NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
2087 | 1bd6 | 4268 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H ALA 1 HN1 ALA 1 -2.590 -5.153 8.265 2 2H ALA 1 HN2 ALA 1 -2.918 -3.747 9.122 3 2H ALA 1 HN3 ALA 1 -2.918 -3.747 9.122 4 HA ALA 1 HA ALA 1 -0.602 -4.313 7.435 5 1HB ALA 1 HB3 ALA 1 0.061 -3.065 9.379 6 2HB ALA 1 HB2 ALA 1 0.368 -2.385 7.768 7 3HB ALA 1 HB1 ALA 1 -0.938 -1.709 8.786 8 H TYR 2 HN TYR 2 -0.978 -1.320 6.670 9 HA TYR 2 HA TYR 2 -3.449 -1.406 5.043 10 1HB TYR 2 HB2 TYR 2 -1.660 0.743 6.122 11 2HB TYR 2 HB3 TYR 2 -2.526 1.039 4.626 12 HD1 TYR 2 HD1 TYR 2 -2.970 0.231 8.204 13 HD2 TYR 2 HD2 TYR 2 -4.941 1.252 4.524 14 HE1 TYR 2 HE1 TYR 2 -5.091 0.602 9.452 15 HE2 TYR 2 HE2 TYR 2 -7.052 1.631 5.759 16 HH TYR 2 HOH TYR 2 -7.684 2.283 8.042 17 H VAL 3 HN VAL 3 -3.396 -1.641 2.909 18 HA VAL 3 HA VAL 3 -0.721 -1.851 1.567 19 HB VAL 3 HB VAL 3 -2.851 -3.902 1.155 20 1HG1 VAL 3 HG13 VAL 3 0.209 -3.832 1.122 21 2HG1 VAL 3 HG11 VAL 3 -0.718 -5.320 0.954 22 3HG1 VAL 3 HG12 VAL 3 -0.887 -4.041 -0.262 23 1HG2 VAL 3 HG23 VAL 3 -1.020 -3.878 3.562 24 2HG2 VAL 3 HG21 VAL 3 -2.796 -4.029 3.541 25 3HG2 VAL 3 HG22 VAL 3 -1.784 -5.349 2.956 26 H ILE 4 HN ILE 4 -0.725 -1.930 -0.626 27 HA ILE 4 HA ILE 4 -2.372 0.050 -1.790 28 HB ILE 4 HB ILE 4 0.104 -1.206 -2.321 29 1HG1 ILE 4 HG12 ILE 4 0.051 -0.058 -4.580 30 2HG1 ILE 4 HG13 ILE 4 -1.652 0.325 -4.306 31 1HG2 ILE 4 HG23 ILE 4 -1.019 -3.186 -3.071 32 2HG2 ILE 4 HG21 ILE 4 -1.605 -2.312 -4.518 33 3HG2 ILE 4 HG22 ILE 4 0.140 -2.457 -4.230 34 1HD1 ILE 4 HD1 ILE 4 -0.197 1.175 -1.961 35 2HD1 ILE 4 HD2 ILE 4 0.694 1.737 -3.390 36 3HD1 ILE 4 HD3 ILE 4 -1.019 2.150 -3.193 37 H THR 5 HN THR 5 -3.819 -0.214 -3.722 38 HA THR 5 HA THR 5 -4.478 -2.967 -4.404 39 HB THR 5 HB THR 5 -6.903 -2.442 -4.651 40 HG1 THR 5 HOG THR 5 -6.291 -0.180 -3.059 41 1HG2 THR 5 HG2 THR 5 -6.099 -3.719 -2.702 42 2HG2 THR 5 HG3 THR 5 -6.035 -2.210 -1.763 43 3HG2 THR 5 HG1 THR 5 -7.591 -2.812 -2.388 44 H GLU 6 HN GLU 6 -5.637 -3.028 -6.387 45 HA GLU 6 HA GLU 6 -4.886 -2.272 -8.675 46 1HB GLU 6 HB2 GLU 6 -6.803 -3.585 -8.156 47 2HB GLU 6 HB3 GLU 6 -7.696 -2.146 -7.787 48 1HG GLU 6 HG2 GLU 6 -8.445 -2.575 -9.884 49 2HG GLU 6 HG3 GLU 6 -7.116 -1.493 -10.317 50 HA PRO 7 HA PRO 7 -7.038 1.934 -9.301 51 1HB PRO 7 HB2 PRO 7 -7.393 3.527 -6.943 52 2HB PRO 7 HB3 PRO 7 -8.621 2.764 -7.982 53 1HG PRO 7 HG2 PRO 7 -7.395 1.701 -5.438 54 2HG PRO 7 HG3 PRO 7 -9.074 1.544 -6.014 55 1HD PRO 7 HD2 PRO 7 -7.356 -0.501 -6.195 56 2HD PRO 7 HD3 PRO 7 -8.460 -0.127 -7.554 57 H CYS 8 HN CYS 8 -4.395 1.712 -6.870 58 HA CYS 8 HA CYS 8 -3.358 4.335 -7.646 59 1HB CYS 8 HB2 CYS 8 -2.871 3.550 -5.481 60 2HB CYS 8 HB3 CYS 8 -2.130 2.089 -6.103 61 H ILE 9 HN ILE 9 -3.193 1.070 -9.061 62 HA ILE 9 HA ILE 9 -0.773 1.189 -10.398 63 HB ILE 9 HB ILE 9 -3.348 -0.103 -11.200 64 1HG1 ILE 9 HG12 ILE 9 -0.824 -1.175 -9.888 65 2HG1 ILE 9 HG13 ILE 9 -2.312 -0.792 -9.005 66 1HG2 ILE 9 HG23 ILE 9 -0.506 -0.475 -12.274 67 2HG2 ILE 9 HG21 ILE 9 -1.889 -1.508 -12.689 68 3HG2 ILE 9 HG22 ILE 9 -1.881 0.172 -13.191 69 1HD1 ILE 9 HD3 ILE 9 -3.492 -2.416 -10.523 70 2HD1 ILE 9 HD1 ILE 9 -1.871 -2.972 -11.024 71 3HD1 ILE 9 HD2 ILE 9 -2.354 -3.078 -9.319 72 H GLY 10 HN GLY 10 -0.072 2.467 -12.031 73 1HA GLY 10 HA2 GLY 10 -0.102 3.705 -13.988 74 2HA GLY 10 HA3 GLY 10 -1.857 3.527 -14.098 75 H THR 11 HN THR 11 -2.605 4.641 -11.551 76 HA THR 11 HA THR 11 -2.408 7.443 -11.850 77 HB THR 11 HB THR 11 -2.725 5.955 -9.208 78 HG1 THR 11 HOG THR 11 -4.545 5.183 -9.967 79 1HG2 THR 11 HG3 THR 11 -3.875 8.565 -10.280 80 2HG2 THR 11 HG1 THR 11 -4.274 7.822 -8.716 81 3HG2 THR 11 HG2 THR 11 -2.626 8.402 -9.023 82 H LYS 12 HN LYS 12 -0.561 5.170 -9.825 83 HA LYS 12 HA LYS 12 1.543 4.885 -9.474 84 1HB LYS 12 HB2 LYS 12 1.640 5.339 -11.883 85 2HB LYS 12 HB3 LYS 12 2.097 7.023 -11.583 86 1HG LYS 12 HG2 LYS 12 3.662 4.837 -10.241 87 2HG LYS 12 HG3 LYS 12 3.872 5.008 -11.973 88 1HD LYS 12 HD2 LYS 12 4.914 7.054 -11.824 89 2HD LYS 12 HD3 LYS 12 4.129 7.532 -10.321 90 1HE LYS 12 HE2 LYS 12 6.121 5.216 -10.396 91 2HE LYS 12 HE3 LYS 12 6.640 6.898 -10.206 92 1HZ LYS 12 HNZ2 LYS 12 4.681 5.709 -8.353 93 2HZ LYS 12 HNZ3 LYS 12 6.333 5.738 -8.109 94 3HZ LYS 12 HNZ1 LYS 12 5.471 7.132 -8.273 95 H ASP 13 HN ASP 13 0.823 8.359 -9.339 96 HA ASP 13 HA ASP 13 2.204 8.582 -6.772 97 1HB ASP 13 HB2 ASP 13 3.150 9.921 -9.295 98 2HB ASP 13 HB3 ASP 13 2.966 10.976 -7.898 99 H ALA 14 HN ALA 14 1.657 10.777 -5.849 100 HA ALA 14 HA ALA 14 -0.706 12.137 -6.635 101 1HB ALA 14 HB1 ALA 14 -1.129 9.637 -5.121 102 2HB ALA 14 HB2 ALA 14 -1.873 11.059 -4.369 103 3HB ALA 14 HB3 ALA 14 -2.260 10.636 -6.044 104 H SER 15 HN SER 15 1.093 12.857 -2.993 105 HA SER 15 HA SER 15 0.909 10.056 -3.883 106 1HB SER 15 HB2 SER 15 3.553 11.349 -3.080 107 2HB SER 15 HB3 SER 15 3.289 9.763 -3.834 108 HG SER 15 HOG SER 15 3.860 10.937 -5.531 109 H CYS 16 HN CYS 16 1.743 8.668 -2.135 110 HA CYS 16 HA CYS 16 0.820 9.641 0.497 111 1HB CYS 16 HB2 CYS 16 1.281 7.184 1.049 112 2HB CYS 16 HB3 CYS 16 -0.146 7.623 0.137 113 H VAL 17 HN VAL 17 3.505 7.649 -0.586 114 HA VAL 17 HA VAL 17 5.337 7.146 0.788 115 HB VAL 17 HB VAL 17 5.825 7.665 -1.462 116 1HG1 VAL 17 HG12 VAL 17 5.008 10.134 -1.373 117 2HG1 VAL 17 HG13 VAL 17 6.673 10.505 -0.872 118 3HG1 VAL 17 HG11 VAL 17 6.372 9.703 -2.413 119 1HG2 VAL 17 HG22 VAL 17 7.696 7.097 0.058 120 2HG2 VAL 17 HG21 VAL 17 8.201 8.109 -1.307 121 3HG2 VAL 17 HG23 VAL 17 8.016 8.826 0.304 122 H GLU 18 HN GLU 18 5.597 10.742 0.806 123 HA GLU 18 HA GLU 18 7.477 10.631 2.898 124 1HB GLU 18 HB2 GLU 18 7.229 13.085 2.961 125 2HB GLU 18 HB3 GLU 18 7.468 12.451 1.330 126 1HG GLU 18 HG2 GLU 18 5.073 12.738 0.823 127 2HG GLU 18 HG3 GLU 18 4.767 13.268 2.487 128 H VAL 19 HN VAL 19 3.953 10.669 3.115 129 HA VAL 19 HA VAL 19 3.923 11.945 5.695 130 HB VAL 19 HB VAL 19 1.633 11.403 5.860 131 1HG1 VAL 19 HG12 VAL 19 2.308 13.183 4.266 132 2HG1 VAL 19 HG13 VAL 19 2.240 12.011 2.935 133 3HG1 VAL 19 HG11 VAL 19 0.770 12.415 3.835 134 1HG2 VAL 19 HG21 VAL 19 1.641 9.021 5.165 135 2HG2 VAL 19 HG22 VAL 19 0.402 9.974 4.344 136 3HG2 VAL 19 HG23 VAL 19 1.879 9.518 3.484 137 H CYS 20 HN CYS 20 4.790 8.677 4.855 138 HA CYS 20 HA CYS 20 3.470 7.478 7.062 139 1HB CYS 20 HB2 CYS 20 3.755 6.319 5.105 140 2HB CYS 20 HB3 CYS 20 5.518 6.489 5.157 141 HA PRO 21 HA PRO 21 6.413 8.465 10.313 142 1HB PRO 21 HB2 PRO 21 5.231 5.939 11.479 