NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype |
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612677 |
5i4g   |
30013 | cing | 1-original | 2 | PDB | coordinate | ensemble |
# fout=/data18/home/kaching/LfcinP/LfcinP_amber//final.upl-amber with 326 total noe's after 0 conversions # Restraints file 2: dummy.pdb EXPDTA NMR, 20 STRUCTURES REMARK 99 B-FACTOR COLUMN STORES ADDITIONAL COORDINATE DIGITS. MODEL 1 ATOM 1 N SER A 1 1.329 0.000 0.000 1.00 2.00 ATOM 3 CA SER A 1 2.094 0.002 -1.242 1.00 34.22 ATOM 4 HA SER A 1 1.748 -0.824 -1.845 1.00 73.31 ATOM 5 CB SER A 1 1.863 1.307 -2.006 1.00 11.25 ATOM 6 2HB SER A 1 2.320 2.123 -1.466 1.00 64.52 ATOM 7 3HB SER A 1 2.308 1.230 -2.987 1.00 52.11 ATOM 8 OG SER A 1 0.479 1.575 -2.151 1.00 0.31 ATOM 9 HG SER A 1 0.215 1.412 -3.059 1.00 52.23 ATOM 10 C SER A 1 3.582 -0.182 -0.964 1.00 4.55 ATOM 11 O SER A 1 4.016 -0.180 0.189 1.00 51.31 ATOM 12 N LYS A 2 4.362 -0.340 -2.028 1.00 54.00 ATOM 13 H LYS A 2 3.957 -0.332 -2.921 1.00 64.45 ATOM 14 CA LYS A 2 5.803 -0.524 -1.902 1.00 14.54 ATOM 15 HA LYS A 2 6.036 -0.603 -0.851 1.00 10.23 ATOM 16 CB LYS A 2 6.237 -1.810 -2.607 1.00 64.11 ATOM 17 2HB LYS A 2 5.755 -1.858 -3.572 1.00 40.22 ATOM 18 3HB LYS A 2 7.308 -1.783 -2.750 1.00 61.54 ATOM 19 CG LYS A 2 5.891 -3.073 -1.837 1.00 51.24 ATOM 20 2HG LYS A 2 6.643 -3.240 -1.080 1.00 73.04 ATOM 21 3HG LYS A 2 4.926 -2.943 -1.367 1.00 64.41 ATOM 22 CD LYS A 2 5.836 -4.285 -2.751 1.00 73.53 ATOM 23 2HD LYS A 2 6.654 -4.233 -3.454 1.00 73.44 ATOM 24 3HD LYS A 2 5.929 -5.181 -2.153 1.00 4.20 ATOM 25 CE LYS A 2 4.527 -4.342 -3.524 1.00 51.21 ATOM 26 2HE LYS A 2 3.709 -4.225 -2.830 1.00 72.40 ATOM 27 3HE LYS A 2 4.511 -3.532 -4.238 1.00 51.14 ATOM 28 NZ LYS A 2 4.367 -5.632 -4.250 1.00 73.04 ATOM 29 1HZ LYS A 2 3.543 -6.149 -3.882 1.00 21.33 ATOM 30 2HZ LYS A 2 5.215 -6.220 -4.125 1.00 62.14 ATOM 31 3HZ LYS A 2 4.226 -5.456 -5.266 1.00 3.15 ATOM 32 C LYS A 2 6.556 0.668 -2.484 1.00 60.13 ATOM 33 O LYS A 2 7.679 0.966 -2.076 1.00 32.45 ATOM 34 N CYSSA 3 5.931 1.347 -3.440 1.00 41.31 ATOM 35 H CYSSA 3 5.037 1.061 -3.724 1.00 14.53 ATOM 36 CA CYSSA 3 6.541 2.507 -4.078 1.00 45.15 ATOM 37 HA CYSSA 3 7.571 2.265 -4.293 1.00 22.35 ATOM 38 CB CYSSA 3 5.823 2.830 -5.390 1.00 41.51 ATOM 39 2HB CYSSA 3 4.782 3.029 -5.182 1.00 33.43 ATOM 40 3HB CYSSA 3 6.270 3.710 -5.829 1.00 65.23 ATOM 41 SG CYSSA 3 5.895 1.494 -6.626 1.00 52.21 ATOM 42 C CYSSA 3 6.504 3.720 -3.153 1.00 63.10 ATOM 43 O CYSSA 3 7.546 4.236 -2.747 1.00 33.55 ATOM 44 N ARG A 4 5.298 4.170 -2.824 1.00 74.53 ATOM 45 H ARG A 4 4.505 3.716 -3.180 1.00 51.21 ATOM 46 CA ARG A 4 5.124 5.322 -1.948 1.00 23.31 ATOM 47 HA ARG A 4 5.498 6.192 -2.466 1.00 53.12 ATOM 48 CB ARG A 4 3.642 5.529 -1.630 1.00 43.44 ATOM 49 2HB ARG A 4 3.052 5.112 -2.433 1.00 40.21 ATOM 50 3HB ARG A 4 3.407 5.010 -0.714 1.00 12.02 ATOM 51 CG ARG A 4 3.254 6.989 -1.464 1.00 51.41 ATOM 52 2HG ARG A 4 3.405 7.502 -2.403 1.00 31.23 ATOM 53 3HG ARG A 4 2.212 7.045 -1.184 1.00 44.45 ATOM 54 CD ARG A 4 4.091 7.670 -0.393 1.00 4.12 ATOM 55 2HD ARG A 4 5.128 7.642 -0.693 1.00 62.22 ATOM 56 3HD ARG A 4 3.771 8.697 -0.303 1.00 52.20 ATOM 57 NE ARG A 4 3.956 7.015 0.906 1.00 44.43 ATOM 58 HE ARG A 4 4.726 6.511 1.242 1.00 72.12 ATOM 59 CZ ARG A 4 2.854 7.070 1.645 1.00 23.02 ATOM 60 NH1 ARG A 4 1.797 7.745 1.216 1.00 11.12 ATOM 61 1HH1 ARG A 4 1.828 8.214 0.334 1.00 65.03 ATOM 62 2HH1 ARG A 4 0.968 7.784 1.774 1.00 33.44 ATOM 63 NH2 ARG A 4 2.808 6.448 2.816 1.00 21.23 ATOM 64 1HH2 ARG A 4 3.603 5.938 3.143 1.00 62.31 ATOM 65 2HH2 ARG A 4 1.978 6.490 3.372 1.00 25.41 ATOM 66 C ARG A 4 5.913 5.144 -0.654 1.00 34.34 ATOM 67 O ARG A 4 6.711 6.002 -0.280 1.00 3.21 ATOM 68 N GLN A 5 5.681 4.025 0.025 1.00 23.41 ATOM 69 H GLN A 5 5.033 3.379 -0.324 1.00 40.04 ATOM 70 CA GLN A 5 6.369 3.736 1.278 1.00 61.52 ATOM 71 HA GLN A 5 6.065 4.476 2.002 1.00 55.24 ATOM 72 CB GLN A 5 5.977 2.349 1.791 1.00 63.31 ATOM 73 2HB GLN A 5 4.902 2.258 1.763 1.00 52.12 ATOM 74 3HB GLN A 5 6.411 1.602 1.142 1.00 54.23 ATOM 75 CG GLN A 5 6.442 2.072 3.211 1.00 25.24 ATOM 76 2HG GLN A 5 6.171 1.060 3.475 1.00 14.51 ATOM 77 3HG GLN A 5 7.517 2.177 3.251 1.00 34.34 ATOM 78 CD GLN A 5 5.825 3.017 4.223 1.00 54.44 ATOM 79 OE1 GLN A 5 4.740 3.557 4.003 1.00 33.12 ATOM 80 NE2 GLN A 5 6.514 3.223 5.339 1.00 53.51 ATOM 81 1HE2 GLN A 5 7.372 2.761 5.445 1.00 74.52 ATOM 82 2HE2 GLN A 5 6.138 3.830 6.009 1.00 4.51 ATOM 83 C GLN A 5 7.882 3.816 1.100 1.00 54.24 ATOM 84 O GLN A 5 8.591 4.331 1.964 1.00 43.24 ATOM 85 N TRP A 6 8.368 3.304 -0.025 1.00 54.01 ATOM 86 H TRP A 6 7.751 2.907 -0.676 1.00 22.12 ATOM 87 CA TRP A 6 9.797 3.318 -0.316 1.00 52.01 ATOM 88 HA TRP A 6 10.308 2.854 0.515 1.00 52.22 ATOM 89 CB TRP A 6 10.087 2.518 -1.587 1.00 42.31 ATOM 90 2HB TRP A 6 9.876 1.475 -1.405 1.00 53.31 ATOM 91 3HB TRP A 6 9.450 2.878 -2.383 1.00 25.43 ATOM 92 CG TRP A 6 11.510 2.629 -2.046 1.00 73.43 ATOM 93 CD1 TRP A 6 12.632 2.420 -1.296 1.00 14.50 ATOM 94 CD2 TRP A 6 11.962 2.976 -3.360 1.00 33.52 ATOM 95 CE3 TRP A 6 11.314 3.297 -4.556 1.00 2.55 ATOM 96 CE2 TRP A 6 13.370 2.958 -3.334 1.00 20.40 ATOM 97 NE1 TRP A 6 13.754 2.617 -2.064 1.00 11.11 ATOM 98 HD1 TRP A 6 12.623 2.144 -0.253 1.00 14.33 ATOM 99 HE3 TRP A 6 10.236 3.323 -4.618 1.00 22.53 ATOM 100 CZ3 TRP A 6 12.078 3.588 -5.670 1.00 4.35 ATOM 101 CZ2 TRP A 6 14.139 3.251 -4.457 1.00 74.54 ATOM 102 HE1 TRP A 6 14.679 2.526 -1.752 1.00 42.45 ATOM 103 HZ3 TRP A 6 11.595 3.840 -6.602 1.00 65.14 ATOM 104 CH2 TRP A 6 13.478 3.563 -5.615 1.00 23.54 ATOM 105 HZ2 TRP A 6 15.218 3.234 -4.431 1.00 44.33 ATOM 106 HH2 TRP A 6 14.035 3.797 -6.509 1.00 32.41 ATOM 107 C TRP A 6 10.307 4.746 -0.472 