LEU 42 -3.929 -0.738 0.824 304 2HB LEU 42 HB1 LEU 42 -3.644 0.099 -0.694 305 HG LEU 42 HG LEU 42 -6.059 0.600 1.008 306 1HD1 LEU 42 HD11 LEU 42 -4.900 2.606 1.828 307 2HD1 LEU 42 HD12 LEU 42 -3.432 2.082 1.003 308 3HD1 LEU 42 HD13 LEU 42 -4.088 1.126 2.332 309 1HD2 LEU 42 HD21 LEU 42 -6.211 2.662 -0.274 310 2HD2 LEU 42 HD22 LEU 42 -6.214 1.261 -1.348 311 3HD2 LEU 42 HD23 LEU 42 -4.751 2.229 -1.165 312 H LYS 43 HN LYS 43 -4.960 -2.790 -2.736 313 HA LYS 43 HA LYS 43 -3.583 -4.868 -1.170 314 1HB LYS 43 HB2 LYS 43 -5.029 -5.160 -3.818 315 2HB LYS 43 HB1 LYS 43 -4.201 -6.442 -2.962 316 1HG LYS 43 HG2 LYS 43 -6.491 -6.764 -2.557 317 2HG LYS 43 HG1 LYS 43 -5.822 -6.094 -1.071 318 1HD LYS 43 HD2 LYS 43 -8.045 -5.149 -1.792 319 2HD LYS 43 HD1 LYS 43 -6.775 -3.959 -1.503 320 1HE LYS 43 HE2 LYS 43 -6.419 -3.640 -3.808 321 2HE LYS 43 HE1 LYS 43 -7.378 -5.060 -4.232 322 1HZ LYS 43 HZ1 LYS 43 -9.349 -3.883 -3.431 323 2HZ LYS 43 HZ2 LYS 43 -8.580 -3.015 -4.664 324 3HZ LYS 43 HZ3 LYS 43 -8.404 -2.530 -3.049 325 H ALA 44 HN ALA 44 -1.496 -5.128 -1.582 326 HA ALA 44 HA ALA 44 -0.218 -3.559 -3.593 327 1HB ALA 44 HB1 ALA 44 0.908 -3.988 -1.510 328 2HB ALA 44 HB2 ALA 44 1.835 -4.698 -2.831 329 3HB ALA 44 HB3 ALA 44 0.846 -5.726 -1.795 330 H ASP 45 HN ASP 45 1.118 -4.419 -5.302 331 HA ASP 45 HA ASP 45 -0.285 -6.374 -6.844 332 1HB ASP 45 HB2 ASP 45 0.850 -4.471 -7.901 333 2HB ASP 45 HB1 ASP 45 2.403 -5.063 -7.320 334 H THR 46 HN THR 46 0.512 -8.406 -7.558 335 HA THR 46 HA THR 46 1.368 -9.963 -5.392 336 HB THR 46 HB THR 46 -0.102 -10.787 -7.195 337 HG1 THR 46 HG1 THR 46 2.213 -12.159 -6.378 338 1HG2 THR 46 HG21 THR 46 2.433 -10.875 -8.836 339 2HG2 THR 46 HG22 THR 46 1.051 -9.818 -9.118 340 3HG2 THR 46 HG23 THR 46 0.879 -11.562 -9.307 341 H ASP 47 HN ASP 47 3.298 -8.114 -7.435 342 HA ASP 47 HA ASP 47 5.581 -9.865 -7.425 343 1HB ASP 47 HB2 ASP 47 5.123 -8.035 -9.133 344 2HB ASP 47 HB1 ASP 47 5.609 -6.884 -7.892 345 H ASN 48 HN ASN 48 4.248 -7.413 -5.369 346 HA ASN 48 HA ASN 48 6.482 -7.790 -3.481 347 1HB ASN 48 HB2 ASN 48 6.202 -5.475 -2.724 348 2HB ASN 48 HB1 ASN 48 6.540 -5.488 -4.449 349 1HD2 ASN 48 HD21 ASN 48 4.342 -4.639 -1.993 350 2HD2 ASN 48 HD22 ASN 48 3.141 -3.917 -3.007 351 H PHE 49 HN PHE 49 3.806 -9.058 -3.923 352 HA PHE 49 HA PHE 49 2.676 -8.720 -1.230 353 1HB PHE 49 HB2 PHE 49 1.321 -7.348 -2.684 354 2HB PHE 49 HB1 PHE 49 1.197 -8.633 -3.863 355 HD1 PHE 49 HD1 PHE 49 0.186 -7.627 -0.451 356 HD2 PHE 49 HD2 PHE 49 -0.591 -10.133 -3.800 357 HE1 PHE 49 HE1 PHE 49 -1.899 -8.389 0.609 358 HE2 PHE 49 HE2 PHE 49 -2.682 -10.886 -2.751 359 HZ PHE 49 HZ PHE 49 -3.508 -9.773 -0.736 360 H GLU 50 HN GLU 50 3.029 -10.678 -0.375 361 HA GLU 50 HA GLU 50 2.713 -13.047 -2.083 362 1HB GLU 50 HB2 GLU 50 4.075 -12.753 0.600 363 2HB GLU 50 HB1 GLU 50 3.993 -14.237 -0.341 364 1HG GLU 50 HG2 GLU 50 5.365 -11.686 -1.154 365 2HG GLU 50 HG1 GLU 50 6.145 -13.170 -0.606 366 H GLN 51 HN GLN 51 0.572 -13.451 -2.041 367 HA GLN 51 HA GLN 51 -1.371 -14.365 -1.338 368 1HB GLN 51 HB2 GLN 51 -0.031 -16.026 -0.163 369 2HB GLN 51 HB1 GLN 51 0.143 -14.946 1.213 370 1HG GLN 51 HG2 GLN 51 -1.517 -16.685 1.624 371 2HG GLN 51 HG1 GLN 51 -2.233 -15.075 1.656 372 1HE2 GLN 51 HE21 GLN 51 -4.289 -15.822 1.224 373 2HE2 GLN 51 HE22 GLN 51 -4.754 -16.419 -0.337 374 H GLY 52 HN GLY 52 0.069 -12.491 1.317 375 1HA GLY 52 HA2 GLY 52 -1.972 -10.545 1.306 376 2HA GLY 52 HA1 GLY 52 -2.291 -11.722 2.580 377 H LYS 53 HN LYS 53 0.886 -10.751 1.481 378 HA LYS 53 HA LYS 53 1.208 -8.918 3.746 379 1HB LYS 53 HB2 LYS 53 3.362 -10.883 2.944 380 2HB LYS 53 HB1 LYS 53 3.340 -9.837 4.348 381 1HG LYS 53 HG2 LYS 53 1.302 -12.003 4.016 382 2HG LYS 53 HG1 LYS 53 2.906 -12.348 4.662 383 1HD LYS 53 HD2 LYS 53 1.122 -10.203 5.781 384 2HD LYS 53 HD1 LYS 53 1.087 -11.871 6.357 385 1HE LYS 53 HE2 LYS 53 3.571 -10.168 6.282 386 2HE LYS 53 HE1 LYS 53 2.533 -10.325 7.698 387 1HZ LYS 53 HZ1 LYS 53 4.500 -11.827 7.680 388 2HZ LYS 53 HZ2 LYS 53 3.822 -12.635 6.355 389 3HZ LYS 53 HZ3 LYS 53 3.016 -12.631 7.842 390 H PHE 54 HN PHE 54 2.239 -7.044 3.065 391 HA PHE 54 HA PHE 54 3.492 -7.198 0.422 392 1HB PHE 54 HB2 PHE 54 2.894 -4.736 0.181 393 2HB PHE 54 HB1 PHE 54 1.602 -5.908 0.011 394 HD1 PHE 54 HD1 PHE 54 -0.346 -4.891 0.633 395 HD2 PHE 54 HD2 PHE 54 3.106 -4.312 3.050 396 HE1 PHE 54 HE1 PHE 54 -1.703 -3.617 2.251 397 HE2 PHE 54 HE2 PHE 54 1.756 -3.051 4.676 398 HZ PHE 54 HZ PHE 54 -0.646 -2.702 4.279 399 H PHE 55 HN PHE 55 5.272 -6.029 -0.032 400 HA PHE 55 HA PHE 55 6.657 -4.577 2.071 401 1HB PHE 55 HB2 PHE 55 8.746 -6.008 1.544 402 2HB PHE 55 HB1 PHE 55 7.546 -6.692 2.625 403 HD1 PHE 55 HD1 PHE 55 8.856 -6.760 -0.823 404 HD2 PHE 55 HD2 PHE 55 6.384 -8.680 2.060 405 HE1 PHE 55 HE1 PHE 55 8.699 -8.736 -2.279 406 HE2 PHE 55 HE2 PHE 55 6.219 -10.659 0.606 407 HZ PHE 55 HZ PHE 55 7.356 -10.666 -1.594 408 H LEU 56 HN LEU 56 8.915 -3.933 1.105 409 HA LEU 56 HA LEU 56 8.529 -3.054 -1.647 410 1HB LEU 56 HB2 LEU 56 11.004 -2.689 0.045 411 2HB LEU 56 HB1 LEU 56 10.590 -1.834 -1.421 412 HG LEU 56 HG LEU 56 10.090 -0.197 0.028 413 1HD1 LEU 56 HD11 LEU 56 7.950 -0.688 -0.962 414 2HD1 LEU 56 HD12 LEU 56 7.739 -0.141 0.703 415 3HD1 LEU 56 HD13 LEU 56 7.601 -1.856 0.313 416 1HD2 LEU 56 HD21 LEU 56 9.491 -0.510 2.366 417 2HD2 LEU 56 HD22 LEU 56 10.963 -1.383 1.947 418 3HD2 LEU 56 HD23 LEU 56 9.440 -2.254 2.122 419 H ILE 57 HN ILE 57 9.168 -4.331 -3.303 420 HA ILE 57 HA ILE 57 11.239 -6.332 -2.705 421 HB ILE 57 HB ILE 57 9.147 -7.333 -3.492 422 1HG1 ILE 57 HG12 ILE 57 10.082 -8.653 -5.374 423 2HG1 ILE 57 HG11 ILE 57 11.404 -7.497 -5.498 424 1HG2 ILE 57 HG21 ILE 57 8.354 -6.997 -5.784 425 2HG2 ILE 57 HG22 ILE 57 9.562 -5.730 -6.008 426 3HG2 ILE 57 HG23 ILE 57 8.268 -5.516 -4.829 427 1HD1 ILE 57 HD11 ILE 57 10.795 -9.218 -3.108 428 2HD1 ILE 57 HD12 ILE 57 12.133 -8.079 -3.253 429 3HD1 ILE 57 HD13 ILE 57 12.066 -9.502 -4.293 430 H SER 58 HN SER 58 13.188 -5.881 -3.410 431 HA SER 58 HA SER 58 13.638 -3.620 -5.086 432 1HB SER 58 HB2 SER 58 15.189 -4.317 -3.240 433 2HB SER 58 HB1 SER 58 15.644 -5.716 -4.211 434 HG SER 58 HG SER 58 15.822 -3.097 -5.261 435 H ASP 59 HN ASP 59 14.408 -3.545 -7.171 436 HA ASP 59 HA ASP 59 13.794 -5.674 -8.937 437 1HB ASP 59 HB2 ASP 59 15.563 -3.255 -9.398 438 2HB ASP 59 HB1 ASP 59 14.908 -4.298 -10.655 439 H ASN 60 HN ASN 60 16.305 -5.205 -6.808 440 HA ASN 60 HA ASN 60 18.215 -6.866 -8.268 441 1HB ASN 60 HB2 ASN 60 18.439 -5.629 -5.510 442 2HB ASN 60 HB1 ASN 60 19.736 -6.408 -6.409 443 1HD2 ASN 60 HD21 ASN 60 17.786 -3.569 -6.070 444 2HD2 ASN 60 HD22 ASN 60 18.686 -2.566 -7.168 445 H ASN 61 HN ASN 61 15.547 -7.272 -6.435 446 HA ASN 61 HA ASN 61 14.627 -8.839 -5.091 447 1HB ASN 61 HB2 ASN 61 14.647 -11.053 -5.992 448 2HB ASN 61 HB1 ASN 61 14.709 -9.917 -7.329 449 1HD2 ASN 61 HD21 ASN 61 16.377 -12.390 -5.583 450 2HD2 ASN 61 HD22 ASN 61 17.681 -12.599 -6.701 451 H ARG 62 HN ARG 62 17.189 -7.861 -4.021 452 HA ARG 62 HA ARG 62 18.372 -10.197 -2.782 453 1HB ARG 62 HB2 ARG 62 18.965 -7.253 -2.468 454 2HB ARG 62 HB1 ARG 62 19.841 -8.531 -1.636 455 1HG ARG 62 HG2 ARG 62 20.580 -9.437 -3.764 456 2HG ARG 62 HG1 ARG 62 19.670 -8.191 -4.620 457 1HD ARG 62 HD2 ARG 62 21.033 -6.466 -3.509 458 2HD ARG 62 HD1 ARG 62 21.971 -7.738 -2.726 459 HE ARG 62 HE ARG 62 22.350 -8.439 -5.217 460 1HH1 ARG 62 HH11 ARG 62 22.339 -5.228 -3.847 461 2HH1 ARG 62 HH12 ARG 62 23.409 -4.562 -5.041 462 1HH2 ARG 62 HH21 ARG 62 23.758 -7.598 -6.801 463 2HH2 ARG 62 HH22 ARG 62 24.215 -5.916 -6.735 464 H ASP 63 HN ASP 63 16.700 -7.260 -1.659 465 HA ASP 63 HA ASP 63 16.039 -8.711 0.824 466 1HB ASP 63 HB2 ASP 63 16.580 -5.743 0.650 467 2HB ASP 63 HB1 ASP 63 16.373 -6.709 2.107 468 H LYS 64 HN LYS 64 14.122 -7.959 1.916 469 HA LYS 64 HA LYS 64 12.313 -6.254 0.408 470 1HB LYS 64 HB2 LYS 64 10.465 -7.863 0.505 471 2HB LYS 64 HB1 LYS 64 11.805 -8.496 -0.436 472 1HG LYS 64 HG2 LYS 64 11.330 -10.351 0.763 473 2HG LYS 64 HG1 LYS 64 12.421 -9.586 1.918 474 1HD LYS 64 HD2 LYS 64 10.501 -8.632 3.103 475 2HD LYS 64 HD1 LYS 64 9.410 -9.377 1.935 476 1HE LYS 64 HE2 LYS 64 11.278 -10.839 3.798 477 2HE LYS 64 HE1 LYS 64 9.536 -10.667 4.008 478 1HZ LYS 64 HZ1 LYS 64 9.974 -12.792 3.073 479 2HZ LYS 64 HZ2 LYS 64 10.945 -12.139 1.846 480 3HZ LYS 64 HZ3 LYS 64 9.276 -11.849 1.853 481 H LEU 65 HN LEU 65 11.024 -5.039 1.730 482 HA LEU 65 HA LEU 65 11.161 -5.613 4.613 483 1HB LEU 65 HB2 LEU 65 11.479 -2.881 3.363 484 2HB LEU 65 HB1 LEU 65 11.426 -3.219 5.074 485 HG LEU 65 HG LEU 65 13.653 -2.838 4.650 486 1HD1 LEU 65 HD11 LEU 65 13.317 -5.820 4.473 487 2HD1 LEU 65 HD12 LEU 65 13.403 -4.850 5.943 488 3HD1 LEU 65 HD13 LEU 65 14.814 -4.987 4.893 489 1HD2 LEU 65 HD21 LEU 65 14.922 -3.792 2.777 490 2HD2 LEU 65 HD22 LEU 65 13.585 -2.779 2.236 491 3HD2 LEU 65 HD23 LEU 65 13.443 -4.535 2.171 492 H TYR 66 HN TYR 66 9.251 -5.341 5.664 493 HA TYR 66 HA TYR 66 6.920 -4.948 4.048 494 1HB TYR 66 HB2 TYR 66 7.168 -5.283 7.046 495 2HB TYR 66 HB1 TYR 66 5.673 -5.388 6.121 496 HD1 TYR 66 HD1 TYR 66 8.936 -7.043 6.744 497 HD2 TYR 66 HD2 TYR 66 5.067 -7.372 4.990 498 HE1 TYR 66 HE1 TYR 66 9.296 -9.451 6.408 499 HE2 TYR 66 HE2 TYR 66 5.416 -9.781 4.659 500 HH TYR 66 HH TYR 66 7.229 -11.362 4.444 501 H VAL 67 HN VAL 67 5.592 -3.241 3.952 502 HA VAL 67 HA VAL 67 6.304 -0.847 5.513 503 HB VAL 67 HB VAL 67 5.125 0.405 3.614 504 1HG1 VAL 67 HG11 VAL 67 7.504 0.556 4.075 505 2HG1 VAL 67 HG12 VAL 67 7.199 0.557 2.338 506 3HG1 VAL 67 HG13 VAL 67 7.793 -0.904 3.128 507 1HG2 VAL 67 HG21 VAL 67 5.778 -2.168 2.175 508 2HG2 VAL 67 HG22 VAL 67 5.259 -0.666 1.413 509 3HG2 VAL 67 HG23 VAL 67 4.163 -1.533 2.488 510 H ASN 68 HN ASN 68 4.491 0.642 5.845 511 HA ASN 68 HA ASN 68 1.904 -0.763 5.921 512 1HB ASN 68 HB2 ASN 68 2.978 1.307 7.856 513 2HB ASN 68 HB1 ASN 68 1.325 0.708 7.859 514 1HD2 ASN 68 HD21 ASN 68 4.628 0.009 8.622 515 2HD2 ASN 68 HD22 ASN 68 4.333 -1.440 9.515 516 H ILE 69 HN ILE 69 0.796 0.009 4.246 517 HA ILE 69 HA ILE 69 0.873 2.847 3.607 518 HB ILE 69 HB ILE 69 -1.120 1.977 2.043 519 1HG1 ILE 69 HG12 ILE 69 0.642 -0.450 2.337 520 2HG1 ILE 69 HG11 ILE 69 -0.964 -0.315 3.044 521 1HG2 ILE 69 HG21 ILE 69 1.797 1.517 1.456 522 2HG2 ILE 69 HG22 ILE 69 0.937 3.049 1.289 523 3HG2 ILE 69 HG23 ILE 69 0.507 1.679 0.262 524 1HD1 ILE 69 HD11 ILE 69 -0.303 -0.224 0.108 525 2HD1 ILE 69 HD12 ILE 69 -1.917 -0.074 0.804 526 3HD1 ILE 69 HD13 ILE 69 -1.018 -1.583 0.975 527 H ARG 70 HN ARG 70 0.047 3.708 5.490 528 HA ARG 70 HA ARG 70 -2.734 2.970 6.112 529 1HB ARG 70 HB2 ARG 70 -0.958 2.371 7.796 530 2HB ARG 70 HB1 ARG 70 -0.653 4.086 7.991 531 1HG ARG 70 HG2 ARG 70 -2.863 4.430 8.881 532 2HG ARG 70 HG1 ARG 70 -3.286 2.744 8.563 533 1HD ARG 70 HD2 ARG 70 -1.451 2.052 10.075 534 2HD ARG 70 HD1 ARG 70 -1.164 3.746 10.456 535 HE ARG 70 HE ARG 70 -3.690 3.574 11.173 536 1HH1 ARG 70 HH11 ARG 70 -1.157 1.196 11.598 537 2HH1 ARG 70 HH12 ARG 70 -1.752 0.636 13.129 538 1HH2 ARG 70 HH21 ARG 70 -4.501 2.812 13.191 539 2HH2 ARG 70 HH22 ARG 70 -3.656 1.545 14.032 540 HA PRO 71 HA PRO 71 -4.061 7.024 4.901 541 1HB PRO 71 HB2 PRO 71 -5.551 6.743 7.482 542 2HB PRO 71 HB1 PRO 71 -6.117 7.298 5.908 543 1HG PRO 71 HG2 PRO 71 -6.654 4.831 6.751 544 2HG PRO 71 HG1 PRO 71 -6.283 5.161 5.049 545 1HD PRO 71 HD2 PRO 71 -4.630 3.838 7.120 546 2HD PRO 71 HD1 PRO 71 -4.605 3.645 5.356 547 H MET 72 HN MET 72 -2.865 8.794 5.173 548 HA MET 72 HA MET 72 -1.159 9.107 7.416 549 1HB MET 72 HB2 MET 72 -0.545 9.891 5.159 550 2HB MET 72 HB1 MET 72 -1.823 11.096 5.237 551 1HG MET 72 HG2 MET 72 -0.704 12.177 7.112 552 2HG MET 72 HG1 MET 72 0.566 10.956 7.063 553 1HE MET 72 HE1 MET 72 1.118 14.077 7.005 554 2HE MET 72 HE2 MET 72 2.357 14.191 5.755 555 3HE MET 72 HE3 MET 72 2.411 12.877 6.932 556 H ASP 73 HN ASP 73 -2.478 9.174 9.198 557 HA ASP 73 HA ASP 73 -3.817 10.021 10.815 558 1HB ASP 73 HB2 ASP 73 -1.903 11.591 10.902 559 2HB ASP 73 HB1 ASP 73 -2.753 12.658 9.789 560 H ASN 74 HN ASN 74 -5.584 9.255 9.319 561 HA ASN 74 HA ASN 74 -7.436 11.473 8.873 562 1HB ASN 74 HB2 ASN 74 -6.371 9.666 6.794 563 2HB ASN 74 HB1 ASN 74 -8.112 9.932 6.753 564 1HD2 ASN 74 HD21 ASN 74 -4.988 11.316 6.245 565 2HD2 ASN 74 HD22 ASN 74 -5.535 12.818 5.588 566 H SER 75 HN SER 75 -7.140 7.915 8.750 567 HA SER 75 HA SER 75 -9.516 7.687 10.405 568 1HB SER 75 HB2 SER 75 -9.391 6.278 7.729 569 2HB SER 75 HB1 SER 75 -10.738 6.298 8.867 570 HG SER 75 HG SER 75 -10.525 8.736 8.485 571 H ALA 76 HN ALA 76 -9.875 5.445 11.121 572 HA ALA 76 HA ALA 76 -7.323 4.016 11.325 573 1HB ALA 76 HB1 ALA 76 -8.367 4.646 13.447 574 2HB ALA 76 HB2 ALA 76 -8.302 2.893 13.264 575 3HB ALA 76 HB3 ALA 76 -9.819 3.752 12.999 576 H TRP 77 HN TRP 77 -7.425 3.022 9.306 577 HA TRP 77 HA TRP 77 -9.646 1.376 8.536 578 1HB TRP 77 HB2 TRP 77 -6.856 1.725 7.430 579 2HB TRP 77 HB1 TRP 77 -8.014 0.594 6.744 580 HD1 TRP 77 HD1 TRP 77 -9.157 4.103 7.855 581 HE1 TRP 77 HE1 TRP 77 -9.851 5.429 5.742 582 HE3 TRP 77 HE3 TRP 77 -7.593 0.802 4.286 583 HZ2 TRP 77 HZ2 TRP 77 -9.724 5.097 2.940 584 HZ3 TRP 77 HZ3 TRP 77 -7.912 1.372 1.922 585 HH2 TRP 77 HH2 TRP 77 -8.952 3.479 1.261 586 H THR 78 HN THR 78 -9.517 -0.948 8.231 587 HA THR 78 HA THR 78 -8.286 -2.363 10.371 588 HB THR 78 HB THR 78 -9.412 -3.529 7.810 589 HG1 THR 78 HG1 THR 78 -10.663 -2.483 10.121 590 1HG2 THR 78 HG21 THR 78 -9.895 -5.471 9.239 591 2HG2 THR 78 HG22 THR 78 -9.126 -4.653 10.598 592 3HG2 THR 78 HG23 THR 78 -8.170 -5.112 9.191 593 H THR 79 HN THR 79 -6.215 -2.956 10.481 594 HA THR 79 HA THR 79 -4.637 -2.587 8.052 595 HB THR 79 HB THR 79 -3.919 -1.153 9.795 596 HG1 THR 79 HG1 THR 79 -2.174 -3.384 9.502 597 1HG2 THR 79 HG21 THR 79 -3.159 -1.966 11.999 598 2HG2 THR 79 HG22 THR 79 -3.719 -3.584 11.574 599 3HG2 THR 79 HG23 THR 79 -4.877 -2.263 11.726 600 H ASP 80 HN ASP 80 -4.805 -4.509 7.030 601 HA ASP 80 HA ASP 80 -3.549 -6.823 8.320 602 1HB ASP 80 HB2 ASP 80 -5.143 -6.437 5.802 603 2HB ASP 80 HB1 ASP 80 -4.047 -7.807 5.925 604 H ASN 81 HN ASN 81 -1.741 -7.882 7.106 605 HA ASN 81 HA ASN 81 0.124 -5.816 6.323 606 1HB ASN 81 HB2 ASN 81 0.573 -8.088 7.628 607 2HB ASN 81 HB1 ASN 81 0.776 -8.713 6.002 608 1HD2 ASN 81 HD21 ASN 81 1.866 -6.156 5.008 609 2HD2 ASN 81 HD22 ASN 81 3.483 -6.081 5.617 610 H GLY 82 HN GLY 82 -2.222 -7.535 4.704 611 1HA GLY 82 HA2 GLY 82 -0.723 -7.303 2.170 612 2HA GLY 82 HA1 GLY 82 -1.932 -8.543 2.462 613 H VAL 83 HN VAL 83 -3.818 -6.784 3.750 614 HA VAL 83 HA VAL 83 -4.594 -5.119 1.457 615 HB VAL 83 HB VAL 83 -6.955 -5.699 1.874 616 1HG1 VAL 83 HG11 VAL 83 -5.198 -8.103 1.381 617 2HG1 VAL 83 HG12 VAL 83 -5.720 -6.928 0.174 618 3HG1 VAL 83 HG13 VAL 83 -6.908 -7.970 0.960 619 1HG2 VAL 83 HG21 VAL 83 -5.847 -7.710 3.835 620 2HG2 VAL 83 HG22 VAL 83 -7.529 -7.601 3.314 621 3HG2 VAL 83 HG23 VAL 83 -6.804 -6.284 4.236 622 H PHE 84 HN PHE 84 -5.870 -3.245 2.014 623 HA PHE 84 HA PHE 84 -5.824 -2.611 4.876 624 1HB PHE 84 HB2 PHE 84 -3.955 -1.579 3.110 625 2HB PHE 84 HB1 PHE 84 -5.184 -0.319 3.176 626 HD1 PHE 84 HD1 PHE 84 -5.775 0.707 5.359 627 HD2 PHE 84 HD2 PHE 84 -2.495 -1.974 4.921 628 HE1 PHE 84 HE1 PHE 84 -4.846 1.494 7.495 629 HE2 PHE 84 HE2 PHE 84 -1.563 -1.188 7.058 630 HZ PHE 84 HZ PHE 84 -2.742 0.547 8.350 631 H TYR 85 HN TYR 85 -7.941 -2.489 5.245 632 HA TYR 85 HA TYR 85 -9.514 -0.800 3.453 633 1HB TYR 85 HB2 TYR 85 -11.326 -2.407 3.340 634 2HB TYR 85 HB1 TYR 85 -9.848 -3.109 2.701 635 HD1 TYR 85 HD1 TYR 85 -12.571 -3.562 4.935 636 HD2 TYR 85 HD2 TYR 85 -8.490 -4.596 4.308 637 HE1 TYR 85 HE1 TYR 85 -12.821 -5.462 6.480 638 HE2 TYR 85 HE2 TYR 85 -8.735 -6.510 5.839 639 HH TYR 85 HH TYR 85 -11.756 -7.626 6.941 640 H LYS 86 HN LYS 86 -11.128 0.304 4.376 641 HA LYS 86 HA LYS 86 -10.942 0.568 7.235 642 1HB LYS 86 HB2 LYS 86 -12.449 2.499 6.909 643 2HB LYS 86 HB1 LYS 86 -11.019 2.572 5.885 644 1HG LYS 86 HG2 LYS 86 -12.504 1.525 4.075 645 2HG LYS 86 HG1 LYS 86 -13.852 1.989 5.115 646 1HD LYS 86 HD2 LYS 86 -12.945 4.322 5.098 647 2HD LYS 86 HD1 LYS 86 -11.786 3.794 3.876 648 1HE LYS 86 HE2 LYS 86 -13.586 4.769 2.697 649 2HE LYS 86 HE1 LYS 86 -13.763 3.023 2.507 650 1HZ LYS 86 HZ1 LYS 86 -15.382 3.075 4.344 651 2HZ LYS 86 HZ2 LYS 86 -15.872 3.984 3.001 652 3HZ LYS 86 HZ3 LYS 86 -15.272 4.771 4.379 653 H ASN 87 HN ASN 87 -12.457 0.098 8.720 654 HA ASN 87 HA ASN 87 -14.464 -1.836 8.150 655 1HB ASN 87 HB2 ASN 87 -13.281 -1.553 10.349 656 2HB ASN 87 HB1 ASN 87 -14.169 -0.056 10.590 657 1HD2 ASN 87 HD21 ASN 87 -14.075 -2.605 12.094 658 2HD2 ASN 87 HD22 ASN 87 -15.726 -3.105 12.244 659 H ASP 88 HN ASP 88 -14.348 1.621 8.560 660 HA ASP 88 HA ASP 88 -17.054 2.297 8.473 661 1HB ASP 88 HB2 ASP 88 -14.718 3.789 7.232 662 2HB ASP 88 HB1 ASP 88 -16.303 4.468 7.570 663 H VAL 89 HN VAL 89 -18.554 1.945 6.907 664 HA VAL 89 HA VAL 89 -17.637 1.365 4.200 665 HB VAL 89 HB VAL 89 -20.019 0.959 3.659 666 1HG1 VAL 89 HG11 VAL 89 -18.631 -0.881 4.416 667 2HG1 VAL 89 HG12 VAL 89 -20.282 -1.073 5.005 668 3HG1 VAL 89 HG13 VAL 89 -19.016 -0.507 6.096 669 1HG2 VAL 89 HG21 VAL 89 -21.682 0.875 5.463 670 2HG2 VAL 89 HG22 VAL 89 -21.068 2.508 5.206 671 3HG2 VAL 89 HG23 VAL 89 -20.496 1.556 6.577 672 H GLY 90 HN GLY 90 -17.698 2.754 2.533 673 1HA GLY 90 HA2 GLY 90 -19.251 4.743 1.766 674 2HA GLY 90 HA1 GLY 90 -18.491 5.503 3.159 675 H SER 91 HN SER 91 -17.788 7.035 1.427 676 HA SER 91 HA SER 91 -15.647 6.135 -0.287 677 1HB SER 91 HB2 SER 91 -15.474 8.596 -0.811 678 2HB SER 91 HB1 SER 91 -17.067 7.905 -1.114 679 HG SER 91 HG SER 91 -16.285 9.825 0.697 680 H TRP 92 HN TRP 92 -13.700 7.976 -0.113 681 HA TRP 92 HA TRP 92 -13.004 8.516 2.632 682 1HB TRP 92 HB2 TRP 92 -12.251 6.137 2.220 683 2HB TRP 92 HB1 TRP 92 -11.096 6.806 1.057 684 HD1 TRP 92 HD1 TRP 92 -12.007 7.142 4.804 685 HE1 TRP 92 HE1 TRP 92 -9.890 7.877 6.073 686 HE3 TRP 92 HE3 TRP 92 -8.871 7.641 0.828 687 HZ2 TRP 92 HZ2 TRP 92 -7.230 8.580 5.425 688 HZ3 TRP 92 HZ3 TRP 92 -6.577 8.351 1.226 689 HH2 TRP 92 HH2 TRP 92 -5.751 8.802 3.480 690 H GLY 93 HN GLY 93 -11.496 8.220 -0.544 691 1HA GLY 93 HA2 GLY 93 -10.069 9.641 -1.689 692 2HA GLY 93 HA1 GLY 93 -11.398 10.746 -1.445 693 H GLY 94 HN GLY 94 -8.226 9.788 -0.383 694 1HA GLY 94 HA2 GLY 94 -7.669 12.452 0.523 695 2HA GLY 94 HA1 GLY 94 -7.754 11.294 1.844 696 H THR 95 HN THR 95 -5.640 11.181 2.428 697 HA THR 95 HA THR 95 -3.813 10.126 0.391 698 HB THR 95 HB THR 95 -2.011 11.423 1.773 699 HG1 THR 95 HG1 THR 95 -2.801 12.829 3.145 700 1HG2 THR 95 HG21 THR 95 -3.873 12.776 -0.183 701 2HG2 THR 95 HG22 THR 95 -2.444 11.824 -0.582 702 3HG2 THR 95 HG23 THR 95 -2.271 13.363 0.262 703 H ILE 96 HN ILE 96 -3.000 8.257 0.928 704 HA ILE 96 HA ILE 96 -2.729 7.496 3.756 705 HB ILE 96 HB ILE 96 -2.215 5.230 2.868 706 1HG1 ILE 96 HG12 ILE 96 -3.002 6.368 0.189 707 2HG1 ILE 96 HG11 ILE 96 -1.329 6.125 0.680 708 1HG2 ILE 96 HG21 ILE 96 -4.504 5.766 3.483 709 2HG2 ILE 96 HG22 ILE 96 -4.486 4.702 2.077 710 3HG2 ILE 96 HG23 ILE 96 -4.804 6.424 1.873 711 1HD1 ILE 96 HD11 ILE 96 -3.419 3.973 0.432 712 2HD1 ILE 96 HD12 ILE 96 -1.726 3.735 0.873 713 3HD1 ILE 96 HD13 ILE 96 -2.145 4.318 -0.739 714 H GLY 97 HN GLY 97 -0.594 6.428 4.333 715 1HA GLY 97 HA2 GLY 97 1.568 7.635 2.722 716 2HA GLY 97 HA1 GLY 97 1.552 7.753 4.472 717 H ILE 98 HN ILE 98 3.503 6.547 2.583 718 HA ILE 98 HA ILE 98 3.467 3.765 3.468 719 HB ILE 98 HB ILE 98 5.055 5.212 1.349 720 1HG1 ILE 98 HG12 ILE 98 3.262 2.815 1.201 721 2HG1 ILE 98 HG11 ILE 98 2.696 4.450 0.921 722 1HG2 ILE 98 HG21 ILE 98 6.577 3.676 2.466 723 2HG2 ILE 98 HG22 ILE 98 6.155 3.069 0.864 724 3HG2 ILE 98 HG23 ILE 98 5.405 2.368 2.298 725 1HD1 ILE 98 HD11 ILE 98 4.196 4.652 -0.986 726 2HD1 ILE 98 HD12 ILE 98 3.125 3.261 -1.167 727 3HD1 ILE 98 HD13 ILE 98 4.805 3.023 -0.690 728 H TYR 99 HN TYR 99 4.539 3.291 5.244 729 HA TYR 99 HA TYR 99 7.203 4.417 5.573 730 1HB TYR 99 HB2 TYR 99 6.686 4.323 8.140 731 2HB TYR 99 HB1 TYR 99 6.279 5.741 7.190 732 HD1 TYR 99 HD1 TYR 99 5.059 3.207 9.392 733 HD2 TYR 99 HD2 TYR 99 3.859 5.992 6.416 734 HE1 TYR 99 HE1 TYR 99 2.767 3.150 10.271 735 HE2 TYR 99 HE2 TYR 99 1.561 5.934 7.272 736 HH TYR 99 HH TYR 99 0.772 4.773 10.275 737 H VAL 100 HN VAL 100 8.574 3.125 6.987 738 HA VAL 100 HA VAL 100 8.201 0.379 6.131 739 HB VAL 100 HB VAL 100 10.335 1.558 5.702 740 1HG1 VAL 100 HG11 VAL 100 10.503 2.898 7.709 741 2HG1 VAL 100 HG12 VAL 100 11.929 1.868 7.551 742 3HG1 VAL 100 HG13 VAL 100 10.658 1.442 8.695 743 1HG2 VAL 100 HG21 VAL 100 10.562 -0.860 7.488 744 2HG2 VAL 100 HG22 VAL 100 11.801 -0.281 6.375 745 3HG2 VAL 100 HG23 VAL 100 10.261 -0.872 5.751 746 H ASP 101 HN ASP 101 7.974 -1.348 7.422 747 HA ASP 101 HA ASP 101 6.805 -0.939 9.961 748 1HB ASP 101 HB2 ASP 101 6.197 -2.800 8.467 749 2HB ASP 101 HB1 ASP 101 7.791 -3.509 8.701 750 H GLY 102 HN GLY 102 8.082 -0.085 11.505 751 1HA GLY 102 HA2 GLY 102 9.467 -0.208 13.330 752 2HA GLY 102 HA1 GLY 102 9.796 -1.876 12.896 753 H GLN 103 HN GLN 103 10.402 0.915 10.842 754 HA GLN 103 HA GLN 103 12.267 1.432 9.638 755 1HB GLN 103 HB2 GLN 103 14.050 2.442 11.028 756 2HB GLN 103 HB1 GLN 103 12.430 2.992 11.417 757 1HG GLN 103 HG2 GLN 103 12.413 1.495 13.366 758 2HG GLN 103 HG1 GLN 103 14.062 1.002 12.981 759 1HE2 GLN 103 HE21 GLN 103 14.788 3.709 12.101 760 2HE2 GLN 103 HE22 GLN 103 14.972 4.640 13.543 761 H GLN 104 HN GLN 104 13.089 -0.095 8.409 762 HA GLN 104 HA GLN 104 14.306 -2.443 9.536 763 1HB GLN 104 HB2 GLN 104 13.649 -1.574 6.732 764 2HB GLN 104 HB1 GLN 104 14.507 -3.073 7.059 765 1HG GLN 104 HG2 GLN 104 11.784 -2.356 8.129 766 2HG GLN 104 HG1 GLN 104 12.093 -3.399 6.743 767 1HE2 GLN 104 HE21 GLN 104 14.422 -4.666 7.949 768 2HE2 GLN 104 HE22 GLN 104 13.809 -5.724 9.174 769 H THR 105 HN THR 105 15.569 0.398 9.407 770 HA THR 105 HA THR 105 17.700 0.999 9.909 771 HB THR 105 HB THR 105 18.640 -1.734 9.058 772 HG1 THR 105 HG1 THR 105 17.079 -0.986 11.183 773 1HG2 THR 105 HG21 THR 105 19.744 0.288 11.008 774 2HG2 THR 105 HG22 THR 105 20.370 -0.026 9.389 775 3HG2 THR 105 HG23 THR 105 20.457 -1.279 10.627 776 H ASN 106 HN ASN 106 17.054 -0.577 6.897 777 HA ASN 106 HA ASN 106 17.461 0.049 4.767 778 1HB ASN 106 HB2 ASN 106 17.365 2.395 5.435 779 2HB ASN 106 HB1 ASN 106 19.052 2.335 5.934 780 1HD2 ASN 106 HD21 ASN 106 20.623 2.580 4.426 781 2HD2 ASN 106 HD22 ASN 106 20.318 2.860 2.741 782 H THR 107 HN THR 107 18.485 -1.898 4.637 783 HA THR 107 HA THR 107 21.401 -1.975 4.739 784 HB THR 107 HB THR 107 19.432 -4.157 3.989 785 HG1 THR 107 HG1 THR 107 20.437 -3.253 6.482 786 1HG2 THR 107 HG21 THR 107 21.724 -4.626 3.267 787 2HG2 THR 107 HG22 THR 107 21.247 -5.693 4.587 788 3HG2 THR 107 HG23 THR 107 22.309 -4.321 4.902 789 HA PRO 108 HA PRO 108 22.659 -0.706 0.738 790 1HB PRO 108 HB2 PRO 108 23.262 -3.616 0.371 791 2HB PRO 108 HB1 PRO 108 24.243 -2.207 -0.042 792 1HG PRO 108 HG2 PRO 108 24.473 -3.690 2.299 793 2HG PRO 108 HG1 PRO 108 25.091 -2.048 2.060 794 1HD PRO 108 HD2 PRO 108 23.049 -2.851 3.852 795 2HD PRO 108 HD1 PRO 108 23.502 -1.186 3.433 796 HA PRO 