143 2HB PRO 21 HB3 PRO 21 5.556 7.496 12.290 144 1HG PRO 21 HG2 PRO 21 3.037 6.818 11.481 145 2HG PRO 21 HG3 PRO 21 3.639 8.492 11.285 146 1HD PRO 21 HD2 PRO 21 3.390 6.335 9.208 147 2HD PRO 21 HD3 PRO 21 3.103 8.100 9.090 148 H VAL 22 HN VAL 22 6.128 5.207 8.902 149 HA VAL 22 HA VAL 22 8.957 4.586 9.670 150 HB VAL 22 HB VAL 22 8.272 2.220 9.611 151 1HG1 VAL 22 HG12 VAL 22 8.320 3.477 11.745 152 2HG1 VAL 22 HG13 VAL 22 6.598 3.866 11.551 153 3HG1 VAL 22 HG11 VAL 22 7.111 2.181 11.743 154 1HG2 VAL 22 HG21 VAL 22 6.272 2.411 8.121 155 2HG2 VAL 22 HG22 VAL 22 5.923 1.569 9.638 156 3HG2 VAL 22 HG23 VAL 22 5.400 3.245 9.426 157 H ASP 23 HN ASP 23 7.762 6.036 7.282 158 HA ASP 23 HA ASP 23 7.864 6.101 5.067 159 1HB ASP 23 HB2 ASP 23 10.031 6.552 4.394 160 2HB ASP 23 HB3 ASP 23 10.002 6.880 6.126 161 H CYS 24 HN CYS 24 7.136 3.264 5.756 162 HA CYS 24 HA CYS 24 8.746 1.633 4.065 163 1HB CYS 24 HB2 CYS 24 7.457 -0.196 4.833 164 2HB CYS 24 HB3 CYS 24 7.766 0.887 6.198 165 HG CYS 24 HSG CYS 24 5.262 -0.375 5.894 166 H ILE 25 HN ILE 25 7.378 3.656 2.526 167 HA ILE 25 HA ILE 25 5.579 2.108 0.712 168 HB ILE 25 HB ILE 25 6.168 5.088 0.894 169 1HG1 ILE 25 HG12 ILE 25 3.655 5.249 1.122 170 2HG1 ILE 25 HG13 ILE 25 3.592 3.516 1.348 171 1HG2 ILE 25 HG22 ILE 25 4.483 3.512 -1.098 172 2HG2 ILE 25 HG23 ILE 25 4.469 5.280 -0.958 173 3HG2 ILE 25 HG21 ILE 25 5.943 4.464 -1.459 174 1HD1 ILE 25 HD1 ILE 25 5.467 4.886 3.201 175 2HD1 ILE 25 HD2 ILE 25 3.775 5.417 3.251 176 3HD1 ILE 25 HD3 ILE 25 4.167 3.709 3.535 177 H HIS 26 HN HIS 26 6.749 1.130 -0.956 178 HA HIS 26 HA HIS 26 9.278 2.429 -1.880 179 1HB HIS 26 HB2 HIS 26 8.646 -0.476 -1.396 180 2HB HIS 26 HB3 HIS 26 10.160 0.186 -1.952 181 HD1 HIS 26 HND HIS 26 11.052 2.199 0.130 182 HD2 HIS 26 HD HIS 26 8.644 -1.107 1.128 183 HE1 HIS 26 HE HIS 26 11.340 1.812 2.634 184 H GLU 27 HN GLU 27 9.649 2.161 -4.142 185 HA GLU 27 HA GLU 27 7.258 1.961 -5.633 186 1HB GLU 27 HB2 GLU 27 10.146 2.125 -6.545 187 2HB GLU 27 HB3 GLU 27 8.735 2.243 -7.610 188 1HG GLU 27 HG2 GLU 27 8.928 4.178 -5.301 189 2HG GLU 27 HG3 GLU 27 9.902 4.413 -6.755 190 H GLY 28 HN GLY 28 6.619 0.407 -7.205 191 1HA GLY 28 HA2 GLY 28 8.462 -1.964 -7.546 192 2HA GLY 28 HA3 GLY 28 6.713 -2.136 -7.578 193 H GLU 29 HN GLU 29 6.288 -2.666 -9.666 194 HA GLU 29 HA GLU 29 7.946 -2.077 -11.828 195 1HB GLU 29 HB2 GLU 29 4.973 -2.867 -11.730 196 2HB GLU 29 HB3 GLU 29 6.044 -2.945 -13.109 197 1HG GLU 29 HG2 GLU 29 6.144 -5.131 -12.360 198 2HG GLU 29 HG3 GLU 29 7.551 -4.463 -11.529 199 H ASP 30 HN ASP 30 4.674 -0.867 -11.184 200 HA ASP 30 HA ASP 30 5.144 1.614 -12.777 201 1HB ASP 30 HB2 ASP 30 3.442 0.255 -13.736 202 2HB ASP 30 HB3 ASP 30 2.728 -0.155 -12.182 203 H GLN 31 HN GLN 31 2.907 0.582 -10.285 204 HA GLN 31 HA GLN 31 3.006 3.129 -8.893 205 1HB GLN 31 HB2 GLN 31 1.326 1.990 -7.380 206 2HB GLN 31 HB3 GLN 31 0.864 2.106 -9.078 207 1HG GLN 31 HG2 GLN 31 1.152 -0.179 -9.473 208 2HG GLN 31 HG3 GLN 31 2.332 -0.354 -8.189 209 1HE2 GLN 31 HNE2 GLN 31 -1.421 -0.063 -6.582 210 2HE2 GLN 31 HNE1 GLN 31 -0.735 1.264 -7.489 211 H TYR 32 HN TYR 32 2.957 3.068 -6.417 212 HA TYR 32 HA TYR 32 5.323 1.635 -5.471 213 1HB TYR 32 HB2 TYR 32 3.393 3.275 -3.781 214 