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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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6046 |
1idi ![]() ![]() |
5024 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H ILE 1 1H ILE 1 -2.864 12.759 -2.268 2 2H ILE 1 2H ILE 1 -2.152 14.253 -2.347 3 3H ILE 1 3H ILE 1 -2.406 13.353 -3.716 4 HA ILE 1 HA ILE 1 -0.944 11.717 -3.243 5 HB ILE 1 HB ILE 1 -0.125 13.735 -4.316 6 1HG1 ILE 1 1HG1 ILE 1 1.744 12.748 -4.808 7 2HG1 ILE 1 2HG1 ILE 1 2.541 13.326 -3.390 8 1HG2 ILE 1 1HG2 ILE 1 -0.317 15.504 -2.649 9 2HG2 ILE 1 2HG2 ILE 1 0.971 14.778 -1.665 10 3HG2 ILE 1 3HG2 ILE 1 1.336 15.427 -3.269 11 1HD1 ILE 1 1HD1 ILE 1 1.173 10.561 -3.679 12 2HD1 ILE 1 2HD1 ILE 1 1.864 11.185 -2.146 13 3HD1 ILE 1 3HD1 ILE 1 2.904 10.961 -3.552 14 H VAL 2 H VAL 2 -2.124 10.921 -1.249 15 HA VAL 2 HA VAL 2 -0.387 11.118 1.254 16 HB VAL 2 HB VAL 2 -2.316 11.510 2.728 17 1HG1 VAL 2 1HG1 VAL 2 -0.956 13.487 1.946 18 2HG1 VAL 2 2HG1 VAL 2 -2.596 13.922 2.383 19 3HG1 VAL 2 3HG1 VAL 2 -2.138 13.807 0.659 20 1HG2 VAL 2 1HG2 VAL 2 -4.239 10.645 1.418 21 2HG2 VAL 2 2HG2 VAL 2 -4.117 12.041 0.320 22 3HG2 VAL 2 3HG2 VAL 2 -4.519 12.277 2.037 23 H CYS 3 H CYS 3 -2.672 9.619 2.669 24 HA CYS 3 HA CYS 3 -1.634 6.866 2.127 25 1HB CYS 3 1HB CYS 3 -3.767 7.825 4.129 26 2HB CYS 3 2HB CYS 3 -3.000 6.232 4.075 27 H HIS 4 H HIS 4 -5.029 6.912 2.803 28 HA HIS 4 HA HIS 4 -5.525 5.352 0.303 29 1HB HIS 4 1HB HIS 4 -7.427 5.975 2.625 30 2HB HIS 4 2HB HIS 4 -7.877 5.096 1.184 31 HD1 HIS 4 HD1 HIS 4 -5.274 4.618 4.117 32 HD2 HIS 4 HD2 HIS 4 -7.909 2.590 1.421 33 HE1 HIS 4 HE1 HIS 4 -5.526 2.149 4.798 34 HE2 HIS 4 HE2 HIS 4 -7.112 0.848 3.247 35 H THR 5 H THR 5 -5.896 6.425 -1.462 36 HA THR 5 HA THR 5 -7.760 8.822 -1.614 37 HB THR 5 HB THR 5 -5.846 7.546 -3.585 38 HG1 THR 5 HG1 THR 5 -5.121 8.994 -2.026 39 1HG2 THR 5 1HG2 THR 5 -8.222 8.949 -4.493 40 2HG2 THR 5 2HG2 THR 5 -6.881 8.279 -5.422 41 3HG2 THR 5 3HG2 THR 5 -6.810 9.931 -4.829 42 H THR 6 H THR 6 -7.831 6.371 -4.104 43 HA THR 6 HA THR 6 -9.669 4.954 -4.772 44 HB THR 6 HB THR 6 -11.571 6.401 -2.867 45 HG1 THR 6 HG1 THR 6 -10.238 4.990 -1.815 46 1HG2 THR 6 1HG2 THR 6 -12.262 4.013 -4.639 47 2HG2 THR 6 2HG2 THR 6 -13.258 4.814 -3.411 48 3HG2 THR 6 3HG2 THR 6 -12.828 5.688 -4.871 49 H ALA 7 H ALA 7 -8.705 6.297 -6.449 50 HA ALA 7 HA ALA 7 -8.989 7.240 -8.489 51 1HB ALA 7 1HB ALA 7 -10.601 5.375 -8.474 52 2HB ALA 7 2HB ALA 7 -11.932 6.483 -8.082 53 3HB ALA 7 3HB ALA 7 -11.061 6.652 -9.622 54 H THR 8 H THR 8 -11.626 8.836 -6.705 55 HA THR 8 HA THR 8 -11.850 10.844 -8.959 56 HB THR 8 HB THR 8 -13.653 9.288 -8.678 57 HG1 THR 8 HG1 THR 8 -13.538 8.949 -6.491 58 1HG2 THR 8 1HG2 THR 8 -14.925 11.878 -7.736 59 2HG2 THR 8 2HG2 THR 8 -15.484 10.766 -8.990 60 3HG2 THR 8 3HG2 THR 8 -14.094 11.851 -9.314 61 H SER 9 H SER 9 -13.311 11.744 -5.837 62 HA SER 9 HA SER 9 -11.737 14.313 -6.271 63 1HB SER 9 1HB SER 9 -14.074 14.056 -7.437 64 2HB SER 9 2HB SER 9 -14.765 14.391 -5.856 65 HG SER 9 HG SER 9 -14.332 16.217 -7.202 66 HA PRO 10 HA PRO 10 -13.414 