109 HA PRO 109 18.987 -2.129 -1.554 797 1HB PRO 109 HB2 PRO 109 17.947 0.452 -1.674 798 2HB PRO 109 HB1 PRO 109 17.530 -0.777 -0.481 799 1HG PRO 109 HG2 PRO 109 18.865 1.657 0.010 800 2HG PRO 109 HG1 PRO 109 18.661 0.314 1.138 801 1HD PRO 109 HD2 PRO 109 20.997 1.008 -0.575 802 2HD PRO 109 HD1 PRO 109 20.936 0.271 1.046 803 H GLY 110 HN GLY 110 17.819 -0.332 -3.234 804 1HA GLY 110 HA2 GLY 110 19.553 1.095 -4.950 805 2HA GLY 110 HA1 GLY 110 19.189 -0.492 -5.628 806 H ASN 111 HN ASN 111 17.349 -0.700 -6.762 807 HA ASN 111 HA ASN 111 15.252 1.318 -6.366 808 1HB ASN 111 HB2 ASN 111 15.551 -0.741 -8.570 809 2HB ASN 111 HB1 ASN 111 14.260 0.447 -8.457 810 1HD2 ASN 111 HD21 ASN 111 14.769 2.657 -8.779 811 2HD2 ASN 111 HD22 ASN 111 16.190 3.124 -9.651 812 H TYR 112 HN TYR 112 13.413 0.819 -5.367 813 HA TYR 112 HA TYR 112 12.848 -2.016 -4.836 814 1HB TYR 112 HB2 TYR 112 12.868 0.356 -3.062 815 2HB TYR 112 HB1 TYR 112 11.541 -0.768 -2.812 816 HD1 TYR 112 HD1 TYR 112 12.067 -3.168 -2.269 817 HD2 TYR 112 HD2 TYR 112 15.046 -0.144 -2.365 818 HE1 TYR 112 HE1 TYR 112 13.546 -4.588 -0.933 819 HE2 TYR 112 HE2 TYR 112 16.543 -1.565 -1.039 820 HH TYR 112 HH TYR 112 16.327 -3.452 0.572 821 H THR 113 HN THR 113 11.070 -2.750 -5.714 822 HA THR 113 HA THR 113 9.143 -0.851 -6.816 823 HB THR 113 HB THR 113 9.506 -3.807 -7.334 824 HG1 THR 113 HG1 THR 113 10.848 -3.214 -8.876 825 1HG2 THR 113 HG21 THR 113 8.028 -3.435 -9.266 826 2HG2 THR 113 HG22 THR 113 7.778 -1.769 -8.745 827 3HG2 THR 113 HG23 THR 113 7.203 -3.102 -7.745 828 H LEU 114 HN LEU 114 7.118 -0.701 -6.093 829 HA LEU 114 HA LEU 114 5.851 -2.904 -4.729 830 1HB LEU 114 HB2 LEU 114 5.133 -1.429 -2.815 831 2HB LEU 114 HB1 LEU 114 6.816 -1.919 -2.801 832 HG LEU 114 HG LEU 114 6.208 0.671 -4.080 833 1HD1 LEU 114 HD11 LEU 114 6.109 0.279 -1.091 834 2HD1 LEU 114 HD12 LEU 114 4.764 0.770 -2.121 835 3HD1 LEU 114 HD13 LEU 114 6.156 1.835 -1.918 836 1HD2 LEU 114 HD21 LEU 114 8.353 -0.256 -2.180 837 2HD2 LEU 114 HD22 LEU 114 8.298 1.310 -2.990 838 3HD2 LEU 114 HD23 LEU 114 8.488 -0.168 -3.935 839 H THR 115 HN THR 115 4.368 -2.984 -6.334 840 HA THR 115 HA THR 115 2.999 -0.588 -7.210 841 HB THR 115 HB THR 115 2.395 -3.450 -7.979 842 HG1 THR 115 HG1 THR 115 4.224 -3.420 -9.030 843 1HG2 THR 115 HG21 THR 115 0.671 -1.827 -8.602 844 2HG2 THR 115 HG22 THR 115 1.513 -2.429 -10.031 845 3HG2 THR 115 HG23 THR 115 1.889 -0.827 -9.395 846 H LEU 116 HN LEU 116 0.894 -0.062 -6.756 847 HA LEU 116 HA LEU 116 -0.445 -1.700 -4.701 848 1HB LEU 116 HB2 LEU 116 -0.467 1.288 -5.087 849 2HB LEU 116 HB1 LEU 116 -1.456 0.434 -3.917 850 HG LEU 116 HG LEU 116 1.563 0.539 -3.924 851 1HD1 LEU 116 HD11 LEU 116 -0.462 1.881 -2.138 852 2HD1 LEU 116 HD12 LEU 116 0.570 2.677 -3.326 853 3HD1 LEU 116 HD13 LEU 116 1.287 1.905 -1.912 854 1HD2 LEU 116 HD21 LEU 116 -0.352 -0.648 -1.920 855 2HD2 LEU 116 HD22 LEU 116 1.402 -0.560 -1.757 856 3HD2 LEU 116 HD23 LEU 116 0.682 -1.559 -3.020 857 H THR 117 HN THR 117 -2.261 -2.601 -5.388 858 HA THR 117 HA THR 117 -3.644 -1.459 -7.704 859 HB THR 117 HB THR 117 -4.046 -4.146 -6.365 860 HG1 THR 117 HG1 THR 117 -2.331 -3.236 -8.397 861 1HG2 THR 117 HG21 THR 117 -6.011 -3.334 -7.611 862 2HG2 THR 117 HG22 THR 117 -5.271 -4.732 -8.394 863 3HG2 THR 117 HG23 THR 117 -5.001 -3.114 -9.042 864 H GLY 118 HN GLY 118 -5.408 -0.275 -7.401 865 1HA GLY 118 HA2 GLY 118 -6.536 -0.003 -4.765 866 2HA GLY 118 HA1 GLY 118 -7.007 0.891 -6.202 867 H GLY 119 HN GLY 119 -9.179 0.574 -5.433 868 1HA GLY 119 HA2 GLY 119 -11.101 -0.511 -6.441 869 2HA GLY 119 HA1 GLY 119 -10.233 -2.035 -6.294 870 H TYR 120 HN TYR 120 -12.781 -1.863 -5.311 871 HA TYR 120 HA TYR 120 -12.531 -1.227 -2.495 872 1HB TYR 120 HB2 TYR 120 -14.939 -1.638 -2.332 873 2HB TYR 120 HB1 TYR 120 -14.549 -0.459 -3.569 874 HD1 TYR 120 HD1 TYR 120 -15.798 -3.840 -2.928 875 HD2 TYR 120 HD2 TYR 120 -15.030 -0.899 -5.923 876 HE1 TYR 120 HE1 TYR 120 -17.104 -5.154 -4.540 877 HE2 TYR 120 HE2 TYR 120 -16.344 -2.214 -7.539 878 HH TYR 120 HH TYR 120 -18.358 -4.814 -6.596 879 H TRP 121 HN TRP 121 -13.922 -2.835 -1.116 880 HA TRP 121 HA TRP 121 -12.775 -5.516 -1.513 881 1HB TRP 121 HB2 TRP 121 -11.301 -4.504 0.014 882 2HB TRP 121 HB1 TRP 121 -12.589 -3.633 0.833 883 HD1 TRP 121 HD1 TRP 121 -14.250 -5.213 2.332 884 HE1 TRP 121 HE1 TRP 121 -13.673 -7.219 3.821 885 HE3 TRP 121 HE3 TRP 121 -9.734 -6.425 0.294 886 HZ2 TRP 121 HZ2 TRP 121 -11.581 -9.059 4.088 887 HZ3 TRP 121 HZ3 TRP 121 -8.521 -8.348 1.244 888 HH2 TRP 121 HH2 TRP 121 -9.425 -9.626 3.091 889 H ALA 122 HN ALA 122 -13.946 -7.206 -0.521 890 HA ALA 122 HA ALA 122 -16.606 -6.536 0.522 891 1HB ALA 122 HB1 ALA 122 -16.855 -7.217 -1.814 892 2HB ALA 122 HB2 ALA 122 -17.570 -8.408 -0.726 893 3HB ALA 122 HB3 ALA 122 -16.002 -8.722 -1.471 894 H LYS 123 HN LYS 123 -17.451 -8.082 2.000 895 HA LYS 123 HA LYS 123 -17.378 -9.465 3.794 896 1HB LYS 123 HB2 LYS 123 -16.036 -10.871 1.716 897 2HB LYS 123 HB1 LYS 123 -15.159 -11.162 3.212 898 1HG LYS 123 HG2 LYS 123 -18.109 -11.618 2.784 899 2HG LYS 123 HG1 LYS 123 -16.863 -12.866 2.826 900 1HD LYS 123 HD2 LYS 123 -16.373 -12.373 5.131 901 2HD LYS 123 HD1 LYS 123 -17.463 -10.988 5.111 902 1HE LYS 123 HE2 LYS 123 -19.353 -12.506 4.702 903 2HE LYS 123 HE1 LYS 123 -18.252 -13.879 4.759 904 1HZ LYS 123 HZ1 LYS 123 -19.448 -13.509 6.857 905 2HZ LYS 123 HZ2 LYS 123 -18.711 -11.992 7.007 906 3HZ LYS 123 HZ3 LYS 123 -17.764 -13.401 7.045 907 H ASP 124 HN ASP 124 -14.850 -10.801 4.748 908 HA ASP 124 HA ASP 124 -13.074 -8.586 5.298 909 1HB ASP 124 HB2 ASP 124 -13.162 -8.775 7.714 910 2HB ASP 124 HB1 ASP 124 -14.768 -8.412 7.097 911 H ASN 125 HN ASN 125 -11.075 -9.159 5.548 912 HA ASN 125 HA ASN 125 -9.165 -10.302 5.433 913 1HB ASN 125 HB2 ASN 125 -8.617 -11.361 7.330 914 2HB ASN 125 HB1 ASN 125 -10.140 -10.650 7.839 915 1HD2 ASN 125 HD21 ASN 125 -11.963 -11.995 8.089 916 2HD2 ASN 125 HD22 ASN 125 -11.791 -13.711 8.252 917 H LYS 126 HN LYS 126 -11.841 -11.999 4.290 918 HA LYS 126 HA LYS 126 -10.399 -14.375 3.540 919 1HB LYS 126 HB2 LYS 126 -12.382 -15.026 2.347 920 2HB LYS 126 HB1 LYS 126 -12.856 -14.374 3.903 921 1HG LYS 126 HG2 LYS 126 -14.376 -13.252 2.710 922 2HG LYS 126 HG1 LYS 126 -13.035 -12.166 2.339 923 1HD LYS 126 HD2 LYS 126 -12.605 -13.332 0.267 924 2HD LYS 126 HD1 LYS 126 -13.822 -14.550 0.658 925 1HE LYS 126 HE2 LYS 126 -15.564 -12.857 0.574 926 2HE LYS 126 HE1 LYS 126 -14.363 -11.616 0.238 927 1HZ LYS 126 HZ1 LYS 126 -15.094 -13.907 -1.511 928 2HZ LYS 126 HZ2 LYS 126 -13.819 -12.838 -1.834 929 3HZ LYS 126 HZ3 LYS 126 -15.414 -12.267 -1.799 930 H GLN 127 HN GLN 127 -10.194 -11.316 2.614 931 HA GLN 127 HA GLN 127 -9.232 -10.175 0.948 932 1HB GLN 127 HB2 GLN 127 -7.622 -12.145 0.979 933 2HB GLN 127 HB1 GLN 127 -8.521 -12.774 -0.398 934 1HG GLN 127 HG2 GLN 127 -8.017 -10.777 -1.676 935 2HG GLN 127 HG1 GLN 127 -7.173 -10.084 -0.295 936 1HE2 GLN 127 HE21 GLN 127 -6.030 -12.723 0.418 937 2HE2 GLN 127 HE22 GLN 127 -4.733 -12.958 -0.702 938 H GLY 128 HN GLY 128 -11.854 -10.255 0.800 939 1HA GLY 128 HA2 GLY 128 -12.551 -10.800 -1.970 940 2HA GLY 128 HA1 GLY 128 -13.614 -10.126 -0.735 941 H PHE 129 HN PHE 129 -11.775 -9.403 -3.427 942 HA PHE 129 HA PHE 129 -12.215 -6.572 -2.959 943 1HB PHE 129 HB2 PHE 129 -9.925 -5.904 -3.343 944 2HB PHE 129 HB1 PHE 129 -9.930 -7.076 -2.029 945 HD1 PHE 129 HD1 PHE 129 -9.304 -9.483 -2.581 946 HD2 PHE 129 HD2 PHE 129 -8.623 -6.235 -5.247 947 HE1 PHE 129 HE1 PHE 129 -7.644 -10.831 -3.795 948 HE2 PHE 129 HE2 PHE 129 -6.963 -7.579 -6.466 949 HZ PHE 129 HZ PHE 129 -6.472 -9.880 -5.740 950 H THR 130 HN THR 130 -11.610 -5.337 -5.024 951 HA THR 130 HA THR 130 -11.249 -6.991 -7.389 952 HB THR 130 HB THR 130 -13.668 -6.901 -7.257 953 HG1 THR 130 HG1 THR 130 -12.940 -4.943 -9.184 954 1HG2 THR 130 HG21 THR 130 -14.873 -4.769 -7.284 955 2HG2 THR 130 HG22 THR 130 -13.342 -3.908 -7.135 956 3HG2 THR 130 HG23 THR 130 -13.899 -4.949 -5.825 957 HA PRO 131 HA PRO 131 -8.829 -3.428 -8.573 958 1HB PRO 131 HB2 PRO 131 -9.213 -4.277 -11.359 959 2HB PRO 131 HB1 PRO 131 -7.724 -4.184 -10.416 960 1HG PRO 131 HG2 PRO 131 -8.833 -6.537 -11.120 961 2HG PRO 131 HG1 PRO 131 -7.952 -6.324 -9.595 962 1HD PRO 131 HD2 PRO 131 -10.906 -6.381 -10.090 963 2HD PRO 131 HD1 PRO 131 -9.973 -7.104 -8.762 964 H SER 132 HN SER 132 -9.992 -1.611 -8.297 965 HA SER 132 HA SER 132 -11.818 -0.822 -10.458 966 1HB SER 132 HB2 SER 132 -12.281 -0.197 -7.532 967 2HB SER 132 HB1 SER 132 -13.377 0.110 -8.879 968 HG SER 132 HG SER 132 -14.085 -1.862 -8.734 969 H GLY 133 HN GLY 133 -11.194 1.042 -11.356 970 1HA GLY 133 HA2 GLY 133 -10.496 3.327 -11.233 971 2HA GLY 133 HA1 GLY 133 -9.665 2.954 -9.727 972 H THR 134 HN THR 134 -7.541 2.658 -9.821 973 HA THR 134 HA THR 134 -6.338 1.570 -12.254 974 HB THR 134 HB THR 134 -4.503 3.297 -12.116 975 HG1 THR 134 HG1 THR 134 -4.610 4.707 -10.561 976 1HG2 THR 134 HG21 THR 134 -6.227 3.387 -13.857 977 2HG2 THR 134 HG22 THR 134 -5.723 5.003 -13.362 978 3HG2 THR 134 HG23 THR 134 -7.253 4.343 -12.789 979 H THR 135 HN THR 135 -3.883 1.275 -11.851 980 HA THR 135 HA THR 135 -3.369 0.719 -9.013 981 HB THR 135 HB THR 135 -3.725 -1.406 -10.257 982 HG1 THR 135 HG1 THR 135 -1.816 -0.828 -8.592 983 1HG2 THR 135 HG21 THR 135 -2.879 -0.719 -12.448 984 2HG2 THR 135 HG22 THR 135 -2.066 -2.174 -11.873 985 3HG2 THR 135 HG23 THR 135 -1.247 -0.614 -11.787 986 H GLY 136 HN GLY 136 -1.522 1.592 -8.232 987 1HA GLY 136 HA2 GLY 136 0.127 3.066 -10.190 988 2HA GLY 136 HA1 GLY 136 -0.162 3.587 -8.534 989 H THR 137 HN THR 137 2.296 2.856 -10.211 990 HA THR 137 HA THR 137 3.394 0.738 -8.503 991 HB THR 137 HB THR 137 4.705 2.016 -10.910 992 HG1 THR 137 HG1 THR 137 2.758 0.982 -11.553 993 1HG2 THR 137 HG21 THR 137 6.236 0.845 -9.418 994 2HG2 THR 137 HG22 THR 137 6.040 -0.052 -10.924 995 3HG2 THR 137 HG23 THR 137 5.210 -0.589 -9.464 996 H THR 138 HN THR 138 4.054 1.632 -6.626 997 HA THR 138 HA THR 138 5.393 4.186 -6.580 998 HB THR 138 HB THR 138 5.137 2.192 -4.320 999 HG1 THR 138 HG1 THR 138 3.086 2.698 -4.358 1000 1HG2 THR 138 HG21 THR 138 5.591 5.177 -4.340 1001 2HG2 THR 138 HG22 THR 138 6.784 3.947 -3.924 1002 3HG2 THR 138 HG23 THR 138 5.366 4.184 -2.902 1003 H LYS 139 HN LYS 139 7.428 4.330 -7.235 1004 HA LYS 139 HA LYS 139 9.193 2.016 -6.851 1005 1HB LYS 139 HB2 LYS 139 9.100 2.857 -9.145 1006 2HB LYS 139 HB1 LYS 139 9.529 4.470 -8.592 1007 1HG LYS 139 HG2 LYS 139 11.478 3.500 -9.526 1008 2HG LYS 139 HG1 LYS 139 11.698 3.528 -7.778 1009 1HD LYS 139 HD2 LYS 139 12.469 1.409 -8.482 1010 2HD LYS 139 HD1 LYS 139 10.871 1.119 -7.791 1011 1HE LYS 139 HE2 LYS 139 9.882 0.998 -9.966 1012 2HE LYS 139 HE1 LYS 139 11.380 1.515 -10.734 1013 1HZ LYS 139 HZ1 LYS 139 12.400 -0.573 -9.824 1014 2HZ LYS 139 HZ2 LYS 139 11.217 -0.811 -11.012 1015 3HZ LYS 139 HZ3 LYS 139 10.844 -1.073 -9.381 1016 H LEU 140 HN LEU 140 10.158 2.032 -5.032 1017 HA LEU 140 HA LEU 140 10.942 4.523 -3.760 1018 1HB LEU 140 HB2 LEU 140 9.893 3.111 -2.238 1019 2HB LEU 140 HB1 LEU 140 10.645 1.672 -2.894 1020 HG LEU 140 HG LEU 140 12.803 2.429 -1.921 1021 1HD1 LEU 140 HD11 LEU 140 12.345 4.811 -1.790 1022 2HD1 LEU 140 HD12 LEU 140 12.768 4.167 -0.204 1023 3HD1 LEU 140 HD13 LEU 140 11.085 4.515 -0.594 1024 1HD2 LEU 140 HD21 LEU 140 10.533 2.104 0.035 1025 2HD2 LEU 140 HD22 LEU 140 12.241 1.829 0.377 1026 3HD2 LEU 140 HD23 LEU 140 11.396 0.797 -0.775 1027 H THR 141 HN THR 141 12.692 5.236 -4.868 1028 HA THR 141 HA THR 141 14.911 3.411 -5.371 1029 HB THR 141 HB THR 141 14.677 6.337 -6.104 1030 HG1 THR 141 HG1 THR 141 13.331 5.674 -7.585 1031 1HG2 THR 141 HG21 THR 141 16.453 4.137 -7.165 1032 2HG2 THR 141 HG22 THR 141 16.961 5.461 -6.115 1033 3HG2 THR 141 HG23 THR 141 16.406 5.797 -7.755 1034 H VAL 142 HN VAL 142 16.665 3.343 -4.081 1035 HA VAL 142 HA VAL 142 16.772 5.349 -1.931 1036 HB VAL 142 HB VAL 142 18.046 2.625 -1.946 1037 1HG1 VAL 142 HG11 VAL 142 17.613 4.631 0.251 1038 2HG1 VAL 142 HG12 VAL 142 19.154 4.167 -0.470 1039 3HG1 VAL 142 HG13 VAL 142 18.236 2.997 0.477 1040 1HG2 VAL 142 HG21 VAL 142 16.232 1.930 -0.447 1041 2HG2 VAL 142 HG22 VAL 142 15.631 2.386 -2.040 1042 3HG2 VAL 142 HG23 VAL 142 15.454 3.494 -0.681 1043 H THR 143 HN THR 143 18.113 6.915 -2.557 1044 HA THR 143 HA THR 143 20.849 6.100 -3.266 1045 HB THR 143 HB THR 143 19.490 8.702 -4.015 1046 HG1 THR 143 HG1 THR 143 19.586 6.228 -5.241 1047 1HG2 THR 143 HG21 THR 143 22.173 7.553 -4.804 1048 2HG2 THR 143 HG22 THR 143 21.911 8.920 -3.723 1049 3HG2 THR 143 HG23 THR 143 21.474 9.047 -5.427 Start of MODEL 13 1 H GLU 1 H GLU 1 -23.042 2.640 -6.949 2 HA GLU 1 HA GLU 1 -23.580 1.130 -8.725 3 1HB GLU 1 HB2 GLU 1 -22.987 1.731 -11.046 4 2HB GLU 1 HB1 GLU 1 -24.284 2.726 -10.405 5 1HG GLU 1 HG2 GLU 1 -22.700 4.539 -10.001 6 2HG GLU 1 HG1 GLU 1 -21.398 3.541 -10.647 7 H GLU 2 HN GLU 2 -20.849 3.371 -8.417 8 HA GLU 2 HA GLU 2 -19.081 1.180 -7.888 9 1HB GLU 2 HB2 GLU 2 -19.071 1.090 -10.326 10 2HB GLU 2 HB1 GLU 2 -18.685 2.802 -10.399 11 1HG GLU 2 HG2 GLU 2 -16.572 2.288 -9.162 12 2HG GLU 2 HG1 GLU 2 -16.943 0.579 -9.381 13 H CYS 3 HN CYS 3 -17.927 1.911 -6.275 14 HA CYS 3 HA CYS 3 -17.015 4.681 -6.196 15 1HB CYS 3 HB2 CYS 3 -17.676 3.918 -4.055 16 2HB CYS 3 HB1 CYS 3 -16.858 2.375 -4.261 17 H GLN 4 HN GLN 4 -15.391 5.016 -7.579 18 HA GLN 4 HA GLN 4 -13.430 2.886 -7.994 19 1HB GLN 4 HB2 GLN 4 -12.728 4.246 -9.964 20 2HB GLN 4 HB1 GLN 4 -14.400 3.715 -10.027 21 1HG GLN 4 HG2 GLN 4 -15.093 5.951 -9.238 22 2HG GLN 4 HG1 GLN 4 -13.409 6.462 -9.311 23 1HE2 GLN 4 HE21 GLN 4 -14.908 4.285 -11.603 24 2HE2 GLN 4 HE22 GLN 4 -14.845 5.368 -12.952 25 H VAL 5 HN VAL 5 -11.281 3.125 -7.640 26 HA VAL 5 HA VAL 5 -10.440 5.584 -6.253 27 HB VAL 5 HB VAL 5 -9.540 2.736 -5.780 28 1HG1 VAL 5 HG11 VAL 5 -8.036 3.665 -4.069 29 2HG1 VAL 5 HG12 VAL 5 -8.454 5.295 -4.602 30 3HG1 VAL 5 HG13 VAL 5 -7.602 4.200 -5.692 31 1HG2 VAL 5 HG21 VAL 5 -11.639 3.328 -4.697 32 2HG2 VAL 5 HG22 VAL 5 -10.887 4.756 -3.988 33 3HG2 VAL 5 HG23 VAL 5 -10.357 3.146 -3.501 34 H ARG 6 HN ARG 6 -9.061 6.742 -7.391 35 HA ARG 6 HA ARG 6 -7.629 5.516 -9.606 36 1HB ARG 6 HB2 ARG 6 -7.837 8.404 -8.739 37 2HB ARG 6 HB1 ARG 6 -6.993 7.847 -10.176 38 1HG ARG 6 HG2 ARG 6 -9.944 7.598 -9.632 39 2HG ARG 6 HG1 ARG 6 -9.171 8.724 -10.748 40 1HD ARG 6 HD2 ARG 6 -9.171 5.716 -10.946 41 2HD ARG 6 HD1 ARG 6 -10.092 6.830 -11.953 42 HE ARG 6 HE ARG 6 -7.155 6.955 -11.936 43 1HH1 ARG 6 HH11 ARG 6 -10.171 6.443 -13.656 44 2HH1 ARG 6 HH12 ARG 6 -9.396 6.337 -15.214 45 1HH2 ARG 6 HH21 ARG 6 -6.157 6.798 -13.980 46 2HH2 ARG 6 HH22 ARG 6 -7.124 6.536 -15.398 47 H VAL 7 HN VAL 7 -5.837 4.476 -9.013 48 HA VAL 7 HA VAL 7 -3.929 5.891 -7.272 49 HB VAL 7 HB VAL 7 -4.108 2.917 -7.818 50 1HG1 VAL 7 HG11 VAL 7 -1.810 3.603 -7.459 51 2HG1 VAL 7 HG12 VAL 7 -2.399 2.710 -6.056 52 3HG1 VAL 7 HG13 VAL 7 -2.273 4.468 -5.992 53 1HG2 VAL 7 HG21 VAL 7 -4.772 4.485 -5.327 54 2HG2 VAL 7 HG22 VAL 7 -4.768 2.726 -5.461 55 3HG2 VAL 7 HG23 VAL 7 -5.928 3.678 -6.389 56 H GLY 8 HN GLY 8 -2.352 6.816 -8.394 57 1HA GLY 8 HA2 GLY 8 -1.564 5.624 -10.964 58 2HA GLY 8 HA1 GLY 8 -1.294 7.296 -10.494 59 H ASP 9 HN ASP 9 0.889 6.339 -11.438 60 HA ASP 9 HA ASP 9 2.427 4.989 -9.364 61 1HB ASP 9 HB2 ASP 9 4.131 4.665 -10.973 62 2HB ASP 9 HB1 ASP 9 2.628 4.434 -11.858 63 H LEU 10 HN LEU 10 4.201 5.889 -8.341 64 HA LEU 10 HA LEU 10 4.786 8.702 -8.828 65 1HB LEU 10 HB2 LEU 10 4.684 9.279 -6.465 66 2HB LEU 10 HB1 LEU 10 3.125 8.734 -7.043 67 HG LEU 10 HG LEU 10 4.967 6.865 -5.574 68 1HD1 LEU 10 HD11 LEU 10 2.916 8.727 -4.377 69 2HD1 LEU 10 HD12 LEU 10 4.663 8.839 -4.165 70 3HD1 LEU 10 HD13 LEU 10 3.783 7.454 -3.518 71 1HD2 LEU 10 HD21 LEU 10 2.881 5.731 -5.032 72 2HD2 LEU 10 HD22 LEU 10 3.052 5.905 -6.781 73 3HD2 LEU 10 HD23 LEU 10 1.967 6.973 -5.888 74 H THR 11 HN THR 11 6.885 9.287 -8.344 75 HA THR 11 HA THR 11 8.655 7.011 -7.719 76 HB THR 11 HB THR 11 9.389 9.391 -9.422 77 HG1 THR 11 HG1 THR 11 7.589 8.087 -10.287 78 1HG2 THR 11 HG21 THR 11 10.577 6.628 -9.145 79 2HG2 THR 11 HG22 THR 11 11.262 8.123 -8.508 80 3HG2 THR 11 HG23 THR 11 11.140 7.881 -10.250 81 H VAL 12 HN VAL 12 9.666 7.233 -5.837 82 HA VAL 12 HA VAL 12 10.388 9.946 -4.936 83 HB VAL 12 HB VAL 12 8.520 9.082 -3.597 84 1HG1 VAL 12 HG11 VAL 12 8.919 6.699 -3.819 85 2HG1 VAL 12 HG12 VAL 12 8.800 7.162 -2.123 86 3HG1 VAL 12 HG13 VAL 12 10.378 6.839 -2.837 87 1HG2 VAL 12 HG21 VAL 12 10.087 10.579 -2.524 88 2HG2 VAL 12 HG22 VAL 12 11.125 9.221 -2.090 89 3HG2 VAL 12 HG23 VAL 12 9.521 9.371 -1.370 90 H ALA 13 HN ALA 13 12.408 10.216 -4.101 91 HA ALA 13 HA ALA 13 14.134 7.826 -4.068 92 1HB ALA 13 HB1 ALA 13 14.895 10.667 -4.752 93 2HB ALA 13 HB2 ALA 13 14.721 9.332 -5.893 94 3HB ALA 13 HB3 ALA 13 16.001 9.295 -4.678 95 H LYS 14 HN LYS 14 14.600 7.263 -2.053 96 HA LYS 14 HA LYS 14 15.703 9.125 -0.192 97 1HB LYS 14 HB2 LYS 14 13.046 9.285 -0.117 98 2HB LYS 14 HB1 LYS 14 13.220 7.840 0.867 99 1HG LYS 14 HG2 LYS 14 13.118 9.698 2.338 100 2HG LYS 14 HG1 LYS 14 14.787 9.124 2.334 101 1HD LYS 14 HD2 LYS 14 14.916 11.478 2.207 102 2HD LYS 14 HD1 LYS 14 15.244 10.892 0.576 103 1HE LYS 14 HE2 LYS 14 13.760 12.666 0.251 104 2HE LYS 14 HE1 LYS 14 12.736 11.230 0.159 105 1HZ LYS 14 HZ1 LYS 14 11.621 12.794 1.512 106 2HZ LYS 14 HZ2 LYS 14 13.009 13.121 2.431 107 3HZ LYS 14 HZ3 LYS 14 12.233 11.625 2.575 108 H THR 15 HN THR 15 15.799 7.928 2.068 109 HA THR 15 HA THR 15 16.769 5.213 1.539 110 HB THR 15 HB THR 15 17.598 5.908 4.076 111 HG1 THR 15 HG1 THR 15 18.057 8.190 2.454 112 1HG2 THR 15 HG21 THR 15 19.799 6.271 3.030 113 2HG2 THR 15 HG22 THR 15 19.021 6.350 1.449 114 3HG2 THR 15 HG23 THR 15 18.986 4.849 2.376 115 H ARG 16 HN ARG 16 16.366 3.556 3.295 116 HA ARG 16 HA ARG 16 13.550 3.694 3.958 117 1HB ARG 16 HB2 ARG 16 15.539 1.462 4.420 118 2HB ARG 16 HB1 ARG 16 13.827 1.366 4.827 119 1HG ARG 16 HG2 ARG 16 13.893 0.301 2.790 120 2HG ARG 16 HG1 ARG 16 13.467 1.950 2.324 121 1HD ARG 16 HD2 ARG 16 16.054 2.250 2.119 122 2HD ARG 16 HD1 ARG 16 16.045 0.492 1.987 123 HE ARG 16 HE ARG 16 14.575 0.775 0.057 124 1HH1 ARG 16 HH11 ARG 16 16.615 3.386 1.087 125 2HH1 ARG 16 HH12 ARG 16 16.450 4.296 -0.382 126 1HH2 ARG 16 HH21 ARG 16 14.410 1.921 -1.959 127 2HH2 ARG 16 HH22 ARG 16 15.230 3.438 -2.128 128 H GLY 17 HN GLY 17 16.395 4.551 5.516 129 1HA GLY 17 HA2 GLY 17 15.535 4.141 8.220 130 2HA GLY 17 HA1 GLY 17 16.811 5.230 7.684 131 H GLN 18 HN GLN 18 14.690 6.286 5.741 132 HA GLN 18 HA GLN 18 13.852 8.555 7.194 133 1HB GLN 18 HB2 GLN 18 14.142 8.724 4.829 134 2HB GLN 18 HB1 GLN 18 13.061 7.375 4.530 135 1HG GLN 18 HG2 GLN 18 11.743 9.138 3.939 136 2HG GLN 18 HG1 GLN 18 11.277 8.923 5.623 137 1HE2 GLN 18 HE21 GLN 18 13.776 10.107 6.618 138 2HE2 GLN 18 HE22 GLN 18 13.608 11.807 6.369 139 H LEU 19 HN LEU 19 12.443 5.423 6.664 140 HA LEU 19 HA LEU 19 9.726 6.363 7.145 141 1HB LEU 19 HB2 LEU 19 10.513 3.506 6.693 142 2HB LEU 19 HB1 LEU 19 8.991 4.302 6.331 143 HG LEU 19 HG LEU 19 11.576 4.756 4.840 144 1HD1 LEU 19 HD11 LEU 19 9.089 3.237 4.058 145 2HD1 LEU 19 HD12 LEU 19 10.659 2.531 4.437 146 3HD1 LEU 19 HD13 LEU 19 10.475 3.556 3.015 147 1HD2 LEU 19 HD21 LEU 19 8.781 5.742 4.293 148 2HD2 LEU 19 HD22 LEU 19 10.197 6.008 3.277 149 3HD2 LEU 19 HD23 LEU 19 10.121 6.721 4.887 150 H THR 20 HN THR 20 11.840 6.124 9.304 151 HA THR 20 HA THR 20 11.903 3.996 10.878 152 HB THR 20 HB THR 20 11.785 5.757 12.856 153 HG1 THR 20 HG1 THR 20 11.004 7.524 11.799 154 1HG2 THR 20 HG21 THR 20 14.132 6.323 12.379 155 2HG2 THR 20 HG22 THR 20 13.939 5.694 10.743 156 3HG2 THR 20 HG23 THR 20 13.802 4.609 12.125 157 H ASP 21 HN ASP 21 10.149 2.702 10.935 158 HA ASP 21 HA ASP 21 8.380 1.686 11.876 159 1HB ASP 21 HB2 ASP 21 8.283 4.057 13.742 160 2HB ASP 21 HB1 ASP 21 7.366 2.566 13.932 161 H ALA 22 HN ALA 22 7.687 5.178 11.697 162 HA ALA 22 HA ALA 22 5.718 4.683 9.674 163 1HB ALA 22 HB1 ALA 22 4.389 4.218 11.674 164 2HB ALA 22 HB2 ALA 22 3.808 5.641 10.811 165 3HB ALA 22 HB3 ALA 22 4.754 5.830 12.288 166 H ALA 23 HN ALA 23 7.420 5.976 8.705 167 HA ALA 23 HA ALA 23 6.561 8.777 8.768 168 1HB ALA 23 HB1 ALA 23 8.850 9.572 8.487 169 2HB ALA 23 HB2 ALA 23 9.453 7.919 8.608 170 3HB ALA 23 HB3 ALA 23 8.686 8.682 10.001 171 HA PRO 24 HA PRO 24 5.991 7.360 4.635 172 1HB PRO 24 HB2 PRO 24 4.584 9.436 3.702 173 2HB PRO 24 HB1 PRO 24 3.925 8.331 4.915 174 1HG PRO 24 HG2 PRO 24 5.122 11.051 5.282 175 2HG PRO 24 HG1 PRO 24 3.678 10.355 6.037 176 1HD PRO 24 HD2 PRO 24 6.136 10.480 7.258 177 2HD PRO 24 HD1 PRO 24 4.895 9.277 7.649 178 H ILE 25 HN ILE 25 7.320 7.319 2.977 179 HA ILE 25 HA ILE 25 8.985 9.526 2.201 180 HB ILE 25 HB ILE 25 9.056 7.980 0.017 181 1HG1 ILE 25 HG12 ILE 25 8.336 6.055 2.237 182 2HG1 ILE 25 HG11 ILE 25 7.304 6.462 0.870 183 1HG2 ILE 25 HG21 ILE 25 10.495 7.417 2.599 184 2HG2 ILE 25 HG22 ILE 25 10.977 8.569 1.354 185 3HG2 ILE 25 HG23 ILE 25 10.996 6.840 1.011 186 1HD1 ILE 25 HD11 ILE 25 8.400 4.332 0.530 187 2HD1 ILE 25 HD12 ILE 25 9.980 5.096 0.731 188 3HD1 ILE 25 HD13 ILE 25 8.967 5.513 -0.652 189 H GLY 26 HN GLY 26 6.283 7.830 0.652 190 1HA GLY 26 HA2 GLY 26 5.458 10.360 -0.582 191 2HA GLY 26 HA1 GLY 26 5.695 8.938 -1.592 192 HA PRO 27 HA PRO 27 1.716 8.405 1.155 193 1HB PRO 27 HB2 PRO 27 0.345 10.772 1.314 194 2HB PRO 27 HB1 PRO 27 1.396 10.156 2.591 195 1HG PRO 27 HG2 PRO 27 1.928 12.245 0.538 196 2HG PRO 27 HG1 PRO 27 2.448 12.172 2.231 197 1HD PRO 27 HD2 PRO 27 4.082 11.577 0.128 198 2HD PRO 27 HD1 PRO 27 4.272 10.869 1.742 199 H VAL 28 HN VAL 28 0.280 7.517 -0.165 200 HA VAL 28 HA VAL 28 0.009 8.465 -2.877 201 HB VAL 28 HB VAL 28 -1.421 6.176 -1.506 202 1HG1 VAL 28 HG11 VAL 28 -2.564 6.923 -3.513 203 2HG1 VAL 28 HG12 VAL 28 -1.805 5.358 -3.793 204 3HG1 VAL 28 HG13 VAL 28 -1.064 6.827 -4.430 205 1HG2 VAL 28 HG21 VAL 28 1.107 6.174 -3.156 206 2HG2 VAL 28 HG22 VAL 28 0.245 4.735 -2.613 207 3HG2 VAL 28 HG23 VAL 28 0.973 5.820 -1.432 208 H THR 29 HN THR 29 -1.489 9.835 -3.534 209 HA THR 29 HA THR 29 -3.571 10.707 -1.768 210 HB THR 29 HB THR 29 -2.631 12.422 -3.094 211 HG1 THR 29 HG1 THR 29 -5.159 11.680 -4.188 212 1HG2 THR 29 HG21 THR 29 -2.574 12.397 -5.549 213 2HG2 THR 29 HG22 THR 29 -3.243 10.763 -5.544 214 3HG2 THR 29 HG23 THR 29 -1.642 11.065 -4.865 215 H VAL 30 HN VAL 30 -4.539 8.572 -1.556 216 HA VAL 30 HA VAL 30 -5.884 7.359 -3.763 217 HB VAL 30 HB VAL 30 -6.228 7.000 -0.779 218 1HG1 VAL 30 HG11 VAL 30 -7.381 5.375 -3.044 219 2HG1 VAL 30 HG12 VAL 30 -8.280 6.346 -1.876 220 3HG1 VAL 30 HG13 VAL 30 -7.409 4.909 -1.345 221 1HG2 VAL 30 HG21 VAL 30 -4.991 4.904 -1.162 222 2HG2 VAL 30 HG22 VAL 30 -4.044 6.327 -1.591 223 3HG2 VAL 30 HG23 VAL 30 -4.787 5.349 -2.857 224 H GLN 31 HN GLN 31 -7.535 8.274 -4.719 225 HA GLN 31 HA GLN 31 -9.469 9.768 -3.109 226 1HB GLN 31 HB2 GLN 31 -9.956 11.118 -5.093 227 2HB GLN 31 HB1 GLN 31 -8.260 11.230 -4.653 228 1HG GLN 31 HG2 GLN 31 -7.787 9.517 -6.419 229 2HG GLN 31 HG1 GLN 31 -9.465 9.689 -6.935 230 1HE2 GLN 31 HE21 GLN 31 -9.004 10.531 -8.928 231 2HE2 GLN 31 HE22 GLN 31 -8.336 12.109 -9.157 232 H ALA 32 HN ALA 32 -11.439 9.021 -3.039 233 HA ALA 32 HA ALA 32 -12.193 6.863 -4.888 234 1HB ALA 32 HB1 ALA 32 -11.947 6.152 -2.554 235 2HB ALA 32 HB2 ALA 32 -13.615 6.004 -3.106 236 3HB ALA 32 HB3 ALA 32 -13.147 7.350 -2.067 237 H LEU 33 HN LEU 33 -13.970 7.098 -6.093 238 HA LEU 33 HA LEU 33 -15.511 9.585 -5.736 239 1HB LEU 33 HB2 LEU 33 -14.115 9.369 -7.797 240 2HB LEU 33 HB1 LEU 33 -15.085 7.984 -8.256 241 HG LEU 33 HG LEU 33 -17.091 9.441 -8.333 242 1HD1 LEU 33 HD11 LEU 33 -15.098 11.661 -7.882 243 2HD1 LEU 33 HD12 LEU 33 -16.369 11.160 -6.765 244 3HD1 LEU 33 HD13 LEU 33 -16.793 11.868 -8.324 245 1HD2 LEU 33 HD21 LEU 33 -16.505 10.567 -10.406 246 2HD2 LEU 33 HD22 LEU 33 -15.796 8.953 -10.353 247 3HD2 LEU 33 HD23 LEU 33 -14.790 10.369 -10.046 248 H GLY 34 HN GLY 34 -17.456 9.243 -4.911 249 1HA GLY 34 HA2 GLY 34 -19.628 8.517 -4.772 250 2HA GLY 34 HA1 GLY 34 -19.395 7.744 -6.329 251 H CYS 35 HN CYS 35 -18.679 7.316 -2.874 252 HA CYS 35 HA CYS 35 -18.716 4.420 -3.347 253 1HB CYS 35 HB2 CYS 35 -17.688 5.807 -0.880 254 2HB CYS 35 HB1 CYS 35 -17.374 4.156 -1.407 255 H ASN 36 HN ASN 36 -19.494 6.530 -0.586 256 HA ASN 36 HA ASN 36 -21.219 6.625 0.857 257 1HB ASN 36 HB2 ASN 36 -22.664 5.208 -1.364 258 2HB ASN 36 HB1 ASN 36 -23.456 5.678 0.135 259 1HD2 ASN 36 HD21 ASN 36 -22.169 6.735 -2.878 260 2HD2 ASN 36 HD22 ASN 36 -22.668 8.390 -2.754 261 H ALA 37 HN ALA 37 -21.002 3.364 -0.562 262 HA ALA 37 HA ALA 37 -20.718 2.294 2.137 263 1HB ALA 37 HB1 ALA 37 -22.366 0.537 1.772 264 2HB ALA 37 HB2 ALA 37 -22.751 1.210 0.188 265 3HB ALA 37 HB3 ALA 37 -23.119 2.126 1.649 266 H ARG 38 HN ARG 38 -18.530 2.293 1.107 267 HA ARG 38 HA ARG 38 -18.024 -0.301 -0.105 268 1HB ARG 38 HB2 ARG 38 -18.439 1.306 -1.979 269 2HB ARG 38 HB1 ARG 38 -17.081 2.260 -1.407 270 1HG ARG 38 HG2 ARG 38 -16.602 -0.601 -2.020 271 2HG ARG 38 HG1 ARG 38 -16.845 0.507 -3.371 272 1HD ARG 38 HD2 ARG 38 -15.075 1.827 -1.679 273 2HD ARG 38 HD1 ARG 38 -14.545 0.146 -1.651 274 HE ARG 38 HE ARG 38 -15.042 1.279 -4.279 275 1HH1 ARG 38 HH11 ARG 38 -12.710 0.469 -1.818 276 2HH1 ARG 38 HH12 ARG 38 -11.348 0.576 -2.890 277 1HH2 ARG 38 HH21 ARG 38 -13.282 1.427 -5.700 278 2HH2 ARG 38 HH22 ARG 38 -11.674 1.134 -5.107 279 H GLN 39 HN GLN 39 -16.183 -1.174 0.678 280 HA GLN 39 HA GLN 39 -14.567 0.446 2.461 281 1HB GLN 39 HB2 GLN 39 -14.564 -2.502 1.805 282 2HB GLN 39 HB1 GLN 39 -13.398 -1.756 2.892 283 1HG GLN 39 HG2 GLN 39 -15.163 -1.069 4.383 284 2HG GLN 39 HG1 GLN 39 -16.382 -1.679 3.269 285 1HE2 GLN 39 HE21 GLN 39 -15.830 -2.355 6.066 286 2HE2 GLN 39 HE22 GLN 39 -15.584 -4.067 6.087 287 H VAL 40 HN VAL 40 -12.709 1.364 1.928 288 HA VAL 40 HA VAL 40 -11.661 0.838 -0.753 289 HB VAL 40 HB VAL 40 -11.121 3.129 1.148 290 1HG1 VAL 40 HG11 VAL 40 -9.830 4.134 -0.684 291 2HG1 VAL 40 HG12 VAL 40 -10.023 2.654 -1.623 292 3HG1 VAL 40 HG13 VAL 40 -9.101 2.631 -0.119 293 1HG2 VAL 40 HG21 VAL 40 -12.557 2.998 -1.501 294 2HG2 VAL 40 HG22 VAL 40 -12.240 4.470 -0.580 295 3HG2 VAL 40 HG23 VAL 40 -13.301 3.226 0.082 296 H ALA 41 HN ALA 41 -10.106 -0.617 -0.876 297 HA ALA 41 HA ALA 41 -8.250 -0.899 1.377 298 1HB ALA 41 HB1 ALA 41 -8.216 -3.221 1.082 299 2HB ALA 41 HB2 ALA 41 -8.942 -3.114 -0.520 300 3HB ALA 41 HB3 ALA 41 -9.921 -2.793 0.908 301 H LEU 42 HN LEU 42 -6.102 -1.046 0.930 302 HA LEU 42 HA LEU 42 -5.303 -0.776 -1.879 303 1HB LEU 42 HB2 LEU 42 -3.630 -0.407 0.603 304 2HB LEU 42 HB1 LEU 42 -3.154 -0.035 -1.042 305 HG LEU 42 HG LEU 42 -5.288 1.361 0.557 306 1HD1 LEU 42 HD11 LEU 42 -3.763 3.288 0.372 307 2HD1 LEU 42 HD12 LEU 42 -2.568 2.244 -0.399 308 3HD1 LEU 42 HD13 LEU 42 -3.054 1.947 1.271 309 1HD2 LEU 42 HD21 LEU 42 -5.910 1.255 -1.796 310 2HD2 LEU 42 HD22 LEU 42 -4.323 1.872 -2.257 311 3HD2 LEU 42 HD23 LEU 42 -5.438 2.896 -1.353 312 H LYS 43 HN LYS 43 -4.331 -2.393 -2.893 313 HA LYS 43 HA LYS 43 -3.399 -4.682 -1.292 314 1HB LYS 43 HB2 LYS 43 -4.470 -4.885 -4.110 315 2HB LYS 43 HB1 LYS 43 -4.114 -6.198 -3.001 316 1HG LYS 43 HG2 LYS 43 -6.415 -6.101 -2.952 317 2HG LYS 43 HG1 LYS 43 -5.961 -5.143 -1.539 318 1HD LYS 43 HD2 LYS 43 -6.131 -3.100 -2.982 319 2HD LYS 43 HD1 LYS 43 -6.800 -4.127 -4.251 320 1HE LYS 43 HE2 LYS 43 -7.956 -3.731 -1.502 321 2HE LYS 43 HE1 LYS 43 -8.551 -2.986 -2.986 322 1HZ LYS 43 HZ1 LYS 43 -8.622 -5.825 -2.199 323 2HZ LYS 43 HZ2 LYS 43 -8.824 -5.346 -3.807 324 3HZ LYS 43 HZ3 LYS 43 -9.918 -4.818 -2.625 325 H ALA 44 HN ALA 44 -1.545 -5.751 -2.098 326 HA ALA 44 HA ALA 44 0.114 -4.039 -3.772 327 1HB ALA 44 HB1 ALA 44 1.928 -5.605 -3.112 328 2HB ALA 44 HB2 ALA 44 0.753 -6.479 -2.131 329 3HB ALA 44 HB3 ALA 44 1.142 -4.802 -1.755 330 H ASP 45 HN ASP 45 1.365 -5.005 -5.513 331 HA ASP 45 HA ASP 45 -0.308 -6.800 -7.084 332 1HB ASP 45 HB2 ASP 45 0.734 -4.686 -8.037 333 2HB ASP 45 HB1 ASP 45 2.295 -5.492 -7.909 334 H THR 46 HN THR 46 1.086 -8.496 -8.414 335 HA THR 46 HA THR 46 1.863 -10.359 -6.433 336 HB THR 46 HB THR 46 0.782 -10.998 -8.559 337 HG1 THR 46 HG1 THR 46 3.217 -12.367 -8.685 338 1HG2 THR 46 HG21 THR 46 1.965 -9.495 -10.065 339 2HG2 THR 46 HG22 THR 46 2.115 -11.168 -10.603 340 3HG2 THR 46 HG23 THR 46 3.465 -10.381 -9.788 341 H ASP 47 HN ASP 47 3.609 -7.818 -7.595 342 HA ASP 47 HA ASP 47 6.172 -9.178 -7.610 343 1HB ASP 47 HB2 ASP 47 7.102 -6.877 -8.045 344 2HB ASP 47 HB1 ASP 47 6.011 -7.493 -9.275 345 H ASN 48 HN ASN 48 4.210 -7.271 -5.447 346 HA ASN 48 HA ASN 48 6.312 -7.635 -3.411 347 1HB ASN 48 HB2 ASN 48 5.801 -5.475 -2.421 348 2HB ASN 48 HB1 ASN 48 6.270 -5.265 -4.104 349 1HD2 ASN 48 HD21 ASN 48 4.708 -3.558 -2.311 350 2HD2 ASN 48 HD22 ASN 48 3.201 -3.288 -3.118 351 H PHE 49 HN PHE 49 3.530 -8.798 -4.252 352 HA PHE 49 HA PHE 49 2.367 -8.827 -1.537 353 1HB PHE 49 HB2 PHE 49 0.953 -7.920 -3.425 354 2HB PHE 49 HB1 PHE 49 1.018 -9.506 -4.160 355 HD1 PHE 49 HD1 PHE 49 -0.263 -7.603 -1.252 356 HD2 PHE 49 HD2 PHE 49 -0.454 -11.214 -3.502 357 HE1 PHE 49 HE1 PHE 49 -2.345 -8.204 -0.107 358 HE2 PHE 49 HE2 PHE 49 -2.537 -11.824 -2.345 359 HZ PHE 49 HZ PHE 49 -3.496 -10.306 -0.653 360 H GLU 50 HN GLU 50 3.345 -10.574 -0.594 361 HA GLU 50 HA GLU 50 3.542 -13.047 -2.139 362 1HB GLU 50 HB2 GLU 50 4.868 -13.892 -0.194 363 2HB GLU 50 HB1 GLU 50 5.572 -12.494 -0.991 364 1HG GLU 50 HG2 GLU 50 4.943 -11.052 0.765 365 2HG GLU 50 HG1 GLU 50 3.887 -12.266 1.478 366 H GLN 51 HN GLN 51 1.502 -13.795 -2.228 367 HA GLN 51 HA GLN 51 -0.298 -15.033 -1.647 368 1HB GLN 51 HB2 GLN 51 1.006 -15.303 1.067 369 2HB GLN 51 HB1 GLN 51 -0.322 -16.277 0.450 370 1HG GLN 51 HG2 GLN 51 2.501 -16.203 -0.581 371 2HG GLN 51 HG1 GLN 51 1.718 -17.522 0.284 372 1HE2 GLN 51 HE21 GLN 51 2.988 -17.494 -2.341 373 2HE2 GLN 51 HE22 GLN 51 1.777 -17.994 -3.477 374 H GLY 52 HN GLY 52 0.598 -12.917 1.069 375 1HA GLY 52 HA2 GLY 52 -1.733 -11.313 0.791 376 2HA GLY 52 HA1 GLY 52 -1.913 -12.438 2.136 377 H LYS 53 HN LYS 53 1.069 -10.966 1.041 378 HA LYS 53 HA LYS 53 1.159 -9.227 3.403 379 1HB LYS 53 HB2 LYS 53 3.461 -10.967 2.495 380 2HB LYS 53 HB1 LYS 53 3.431 -9.915 3.899 381 1HG LYS 53 HG2 LYS 53 1.534 -12.219 3.649 382 2HG LYS 53 HG1 LYS 53 3.175 -12.436 4.258 383 1HD LYS 53 HD2 LYS 53 1.244 -10.430 5.394 384 2HD LYS 53 HD1 LYS 53 1.388 -12.081 6.001 385 1HE LYS 53 HE2 LYS 53 3.646 -10.084 5.854 386 2HE LYS 53 HE1 LYS 53 2.717 -10.451 7.307 387 1HZ LYS 53 HZ1 LYS 53 3.509 -12.708 7.243 388 2HZ LYS 53 HZ2 LYS 53 4.838 -11.655 7.204 389 3HZ LYS 53 HZ3 LYS 53 4.332 -12.434 5.783 390 H PHE 54 HN PHE 54 1.982 -7.213 2.880 391 HA PHE 54 HA PHE 54 3.356 -7.038 0.301 392 1HB PHE 54 HB2 PHE 54 2.533 -4.624 0.235 393 2HB PHE 54 HB1 PHE 54 1.393 -5.906 -0.107 394 HD1 PHE 54 HD1 PHE 54 -0.637 -4.727 0.362 395 HD2 PHE 54 HD2 PHE 54 2.495 -4.879 3.239 396 HE1 PHE 54 HE1 PHE 54 -2.158 -3.817 2.069 397 HE2 PHE 54 HE2 PHE 54 0.981 -3.962 4.948 398 HZ PHE 54 HZ PHE 54 -1.461 -3.322 4.199 399 H PHE 55 HN PHE 55 5.001 -5.554 0.007 400 HA PHE 55 HA PHE 55 6.268 -4.326 2.297 401 1HB PHE 55 HB2 PHE 55 8.409 -5.698 1.782 402 2HB PHE 55 HB1 PHE 55 7.163 -6.460 2.758 403 HD1 PHE 55 HD1 PHE 55 8.575 -6.245 -0.647 404 HD2 PHE 55 HD2 PHE 55 6.113 -8.447 2.033 405 HE1 PHE 55 HE1 PHE 55 8.521 -8.115 -2.240 406 HE2 PHE 55 HE2 PHE 55 6.052 -10.323 0.438 407 HZ PHE 55 HZ PHE 55 7.175 -10.144 -1.709 408 H LEU 56 HN LEU 56 8.490 -3.499 1.631 409 HA LEU 56 HA LEU 56 8.485 -2.461 -1.087 410 1HB LEU 56 HB2 LEU 56 10.664 -2.148 0.979 411 2HB LEU 56 HB1 LEU 56 10.364 -1.147 -0.421 412 HG LEU 56 HG LEU 56 8.504 -1.293 1.946 413 1HD1 LEU 56 HD11 LEU 56 10.644 0.737 1.315 414 2HD1 LEU 56 HD12 LEU 56 10.673 -0.425 2.642 415 3HD1 LEU 56 HD13 LEU 56 9.458 0.852 2.615 416 1HD2 LEU 56 HD21 LEU 56 7.573 0.743 1.008 417 2HD2 LEU 56 HD22 LEU 56 7.488 -0.573 -0.164 418 3HD2 LEU 56 HD23 LEU 56 8.725 0.677 -0.325 419 H ILE 57 HN ILE 57 9.184 -3.879 -2.621 420 HA ILE 57 HA ILE 57 11.428 -5.644 -1.911 421 HB ILE 57 HB ILE 57 9.443 -6.849 -2.683 422 1HG1 ILE 57 HG12 ILE 57 10.489 -8.116 -4.572 423 2HG1 ILE 57 HG11 ILE 57 11.741 -6.880 -4.650 424 1HG2 ILE 57 HG21 ILE 57 8.419 -5.159 -4.061 425 2HG2 ILE 57 HG22 ILE 57 8.660 -6.631 -5.002 426 3HG2 ILE 57 HG23 ILE 57 9.745 -5.257 -5.220 427 1HD1 ILE 57 HD11 ILE 57 12.506 -8.835 -3.432 428 2HD1 ILE 57 HD12 ILE 57 11.169 -8.668 -2.296 429 3HD1 ILE 57 HD13 ILE 57 12.423 -7.429 -2.371 430 H SER 58 HN SER 58 13.294 -5.619 -3.121 431 HA SER 58 HA SER 58 13.581 -3.232 -4.796 432 1HB SER 58 HB2 SER 58 14.995 -3.678 -2.652 433 2HB SER 58 HB1 SER 58 15.889 -4.798 -3.680 434 HG SER 58 HG SER 58 16.752 -3.178 -4.732 435 H ASP 59 HN ASP 59 14.829 -3.327 -6.690 436 HA ASP 59 HA ASP 59 14.071 -5.205 -8.527 437 1HB ASP 59 HB2 ASP 59 14.903 -3.140 -9.314 438 2HB ASP 59 HB1 ASP 59 16.434 -3.341 -8.471 439 H ASN 60 HN ASN 60 17.076 -5.239 -6.642 440 HA ASN 60 HA ASN 60 18.299 -7.340 -8.076 441 1HB ASN 60 HB2 ASN 60 19.567 -5.806 -6.641 442 2HB ASN 60 HB1 ASN 60 18.769 -6.468 -5.217 443 1HD2 ASN 60 HD21 ASN 60 21.034 -7.110 -7.786 444 2HD2 ASN 60 HD22 ASN 60 21.799 -8.475 -7.045 445 H ASN 61 HN ASN 61 15.796 -7.358 -5.739 446 HA ASN 61 HA ASN 61 14.652 -8.977 -4.647 447 1HB ASN 61 HB2 ASN 61 14.538 -10.001 -6.920 448 2HB ASN 61 HB1 ASN 61 16.005 -10.902 -6.559 449 1HD2 ASN 61 HD21 ASN 61 12.611 -10.603 -6.001 450 2HD2 ASN 61 HD22 ASN 61 12.404 -12.113 -5.163 451 H ARG 62 HN ARG 62 15.772 -8.618 -2.731 452 HA ARG 62 HA ARG 62 17.438 -10.792 -1.824 453 1HB ARG 62 HB2 ARG 62 19.234 -9.191 -1.009 454 2HB ARG 62 HB1 ARG 62 19.215 -9.523 -2.736 455 1HG ARG 62 HG2 ARG 62 18.355 -7.413 -3.251 456 2HG ARG 62 HG1 ARG 62 17.841 -7.120 -1.589 457 1HD ARG 62 HD2 ARG 62 20.720 -7.427 -2.408 458 2HD ARG 62 HD1 ARG 62 19.893 -5.870 -2.320 459 HE ARG 62 HE ARG 62 19.420 -6.706 0.115 460 1HH1 ARG 62 HH11 ARG 62 22.366 -7.213 -1.702 461 2HH1 ARG 62 HH12 ARG 62 23.394 -7.104 -0.304 462 1HH2 ARG 62 HH21 ARG 62 20.733 -6.571 1.930 463 2HH2 ARG 62 HH22 ARG 62 22.458 -6.743 1.783 464 H ASP 63 HN ASP 63 16.055 -7.621 -1.177 465 HA ASP 63 HA ASP 63 15.434 -8.517 1.541 466 1HB ASP 63 HB2 ASP 63 16.709 -5.929 0.696 467 2HB ASP 63 HB1 ASP 63 15.715 -5.998 2.149 468 H LYS 64 HN LYS 64 13.573 -7.574 2.463 469 HA LYS 64 HA LYS 64 11.888 -5.899 0.826 470 1HB LYS 64 HB2 LYS 64 9.950 -7.499 0.959 471 2HB LYS 64 HB1 LYS 64 11.236 -7.985 -0.130 472 1HG LYS 64 HG2 LYS 64 10.842 -9.968 0.893 473 2HG LYS 64 HG1 LYS 64 12.056 -9.321 1.991 474 1HD LYS 64 HD2 LYS 64 10.175 -8.440 3.405 475 2HD LYS 64 HD1 LYS 64 9.063 -9.336 2.372 476 1HE LYS 64 HE2 LYS 64 9.553 -10.647 4.334 477 2HE LYS 64 HE1 LYS 64 10.275 -11.419 2.919 478 1HZ LYS 64 HZ1 LYS 64 11.794 -11.412 4.789 479 2HZ LYS 64 HZ2 LYS 64 11.707 -9.721 4.898 480 3HZ LYS 64 HZ3 LYS 64 12.410 -10.451 3.533 481 H LEU 65 HN LEU 65 10.782 -4.550 2.085 482 HA LEU 65 HA LEU 65 10.720 -5.163 4.969 483 1HB LEU 65 HB2 LEU 65 10.528 -2.374 3.940 484 2HB LEU 65 HB1 LEU 65 11.164 -2.964 5.466 485 HG LEU 65 HG LEU 65 12.518 -3.272 2.799 486 1HD1 LEU 65 HD11 LEU 65 13.147 -1.417 5.086 487 2HD1 LEU 65 HD12 LEU 65 12.447 -0.943 3.539 488 3HD1 LEU 65 HD13 LEU 65 14.085 -1.596 3.604 489 1HD2 LEU 65 HD21 LEU 65 13.085 -5.067 4.349 490 2HD2 LEU 65 HD22 LEU 65 13.492 -3.880 5.589 491 3HD2 LEU 65 HD23 LEU 65 14.457 -3.983 4.117 492 H TYR 66 HN TYR 66 8.742 -5.472 5.768 493 HA TYR 66 HA TYR 66 6.447 -5.140 4.139 494 1HB TYR 66 HB2 TYR 66 6.707 -5.751 7.086 495 2HB TYR 66 HB1 TYR 66 5.191 -5.807 6.192 496 HD1 TYR 66 HD1 TYR 66 8.480 -7.409 6.629 497 HD2 TYR 66 HD2 TYR 66 4.682 -7.640 4.731 498 HE1 TYR 66 HE1 TYR 66 8.935 -9.744 6.015 499 HE2 TYR 66 HE2 TYR 66 5.127 -9.976 4.110 500 HH TYR 66 HH TYR 66 7.109 -11.440 3.727 501 H VAL 67 HN VAL 67 5.077 -3.499 3.957 502 HA VAL 67 HA VAL 67 5.456 -1.203 5.756 503 HB VAL 67 HB VAL 67 4.836 0.241 3.792 504 1HG1 VAL 67 HG11 VAL 67 7.105 0.119 4.607 505 2HG1 VAL 67 HG12 VAL 67 7.111 0.186 2.842 506 3HG1 VAL 67 HG13 VAL 67 7.395 -1.348 3.669 507 1HG2 VAL 67 HG21 VAL 67 5.471 -2.272 2.241 508 2HG2 VAL 67 HG22 VAL 67 5.220 -0.667 1.552 509 3HG2 VAL 67 HG23 VAL 67 3.889 -1.500 2.358 510 H ASN 68 HN ASN 68 3.728 -0.637 6.829 511 HA ASN 68 HA ASN 68 1.118 -1.517 5.850 512 1HB ASN 68 HB2 ASN 68 2.102 -0.665 8.558 513 2HB ASN 68 HB1 ASN 68 0.384 -0.612 8.183 514 1HD2 ASN 68 HD21 ASN 68 3.114 -2.632 8.806 515 2HD2 ASN 68 HD22 ASN 68 2.248 -4.124 8.911 516 H ILE 69 HN ILE 69 0.097 -0.158 4.617 517 HA ILE 69 HA ILE 69 0.826 2.604 4.452 518 HB ILE 69 HB ILE 69 -1.630 1.517 3.139 519 1HG1 ILE 69 HG12 ILE 69 1.196 0.932 2.222 520 2HG1 ILE 69 HG11 ILE 69 0.112 -0.251 2.946 521 1HG2 ILE 69 HG21 ILE 69 -0.976 2.994 1.355 522 2HG2 ILE 69 HG22 ILE 69 0.585 3.294 2.121 523 3HG2 ILE 69 HG23 ILE 69 -0.895 3.878 2.879 524 1HD1 ILE 69 HD11 ILE 69 -1.416 -0.008 1.073 525 2HD1 ILE 69 HD12 ILE 69 0.200 -0.461 0.523 526 3HD1 ILE 69 HD13 ILE 69 -0.356 1.207 0.357 527 H ARG 70 HN ARG 70 0.297 3.464 6.472 528 HA ARG 70 HA ARG 70 -2.470 3.283 7.383 529 1HB ARG 70 HB2 ARG 70 -0.022 4.456 8.734 530 2HB ARG 70 HB1 ARG 70 -1.615 4.301 9.467 531 1HG ARG 70 HG2 ARG 70 -1.491 1.943 9.467 532 2HG ARG 70 HG1 ARG 70 -0.073 1.946 8.421 533 1HD ARG 70 HD2 ARG 70 1.228 3.004 10.221 534 2HD ARG 70 HD1 ARG 70 -0.195 2.952 11.263 535 HE ARG 70 HE ARG 70 -0.076 0.444 10.910 536 1HH1 ARG 70 HH11 ARG 70 2.759 2.501 10.948 537 2HH1 ARG 70 HH12 ARG 70 3.852 1.209 11.320 538 1HH2 ARG 70 HH21 ARG 70 1.345 -1.252 11.411 539 2HH2 ARG 70 HH22 ARG 70 3.053 -0.955 11.570 540 HA PRO 71 HA PRO 71 -3.795 7.118 5.715 541 1HB PRO 71 HB2 PRO 71 -4.957 7.592 8.425 542 2HB PRO 71 HB1 PRO 71 -5.726 7.694 6.835 543 1HG PRO 71 HG2 PRO 71 -6.172 5.603 8.418 544 2HG PRO 71 HG1 PRO 71 -5.983 5.392 6.667 545 1HD PRO 71 HD2 PRO 71 -4.064 4.786 8.867 546 2HD PRO 71 HD1 PRO 71 -4.335 3.932 7.335 547 H MET 72 HN MET 72 -2.835 9.028 5.484 548 HA MET 72 HA MET 72 -0.797 9.867 7.314 549 1HB MET 72 HB2 MET 72 -0.558 10.178 4.886 550 2HB MET 72 HB1 MET 72 -1.948 11.254 4.882 551 1HG MET 72 HG2 MET 72 0.061 12.547 4.763 552 2HG MET 72 HG1 MET 72 -0.712 12.817 6.322 553 1HE MET 72 HE1 MET 72 1.513 13.922 7.215 554 2HE MET 72 HE2 MET 72 2.295 13.638 5.658 555 3HE MET 72 HE3 MET 72 3.095 13.142 7.151 556 H ASP 73 HN ASP 73 -2.293 9.981 9.140 557 HA ASP 73 HA ASP 73 -3.608 11.025 10.657 558 1HB ASP 73 HB2 ASP 73 -1.714 12.595 10.656 559 2HB ASP 73 HB1 ASP 73 -2.476 13.518 9.364 560 H ASN 74 HN ASN 74 -5.479 10.180 9.563 561 HA ASN 74 HA ASN 74 -7.252 12.296 8.637 562 1HB ASN 74 HB2 ASN 74 -6.301 10.063 6.901 563 2HB ASN 74 HB1 ASN 74 -7.993 10.531 6.781 564 1HD2 ASN 74 HD21 ASN 74 -4.716 11.447 6.145 565 2HD2 ASN 74 HD22 ASN 74 -5.075 12.855 5.214 566 H SER 75 HN SER 75 -7.087 8.734 8.931 567 HA SER 75 HA SER 75 -9.414 8.758 10.662 568 1HB SER 75 HB2 SER 75 -9.461 7.237 8.046 569 2HB SER 75 HB1 SER 75 -10.740 7.288 9.256 570 HG SER 75 HG SER 75 -11.222 9.328 8.701 571 H ALA 76 HN ALA 76 -10.060 6.329 11.052 572 HA ALA 76 HA ALA 76 -7.578 4.823 11.536 573 1HB ALA 76 HB1 ALA 76 -8.900 5.402 13.536 574 2HB ALA 76 HB2 ALA 76 -8.791 3.661 13.287 575 3HB ALA 76 HB3 ALA 76 -10.273 4.520 12.866 576 H TRP 77 HN TRP 77 -7.228 3.101 10.311 577 HA TRP 77 HA TRP 77 -9.506 1.916 8.859 578 1HB TRP 77 HB2 TRP 77 -6.626 2.317 8.103 579 2HB TRP 77 HB1 TRP 77 -7.607 1.110 7.295 580 HD1 TRP 77 HD1 TRP 77 -9.165 4.511 8.188 581 HE1 TRP 77 HE1 TRP 77 -9.665 5.776 5.985 582 HE3 TRP 77 HE3 TRP 77 -6.816 1.375 4.906 583 HZ2 TRP 77 HZ2 TRP 77 -9.116 5.461 3.231 584 HZ3 TRP 77 HZ3 TRP 77 -6.849 1.928 2.511 585 HH2 TRP 77 HH2 TRP 77 -7.977 3.927 1.693 586 H THR 78 HN THR 78 -9.168 -0.403 8.264 587 HA THR 78 HA THR 78 -8.173 -1.947 10.518 588 HB THR 78 HB THR 78 -9.448 -2.936 7.953 589 HG1 THR 78 HG1 THR 78 -10.764 -2.521 10.453 590 1HG2 THR 78 HG21 THR 78 -9.208 -4.225 10.677 591 2HG2 THR 78 HG22 THR 78 -8.241 -4.643 9.262 592 3HG2 THR 78 HG23 THR 78 -9.982 -4.927 9.256 593 H THR 79 HN THR 79 -6.313 -3.140 10.465 594 HA THR 79 HA THR 79 -4.628 -2.647 8.115 595 HB THR 79 HB THR 79 -3.808 -1.495 10.044 596 HG1 THR 79 HG1 THR 79 -2.367 -3.275 8.748 597 1HG2 THR 79 HG21 THR 79 -4.919 -2.817 11.782 598 2HG2 THR 79 HG22 THR 79 -3.202 -2.600 12.127 599 3HG2 THR 79 HG23 THR 79 -3.785 -4.140 11.496 600 H ASP 80 HN ASP 80 -4.465 -4.346 6.857 601 HA ASP 80 HA ASP 80 -3.555 -6.860 8.100 602 1HB ASP 80 HB2 ASP 80 -5.877 -7.017 7.017 603 2HB ASP 80 HB1 ASP 80 -5.075 -6.711 5.483 604 H ASN 81 HN ASN 81 -2.028 -8.067 6.600 605 HA ASN 81 HA ASN 81 -0.300 -6.113 5.324 606 1HB ASN 81 HB2 ASN 81 0.040 -9.039 5.920 607 2HB ASN 81 HB1 ASN 81 1.174 -8.159 4.905 608 1HD2 ASN 81 HD21 ASN 81 2.442 -6.522 5.810 609 2HD2 ASN 81 HD22 ASN 81 2.725 -6.438 7.521 610 H GLY 82 HN GLY 82 -2.873 -7.985 4.373 611 1HA GLY 82 HA2 GLY 82 -1.866 -8.227 1.642 612 2HA GLY 82 HA1 GLY 82 -3.340 -8.959 2.262 613 H VAL 83 HN VAL 83 -4.356 -6.618 3.531 614 HA VAL 83 HA VAL 83 -4.720 -4.733 1.334 615 HB VAL 83 HB VAL 83 -7.161 -4.685 1.641 616 1HG1 VAL 83 HG11 VAL 83 -7.684 -6.776 0.462 617 2HG1 VAL 83 HG12 VAL 83 -6.082 -7.396 0.872 618 3HG1 VAL 83 HG13 VAL 83 -6.240 -5.993 -0.186 619 1HG2 VAL 83 HG21 VAL 83 -6.719 -7.126 3.360 620 2HG2 VAL 83 HG22 VAL 83 -8.285 -6.521 2.824 621 3HG2 VAL 83 HG23 VAL 83 -7.290 -5.550 3.909 622 H PHE 84 HN PHE 84 -5.621 -2.715 2.009 623 HA PHE 84 HA PHE 84 -5.662 -2.309 4.917 624 1HB PHE 84 HB2 PHE 84 -3.590 -1.430 3.335 625 2HB PHE 84 HB1 PHE 84 -4.652 -0.026 3.360 626 HD1 PHE 84 HD1 PHE 84 -5.534 0.667 5.734 627 HD2 PHE 84 HD2 PHE 84 -2.078 -1.717 5.037 628 HE1 PHE 84 HE1 PHE 84 -4.680 1.259 7.965 629 HE2 PHE 84 HE2 PHE 84 -1.214 -1.123 7.258 630 HZ PHE 84 HZ PHE 84 -2.517 0.364 8.731 631 H TYR 85 HN TYR 85 -7.706 -1.760 5.351 632 HA TYR 85 HA TYR 85 -9.035 0.213 3.668 633 1HB TYR 85 HB2 TYR 85 -10.996 -1.139 3.278 634 2HB TYR 85 HB1 TYR 85 -9.590 -2.008 2.697 635 HD1 TYR 85 HD1 TYR 85 -12.534 -2.239 4.647 636 HD2 TYR 85 HD2 TYR 85 -8.568 -3.757 4.346 637 HE1 TYR 85 HE1 TYR 85 -13.178 -4.187 6.006 638 HE2 TYR 85 HE2 TYR 85 -9.207 -5.707 5.700 639 HH TYR 85 HH TYR 85 -10.858 -6.378 7.286 640 H LYS 86 HN LYS 86 -10.714 1.318 4.728 641 HA LYS 86 HA LYS 86 -10.703 1.022 7.590 642 1HB LYS 86 HB2 LYS 86 -11.982 2.974 7.735 643 2HB LYS 86 HB1 LYS 86 -10.907 3.266 6.383 644 1HG LYS 86 HG2 LYS 86 -13.624 2.190 5.837 645 2HG LYS 86 HG1 LYS 86 -13.465 3.878 6.309 646 1HD LYS 86 HD2 LYS 86 -11.799 4.143 4.450 647 2HD LYS 86 HD1 LYS 86 -12.228 2.511 3.924 648 1HE LYS 86 HE2 LYS 86 -14.549 3.193 3.635 649 2HE LYS 86 HE1 LYS 86 -14.165 4.809 4.229 650 1HZ LYS 86 HZ1 LYS 86 -12.967 3.614 1.801 651 2HZ LYS 86 HZ2 LYS 86 -12.821 5.211 2.336 652 3HZ LYS 86 HZ3 LYS 86 -14.318 4.635 1.793 653 H ASN 87 HN ASN 87 -12.297 0.229 8.849 654 HA ASN 87 HA ASN 87 -13.919 -1.821 7.878 655 1HB ASN 87 HB2 ASN 87 -13.235 -1.591 10.244 656 2HB ASN 87 HB1 ASN 87 -14.305 -0.201 10.408 657 1HD2 ASN 87 HD21 ASN 87 -14.105 -3.661 10.122 658 2HD2 ASN 87 HD22 ASN 87 -15.752 -3.993 10.529 659 H ASP 88 HN ASP 88 -14.568 1.586 8.340 660 HA ASP 88 HA ASP 88 -17.347 1.604 7.974 661 1HB ASP 88 HB2 ASP 88 -15.238 3.685 7.392 662 2HB ASP 88 HB1 ASP 88 -16.958 3.988 7.179 663 H VAL 89 HN VAL 89 -18.511 1.024 6.267 664 HA VAL 89 HA VAL 89 -17.334 0.915 3.635 665 HB VAL 89 HB VAL 89 -19.669 0.296 2.894 666 1HG1 VAL 89 HG11 VAL 89 -17.997 -1.400 3.380 667 2HG1 VAL 89 HG12 VAL 89 -19.597 -1.942 3.886 668 3HG1 VAL 89 HG13 VAL 89 -18.440 -1.368 5.085 669 1HG2 VAL 89 HG21 VAL 89 -21.279 -0.355 4.635 670 2HG2 VAL 89 HG22 VAL 89 -20.949 1.377 4.662 671 3HG2 VAL 89 HG23 VAL 89 -20.211 0.320 5.864 672 H GLY 90 HN GLY 90 -16.920 2.830 2.682 673 1HA GLY 90 HA2 GLY 90 -18.911 4.468 1.683 674 2HA GLY 90 HA1 GLY 90 -18.438 5.176 3.219 675 H SER 91 HN SER 91 -17.804 7.007 1.895 676 HA SER 91 HA SER 91 -15.568 6.662 0.107 677 1HB SER 91 HB2 SER 91 -16.949 9.190 1.037 678 2HB SER 91 HB1 SER 91 -15.843 9.045 -0.330 679 HG SER 91 HG SER 91 -18.447 8.737 -0.368 680 H TRP 92 HN TRP 92 -13.642 8.052 0.360 681 HA TRP 92 HA TRP 92 -12.957 8.876 3.058 682 1HB TRP 92 HB2 TRP 92 -12.366 6.436 2.850 683 2HB TRP 92 HB1 TRP 92 -11.202 6.912 1.607 684 HD1 TRP 92 HD1 TRP 92 -11.910 7.507 5.365 685 HE1 TRP 92 HE1 TRP 92 -9.674 8.101 6.502 686 HE3 TRP 92 HE3 TRP 92 -8.972 7.664 1.225 687 HZ2 TRP 92 HZ2 TRP 92 -6.986 8.563 5.704 688 HZ3 TRP 92 HZ3 TRP 92 -6.611 8.195 1.468 689 HH2 TRP 92 HH2 TRP 92 -5.618 8.631 3.661 690 H GLY 93 HN GLY 93 -11.424 8.169 -0.031 691 1HA GLY 93 HA2 GLY 93 -9.863 9.363 -1.262 692 2HA GLY 93 HA1 GLY 93 -11.148 10.543 -1.229 693 H GLY 94 HN GLY 94 -8.017 9.666 0.016 694 1HA GLY 94 HA2 GLY 94 -7.514 12.416 0.702 695 2HA GLY 94 HA1 GLY 94 -7.548 11.346 2.096 696 H THR 95 HN THR 95 -5.542 10.905 2.723 697 HA THR 95 HA THR 95 -3.571 10.152 0.684 698 HB THR 95 HB THR 95 -1.861 11.379 2.208 699 HG1 THR 95 HG1 THR 95 -3.249 13.401 2.915 700 1HG2 THR 95 HG21 THR 95 -2.157 13.464 0.949 701 2HG2 THR 95 HG22 THR 95 -3.770 12.940 0.463 702 3HG2 THR 95 HG23 THR 95 -2.350 12.051 -0.088 703 H ILE 96 HN ILE 96 -2.421 8.390 1.164 704 HA ILE 96 HA ILE 96 -2.205 7.527 3.971 705 HB ILE 96 HB ILE 96 -2.134 5.203 2.363 706 1HG1 ILE 96 HG12 ILE 96 -4.320 7.115 1.648 707 2HG1 ILE 96 HG11 ILE 96 -3.352 6.099 0.593 708 1HG2 ILE 96 HG21 ILE 96 -4.057 4.542 3.721 709 2HG2 ILE 96 HG22 ILE 96 -4.241 6.209 4.264 710 3HG2 ILE 96 HG23 ILE 96 -2.796 5.295 4.697 711 1HD1 ILE 96 HD11 ILE 96 -5.496 5.130 2.463 712 2HD1 ILE 96 HD12 ILE 96 -4.538 4.129 1.372 713 3HD1 ILE 96 HD13 ILE 96 -5.653 5.328 0.718 714 H GLY 97 HN GLY 97 -0.188 6.750 4.553 715 1HA GLY 97 HA2 GLY 97 1.855 7.340 2.510 716 2HA GLY 97 HA1 GLY 97 2.062 7.587 4.237 717 H ILE 98 HN ILE 98 3.804 6.153 2.478 718 HA ILE 98 HA ILE 98 3.460 3.388 3.347 719 HB ILE 98 HB ILE 98 5.286 4.675 1.326 720 1HG1 ILE 98 HG12 ILE 98 4.221 2.862 -0.116 721 2HG1 ILE 98 HG11 ILE 98 3.102 2.601 1.224 722 1HG2 ILE 98 HG21 ILE 98 6.277 2.463 0.933 723 2HG2 ILE 98 HG22 ILE 98 5.408 1.840 