2HB TYR 32 HB3 TYR 32 5.023 2.732 -3.372 215 HD1 TYR 32 HD1 TYR 32 3.108 5.177 -5.420 216 HD2 TYR 32 HD2 TYR 32 6.917 4.065 -3.736 217 HE1 TYR 32 HE1 TYR 32 3.896 7.491 -5.665 218 HE2 TYR 32 HE2 TYR 32 7.697 6.404 -3.973 219 HH TYR 32 HOH TYR 32 5.722 8.941 -5.513 220 H TYR 33 HN TYR 33 5.271 0.520 -3.536 221 HA TYR 33 HA TYR 33 2.794 -0.998 -2.893 222 1HB TYR 33 HB2 TYR 33 5.635 -2.070 -2.916 223 2HB TYR 33 HB3 TYR 33 4.253 -2.945 -2.332 224 HD1 TYR 33 HD1 TYR 33 5.468 -1.273 -5.481 225 HD2 TYR 33 HD2 TYR 33 3.211 -4.494 -3.764 226 HE1 TYR 33 HE1 TYR 33 4.560 -1.780 -7.687 227 HE2 TYR 33 HE2 TYR 33 2.265 -5.020 -5.978 228 HH TYR 33 HOH TYR 33 3.808 -3.713 -8.858 229 H ILE 34 HN ILE 34 3.289 -2.008 -0.611 230 HA ILE 34 HA ILE 34 4.720 -0.083 1.146 231 HB ILE 34 HB ILE 34 1.880 -1.176 1.545 232 1HG1 ILE 34 HG12 ILE 34 2.833 1.634 0.958 233 2HG1 ILE 34 HG13 ILE 34 2.001 0.603 -0.195 234 1HG2 ILE 34 HG21 ILE 34 3.518 0.736 3.279 235 2HG2 ILE 34 HG22 ILE 34 1.828 0.294 3.572 236 3HG2 ILE 34 HG23 ILE 34 3.067 -0.915 3.732 237 1HD1 ILE 34 HD2 ILE 34 -0.012 0.564 1.213 238 2HD1 ILE 34 HD3 ILE 34 0.749 1.740 2.318 239 3HD1 ILE 34 HD1 ILE 34 0.446 2.176 0.632 240 H ASP 35 HN ASP 35 5.779 -1.224 2.897 241 HA ASP 35 HA ASP 35 5.464 -4.122 2.978 242 1HB ASP 35 HB2 ASP 35 7.674 -3.198 3.346 243 2HB ASP 35 HB3 ASP 35 7.088 -2.363 4.781 244 HA PRO 36 HA PRO 36 1.988 -3.029 5.671 245 1HB PRO 36 HB2 PRO 36 1.185 -5.847 5.793 246 2HB PRO 36 HB3 PRO 36 0.337 -4.424 5.162 247 1HG PRO 36 HG2 PRO 36 1.482 -6.505 3.580 248 2HG PRO 36 HG3 PRO 36 1.328 -4.837 2.971 249 1HD PRO 36 HD2 PRO 36 3.743 -6.115 4.233 250 2HD PRO 36 HD3 PRO 36 3.609 -5.124 2.768 251 H ASP 37 HN ASP 37 4.619 -5.338 6.387 252 HA ASP 37 HA ASP 37 3.521 -6.136 8.957 253 1HB ASP 37 HB2 ASP 37 5.593 -6.982 7.068 254 2HB ASP 37 HB3 ASP 37 5.530 -7.592 8.682 255 H VAL 38 HN VAL 38 5.937 -4.138 7.347 256 HA VAL 38 HA VAL 38 7.094 -3.097 9.840 257 HB VAL 38 HB VAL 38 7.100 -2.200 6.950 258 1HG1 VAL 38 HG11 VAL 38 8.345 -0.840 9.362 259 2HG1 VAL 38 HG12 VAL 38 8.853 -0.537 7.688 260 3HG1 VAL 38 HG13 VAL 38 7.191 -0.161 8.186 261 1HG2 VAL 38 HG22 VAL 38 8.503 -4.222 7.681 262 2HG2 VAL 38 HG23 VAL 38 9.401 -2.889 6.940 263 3HG2 VAL 38 HG21 VAL 38 9.421 -3.100 8.705 264 H CYS 39 HN CYS 39 4.567 -1.996 7.430 265 HA CYS 39 HA CYS 39 3.900 0.418 8.682 266 1HB CYS 39 HB2 CYS 39 2.998 -0.320 6.499 267 2HB CYS 39 HB3 CYS 39 2.250 -1.632 7.321 268 H ILE 40 HN ILE 40 2.724 0.970 10.449 269 HA ILE 40 HA ILE 40 2.334 -1.171 12.434 270 HB ILE 40 HB ILE 40 2.342 0.663 14.022 271 1HG1 ILE 40 HG12 ILE 40 3.353 2.886 12.724 272 2HG1 ILE 40 HG13 ILE 40 2.031 2.413 11.656 273 1HG2 ILE 40 HG23 ILE 40 4.429 -0.457 13.268 274 2HG2 ILE 40 HG21 ILE 40 4.662 0.824 12.061 275 3HG2 ILE 40 HG22 ILE 40 4.690 1.214 13.791 276 1HD1 ILE 40 HD2 ILE 40 1.769 2.791 14.669 277 2HD1 ILE 40 HD3 ILE 40 1.354 4.003 13.446 278 3HD1 ILE 40 HD1 ILE 40 0.453 2.475 13.508 279 H ASP 41 HN ASP 41 0.154 -0.792 10.312 280 HA ASP 41 HA ASP 41 -2.012 -0.124 10.080 281 1HB ASP 41 HB2 ASP 41 -2.074 -1.457 12.800 282 2HB ASP 41 HB3 ASP 41 -3.534 -0.796 12.057 283 H CYS 42 HN CYS 42 -1.593 2.077 9.816 284 HA CYS 42 HA CYS 42 -2.630 