NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
6856 | 1jnt | 5225 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H ALA 1 HT1 ALA 1 -16.419 0.221 -4.303 2 2H ALA 1 HT2 ALA 1 -15.861 -1.035 -5.301 3 3H ALA 1 HT3 ALA 1 -15.011 -0.628 -3.887 4 HA ALA 1 HA ALA 1 -17.661 -1.953 -4.094 5 1HB ALA 1 HB1 ALA 1 -15.985 -3.311 -2.382 6 2HB ALA 1 HB2 ALA 1 -14.842 -2.630 -3.541 7 3HB ALA 1 HB3 ALA 1 -16.155 -3.666 -4.100 8 H LYS 2 HN LYS 2 -18.235 -2.695 -1.702 9 HA LYS 2 HA LYS 2 -18.879 -0.399 -0.135 10 1HB LYS 2 HB2 LYS 2 -18.562 -3.342 0.549 11 2HB LYS 2 HB1 LYS 2 -19.363 -2.166 1.591 12 1HG LYS 2 HG1 LYS 2 -20.970 -1.680 -0.198 13 2HG LYS 2 HG2 LYS 2 -20.180 -2.854 -1.244 14 1HD LYS 2 HD1 LYS 2 -20.679 -4.641 0.388 15 2HD LYS 2 HD2 LYS 2 -21.480 -3.465 1.430 16 1HE LYS 2 HE1 LYS 2 -23.229 -3.101 -0.167 17 2HE LYS 2 HE2 LYS 2 -22.333 -3.951 -1.441 18 1HZ LYS 2 HZ1 LYS 2 -22.610 -5.986 -0.387 19 2HZ LYS 2 HZ2 LYS 2 -24.114 -5.244 -0.115 20 3HZ LYS 2 HZ3 LYS 2 -22.948 -5.288 1.121 21 H THR 3 HN THR 3 -16.516 -2.956 0.526 22 HA THR 3 HA THR 3 -14.655 -0.959 1.716 23 HB THR 3 HB THR 3 -14.555 -2.157 3.802 24 HG1 THR 3 HG1 THR 3 -15.491 -4.133 4.057 25 1HG2 THR 3 HG21 THR 3 -16.564 -0.684 3.419 26 2HG2 THR 3 HG22 THR 3 -16.818 -1.951 4.619 27 3HG2 THR 3 HG23 THR 3 -17.472 -2.134 2.992 28 H ALA 4 HN ALA 4 -12.439 -1.845 1.861 29 HA ALA 4 HA ALA 4 -12.067 -4.362 0.275 30 1HB ALA 4 HB1 ALA 4 -11.584 -2.560 -1.198 31 2HB ALA 4 HB2 ALA 4 -10.005 -3.078 -0.607 32 3HB ALA 4 HB3 ALA 4 -10.772 -1.641 0.070 33 H ALA 5 HN ALA 5 -10.250 -5.628 0.871 34 HA ALA 5 HA ALA 5 -9.114 -5.020 3.567 35 1HB ALA 5 HB1 ALA 5 -8.266 -7.424 3.222 36 2HB ALA 5 HB2 ALA 5 -9.247 -7.444 1.757 37 3HB ALA 5 HB3 ALA 5 -10.016 -7.229 3.330 38 H ALA 6 HN ALA 6 -7.142 -4.002 3.573 39 HA ALA 6 HA ALA 6 -5.446 -4.300 1.114 40 1HB ALA 6 HB1 ALA 6 -5.370 -1.958 0.962 41 2HB ALA 6 HB2 ALA 6 -5.822 -1.742 2.654 42 3HB ALA 6 HB3 ALA 6 -7.028 -2.264 1.478 43 H LEU 7 HN LEU 7 -3.298 -4.479 1.420 44 HA LEU 7 HA LEU 7 -2.142 -4.029 4.153 45 1HB LEU 7 HB1 LEU 7 -1.009 -5.382 1.674 46 2HB LEU 7 HB2 LEU 7 -0.242 -5.330 3.263 47 HG LEU 7 HG LEU 7 -2.915 -6.622 2.633 48 1HD1 LEU 7 HD11 LEU 7 -1.801 -8.563 2.308 49 2HD1 LEU 7 HD12 LEU 7 -0.771 -8.290 3.714 50 3HD1 LEU 7 HD13 LEU 7 -0.345 -7.579 2.156 51 1HD2 LEU 7 HD21 LEU 7 -1.288 -6.482 5.189 52 2HD2 LEU 7 HD22 LEU 7 -2.735 -7.466 4.967 53 3HD2 LEU 7 HD23 LEU 7 -2.846 -5.707 4.903 54 H HIS 8 HN HIS 8 -0.654 -2.286 4.349 55 HA HIS 8 HA HIS 8 -0.065 -0.791 1.809 56 1HB HIS 8 HB1 HIS 8 -1.169 0.235 4.443 57 2HB HIS 8 HB2 HIS 8 -0.531 1.286 3.180 58 HD1 HIS 8 HD1 HIS 8 -2.218 2.091 1.567 59 HD2 HIS 8 HD2 HIS 8 -3.334 -1.564 3.232 60 HE1 HIS 8 HE1 HIS 8 -4.498 1.538 0.615 61 H ILE 9 HN ILE 9 1.982 -0.080 1.624 62 HA ILE 9 HA ILE 9 3.607 0.264 4.114 63 HB ILE 9 HB ILE 9 4.531 -0.584 1.351 64 1HG1 ILE 9 HG11 ILE 9 4.496 -2.115 3.968 65 2HG1 ILE 9 HG12 ILE 9 3.347 -2.352 2.649 66 1HG2 ILE 9 HG21 ILE 9 6.740 -0.651 2.241 67 2HG2 ILE 9 HG22 ILE 9 6.159 -0.437 3.892 68 3HG2 ILE 9 HG23 ILE 9 6.076 0.903 2.747 69 1HD1 ILE 9 HD11 ILE 9 5.349 -3.953 2.704 70 2HD1 ILE 9 HD12 ILE 9 6.336 -2.567 2.239 71 3HD1 ILE 9 HD13 ILE 9 5.050 -3.132 1.172 72 H LEU 10 HN LEU 10 4.091 2.405 4.381 73 HA LEU 10 HA LEU 10 3.840 4.244 2.046 74 1HB LEU 10 HB2 LEU 10 2.658 4.481 4.352 75 2HB LEU 10 HB1 LEU 10 4.241 4.976 4.951 76 HG LEU 10 HG LEU 10 2.556 6.316 2.825 77 1HD1 LEU 10 HD11 LEU 10 3.498 6.933 5.589 78 2HD1 LEU 10 HD12 LEU 10 1.947 7.285 4.826 79 3HD1 LEU 10 HD13 LEU 10 3.359 8.274 4.452 80 1HD2 LEU 10 HD21 LEU 10 4.523 7.885 2.592 81 2HD2 LEU 10 HD22 LEU 10 4.792 6.275 1.923 82 3HD2 LEU 10 HD23 LEU 10 5.485 6.708 3.486 83 H VAL 11 HN VAL 11 5.737 4.760 1.048 84 HA VAL 11 HA VAL 11 8.297 4.528 2.567 85 HB VAL 11 HB VAL 11 8.058 5.059 -0.386 86 1HG1 VAL 11 HG21 VAL 11 10.289 4.849 0.055 87 2HG1 VAL 11 HG22 VAL 11 9.930 3.124 -0.023 88 3HG1 VAL 11 HG23 VAL 11 10.012 3.938 1.540 89 1HG2 VAL 11 HG11 VAL 11 6.519 3.301 -0.332 90 2HG2 VAL 11 HG12 VAL 11 7.271 2.554 1.078 91 3HG2 VAL 11 HG13 VAL 11 8.042 2.430 -0.503 92 H LYS 12 HN LYS 12 9.397 6.377 3.120 93 HA LYS 12 HA LYS 12 8.237 8.976 2.855 94 1HB LYS 12 HB1 LYS 12 9.802 8.330 4.620 95 2HB LYS 12 HB2 LYS 12 11.066 8.034 3.426 96 