Browse entries in the PDBbind-CN Database
HEADER 1HMT_COMPLEX COMPND 1HMT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 131 VAL ASP ALA PHE LEU GLY THR TRP LYS LEU VAL ASP SER SEQRES 2 A 131 LYS ASN PHE ASP ASP TYR MET LYS SER LEU GLY VAL GLY SEQRES 3 A 131 PHE ALA THR ARG GLN VAL ALA SER MET THR LYS PRO THR SEQRES 4 A 131 THR ILE ILE GLU LYS ASN GLY ASP ILE LEU THR LEU LYS SEQRES 5 A 131 THR HIS SER THR PHE LYS ASN THR GLU ILE SER PHE LYS SEQRES 6 A 131 LEU GLY VAL GLU PHE ASP GLU THR THR ALA ASP ASP ARG SEQRES 7 A 131 LYS VAL LYS SER ILE VAL THR LEU ASP GLY GLY LYS LEU SEQRES 8 A 131 VAL HIS LEU GLN LYS TRP ASP GLY GLN GLU THR THR LEU SEQRES 9 A 131 VAL ARG GLU LEU ILE ASP GLY LYS LEU ILE LEU THR LEU SEQRES 10 A 131 THR HIS GLY THR ALA VAL CYS THR ARG THR TYR GLU LYS SEQRES 11 A 131 GLU HET STE A 320 55 ATOM 1 N VAL A 1 21.895 39.503 33.657 1.00 26.12 N ATOM 2 CA VAL A 1 21.210 39.592 34.954 1.00 14.87 C ATOM 3 C VAL A 1 19.735 39.327 34.914 1.00 14.63 C ATOM 4 O VAL A 1 19.104 39.068 35.949 1.00 15.04 O ATOM 5 CB VAL A 1 21.552 40.793 35.803 1.00 20.40 C ATOM 6 CG1 VAL A 1 20.697 42.001 35.668 1.00 24.96 C ATOM 7 CG2 VAL A 1 21.974 40.488 37.186 1.00 30.84 C ATOM 8 HA VAL A 1 21.652 38.746 35.480 1.00 0.00 H ATOM 9 HB VAL A 1 22.462 41.126 35.304 1.00 0.00 H ATOM 10 HG11 VAL A 1 20.734 42.358 34.639 1.00 0.00 H ATOM 11 HG12 VAL A 1 19.669 41.748 35.929 1.00 0.00 H ATOM 12 HG13 VAL A 1 21.063 42.780 36.337 1.00 0.00 H ATOM 13 HG21 VAL A 1 21.171 39.962 37.702 1.00 0.00 H ATOM 14 HG22 VAL A 1 22.865 39.861 37.163 1.00 0.00 H ATOM 15 HG23 VAL A 1 22.196 41.418 37.710 1.00 0.00 H ATOM 16 HN3 VAL A 1 21.485 40.199 33.002 1.00 0.00 H ATOM 17 HN2 VAL A 1 21.775 38.546 33.268 1.00 0.00 H ATOM 18 HN1 VAL A 1 22.908 39.701 33.787 1.00 0.00 H ATOM 19 N ASP A 2 19.096 39.459 33.743 1.00 14.12 N ATOM 20 CA ASP A 2 17.647 39.561 33.700 1.00 14.96 C ATOM 21 C ASP A 2 16.897 38.316 34.100 1.00 16.00 C ATOM 22 O ASP A 2 15.762 38.390 34.575 1.00 16.41 O ATOM 23 CB ASP A 2 17.185 40.043 32.347 1.00 18.49 C ATOM 24 CG ASP A 2 17.662 41.451 32.017 1.00 24.37 C ATOM 25 OD1 ASP A 2 17.128 42.424 32.616 1.00 27.07 O ATOM 26 OD2 ASP A 2 18.463 41.546 31.132 1.00 27.90 O ATOM 27 HA ASP A 2 17.401 40.296 34.467 1.00 0.00 H ATOM 28 HB2 ASP A 2 17.566 39.361 31.587 1.00 0.00 H ATOM 29 HB3 ASP A 2 16.095 40.033 32.329 1.00 0.00 H ATOM 30 H ASP A 2 19.642 39.489 32.858 1.00 0.00 H ATOM 31 N ALA A 3 17.530 37.150 33.991 1.00 15.43 N ATOM 32 CA ALA A 3 16.829 35.927 34.367 1.00 19.25 C ATOM 33 C ALA A 3 16.717 35.760 35.864 1.00 14.01 C ATOM 34 O ALA A 3 15.889 34.970 36.308 1.00 15.92 O ATOM 35 CB ALA A 3 17.540 34.731 33.766 1.00 24.21 C ATOM 36 HA ALA A 3 15.814 35.998 33.976 1.00 0.00 H ATOM 37 HB1 ALA A 3 17.551 34.825 32.680 1.00 0.00 H ATOM 38 HB2 ALA A 3 18.563 34.693 34.139 1.00 0.00 H ATOM 39 HB3 ALA A 3 17.015 33.818 34.048 1.00 0.00 H ATOM 40 H ALA A 3 18.509 37.111 33.643 1.00 0.00 H ATOM 41 N PHE A 4 17.555 36.479 36.613 1.00 12.68 N ATOM 42 CA PHE A 