3.743 12.031 285 1HB CYS 42 HB2 CYS 42 -0.957 5.120 12.115 286 2HB CYS 42 HB3 CYS 42 0.004 3.750 11.570 287 H GLY 43 HN GLY 43 -3.317 5.939 11.128 288 1HA GLY 43 HA2 GLY 43 -5.068 5.301 8.773 289 2HA GLY 43 HA3 GLY 43 -5.443 6.375 10.115 290 H ALA 44 HN ALA 44 -2.242 6.971 9.147 291 HA ALA 44 HA ALA 44 -2.985 9.622 8.339 292 1HB ALA 44 HB2 ALA 44 -0.890 9.150 9.513 293 2HB ALA 44 HB3 ALA 44 -0.288 8.209 8.135 294 3HB ALA 44 HB1 ALA 44 -0.576 9.952 7.962 295 H CYS 45 HN CYS 45 -1.200 7.136 6.453 296 HA CYS 45 HA CYS 45 -1.443 8.459 3.993 297 1HB CYS 45 HB2 CYS 45 -0.646 6.469 3.007 298 2HB CYS 45 HB3 CYS 45 0.238 6.795 4.478 299 H GLU 46 HN GLU 46 -3.487 5.882 5.378 300 HA GLU 46 HA GLU 46 -5.387 5.412 3.470 301 1HB GLU 46 HB2 GLU 46 -5.419 4.476 5.799 302 2HB GLU 46 HB3 GLU 46 -5.979 6.043 6.400 303 1HG GLU 46 HG2 GLU 46 -8.004 5.781 4.826 304 2HG GLU 46 HG3 GLU 46 -7.465 4.115 4.583 305 H ALA 47 HN ALA 47 -5.425 8.248 5.692 306 HA ALA 47 HA ALA 47 -7.826 9.359 4.594 307 1HB ALA 47 HB3 ALA 47 -7.023 9.850 6.871 308 2HB ALA 47 HB1 ALA 47 -5.605 10.690 6.203 309 3HB ALA 47 HB2 ALA 47 -7.235 11.339 5.925 310 H VAL 48 HN VAL 48 -4.336 9.842 3.831 311 HA VAL 48 HA VAL 48 -4.870 12.214 2.322 312 HB VAL 48 HB VAL 48 -2.758 11.157 3.633 313 1HG1 VAL 48 HG13 VAL 48 -2.101 9.697 1.780 314 2HG1 VAL 48 HG11 VAL 48 -1.987 11.106 0.687 315 3HG1 VAL 48 HG12 VAL 48 -0.890 10.956 2.070 316 1HG2 VAL 48 HG22 VAL 48 -3.256 13.455 3.412 317 2HG2 VAL 48 HG23 VAL 48 -1.570 13.157 2.958 318 3HG2 VAL 48 HG21 VAL 48 -2.786 13.454 1.690 319 H CYS 49 HN CYS 49 -4.351 8.768 1.559 320 HA CYS 49 HA CYS 49 -3.804 9.028 -1.149 321 1HB CYS 49 HB2 CYS 49 -3.463 6.967 0.156 322 2HB CYS 49 HB3 CYS 49 -5.195 6.795 0.285 323 HA PRO 50 HA PRO 50 -7.773 10.428 -2.749 324 1HB PRO 50 HB2 PRO 50 -6.931 8.983 -5.249 325 2HB PRO 50 HB3 PRO 50 -7.566 10.640 -5.064 326 1HG PRO 50 HG2 PRO 50 -4.892 10.111 -5.448 327 2HG PRO 50 HG3 PRO 50 -5.453 11.467 -4.426 328 1HD PRO 50 HD2 PRO 50 -4.352 8.813 -3.585 329 2HD PRO 50 HD3 PRO 50 -4.222 10.415 -2.801 330 H VAL 51 HN VAL 51 -9.566 9.389 -2.084 331 HA VAL 51 HA VAL 51 -11.168 7.878 -1.743 332 HB VAL 51 HB VAL 51 -10.307 6.302 -4.189 333 1HG1 VAL 51 HG11 VAL 51 -13.006 7.092 -2.995 334 2HG1 VAL 51 HG12 VAL 51 -12.802 6.246 -4.538 335 3HG1 VAL 51 HG13 VAL 51 -12.310 5.461 -3.042 336 1HG2 VAL 51 HG23 VAL 51 -11.637 9.044 -4.186 337 2HG2 VAL 51 HG21 VAL 51 -10.111 8.593 -4.982 338 3HG2 VAL 51 HG22 VAL 51 -11.627 7.934 -5.571 339 H SER 52 HN SER 52 -8.353 7.408 -0.702 340 HA SER 52 HA SER 52 -7.133 5.864 0.384 341 1HB SER 52 HB2 SER 52 -9.813 4.635 1.034 342 2HB SER 52 HB3 SER 52 -8.305 4.502 1.959 343 HG SER 52 HOG SER 52 -8.383 6.790 2.251 344 H ALA 53 HN ALA 53 -6.857 5.347 -2.184 345 HA ALA 53 HA ALA 53 -7.420 2.725 -3.095 346 1HB ALA 53 HB2 ALA 53 -5.938 4.870 -4.068 347 2HB ALA 53 HB3 ALA 53 -4.677 3.672 -3.706 348 3HB ALA 53 HB1 ALA 53 -6.000 3.268 -4.797 349 H ILE 54 HN ILE 54 -5.040 3.942 -0.770 350 HA ILE 54 HA ILE 54 -3.889 1.357 -0.135 351 HB ILE 54 HB ILE 54 -4.084 3.944 1.441 352 1HG1 ILE 54 HG12 ILE 54 -1.796 2.793 -0.223 353 2HG1 ILE 54 HG13 ILE 54 -2.851 4.139 -0.662 354 1HG2 ILE 54 HG23 ILE 54 -3.260 