1.00 13.43 ATOM 108 O TRP A 6 11.264 5.148 0.190 1.00 55.01 ATOM 109 N GLN A 7 9.662 5.508 -1.349 1.00 52.24 ATOM 110 H GLN A 7 8.907 5.131 -1.846 1.00 72.31 ATOM 111 CA GLN A 7 10.052 6.892 -1.591 1.00 10.21 ATOM 112 HA GLN A 7 11.025 6.885 -2.058 1.00 2.42 ATOM 113 CB GLN A 7 9.054 7.569 -2.532 1.00 72.31 ATOM 114 2HB GLN A 7 8.053 7.372 -2.178 1.00 10.42 ATOM 115 3HB GLN A 7 9.230 8.634 -2.518 1.00 54.32 ATOM 116 CG GLN A 7 9.153 7.089 -3.971 1.00 62.12 ATOM 117 2HG GLN A 7 9.278 6.016 -3.972 1.00 4.22 ATOM 118 3HG GLN A 7 8.238 7.344 -4.486 1.00 25.33 ATOM 119 CD GLN A 7 10.318 7.712 -4.715 1.00 21.30 ATOM 120 OE1 GLN A 7 10.198 8.799 -5.281 1.00 63.52 ATOM 121 NE2 GLN A 7 11.455 7.025 -4.717 1.00 75.24 ATOM 122 1HE2 GLN A 7 11.476 6.165 -4.246 1.00 42.12 ATOM 123 2HE2 GLN A 7 12.223 7.403 -5.191 1.00 42.41 ATOM 124 C GLN A 7 10.141 7.669 -0.282 1.00 1.15 ATOM 125 O GLN A 7 11.126 8.361 -0.025 1.00 25.45 ATOM 126 N SER A 8 9.105 7.551 0.543 1.00 62.51 ATOM 127 H SER A 8 8.349 6.984 0.281 1.00 0.25 ATOM 128 CA SER A 8 9.065 8.245 1.824 1.00 13.24 ATOM 129 HA SER A 8 9.293 9.285 1.645 1.00 55.41 ATOM 130 CB SER A 8 7.669 8.140 2.441 1.00 13.44 ATOM 131 2HB SER A 8 7.322 7.121 2.371 1.00 62.35 ATOM 132 3HB SER A 8 7.715 8.434 3.480 1.00 35.13 ATOM 133 OG SER A 8 6.749 8.983 1.769 1.00 42.03 ATOM 134 HG SER A 8 7.215 9.739 1.404 1.00 1.00 ATOM 135 C SER A 8 10.102 7.673 2.785 1.00 23.05 ATOM 136 O SER A 8 10.702 8.401 3.577 1.00 52.34 ATOM 137 N LYS A 9 10.309 6.363 2.711 1.00 21.40 ATOM 138 H LYS A 9 9.800 5.835 2.060 1.00 63.23 ATOM 139 CA LYS A 9 11.274 5.690 3.572 1.00 24.31 ATOM 140 HA LYS A 9 11.003 5.893 4.597 1.00 44.41 ATOM 141 CB LYS A 9 11.232 4.178 3.336 1.00 4.25 ATOM 142 2HB LYS A 9 10.865 3.992 2.338 1.00 22.30 ATOM 143 3HB LYS A 9 12.235 3.785 3.421 1.00 22.22 ATOM 144 CG LYS A 9 10.344 3.434 4.318 1.00 0.03 ATOM 145 2HG LYS A 9 10.543 3.796 5.316 1.00 25.21 ATOM 146 3HG LYS A 9 9.310 3.620 4.066 1.00 34.10 ATOM 147 CD LYS A 9 10.601 1.937 4.278 1.00 35.12 ATOM 148 2HD LYS A 9 10.115 1.520 3.409 1.00 54.15 ATOM 149 3HD LYS A 9 11.666 1.765 4.215 1.00 73.50 ATOM 150 CE LYS A 9 10.061 1.245 5.521 1.00 54.43 ATOM 151 2HE LYS A 9 10.196 1.900 6.368 1.00 31.43 ATOM 152 3HE LYS A 9 9.007 1.052 5.380 1.00 43.11 ATOM 153 NZ LYS A 9 10.759 -0.043 5.786 1.00 12.12 ATOM 154 1HZ LYS A 9 10.196 -0.836 5.418 1.00 61.33 ATOM 155 2HZ LYS A 9 10.892 -0.173 6.809 1.00 12.02 ATOM 156 3HZ LYS A 9 11.690 -0.047 5.323 1.00 73.21 ATOM 157 C LYS A 9 12.685 6.215 3.323 1.00 73.33 ATOM 158 O LYS A 9 13.473 6.371 4.256 1.00 14.30 ATOM 159 N ILE A 10 12.995 6.486 2.060 1.00 64.13 ATOM 160 H ILE A 10 12.325 6.340 1.361 1.00 53.45 ATOM 161 CA ILE A 10 14.310 6.996 1.689 1.00 33.24 ATOM 162 HA ILE A 10 15.053 6.311 2.073 1.00 74.05 ATOM 163 CB ILE A 10 14.471 7.080 0.160 1.00 73.40 ATOM 