15.350 -1.759 67 1HB PRO 10 1HB PRO 10 -13.955 12.659 -0.478 68 2HB PRO 10 2HB PRO 10 -14.906 14.144 -0.397 69 1HG PRO 10 1HG PRO 10 -15.663 11.931 -1.883 70 2HG PRO 10 2HG PRO 10 -16.073 13.591 -2.382 71 1HD PRO 10 1HD PRO 10 -13.833 11.785 -3.440 72 2HD PRO 10 2HD PRO 10 -14.944 12.846 -4.340 73 H ILE 11 H ILE 11 -11.985 12.249 -2.055 74 HA ILE 11 HA ILE 11 -9.942 12.223 0.054 75 HB ILE 11 HB ILE 11 -9.251 10.180 -1.291 76 1HG1 ILE 11 1HG1 ILE 11 -10.595 9.170 -3.041 77 2HG1 ILE 11 2HG1 ILE 11 -11.789 10.421 -3.009 78 1HG2 ILE 11 1HG2 ILE 11 -10.689 9.856 0.599 79 2HG2 ILE 11 2HG2 ILE 11 -11.308 8.816 -0.695 80 3HG2 ILE 11 3HG2 ILE 11 -12.147 10.331 -0.317 81 1HD1 ILE 11 1HD1 ILE 11 -10.074 10.414 -4.989 82 2HD1 ILE 11 2HD1 ILE 11 -10.396 11.991 -4.219 83 3HD1 ILE 11 3HD1 ILE 11 -8.899 11.102 -3.847 84 H SER 12 H SER 12 -7.612 11.469 -0.992 85 HA SER 12 HA SER 12 -5.525 12.404 -1.513 86 1HB SER 12 1HB SER 12 -6.899 14.050 -3.708 87 2HB SER 12 2HB SER 12 -5.156 13.815 -3.490 88 HG SER 12 HG SER 12 -7.126 11.950 -4.200 89 H ALA 13 H ALA 13 -6.189 13.272 0.710 90 HA ALA 13 HA ALA 13 -6.202 16.331 0.845 91 1HB ALA 13 1HB ALA 13 -8.559 15.507 0.518 92 2HB ALA 13 2HB ALA 13 -8.315 16.338 2.069 93 3HB ALA 13 3HB ALA 13 -8.424 14.558 2.018 94 H VAL 14 H VAL 14 -7.144 14.539 3.652 95 HA VAL 14 HA VAL 14 -4.414 15.192 4.917 96 HB VAL 14 HB VAL 14 -7.138 15.690 6.258 97 1HG1 VAL 14 1HG1 VAL 14 -5.264 15.249 7.880 98 2HG1 VAL 14 2HG1 VAL 14 -4.296 16.541 7.132 99 3HG1 VAL 14 3HG1 VAL 14 -5.826 16.921 7.980 100 1HG2 VAL 14 1HG2 VAL 14 -6.661 18.154 6.009 101 2HG2 VAL 14 2HG2 VAL 14 -5.282 17.767 4.936 102 3HG2 VAL 14 3HG2 VAL 14 -6.947 17.354 4.460 103 H THR 15 H THR 15 -3.527 13.513 5.790 104 HA THR 15 HA THR 15 -5.029 11.627 7.539 105 HB THR 15 HB THR 15 -3.726 9.550 6.629 106 HG1 THR 15 HG1 THR 15 -3.932 11.075 4.266 107 1HG2 THR 15 1HG2 THR 15 -5.554 8.872 5.088 108 2HG2 THR 15 2HG2 THR 15 -6.180 10.533 5.056 109 3HG2 THR 15 3HG2 THR 15 -6.198 9.598 6.575 110 H CYS 16 H CYS 16 -1.695 11.782 6.146 111 HA CYS 16 HA CYS 16 -0.640 12.116 9.011 112 1HB CYS 16 1HB CYS 16 -0.116 9.905 7.117 113 2HB CYS 16 2HB CYS 16 1.374 10.780 7.394 114 HA PRO 17 HA PRO 17 1.678 15.745 7.970 115 1HB PRO 17 1HB PRO 17 4.437 14.450 8.079 116 2HB PRO 17 2HB PRO 17 3.814 15.840 8.999 117 1HG PRO 17 1HG PRO 17 4.046 13.453 10.228 118 2HG PRO 17 2HG PRO 17 2.585 14.437 10.511 119 1HD PRO 17 1HD PRO 17 2.917 12.062 8.601 120 2HD PRO 17 2HD PRO 17 1.604 12.394 9.771 121 HA PRO 18 HA PRO 18 2.822 16.276 3.656 122 1HB PRO 18 1HB PRO 18 4.692 18.259 3.366 123 2HB PRO 18 2HB PRO 18 3.142 18.509 4.181 124 1HG PRO 18 1HG PRO 18 5.858 17.964 5.477 125 2HG PRO 18 2HG PRO 18 4.689 19.236 5.895 126 1HD PRO 18 1HD PRO 18 4.878 16.795 7.228 127 2HD PRO 18 2HD PRO 18 3.336 17.704 7.139 128 H GLY 19 H GLY 19 4.004 15.862 1.796 129 1HA GLY 19 1HA GLY 19 6.458 15.511 0.913 130 2HA GLY 19 2HA GLY 19 6.587 14.201 2.072 131 H GLU 20 H GLU 20 6.757 12.503 0.800 132 HA GLU 20 HA GLU 20 4.972 11.968 -1.616 133 1HB GLU 20 1HB GLU 20 7.308 10.341 -0.415 134 