NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
4151 | 1etf | cing | 1-original | 10 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H5* G 41 1H5' G 41 -9.406 -23.750 -0.385 2 2H5* G 41 2H5' G 41 -10.741 -23.252 0.682 3 H4* G 41 H4' G 41 -9.443 -24.154 2.644 4 H3* G 41 H3' G 41 -8.080 -22.028 0.913 5 1H2* G 41 H2' G 41 -6.433 -21.943 2.550 6 2HO* G 41 HO2' G 41 -8.205 -23.351 4.264 7 H1* G 41 H1' G 41 -6.586 -24.705 3.192 8 H8 G 41 H8 G 41 -6.173 -23.837 -0.519 9 H1 G 41 H1 G 41 -0.692 -24.164 2.784 10 1H2 G 41 1H2 G 41 -2.746 -24.390 5.586 11 2H2 G 41 2H2 G 41 -1.115 -24.332 4.956 12 1H5* G 42 1H5' G 42 -8.662 -19.719 5.524 13 2H5* G 42 2H5' G 42 -8.348 -21.411 5.074 14 H4* G 42 H4' G 42 -6.743 -20.715 6.803 15 H3* G 42 H3' G 42 -6.068 -18.451 4.858 16 1H2* G 42 H2' G 42 -3.914 -18.506 5.720 17 2HO* G 42 HO2' G 42 -4.918 -20.100 7.843 18 H1* G 42 H1' G 42 -3.819 -21.298 6.064 19 H8 G 42 H8 G 42 -5.139 -20.123 2.665 20 H1 G 42 H1 G 42 1.247 -20.444 3.075 21 1H2 G 42 1H2 G 42 0.700 -20.991 6.470 22 2H2 G 42 2H2 G 42 1.863 -20.820 5.174 23 1H5* U 43 1H5' U 43 -4.691 -16.295 9.319 24 2H5* U 43 2H5' U 43 -4.526 -17.975 8.756 25 H4* U 43 H4' U 43 -2.359 -17.163 9.610 26 H3* U 43 H3' U 43 -2.726 -14.918 7.564 27 1H2* U 43 H2' U 43 -0.415 -14.848 7.392 28 2HO* U 43 HO2' U 43 0.035 -14.939 9.630 29 H1* U 43 H1' U 43 -0.064 -17.647 7.607 30 H3 U 43 H3 U 43 1.425 -16.565 3.409 31 H5 U 43 H5 U 43 -2.739 -16.068 3.180 32 H6 U 43 H6 U 43 -2.871 -16.416 5.521 33 1H5* C 44 1H5' C 44 0.279 -12.289 10.910 34 2H5* C 44 2H5' C 44 0.388 -14.026 10.551 35 H4* C 44 H4' C 44 2.602 -12.935 10.299 36 H3* C 44 H3' C 44 1.157 -11.164 8.264 37 1H2* C 44 H2' C 44 3.184 -11.013 7.137 38 2HO* C 44 HO2' C 44 4.411 -12.185 9.410 39 H1* C 44 H1' C 44 3.910 -13.704 7.578 40 1H4 C 44 1H4 C 44 0.098 -13.494 2.143 41 2H4 C 44 2H4 C 44 1.743 -13.303 1.580 42 H5 C 44 H5 C 44 -0.498 -13.485 4.534 43 H6 C 44 H6 C 44 0.341 -13.362 6.742 44 1H5* U 45 1H5' U 45 5.006 -9.625 9.338 45 2H5* U 45 2H5' U 45 4.884 -7.865 9.555 46 H4* U 45 H4' U 45 6.754 -8.466 8.020 47 H3* U 45 H3' U 45 4.395 -7.039 6.684 48 1H2* U 45 H2' U 45 5.730 -6.917 4.792 49 2HO* U 45 HO2' U 45 7.939 -7.619 6.427 50 H1* U 45 H1' U 45 6.984 -9.438 5.231 51 H3 U 45 H3 U 45 4.922 -9.830 1.155 52 H5 U 45 H5 U 45 1.744 -9.626 3.893 53 H6 U 45 H6 U 45 3.310 -9.145 5.613 54 1H5* G 46 1H5' G 46 8.014 -5.542 5.843 55 2H5* G 46 2H5' G 46 8.159 -3.780 6.002 56 H4* G 46 H4' G 46 9.121 -4.550 3.863 57 H3* G 46 H3' G 46 7.269 -2.434 4.068 58 1H2* G 46 H2' G 46 5.450 -3.673 3.279 59 2HO* G 46 HO2' G 46 5.786 -1.927 1.830 60 H1* G 46 H1' G 46 7.366 -4.958 1.289 61 H8 G 46 H8 G 46 4.534 -6.156 3.696 62 H1 G 46 H1 G 46 3.881 -7.797 -2.463 63 1H2 G 46 1H2 G 46 6.817 -5.988 -2.946 64 2H2 G 46 2H2 G 46 5.545 -6.953 -3.663 65 1H5* G 47 1H5' G 47 12.110 -1.479 0.781 66 2H5* G 47 2H5' G 47 11.157 -2.934 1.124 67 H4* G 47 H4' G 47 11.370 -2.397 -1.331 68 H3* G 47 H3' G 47 9.542 -0.039 -0.600 69 1H2* G 47 H2' G 47 8.676 -0.275 -2.715 70 2HO* G 47 HO2' G 47 9.705 -1.572 -4.307 71 H1* G 47 H1' G 47 8.969 -3.109 -2.768 72 H8 G 47 H8 G 47 7.172 -1.146 0.068 73 H1 G 47 H1 G 47 3.370 -3.736 -4.390 74 1H2 G 47 1H2 G 47 4.590 -4.642 -6.008 75 2H2 G 47 2H2 G 47 6.338 -4.602 -5.990 