NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
1129 | 1a7i | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 H ASN 8 HN ASN 8 -2.246 -11.600 6.044 2 HA ASN 8 HA ASN 8 -1.826 -13.067 8.011 3 1HB ASN 8 2HB ASN 8 1.096 -12.512 7.115 4 2HB ASN 8 1HB ASN 8 0.638 -13.162 8.735 5 1HD2 ASN 8 2HD2 ASN 8 -0.451 -16.397 7.386 6 2HD2 ASN 8 1HD2 ASN 8 -0.898 -15.223 8.579 7 H LYS 9 HN LYS 9 0.725 -10.576 7.384 8 HA LYS 9 HA LYS 9 -0.740 -8.788 9.204 9 1HB LYS 9 2HB LYS 9 2.266 -9.395 9.203 10 2HB LYS 9 1HB LYS 9 1.461 -8.105 10.168 11 1HG LYS 9 2HG LYS 9 0.067 -9.835 11.307 12 2HG LYS 9 1HG LYS 9 1.001 -11.127 10.476 13 1HD LYS 9 2HD LYS 9 2.154 -8.988 12.371 14 2HD LYS 9 1HD LYS 9 1.732 -10.679 12.820 15 1HE LYS 9 2HE LYS 9 3.453 -11.559 11.206 16 2HE LYS 9 1HE LYS 9 3.923 -9.862 10.780 17 1HZ LYS 9 1HZ LYS 9 4.073 -11.096 13.479 18 2HZ LYS 9 3HZ LYS 9 5.368 -10.810 12.418 19 3HZ LYS 9 2HZ LYS 9 4.507 -9.504 13.079 20 H CYS 10 HN CYS 10 -0.726 -6.753 8.775 21 HA CYS 10 HA CYS 10 -0.184 -5.776 6.243 22 1HB CYS 10 2HB CYS 10 -2.185 -5.358 7.452 23 2HB CYS 10 1HB CYS 10 -1.308 -4.836 8.904 24 H GLY 11 HN GLY 11 0.985 -3.714 5.897 25 1HA GLY 11 2HA GLY 11 3.588 -3.797 7.101 26 2HA GLY 11 1HA GLY 11 2.970 -2.744 5.775 27 H ALA 12 HN ALA 12 0.621 -1.949 7.505 28 HA ALA 12 HA ALA 12 1.922 0.248 8.871 29 1HB ALA 12 1HB ALA 12 -0.893 -0.284 7.978 30 2HB ALA 12 3HB ALA 12 -0.476 1.118 9.059 31 3HB ALA 12 2HB ALA 12 0.224 0.988 7.409 32 H CYS 13 HN CYS 13 -1.029 -1.360 9.763 33 HA CYS 13 HA CYS 13 -0.381 -1.304 12.485 34 1HB CYS 13 2HB CYS 13 -2.235 -3.438 12.563 35 2HB CYS 13 1HB CYS 13 -2.347 -1.795 12.845 36 H GLY 14 HN GLY 14 -1.169 -4.258 10.868 37 1HA GLY 14 2HA GLY 14 0.417 -6.074 10.639 38 2HA GLY 14 1HA GLY 14 0.990 -5.667 12.311 39 H ARG 15 HN ARG 15 -2.467 -5.012 11.811 40 HA ARG 15 HA ARG 15 -3.273 -7.234 13.307 41 1HB ARG 15 2HB ARG 15 -4.550 -5.023 11.633 42 2HB ARG 15 1HB ARG 15 -5.563 -6.287 12.337 43 1HG ARG 15 2HG ARG 15 -3.721 -4.413 13.917 44 2HG ARG 15 1HG ARG 15 -5.485 -4.188 13.647 45 1HD ARG 15 2HD ARG 15 -5.973 -6.318 14.890 46 2HD ARG 15 1HD ARG 15 -4.195 -6.545 15.200 47 HE ARG 15 HE ARG 15 -4.951 -3.908 16.066 48 1HH1 ARG 15 2HH1 ARG 15 -5.488 -7.348 16.958 49 2HH1 ARG 15 1HH1 ARG 15 -5.718 -7.002 18.640 50 1HH2 ARG 15 1HH2 ARG 15 -5.267 -3.498 18.330 51 2HH2 ARG 15 2HH2 ARG 15 -5.591 -4.801 19.424 52 H THR 16 HN THR 16 -5.504 -8.283 11.956 53 HA THR 16 HA THR 16 -4.019 -10.050 10.224 54 HB THR 16 HB THR 16 -6.831 -10.377 11.314 55 HG1 THR 