NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
9805 | 1opz | 5769 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H MET 1 H1 MET 1 7.234 -1.888 -24.447 2 2H MET 1 H2 MET 1 8.467 -2.380 -25.415 3 3H MET 1 H3 MET 1 8.802 -1.679 -23.959 4 HA MET 1 HA MET 1 9.203 -0.233 -25.828 5 1HB MET 1 HB2 MET 1 6.986 -1.274 -26.957 6 2HB MET 1 HB3 MET 1 6.220 0.088 -26.139 7 1HG MET 1 HG2 MET 1 6.769 1.117 -28.138 8 2HG MET 1 HG3 MET 1 8.252 1.447 -27.253 9 1HE MET 1 HE1 MET 1 6.573 -0.147 -30.270 10 2HE MET 1 HE2 MET 1 7.642 -1.488 -30.740 11 3HE MET 1 HE3 MET 1 6.661 -1.611 -29.260 12 H LEU 2 H LEU 2 6.865 -0.385 -23.118 13 HA LEU 2 HA LEU 2 7.018 2.527 -22.663 14 1HB LEU 2 HB2 LEU 2 4.703 0.824 -23.546 15 2HB LEU 2 HB3 LEU 2 4.417 1.699 -22.057 16 HG LEU 2 HG LEU 2 5.166 3.828 -23.285 17 1HD1 LEU 2 HD11 LEU 2 4.542 2.050 -25.697 18 2HD1 LEU 2 HD12 LEU 2 4.764 3.809 -25.728 19 3HD1 LEU 2 HD13 LEU 2 6.128 2.762 -25.325 20 1HD2 LEU 2 HD21 LEU 2 2.860 3.338 -22.598 21 2HD2 LEU 2 HD22 LEU 2 2.873 4.105 -24.193 22 3HD2 LEU 2 HD23 LEU 2 2.610 2.353 -24.053 23 H SER 3 H SER 3 6.261 2.997 -20.499 24 HA SER 3 HA SER 3 5.687 0.828 -18.629 25 1HB SER 3 HB2 SER 3 7.299 2.409 -17.045 26 2HB SER 3 HB3 SER 3 7.769 0.856 -17.732 27 HG SER 3 HG SER 3 8.246 3.413 -18.864 28 H GLU 4 H GLU 4 3.655 1.536 -18.168 29 HA GLU 4 HA GLU 4 3.196 4.441 -17.755 30 1HB GLU 4 HB2 GLU 4 0.897 4.092 -18.548 31 2HB GLU 4 HB3 GLU 4 2.120 3.942 -19.809 32 1HG GLU 4 HG2 GLU 4 1.930 1.453 -19.689 33 2HG GLU 4 HG3 GLU 4 0.647 1.634 -18.475 34 H GLN 5 H GLN 5 2.599 4.853 -15.782 35 HA GLN 5 HA GLN 5 2.468 2.638 -13.911 36 1HB GLN 5 HB2 GLN 5 2.520 4.383 -12.210 37 2HB GLN 5 HB3 GLN 5 3.841 4.513 -13.395 38 1HG GLN 5 HG2 GLN 5 2.653 6.405 -14.501 39 2HG GLN 5 HG3 GLN 5 1.293 6.211 -13.381 40 1HE2 GLN 5 HE21 GLN 5 4.048 5.525 -11.620 41 2HE2 GLN 5 HE22 GLN 5 4.197 7.056 -10.838 42 H LYS 6 H LYS 6 0.910 2.568 -12.118 43 HA LYS 6 HA LYS 6 -1.817 3.421 -12.886 44 1HB LYS 6 HB2 LYS 6 -0.712 0.701 -13.140 45 2HB LYS 6 HB3 LYS 6 -2.122 0.726 -12.099 46 1HG LYS 6 HG2 LYS 6 -2.208 2.148 -14.765 47 2HG LYS 6 HG3 LYS 6 -2.414 0.394 -14.684 48 1HD LYS 6 HD2 LYS 6 -4.281 0.554 -13.168 49 2HD LYS 6 HD3 LYS 6 -4.054 2.296 -12.955 50 1HE LYS 6 HE2 LYS 6 -4.629 2.713 -15.311 51 2HE LYS 6 HE3 LYS 6 -4.823 0.975 -15.594 52 1HZ LYS 6 HZ1 LYS 6 -6.923 2.071 -15.199 53 2HZ LYS 6 HZ2 LYS 6 -6.626 0.986 -14.000 54 3HZ LYS 6 HZ3 LYS 6 -6.441 2.596 -13.716 55 H GLU 7 H GLU 7 -3.261 3.286 -11.339 56 HA GLU 7 HA GLU 7 -2.454 3.485 -8.514 57 1HB GLU 7 HB2 GLU 7 -5.024 3.984 -8.414 58 2HB GLU 7 HB3 GLU 7 -3.944 5.226 -9.038 59 1HG GLU 7 HG2 GLU 7 -4.542 4.788 -11.325 60 2HG GLU 7 HG3 GLU 7 -5.412 3.295 -10.869 61 H ILE 8 H ILE 8 -2.815 1.790 -7.158 62 HA ILE 8 HA ILE 8 -4.906 -0.183 -7.913 63 HB ILE 8 HB ILE 8 -2.326 -0.932 -7.543 64 1HG1 ILE 8 HG12 ILE 8 -3.227 -3.158 -6.674 65 2HG1 ILE 8 HG13 ILE 8 -4.834 -2.416 -6.719 66 1HG2 ILE 8 HG21 ILE 8 -2.195 0.006 -5.277 67 2HG2 ILE 8 HG22 ILE 8 -3.475 -1.103 -4.731 68 3HG2 ILE 8 HG23 ILE 8 -1.927 -1.745 -5.284 69 1HD1 ILE 8 HD11 ILE 8 -4.496 -1.957 -9.172 70 2HD1 ILE 8 HD12 ILE 8 -2.872 -2.660 -9.060 71 3HD1 ILE 8 HD13 ILE 8 -4.300 -3.681 -8.798 72 H ALA 9 H ALA 9 -6.345 -0.619 -6.217 73 HA ALA 9 HA ALA 9 -6.211 1.041 -3.781 74 1HB ALA 9 HB1 ALA 9 -8.586 1.643 -4.016 