76 1H5* G 48 1H5' G 48 12.177 1.498 -4.762 77 2H5* G 48 2H5' G 48 11.459 -0.087 -4.409 78 H4* G 48 H4' G 48 11.029 0.652 -6.757 79 H3* G 48 H3' G 48 10.547 3.208 -5.636 80 1H2* G 48 H2' G 48 8.457 2.649 -4.775 81 2HO* G 48 HO2' G 48 6.839 3.319 -6.265 82 H1* G 48 H1' G 48 8.001 0.969 -7.271 83 H8 G 48 H8 G 48 7.432 0.773 -3.414 84 H1 G 48 H1 G 48 2.376 -0.705 -7.058 85 1H2 G 48 1H2 G 48 4.471 0.036 -9.739 86 2H2 G 48 2H2 G 48 2.887 -0.481 -9.207 87 1H5* C 49 1H5' C 49 9.091 4.129 -10.955 88 2H5* C 49 2H5' C 49 8.840 2.555 -10.170 89 H4* C 49 H4' C 49 6.908 3.174 -11.610 90 H3* C 49 H3' C 49 6.646 5.563 -9.704 91 1H2* C 49 H2' C 49 4.376 5.453 -10.126 92 2HO* C 49 HO2' C 49 3.530 4.210 -11.857 93 H1* C 49 H1' C 49 4.338 2.598 -10.383 94 1H4 C 49 1H4 C 49 2.777 4.080 -4.121 95 2H4 C 49 2H4 C 49 1.259 4.002 -4.988 96 H5 C 49 H5 C 49 4.960 3.985 -5.259 97 H6 C 49 H6 C 49 6.054 3.720 -7.344 98 1H5* G 50 1H5' G 50 4.437 5.823 -13.340 99 2H5* G 50 2H5' G 50 4.424 7.490 -13.960 100 H4* G 50 H4' G 50 2.118 6.523 -13.809 101 H3* G 50 H3' G 50 2.736 8.830 -11.894 102 1H2* G 50 H2' G 50 0.487 8.791 -11.320 103 2HO* G 50 HO2' G 50 -0.326 8.686 -13.456 104 H1* G 50 H1' G 50 0.200 5.995 -11.502 105 H8 G 50 H8 G 50 3.208 7.398 -9.539 106 H1 G 50 H1 G 50 -2.147 6.637 -6.105 107 1H2 G 50 1H2 G 50 -3.639 5.873 -9.157 108 2H2 G 50 2H2 G 50 -3.836 6.060 -7.429 109 1H5* C 51 1H5' C 51 -0.955 11.337 -14.352 110 2H5* C 51 2H5' C 51 -0.805 9.605 -13.968 111 H4* C 51 H4' C 51 -2.899 10.507 -13.016 112 H3* C 51 H3' C 51 -1.049 12.459 -11.547 113 1H2* C 51 H2' C 51 -2.617 12.450 -9.840 114 2HO* C 51 HO2' C 51 -4.713 11.575 -10.139 115 H1* C 51 H1' C 51 -3.332 9.712 -10.171 116 1H4 C 51 1H4 C 51 1.451 10.046 -5.604 117 2H4 C 51 2H4 C 51 -0.048 10.247 -4.725 118 H5 C 51 H5 C 51 1.560 10.015 -8.059 119 H6 C 51 H6 C 51 0.301 10.096 -10.064 120 1H5* A 52 1H5' A 52 -5.006 13.696 -11.237 121 2H5* A 52 2H5' A 52 -5.141 15.467 -11.337 122 H4* A 52 H4' A 52 -6.143 14.556 -9.225 123 H3* A 52 H3' A 52 -3.640 16.285 -8.911 124 1H2* A 52 H2' A 52 -3.958 16.149 -6.614 125 2HO* A 52 HO2' A 52 -5.892 15.310 -5.718 126 H1* A 52 H1' A 52 -4.815 13.486 -6.594 127 H8 A 52 H8 A 52 -1.762 13.941 -8.810 128 1H6 A 52 1H6 A 52 1.617 13.559 -3.639 129 2H6 A 52 2H6 A 52 1.666 13.599 -5.386 130 H2 A 52 H2 A 52 -2.695 13.838 -2.481 131 1H5* G 53 1H5' G 53 -6.656 17.589 -6.247 132 2H5* G 53 2H5' G 53 -6.721 19.365 -6.266 133 H4* G 53 H4' G 53 -6.490 18.505 -3.946 134 H3* G 53 H3' G 53 -4.018 19.956 -5.026 135 1H2* G 53 H2' G 53 -3.166 19.832 -2.875 136 2HO* G 53 HO2' G 53 -5.069 20.450 -1.775 137 H1* G 53 H1' G 53 -4.160 17.255 -2.355 138 H8 G 53 H8 G 53 -2.502 17.845 -5.782 139 H1 G 53 H1 G 53 1.501 16.045 -1.116 140 1H2 G 53 1H2 G 53 -1.248 16.421 0.984 141 2H2 G 53 2H2 G 53 0.442 15.992 0.831 142 1H5* C 54 1H5' C 54 -4.912 23.604 -1.531 143 2H5* C 54 2H5' C 54 -5.082 21.858 -1.236 144 H4* C 54 H4' C 54 -3.581 22.924 0.439 145 H3* C 54 H3' C 54 -1.938 23.731 -2.018 146 1H2* C 54 H2' C 54 -0.065 23.589 -0.675 147 2HO* C 54 HO2' C 54 -0.924 24.715 1.115 148 H1* C 54 H1' C 54 -0.986 21.353 0.809 149 1H4 C 54 1H4 C 54 2.200 18.809 -4.379 150 2H4 C 54 2H4 C 54 3.417 19.037 -3.144 151 H5 C 54 H5 C 54 -0.069 19.769 -4.202 152 H6 C 54 H6 C 54 -1.586 20.893 -2.783 153 1H5* G 55 1H5' G 55 -0.383 27.695 0.746 154 2H5* G 55 2H5' G 55 -0.423 25.998 1.272 155 H4* G 55 H4' G 55 1.796 27.076 1.684 156 H3* G 55 H3' G 55 1.835 27.423 -1.365 157 1H2* G 55 H2' G 55 4.173 27.347 -1.147 158 2HO* G 55 HO2' G 55 5.149 27.169 0.928 159 H1* G 55 H1' G 55 4.129 25.147 0.515 160 H8 G 55 H8 G 55 1.276 24.861 -1.978 161 H1 G 55 H1 G 55 6.979 23.221 -4.390 162 1H2 G 55 1H2 G 55 8.260 24.417 -1.382 163 2H2 G 55 2H2 G 55 8.594 23.723 -2.954 164 1H5* C 56 1H5' C 56 4.526 30.833 0.415 165 2H5* C 56 2H5' C 56 4.051 32.167 -0.656 166 H4* C 56 H4' C 56 5.919 31.582 -2.208 167 H3* C 56 H3' C 56 6.163 29.215 -0.617 168 1H2* C 56 H2' C 56 7.291 30.269 1.099 169 2HO* C 56 HO2' C 56 8.824 28.832 0.198 170 H1* C 56 H1' C 56 8.524 32.103 -1.014 171 1H4 C 56 1H4 C 56 9.797 34.959 4.850 172 2H4 C 56 2H4 C 56 11.345 34.389 4.264 173 H5 C 56 H5 C 56 7.677 34.444 3.724 174 H6 C 56 H6 C 56 6.669 33.350 1.877 175 1H5* A 57 1H5' A 57 10.363 29.056 -1.986 176 2H5* A 57 2H5' A 57 10.481 27.549 -2.920 177 H4* A 57 H4' A 57 12.196 27.656 -1.115 178 H3* A 57 H3' A 57 10.092 25.495 -1.123 179 1H2* A 57 H2' A 57 10.720 24.694 0.958 180 2HO* A 57 HO2' A 57 13.061 26.284 0.752 181 H1* A 57 H1' A 57 11.120 27.057 2.244 182 H8 A 57 H8 A 57 8.228 27.674 -0.089 183 1H6 A 57 1H6 A 57 4.658 24.883 4.128 184 2H6 A 57 2H6 A 57 4.670 25.834 2.660 185 H2 A 57 H2 A 57 8.934 24.221 5.254 186 1H5* A 58 1H5' A 58 13.650 23.753 0.355 187 2H5* A 58 2H5' A 58 13.830 22.100 -0.285 188 H4* A 58 H4' A 58 13.707 22.154 2.228 189 H3* A 58 H3' A 58 11.503 20.747 0.674 190 1H2* A 58 H2' A 58 10.473 20.157 2.677 191 2HO* A 58 HO2' A 58 12.759 21.146 4.038 192 H1* A 58 H1' A 58 10.672 22.612 3.864 193 H8 A 58 H8 A 58 10.296 23.179 0.126 194 1H6 A 58 1H6 A 58 5.450 23.078 -0.109 195 2H6 A 58 2H6 A 58 4.199 22.655 1.040 196 H2 A 58 H2 A 58 6.285 21.473 4.814 197 1H5* G 64 1H5' G 64 11.662 19.312 3.785 198 2H5* G 64 2H5' G 64 11.991 17.571 3.977 199 H4* G 64 H4' G 64 9.877 18.321 5.142 200 H3* G 64 H3' G 64 9.667 16.301 2.860 201 1H2* G 64 H2' G 64 7.399 16.116 3.321 202 2HO* G 64 HO2' G 64 7.880 17.576 5.711 203 H1* G 64 H1' G 64 6.960 18.823 3.769 204 H8 G 64 H8 G 64 9.272 17.532 0.912 205 H1 G 64 H1 G 64 3.235 18.858 -0.772 206 1H2 G 64 1H2 G 64 2.745 19.483 2.619 207 2H2 G 64 2H2 G 64 2.047 19.428 1.017 208 1H5* C 65 1H5' C 65 7.264 13.052 3.571 209 2H5* C 65 2H5' C 65 7.387 12.257 5.158 210 H4* C 65 H4' C 65 5.489 13.621 6.009 211 H3* C 65 H3' C 65 5.019 12.034 3.448 212 1H2* C 65 H2' C 65 2.837 12.804 3.381 213 2HO* C 65 HO2' C 65 3.199 13.778 6.020 214 H1* C 65 H1' C 65 3.362 15.421 4.192 215 1H4 C 65 1H4 C 65 4.571 15.324 -2.305 216 2H4 C 65 2H4 C 65 2.839 15.503 -2.168 217 H5 C 65 H5 C 65 6.041 14.981 -0.346 218 H6 C 65 H6 C 65 6.107 14.630 1.971 219 1H5* U 66 1H5' U 66 1.127 10.061 6.004 220 2H5* U 66 2H5' U 66 1.727 11.732 5.891 221 H4* U 66 H4' U 66 -0.663 11.648 5.264 222 H3* U 66 H3' U 66 0.264 9.581 3.210 223 1H2* U 66 H2' U 66 -1.419 10.339 1.814 224 2HO* U 66 HO2' U 66 -3.042 11.782 2.568 225 H1* U 66 H1' U 66 -1.148 13.059 2.512 226 H3 U 66 H3 U 66 0.120 12.998 -1.881 227 H5 U 66 H5 U 66 3.253 11.041 0.112 228 H6 U 66 H6 U 66 1.968 11.087 2.103 229 1H5* G 67 1H5' G 67 -4.636 8.337 4.285 