4 17.422 36.427 38.087 1.00 11.03 C ATOM 43 C PHE A 4 16.301 37.266 38.615 1.00 9.76 C ATOM 44 O PHE A 4 15.972 37.123 39.837 1.00 12.27 O ATOM 45 CB PHE A 4 18.746 36.961 38.720 1.00 14.74 C ATOM 46 CG PHE A 4 19.898 36.016 38.517 1.00 14.62 C ATOM 47 CD1 PHE A 4 20.077 34.943 39.398 1.00 14.25 C ATOM 48 CD2 PHE A 4 20.803 36.159 37.494 1.00 14.76 C ATOM 49 CE1 PHE A 4 21.132 34.082 39.227 1.00 16.28 C ATOM 50 CE2 PHE A 4 21.893 35.317 37.342 1.00 16.29 C ATOM 51 CZ PHE A 4 22.021 34.267 38.190 1.00 15.65 C ATOM 52 HA PHE A 4 17.213 35.390 38.349 1.00 0.00 H ATOM 53 HB2 PHE A 4 18.993 37.918 38.261 1.00 0.00 H ATOM 54 HB3 PHE A 4 18.592 37.101 39.790 1.00 0.00 H ATOM 55 HD2 PHE A 4 20.658 36.965 36.775 1.00 0.00 H ATOM 56 HE2 PHE A 4 22.630 35.495 36.559 1.00 0.00 H ATOM 57 HZ PHE A 4 22.838 33.559 38.050 1.00 0.00 H ATOM 58 HE1 PHE A 4 21.268 33.247 39.915 1.00 0.00 H ATOM 59 HD1 PHE A 4 19.378 34.791 40.220 1.00 0.00 H ATOM 60 H PHE A 4 18.290 37.066 36.169 1.00 0.00 H ATOM 61 N LEU A 5 15.796 38.232 37.883 1.00 11.23 N ATOM 62 CA LEU A 5 14.829 39.188 38.410 1.00 12.03 C ATOM 63 C LEU A 5 13.475 38.511 38.683 1.00 10.84 C ATOM 64 O LEU A 5 13.039 37.639 37.975 1.00 14.42 O ATOM 65 CB LEU A 5 14.585 40.304 37.369 1.00 13.07 C ATOM 66 CG LEU A 5 15.783 41.085 36.938 1.00 13.27 C ATOM 67 CD1 LEU A 5 15.423 42.131 35.915 1.00 17.83 C ATOM 68 CD2 LEU A 5 16.631 41.660 38.069 1.00 17.16 C ATOM 69 HA LEU A 5 15.235 39.592 39.337 1.00 0.00 H ATOM 70 HB2 LEU A 5 14.154 39.841 36.481 1.00 0.00 H ATOM 71 HB3 LEU A 5 13.868 41.005 37.796 1.00 0.00 H ATOM 72 HG LEU A 5 16.435 40.349 36.467 1.00 0.00 H ATOM 73 HD21 LEU A 5 16.022 42.335 38.671 1.00 0.00 H ATOM 74 HD22 LEU A 5 17.000 40.847 38.694 1.00 0.00 H ATOM 75 HD23 LEU A 5 17.474 42.208 37.647 1.00 0.00 H ATOM 76 HD11 LEU A 5 14.993 41.647 35.038 1.00 0.00 H ATOM 77 HD12 LEU A 5 14.697 42.822 36.343 1.00 0.00 H ATOM 78 HD13 LEU A 5 16.320 42.678 35.626 1.00 0.00 H ATOM 79 H LEU A 5 16.097 38.319 36.891 1.00 0.00 H ATOM 80 N GLY A 6 12.909 38.906 39.810 1.00 9.27 N ATOM 81 CA GLY A 6 11.588 38.482 40.201 1.00 10.55 C ATOM 82 C GLY A 6 11.489 38.143 41.689 1.00 8.96 C ATOM 83 O GLY A 6 12.379 38.527 42.444 1.00 10.21 O ATOM 84 HA3 GLY A 6 11.321 37.597 39.624 1.00 0.00 H ATOM 85 HA2 GLY A 6 10.885 39.285 39.979 1.00 0.00 H ATOM 86 H GLY A 6 13.436 39.546 40.438 1.00 0.00 H ATOM 87 N THR A 7 10.460 37.416 42.042 1.00 9.44 N ATOM 88 CA THR A 7 10.158 37.031 43.416 1.00 11.80 C ATOM 89 C THR A 7 10.336 35.487 43.546 1.00 9.84 C ATOM 90 O THR A 7 9.781 34.770 42.736 1.00 12.42 O ATOM 91 CB THR A 7 8.707 37.375 43.755 1.00 12.57 C ATOM 92 OG1 THR A 7 8.594 38.841 43.646 1.00 14.51 O ATOM 93 CG2 THR A 7 8.420 37.029 45.201 1.00 15.46 C ATOM 94 HA THR A 7 10.825 37.564 44.093 1.00 0.00 H ATOM 95 HB THR A 7 8.026 36.835 43.097 1.00 0.00 H ATOM 96 HG1 THR A 7 8.820 39.121 42.724 1.00 0.00 H ATOM 97 HG23 THR A 7 8.491 35.950 45.336 1.00 0.00 H ATOM 98 HG21 THR A 7 9.147 37.525 45.843 1.00 0.00 H ATOM 99 HG22 