2.335 724 3HG2 ILE 98 HG23 ILE 98 6.642 3.083 2.543 725 1HD1 ILE 98 HD11 ILE 98 2.319 4.893 1.018 726 2HD1 ILE 98 HD12 ILE 98 2.138 4.017 -0.502 727 3HD1 ILE 98 HD13 ILE 98 3.455 5.171 -0.301 728 H TYR 99 HN TYR 99 4.351 2.760 5.157 729 HA TYR 99 HA TYR 99 6.832 4.057 6.074 730 1HB TYR 99 HB2 TYR 99 4.903 2.927 8.064 731 2HB TYR 99 HB1 TYR 99 6.056 4.240 8.251 732 HD1 TYR 99 HD1 TYR 99 5.488 6.499 7.408 733 HD2 TYR 99 HD2 TYR 99 2.650 3.342 7.402 734 HE1 TYR 99 HE1 TYR 99 3.680 8.136 7.160 735 HE2 TYR 99 HE2 TYR 99 0.833 4.976 7.139 736 HH TYR 99 HH TYR 99 0.360 7.285 7.462 737 H VAL 100 HN VAL 100 8.455 2.617 6.570 738 HA VAL 100 HA VAL 100 8.085 -0.173 6.220 739 HB VAL 100 HB VAL 100 10.290 0.871 5.902 740 1HG1 VAL 100 HG11 VAL 100 10.343 1.176 8.900 741 2HG1 VAL 100 HG12 VAL 100 10.261 2.488 7.725 742 3HG1 VAL 100 HG13 VAL 100 11.696 1.466 7.808 743 1HG2 VAL 100 HG21 VAL 100 10.146 -1.517 6.309 744 2HG2 VAL 100 HG22 VAL 100 10.244 -1.240 8.049 745 3HG2 VAL 100 HG23 VAL 100 11.619 -0.852 7.016 746 H ASP 101 HN ASP 101 7.126 -1.554 7.587 747 HA ASP 101 HA ASP 101 6.282 -0.668 10.176 748 1HB ASP 101 HB2 ASP 101 4.965 -2.233 8.708 749 2HB ASP 101 HB1 ASP 101 6.152 -3.482 9.074 750 H GLY 102 HN GLY 102 8.172 -0.199 11.228 751 1HA GLY 102 HA2 GLY 102 9.675 -0.966 12.929 752 2HA GLY 102 HA1 GLY 102 9.806 -2.495 12.064 753 H GLN 103 HN GLN 103 10.831 0.821 12.230 754 HA GLN 103 HA GLN 103 12.310 1.472 10.160 755 1HB GLN 103 HB2 GLN 103 14.133 2.215 11.789 756 2HB GLN 103 HB1 GLN 103 12.508 2.811 12.071 757 1HG GLN 103 HG2 GLN 103 12.169 1.127 13.793 758 2HG GLN 103 HG1 GLN 103 13.795 0.510 13.510 759 1HE2 GLN 103 HE21 GLN 103 12.477 1.720 15.870 760 2HE2 GLN 103 HE22 GLN 103 13.523 3.005 16.361 761 H GLN 104 HN GLN 104 13.263 0.136 8.748 762 HA GLN 104 HA GLN 104 14.951 -2.042 9.596 763 1HB GLN 104 HB2 GLN 104 13.500 -2.142 7.572 764 2HB GLN 104 HB1 GLN 104 14.511 -0.915 6.825 765 1HG GLN 104 HG2 GLN 104 15.114 -3.078 5.983 766 2HG GLN 104 HG1 GLN 104 16.433 -2.444 6.964 767 1HE2 GLN 104 HE21 GLN 104 17.266 -4.501 7.295 768 2HE2 GLN 104 HE22 GLN 104 16.517 -5.630 8.377 769 H THR 105 HN THR 105 15.354 1.266 9.021 770 HA THR 105 HA THR 105 17.128 2.663 8.965 771 HB THR 105 HB THR 105 18.817 0.338 9.907 772 HG1 THR 105 HG1 THR 105 17.816 0.461 11.793 773 1HG2 THR 105 HG21 THR 105 20.040 2.407 9.379 774 2HG2 THR 105 HG22 THR 105 20.042 2.096 11.114 775 3HG2 THR 105 HG23 THR 105 18.961 3.315 10.440 776 H ASN 106 HN ASN 106 16.480 0.873 6.662 777 HA ASN 106 HA ASN 106 17.094 0.796 4.492 778 1HB ASN 106 HB2 ASN 106 17.666 3.167 4.913 779 2HB ASN 106 HB1 ASN 106 19.300 2.680 5.330 780 1HD2 ASN 106 HD21 ASN 106 20.703 2.035 3.703 781 2HD2 ASN 106 HD22 ASN 106 20.377 2.355 2.035 782 H THR 107 HN THR 107 17.627 -1.387 4.598 783 HA THR 107 HA THR 107 20.427 -2.136 4.861 784 HB THR 107 HB THR 107 18.014 -3.823 4.115 785 HG1 THR 107 HG1 THR 107 19.236 -3.212 6.614 786 1HG2 THR 107 HG21 THR 107 20.752 -4.651 5.104 787 2HG2 THR 107 HG22 THR 107 20.158 -4.836 3.454 788 3HG2 THR 107 HG23 THR 107 19.398 -5.731 4.769 789 HA PRO 108 HA PRO 108 22.098 -1.240 0.935 790 1HB PRO 108 HB2 PRO 108 22.159 -4.221 0.629 791 2HB PRO 108 HB1 PRO 108 23.405 -3.028 0.242 792 1HG PRO 108 HG2 PRO 108 23.273 -4.472 2.605 793 2HG PRO 108 HG1 PRO 108 24.161 -2.955 2.384 794 1HD PRO 108 HD2 PRO 108 21.908 -3.398 4.064 795 2HD PRO 108 HD1 PRO 108 22.684 -1.844 3.702 796 HA PRO 109 HA PRO 109 18.271 -2.013 -1.390 797 1HB PRO 109 HB2 PRO 109 17.414 0.519 -1.457 798 2HB PRO 109 HB1 PRO 109 17.281 -0.463 0.005 799 1HG PRO 109 HG2 PRO 109 19.068 1.799 -0.573 800 2HG PRO 109 HG1 PRO 109 18.545 1.147 0.985 801 1HD PRO 109 HD2 PRO 109 21.008 0.647 -0.441 802 2HD PRO 109 HD1 PRO 109 20.521 0.092 1.174 803 H GLY 110 HN GLY 110 17.341 -0.176 -3.136 804 1HA GLY 110 HA2 GLY 110 19.234 1.007 -4.858 805 2HA GLY 110 HA1 GLY 110 18.790 -0.581 -5.472 806 H ASN 111 HN ASN 111 16.902 -0.825 -6.517 807 HA ASN 111 HA ASN 111 15.064 1.478 -6.561 808 1HB ASN 111 HB2 ASN 111 15.498 -0.665 -8.660 809 2HB ASN 111 HB1 ASN 111 14.310 0.628 -8.765 810 1HD2 ASN 111 HD21 ASN 111 14.996 2.733 -9.158 811 2HD2 ASN 111 HD22 ASN 111 16.569 3.071 -9.790 812 H TYR 112 HN TYR 112 13.344 1.100 -5.308 813 HA TYR 112 HA TYR 112 12.509 -1.664 -4.876 814 1HB TYR 112 HB2 TYR 112 12.062 0.883 -3.364 815 2HB TYR 112 HB1 TYR 112 10.952 -0.467 -3.150 816 HD1 TYR 112 HD1 TYR 112 11.468 -2.182 -1.687 817 HD2 TYR 112 HD2 TYR 112 14.566 0.414 -2.979 818 HE1 TYR 112 HE1 TYR 112 12.996 -3.225 -0.071 819 HE2 TYR 112 HE2 TYR 112 16.103 -0.623 -1.377 820 HH TYR 112 HH TYR 112 15.416 -3.510 0.260 821 H THR 113 HN THR 113 10.736 -2.474 -5.661 822 HA THR 113 HA THR 113 8.992 -0.692 -7.230 823 HB THR 113 HB THR 113 9.646 -3.585 -7.754 824 HG1 THR 113 HG1 THR 113 11.398 -1.997 -8.046 825 1HG2 THR 113 HG21 THR 113 8.224 -1.524 -9.443 826 2HG2 THR 113 HG22 THR 113 7.474 -2.905 -8.644 827 3HG2 THR 113 HG23 THR 113 8.626 -3.164 -9.955 828 H LEU 114 HN LEU 114 7.340 -0.413 -5.808 829 HA LEU 114 HA LEU 114 5.984 -2.852 -4.892 830 1HB LEU 114 HB2 LEU 114 5.035 -1.327 -3.063 831 2HB LEU 114 HB1 LEU 114 6.687 -1.879 -2.902 832 HG LEU 114 HG LEU 114 6.249 0.768 -4.190 833 1HD1 LEU 114 HD11 LEU 114 4.734 0.809 -2.257 834 2HD1 LEU 114 HD12 LEU 114 6.118 1.876 -2.027 835 3HD1 LEU 114 HD13 LEU 114 6.064 0.312 -1.212 836 1HD2 LEU 114 HD21 LEU 114 8.316 1.281 -2.973 837 2HD2 LEU 114 HD22 LEU 114 8.494 -0.148 -3.993 838 3HD2 LEU 114 HD23 LEU 114 8.283 -0.328 -2.251 839 H THR 115 HN THR 115 4.431 -3.133 -6.368 840 HA THR 115 HA THR 115 2.981 -0.843 -7.413 841 HB THR 115 HB THR 115 2.596 -3.769 -8.069 842 HG1 THR 115 HG1 THR 115 4.542 -3.515 -8.907 843 1HG2 THR 115 HG21 THR 115 0.728 -2.336 -8.732 844 2HG2 THR 115 HG22 THR 115 1.617 -2.889 -10.152 845 3HG2 THR 115 HG23 THR 115 1.844 -1.245 -9.554 846 H LEU 116 HN LEU 116 0.969 -0.269 -6.832 847 HA LEU 116 HA LEU 116 -0.407 -1.974 -4.866 848 1HB LEU 116 HB2 LEU 116 -0.350 1.019 -5.166 849 2HB LEU 116 HB1 LEU 116 -1.456 0.183 -4.093 850 HG LEU 116 HG LEU 116 1.559 0.138 -3.895 851 1HD1 LEU 116 HD11 LEU 116 -0.507 1.525 -2.194 852 2HD1 LEU 116 HD12 LEU 116 0.614 2.305 -3.310 853 3HD1 LEU 116 HD13 LEU 116 1.227 1.474 -1.879 854 1HD2 LEU 116 HD21 LEU 116 1.182 -0.996 -1.756 855 2HD2 LEU 116 HD22 LEU 116 0.558 -1.942 -3.106 856 3HD2 LEU 116 HD23 LEU 116 -0.553 -1.033 -2.082 857 H THR 117 HN THR 117 -2.286 -2.767 -5.441 858 HA THR 117 HA THR 117 -3.537 -1.875 -7.918 859 HB THR 117 HB THR 117 -4.311 -4.189 -6.130 860 HG1 THR 117 HG1 THR 117 -2.158 -3.891 -7.681 861 1HG2 THR 117 HG21 THR 117 -6.082 -3.480 -7.651 862 2HG2 THR 117 HG22 THR 117 -5.422 -5.036 -8.154 863 3HG2 THR 117 HG23 THR 117 -4.965 -3.565 -9.013 864 H GLY 118 HN GLY 118 -4.955 -0.249 -7.761 865 1HA GLY 118 HA2 GLY 118 -6.378 0.321 -5.328 866 2HA GLY 118 HA1 GLY 118 -6.567 1.148 -6.869 867 H GLY 119 HN GLY 119 -8.219 -0.587 -4.682 868 1HA GLY 119 HA2 GLY 119 -10.365 -1.112 -6.481 869 2HA GLY 119 HA1 GLY 119 -9.549 -2.600 -6.028 870 H TYR 120 HN TYR 120 -11.950 -2.799 -5.285 871 HA TYR 120 HA TYR 120 -12.148 -1.727 -2.567 872 1HB TYR 120 HB2 TYR 120 -14.502 -2.133 -2.614 873 2HB TYR 120 HB1 TYR 120 -14.074 -1.288 -4.092 874 HD1 TYR 120 HD1 TYR 120 -15.243 -4.460 -2.663 875 HD2 TYR 120 HD2 TYR 120 -14.305 -2.361 -6.252 876 HE1 TYR 120 HE1 TYR 120 -16.340 -6.224 -3.979 877 HE2 TYR 120 HE2 TYR 120 -15.408 -4.117 -7.568 878 HH TYR 120 HH TYR 120 -17.313 -6.602 -6.121 879 H TRP 121 HN TRP 121 -13.550 -3.334 -1.199 880 HA TRP 121 HA TRP 121 -12.591 -6.069 -1.438 881 1HB TRP 121 HB2 TRP 121 -10.754 -5.306 -0.209 882 2HB TRP 121 HB1 TRP 121 -11.691 -4.082 0.636 883 HD1 TRP 121 HD1 TRP 121 -13.541 -5.199 2.426 884 HE1 TRP 121 HE1 TRP 121 -13.160 -7.069 4.125 885 HE3 TRP 121 HE3 TRP 121 -9.400 -7.321 0.343 886 HZ2 TRP 121 HZ2 TRP 121 -11.356 -9.146 4.537 887 HZ3 TRP 121 HZ3 TRP 121 -8.411 -9.266 1.501 888 HH2 TRP 121 HH2 TRP 121 -9.378 -10.156 3.520 889 H ALA 122 HN ALA 122 -13.919 -7.501 -0.249 890 HA ALA 122 HA ALA 122 -16.148 -6.276 1.224 891 1HB ALA 122 HB1 ALA 122 -17.633 -8.022 0.378 892 2HB ALA 122 HB2 ALA 122 -16.310 -8.688 -0.582 893 3HB ALA 122 HB3 ALA 122 -16.939 -7.080 -0.943 894 H LYS 123 HN LYS 123 -16.757 -7.255 3.094 895 HA LYS 123 HA LYS 123 -16.894 -8.696 4.835 896 1HB LYS 123 HB2 LYS 123 -15.260 -10.603 3.161 897 2HB LYS 123 HB1 LYS 123 -16.119 -11.002 4.643 898 1HG LYS 123 HG2 LYS 123 -17.344 -10.141 2.029 899 2HG LYS 123 HG1 LYS 123 -17.402 -11.752 2.745 900 1HD LYS 123 HD2 LYS 123 -18.746 -10.944 4.574 901 2HD LYS 123 HD1 LYS 123 -18.570 -9.278 4.016 902 1HE LYS 123 HE2 LYS 123 -20.745 -10.148 3.384 903 2HE LYS 123 HE1 LYS 123 -19.760 -9.860 1.950 904 1HZ LYS 123 HZ1 LYS 123 -20.877 -11.950 1.740 905 2HZ LYS 123 HZ2 LYS 123 -20.293 -12.484 3.240 906 3HZ LYS 123 HZ3 LYS 123 -19.222 -12.254 1.946 907 H ASP 124 HN ASP 124 -14.536 -10.589 5.444 908 HA ASP 124 HA ASP 124 -12.447 -8.656 5.999 909 1HB ASP 124 HB2 ASP 124 -12.475 -8.954 8.413 910 2HB ASP 124 HB1 ASP 124 -14.014 -8.310 7.859 911 H ASN 125 HN ASN 125 -10.600 -9.536 5.667 912 HA ASN 125 HA ASN 125 -8.808 -10.891 5.700 913 1HB ASN 125 HB2 ASN 125 -9.215 -11.228 8.014 914 2HB ASN 125 HB1 ASN 125 -10.449 -12.437 7.685 915 1HD2 ASN 125 HD21 ASN 125 -7.036 -11.744 7.683 916 2HD2 ASN 125 HD22 ASN 125 -6.499 -13.389 7.609 917 H LYS 126 HN LYS 126 -11.867 -12.432 5.025 918 HA LYS 126 HA LYS 126 -10.886 -14.810 3.867 919 1HB LYS 126 HB2 LYS 126 -13.089 -15.093 2.952 920 2HB LYS 126 HB1 LYS 126 -13.247 -14.406 4.561 921 1HG LYS 126 HG2 LYS 126 -14.668 -12.985 3.582 922 2HG LYS 126 HG1 LYS 126 -13.213 -12.164 3.011 923 1HD LYS 126 HD2 LYS 126 -13.287 -13.472 0.944 924 2HD LYS 126 HD1 LYS 126 -14.740 -14.297 1.516 925 1HE LYS 126 HE2 LYS 126 -15.918 -12.143 1.580 926 2HE LYS 126 HE1 LYS 126 -14.465 -11.341 0.986 927 1HZ LYS 126 HZ1 LYS 126 -15.995 -13.435 -0.473 928 2HZ LYS 126 HZ2 LYS 126 -14.612 -12.643 -1.044 929 3HZ LYS 126 HZ3 LYS 126 -16.047 -11.773 -0.802 930 H GLN 127 HN GLN 127 -10.360 -11.748 2.931 931 HA GLN 127 HA GLN 127 -9.435 -10.749 1.157 932 1HB GLN 127 HB2 GLN 127 -8.050 -12.834 1.121 933 2HB GLN 127 HB1 GLN 127 -9.161 -13.484 -0.078 934 1HG GLN 127 HG2 GLN 127 -8.571 -11.786 -1.649 935 2HG GLN 127 HG1 GLN 127 -7.627 -10.920 -0.437 936 1HE2 GLN 127 HE21 GLN 127 -6.822 -12.026 -3.037 937 2HE2 GLN 127 HE22 GLN 127 -5.513 -13.101 -2.704 938 H GLY 128 HN GLY 128 -11.796 -10.109 1.065 939 1HA GLY 128 HA2 GLY 128 -13.113 -11.056 -1.339 940 2HA GLY 128 HA1 GLY 128 -13.770 -9.906 -0.184 941 H PHE 129 HN PHE 129 -10.788 -10.004 -2.115 942 HA PHE 129 HA PHE 129 -11.010 -7.126 -2.418 943 1HB PHE 129 HB2 PHE 129 -8.718 -7.148 -2.892 944 2HB PHE 129 HB1 PHE 129 -8.883 -8.522 -1.814 945 HD1 PHE 129 HD1 PHE 129 -9.252 -10.836 -3.010 946 HD2 PHE 129 HD2 PHE 129 -7.601 -7.384 -4.875 947 HE1 PHE 129 HE1 PHE 129 -8.203 -12.262 -4.717 948 HE2 PHE 129 HE2 PHE 129 -6.550 -8.804 -6.585 949 HZ PHE 129 HZ PHE 129 -6.851 -11.246 -6.507 950 H THR 130 HN THR 130 -11.263 -6.052 -4.379 951 HA THR 130 HA THR 130 -11.073 -7.546 -6.873 952 HB THR 130 HB THR 130 -13.570 -5.980 -6.164 953 HG1 THR 130 HG1 THR 130 -12.868 -8.588 -5.774 954 1HG2 THR 130 HG21 THR 130 -12.911 -7.622 -8.617 955 2HG2 THR 130 HG22 THR 130 -12.989 -5.862 -8.550 956 3HG2 THR 130 HG23 THR 130 -14.447 -6.820 -8.289 957 HA PRO 131 HA PRO 131 -9.037 -3.725 -8.002 958 1HB PRO 131 HB2 PRO 131 -9.678 -4.589 -10.766 959 2HB PRO 131 HB1 PRO 131 -8.116 -4.194 -10.043 960 1HG PRO 131 HG2 PRO 131 -8.776 -6.724 -10.572 961 2HG PRO 131 HG1 PRO 131 -7.863 -6.302 -9.111 962 1HD PRO 131 HD2 PRO 131 -10.766 -6.963 -9.408 963 2HD PRO 131 HD1 PRO 131 -9.627 -7.434 -8.128 964 H SER 132 HN SER 132 -9.794 -1.711 -8.234 965 HA SER 132 HA SER 132 -12.057 -1.115 -9.905 966 1HB SER 132 HB2 SER 132 -13.110 -1.924 -7.787 967 2HB SER 132 HB1 SER 132 -12.298 -0.611 -6.945 968 HG SER 132 HG SER 132 -14.024 -0.194 -9.157 969 H GLY 133 HN GLY 133 -10.797 0.349 -10.983 970 1HA GLY 133 HA2 GLY 133 -10.592 2.867 -10.795 971 2HA GLY 133 HA1 GLY 133 -9.629 2.525 -9.365 972 H THR 134 HN THR 134 -7.491 2.081 -9.591 973 HA THR 134 HA THR 134 -6.404 1.352 -12.184 974 HB THR 134 HB THR 134 -5.426 3.879 -10.845 975 HG1 THR 134 HG1 THR 134 -7.513 3.446 -12.613 976 1HG2 THR 134 HG21 THR 134 -3.782 2.710 -12.254 977 2HG2 THR 134 HG22 THR 134 -4.266 4.251 -12.965 978 3HG2 THR 134 HG23 THR 134 -4.922 2.741 -13.600 979 H THR 135 HN THR 135 -4.372 0.403 -12.041 980 HA THR 135 HA THR 135 -3.325 -0.057 -9.340 981 HB THR 135 HB THR 135 -2.580 -1.441 -11.930 982 HG1 THR 135 HG1 THR 135 -4.642 -2.082 -11.572 983 1HG2 THR 135 HG21 THR 135 -0.847 -1.649 -10.262 984 2HG2 THR 135 HG22 THR 135 -1.698 -3.189 -10.398 985 3HG2 THR 135 HG23 THR 135 -2.029 -2.114 -9.040 986 H GLY 136 HN GLY 136 -1.449 0.917 -8.708 987 1HA GLY 136 HA2 GLY 136 0.233 2.127 -10.818 988 2HA GLY 136 HA1 GLY 136 -0.275 3.069 -9.423 989 H THR 137 HN THR 137 2.417 2.094 -10.484 990 HA THR 137 HA THR 137 3.329 0.501 -8.217 991 HB THR 137 HB THR 137 4.860 1.446 -10.652 992 HG1 THR 137 HG1 THR 137 3.955 -1.198 -10.085 993 1HG2 THR 137 HG21 THR 137 6.528 -0.211 -9.984 994 2HG2 THR 137 HG22 THR 137 5.578 -0.605 -8.553 995 3HG2 THR 137 HG23 THR 137 6.303 0.995 -8.718 996 H THR 138 HN THR 138 4.124 1.439 -6.468 997 HA THR 138 HA THR 138 5.034 4.197 -6.528 998 HB THR 138 HB THR 138 5.093 2.241 -4.217 999 HG1 THR 138 HG1 THR 138 2.983 3.260 -5.446 1000 1HG2 THR 138 HG21 THR 138 5.117 4.277 -2.839 1001 2HG2 THR 138 HG22 THR 138 5.148 5.263 -4.301 1002 3HG2 THR 138 HG23 THR 138 6.512 4.215 -3.917 1003 H LYS 139 HN LYS 139 7.070 4.633 -7.132 1004 HA LYS 139 HA LYS 139 9.032 2.454 -6.976 1005 1HB LYS 139 HB2 LYS 139 8.537 3.555 -9.192 1006 2HB LYS 139 HB1 LYS 139 9.257 5.022 -8.547 1007 1HG LYS 139 HG2 LYS 139 10.910 3.905 -9.850 1008 2HG LYS 139 HG1 LYS 139 11.363 3.748 -8.156 1009 1HD LYS 139 HD2 LYS 139 11.693 1.641 -9.324 1010 2HD LYS 139 HD1 LYS 139 10.408 1.482 -8.127 1011 1HE LYS 139 HE2 LYS 139 9.791 0.371 -10.197 1012 2HE LYS 139 HE1 LYS 139 8.734 1.747 -9.899 1013 1HZ LYS 139 HZ1 LYS 139 11.002 1.617 -11.811 1014 2HZ LYS 139 HZ2 LYS 139 10.152 3.039 -11.454 1015 3HZ LYS 139 HZ3 LYS 139 9.351 1.739 -12.189 1016 H LEU 140 HN LEU 140 10.246 2.467 -5.300 1017 HA LEU 140 HA LEU 140 10.978 5.026 -4.065 1018 1HB LEU 140 HB2 LEU 140 9.833 3.862 -2.436 1019 2HB LEU 140 HB1 LEU 140 10.399 2.301 -2.985 1020 HG LEU 140 HG LEU 140 12.614 2.795 -2.021 1021 1HD1 LEU 140 HD11 LEU 140 12.543 5.233 -2.120 1022 2HD1 LEU 140 HD12 LEU 140 12.870 4.675 -0.480 1023 3HD1 LEU 140 HD13 LEU 140 11.260 5.251 -0.910 1024 1HD2 LEU 140 HD21 LEU 140 10.972 1.528 -0.768 1025 2HD2 LEU 140 HD22 LEU 140 10.309 3.021 -0.102 1026 3HD2 LEU 140 HD23 LEU 140 11.953 2.525 0.306 1027 H THR 141 HN THR 141 12.850 5.593 -5.002 1028 HA THR 141 HA THR 141 14.962 3.615 -5.424 1029 HB THR 141 HB THR 141 14.953 6.562 -6.129 1030 HG1 THR 141 HG1 THR 141 14.135 5.979 -8.091 1031 1HG2 THR 141 HG21 THR 141 17.184 5.594 -6.082 1032 2HG2 THR 141 HG22 THR 141 16.695 5.887 -7.751 1033 3HG2 THR 141 HG23 THR 141 16.648 4.253 -7.094 1034 H VAL 142 HN VAL 142 16.964 3.698 -4.356 1035 HA VAL 142 HA VAL 142 16.919 4.860 -1.758 1036 HB VAL 142 HB VAL 142 18.093 2.787 -2.112 1037 1HG1 VAL 142 HG11 VAL 142 18.860 3.103 -4.389 1038 2HG1 VAL 142 HG12 VAL 142 20.220 2.699 -3.341 1039 3HG1 VAL 142 HG13 VAL 142 19.972 4.367 -3.862 1040 1HG2 VAL 142 HG21 VAL 142 19.980 5.012 -1.354 1041 2HG2 VAL 142 HG22 VAL 142 20.205 3.302 -0.977 1042 3HG2 VAL 142 HG23 VAL 142 18.847 4.189 -0.278 1043 H THR 143 HN THR 143 17.625 6.711 -1.020 1044 HA THR 143 HA THR 143 19.863 8.080 -2.211 1045 HB THR 143 HB THR 143 17.193 9.491 -1.937 1046 HG1 THR 143 HG1 THR 143 18.213 8.089 -3.946 1047 1HG2 THR 143 HG21 THR 143 19.060 10.948 -1.336 1048 2HG2 THR 143 HG22 THR 143 18.370 11.430 -2.885 1049 3HG2 THR 143 HG23 THR 143 19.884 10.527 -2.838 Start of MODEL 14 1 H GLU 1 H GLU 1 -23.106 -1.483 -5.023 2 HA GLU 1 HA GLU 1 -22.181 0.572 -5.738 3 1HB GLU 1 HB2 GLU 1 -20.772 -0.464 -3.265 4 2HB GLU 1 HB1 GLU 1 -20.975 1.229 -3.688 5 1HG GLU 1 HG2 GLU 1 -23.155 -0.727 -3.005 6 2HG GLU 1 HG1 GLU 1 -22.572 0.601 -2.004 7 H GLU 2 HN GLU 2 -20.896 0.850 -7.487 8 HA GLU 2 HA GLU 2 -18.128 -0.092 -7.345 9 1HB GLU 2 HB2 GLU 2 -19.428 -0.609 -9.409 10 2HB GLU 2 HB1 GLU 2 -19.565 1.119 -9.715 11 1HG GLU 2 HG2 GLU 2 -17.092 1.256 -9.774 12 2HG GLU 2 HG1 GLU 2 -17.026 -0.495 -9.606 13 H CYS 3 HN CYS 3 -16.447 1.220 -7.353 14 HA CYS 3 HA CYS 3 -16.781 4.093 -7.542 15 1HB CYS 3 HB2 CYS 3 -17.261 3.591 -5.193 16 2HB CYS 3 HB1 CYS 3 -15.763 2.682 -5.067 17 H GLN 4 HN GLN 4 -14.969 4.961 -8.465 18 HA GLN 4 HA GLN 4 -12.923 3.043 -9.195 19 1HB GLN 4 HB2 GLN 4 -12.074 4.805 -10.693 20 2HB GLN 4 HB1 GLN 4 -13.777 4.471 -10.956 21 1HG GLN 4 HG2 GLN 4 -14.396 6.472 -9.777 22 2HG GLN 4 HG1 GLN 4 -12.706 6.786 -9.369 23 1HE2 GLN 4 HE21 GLN 4 -15.083 6.737 -11.910 24 2HE2 GLN 4 HE22 GLN 4 -14.169 7.663 -13.055 25 H VAL 5 HN VAL 5 -11.088 2.803 -8.176 26 HA VAL 5 HA VAL 5 -10.268 4.809 -6.219 27 HB VAL 5 HB VAL 5 -9.178 2.029 -6.712 28 1HG1 VAL 5 HG11 VAL 5 -8.046 2.307 -4.566 29 2HG1 VAL 5 HG12 VAL 5 -8.648 3.961 -4.461 30 3HG1 VAL 5 HG13 VAL 5 -7.511 3.517 -5.735 31 1HG2 VAL 5 HG21 VAL 5 -11.011 3.048 -4.550 32 2HG2 VAL 5 HG22 VAL 5 -10.332 1.425 -4.647 33 3HG2 VAL 5 HG23 VAL 5 -11.466 1.980 -5.879 34 H ARG 6 HN ARG 6 -9.015 6.353 -6.966 35 HA ARG 6 HA ARG 6 -7.305 5.961 -9.250 36 1HB ARG 6 HB2 ARG 6 -8.037 8.282 -7.520 37 2HB ARG 6 HB1 ARG 6 -6.575 8.378 -8.488 38 1HG ARG 6 HG2 ARG 6 -9.362 7.901 -9.517 39 2HG ARG 6 HG1 ARG 6 -8.433 9.397 -9.649 40 1HD ARG 6 HD2 ARG 6 -7.836 6.739 -10.936 41 2HD ARG 6 HD1 ARG 6 -8.282 8.244 -11.739 42 HE ARG 6 HE ARG 6 -5.954 8.777 -10.333 43 1HH1 ARG 6 HH11 ARG 6 -6.982 6.694 -12.953 44 2HH1 ARG 6 HH12 ARG 6 -5.394 6.576 -13.646 45 1HH2 ARG 6 HH21 ARG 6 -3.848 8.616 -11.259 46 2HH2 ARG 6 HH22 ARG 6 -3.621 7.646 -12.691 47 H VAL 7 HN VAL 7 -5.802 4.457 -8.618 48 HA VAL 7 HA VAL 7 -3.816 5.429 -6.675 49 HB VAL 7 HB VAL 7 -3.974 2.666 -7.903 50 1HG1 VAL 7 HG11 VAL 7 -1.740 3.349 -7.167 51 2HG1 VAL 7 HG12 VAL 7 -2.384 2.056 -6.157 52 3HG1 VAL 7 HG13 VAL 7 -2.382 3.718 -5.567 53 1HG2 VAL 7 HG21 VAL 7 -5.923 2.999 -6.513 54 2HG2 VAL 7 HG22 VAL 7 -4.920 3.622 -5.203 55 3HG2 VAL 7 HG23 VAL 7 -4.789 1.929 -5.686 56 H GLY 8 HN GLY 8 -2.190 6.497 -7.579 57 1HA GLY 8 HA2 GLY 8 -1.585 5.944 -10.408 58 2HA GLY 8 HA1 GLY 8 -1.321 7.488 -9.610 59 H ASP 9 HN ASP 9 0.788 6.916 -10.820 60 HA ASP 9 HA ASP 9 2.533 5.307 -9.094 61 1HB ASP 9 HB2 ASP 9 4.153 5.356 -10.905 62 2HB ASP 9 HB1 ASP 9 2.597 4.817 -11.528 63 H LEU 10 HN LEU 10 4.378 6.172 -8.183 64 HA LEU 10 HA LEU 10 5.020 8.961 -8.573 65 1HB LEU 10 HB2 LEU 10 4.808 9.617 -6.255 66 2HB LEU 10 HB1 LEU 10 3.254 9.079 -6.859 67 HG LEU 10 HG LEU 10 5.036 7.252 -5.262 68 1HD1 LEU 10 HD11 LEU 10 2.947 9.165 -4.224 69 2HD1 LEU 10 HD12 LEU 10 4.682 9.241 -3.912 70 3HD1 LEU 10 HD13 LEU 10 3.728 7.896 -3.283 71 1HD2 LEU 10 HD21 LEU 10 2.061 7.318 -5.768 72 2HD2 LEU 10 HD22 LEU 10 2.902 6.152 -4.748 73 3HD2 LEU 10 HD23 LEU 10 3.215 6.193 -6.484 74 H THR 11 HN THR 11 7.125 9.384 -8.141 75 HA THR 11 HA THR 11 8.726 7.088 -7.231 76 HB THR 11 HB THR 11 9.694 9.475 -8.819 77 HG1 THR 11 HG1 THR 11 8.020 7.950 -9.804 78 1HG2 THR 11 HG21 THR 11 10.877 6.743 -8.305 79 2HG2 THR 11 HG22 THR 11 11.449 8.271 -7.635 80 3HG2 THR 11 HG23 THR 11 11.570 7.967 -9.368 81 H VAL 12 HN VAL 12 9.402 7.250 -5.209 82 HA VAL 12 HA VAL 12 10.026 9.922 -4.146 83 HB VAL 12 HB VAL 12 8.272 8.921 -2.842 84 1HG1 VAL 12 HG11 VAL 12 8.501 6.776 -1.711 85 2HG1 VAL 12 HG12 VAL 12 10.070 6.532 -2.478 86 3HG1 VAL 12 HG13 VAL 12 8.607 6.590 -3.461 87 1HG2 VAL 12 HG21 VAL 12 9.936 10.165 -1.587 88 2HG2 VAL 12 HG22 VAL 12 10.900 8.703 -1.379 89 3HG2 VAL 12 HG23 VAL 12 9.310 8.828 -0.624 90 H ALA 13 HN ALA 13 12.057 10.370 -3.670 91 HA ALA 13 HA ALA 13 14.023 8.193 -3.923 92 1HB ALA 13 HB1 ALA 13 14.203 9.994 -5.575 93 2HB ALA 13 HB2 ALA 13 15.621 9.927 -4.531 94 3HB ALA 13 HB3 ALA 13 14.395 11.169 -4.273 95 H LYS 14 HN LYS 14 14.449 7.445 -1.922 96 HA LYS 14 HA LYS 14 15.925 9.016 -0.116 97 1HB LYS 14 HB2 LYS 14 13.167 9.382 0.190 98 2HB LYS 14 HB1 LYS 14 13.614 8.258 1.468 99 1HG LYS 14 HG2 LYS 14 15.160 9.774 2.404 100 2HG LYS 14 HG1 LYS 14 15.108 10.818 0.984 101 1HD LYS 14 HD2 LYS 14 12.837 10.339 2.913 102 2HD LYS 14 HD1 LYS 14 13.851 11.783 2.846 103 1HE LYS 14 HE2 LYS 14 13.088 12.076 0.469 104 2HE LYS 14 HE1 LYS 14 11.925 10.784 0.758 105 1HZ LYS 14 HZ1 LYS 14 12.040 13.457 2.022 106 2HZ LYS 14 HZ2 LYS 14 11.133 12.190 2.689 107 3HZ LYS 14 HZ3 LYS 14 10.769 12.765 1.136 108 H THR 15 HN THR 15 15.851 7.741 2.176 109 HA THR 15 HA THR 15 16.456 4.973 1.402 110 HB THR 15 HB THR 15 17.981 4.951 3.343 111 HG1 THR 15 HG1 THR 15 18.263 7.491 3.908 112 1HG2 THR 15 HG21 THR 15 18.858 5.607 1.156 113 2HG2 THR 15 HG22 THR 15 19.670 6.490 2.450 114 3HG2 THR 15 HG23 THR 15 18.431 7.288 1.481 115 H ARG 16 HN ARG 16 16.118 3.312 3.101 116 HA ARG 16 HA ARG 16 13.572 3.674 4.413 117 1HB ARG 16 HB2 ARG 16 15.441 1.299 4.602 118 2HB ARG 16 HB1 ARG 16 13.766 1.350 5.135 119 1HG ARG 16 HG2 ARG 16 13.614 0.222 3.127 120 2HG ARG 16 HG1 ARG 16 13.245 1.882 2.653 121 1HD ARG 16 HD2 ARG 16 14.883 1.771 1.160 122 2HD ARG 16 HD1 ARG 16 16.030 1.648 2.489 123 HE ARG 16 HE ARG 16 15.315 -0.393 0.656 124 1HH1 ARG 16 HH11 ARG 16 16.044 -0.002 4.084 125 2HH1 ARG 16 HH12 ARG 16 16.808 -1.553 4.224 126 1HH2 ARG 16 HH21 ARG 16 16.375 -2.431 0.878 127 2HH2 ARG 16 HH22 ARG 16 17.008 -2.903 2.426 128 H GLY 17 HN GLY 17 16.604 4.610 5.148 129 1HA GLY 17 HA2 GLY 17 16.644 3.997 7.964 130 2HA GLY 17 HA1 GLY 17 17.740 5.079 7.110 131 H GLN 18 HN GLN 18 15.243 6.377 5.950 132 HA GLN 18 HA GLN 18 14.821 8.386 7.947 133 1HB GLN 18 HB2 GLN 18 13.164 7.861 5.472 134 2HB GLN 18 HB1 GLN 18 13.289 9.368 6.363 135 1HG GLN 18 HG2 GLN 18 15.578 8.091 4.893 136 2HG GLN 18 HG1 GLN 18 14.516 9.319 4.205 137 1HE2 GLN 18 HE21 GLN 18 17.039 8.664 6.507 138 2HE2 GLN 18 HE22 GLN 18 17.458 10.312 6.832 139 H LEU 19 HN LEU 19 13.486 5.381 7.128 140 HA LEU 19 HA LEU 19 10.879 5.864 8.283 141 1HB LEU 19 HB2 LEU 19 12.111 3.354 7.143 142 2HB LEU 19 HB1 LEU 19 10.438 3.540 7.633 143 HG LEU 19 HG LEU 19 11.699 5.163 5.429 144 1HD1 LEU 19 HD11 LEU 19 11.734 2.793 4.834 145 2HD1 LEU 19 HD12 LEU 19 10.532 3.668 3.884 146 3HD1 LEU 19 HD13 LEU 19 10.023 2.662 5.241 147 1HD2 LEU 19 HD21 LEU 19 9.737 6.151 6.500 148 2HD2 LEU 19 HD22 LEU 19 8.832 4.663 6.208 149 3HD2 LEU 19 HD23 LEU 19 9.385 5.641 4.848 150 H THR 20 HN THR 20 11.202 6.143 10.458 151 HA THR 20 HA THR 20 12.455 3.977 11.966 152 HB THR 20 HB THR 20 11.486 6.643 13.032 153 HG1 THR 20 HG1 THR 20 14.067 5.856 12.063 154 1HG2 THR 20 HG21 THR 20 11.821 4.908 14.726 155 2HG2 THR 20 HG22 THR 20 13.058 