230 2H5* G 67 2H5' G 67 -4.075 9.946 3.843 231 H4* G 67 H4' G 67 -6.285 9.363 2.786 232 H3* G 67 H3' G 67 -4.699 7.087 1.550 233 1H2* G 67 H2' G 67 -5.681 7.437 -0.516 234 2HO* G 67 HO2' G 67 -7.486 9.215 0.759 235 H1* G 67 H1' G 67 -5.503 10.154 -0.575 236 H8 G 67 H8 G 67 -2.607 8.410 1.298 237 H1 G 67 H1 G 67 -1.646 9.458 -4.950 238 1H2 G 67 1H2 G 67 -4.973 10.487 -4.982 239 2H2 G 67 2H2 G 67 -3.497 10.245 -5.889 240 1H5* A 68 1H5' A 68 -8.754 5.297 1.971 241 2H5* A 68 2H5' A 68 -9.273 5.220 3.679 242 H4* A 68 H4' A 68 -8.355 2.801 2.058 243 H3* A 68 H3' A 68 -10.898 4.052 1.795 244 1H2* A 68 H2' A 68 -11.508 3.672 3.983 245 2HO* A 68 HO2' A 68 -12.168 1.225 2.685 246 H1* A 68 H1' A 68 -10.168 0.947 3.802 247 H8 A 68 H8 A 68 -10.888 3.941 6.194 248 1H6 A 68 1H6 A 68 -12.388 -0.430 10.305 249 2H6 A 68 2H6 A 68 -12.349 1.289 9.985 250 H2 A 68 H2 A 68 -10.725 -2.443 6.682 251 1H5* C 69 1H5' C 69 -8.820 4.735 -0.119 252 2H5* C 69 2H5' C 69 -7.215 4.036 -0.410 253 H4* C 69 H4' C 69 -9.397 4.496 -2.484 254 H3* C 69 H3' C 69 -6.880 2.781 -2.576 255 1H2* C 69 H2' C 69 -6.610 3.391 -4.813 256 2HO* C 69 HO2' C 69 -8.234 4.543 -5.943 257 H1* C 69 H1' C 69 -7.356 6.077 -4.465 258 1H4 C 69 1H4 C 69 -0.928 5.628 -2.907 259 2H4 C 69 2H4 C 69 -0.967 5.754 -4.652 260 H5 C 69 H5 C 69 -2.956 5.393 -1.545 261 H6 C 69 H6 C 69 -5.311 5.233 -1.579 262 1H5* G 70 1H5' G 70 -9.053 2.221 -6.086 263 2H5* G 70 2H5' G 70 -9.142 0.497 -6.523 264 H4* G 70 H4' G 70 -8.215 1.938 -8.376 265 H3* G 70 H3' G 70 -6.358 -0.144 -7.136 266 1H2* G 70 H2' G 70 -4.803 0.395 -8.756 267 2HO* G 70 HO2' G 70 -6.831 1.905 -10.062 268 H1* G 70 H1' G 70 -5.255 3.147 -8.683 269 H8 G 70 H8 G 70 -5.203 1.731 -5.152 270 H1 G 70 H1 G 70 0.594 2.796 -7.659 271 1H2 G 70 1H2 G 70 -1.119 3.275 -10.653 272 2H2 G 70 2H2 G 70 0.424 3.243 -9.829 273 1H5* G 71 1H5' G 71 -7.774 -3.355 -7.440 274 2H5* G 71 2H5' G 71 -6.530 -4.453 -8.047 275 H4* G 71 H4' G 71 -6.281 -4.510 -5.675 276 H3* G 71 H3' G 71 -7.351 -1.933 -5.486 277 1H2* G 71 H2' G 71 -5.528 -0.822 -6.385 278 2HO* G 71 HO2' G 71 -5.878 -0.010 -4.278 279 H1* G 71 H1' G 71 -3.656 -2.576 -4.777 280 H8 G 71 H8 G 71 -3.947 -1.709 -8.562 281 H1 G 71 H1 G 71 1.312 0.437 -5.604 282 1H2 G 71 1H2 G 71 -0.173 -0.794 -2.706 283 2H2 G 71 2H2 G 71 1.192 0.028 -3.427 284 1H5* U 72 1H5' U 72 -7.259 -6.004 -2.031 285 2H5* U 72 2H5' U 72 -6.015 -5.748 -3.271 286 H4* U 72 H4' U 72 -6.843 -8.098 -3.264 287 H3* U 72 H3' U 72 -6.641 -6.495 -5.592 288 1H2* U 72 H2' U 72 -8.943 -6.092 -5.733 289 2HO* U 72 HO2' U 72 -8.629 -8.605 -7.020 290 H1* U 72 H1' U 72 -9.346 -8.982 -4.833 291 H3 U 72 H3 U 72 -13.717 -8.421 -6.058 292 H5 U 72 H5 U 72 -13.019 -5.389 -3.235 293 H6 U 72 H6 U 72 -10.704 -5.917 -3.299 294 1H5* A 73 1H5' A 73 -5.812 -7.299 -8.130 295 2H5* A 73 2H5' A 73 -4.756 -8.702 -8.413 296 H4* A 73 H4' A 73 -4.119 -6.667 -9.779 297 H3* A 73 H3' A 73 -2.180 -7.904 -7.784 298 1H2* A 73 H2' A 73 -0.544 -6.384 -8.457 299 2HO* A 73 HO2' A 73 -2.272 -5.646 -10.578 300 H1* A 73 H1' A 73 -2.183 -4.177 -8.516 301 H8 A 73 H8 A 73 -3.637 -5.499 -5.513 302 1H6 A 73 1H6 A 73 1.672 -4.467 -2.497 303 2H6 A 73 2H6 A 73 -0.034 -4.813 -2.320 304 H2 A 73 H2 A 73 2.497 -4.294 -6.885 305 1H5* C 74 1H5' C 74 0.512 -7.523 -10.756 