1HG LYS 12 HG2 LYS 12 10.838 10.458 2.730 97 2HG LYS 12 HG1 LYS 12 9.785 10.688 4.125 98 1HD LYS 12 HD2 LYS 12 11.549 10.088 5.652 99 2HD LYS 12 HD1 LYS 12 12.588 9.560 4.328 100 1HE LYS 12 HE1 LYS 12 13.018 11.763 3.621 101 2HE LYS 12 HE2 LYS 12 11.565 12.400 4.414 102 1HZ LYS 12 HZ1 LYS 12 13.142 12.934 5.968 103 2HZ LYS 12 HZ2 LYS 12 14.141 11.614 5.586 104 3HZ LYS 12 HZ3 LYS 12 12.736 11.380 6.513 105 H GLU 13 HN GLU 13 10.818 7.346 1.010 106 HA GLU 13 HA GLU 13 10.589 9.497 -1.058 107 1HB GLU 13 HB1 GLU 13 13.088 9.509 -1.097 108 2HB GLU 13 HB2 GLU 13 12.435 10.004 0.465 109 1HG GLU 13 HG1 GLU 13 12.766 7.714 1.329 110 2HG GLU 13 HG2 GLU 13 13.419 7.221 -0.233 111 H GLU 14 HN GLU 14 11.347 8.823 -3.172 112 HA GLU 14 HA GLU 14 10.507 6.241 -3.965 113 1HB GLU 14 HB2 GLU 14 10.689 8.275 -5.376 114 2HB GLU 14 HB1 GLU 14 12.447 8.163 -5.291 115 1HG GLU 14 HG1 GLU 14 12.356 5.941 -6.367 116 2HG GLU 14 HG2 GLU 14 10.597 6.056 -6.450 117 H LYS 15 HN LYS 15 13.785 7.463 -3.265 118 HA LYS 15 HA LYS 15 15.345 5.337 -4.198 119 1HB LYS 15 HB1 LYS 15 15.582 7.057 -1.710 120 2HB LYS 15 HB2 LYS 15 16.895 6.060 -2.336 121 1HG LYS 15 HG2 LYS 15 16.798 7.280 -4.482 122 2HG LYS 15 HG1 LYS 15 15.486 8.277 -3.853 123 1HD LYS 15 HD2 LYS 15 16.965 9.105 -2.062 124 2HD LYS 15 HD1 LYS 15 18.280 8.106 -2.681 125 1HE LYS 15 HE1 LYS 15 18.831 9.926 -3.943 126 2HE LYS 15 HE2 LYS 15 17.418 9.511 -4.932 127 1HZ LYS 15 HZ1 LYS 15 17.535 11.331 -2.589 128 2HZ LYS 15 HZ2 LYS 15 16.071 10.735 -3.213 129 3HZ LYS 15 HZ3 LYS 15 17.072 11.715 -4.175 130 H LEU 16 HN LEU 16 13.707 5.590 -1.026 131 HA LEU 16 HA LEU 16 14.551 2.975 -0.096 132 1HB LEU 16 HB2 LEU 16 13.592 5.085 1.135 133 2HB LEU 16 HB1 LEU 16 12.021 4.397 0.720 134 HG LEU 16 HG LEU 16 13.981 2.495 1.874 135 1HD1 LEU 16 HD11 LEU 16 13.048 4.957 3.289 136 2HD1 LEU 16 HD12 LEU 16 14.558 4.065 3.469 137 3HD1 LEU 16 HD13 LEU 16 13.077 3.447 4.200 138 1HD2 LEU 16 HD21 LEU 16 11.474 2.170 1.269 139 2HD2 LEU 16 HD22 LEU 16 11.154 3.054 2.761 140 3HD2 LEU 16 HD23 LEU 16 12.045 1.532 2.811 141 H ALA 17 HN ALA 17 11.688 4.230 -1.800 142 HA ALA 17 HA ALA 17 10.160 1.813 -1.920 143 1HB ALA 17 HB1 ALA 17 8.943 2.998 -3.585 144 2HB ALA 17 HB2 ALA 17 10.369 3.903 -4.094 145 3HB ALA 17 HB3 ALA 17 9.602 4.263 -2.547 146 H LEU 18 HN LEU 18 12.759 3.098 -4.000 147 HA LEU 18 HA LEU 18 12.740 1.046 -6.002 148 1HB LEU 18 HB2 LEU 18 14.291 3.302 -5.169 149 2HB LEU 18 HB1 LEU 18 15.395 1.944 -5.379 150 HG LEU 18 HG LEU 18 13.472 2.006 -7.542 151 1HD1 LEU 18 HD21 LEU 18 14.868 4.207 -8.376 152 2HD1 LEU 18 HD22 LEU 18 14.618 4.584 -6.671 153 3HD1 LEU 18 HD23 LEU 18 13.234 4.264 -7.716 154 1HD2 LEU 18 HD11 LEU 18 15.927 2.549 -8.618 155 2HD2 LEU 18 HD12 LEU 18 15.372 0.930 -8.191 156 3HD2 LEU 18 HD13 LEU 18 16.383 1.840 -7.069 157 H ASP 19 HN ASP 19 14.526 1.331 -2.924 158 HA ASP 19 HA ASP 19 15.797 -1.244 -3.001 159 1HB ASP 19 HB2 ASP 19 16.302 0.674 -1.469 160 2HB ASP 19 HB1 ASP 19 14.770 0.379 -0.646 161 H LEU 20 HN LEU 20 12.608 -0.153 -1.828 162 HA LEU 20 HA LEU 20 11.777 -2.677 -0.726 163 1HB LEU 20 HB1 LEU 20 10.075 -1.331 -0.089 164 2HB LEU 20 HB2 LEU 20 10.858 -0.027 -0.979 165 HG LEU 20 HG LEU 20 9.632 -0.838 -3.046 166 1HD1 LEU 20 HD11 LEU 20 8.399 -2.724 -2.966 167 2HD1 LEU 20 HD12 LEU 20 7.507 -2.130 -1.566 168 3HD1 LEU 20 HD13 LEU 20 9.024 -3.001 -1.340 169 1HD2 LEU 20 HD21 LEU 20 8.807 0.800 -0.948 170 2HD2 LEU 20 HD22 LEU 20 7.411 -0.231 -1.260 171 3HD2 LEU 20 HD23 LEU 20 8.098 0.742 -2.561 172 H LEU 21 HN LEU 21 11.296 -1.182 -3.927 173 HA LEU 21 HA LEU 21 9.610 -3.139 -5.075 174 1HB LEU 21 HB2 LEU 21 11.646 -1.155 -6.040 175 2HB LEU 21 HB1 LEU 21 10.934 -2.274 -7.203 176 HG LEU 21 HG LEU 21 8.845 -1.220 -5.536 177 1HD1 LEU 21 HD11 LEU 21 10.975 0.668 -6.177 178 2HD1 LEU 21 HD12 LEU 21 9.564 0.888 -5.143 179 3HD1 LEU 21 HD13 LEU 21 9.435 1.155 -6.882 180 1HD2 LEU 21 HD21 LEU 21 8.655 -0.114 -8.103 181 2HD2 LEU 21 HD22 LEU 21 7.936 -1.631 -7.561 182 3HD2 LEU 21 HD23 LEU 21 9.521 -1.633 -8.336 183 H GLU 22 HN GLU 22 13.181 -2.913 -5.307 184 HA GLU 22 HA GLU 22 13.574 -5.414 -6.642 185 1HB GLU 22 HB1 GLU 22 15.215 -3.582 -6.492 186 2HB GLU 22 HB2 GLU 22 15.345 -3.833 -4.751 187 1HG GLU 22 HG2 GLU 22 16.164 -6.128 -5.144 188 2HG GLU 22 HG1 GLU 