6.158 14.861 156 3HG2 THR 20 HG23 THR 20 13.449 4.610 14.110 157 H ASP 21 HN ASP 21 10.547 2.743 11.200 158 HA ASP 21 HA ASP 21 8.625 1.621 11.577 159 1HB ASP 21 HB2 ASP 21 9.188 1.601 13.946 160 2HB ASP 21 HB1 ASP 21 8.489 3.203 14.150 161 H ALA 22 HN ALA 22 8.009 4.933 12.784 162 HA ALA 22 HA ALA 22 5.745 5.021 10.907 163 1HB ALA 22 HB1 ALA 22 4.656 6.589 12.413 164 2HB ALA 22 HB2 ALA 22 6.040 6.526 13.504 165 3HB ALA 22 HB3 ALA 22 5.046 5.090 13.256 166 H ALA 23 HN ALA 23 6.676 5.946 9.150 167 HA ALA 23 HA ALA 23 7.258 8.770 9.356 168 1HB ALA 23 HB1 ALA 23 9.349 6.905 8.236 169 2HB ALA 23 HB2 ALA 23 9.457 7.762 9.774 170 3HB ALA 23 HB3 ALA 23 9.424 8.667 8.262 171 HA PRO 24 HA PRO 24 4.896 7.831 5.518 172 1HB PRO 24 HB2 PRO 24 3.759 10.333 5.474 173 2HB PRO 24 HB1 PRO 24 3.069 8.943 6.320 174 1HG PRO 24 HG2 PRO 24 4.723 11.190 7.404 175 2HG PRO 24 HG1 PRO 24 3.287 10.418 8.103 176 1HD PRO 24 HD2 PRO 24 5.754 9.823 8.972 177 2HD PRO 24 HD1 PRO 24 4.489 8.586 8.861 178 H ILE 25 HN ILE 25 7.076 7.840 4.617 179 HA ILE 25 HA ILE 25 8.319 10.258 3.807 180 HB ILE 25 HB ILE 25 9.535 8.689 2.165 181 1HG1 ILE 25 HG12 ILE 25 9.260 6.341 3.620 182 2HG1 ILE 25 HG11 ILE 25 7.608 6.878 3.359 183 1HG2 ILE 25 HG21 ILE 25 10.512 9.568 4.210 184 2HG2 ILE 25 HG22 ILE 25 10.993 7.890 3.961 185 3HG2 ILE 25 HG23 ILE 25 9.743 8.283 5.142 186 1HD1 ILE 25 HD11 ILE 25 7.993 6.944 0.966 187 2HD1 ILE 25 HD12 ILE 25 8.384 5.350 1.612 188 3HD1 ILE 25 HD13 ILE 25 9.677 6.479 1.206 189 H GLY 26 HN GLY 26 6.446 7.869 1.901 190 1HA GLY 26 HA2 GLY 26 6.032 10.031 -0.066 191 2HA GLY 26 HA1 GLY 26 6.359 8.376 -0.552 192 HA PRO 27 HA PRO 27 1.794 8.470 1.501 193 1HB PRO 27 HB2 PRO 27 0.979 11.160 1.215 194 2HB PRO 27 HB1 PRO 27 1.259 10.295 2.729 195 1HG PRO 27 HG2 PRO 27 3.084 12.108 1.214 196 2HG PRO 27 HG1 PRO 27 2.903 11.901 2.968 197 1HD PRO 27 HD2 PRO 27 5.003 10.837 1.730 198 2HD PRO 27 HD1 PRO 27 4.138 9.916 2.979 199 H VAL 28 HN VAL 28 1.002 7.487 -0.246 200 HA VAL 28 HA VAL 28 0.850 8.837 -2.801 201 HB VAL 28 HB VAL 28 1.392 6.476 -2.843 202 1HG1 VAL 28 HG11 VAL 28 -0.232 4.763 -2.135 203 2HG1 VAL 28 HG12 VAL 28 -1.251 6.036 -1.462 204 3HG1 VAL 28 HG13 VAL 28 0.354 5.745 -0.792 205 1HG2 VAL 28 HG21 VAL 28 0.131 7.313 -4.734 206 2HG2 VAL 28 HG22 VAL 28 -1.387 6.980 -3.901 207 3HG2 VAL 28 HG23 VAL 28 -0.337 5.647 -4.383 208 H THR 29 HN THR 29 -0.926 9.739 -3.670 209 HA THR 29 HA THR 29 -3.159 10.134 -1.873 210 HB THR 29 HB THR 29 -2.267 12.130 -2.885 211 HG1 THR 29 HG1 THR 29 -4.688 11.700 -2.702 212 1HG2 THR 29 HG21 THR 29 -2.920 10.884 -5.557 213 2HG2 THR 29 HG22 THR 29 -1.308 11.207 -4.921 214 3HG2 THR 29 HG23 THR 29 -2.388 12.548 -5.307 215 H VAL 30 HN VAL 30 -4.503 8.467 -1.874 216 HA VAL 30 HA VAL 30 -5.407 7.320 -4.406 217 HB VAL 30 HB VAL 30 -5.862 6.511 -1.535 218 1HG1 VAL 30 HG11 VAL 30 -7.952 6.185 -2.785 219 2HG1 VAL 30 HG12 VAL 30 -7.206 4.646 -2.350 220 3HG1 VAL 30 HG13 VAL 30 -7.077 5.252 -4.001 221 1HG2 VAL 30 HG21 VAL 30 -4.747 4.436 -2.289 222 2HG2 VAL 30 HG22 VAL 30 -3.723 5.857 -2.500 223 3HG2 VAL 30 HG23 VAL 30 -4.541 5.145 -3.891 224 H GLN 31 HN GLN 31 -7.047 8.200 -5.366 225 HA GLN 31 HA GLN 31 -8.995 9.765 -3.837 226 1HB GLN 31 HB2 GLN 31 -7.909 10.979 -5.615 227 2HB GLN 31 HB1 GLN 31 -8.280 9.712 -6.772 228 1HG GLN 31 HG2 GLN 31 -10.665 10.222 -6.550 229 2HG GLN 31 HG1 GLN 31 -10.268 11.518 -5.419 230 1HE2 GLN 31 HE21 GLN 31 -9.298 13.394 -6.184 231 2HE2 GLN 31 HE22 GLN 31 -9.247 13.782 -7.866 232 H ALA 32 HN ALA 32 -10.978 8.983 -3.525 233 HA ALA 32 HA ALA 32 -11.848 6.677 -5.140 234 1HB ALA 32 HB1 ALA 32 -12.615 7.387 -2.306 235 2HB ALA 32 HB2 ALA 32 -11.471 6.131 -2.780 236 3HB ALA 32 HB3 ALA 32 -13.175 5.981 -3.211 237 H LEU 33 HN LEU 33 -13.384 7.200 -6.553 238 HA LEU 33 HA LEU 33 -15.027 9.570 -5.998 239 1HB LEU 33 HB2 LEU 33 -14.188 8.244 -8.558 240 2HB LEU 33 HB1 LEU 33 -15.452 9.451 -8.510 241 HG LEU 33 HG LEU 33 -12.573 9.860 -7.701 242 1HD1 LEU 33 HD11 LEU 33 -12.516 11.359 -9.651 243 2HD1 LEU 33 HD12 LEU 33 -14.150 10.845 -10.071 244 3HD1 LEU 33 HD13 LEU 33 -12.824 9.681 -10.096 245 1HD2 LEU 33 HD21 LEU 33 -14.862 11.822 -7.788 246 2HD2 LEU 33 HD22 LEU 33 -13.175 12.217 -7.457 247 3HD2 LEU 33 HD23 LEU 33 -14.082 11.203 -6.333 248 H GLY 34 HN GLY 34 -16.915 9.084 -5.155 249 1HA GLY 34 HA2 GLY 34 -19.106 8.396 -5.152 250 2HA GLY 34 HA1 GLY 34 -18.840 7.702 -6.741 251 H CYS 35 HN CYS 35 -17.606 7.019 -3.451 252 HA CYS 35 HA CYS 35 -17.888 4.176 -3.987 253 1HB CYS 35 HB2 CYS 35 -16.820 5.672 -1.595 254 2HB CYS 35 HB1 CYS 35 -16.929 3.928 -1.682 255 H ASN 36 HN ASN 36 -19.098 6.516 -1.605 256 HA ASN 36 HA ASN 36 -21.083 6.743 -0.542 257 1HB ASN 36 HB2 ASN 36 -22.198 6.251 -2.631 258 2HB ASN 36 HB1 ASN 36 -21.968 4.524 -2.394 259 1HD2 ASN 36 HD21 ASN 36 -24.076 3.965 -2.435 260 2HD2 ASN 36 HD22 ASN 36 -25.224 4.445 -1.229 261 H ALA 37 HN ALA 37 -20.713 3.241 -1.029 262 HA ALA 37 HA ALA 37 -20.620 2.833 1.853 263 1HB ALA 37 HB1 ALA 37 -22.417 1.156 1.810 264 2HB ALA 37 HB2 ALA 37 -22.737 1.550 0.120 265 3HB ALA 37 HB3 ALA 37 -23.012 2.758 1.376 266 H ARG 38 HN ARG 38 -18.456 2.366 1.057 267 HA ARG 38 HA ARG 38 -18.153 -0.339 0.004 268 1HB ARG 38 HB2 ARG 38 -18.342 1.228 -1.912 269 2HB ARG 38 HB1 ARG 38 -16.984 2.135 -1.269 270 1HG ARG 38 HG2 ARG 38 -15.538 0.179 -1.614 271 2HG ARG 38 HG1 ARG 38 -16.914 -0.677 -2.325 272 1HD ARG 38 HD2 ARG 38 -17.124 0.993 -4.046 273 2HD ARG 38 HD1 ARG 38 -15.858 1.964 -3.308 274 HE ARG 38 HE ARG 38 -15.420 -0.641 -4.608 275 1HH1 ARG 38 HH11 ARG 38 -14.301 2.500 -3.576 276 2HH1 ARG 38 HH12 ARG 38 -12.852 2.443 -4.517 277 1HH2 ARG 38 HH21 ARG 38 -13.497 -0.726 -5.884 278 2HH2 ARG 38 HH22 ARG 38 -12.402 0.617 -5.844 279 H GLN 39 HN GLN 39 -16.445 -1.349 0.926 280 HA GLN 39 HA GLN 39 -14.692 0.108 2.689 281 1HB GLN 39 HB2 GLN 39 -14.600 -2.818 1.915 282 2HB GLN 39 HB1 GLN 39 -13.860 -2.070 3.325 283 1HG GLN 39 HG2 GLN 39 -15.972 -1.659 4.328 284 2HG GLN 39 HG1 GLN 39 -16.829 -2.091 2.853 285 1HE2 GLN 39 HE21 GLN 39 -14.110 -3.879 4.143 286 2HE2 GLN 39 HE22 GLN 39 -15.005 -5.294 4.569 287 H VAL 40 HN VAL 40 -13.341 1.368 1.506 288 HA VAL 40 HA VAL 40 -12.075 0.505 -0.906 289 HB VAL 40 HB VAL 40 -11.362 2.860 0.849 290 1HG1 VAL 40 HG11 VAL 40 -10.762 2.314 -2.056 291 2HG1 VAL 40 HG12 VAL 40 -9.602 2.288 -0.730 292 3HG1 VAL 40 HG13 VAL 40 -10.382 3.801 -1.188 293 1HG2 VAL 40 HG21 VAL 40 -12.767 4.192 -0.640 294 2HG2 VAL 40 HG22 VAL 40 -13.707 2.939 0.170 295 3HG2 VAL 40 HG23 VAL 40 -13.230 2.733 -1.516 296 H ALA 41 HN ALA 41 -10.391 -0.817 -1.031 297 HA ALA 41 HA ALA 41 -8.593 -1.024 1.279 298 1HB ALA 41 HB1 ALA 41 -10.139 -2.996 0.862 299 2HB ALA 41 HB2 ALA 41 -8.416 -3.356 0.961 300 3HB ALA 41 HB3 ALA 41 -9.212 -3.280 -0.610 301 H LEU 42 HN LEU 42 -6.421 -1.265 0.874 302 HA LEU 42 HA LEU 42 -5.548 -0.683 -1.865 303 1HB LEU 42 HB2 LEU 42 -3.898 -0.636 0.658 304 2HB LEU 42 HB1 LEU 42 -3.481 0.056 -0.898 305 HG LEU 42 HG LEU 42 -5.717 1.018 0.875 306 1HD1 LEU 42 HD11 LEU 42 -3.533 1.445 1.867 307 2HD1 LEU 42 HD12 LEU 42 -4.286 2.943 1.320 308 3HD1 LEU 42 HD13 LEU 42 -2.994 2.207 0.370 309 1HD2 LEU 42 HD21 LEU 42 -4.552 2.201 -1.645 310 2HD2 LEU 42 HD22 LEU 42 -5.816 2.923 -0.649 311 3HD2 LEU 42 HD23 LEU 42 -6.124 1.413 -1.506 312 H LYS 43 HN LYS 43 -5.004 -2.397 -3.023 313 HA LYS 43 HA LYS 43 -4.026 -4.792 -1.629 314 1HB LYS 43 HB2 LYS 43 -5.112 -4.553 -4.445 315 2HB LYS 43 HB1 LYS 43 -4.617 -6.039 -3.656 316 1HG LYS 43 HG2 LYS 43 -6.971 -5.996 -3.598 317 2HG LYS 43 HG1 LYS 43 -6.422 -5.612 -1.962 318 1HD LYS 43 HD2 LYS 43 -6.840 -3.269 -2.317 319 2HD LYS 43 HD1 LYS 43 -7.194 -3.546 -4.021 320 1HE LYS 43 HE2 LYS 43 -8.789 -4.737 -1.770 321 2HE LYS 43 HE1 LYS 43 -9.191 -3.207 -2.553 322 1HZ LYS 43 HZ1 LYS 43 -9.349 -4.395 -4.661 323 2HZ LYS 43 HZ2 LYS 43 -10.443 -5.001 -3.520 324 3HZ LYS 43 HZ3 LYS 43 -9.023 -5.857 -3.874 325 H ALA 44 HN ALA 44 -1.939 -5.268 -1.809 326 HA ALA 44 HA ALA 44 -0.267 -3.831 -3.645 327 1HB ALA 44 HB1 ALA 44 0.399 -6.205 -1.919 328 2HB ALA 44 HB2 ALA 44 0.529 -4.519 -1.422 329 3HB ALA 44 HB3 ALA 44 1.546 -5.138 -2.725 330 H ASP 45 HN ASP 45 0.700 -4.607 -5.489 331 HA ASP 45 HA ASP 45 -0.694 -6.739 -6.831 332 1HB ASP 45 HB2 ASP 45 0.143 -4.716 -8.031 333 2HB ASP 45 HB1 ASP 45 1.791 -5.251 -7.714 334 H THR 46 HN THR 46 0.268 -8.710 -7.569 335 HA THR 46 HA THR 46 1.528 -10.071 -5.500 336 HB THR 46 HB THR 46 0.155 -11.229 -7.119 337 HG1 THR 46 HG1 THR 46 2.711 -12.012 -6.470 338 1HG2 THR 46 HG21 THR 46 0.967 -11.718 -9.379 339 2HG2 THR 46 HG22 THR 46 2.384 -10.711 -9.092 340 3HG2 THR 46 HG23 THR 46 0.779 -9.982 -9.131 341 H ASP 47 HN ASP 47 2.997 -8.133 -7.924 342 HA ASP 47 HA ASP 47 5.556 -9.303 -8.037 343 1HB ASP 47 HB2 ASP 47 4.733 -7.486 -9.539 344 2HB ASP 47 HB1 ASP 47 4.864 -6.359 -8.194 345 H ASN 48 HN ASN 48 3.989 -7.280 -5.675 346 HA ASN 48 HA ASN 48 6.310 -7.568 -3.890 347 1HB ASN 48 HB2 ASN 48 5.764 -5.325 -2.941 348 2HB ASN 48 HB1 ASN 48 6.280 -5.233 -4.621 349 1HD2 ASN 48 HD21 ASN 48 3.762 -4.672 -2.378 350 2HD2 ASN 48 HD22 ASN 48 2.636 -3.968 -3.483 351 H PHE 49 HN PHE 49 3.788 -9.043 -4.329 352 HA PHE 49 HA PHE 49 2.710 -8.933 -1.591 353 1HB PHE 49 HB2 PHE 49 1.121 -7.812 -3.111 354 2HB PHE 49 HB1 PHE 49 1.119 -9.219 -4.155 355 HD1 PHE 49 HD1 PHE 49 -0.553 -7.539 -1.557 356 HD2 PHE 49 HD2 PHE 49 0.265 -11.442 -3.049 357 HE1 PHE 49 HE1 PHE 49 -2.538 -8.398 -0.397 358 HE2 PHE 49 HE2 PHE 49 -1.724 -12.305 -1.888 359 HZ PHE 49 HZ PHE 49 -3.135 -10.776 -0.563 360 H GLU 50 HN GLU 50 3.446 -10.820 -0.771 361 HA GLU 50 HA GLU 50 3.065 -13.230 -2.416 362 1HB GLU 50 HB2 GLU 50 4.886 -14.280 -1.084 363 2HB GLU 50 HB1 GLU 50 5.420 -12.918 -2.055 364 1HG GLU 50 HG2 GLU 50 5.387 -11.495 -0.063 365 2HG GLU 50 HG1 GLU 50 4.866 -12.874 0.904 366 H GLN 51 HN GLN 51 1.440 -14.397 -1.801 367 HA GLN 51 HA GLN 51 0.011 -15.639 -0.554 368 1HB GLN 51 HB2 GLN 51 1.787 -14.920 1.784 369 2HB GLN 51 HB1 GLN 51 0.484 -16.100 1.830 370 1HG GLN 51 HG2 GLN 51 1.681 -17.383 0.065 371 2HG GLN 51 HG1 GLN 51 3.023 -16.251 0.227 372 1HE2 GLN 51 HE21 GLN 51 2.901 -19.124 0.707 373 2HE2 GLN 51 HE22 GLN 51 3.408 -19.360 2.347 374 H GLY 52 HN GLY 52 0.944 -12.701 1.183 375 1HA GLY 52 HA2 GLY 52 -1.458 -11.358 1.040 376 2HA GLY 52 HA1 GLY 52 -1.579 -12.378 2.474 377 H LYS 53 HN LYS 53 1.410 -11.086 1.302 378 HA LYS 53 HA LYS 53 1.468 -9.075 3.445 379 1HB LYS 53 HB2 LYS 53 3.484 -11.169 2.764 380 2HB LYS 53 HB1 LYS 53 4.042 -9.629 3.352 381 1HG LYS 53 HG2 LYS 53 3.942 -11.183 5.170 382 2HG LYS 53 HG1 LYS 53 2.724 -9.928 5.400 383 1HD LYS 53 HD2 LYS 53 1.000 -11.414 4.615 384 2HD LYS 53 HD1 LYS 53 2.196 -12.659 4.253 385 1HE LYS 53 HE2 LYS 53 2.726 -12.915 6.573 386 2HE LYS 53 HE1 LYS 53 1.732 -11.525 7.001 387 1HZ LYS 53 HZ1 LYS 53 -0.204 -12.697 6.706 388 2HZ LYS 53 HZ2 LYS 53 0.815 -13.911 7.308 389 3HZ LYS 53 HZ3 LYS 53 0.491 -13.822 5.646 390 H PHE 54 HN PHE 54 2.331 -7.129 2.828 391 HA PHE 54 HA PHE 54 3.499 -7.068 0.152 392 1HB PHE 54 HB2 PHE 54 2.604 -4.718 -0.033 393 2HB PHE 54 HB1 PHE 54 1.454 -6.040 -0.130 394 HD1 PHE 54 HD1 PHE 54 -0.459 -4.782 0.323 395 HD2 PHE 54 HD2 PHE 54 2.785 -4.729 3.074 396 HE1 PHE 54 HE1 PHE 54 -1.903 -3.688 1.985 397 HE2 PHE 54 HE2 PHE 54 1.348 -3.634 4.745 398 HZ PHE 54 HZ PHE 54 -0.997 -3.112 4.201 399 H PHE 55 HN PHE 55 5.095 -5.565 -0.291 400 HA PHE 55 HA PHE 55 6.537 -4.365 1.901 401 1HB PHE 55 HB2 PHE 55 8.556 -5.867 1.394 402 2HB PHE 55 HB1 PHE 55 7.245 -6.597 2.319 403 HD1 PHE 55 HD1 PHE 55 8.803 -6.405 -1.023 404 HD2 PHE 55 HD2 PHE 55 6.013 -8.428 1.475 405 HE1 PHE 55 HE1 PHE 55 8.613 -8.207 -2.691 406 HE2 PHE 55 HE2 PHE 55 5.824 -10.226 -0.185 407 HZ PHE 55 HZ PHE 55 7.123 -10.117 -2.271 408 H LEU 56 HN LEU 56 8.725 -3.622 1.098 409 HA LEU 56 HA LEU 56 8.583 -2.512 -1.573 410 1HB LEU 56 HB2 LEU 56 11.028 -2.489 0.170 411 2HB LEU 56 HB1 LEU 56 10.496 -1.287 -0.988 412 HG LEU 56 HG LEU 56 9.093 -1.786 1.636 413 1HD1 LEU 56 HD11 LEU 56 11.392 -1.083 2.049 414 2HD1 LEU 56 HD12 LEU 56 10.249 0.195 2.465 415 3HD1 LEU 56 HD13 LEU 56 11.172 0.291 0.966 416 1HD2 LEU 56 HD21 LEU 56 8.146 0.436 1.223 417 2HD2 LEU 56 HD22 LEU 56 7.725 -0.699 -0.058 418 3HD2 LEU 56 HD23 LEU 56 8.985 0.503 -0.326 419 H ILE 57 HN ILE 57 9.073 -3.904 -3.259 420 HA ILE 57 HA ILE 57 11.160 -5.899 -2.716 421 HB ILE 57 HB ILE 57 9.053 -6.898 -3.469 422 1HG1 ILE 57 HG12 ILE 57 9.958 -8.248 -5.331 423 2HG1 ILE 57 HG11 ILE 57 11.259 -7.081 -5.533 424 1HG2 ILE 57 HG21 ILE 57 8.147 -5.109 -4.798 425 2HG2 ILE 57 HG22 ILE 57 8.267 -6.571 -5.778 426 3HG2 ILE 57 HG23 ILE 57 9.451 -5.278 -5.973 427 1HD1 ILE 57 HD11 ILE 57 12.038 -9.020 -4.326 428 2HD1 ILE 57 HD12 ILE 57 10.774 -8.804 -3.114 429 3HD1 ILE 57 HD13 ILE 57 12.057 -7.604 -3.275 430 H SER 58 HN SER 58 13.036 -5.737 -3.611 431 HA SER 58 HA SER 58 13.654 -3.435 -5.188 432 1HB SER 58 HB2 SER 58 15.171 -4.284 -3.432 433 2HB SER 58 HB1 SER 58 15.406 -5.764 -4.358 434 HG SER 58 HG SER 58 16.001 -3.174 -5.346 435 H ASP 59 HN ASP 59 13.936 -3.298 -7.315 436 HA ASP 59 HA ASP 59 13.333 -5.319 -9.160 437 1HB ASP 59 HB2 ASP 59 13.537 -2.780 -9.527 438 2HB ASP 59 HB1 ASP 59 15.269 -3.049 -9.657 439 H ASN 60 HN ASN 60 16.270 -4.362 -7.556 440 HA ASN 60 HA ASN 60 18.107 -5.970 -8.997 441 1HB ASN 60 HB2 ASN 60 18.346 -5.000 -6.140 442 2HB ASN 60 HB1 ASN 60 19.661 -5.452 -7.218 443 1HD2 ASN 60 HD21 ASN 60 20.368 -4.013 -8.758 444 2HD2 ASN 60 HD22 ASN 60 19.853 -2.357 -8.806 445 H ASN 61 HN ASN 61 15.841 -6.590 -6.487 446 HA ASN 61 HA ASN 61 15.220 -8.408 -5.294 447 1HB ASN 61 HB2 ASN 61 15.253 -9.513 -7.526 448 2HB ASN 61 HB1 ASN 61 16.920 -9.997 -7.229 449 1HD2 ASN 61 HD21 ASN 61 17.349 -11.638 -5.771 450 2HD2 ASN 61 HD22 ASN 61 16.113 -12.674 -5.139 451 H ARG 62 HN ARG 62 16.110 -8.048 -3.352 452 HA ARG 62 HA ARG 62 18.227 -9.722 -2.470 453 1HB ARG 62 HB2 ARG 62 19.686 -7.809 -1.639 454 2HB ARG 62 HB1 ARG 62 19.755 -8.155 -3.359 455 1HG ARG 62 HG2 ARG 62 18.576 -6.221 -3.920 456 2HG ARG 62 HG1 ARG 62 17.946 -6.018 -2.285 457 1HD ARG 62 HD2 ARG 62 20.848 -5.754 -3.059 458 2HD ARG 62 HD1 ARG 62 19.734 -4.402 -2.847 459 HE ARG 62 HE ARG 62 19.525 -5.760 -0.501 460 1HH1 ARG 62 HH11 ARG 62 22.232 -4.406 -2.277 461 2HH1 ARG 62 HH12 ARG 62 23.205 -4.187 -0.860 462 1HH2 ARG 62 HH21 ARG 62 20.773 -5.449 1.334 463 2HH2 ARG 62 HH22 ARG 62 22.378 -4.787 1.207 464 H ASP 63 HN ASP 63 16.333 -6.813 -1.812 465 HA ASP 63 HA ASP 63 15.899 -7.773 0.932 466 1HB ASP 63 HB2 ASP 63 16.391 -4.959 -0.047 467 2HB ASP 63 HB1 ASP 63 15.591 -5.278 1.484 468 H LYS 64 HN LYS 64 13.804 -7.825 1.597 469 HA LYS 64 HA LYS 64 11.908 -6.139 0.161 470 1HB LYS 64 HB2 LYS 64 10.193 -7.872 0.123 471 2HB LYS 64 HB1 LYS 64 11.605 -8.366 -0.790 472 1HG LYS 64 HG2 LYS 64 11.366 -10.301 0.288 473 2HG LYS 64 HG1 LYS 64 12.115 -9.467 1.649 474 1HD LYS 64 HD2 LYS 64 9.991 -8.975 2.620 475 2HD LYS 64 HD1 LYS 64 9.132 -9.514 1.178 476 1HE LYS 64 HE2 LYS 64 10.797 -11.265 2.989 477 2HE LYS 64 HE1 LYS 64 9.036 -11.167 2.992 478 1HZ LYS 64 HZ1 LYS 64 10.670 -12.026 0.659 479 2HZ LYS 64 HZ2 LYS 64 8.975 -12.049 0.774 480 3HZ LYS 64 HZ3 LYS 64 9.908 -13.080 1.745 481 H LEU 65 HN LEU 65 11.346 -4.719 1.582 482 HA LEU 65 HA LEU 65 11.016 -5.559 4.370 483 1HB LEU 65 HB2 LEU 65 12.631 -3.981 4.465 484 2HB LEU 65 HB1 LEU 65 12.006 -3.057 3.117 485 HG LEU 65 HG LEU 65 10.106 -2.398 4.700 486 1HD1 LEU 65 HD11 LEU 65 10.653 -2.482 7.081 487 2HD1 LEU 65 HD12 LEU 65 12.098 -3.425 6.718 488 3HD1 LEU 65 HD13 LEU 65 10.500 -4.099 6.395 489 1HD2 LEU 65 HD21 LEU 65 11.822 -0.856 3.979 490 2HD2 LEU 65 HD22 LEU 65 12.936 -1.482 5.193 491 3HD2 LEU 65 HD23 LEU 65 11.485 -0.611 5.691 492 H TYR 66 HN TYR 66 9.145 -5.467 5.274 493 HA TYR 66 HA TYR 66 6.828 -4.947 3.705 494 1HB TYR 66 HB2 TYR 66 6.868 -5.391 6.670 495 2HB TYR 66 HB1 TYR 66 5.644 -5.891 5.507 496 HD1 TYR 66 HD1 TYR 66 8.822 -6.762 7.099 497 HD2 TYR 66 HD2 TYR 66 6.036 -7.839 4.065 498 HE1 TYR 66 HE1 TYR 66 9.871 -8.973 6.925 499 HE2 TYR 66 HE2 TYR 66 7.079 -10.054 3.887 500 HH TYR 66 HH TYR 66 9.080 -11.195 4.381 501 H VAL 67 HN VAL 67 5.353 -3.287 3.895 502 HA VAL 67 HA VAL 67 5.928 -1.152 5.818 503 HB VAL 67 HB VAL 67 5.481 0.556 4.038 504 1HG1 VAL 67 HG11 VAL 67 7.737 0.499 3.110 505 2HG1 VAL 67 HG12 VAL 67 7.906 -1.184 3.610 506 3HG1 VAL 67 HG13 VAL 67 7.747 0.084 4.825 507 1HG2 VAL 67 HG21 VAL 67 4.383 -0.904 2.418 508 2HG2 VAL 67 HG22 VAL 67 5.887 -1.795 2.187 509 3HG2 VAL 67 HG23 VAL 67 5.778 -0.105 1.695 510 H ASN 68 HN ASN 68 4.162 -0.030 6.530 511 HA ASN 68 HA ASN 68 1.581 -1.203 5.758 512 1HB ASN 68 HB2 ASN 68 2.266 0.404 8.238 513 2HB ASN 68 HB1 ASN 68 0.732 -0.394 7.909 514 1HD2 ASN 68 HD21 ASN 68 3.938 -0.742 9.065 515 2HD2 ASN 68 HD22 ASN 68 3.842 -2.420 9.495 516 H ILE 69 HN ILE 69 0.313 -0.058 4.515 517 HA ILE 69 HA ILE 69 0.886 2.717 3.967 518 HB ILE 69 HB ILE 69 -1.593 1.510 2.882 519 1HG1 ILE 69 HG12 ILE 69 1.132 0.535 1.995 520 2HG1 ILE 69 HG11 ILE 69 -0.011 -0.419 2.928 521 1HG2 ILE 69 HG21 ILE 69 0.735 2.949 1.610 522 2HG2 ILE 69 HG22 ILE 69 -0.753 3.701 2.177 523 3HG2 ILE 69 HG23 ILE 69 -0.800 2.564 0.832 524 1HD1 ILE 69 HD11 ILE 69 -1.597 -0.327 1.087 525 2HD1 ILE 69 HD12 ILE 69 -0.057 -1.016 0.576 526 3HD1 ILE 69 HD13 ILE 69 -0.463 0.649 0.153 527 H ARG 70 HN ARG 70 0.377 3.786 5.896 528 HA ARG 70 HA ARG 70 -2.281 3.364 7.029 529 1HB ARG 70 HB2 ARG 70 -0.488 3.281 8.638 530 2HB ARG 70 HB1 ARG 70 0.137 4.830 8.090 531 1HG ARG 70 HG2 ARG 70 -1.909 5.926 8.892 532 2HG ARG 70 HG1 ARG 70 -2.496 4.370 9.484 533 1HD ARG 70 HD2 ARG 70 -0.667 4.220 11.041 534 2HD ARG 70 HD1 ARG 70 0.077 5.672 10.369 535 HE ARG 70 HE ARG 70 -2.337 6.576 11.151 536 1HH1 ARG 70 HH11 ARG 70 0.117 4.698 12.817 537 2HH1 ARG 70 HH12 ARG 70 -0.315 5.308 14.387 538 1HH2 ARG 70 HH21 ARG 70 -2.868 7.401 13.195 539 2HH2 ARG 70 HH22 ARG 70 -1.985 6.879 14.598 540 HA PRO 71 HA PRO 71 -4.033 6.955 5.062 541 1HB PRO 71 HB2 PRO 71 -5.811 7.332 7.223 542 2HB PRO 71 HB1 PRO 71 -6.147 6.497 5.707 543 1HG PRO 71 HG2 PRO 71 -5.440 5.389 8.360 544 2HG PRO 71 HG1 PRO 71 -6.413 4.680 7.059 545 1HD PRO 71 HD2 PRO 71 -3.914 3.836 7.603 546 2HD PRO 71 HD1 PRO 71 -4.566 3.862 5.950 547 H MET 72 HN MET 72 -3.624 9.056 5.202 548 HA MET 72 HA MET 72 -1.941 10.061 7.258 549 1HB MET 72 HB2 MET 72 -1.914 10.745 4.841 550 2HB MET 72 HB1 MET 72 -3.419 11.608 5.128 551 1HG MET 72 HG2 MET 72 -2.312 13.073 6.712 552 2HG MET 72 HG1 MET 72 -0.803 12.183 6.501 553 1HE MET 72 HE1 MET 72 0.457 14.462 5.966 554 2HE MET 72 HE2 MET 72 -1.049 15.356 6.164 555 3HE MET 72 HE3 MET 72 -0.063 15.600 4.722 556 H ASP 73 HN ASP 73 -3.737 9.329 8.874 557 HA ASP 73 HA ASP 73 -5.003 9.951 10.645 558 1HB ASP 73 HB2 ASP 73 -3.303 11.854 10.598 559 2HB ASP 73 HB1 ASP 73 -4.568 12.828 9.858 560 H ASN 74 HN ASN 74 -6.160 9.915 7.770 561 HA ASN 74 HA ASN 74 -8.325 11.796 7.914 562 1HB ASN 74 HB2 ASN 74 -7.778 9.562 5.963 563 2HB ASN 74 HB1 ASN 74 -9.149 10.656 5.838 564 1HD2 ASN 74 HD21 ASN 74 -5.767 10.260 5.366 565 2HD2 ASN 74 HD22 ASN 74 -5.463 11.803 4.658 566 H SER 75 HN SER 75 -7.943 8.358 8.539 567 HA SER 75 HA SER 75 -10.161 8.332 10.286 568 1HB SER 75 HB2 SER 75 -11.599 6.731 9.043 569 2HB SER 75 HB1 SER 75 -11.500 8.301 8.248 570 HG SER 75 HG SER 75 -11.031 5.989 7.176 571 H ALA 76 HN ALA 76 -10.679 5.959 10.930 572 HA ALA 76 HA ALA 76 -8.126 4.623 11.315 573 1HB ALA 76 HB1 ALA 76 -9.562 4.933 13.258 574 2HB ALA 76 HB2 ALA 76 -9.357 3.216 12.909 575 3HB ALA 76 HB3 ALA 76 -10.855 4.033 12.463 576 H TRP 77 HN TRP 77 -7.526 2.843 10.274 577 HA TRP 77 HA TRP 77 -9.506 1.513 8.545 578 1HB TRP 77 HB2 TRP 77 -6.579 2.091 8.094 579 2HB TRP 77 HB1 TRP 77 -7.457 0.902 7.141 580 HD1 TRP 77 HD1 TRP 77 -8.944 4.343 8.093 581 HE1 TRP 77 HE1 TRP 77 -9.346 5.668 5.913 582 HE3 TRP 77 HE3 TRP 77 -6.747 1.138 4.780 583 HZ2 TRP 77 HZ2 TRP 77 -8.786 5.378 3.172 584 HZ3 TRP 77 HZ3 TRP 77 -6.722 1.740 2.399 585 HH2 TRP 77 HH2 TRP 77 -7.715 3.819 1.617 586 H THR 78 HN THR 78 -9.251 -0.751 8.232 587 HA THR 78 HA THR 78 -8.030 -2.139 10.481 588 HB THR 78 HB THR 78 -9.655 -3.235 8.171 589 HG1 THR 78 HG1 THR 78 -10.315 -2.199 10.717 590 1HG2 THR 78 HG21 THR 78 -9.920 -5.219 9.565 591 2HG2 THR 78 HG22 THR 78 -8.922 -4.491 10.823 592 3HG2 THR 78 HG23 THR 78 -8.210 -4.911 9.265 593 H THR 79 HN THR 79 -5.982 -2.742 10.341 594 HA THR 79 HA THR 79 -4.695 -2.647 7.749 595 HB THR 79 HB THR 79 -3.604 -1.397 9.476 596 HG1 THR 79 HG1 THR 79 -2.397 -3.291 8.088 597 1HG2 THR 79 HG21 THR 79 -2.663 -2.432 11.486 598 2HG2 THR 79 HG22 THR 79 -3.393 -3.972 11.034 599 3HG2 THR 79 HG23 THR 79 -4.418 -2.594 11.439 600 H ASP 80 HN ASP 80 -4.354 -4.329 6.579 601 HA ASP 80 HA ASP 80 -3.445 -6.805 7.872 602 1HB ASP 80 HB2 ASP 80 -5.675 -7.253 6.984 603 2HB ASP 80 HB1 ASP 80 -5.240 -6.536 5.438 604 H ASN 81 HN ASN 81 -1.921 -8.015 6.373 605 HA ASN 81 HA ASN 81 -0.221 -6.043 5.094 606 1HB ASN 81 HB2 ASN 81 0.182 -8.947 5.768 607 2HB ASN 81 HB1 ASN 81 1.319 -8.065 4.752 608 1HD2 ASN 81 HD21 ASN 81 2.520 -6.348 5.658 609 2HD2 ASN 81 HD22 ASN 81 2.712 -6.190 7.373 610 H GLY 82 HN GLY 82 -2.764 -7.915 4.099 611 1HA GLY 82 HA2 GLY 82 -1.700 -8.061 1.360 612 2HA GLY 82 HA1 GLY 82 -3.107 -8.938 1.951 613 H VAL 83 HN VAL 83 -4.289 -6.732 3.314 614 HA VAL 83 HA VAL 83 -4.868 -4.847 1.147 615 HB VAL 83 HB VAL 83 -7.287 -4.970 1.641 616 1HG1 VAL 83 HG11 VAL 83 -6.081 -7.593 0.766 617 2HG1 VAL 83 HG12 VAL 83 -6.391 -6.196 -0.266 618 3HG1 VAL 83 HG13 VAL 83 -7.738 -7.070 0.466 619 1HG2 VAL 83 HG21 VAL 83 -8.174 -6.889 2.896 620 2HG2 VAL 83 HG22 VAL 83 -7.170 -5.846 3.905 621 3HG2 VAL 83 HG23 VAL 83 -6.527 -7.373 3.302 622 H PHE 84 HN PHE 84 -5.870 -2.882 1.888 623 HA PHE 84 HA PHE 84 -5.747 -2.450 4.785 624 1HB PHE 84 HB2 PHE 84 -3.703 -1.603 3.184 625 2HB PHE 84 HB1 PHE 84 -4.770 -0.207 3.108 626 HD1 PHE 84 HD1 PHE 84 -5.665 0.608 5.468 627 HD2 PHE 84 HD2 PHE 84 -2.149 -1.708 4.851 628 HE1 PHE 84 HE1 PHE 84 -4.774 1.395 7.622 629 HE2 PHE 84 HE2 PHE 84 -1.254 -0.926 7.004 630 HZ PHE 84 HZ PHE 84 -2.567 0.629 8.393 631 H TYR 85 HN TYR 85 -7.837 -1.972 5.223 632 HA TYR 85 HA TYR 85 -9.179 -0.030 3.492 633 1HB TYR 85 HB2 TYR 85 -11.221 -1.369 3.391 634 2HB TYR 85 HB1 TYR 85 -9.872 -2.212 2.650 635 HD1 TYR 85 HD1 TYR 85 -12.612 -2.523 4.808 636 HD2 TYR 85 HD2 TYR 85 -8.617 -3.912 4.268 637 HE1 TYR 85 HE1 TYR 85 -13.113 -4.506 6.187 638 HE2 TYR 85 HE2 TYR 85 -9.116 -5.893 5.638 639 HH TYR 85 HH TYR 85 -10.596 -6.765 7.146 640 H LYS 86 HN LYS 86 -10.768 1.188 4.458 641 HA LYS 86 HA LYS 86 -10.543 1.387 7.309 642 1HB LYS 86 HB2 LYS 86 -12.146 3.269 7.076 643 2HB LYS 86 HB1 LYS 86 -10.703 3.443 6.092 644 1HG LYS 86 HG2 LYS 86 -11.897 2.921 4.108 645 2HG LYS 86 HG1 LYS 86 -13.319 2.416 5.025 646 1HD LYS 86 HD2 LYS 86 -13.644 4.682 5.824 647 2HD LYS 86 HD1 LYS 86 -12.174 5.207 5.009 648 1HE LYS 86 HE2 LYS 86 -13.149 4.835 2.861 649 2HE LYS 86 HE1 LYS 