75 2HB ALA 9 HB2 ALA 9 -7.623 2.330 -5.338 76 3HB ALA 9 HB3 ALA 9 -8.628 0.893 -5.628 77 H MET 10 H MET 10 -6.571 -0.284 -2.043 78 HA MET 10 HA MET 10 -8.107 -2.772 -2.363 79 1HB MET 10 HB2 MET 10 -6.151 -4.221 -1.901 80 2HB MET 10 HB3 MET 10 -5.924 -3.302 -3.394 81 1HG MET 10 HG2 MET 10 -4.730 -1.533 -1.836 82 2HG MET 10 HG3 MET 10 -4.704 -2.888 -0.702 83 1HE MET 10 HE1 MET 10 -2.404 -0.906 -2.114 84 2HE MET 10 HE2 MET 10 -2.004 -1.997 -0.776 85 3HE MET 10 HE3 MET 10 -1.059 -2.047 -2.280 86 H GLN 11 H GLN 11 -7.703 -4.116 -0.130 87 HA GLN 11 HA GLN 11 -8.343 -2.051 1.909 88 1HB GLN 11 HB2 GLN 11 -9.360 -4.839 2.258 89 2HB GLN 11 HB3 GLN 11 -9.934 -3.302 2.838 90 1HG GLN 11 HG2 GLN 11 -11.560 -3.811 1.343 91 2HG GLN 11 HG3 GLN 11 -10.528 -2.836 0.302 92 1HE2 GLN 11 HE21 GLN 11 -9.079 -4.108 -1.191 93 2HE2 GLN 11 HE22 GLN 11 -9.599 -5.625 -1.810 94 H VAL 12 H VAL 12 -7.576 -2.467 4.064 95 HA VAL 12 HA VAL 12 -5.271 -4.361 4.157 96 HB VAL 12 HB VAL 12 -5.173 -1.930 5.886 97 1HG1 VAL 12 HG11 VAL 12 -3.103 -3.472 4.278 98 2HG1 VAL 12 HG12 VAL 12 -2.771 -2.168 5.426 99 3HG1 VAL 12 HG13 VAL 12 -3.442 -3.699 6.015 100 1HG2 VAL 12 HG21 VAL 12 -4.485 -1.912 2.916 101 2HG2 VAL 12 HG22 VAL 12 -5.674 -0.849 3.719 102 3HG2 VAL 12 HG23 VAL 12 -3.954 -0.675 4.086 103 H SER 13 H SER 13 -4.851 -5.285 6.212 104 HA SER 13 HA SER 13 -7.220 -5.347 8.042 105 1HB SER 13 HB2 SER 13 -6.417 -7.413 6.622 106 2HB SER 13 HB3 SER 13 -5.032 -7.365 7.712 107 HG SER 13 HG SER 13 -6.685 -8.779 8.427 108 H GLY 14 H GLY 14 -6.746 -4.922 10.220 109 1HA GLY 14 HA2 GLY 14 -5.428 -5.032 12.125 110 2HA GLY 14 HA3 GLY 14 -3.952 -5.065 11.170 111 H MET 15 H MET 15 -5.230 -2.535 9.708 112 HA MET 15 HA MET 15 -3.909 -0.494 11.071 113 1HB MET 15 HB2 MET 15 -5.193 1.097 9.810 114 2HB MET 15 HB3 MET 15 -4.733 -0.257 8.773 115 1HG MET 15 HG2 MET 15 -7.525 0.084 9.959 116 2HG MET 15 HG3 MET 15 -7.042 0.667 8.393 117 1HE MET 15 HE1 MET 15 -9.279 -2.229 7.311 118 2HE MET 15 HE2 MET 15 -8.879 -0.497 7.167 119 3HE MET 15 HE3 MET 15 -9.549 -1.139 8.693 120 H THR 16 H THR 16 -4.218 0.464 13.048 121 HA THR 16 HA THR 16 -6.985 0.541 14.199 122 HB THR 16 HB THR 16 -5.707 0.846 16.357 123 HG1 THR 16 HG1 THR 16 -3.696 1.401 15.330 124 1HG2 THR 16 HG21 THR 16 -5.202 -1.749 14.836 125 2HG2 THR 16 HG22 THR 16 -5.184 -1.542 16.594 126 3HG2 THR 16 HG23 THR 16 -6.699 -1.334 15.692 127 H CYS 17 H CYS 17 -6.534 2.257 12.198 128 HA CYS 17 HA CYS 17 -6.512 4.412 11.579 129 1HB CYS 17 HB2 CYS 17 -8.528 4.227 13.033 130 2HB CYS 17 HB3 CYS 17 -7.607 4.996 14.353 131 HG CYS 17 HG CYS 17 -9.147 6.776 13.256 132 H ALA 18 H ALA 18 -6.010 6.602 13.939 133 HA ALA 18 HA ALA 18 -4.191 7.987 14.170 134 1HB ALA 18 HB1 ALA 18 -3.449 5.474 15.707 135 2HB ALA 18 HB2 ALA 18 -2.860 7.120 16.039 136 3HB ALA 18 HB3 ALA 18 -4.581 6.739 16.233 137 H ALA 19 H ALA 19 -3.708 7.449 11.713 138 HA ALA 19 HA ALA 19 -2.169 7.359 10.081 139 1HB ALA 19 HB1 ALA 19 0.041 8.256 10.579 140 2HB ALA 19 HB2 ALA 19 -1.186 9.129 11.511 141 3HB ALA 19 HB3 ALA 19 -0.165 7.911 12.305 142 H CYS 20 H CYS 20 -2.673 4.741 11.604 143 HA CYS 20 HA CYS 20 -0.195 3.263 11.581 144 1HB CYS 20 HB2 CYS 20 -3.109 2.350 11.628 145 2HB CYS 20 HB3 CYS 20 -1.721 1.250 11.684 146 HG CYS 20 HG CYS 20 -2.326 3.771 13.716 147 H ALA 21 H ALA 21 -3.078 3.029 9.436 148 HA ALA 