22 16.034 -5.879 -6.884 189 H GLN 23 HN GLN 23 13.504 -4.569 -3.186 190 HA GLN 23 HA GLN 23 14.577 -6.935 -2.131 191 1HB GLN 23 HB2 GLN 23 14.011 -4.717 -1.024 192 2HB GLN 23 HB1 GLN 23 12.345 -5.286 -0.918 193 1HG GLN 23 HG1 GLN 23 13.354 -5.846 1.175 194 2HG GLN 23 HG2 GLN 23 13.278 -7.355 0.263 195 1HE2 GLN 23 HE21 GLN 23 15.236 -8.473 0.077 196 2HE2 GLN 23 HE22 GLN 23 16.770 -7.790 0.330 197 H ILE 24 HN ILE 24 11.150 -6.221 -2.860 198 HA ILE 24 HA ILE 24 10.041 -8.571 -1.690 199 HB ILE 24 HB ILE 24 9.148 -6.852 -4.028 200 1HG1 ILE 24 HG11 ILE 24 8.281 -6.709 -1.134 201 2HG1 ILE 24 HG12 ILE 24 9.637 -5.767 -1.753 202 1HG2 ILE 24 HG21 ILE 24 8.039 -9.254 -2.939 203 2HG2 ILE 24 HG22 ILE 24 7.357 -8.207 -4.184 204 3HG2 ILE 24 HG23 ILE 24 6.989 -7.912 -2.484 205 1HD1 ILE 24 HD11 ILE 24 6.857 -5.708 -2.959 206 2HD1 ILE 24 HD12 ILE 24 8.211 -4.650 -3.356 207 3HD1 ILE 24 HD13 ILE 24 7.437 -4.535 -1.776 208 H LYS 25 HN LYS 25 10.976 -7.954 -5.104 209 HA LYS 25 HA LYS 25 10.319 -10.579 -6.058 210 1HB LYS 25 HB2 LYS 25 12.244 -8.403 -6.907 211 2HB LYS 25 HB1 LYS 25 12.008 -9.871 -7.856 212 1HG LYS 25 HG1 LYS 25 9.703 -9.373 -8.230 213 2HG LYS 25 HG2 LYS 25 9.701 -8.112 -6.997 214 1HD LYS 25 HD2 LYS 25 10.654 -6.570 -8.390 215 2HD LYS 25 HD1 LYS 25 11.680 -7.768 -9.179 216 1HE LYS 25 HE1 LYS 25 8.945 -8.375 -9.813 217 2HE LYS 25 HE2 LYS 25 9.243 -6.661 -10.160 218 1HZ LYS 25 HZ1 LYS 25 10.108 -7.638 -12.039 219 2HZ LYS 25 HZ2 LYS 25 10.601 -9.045 -11.224 220 3HZ LYS 25 HZ3 LYS 25 11.492 -7.608 -11.058 221 H ASN 26 HN ASN 26 13.470 -9.191 -5.042 222 HA ASN 26 HA ASN 26 14.981 -11.610 -5.231 223 1HB ASN 26 HB2 ASN 26 15.214 -9.080 -3.586 224 2HB ASN 26 HB1 ASN 26 16.462 -10.325 -3.592 225 1HD2 ASN 26 HD21 ASN 26 16.957 -11.050 -6.073 226 2HD2 ASN 26 HD22 ASN 26 17.208 -9.748 -7.132 227 H GLY 27 HN GLY 27 13.146 -10.194 -2.511 228 1HA GLY 27 HA2 GLY 27 13.703 -12.669 -0.939 229 2HA GLY 27 HA1 GLY 27 13.190 -11.128 -0.247 230 H ALA 28 HN ALA 28 10.989 -10.369 -1.245 231 HA ALA 28 HA ALA 28 8.766 -10.835 -1.961 232 1HB ALA 28 HB1 ALA 28 9.979 -12.950 -2.931 233 2HB ALA 28 HB2 ALA 28 8.227 -12.972 -2.734 234 3HB ALA 28 HB3 ALA 28 9.257 -13.768 -1.545 235 H ASP 29 HN ASP 29 7.929 -9.906 -0.106 236 HA ASP 29 HA ASP 29 6.568 -11.604 1.776 237 1HB ASP 29 HB2 ASP 29 9.354 -10.997 2.203 238 2HB ASP 29 HB1 ASP 29 8.393 -10.273 3.496 239 H PHE 30 HN PHE 30 4.986 -9.974 0.968 240 HA PHE 30 HA PHE 30 5.366 -7.162 1.290 241 1HB PHE 30 HB1 PHE 30 3.175 -9.073 0.689 242 2HB PHE 30 HB2 PHE 30 2.667 -7.484 1.267 243 HD1 PHE 30 HD1 PHE 30 4.259 -9.341 -1.477 244 HD2 PHE 30 HD2 PHE 30 3.294 -5.434 0.035 245 HE1 PHE 30 HE1 PHE 30 4.724 -8.364 -3.705 246 HE2 PHE 30 HE2 PHE 30 3.759 -4.459 -2.197 247 HZ PHE 30 HZ PHE 30 4.474 -5.923 -4.067 248 H GLY 31 HN GLY 31 3.695 -9.543 3.378 249 1HA GLY 31 HA1 GLY 31 2.808 -7.625 5.316 250 2HA GLY 31 HA2 GLY 31 2.981 -9.355 5.608 251 H LYS 32 HN LYS 32 5.652 -9.811 5.339 252 HA LYS 32 HA LYS 32 6.705 -8.799 7.804 253 1HB LYS 32 HB2 LYS 32 7.872 -10.285 5.444 254 2HB LYS 32 HB1 LYS 32 8.813 -9.930 6.894 255 1HG LYS 32 HG1 LYS 32 6.931 -11.019 8.227 256 2HG LYS 32 HG2 LYS 32 6.284 -11.582 6.686 257 1HD LYS 32 HD2 LYS 32 8.099 -13.000 6.292 258 2HD LYS 32 HD1 LYS 32 9.169 -12.088 7.356 259 1HE LYS 32 HE1 LYS 32 6.747 -13.429 8.536 260 2HE LYS 32 HE2 LYS 32 8.194 -14.395 8.189 261 1HZ LYS 32 HZ1 LYS 32 7.967 -13.058 10.432 262 2HZ LYS 32 HZ2 LYS 32 8.531 -11.776 9.471 263 3HZ LYS 32 HZ3 LYS 32 9.462 -13.186 9.642 264 H LEU 33 HN LEU 33 7.305 -7.851 4.412 265 HA LEU 33 HA LEU 33 9.462 -6.044 4.932 266 1HB LEU 33 HB2 LEU 33 7.309 -6.240 2.816 267 2HB LEU 33 HB1 LEU 33 8.587 -5.023 2.744 268 HG LEU 33 HG LEU 33 9.126 -7.993 3.019 269 1HD1 LEU 33 HD11 LEU 33 9.012 -6.223 0.562 270 2HD1 LEU 33 HD12 LEU 33 8.051 -7.667 0.880 271 3HD1 LEU 33 HD13 LEU 33 9.784 -7.808 0.586 272 1HD2 LEU 33 HD21 LEU 33 11.215 -7.253 3.431 273 2HD2 LEU 33 HD22 LEU 33 10.722 -5.583 3.152 274 3HD2 LEU 33 HD23 LEU 33 11.246 -6.586 1.799 275 H ALA 34 HN ALA 34 5.919 -5.572 4.952 276 HA ALA 34 HA ALA 34 5.919 -2.748 5.458 277 1HB ALA 34 HB1 ALA 34 3.642 -3.156 6.108 278 2HB ALA 34 HB2 ALA 34 4.002 -4.822 6.560 279 3HB ALA 34 HB3 ALA 34 4.005 -4.349 4.860 280 H LYS 35 HN LYS 35 6.066 -5.574 7.626 281 HA LYS 35 HA LYS 35 6.083 -4.198 10.132 282 1HB LYS 35 HB1 LYS 35 5.752 -6.588 9.905 283 2HB LYS 35 HB2 LYS 35 7.323 -6.778 9.130 284 1HG LYS 35 HG1 LYS 35 8.438 -6.045 11.210 285 2HG LYS 35 HG2 LYS 35 6.863 -5.859 11.985 286 1HD LYS 35 HD1 LYS 35 6.423 -8.199 11.884 287 2HD LYS 35 HD2 LYS 35 7.737 -8.473 10.741 288 1HE LYS 35 HE1 LYS 35 8.360 -9.191 13.048 289 2HE LYS 35 HE2 LYS 35 9.384 -7.854 12.492 290 1HZ LYS 35 HZ1 LYS 35 8.373 -7.533 14.750 291 2HZ LYS 35 HZ2 LYS 35 6.851 -7.468 13.998 292 3HZ LYS 35 HZ3 LYS 35 8.029 -6.296 13.642 293 H LYS 36 HN LYS 36 8.789 -5.220 8.024 294 HA LYS 36 HA LYS 36 10.862 -4.371 9.793 295 1HB LYS 36 HB2 LYS 36 11.112 -6.042 8.028 296 2HB LYS 36 HB1 LYS 36 10.782 -4.823 6.797 297 1HG LYS 36 HG1 LYS 36 12.794 -3.573 7.494 298 2HG LYS 36 HG2 LYS 36 13.124 -4.792 8.727 299 1HD LYS 36 HD1 LYS 36 13.418 -6.504 7.027 300 2HD LYS 36 HD2 LYS 36 12.924 -5.382 5.758 301 1HE LYS 36 HE2 LYS 36 14.890 -3.960 6.243 302 2HE LYS 36 HE1 LYS 36 15.386 -5.085 7.521 303 1HZ LYS 36 HZ1 LYS 36 15.660 -6.814 5.973 304 2HZ LYS 36 HZ2 LYS 36 16.375 -5.467 5.224 305 3HZ LYS 36 HZ3 LYS 36 14.827 -5.983 4.751 306 H HIS 37 HN HIS 37 9.376 -2.721 6.994 307 HA HIS 37 HA HIS 37 11.333 -0.526 7.287 308 1HB HIS 37 HB1 HIS 37 9.360 -1.449 5.200 309 2HB HIS 37 HB2 HIS 37 10.220 0.081 5.037 310 HD1 HIS 37 HD1 HIS 37 12.968 -0.205 5.363 311 HD2 HIS 37 HD2 HIS 37 10.811 -3.583 4.215 312 HE1 HIS 37 HE1 HIS 37 14.647 -1.828 4.383 313 H SER 38 HN SER 38 7.899 -1.062 7.792 314 HA SER 38 HA SER 38 6.928 1.576 7.459 315 1HB SER 38 HB1 SER 38 5.587 -0.489 7.763 316 2HB SER 38 HB2 SER 38 6.102 -0.562 9.449 317 HG SER 38 HG SER 38 4.582 1.466 8.187 318 H ILE 39 HN ILE 39 8.297 0.017 10.369 319 HA ILE 39 HA ILE 39 8.866 0.997 12.470 320 HB ILE 39 HB ILE 39 10.698 1.367 10.769 321 1HG1 ILE 39 HG12 ILE 39 10.513 3.654 12.737 322 2HG1 ILE 39 HG11 ILE 39 10.800 1.993 13.254 323 1HG2 ILE 39 HG21 ILE 39 10.923 3.869 10.136 324 2HG2 ILE 39 HG22 ILE 39 9.202 3.975 10.506 325 3HG2 ILE 39 HG23 ILE 39 9.765 2.897 9.229 326 1HD1 ILE 39 HD11 ILE 39 12.993 2.399 12.877 327 2HD1 ILE 39 HD12 ILE 39 12.640 3.892 12.007 328 3HD1 ILE 39 HD13 ILE 39 12.598 2.346 11.159 329 H CYS 40 HN CYS 40 6.244 1.969 11.345 330 HA CYS 40 HA CYS 40 6.226 4.680 12.635 331 1HB CYS 40 HB1 CYS 40 4.717 5.386 10.918 332 2HB CYS 40 HB2 CYS 40 5.980 4.479 10.083 333 HG CYS 40 HG CYS 40 3.532 3.666 9.344 334 HA PRO 41 HA PRO 41 3.005 3.452 15.319 335 1HB PRO 41 HB2 PRO 41 1.148 5.491 14.241 336 2HB PRO 41 HB1 PRO 41 1.819 5.338 15.873 337 1HG PRO 41 HG1 PRO 41 2.606 7.245 14.134 338 2HG PRO 41 HG2 PRO 41 3.679 6.557 15.360 339 1HD PRO 41 HD1 PRO 41 3.607 6.086 12.429 340 2HD PRO 41 HD2 PRO 41 4.984 6.056 13.550 341 H SER 42 HN SER 42 2.275 3.810 11.933 342 HA SER 42 HA SER 42 -0.022 1.918 12.175 343 1HB SER 42 HB2 SER 42 0.161 2.787 9.545 344 2HB SER 42 HB1 SER 42 -0.879 3.497 10.781 345 HG SER 42 HG SER 42 0.272 5.208 10.381 346 H GLY 43 HN GLY 43 2.924 1.258 12.345 347 1HA GLY 43 HA1 GLY 43 3.483 -0.251 9.893 348 2HA GLY 43 HA2 GLY 43 4.399 -0.346 11.400 349 H LYS 44 HN LYS 44 2.718 -1.142 13.275 350 HA LYS 44 HA LYS 44 2.044 -3.878 12.728 351 1HB LYS 44 HB2 LYS 44 1.239 -1.882 14.858 352 2HB LYS 44 HB1 LYS 44 0.782 -3.585 14.921 353 1HG LYS 44 HG1 LYS 44 3.195 -4.200 14.777 354 2HG LYS 44 HG2 LYS 44 3.608 -2.486 14.823 355 1HD LYS 44 HD1 LYS 44 2.625 -2.249 17.027 356 2HD LYS 44 HD2 LYS 44 2.002 -3.897 16.972 357 1HE LYS 44 HE2 LYS 44 4.963 -3.241 16.796 358 2HE LYS 44 HE1 LYS 44 4.140 -3.658 18.311 359 1HZ LYS 44 HZ1 LYS 44 4.010 -5.794 17.707 360 2HZ LYS 44 HZ2 LYS 44 5.105 -5.437 16.459 361 3HZ LYS 44 HZ3 LYS 44 3.434 -5.413 16.159 362 H ARG 45 HN ARG 45 0.087 -0.881 12.720 363 HA ARG 45 HA ARG 45 -2.330 -2.467 12.065 364 1HB ARG 45 HB2 ARG 45 -2.714 -0.852 13.713 365 2HB ARG 45 HB1 ARG 45 -1.664 0.335 12.940 366 1HG ARG 45 HG2 ARG 45 -4.057 0.930 12.690 367 2HG ARG 45 HG1 ARG 45 -3.300 0.617 11.128 368 1HD ARG 45 HD1 ARG 45 -4.574 -1.252 10.753 369 2HD ARG 45 HD2 ARG 45 -4.500 -1.757 12.452 370 HE ARG 45 HE ARG 45 -6.503 0.038 11.273 371 1HH1 ARG 45 HH11 ARG 45 -4.795 -0.973 14.100 372 2HH1 ARG 45 HH12 ARG 45 -6.026 -0.437 15.193 373 1HH2 ARG 45 HH21 ARG 45 -8.115 0.742 12.691 374 2HH2 