86 -14.554 4.037 3.568 650 1HZ LYS 86 HZ1 LYS 86 -14.845 6.434 2.864 651 2HZ LYS 86 HZ2 LYS 86 -13.868 6.864 4.178 652 3HZ LYS 86 HZ3 LYS 86 -15.340 6.061 4.436 653 H ASN 87 HN ASN 87 -12.334 1.406 8.755 654 HA ASN 87 HA ASN 87 -14.159 -0.789 8.248 655 1HB ASN 87 HB2 ASN 87 -14.768 -0.538 10.616 656 2HB ASN 87 HB1 ASN 87 -13.021 -0.622 10.426 657 1HD2 ASN 87 HD21 ASN 87 -14.663 0.488 12.575 658 2HD2 ASN 87 HD22 ASN 87 -14.172 2.140 12.741 659 H ASP 88 HN ASP 88 -14.194 2.242 7.300 660 HA ASP 88 HA ASP 88 -17.054 2.700 7.799 661 1HB ASP 88 HB2 ASP 88 -15.024 4.630 6.639 662 2HB ASP 88 HB1 ASP 88 -16.679 5.001 7.100 663 H VAL 89 HN VAL 89 -18.454 2.351 6.143 664 HA VAL 89 HA VAL 89 -17.300 1.704 3.552 665 HB VAL 89 HB VAL 89 -19.613 1.017 2.905 666 1HG1 VAL 89 HG11 VAL 89 -19.609 -1.022 4.265 667 2HG1 VAL 89 HG12 VAL 89 -18.479 -0.269 5.390 668 3HG1 VAL 89 HG13 VAL 89 -17.984 -0.595 3.729 669 1HG2 VAL 89 HG21 VAL 89 -21.292 0.729 4.677 670 2HG2 VAL 89 HG22 VAL 89 -20.888 2.429 4.444 671 3HG2 VAL 89 HG23 VAL 89 -20.227 1.547 5.820 672 H GLY 90 HN GLY 90 -16.836 3.367 2.323 673 1HA GLY 90 HA2 GLY 90 -18.688 4.887 0.974 674 2HA GLY 90 HA1 GLY 90 -18.259 5.847 2.385 675 H SER 91 HN SER 91 -17.413 7.381 0.789 676 HA SER 91 HA SER 91 -15.089 6.549 -0.715 677 1HB SER 91 HB2 SER 91 -16.386 9.274 -0.421 678 2HB SER 91 HB1 SER 91 -15.113 8.860 -1.572 679 HG SER 91 HG SER 91 -17.685 8.647 -1.957 680 H TRP 92 HN TRP 92 -13.010 7.341 -0.396 681 HA TRP 92 HA TRP 92 -12.506 8.502 2.266 682 1HB TRP 92 HB2 TRP 92 -11.851 6.087 2.028 683 2HB TRP 92 HB1 TRP 92 -10.678 6.601 0.813 684 HD1 TRP 92 HD1 TRP 92 -11.438 7.042 4.575 685 HE1 TRP 92 HE1 TRP 92 -9.242 7.686 5.756 686 HE3 TRP 92 HE3 TRP 92 -8.471 7.518 0.474 687 HZ2 TRP 92 HZ2 TRP 92 -6.578 8.310 5.009 688 HZ3 TRP 92 HZ3 TRP 92 -6.133 8.147 0.778 689 HH2 TRP 92 HH2 TRP 92 -5.197 8.533 2.996 690 H GLY 93 HN GLY 93 -10.920 7.926 -0.824 691 1HA GLY 93 HA2 GLY 93 -9.361 9.187 -1.984 692 2HA GLY 93 HA1 GLY 93 -10.712 10.287 -2.000 693 H GLY 94 HN GLY 94 -7.614 9.552 -0.633 694 1HA GLY 94 HA2 GLY 94 -7.170 12.339 -0.075 695 2HA GLY 94 HA1 GLY 94 -7.249 11.349 1.377 696 H THR 95 HN THR 95 -5.268 10.931 2.100 697 HA THR 95 HA THR 95 -3.272 9.954 0.188 698 HB THR 95 HB THR 95 -1.581 11.221 1.772 699 HG1 THR 95 HG1 THR 95 -2.441 12.766 2.947 700 1HG2 THR 95 HG21 THR 95 -1.780 11.567 -0.644 701 2HG2 THR 95 HG22 THR 95 -1.569 13.100 0.201 702 3HG2 THR 95 HG23 THR 95 -3.164 12.627 -0.382 703 H ILE 96 HN ILE 96 -2.266 8.170 0.826 704 HA ILE 96 HA ILE 96 -2.277 7.485 3.692 705 HB ILE 96 HB ILE 96 -1.871 5.081 2.785 706 1HG1 ILE 96 HG12 ILE 96 -1.821 6.082 0.385 707 2HG1 ILE 96 HG11 ILE 96 -2.605 4.530 0.665 708 1HG2 ILE 96 HG21 ILE 96 -4.322 4.666 2.709 709 2HG2 ILE 96 HG22 ILE 96 -4.566 6.412 2.766 710 3HG2 ILE 96 HG23 ILE 96 -3.775 5.583 4.109 711 1HD1 ILE 96 HD11 ILE 96 -3.905 5.960 -0.816 712 2HD1 ILE 96 HD12 ILE 96 -4.003 7.186 0.447 713 3HD1 ILE 96 HD13 ILE 96 -4.777 5.618 0.676 714 H GLY 97 HN GLY 97 -0.319 6.965 4.602 715 1HA GLY 97 HA2 GLY 97 1.981 7.584 2.883 716 2HA GLY 97 HA1 GLY 97 1.944 7.727 4.630 717 H ILE 98 HN ILE 98 3.960 6.407 3.124 718 HA ILE 98 HA ILE 98 3.474 3.597 3.735 719 HB ILE 98 HB ILE 98 5.675 4.994 2.228 720 1HG1 ILE 98 HG12 ILE 98 4.956 3.190 0.529 721 2HG1 ILE 98 HG11 ILE 98 3.546 2.981 1.570 722 1HG2 ILE 98 HG21 ILE 98 5.645 2.107 3.089 723 2HG2 ILE 98 HG22 ILE 98 6.785 3.347 3.612 724 3HG2 ILE 98 HG23 ILE 98 6.770 2.814 1.931 725 1HD1 ILE 98 HD11 ILE 98 4.353 5.528 0.187 726 2HD1 ILE 98 HD12 ILE 98 2.949 5.320 1.232 727 3HD1 ILE 98 HD13 ILE 98 3.048 4.444 -0.297 728 H TYR 99 HN TYR 99 3.823 2.994 5.722 729 HA TYR 99 HA TYR 99 6.017 4.243 7.243 730 1HB TYR 99 HB2 TYR 99 3.585 2.749 8.290 731 2HB TYR 99 HB1 TYR 99 4.823 3.517 9.272 732 HD1 TYR 99 HD1 TYR 99 4.209 5.533 10.244 733 HD2 TYR 99 HD2 TYR 99 2.514 4.488 6.491 734 HE1 TYR 99 HE1 TYR 99 2.908 7.616 10.255 735 HE2 TYR 99 HE2 TYR 99 1.206 6.563 6.494 736 HH TYR 99 HH TYR 99 1.807 9.106 8.693 737 H VAL 100 HN VAL 100 7.747 2.972 7.518 738 HA VAL 100 HA VAL 100 7.959 0.350 6.574 739 HB VAL 100 HB VAL 100 9.888 1.856 6.938 740 1HG1 VAL 100 HG11 VAL 100 9.473 1.216 9.851 741 2HG1 VAL 100 HG12 VAL 100 9.231 2.787 9.086 742 3HG1 VAL 100 HG13 VAL 100 10.847 2.086 9.167 743 1HG2 VAL 100 HG21 VAL 100 10.085 -0.773 8.392 744 2HG2 VAL 100 HG22 VAL 100 11.441 0.164 7.763 745 3HG2 VAL 100 HG23 VAL 100 10.256 -0.529 6.654 746 H ASP 101 HN ASP 101 7.622 -1.641 7.500 747 HA ASP 101 HA ASP 101 6.468 -1.712 10.162 748 1HB ASP 101 HB2 ASP 101 5.707 -3.164 8.192 749 2HB ASP 101 HB1 ASP 101 7.177 -4.097 8.450 750 H GLY 102 HN GLY 102 8.247 -0.964 11.360 751 1HA GLY 102 HA2 GLY 102 10.100 -1.290 12.703 752 2HA GLY 102 HA1 GLY 102 10.228 -2.926 12.068 753 H GLN 103 HN GLN 103 11.569 0.171 12.050 754 HA GLN 103 HA GLN 103 12.702 0.662 9.667 755 1HB GLN 103 HB2 GLN 103 14.863 1.166 11.164 756 2HB GLN 103 HB1 GLN 103 13.438 2.191 11.157 757 1HG GLN 103 HG2 GLN 103 14.042 1.913 13.411 758 2HG GLN 103 HG1 GLN 103 12.628 0.898 13.156 759 1HE2 GLN 103 HE21 GLN 103 16.044 0.960 13.755 760 2HE2 GLN 103 HE22 GLN 103 16.208 -0.710 14.185 761 H GLN 104 HN GLN 104 13.935 -0.309 8.226 762 HA GLN 104 HA GLN 104 15.070 -2.910 8.879 763 1HB GLN 104 HB2 GLN 104 13.572 -2.457 6.879 764 2HB GLN 104 HB1 GLN 104 14.914 -1.572 6.175 765 1HG GLN 104 HG2 GLN 104 14.789 -3.819 5.279 766 2HG GLN 104 HG1 GLN 104 16.271 -3.606 6.209 767 1HE2 GLN 104 HE21 GLN 104 13.174 -4.020 7.754 768 2HE2 GLN 104 HE22 GLN 104 13.473 -5.604 8.377 769 H THR 105 HN THR 105 16.226 -0.198 9.595 770 HA THR 105 HA THR 105 18.306 0.568 10.072 771 HB THR 105 HB THR 105 19.463 -1.843 8.677 772 HG1 THR 105 HG1 THR 105 19.004 -3.038 10.435 773 1HG2 THR 105 HG21 THR 105 21.240 -1.583 10.342 774 2HG2 THR 105 HG22 THR 105 20.404 -0.183 11.019 775 3HG2 THR 105 HG23 THR 105 21.051 -0.117 9.380 776 H ASN 106 HN ASN 106 17.265 0.063 6.929 777 HA ASN 106 HA ASN 106 17.731 0.977 4.914 778 1HB ASN 106 HB2 ASN 106 17.887 3.130 5.921 779 2HB ASN 106 HB1 ASN 106 19.464 2.775 6.600 780 1HD2 ASN 106 HD21 ASN 106 18.657 1.927 3.292 781 2HD2 ASN 106 HD22 ASN 106 19.682 3.107 2.556 782 H THR 107 HN THR 107 18.542 -0.963 4.242 783 HA THR 107 HA THR 107 21.415 -1.330 4.143 784 HB THR 107 HB THR 107 20.474 -3.272 2.552 785 HG1 THR 107 HG1 THR 107 18.433 -3.975 3.329 786 1HG2 THR 107 HG21 THR 107 21.777 -3.646 4.563 787 2HG2 THR 107 HG22 THR 107 20.400 -4.746 4.509 788 3HG2 THR 107 HG23 THR 107 20.358 -3.332 5.562 789 HA PRO 108 HA PRO 108 22.411 0.793 0.447 790 1HB PRO 108 HB2 PRO 108 23.208 -1.928 -0.536 791 2HB PRO 108 HB1 PRO 108 24.065 -0.388 -0.686 792 1HG PRO 108 HG2 PRO 108 24.758 -2.165 1.181 793 2HG PRO 108 HG1 PRO 108 24.790 -0.424 1.513 794 1HD PRO 108 HD2 PRO 108 22.925 -2.491 2.502 795 2HD PRO 108 HD1 PRO 108 23.347 -0.920 3.208 796 HA PRO 109 HA PRO 109 18.468 -0.561 -1.274 797 1HB PRO 109 HB2 PRO 109 17.928 2.242 -1.813 798 2HB PRO 109 HB1 PRO 109 17.143 1.166 -0.656 799 1HG PRO 109 HG2 PRO 109 18.746 3.256 0.067 800 2HG PRO 109 HG1 PRO 109 18.508 1.810 1.060 801 1HD PRO 109 HD2 PRO 109 20.797 2.526 -0.729 802 2HD PRO 109 HD1 PRO 109 20.805 1.712 0.862 803 H GLY 110 HN GLY 110 17.213 0.220 -3.268 804 1HA GLY 110 HA2 GLY 110 18.807 1.261 -5.447 805 2HA GLY 110 HA1 GLY 110 18.308 -0.420 -5.611 806 H ASN 111 HN ASN 111 16.664 -0.521 -6.951 807 HA ASN 111 HA ASN 111 14.521 1.461 -6.756 808 1HB ASN 111 HB2 ASN 111 15.416 0.786 -9.005 809 2HB ASN 111 HB1 ASN 111 14.820 -0.841 -8.705 810 1HD2 ASN 111 HD21 ASN 111 14.153 1.030 -10.804 811 2HD2 ASN 111 HD22 ASN 111 12.443 1.280 -10.712 812 H TYR 112 HN TYR 112 13.182 1.005 -5.092 813 HA TYR 112 HA TYR 112 12.304 -1.776 -4.774 814 1HB TYR 112 HB2 TYR 112 12.128 0.589 -2.894 815 2HB TYR 112 HB1 TYR 112 11.255 -0.919 -2.622 816 HD1 TYR 112 HD1 TYR 112 12.695 -3.095 -2.566 817 HD2 TYR 112 HD2 TYR 112 14.299 0.818 -2.130 818 HE1 TYR 112 HE1 TYR 112 14.662 -4.034 -1.445 819 HE2 TYR 112 HE2 TYR 112 16.276 -0.115 -1.012 820 HH TYR 112 HH TYR 112 16.843 -2.169 0.295 821 H THR 113 HN THR 113 10.663 -2.251 -5.963 822 HA THR 113 HA THR 113 8.743 -0.176 -6.718 823 HB THR 113 HB THR 113 9.111 -2.964 -7.831 824 HG1 THR 113 HG1 THR 113 10.621 -0.772 -8.128 825 1HG2 THR 113 HG21 THR 113 7.814 -2.122 -9.730 826 2HG2 THR 113 HG22 THR 113 7.625 -0.568 -8.916 827 3HG2 THR 113 HG23 THR 113 6.885 -2.014 -8.234 828 H LEU 114 HN LEU 114 6.792 -0.128 -5.797 829 HA LEU 114 HA LEU 114 5.619 -2.649 -4.882 830 1HB LEU 114 HB2 LEU 114 4.555 -1.095 -3.019 831 2HB LEU 114 HB1 LEU 114 6.082 -1.919 -2.780 832 HG LEU 114 HG LEU 114 6.133 0.849 -3.875 833 1HD1 LEU 114 HD11 LEU 114 4.576 1.013 -1.999 834 2HD1 LEU 114 HD12 LEU 114 6.120 1.766 -1.600 835 3HD1 LEU 114 HD13 LEU 114 5.725 0.169 -0.962 836 1HD2 LEU 114 HD21 LEU 114 7.896 -0.679 -1.976 837 2HD2 LEU 114 HD22 LEU 114 8.205 0.941 -2.602 838 3HD2 LEU 114 HD23 LEU 114 8.186 -0.440 -3.699 839 H THR 115 HN THR 115 3.971 -2.957 -6.155 840 HA THR 115 HA THR 115 2.577 -0.667 -7.322 841 HB THR 115 HB THR 115 2.238 -3.595 -7.997 842 HG1 THR 115 HG1 THR 115 4.456 -2.742 -8.238 843 1HG2 THR 115 HG21 THR 115 1.709 -1.084 -9.590 844 2HG2 THR 115 HG22 THR 115 0.481 -2.083 -8.812 845 3HG2 THR 115 HG23 THR 115 1.442 -2.740 -10.138 846 H LEU 116 HN LEU 116 0.414 -0.282 -7.013 847 HA LEU 116 HA LEU 116 -0.977 -2.014 -5.078 848 1HB LEU 116 HB2 LEU 116 -0.963 0.997 -5.226 849 2HB LEU 116 HB1 LEU 116 -2.056 0.070 -4.215 850 HG LEU 116 HG LEU 116 0.955 0.098 -3.969 851 1HD1 LEU 116 HD11 LEU 116 -1.179 1.388 -2.275 852 2HD1 LEU 116 HD12 LEU 116 -0.005 2.218 -3.296 853 3HD1 LEU 116 HD13 LEU 116 0.537 1.318 -1.879 854 1HD2 LEU 116 HD21 LEU 116 0.560 -1.119 -1.876 855 2HD2 LEU 116 HD22 LEU 116 0.012 -2.030 -3.282 856 3HD2 LEU 116 HD23 LEU 116 -1.160 -1.202 -2.257 857 H THR 117 HN THR 117 -2.869 -2.744 -5.758 858 HA THR 117 HA THR 117 -4.036 -1.568 -8.184 859 HB THR 117 HB THR 117 -4.724 -4.218 -6.902 860 HG1 THR 117 HG1 THR 117 -2.467 -3.515 -8.128 861 1HG2 THR 117 HG21 THR 117 -5.135 -3.171 -9.708 862 2HG2 THR 117 HG22 THR 117 -6.390 -3.324 -8.477 863 3HG2 THR 117 HG23 THR 117 -5.599 -4.766 -9.117 864 H GLY 118 HN GLY 118 -5.686 -0.221 -7.902 865 1HA GLY 118 HA2 GLY 118 -6.966 0.132 -5.393 866 2HA GLY 118 HA1 GLY 118 -7.439 0.883 -6.910 867 H GLY 119 HN GLY 119 -9.038 -0.331 -4.716 868 1HA GLY 119 HA2 GLY 119 -11.161 -1.264 -6.175 869 2HA GLY 119 HA1 GLY 119 -10.222 -2.703 -5.793 870 H TYR 120 HN TYR 120 -12.596 -2.870 -4.806 871 HA TYR 120 HA TYR 120 -12.434 -1.879 -2.055 872 1HB TYR 120 HB2 TYR 120 -14.813 -2.524 -1.842 873 2HB TYR 120 HB1 TYR 120 -14.535 -1.316 -3.084 874 HD1 TYR 120 HD1 TYR 120 -15.523 -4.797 -2.435 875 HD2 TYR 120 HD2 TYR 120 -14.940 -1.816 -5.414 876 HE1 TYR 120 HE1 TYR 120 -16.799 -6.157 -4.043 877 HE2 TYR 120 HE2 TYR 120 -16.206 -3.167 -7.026 878 HH TYR 120 HH TYR 120 -17.993 -5.966 -6.077 879 H TRP 121 HN TRP 121 -13.500 -3.466 -0.480 880 HA TRP 121 HA TRP 121 -12.576 -6.194 -1.011 881 1HB TRP 121 HB2 TRP 121 -10.804 -5.470 0.297 882 2HB TRP 121 HB1 TRP 121 -11.789 -4.310 1.176 883 HD1 TRP 121 HD1 TRP 121 -13.563 -5.498 2.970 884 HE1 TRP 121 HE1 TRP 121 -13.116 -7.435 4.588 885 HE3 TRP 121 HE3 TRP 121 -9.480 -7.521 0.682 886 HZ2 TRP 121 HZ2 TRP 121 -11.275 -9.519 4.869 887 HZ3 TRP 121 HZ3 TRP 121 -8.431 -9.502 1.722 888 HH2 TRP 121 HH2 TRP 121 -9.317 -10.470 3.758 889 H ALA 122 HN ALA 122 -13.794 -7.791 -0.008 890 HA ALA 122 HA ALA 122 -16.253 -6.861 1.293 891 1HB ALA 122 HB1 ALA 122 -15.901 -9.290 -0.457 892 2HB ALA 122 HB2 ALA 122 -16.663 -7.774 -0.939 893 3HB ALA 122 HB3 ALA 122 -17.399 -8.771 0.315 894 H LYS 123 HN LYS 123 -16.902 -7.826 3.078 895 HA LYS 123 HA LYS 123 -17.064 -9.132 4.895 896 1HB LYS 123 HB2 LYS 123 -16.515 -10.953 3.010 897 2HB LYS 123 HB1 LYS 123 -15.079 -11.132 4.014 898 1HG LYS 123 HG2 LYS 123 -16.796 -12.710 4.696 899 2HG LYS 123 HG1 LYS 123 -16.501 -11.526 5.974 900 1HD LYS 123 HD2 LYS 123 -18.461 -10.227 5.058 901 2HD LYS 123 HD1 LYS 123 -18.811 -11.622 4.040 902 1HE LYS 123 HE2 LYS 123 -18.724 -11.583 7.054 903 2HE LYS 123 HE1 LYS 123 -20.174 -11.650 6.055 904 1HZ LYS 123 HZ1 LYS 123 -19.761 -13.832 6.743 905 2HZ LYS 123 HZ2 LYS 123 -18.103 -13.733 6.421 906 3HZ LYS 123 HZ3 LYS 123 -19.212 -13.785 5.138 907 H ASP 124 HN ASP 124 -14.710 -10.850 5.777 908 HA ASP 124 HA ASP 124 -12.760 -8.811 6.443 909 1HB ASP 124 HB2 ASP 124 -14.244 -8.445 8.244 910 2HB ASP 124 HB1 ASP 124 -14.557 -10.164 8.443 911 H ASN 125 HN ASN 125 -10.847 -9.587 6.288 912 HA ASN 125 HA ASN 125 -9.047 -10.882 6.079 913 1HB ASN 125 HB2 ASN 125 -8.351 -11.752 8.003 914 2HB ASN 125 HB1 ASN 125 -9.821 -11.022 8.614 915 1HD2 ASN 125 HD21 ASN 125 -8.192 -13.308 9.513 916 2HD2 ASN 125 HD22 ASN 125 -9.290 -14.642 9.642 917 H LYS 126 HN LYS 126 -11.920 -12.332 5.301 918 HA LYS 126 HA LYS 126 -10.898 -14.935 4.663 919 1HB LYS 126 HB2 LYS 126 -13.047 -15.303 3.595 920 2HB LYS 126 HB1 LYS 126 -13.279 -14.541 5.161 921 1HG LYS 126 HG2 LYS 126 -14.630 -13.147 4.079 922 2HG LYS 126 HG1 LYS 126 -13.146 -12.387 3.496 923 1HD LYS 126 HD2 LYS 126 -13.212 -13.954 1.544 924 2HD LYS 126 HD1 LYS 126 -14.804 -14.480 2.098 925 1HE LYS 126 HE2 LYS 126 -15.502 -12.062 2.004 926 2HE LYS 126 HE1 LYS 126 -13.974 -11.739 1.188 927 1HZ LYS 126 HZ1 LYS 126 -16.117 -13.556 0.213 928 2HZ LYS 126 HZ2 LYS 126 -14.613 -13.344 -0.535 929 3HZ LYS 126 HZ3 LYS 126 -15.703 -12.049 -0.443 930 H GLN 127 HN GLN 127 -10.326 -11.994 3.442 931 HA GLN 127 HA GLN 127 -9.306 -11.172 1.618 932 1HB GLN 127 HB2 GLN 127 -7.987 -13.320 1.775 933 2HB GLN 127 HB1 GLN 127 -9.085 -13.995 0.578 934 1HG GLN 127 HG2 GLN 127 -8.404 -12.336 -1.036 935 2HG GLN 127 HG1 GLN 127 -7.374 -11.554 0.162 936 1HE2 GLN 127 HE21 GLN 127 -5.450 -12.550 0.777 937 2HE2 GLN 127 HE22 GLN 127 -4.739 -13.820 -0.155 938 H GLY 128 HN GLY 128 -11.570 -10.377 1.337 939 1HA GLY 128 HA2 GLY 128 -12.785 -11.489 -1.098 940 2HA GLY 128 HA1 GLY 128 -13.608 -10.473 0.083 941 H PHE 129 HN PHE 129 -10.466 -10.027 -1.535 942 HA PHE 129 HA PHE 129 -11.103 -7.263 -1.895 943 1HB PHE 129 HB2 PHE 129 -8.845 -7.007 -2.581 944 2HB PHE 129 HB1 PHE 129 -8.823 -8.168 -1.271 945 HD1 PHE 129 HD1 PHE 129 -8.654 -10.634 -1.876 946 HD2 PHE 129 HD2 PHE 129 -7.888 -7.495 -4.644 947 HE1 PHE 129 HE1 PHE 129 -7.382 -12.194 -3.289 948 HE2 PHE 129 HE2 PHE 129 -6.617 -9.051 -6.064 949 HZ PHE 129 HZ PHE 129 -6.362 -11.405 -5.386 950 H THR 130 HN THR 130 -11.909 -6.324 -3.667 951 HA THR 130 HA THR 130 -11.873 -7.834 -6.200 952 HB THR 130 HB THR 130 -13.964 -5.816 -5.364 953 HG1 THR 130 HG1 THR 130 -14.538 -8.555 -5.491 954 1HG2 THR 130 HG21 THR 130 -13.964 -7.893 -7.557 955 2HG2 THR 130 HG22 THR 130 -13.689 -6.167 -7.791 956 3HG2 THR 130 HG23 THR 130 -15.252 -6.742 -7.209 957 HA PRO 131 HA PRO 131 -9.416 -4.286 -7.544 958 1HB PRO 131 HB2 PRO 131 -9.741 -5.581 -10.178 959 2HB PRO 131 HB1 PRO 131 -8.263 -5.154 -9.310 960 1HG PRO 131 HG2 PRO 131 -9.038 -7.700 -9.553 961 2HG PRO 131 HG1 PRO 131 -8.269 -7.107 -8.070 962 1HD PRO 131 HD2 PRO 131 -11.168 -7.624 -8.626 963 2HD PRO 131 HD1 PRO 131 -10.218 -7.994 -7.170 964 H SER 132 HN SER 132 -10.284 -2.374 -7.936 965 HA SER 132 HA SER 132 -12.055 -1.944 -10.160 966 1HB SER 132 HB2 SER 132 -13.598 -0.637 -8.355 967 2HB SER 132 HB1 SER 132 -13.928 -2.281 -8.903 968 HG SER 132 HG SER 132 -12.769 -3.038 -7.081 969 H GLY 133 HN GLY 133 -10.576 -0.543 -10.968 970 1HA GLY 133 HA2 GLY 133 -10.473 2.062 -10.693 971 2HA GLY 133 HA1 GLY 133 -9.548 1.605 -9.266 972 H THR 134 HN THR 134 -7.596 2.471 -9.971 973 HA THR 134 HA THR 134 -6.483 1.231 -12.395 974 HB THR 134 HB THR 134 -4.812 3.099 -12.334 975 HG1 THR 134 HG1 THR 134 -4.798 4.249 -10.562 976 1HG2 THR 134 HG21 THR 134 -6.729 3.185 -13.833 977 2HG2 THR 134 HG22 THR 134 -6.372 4.795 -13.207 978 3HG2 THR 134 HG23 THR 134 -7.723 3.873 -12.549 979 H THR 135 HN THR 135 -4.252 0.609 -12.371 980 HA THR 135 HA THR 135 -3.364 -0.325 -9.746 981 HB THR 135 HB THR 135 -2.202 -1.067 -12.439 982 HG1 THR 135 HG1 THR 135 -3.589 -2.957 -12.206 983 1HG2 THR 135 HG21 THR 135 -1.421 -3.051 -11.248 984 2HG2 THR 135 HG22 THR 135 -2.189 -2.482 -9.766 985 3HG2 THR 135 HG23 THR 135 -0.835 -1.588 -10.457 986 H GLY 136 HN GLY 136 -2.255 1.309 -8.792 987 1HA GLY 136 HA2 GLY 136 -0.437 2.945 -10.403 988 2HA GLY 136 HA1 GLY 136 -0.954 3.281 -8.755 989 H THR 137 HN THR 137 1.722 3.434 -9.526 990 HA THR 137 HA THR 137 2.842 1.106 -8.124 991 HB THR 137 HB THR 137 4.187 2.538 -10.423 992 HG1 THR 137 HG1 THR 137 2.177 0.956 -10.630 993 1HG2 THR 137 HG21 THR 137 5.734 1.492 -8.840 994 2HG2 THR 137 HG22 THR 137 5.717 0.616 -10.371 995 3HG2 THR 137 HG23 THR 137 4.854 -0.031 -8.975 996 H THR 138 HN THR 138 3.440 1.867 -6.193 997 HA THR 138 HA THR 138 4.628 4.486 -5.892 998 HB THR 138 HB THR 138 4.629 2.322 -3.785 999 HG1 THR 138 HG1 THR 138 2.481 3.963 -4.671 1000 1HG2 THR 138 HG21 THR 138 5.872 4.385 -3.322 1001 2HG2 THR 138 HG22 THR 138 4.467 4.230 -2.265 1002 3HG2 THR 138 HG23 THR 138 4.418 5.331 -3.642 1003 H LYS 139 HN LYS 139 6.710 4.825 -6.382 1004 HA LYS 139 HA LYS 139 8.516 2.499 -6.282 1005 1HB LYS 139 HB2 LYS 139 8.080 3.502 -8.541 1006 2HB LYS 139 HB1 LYS 139 8.817 4.988 -7.965 1007 1HG LYS 139 HG2 LYS 139 10.928 3.831 -7.614 1008 2HG LYS 139 HG1 LYS 139 10.195 2.314 -8.140 1009 1HD LYS 139 HD2 LYS 139 10.464 4.803 -9.827 1010 2HD LYS 139 HD1 LYS 139 11.516 3.389 -9.918 1011 1HE LYS 139 HE2 LYS 139 9.668 2.003 -10.611 1012 2HE LYS 139 HE1 LYS 139 8.538 3.336 -10.389 1013 1HZ LYS 139 HZ1 LYS 139 9.132 3.014 -12.719 1014 2HZ LYS 139 HZ2 LYS 139 10.765 3.290 -12.355 1015 3HZ LYS 139 HZ3 LYS 139 9.630 4.536 -12.159 1016 H LEU 140 HN LEU 140 9.597 2.540 -4.504 1017 HA LEU 140 HA LEU 140 10.634 5.068 -3.481 1018 1HB LEU 140 HB2 LEU 140 9.651 3.859 -1.744 1019 2HB LEU 140 HB1 LEU 140 10.266 2.323 -2.321 1020 HG LEU 140 HG LEU 140 12.541 3.030 -1.652 1021 1HD1 LEU 140 HD11 LEU 140 12.243 5.445 -1.780 1022 2HD1 LEU 140 HD12 LEU 140 12.816 4.967 -0.183 1023 3HD1 LEU 140 HD13 LEU 140 11.120 5.391 -0.421 1024 1HD2 LEU 140 HD21 LEU 140 10.477 3.100 0.545 1025 2HD2 LEU 140 HD22 LEU 140 12.195 2.767 0.756 1026 3HD2 LEU 140 HD23 LEU 140 11.190 1.654 -0.170 1027 H THR 141 HN THR 141 12.499 5.669 -4.282 1028 HA THR 141 HA THR 141 14.430 3.592 -5.099 1029 HB THR 141 HB THR 141 14.098 6.279 -6.431 1030 HG1 THR 141 HG1 THR 141 12.339 4.378 -6.484 1031 1HG2 THR 141 HG21 THR 141 15.288 5.186 -8.282 1032 2HG2 THR 141 HG22 THR 141 15.400 3.702 -7.336 1033 3HG2 THR 141 HG23 THR 141 16.243 5.156 -6.800 1034 H VAL 142 HN VAL 142 16.574 3.950 -4.606 1035 HA VAL 142 HA VAL 142 17.179 6.114 -2.782 1036 HB VAL 142 HB VAL 142 18.162 3.853 -2.454 1037 1HG1 VAL 142 HG11 VAL 142 20.007 3.108 -3.858 1038 2HG1 VAL 142 HG12 VAL 142 19.784 4.505 -4.911 1039 3HG1 VAL 142 HG13 VAL 142 18.526 3.274 -4.803 1040 1HG2 VAL 142 HG21 VAL 142 20.186 6.039 -2.924 1041 2HG2 VAL 142 HG22 VAL 142 20.416 4.610 -1.914 1042 3HG2 VAL 142 HG23 VAL 142 19.215 5.824 -1.469 1043 H THR 143 HN THR 143 18.451 7.877 -3.229 1044 HA THR 143 HA THR 143 19.614 8.154 -5.882 1045 HB THR 143 HB THR 143 17.678 10.193 -4.750 1046 HG1 THR 143 HG1 THR 143 17.291 7.996 -6.251 1047 1HG2 THR 143 HG21 THR 143 19.225 10.145 -7.346 1048 2HG2 THR 143 HG22 THR 143 19.472 11.262 -6.003 1049 3HG2 THR 143 HG23 THR 143 17.975 11.315 -6.934 Start of MODEL 15 1 H GLU 1 H GLU 1 -18.472 6.680 -9.958 2 HA GLU 1 HA GLU 1 -20.610 4.714 -10.506 3 1HB GLU 1 HB2 GLU 1 -17.967 5.278 -11.866 4 2HB GLU 1 HB1 GLU 1 -18.917 3.829 -12.152 5 1HG GLU 1 HG2 GLU 1 -19.273 5.428 -13.920 6 2HG GLU 1 HG1 GLU 1 -20.756 5.213 -12.994 7 H GLU 2 HN GLU 2 -20.562 3.098 -9.145 8 HA GLU 2 HA GLU 2 -19.891 1.598 -7.584 9 1HB GLU 2 HB2 GLU 2 -18.270 0.039 -8.369 10 2HB GLU 2 HB1 GLU 2 -19.203 0.618 -9.740 11 1HG GLU 2 HG2 GLU 2 -17.349 2.193 -10.244 12 2HG GLU 2 HG1 GLU 2 -16.432 1.413 -8.958 13 H CYS 3 HN CYS 3 -17.153 0.743 -7.010 14 HA CYS 3 HA CYS 3 -16.236 3.089 -5.488 15 1HB CYS 3 HB2 CYS 3 -16.914 1.155 -4.101 16 2HB CYS 3 HB1 CYS 3 -15.735 0.151 -4.938 17 H GLN 4 HN GLN 4 -14.994 3.955 -7.167 18 HA GLN 4 HA GLN 4 -12.851 2.248 -8.217 19 1HB GLN 4 HB2 GLN 4 -14.265 3.269 -9.917 20 2HB GLN 4 HB1 GLN 4 -13.954 4.867 -9.249 21 1HG GLN 4 HG2 GLN 4 -11.620 4.686 -9.832 22 2HG GLN 4 HG1 GLN 4 -11.876 3.049 -10.427 23 1HE2 GLN 4 HE21 GLN 4 -14.178 5.614 -10.951 24 2HE2 GLN 4 HE22 GLN 4 -13.916 5.759 -12.654 25 H VAL 5 HN VAL 5 -10.984 2.422 -7.193 26 HA VAL 5 HA VAL 5 -10.333 4.967 -5.862 27 HB VAL 5 HB VAL 5 -9.182 2.229 -5.289 28 1HG1 VAL 5 HG11 VAL 5 -9.002 4.823 -3.755 29 2HG1 VAL 5 HG12 VAL 5 -7.699 4.069 -4.672 30 3HG1 VAL 5 HG13 VAL 5 -8.344 3.271 -3.237 31 1HG2 VAL 5 HG21 VAL 5 -11.552 2.265 -4.753 32 2HG2 VAL 5 HG22 VAL 5 -11.338 3.753 -3.832 33 3HG2 VAL 5 HG23 VAL 5 -10.589 2.256 -3.274 34 H ARG 6 HN ARG 6 -8.705 6.138 -6.660 35 HA ARG 6 HA ARG 6 -7.005 4.930 -8.701 36 1HB ARG 6 HB2 ARG 6 -6.330 7.141 -9.305 37 2HB ARG 6 HB1 ARG 6 -8.074 7.159 -9.099 38 1HG ARG 6 HG2 ARG 6 -7.901 8.289 -7.022 39 2HG ARG 6 HG1 ARG 6 -6.154 8.049 -6.966 40 1HD ARG 6 HD2 ARG 6 -6.633 10.323 -7.613 41 2HD ARG 6 HD1 ARG 6 -5.926 9.458 -8.978 42 HE ARG 6 HE ARG 6 -8.844 9.726 -8.794 43 1HH1 ARG 6 HH11 ARG 6 -5.841 10.500 -10.412 44 2HH1 ARG 6 HH12 ARG 6 -6.624 11.174 -11.814 45 1HH2 ARG 6 HH21 ARG 6 -9.873 10.611 -10.623 46 2HH2 ARG 6 HH22 ARG 6 -8.915 11.219 -11.942 47 H VAL 7 HN VAL 7 -4.842 4.682 -8.538 48 HA VAL 7 HA VAL 7 -3.543 5.519 -6.034 49 HB VAL 7 HB VAL 7 -2.798 3.127 -7.740 50 1HG1 VAL 7 HG11 VAL 7 -1.744 4.029 -5.060 51 2HG1 VAL 7 HG12 VAL 7 -0.897 4.167 -6.602 52 3HG1 VAL 7 HG13 VAL 7 -1.258 2.575 -5.934 53 1HG2 VAL 7 HG21 VAL 7 -3.592 1.759 -5.860 54 2HG2 VAL 7 HG22 VAL 7 -4.892 2.710 -6.578 55 3HG2 VAL 7 HG23 VAL 7 -4.168 3.216 -5.051 56 H GLY 8 HN GLY 8 -2.192 7.152 -6.431 57 1HA GLY 8 HA2 GLY 8 -1.436 7.862 -9.087 58 2HA GLY 8 HA1 GLY 8 -0.902 8.649 -7.610 59 H ASP 9 HN ASP 9 0.227 7.180 -10.236 60 HA ASP 9 HA ASP 9 2.245 5.474 -9.203 61 1HB ASP 9 HB2 ASP 9 2.142 7.037 -11.787 62 2HB ASP 9 HB1 ASP 9 3.362 5.832 -11.407 63 H LEU 10 HN LEU 10 3.586 6.220 -7.718 64 HA LEU 10 HA LEU 10 4.646 8.946 -7.984 65 1HB LEU 10 HB2 LEU 10 4.607 7.136 -5.568 66 2HB LEU 10 HB1 LEU 10 5.209 8.781 -5.599 67 HG LEU 10 HG LEU 10 2.345 7.896 -5.937 68 1HD1 LEU 10 HD11 LEU 10 2.019 9.170 -3.862 69 2HD1 LEU 10 HD12 LEU 10 3.758 9.450 -3.776 70 3HD1 LEU 10 HD13 LEU 10 3.120 7.811 -3.650 71 1HD2 LEU 10 HD21 LEU 10 1.812 10.295 -6.008 72 2HD2 LEU 10 HD22 LEU 10 2.788 9.796 -7.389 73 3HD2 LEU 10 HD23 LEU 10 3.536 10.668 -6.051 74 H THR 11 HN THR 11 6.862 9.335 -7.743 75 HA THR 11 HA THR 11 8.591 6.968 -7.488 76 HB THR 11 HB THR 11 9.219 9.291 -9.326 77 HG1 THR 11 HG1 THR 11 7.476 7.357 -9.731 78 1HG2 THR 11 HG21 THR 11 11.168 8.086 -8.464 79 2HG2 THR 11 HG22 THR 11 10.949 7.766 -10.185 80 