306 2H5* C 74 2H5' C 74 1.171 -9.144 -11.079 307 H4* C 74 H4' C 74 2.984 -7.532 -10.517 308 H3* C 74 H3' C 74 2.462 -9.813 -8.552 309 1H2* C 74 H2' C 74 4.301 -9.069 -7.319 310 2HO* C 74 HO2' C 74 4.895 -7.322 -9.472 311 H1* C 74 H1' C 74 3.711 -6.393 -7.480 312 1H4 C 74 1H4 C 74 -0.264 -8.978 -2.822 313 2H4 C 74 2H4 C 74 1.239 -8.604 -2.008 314 H5 C 74 H5 C 74 -0.533 -8.797 -5.258 315 H6 C 74 H6 C 74 0.526 -8.213 -7.292 316 1H5* A 75 1H5' A 75 6.505 -9.707 -8.886 317 2H5* A 75 2H5' A 75 7.111 -11.337 -9.251 318 H4* A 75 H4' A 75 8.222 -10.375 -7.236 319 H3* A 75 H3' A 75 6.368 -12.755 -6.713 320 1H2* A 75 H2' A 75 7.169 -12.739 -4.536 321 2HO* A 75 HO2' A 75 9.226 -10.995 -5.415 322 H1* A 75 H1' A 75 7.353 -9.935 -4.342 323 H8 A 75 H8 A 75 4.037 -11.097 -5.803 324 1H6 A 75 1H6 A 75 2.110 -11.756 0.041 325 2H6 A 75 2H6 A 75 1.626 -11.759 -1.640 326 H2 A 75 H2 A 75 6.504 -10.934 0.101 327 1H5* G 76 1H5' G 76 10.247 -13.382 -5.027 328 2H5* G 76 2H5' G 76 10.710 -15.082 -5.264 329 H4* G 76 H4' G 76 10.907 -14.417 -2.874 330 H3* G 76 H3' G 76 8.639 -16.390 -3.466 331 1H2* G 76 H2' G 76 8.390 -16.575 -1.170 332 2HO* G 76 HO2' G 76 10.897 -15.274 -0.896 333 H1* G 76 H1' G 76 8.981 -13.863 -0.633 334 H8 G 76 H8 G 76 6.436 -14.628 -3.420 335 H1 G 76 H1 G 76 3.942 -14.164 2.463 336 1H2 G 76 1H2 G 76 7.252 -14.005 3.529 337 2H2 G 76 2H2 G 76 5.561 -14.000 3.972 338 1H5* G 77 1H5' G 77 11.372 -17.655 -0.386 339 2H5* G 77 2H5' G 77 11.642 -19.408 -0.524 340 H4* G 77 H4' G 77 11.030 -18.769 1.800 341 H3* G 77 H3' G 77 8.883 -20.378 0.316 342 1H2* G 77 H2' G 77 7.788 -20.514 2.351 343 2HO* G 77 HO2' G 77 9.608 -21.086 3.607 344 H1* G 77 H1' G 77 8.533 -17.924 3.213 345 H8 G 77 H8 G 77 7.070 -18.317 -0.331 346 H1 G 77 H1 G 77 2.743 -17.385 4.299 347 1H2 G 77 1H2 G 77 5.440 -17.725 6.475 348 2H2 G 77 2H2 G 77 3.722 -17.451 6.290 349 1H5* C 78 1H5' C 78 10.030 -22.096 4.086 350 2H5* C 78 2H5' C 78 10.045 -23.869 3.944 351 H4* C 78 H4' C 78 8.668 -23.104 5.884 352 H3* C 78 H3' C 78 7.138 -24.420 3.583 353 1H2* C 78 H2' C 78 5.257 -24.342 4.953 354 2HO* C 78 HO2' C 78 6.980 -23.625 7.090 355 H1* C 78 H1' C 78 5.804 -21.784 5.983 356 1H4 C 78 1H4 C 78 2.619 -20.978 0.223 357 2H4 C 78 2H4 C 78 1.367 -21.163 1.430 358 H5 C 78 H5 C 78 5.004 -21.335 0.717 359 H6 C 78 H6 C 78 6.582 -21.842 2.403 360 1H5* C 79 1H5' C 79 6.576 -25.864 7.591 361 2H5* C 79 2H5' C 79 6.396 -27.632 7.631 362 H4* C 79 H4' C 79 4.633 -26.461 8.974 363 H3* C 79 H3' C 79 3.725 -28.017 6.517 364 1H2* C 79 H2' C 79 1.521 -27.590 7.192 365 2HO* C 79 HO2' C 79 2.599 -26.486 9.571 366 H1* C 79 H1' C 79 1.964 -24.901 7.703 367 1H4 C 79 1H4 C 79 1.646 -25.503 1.106 368 2H4 C 79 2H4 C 79 -0.013 -25.391 1.644 369 H5 C 79 H5 C 79 3.538 -25.706 2.662 370 H6 C 79 H6 C 79 4.182 -25.798 4.938 371 1H ASP 33 2H ASP 33 9.454 2.329 8.797 372 2H ASP 33 1H ASP 33 8.404 3.378 9.515 373 3H ASP 33 3H ASP 33 8.481 1.811 10.024 374 HA ASP 33 HA ASP 33 7.660 1.020 7.933 375 1HB ASP 33 2HB ASP 33 5.972 3.223 9.186 376 2HB ASP 33 1HB ASP 33 5.366 1.908 8.155 377 HD1 ASP 33 HD2 ASP 33 6.089 -0.575 10.676 378 H THR 34 H THR 34 6.270 1.755 6.050 379 HA THR 34 HA THR 34 7.032 4.379 4.893 380 HB THR 34 HB THR 34 7.541 3.279 2.746 381 HG1 THR 34 HG1 THR 34 7.388 