21 HA ALA 21 -1.782 1.570 7.388 149 1HB ALA 21 HB1 ALA 21 -3.667 2.410 5.955 150 2HB ALA 21 HB2 ALA 21 -4.173 1.664 7.481 151 3HB ALA 21 HB3 ALA 21 -4.159 3.436 7.332 152 H ALA 22 H ALA 22 -1.908 5.044 8.023 153 HA ALA 22 HA ALA 22 -0.714 5.901 5.579 154 1HB ALA 22 HB1 ALA 22 -0.483 7.079 8.386 155 2HB ALA 22 HB2 ALA 22 -0.072 7.912 6.872 156 3HB ALA 22 HB3 ALA 22 -1.755 7.446 7.210 157 H ARG 23 H ARG 23 0.801 4.900 8.734 158 HA ARG 23 HA ARG 23 3.507 5.082 7.855 159 1HB ARG 23 HB2 ARG 23 2.195 3.240 9.891 160 2HB ARG 23 HB3 ARG 23 3.919 3.294 9.599 161 1HG ARG 23 HG2 ARG 23 2.616 5.946 10.096 162 2HG ARG 23 HG3 ARG 23 2.616 4.812 11.455 163 1HD ARG 23 HD2 ARG 23 5.009 4.541 11.350 164 2HD ARG 23 HD3 ARG 23 5.115 5.536 9.872 165 HE ARG 23 HE ARG 23 3.844 7.125 11.787 166 1HH1 ARG 23 HH22 ARG 23 6.957 5.502 11.516 167 2HH1 ARG 23 HH21 ARG 23 7.852 6.687 12.416 168 1HH2 ARG 23 HH12 ARG 23 4.999 8.761 12.956 169 2HH2 ARG 23 HH11 ARG 23 6.699 8.597 13.245 170 H ILE 24 H ILE 24 1.212 2.306 7.705 171 HA ILE 24 HA ILE 24 2.895 0.409 6.541 172 HB ILE 24 HB ILE 24 -0.033 0.905 5.826 173 1HG1 ILE 24 HG12 ILE 24 1.192 -1.027 7.808 174 2HG1 ILE 24 HG13 ILE 24 0.365 0.459 8.253 175 1HG2 ILE 24 HG21 ILE 24 1.020 -0.463 4.124 176 2HG2 ILE 24 HG22 ILE 24 1.687 -1.551 5.370 177 3HG2 ILE 24 HG23 ILE 24 -0.064 -1.441 5.087 178 1HD1 ILE 24 HD11 ILE 24 -0.844 -2.051 7.120 179 2HD1 ILE 24 HD12 ILE 24 -1.366 -1.055 8.493 180 3HD1 ILE 24 HD13 ILE 24 -1.652 -0.512 6.837 181 H GLU 25 H GLU 25 0.756 2.683 4.737 182 HA GLU 25 HA GLU 25 1.880 1.807 2.308 183 1HB GLU 25 HB2 GLU 25 -0.390 3.208 2.998 184 2HB GLU 25 HB3 GLU 25 0.580 4.493 2.300 185 1HG GLU 25 HG2 GLU 25 -0.640 3.533 0.449 186 2HG GLU 25 HG3 GLU 25 1.022 2.979 0.278 187 H LYS 26 H LYS 26 2.658 4.621 4.404 188 HA LYS 26 HA LYS 26 4.384 5.948 2.597 189 1HB LYS 26 HB2 LYS 26 4.155 5.764 5.609 190 2HB LYS 26 HB3 LYS 26 5.523 6.571 4.897 191 1HG LYS 26 HG2 LYS 26 2.675 7.303 4.123 192 2HG LYS 26 HG3 LYS 26 3.519 8.021 5.504 193 1HD LYS 26 HD2 LYS 26 5.392 8.737 3.940 194 2HD LYS 26 HD3 LYS 26 4.468 8.096 2.588 195 1HE LYS 26 HE2 LYS 26 4.107 10.458 2.616 196 2HE LYS 26 HE3 LYS 26 2.597 9.681 3.112 197 1HZ LYS 26 HZ1 LYS 26 3.104 11.547 4.498 198 2HZ LYS 26 HZ2 LYS 26 3.224 10.187 5.409 199 3HZ LYS 26 HZ3 LYS 26 4.585 10.955 4.889 200 H GLY 27 H GLY 27 4.862 3.107 4.674 201 1HA GLY 27 HA2 GLY 27 7.613 2.604 4.190 202 2HA GLY 27 HA3 GLY 27 6.344 1.381 4.374 203 H LEU 28 H LEU 28 4.684 1.766 2.178 204 HA LEU 28 HA LEU 28 6.292 0.657 0.062 205 1HB LEU 28 HB2 LEU 28 3.443 1.659 0.056 206 2HB LEU 28 HB3 LEU 28 4.227 0.835 -1.291 207 HG LEU 28 HG LEU 28 3.949 -0.390 1.471 208 1HD1 LEU 28 HD11 LEU 28 1.799 -0.177 0.675 209 2HD1 LEU 28 HD12 LEU 28 2.229 -0.427 -1.018 210 3HD1 LEU 28 HD13 LEU 28 2.259 -1.795 0.109 211 1HD2 LEU 28 HD21 LEU 28 5.131 -1.434 -1.130 212 2HD2 LEU 28 HD22 LEU 28 5.803 -1.456 0.497 213 3HD2 LEU 28 HD23 LEU 28 4.456 -2.515 0.109 214 H LYS 29 H LYS 29 5.192 3.972 0.706 215 HA LYS 29 HA LYS 29 5.979 5.000 -1.822 216 1HB LYS 29 HB2 LYS 29 4.659 6.367 -0.587 217 2HB LYS 29 HB3 LYS 29 5.687 6.396 0.828 218 1HG LYS 29 HG2 LYS 29 7.437 7.643 -0.374 219 2HG LYS 29 HG3 LYS 29 6.536 7.492 -1.886 220 1HD LYS 29 HD2 LYS 29 5.815 9.176 0.548 221 2HD LYS 29 HD3 LYS 29 6.322 9.707 -1.068 222 1HE LYS 29 HE2 LYS 29 