3HG2 THR 11 HG23 THR 11 10.468 6.557 -8.994 81 H VAL 12 HN VAL 12 9.718 7.204 -5.670 82 HA VAL 12 HA VAL 12 10.332 9.944 -4.756 83 HB VAL 12 HB VAL 12 9.820 7.525 -3.007 84 1HG1 VAL 12 HG11 VAL 12 9.773 9.128 -1.170 85 2HG1 VAL 12 HG12 VAL 12 10.141 10.437 -2.291 86 3HG1 VAL 12 HG13 VAL 12 11.327 9.163 -2.005 87 1HG2 VAL 12 HG21 VAL 12 7.704 8.598 -2.407 88 2HG2 VAL 12 HG22 VAL 12 7.767 8.212 -4.127 89 3HG2 VAL 12 HG23 VAL 12 8.014 9.872 -3.587 90 H ALA 13 HN ALA 13 12.381 10.362 -4.071 91 HA ALA 13 HA ALA 13 14.304 8.135 -4.207 92 1HB ALA 13 HB1 ALA 13 14.684 9.846 -5.912 93 2HB ALA 13 HB2 ALA 13 16.008 9.797 -4.748 94 3HB ALA 13 HB3 ALA 13 14.801 11.079 -4.655 95 H LYS 14 HN LYS 14 14.533 7.449 -2.158 96 HA LYS 14 HA LYS 14 15.831 9.126 -0.251 97 1HB LYS 14 HB2 LYS 14 13.116 9.417 -0.156 98 2HB LYS 14 HB1 LYS 14 13.346 8.065 0.953 99 1HG LYS 14 HG2 LYS 14 14.328 9.325 2.517 100 2HG LYS 14 HG1 LYS 14 15.165 10.336 1.337 101 1HD LYS 14 HD2 LYS 14 12.211 10.515 1.921 102 2HD LYS 14 HD1 LYS 14 13.433 11.534 2.683 103 1HE LYS 14 HE2 LYS 14 14.140 12.211 0.348 104 2HE LYS 14 HE1 LYS 14 12.683 11.404 -0.232 105 1HZ LYS 14 HZ1 LYS 14 11.335 12.892 1.056 106 2HZ LYS 14 HZ2 LYS 14 12.399 13.818 0.110 107 3HZ LYS 14 HZ3 LYS 14 12.706 13.603 1.763 108 H THR 15 HN THR 15 15.929 7.813 1.936 109 HA THR 15 HA THR 15 16.704 5.097 1.181 110 HB THR 15 HB THR 15 17.829 5.126 3.441 111 HG1 THR 15 HG1 THR 15 17.941 7.089 4.533 112 1HG2 THR 15 HG21 THR 15 19.644 6.640 2.747 113 2HG2 THR 15 HG22 THR 15 18.595 7.310 1.499 114 3HG2 THR 15 HG23 THR 15 19.093 5.621 1.417 115 H ARG 16 HN ARG 16 16.265 3.325 2.794 116 HA ARG 16 HA ARG 16 13.509 3.542 3.743 117 1HB ARG 16 HB2 ARG 16 15.309 1.109 3.927 118 2HB ARG 16 HB1 ARG 16 13.565 1.160 4.197 119 1HG ARG 16 HG2 ARG 16 13.679 0.271 2.084 120 2HG ARG 16 HG1 ARG 16 13.493 1.992 1.727 121 1HD ARG 16 HD2 ARG 16 16.016 2.106 1.590 122 2HD ARG 16 HD1 ARG 16 16.016 0.349 1.640 123 HE ARG 16 HE ARG 16 15.195 0.306 -0.514 124 1HH1 ARG 16 HH11 ARG 16 15.243 3.558 0.724 125 2HH1 ARG 16 HH12 ARG 16 15.012 4.318 -0.815 126 1HH2 ARG 16 HH21 ARG 16 14.869 1.291 -2.586 127 2HH2 ARG 16 HH22 ARG 16 14.776 3.013 -2.701 128 H GLY 17 HN GLY 17 16.527 4.207 4.854 129 1HA GLY 17 HA2 GLY 17 16.119 3.559 7.631 130 2HA GLY 17 HA1 GLY 17 17.387 4.584 6.968 131 H GLN 18 HN GLN 18 15.493 6.248 5.490 132 HA GLN 18 HA GLN 18 14.794 8.197 7.380 133 1HB GLN 18 HB2 GLN 18 15.053 8.610 4.933 134 2HB GLN 18 HB1 GLN 18 13.548 7.743 4.663 135 1HG GLN 18 HG2 GLN 18 13.148 10.112 4.601 136 2HG GLN 18 HG1 GLN 18 12.363 9.414 6.014 137 1HE2 GLN 18 HE21 GLN 18 14.917 11.462 4.869 138 2HE2 GLN 18 HE22 GLN 18 15.315 12.170 6.396 139 H LEU 19 HN LEU 19 13.000 5.590 5.865 140 HA LEU 19 HA LEU 19 10.563 5.893 7.241 141 1HB LEU 19 HB2 LEU 19 11.930 3.410 6.191 142 2HB LEU 19 HB1 LEU 19 10.269 3.470 6.746 143 HG LEU 19 HG LEU 19 11.261 5.137 4.439 144 1HD1 LEU 19 HD11 LEU 19 9.975 2.408 4.383 145 2HD1 LEU 19 HD12 LEU 19 11.632 2.787 3.909 146 3HD1 LEU 19 HD13 LEU 19 10.280 3.431 2.978 147 1HD2 LEU 19 HD21 LEU 19 8.879 5.224 3.892 148 2HD2 LEU 19 HD22 LEU 19 9.183 5.866 5.507 149 3HD2 LEU 19 HD23 LEU 19 8.512 4.246 5.314 150 H THR 20 HN THR 20 10.362 5.911 9.407 151 HA THR 20 HA THR 20 11.893 3.936 10.957 152 HB THR 20 HB THR 20 11.338 6.758 11.897 153 HG1 THR 20 HG1 THR 20 13.034 6.174 10.098 154 1HG2 THR 20 HG21 THR 20 13.085 4.565 13.026 155 2HG2 THR 20 HG22 THR 20 11.552 5.116 13.701 156 3HG2 THR 20 HG23 THR 20 12.942 6.200 13.673 157 H ASP 21 HN ASP 21 10.047 2.623 10.953 158 HA ASP 21 HA ASP 21 8.145 1.710 11.747 159 1HB ASP 21 HB2 ASP 21 8.543 3.809 13.870 160 2HB ASP 21 HB1 ASP 21 7.200 2.670 13.907 161 H ALA 22 HN ALA 22 7.452 5.102 12.553 162 HA ALA 22 HA ALA 22 5.216 4.977 10.646 163 1HB ALA 22 HB1 ALA 22 3.890 6.356 12.138 164 2HB ALA 22 HB2 ALA 22 5.211 6.395 13.305 165 3HB ALA 22 HB3 ALA 22 4.394 4.873 12.951 166 H ALA 23 HN ALA 23 6.673 5.878 9.121 167 HA ALA 23 HA ALA 23 6.632 8.787 9.218 168 1HB ALA 23 HB1 ALA 23 8.942 9.004 8.480 169 2HB ALA 23 HB2 ALA 23 9.149 7.253 8.559 170 3HB ALA 23 HB3 ALA 23 8.873 8.175 10.036 171 HA PRO 24 HA PRO 24 5.072 7.270 5.256 172 1HB PRO 24 HB2 PRO 24 3.607 9.468 4.665 173 2HB PRO 24 HB1 PRO 24 3.057 8.235 5.807 174 1HG PRO 24 HG2 PRO 24 4.340 10.883 6.354 175 2HG PRO 24 HG1 PRO 24 2.958 10.121 7.165 176 1HD PRO 24 HD2 PRO 24 5.472 10.085 8.197 177 2HD PRO 24 HD1 PRO 24 4.304 8.778 8.462 178 H ILE 25 HN ILE 25 6.817 7.255 3.919 179 HA ILE 25 HA ILE 25 7.890 9.804 2.962 180 HB ILE 25 HB ILE 25 8.821 6.979 2.448 181 1HG1 ILE 25 HG12 ILE 25 9.129 7.663 4.757 182 2HG1 ILE 25 HG11 ILE 25 10.678 7.615 3.928 183 1HG2 ILE 25 HG21 ILE 25 10.128 9.595 1.702 184 2HG2 ILE 25 HG22 ILE 25 9.408 8.437 0.583 185 3HG2 ILE 25 HG23 ILE 25 10.840 7.993 1.510 186 1HD1 ILE 25 HD11 ILE 25 10.532 9.553 5.372 187 2HD1 ILE 25 HD12 ILE 25 9.082 10.090 4.522 188 3HD1 ILE 25 HD13 ILE 25 10.631 10.042 3.680 189 H GLY 26 HN GLY 26 5.929 7.118 1.925 190 1HA GLY 26 HA2 GLY 26 5.646 8.483 -0.673 191 2HA GLY 26 HA1 GLY 26 5.481 6.747 -0.482 192 HA PRO 27 HA PRO 27 1.365 8.566 1.468 193 1HB PRO 27 HB2 PRO 27 1.216 11.323 1.137 194 2HB PRO 27 HB1 PRO 27 1.537 10.492 2.665 195 1HG PRO 27 HG2 PRO 27 3.457 11.731 0.731 196 2HG PRO 27 HG1 PRO 27 3.486 11.742 2.506 197 1HD PRO 27 HD2 PRO 27 5.102 10.109 1.138 198 2HD PRO 27 HD1 PRO 27 4.308 9.564 2.629 199 H VAL 28 HN VAL 28 0.145 7.866 -0.149 200 HA VAL 28 HA VAL 28 0.447 8.922 -2.840 201 HB VAL 28 HB VAL 28 -1.421 6.765 -1.829 202 1HG1 VAL 28 HG11 VAL 28 -2.143 7.723 -3.945 203 2HG1 VAL 28 HG12 VAL 28 -1.540 6.084 -4.183 204 3HG1 VAL 28 HG13 VAL 28 -0.536 7.464 -4.627 205 1HG2 VAL 28 HG21 VAL 28 1.315 6.522 -3.079 206 2HG2 VAL 28 HG22 VAL 28 0.221 5.177 -2.761 207 3HG2 VAL 28 HG23 VAL 28 0.877 6.114 -1.420 208 H THR 29 HN THR 29 -0.952 10.276 -3.838 209 HA THR 29 HA THR 29 -3.046 11.516 -2.342 210 HB THR 29 HB THR 29 -3.528 12.377 -4.843 211 HG1 THR 29 HG1 THR 29 -1.685 12.330 -6.069 212 1HG2 THR 29 HG21 THR 29 -1.214 13.295 -3.133 213 2HG2 THR 29 HG22 THR 29 -2.898 13.770 -2.918 214 3HG2 THR 29 HG23 THR 29 -2.025 14.247 -4.374 215 H VAL 30 HN VAL 30 -4.740 10.367 -1.858 216 HA VAL 30 HA VAL 30 -5.675 8.281 -3.663 217 HB VAL 30 HB VAL 30 -6.705 8.857 -0.889 218 1HG1 VAL 30 HG11 VAL 30 -8.061 7.337 -2.208 219 2HG1 VAL 30 HG12 VAL 30 -7.234 6.439 -0.936 220 3HG1 VAL 30 HG13 VAL 30 -6.648 6.357 -2.597 221 1HG2 VAL 30 HG21 VAL 30 -5.090 7.186 -0.073 222 2HG2 VAL 30 HG22 VAL 30 -4.295 8.619 -0.725 223 3HG2 VAL 30 HG23 VAL 30 -4.349 7.132 -1.673 224 H GLN 31 HN GLN 31 -7.622 8.174 -4.494 225 HA GLN 31 HA GLN 31 -9.721 10.036 -3.755 226 1HB GLN 31 HB2 GLN 31 -8.582 11.192 -5.609 227 2HB GLN 31 HB1 GLN 31 -8.752 9.758 -6.614 228 1HG GLN 31 HG2 GLN 31 -11.257 10.009 -6.286 229 2HG GLN 31 HG1 GLN 31 -10.902 11.605 -5.628 230 1HE2 GLN 31 HE21 GLN 31 -10.111 13.213 -6.991 231 2HE2 GLN 31 HE22 GLN 31 -10.215 13.081 -8.715 232 H ALA 32 HN ALA 32 -11.412 8.781 -3.385 233 HA ALA 32 HA ALA 32 -11.707 6.312 -4.957 234 1HB ALA 32 HB1 ALA 32 -11.405 5.924 -2.556 235 2HB ALA 32 HB2 ALA 32 -13.009 5.424 -3.091 236 3HB ALA 32 HB3 ALA 32 -12.804 6.942 -2.215 237 H LEU 33 HN LEU 33 -13.039 6.724 -6.591 238 HA LEU 33 HA LEU 33 -15.171 8.649 -6.382 239 1HB LEU 33 HB2 LEU 33 -13.930 8.298 -8.484 240 2HB LEU 33 HB1 LEU 33 -14.540 6.655 -8.561 241 HG LEU 33 HG LEU 33 -16.850 7.568 -8.729 242 1HD1 LEU 33 HD11 LEU 33 -15.417 10.211 -8.966 243 2HD1 LEU 33 HD12 LEU 33 -16.496 9.718 -7.661 244 3HD1 LEU 33 HD13 LEU 33 -17.130 9.940 -9.292 245 1HD2 LEU 33 HD21 LEU 33 -15.645 6.893 -10.719 246 2HD2 LEU 33 HD22 LEU 33 -14.887 8.481 -10.827 247 3HD2 LEU 33 HD23 LEU 33 -16.629 8.317 -11.057 248 H GLY 34 HN GLY 34 -16.970 8.181 -5.324 249 1HA GLY 34 HA2 GLY 34 -18.985 7.039 -4.975 250 2HA GLY 34 HA1 GLY 34 -18.318 5.652 -5.823 251 H CYS 35 HN CYS 35 -18.109 3.963 -4.572 252 HA CYS 35 HA CYS 35 -17.587 2.603 -2.827 253 1HB CYS 35 HB2 CYS 35 -16.055 4.996 -1.789 254 2HB CYS 35 HB1 CYS 35 -15.893 3.343 -1.211 255 H ASN 36 HN ASN 36 -19.788 4.794 -2.697 256 HA ASN 36 HA ASN 36 -20.037 5.643 -0.031 257 1HB ASN 36 HB2 ASN 36 -22.063 5.438 -2.251 258 2HB ASN 36 HB1 ASN 36 -22.431 6.133 -0.673 259 1HD2 ASN 36 HD21 ASN 36 -21.435 8.059 -0.053 260 2HD2 ASN 36 HD22 ASN 36 -20.681 9.108 -1.210 261 H ALA 37 HN ALA 37 -20.607 2.599 -1.365 262 HA ALA 37 HA ALA 37 -21.571 1.712 1.260 263 1HB ALA 37 HB1 ALA 37 -23.241 0.220 0.243 264 2HB ALA 37 HB2 ALA 37 -22.893 0.902 -1.347 265 3HB ALA 37 HB3 ALA 37 -23.609 1.912 -0.089 266 H ARG 38 HN ARG 38 -19.110 1.446 0.853 267 HA ARG 38 HA ARG 38 -18.602 -1.335 0.623 268 1HB ARG 38 HB2 ARG 38 -18.692 -0.303 -1.824 269 2HB ARG 38 HB1 ARG 38 -17.074 0.242 -1.406 270 1HG ARG 38 HG2 ARG 38 -16.861 -1.807 -2.573 271 2HG ARG 38 HG1 ARG 38 -16.498 -2.130 -0.876 272 1HD ARG 38 HD2 ARG 38 -17.920 -3.871 -1.878 273 2HD ARG 38 HD1 ARG 38 -18.723 -3.036 -0.547 274 HE ARG 38 HE ARG 38 -19.897 -1.721 -2.303 275 1HH1 ARG 38 HH11 ARG 38 -18.650 -4.910 -3.026 276 2HH1 ARG 38 HH12 ARG 38 -19.740 -5.176 -4.346 277 1HH2 ARG 38 HH21 ARG 38 -21.331 -2.065 -4.034 278 2HH2 ARG 38 HH22 ARG 38 -21.280 -3.571 -4.906 279 H GLN 39 HN GLN 39 -16.364 -1.822 1.176 280 HA GLN 39 HA GLN 39 -15.036 0.367 2.578 281 1HB GLN 39 HB2 GLN 39 -14.394 -2.594 2.499 282 2HB GLN 39 HB1 GLN 39 -13.528 -1.400 3.448 283 1HG GLN 39 HG2 GLN 39 -14.954 -2.497 4.942 284 2HG GLN 39 HG1 GLN 39 -15.699 -0.933 4.630 285 1HE2 GLN 39 HE21 GLN 39 -15.810 -3.587 2.351 286 2HE2 GLN 39 HE22 GLN 39 -17.511 -3.887 2.501 287 H VAL 40 HN VAL 40 -12.970 1.073 2.028 288 HA VAL 40 HA VAL 40 -12.081 0.379 -0.677 289 HB VAL 40 HB VAL 40 -11.350 2.703 1.122 290 1HG1 VAL 40 HG11 VAL 40 -9.415 2.064 -0.196 291 2HG1 VAL 40 HG12 VAL 40 -10.091 3.575 -0.806 292 3HG1 VAL 40 HG13 VAL 40 -10.388 2.065 -1.666 293 1HG2 VAL 40 HG21 VAL 40 -12.886 2.604 -1.473 294 2HG2 VAL 40 HG22 VAL 40 -12.483 4.062 -0.565 295 3HG2 VAL 40 HG23 VAL 40 -13.575 2.864 0.130 296 H ALA 41 HN ALA 41 -10.355 -0.909 -0.921 297 HA ALA 41 HA ALA 41 -8.603 -1.321 1.396 298 1HB ALA 41 HB1 ALA 41 -10.161 -3.214 1.018 299 2HB ALA 41 HB2 ALA 41 -8.463 -3.660 0.864 300 3HB ALA 41 HB3 ALA 41 -9.450 -3.431 -0.581 301 H LEU 42 HN LEU 42 -6.461 -1.414 1.025 302 HA LEU 42 HA LEU 42 -5.550 -0.941 -1.724 303 1HB LEU 42 HB2 LEU 42 -3.946 -0.739 0.821 304 2HB LEU 42 HB1 LEU 42 -3.533 -0.085 -0.753 305 HG LEU 42 HG LEU 42 -5.811 0.866 0.979 306 1HD1 LEU 42 HD11 LEU 42 -4.437 2.837 1.354 307 2HD1 LEU 42 HD12 LEU 42 -3.130 2.115 0.412 308 3HD1 LEU 42 HD13 LEU 42 -3.630 1.382 1.936 309 1HD2 LEU 42 HD21 LEU 42 -4.683 1.967 -1.597 310 2HD2 LEU 42 HD22 LEU 42 -5.932 2.728 -0.611 311 3HD2 LEU 42 HD23 LEU 42 -6.252 1.184 -1.399 312 H LYS 43 HN LYS 43 -4.563 -2.533 -2.802 313 HA LYS 43 HA LYS 43 -3.540 -4.815 -1.244 314 1HB LYS 43 HB2 LYS 43 -4.576 -4.957 -4.079 315 2HB LYS 43 HB1 LYS 43 -4.117 -6.301 -3.045 316 1HG LYS 43 HG2 LYS 43 -6.394 -6.402 -2.924 317 2HG LYS 43 HG1 LYS 43 -6.030 -5.395 -1.520 318 1HD LYS 43 HD2 LYS 43 -6.441 -3.387 -2.909 319 2HD LYS 43 HD1 LYS 43 -6.899 -4.443 -4.247 320 1HE LYS 43 HE2 LYS 43 -8.703 -5.372 -2.869 321 2HE LYS 43 HE1 LYS 43 -8.257 -4.266 -1.566 322 1HZ LYS 43 HZ1 LYS 43 -10.131 -3.473 -2.934 323 2HZ LYS 43 HZ2 LYS 43 -9.099 -3.401 -4.275 324 3HZ LYS 43 HZ3 LYS 43 -8.811 -2.408 -2.932 325 H ALA 44 HN ALA 44 -1.633 -5.772 -1.989 326 HA ALA 44 HA ALA 44 -0.045 -4.076 -3.752 327 1HB ALA 44 HB1 ALA 44 1.029 -4.660 -1.698 328 2HB ALA 44 HB2 ALA 44 1.843 -5.514 -3.010 329 3HB ALA 44 HB3 ALA 44 0.713 -6.374 -1.963 330 H ASP 45 HN ASP 45 1.083 -4.980 -5.524 331 HA ASP 45 HA ASP 45 -0.424 -7.026 -6.924 332 1HB ASP 45 HB2 ASP 45 0.380 -5.016 -8.113 333 2HB ASP 45 HB1 ASP 45 2.041 -5.446 -7.723 334 H THR 46 HN THR 46 0.856 -8.875 -7.985 335 HA THR 46 HA THR 46 2.104 -10.436 -6.034 336 HB THR 46 HB THR 46 1.102 -11.390 -8.077 337 HG1 THR 46 HG1 THR 46 2.800 -12.510 -6.836 338 1HG2 THR 46 HG21 THR 46 3.562 -10.333 -9.473 339 2HG2 THR 46 HG22 THR 46 1.913 -9.750 -9.704 340 3HG2 THR 46 HG23 THR 46 2.344 -11.392 -10.182 341 H ASP 47 HN ASP 47 3.338 -7.930 -7.984 342 HA ASP 47 HA ASP 47 6.077 -8.365 -8.016 343 1HB ASP 47 HB2 ASP 47 5.214 -6.554 -9.243 344 2HB ASP 47 HB1 ASP 47 4.340 -5.922 -7.859 345 H ASN 48 HN ASN 48 4.009 -7.161 -5.398 346 HA ASN 48 HA ASN 48 6.280 -7.428 -3.564 347 1HB ASN 48 HB2 ASN 48 5.787 -5.278 -2.499 348 2HB ASN 48 HB1 ASN 48 6.210 -5.054 -4.193 349 1HD2 ASN 48 HD21 ASN 48 4.680 -3.390 -2.314 350 2HD2 ASN 48 HD22 ASN 48 3.161 -3.102 -3.089 351 H PHE 49 HN PHE 49 3.678 -8.856 -4.131 352 HA PHE 49 HA PHE 49 2.590 -8.787 -1.384 353 1HB PHE 49 HB2 PHE 49 1.027 -7.900 -3.131 354 2HB PHE 49 HB1 PHE 49 1.103 -9.453 -3.936 355 HD1 PHE 49 HD1 PHE 49 -0.214 -7.607 -1.068 356 HD2 PHE 49 HD2 PHE 49 -0.122 -11.369 -3.071 357 HE1 PHE 49 HE1 PHE 49 -2.080 -8.402 0.327 358 HE2 PHE 49 HE2 PHE 49 -1.979 -12.151 -1.688 359 HZ PHE 49 HZ PHE 49 -3.162 -10.586 -0.212 360 H GLU 50 HN GLU 50 3.581 -10.501 -0.475 361 HA GLU 50 HA GLU 50 3.725 -13.013 -1.993 362 1HB GLU 50 HB2 GLU 50 5.244 -12.011 0.412 363 2HB GLU 50 HB1 GLU 50 5.307 -13.688 -0.113 364 1HG GLU 50 HG2 GLU 50 5.987 -11.406 -1.936 365 2HG GLU 50 HG1 GLU 50 7.177 -12.169 -0.884 366 H GLN 51 HN GLN 51 1.976 -14.185 -1.702 367 HA GLN 51 HA GLN 51 0.338 -15.426 -0.758 368 1HB GLN 51 HB2 GLN 51 1.987 -15.029 1.735 369 2HB GLN 51 HB1 GLN 51 0.539 -16.028 1.685 370 1HG GLN 51 HG2 GLN 51 3.058 -16.442 0.093 371 2HG GLN 51 HG1 GLN 51 2.511 -17.398 1.470 372 1HE2 GLN 51 HE21 GLN 51 0.732 -18.776 1.219 373 2HE2 GLN 51 HE22 GLN 51 0.186 -19.282 -0.345 374 H GLY 52 HN GLY 52 1.118 -12.815 1.515 375 1HA GLY 52 HA2 GLY 52 -1.326 -11.450 1.147 376 2HA GLY 52 HA1 GLY 52 -1.431 -12.468 2.583 377 H LYS 53 HN LYS 53 1.474 -10.944 1.388 378 HA LYS 53 HA LYS 53 1.394 -8.974 3.567 379 1HB LYS 53 HB2 LYS 53 3.857 -10.549 2.804 380 2HB LYS 53 HB1 LYS 53 3.721 -9.371 4.096 381 1HG LYS 53 HG2 LYS 53 2.299 -12.025 4.031 382 2HG LYS 53 HG1 LYS 53 3.788 -11.686 4.915 383 1HD LYS 53 HD2 LYS 53 2.563 -9.908 6.159 384 2HD LYS 53 HD1 LYS 53 1.080 -10.436 5.362 385 1HE LYS 53 HE2 LYS 53 1.167 -11.457 7.524 386 2HE LYS 53 HE1 LYS 53 1.457 -12.708 6.314 387 1HZ LYS 53 HZ1 LYS 53 3.534 -11.332 7.937 388 2HZ LYS 53 HZ2 LYS 53 3.843 -12.500 6.748 389 3HZ LYS 53 HZ3 LYS 53 2.995 -12.928 8.149 390 H PHE 54 HN PHE 54 2.038 -6.966 2.880 391 HA PHE 54 HA PHE 54 3.321 -6.879 0.256 392 1HB PHE 54 HB2 PHE 54 2.491 -4.450 0.223 393 2HB PHE 54 HB1 PHE 54 1.356 -5.754 -0.062 394 HD1 PHE 54 HD1 PHE 54 -0.670 -4.870 0.515 395 HD2 PHE 54 HD2 PHE 54 2.597 -4.449 3.208 396 HE1 PHE 54 HE1 PHE 54 -2.196 -3.946 2.207 397 HE2 PHE 54 HE2 PHE 54 1.075 -3.528 4.910 398 HZ PHE 54 HZ PHE 54 -1.325 -3.274 4.409 399 H PHE 55 HN PHE 55 5.045 -5.631 -0.157 400 HA PHE 55 HA PHE 55 6.382 -4.209 1.991 401 1HB PHE 55 HB2 PHE 55 8.450 -5.583 1.752 402 2HB PHE 55 HB1 PHE 55 7.112 -6.498 2.430 403 HD1 PHE 55 HD1 PHE 55 9.399 -6.127 -0.341 404 HD2 PHE 55 HD2 PHE 55 5.957 -8.193 1.066 405 HE1 PHE 55 HE1 PHE 55 9.692 -7.824 -2.105 406 HE2 PHE 55 HE2 PHE 55 6.245 -9.890 -0.689 407 HZ PHE 55 HZ PHE 55 8.118 -9.706 -2.279 408 H LEU 56 HN LEU 56 8.719 -3.615 1.041 409 HA LEU 56 HA LEU 56 8.335 -2.674 -1.716 410 1HB LEU 56 HB2 LEU 56 10.698 -2.019 0.026 411 2HB LEU 56 HB1 LEU 56 10.060 -1.119 -1.334 412 HG LEU 56 HG LEU 56 8.773 -1.346 1.384 413 1HD1 LEU 56 HD11 LEU 56 10.792 0.024 1.382 414 2HD1 LEU 56 HD12 LEU 56 9.346 1.009 1.603 415 3HD1 LEU 56 HD13 LEU 56 10.155 0.967 0.036 416 1HD2 LEU 56 HD21 LEU 56 7.225 0.359 0.548 417 2HD2 LEU 56 HD22 LEU 56 7.104 -1.145 -0.363 418 3HD2 LEU 56 HD23 LEU 56 7.962 0.233 -1.049 419 H ILE 57 HN ILE 57 9.319 -3.780 -3.360 420 HA ILE 57 HA ILE 57 11.365 -5.727 -2.540 421 HB ILE 57 HB ILE 57 9.382 -6.753 -3.575 422 1HG1 ILE 57 HG12 ILE 57 10.556 -8.084 -5.303 423 2HG1 ILE 57 HG11 ILE 57 11.865 -6.908 -5.303 424 1HG2 ILE 57 HG21 ILE 57 8.924 -6.434 -5.967 425 2HG2 ILE 57 HG22 ILE 57 10.113 -5.129 -6.001 426 3HG2 ILE 57 HG23 ILE 57 8.656 -4.973 -5.018 427 1HD1 ILE 57 HD11 ILE 57 11.043 -8.657 -2.995 428 2HD1 ILE 57 HD12 ILE 57 12.329 -7.450 -2.958 429 3HD1 ILE 57 HD13 ILE 57 12.469 -8.856 -4.013 430 H SER 58 HN SER 58 13.380 -5.335 -3.065 431 HA SER 58 HA SER 58 14.193 -3.355 -4.930 432 1HB SER 58 HB2 SER 58 15.618 -4.126 -3.035 433 2HB SER 58 HB1 SER 58 15.764 -5.702 -3.808 434 HG SER 58 HG SER 58 17.354 -3.717 -4.142 435 H ASP 59 HN ASP 59 14.341 -3.520 -7.088 436 HA ASP 59 HA ASP 59 13.095 -5.612 -8.444 437 1HB ASP 59 HB2 ASP 59 13.268 -3.345 -9.336 438 2HB ASP 59 HB1 ASP 59 15.006 -3.538 -9.525 439 H ASN 60 HN ASN 60 16.421 -5.265 -7.517 440 HA ASN 60 HA ASN 60 17.358 -7.304 -9.346 441 1HB ASN 60 HB2 ASN 60 18.752 -5.858 -7.087 442 2HB ASN 60 HB1 ASN 60 19.533 -7.023 -8.151 443 1HD2 ASN 60 HD21 ASN 60 18.027 -6.134 -10.500 444 2HD2 ASN 60 HD22 ASN 60 18.705 -4.606 -10.956 445 H ASN 61 HN ASN 61 15.604 -7.414 -6.602 446 HA ASN 61 HA ASN 61 15.096 -8.965 -5.034 447 1HB ASN 61 HB2 ASN 61 14.798 -10.391 -7.042 448 2HB ASN 61 HB1 ASN 61 16.478 -10.905 -6.903 449 1HD2 ASN 61 HD21 ASN 61 13.276 -11.165 -5.596 450 2HD2 ASN 61 HD22 ASN 61 13.594 -12.507 -4.544 451 H ARG 62 HN ARG 62 16.383 -8.141 -3.392 452 HA ARG 62 HA ARG 62 18.443 -9.949 -2.522 453 1HB ARG 62 HB2 ARG 62 20.190 -8.265 -2.218 454 2HB ARG 62 HB1 ARG 62 19.773 -8.449 -3.914 455 1HG ARG 62 HG2 ARG 62 18.531 -6.395 -3.893 456 2HG ARG 62 HG1 ARG 62 18.746 -6.238 -2.147 457 1HD ARG 62 HD2 ARG 62 20.906 -6.149 -4.250 458 2HD ARG 62 HD1 ARG 62 20.314 -4.794 -3.286 459 HE ARG 62 HE ARG 62 21.133 -6.312 -1.331 460 1HH1 ARG 62 HH11 ARG 62 22.704 -5.777 -4.414 461 2HH1 ARG 62 HH12 ARG 62 24.286 -6.197 -3.825 462 1HH2 ARG 62 HH21 ARG 62 23.187 -6.834 -0.549 463 2HH2 ARG 62 HH22 ARG 62 24.562 -6.793 -1.609 464 H ASP 63 HN ASP 63 16.622 -6.987 -1.967 465 HA ASP 63 HA ASP 63 16.407 -7.722 0.853 466 1HB ASP 63 HB2 ASP 63 18.187 -6.024 0.724 467 2HB ASP 63 HB1 ASP 63 17.090 -4.934 -0.119 468 H LYS 64 HN LYS 64 14.482 -7.179 1.807 469 HA LYS 64 HA LYS 64 12.613 -5.501 0.367 470 1HB LYS 64 HB2 LYS 64 10.785 -7.168 0.511 471 2HB LYS 64 HB1 LYS 64 12.072 -7.648 -0.581 472 1HG LYS 64 HG2 LYS 64 11.601 -9.613 0.510 473 2HG LYS 64 HG1 LYS 64 12.952 -8.992 1.454 474 1HD LYS 64 HD2 LYS 64 11.420 -8.137 3.136 475 2HD LYS 64 HD1 LYS 64 10.036 -8.669 2.174 476 1HE LYS 64 HE2 LYS 64 10.555 -10.224 4.010 477 2HE LYS 64 HE1 LYS 64 10.720 -10.982 2.429 478 1HZ LYS 64 HZ1 LYS 64 13.080 -10.804 2.557 479 2HZ LYS 64 HZ2 LYS 64 12.542 -11.508 4.004 480 3HZ LYS 64 HZ3 LYS 64 13.002 -9.878 3.979 481 H LEU 65 HN LEU 65 11.046 -4.583 1.672 482 HA LEU 65 HA LEU 65 11.129 -5.260 4.515 483 1HB LEU 65 HB2 LEU 65 11.283 -2.920 5.165 484 2HB LEU 65 HB1 LEU 65 12.683 -3.423 4.239 485 HG LEU 65 HG LEU 65 10.448 -2.059 2.811 486 1HD1 LEU 65 HD11 LEU 65 10.865 -0.683 4.798 487 2HD1 LEU 65 HD12 LEU 65 11.401 0.112 3.319 488 3HD1 LEU 65 HD13 LEU 65 12.580 -0.637 4.395 489 1HD2 LEU 65 HD21 LEU 65 12.300 -1.236 1.445 490 2HD2 LEU 65 HD22 LEU 65 12.317 -2.997 1.550 491 3HD2 LEU 65 HD23 LEU 65 13.449 -2.045 2.512 492 H TYR 66 HN TYR 66 9.199 -5.205 5.491 493 HA TYR 66 HA TYR 66 6.903 -4.891 3.796 494 1HB TYR 66 HB2 TYR 66 7.078 -5.512 6.755 495 2HB TYR 66 HB1 TYR 66 5.616 -5.612 5.778 496 HD1 TYR 66 HD1 TYR 66 8.909 -7.120 6.413 497 HD2 TYR 66 HD2 TYR 66 5.236 -7.464 4.300 498 HE1 TYR 66 HE1 TYR 66 9.484 -9.429 5.802 499 HE2 TYR 66 HE2 TYR 66 5.798 -9.776 3.684 500 HH TYR 66 HH TYR 66 8.467 -11.459 5.088 501 H VAL 67 HN VAL 67 5.620 -3.200 3.607 502 HA VAL 67 HA VAL 67 5.997 -0.966 5.486 503 HB VAL 67 HB VAL 67 5.338 0.540 3.609 504 1HG1 VAL 67 HG11 VAL 67 7.551 0.522 2.561 505 2HG1 VAL 67 HG12 VAL 67 7.851 -1.084 3.227 506 3HG1 VAL 67 HG13 VAL 67 7.658 0.298 4.306 507 1HG2 VAL 67 HG21 VAL 67 5.562 -0.295 1.318 508 2HG2 VAL 67 HG22 VAL 67 4.257 -1.113 2.178 509 3HG2 VAL 67 HG23 VAL 67 5.801 -1.929 1.937 510 H ASN 68 HN ASN 68 4.268 -0.056 6.352 511 HA ASN 68 HA ASN 68 1.697 -1.321 5.761 512 1HB ASN 68 HB2 ASN 68 2.663 0.376 8.071 513 2HB ASN 68 HB1 ASN 68 0.974 -0.062 7.858 514 1HD2 ASN 68 HD21 ASN 68 3.556 -2.253 7.020 515 2HD2 ASN 68 HD22 ASN 68 3.295 -3.360 8.324 516 H ILE 69 HN ILE 69 0.632 -0.337 4.194 517 HA ILE 69 HA ILE 69 0.802 2.507 3.769 518 HB ILE 69 HB ILE 69 -1.445 1.514 2.386 519 1HG1 ILE 69 HG12 ILE 69 0.917 -0.355 2.110 520 2HG1 ILE 69 HG11 ILE 69 -0.583 -0.761 2.944 521 1HG2 ILE 69 HG21 ILE 69 -0.022 1.889 0.408 522 2HG2 ILE 69 HG22 ILE 69 1.377 2.046 1.469 523 3HG2 ILE 69 HG23 ILE 69 0.060 3.214 1.569 524 1HD1 ILE 69 HD11 ILE 69 -0.324 -0.069 0.024 525 2HD1 ILE 69 HD12 ILE 69 -1.812 -0.514 0.861 526 3HD1 ILE 69 HD13 ILE 69 -0.510 -1.691 0.694 527 H ARG 70 HN ARG 70 -0.107 3.749 5.282 528 HA ARG 70 HA ARG 70 -2.733 2.911 6.341 529 1HB ARG 70 HB2 ARG 70 -0.590 4.327 7.932 530 2HB ARG 70 HB1 ARG 70 -2.160 3.802 8.514 531 1HG ARG 70 HG2 ARG 70 -1.491 1.469 8.176 532 2HG ARG 70 HG1 ARG 70 0.100 2.018 7.634 533 1HD ARG 70 HD2 ARG 70 0.413 3.135 9.820 534 2HD ARG 70 HD1 ARG 70 -1.133 2.475 10.351 535 HE ARG 70 HE ARG 70 0.719 0.483 9.431 536 1HH1 ARG 70 HH11 ARG 70 -0.337 2.369 12.190 537 2HH1 ARG 70 HH12 ARG 70 0.313 1.249 13.351 538 1HH2 ARG 70 HH21 ARG 70 1.570 -0.982 10.954 539 2HH2 ARG 70 HH22 ARG 70 1.401 -0.653 12.655 540 HA PRO 71 HA PRO 71 -4.318 6.830 5.075 541 1HB PRO 71 HB2 PRO 71 -5.820 7.150 7.451 542 2HB PRO 71 HB1 PRO 71 -6.393 6.548 5.900 543 1HG PRO 71 HG2 PRO 71 -5.612 5.058 8.324 544 2HG PRO 71 HG1 PRO 71 -6.730 4.607 7.022 545 1HD PRO 71 HD2 PRO 71 -4.287 3.489 7.291 546 2HD PRO 71 HD1 PRO 71 -5.056 3.740 5.711 547 H MET 72 HN MET 72 -3.532 8.842 5.298 548 HA MET 72 HA MET 72 -1.476 9.354 7.155 549 1HB MET 72 HB2 MET 72 -1.610 10.435 4.943 550 2HB MET 72 HB1 MET 72 -3.033 11.325 5.470 551 1HG MET 72 HG2 MET 72 -1.726 12.506 7.123 552 2HG MET 72 HG1 MET 72 -0.301 11.553 6.712 553 1HE MET 72 HE1 MET 72 0.718 15.031 5.321 554 2HE MET 72 HE2 MET 72 1.224 13.635 6.274 555 3HE MET 72 HE3 MET 72 -0.114 14.643 6.827 556 H ASP 73 HN ASP 73 -4.778 10.678 6.936 557 HA ASP 73 HA ASP 73 -5.309 10.357 9.674 558 1HB ASP 73 HB2 ASP 73 -3.725 12.197 10.004 559 2HB ASP 73 HB1 ASP 73 -4.634 13.200 8.877 560 H ASN 74 HN ASN 74 -7.365 9.771 9.342 561 HA ASN 74 HA ASN 74 -9.288 11.684 8.393 562 1HB ASN 74 HB2 ASN 74 -8.194 9.760 6.520 563 2HB ASN 74 HB1 ASN 74 -9.927 9.546 6.715 564 1HD2 ASN 74 HD21 ASN 74 -7.409 11.555 5.488 565 2HD2 ASN 74 HD22 ASN 74 -8.433 12.696 4.678 566 H SER 75 HN SER 75 -8.945 8.130 8.608 567 HA SER 75 HA SER 75 -10.931 7.999 10.694 568 1HB SER 75 HB2 SER 75 -12.238 8.153 8.509 569 2HB SER 75 HB1 SER 75 -11.540 6.591 8.082 570 HG SER 75 HG SER 75 -13.114 5.755 9.199 571 H ALA 76 HN ALA 76 -11.264 5.712 11.393 572 HA ALA 76 HA ALA 76 -8.712 4.411 11.538 573 1HB ALA 76 HB1 ALA 76 -10.171 4.535 13.489 574 2HB ALA 76 