THR A 7 7.416 37.364 45.461 1.00 0.00 H ATOM 100 H THR A 7 9.815 37.091 41.294 1.00 0.00 H ATOM 101 N TRP A 8 11.109 35.128 44.515 1.00 9.42 N ATOM 102 CA TRP A 8 11.526 33.723 44.723 1.00 10.49 C ATOM 103 C TRP A 8 11.172 33.270 46.125 1.00 10.90 C ATOM 104 O TRP A 8 11.382 34.063 47.048 1.00 12.13 O ATOM 105 CB TRP A 8 13.058 33.682 44.533 1.00 10.37 C ATOM 106 CG TRP A 8 13.530 34.120 43.194 1.00 9.48 C ATOM 107 CD1 TRP A 8 13.884 35.398 42.824 1.00 11.19 C ATOM 108 CD2 TRP A 8 13.693 33.290 42.039 1.00 10.18 C ATOM 109 NE1 TRP A 8 14.262 35.392 41.473 1.00 12.32 N ATOM 110 CE2 TRP A 8 14.157 34.112 41.000 1.00 11.07 C ATOM 111 CE3 TRP A 8 13.498 31.929 41.789 1.00 11.38 C ATOM 112 CZ2 TRP A 8 14.417 33.602 39.714 1.00 12.42 C ATOM 113 CZ3 TRP A 8 13.780 31.451 40.543 1.00 13.15 C ATOM 114 CH2 TRP A 8 14.242 32.289 39.536 1.00 13.84 C ATOM 115 HA TRP A 8 11.020 33.061 44.020 1.00 0.00 H ATOM 116 HB2 TRP A 8 13.511 34.332 45.282 1.00 0.00 H ATOM 117 HB3 TRP A 8 13.393 32.657 44.693 1.00 0.00 H ATOM 118 HE1 TRP A 8 14.570 36.220 40.924 1.00 0.00 H ATOM 119 HD1 TRP A 8 13.872 36.272 43.475 1.00 0.00 H ATOM 120 HZ2 TRP A 8 14.746 34.248 38.900 1.00 0.00 H ATOM 121 HH2 TRP A 8 14.471 31.858 38.561 1.00 0.00 H ATOM 122 HZ3 TRP A 8 13.640 30.391 40.333 1.00 0.00 H ATOM 123 HE3 TRP A 8 13.129 31.265 42.571 1.00 0.00 H ATOM 124 H TRP A 8 11.452 35.854 45.176 1.00 0.00 H ATOM 125 N LYS A 9 10.749 32.051 46.325 1.00 11.33 N ATOM 126 CA LYS A 9 10.464 31.563 47.659 1.00 10.74 C ATOM 127 C LYS A 9 11.265 30.313 47.984 1.00 10.69 C ATOM 128 O LYS A 9 11.479 29.447 47.101 1.00 11.31 O ATOM 129 CB LYS A 9 8.964 31.225 47.762 1.00 17.96 C ATOM 130 CG LYS A 9 8.125 32.543 47.833 1.00 24.70 C ATOM 131 CD LYS A 9 6.840 32.272 48.596 1.00 32.37 C ATOM 132 CE LYS A 9 5.854 33.383 48.537 1.00 37.42 C ATOM 133 NZ LYS A 9 6.280 34.584 49.280 1.00 39.75 N ATOM 134 HA LYS A 9 10.740 32.344 48.368 1.00 0.00 H ATOM 135 HB2 LYS A 9 8.662 30.650 46.886 1.00 0.00 H ATOM 136 HB3 LYS A 9 8.787 30.635 48.661 1.00 0.00 H ATOM 137 HG2 LYS A 9 8.699 33.315 48.346 1.00 0.00 H ATOM 138 HG3 LYS A 9 7.887 32.880 46.824 1.00 0.00 H ATOM 139 HD2 LYS A 9 6.375 31.379 48.178 1.00 0.00 H ATOM 140 HD3 LYS A 9 7.093 32.094 49.641 1.00 0.00 H ATOM 141 HE2 LYS A 9 4.912 33.032 48.958 1.00 0.00 H ATOM 142 HE3 LYS A 9 5.704 33.657 47.493 1.00 0.00 H ATOM 143 HZ1 LYS A 9 6.417 34.340 50.282 1.00 0.00 H ATOM 144 HZ2 LYS A 9 7.174 34.937 48.882 1.00 0.00 H ATOM 145 HZ3 LYS A 9 5.548 35.319 49.198 1.00 0.00 H ATOM 146 H LYS A 9 10.614 31.418 45.511 1.00 0.00 H ATOM 147 N LEU A 10 11.741 30.206 49.232 1.00 10.30 N ATOM 148 CA LEU A 10 12.580 29.056 49.582 1.00 10.10 C ATOM 149 C LEU A 10 11.752 27.786 49.610 1.00 9.49 C ATOM 150 O LEU A 10 10.682 27.713 50.242 1.00 12.90 O ATOM 151 CB LEU A 10 13.213 29.300 50.950 1.00 11.27 C ATOM 152 CG LEU A 10 14.167 28.227 51.460 1.00 11.44 C ATOM 153 CD1 LEU A 10 15.532 28.395 50.914 1.00 15.37 C ATOM 154 CD2 LEU A 10 14.183 28.254 52.987 1.00 14.18 C ATOM 