164 HB ILE A 10 13.719 7.753 -0.222 1.00 41.14 ATOM 165 CG2 ILE A 10 15.838 7.643 -0.199 1.00 32.44 ATOM 166 1HG2 ILE A 10 16.346 6.959 -0.862 1.00 72.45 ATOM 167 2HG2 ILE A 10 15.716 8.596 -0.690 1.00 42.12 ATOM 168 3HG2 ILE A 10 16.421 7.772 0.700 1.00 3.13 ATOM 169 CG1 ILE A 10 14.274 5.700 -0.472 1.00 23.13 ATOM 170 2HG1 ILE A 10 15.237 5.287 -0.726 1.00 65.13 ATOM 171 3HG1 ILE A 10 13.787 5.052 0.242 1.00 34.21 ATOM 172 CD1 ILE A 10 13.433 5.725 -1.729 1.00 10.14 ATOM 173 1HD1 ILE A 10 12.640 4.997 -1.646 1.00 71.42 ATOM 174 2HD1 ILE A 10 13.008 6.709 -1.858 1.00 73.32 ATOM 175 3HD1 ILE A 10 14.053 5.486 -2.581 1.00 73.01 ATOM 176 C ILE A 10 14.554 8.375 2.291 1.00 12.43 ATOM 177 O ILE A 10 15.555 8.598 2.972 1.00 13.45 ATOM 178 N ARG A 11 13.631 9.298 2.037 1.00 63.43 ATOM 179 H ARG A 11 12.856 9.059 1.487 1.00 15.32 ATOM 180 CA ARG A 11 13.746 10.656 2.554 1.00 33.10 ATOM 181 HA ARG A 11 14.598 11.121 2.081 1.00 73.51 ATOM 182 CB ARG A 11 12.489 11.460 2.217 1.00 41.45 ATOM 183 2HB ARG A 11 11.631 10.807 2.274 1.00 11.01 ATOM 184 3HB ARG A 11 12.378 12.252 2.942 1.00 51.21 ATOM 185 CG ARG A 11 12.519 12.084 0.831 1.00 43.51 ATOM 186 2HG ARG A 11 13.187 12.934 0.843 1.00 34.31 ATOM 187 3HG ARG A 11 12.879 11.352 0.124 1.00 31.52 ATOM 188 CD ARG A 11 11.138 12.552 0.400 1.00 32.31 ATOM 189 2HD ARG A 11 11.187 12.878 -0.628 1.00 60.20 ATOM 190 3HD ARG A 11 10.451 11.723 0.482 1.00 33.21 ATOM 191 NE ARG A 11 10.651 13.655 1.224 1.00 24.13 ATOM 192 HE ARG A 11 11.183 13.904 2.008 1.00 11.34 ATOM 193 CZ ARG A 11 9.537 14.329 0.966 1.00 53.53 ATOM 194 NH1 ARG A 11 8.797 14.015 -0.088 1.00 72.35 ATOM 195 1HH1 ARG A 11 9.078 13.267 -0.690 1.00 52.32 ATOM 196 2HH1 ARG A 11 7.957 14.523 -0.280 1.00 42.43 ATOM 197 NH2 ARG A 11 9.160 15.321 1.763 1.00 52.12 ATOM 198 1HH2 ARG A 11 9.715 15.561 2.559 1.00 51.14 ATOM 199 2HH2 ARG A 11 8.321 15.828 1.567 1.00 0.24 ATOM 200 C ARG A 11 13.966 10.646 4.064 1.00 60.21 ATOM 201 O ARG A 11 14.605 11.543 4.614 1.00 54.21 ATOM 202 N ARG A 12 13.433 9.625 4.728 1.00 53.53 ATOM 203 H ARG A 12 12.935 8.941 4.234 1.00 54.25 ATOM 204 CA ARG A 12 13.569 9.500 6.174 1.00 64.33 ATOM 205 HA ARG A 12 13.529 10.491 6.599 1.00 54.45 ATOM 206 CB ARG A 12 12.421 8.666 6.745 1.00 23.14 ATOM 207 2HB ARG A 12 11.622 8.630 6.020 1.00 14.31 ATOM 208 3HB ARG A 12 12.777 7.663 6.927 1.00 73.11 ATOM 209 CG ARG A 12 11.859 9.215 8.046 1.00 31.24 ATOM 210 2HG ARG A 12 12.017 8.489 8.831 1.00 52.23 ATOM 211 3HG ARG A 12 12.374 10.131 8.292 1.00 43.31 ATOM 212 CD ARG A 12 10.369 9.499 7.933 1.00 4.43 ATOM 213 2HD ARG A 12 9.848 8.565 7.788 1.00 40.15 ATOM 214 3HD ARG A 12 10.034 9.959 8.851 1.00 51.11 ATOM 215 NE ARG A 12 10.066 10.391 6.817 1.00 34.40 ATOM 216 HE ARG A 12 9.713 9.987 5.997 1.00 43.11 ATOM 217 CZ ARG A 12 10.241 11.707 6.859 1.00 70.34 ATOM 218 NH1 ARG