16 HG1 THR 16 -5.852 -11.559 12.856 56 1HG2 THR 16 2HG2 THR 16 -4.756 -12.334 10.047 57 2HG2 THR 16 1HG2 THR 16 -6.313 -12.826 10.808 58 3HG2 THR 16 3HG2 THR 16 -6.324 -11.849 9.307 59 H VAL 17 HN VAL 17 -3.883 -9.056 8.103 60 HA VAL 17 HA VAL 17 -6.066 -8.703 6.506 61 HB VAL 17 HB VAL 17 -4.045 -9.451 4.774 62 1HG1 VAL 17 2HG1 VAL 17 -5.354 -7.232 4.738 63 2HG1 VAL 17 1HG1 VAL 17 -4.206 -6.650 5.997 64 3HG1 VAL 17 3HG1 VAL 17 -3.613 -7.171 4.386 65 1HG2 VAL 17 1HG2 VAL 17 -2.641 -9.750 6.720 66 2HG2 VAL 17 3HG2 VAL 17 -2.048 -8.389 5.643 67 3HG2 VAL 17 2HG2 VAL 17 -2.991 -8.003 7.166 68 H TYR 18 HN TYR 18 -6.983 -10.529 5.115 69 HA TYR 18 HA TYR 18 -5.705 -13.117 5.404 70 1HB TYR 18 2HB TYR 18 -7.189 -12.893 7.486 71 2HB TYR 18 1HB TYR 18 -8.621 -12.743 6.419 72 HD1 TYR 18 HD1 TYR 18 -5.628 -14.963 7.086 73 HD2 TYR 18 HD2 TYR 18 -9.718 -14.732 5.771 74 HE1 TYR 18 HE1 TYR 18 -5.729 -17.425 6.981 75 HE2 TYR 18 HE2 TYR 18 -9.829 -17.194 5.662 76 HH TYR 18 HH TYR 18 -8.726 -19.138 5.958 77 H HIS 19 HN HIS 19 -9.066 -12.045 4.562 78 HA HIS 19 HA HIS 19 -8.520 -12.797 1.782 79 1HB HIS 19 2HB HIS 19 -9.481 -14.801 2.948 80 2HB HIS 19 1HB HIS 19 -10.885 -13.840 3.492 81 HD1 HIS 19 HD1 HIS 19 -12.471 -12.977 1.439 82 HD2 HIS 19 HD2 HIS 19 -9.633 -15.890 0.406 83 HE1 HIS 19 HE1 HIS 19 -13.167 -13.955 -0.791 84 H ALA 20 HN ALA 20 -11.134 -11.729 4.056 85 HA ALA 20 HA ALA 20 -12.361 -10.139 2.169 86 1HB ALA 20 1HB ALA 20 -12.633 -10.162 5.242 87 2HB ALA 20 3HB ALA 20 -13.774 -9.345 4.106 88 3HB ALA 20 2HB ALA 20 -13.598 -11.134 4.080 89 H GLU 21 HN GLU 21 -10.392 -9.375 5.087 90 HA GLU 21 HA GLU 21 -10.405 -6.569 4.452 91 1HB GLU 21 2HB GLU 21 -9.142 -6.340 6.670 92 2HB GLU 21 1HB GLU 21 -10.807 -6.984 6.771 93 1HG GLU 21 2HG GLU 21 -8.260 -8.752 6.760 94 2HG GLU 21 1HG GLU 21 -8.987 -8.026 8.233 95 H GLU 22 HN GLU 22 -8.859 -8.210 2.498 96 HA GLU 22 HA GLU 22 -6.443 -6.665 2.855 97 1HB GLU 22 2HB GLU 22 -4.883 -8.513 2.420 98 2HB GLU 22 1HB GLU 22 -6.090 -8.994 3.660 99 1HG GLU 22 2HG GLU 22 -5.701 -10.873 2.410 100 2HG GLU 22 1HG GLU 22 -7.405 -10.338 2.176 101 H VAL 23 HN VAL 23 -5.351 -6.249 0.934 102 HA VAL 23 HA VAL 23 -6.660 -6.990 -1.566 103 HB VAL 23 HB VAL 23 -5.431 -4.253 -0.940 104 1HG1 VAL 23 1HG1 VAL 23 -6.841 -5.352 -3.463 105 2HG1 VAL 23 3HG1 VAL 23 -6.312 -3.644 -3.220 106 3HG1 VAL 23 2HG1 VAL 23 -5.086 -4.952 -3.305 107 1HG2 VAL 23 1HG2 VAL 23 -8.376 -4.987 -1.211 108 2HG2 VAL 23 3HG2 VAL 23 -7.507 -4.357 0.255 109 3HG2 VAL 23 2HG2 VAL 23 -7.689 -3.307 -1.189 110 H GLN 24 HN GLN 24 -5.009 -7.634 -3.018 111 HA GLN 24 HA GLN 24 -2.464 -8.117 -1.689 112 1HB GLN 24 2HB GLN 24 -3.435 -8.979 -4.477 113 2HB GLN 24 1HB GLN 24 -1.871 -9.439 -3.702 114 1HG GLN 24 2HG GLN 24 -3.129 -10.618 -1.874 115 2HG GLN 24 1HG GLN 24 -4.688 -10.174 -2.668 116 1HE2 GLN 24 2HE2 GLN 24 -2.181 -12.988 -4.512 117 2HE2 GLN 24 1HE2 GLN 24 -1.496 -11.810 -3.443 118 H CYS 25 HN CYS 25 -0.588 -7.147 -2.198 119 HA CYS 25 HA CYS 25 -0.479 -5.314 -4.457 120 1HB CYS 25 2HB CYS 25 -1.273 -4.005 -2.342 121 2HB CYS 25 1HB CYS 25 0.225 -4.489 -1.548 122 HG CYS 25 HG CYS 25 0.409 -2.028 -2.342 123 H ASP 26 HN ASP 26 0.896 -6.913 -5.341 124 HA ASP 26 HA ASP 26 2.750 -7.811 -5.846 125 1HB ASP 26 2HB ASP 26 3.733 -5.538 -5.413 126 2HB ASP 26 1HB ASP 26 4.236 -6.071 -3.780 127 H GLY 27 HN GLY 27 4.486 -7.713 -2.831 128 1HA GLY 27 2HA GLY 27 4.224 -10.585 -2.686 129 2HA GLY 27 1HA GLY 27 5.390 -9.484 -1.862 130 H ARG 28 HN ARG 28 3.451 -7.649 -0.742 131 HA ARG 28 HA ARG 28 2.497 -9.312 1.459 132 1HB ARG 28 2HB ARG 28 2.461 -7.183 2.768 133 2HB ARG 28 1HB ARG 28 4.088 -7.411 2.066 134 1HG ARG 28 2HG ARG 28 1.825 -5.676 0.986 135 2HG ARG 28 1HG ARG 28 3.092 -5.115 2.116 136 1HD ARG 28 2HD ARG 28 3.670 -6.032 -0.790 137 2HD ARG 28 1HD ARG 28 3.567 -4.327 -0.205 138 HE ARG 28 HE ARG 28 5.464 -5.787 1.412 139 1HH1 ARG 28 1HH2 ARG 28 5.057 -4.473 -1.913 140 2HH1 ARG 28 2HH2 ARG 28 6.760 -4.295 -2.181 141 1HH2 ARG 28 1HH1 ARG 28 7.736 -5.529 0.998 142 2HH2 ARG 28 2HH1 ARG 28 8.289 -4.899 -0.518 143 H SER 29 HN SER 29 0.362 -7.985 2.468 144 HA SER 29 HA SER 29 -1.226 -6.892 0.411 145 1HB SER 29 2HB SER 29 -2.370 -8.609 2.815 146 2HB SER 29 1HB SER 29 -3.045 -7.703 1.493 147 HG SER 29 HG SER 29 -2.959 -9.984 1.143 148 H PHE 30 HN PHE 30 -2.730 -5.384 1.671 149 HA PHE 30 HA PHE 30 -1.692 -4.768 4.380 150 1HB PHE 30 2HB PHE 30 -3.017 -2.699 2.543 151 2HB PHE 30 1HB PHE 30 -2.169 -2.389 4.104 152 HD1 PHE 30 HD1 PHE 30 0.197 -2.906 4.434 153 HD2 PHE 30 HD2 PHE 30 -1.460 -2.955 0.445 154 HE1 PHE 30 HE1 PHE 30 2.483 -2.926 3.448 155 HE2 PHE 30 HE2 PHE 30 0.790 -2.615 -0.465 156 HZ PHE 30 HZ PHE 30 2.769 -2.583 1.021 157 H HIS 31 HN HIS 31 -3.506 -3.665 5.601 158 HA HIS 31 HA HIS 31 -5.843 -5.087 5.065 159 1HB HIS 31 2HB HIS 31 -5.854 -2.639 6.867 160 2HB HIS 31 1HB HIS 31 -6.993 -4.078 6.739 161 HD2 HIS 31 HD2 HIS 31 -6.151 -6.463 7.110 162 HE1 HIS 31 HE1 HIS 31 -3.361 -5.282 10.061 163 HE2 HIS 31 HE2 HIS 31 -4.706 -7.207 9.163 164 H ARG 32 HN ARG 32 -7.476 -4.632 