2HB GLU 20 2HB GLU 20 6.410 9.896 -1.854 135 1HG GLU 20 1HG GLU 20 7.178 11.926 -3.080 136 2HG GLU 20 2HG GLU 20 8.129 12.433 -1.684 137 H ASN 21 H ASN 21 4.679 9.255 -1.427 138 HA ASN 21 HA ASN 21 3.139 7.647 -0.485 139 1HB ASN 21 1HB ASN 21 5.330 7.237 1.529 140 2HB ASN 21 2HB ASN 21 4.483 6.114 0.508 141 1HD2 ASN 21 1HD2 ASN 21 7.333 6.474 1.074 142 2HD2 ASN 21 2HD2 ASN 21 8.062 6.441 -0.609 143 H LEU 22 H LEU 22 4.483 8.878 2.535 144 HA LEU 22 HA LEU 22 3.598 9.276 4.618 145 1HB LEU 22 1HB LEU 22 0.748 9.475 3.567 146 2HB LEU 22 2HB LEU 22 1.374 9.986 5.128 147 HG LEU 22 HG LEU 22 1.900 11.231 2.384 148 1HD1 LEU 22 1HD1 LEU 22 -0.253 11.827 3.480 149 2HD1 LEU 22 2HD1 LEU 22 0.820 13.229 3.336 150 3HD1 LEU 22 3HD1 LEU 22 0.616 12.412 4.909 151 1HD2 LEU 22 1HD2 LEU 22 3.238 12.140 5.016 152 2HD2 LEU 22 2HD2 LEU 22 3.342 12.965 3.433 153 3HD2 LEU 22 3HD2 LEU 22 4.088 11.385 3.641 154 H CYS 23 H CYS 23 0.666 7.464 3.958 155 HA CYS 23 HA CYS 23 1.833 5.132 5.524 156 1HB CYS 23 1HB CYS 23 -0.983 4.837 4.452 157 2HB CYS 23 2HB CYS 23 -0.242 4.270 5.937 158 H TYR 24 H TYR 24 3.204 4.233 4.200 159 HA TYR 24 HA TYR 24 3.101 3.806 1.377 160 1HB TYR 24 1HB TYR 24 4.691 1.835 1.813 161 2HB TYR 24 2HB TYR 24 5.138 3.445 2.282 162 HD1 TYR 24 HD1 TYR 24 2.973 1.183 4.506 163 HD2 TYR 24 HD2 TYR 24 6.860 2.914 3.817 164 HE1 TYR 24 HE1 TYR 24 3.699 0.423 6.694 165 HE2 TYR 24 HE2 TYR 24 7.582 2.105 6.012 166 HH TYR 24 HH TYR 24 7.026 0.993 7.835 167 H ARG 25 H ARG 25 2.436 2.188 0.031 168 HA ARG 25 HA ARG 25 0.468 0.113 1.145 169 1HB ARG 25 1HB ARG 25 0.927 0.498 -1.821 170 2HB ARG 25 2HB ARG 25 -0.352 -0.371 -1.001 171 1HG ARG 25 1HG ARG 25 0.055 2.668 -1.106 172 2HG ARG 25 2HG ARG 25 -1.094 1.773 -1.999 173 1HD ARG 25 1HD ARG 25 -1.469 3.160 0.408 174 2HD ARG 25 2HD ARG 25 -2.671 2.324 -0.515 175 HE ARG 25 HE ARG 25 -1.215 1.322 1.976 176 1HH1 ARG 25 1HH1 ARG 25 -3.963 0.862 -0.223 177 2HH1 ARG 25 2HH1 ARG 25 -4.865 -0.076 1.065 178 1HH2 ARG 25 1HH2 ARG 25 -2.310 0.271 3.372 179 2HH2 ARG 25 2HH2 ARG 25 -3.982 -0.392 2.981 180 H LYS 26 H LYS 26 2.072 -0.781 2.319 181 HA LYS 26 HA LYS 26 4.339 -2.322 0.995 182 1HB LYS 26 1HB LYS 26 4.910 -1.007 3.008 183 2HB LYS 26 2HB LYS 26 3.610 -1.710 3.953 184 1HG LYS 26 1HG LYS 26 4.729 -3.985 3.855 185 2HG LYS 26 2HG LYS 26 5.981 -3.300 2.846 186 1HD LYS 26 1HD LYS 26 6.907 -3.465 5.012 187 2HD LYS 26 2HD LYS 26 6.618 -1.742 4.792 188 1HE LYS 26 1HE LYS 26 4.514 -1.925 6.218 189 2HE LYS 26 2HE LYS 26 4.764 -3.673 6.374 190 1HZ LYS 26 1HZ LYS 26 6.619 -1.553 7.366 191 2HZ LYS 26 2HZ LYS 26 6.916 -3.172 7.460 192 3HZ LYS 26 3HZ LYS 26 5.645 -2.520 8.287 193 H MET 27 H MET 27 3.863 -4.393 0.450 194 HA MET 27 HA MET 27 1.329 -5.675 0.780 195 1HB MET 27 1HB MET 27 3.303 -5.927 -0.997 196 2HB MET 27 2HB MET 27 3.969 -7.086 0.139 197 1HG MET 27 1HG MET 27 1.479 -8.201 -0.260 198 2HG MET 27 2HG MET 27 1.698 -7.311 -1.786 199 1HE MET 27 1HE MET 27 3.191 -10.404 -3.446 200 2HE MET 27 2HE MET 27 1.582 -10.013 -2.762 201 3HE MET 27 3HE MET 27 2.483 -8.782 -3.702 202 H TRP 28 H TRP 28 2.678 -8.470 1.348 203 HA TRP 28 HA TRP 28 3.454 -9.844 2.916 204 1HB TRP 28 1HB TRP 28 5.215 -8.104 2.593 205 2HB TRP 28 2HB TRP 28 4.743 -7.318 4.087 206 HD1 TRP 28 HD1 TRP 28 6.500 -7.873 5.942 207 HE1 TRP 28 HE1 TRP 28 8.124 -9.860 6.603 208 HE3 TRP 28 HE3 TRP 28 5.083 -11.079 2.220 209 HZ2 TRP 28 HZ2 TRP 28 8.424 -12.548 5.643 210 HZ3 TRP 28 HZ3 TRP 28 5.932 -13.395 2.252 211 HH2 TRP 28 HH2 TRP 28 7.587 -14.109 3.934 212 H CYS 29 H CYS 29 4.059 -9.198 5.710 213 HA CYS 29 HA CYS 29 1.536 -10.247 6.971 214 1HB CYS 29 1HB CYS 29 2.438 -11.985 5.149 215 2HB CYS 29 2HB CYS 29 3.753 -12.301 6.290 216 H ASP 30 H ASP 30 5.076 -10.209 7.108 217 HA ASP 30 HA ASP 30 6.622 -10.079 8.810 218 1HB ASP 30 1HB ASP 30 5.182 -8.073 9.513 219 2HB ASP 30 2HB ASP 30 4.465 -9.064 10.762 220 H ALA 31 H ALA 31 4.398 -11.048 11.361 221 HA ALA 31 HA ALA 31 5.625 -13.827 11.327 222 1HB ALA 31 1HB ALA 31 5.867 -12.650 13.445 223 2HB ALA 31 2HB ALA 31 4.850 -14.079 13.648 224 3HB ALA 31 3HB ALA 31 4.101 -12.459 13.607 225 H PHE 32 H PHE 32 2.252 -12.504 11.772 226 HA PHE 32 HA PHE 32 1.256 -15.132 10.519 227 1HB PHE 32 1HB PHE 32 -0.097 -13.510 12.764 228 2HB PHE 32 2HB PHE 32 -0.833 -14.859 11.948 229 HD1 PHE 32 HD1 PHE 32 1.136 -14.028 14.778 230 HD2 PHE 32 HD2 PHE 32 0.551 -17.155 11.883 231 HE1 PHE 32 HE1 PHE 32 2.170 -15.649 16.311 232 HE2 PHE 32 HE2 PHE 32 1.579 -18.770 13.430 233 HZ PHE 32 HZ PHE 32 2.402 -18.021 15.640 234 H CYS 33 H CYS 33 -0.342 -15.190 9.174 235 HA CYS 33 HA CYS 33 -2.101 -12.748 8.694 236 1HB CYS 33 1HB CYS 33 -0.967 -14.416 6.357 237 2HB CYS 33 2HB CYS 33 -2.306 -13.250 6.246 238 H SER 34 H SER 34 -2.242 -15.993 7.239 239 HA SER 34 HA SER 34 -4.124 -17.330 6.884 240 1HB SER 34 1HB SER 34 -4.436 -17.028 9.923 241 2HB SER 34 2HB SER 34 -5.360 -18.172 8.945 242 HG SER 34 HG SER 34 -2.533 -18.003 9.095 243 H SER 35 H SER 35 -4.565 -15.038 5.887 244 HA SER 35 HA SER 35 -7.396 -14.072 6.576 245 1HB SER 35 1HB SER 35 -5.526 -12.715 7.664 246 2HB SER 35 2HB SER 35 -4.856 -12.355 6.071 247 HG SER 35 HG SER 35 -6.699 -11.248 5.561 248 H ARG 36 H ARG 36 -8.293 -12.687 4.855 249 HA ARG 36 HA ARG 36 -7.266 -13.312 2.053 250 1HB ARG 36 1HB ARG 36 -9.782 -14.444 3.206 251 2HB ARG 36 2HB ARG 36 -10.066 -13.636 1.700 252 1HG ARG 36 1HG ARG 36 -8.920 -15.105 0.414 253 2HG ARG 36 2HG ARG 36 -7.604 -15.336 1.526 254 1HD ARG 36 1HD ARG 36 -10.355 -16.651 1.880 255 2HD ARG 36 2HD ARG 36 -8.985 -17.405 1.087 256 HE ARG 36 HE ARG 36 -9.429 -17.275 3.987 257 1HH1 ARG 36 1HH1 ARG 36 -6.755 -17.209 1.654 258 2HH1 ARG 36 2HH1 ARG 36 -5.616 -17.934 2.895 259 1HH2 ARG 36 1HH2 ARG 36 -8.040 -18.088 5.337 260 2HH2 ARG 36 2HH2 ARG 36 -6.302 -18.399 4.836 261 H GLY 37 H GLY 37 -6.479 -11.322 2.375 262 1HA GLY 37 1HA GLY 37 -6.993 -9.980 0.177 263 2HA GLY 37 2HA GLY 37 -8.187 -9.116 1.146 264 H LYS 38 H LYS 38 -4.235 -8.308 2.292 265 HA LYS 38 HA LYS 38 -4.713 -10.748 0.554 266 1HB LYS 38 1HB LYS 38 -3.618 -10.840 3.429 267 2HB LYS 38 2HB LYS 38 -5.031 -11.662 2.840 268 1HG LYS 38 1HG LYS 38 -2.132 -12.399 2.098 269 2HG LYS 38 2HG LYS 