NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
8134 | 1lms | 5466 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 H LEU 9 H LEU 9 1.007 -6.734 12.307 2 HA LEU 9 HA LEU 9 3.636 -5.788 11.508 3 1HB LEU 9 HB2 LEU 9 1.163 -6.927 10.121 4 2HB LEU 9 HB3 LEU 9 2.672 -6.535 9.289 5 HG LEU 9 HG LEU 9 3.490 -7.941 11.677 6 1HD1 LEU 9 1HD1 LEU 9 1.420 -8.973 12.184 7 2HD1 LEU 9 2HD1 LEU 9 0.979 -9.146 10.471 8 3HD1 LEU 9 3HD1 LEU 9 2.260 -10.158 11.174 9 1HD2 LEU 9 1HD2 LEU 9 3.176 -8.927 8.908 10 2HD2 LEU 9 2HD2 LEU 9 4.437 -7.816 9.503 11 3HD2 LEU 9 3HD2 LEU 9 4.364 -9.477 10.134 12 H PHE 10 H PHE 10 0.698 -5.008 9.801 13 HA PHE 10 HA PHE 10 1.432 -2.636 8.708 14 1HB PHE 10 HB2 PHE 10 -0.539 -4.006 8.212 15 2HB PHE 10 HB3 PHE 10 -1.294 -3.517 9.722 16 HD1 PHE 10 HD1 PHE 10 0.304 -2.016 6.604 17 HD2 PHE 10 HD2 PHE 10 -2.733 -1.766 9.695 18 HE1 PHE 10 HE1 PHE 10 -0.744 -0.043 5.473 19 HE2 PHE 10 HE2 PHE 10 -3.604 0.347 8.660 20 HZ PHE 10 HZ PHE 10 -2.705 1.084 6.484 21 H LYS 11 H LYS 11 -0.209 -2.937 11.845 22 HA LYS 11 HA LYS 11 -0.301 -0.625 13.234 23 1HB LYS 11 HB2 LYS 11 1.045 -3.122 14.091 24 2HB LYS 11 HB3 LYS 11 0.710 -1.728 15.137 25 1HG LYS 11 HG2 LYS 11 -1.522 -3.191 13.692 26 2HG LYS 11 HG3 LYS 11 -0.895 -3.622 15.299 27 1HD LYS 11 HD2 LYS 11 -1.398 -1.367 16.149 28 2HD LYS 11 HD3 LYS 11 -2.154 -0.948 14.595 29 1HE LYS 11 HE2 LYS 11 -3.800 -2.759 14.893 30 2HE LYS 11 HE3 LYS 11 -2.996 -3.274 16.389 31 2HZ LYS 11 HZ2 LYS 11 -4.351 -0.731 15.928 32 3HZ LYS 11 HZ3 LYS 11 -4.842 -1.970 16.901 33 H THR 12 H THR 12 2.822 -1.967 12.346 34 HA THR 12 HA THR 12 4.037 0.634 13.240 35 HB THR 12 HB THR 12 6.016 -0.540 14.040 36 HG1 THR 12 HG1 THR 12 4.329 -2.795 13.713 37 1HG2 THR 12 1HG2 THR 12 3.431 -1.413 15.428 38 2HG2 THR 12 2HG2 THR 12 4.198 0.175 15.592 39 3HG2 THR 12 3HG2 THR 12 5.040 -1.279 16.161 40 H ARG 13 H ARG 13 4.256 -2.133 11.016 41 HA ARG 13 HA ARG 13 6.461 -1.344 9.437 42 1HB ARG 13 HB2 ARG 13 3.885 -2.879 8.990 43 2HB ARG 13 HB3 ARG 13 4.601 -2.187 7.563 44 1HG ARG 13 HG2 ARG 13 5.464 -4.329 7.650 45 2HG ARG 13 HG3 ARG 13 6.760 -3.212 8.064 46 1HD ARG 13 HD2 ARG 13 5.764 -3.755 10.555 47 2HD ARG 13 HD3 ARG 13 5.339 -5.254 9.745 48 HE ARG 13 HE ARG 13 7.728 -5.412 8.963 49 1HH1 ARG 13 2HH2 ARG 13 7.035 -3.600 11.984 50 2HH1 ARG 13 1HH2 ARG 13 8.656 -3.766 12.571 51 1HH2 ARG 13 2HH1 ARG 13 9.760 -5.674 9.864 52 2HH2 ARG 13 1HH1 ARG 13 10.220 -4.913 11.370 53 H CYS 14 HN CYS 14 3.016 -0.562 8.946 54 HA CYS 14 HA CYS 14 3.723 1.820 7.322 55 1HB CYS 14 HB2 CYS 14 2.467 -0.740 6.258 56 2HB CYS 14 HB3 CYS 14 2.556 0.809 5.399 57 H LEU 15 H LEU 15 2.644 1.957 9.802 58 HA LEU 15 HA LEU 15 -0.201 2.544 9.502 59 1HB LEU 15 HB2 LEU 15 0.581 1.164 11.318 60 2HB LEU 15 HB3 LEU 15 1.851 2.299 11.757 61 HG LEU 15 HG LEU 15 -0.038 2.152 13.325 62 1HD1 LEU 15 1HD1 LEU 15 -0.149 4.397 13.849 63 2HD1 LEU 15 2HD1 LEU 15 1.396 4.164 12.974 64 3HD1 LEU 15 3HD1 LEU 15 0.007 4.932 12.172 65 1HD2 LEU 15 1HD2 LEU 15 -1.741 1.599 11.753 66 2HD2 LEU 15 2HD2 LEU 15 -2.237 2.983 12.757 67 3HD2 LEU 15 3HD2 LEU 15 -1.717 3.250 11.069 68 H GLN 16 H GLN 16 3.015 4.020 9.985 69 HA GLN 16 HA GLN 16 2.461 6.461 11.092 70 1HB GLN 16 HB2 GLN 16 4.397 6.137 8.756 71 2HB GLN 16 HB3 GLN 16 4.431 7.352 10.023 72 1HG GLN 16 HG2 GLN 16 5.949 6.021 10.996 73 2HG GLN 16 HG3 GLN 16 4.591 5.018 11.520 74 1HE2 GLN 16 1HE2 GLN 16 4.580 2.837 10.678 75 2HE2 GLN 16 2HE2 GLN 16 5.554 2.361 9.307 76 H CYS 17 HN CYS 17 2.548 5.840 7.586 77 HA CYS 17 HA CYS 17 1.216 8.360 7.000 78 1HB CYS 17 HB2 CYS 17 2.219 6.091 5.353 79 2HB CYS 17 HB3 CYS 17 1.228 7.364 4.658 80 H HIS 18 HN HIS 18 0.655 4.977 6.062 81 HA HIS 18 HA HIS 18 -1.865 5.260 5.003 82 1HB HIS 18 HB2 HIS 18 -0.396 2.939 6.120 83 2HB HIS 18 HB3 HIS 18 -2.012 2.759 5.415 84 HD1 HIS 18 HD1 HIS 18 -2.320 3.986 2.936 85 HD2 HIS 18 HD2 HIS 18 1.536 2.974 4.330 86 HE1 HIS 18 HE1 HIS 18 -0.795 4.130 0.963 87 H THR 19 H THR 19 -3.825 4.383 5.415 88 HA THR 19 HA THR 19 -3.995 3.247 7.980 89 HB THR 19 HB THR 19 -4.974 5.272 8.725 90 HG1 THR 19 HG1 THR 19 -7.459 4.536 8.436 91 1HG2 THR 19 1HG2 THR 19 -6.957 6.377 7.575 92 2HG2 THR 19 2HG2 THR 19 -5.369 6.571 6.821 93 3HG2 THR 19 3HG2 THR 19 -6.522 5.442 6.137 94 H VAL 20 H VAL 20 -6.587 2.417 8.032 95 HA VAL 20 HA VAL 20 -6.807 0.613 5.661 96 HB VAL 20 HB VAL 20 -5.381 -0.456 7.310 97 1HG1 VAL 20 1HG1 VAL 20 -6.295 0.568 9.400 98 