4.435 165 HA ARG 32 HA ARG 32 -8.166 -3.356 2.138 166 1HB ARG 32 2HB ARG 32 -9.644 -4.993 3.085 167 2HB ARG 32 1HB ARG 32 -10.068 -3.920 4.462 168 1HG ARG 32 2HG ARG 32 -11.342 -2.443 2.958 169 2HG ARG 32 1HG ARG 32 -10.712 -3.303 1.509 170 1HD ARG 32 2HD ARG 32 -13.102 -3.947 2.078 171 2HD ARG 32 1HD ARG 32 -11.944 -5.348 2.087 172 HE ARG 32 HE ARG 32 -12.135 -4.180 4.740 173 1HH1 ARG 32 1HH2 ARG 32 -13.974 -6.242 2.439 174 2HH1 ARG 32 2HH2 ARG 32 -14.740 -7.162 3.691 175 1HH2 ARG 32 1HH1 ARG 32 -13.183 -5.445 6.375 176 2HH2 ARG 32 2HH1 ARG 32 -14.288 -6.706 5.939 177 H CYS 33 HN CYS 33 -8.907 -1.851 5.371 178 HA CYS 33 HA CYS 33 -9.577 0.662 4.084 179 1HB CYS 33 2HB CYS 33 -9.286 -0.077 7.044 180 2HB CYS 33 1HB CYS 33 -9.871 1.490 6.400 181 HG CYS 33 HG CYS 33 -11.868 0.096 7.363 182 H CYS 34 HN CYS 34 -7.132 -0.742 6.304 183 HA CYS 34 HA CYS 34 -5.581 1.707 6.386 184 1HB CYS 34 2HB CYS 34 -5.771 0.767 8.531 185 2HB CYS 34 1HB CYS 34 -5.769 -0.889 7.915 186 H PHE 35 HN PHE 35 -5.385 1.642 4.111 187 HA PHE 35 HA PHE 35 -3.439 -0.324 3.070 188 1HB PHE 35 2HB PHE 35 -5.952 -0.262 2.212 189 2HB PHE 35 1HB PHE 35 -5.567 1.335 1.519 190 HD1 PHE 35 HD2 PHE 35 -4.712 -2.309 1.467 191 HD2 PHE 35 HD1 PHE 35 -4.342 1.467 -0.502 192 HE1 PHE 35 HE2 PHE 35 -3.642 -3.434 -0.406 193 HE2 PHE 35 HE1 PHE 35 -3.430 0.356 -2.491 194 HZ PHE 35 HZ PHE 35 -3.069 -2.098 -2.501 195 H LEU 36 HN LEU 36 -1.402 0.724 2.665 196 HA LEU 36 HA LEU 36 -1.500 3.603 2.210 197 1HB LEU 36 2HB LEU 36 0.534 3.442 3.796 198 2HB LEU 36 1HB LEU 36 -1.050 3.064 4.503 199 HG LEU 36 HG LEU 36 0.658 1.679 5.298 200 1HD1 LEU 36 2HD1 LEU 36 -1.574 0.774 5.481 201 2HD1 LEU 36 3HD1 LEU 36 -1.246 -0.277 4.049 202 3HD1 LEU 36 1HD1 LEU 36 -0.260 -0.459 5.526 203 1HD2 LEU 36 2HD2 LEU 36 2.206 1.399 3.385 204 2HD2 LEU 36 1HD2 LEU 36 1.872 -0.120 4.286 205 3HD2 LEU 36 3HD2 LEU 36 1.080 0.160 2.703 206 H CYS 37 HN CYS 37 0.368 4.570 1.414 207 HA CYS 37 HA CYS 37 2.114 3.376 -0.470 208 1HB CYS 37 2HB CYS 37 1.353 5.799 -0.097 209 2HB CYS 37 1HB CYS 37 2.314 5.873 1.323 210 H MET 38 HN MET 38 4.020 2.266 -0.036 211 HA MET 38 HA MET 38 4.703 1.806 2.724 212 1HB MET 38 2HB MET 38 4.755 0.054 0.933 213 2HB MET 38 1HB MET 38 6.121 0.919 0.157 214 1HG MET 38 2HG MET 38 7.508 0.459 2.186 215 2HG MET 38 1HG MET 38 6.077 -0.252 3.003 216 1HE MET 38 3HE MET 38 7.421 -2.328 3.632 217 2HE MET 38 2HE MET 38 8.393 -3.327 2.498 218 3HE MET 38 1HE MET 38 8.871 -1.627 2.833 219 H VAL 39 HN VAL 39 5.295 4.215 0.364 220 HA VAL 39 