155 HA LEU A 10 13.362 28.937 48.832 1.00 0.00 H ATOM 156 HB2 LEU A 10 13.767 30.237 50.896 1.00 0.00 H ATOM 157 HB3 LEU A 10 12.406 29.398 51.676 1.00 0.00 H ATOM 158 HG LEU A 10 13.810 27.256 51.116 1.00 0.00 H ATOM 159 HD21 LEU A 10 14.517 29.234 53.328 1.00 0.00 H ATOM 160 HD22 LEU A 10 13.178 28.060 53.363 1.00 0.00 H ATOM 161 HD23 LEU A 10 14.865 27.487 53.356 1.00 0.00 H ATOM 162 HD11 LEU A 10 15.497 28.332 49.826 1.00 0.00 H ATOM 163 HD12 LEU A 10 15.923 29.368 51.210 1.00 0.00 H ATOM 164 HD13 LEU A 10 16.178 27.608 51.305 1.00 0.00 H ATOM 165 H LEU A 10 11.518 30.930 49.944 1.00 0.00 H ATOM 166 N VAL A 11 12.278 26.737 48.998 1.00 9.88 N ATOM 167 CA VAL A 11 11.586 25.436 48.996 1.00 10.89 C ATOM 168 C VAL A 11 12.442 24.331 49.576 1.00 12.51 C ATOM 169 O VAL A 11 11.880 23.241 49.852 1.00 16.94 O ATOM 170 CB VAL A 11 11.063 25.106 47.629 1.00 12.90 C ATOM 171 CG1 VAL A 11 10.036 26.085 47.095 1.00 15.35 C ATOM 172 CG2 VAL A 11 12.181 24.927 46.599 1.00 15.27 C ATOM 173 HA VAL A 11 10.724 25.520 49.657 1.00 0.00 H ATOM 174 HB VAL A 11 10.552 24.154 47.774 1.00 0.00 H ATOM 175 HG11 VAL A 11 9.177 26.111 47.766 1.00 0.00 H ATOM 176 HG12 VAL A 11 10.480 27.078 47.034 1.00 0.00 H ATOM 177 HG13 VAL A 11 9.715 25.767 46.103 1.00 0.00 H ATOM 178 HG21 VAL A 11 12.756 25.850 46.524 1.00 0.00 H ATOM 179 HG22 VAL A 11 12.836 24.114 46.913 1.00 0.00 H ATOM 180 HG23 VAL A 11 11.745 24.690 45.629 1.00 0.00 H ATOM 181 H VAL A 11 13.192 26.832 48.512 1.00 0.00 H ATOM 182 N ASP A 12 13.736 24.498 49.696 1.00 10.58 N ATOM 183 CA ASP A 12 14.622 23.459 50.238 1.00 10.25 C ATOM 184 C ASP A 12 15.889 24.123 50.815 1.00 9.31 C ATOM 185 O ASP A 12 16.386 25.123 50.314 1.00 11.42 O ATOM 186 CB ASP A 12 15.033 22.480 49.131 1.00 11.58 C ATOM 187 CG ASP A 12 15.775 21.258 49.665 1.00 13.39 C ATOM 188 OD1 ASP A 12 15.166 20.495 50.403 1.00 18.64 O ATOM 189 OD2 ASP A 12 17.002 21.152 49.511 1.00 17.10 O ATOM 190 HA ASP A 12 14.092 22.914 51.019 1.00 0.00 H ATOM 191 HB2 ASP A 12 14.135 22.143 48.613 1.00 0.00 H ATOM 192 HB3 ASP A 12 15.682 23.002 48.428 1.00 0.00 H ATOM 193 H ASP A 12 14.153 25.402 49.396 1.00 0.00 H ATOM 194 N SER A 13 16.434 23.474 51.867 1.00 9.60 N ATOM 195 CA SER A 13 17.646 23.960 52.485 1.00 9.74 C ATOM 196 C SER A 13 18.481 22.801 53.027 1.00 9.44 C ATOM 197 O SER A 13 17.894 21.954 53.721 1.00 11.08 O ATOM 198 CB SER A 13 17.307 24.911 53.639 1.00 11.23 C ATOM 199 OG SER A 13 18.503 25.522 54.132 1.00 11.60 O ATOM 200 HA SER A 13 18.220 24.491 51.725 1.00 0.00 H ATOM 201 HB2 SER A 13 16.830 24.350 54.442 1.00 0.00 H ATOM 202 HB3 SER A 13 16.626 25.684 53.283 1.00 0.00 H ATOM 203 HG SER A 13 19.121 24.820 54.457 1.00 0.00 H ATOM 204 H SER A 13 15.976 22.616 52.236 1.00 0.00 H ATOM 205 N LYS A 14 19.754 22.805 52.729 1.00 9.82 N ATOM 206 CA LYS A 14 20.666 21.764 53.257 1.00 10.69 C ATOM 207 C LYS A 14 21.863 22.429 53.940 1.00 10.43 C ATOM 208 O LYS A 14 22.505 23.299 53.338 1.00 10.15 O ATOM 209 CB LYS A 14 21.157 20.879 52.126 1.00 14.04 