4.230 8.305 -1.853 223 2HE LYS 29 HE3 LYS 29 3.672 8.510 -0.200 224 1HZ LYS 29 HZ1 LYS 29 4.094 11.027 -0.713 225 2HZ LYS 29 HZ2 LYS 29 4.002 10.560 -2.298 226 3HZ LYS 29 HZ3 LYS 29 2.772 10.277 -1.377 227 H ARG 30 H ARG 30 8.010 3.623 0.644 228 HA ARG 30 HA ARG 30 10.435 4.870 -0.479 229 1HB ARG 30 HB2 ARG 30 9.800 3.239 1.882 230 2HB ARG 30 HB3 ARG 30 11.191 2.615 1.014 231 1HG ARG 30 HG2 ARG 30 11.947 4.208 2.650 232 2HG ARG 30 HG3 ARG 30 12.180 4.911 1.044 233 1HD ARG 30 HD2 ARG 30 9.871 6.051 1.396 234 2HD ARG 30 HD3 ARG 30 9.963 5.551 3.065 235 HE ARG 30 HE ARG 30 11.651 7.491 1.543 236 1HH1 ARG 30 HH22 ARG 30 11.088 5.998 4.695 237 2HH1 ARG 30 HH21 ARG 30 11.871 7.253 5.604 238 1HH2 ARG 30 HH12 ARG 30 12.748 9.125 2.702 239 2HH2 ARG 30 HH11 ARG 30 12.874 9.059 4.428 240 H MET 31 H MET 31 8.413 2.274 -1.607 241 HA MET 31 HA MET 31 10.627 0.631 -2.417 242 1HB MET 31 HB2 MET 31 7.667 0.555 -3.117 243 2HB MET 31 HB3 MET 31 8.831 -0.636 -3.697 244 1HG MET 31 HG2 MET 31 8.276 -0.017 -0.782 245 2HG MET 31 HG3 MET 31 7.667 -1.421 -1.658 246 1HE MET 31 HE1 MET 31 10.135 -2.549 -3.278 247 2HE MET 31 HE2 MET 31 9.096 -3.545 -2.228 248 3HE MET 31 HE3 MET 31 10.867 -3.615 -2.063 249 HA PRO 32 HA PRO 32 11.727 2.736 -6.142 250 1HB PRO 32 HB2 PRO 32 13.087 0.782 -7.506 251 2HB PRO 32 HB3 PRO 32 13.724 1.617 -6.061 252 1HG PRO 32 HG2 PRO 32 12.314 -1.059 -6.171 253 2HG PRO 32 HG3 PRO 32 13.851 -0.666 -5.345 254 1HD PRO 32 HD2 PRO 32 11.506 -0.731 -4.001 255 2HD PRO 32 HD3 PRO 32 12.708 0.543 -3.633 256 H GLY 33 H GLY 33 9.737 3.177 -7.082 257 1HA GLY 33 HA2 GLY 33 9.111 2.961 -9.497 258 2HA GLY 33 HA3 GLY 33 8.678 1.296 -9.150 259 H VAL 34 H VAL 34 7.984 2.704 -6.257 260 HA VAL 34 HA VAL 34 5.206 3.337 -6.780 261 HB VAL 34 HB VAL 34 6.325 2.547 -4.612 262 1HG1 VAL 34 HG11 VAL 34 8.062 4.565 -4.848 263 2HG1 VAL 34 HG12 VAL 34 6.800 5.478 -4.020 264 3HG1 VAL 34 HG13 VAL 34 7.502 4.013 -3.285 265 1HG2 VAL 34 HG21 VAL 34 4.695 3.646 -3.217 266 2HG2 VAL 34 HG22 VAL 34 4.482 4.964 -4.386 267 3HG2 VAL 34 HG23 VAL 34 3.968 3.314 -4.791 268 H THR 35 H THR 35 4.244 5.419 -6.723 269 HA THR 35 HA THR 35 6.119 7.747 -7.004 270 HB THR 35 HB THR 35 3.532 8.403 -8.078 271 HG1 THR 35 HG1 THR 35 4.697 6.007 -9.013 272 1HG2 THR 35 HG21 THR 35 5.689 9.485 -8.643 273 2HG2 THR 35 HG22 THR 35 6.220 7.999 -9.462 274 3HG2 THR 35 HG23 THR 35 4.832 8.923 -10.084 275 H ASP 36 H ASP 36 2.734 6.815 -6.045 276 HA ASP 36 HA ASP 36 3.207 8.315 -3.633 277 1HB ASP 36 HB2 ASP 36 2.234 9.902 -5.604 278 2HB ASP 36 HB3 ASP 36 0.709 9.327 -4.895 279 H ALA 37 H ALA 37 1.445 8.350 -2.078 280 HA ALA 37 HA ALA 37 -0.100 5.795 -2.072 281 1HB ALA 37 HB1 ALA 37 1.894 6.746 0.032 282 2HB ALA 37 HB2 ALA 37 0.742 5.420 0.233 283 3HB ALA 37 HB3 ALA 37 2.031 5.287 -0.980 284 H ASN 38 H ASN 38 -2.130 6.114 -1.218 285 HA ASN 38 HA ASN 38 -2.751 8.598 0.306 286 1HB ASN 38 HB2 ASN 38 -3.687 7.819 -2.452 287 2HB ASN 38 HB3 ASN 38 -4.882 8.462 -1.327 288 1HD2 ASN 38 HD21 ASN 38 -1.586 9.286 -2.635 289 2HD2 ASN 38 HD22 ASN 38 -1.892 11.003 -2.579 290 H VAL 39 H VAL 39 -3.562 7.824 2.143 291 HA VAL 39 HA VAL 39 -4.846 5.201 2.250 292 HB VAL 39 HB VAL 39 -3.118 6.056 3.864 293 1HG1 VAL 39 HG11 VAL 39 -5.423 7.626 5.091 294 2HG1 VAL 39 HG12 VAL 39 -3.764 7.480 5.692 295 3HG1 VAL 39 HG13 VAL 39 -4.078 8.359 4.189 