HA VAL 39 8.005 4.769 1.319 221 HB VAL 39 HB VAL 39 6.702 6.748 -0.620 222 1HG1 VAL 39 1HG1 VAL 39 9.507 5.629 -0.139 223 2HG1 VAL 39 3HG1 VAL 39 9.007 6.938 -1.291 224 3HG1 VAL 39 2HG1 VAL 39 8.824 7.188 0.489 225 1HG2 VAL 39 2HG2 VAL 39 7.466 3.932 -1.368 226 2HG2 VAL 39 1HG2 VAL 39 5.909 4.899 -1.462 227 3HG2 VAL 39 3HG2 VAL 39 7.323 5.380 -2.464 228 H CYS 40 HN CYS 40 5.407 7.108 0.538 229 HA CYS 40 HA CYS 40 6.286 8.765 2.620 230 1HB CYS 40 2HB CYS 40 5.098 10.353 1.479 231 2HB CYS 40 1HB CYS 40 5.423 9.106 0.254 232 H ARG 41 HN ARG 41 3.454 6.931 1.991 233 HA ARG 41 HA ARG 41 2.026 5.779 3.344 234 1HB ARG 41 2HB ARG 41 2.959 7.359 5.787 235 2HB ARG 41 1HB ARG 41 1.758 6.034 5.807 236 1HG ARG 41 2HG ARG 41 4.493 5.442 4.642 237 2HG ARG 41 1HG ARG 41 4.368 5.704 6.411 238 1HD ARG 41 2HD ARG 41 2.888 3.863 6.771 239 2HD ARG 41 1HD ARG 41 2.534 3.673 5.003 240 HE ARG 41 HE ARG 41 5.318 3.390 5.185 241 1HH1 ARG 41 1HH1 ARG 41 2.484 1.746 6.644 242 2HH1 ARG 41 2HH1 ARG 41 3.248 0.192 6.684 243 1HH2 ARG 41 1HH2 ARG 41 6.303 1.283 5.250 244 2HH2 ARG 41 2HH2 ARG 41 5.431 -0.072 5.885 245 H LYS 42 HN LYS 42 0.829 7.470 1.559 246 HA LYS 42 HA LYS 42 -0.663 9.377 3.159 247 1HB LYS 42 2HB LYS 42 -0.351 10.558 1.341 248 2HB LYS 42 1HB LYS 42 0.174 9.155 0.382 249 1HG LYS 42 2HG LYS 42 -2.791 9.900 0.761 250 2HG LYS 42 1HG LYS 42 -1.689 10.442 -0.547 251 1HD LYS 42 2HD LYS 42 -1.089 8.006 -0.906 252 2HD LYS 42 1HD LYS 42 -2.563 7.561 -0.025 253 1HE LYS 42 1HE LYS 42 -2.464 9.384 -2.544 254 2HE LYS 42 2HE LYS 42 -2.994 7.658 -2.514 255 1HZ LYS 42 3HZ LYS 42 -4.774 8.275 -1.032 256 2HZ LYS 42 2HZ LYS 42 -4.286 9.901 -1.064 257 3HZ LYS 42 1HZ LYS 42 -4.842 9.154 -2.485 258 H ASN 43 HN ASN 43 -3.134 9.193 2.908 259 HA ASN 43 HA ASN 43 -3.872 6.551 3.703 260 1HB ASN 43 2HB ASN 43 -5.614 9.049 3.184 261 2HB ASN 43 1HB ASN 43 -6.194 7.504 3.916 262 1HD2 ASN 43 2HD2 ASN 43 -4.418 10.261 6.319 263 2HD2 ASN 43 1HD2 ASN 43 -4.933 10.597 4.699 264 H LEU 44 HN LEU 44 -3.664 5.121 2.069 265 HA LEU 44 HA LEU 44 -4.773 5.702 -0.556 266 1HB LEU 44 2HB LEU 44 -2.325 4.922 -0.100 267 2HB LEU 44 1HB LEU 44 -3.012 3.362 0.402 268 HG LEU 44 HG LEU 44 -3.900 3.016 -1.922 269 1HD1 LEU 44 3HD1 LEU 44 -2.408 5.600 -2.609 270 2HD1 LEU 44 1HD1 LEU 44 -3.111 4.437 -3.791 271 3HD1 LEU 44 2HD1 LEU 44 -4.196 5.360 -2.689 272 1HD2 LEU 44 3HD2 LEU 44 -0.890 3.603 -1.590 273 2HD2 LEU 44 1HD2 LEU 44 -1.740 2.053 -1.266 274 3HD2 LEU 44 2HD2 LEU 44 -1.608 2.674 -2.956 275 H ASP 45 HN ASP 45 -5.891 3.550 -1.546 276 HA ASP 45 HA ASP 45 -7.249 1.931 0.289 277 1HB ASP 45 2HB ASP 45 -9.585 2.847 0.124 278 2HB ASP 45 1HB ASP 45 -8.501 3.919 1.037 279 H SER 46 HN SER 46 -9.702 2.133 -1.579 280 HA SER 46 HA SER 46 -8.549 0.580 -3.760 281 1HB SER 46 2HB SER 46 -11.482 0.992 -2.883 282 2HB SER 46 1HB SER 46 -10.918 -0.092 -4.218 283 HG SER 46 HG SER 46 -10.443 -0.278 -1.445 284 H THR 47 HN THR 47 -7.865 3.278 -3.845 285 HA THR 47 HA THR 47 -9.537 4.481 -5.898 286 HB THR 47 HB THR 47 -7.487 6.105 -6.013 287 HG1 THR 47 HG1 THR 47 -6.316 6.193 -4.163 288 1HG2 THR 47 1HG2 THR 47 -9.354 5.960 -3.552 289 2HG2 THR 47 3HG2 THR 47 -8.477 7.424 -4.133 290 3HG2 THR 47 2HG2 THR 47 -9.752 6.671 -5.156 291 H THR 48 HN THR 48 -5.889 4.004 -5.891 292 HA THR 48 HA THR 48 -6.205 1.889 -7.798 293 HB THR 48 HB THR 48 -4.100 2.802 -8.937 294 HG1 THR 48 HG1 THR 48 -3.653 4.931 -8.675 295 1HG2 THR 48 2HG2 THR 48 -6.382 2.935 -9.963 296 2HG2 THR 48 1HG2 THR 48 -6.649 4.538 -9.181 297 3HG2 THR 48 3HG2 THR 48 -5.349 4.339 -10.411 298 H VAL 49 HN VAL 49 -3.228 2.497 -7.435 299 HA VAL 49 HA VAL 49 -1.979 2.165 -5.208 300 HB VAL 49 HB VAL 49 -3.398 0.436 -4.645 301 1HG1 VAL 49 1HG1 VAL 49 -3.481 -0.334 -6.971 302 2HG1 VAL 49 3HG1 VAL 49 -1.815 -0.996 -6.789 303 3HG1 VAL 49 2HG1 VAL 49 -3.182 -1.735 -5.823 304 1HG2 VAL 49 3HG2 VAL 49 -1.092 0.713 -3.596 305 2HG2 VAL 49 2HG2 VAL 49 -1.592 -1.009 -3.679 306 3HG2 VAL 49 1HG2 VAL 49 -0.401 -0.376 -4.853 307 H ALA 50 HN ALA 50 0.337 1.394 -5.731 308 HA ALA 50 HA ALA 50 0.722 0.574 -8.462 309 1HB ALA 50 3HB ALA 50 2.113 3.119 -7.380 310 2HB ALA 50 2HB ALA 50 2.484 2.300 -8.947 311 3HB ALA 50 1HB ALA 50 0.890 3.090 -8.697 312 H ILE 51 HN ILE 51 3.003 -0.173 -8.750 313 HA ILE 51 HA ILE 51 4.436 -0.523 -6.262 314 HB ILE 51 HB ILE 51 3.257 -2.636 -7.078 315 1HG1 ILE 51 2HG1 ILE 51 5.269 -4.120 -6.896 316 2HG1 ILE 51 1HG1 ILE 51 6.318 -2.662 -6.873 317 1HG2 ILE 51 1HG2 ILE 51 3.456 -2.203 -9.540 318 2HG2 ILE 51 3HG2 ILE 51 5.234 -2.508 -9.441 319 3HG2 ILE 51 2HG2 ILE 51 4.072 -3.820 -9.050 320 1HD1 ILE 51 1HD1 ILE 51 3.992 -3.264 -4.931 321 2HD1 ILE 51 2HD1 ILE 51 5.752 -3.480 -4.545 322 3HD1 ILE 51 3HD1 ILE 51 5.067 -1.837 -4.853 323 H HIS 52 HN HIS 52 6.700 -0.171 -6.496 324 HA HIS 52 HA HIS 52 7.720 -0.004 -9.167 325 1HB HIS 52 2HB HIS 52 6.961 2.403 -8.675 326 2HB HIS 52 1HB HIS 52 8.137 2.444 -7.331 327 HD1 HIS 52 HD1 HIS 52 10.736 1.939 -8.217 328 HD2 HIS 52 HD2 HIS 52 7.949 3.091 -11.134 329 HE1 HIS 52 HE1 HIS 52 12.040 2.721 -10.242 330 H ASP 53 