0.903 4.300 382 1HG2 THR 34 3HG2 THR 34 9.419 3.781 4.346 383 2HG2 THR 34 2HG2 THR 34 9.284 2.119 4.977 384 3HG2 THR 34 1HG2 THR 34 9.739 2.392 3.287 385 H ARG 35 H ARG 35 5.709 4.733 2.847 386 HA ARG 35 HA ARG 35 2.952 4.492 3.478 387 1HB ARG 35 1HB ARG 35 4.359 5.025 0.827 388 2HB ARG 35 2HB ARG 35 2.623 5.244 1.132 389 1HG ARG 35 1HG ARG 35 3.120 6.936 2.864 390 2HG ARG 35 2HG ARG 35 4.861 6.724 2.593 391 1HD ARG 35 2HD ARG 35 4.133 8.683 1.445 392 2HD ARG 35 1HD ARG 35 4.594 7.480 0.248 393 HE ARG 35 HE ARG 35 1.908 8.549 0.896 394 1HH1 ARG 35 1HH2 ARG 35 3.691 6.116 -1.018 395 2HH1 ARG 35 2HH2 ARG 35 2.380 5.920 -2.155 396 1HH2 ARG 35 2HH1 ARG 35 0.245 8.245 -0.599 397 2HH2 ARG 35 1HH1 ARG 35 0.432 7.110 -1.918 398 H GLN 36 H GLN 36 5.061 2.692 1.191 399 HA GLN 36 HA GLN 36 3.095 1.020 0.079 400 1HB GLN 36 1HB GLN 36 6.057 0.622 0.670 401 2HB GLN 36 2HB GLN 36 5.080 -0.592 -0.175 402 1HG GLN 36 2HG GLN 36 6.289 0.764 -1.781 403 2HG GLN 36 1HG GLN 36 4.549 1.021 -1.963 404 1HE2 GLN 36 2HE2 GLN 36 6.843 4.038 -0.232 405 2HE2 GLN 36 1HE2 GLN 36 7.245 2.357 0.044 406 H ALA 37 H ALA 37 5.291 0.339 2.869 407 HA ALA 37 HA ALA 37 4.288 -2.157 3.577 408 1HB ALA 37 3HB ALA 37 6.290 -1.066 4.557 409 2HB ALA 37 1HB ALA 37 5.228 0.081 5.411 410 3HB ALA 37 2HB ALA 37 5.174 -1.651 5.815 411 H ARG 38 H ARG 38 3.143 1.095 4.612 412 HA ARG 38 HA ARG 38 1.050 0.119 6.289 413 1HB ARG 38 1HB ARG 38 2.023 2.416 6.309 414 2HB ARG 38 2HB ARG 38 1.272 2.734 4.734 415 1HG ARG 38 2HG ARG 38 -0.975 2.450 5.712 416 2HG ARG 38 1HG ARG 38 -0.265 2.020 7.282 417 1HD ARG 38 2HD ARG 38 0.141 4.688 5.874 418 2HD ARG 38 1HD ARG 38 -1.069 4.377 7.132 419 HE ARG 38 HE ARG 38 1.380 3.557 8.203 420 1HH1 ARG 38 1HH1 ARG 38 -0.118 6.517 6.980 421 2HH1 ARG 38 2HH1 ARG 38 0.801 7.576 8.027 422 1HH2 ARG 38 2HH2 ARG 38 2.591 4.954 9.584 423 2HH2 ARG 38 1HH2 ARG 38 2.346 6.684 9.512 424 H ARG 39 H ARG 39 1.169 1.155 2.855 425 HA ARG 39 HA ARG 39 -1.576 0.725 2.254 426 1HB ARG 39 2HB ARG 39 0.856 0.289 0.482 427 2HB ARG 39 1HB ARG 39 -0.793 0.550 -0.081 428 1HG ARG 39 1HG ARG 39 0.995 2.581 1.356 429 2HG ARG 39 2HG ARG 39 0.613 2.531 -0.361 430 1HD ARG 39 2HD ARG 39 -1.325 3.154 1.898 431 2HD ARG 39 1HD ARG 39 -0.688 4.259 0.694 432 HE ARG 39 HE ARG 39 -2.885 2.389 0.371 433 1HH1 ARG 39 2HH1 ARG 39 -0.337 4.140 -1.376 434 2HH1 ARG 39 1HH1 ARG 39 -1.195 4.099 -2.900 435 1HH2 ARG 39 1HH2 ARG 39 -3.982 2.348 -1.629 436 2HH2 ARG 39 2HH2 ARG 39 -3.262 3.082 -3.044 437 H ASN 40 H ASN 40 1.258 -1.415 1.675 438 HA ASN 40 HA ASN 40 -0.123 -3.702 0.863 439 1HB ASN 40 2HB ASN 40 2.399 -3.507 2.556 440 2HB ASN 40 1HB ASN 40 1.908 -4.904 1.576 441 1HD2 ASN 40 2HD2 ASN 40 4.403 -2.690 -0.276 442 2HD2 ASN 40 1HD2 ASN 40 4.399 -3.427 1.309 443 H ARG 41 H ARG 41 0.775 -2.628 4.175 444 HA ARG 41 HA ARG 41 -0.295 -4.924 5.491 445 1HB ARG 41 2HB ARG 41 1.357 -3.236 6.390 446 2HB ARG 41 1HB ARG 41 0.016 -2.084 6.547 447 1HG ARG 41 2HG ARG 41 -1.143 -3.713 8.089 448 2HG ARG 41 1HG ARG 41 0.260 -4.790 7.953 449 1HD ARG 41 1HD ARG 41 0.282 -1.948 9.052 450 2HD ARG 41 2HD ARG 41 0.300 -3.436 10.013 451 HE ARG 41 HE ARG 41 2.468 -3.615 8.245 452 1HH1 ARG 41 1HH2 ARG 41 1.346 -1.548 10.885 453 2HH1 ARG 41 2HH2 ARG 41 2.957 -1.103 11.404 454 1HH2 ARG 41 