38 -3.101 -13.080 3.373 270 1HD LYS 38 1HD LYS 38 -3.403 -14.706 1.806 271 2HD LYS 38 2HD LYS 38 -4.844 -13.792 1.534 272 1HE LYS 38 1HE LYS 38 -2.449 -13.055 -0.233 273 2HE LYS 38 2HE LYS 38 -3.042 -14.696 -0.409 274 1HZ LYS 38 1HZ LYS 38 -4.235 -13.412 -1.944 275 2HZ LYS 38 2HZ LYS 38 -4.611 -12.221 -0.859 276 3HZ LYS 38 3HZ LYS 38 -5.309 -13.716 -0.742 277 H VAL 39 H VAL 39 -0.959 -9.731 1.479 278 HA VAL 39 HA VAL 39 -0.501 -7.787 0.841 279 HB VAL 39 HB VAL 39 -2.742 -8.077 -0.919 280 1HG1 VAL 39 1HG1 VAL 39 -3.864 -6.012 -1.209 281 2HG1 VAL 39 2HG1 VAL 39 -2.809 -5.171 -0.074 282 3HG1 VAL 39 3HG1 VAL 39 -3.995 -6.379 0.495 283 1HG2 VAL 39 1HG2 VAL 39 -0.450 -6.088 -1.072 284 2HG2 VAL 39 2HG2 VAL 39 -1.450 -6.705 -2.411 285 3HG2 VAL 39 3HG2 VAL 39 -0.452 -7.822 -1.553 286 H VAL 40 H VAL 40 -0.216 -5.897 1.573 287 HA VAL 40 HA VAL 40 -0.092 -4.256 3.025 288 HB VAL 40 HB VAL 40 -1.495 -2.410 2.787 289 1HG1 VAL 40 1HG1 VAL 40 -1.033 -3.889 0.156 290 2HG1 VAL 40 2HG1 VAL 40 0.071 -2.836 1.005 291 3HG1 VAL 40 3HG1 VAL 40 -1.422 -2.147 0.339 292 1HG2 VAL 40 1HG2 VAL 40 -3.724 -3.053 3.027 293 2HG2 VAL 40 2HG2 VAL 40 -3.667 -4.310 1.784 294 3HG2 VAL 40 3HG2 VAL 40 -3.619 -2.584 1.330 295 H GLU 41 H GLU 41 0.280 -3.837 4.956 296 HA GLU 41 HA GLU 41 -2.097 -3.563 6.860 297 1HB GLU 41 1HB GLU 41 -0.248 -4.963 7.830 298 2HB GLU 41 2HB GLU 41 0.877 -3.621 7.622 299 1HG GLU 41 1HG GLU 41 -0.582 -2.220 9.222 300 2HG GLU 41 2HG GLU 41 -1.693 -3.571 9.375 301 H LEU 42 H LEU 42 0.413 -1.380 7.631 302 HA LEU 42 HA LEU 42 0.357 0.715 5.745 303 1HB LEU 42 1HB LEU 42 -1.363 2.377 6.515 304 2HB LEU 42 2HB LEU 42 -1.962 1.000 5.676 305 HG LEU 42 HG LEU 42 -2.371 0.030 8.195 306 1HD1 LEU 42 1HD1 LEU 42 -3.141 1.818 9.748 307 2HD1 LEU 42 2HD1 LEU 42 -2.617 3.084 8.603 308 3HD1 LEU 42 3HD1 LEU 42 -1.417 2.017 9.390 309 1HD2 LEU 42 1HD2 LEU 42 -4.717 0.709 8.020 310 2HD2 LEU 42 2HD2 LEU 42 -4.101 0.270 6.420 311 3HD2 LEU 42 3HD2 LEU 42 -4.308 1.993 6.836 312 H GLY 43 H GLY 43 0.956 2.907 6.656 313 1HA GLY 43 1HA GLY 43 1.945 2.997 9.512 314 2HA GLY 43 2HA GLY 43 3.221 2.844 8.314 315 H CYS 44 H CYS 44 4.014 4.879 9.171 316 HA CYS 44 HA CYS 44 3.055 7.159 7.444 317 1HB CYS 44 1HB CYS 44 3.252 7.622 10.470 318 2HB CYS 44 2HB CYS 44 3.350 8.911 9.259 319 H ALA 45 H ALA 45 4.777 7.449 6.280 320 HA ALA 45 HA ALA 45 7.587 6.921 7.354 321 1HB ALA 45 1HB ALA 45 7.851 5.073 5.772 322 2HB ALA 45 2HB ALA 45 6.347 4.789 6.658 323 3HB ALA 45 3HB ALA 45 6.287 5.415 4.993 324 H ALA 46 H ALA 46 6.084 7.481 4.088 325 HA ALA 46 HA ALA 46 6.803 8.713 2.266 326 1HB ALA 46 1HB ALA 46 6.415 10.648 3.817 327 2HB ALA 46 2HB ALA 46 7.570 10.982 2.514 328 3HB ALA 46 3HB ALA 46 8.158 10.685 4.166 329 H THR 47 H THR 47 8.692 6.542 3.201 330 HA THR 47 HA THR 47 11.088 7.384 1.515 331 HB THR 47 HB THR 47 11.562 7.839 3.886 332 HG1 THR 47 HG1 THR 47 13.212 7.408 2.534 333 1HG2 THR 47 1HG2 THR 47 10.341 5.913 5.018 334 2HG2 THR 47 2HG2 THR 47 12.035 6.104 5.536 335 3HG2 THR 47 3HG2 THR 47 11.596 4.801 4.406 336 H CYS 48 H CYS 48 9.457 4.440 2.761 337 HA CYS 