HN ASP 53 9.319 -1.393 -8.969 331 HA ASP 53 HA ASP 53 11.000 -2.487 -8.305 332 1HB ASP 53 2HB ASP 53 12.037 -0.184 -8.086 333 2HB ASP 53 1HB ASP 53 11.751 -0.251 -6.321 334 H ALA 54 HN ALA 54 11.497 -1.659 -5.031 335 HA ALA 54 HA ALA 54 10.482 -4.261 -4.277 336 1HB ALA 54 2HB ALA 54 12.848 -3.632 -3.755 337 2HB ALA 54 1HB ALA 54 12.265 -2.236 -2.783 338 3HB ALA 54 3HB ALA 54 11.914 -3.926 -2.248 339 H GLU 55 HN GLU 55 9.379 -0.965 -4.068 340 HA GLU 55 HA GLU 55 7.795 -1.644 -1.677 341 1HB GLU 55 2HB GLU 55 8.000 0.704 -0.914 342 2HB GLU 55 1HB GLU 55 9.552 -0.169 -0.865 343 1HG GLU 55 2HG GLU 55 8.715 1.775 -3.125 344 2HG GLU 55 1HG GLU 55 9.571 2.275 -1.627 345 H VAL 56 HN VAL 56 5.952 -0.212 -1.358 346 HA VAL 56 HA VAL 56 4.448 -0.019 -3.822 347 HB VAL 56 HB VAL 56 3.678 0.347 -0.876 348 1HG1 VAL 56 3HG1 VAL 56 1.826 0.235 -3.350 349 2HG1 VAL 56 2HG1 VAL 56 1.306 0.214 -1.638 350 3HG1 VAL 56 1HG1 VAL 56 2.081 1.678 -2.307 351 1HG2 VAL 56 3HG2 VAL 56 3.391 -2.004 -2.843 352 2HG2 VAL 56 2HG2 VAL 56 4.409 -1.959 -1.355 353 3HG2 VAL 56 1HG2 VAL 56 2.626 -1.914 -1.220 354 H TYR 57 HN TYR 57 3.999 1.880 -4.783 355 HA TYR 57 HA TYR 57 4.379 4.363 -3.229 356 1HB TYR 57 2HB TYR 57 4.494 3.810 -6.283 357 2HB TYR 57 1HB TYR 57 4.175 5.453 -5.607 358 HD1 TYR 57 HD1 TYR 57 6.717 2.629 -5.161 359 HD2 TYR 57 HD2 TYR 57 5.953 6.861 -5.359 360 HE1 TYR 57 HE1 TYR 57 9.111 3.071 -4.903 361 HE2 TYR 57 HE2 TYR 57 8.361 7.311 -5.126 362 HH TYR 57 HH TYR 57 10.734 4.625 -4.759 363 H CYS 58 HN CYS 58 2.543 5.677 -3.081 364 HA CYS 58 HA CYS 58 0.147 4.324 -3.314 365 1HB CYS 58 2HB CYS 58 -0.194 6.226 -1.485 366 2HB CYS 58 1HB CYS 58 1.263 5.745 -1.869 367 H LYS 59 HN LYS 59 -1.300 6.774 -3.787 368 HA LYS 59 HA LYS 59 -1.593 6.590 -6.677 369 1HB LYS 59 2HB LYS 59 -3.559 6.792 -5.123 370 2HB LYS 59 1HB LYS 59 -3.067 8.477 -4.755 371 1HG LYS 59 2HG LYS 59 -3.404 9.082 -7.168 372 2HG LYS 59 1HG LYS 59 -3.790 7.361 -7.530 373 1HD LYS 59 2HD LYS 59 -5.712 7.484 -5.927 374 2HD LYS 59 1HD LYS 59 -5.381 9.236 -5.685 375 1HE LYS 59 2HE LYS 59 -5.825 9.650 -8.139 376 2HE LYS 59 1HE LYS 59 -6.130 7.879 -8.376 377 1HZ LYS 59 2HZ LYS 59 -7.952 8.040 -6.819 378 2HZ LYS 59 1HZ LYS 59 -7.670 9.700 -6.599 379 3HZ LYS 59 3HZ LYS 59 -8.156 9.115 -8.118 380 H SER 60 HN SER 60 -0.777 9.122 -4.264 381 HA SER 60 HA SER 60 -0.437 11.180 -6.084 382 1HB SER 60 2HB SER 60 -1.012 11.430 -3.637 383 2HB SER 60 1HB SER 60 0.667 10.962 -3.203 384 HG SER 60 HG SER 60 0.344 13.197 -3.282 385 H CYS 61 HN CYS 61 2.193 