296 1HG2 VAL 39 HG21 VAL 39 -4.346 4.082 4.371 297 2HG2 VAL 39 HG22 VAL 39 -4.282 5.085 5.838 298 3HG2 VAL 39 HG23 VAL 39 -5.773 5.006 4.872 299 H ASN 40 H ASN 40 -6.969 4.750 2.678 300 HA ASN 40 HA ASN 40 -8.890 6.975 2.967 301 1HB ASN 40 HB2 ASN 40 -8.722 6.133 0.589 302 2HB ASN 40 HB3 ASN 40 -9.315 4.567 1.146 303 1HD2 ASN 40 HD21 ASN 40 -11.027 5.435 -0.604 304 2HD2 ASN 40 HD22 ASN 40 -12.428 6.155 0.175 305 H LEU 41 H LEU 41 -8.415 6.140 5.253 306 HA LEU 41 HA LEU 41 -9.579 3.595 5.977 307 1HB LEU 41 HB2 LEU 41 -8.932 6.000 7.729 308 2HB LEU 41 HB3 LEU 41 -9.380 4.378 8.280 309 HG LEU 41 HG LEU 41 -6.898 5.204 6.750 310 1HD1 LEU 41 HD11 LEU 41 -7.509 4.766 9.551 311 2HD1 LEU 41 HD12 LEU 41 -6.255 3.629 9.035 312 3HD1 LEU 41 HD13 LEU 41 -6.022 5.373 8.807 313 1HD2 LEU 41 HD21 LEU 41 -6.272 2.700 6.957 314 2HD2 LEU 41 HD22 LEU 41 -7.985 2.418 7.296 315 3HD2 LEU 41 HD23 LEU 41 -7.461 3.098 5.737 316 H ALA 42 H ALA 42 -11.046 6.566 5.203 317 HA ALA 42 HA ALA 42 -13.525 6.208 6.650 318 1HB ALA 42 HB1 ALA 42 -13.036 7.523 3.944 319 2HB ALA 42 HB2 ALA 42 -14.468 7.703 4.973 320 3HB ALA 42 HB3 ALA 42 -12.904 8.338 5.521 321 H THR 43 H THR 43 -11.957 4.484 4.048 322 HA THR 43 HA THR 43 -14.373 2.772 3.784 323 HB THR 43 HB THR 43 -12.387 3.352 1.554 324 HG1 THR 43 HG1 THR 43 -14.640 4.818 2.369 325 1HG2 THR 43 HG21 THR 43 -15.288 2.417 1.584 326 2HG2 THR 43 HG22 THR 43 -14.332 2.766 0.126 327 3HG2 THR 43 HG23 THR 43 -13.875 1.416 1.175 328 H GLU 44 H GLU 44 -11.802 2.696 5.584 329 HA GLU 44 HA GLU 44 -10.105 1.302 6.097 330 1HB GLU 44 HB2 GLU 44 -12.298 -0.651 5.287 331 2HB GLU 44 HB3 GLU 44 -10.912 -1.054 6.284 332 1HG GLU 44 HG2 GLU 44 -11.597 0.736 7.923 333 2HG GLU 44 HG3 GLU 44 -13.067 1.000 6.968 334 H THR 45 H THR 45 -9.604 2.314 3.540 335 HA THR 45 HA THR 45 -8.451 0.037 2.025 336 HB THR 45 HB THR 45 -10.405 2.196 1.138 337 HG1 THR 45 HG1 THR 45 -11.282 0.228 1.817 338 1HG2 THR 45 HG21 THR 45 -8.666 2.180 -0.621 339 2HG2 THR 45 HG22 THR 45 -8.861 0.417 -0.776 340 3HG2 THR 45 HG23 THR 45 -10.197 1.493 -1.171 341 H VAL 46 H VAL 46 -6.743 0.661 0.631 342 HA VAL 46 HA VAL 46 -5.800 3.459 0.919 343 HB VAL 46 HB VAL 46 -4.645 2.146 2.558 344 1HG1 VAL 46 HG11 VAL 46 -3.131 0.282 1.963 345 2HG1 VAL 46 HG12 VAL 46 -4.767 -0.124 1.412 346 3HG1 VAL 46 HG13 VAL 46 -3.552 0.431 0.253 347 1HG2 VAL 46 HG21 VAL 46 -2.732 2.660 0.256 348 2HG2 VAL 46 HG22 VAL 46 -3.426 3.963 1.221 349 3HG2 VAL 46 HG23 VAL 46 -2.414 2.754 2.013 350 H ASN 47 H ASN 47 -4.726 4.257 -0.845 351 HA ASN 47 HA ASN 47 -4.843 2.617 -3.307 352 1HB ASN 47 HB2 ASN 47 -6.545 4.392 -3.339 353 2HB ASN 47 HB3 ASN 47 -5.316 5.604 -2.946 354 1HD2 ASN 47 HD21 ASN 47 -3.616 6.071 -4.591 355 2HD2 ASN 47 HD22 ASN 47 -3.992 5.724 -6.273 356 H VAL 48 H VAL 48 -2.926 2.570 -4.491 357 HA VAL 48 HA VAL 48 -0.856 4.548 -3.844 358 HB VAL 48 HB VAL 48 -0.381 2.810 -2.228 359 1HG1 VAL 48 HG11 VAL 48 -1.399 0.870 -3.297 360 2HG1 VAL 48 HG12 VAL 48 -0.155 0.895 -4.573 361 3HG1 VAL 48 HG13 VAL 48 0.288 0.539 -2.892 362 1HG2 VAL 48 HG21 VAL 48 1.948 2.260 -2.862 363 2HG2 VAL 48 HG22 VAL 48 1.631 2.830 -4.511 364 3HG2 VAL 48 HG23 VAL 48 1.549 3.956 -3.137 365 H ILE 49 H ILE 49 0.415 5.049 -5.508 366 HA ILE 49 HA ILE 49 -0.332 3.944 -8.156 367 HB ILE 49 HB ILE 49 0.881 6.619 -7.408 368 1HG1 ILE 49 HG12 ILE 49 -1.862 6.193 -8.636 369 2HG1 ILE 49 HG13 ILE 49 -1.665 6.166 -6.881 370 1HG2 ILE 49 HG21 ILE 49 -0.120 5.585 -10.110 371 2HG2 ILE 49 HG22 ILE 49 0.575 7.188 -9.799 372 3HG2 ILE 49 HG23 ILE 49 1.585 5.757 -9.675 373 1HD1 ILE 49 HD11 ILE 49 -0.840 8.489 -8.658 374 2HD1 ILE 49 HD12 ILE 49 -2.296 8.397 -7.643 375 3HD1 ILE 49 HD13 ILE 49 -0.687 8.400 -6.889 376 H TYR 50 H TYR 50 1.222 2.857 -9.260 377 HA TYR 50 HA TYR 50 4.052 3.380 -8.745 378 1HB TYR 50 HB2 TYR 50 4.450 0.914 -8.404 379 2HB TYR 50 HB3 TYR 50 3.799 1.736 -7.022 380 HD1 TYR 50 HD1 TYR 50 1.798 0.858 -6.016 381 HD2 TYR 50 HD2 TYR 50 2.851 -0.393 -10.006 382 HE1 TYR 50 HE1 TYR 50 0.201 -1.021 -5.864 383 HE2 TYR 50 HE2 TYR 50 1.167 -2.186 -9.891 384 HH TYR 50 HH TYR 50 -0.743 -2.823 -6.951 385 H ASP 51 H ASP 51 5.456 1.996 -10.151 386 HA ASP 51 HA ASP 51 4.205 1.799 -12.802 387 1HB ASP 51 HB2 ASP 51 6.112 3.270 -12.423 388 2HB ASP 51 HB3 ASP 51 7.119 1.893 -12.016 389 HA PRO 52 HA PRO 52 4.348 -2.692 -12.018 390 1HB PRO 52 HB2 PRO 52 3.245 -3.588 -14.303 391 2HB PRO 52 HB3 PRO 52 2.320 -2.733 -13.037 392 1HG PRO 52 HG2 PRO 52 3.516 -1.545 -15.555 393 2HG PRO 52 HG3 PRO 52 1.836 -1.376 -14.962 394 1HD PRO 52 HD2 PRO 52 3.735 0.495 -14.497 395 2HD PRO 52 HD3 PRO 52 2.513 0.112 -13.240 396 H ALA 53 H ALA 53 6.610 -0.990 -13.690 397 HA ALA 53 HA ALA 53 7.802 -3.316 -15.127 398 1HB ALA 53 HB1 ALA 53 8.011 -1.041 -16.086 399 2HB ALA 53 HB2 ALA 53 8.913 -0.520 -14.646 400 3HB ALA 53 HB3 ALA 53 9.584 -1.770 -15.705 401 H GLU 54 H GLU 54 8.393 -1.165 -12.391 402 HA GLU 54 HA GLU 54 10.542 -2.898 -11.275 403 1HB GLU 54 HB2 GLU 54 9.571 -0.050 -10.716 404 2HB GLU 54 HB3 GLU 54 10.831 -0.864 -9.822 405 1HG GLU 54 HG2 GLU 54 11.736 -1.230 -12.405 406 2HG GLU 54 HG3 GLU 54 10.873 0.307 -12.565 407 H THR 55 H THR 55 7.446 -1.390 -10.467 408 HA THR 55 HA THR 55 7.292 -2.723 -7.835 409 HB THR 55 HB THR 55 6.243 -0.159 -8.844 410 HG1 THR 55 HG1 THR 55 8.594 -0.550 -8.021 411 1HG2 THR 55 HG21 THR 55 5.727 0.241 -6.430 412 2HG2 THR 55 HG22 THR 55 4.752 -1.050 -7.152 413 3HG2 THR 55 HG23 THR 55 6.126 -1.479 -6.075 414 H GLY 56 H GLY 56 5.643 -4.145 -7.463 415 1HA GLY 56 HA2 GLY 56 3.072 -3.165 -8.137 416 2HA GLY 56 HA3 GLY 56 3.367 -4.696 -8.993 417 H THR 57 H THR 57 1.433 -4.900 -7.514 418 HA THR 57 HA THR 57 1.195 -5.188 -4.854 419 HB THR 57 HB THR 57 -0.548 -5.501 -6.461 420 HG1 THR 57 HG1 THR 57 -0.423 -7.734 -4.742 421 1HG2 THR 57 HG21 THR 57 0.462 -8.348 -6.874 422 2HG2 THR 57 HG22 THR 57 -1.029 -7.627 -7.504 423 3HG2 THR 57 HG23 THR 57 0.538 -7.041 -8.082 424 H ALA 58 H ALA 58 2.827 -7.529 -6.992 425 HA ALA 58 HA ALA 58 3.498 -9.591 -5.296 426 1HB ALA 58 HB1 ALA 58 5.531 -9.799 -6.745 427 2HB ALA 58 HB2 ALA 58 4.073 -9.463 -7.701 428 3HB ALA 58 HB3 ALA 58 5.235 -8.157 -7.372 429 H ALA 59 H ALA 59 5.286 -6.474 -5.577 430 HA ALA 59 HA ALA 59 7.346 -7.342 -3.637 431 1HB ALA 59 HB1 ALA 59 6.880 -4.685 -5.076 432 2HB ALA 59 HB2 ALA 59 8.279 -5.100 -4.065 433 3HB ALA 59 HB3 ALA 59 8.004 -5.961 -5.592 434 H ILE 60 H ILE 60 4.527 -5.313 -4.058 435 HA ILE 60 HA ILE 60 4.689 -3.873 -1.675 436 HB ILE 60 HB ILE 60 2.805 -4.297 -3.866 437 1HG1 ILE 60 HG12 ILE 60 3.358 -1.888 -2.198 438 2HG1 ILE 60 HG13 ILE 60 4.494 -2.447 -3.444 439 1HG2 ILE 60 HG21 ILE 60 1.177 -4.841 -2.167 440 2HG2 ILE 60 HG22 ILE 60 1.635 -3.436 -1.198 441 3HG2 ILE 60 HG23 ILE 60 0.863 -3.232 -2.786 442 1HD1 ILE 60 HD11 ILE 60 1.652 -1.481 -3.927 443 2HD1 ILE 60 HD12 ILE 60 3.170 -0.703 -4.402 444 3HD1 ILE 60 HD13 ILE 60 2.698 -2.237 -5.158 445 H GLN 61 H GLN 61 2.681 -6.872 -2.187 446 HA GLN 61 HA GLN 61 1.798 -7.184 0.458 447 1HB GLN 61 HB2 GLN 61 2.638 -9.217 -1.637 448 2HB GLN 61 HB3 GLN 61 2.217 -9.688 0.017 449 1HG GLN 61 HG2 GLN 61 0.295 -10.076 -1.184 450 2HG GLN 61 HG3 GLN 61 -0.018 -8.629 -0.228 451 1HE2 GLN 61 HE21 GLN 61 0.071 -6.527 -1.404 452 2HE2 GLN 61 HE22 GLN 61 -0.351 -6.528 -3.114 453 H GLU 62 H GLU 62 4.847 -8.391 -0.974 454 HA GLU 62 HA GLU 62 6.019 -9.507 1.242 455 1HB GLU 62 HB2 GLU 62 6.793 -8.929 -1.345 456 2HB GLU 62 HB3 GLU 62 7.834 -7.801 -0.493 457 1HG GLU 62 HG2 GLU 62 7.672 -10.786 0.171 458 2HG GLU 62 HG3 GLU 62 8.710 -10.117 -1.099 459 H LYS 63 H LYS 63 6.258 -5.995 0.397 460 HA LYS 63 HA LYS 63 7.665 -5.547 2.893 461 1HB LYS 63 HB2 LYS 63 7.027 -3.997 0.498 462 2HB LYS 63 HB3 LYS 63 6.606 -3.122 1.956 463 1HG LYS 63 HG2 LYS 63 8.893 -2.614 1.404 464 2HG LYS 63 HG3 LYS 63 8.909 -3.569 2.879 465 1HD LYS 63 HD2 LYS 63 9.037 -5.276 0.461 466 2HD LYS 63 HD3 LYS 63 10.319 -4.062 0.466 467 1HE LYS 63 HE2 LYS 63 11.110 -4.814 2.669 468 2HE LYS 63 HE3 LYS 63 9.806 -6.015 2.755 469 1HZ LYS 63 HZ1 LYS 63 10.690 -7.111 0.865 470 2HZ LYS 63 HZ2 LYS 63 11.923 -6.034 0.706 471 3HZ LYS 63 HZ3 LYS 63 11.812 -7.035 2.013 472 H ILE 64 H ILE 64 4.222 -5.192 1.895 473 HA ILE 64 HA ILE 64 3.300 -3.814 4.092 474 HB ILE 64 HB ILE 64 1.976 -6.000 2.450 475 1HG1 ILE 64 HG12 ILE 64 2.552 -3.755 1.337 476 2HG1 ILE 64 HG13 ILE 64 0.912 -4.397 1.214 477 1HG2 ILE 64 HG21 ILE 64 0.834 -6.002 4.543 478 2HG2 ILE 64 HG22 ILE 64 0.919 -4.221 4.666 479 3HG2 ILE 64 HG23 ILE 64 -0.135 -5.005 3.472 480 1HD1 ILE 64 HD11 ILE 64 0.254 -2.815 3.093 481 2HD1 ILE 64 HD12 ILE 64 1.911 -2.148 2.946 482 3HD1 ILE 64 HD13 ILE 64 0.741 -2.070 1.604 483 H GLU 65 H GLU 65 3.819 -7.383 3.655 484 HA GLU 65 HA GLU 65 2.954 -8.330 6.176 485 1HB GLU 65 HB2 GLU 65 5.038 -9.216 4.181 486 2HB GLU 65 HB3 GLU 65 4.700 -10.133 5.660 487 1HG GLU 65 HG2 GLU 65 2.524 -9.371 3.658 488 2HG GLU 65 HG3 GLU 65 3.427 -10.884 3.577 489 H LYS 66 H LYS 66 6.095 -6.938 5.190 490 HA LYS 66 HA LYS 66 7.321 -7.472 7.739 491 1HB LYS 66 HB2 LYS 66 8.320 -7.180 5.364 492 2HB LYS 66 HB3 LYS 66 8.279 -5.453 5.722 493 1HG LYS 66 HG2 LYS 66 10.016 -5.605 7.233 494 2HG LYS 66 HG3 LYS 66 9.481 -7.134 7.911 495 1HD LYS 66 HD2 LYS 66 10.845 -6.849 5.208 496 2HD LYS 66 HD3 LYS 66 11.682 -7.255 6.709 497 1HE LYS 66 HE2 LYS 66 9.362 -9.028 6.352 498 2HE LYS 66 HE3 LYS 66 10.324 -9.031 4.876 499 1HZ LYS 66 HZ1 LYS 66 12.235 -9.634 6.208 500 2HZ LYS 66 HZ2 LYS 66 11.326 -9.617 7.586 501 3HZ LYS 66 HZ3 LYS 66 11.013 -10.713 6.401 502 H LEU 67 H LEU 67 5.673 -4.648 6.260 503 HA LEU 67 HA LEU 67 6.120 -2.810 8.381 504 1HB LEU 67 HB2 LEU 67 4.012 -3.223 6.241 505 2HB LEU 67 HB3 LEU 67 3.689 -2.092 7.517 506 HG LEU 67 HG LEU 67 4.500 -0.996 5.603 507 1HD1 LEU 67 HD11 LEU 67 6.790 -0.873 7.593 508 2HD1 LEU 67 HD12 LEU 67 6.147 0.432 6.586 509 3HD1 LEU 67 HD13 LEU 67 5.177 -0.196 7.932 510 1HD2 LEU 67 HD21 LEU 67 7.018 -2.655 5.682 511 2HD2 LEU 67 HD22 LEU 67 5.785 -2.505 4.395 512 3HD2 LEU 67 HD23 LEU 67 6.830 -1.143 4.775 513 H GLY 68 H GLY 