2HG1 VAL 20 2HG1 VAL 20 -6.174 -1.193 9.484 99 3HG1 VAL 20 3HG1 VAL 20 -7.753 -0.433 9.224 100 1HG2 VAL 20 1HG2 VAL 20 -8.065 -1.849 7.097 101 2HG2 VAL 20 2HG2 VAL 20 -6.798 -1.806 5.849 102 3HG2 VAL 20 3HG2 VAL 20 -6.479 -2.594 7.404 103 H GLU 21 H GLU 21 -8.269 2.039 8.544 104 HA GLU 21 HA GLU 21 -10.957 1.854 7.286 105 1HB GLU 21 HB2 GLU 21 -10.352 0.271 9.302 106 2HB GLU 21 HB3 GLU 21 -10.434 1.725 10.282 107 1HG GLU 21 HG2 GLU 21 -12.856 2.000 9.476 108 2HG GLU 21 HG3 GLU 21 -12.650 0.491 8.574 109 H LYS 22 H LYS 22 -12.361 3.482 8.302 110 HA LYS 22 HA LYS 22 -13.089 5.200 9.477 111 1HB LYS 22 HB2 LYS 22 -10.955 3.837 10.965 112 2HB LYS 22 HB3 LYS 22 -11.225 5.467 11.567 113 1HG LYS 22 HG2 LYS 22 -13.547 5.120 11.900 114 2HG LYS 22 HG3 LYS 22 -13.531 3.587 10.998 115 1HD LYS 22 HD2 LYS 22 -12.062 2.574 12.660 116 2HD LYS 22 HD3 LYS 22 -12.030 4.073 13.605 117 1HE LYS 22 HE2 LYS 22 -14.101 3.695 14.491 118 2HE LYS 22 HE3 LYS 22 -14.789 3.219 12.930 119 2HZ LYS 22 HZ2 LYS 22 -13.082 1.465 14.473 120 3HZ LYS 22 HZ3 LYS 22 -13.869 1.171 13.068 121 H GLY 23 H GLY 23 -13.395 7.173 9.003 122 1HA GLY 23 HA3 GLY 23 -13.146 9.432 9.170 123 2HA GLY 23 HA2 GLY 23 -11.640 9.154 10.038 124 H GLY 24 H GLY 24 -9.899 8.151 8.410 125 1HA GLY 24 HA3 GLY 24 -8.186 9.014 7.169 126 2HA GLY 24 HA2 GLY 24 -9.363 9.011 5.847 127 HA PRO 25 HA PRO 25 -10.413 13.245 7.619 128 1HB PRO 25 HB2 PRO 25 -8.843 14.319 9.721 129 2HB PRO 25 HB3 PRO 25 -10.440 13.550 9.878 130 1HG PRO 25 HG2 PRO 25 -7.716 12.346 10.383 131 2HG PRO 25 HG3 PRO 25 -9.242 12.069 11.246 132 1HD PRO 25 HD2 PRO 25 -8.268 10.292 9.420 133 2HD PRO 25 HD3 PRO 25 -10.003 10.626 9.663 134 H HIS 26 H HIS 26 -7.018 12.442 7.716 135 HA HIS 26 HA HIS 26 -6.290 15.297 7.365 136 1HB HIS 26 HB2 HIS 26 -6.070 13.345 9.462 137 2HB HIS 26 HB3 HIS 26 -4.458 13.597 8.918 138 HD1 HIS 26 HD1 HIS 26 -6.389 14.647 11.574 139 HD2 HIS 26 HD2 HIS 26 -4.342 16.772 8.571 140 HE1 HIS 26 HE1 HIS 26 -5.977 16.996 12.481 141 H LYS 27 H LYS 27 -3.902 15.465 7.211 142 HA LYS 27 HA LYS 27 -1.940 15.199 5.837 143 1HB LYS 27 HB2 LYS 27 -2.482 13.363 8.164 144 2HB LYS 27 HB3 LYS 27 -0.956 13.252 7.310 145 1HG LYS 27 HG2 LYS 27 -0.350 15.471 7.816 146 2HG LYS 27 HG3 LYS 27 -1.925 15.778 8.601 147 1HD LYS 27 HD2 LYS 27 -1.467 14.015 10.271 148 2HD LYS 27 HD3 LYS 27 0.022 13.556 9.429 149 1HE LYS 27 HE2 LYS 27 0.611 14.916 11.342 150 2HE LYS 27 HE3 LYS 27 0.951 15.827 9.857 151 2HZ LYS 27 HZ2 LYS 27 -1.319 16.135 11.669 152 3HZ LYS 27 HZ3 LYS 27 -0.117 17.217 11.359 153 H VAL 28 H VAL 28 -2.870 11.784 6.401 154 HA VAL 28 HA VAL 28 -0.237 11.823 5.231 155 HB VAL 28 HB VAL 28 -0.360 9.563 6.751 156 1HG1 VAL 28 1HG1 VAL 28 1.481 10.656 6.957 157 2HG1 VAL 28 2HG1 VAL 28 0.771 12.202 7.318 158 3HG1 VAL 28 3HG1 VAL 28 0.720 10.909 8.530 159 1HG2 VAL 28 1HG2 VAL 28 -2.299 11.274 8.207 160 2HG2 VAL 28 2HG2 VAL 28 -1.368 9.929 8.839 161 3HG2 VAL 28 3HG2 VAL 28 -2.523 9.655 7.538 162 H GLY 29 H GLY 29 -0.940 8.528 5.470 163 1HA GLY 29 HA3 GLY 29 -1.091 8.216 2.516 164 2HA GLY 29 HA2 GLY 29 -0.694 6.965 3.695 165 HA PRO 30 HA PRO 30 -5.220 7.387 4.157 166 1HB PRO 30 HB2 PRO 30 -6.760 7.603 1.855 167 2HB PRO 30 HB3 PRO 30 -6.067 9.085 2.583 168 1HG PRO 30 HG2 PRO 30 -4.913 7.421 0.329 169 2HG PRO 30 HG3 PRO 30 -5.140 9.195 0.354 170 1HD PRO 30 HD2 PRO 30 -2.753 7.972 0.956 171 2HD PRO 30 HD3 PRO 30 -3.261 9.501 1.740 172 H ASN 31 H ASN 31 -6.846 5.873 3.720 173 HA ASN 31 HA ASN 31 -5.179 3.603 3.996 174 1HB ASN 31 HB2 ASN 31 -7.680 2.437 4.261 175 2HB ASN 31 HB3 ASN 31 -7.279 3.630 5.469 176 1HD2 ASN 31 1HD2 ASN 31 -8.618 5.416 5.744 177 2HD2 ASN 31 2HD2 ASN 31 -9.876 5.801 4.584 178 H LEU 32 H LEU 32 -5.166 1.706 3.052 179 HA LEU 32 HA LEU 32 -5.636 1.812 0.145 180 1HB LEU 32 HB2 LEU 32 -4.563 -0.513 1.774 181 2HB LEU 32 HB3 LEU 32 -4.371 -0.190 0.036 182 HG LEU 32 HG LEU 32 -3.250 1.489 2.343 183 1HD1 LEU 32 1HD1 LEU 32 -2.056 -0.679 1.700 184 2HD1 LEU 32 2HD1 LEU 32 -1.608 0.186 0.203 185 3HD1 LEU 32 3HD1 LEU 32 -1.120 0.825 1.774 186 1HD2 LEU 32 1HD2 LEU 32 -3.527 2.047 -0.621 187 2HD2 LEU 32 2HD2 LEU 32 -3.655 3.160 0.761 188 3HD2 LEU 32 3HD2 LEU 32 -2.078 2.580 0.200 189 H HIS 33 H HIS 33 -7.220 0.060 2.774 190 HA HIS 33 HA HIS 33 -9.149 -1.091 2.891 191 1HB HIS 33 HB2 HIS 33 -10.307 0.828 2.500 192 2HB HIS 33 HB3 HIS 33 -9.714 1.025 0.856 193 HD1 HIS 33 HD1 HIS 33 -12.208 -1.365 2.656 194 HD2 