ARG 45 HH22 ARG 45 -7.902 0.533 14.397 375 H GLY 46 HN GLY 46 -0.411 0.187 10.628 376 1HA GLY 46 HA2 GLY 46 -1.949 0.460 8.235 377 2HA GLY 46 HA1 GLY 46 -0.257 0.924 8.406 378 H GLY 47 HN GLY 47 0.707 -1.708 9.130 379 1HA GLY 47 HA2 GLY 47 1.036 -2.838 6.490 380 2HA GLY 47 HA1 GLY 47 1.617 -3.553 7.984 381 H ASP 48 HN ASP 48 -1.581 -2.928 8.476 382 HA ASP 48 HA ASP 48 -2.840 -5.086 7.011 383 1HB ASP 48 HB2 ASP 48 -1.356 -6.324 8.588 384 2HB ASP 48 HB1 ASP 48 -2.142 -5.505 9.940 385 H LEU 49 HN LEU 49 -4.133 -3.048 6.820 386 HA LEU 49 HA LEU 49 -5.450 -1.971 9.192 387 1HB LEU 49 HB1 LEU 49 -5.733 -1.549 6.201 388 2HB LEU 49 HB2 LEU 49 -6.567 -0.572 7.410 389 HG LEU 49 HG LEU 49 -3.629 -0.895 7.767 390 1HD1 LEU 49 HD11 LEU 49 -2.956 0.331 5.951 391 2HD1 LEU 49 HD12 LEU 49 -4.452 1.263 5.897 392 3HD1 LEU 49 HD13 LEU 49 -4.404 -0.367 5.226 393 1HD2 LEU 49 HD21 LEU 49 -5.797 1.062 8.326 394 2HD2 LEU 49 HD22 LEU 49 -4.193 1.731 8.028 395 3HD2 LEU 49 HD23 LEU 49 -4.435 0.572 9.334 396 H GLY 50 HN GLY 50 -6.011 -4.702 7.322 397 1HA GLY 50 HA2 GLY 50 -7.849 -6.173 7.245 398 2HA GLY 50 HA1 GLY 50 -8.650 -5.150 8.439 399 H GLU 51 HN GLU 51 -10.632 -4.782 7.477 400 HA GLU 51 HA GLU 51 -10.668 -3.882 4.631 401 1HB GLU 51 HB2 GLU 51 -12.414 -5.394 6.455 402 2HB GLU 51 HB1 GLU 51 -13.273 -4.224 5.452 403 1HG GLU 51 HG2 GLU 51 -12.683 -5.280 3.475 404 2HG GLU 51 HG1 GLU 51 -11.206 -5.960 4.156 405 H PHE 52 HN PHE 52 -11.239 -1.813 4.133 406 HA PHE 52 HA PHE 52 -12.682 -0.136 6.120 407 1HB PHE 52 HB1 PHE 52 -10.906 1.639 5.779 408 2HB PHE 52 HB2 PHE 52 -10.340 0.213 6.649 409 HD1 PHE 52 HD1 PHE 52 -8.328 -0.736 5.957 410 HD2 PHE 52 HD2 PHE 52 -10.722 1.405 3.103 411 HE1 PHE 52 HE1 PHE 52 -6.596 -1.108 4.224 412 HE2 PHE 52 HE2 PHE 52 -8.995 1.028 1.372 413 HZ PHE 52 HZ PHE 52 -6.929 -0.223 1.930 414 H ARG 53 HN ARG 53 -13.538 1.846 5.068 415 HA ARG 53 HA ARG 53 -14.209 1.329 2.238 416 1HB ARG 53 HB2 ARG 53 -15.800 3.224 2.680 417 2HB ARG 53 HB1 ARG 53 -15.966 1.891 3.821 418 1HG ARG 53 HG1 ARG 53 -14.839 3.076 5.539 419 2HG ARG 53 HG2 ARG 53 -14.185 4.259 4.405 420 1HD ARG 53 HD2 ARG 53 -17.164 3.991 4.617 421 2HD ARG 53 HD1 ARG 53 -16.299 4.877 5.886 422 HE ARG 53 HE ARG 53 -15.177 6.083 3.843 423 1HH1 ARG 53 HH11 ARG 53 -18.428 4.883 3.969 424 2HH1 ARG 53 HH12 ARG 53 -19.011 6.002 2.787 425 1HH2 ARG 53 HH21 ARG 53 -15.945 7.537 2.314 426 2HH2 ARG 53 HH22 ARG 53 -17.615 7.501 1.856 427 H GLN 54 HN GLN 54 -14.248 3.330 0.766 428 HA GLN 54 HA GLN 54 -11.607 4.260 0.332 429 1HB GLN 54 HB2 GLN 54 -12.686 5.648 -1.369 430 2HB GLN 54 HB1 GLN 54 -13.494 4.081 -1.307 431 1HG GLN 54 HG2 GLN 54 -15.200 5.086 0.233 432 2HG GLN 54 HG1 GLN 54 -14.433 6.655 -0.004 433 1HE2 GLN 54 HE21 GLN 54 -16.115 7.672 -1.219 434 2HE2 GLN 54 HE22 GLN 54 -16.625 7.116 -2.740 435 H GLY 55 HN GLY 55 -13.967 5.400 2.558 436 1HA GLY 55 HA2 GLY 55 -12.736 8.105 2.673 437 2HA GLY 55 HA1 GLY 55 -14.280 7.653 3.393 438 H GLN 56 HN GLN 56 -10.864 6.537 3.648 439 HA GLN 56 HA GLN 56 -11.170 6.737 6.631 440 1HB GLN 56 HB2 GLN 56 -9.539 4.611 5.253 441 2HB GLN 56 HB1 GLN 56 -10.200 4.600 6.886 442 1HG GLN 56 HG1 GLN 56 -12.177 4.733 4.659 443 2HG GLN 56 HG2 GLN 56 -11.333 3.207 4.890 444 1HE2 GLN 56 HE21 GLN 56 -13.595 5.482 6.365 445 2HE2 GLN 56 HE22 GLN 56 -14.079 4.451 7.634 446 H MET 57 HN MET 57 -8.733 5.914 4.198 447 HA MET 57 HA MET 57 -6.742 7.299 5.865 448 1HB MET 57 HB2 MET 57 -6.916 4.817 4.803 449 2HB MET 57 HB1 MET 57 -5.964 5.615 3.552 450 1HG MET 57 HG2 MET 57 -4.264 6.244 5.119 451 2HG MET 57 HG1 MET 57 -5.277 5.798 6.495 452 1HE MET 57 HE1 MET 57 -2.824 4.047 3.579 453 2HE MET 57 HE2 MET 57 -4.428 4.632 3.147 454 3HE MET 57 HE3 MET 57 -4.126 2.900 3.234 455 H VAL 58 HN VAL 58 -6.999 6.788 2.329 456 HA VAL 58 HA VAL 58 -6.220 9.627 1.845 457 HB VAL 58 HB VAL 58 -4.165 8.463 2.339 458 1HG1 VAL 58 HG21 VAL 58 -3.635 6.402 0.853 459 2HG1 VAL 58 HG22 VAL 58 -5.375 6.349 0.572 460 3HG1 VAL 58 HG23 VAL 58 -4.742 6.187 2.209 461 1HG2 VAL 58 HG11 VAL 58 -4.155 8.254 -0.642 462 2HG2 VAL 58 HG12 VAL 58 -2.954 8.967 0.434 463 3HG2 VAL 58 HG13 VAL 58 -4.448 9.833 0.087 464 HA PRO 59 HA PRO 59 -8.881 9.052 -1.644 465 1HB PRO 59 HB2 PRO 59 -7.663 11.010 -3.237 466 2HB PRO 59 HB1 PRO 59 -8.959 11.296 -2.062 467 