A 12 10.716 12.281 7.955 1.00 1.20 ATOM 219 1HH1 ARG A 12 10.944 11.723 8.752 1.00 33.25 ATOM 220 2HH1 ARG A 12 10.848 13.272 7.983 1.00 4.33 ATOM 221 NH2 ARG A 12 9.941 12.451 5.802 1.00 63.13 ATOM 222 1HH2 ARG A 12 9.583 12.021 4.973 1.00 1.43 ATOM 223 2HH2 ARG A 12 10.073 13.441 5.834 1.00 4.10 ATOM 224 C ARG A 12 14.907 8.862 6.540 1.00 54.20 ATOM 225 O ARG A 12 15.513 9.205 7.555 1.00 4.03 ATOM 226 N THR A 13 15.361 7.932 5.706 1.00 31.42 ATOM 227 H THR A 13 14.832 7.702 4.914 1.00 71.00 ATOM 228 CA THR A 13 16.624 7.245 5.942 1.00 25.15 ATOM 229 HA THR A 13 16.658 6.957 6.983 1.00 3.44 ATOM 230 CB THR A 13 16.740 5.971 5.085 1.00 63.32 ATOM 231 HB THR A 13 16.704 6.252 4.042 1.00 11.41 ATOM 232 OG1 THR A 13 15.649 5.088 5.369 1.00 50.24 ATOM 233 HG1 THR A 13 15.592 4.419 4.683 1.00 71.35 ATOM 234 CG2 THR A 13 18.058 5.258 5.350 1.00 72.21 ATOM 235 1HG2 THR A 13 18.805 5.613 4.656 1.00 5.24 ATOM 236 2HG2 THR A 13 17.924 4.194 5.221 1.00 14.14 ATOM 237 3HG2 THR A 13 18.379 5.461 6.360 1.00 23.23 ATOM 238 C THR A 13 17.810 8.155 5.642 1.00 14.42 ATOM 239 O THR A 13 18.897 7.974 6.188 1.00 42.32 ATOM 240 N ASN A 14 17.591 9.136 4.771 1.00 22.54 ATOM 241 H ASN A 14 16.702 9.229 4.370 1.00 44.15 ATOM 242 CA ASN A 14 18.643 10.075 4.399 1.00 55.22 ATOM 243 HA ASN A 14 19.395 9.530 3.850 1.00 25.54 ATOM 244 CB ASN A 14 18.075 11.178 3.503 1.00 64.15 ATOM 245 2HB ASN A 14 17.002 11.212 3.620 1.00 50.30 ATOM 246 3HB ASN A 14 18.496 12.127 3.799 1.00 65.14 ATOM 247 CG ASN A 14 18.389 10.950 2.036 1.00 32.44 ATOM 248 OD1 ASN A 14 18.796 11.870 1.327 1.00 75.54 ATOM 249 ND2 ASN A 14 18.200 9.718 1.576 1.00 10.40 ATOM 250 1HD2 ASN A 14 17.874 9.036 2.199 1.00 33.31 ATOM 251 2HD2 ASN A 14 18.395 9.543 0.632 1.00 64.21 ATOM 252 C ASN A 14 19.285 10.692 5.638 1.00 63.54 ATOM 253 O ASN A 14 20.484 10.549 5.882 1.00 75.11 ATOM 254 N PRO A 15 18.471 11.393 6.440 1.00 51.33 ATOM 255 CD PRO A 15 17.032 11.605 6.210 1.00 32.53 ATOM 256 CA PRO A 15 18.937 12.045 7.667 1.00 25.43 ATOM 257 HA PRO A 15 19.782 12.690 7.477 1.00 4.24 ATOM 258 CB PRO A 15 17.735 12.888 8.100 1.00 24.45 ATOM 259 2HB PRO A 15 17.679 12.911 9.180 1.00 62.13 ATOM 260 3HB PRO A 15 17.839 13.892 7.718 1.00 31.20 ATOM 261 CG PRO A 15 16.556 12.198 7.507 1.00 34.03 ATOM 262 2HG PRO A 15 16.212 11.420 8.172 1.00 4.00 ATOM 263 3HG PRO A 15 15.767 12.913 7.325 1.00 73.43 ATOM 264 2HD PRO A 15 16.530 10.668 6.017 1.00 24.34 ATOM 265 3HD PRO A 15 16.869 12.296 5.397 1.00 42.13 ATOM 266 C PRO A 15 19.302 11.039 8.754 1.00 4.22 ATOM 267 O PRO A 15 20.360 11.140 9.376 1.00 4.31 ATOM 268 N ILE A 16 18.421 10.070 8.978 1.00 50.45 ATOM 269 H ILE A 16 17.596 10.043 8.449 1.00 2.35 ATOM 270 CA ILE A 16 18.652 9.046 9.988 1.00 2.15 ATOM 271 HA ILE A 16 18.689 9.532 10.953 1.00 42.42 ATOM 272 CB ILE A 16 17.513 8.010 10.011 1.00 13.33 