1.300 2.305 355 2HG2 ILE 54 HG21 ILE 54 -1.849 2.351 2.278 356 3HG2 ILE 54 HG22 ILE 54 -3.280 2.837 3.198 357 1HD1 ILE 54 HD1 ILE 54 -2.097 5.242 1.562 358 2HD1 ILE 54 HD2 ILE 54 -0.716 4.124 1.456 359 3HD1 ILE 54 HD3 ILE 54 -1.031 5.273 0.150 360 H TYR 55 HN TYR 55 -5.219 -0.234 0.556 361 HA TYR 55 HA TYR 55 -7.391 0.374 2.508 362 1HB TYR 55 HB2 TYR 55 -7.344 -1.524 0.209 363 2HB TYR 55 HB3 TYR 55 -8.504 -1.689 1.527 364 HD1 TYR 55 HD2 TYR 55 -9.749 0.713 2.099 365 HD2 TYR 55 HD1 TYR 55 -8.332 -0.653 -1.733 366 HE1 TYR 55 HE2 TYR 55 -11.336 2.239 0.960 367 HE2 TYR 55 HE1 TYR 55 -9.934 0.853 -2.865 368 HH TYR 55 HOH TYR 55 -11.118 3.503 -1.552 369 H HIS 56 HN HIS 56 -7.830 -1.229 4.055 370 HA HIS 56 HA HIS 56 -5.364 -2.345 5.037 371 1HB HIS 56 HB2 HIS 56 -7.186 -1.364 6.447 372 2HB HIS 56 HB3 HIS 56 -8.241 -2.702 5.986 373 HD1 HIS 56 HND HIS 56 -8.044 -4.851 7.500 374 HD2 HIS 56 HD HIS 56 -4.751 -2.255 7.679 375 HE1 HIS 56 HE HIS 56 -6.311 -5.982 8.989 376 H GLU 57 HN GLU 57 -4.728 -4.529 5.165 377 HA GLU 57 HA GLU 57 -5.184 -6.105 2.993 378 1HB GLU 57 HB2 GLU 57 -4.124 -7.879 4.428 379 2HB GLU 57 HB3 GLU 57 -3.284 -6.317 4.517 380 1HG GLU 57 HG2 GLU 57 -4.468 -5.932 6.681 381 2HG GLU 57 HG3 GLU 57 -5.070 -7.609 6.554 382 H ASP 58 HN ASP 58 -7.187 -6.087 5.863 383 HA ASP 58 HA ASP 58 -8.516 -8.612 5.321 384 1HB ASP 58 HB2 ASP 58 -8.364 -7.676 7.594 385 2HB ASP 58 HB3 ASP 58 -9.320 -6.262 7.097 386 H PHE 59 HN PHE 59 -9.356 -5.131 4.981 387 HA PHE 59 HA PHE 59 -11.961 -5.345 3.961 388 1HB PHE 59 HB2 PHE 59 -9.763 -3.252 3.762 389 2HB PHE 59 HB3 PHE 59 -11.434 -3.013 3.373 390 HD1 PHE 59 HD1 PHE 59 -11.634 -4.986 6.302 391 HD2 PHE 59 HD2 PHE 59 -10.567 -1.007 4.962 392 HE1 PHE 59 HE1 PHE 59 -11.786 -4.167 8.599 393 HE2 PHE 59 HE2 PHE 59 -10.751 -0.191 7.291 394 HZ PHE 59 HZ PHE 59 -11.339 -1.768 9.121 395 H VAL 60 HN VAL 60 -8.716 -5.267 2.617 396 HA VAL 60 HA VAL 60 -9.200 -4.716 -0.087 397 HB VAL 60 HB VAL 60 -7.100 -6.232 1.442 398 1HG1 VAL 60 HG11 VAL 60 -7.532 -6.428 -1.577 399 2HG1 VAL 60 HG12 VAL 60 -5.962 -6.610 -0.821 400 3HG1 VAL 60 HG13 VAL 60 -7.244 -7.756 -0.431 401 1HG2 VAL 60 HG21 VAL 60 -7.344 -3.735 1.001 402 2HG2 VAL 60 HG22 VAL 60 -5.816 -4.445 0.472 403 3HG2 VAL 60 HG23 VAL 60 -7.123 -4.172 -0.721 404 HA PRO 61 HA PRO 61 -11.992 -8.074 -1.013 405 1HB PRO 61 HB2 PRO 61 -11.810 -7.914 -3.840 406 2HB PRO 61 HB3 PRO 61 -12.966 -7.055 -2.794 407 1HG PRO 61 HG2 PRO 61 -10.530 -6.030 -4.141 408 2HG PRO 61 HG3 PRO 61 -11.957 -5.129 -3.569 409 1HD PRO 61 HD2 PRO 61 -9.426 -5.210 -2.306 410 2HD PRO 61 HD3 PRO 61 -10.965 -4.685 -1.545 411 H GLU 62 HN GLU 62 -11.773 -10.348 -1.599 412 HA GLU 62 HA GLU 62 -9.465 -11.670 -1.436 413 1HB GLU 62 HB2 GLU 62 -12.208 -12.038 -2.677 414 2HB GLU 62 HB3 GLU 62 -10.986 -13.249 -2.867 415 1HG GLU 62 HG2 GLU 62 -12.428 -13.682 -0.874 416 2HG GLU 62 HG3 GLU 62 -10.722 -13.493 -0.439 417 H GLU 63 HN GLU 63 -11.016 -10.532 -4.405 418 HA GLU 63 HA GLU 63 -9.371 -11.368 -6.431 419 1HB GLU 63 HB2 GLU 63 -11.399 -10.002 -6.632 420 2HB GLU 63 HB3 GLU 63 -10.506 -8.571 -6.077 421 1HG GLU 63 HG2 GLU 63 -9.013 -8.790 -8.069 422 2HG GLU 63 HG3 GLU 63 -9.922 -10.216 -8.583 423 H TRP 64 