HIS 33 HD2 HIS 33 -11.088 0.091 -1.113 195 HE1 HIS 33 HE1 HIS 33 -13.799 -2.416 0.968 196 H GLY 34 H GLY 34 -7.513 -1.612 -0.157 197 1HA GLY 34 HA3 GLY 34 -8.209 -4.360 -0.328 198 2HA GLY 34 HA2 GLY 34 -9.409 -3.409 -1.238 199 H ILE 35 H ILE 35 -6.434 -4.928 -1.397 200 HA ILE 35 HA ILE 35 -5.468 -3.344 -3.726 201 HB ILE 35 HB ILE 35 -4.288 -4.678 -1.283 202 1HG1 ILE 35 2HG1 ILE 35 -3.117 -2.268 -2.714 203 2HG1 ILE 35 3HG1 ILE 35 -4.672 -2.048 -1.949 204 1HG2 ILE 35 1HG2 ILE 35 -1.911 -4.323 -2.333 205 2HG2 ILE 35 2HG2 ILE 35 -2.798 -5.781 -2.726 206 3HG2 ILE 35 3HG2 ILE 35 -2.720 -4.410 -3.892 207 1HD1 ILE 35 1HD1 ILE 35 -3.795 -2.674 0.228 208 2HD1 ILE 35 2HD1 ILE 35 -2.267 -3.256 -0.447 209 3HD1 ILE 35 3HD1 ILE 35 -2.653 -1.543 -0.510 210 H PHE 36 H PHE 36 -7.497 -5.182 -4.017 211 HA PHE 36 HA PHE 36 -6.232 -7.399 -5.602 212 1HB PHE 36 HB2 PHE 36 -8.717 -7.868 -3.968 213 2HB PHE 36 HB3 PHE 36 -7.511 -9.005 -4.546 214 HD1 PHE 36 HD1 PHE 36 -8.698 -7.146 -1.748 215 HD2 PHE 36 HD2 PHE 36 -5.062 -8.627 -3.521 216 HE1 PHE 36 HE1 PHE 36 -7.553 -6.910 0.427 217 HE2 PHE 36 HE2 PHE 36 -3.888 -8.329 -1.363 218 HZ PHE 36 HZ PHE 36 -5.142 -7.587 0.634 219 H GLY 37 H GLY 37 -6.588 -6.058 -7.375 220 1HA GLY 37 HA3 GLY 37 -7.852 -5.535 -9.333 221 2HA GLY 37 HA2 GLY 37 -9.362 -5.914 -8.484 222 H ARG 38 H ARG 38 -6.603 -3.930 -7.402 223 HA ARG 38 HA ARG 38 -8.346 -1.511 -7.503 224 1HB ARG 38 HB2 ARG 38 -7.134 -2.204 -5.325 225 2HB ARG 38 HB3 ARG 38 -5.644 -1.691 -6.077 226 1HG ARG 38 HG2 ARG 38 -6.600 0.017 -4.615 227 2HG ARG 38 HG3 ARG 38 -6.482 0.614 -6.277 228 1HD ARG 38 HD3 ARG 38 -8.771 0.637 -6.584 229 2HD ARG 38 HD2 ARG 38 -9.008 -0.811 -5.598 230 HE ARG 38 HE ARG 38 -8.499 1.905 -4.412 231 1HH1 ARG 38 2HH2 ARG 38 -10.287 -1.107 -4.135 232 2HH1 ARG 38 1HH2 ARG 38 -11.707 -0.346 -3.474 233 1HH2 ARG 38 2HH1 ARG 38 -10.159 2.832 -3.497 234 2HH2 ARG 38 1HH1 ARG 38 -11.635 1.969 -3.044 235 H HIS 39 H HIS 39 -7.469 0.423 -8.454 236 HA HIS 39 HA HIS 39 -5.172 -0.042 -10.303 237 1HB HIS 39 HB2 HIS 39 -7.638 1.638 -10.959 238 2HB HIS 39 HB3 HIS 39 -6.275 1.260 -12.019 239 HD1 HIS 39 HD1 HIS 39 -6.088 -1.670 -12.322 240 HD2 HIS 39 HD2 HIS 39 -9.739 0.155 -11.313 241 HE1 HIS 39 HE1 HIS 39 -7.921 -3.382 -12.807 242 H SER 40 H SER 40 -3.606 1.073 -9.609 243 HA SER 40 HA SER 40 -2.387 2.484 -8.388 244 1HB SER 40 HB2 SER 40 -3.113 5.027 -8.804 245 2HB SER 40 HB3 SER 40 -2.620 4.003 -10.147 246 HG SER 40 HG SER 40 -5.342 4.165 -9.474 247 H GLY 41 H GLY 41 -2.424 4.514 -6.958 248 1HA GLY 41 HA3 GLY 41 -3.665 4.046 -4.414 249 2HA GLY 41 HA2 GLY 41 -2.938 5.537 -5.060 250 H GLN 42 H GLN 42 -5.812 3.550 -5.146 251 HA GLN 42 HA GLN 42 -7.253 6.115 -5.559 252 1HB GLN 42 HB2 GLN 42 -7.264 4.562 -7.565 253 2HB GLN 42 HB3 GLN 42 -8.394 3.553 -6.640 254 1HG GLN 42 HG2 GLN 42 -9.365 6.196 -6.273 255 2HG GLN 42 HG3 GLN 42 -8.727 6.245 -7.913 256 1HE2 GLN 42 1HE2 GLN 42 -11.405 6.709 -7.258 257 2HE2 GLN 42 2HE2 GLN 42 -12.355 5.370 -7.892 258 H ALA 43 H ALA 43 -8.120 6.684 -3.853 259 HA ALA 43 HA ALA 43 -10.372 5.146 -2.713 260 1HB ALA 43 HB1 ALA 43 -9.600 5.627 -0.321 261 2HB ALA 43 HB2 ALA 43 -8.654 4.388 -1.161 262 3HB ALA 43 HB3 ALA 43 -8.019 6.043 -0.991 263 H GLU 44 H GLU 44 -11.283 6.671 -0.833 264 HA GLU 44 HA GLU 44 -11.737 9.290 -1.731 265 1HB GLU 44 HB2 GLU 44 -12.902 7.643 0.129 266 2HB GLU 44 HB3 GLU 44 -12.031 8.751 1.197 267 1HG GLU 44 HG2 GLU 44 -13.171 10.672 0.083 268 2HG GLU 44 HG3 GLU 44 -13.990 9.542 -1.015 269 H GLY 45 H GLY 45 -8.774 8.339 -0.994 270 1HA GLY 45 HA3 GLY 45 -7.629 10.696 0.237 271 2HA GLY 45 HA2 GLY 45 -6.914 9.638 -1.002 272 H TYR 46 H TYR 46 -6.528 12.410 -1.337 273 HA TYR 46 HA TYR 46 -8.386 13.105 -3.561 274 1HB TYR 46 HB2 TYR 46 -8.590 15.171 -2.784 275 2HB TYR 46 HB3 TYR 46 -8.112 14.546 -1.228 276 HD1 TYR 46 HD1 TYR 46 -5.395 14.471 -0.862 277 HD2 TYR 46 HD2 TYR 46 -7.400 16.926 -3.762 278 HE1 TYR 46 HE1 TYR 46 -3.432 15.946 -0.969 279 HE2 TYR 46 HE2 TYR 46 -5.482 18.488 -3.756 280 HH TYR 46 HH TYR 46 -3.152 18.288 -3.541 281 H SER 47 H SER 47 -5.564 11.685 -2.745 282 HA SER 47 HA SER 47 -3.959 14.047 -3.004 283 1HB SER 47 HB2 SER 47 -4.292 12.314 -1.011 284 2HB SER 47 HB3 SER 47 -3.012 11.411 -1.835 285 HG SER 47 HG SER 47 -1.761 13.386 -1.713 286 H TYR 48 H TYR 48 -4.228 11.146 -4.633 287 HA TYR 48 HA TYR 48 -1.821 10.869 -6.081 288 1HB TYR 48 HB2 TYR 48 -4.567 10.239 -7.158 289 