48 HA CYS 48 9.626 2.227 2.237 338 1HB CYS 48 1HB CYS 48 10.225 1.269 0.045 339 2HB CYS 48 2HB CYS 48 8.880 2.391 0.092 340 HA PRO 49 HA PRO 49 14.086 1.958 3.413 341 1HB PRO 49 1HB PRO 49 13.886 1.329 6.051 342 2HB PRO 49 2HB PRO 49 13.360 2.896 5.418 343 1HG PRO 49 1HG PRO 49 11.615 0.458 6.054 344 2HG PRO 49 2HG PRO 49 11.353 2.147 6.555 345 1HD PRO 49 1HD PRO 49 10.160 0.964 4.280 346 2HD PRO 49 2HD PRO 49 10.432 2.720 4.461 347 H SER 50 H SER 50 11.919 -0.881 3.681 348 HA SER 50 HA SER 50 14.323 -2.668 4.403 349 1HB SER 50 1HB SER 50 11.331 -3.203 4.869 350 2HB SER 50 2HB SER 50 12.681 -4.214 5.397 351 HG SER 50 HG SER 50 11.690 -2.525 6.849 352 H LYS 51 H LYS 51 11.788 -4.523 3.217 353 HA LYS 51 HA LYS 51 11.060 -5.343 1.154 354 1HB LYS 51 1HB LYS 51 10.170 -3.063 1.534 355 2HB LYS 51 2HB LYS 51 11.487 -2.350 0.646 356 1HG LYS 51 1HG LYS 51 9.900 -4.409 -0.908 357 2HG LYS 51 2HG LYS 51 8.964 -3.033 -0.354 358 1HD LYS 51 1HD LYS 51 9.714 -1.803 -2.051 359 2HD LYS 51 2HD LYS 51 11.356 -1.842 -1.519 360 1HE LYS 51 1HE LYS 51 11.457 -2.709 -3.772 361 2HE LYS 51 2HE LYS 51 11.610 -4.132 -2.729 362 1HZ LYS 51 1HZ LYS 51 8.988 -3.972 -3.041 363 2HZ LYS 51 2HZ LYS 51 9.977 -4.883 -3.980 364 3HZ LYS 51 3HZ LYS 51 9.433 -3.336 -4.476 365 H LYS 52 H LYS 52 12.434 -6.832 0.159 366 HA LYS 52 HA LYS 52 13.435 -5.832 -2.404 367 1HB LYS 52 1HB LYS 52 15.743 -7.485 -1.661 368 2HB LYS 52 2HB LYS 52 15.605 -5.966 -2.555 369 1HG LYS 52 1HG LYS 52 15.619 -4.688 -0.442 370 2HG LYS 52 2HG LYS 52 15.554 -6.127 0.530 371 1HD LYS 52 1HD LYS 52 17.767 -6.786 -0.078 372 2HD LYS 52 2HD LYS 52 17.925 -5.604 -1.339 373 1HE LYS 52 1HE LYS 52 17.477 -4.887 1.621 374 2HE LYS 52 2HE LYS 52 19.130 -5.103 0.973 375 1HZ LYS 52 1HZ LYS 52 18.708 -3.346 -0.609 376 2HZ LYS 52 2HZ LYS 52 18.470 -2.773 0.873 377 3HZ LYS 52 3HZ LYS 52 17.149 -3.097 -0.054 378 HA PRO 53 HA PRO 53 13.523 -10.188 -3.631 379 1HB PRO 53 1HB PRO 53 13.698 -12.459 -1.911 380 2HB PRO 53 2HB PRO 53 14.990 -11.595 -2.748 381 1HG PRO 53 1HG PRO 53 14.448 -11.612 0.124 382 2HG PRO 53 2HG PRO 53 15.793 -10.876 -0.764 383 1HD PRO 53 1HD PRO 53 13.378 -9.541 0.355 384 2HD PRO 53 2HD PRO 53 14.881 -8.799 -0.205 385 H TYR 54 H TYR 54 11.482 -10.919 -0.738 386 HA TYR 54 HA TYR 54 10.363 -13.085 -2.216 387 1HB TYR 54 1HB TYR 54 8.790 -12.551 0.259 388 2HB TYR 54 2HB TYR 54 9.406 -13.978 -0.444 389 HD1 TYR 54 HD1 TYR 54 11.429 -10.952 0.902 390 HD2 TYR 54 HD2 TYR 54 10.270 -15.070 1.380 391 HE1 TYR 54 HE1 TYR 54 12.872 -11.120 2.824 392 HE2 TYR 54 HE2 TYR 54 11.680 -15.216 3.378 393 HH TYR 54 HH TYR 54 13.539 -12.404 4.542 394 H GLU 55 H GLU 55 6.944 -10.792 -2.317 395 HA GLU 55 HA GLU 55 9.269 -9.183 -1.956 396 1HB GLU 55 1HB GLU 55 7.845 -9.364 0.813 397 2HB GLU 55 2HB GLU 55 9.083 -10.482 0.429 398 1HG GLU 55 1HG GLU 55 10.719 -8.595 -0.046 399 2HG GLU 55 2HG GLU 55 9.513 -7.422 0.444 400 H GLU 56 H GLU 56 8.597 -6.983 -1.063 401 HA GLU 56 HA GLU 56 5.658 -6.549 -0.770 402 1HB GLU 56 1HB GLU 56 8.066 -4.905 0.125 403 2HB GLU 56 2HB GLU 56 6.412 -4.358 0.393 404 1HG GLU 56 