C ATOM 210 CG LYS A 14 20.025 20.107 51.419 1.00 17.84 C ATOM 211 CD LYS A 14 20.455 19.222 50.334 1.00 22.27 C ATOM 212 CE LYS A 14 19.303 18.211 50.026 1.00 23.51 C ATOM 213 NZ LYS A 14 18.376 18.787 49.056 1.00 23.77 N ATOM 214 HA LYS A 14 20.126 21.153 53.980 1.00 0.00 H ATOM 215 HB2 LYS A 14 21.661 21.506 51.390 1.00 0.00 H ATOM 216 HB3 LYS A 14 21.866 20.158 52.533 1.00 0.00 H ATOM 217 HG2 LYS A 14 19.513 19.501 52.166 1.00 0.00 H ATOM 218 HG3 LYS A 14 19.328 20.835 51.004 1.00 0.00 H ATOM 219 HD2 LYS A 14 20.674 19.812 49.444 1.00 0.00 H ATOM 220 HD3 LYS A 14 21.350 18.678 50.637 1.00 0.00 H ATOM 221 HE2 LYS A 14 18.766 17.984 50.947 1.00 0.00 H ATOM 222 HE3 LYS A 14 19.727 17.293 49.619 1.00 0.00 H ATOM 223 HZ1 LYS A 14 17.969 19.661 49.445 1.00 0.00 H ATOM 224 HZ2 LYS A 14 18.887 19.002 48.176 1.00 0.00 H ATOM 225 HZ3 LYS A 14 17.615 18.106 48.859 1.00 0.00 H ATOM 226 H LYS A 14 20.132 23.551 52.111 1.00 0.00 H ATOM 227 N ASN A 15 22.124 22.047 55.201 1.00 8.12 N ATOM 228 CA ASN A 15 23.271 22.429 55.928 1.00 8.15 C ATOM 229 C ASN A 15 23.328 23.905 56.290 1.00 9.08 C ATOM 230 O ASN A 15 24.414 24.392 56.585 1.00 9.87 O ATOM 231 CB ASN A 15 24.563 22.027 55.219 1.00 10.55 C ATOM 232 CG ASN A 15 24.557 20.536 54.862 1.00 15.69 C ATOM 233 OD1 ASN A 15 24.121 19.708 55.604 1.00 18.49 O ATOM 234 ND2 ASN A 15 25.114 20.259 53.664 1.00 26.38 N ATOM 235 HA ASN A 15 23.182 21.878 56.864 1.00 0.00 H ATOM 236 HB2 ASN A 15 24.664 22.612 54.305 1.00 0.00 H ATOM 237 HB3 ASN A 15 25.408 22.233 55.876 1.00 0.00 H ATOM 238 HD22 ASN A 15 25.474 21.031 53.067 1.00 0.00 H ATOM 239 HD21 ASN A 15 25.183 19.274 53.338 1.00 0.00 H ATOM 240 H ASN A 15 21.434 21.428 55.673 1.00 0.00 H ATOM 241 N PHE A 16 22.162 24.528 56.434 1.00 9.11 N ATOM 242 CA PHE A 16 22.215 25.963 56.838 1.00 8.62 C ATOM 243 C PHE A 16 22.706 26.079 58.242 1.00 8.49 C ATOM 244 O PHE A 16 23.382 27.057 58.598 1.00 10.07 O ATOM 245 CB PHE A 16 20.832 26.591 56.625 1.00 9.12 C ATOM 246 CG PHE A 16 20.739 28.090 56.760 1.00 10.19 C ATOM 247 CD1 PHE A 16 21.708 28.900 56.219 1.00 12.97 C ATOM 248 CD2 PHE A 16 19.629 28.650 57.374 1.00 11.83 C ATOM 249 CE1 PHE A 16 21.592 30.281 56.274 1.00 14.53 C ATOM 250 CE2 PHE A 16 19.484 30.033 57.415 1.00 13.78 C ATOM 251 CZ PHE A 16 20.436 30.808 56.816 1.00 14.21 C ATOM 252 HA PHE A 16 22.923 26.515 56.220 1.00 0.00 H ATOM 253 HB2 PHE A 16 20.501 26.329 55.620 1.00 0.00 H ATOM 254 HB3 PHE A 16 20.153 26.151 57.356 1.00 0.00 H ATOM 255 HD2 PHE A 16 18.872 28.008 57.824 1.00 0.00 H ATOM 256 HE2 PHE A 16 18.629 30.488 57.914 1.00 0.00 H ATOM 257 HZ PHE A 16 20.277 31.885 56.764 1.00 0.00 H ATOM 258 HE1 PHE A 16 22.386 30.928 55.902 1.00 0.00 H ATOM 259 HD1 PHE A 16 22.579 28.452 55.741 1.00 0.00 H ATOM 260 H PHE A 16 21.258 24.039 56.273 1.00 0.00 H ATOM 261 N ASP A 17 22.397 25.120 59.112 1.00 10.24 N ATOM 262 CA ASP A 17 22.898 25.182 60.477 1.00 9.49 C ATOM 263 C ASP A 17 24.413 25.241 60.524 1.00 10.75 C ATOM 264 O ASP A 17 25.011 25.978 61.322 