1HG PRO 59 HG1 PRO 59 -6.034 11.725 -1.806 468 2HG PRO 59 HG2 PRO 59 -7.377 12.634 -1.099 469 1HD PRO 59 HD2 PRO 59 -5.856 10.915 0.338 470 2HD PRO 59 HD1 PRO 59 -7.574 11.197 0.690 471 H ALA 60 HN ALA 60 -5.442 9.640 -2.477 472 HA ALA 60 HA ALA 60 -5.111 8.487 -4.926 473 1HB ALA 60 HB1 ALA 60 -2.907 7.774 -4.113 474 2HB ALA 60 HB2 ALA 60 -3.487 7.821 -2.448 475 3HB ALA 60 HB3 ALA 60 -3.340 9.315 -3.373 476 H PHE 61 HN PHE 61 -6.001 6.757 -1.980 477 HA PHE 61 HA PHE 61 -5.618 4.061 -2.833 478 1HB PHE 61 HB2 PHE 61 -6.151 4.638 -0.550 479 2HB PHE 61 HB1 PHE 61 -7.645 5.434 -1.047 480 HD1 PHE 61 HD1 PHE 61 -9.605 4.155 -1.723 481 HD2 PHE 61 HD2 PHE 61 -5.977 2.185 -0.530 482 HE1 PHE 61 HE1 PHE 61 -10.831 2.007 -1.545 483 HE2 PHE 61 HE2 PHE 61 -7.205 0.036 -0.350 484 HZ PHE 61 HZ PHE 61 -9.632 -0.052 -0.859 485 H ASP 62 HN ASP 62 -8.326 6.324 -3.341 486 HA ASP 62 HA ASP 62 -10.091 4.537 -4.728 487 1HB ASP 62 HB1 ASP 62 -10.680 6.773 -3.846 488 2HB ASP 62 HB2 ASP 62 -9.588 7.520 -5.011 489 H LYS 63 HN LYS 63 -7.403 6.607 -5.841 490 HA LYS 63 HA LYS 63 -7.748 6.208 -8.639 491 1HB LYS 63 HB1 LYS 63 -5.304 6.668 -6.904 492 2HB LYS 63 HB2 LYS 63 -5.275 6.765 -8.665 493 1HG LYS 63 HG1 LYS 63 -7.034 8.513 -8.583 494 2HG LYS 63 HG2 LYS 63 -7.014 8.434 -6.821 495 1HD LYS 63 HD2 LYS 63 -4.598 9.049 -6.853 496 2HD LYS 63 HD1 LYS 63 -4.689 9.213 -8.607 497 1HE LYS 63 HE1 LYS 63 -6.217 10.848 -6.550 498 2HE LYS 63 HE2 LYS 63 -4.970 11.430 -7.668 499 1HZ LYS 63 HZ1 LYS 63 -7.731 10.611 -8.216 500 2HZ LYS 63 HZ2 LYS 63 -6.560 10.258 -9.396 501 3HZ LYS 63 HZ3 LYS 63 -6.823 11.864 -8.909 502 H VAL 64 HN VAL 64 -5.641 4.383 -6.363 503 HA VAL 64 HA VAL 64 -4.814 2.471 -8.368 504 HB VAL 64 HB VAL 64 -3.496 2.966 -6.364 505 1HG1 VAL 64 HG21 VAL 64 -5.573 1.515 -4.721 506 2HG1 VAL 64 HG22 VAL 64 -5.624 3.263 -4.919 507 3HG1 VAL 64 HG23 VAL 64 -4.231 2.507 -4.157 508 1HG2 VAL 64 HG11 VAL 64 -2.689 0.848 -6.262 509 2HG2 VAL 64 HG12 VAL 64 -3.963 0.468 -7.421 510 3HG2 VAL 64 HG13 VAL 64 -4.229 0.196 -5.699 511 H VAL 65 HN VAL 65 -7.221 2.255 -5.704 512 HA VAL 65 HA VAL 65 -8.138 -0.382 -6.223 513 HB VAL 65 HB VAL 65 -8.773 1.745 -4.565 514 1HG1 VAL 65 HG21 VAL 65 -10.310 2.752 -6.151 515 2HG1 VAL 65 HG22 VAL 65 -11.255 2.010 -4.862 516 3HG1 VAL 65 HG23 VAL 65 -11.108 1.203 -6.423 517 1HG2 VAL 65 HG11 VAL 65 -9.992 -0.961 -5.070 518 2HG2 VAL 65 HG12 VAL 65 -10.646 0.087 -3.810 519 3HG2 VAL 65 HG13 VAL 65 -8.965 -0.439 -3.734 520 H PHE 66 HN PHE 66 -8.681 2.637 -7.929 521 HA PHE 66 HA PHE 66 -10.556 1.319 -9.837 522 1HB PHE 66 HB1 PHE 66 -9.721 4.115 -9.123 523 2HB PHE 66 HB2 PHE 66 -10.412 3.815 -10.720 524 HD1 PHE 66 HD1 PHE 66 -11.422 5.225 -7.932 525 HD2 PHE 66 HD2 PHE 66 -12.350 1.654 -10.131 526 HE1 PHE 66 HE1 PHE 66 -13.693 5.201 -6.934 527 HE2 PHE 66 HE2 PHE 66 -14.620 1.628 -9.132 528 HZ PHE 66 HZ PHE 66 -15.292 3.402 -7.534 529 H SER 67 HN SER 67 -7.317 1.504 -9.381 530 HA SER 67 HA SER 67 -6.568 1.833 -12.238 531 1HB SER 67 HB1 SER 67 -5.288 2.889 -10.331 532 2HB SER 67 HB2 SER 67 -4.874 1.264 -9.786 533 HG SER 67 HG SER 67 -3.971 2.700 -11.976 534 H CYS 68 HN CYS 68 -5.541 -0.462 -9.696 535 HA CYS 68 HA CYS 68 -5.925 -2.697 -11.661 536 1HB CYS 68 HB2 CYS 68 -4.271 -2.473 -9.122 537 2HB CYS 68 HB1 CYS 68 -4.321 -3.884 -10.181 538 HG CYS 68 HG CYS 68 -2.571 -1.521 -10.639 539 HA PRO 69 HA PRO 69 -9.333 -3.984 -9.182 540 1HB PRO 69 HB1 PRO 69 -9.430 -6.610 -9.994 541 2HB PRO 69 HB2 PRO 69 -10.042 -5.257 -10.964 542 1HG PRO 69 HG2 PRO 69 -7.498 -6.775 -11.206 543 2HG PRO 69 HG1 PRO 69 -8.524 -6.083 -12.469 544 1HD PRO 69 HD2 PRO 69 -6.182 -4.955 -11.597 545 2HD PRO 69 HD1 PRO 69 -7.510 -4.039 -12.339 546 H VAL 70 HN VAL 70 -9.819 -5.604 -7.447 547 HA VAL 70 HA VAL 70 -7.732 -5.938 -5.553 548 HB VAL 70 HB VAL 70 -10.142 -5.968 -5.065 549 1HG1 VAL 70 HG11 VAL 70 -10.090 -7.992 -7.151 550 2HG1 VAL 70 HG12 VAL 70 -11.462 -7.092 -6.505 551 3HG1 VAL 70 HG13 VAL 70 -10.930 -8.577 -5.714 552 1HG2 VAL 70 HG21 VAL 70 -8.809 -8.614 -4.413 553 2HG2 VAL 70 HG22 VAL 70 -10.197 -7.931 -3.568 554 3HG2 VAL 70 HG23 VAL 70 -8.632 -7.121 -3.492 555 H LEU 71 HN LEU 71 -7.017 -8.181 -4.747 556 HA LEU 71 HA LEU 71 -5.764 -10.140 -5.160 557 1HB LEU 71 HB2 LEU 71 -7.705 -10.171 -7.492 558 2HB LEU 71 