2HB TYR 48 HB3 TYR 48 -3.080 9.303 -7.303 290 HD1 TYR 48 HD1 TYR 48 -6.177 9.774 -5.489 291 HD2 TYR 48 HD2 TYR 48 -2.166 8.238 -5.067 292 HE1 TYR 48 HE1 TYR 48 -6.860 8.537 -3.449 293 HE2 TYR 48 HE2 TYR 48 -2.874 6.967 -3.069 294 HH TYR 48 HH TYR 48 -4.644 6.270 -1.828 295 H THR 49 H THR 49 -3.585 13.559 -5.976 296 HA THR 49 HA THR 49 -4.210 14.788 -8.249 297 HB THR 49 HB THR 49 -3.265 16.894 -7.140 298 HG1 THR 49 HG1 THR 49 -2.481 15.031 -5.113 299 1HG2 THR 49 1HG2 THR 49 -4.652 15.540 -4.955 300 2HG2 THR 49 2HG2 THR 49 -4.952 17.086 -5.737 301 3HG2 THR 49 3HG2 THR 49 -5.528 15.609 -6.518 302 H ASP 50 H ASP 50 -1.421 13.265 -8.800 303 HA ASP 50 HA ASP 50 -0.856 14.619 -11.080 304 1HB ASP 50 HB2 ASP 50 0.252 16.205 -8.924 305 2HB ASP 50 HB3 ASP 50 1.599 15.540 -9.789 306 H ALA 51 H ALA 51 -0.912 11.917 -10.456 307 HA ALA 51 HA ALA 51 1.104 11.101 -12.200 308 1HB ALA 51 HB1 ALA 51 2.931 11.348 -10.683 309 2HB ALA 51 HB2 ALA 51 1.994 10.716 -9.318 310 3HB ALA 51 HB3 ALA 51 2.573 9.651 -10.620 311 H ASN 52 H ASN 52 0.813 9.081 -9.455 312 HA ASN 52 HA ASN 52 0.562 6.725 -10.534 313 1HB ASN 52 HB2 ASN 52 1.042 7.192 -8.248 314 2HB ASN 52 HB3 ASN 52 -0.543 7.931 -7.987 315 1HD2 ASN 52 1HD2 ASN 52 0.249 4.721 -9.513 316 2HD2 ASN 52 2HD2 ASN 52 -0.540 3.863 -8.201 317 H ILE 53 H ILE 53 -2.407 8.569 -9.672 318 HA ILE 53 HA ILE 53 -4.267 6.638 -10.549 319 HB ILE 53 HB ILE 53 -4.659 8.446 -9.056 320 1HG1 ILE 53 2HG1 ILE 53 -6.597 8.624 -11.402 321 2HG1 ILE 53 3HG1 ILE 53 -6.496 7.202 -10.358 322 1HG2 ILE 53 1HG2 ILE 53 -5.255 10.472 -11.178 323 2HG2 ILE 53 2HG2 ILE 53 -4.664 10.683 -9.527 324 3HG2 ILE 53 3HG2 ILE 53 -3.543 10.224 -10.802 325 1HD1 ILE 53 1HD1 ILE 53 -6.895 9.940 -9.127 326 2HD1 ILE 53 2HD1 ILE 53 -8.257 9.018 -9.792 327 3HD1 ILE 53 3HD1 ILE 53 -7.280 8.334 -8.471 328 H LYS 54 H LYS 54 -2.588 9.131 -12.345 329 HA LYS 54 HA LYS 54 -4.198 8.929 -14.752 330 1HB LYS 54 HB2 LYS 54 -2.354 10.741 -13.708 331 2HB LYS 54 HB3 LYS 54 -1.374 9.907 -14.919 332 1HG LYS 54 HG2 LYS 54 -3.148 10.436 -16.622 333 2HG LYS 54 HG3 LYS 54 -4.055 11.294 -15.351 334 1HD LYS 54 HD2 LYS 54 -2.072 12.772 -14.963 335 2HD LYS 54 HD3 LYS 54 -1.226 11.947 -16.291 336 1HE LYS 54 HE2 LYS 54 -3.054 12.655 -17.845 337 2HE LYS 54 HE3 LYS 54 -3.823 13.533 -16.503 338 2HZ LYS 54 HZ2 LYS 54 -1.143 14.031 -17.566 339 3HZ LYS 54 HZ3 LYS 54 -1.850 14.843 -16.321 340 H LYS 55 H LYS 55 -1.272 7.562 -13.428 341 HA LYS 55 HA LYS 55 -0.463 5.988 -15.756 342 1HB LYS 55 HB2 LYS 55 1.115 6.620 -13.954 343 2HB LYS 55 HB3 LYS 55 0.161 5.716 -12.784 344 1HG LYS 55 HG2 LYS 55 1.998 4.381 -13.246 345 2HG LYS 55 HG3 LYS 55 0.650 3.600 -14.079 346 1HD LYS 55 HD2 LYS 55 1.417 4.762 -16.219 347 2HD LYS 55 HD3 LYS 55 2.803 5.389 -15.300 348 1HE LYS 55 HE2 LYS 55 3.454 3.020 -14.773 349 2HE LYS 55 HE3 LYS 55 2.124 2.457 -15.809 350 2HZ LYS 55 HZ2 LYS 55 4.256 2.540 -16.895 351 3HZ LYS 55 HZ3 LYS 55 4.330 4.172 -16.681 352 H ASN 56 H ASN 56 -2.453 5.389 -12.885 353 HA ASN 56 HA ASN 56 -4.013 4.005 -12.404 354 1HB ASN 56 HB2 ASN 56 -4.398 4.513 -15.188 355 2HB ASN 56 HB3 ASN 56 -4.641 2.783 -15.057 356 1HD2 ASN 56 1HD2 ASN 56 -6.705 4.304 -15.911 357 2HD2 ASN 56 2HD2 ASN 56 -7.907 4.444 -14.629 358 H VAL 57 H VAL 57 -1.672 3.117 -11.838 359 HA VAL 57 HA VAL 57 -0.911 0.709 -13.001 360 HB VAL 57 HB VAL 57 0.423 2.380 -11.669 361 1HG1 VAL 57 1HG1 VAL 57 -0.183 0.564 -9.293 362 2HG1 VAL 57 2HG1 VAL 57 1.000 1.872 -9.371 363 3HG1 VAL 57 3HG1 VAL 57 -0.711 2.246 -9.529 364 1HG2 VAL 57 1HG2 VAL 57 0.670 -0.618 -11.713 365 2HG2 VAL 57 2HG2 VAL 57 1.579 0.586 -12.647 366 3HG2 VAL 57 3HG2 VAL 57 1.949 0.330 -10.925 367 H LEU 58 H LEU 58 -2.072 -1.093 -13.103 368 HA LEU 58 HA LEU 58 -4.094 -1.858 -11.356 369 1HB LEU 58 HB2 LEU 58 -4.152 -2.631 -13.521 370 2HB LEU 58 HB3 LEU 58 -2.513 -3.253 -13.500 371 HG LEU 58 HG LEU 58 -4.390 -4.894 -13.595 372 1HD1 LEU 58 1HD1 LEU 58 -2.969 -6.471 -12.922 373 2HD1 LEU 58 2HD1 LEU 58 -1.867 -5.155 -12.507 374 3HD1 LEU 58 3HD1 LEU 58 -2.879 -5.885 -11.262 375 1HD2 LEU 58 1HD2 LEU 58 -5.560 -3.639 -11.493 376 2HD2 LEU 58 2HD2 LEU 58 -5.878 -5.316 -11.948 377 3HD2 LEU 58 3HD2 LEU 58 -4.753 -4.954 -10.641 378 H TRP 59 H TRP 59 -4.300 -2.946 -9.542 379 HA TRP 59 HA TRP 59 -1.979 -4.268 -8.220 380 1HB TRP 59 HB2 TRP 59 -4.144 -2.460 -7.262 381 2HB TRP 59 HB3 TRP 59 -3.330 -3.540 -6.128 382 HD1 TRP 59 HD1 TRP 59 -3.265 -0.137 -6.992 