ATOM 273 HB ILE A 16 17.449 7.556 9.034 1.00 4.23 ATOM 274 CG2 ILE A 16 17.813 6.915 11.024 1.00 14.31 ATOM 275 1HG2 ILE A 16 18.268 7.351 11.901 1.00 42.10 ATOM 276 2HG2 ILE A 16 16.893 6.423 11.304 1.00 4.11 ATOM 277 3HG2 ILE A 16 18.488 6.196 10.587 1.00 23.42 ATOM 278 CG1 ILE A 16 16.181 8.692 10.334 1.00 62.53 ATOM 279 2HG1 ILE A 16 16.160 8.950 11.381 1.00 44.35 ATOM 280 3HG1 ILE A 16 16.094 9.592 9.743 1.00 71.12 ATOM 281 CD1 ILE A 16 14.974 7.826 10.045 1.00 4.33 ATOM 282 1HD1 ILE A 16 14.074 8.407 10.182 1.00 72.24 ATOM 283 2HD1 ILE A 16 15.022 7.468 9.028 1.00 25.23 ATOM 284 3HD1 ILE A 16 14.965 6.985 10.723 1.00 32.23 ATOM 285 C ILE A 16 19.975 8.326 9.749 1.00 75.54 ATOM 286 O ILE A 16 20.576 7.784 10.676 1.00 31.23 ATOM 287 N PHE A 17 20.423 8.325 8.498 1.00 60.54 ATOM 288 H PHE A 17 19.899 8.773 7.801 1.00 14.55 ATOM 289 CA PHE A 17 21.675 7.671 8.135 1.00 3.30 ATOM 290 HA PHE A 17 21.922 6.971 8.918 1.00 11.22 ATOM 291 CB PHE A 17 21.515 6.910 6.818 1.00 61.43 ATOM 292 2HB PHE A 17 20.746 6.161 6.934 1.00 11.03 ATOM 293 3HB PHE A 17 21.223 7.602 6.043 1.00 1.41 ATOM 294 CG PHE A 17 22.770 6.215 6.370 1.00 14.42 ATOM 295 CD1 PHE A 17 23.244 6.377 5.078 1.00 14.34 ATOM 296 HD1 PHE A 17 22.701 7.011 4.390 1.00 24.13 ATOM 297 CE1 PHE A 17 24.398 5.740 4.663 1.00 11.34 ATOM 298 HE1 PHE A 17 24.756 5.875 3.653 1.00 32.24 ATOM 299 CZ PHE A 17 25.091 4.930 5.541 1.00 2.33 ATOM 300 HZ PHE A 17 25.994 4.432 5.219 1.00 15.35 ATOM 301 CE2 PHE A 17 24.630 4.761 6.832 1.00 14.32 ATOM 302 HE2 PHE A 17 25.170 4.128 7.520 1.00 13.34 ATOM 303 CD2 PHE A 17 23.475 5.400 7.241 1.00 15.53 ATOM 304 HD2 PHE A 17 23.114 5.266 8.251 1.00 43.33 ATOM 305 C PHE A 17 22.805 8.690 8.012 1.00 14.22 ATOM 306 O PHE A 17 23.977 8.358 8.187 1.00 45.41 ATOM 307 N CYSSA 18 22.442 9.932 7.710 1.00 42.41 ATOM 308 H CYSSA 18 21.491 10.136 7.583 1.00 61.24 ATOM 309 CA CYSSA 18 23.423 11.001 7.562 1.00 12.01 ATOM 310 HA CYSSA 18 24.255 10.612 6.995 1.00 53.11 ATOM 311 CB CYSSA 18 22.812 12.181 6.804 1.00 14.21 ATOM 312 2HB CYSSA 18 21.749 12.212 6.998 1.00 62.13 ATOM 313 3HB CYSSA 18 23.263 13.097 7.155 1.00 12.34 ATOM 314 SG CYSSA 18 23.042 12.105 4.999 1.00 63.03 ATOM 315 C CYSSA 18 23.931 11.465 8.924 1.00 12.31 ATOM 316 O CYSSA 18 25.056 11.949 9.046 1.00 44.51 ATOM 317 N ILE A 19 23.094 11.314 9.945 1.00 75.24 ATOM 318 H ILE A 19 22.210 10.922 9.784 1.00 22.42 ATOM 319 CA ILE A 19 23.458 11.716 11.297 1.00 21.14 ATOM 320 HA ILE A 19 24.536 11.696 11.372 1.00 71.23 ATOM 321 CB ILE A 19 22.977 13.146 11.609 1.00 63.44 ATOM 322 HB ILE A 19 23.205 13.361 12.641 1.00 2.32 ATOM 323 CG2 ILE A 19 23.715 14.153 10.740 1.00 5.41 ATOM 324 1HG2 ILE A 19 23.426 14.019 9.708 1.00 11.52 ATOM 325 2HG2 ILE A 19 23.463 15.154 11.057 1.00 53.11 ATOM 326 3HG2 ILE A 19 24.780 14.002 10.838 1.00 52.10 ATOM 327 CG1 ILE