HB1 LEU 71 -6.588 -11.488 -7.147 559 HG LEU 71 HG LEU 71 -7.727 -11.079 -4.685 560 1HD1 LEU 71 HD21 LEU 71 -9.792 -10.173 -4.827 561 2HD1 LEU 71 HD22 LEU 71 -10.206 -11.183 -6.212 562 3HD1 LEU 71 HD23 LEU 71 -9.359 -9.657 -6.457 563 1HD2 LEU 71 HD11 LEU 71 -7.791 -13.292 -5.176 564 2HD2 LEU 71 HD12 LEU 71 -7.968 -12.985 -6.904 565 3HD2 LEU 71 HD13 LEU 71 -9.385 -12.963 -5.854 566 H GLU 72 HN GLU 72 -4.877 -7.511 -6.121 567 HA GLU 72 HA GLU 72 -2.757 -8.432 -7.913 568 1HB GLU 72 HB1 GLU 72 -5.028 -7.819 -9.181 569 2HB GLU 72 HB2 GLU 72 -4.401 -6.181 -9.002 570 1HG GLU 72 HG2 GLU 72 -2.409 -6.708 -10.207 571 2HG GLU 72 HG1 GLU 72 -2.724 -8.441 -10.110 572 HA PRO 73 HA PRO 73 -1.531 -5.246 -4.865 573 1HB PRO 73 HB2 PRO 73 1.188 -5.838 -5.394 574 2HB PRO 73 HB1 PRO 73 0.223 -6.433 -4.034 575 1HG PRO 73 HG1 PRO 73 0.954 -7.769 -6.563 576 2HG PRO 73 HG2 PRO 73 0.603 -8.465 -4.975 577 1HD PRO 73 HD1 PRO 73 -1.114 -8.615 -7.068 578 2HD PRO 73 HD2 PRO 73 -1.657 -8.563 -5.377 579 H THR 74 HN THR 74 -0.797 -3.138 -5.276 580 HA THR 74 HA THR 74 0.342 -2.558 -7.980 581 HB THR 74 HB THR 74 -2.102 -1.371 -6.637 582 HG1 THR 74 HG1 THR 74 -1.912 -3.364 -8.160 583 1HG2 THR 74 HG21 THR 74 -1.158 0.545 -7.554 584 2HG2 THR 74 HG22 THR 74 -2.097 -0.055 -8.921 585 3HG2 THR 74 HG23 THR 74 -0.359 -0.346 -8.849 586 H GLY 75 HN GLY 75 1.785 -0.806 -7.975 587 1HA GLY 75 HA1 GLY 75 2.212 1.419 -6.675 588 2HA GLY 75 HA2 GLY 75 2.406 0.340 -5.294 589 HA PRO 76 HA PRO 76 3.764 1.711 -4.543 590 1HB PRO 76 HB1 PRO 76 5.740 3.605 -4.522 591 2HB PRO 76 HB2 PRO 76 5.901 2.028 -3.728 592 1HG PRO 76 HG2 PRO 76 6.990 2.965 -6.335 593 2HG PRO 76 HG1 PRO 76 7.719 1.897 -5.127 594 1HD PRO 76 HD1 PRO 76 6.549 1.029 -7.455 595 2HD PRO 76 HD2 PRO 76 6.712 0.039 -5.990 596 H LEU 77 HN LEU 77 2.327 3.417 -4.750 597 HA LEU 77 HA LEU 77 2.236 4.810 -7.382 598 1HB LEU 77 HB2 LEU 77 0.272 3.561 -6.564 599 2HB LEU 77 HB1 LEU 77 0.251 4.544 -5.099 600 HG LEU 77 HG LEU 77 -0.036 6.578 -6.539 601 1HD1 LEU 77 HD11 LEU 77 -0.979 5.061 -8.853 602 2HD1 LEU 77 HD12 LEU 77 0.748 4.843 -8.570 603 3HD1 LEU 77 HD13 LEU 77 0.089 6.463 -8.794 604 1HD2 LEU 77 HD21 LEU 77 -2.017 4.325 -6.472 605 2HD2 LEU 77 HD22 LEU 77 -2.414 5.787 -7.376 606 3HD2 LEU 77 HD23 LEU 77 -2.072 5.883 -5.648 607 H HIS 78 HN HIS 78 1.758 7.158 -7.385 608 HA HIS 78 HA HIS 78 3.473 8.596 -5.529 609 1HB HIS 78 HB1 HIS 78 1.592 9.366 -7.773 610 2HB HIS 78 HB2 HIS 78 2.584 10.545 -6.912 611 HD1 HIS 78 HD1 HIS 78 2.691 8.216 -9.702 612 HD2 HIS 78 HD2 HIS 78 5.490 9.837 -7.072 613 HE1 HIS 78 HE1 HIS 78 4.963 7.853 -10.761 614 H THR 79 HN THR 79 2.881 9.705 -3.711 615 HA THR 79 HA THR 79 0.107 10.688 -3.436 616 HB THR 79 HB THR 79 0.339 8.325 -2.447 617 HG1 THR 79 HG1 THR 79 -0.981 10.392 -1.674 618 1HG2 THR 79 HG21 THR 79 2.647 9.275 -1.383 619 2HG2 THR 79 HG22 THR 79 1.751 7.917 -0.704 620 3HG2 THR 79 HG23 THR 79 1.548 9.534 -0.029 621 H GLN 80 HN GLN 80 -0.016 12.375 -1.754 622 HA GLN 80 HA GLN 80 2.182 14.152 -1.792 623 1HB GLN 80 HB1 GLN 80 -0.228 13.881 0.025 624 2HB GLN 80 HB2 GLN 80 0.849 15.276 0.063 625 1HG GLN 80 HG2 GLN 80 0.346 15.823 -2.227 626 2HG GLN 80 HG1 GLN 80 -0.521 14.304 -2.457 627 1HE2 GLN 80 HE21 GLN 80 -1.774 16.866 -2.898 628 2HE2 GLN 80 HE22 GLN 80 -2.989 17.064 -1.729 629 H PHE 81 HN PHE 81 1.375 11.615 0.533 630 HA PHE 81 HA PHE 81 3.249 12.549 2.563 631 1HB PHE 81 HB2 PHE 81 1.651 10.020 2.089 632 2HB PHE 81 HB1 PHE 81 2.638 10.271 3.529 633 HD1 PHE 81 HD1 PHE 81 2.040 11.961 5.195 634 HD2 PHE 81 HD2 PHE 81 -0.363 11.350 1.686 635 HE1 PHE 81 HE1 PHE 81 0.212 13.292 6.215 636 HE2 PHE 81 HE2 PHE 81 -2.192 12.680 2.706 637 HZ PHE 81 HZ PHE 81 -1.904 13.651 4.971 638 H GLY 82 HN GLY 82 3.630 10.847 -0.371 639 1HA GLY 82 HA2 GLY 82 6.281 10.542 -0.597 640 2HA GLY 82 HA1 GLY 82 5.950 9.287 0.596 641 H TYR 83 HN TYR 83 5.707 7.319 -0.308 642 HA TYR 83 HA TYR 83 4.217 7.126 -2.902 643 1HB TYR 83 HB1 TYR 83 6.749 5.723 -1.992 644 2HB TYR 83 HB2 TYR 83 5.814 5.211 -3.398 645 HD1 TYR 83 HD1 TYR 83 5.698 6.593 -5.413 646 HD2 TYR 83 HD2 TYR 83 7.980 7.834 -1.991 647 HE1 TYR 83 HE1 TYR 83 6.831 8.315 -6.794 648 HE2 TYR 83 HE2 TYR 83 9.113 9.557 -3.371 649 HH TYR 83 HH TYR 83 9.240 9.553 -6.572 650 H HIS 84 HN HIS 84 2.506 5.730 -2.715 