383 HE1 TRP 59 HE1 TRP 59 -1.075 0.992 -6.623 384 HE3 TRP 59 HE3 TRP 59 -0.322 -4.228 -6.799 385 HZ2 TRP 59 HZ2 TRP 59 1.944 -0.057 -5.982 386 HZ3 TRP 59 HZ3 TRP 59 2.047 -4.072 -5.763 387 HH2 TRP 59 HH2 TRP 59 2.850 -1.970 -4.944 388 H ASP 60 H ASP 60 -2.625 -6.267 -9.131 389 HA ASP 60 HA ASP 60 -4.352 -7.947 -7.605 390 1HB ASP 60 HB2 ASP 60 -6.039 -6.689 -9.117 391 2HB ASP 60 HB3 ASP 60 -5.262 -7.402 -10.491 392 H GLU 61 H GLU 61 -2.344 -9.336 -7.619 393 HA GLU 61 HA GLU 61 -1.292 -10.186 -10.186 394 1HB GLU 61 HB2 GLU 61 -1.111 -7.414 -9.612 395 2HB GLU 61 HB3 GLU 61 0.473 -7.942 -9.258 396 1HG GLU 61 HG2 GLU 61 -1.123 -8.359 -11.837 397 2HG GLU 61 HG3 GLU 61 0.238 -7.256 -11.608 398 H ASN 62 H ASN 62 1.407 -9.508 -9.584 399 HA ASN 62 HA ASN 62 2.285 -11.889 -8.027 400 1HB ASN 62 HB2 ASN 62 1.730 -11.508 -10.860 401 2HB ASN 62 HB3 ASN 62 3.464 -11.691 -10.698 402 1HD2 ASN 62 1HD2 ASN 62 1.656 -13.241 -12.145 403 2HD2 ASN 62 2HD2 ASN 62 1.710 -14.872 -11.474 404 H ASN 63 H ASN 63 3.293 -9.310 -10.356 405 HA ASN 63 HA ASN 63 5.884 -8.831 -9.223 406 1HB ASN 63 HB2 ASN 63 3.957 -7.096 -10.799 407 2HB ASN 63 HB3 ASN 63 5.530 -6.498 -10.225 408 1HD2 ASN 63 1HD2 ASN 63 3.907 -8.630 -12.526 409 2HD2 ASN 63 2HD2 ASN 63 5.394 -8.918 -13.449 410 H MET 64 H MET 64 2.677 -7.440 -8.276 411 HA MET 64 HA MET 64 3.521 -5.776 -6.192 412 1HB MET 64 HB2 MET 64 1.277 -6.004 -5.376 413 2HB MET 64 HB3 MET 64 1.147 -6.085 -7.151 414 1HG MET 64 HG2 MET 64 1.085 -8.601 -6.888 415 2HG MET 64 HG3 MET 64 0.975 -8.360 -5.136 416 1HE MET 64 HE1 MET 64 -0.957 -5.726 -4.932 417 2HE MET 64 HE2 MET 64 -2.339 -6.789 -4.576 418 3HE MET 64 HE3 MET 64 -0.754 -7.162 -3.877 419 H SER 65 H SER 65 3.294 -9.292 -6.305 420 HA SER 65 HA SER 65 3.183 -9.635 -3.455 421 1HB SER 65 HB2 SER 65 3.256 -11.361 -5.799 422 2HB SER 65 HB3 SER 65 4.507 -11.906 -4.674 423 HG SER 65 HG SER 65 2.123 -12.578 -4.543 424 H GLU 66 H GLU 66 5.883 -9.741 -5.831 425 HA GLU 66 HA GLU 66 7.964 -9.637 -3.888 426 1HB GLU 66 HB2 GLU 66 7.819 -8.917 -6.830 427 2HB GLU 66 HB3 GLU 66 9.314 -8.843 -5.877 428 1HG GLU 66 HG2 GLU 66 9.040 -11.231 -5.231 429 2HG GLU 66 HG3 GLU 66 7.565 -11.338 -6.205 430 H TYR 67 H TYR 67 6.488 -6.872 -5.752 431 HA TYR 67 HA TYR 67 8.155 -5.062 -4.498 432 1HB TYR 67 HB2 TYR 67 5.415 -4.432 -5.871 433 2HB TYR 67 HB3 TYR 67 6.388 -3.228 -5.190 434 HD1 TYR 67 HD1 TYR 67 8.976 -3.195 -5.686 435 HD2 TYR 67 HD2 TYR 67 5.962 -4.967 -8.203 436 HE1 TYR 67 HE1 TYR 67 10.476 -2.965 -7.648 437 HE2 TYR 67 HE2 TYR 67 7.418 -4.618 -10.183 438 HH TYR 67 HH TYR 67 9.392 -3.791 -10.939 439 H LEU 68 H LEU 68 5.009 -6.035 -3.395 440 HA LEU 68 HA LEU 68 5.186 -4.215 -1.147 441 1HB LEU 68 HB2 LEU 68 3.318 -6.590 -1.615 442 2HB LEU 68 HB3 LEU 68 3.142 -5.387 -0.328 443 HG LEU 68 HG LEU 68 2.717 -4.808 -3.303 444 1HD1 LEU 68 1HD1 LEU 68 1.117 -6.375 -2.366 445 2HD1 LEU 68 2HD1 LEU 68 0.669 -5.144 -1.166 446 3HD1 LEU 68 3HD1 LEU 68 0.450 -4.819 -2.893 447 1HD2 LEU 68 1HD2 LEU 68 3.355 -2.973 -1.253 448 2HD2 LEU 68 2HD2 LEU 68 2.414 -2.605 -2.702 449 3HD2 LEU 68 3HD2 LEU 68 1.594 -3.044 -1.198 450 H THR 69 H THR 69 5.974 -7.704 -1.725 451 HA THR 69 HA THR 69 6.424 -8.498 0.962 452 HB THR 69 HB THR 69 7.817 -9.348 -1.587 453 HG1 THR 69 HG1 THR 69 5.857 -10.249 -1.390 454 1HG2 THR 69 1HG2 THR 69 9.501 -9.700 0.166 455 2HG2 THR 69 2HG2 THR 69 8.273 -10.478 1.198 456 3HG2 THR 69 3HG2 THR 69 8.773 -11.225 -0.330 457 H ASN 70 H ASN 70 8.639 -6.869 -1.309 458 HA ASN 70 HA ASN 70 10.572 -6.442 0.847 459 1HB ASN 70 HB2 ASN 70 10.390 -5.677 -2.073 460 2HB ASN 70 HB3 ASN 70 11.537 -4.845 -1.020 461 1HD2 ASN 70 1HD2 ASN 70 13.499 -5.699 -1.706 462 2HD2 ASN 70 2HD2 ASN 70 13.844 -7.422 -1.573 463 HA PRO 71 HA PRO 71 9.030 -2.425 2.214 464 1HB PRO 71 HB2 PRO 71 11.334 -1.261 3.087 465 2HB PRO 71 HB3 PRO 71 10.685 -2.725 3.876 466 1HG PRO 71 HG2 PRO 71 12.777 -2.674 1.648 467 2HG PRO 71 HG3 PRO 71 12.958 -3.418 3.243 468 1HD PRO 71 HD2 PRO 71 12.191 -4.911 1.237 469 2HD PRO 71 HD3 PRO 71 11.348 -5.085 2.804 470 H ALA 72 H ALA 72 8.672 -2.334 -0.240 471 HA ALA 72 HA ALA 72 10.218 -0.063 -1.453 472 1HB ALA 72 HB1 ALA 72 9.496 -2.637 -2.908 473 2HB ALA 72 HB2 ALA 72 10.414 -1.253 -3.533 474 3HB ALA 72 HB3 ALA 72 11.104 -2.261 -2.247 475 H LYS 73 H LYS 73 7.270 -2.090 -1.621 476 HA LYS 73 HA LYS 73 5.177 -1.646 -2.287 477 1HB LYS 73 HB2 LYS 73 4.110 0.293 -1.163 478 2HB LYS 73 