1HG GLU 56 5.901 -6.117 1.870 405 2HG GLU 56 2HG GLU 56 7.282 -7.101 1.391 406 H VAL 57 H VAL 57 4.530 -4.631 -1.288 407 HA VAL 57 HA VAL 57 5.485 -3.068 -3.708 408 HB VAL 57 HB VAL 57 3.402 -3.778 -4.195 409 1HG1 VAL 57 1HG1 VAL 57 1.306 -2.913 -2.623 410 2HG1 VAL 57 2HG1 VAL 57 2.470 -3.388 -1.383 411 3HG1 VAL 57 3HG1 VAL 57 2.001 -4.536 -2.600 412 1HG2 VAL 57 1HG2 VAL 57 2.824 -0.889 -3.393 413 2HG2 VAL 57 2HG2 VAL 57 3.871 -1.367 -4.739 414 3HG2 VAL 57 3HG2 VAL 57 2.148 -1.830 -4.731 415 H THR 58 H THR 58 4.754 -0.687 -3.310 416 HA THR 58 HA THR 58 7.295 -0.042 -1.768 417 HB THR 58 HB THR 58 7.402 1.449 -4.144 418 HG1 THR 58 HG1 THR 58 6.730 0.169 -5.806 419 1HG2 THR 58 1HG2 THR 58 8.883 -0.224 -5.098 420 2HG2 THR 58 2HG2 THR 58 9.220 -0.004 -3.373 421 3HG2 THR 58 3HG2 THR 58 8.325 -1.447 -3.918 422 H CYS 59 H CYS 59 7.934 2.103 -1.923 423 HA CYS 59 HA CYS 59 6.604 4.504 -1.341 424 1HB CYS 59 1HB CYS 59 8.283 4.997 -3.688 425 2HB CYS 59 2HB CYS 59 8.639 5.322 -2.013 426 H CYS 60 H CYS 60 4.817 5.378 -2.066 427 HA CYS 60 HA CYS 60 3.483 4.722 -4.668 428 1HB CYS 60 1HB CYS 60 2.823 6.701 -2.388 429 2HB CYS 60 2HB CYS 60 1.979 6.773 -3.922 430 H SER 61 H SER 61 3.979 5.683 -6.501 431 HA SER 61 HA SER 61 5.263 8.404 -6.746 432 1HB SER 61 1HB SER 61 5.572 6.470 -8.463 433 2HB SER 61 2HB SER 61 3.928 6.809 -9.015 434 HG SER 61 HG SER 61 4.704 9.067 -9.171 435 H THR 62 H THR 62 2.123 7.536 -5.821 436 HA THR 62 HA THR 62 0.792 9.972 -6.852 437 HB THR 62 HB THR 62 0.973 8.591 -8.959 438 HG1 THR 62 HG1 THR 62 -1.152 8.877 -9.528 439 1HG2 THR 62 1HG2 THR 62 0.644 6.246 -8.046 440 2HG2 THR 62 2HG2 THR 62 -1.066 6.663 -7.685 441 3HG2 THR 62 3HG2 THR 62 -0.480 6.639 -9.364 442 H ASP 63 H ASP 63 -1.344 10.145 -6.380 443 HA ASP 63 HA ASP 63 -2.535 9.592 -3.931 444 1HB ASP 63 1HB ASP 63 -4.165 9.664 -6.548 445 2HB ASP 63 2HB ASP 63 -4.649 10.209 -4.965 446 H LYS 64 H LYS 64 -2.704 7.688 -2.989 447 HA LYS 64 HA LYS 64 -3.217 5.607 -2.391 448 1HB LYS 64 1HB LYS 64 -5.411 5.597 -4.197 449 2HB LYS 64 2HB LYS 64 -4.515 4.192 -4.653 450 1HG LYS 64 1HG LYS 64 -4.458 3.497 -2.133 451 2HG LYS 64 2HG LYS 64 -5.486 4.862 -1.817 452 1HD LYS 64 1HD LYS 64 -6.936 3.547 -3.860 453 2HD LYS 64 2HD LYS 64 -6.105 2.218 -3.059 454 1HE LYS 64 1HE LYS 64 -7.087 3.028 -0.810 455 2HE LYS 64 2HE LYS 64 -8.042 4.208 -1.715 456 1HZ LYS 64 1HZ LYS 64 -8.855 2.168 -3.048 457 2HZ LYS 64 2HZ LYS 64 -9.394 2.308 -1.495 458 3HZ LYS 64 3HZ LYS 64 -8.189 1.240 -1.869 459 H CYS 65 H CYS 65 -2.267 5.447 -5.828 460 HA CYS 65 HA CYS 65 -0.889 4.127 -6.977 461 1HB CYS 65 1HB CYS 65 1.243 3.400 -6.462 462 2HB CYS 65 2HB CYS 65 1.023 5.010 -5.808 463 H ASN 66 H ASN 66 -0.657 1.984 -4.118 464 HA ASN 66 HA ASN 66 -2.103 0.572 -3.340 465 1HB ASN 66 1HB ASN 66 -4.298 0.750 -3.400 466 2HB ASN 66 2HB ASN 66 -3.712 2.255 -3.947 467 1HD2 ASN 66 1HD2 ASN 66 -6.136 0.101 -4.446 468 2HD2 ASN 66 2HD2 ASN 66 -6.568 0.569 -6.151 469 HA PRO 67 HA PRO 67 -0.914 -3.119 -4.139 470 1HB PRO 67 1HB PRO 67 -2.185 -4.740 -2.509 471 2HB PRO 67 2HB PRO 67 -1.482 -3.231 -2.024 472 