HN TRP 64 -8.727 -8.693 -4.154 424 HA TRP 64 HA TRP 64 -5.999 -8.227 -5.259 425 1HB TRP 64 HB2 TRP 64 -7.915 -6.408 -3.795 426 2HB TRP 64 HB3 TRP 64 -6.282 -5.968 -4.250 427 HD1 TRP 64 HD TRP 64 -6.771 -7.630 -7.179 428 HE1 TRP 64 HNE TRP 64 -8.126 -6.550 -9.021 429 HE3 TRP 64 HE TRP 64 -8.954 -3.850 -4.473 430 HZ2 TRP 64 HZ1 TRP 64 -10.017 -4.430 -9.304 431 HZ3 TRP 64 HZ2 TRP 64 -10.368 -2.185 -5.663 432 HH2 TRP 64 HH TRP 64 -10.966 -2.512 -8.044 433 H LYS 65 HN LYS 65 -7.370 -9.893 -2.731 434 HA LYS 65 HA LYS 65 -5.367 -9.497 -0.713 435 1HB LYS 65 HB2 LYS 65 -6.965 -11.948 -1.454 436 2HB LYS 65 HB3 LYS 65 -5.746 -11.881 -0.170 437 1HG LYS 65 HG2 LYS 65 -6.866 -9.805 0.707 438 2HG LYS 65 HG3 LYS 65 -8.209 -10.081 -0.390 439 1HD LYS 65 HD2 LYS 65 -8.834 -12.125 0.812 440 2HD LYS 65 HD3 LYS 65 -7.247 -12.182 1.596 441 1HE LYS 65 HE2 LYS 65 -8.627 -11.321 3.290 442 2HE LYS 65 HE3 LYS 65 -7.722 -9.953 2.613 443 1HZ LYS 65 HNZ1 LYS 65 -9.729 -9.361 1.375 444 2HZ LYS 65 HNZ2 LYS 65 -10.536 -10.658 1.977 445 3HZ LYS 65 HNZ3 LYS 65 -10.071 -9.392 2.954 446 H SER 66 HN SER 66 -5.245 -10.900 -3.950 447 HA SER 66 HA SER 66 -2.763 -12.238 -4.001 448 1HB SER 66 HB2 SER 66 -2.839 -11.374 -6.420 449 2HB SER 66 HB3 SER 66 -4.261 -12.300 -5.891 450 HG SER 66 HOG SER 66 -5.363 -10.525 -6.363 451 H TYR 67 HN TYR 67 -3.514 -8.807 -4.794 452 HA TYR 67 HA TYR 67 -0.808 -7.937 -4.991 453 1HB TYR 67 HB2 TYR 67 -3.328 -6.438 -4.091 454 2HB TYR 67 HB3 TYR 67 -1.777 -5.657 -4.194 455 HD1 TYR 67 HD2 TYR 67 -0.636 -6.558 -6.772 456 HD2 TYR 67 HD1 TYR 67 -4.704 -5.560 -5.761 457 HE1 TYR 67 HE2 TYR 67 -1.162 -6.232 -9.170 458 HE2 TYR 67 HE1 TYR 67 -5.214 -5.230 -8.154 459 HH TYR 67 HOH TYR 67 -4.329 -5.040 -10.279 460 H ILE 68 HN ILE 68 -2.948 -8.136 -2.070 461 HA ILE 68 HA ILE 68 -1.059 -6.828 -0.507 462 HB ILE 68 HB ILE 68 -3.366 -8.724 -0.060 463 1HG1 ILE 68 HG12 ILE 68 -4.508 -6.919 0.701 464 2HG1 ILE 68 HG13 ILE 68 -3.083 -6.075 1.263 465 1HG2 ILE 68 HG22 ILE 68 -1.606 -7.774 2.210 466 2HG2 ILE 68 HG23 ILE 68 -3.250 -8.439 2.374 467 3HG2 ILE 68 HG21 ILE 68 -1.960 -9.454 1.730 468 1HD1 ILE 68 HD1 ILE 68 -3.937 -6.259 -1.660 469 2HD1 ILE 68 HD2 ILE 68 -4.091 -4.863 -0.618 470 3HD1 ILE 68 HD3 ILE 68 -2.511 -5.403 -1.086 471 H GLN 69 HN GLN 69 -1.448 -10.332 -1.169 472 HA GLN 69 HA GLN 69 0.837 -11.192 0.303 473 1HB GLN 69 HB2 GLN 69 -0.736 -12.198 -2.079 474 2HB GLN 69 HB3 GLN 69 0.758 -12.992 -1.601 475 1HG GLN 69 HG2 GLN 69 -0.075 -13.577 0.526 476 2HG GLN 69 HG3 GLN 69 -1.381 -12.383 0.452 477 1HE2 GLN 69 HNE2 GLN 69 -3.552 -14.352 -1.594 478 2HE2 GLN 69 HNE1 GLN 69 -3.034 -12.690 -1.292 479 H LYS 70 HN LYS 70 0.530 -9.815 -3.019 480 HA LYS 70 HA LYS 70 3.250 -10.088 -3.673 481 1HB LYS 70 HB2 LYS 70 1.225 -9.344 -5.164 482 2HB LYS 70 HB3 LYS 70 1.551 -7.726 -4.558 483 1HG LYS 70 HG2 LYS 70 3.811 -7.729 -5.432 484 2HG LYS 70 HG3 LYS 70 3.623 -9.404 -5.993 485 1HD LYS 70 HD2 LYS 70 1.790 -8.748 -7.487 486 2HD LYS 70 HD3 LYS 70 1.874 -7.070 -6.949 487 1HE LYS 70 HE2 LYS 70 4.212 -8.531 -8.271 488 2HE LYS 70 HE3 LYS 70 3.002 -7.618 -9.180 489 1HZ LYS 70 HNZ3 LYS 70 4.701 -6.397 -7.096 490 2HZ LYS 70 HNZ1 LYS 70 4.974 -6.354 -8.709 491 3HZ LYS 