HB3 LYS 73 4.954 -0.883 -0.185 479 1HG LYS 73 HG2 LYS 73 5.367 1.132 0.842 480 2HG LYS 73 HG3 LYS 73 6.870 0.665 0.115 481 1HD LYS 73 HD2 LYS 73 6.440 3.077 0.027 482 2HD LYS 73 HD3 LYS 73 6.615 2.399 -1.576 483 1HE LYS 73 HE2 LYS 73 4.925 3.870 -1.886 484 2HE LYS 73 HE3 LYS 73 3.954 2.420 -1.634 485 2HZ LYS 73 HZ2 LYS 73 3.456 4.526 -0.657 486 3HZ LYS 73 HZ3 LYS 73 4.679 4.354 0.380 487 H TYR 74 H TYR 74 5.932 -1.623 -4.468 488 HA TYR 74 HA TYR 74 4.559 0.389 -5.969 489 1HB TYR 74 HB2 TYR 74 7.523 0.616 -5.559 490 2HB TYR 74 HB3 TYR 74 7.007 0.822 -7.213 491 HD1 TYR 74 HD1 TYR 74 8.528 2.806 -6.434 492 HD2 TYR 74 HD2 TYR 74 4.307 2.421 -5.582 493 HE1 TYR 74 HE1 TYR 74 8.279 5.263 -6.472 494 HE2 TYR 74 HE2 TYR 74 4.104 4.843 -5.532 495 HH TYR 74 HH TYR 74 5.186 6.843 -5.692 496 H ILE 75 H ILE 75 3.438 -1.504 -6.860 497 HA ILE 75 HA ILE 75 4.559 -3.169 -8.705 498 HB ILE 75 HB ILE 75 2.005 -2.102 -8.014 499 1HG1 ILE 75 2HG1 ILE 75 2.776 -4.439 -7.701 500 2HG1 ILE 75 3HG1 ILE 75 1.207 -4.301 -8.516 501 1HG2 ILE 75 1HG2 ILE 75 2.160 -1.969 -10.893 502 2HG2 ILE 75 2HG2 ILE 75 0.949 -3.061 -10.278 503 3HG2 ILE 75 3HG2 ILE 75 0.901 -1.446 -9.683 504 1HD1 ILE 75 1HD1 ILE 75 2.671 -4.513 -10.679 505 2HD1 ILE 75 2HD1 ILE 75 3.889 -5.089 -9.508 506 3HD1 ILE 75 3HD1 ILE 75 2.320 -5.927 -9.647 507 HA PRO 76 HA PRO 76 4.792 0.002 -12.100 508 1HB PRO 76 HB2 PRO 76 5.126 2.686 -11.682 509 2HB PRO 76 HB3 PRO 76 3.558 1.853 -11.685 510 1HG PRO 76 HG2 PRO 76 5.249 2.646 -9.323 511 2HG PRO 76 HG3 PRO 76 3.488 2.852 -9.528 512 1HD PRO 76 HD2 PRO 76 4.664 0.881 -8.151 513 2HD PRO 76 HD3 PRO 76 3.091 0.602 -8.927 514 H GLY 77 H GLY 77 7.231 -0.751 -10.027 515 1HA GLY 77 HA3 GLY 77 8.975 -1.418 -11.707 516 2HA GLY 77 HA2 GLY 77 9.172 0.268 -12.105 517 H THR 78 H THR 78 9.058 0.404 -8.801 518 HA THR 78 HA THR 78 11.969 1.061 -9.087 519 HB THR 78 HB THR 78 9.574 2.875 -8.585 520 HG1 THR 78 HG1 THR 78 10.944 2.756 -11.020 521 1HG2 THR 78 1HG2 THR 78 12.241 3.256 -9.491 522 2HG2 THR 78 2HG2 THR 78 12.411 3.874 -8.345 523 3HG2 THR 78 3HG2 THR 78 11.170 3.890 -7.899 524 H ALA 79 H ALA 79 13.203 1.471 -7.237 525 HA ALA 79 HA ALA 79 13.795 2.332 -5.347 526 1HB ALA 79 HB1 ALA 79 12.552 4.220 -6.166 527 2HB ALA 79 HB2 ALA 79 11.076 3.655 -5.333 528 3HB ALA 79 HB3 ALA 79 12.516 4.188 -4.427 529 H MET 80 H MET 80 12.263 3.079 -2.869 530 HA MET 80 HA MET 80 12.907 0.500 -1.727 531 1HB MET 80 HB2 MET 80 14.785 1.442 -3.265 532 2HB MET 80 HB3 MET 80 14.911 2.746 -2.112 533 1HG MET 80 HG2 MET 80 15.094 0.581 -0.426 534 2HG MET 80 HG3 MET 80 15.580 -0.165 -1.954 535 1HE MET 80 HE1 MET 80 16.110 3.410 -0.404 536 2HE MET 80 HE2 MET 80 16.438 2.272 0.923 537 3HE MET 80 HE3 MET 80 17.755 3.256 0.234 538 H ALA 81 H ALA 81 13.459 4.105 -1.146 539 HA ALA 81 HA ALA 81 14.134 3.529 1.522 540 1HB ALA 81 HB1 ALA 81 13.722 6.383 0.675 541 2HB ALA 81 HB2 ALA 81 14.708 5.701 1.947 542 3HB ALA 81 HB3 ALA 81 15.166 5.405 0.277 543 H PHE 82 H PHE 82 11.256 2.874 1.107 544 HA PHE 82 HA PHE 82 9.984 4.144 3.418 545 1HB PHE 82 HB2 PHE 82 8.487 2.950 2.109 546 2HB PHE 82 HB3 PHE 82 9.614 1.626 1.826 547 HD1 PHE 82 HD1 PHE 82 8.514 3.229 5.035 548 HD2 PHE 82 HD2 PHE 82 8.698 -0.316 2.649 549 HE1 PHE 82 HE1 PHE 82 8.217 1.879 7.070 550 HE2 PHE 82 HE2 PHE 82 8.707 -1.691 4.701 551 HZ PHE 82 HZ PHE 82 8.771 -0.519 6.953 552 H GLY 83 H GLY 83 12.487 1.717 2.810 553 1HA GLY 83 HA3 GLY 83 14.360 2.809 3.418 554 2HA GLY 83 HA2 GLY 83 13.507 3.623 4.713 555 H GLY 84 H GLY 84 13.869 0.085 4.679 556 1HA GLY 84 HA3 GLY 84 16.030 -0.963 5.190 557 2HA GLY 84 HA2 GLY 84 16.413 0.340 6.283 558 H LEU 85 H LEU 85 13.099 -0.776 6.189 559 HA LEU 85 HA LEU 85 13.429 -3.164 7.774 560 1HB LEU 85 HB2 LEU 85 11.255 -2.120 7.721 561 2HB LEU 85 HB3 LEU 85 11.311 -1.917 5.977 562 HG LEU 85 HG LEU 85 10.946 -4.199 5.550 563 1HD1 LEU 85 1HD1 LEU 85 10.699 -5.692 8.190 564 2HD1 LEU 85 2HD1 LEU 85 11.071 -4.388 8.369 565 3HD1 LEU 85 3HD1 LEU 85 10.628 -5.679 6.896 566 1HD2 LEU 85 1HD2 LEU 85 8.733 -4.226 6.055 567 2HD2 LEU 85 2HD2 LEU 85 8.989 -3.888 7.785 568 3HD2 LEU 85 3HD2 LEU 85 9.085 -2.597 6.620 569 H LYS 86 H LYS 86 12.922 -4.982 6.355 570 HA LYS 86 HA LYS 86 15.078 -5.299 4.350 571 1HB LYS 86 HB3 LYS 86 14.998 -5.428 7.213 572 2HB LYS 86 HB2 LYS 86 14.820 -7.051 6.728 573 1HG LYS 86 HG2 LYS 86 17.105 -6.799 7.017 574 2HG LYS 86 HG3 LYS 86 16.873 -6.834 5.265 575 1HD LYS 86 HD3 