1.00 12.38 O ATOM 265 CB ASP A 17 22.375 24.054 61.334 1.00 10.42 C ATOM 266 CG ASP A 17 22.618 24.218 62.809 1.00 13.08 C ATOM 267 OD1 ASP A 17 22.103 25.178 63.401 1.00 14.73 O ATOM 268 OD2 ASP A 17 23.340 23.416 63.387 1.00 17.49 O ATOM 269 HA ASP A 17 22.516 26.112 60.898 1.00 0.00 H ATOM 270 HB2 ASP A 17 21.300 23.976 61.174 1.00 0.00 H ATOM 271 HB3 ASP A 17 22.857 23.131 61.011 1.00 0.00 H ATOM 272 H ASP A 17 21.796 24.325 58.816 1.00 0.00 H ATOM 273 N ASP A 18 25.067 24.405 59.771 1.00 13.01 N ATOM 274 CA ASP A 18 26.523 24.349 59.708 1.00 12.70 C ATOM 275 C ASP A 18 27.107 25.682 59.310 1.00 11.33 C ATOM 276 O ASP A 18 28.102 26.122 59.869 1.00 13.71 O ATOM 277 CB ASP A 18 26.971 23.282 58.686 1.00 15.98 C ATOM 278 CG ASP A 18 26.635 21.873 59.030 1.00 30.18 C ATOM 279 OD1 ASP A 18 26.796 21.413 60.169 1.00 38.60 O ATOM 280 OD2 ASP A 18 26.340 21.095 58.071 1.00 43.53 O ATOM 281 HA ASP A 18 26.885 24.089 60.703 1.00 0.00 H ATOM 282 HB2 ASP A 18 26.500 23.515 57.731 1.00 0.00 H ATOM 283 HB3 ASP A 18 28.054 23.352 58.582 1.00 0.00 H ATOM 284 H ASP A 18 24.523 23.742 59.183 1.00 0.00 H ATOM 285 N TYR A 19 26.529 26.285 58.285 1.00 10.65 N ATOM 286 CA TYR A 19 26.876 27.584 57.826 1.00 10.60 C ATOM 287 C TYR A 19 26.763 28.672 58.899 1.00 10.47 C ATOM 288 O TYR A 19 27.695 29.449 59.145 1.00 12.35 O ATOM 289 CB TYR A 19 26.126 27.960 56.555 1.00 9.71 C ATOM 290 CG TYR A 19 26.540 29.309 55.979 1.00 9.22 C ATOM 291 CD1 TYR A 19 27.713 29.498 55.274 1.00 8.95 C ATOM 292 CD2 TYR A 19 25.718 30.402 56.147 1.00 10.44 C ATOM 293 CE1 TYR A 19 28.079 30.737 54.754 1.00 8.78 C ATOM 294 CE2 TYR A 19 26.069 31.640 55.654 1.00 10.90 C ATOM 295 CZ TYR A 19 27.214 31.812 54.958 1.00 10.13 C ATOM 296 OH TYR A 19 27.534 33.037 54.435 1.00 10.97 O ATOM 297 HA TYR A 19 27.936 27.528 57.579 1.00 0.00 H ATOM 298 HB3 TYR A 19 25.060 27.994 56.781 1.00 0.00 H ATOM 299 HB2 TYR A 19 26.313 27.192 55.804 1.00 0.00 H ATOM 300 HD2 TYR A 19 24.774 30.285 56.679 1.00 0.00 H ATOM 301 HE2 TYR A 19 25.413 32.493 55.828 1.00 0.00 H ATOM 302 HE1 TYR A 19 29.012 30.863 54.205 1.00 0.00 H ATOM 303 HD1 TYR A 19 28.376 28.647 55.119 1.00 0.00 H ATOM 304 HH TYR A 19 28.401 32.976 53.961 1.00 0.00 H ATOM 305 H TYR A 19 25.773 25.777 57.783 1.00 0.00 H ATOM 306 N MET A 20 25.603 28.724 59.544 1.00 9.67 N ATOM 307 CA MET A 20 25.394 29.681 60.639 1.00 11.04 C ATOM 308 C MET A 20 26.344 29.442 61.808 1.00 11.96 C ATOM 309 O MET A 20 26.890 30.370 62.347 1.00 13.30 O ATOM 310 CB MET A 20 23.953 29.677 61.126 1.00 11.31 C ATOM 311 CG MET A 20 22.916 30.121 60.115 1.00 12.72 C ATOM 312 SD MET A 20 21.245 30.220 60.788 1.00 12.54 S ATOM 313 CE MET A 20 20.795 28.486 60.836 1.00 13.42 C ATOM 314 HA MET A 20 25.615 30.665 60.225 1.00 0.00 H ATOM 315 HB2 MET A 20 23.706 28.661 61.435 1.00 0.00 H ATOM 316 HB3 MET A 20 23.888 30.343 61.987 1.00 0.00 H ATOM 317 HG2 MET A 20 22.913 29.410 59.289 1.00 0.00 H ATOM 318 HG3 MET A 20 23.197 31.106 59.743 1.00 0.00 H ATOM 319 HE1 MET A 20 20.835 