651 HA HIS 84 HA HIS 84 2.375 3.979 -0.295 652 1HB HIS 84 HB2 HIS 84 0.309 5.122 -2.195 653 2HB HIS 84 HB1 HIS 84 -0.080 3.896 -0.992 654 HD1 HIS 84 HD1 HIS 84 -1.054 6.977 -0.997 655 HD2 HIS 84 HD2 HIS 84 1.956 5.324 1.367 656 HE1 HIS 84 HE1 HIS 84 -0.820 8.489 1.022 657 H ILE 85 HN ILE 85 2.706 1.835 -0.588 658 HA ILE 85 HA ILE 85 2.004 0.677 -3.263 659 HB ILE 85 HB ILE 85 4.409 0.519 -2.218 660 1HG1 ILE 85 HG12 ILE 85 3.392 -2.197 -2.895 661 2HG1 ILE 85 HG11 ILE 85 3.121 -0.926 -4.088 662 1HG2 ILE 85 HG21 ILE 85 4.762 -1.099 -0.550 663 2HG2 ILE 85 HG22 ILE 85 3.191 -1.854 -0.819 664 3HG2 ILE 85 HG23 ILE 85 3.290 -0.292 -0.007 665 1HD1 ILE 85 HD11 ILE 85 5.358 -0.691 -4.541 666 2HD1 ILE 85 HD12 ILE 85 5.412 -2.359 -3.972 667 3HD1 ILE 85 HD13 ILE 85 5.836 -1.040 -2.880 668 H ILE 86 HN ILE 86 0.183 -0.563 -3.233 669 HA ILE 86 HA ILE 86 -0.908 -1.344 -0.547 670 HB ILE 86 HB ILE 86 -2.220 -0.177 -3.023 671 1HG1 ILE 86 HG11 ILE 86 -2.048 1.057 -0.277 672 2HG1 ILE 86 HG12 ILE 86 -0.752 1.275 -1.453 673 1HG2 ILE 86 HG21 ILE 86 -3.309 -1.265 -0.439 674 2HG2 ILE 86 HG22 ILE 86 -3.911 -1.494 -2.080 675 3HG2 ILE 86 HG23 ILE 86 -4.149 0.050 -1.260 676 1HD1 ILE 86 HD11 ILE 86 -3.622 1.807 -2.208 677 2HD1 ILE 86 HD12 ILE 86 -2.152 2.424 -2.961 678 3HD1 ILE 86 HD13 ILE 86 -2.664 3.041 -1.390 679 H LYS 87 HN LYS 87 -1.672 -3.413 -0.385 680 HA LYS 87 HA LYS 87 -1.980 -5.060 -2.866 681 1HB LYS 87 HB2 LYS 87 -0.511 -5.948 -1.102 682 2HB LYS 87 HB1 LYS 87 -1.805 -5.767 0.082 683 1HG LYS 87 HG2 LYS 87 -3.166 -7.406 -1.060 684 2HG LYS 87 HG1 LYS 87 -2.021 -7.494 -2.398 685 1HD LYS 87 HD2 LYS 87 -1.146 -8.100 0.423 686 2HD LYS 87 HD1 LYS 87 -1.917 -9.340 -0.567 687 1HE LYS 87 HE1 LYS 87 -0.075 -8.359 -2.335 688 2HE LYS 87 HE2 LYS 87 0.792 -8.168 -0.800 689 1HZ LYS 87 HZ1 LYS 87 1.133 -10.396 -1.587 690 2HZ LYS 87 HZ2 LYS 87 -0.534 -10.629 -1.818 691 3HZ LYS 87 HZ3 LYS 87 0.095 -10.470 -0.248 692 H VAL 88 HN VAL 88 -4.066 -5.453 -3.528 693 HA VAL 88 HA VAL 88 -6.266 -4.512 -1.750 694 HB VAL 88 HB VAL 88 -6.207 -5.105 -4.724 695 1HG1 VAL 88 HG11 VAL 88 -8.465 -5.008 -4.054 696 2HG1 VAL 88 HG12 VAL 88 -8.124 -3.357 -4.573 697 3HG1 VAL 88 HG13 VAL 88 -8.148 -3.754 -2.855 698 1HG2 VAL 88 HG21 VAL 88 -6.218 -2.414 -4.576 699 2HG2 VAL 88 HG22 VAL 88 -4.727 -3.350 -4.682 700 3HG2 VAL 88 HG23 VAL 88 -5.297 -2.772 -3.116 701 H LEU 89 HN LEU 89 -7.756 -5.958 -0.961 702 HA LEU 89 HA LEU 89 -8.020 -8.628 -2.237 703 1HB LEU 89 HB2 LEU 89 -7.749 -8.075 0.734 704 2HB LEU 89 HB1 LEU 89 -7.757 -9.651 -0.056 705 HG LEU 89 HG LEU 89 -5.658 -7.502 -0.486 706 1HD1 LEU 89 HD11 LEU 89 -5.062 -10.137 0.780 707 2HD1 LEU 89 HD12 LEU 89 -5.889 -8.934 1.770 708 3HD1 LEU 89 HD13 LEU 89 -4.317 -8.563 1.060 709 1HD2 LEU 89 HD21 LEU 89 -4.622 -8.949 -1.976 710 2HD2 LEU 89 HD22 LEU 89 -6.313 -9.331 -2.298 711 3HD2 LEU 89 HD23 LEU 89 -5.356 -10.382 -1.255 712 H TYR 90 HN TYR 90 -9.822 -9.672 -0.542 713 HA TYR 90 HA TYR 90 -12.218 -9.716 -0.408 714 1HB TYR 90 HB2 TYR 90 -11.080 -7.510 1.317 715 2HB TYR 90 HB1 TYR 90 -12.759 -8.039 1.458 716 HD1 TYR 90 HD1 TYR 90 -13.307 -9.998 2.676 717 HD2 TYR 90 HD2 TYR 90 -9.230 -9.263 1.534 718 HE1 TYR 90 HE1 TYR 90 -12.570 -11.920 4.062 719 HE2 TYR 90 HE2 TYR 90 -8.494 -11.181 2.921 720 HH TYR 90 HH TYR 90 -10.841 -13.087 4.815 721 H ARG 91 HN ARG 91 -12.032 -6.204 0.037 722 HA ARG 91 HA ARG 91 -13.078 -4.455 -1.172 723 1HB ARG 91 HB1 ARG 91 -11.483 -5.427 -2.860 724 2HB ARG 91 HB2 ARG 91 -12.815 -6.406 -3.470 725 1HG ARG 91 HG1 ARG 91 -14.116 -4.353 -3.915 726 2HG ARG 91 HG2 ARG 91 -12.780 -3.374 -3.311 727 1HD ARG 91 HD1 ARG 91 -11.318 -4.331 -5.101 728 2HD ARG 91 HD2 ARG 91 -12.725 -5.200 -5.742 729 HE ARG 91 HE ARG 91 -13.204 -2.341 -5.324 730 1HH1 ARG 91 HH11 ARG 91 -12.033 -4.804 -7.440 731 2HH1 ARG 91 HH12 ARG 91 -12.300 -3.877 -8.878 732 1HH2 ARG 91 HH21 ARG 91 -13.556 -1.121 -7.191 733 2HH2 ARG 91 HH22 ARG 91 -13.161 -1.794 -8.738 734 H ASN 92 HN ASN 92 -14.842 -6.067 0.238 735 HA ASN 92 HA ASN 92 -17.329 -5.389 -0.829 736 1HB ASN 92 HB1 ASN 92 -16.089 -7.556 -2.229 737 2HB ASN 92 HB2 ASN 92 -17.498 -8.194 -1.382 738 1HD2 ASN 92 HD21 ASN 92 -17.131 -4.864 -2.651 739 2HD2 ASN 92 HD22 ASN 92 -18.399 -4.981 -3.772
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