68 4.323 -5.806 8.314 514 1HA GLY 68 HA2 GLY 68 3.853 -6.925 10.283 515 2HA GLY 68 HA3 GLY 68 3.747 -5.409 11.186 516 H TYR 69 H TYR 69 2.133 -5.980 8.047 517 HA TYR 69 HA TYR 69 -0.497 -6.447 9.370 518 1HB TYR 69 HB2 TYR 69 0.047 -4.250 7.334 519 2HB TYR 69 HB3 TYR 69 -1.528 -4.679 7.990 520 HD1 TYR 69 HD1 TYR 69 1.800 -3.248 8.825 521 HD2 TYR 69 HD2 TYR 69 -2.303 -3.667 10.039 522 HE1 TYR 69 HE1 TYR 69 2.177 -1.599 10.592 523 HE2 TYR 69 HE2 TYR 69 -1.974 -1.884 11.735 524 HH TYR 69 HH TYR 69 1.201 -0.342 12.281 525 H HIS 70 H HIS 70 -2.150 -6.950 7.382 526 HA HIS 70 HA HIS 70 -0.616 -7.920 5.081 527 1HB HIS 70 HB2 HIS 70 -1.559 -9.886 4.944 528 2HB HIS 70 HB3 HIS 70 -1.152 -9.838 6.647 529 HD1 HIS 70 HD1 HIS 70 -3.749 -11.063 4.503 530 HD2 HIS 70 HD2 HIS 70 -3.611 -8.965 8.130 531 HE1 HIS 70 HE1 HIS 70 -5.999 -11.452 5.656 532 H VAL 71 H VAL 71 -1.385 -7.285 3.303 533 HA VAL 71 HA VAL 71 -3.866 -5.669 3.186 534 HB VAL 71 HB VAL 71 -1.825 -4.720 2.236 535 1HG1 VAL 71 HG11 VAL 71 -0.862 -5.574 0.155 536 2HG1 VAL 71 HG12 VAL 71 -0.685 -6.784 1.433 537 3HG1 VAL 71 HG13 VAL 71 -1.940 -6.979 0.186 538 1HG2 VAL 71 HG21 VAL 71 -3.919 -3.978 1.359 539 2HG2 VAL 71 HG22 VAL 71 -2.666 -4.011 0.122 540 3HG2 VAL 71 HG23 VAL 71 -3.915 -5.267 0.121 541 H VAL 72 H VAL 72 -5.548 -6.142 1.677 542 HA VAL 72 HA VAL 72 -5.579 -8.980 0.679 543 HB VAL 72 HB VAL 72 -8.183 -8.459 0.780 544 1HG1 VAL 72 HG11 VAL 72 -7.131 -10.387 1.752 545 2HG1 VAL 72 HG12 VAL 72 -6.495 -9.403 3.104 546 3HG1 VAL 72 HG13 VAL 72 -8.254 -9.646 2.914 547 1HG2 VAL 72 HG21 VAL 72 -7.872 -6.240 1.794 548 2HG2 VAL 72 HG22 VAL 72 -8.844 -7.318 2.810 549 3HG2 VAL 72 HG23 VAL 72 -7.157 -6.988 3.260 550 H ILE 73 H ILE 73 -5.202 -8.976 -1.405 551 HA ILE 73 HA ILE 73 -6.287 -6.857 -3.169 552 HB ILE 73 HB ILE 73 -4.907 -9.458 -3.936 553 1HG1 ILE 73 HG12 ILE 73 -3.331 -8.244 -2.534 554 2HG1 ILE 73 HG13 ILE 73 -2.842 -8.250 -4.221 555 1HG2 ILE 73 HG21 ILE 73 -4.463 -8.184 -6.048 556 2HG2 ILE 73 HG22 ILE 73 -6.191 -8.412 -5.750 557 3HG2 ILE 73 HG23 ILE 73 -5.457 -6.847 -5.424 558 1HD1 ILE 73 HD11 ILE 73 -4.207 -5.913 -2.811 559 2HD1 ILE 73 HD12 ILE 73 -2.478 -6.053 -3.143 560 3HD1 ILE 73 HD13 ILE 73 -3.611 -5.917 -4.491 561 H GLU 74 H GLU 74 -8.361 -7.371 -2.101 562 HA GLU 74 HA GLU 74 -9.801 -9.349 -3.812 563 1HB GLU 74 HB2 GLU 74 -10.084 -9.368 -1.072 564 2HB GLU 74 HB3 GLU 74 -11.295 -8.161 -1.522 565 1HG GLU 74 HG2 GLU 74 -11.971 -9.997 -3.357 566 2HG GLU 74 HG3 GLU 74 -11.106 -11.089 -2.271 567 H GLY 75 H GLY 75 -11.794 -8.444 -4.683 568 1HA GLY 75 HA2 GLY 75 -13.144 -6.451 -5.152 569 2HA GLY 75 HA3 GLY 75 -11.665 -5.479 -5.172 570 H ARG 76 H ARG 76 -9.934 -6.126 -6.838 571 HA ARG 76 HA ARG 76 -10.437 -7.770 -8.990 572 1HB ARG 76 HB2 ARG 76 -12.169 -5.705 -9.288 573 2HB ARG 76 HB3 ARG 76 -10.741 -4.853 -9.811 574 1HG ARG 76 HG2 ARG 76 -10.951 -7.464 -11.161 575 2HG ARG 76 HG3 ARG 76 -12.500 -6.627 -11.246 576 1HD ARG 76 HD2 ARG 76 -11.139 -6.108 -13.198 577 2HD ARG 76 HD3 ARG 76 -11.379 -4.637 -12.227 578 HE ARG 76 HE ARG 76 -9.150 -5.446 -11.101 579 1HH1 ARG 76 HH22 ARG 76 -9.549 -5.531 -14.600 580 2HH1 ARG 76 HH21 ARG 76 -7.955 -6.181 -14.867 581 1HH2 ARG 76 HH12 ARG 76 -7.336 -6.301 -11.338 582 2HH2 ARG 76 HH11 ARG 76 -6.531 -6.578 -12.887
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