28.073 59.828 1.00 0.00 H ATOM 320 HE2 MET A 20 21.493 27.949 61.478 1.00 0.00 H ATOM 321 HE3 MET A 20 19.784 28.385 61.231 1.00 0.00 H ATOM 322 H MET A 20 24.834 28.080 59.271 1.00 0.00 H ATOM 323 N LYS A 21 26.563 28.172 62.177 1.00 13.00 N ATOM 324 CA LYS A 21 27.489 27.855 63.270 1.00 12.79 C ATOM 325 C LYS A 21 28.872 28.441 62.949 1.00 12.16 C ATOM 326 O LYS A 21 29.554 28.940 63.801 1.00 14.92 O ATOM 327 CB LYS A 21 27.599 26.372 63.585 1.00 19.67 C ATOM 328 CG LYS A 21 26.556 25.730 64.442 1.00 23.77 C ATOM 329 CD LYS A 21 26.811 24.192 64.670 1.00 28.25 C ATOM 330 CE LYS A 21 25.865 23.637 65.701 1.00 29.03 C ATOM 331 NZ LYS A 21 26.061 22.177 66.016 1.00 38.96 N ATOM 332 HA LYS A 21 27.077 28.311 64.170 1.00 0.00 H ATOM 333 HB2 LYS A 21 27.599 25.843 62.632 1.00 0.00 H ATOM 334 HB3 LYS A 21 28.557 26.222 64.082 1.00 0.00 H ATOM 335 HG2 LYS A 21 26.547 26.229 65.411 1.00 0.00 H ATOM 336 HG3 LYS A 21 25.586 25.854 63.961 1.00 0.00 H ATOM 337 HD2 LYS A 21 26.664 23.662 63.729 1.00 0.00 H ATOM 338 HD3 LYS A 21 27.836 24.047 65.011 1.00 0.00 H ATOM 339 HE2 LYS A 21 24.847 23.772 65.335 1.00 0.00 H ATOM 340 HE3 LYS A 21 25.997 24.204 66.623 1.00 0.00 H ATOM 341 HZ1 LYS A 21 25.926 21.616 65.151 1.00 0.00 H ATOM 342 HZ2 LYS A 21 27.024 22.028 66.380 1.00 0.00 H ATOM 343 HZ3 LYS A 21 25.368 21.882 66.734 1.00 0.00 H ATOM 344 H LYS A 21 26.070 27.401 61.682 1.00 0.00 H ATOM 345 N SER A 22 29.318 28.238 61.693 1.00 11.69 N ATOM 346 CA SER A 22 30.646 28.648 61.289 1.00 12.24 C ATOM 347 C SER A 22 30.808 30.179 61.436 1.00 13.38 C ATOM 348 O SER A 22 31.912 30.649 61.706 1.00 15.45 O ATOM 349 CB SER A 22 30.903 28.233 59.840 1.00 12.85 C ATOM 350 OG SER A 22 32.222 28.439 59.432 1.00 13.52 O ATOM 351 HA SER A 22 31.373 28.157 61.936 1.00 0.00 H ATOM 352 HB2 SER A 22 30.246 28.813 59.192 1.00 0.00 H ATOM 353 HB3 SER A 22 30.670 27.173 59.737 1.00 0.00 H ATOM 354 HG SER A 22 32.830 27.910 60.007 1.00 0.00 H ATOM 355 H SER A 22 28.695 27.777 61.000 1.00 0.00 H ATOM 356 N LEU A 23 29.719 30.921 61.171 1.00 13.05 N ATOM 357 CA LEU A 23 29.738 32.346 61.272 1.00 13.91 C ATOM 358 C LEU A 23 29.598 32.822 62.719 1.00 14.74 C ATOM 359 O LEU A 23 29.742 34.032 62.971 1.00 19.79 O ATOM 360 CB LEU A 23 28.588 32.973 60.471 1.00 14.75 C ATOM 361 CG LEU A 23 28.684 32.943 58.967 1.00 14.91 C ATOM 362 CD1 LEU A 23 27.375 33.438 58.334 1.00 18.14 C ATOM 363 CD2 LEU A 23 29.877 33.701 58.483 1.00 18.60 C ATOM 364 HA LEU A 23 30.702 32.660 60.873 1.00 0.00 H ATOM 365 HB2 LEU A 23 27.673 32.449 60.750 1.00 0.00 H ATOM 366 HB3 LEU A 23 28.513 34.018 60.772 1.00 0.00 H ATOM 367 HG LEU A 23 28.827 31.910 58.649 1.00 0.00 H ATOM 368 HD21 LEU A 23 29.801 34.740 58.805 1.00 0.00 H ATOM 369 HD22 LEU A 23 30.781 33.256 58.897 1.00 0.00 H ATOM 370 HD23 LEU A 23 29.916 33.659 57.395 1.00 0.00 H ATOM 371 HD11 LEU A 23 26.554 32.794 58.650 1.00 0.00 H ATOM 372 HD12 LEU A 23 27.181 34.461 58.657 1.00 0.00 H ATOM 373 HD13 LEU A 23 27.464 33.409 57.248 1.00 0.00 H ATOM 374 H LEU