1HH1 ARG 41 4.594 -3.024 8.926 455 2HH2 ARG 41 2HH1 ARG 41 4.809 -1.946 10.287 456 H ARG 42 H ARG 42 -1.580 -1.594 5.024 457 HA ARG 42 HA ARG 42 -4.005 -1.927 6.350 458 1HB ARG 42 1HB ARG 42 -2.947 0.181 5.458 459 2HB ARG 42 2HB ARG 42 -3.496 -0.282 3.835 460 1HG ARG 42 1HG ARG 42 -5.866 -0.260 4.657 461 2HG ARG 42 2HG ARG 42 -5.291 0.237 6.259 462 1HD ARG 42 1HD ARG 42 -4.922 1.792 3.666 463 2HD ARG 42 2HD ARG 42 -6.135 2.136 4.903 464 HE ARG 42 HE ARG 42 -3.322 2.837 4.939 465 1HH1 ARG 42 1HH1 ARG 42 -6.111 2.109 7.009 466 2HH1 ARG 42 2HH1 ARG 42 -5.478 3.000 8.376 467 1HH2 ARG 42 2HH2 ARG 42 -2.514 3.992 6.737 468 2HH2 ARG 42 1HH2 ARG 42 -3.438 4.070 8.220 469 H ARG 43 H ARG 43 -3.159 -2.647 2.936 470 HA ARG 43 HA ARG 43 -5.746 -3.303 2.038 471 1HB ARG 43 1HB ARG 43 -3.712 -3.039 0.629 472 2HB ARG 43 2HB ARG 43 -3.059 -4.545 1.304 473 1HG ARG 43 1HG ARG 43 -4.892 -5.838 0.300 474 2HG ARG 43 2HG ARG 43 -5.690 -4.349 -0.243 475 1HD ARG 43 2HD ARG 43 -4.510 -5.444 -2.093 476 2HD ARG 43 1HD ARG 43 -3.832 -3.850 -1.749 477 HE ARG 43 HE ARG 43 -1.830 -4.815 -1.186 478 1HH1 ARG 43 1HH2 ARG 43 -4.340 -7.325 -1.153 479 2HH1 ARG 43 2HH2 ARG 43 -3.199 -8.631 -0.922 480 1HH2 ARG 43 1HH1 ARG 43 -0.357 -6.535 -0.889 481 2HH2 ARG 43 2HH1 ARG 43 -0.934 -8.182 -0.772 482 H ARG 44 H ARG 44 -3.358 -5.118 3.939 483 HA ARG 44 HA ARG 44 -4.674 -7.659 3.833 484 1HB ARG 44 1HB ARG 44 -2.993 -6.478 6.076 485 2HB ARG 44 2HB ARG 44 -3.295 -8.192 5.770 486 1HG ARG 44 1HG ARG 44 -1.628 -6.289 4.052 487 2HG ARG 44 2HG ARG 44 -1.058 -7.595 5.093 488 1HD ARG 44 2HD ARG 44 -2.381 -9.209 3.639 489 2HD ARG 44 1HD ARG 44 -2.592 -7.863 2.492 490 HE ARG 44 HE ARG 44 0.140 -7.994 3.091 491 1HH1 ARG 44 2HH2 ARG 44 -2.372 -9.994 1.616 492 2HH1 ARG 44 1HH2 ARG 44 -1.272 -10.827 0.542 493 1HH2 ARG 44 1HH1 ARG 44 1.592 -9.077 1.663 494 2HH2 ARG 44 2HH1 ARG 44 0.993 -10.304 0.568 495 H TRP 45 H TRP 45 -4.697 -5.016 6.273 496 HA TRP 45 HA TRP 45 -6.519 -6.197 8.062 497 1HB TRP 45 2HB TRP 45 -5.117 -4.240 8.523 498 2HB TRP 45 1HB TRP 45 -6.048 -3.289 7.364 499 HD1 TRP 45 HD1 TRP 45 -7.003 -5.454 10.437 500 HE1 TRP 45 HE1 TRP 45 -8.529 -4.073 12.003 501 HE3 TRP 45 HE3 TRP 45 -7.408 -1.197 7.657 502 HZ2 TRP 45 HZ2 TRP 45 -9.644 -1.451 12.082 503 HZ3 TRP 45 HZ3 TRP 45 -8.652 0.754 8.535 504 HH2 TRP 45 HH2 TRP 45 -9.720 0.658 10.769 505 H ARG 46 H ARG 46 -7.155 -3.842 5.395 506 HA ARG 46 HA ARG 46 -9.946 -3.739 5.750 507 1HB ARG 46 1HB ARG 46 -8.608 -2.208 4.325 508 2HB ARG 46 2HB ARG 46 -8.328 -3.524 3.166 509 1HG ARG 46 1HG ARG 46 -10.050 -3.568 2.526 510 2HG ARG 46 2HG ARG 46 -9.993 -1.790 3.416 511 1HD ARG 46 1HD ARG 46 -11.420 -2.683 1.391 512 2HD ARG 46 2HD ARG 46 -11.023 -1.100 2.097 513 HE ARG 46 HE ARG 46 -8.558 -2.169 1.555 514 1HH1 ARG 46 2HH2 ARG 46 -11.462 -1.635 -0.418 515 2HH1 ARG 46 1HH2 ARG 46 -10.559 -1.433 -1.903 516 1HH2 ARG 46 2HH1 ARG 46 -7.401 -1.890 -0.399 517 2HH2 ARG 46 1HH1 ARG 46 -8.258 -1.575 -1.891 518 H GLU 47 H GLU 47 -8.006 -5.730 3.459 519 HA GLU 47 HA GLU 47 -10.197 -7.184 2.424 520 1HB GLU 47 1HB GLU 47 -7.930 -6.938 1.403 521 2HB GLU 47 2HB GLU 47 -7.261 -7.987 2.668 522 1HG GLU 47 2HG GLU 47 -8.657 -9.865 1.866 523 2HG GLU 47 1HG GLU 47 -9.410 -8.799 0.659 524 HE2 GLU 47 HE2 GLU 47 -6.876 -10.521 -1.197 525 H ARG 48 H ARG 48 -7.950 -7.843 5.143 526 HA ARG 48 HA ARG 48 -8.819 -10.463 5.696 527 1HB ARG 48 2HB ARG 48 -6.888 -8.920 6.628 528 2HB ARG 48 1HB ARG 48 -8.044 -8.492 7.885 529 1HG ARG 48 1HG ARG 48 -6.966 -11.266 7.189 530 2HG ARG 48 2HG ARG 48 -6.570 -10.289 8.609 531 1HD ARG 48 2HD ARG 48 -9.267 -11.552 8.000 532 2HD ARG 48 1HD ARG 48 -8.100 -12.048 9.231 533 HE ARG 48 HE ARG 48 -8.752 -9.310 9.654 534 1HH1 ARG 48 2HH1 ARG 48 -10.103 -12.571 9.909 535 2HH1 ARG 48 1HH1 ARG 48 -11.161 -12.169 11.243 536 1HH2 ARG 48 2HH2 ARG 48 -10.146 -8.789 11.419 537 2HH2 ARG 48 1HH2 ARG 48 -11.185 -10.018 12.104 538 H GLN 49 H GLN 49 -9.902 -7.341 7.202 539 HA GLN 49 HA GLN 49 -12.064 -8.335 8.608 540 1HB GLN 49 2HB GLN 49 -10.963 -5.931 8.395 541 2HB GLN 49 1HB GLN 49 -12.108 -5.721 7.064 542 1HG GLN 49 1HG GLN 49 -13.140 -4.804 9.019 543 2HG GLN 49 2HG GLN 49 -13.971 -6.331 8.660 544 1HE2 GLN 49 1HE2 GLN 49 -13.544 -6.590 12.242 545 2HE2 GLN 49 2HE2 GLN 49 -14.587 -5.887 11.016 546 H ARG 50 H ARG 50 -11.617 -7.853 5.181 547 HA ARG 50 HA ARG 50 -14.287 -7.703 4.314 548 1HB ARG 50 1HB ARG 50 -12.380 -7.264 2.858 549 2HB ARG 50 2HB ARG 50 -11.770 -8.902 3.095 550 1HG ARG 50 1HG ARG 50 -12.790 -8.563 0.879 551 2HG ARG 50 2HG ARG 50 -13.554 -9.873 1.778 552 1HD ARG 50 1HD ARG 50 -15.148 -8.414 0.545 553 2HD ARG 50 2HD ARG 50 -15.486 -8.473 2.277 554 HE ARG 50 HE ARG 50 -13.748 -6.263 1.628 555 1HH1 ARG 50 2HH1 ARG 50 -17.103 -7.368 1.439 556 2HH1 ARG 50 1HH1 ARG 50 -17.773 -5.752 1.415 557 1HH2 ARG 50 1HH2 ARG 50 -14.636 -4.135 1.607 558 2HH2 ARG 50 2HH2 ARG 50 -16.368 -3.912 1.512 559 H ALA 51 H ALA 51 -12.139 -10.574 4.716 560 HA ALA 51 HA ALA 51 -14.033 -12.536 4.008 561 1HB ALA 51 1HB ALA 51 -11.614 -12.955 4.317 562 2HB ALA 51 2HB ALA 51 -11.783 -12.655 6.063 563 3HB ALA 51 3HB ALA 51 -12.587 -14.058 5.319 564 H ALA 52 H ALA 52 -13.198 -11.201 7.254 565 HA ALA 52 HA ALA 52 -15.101 -12.705 8.716 566 1HB ALA 52 3HB ALA 52 -13.973 -9.918 9.221 567 2HB ALA 52 2HB ALA 52 -14.786 -10.942 10.430 568 3HB ALA 52 1HB ALA 52 -13.232 -11.454 9.730 569 H ALA 53 H ALA 53 -15.292 -9.327 7.454 570 HA ALA 53 HA ALA 53 -17.941 -8.818 8.230 571 1HB ALA 53 1HB ALA 53 -16.413 -7.858 5.771 572 2HB ALA 53 3HB ALA 53 -17.876 -7.098 6.445 573 3HB ALA 53 2HB ALA 53 -16.365 -7.112 7.386 574 H ALA 54 H ALA 54 -16.732 -9.938 5.016 575 HA ALA 54 HA ALA 54 -19.327 -10.395 3.927 576 1HB ALA 54 1HB ALA 54 -16.627 -11.637 3.254 577 2HB ALA 54 3HB ALA 54 -18.076 -11.683 2.220 578 3HB ALA 54 2HB ALA 54 -17.279 -10.129 2.573 579 H ARG 55 H ARG 55 -17.033 -12.417 5.755 580 HA ARG 55 HA ARG 55 -18.615 -14.835 5.483 581 1HB ARG 55 1HB ARG 55 -16.163 -14.847 5.858 582 2HB ARG 55 2HB ARG 55 -16.410 -14.065 7.440 583 1HG ARG 55 1HG ARG 55 -17.838 -15.995 8.129 584 2HG ARG 55 2HG ARG 55 -17.523 -16.762 6.558 585 1HD ARG 55 1HD ARG 55 -15.079 -16.784 7.091 586 2HD ARG 55 2HD ARG 55 -15.439 -16.049 8.663 587 HE ARG 55 HE ARG 55 -16.117 -18.072 9.484 588 1HH1 ARG 55 2HH1 ARG 55 -16.041 -18.260 5.940 589 2HH1 ARG 55 1HH1 ARG 55 -16.377 -19.976 5.904 590 1HH2 ARG 55 2HH2 ARG 55 -16.566 -20.319 9.412 591 2HH2 ARG 55 1HH2 ARG 55 -16.677 -21.144 7.874 No H/Q in entry = 591
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