A 19 21.466 13.257 11.396 1.00 62.53 ATOM 328 2HG1 ILE A 19 21.256 13.241 10.338 1.00 33.11 ATOM 329 3HG1 ILE A 19 20.981 12.414 11.868 1.00 42.24 ATOM 330 CD1 ILE A 19 20.866 14.521 11.970 1.00 64.11 ATOM 331 1HD1 ILE A 19 21.312 14.727 12.932 1.00 61.21 ATOM 332 2HD1 ILE A 19 21.056 15.346 11.300 1.00 14.22 ATOM 333 3HD1 ILE A 19 19.800 14.391 12.089 1.00 40.42 ATOM 334 C ILE A 19 22.875 10.759 12.331 1.00 14.04 ATOM 335 O ILE A 19 21.885 10.075 12.070 1.00 15.55 ATOM 336 N ARG A 20 23.494 10.717 13.507 1.00 51.04 ATOM 337 H ARG A 20 24.278 11.286 13.655 1.00 63.24 ATOM 338 CA ARG A 20 23.036 9.844 14.581 1.00 53.51 ATOM 339 HA ARG A 20 22.139 9.346 14.244 1.00 11.43 ATOM 340 CB ARG A 20 24.099 8.792 14.901 1.00 41.15 ATOM 341 2HB ARG A 20 24.982 9.291 15.272 1.00 65.33 ATOM 342 3HB ARG A 20 23.718 8.134 15.667 1.00 10.30 ATOM 343 CG ARG A 20 24.498 7.946 13.702 1.00 5.44 ATOM 344 2HG ARG A 20 24.855 8.597 12.917 1.00 35.30 ATOM 345 3HG ARG A 20 25.287 7.270 13.998 1.00 52.31 ATOM 346 CD ARG A 20 23.324 7.137 13.175 1.00 12.32 ATOM 347 2HD ARG A 20 22.513 7.812 12.945 1.00 43.41 ATOM 348 3HD ARG A 20 23.632 6.625 12.276 1.00 31.00 ATOM 349 NE ARG A 20 22.858 6.152 14.147 1.00 31.21 ATOM 350 HE ARG A 20 23.386 6.035 14.964 1.00 61.23 ATOM 351 CZ ARG A 20 21.765 5.415 13.981 1.00 42.05 ATOM 352 NH1 ARG A 20 21.030 5.551 12.885 1.00 3.45 ATOM 353 1HH1 ARG A 20 21.299 6.210 12.183 1.00 61.12 ATOM 354 2HH1 ARG A 20 20.209 4.994 12.762 1.00 54.51 ATOM 355 NH2 ARG A 20 21.406 4.539 14.910 1.00 1.13 ATOM 356 1HH2 ARG A 20 21.958 4.433 15.737 1.00 52.30 ATOM 357 2HH2 ARG A 20 20.584 3.985 14.784 1.00 13.21 ATOM 358 C ARG A 20 22.710 10.651 15.835 1.00 72.14 ATOM 359 O ARG A 20 22.955 10.202 16.954 1.00 2.15 ATOM 360 N ARG A 21 22.156 11.843 15.638 1.00 44.01 ATOM 361 H ARG A 21 21.985 12.146 14.721 1.00 22.45 ATOM 362 CA ARG A 21 21.799 12.713 16.752 1.00 33.51 ATOM 363 HA ARG A 21 22.422 12.448 17.593 1.00 43.22 ATOM 364 CB ARG A 21 22.051 14.176 16.386 1.00 42.30 ATOM 365 2HB ARG A 21 22.947 14.236 15.785 1.00 75.34 ATOM 366 3HB ARG A 21 21.215 14.540 15.808 1.00 33.45 ATOM 367 CG ARG A 21 22.228 15.084 17.592 1.00 14.02 ATOM 368 2HG ARG A 21 22.740 14.538 18.370 1.00 31.25 ATOM 369 3HG ARG A 21 22.818 15.941 17.303 1.00 73.22 ATOM 370 CD ARG A 21 20.888 15.564 18.129 1.00 22.31 ATOM 371 2HD ARG A 21 20.249 15.812 17.295 1.00 70.41 ATOM 372 3HD ARG A 21 20.439 14.766 18.702 1.00 50.31 ATOM 373 NE ARG A 21 21.030 16.740 18.983 1.00 63.01 ATOM 374 HE ARG A 21 21.928 16.960 19.306 1.00 3.33 ATOM 375 CZ ARG A 21 20.013 17.517 19.338 1.00 4.24 ATOM 376 NH1 ARG A 21 18.787 17.244 18.916 1.00 34.12 ATOM 377 1HH1 ARG A 21 18.626 16.451 18.329 1.00 31.43 ATOM 378 2HH1 ARG A 21 18.022 17.830 19.186 1.00 4.23 ATOM 379 NH2 ARG A 21 20.223 18.570 20.118 1.00 14.23 ATOM 380 1HH2 ARG A 21 