1HG PRO 67 1HG PRO 67 -4.443 -3.693 -2.664 473 2HG PRO 67 2HG PRO 67 -3.769 -2.968 -1.183 474 1HD PRO 67 1HD PRO 67 -4.585 -1.416 -3.296 475 2HD PRO 67 2HD PRO 67 -3.211 -0.961 -2.264 476 H HIS 68 H HIS 68 -3.032 -5.509 -6.592 477 HA HIS 68 HA HIS 68 -4.848 -6.248 -5.714 478 1HB HIS 68 1HB HIS 68 -3.371 -6.206 -3.168 479 2HB HIS 68 2HB HIS 68 -4.934 -6.939 -3.254 480 HD1 HIS 68 HD1 HIS 68 -1.456 -7.319 -5.065 481 HD2 HIS 68 HD2 HIS 68 -4.724 -9.504 -3.376 482 HE1 HIS 68 HE1 HIS 68 -0.965 -9.840 -5.117 483 HE2 HIS 68 HE2 HIS 68 -2.884 -11.254 -4.173 484 HA PRO 69 HA PRO 69 -8.367 -4.238 -5.200 485 1HB PRO 69 1HB PRO 69 -8.721 -2.657 -7.392 486 2HB PRO 69 2HB PRO 69 -8.298 -1.981 -5.812 487 1HG PRO 69 1HG PRO 69 -6.442 -2.497 -8.172 488 2HG PRO 69 2HG PRO 69 -6.511 -1.077 -7.165 489 1HD PRO 69 1HD PRO 69 -4.696 -3.219 -6.847 490 2HD PRO 69 2HD PRO 69 -5.112 -2.112 -5.506 491 H LYS 70 H LYS 70 -6.687 -4.196 -8.318 492 HA LYS 70 HA LYS 70 -6.200 -5.717 -9.974 493 1HB LYS 70 1HB LYS 70 -4.608 -5.802 -8.034 494 2HB LYS 70 2HB LYS 70 -5.255 -7.350 -7.509 495 1HG LYS 70 1HG LYS 70 -3.834 -6.731 -10.183 496 2HG LYS 70 2HG LYS 70 -3.120 -7.501 -8.783 497 1HD LYS 70 1HD LYS 70 -5.201 -8.727 -10.670 498 2HD LYS 70 2HD LYS 70 -3.584 -9.148 -10.563 499 1HE LYS 70 1HE LYS 70 -5.923 -9.824 -8.654 500 2HE LYS 70 2HE LYS 70 -4.829 -10.939 -9.398 501 1HZ LYS 70 1HZ LYS 70 -4.131 -9.093 -7.211 502 2HZ LYS 70 2HZ LYS 70 -4.466 -10.765 -7.082 503 3HZ LYS 70 3HZ LYS 70 -3.077 -10.217 -7.874 504 H GLN 71 H GLN 71 -7.186 -6.896 -11.289 505 HA GLN 71 HA GLN 71 -9.180 -9.051 -10.426 506 1HB GLN 71 1HB GLN 71 -10.745 -8.192 -12.027 507 2HB GLN 71 2HB GLN 71 -10.351 -7.044 -10.784 508 1HG GLN 71 1HG GLN 71 -9.282 -6.833 -13.681 509 2HG GLN 71 2HG GLN 71 -10.723 -6.081 -13.073 510 1HE2 GLN 71 1HE2 GLN 71 -7.349 -5.630 -13.415 511 2HE2 GLN 71 2HE2 GLN 71 -7.267 -4.114 -12.384 512 H ARG 72 H ARG 72 -8.540 -8.243 -13.737 513 HA ARG 72 HA ARG 72 -7.140 -10.843 -14.372 514 1HB ARG 72 1HB ARG 72 -10.005 -10.161 -15.390 515 2HB ARG 72 2HB ARG 72 -9.012 -11.426 -16.030 516 1HG ARG 72 1HG ARG 72 -9.989 -12.890 -14.697 517 2HG ARG 72 2HG ARG 72 -9.067 -12.252 -13.378 518 1HD ARG 72 1HD ARG 72 -11.520 -12.534 -12.882 519 2HD ARG 72 2HD ARG 72 -10.936 -10.896 -12.587 520 HE ARG 72 HE ARG 72 -12.593 -10.106 -14.066 521 1HH1 ARG 72 1HH1 ARG 72 -11.967 -13.476 -15.036 522 2HH1 ARG 72 2HH1 ARG 72 -13.192 -13.311 -16.397 523 1HH2 ARG 72 1HH2 ARG 72 -13.967 -10.057 -15.627 524 2HH2 ARG 72 2HH2 ARG 72 -14.268 -11.536 -16.674 525 HA PRO 73 HA PRO 73 -6.401 -8.290 -18.351 526 1HB PRO 73 1HB PRO 73 -6.066 -10.302 -20.205 527 2HB PRO 73 2HB PRO 73 -4.827 -9.865 -19.022 528 1HG PRO 73 1HG PRO 73 -6.836 -12.170 -18.808 529 2HG PRO 73 2HG PRO 73 -5.081 -12.228 -18.561 530 1HD PRO 73 1HD PRO 73 -6.831 -11.997 -16.440 531 2HD PRO 73 2HD PRO 73 -5.240 -11.194 -16.398 532 H GLY 74 H GLY 74 -8.229 -7.287 -19.030 533 1HA GLY 74 1HA GLY 74 -10.803 -8.896 -19.637 534 2HA GLY 74 2HA GLY 74 -10.771 -7.541 -18.521
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