9.422 -4.118 386 HA CYS 61 HA CYS 61 4.175 10.863 -5.394 387 1HB CYS 61 2HB CYS 61 4.442 8.186 -3.941 388 2HB CYS 61 1HB CYS 61 5.705 9.439 -4.112 389 H TYR 62 HN TYR 62 2.449 8.009 -6.511 390 HA TYR 62 HA TYR 62 4.661 6.990 -8.005 391 1HB TYR 62 2HB TYR 62 2.701 5.516 -7.330 392 2HB TYR 62 1HB TYR 62 1.631 6.457 -8.430 393 HD1 TYR 62 HD1 TYR 62 5.035 4.775 -8.474 394 HD2 TYR 62 HD2 TYR 62 1.360 5.517 -10.588 395 HE1 TYR 62 HE1 TYR 62 5.906 3.554 -10.388 396 HE2 TYR 62 HE2 TYR 62 2.185 4.173 -12.488 397 HH TYR 62 HH TYR 62 5.484 2.720 -12.454 398 H GLY 63 HN GLY 63 1.719 8.992 -8.673 399 1HA GLY 63 2HA GLY 63 2.345 9.201 -11.433 400 2HA GLY 63 1HA GLY 63 1.058 10.024 -10.482 401 H LYS 64 HN LYS 64 3.600 10.929 -8.696 402 HA LYS 64 HA LYS 64 3.950 13.385 -10.294 403 1HB LYS 64 2HB LYS 64 3.723 12.822 -7.328 404 2HB LYS 64 1HB LYS 64 4.662 14.253 -7.863 405 1HG LYS 64 2HG LYS 64 2.258 14.734 -7.298 406 2HG LYS 64 1HG LYS 64 2.861 15.328 -8.884 407 1HD LYS 64 2HD LYS 64 1.737 13.542 -10.099 408 2HD LYS 64 1HD LYS 64 1.198 12.778 -8.569 409 1HE LYS 64 2HE LYS 64 -0.207 14.809 -8.029 410 2HE LYS 64 1HE LYS 64 0.327 15.577 -9.582 411 1HZ LYS 64 1HZ LYS 64 -1.159 13.013 -9.309 412 2HZ LYS 64 3HZ LYS 64 -1.803 14.512 -9.781 413 3HZ LYS 64 2HZ LYS 64 -0.659 13.731 -10.765 414 H LYS 65 HN LYS 65 5.681 10.796 -8.532 415 HA LYS 65 HA LYS 65 8.212 12.066 -8.841 416 1HB LYS 65 2HB LYS 65 7.787 10.328 -7.075 417 2HB LYS 65 1HB LYS 65 7.496 9.107 -8.355 418 1HG LYS 65 2HG LYS 65 9.678 8.785 -7.400 419 2HG LYS 65 1HG LYS 65 9.884 9.330 -9.096 420 1HD LYS 65 2HD LYS 65 10.413 11.635 -8.285 421 2HD LYS 65 1HD LYS 65 10.150 11.092 -6.587 422 1HE LYS 65 2HE LYS 65 12.066 9.469 -6.810 423 2HE LYS 65 1HE LYS 65 12.323 10.012 -8.519 424 1HZ LYS 65 3HZ LYS 65 12.755 12.226 -7.691 425 2HZ LYS 65 1HZ LYS 65 12.514 11.717 -6.089 426 3HZ LYS 65 2HZ LYS 65 13.809 11.092 -6.993 427 H TYR 66 HN TYR 66 6.317 9.514 -10.542 428 HA TYR 66 HA TYR 66 8.392 9.382 -12.590 429 1HB TYR 66 2HB TYR 66 6.044 7.461 -12.064 430 2HB TYR 66 1HB TYR 66 7.375 7.224 -13.266 431 HD1 TYR 66 HD2 TYR 66 9.861 7.728 -12.061 432 HD2 TYR 66 HD1 TYR 66 6.343 6.170 -10.146 433 HE1 TYR 66 HE2 TYR 66 11.254 6.798 -10.264 434 HE2 TYR 66 HE1 TYR 66 7.723 5.263 -8.323 435 HH TYR 66 HH TYR 66 11.301 5.681 -8.312 436 H GLY 67 HN GLY 67 5.071 10.760 -12.124 437 1HA GLY 67 1HA GLY 67 4.238 12.149 -13.647 438 2HA GLY 67 2HA GLY 67 5.259 11.457 -14.951 No H/Q in entry = 438
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