21.146 18.779 20.439 1.00 50.23 ATOM 381 2HH2 ARG A 21 19.457 19.155 20.385 1.00 32.51 ATOM 382 C ARG A 21 20.337 12.520 17.144 1.00 14.12 ATOM 383 O ARG A 21 20.009 12.416 18.326 1.00 62.12 ATOM 384 N ALA A 22 19.462 12.475 16.144 1.00 23.43 ATOM 385 H ALA A 22 19.784 12.564 15.223 1.00 24.43 ATOM 386 CA ALA A 22 18.036 12.293 16.384 1.00 0.44 ATOM 387 HA ALA A 22 17.815 12.661 17.376 1.00 22.02 ATOM 388 CB ALA A 22 17.225 13.108 15.387 1.00 3.03 ATOM 389 1HB ALA A 22 17.128 14.122 15.747 1.00 11.11 ATOM 390 2HB ALA A 22 17.728 13.111 14.432 1.00 44.31 ATOM 391 3HB ALA A 22 16.245 12.669 15.277 1.00 0.21 ATOM 392 C ALA A 22 17.649 10.821 16.306 1.00 71.51 ATOM 393 O ALA A 22 17.467 10.274 15.218 1.00 23.32 ATOM 394 N SER A 23 17.525 10.183 17.466 1.00 51.41 ATOM 395 H SER A 23 17.683 10.674 18.300 1.00 53.13 ATOM 396 CA SER A 23 17.164 8.772 17.528 1.00 53.00 ATOM 397 HA SER A 23 16.905 8.452 16.530 1.00 75.02 ATOM 398 CB SER A 23 18.349 7.942 18.025 1.00 33.02 ATOM 399 2HB SER A 23 19.264 8.348 17.622 1.00 72.24 ATOM 400 3HB SER A 23 18.383 7.980 19.104 1.00 22.55 ATOM 401 OG SER A 23 18.230 6.590 17.619 1.00 64.43 ATOM 402 HG SER A 23 17.947 6.554 16.702 1.00 15.23 ATOM 403 C SER A 23 15.960 8.559 18.441 1.00 21.01 ATOM 404 O SER A 23 16.073 8.025 19.545 1.00 53.22 ATOM 405 N PRO A 24 14.779 8.986 17.971 1.00 52.22 ATOM 406 CD PRO A 24 14.571 9.632 16.664 1.00 73.53 ATOM 407 CA PRO A 24 13.531 8.853 18.728 1.00 55.12 ATOM 408 HA PRO A 24 13.619 9.279 19.717 1.00 51.04 ATOM 409 CB PRO A 24 12.529 9.668 17.906 1.00 11.53 ATOM 410 2HB PRO A 24 11.555 9.201 17.954 1.00 2.24 ATOM 411 3HB PRO A 24 12.472 10.674 18.296 1.00 34.41 ATOM 412 CG PRO A 24 13.074 9.652 16.520 1.00 50.41 ATOM 413 2HG PRO A 24 12.735 8.768 16.002 1.00 14.41 ATOM 414 3HG PRO A 24 12.761 10.541 15.993 1.00 50.44 ATOM 415 2HD PRO A 24 15.018 9.050 15.871 1.00 12.20 ATOM 416 3HD PRO A 24 14.964 10.638 16.664 1.00 32.53 ATOM 417 C PRO A 24 13.072 7.403 18.840 1.00 43.10 ATOM 418 O PRO A 24 12.386 6.887 17.957 1.00 41.30 ATOM 419 N THR A 25 13.456 6.749 19.932 1.00 35.20 ATOM 420 H THR A 25 14.002 7.214 20.600 1.00 55.03 ATOM 421 CA THR A 25 13.085 5.358 20.159 1.00 34.23 ATOM 422 HA THR A 25 12.687 4.963 19.235 1.00 0.44 ATOM 423 CB THR A 25 14.306 4.509 20.562 1.00 54.35 ATOM 424 HB THR A 25 13.958 3.546 20.906 1.00 73.11 ATOM 425 OG1 THR A 25 15.022 5.153 21.621 1.00 0.21 ATOM 426 HG1 THR A 25 14.768 4.764 22.462 1.00 41.53 ATOM 427 CG2 THR A 25 15.231 4.296 19.373 1.00 22.44 ATOM 428 1HG2 THR A 25 14.653 3.974 18.520 1.00 50.13 ATOM 429 2HG2 THR A 25 15.963 3.540 19.618 1.00 13.13 ATOM 430 3HG2 THR A 25 15.734 5.221 19.139 1.00 43.44 ATOM 431 C THR A 25 12.020 5.243 21.245 1.00 64.14 ATOM 432 O THR A 25 11.900 4.210 21.904 1.00 65.20 TER 433 THR A 25 END
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