70 HNZ2 LYS 70 3.658 -5.625 -8.115 492 H ASN 71 HN ASN 71 1.689 -7.148 -2.230 493 HA ASN 71 HA ASN 71 4.025 -5.675 -1.779 494 1HB ASN 71 HB2 ASN 71 1.383 -6.024 -0.277 495 2HB ASN 71 HB3 ASN 71 2.601 -4.927 0.331 496 1HD2 ASN 71 HND2 ASN 71 0.745 -3.973 -3.226 497 2HD2 ASN 71 HND1 ASN 71 0.716 -5.634 -2.680 498 H ARG 72 HN ARG 72 2.610 -8.301 0.252 499 HA ARG 72 HA ARG 72 4.704 -8.082 2.163 500 1HB ARG 72 HB2 ARG 72 2.547 -9.969 1.528 501 2HB ARG 72 HB3 ARG 72 4.010 -10.862 1.861 502 1HG ARG 72 HG2 ARG 72 3.994 -10.360 4.090 503 2HG ARG 72 HG3 ARG 72 3.597 -8.667 3.818 504 1HD ARG 72 HD2 ARG 72 1.265 -9.340 3.256 505 2HD ARG 72 HD3 ARG 72 1.641 -10.957 3.926 506 HE ARG 72 HNE ARG 72 2.507 -9.197 5.890 507 1HH1 ARG 72 HN22 ARG 72 -0.549 -9.783 4.194 508 2HH1 ARG 72 HN21 ARG 72 -1.530 -9.064 5.465 509 1HH2 ARG 72 HN12 ARG 72 1.164 -8.167 7.510 510 2HH2 ARG 72 HN11 ARG 72 -0.596 -8.019 7.255 511 H ASP 73 HN ASP 73 4.461 -10.118 -0.815 512 HA ASP 73 HA ASP 73 6.782 -11.556 -0.434 513 1HB ASP 73 HB2 ASP 73 4.779 -11.517 -2.285 514 2HB ASP 73 HB3 ASP 73 6.065 -10.837 -3.254 515 H PHE 74 HN PHE 74 6.276 -8.500 -2.001 516 HA PHE 74 HA PHE 74 8.736 -7.903 -3.172 517 1HB PHE 74 HB2 PHE 74 6.456 -6.389 -1.937 518 2HB PHE 74 HB3 PHE 74 7.957 -5.527 -2.056 519 HD1 PHE 74 HD1 PHE 74 6.689 -8.076 -4.521 520 HD2 PHE 74 HD2 PHE 74 7.534 -3.928 -3.694 521 HE1 PHE 74 HE1 PHE 74 6.879 -7.615 -6.945 522 HE2 PHE 74 HE2 PHE 74 7.628 -3.469 -6.078 523 HZ PHE 74 HZ PHE 74 7.279 -5.289 -7.748 524 H PHE 75 HN PHE 75 7.892 -7.624 0.309 525 HA PHE 75 HA PHE 75 10.747 -7.010 0.856 526 1HB PHE 75 HB2 PHE 75 8.349 -6.434 2.607 527 2HB PHE 75 HB3 PHE 75 9.964 -5.790 2.763 528 HD1 PHE 75 HD2 PHE 75 10.846 -4.430 0.567 529 HD2 PHE 75 HD1 PHE 75 6.721 -5.194 1.503 530 HE1 PHE 75 HE2 PHE 75 10.148 -2.815 -1.181 531 HE2 PHE 75 HE1 PHE 75 6.014 -3.593 -0.242 532 HZ PHE 75 HZ PHE 75 7.721 -2.445 -1.633 533 H LYS 76 HN LYS 76 8.649 -9.464 0.940 534 HA LYS 76 HA LYS 76 9.699 -10.829 3.336 535 1HB LYS 76 HB2 LYS 76 7.279 -10.962 2.284 536 2HB LYS 76 HB3 LYS 76 8.096 -12.114 1.203 537 1HG LYS 76 HG2 LYS 76 8.569 -13.545 3.263 538 2HG LYS 76 HG3 LYS 76 7.810 -12.292 4.222 539 1HD LYS 76 HD2 LYS 76 6.362 -14.300 3.646 540 2HD LYS 76 HD3 LYS 76 5.682 -12.702 3.367 541 1HE LYS 76 HE2 LYS 76 5.129 -14.365 1.578 542 2HE LYS 76 HE3 LYS 76 5.813 -12.853 1.027 543 1HZ LYS 76 HNZ3 LYS 76 8.019 -14.428 1.118 544 2HZ LYS 76 HNZ1 LYS 76 6.886 -15.514 0.776 545 3HZ LYS 76 HNZ2 LYS 76 7.048 -14.203 -0.183 546 H LYS 77 HN LYS 77 9.654 -13.465 1.797 547 HA LYS 77 HA LYS 77 12.247 -13.691 0.630 548 1HB LYS 77 HB2 LYS 77 11.301 -14.758 3.352 549 2HB LYS 77 HB3 LYS 77 12.887 -14.931 2.633 550 1HG LYS 77 HG2 LYS 77 11.624 -12.343 3.672 551 2HG LYS 77 HG3 LYS 77 12.770 -13.328 4.563 552 1HD LYS 77 HD2 LYS 77 14.567 -12.931 3.106 553 2HD LYS 77 HD3 LYS 77 13.574 -12.266 1.828 554 1HE LYS 77 HE2 LYS 77 13.893 -10.879 4.545 555 2HE LYS 77 HE3 LYS 77 14.977 -10.631 3.168 556 1HZ LYS 77 HNZ1 LYS 77 12.747 -10.173 1.943 557 2HZ LYS 77 HNZ2 LYS 77 12.204 -9.704 3.384 558 3HZ LYS 77 HNZ3 LYS 77 13.524 -8.982 2.774 No H/Q in entry = 557
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