LYS 86 18.426 -5.069 5.990 576 2HD LYS 86 HD2 LYS 86 17.040 -4.372 5.161 577 1HE LYS 86 HE2 LYS 86 17.798 -3.126 7.236 578 2HE LYS 86 HE3 LYS 86 16.097 -3.607 7.218 579 2HZ LYS 86 HZ2 LYS 86 17.069 -4.001 9.283 580 3HZ LYS 86 HZ3 LYS 86 18.241 -4.968 8.647 581 H LYS 87 H LYS 87 12.109 -6.842 5.778 582 HA LYS 87 HA LYS 87 13.694 -9.299 5.349 583 1HB LYS 87 HB2 LYS 87 13.063 -7.829 7.674 584 2HB LYS 87 HB3 LYS 87 11.854 -9.077 7.666 585 1HG LYS 87 HG2 LYS 87 13.697 -9.887 8.944 586 2HG LYS 87 HG3 LYS 87 13.702 -10.806 7.437 587 1HD LYS 87 HD2 LYS 87 15.451 -9.067 6.597 588 2HD LYS 87 HD3 LYS 87 15.553 -8.550 8.295 589 1HE LYS 87 HE3 LYS 87 16.163 -11.286 7.098 590 2HE LYS 87 HE2 LYS 87 17.330 -10.080 7.672 591 2HZ LYS 87 HZ2 LYS 87 15.426 -11.620 9.290 592 3HZ LYS 87 HZ3 LYS 87 16.306 -10.337 9.867 593 H GLU 88 H GLU 88 12.809 -11.296 5.680 594 HA GLU 88 HA GLU 88 11.210 -12.960 5.236 595 1HB GLU 88 HB2 GLU 88 10.985 -11.265 7.690 596 2HB GLU 88 HB3 GLU 88 9.727 -12.483 7.500 597 1HG GLU 88 HG2 GLU 88 11.206 -14.272 7.479 598 2HG GLU 88 HG3 GLU 88 12.628 -13.259 7.164 599 H LYS 89 H LYS 89 8.804 -10.810 6.565 600 HA LYS 89 HA LYS 89 6.912 -11.638 4.463 601 1HB LYS 89 HB2 LYS 89 8.148 -13.667 5.736 602 2HB LYS 89 HB3 LYS 89 7.064 -13.251 7.040 603 1HG LYS 89 HG2 LYS 89 5.161 -13.652 5.564 604 2HG LYS 89 HG3 LYS 89 6.220 -13.948 4.172 605 1HD LYS 89 HD2 LYS 89 6.611 -15.547 6.707 606 2HD LYS 89 HD3 LYS 89 5.210 -15.914 5.704 607 1HE LYS 89 HE2 LYS 89 7.300 -17.318 5.334 608 2HE LYS 89 HE3 LYS 89 6.504 -16.671 3.889 609 2HZ LYS 89 HZ2 LYS 89 8.177 -15.175 3.585 610 3HZ LYS 89 HZ3 LYS 89 8.980 -16.526 4.082 611 H ASP 90 H ASP 90 7.053 -9.082 5.824 612 HA ASP 90 HA ASP 90 5.038 -9.291 7.897 613 1HB ASP 90 HB2 ASP 90 5.197 -6.628 7.571 614 2HB ASP 90 HB3 ASP 90 6.353 -7.548 8.560 615 H ARG 91 H ARG 91 5.404 -7.892 4.721 616 HA ARG 91 HA ARG 91 2.828 -7.150 4.090 617 1HB ARG 91 HB2 ARG 91 4.787 -6.934 2.622 618 2HB ARG 91 HB3 ARG 91 4.817 -8.683 2.376 619 1HG ARG 91 HG2 ARG 91 2.639 -6.795 1.403 620 2HG ARG 91 HG3 ARG 91 3.946 -7.501 0.438 621 1HD ARG 91 HD3 ARG 91 2.918 -9.715 1.581 622 2HD ARG 91 HD2 ARG 91 1.456 -8.715 1.256 623 HE ARG 91 HE ARG 91 3.276 -9.119 -1.008 624 1HH1 ARG 91 2HH2 ARG 91 0.884 -10.652 1.051 625 2HH1 ARG 91 1HH2 ARG 91 0.904 -12.186 0.232 626 1HH2 ARG 91 2HH1 ARG 91 3.010 -11.217 -2.330 627 2HH2 ARG 91 1HH1 ARG 91 2.183 -12.477 -1.542 628 H ASN 92 H ASN 92 3.905 -10.552 4.182 629 HA ASN 92 HA ASN 92 1.715 -11.733 2.865 630 1HB ASN 92 HB2 ASN 92 3.887 -12.771 3.642 631 2HB ASN 92 HB3 ASN 92 3.119 -12.949 5.235 632 1HD2 ASN 92 1HD2 ASN 92 2.634 -15.127 5.393 633 2HD2 ASN 92 2HD2 ASN 92 1.843 -16.047 4.114 634 H ASP 93 H ASP 93 2.030 -11.511 6.451 635 HA ASP 93 HA ASP 93 -0.581 -12.011 7.165 636 1HB ASP 93 HB2 ASP 93 1.610 -10.359 8.413 637 2HB ASP 93 HB3 ASP 93 0.092 -10.796 9.234 638 H LEU 94 H LEU 94 0.875 -8.780 6.479 639 HA LEU 94 HA LEU 94 -1.404 -7.171 6.993 640 1HB LEU 94 HB2 LEU 94 0.631 -6.145 6.752 641 2HB LEU 94 HB3 LEU 94 1.017 -6.958 5.253 642 HG LEU 94 HG LEU 94 -0.133 -5.494 3.902 643 1HD1 LEU 94 1HD1 LEU 94 -1.803 -4.679 6.283 644 2HD1 LEU 94 2HD1 LEU 94 -1.601 -3.607 4.867 645 3HD1 LEU 94 3HD1 LEU 94 -2.294 -5.189 4.652 646 1HD2 LEU 94 1HD2 LEU 94 0.993 -3.987 6.263 647 2HD2 LEU 94 2HD2 LEU 94 1.887 -4.591 4.873 648 3HD2 LEU 94 3HD2 LEU 94 0.704 -3.284 4.638 649 H ILE 95 H ILE 95 -0.433 -8.449 3.784 650 HA ILE 95 HA ILE 95 -2.860 -7.717 2.447 651 HB ILE 95 HB ILE 95 -0.543 -9.462 1.844 652 1HG1 ILE 95 2HG1 ILE 95 -0.240 -7.998 -0.095 653 2HG1 ILE 95 3HG1 ILE 95 -1.830 -7.292 0.058 654 1HG2 ILE 95 1HG2 ILE 95 -3.151 -9.669 0.345 655 2HG2 ILE 95 2HG2 ILE 95 -1.580 -10.139 -0.336 656 3HG2 ILE 95 3HG2 ILE 95 -2.198 -10.958 1.101 657 1HD1 ILE 95 1HD1 ILE 95 0.205 -6.950 2.236 658 2HD1 ILE 95 2HD1 ILE 95 0.190 -5.964 0.773 659 3HD1 ILE 95 3HD1 ILE 95 -1.228 -5.952 1.803 660 H THR 96 H THR 96 -1.993 -10.714 4.269 661 HA THR 96 HA THR 96 -4.437 -12.076 3.879 662 HB THR 96 HB THR 96 -2.241 -12.182 5.797 663 HG1 THR 96 HG1 THR 96 -2.539 -13.716 4.271 664 1HG2 THR 96 1HG2 THR 96 -3.351 -13.507 7.517 665 2HG2 THR 96 2HG2 THR 96 -3.860 -11.826 7.595 666 3HG2 THR 96 3HG2 THR 96 -4.941 -13.056 6.879 667 H TYR 97 H TYR 97 -3.682 -9.620 6.379 668 HA TYR 97 HA TYR 97 -6.238 -9.529 7.580 669 1HB TYR 97 HB2 TYR 97 -3.745 -8.087 7.790 670 2HB TYR 97 HB3 TYR 97 -5.021 -6.902 7.634 