HB2 ALA 76 -9.814 2.861 13.068 575 3HB ALA 76 HB3 ALA 76 -11.381 3.559 12.655 576 H TRP 77 HN TRP 77 -7.980 2.803 10.362 577 HA TRP 77 HA TRP 77 -9.837 1.354 8.597 578 1HB TRP 77 HB2 TRP 77 -6.935 2.106 8.253 579 2HB TRP 77 HB1 TRP 77 -7.688 0.852 7.279 580 HD1 TRP 77 HD1 TRP 77 -9.231 4.315 8.161 581 HE1 TRP 77 HE1 TRP 77 -9.719 5.544 5.938 582 HE3 TRP 77 HE3 TRP 77 -7.202 0.943 4.902 583 HZ2 TRP 77 HZ2 TRP 77 -9.282 5.129 3.191 584 HZ3 TRP 77 HZ3 TRP 77 -7.278 1.439 2.494 585 HH2 TRP 77 HH2 TRP 77 -8.291 3.492 1.670 586 H THR 78 HN THR 78 -9.587 -0.892 8.374 587 HA THR 78 HA THR 78 -8.404 -2.252 10.639 588 HB THR 78 HB THR 78 -9.721 -3.455 8.191 589 HG1 THR 78 HG1 THR 78 -10.886 -2.741 10.709 590 1HG2 THR 78 HG21 THR 78 -8.402 -5.030 9.526 591 2HG2 THR 78 HG22 THR 78 -10.126 -5.374 9.659 592 3HG2 THR 78 HG23 THR 78 -9.288 -4.551 10.974 593 H THR 79 HN THR 79 -6.429 -3.182 10.643 594 HA THR 79 HA THR 79 -4.888 -2.817 8.177 595 HB THR 79 HB THR 79 -4.004 -1.558 10.024 596 HG1 THR 79 HG1 THR 79 -2.593 -3.090 8.580 597 1HG2 THR 79 HG21 THR 79 -4.902 -2.834 11.892 598 2HG2 THR 79 HG22 THR 79 -3.157 -2.637 12.067 599 3HG2 THR 79 HG23 THR 79 -3.821 -4.177 11.518 600 H ASP 80 HN ASP 80 -4.461 -4.494 6.995 601 HA ASP 80 HA ASP 80 -3.330 -6.840 8.349 602 1HB ASP 80 HB2 ASP 80 -5.662 -7.308 7.370 603 2HB ASP 80 HB1 ASP 80 -4.934 -7.055 5.787 604 H ASN 81 HN ASN 81 -1.695 -7.932 6.915 605 HA ASN 81 HA ASN 81 -0.245 -5.909 5.440 606 1HB ASN 81 HB2 ASN 81 0.392 -8.744 6.195 607 2HB ASN 81 HB1 ASN 81 1.393 -7.858 5.055 608 1HD2 ASN 81 HD21 ASN 81 2.704 -6.196 5.784 609 2HD2 ASN 81 HD22 ASN 81 2.989 -5.906 7.466 610 H GLY 82 HN GLY 82 -2.673 -8.026 4.670 611 1HA GLY 82 HA2 GLY 82 -1.741 -8.322 1.918 612 2HA GLY 82 HA1 GLY 82 -3.121 -9.152 2.624 613 H VAL 83 HN VAL 83 -4.372 -6.934 3.800 614 HA VAL 83 HA VAL 83 -4.964 -5.164 1.545 615 HB VAL 83 HB VAL 83 -7.396 -5.356 1.989 616 1HG1 VAL 83 HG11 VAL 83 -6.438 -6.592 0.137 617 2HG1 VAL 83 HG12 VAL 83 -7.740 -7.519 0.883 618 3HG1 VAL 83 HG13 VAL 83 -6.058 -7.942 1.205 619 1HG2 VAL 83 HG21 VAL 83 -8.265 -7.245 3.272 620 2HG2 VAL 83 HG22 VAL 83 -7.282 -6.186 4.285 621 3HG2 VAL 83 HG23 VAL 83 -6.620 -7.715 3.705 622 H PHE 84 HN PHE 84 -6.024 -3.187 2.190 623 HA PHE 84 HA PHE 84 -6.006 -2.664 5.073 624 1HB PHE 84 HB2 PHE 84 -3.902 -1.854 3.513 625 2HB PHE 84 HB1 PHE 84 -4.958 -0.451 3.419 626 HD1 PHE 84 HD1 PHE 84 -5.911 0.369 5.731 627 HD2 PHE 84 HD2 PHE 84 -2.418 -2.000 5.230 628 HE1 PHE 84 HE1 PHE 84 -5.090 1.128 7.920 629 HE2 PHE 84 HE2 PHE 84 -1.586 -1.250 7.416 630 HZ PHE 84 HZ PHE 84 -2.925 0.316 8.768 631 H TYR 85 HN TYR 85 -8.037 -2.045 5.485 632 HA TYR 85 HA TYR 85 -9.400 -0.320 3.558 633 1HB TYR 85 HB2 TYR 85 -11.387 -1.753 3.539 634 2HB TYR 85 HB1 TYR 85 -9.984 -2.597 2.905 635 HD1 TYR 85 HD1 TYR 85 -12.711 -2.768 5.134 636 HD2 TYR 85 HD2 TYR 85 -8.708 -4.131 4.622 637 HE1 TYR 85 HE1 TYR 85 -13.149 -4.625 6.687 638 HE2 TYR 85 HE2 TYR 85 -9.139 -5.991 6.170 639 HH TYR 85 HH TYR 85 -10.735 -6.478 8.068 640 H LYS 86 HN LYS 86 -10.952 1.014 4.420 641 HA LYS 86 HA LYS 86 -10.890 1.279 7.275 642 1HB LYS 86 HB2 LYS 86 -12.104 3.275 7.047 643 2HB LYS 86 HB1 LYS 86 -11.026 3.236 5.669 644 1HG LYS 86 HG2 LYS 86 -13.887 2.362 5.470 645 2HG LYS 86 HG1 LYS 86 -13.406 4.050 5.309 646 1HD LYS 86 HD2 LYS 86 -11.757 3.168 3.528 647 2HD LYS 86 HD1 LYS 86 -12.777 1.725 3.527 648 1HE LYS 86 HE2 LYS 86 -13.705 4.552 3.010 649 2HE LYS 86 HE1 LYS 86 -13.459 3.314 1.782 650 1HZ LYS 86 HZ1 LYS 86 -15.264 2.072 2.608 651 2HZ LYS 86 HZ2 LYS 86 -15.801 3.674 2.521 652 3HZ LYS 86 HZ3 LYS 86 -15.377 3.002 4.020 653 H ASN 87 HN ASN 87 -12.413 0.758 8.716 654 HA ASN 87 HA ASN 87 -14.181 -1.350 8.123 655 1HB ASN 87 HB2 ASN 87 -13.178 -0.976 10.348 656 2HB ASN 87 HB1 ASN 87 -14.129 0.494 10.526 657 1HD2 ASN 87 HD21 ASN 87 -16.261 0.363 11.083 658 2HD2 ASN 87 HD22 ASN 87 -17.030 -1.128 11.540 659 H ASP 88 HN ASP 88 -14.500 2.071 8.035 660 HA ASP 88 HA ASP 88 -17.350 2.214 8.111 661 1HB ASP 88 HB2 ASP 88 -15.531 4.237 6.807 662 2HB ASP 88 HB1 ASP 88 -17.101 4.511 7.552 663 H VAL 89 HN VAL 89 -18.802 2.342 6.411 664 HA VAL 89 HA VAL 89 -17.753 1.766 3.730 665 HB VAL 89 HB VAL 89 -20.377 1.431 5.007 666 1HG1 VAL 89 HG11 VAL 89 -20.251 2.396 2.208 667 2HG1 VAL 89 HG12 VAL 89 -21.145 3.093 3.555 668 3HG1 VAL 89 HG13 VAL 89 -21.624 1.530 2.893 669 1HG2 VAL 89 HG21 VAL 89 -19.042 -0.469 4.413 670 2HG2 VAL 89 HG22 VAL 89 -18.998 0.071 2.735 671 3HG2 VAL 89 HG23 VAL 89 -20.522 -0.454 3.452 672 H GLY 90 HN GLY 90 -18.015 3.213 2.026 673 1HA GLY 90 HA2 GLY 90 -19.186 5.367 1.378 674 2HA GLY 90 HA1 GLY 90 -18.548 5.979 2.897 675 H SER 91 HN SER 91 -17.766 7.530 1.105 676 HA SER 91 HA SER 91 -15.526 6.711 -0.457 677 1HB SER 91 HB2 SER 91 -16.320 9.515 0.378 678 2HB SER 91 HB1 SER 91 -15.331 9.057 -1.009 679 HG SER 91 HG SER 91 -17.305 7.828 -1.679 680 H TRP 92 HN TRP 92 -13.470 8.298 -0.119 681 HA TRP 92 HA TRP 92 -12.819 8.759 2.642 682 1HB TRP 92 HB2 TRP 92 -12.378 6.267 2.292 683 2HB TRP 92 HB1 TRP 92 -11.060 6.764 1.226 684 HD1 TRP 92 HD1 TRP 92 -12.170 7.136 4.911 685 HE1 TRP 92 HE1 TRP 92 -10.077 7.619 6.330 686 HE3 TRP 92 HE3 TRP 92 -8.725 7.423 1.181 687 HZ2 TRP 92 HZ2 TRP 92 -7.318 8.089 5.892 688 HZ3 TRP 92 HZ3 TRP 92 -6.408 7.910 1.730 689 HH2 TRP 92 HH2 TRP 92 -5.701 8.230 4.050 690 H GLY 93 HN GLY 93 -11.721 8.554 -0.703 691 1HA GLY 93 HA2 GLY 93 -10.086 9.700 -1.869 692 2HA GLY 93 HA1 GLY 93 -10.645 11.085 -0.942 693 H GLY 94 HN GLY 94 -8.870 12.091 -0.118 694 1HA GLY 94 HA2 GLY 94 -7.488 12.400 1.697 695 2HA GLY 94 HA1 GLY 94 -7.730 10.716 2.115 696 H THR 95 HN THR 95 -5.597 10.473 2.647 697 HA THR 95 HA THR 95 -3.830 9.944 0.404 698 HB THR 95 HB THR 95 -1.977 11.045 1.957 699 HG1 THR 95 HG1 THR 95 -2.980 13.096 2.742 700 1HG2 THR 95 HG21 THR 95 -2.367 11.646 -0.371 701 2HG2 THR 95 HG22 THR 95 -2.127 13.093 0.610 702 3HG2 THR 95 HG23 THR 95 -3.752 12.632 0.100 703 H ILE 96 HN ILE 96 -2.681 8.123 0.733 704 HA ILE 96 HA ILE 96 -2.695 6.972 3.449 705 HB ILE 96 HB ILE 96 -2.114 5.482 0.888 706 1HG1 ILE 96 HG12 ILE 96 -4.459 6.517 1.071 707 2HG1 ILE 96 HG11 ILE 96 -4.363 4.788 0.752 708 1HG2 ILE 96 HG21 ILE 96 -2.880 4.546 3.635 709 2HG2 ILE 96 HG22 ILE 96 -1.263 4.474 2.927 710 3HG2 ILE 96 HG23 ILE 96 -2.575 3.517 2.236 711 1HD1 ILE 96 HD11 ILE 96 -6.083 5.279 2.382 712 2HD1 ILE 96 HD12 ILE 96 -4.901 6.083 3.414 713 3HD1 ILE 96 HD13 ILE 96 -4.782 4.348 3.124 714 H GLY 97 HN GLY 97 -0.801 6.684 4.467 715 1HA GLY 97 HA2 GLY 97 1.599 7.560 3.022 716 2HA GLY 97 HA1 GLY 97 1.379 7.597 4.766 717 H ILE 98 HN ILE 98 3.491 6.396 3.108 718 HA ILE 98 HA ILE 98 3.151 3.574 3.758 719 HB ILE 98 HB ILE 98 5.164 5.021 2.051 720 1HG1 ILE 98 HG12 ILE 98 3.090 2.926 1.460 721 2HG1 ILE 98 HG11 ILE 98 2.924 4.635 1.117 722 1HG2 ILE 98 HG21 ILE 98 6.162 2.847 1.547 723 2HG2 ILE 98 HG22 ILE 98 5.098 2.081 2.726 724 3HG2 ILE 98 HG23 ILE 98 6.318 3.235 3.262 725 1HD1 ILE 98 HD11 ILE 98 4.770 4.509 -0.465 726 2HD1 ILE 98 HD12 ILE 98 3.484 3.377 -0.884 727 3HD1 ILE 98 HD13 ILE 98 4.957 2.791 -0.113 728 H TYR 99 HN TYR 99 3.797 2.950 5.654 729 HA TYR 99 HA TYR 99 6.102 4.265 6.937 730 1HB TYR 99 HB2 TYR 99 3.933 2.709 8.365 731 2HB TYR 99 HB1 TYR 99 5.116 3.803 9.065 732 HD1 TYR 99 HD1 TYR 99 4.610 6.085 9.366 733 HD2 TYR 99 HD2 TYR 99 2.079 3.690 6.934 734 HE1 TYR 99 HE1 TYR 99 2.983 7.922 9.261 735 HE2 TYR 99 HE2 TYR 99 0.445 5.521 6.825 736 HH TYR 99 HH TYR 99 1.176 8.704 7.884 737 H VAL 100 HN VAL 100 7.817 2.953 7.407 738 HA VAL 100 HA VAL 100 7.852 0.265 6.450 739 HB VAL 100 HB VAL 100 9.860 1.681 6.444 740 1HG1 VAL 100 HG11 VAL 100 11.068 2.167 8.452 741 2HG1 VAL 100 HG12 VAL 100 9.893 1.278 9.423 742 3HG1 VAL 100 HG13 VAL 100 9.423 2.777 8.620 743 1HG2 VAL 100 HG21 VAL 100 11.417 -0.018 7.091 744 2HG2 VAL 100 HG22 VAL 100 9.994 -0.799 6.407 745 3HG2 VAL 100 HG23 VAL 100 10.229 -0.767 8.156 746 H ASP 101 HN ASP 101 7.545 -1.629 7.548 747 HA ASP 101 HA ASP 101 6.401 -1.509 10.172 748 1HB ASP 101 HB2 ASP 101 5.602 -3.153 8.521 749 2HB ASP 101 HB1 ASP 101 7.192 -3.910 8.504 750 H GLY 102 HN GLY 102 7.996 -0.694 11.532 751 1HA GLY 102 HA2 GLY 102 9.318 -1.288 13.361 752 2HA GLY 102 HA1 GLY 102 9.729 -2.792 12.557 753 H GLN 103 HN GLN 103 10.103 -0.033 10.594 754 HA GLN 103 HA GLN 103 11.886 1.015 9.692 755 1HB GLN 103 HB2 GLN 103 12.150 1.990 11.898 756 2HB GLN 103 HB1 GLN 103 13.118 0.615 12.416 757 1HG GLN 103 HG2 GLN 103 14.827 1.197 10.771 758 2HG GLN 103 HG1 GLN 103 13.849 2.562 10.236 759 1HE2 GLN 103 HE21 GLN 103 15.420 4.059 10.749 760 2HE2 GLN 103 HE22 GLN 103 15.814 4.475 12.381 761 H GLN 104 HN GLN 104 12.897 0.088 8.107 762 HA GLN 104 HA GLN 104 14.227 -2.446 8.337 763 1HB GLN 104 HB2 GLN 104 13.044 -1.792 6.281 764 2HB GLN 104 HB1 GLN 104 14.143 -0.440 6.071 765 1HG GLN 104 HG2 GLN 104 14.828 -2.126 4.569 766 2HG GLN 104 HG1 GLN 104 16.008 -2.096 5.877 767 1HE2 GLN 104 HE21 GLN 104 15.339 -4.230 3.976 768 2HE2 GLN 104 HE22 GLN 104 14.879 -5.589 4.944 769 H THR 105 HN THR 105 15.061 0.890 8.491 770 HA THR 105 HA THR 105 16.961 2.033 8.927 771 HB THR 105 HB THR 105 18.309 -0.588 9.602 772 HG1 THR 105 HG1 THR 105 16.950 -0.786 11.219 773 1HG2 THR 105 HG21 THR 105 19.504 0.779 11.242 774 2HG2 THR 105 HG22 THR 105 18.584 2.200 10.748 775 3HG2 THR 105 HG23 THR 105 19.711 1.444 9.622 776 H ASN 106 HN ASN 106 16.397 0.528 6.353 777 HA ASN 106 HA ASN 106 17.192 0.572 4.250 778 1HB ASN 106 HB2 ASN 106 17.745 2.916 4.954 779 2HB ASN 106 HB1 ASN 106 19.377 2.362 5.305 780 1HD2 ASN 106 HD21 ASN 106 20.763 1.907 3.629 781 2HD2 ASN 106 HD22 ASN 106 20.419 2.335 1.990 782 H THR 107 HN THR 107 17.724 -1.618 4.261 783 HA THR 107 HA THR 107 20.521 -2.357 4.643 784 HB THR 107 HB THR 107 18.526 -4.250 3.480 785 HG1 THR 107 HG1 THR 107 17.255 -4.252 5.168 786 1HG2 THR 107 HG21 THR 107 19.624 -5.829 5.004 787 2HG2 THR 107 HG22 THR 107 20.599 -4.514 5.661 788 3HG2 THR 107 HG23 THR 107 20.793 -5.003 3.977 789 HA PRO 108 HA PRO 108 22.375 -1.682 0.708 790 1HB PRO 108 HB2 PRO 108 22.074 -4.634 0.348 791 2HB PRO 108 HB1 PRO 108 23.475 -3.600 0.044 792 1HG PRO 108 HG2 PRO 108 23.015 -5.083 2.367 793 2HG PRO 108 HG1 PRO 108 24.182 -3.766 2.189 794 1HD PRO 108 HD2 PRO 108 21.907 -3.779 3.855 795 2HD PRO 108 HD1 PRO 108 22.899 -2.365 3.439 796 HA PRO 109 HA PRO 109 18.361 -1.994 -1.411 797 1HB PRO 109 HB2 PRO 109 18.174 0.771 -1.740 798 2HB PRO 109 HB1 PRO 109 17.484 -0.171 -0.418 799 1HG PRO 109 HG2 PRO 109 19.564 1.739 -0.256 800 2HG PRO 109 HG1 PRO 109 18.997 0.663 1.028 801 1HD PRO 109 HD2 PRO 109 21.350 0.394 -0.760 802 2HD PRO 109 HD1 PRO 109 21.096 -0.203 0.897 803 H GLY 110 HN GLY 110 17.755 0.063 -3.182 804 1HA GLY 110 HA2 GLY 110 19.496 0.573 -5.270 805 2HA GLY 110 HA1 GLY 110 18.740 -0.991 -5.594 806 H ASN 111 HN ASN 111 17.227 -0.519 -7.148 807 HA ASN 111 HA ASN 111 15.314 1.601 -6.500 808 1HB ASN 111 HB2 ASN 111 16.282 0.995 -8.912 809 2HB ASN 111 HB1 ASN 111 14.923 -0.128 -8.894 810 1HD2 ASN 111 HD21 ASN 111 15.228 2.102 -10.623 811 2HD2 ASN 111 HD22 ASN 111 13.925 3.192 -10.291 812 H TYR 112 HN TYR 112 13.482 1.153 -5.482 813 HA TYR 112 HA TYR 112 12.724 -1.670 -5.203 814 1HB TYR 112 HB2 TYR 112 12.336 0.698 -3.385 815 2HB TYR 112 HB1 TYR 112 11.332 -0.737 -3.234 816 HD1 TYR 112 HD1 TYR 112 11.959 -2.095 -1.496 817 HD2 TYR 112 HD2 TYR 112 14.995 -0.103 -3.695 818 HE1 TYR 112 HE1 TYR 112 13.672 -3.164 -0.093 819 HE2 TYR 112 HE2 TYR 112 16.705 -1.170 -2.309 820 HH TYR 112 HH TYR 112 15.878 -3.500 0.212 821 H THR 113 HN THR 113 10.923 -2.334 -6.049 822 HA THR 113 HA THR 113 9.032 -0.342 -7.077 823 HB THR 113 HB THR 113 9.408 -3.238 -7.866 824 HG1 THR 113 HG1 THR 113 10.603 -2.495 -9.507 825 1HG2 THR 113 HG21 THR 113 7.902 -2.707 -9.731 826 2HG2 THR 113 HG22 THR 113 7.682 -1.079 -9.090 827 3HG2 THR 113 HG23 THR 113 7.097 -2.471 -8.179 828 H LEU 114 HN LEU 114 7.031 -0.279 -6.272 829 HA LEU 114 HA LEU 114 6.006 -2.608 -4.848 830 1HB LEU 114 HB2 LEU 114 4.956 -0.805 -3.237 831 2HB LEU 114 HB1 LEU 114 6.545 -1.481 -2.939 832 HG LEU 114 HG LEU 114 6.393 1.028 -4.527 833 1HD1 LEU 114 HD11 LEU 114 6.050 0.914 -1.534 834 2HD1 LEU 114 HD12 LEU 114 4.841 1.460 -2.697 835 3HD1 LEU 114 HD13 LEU 114 6.335 2.373 -2.483 836 1HD2 LEU 114 HD21 LEU 114 8.539 -0.056 -4.148 837 2HD2 LEU 114 HD22 LEU 114 8.277 0.012 -2.406 838 3HD2 LEU 114 HD23 LEU 114 8.470 1.504 -3.327 839 H THR 115 HN THR 115 4.711 -3.054 -6.544 840 HA THR 115 HA THR 115 3.062 -1.048 -7.772 841 HB THR 115 HB THR 115 2.808 -4.040 -8.091 842 HG1 THR 115 HG1 THR 115 4.996 -3.454 -8.452 843 1HG2 THR 115 HG21 THR 115 2.256 -1.741 -9.973 844 2HG2 THR 115 HG22 THR 115 1.036 -2.662 -9.094 845 3HG2 THR 115 HG23 THR 115 2.019 -3.451 -10.328 846 H LEU 116 HN LEU 116 1.221 -0.322 -6.919 847 HA LEU 116 HA LEU 116 -0.158 -1.995 -4.934 848 1HB LEU 116 HB2 LEU 116 -0.238 0.975 -5.402 849 2HB LEU 116 HB1 LEU 116 -1.171 0.136 -4.178 850 HG LEU 116 HG LEU 116 1.844 0.300 -4.286 851 1HD1 LEU 116 HD11 LEU 116 -0.129 1.621 -2.431 852 2HD1 LEU 116 HD12 LEU 116 0.800 2.426 -3.697 853 3HD1 LEU 116 HD13 LEU 116 1.629 1.710 -2.313 854 1HD2 LEU 116 HD21 LEU 116 1.079 -1.797 -3.306 855 2HD2 LEU 116 HD22 LEU 116 0.022 -0.907 -2.209 856 3HD2 LEU 116 HD23 LEU 116 1.772 -0.739 -2.077 857 H THR 117 HN THR 117 -2.245 -2.551 -5.177 858 HA THR 117 HA THR 117 -3.538 -1.750 -7.702 859 HB THR 117 HB THR 117 -4.130 -4.220 -6.063 860 HG1 THR 117 HG1 THR 117 -1.914 -3.800 -7.264 861 1HG2 THR 117 HG21 THR 117 -5.909 -3.503 -7.600 862 2HG2 THR 117 HG22 THR 117 -5.173 -5.013 -8.134 863 3HG2 THR 117 HG23 THR 117 -4.754 -3.496 -8.932 864 H GLY 118 HN GLY 118 -5.114 -0.302 -7.419 865 1HA GLY 118 HA2 GLY 118 -6.342 0.073 -4.826 866 2HA GLY 118 HA1 GLY 118 -6.638 1.029 -6.271 867 H GLY 119 HN GLY 119 -8.746 0.354 -4.692 868 1HA GLY 119 HA2 GLY 119 -10.748 -0.408 -6.204 869 2HA GLY 119 HA1 GLY 119 -9.998 -1.977 -5.932 870 H TYR 120 HN TYR 120 -12.339 -2.162 -5.086 871 HA TYR 120 HA TYR 120 -12.526 -1.175 -2.343 872 1HB TYR 120 HB2 TYR 120 -14.868 -1.804 -2.427 873 2HB TYR 120 HB1 TYR 120 -14.461 -0.797 -3.808 874 HD1 TYR 120 HD1 TYR 120 -15.482 -4.136 -2.709 875 HD2 TYR 120 HD2 TYR 120 -14.475 -1.722 -6.064 876 HE1 TYR 120 HE1 TYR 120 -16.489 -5.805 -4.203 877 HE2 TYR 120 HE2 TYR 120 -15.479 -3.388 -7.567 878 HH TYR 120 HH TYR 120 -16.098 -5.701 -7.626 879 H TRP 121 HN TRP 121 -13.956 -2.865 -1.027 880 HA TRP 121 HA TRP 121 -13.007 -5.589 -1.291 881 1HB TRP 121 HB2 TRP 121 -11.215 -4.980 0.036 882 2HB TRP 121 HB1 TRP 121 -12.088 -3.658 0.798 883 HD1 TRP 121 HD1 TRP 121 -13.999 -4.498 2.645 884 HE1 TRP 121 HE1 TRP 121 -13.826 -6.364 4.391 885 HE3 TRP 121 HE3 TRP 121 -10.103 -7.152 0.628 886 HZ2 TRP 121 HZ2 TRP 121 -12.259 -8.611 4.867 887 HZ3 TRP 121 HZ3 TRP 121 -9.337 -9.160 1.854 888 HH2 TRP 121 HH2 TRP 121 -10.398 -9.863 3.901 889 H ALA 122 HN ALA 122 -14.331 -7.053 -0.112 890 HA ALA 122 HA ALA 122 -16.758 -5.858 1.042 891 1HB ALA 122 HB1 ALA 122 -16.606 -8.394 -0.578 892 2HB ALA 122 HB2 ALA 122 -17.168 -6.834 -1.179 893 3HB ALA 122 HB3 ALA 122 -18.062 -7.662 0.096 894 H LYS 123 HN LYS 123 -17.628 -6.796 2.807 895 HA LYS 123 HA LYS 123 -17.822 -7.903 4.739 896 1HB LYS 123 HB2 LYS 123 -16.371 -10.066 3.231 897 2HB LYS 123 HB1 LYS 123 -17.046 -10.280 4.844 898 1HG LYS 123 HG2 LYS 123 -19.252 -9.455 3.774 899 2HG LYS 123 HG1 LYS 123 -18.467 -9.849 2.245 900 1HD LYS 123 HD2 LYS 123 -19.790 -11.729 2.969 901 2HD LYS 123 HD1 LYS 123 -18.079 -12.147 3.084 902 1HE LYS 123 HE2 LYS 123 -19.367 -12.903 5.043 903 2HE LYS 123 HE1 LYS 123 -18.107 -11.747 5.474 904 1HZ LYS 123 HZ1 LYS 123 -20.978 -11.063 5.104 905 2HZ LYS 123 HZ2 LYS 123 -19.751 -10.012 5.624 906 3HZ LYS 123 HZ3 LYS 123 -20.223 -11.311 6.603 907 H ASP 124 HN ASP 124 -15.615 -9.874 5.686 908 HA ASP 124 HA ASP 124 -13.444 -7.995 6.128 909 1HB ASP 124 HB2 ASP 124 -13.568 -7.963 8.519 910 2HB ASP 124 HB1 ASP 124 -15.144 -7.493 7.898 911 H ASN 125 HN ASN 125 -11.611 -8.978 5.999 912 HA ASN 125 HA ASN 125 -9.907 -10.439 6.125 913 1HB ASN 125 HB2 ASN 125 -10.590 -10.422 8.507 914 2HB ASN 125 HB1 ASN 125 -11.525 -11.880 8.207 915 1HD2 ASN 125 HD21 ASN 125 -10.469 -13.830 7.943 916 2HD2 ASN 125 HD22 ASN 125 -8.772 -14.030 8.256 917 H LYS 126 HN LYS 126 -13.013 -11.673 5.389 918 HA LYS 126 HA LYS 126 -12.271 -14.310 4.644 919 1HB LYS 126 HB2 LYS 126 -14.446 -14.438 3.618 920 2HB LYS 126 HB1 LYS 126 -14.593 -13.575 5.144 921 1HG LYS 126 HG2 LYS 126 -15.756 -12.077 3.964 922 2HG LYS 126 HG1 LYS 126 -14.183 -11.530 3.380 923 1HD LYS 126 HD2 LYS 126 -14.405 -13.157 1.494 924 2HD LYS 126 HD1 LYS 126 -16.047 -13.493 2.046 925 1HE LYS 126 HE2 LYS 126 -16.493 -11.023 1.828 926 2HE LYS 126 HE1 LYS 126 -14.939 -10.897 1.007 927 1HZ LYS 126 HZ1 LYS 126 -16.655 -11.117 -0.626 928 2HZ LYS 126 HZ2 LYS 126 -17.278 -12.503 0.127 929 3HZ LYS 126 HZ3 LYS 126 -15.754 -12.553 -0.617 930 H GLN 127 HN GLN 127 -11.348 -11.447 3.396 931 HA GLN 127 HA GLN 127 -10.295 -10.760 1.534 932 1HB GLN 127 HB2 GLN 127 -9.119 -12.907 1.563 933 2HB GLN 127 HB1 GLN 127 -10.438 -13.655 0.673 934 1HG GLN 127 HG2 GLN 127 -9.986 -12.202 -1.231 935 2HG GLN 127 HG1 GLN 127 -8.677 -11.432 -0.337 936 1HE2 GLN 127 HE21 GLN 127 -7.771 -13.922 0.866 937 2HE2 GLN 127 HE22 GLN 127 -6.970 -14.806 -0.390 938 H GLY 128 HN GLY 128 -12.359 -9.612 1.253 939 1HA GLY 128 HA2 GLY 128 -13.723 -10.535 -1.175 940 2HA GLY 128 HA1 GLY 128 -14.364 -9.351 -0.040 941 H PHE 129 HN PHE 129 -11.059 -9.400 -1.257 942 HA PHE 129 HA PHE 129 -11.246 -6.624 -1.867 943 1HB PHE 129 HB2 PHE 129 -8.946 -6.673 -2.056 944 2HB PHE 129 HB1 PHE 129 -9.207 -8.052 -1.006 945 HD1 PHE 129 HD1 PHE 129 -9.054 -10.348 -1.934 946 HD2 PHE 129 HD2 PHE 129 -8.000 -6.913 -4.216 947 HE1 PHE 129 HE1 PHE 129 -7.811 -11.772 -3.506 948 HE2 PHE 129 HE2 PHE 129 -6.762 -8.333 -5.793 949 HZ PHE 129 HZ PHE 129 -6.665 -10.767 -5.440 950 H THR 130 HN THR 130 -11.247 -5.626 -3.854 951 HA THR 130 HA THR 130 -11.053 -7.270 -6.266 952 HB THR 130 HB THR 130 -13.313 -5.305 -5.817 953 HG1 THR 130 HG1 THR 130 -13.055 -8.005 -5.278 954 1HG2 THR 130 HG21 THR 130 -14.209 -6.190 -7.904 955 2HG2 THR 130 HG22 THR 130 -12.825 -7.273 -8.059 956 3HG2 THR 130 HG23 THR 130 -12.596 -5.527 -8.163 957 HA PRO 131 HA PRO 131 -8.670 -3.663 -7.486 958 1HB PRO 131 HB2 PRO 131 -8.239 -4.389 -10.062 959 2HB PRO 131 HB1 PRO 131 -7.358 -5.105 -8.709 960 1HG PRO 131 HG2 PRO 131 -9.693 -6.183 -10.234 961 2HG PRO 131 HG1 PRO 131 -8.246 -7.028 -9.652 962 1HD PRO 131 HD2 PRO 131 -10.650 -7.137 -8.378 963 2HD PRO 131 HD1 PRO 131 -9.097 -7.287 -7.535 964 H SER 132 HN SER 132 -9.475 -1.739 -8.016 965 HA SER 132 HA SER 132 -11.288 -1.419 -10.253 966 1HB SER 132 HB2 SER 132 -12.148 -0.571 -7.475 967 2HB SER 132 HB1 SER 132 -13.068 -0.376 -8.969 968 HG SER 132 HG SER 132 -12.574 -2.887 -8.929 969 H GLY 133 HN GLY 133 -10.392 0.223 -11.319 970 1HA GLY 133 HA2 GLY 133 -10.106 2.705 -11.192 971 2HA GLY 133 HA1 GLY 133 -9.152 2.397 -9.747 972 H THR 134 HN THR 134 -7.027 2.035 -9.962 973 HA THR 134 HA THR 134 -5.963 1.083 -12.481 974 HB THR 134 HB THR 134 -6.047 3.511 -12.842 975 HG1 THR 134 HG1 THR 134 -4.180 2.146 -13.541 976 1HG2 THR 134 HG21 THR 134 -4.268 3.675 -10.416 977 2HG2 THR 134 HG22 THR 134 -5.937 4.236 -10.518 978 3HG2 THR 134 HG23 THR 134 -4.683 5.017 -11.482 979 H THR 135 HN THR 135 -3.806 0.332 -12.320 980 HA THR 135 HA THR 135 -3.029 -0.366 -9.596 981 HB THR 135 HB THR 135 -1.748 -1.305 -12.168 982 HG1 THR 135 HG1 THR 135 -3.608 -2.284 -12.480 983 1HG2 THR 135 HG21 THR 135 -1.019 -3.190 -10.815 984 2HG2 THR 135 HG22 THR 135 -1.871 -2.542 -9.415 985 3HG2 THR 135 HG23 THR 135 -0.485 -1.678 -10.080 986 H GLY 136 HN GLY 136 -2.017 1.376 -8.725 987 1HA GLY 136 HA2 GLY 136 -0.179 2.970 -10.300 988 2HA GLY 136 HA1 GLY 136 -0.654 3.264 -8.634 989 H THR 137 HN THR 137 1.963 2.869 -10.288 990 HA THR 137 HA THR 137 3.212 0.878 -8.524 991 HB THR 137 HB THR 137 4.388 2.189 -10.984 992 HG1 THR 137 HG1 THR 137 2.535 0.880 -11.470 993 1HG2 THR 137 HG21 THR 137 5.211 -0.263 -9.420 994 2HG2 THR 137 HG22 THR 137 6.046 1.291 -9.432 995 3HG2 THR 137 HG23 THR 137 5.975 0.318 -10.901 996 H THR 138 HN THR 138 3.915 1.823 -6.686 997 HA THR 138 HA THR 138 5.061 4.486 -6.801 998 HB THR 138 HB THR 138 4.912 2.637 -4.403 999 HG1 THR 138 HG1 THR 138 2.897 3.638 -5.678 1000 1HG2 THR 138 HG21 THR 138 5.103 4.719 -3.124 1001 2HG2 THR 138 HG22 THR 138 5.257 5.627 -4.628 1002 3HG2 THR 138 HG23 THR 138 6.506 4.473 -4.163 1003 H LYS 139 HN LYS 139 7.085 4.773 -7.341 1004 HA LYS 139 HA LYS 139 8.959 2.517 -7.095 1005 1HB LYS 139 HB2 LYS 139 8.535 3.542 -9.359 1006 2HB LYS 139 HB1 LYS 139 9.240 5.029 -8.753 1007 1HG LYS 139 HG2 LYS 139 10.960 3.968 -9.939 1008 2HG LYS 139 HG1 LYS 139 11.320 3.671 -8.240 1009 1HD LYS 139 HD2 LYS 139 11.659 1.650 -9.543 1010 2HD LYS 139 HD1 LYS 139 10.312 1.443 -8.423 1011 1HE LYS 139 HE2 LYS 139 8.717 1.669 -10.154 1012 2HE LYS 139 HE1 LYS 139 9.929 2.254 -11.294 1013 1HZ LYS 139 HZ1 LYS 139 9.286 -0.081 -11.661 1014 2HZ LYS 139 HZ2 LYS 139 9.904 -0.479 -10.129 1015 3HZ LYS 139 HZ3 LYS 139 10.939 0.100 -11.338 1016 H LEU 140 HN LEU 140 10.569 2.598 -5.743 1017 HA LEU 140 HA LEU 140 11.190 5.183 -4.495 1018 1HB LEU 140 HB2 LEU 140 9.899 4.077 -2.889 1019 2HB LEU 140 HB1 LEU 140 10.619 2.519 -3.242 1020 HG LEU 140 HG LEU 140 12.702 3.241 -2.201 1021 1HD1 LEU 140 HD11 LEU 140 12.549 5.645 -2.642 1022 2HD1 LEU 140 HD12 LEU 140 12.806 5.332 -0.926 1023 3HD1 LEU 140 HD13 LEU 140 11.201 5.770 -1.512 1024 1HD2 LEU 140 HD21 LEU 140 10.273 3.634 -0.465 1025 2HD2 LEU 140 HD22 LEU 140 11.904 3.288 0.113 1026 3HD2 LEU 140 HD23 LEU 140 11.038 2.095 -0.857 1027 H THR 141 HN THR 141 13.100 5.646 -5.372 1028 HA THR 141 HA THR 141 15.165 3.568 -5.531 1029 HB THR 141 HB THR 141 15.320 6.391 -6.601 1030 HG1 THR 141 HG1 THR 141 14.082 4.081 -7.640 1031 1HG2 THR 141 HG21 THR 141 16.809 3.855 -7.306 1032 2HG2 THR 141 HG22 THR 141 17.461 5.230 -6.413 1033 3HG2 THR 141 HG23 THR 141 17.007 5.411 -8.109 1034 H VAL 142 HN VAL 142 17.113 3.749 -4.413 1035 HA VAL 142 HA VAL 142 17.064 5.657 -2.211 1036 HB VAL 142 HB VAL 142 17.454 3.354 -1.595 1037 1HG1 VAL 142 HG11 VAL 142 19.476 2.153 -2.260 1038 2HG1 VAL 142 HG12 VAL 142 19.906 3.481 -3.338 1039 3HG1 VAL 142 HG13 VAL 142 18.452 2.531 -3.645 1040 1HG2 VAL 142 HG21 VAL 142 19.535 3.613 -0.313 1041 2HG2 VAL 142 HG22 VAL 142 18.506 5.043 -0.222 1042 3HG2 VAL 142 HG23 VAL 142 19.928 5.044 -1.267 1043 H THR 143 HN THR 143 17.823 7.580 -2.780 1044 HA THR 143 HA THR 143 20.632 7.806 -3.368 1045 HB THR 143 HB THR 143 18.622 9.014 -5.296 1046 HG1 THR 143 HG1 THR 143 19.750 6.635 -5.299 1047 1HG2 THR 143 HG21 THR 143 20.578 9.860 -6.503 1048 2HG2 THR 143 HG22 THR 143 21.640 9.202 -5.258 1049 3HG2 THR 143 HG23 THR 143 20.524 10.510 -4.864
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