671 HD1 TYR 97 HD1 TYR 97 -3.403 -9.247 9.850 672 HD2 TYR 97 HD2 TYR 97 -7.062 -7.060 9.199 673 HE1 TYR 97 HE1 TYR 97 -4.025 -9.556 12.240 674 HE2 TYR 97 HE2 TYR 97 -7.674 -7.378 11.581 675 HH TYR 97 HH TYR 97 -7.062 -8.267 13.580 676 H LEU 98 H LEU 98 -4.883 -7.503 4.951 677 HA LEU 98 HA LEU 98 -7.281 -6.038 4.421 678 1HB LEU 98 HB2 LEU 98 -5.007 -6.879 2.647 679 2HB LEU 98 HB3 LEU 98 -6.309 -5.826 2.076 680 HG LEU 98 HG LEU 98 -4.562 -5.130 4.466 681 1HD1 LEU 98 1HD1 LEU 98 -3.382 -3.628 2.816 682 2HD1 LEU 98 2HD1 LEU 98 -3.197 -5.353 2.444 683 3HD1 LEU 98 3HD1 LEU 98 -4.345 -4.382 1.518 684 1HD2 LEU 98 1HD2 LEU 98 -6.772 -3.900 4.296 685 2HD2 LEU 98 2HD2 LEU 98 -5.357 -2.859 4.104 686 3HD2 LEU 98 3HD2 LEU 98 -6.290 -3.352 2.677 687 H LYS 99 H LYS 99 -6.215 -9.241 3.097 688 HA LYS 99 HA LYS 99 -8.521 -9.658 1.473 689 1HB LYS 99 HB2 LYS 99 -6.309 -11.260 2.484 690 2HB LYS 99 HB3 LYS 99 -7.800 -12.138 2.774 691 1HG LYS 99 HG2 LYS 99 -6.709 -12.717 0.676 692 2HG LYS 99 HG3 LYS 99 -8.366 -12.121 0.427 693 1HD LYS 99 HD2 LYS 99 -7.566 -9.986 -0.348 694 2HD LYS 99 HD3 LYS 99 -5.901 -10.361 0.126 695 1HE LYS 99 HE2 LYS 99 -7.196 -10.731 -2.400 696 2HE LYS 99 HE3 LYS 99 -5.536 -11.161 -1.961 697 2HZ LYS 99 HZ2 LYS 99 -7.963 -12.754 -1.870 698 3HZ LYS 99 HZ3 LYS 99 -6.665 -12.960 -2.827 699 H LYS 100 H LYS 100 -8.119 -10.628 4.899 700 HA LYS 100 HA LYS 100 -10.879 -11.344 5.233 701 1HB LYS 100 HB2 LYS 100 -8.736 -10.392 7.177 702 2HB LYS 100 HB3 LYS 100 -10.381 -10.752 7.696 703 1HG LYS 100 HG2 LYS 100 -9.559 -12.920 6.006 704 2HG LYS 100 HG3 LYS 100 -8.194 -12.577 7.057 705 1HD LYS 100 HD2 LYS 100 -9.213 -13.565 8.822 706 2HD LYS 100 HD3 LYS 100 -10.696 -12.628 8.618 707 1HE LYS 100 HE2 LYS 100 -11.456 -14.165 6.838 708 2HE LYS 100 HE3 LYS 100 -9.997 -15.152 7.081 709 2HZ LYS 100 HZ2 LYS 100 -11.831 -16.011 8.252 710 3HZ LYS 100 HZ3 LYS 100 -12.092 -14.587 9.032 711 H ALA 101 H ALA 101 -9.430 -8.112 5.523 712 HA ALA 101 HA ALA 101 -11.868 -6.962 6.522 713 1HB ALA 101 HB1 ALA 101 -10.755 -4.802 6.080 714 2HB ALA 101 HB2 ALA 101 -9.674 -5.941 6.910 715 3HB ALA 101 HB3 ALA 101 -9.485 -5.642 5.168 716 H THR 102 H THR 102 -10.481 -7.229 3.277 717 HA THR 102 HA THR 102 -12.499 -5.564 1.986 718 HB THR 102 HB THR 102 -10.261 -7.182 0.685 719 HG1 THR 102 HG1 THR 102 -10.067 -4.520 1.534 720 1HG2 THR 102 1HG2 THR 102 -10.382 -5.424 -1.017 721 2HG2 THR 102 2HG2 THR 102 -11.975 -6.159 -0.843 722 3HG2 THR 102 3HG2 THR 102 -11.650 -4.574 -0.106 723 H GLU 103 H GLU 103 -11.379 -8.959 1.689 724 HA GLU 103 HA GLU 103 -13.421 -9.626 -0.335 725 1HB GLU 103 HB2 GLU 103 -10.881 -10.953 0.710 726 2HB GLU 103 HB3 GLU 103 -12.099 -11.845 -0.190 727 1HG GLU 103 HG2 GLU 103 -11.571 -9.487 -1.727 728 2HG GLU 103 HG3 GLU 103 -10.004 -10.082 -1.163 729 HHA HEC 118 HHA HEC 118 -0.522 5.142 -1.993 730 HHB HEC 118 HHB HEC 118 1.433 -0.734 -0.230 731 HHC HEC 118 HHC HEC 118 5.145 1.961 4.334 732 HHD HEC 118 HHD HEC 118 3.049 7.762 2.662 733 1HMA HEC 118 1HMA HEC 118 -1.269 -0.301 -2.299 734 2HMA HEC 118 2HMA HEC 118 0.011 -0.053 -3.496 735 3HMA HEC 118 3HMA HEC 118 0.333 -1.010 -2.056 736 1HAA HEC 118 1HAA HEC 118 -1.910 3.487 -2.882 737 2HAA HEC 118 2HAA HEC 118 -1.911 1.775 -3.257 738 1HBA HEC 118 1HBA HEC 118 -1.379 2.851 -5.300 739 2HBA HEC 118 2HBA HEC 118 0.130 2.147 -4.731 740 1HMB HEC 118 1HMB HEC 118 3.409 -2.655 1.307 741 2HMB HEC 118 2HMB HEC 118 2.391 -2.585 2.775 742 3HMB HEC 118 3HMB HEC 118 1.695 -2.230 1.241 743 HAB HEC 118 HAB HEC 118 5.759 -0.775 3.549 744 1HBB HEC 118 1HBB HEC 118 4.690 -2.910 3.132 745 2HBB HEC 118 2HBB HEC 118 5.341 -2.777 4.752 746 3HBB HEC 118 3HBB HEC 118 3.602 -2.635 4.543 747 1HMC HEC 118 1HMC HEC 118 5.889 5.039 6.338 748 2HMC HEC 118 2HMC HEC 118 4.993 3.512 6.360 749 3HMC HEC 118 3HMC HEC 118 6.457 3.687 5.399 750 HAC HEC 118 HAC HEC 118 4.701 6.736 6.067 751 1HBC HEC 118 1HBC HEC 118 6.784 7.049 4.785 752 2HBC HEC 118 2HBC HEC 118 5.930 8.159 3.687 753 3HBC HEC 118 3HBC HEC 118 6.139 8.585 5.403 754 1HMD HEC 118 1HMD HEC 118 1.669 9.289 2.010 755 2HMD HEC 118 2HMD HEC 118 1.749 9.679 0.282 756 3HMD HEC 118 3HMD HEC 118 0.192 9.501 1.096 757 1HAD HEC 118 1HAD HEC 118 -0.972 8.675 -0.573 758 2HAD HEC 118 2HAD HEC 118 -1.508 7.133 -1.209 759 1HBD HEC 118 1HBD HEC 118 -1.006 8.819 -2.969 760 2HBD HEC 118 2HBD HEC 118 0.043 7.398 -3.134
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