A 23 28.840 30.445 60.885 1.00 0.00 H ATOM 375 N GLY A 24 29.285 31.930 63.622 1.00 15.76 N ATOM 376 CA GLY A 24 29.236 32.330 65.056 1.00 16.97 C ATOM 377 C GLY A 24 27.854 32.686 65.486 1.00 14.95 C ATOM 378 O GLY A 24 27.635 33.275 66.553 1.00 19.19 O ATOM 379 HA3 GLY A 24 29.885 33.193 65.204 1.00 0.00 H ATOM 380 HA2 GLY A 24 29.593 31.500 65.666 1.00 0.00 H ATOM 381 H GLY A 24 29.072 30.951 63.342 1.00 0.00 H ATOM 382 N VAL A 25 26.853 32.341 64.677 1.00 13.72 N ATOM 383 CA VAL A 25 25.450 32.611 65.054 1.00 14.17 C ATOM 384 C VAL A 25 25.013 31.753 66.214 1.00 13.78 C ATOM 385 O VAL A 25 25.223 30.532 66.236 1.00 16.53 O ATOM 386 CB VAL A 25 24.561 32.441 63.821 1.00 15.52 C ATOM 387 CG1 VAL A 25 23.078 32.582 64.169 1.00 16.19 C ATOM 388 CG2 VAL A 25 25.000 33.355 62.726 1.00 19.09 C ATOM 389 HA VAL A 25 25.357 33.640 65.402 1.00 0.00 H ATOM 390 HB VAL A 25 24.678 31.424 63.447 1.00 0.00 H ATOM 391 HG11 VAL A 25 22.803 31.820 64.899 1.00 0.00 H ATOM 392 HG12 VAL A 25 22.897 33.571 64.589 1.00 0.00 H ATOM 393 HG13 VAL A 25 22.481 32.455 63.266 1.00 0.00 H ATOM 394 HG21 VAL A 25 24.935 34.388 63.069 1.00 0.00 H ATOM 395 HG22 VAL A 25 26.030 33.125 62.454 1.00 0.00 H ATOM 396 HG23 VAL A 25 24.354 33.218 61.859 1.00 0.00 H ATOM 397 H VAL A 25 27.062 31.877 63.770 1.00 0.00 H ATOM 398 N GLY A 26 24.360 32.356 67.217 1.00 15.20 N ATOM 399 CA GLY A 26 23.975 31.667 68.416 1.00 17.54 C ATOM 400 C GLY A 26 22.843 30.689 68.249 1.00 16.24 C ATOM 401 O GLY A 26 22.059 30.764 67.303 1.00 14.82 O ATOM 402 HA3 GLY A 26 23.674 32.412 69.153 1.00 0.00 H ATOM 403 HA2 GLY A 26 24.843 31.121 68.787 1.00 0.00 H ATOM 404 H GLY A 26 24.123 33.364 67.123 1.00 0.00 H ATOM 405 N PHE A 27 22.755 29.709 69.175 1.00 15.86 N ATOM 406 CA PHE A 27 21.805 28.635 68.996 1.00 15.67 C ATOM 407 C PHE A 27 20.393 29.088 68.881 1.00 15.48 C ATOM 408 O PHE A 27 19.588 28.473 68.138 1.00 14.26 O ATOM 409 CB PHE A 27 21.989 27.523 70.073 1.00 17.53 C ATOM 410 CG PHE A 27 21.490 27.942 71.423 1.00 18.86 C ATOM 411 CD1 PHE A 27 20.127 27.809 71.715 1.00 22.59 C ATOM 412 CD2 PHE A 27 22.312 28.553 72.338 1.00 21.60 C ATOM 413 CE1 PHE A 27 19.625 28.276 72.898 1.00 24.84 C ATOM 414 CE2 PHE A 27 21.810 28.984 73.553 1.00 23.86 C ATOM 415 CZ PHE A 27 20.458 28.900 73.805 1.00 24.40 C ATOM 416 HA PHE A 27 22.034 28.195 68.025 1.00 0.00 H ATOM 417 HB2 PHE A 27 21.440 26.636 69.757 1.00 0.00 H ATOM 418 HB3 PHE A 27 23.050 27.284 70.151 1.00 0.00 H ATOM 419 HD2 PHE A 27 23.367 28.699 72.105 1.00 0.00 H ATOM 420 HE2 PHE A 27 22.482 29.389 74.309 1.00 0.00 H ATOM 421 HZ PHE A 27 20.046 29.326 74.720 1.00 0.00 H ATOM 422 HE1 PHE A 27 18.566 28.155 73.125 1.00 0.00 H ATOM 423 HD1 PHE A 27 19.463 27.331 70.995 1.00 0.00 H ATOM 424 H PHE A 27 23.369 29.728 70.014 1.00 0.00 H ATOM 425 N ALA A 28 19.965 30.140 69.594 1.00 16.90 N ATOM 426 CA ALA A 28 18.531 30.518 69.531 1.00 16.72 C ATOM 427 C ALA A 28 18.142 31.089 68.196 1.00 17.22 C ATOM 428 O ALA A 28 17.021 30.844 67.676 1.00 16.51 O ATOM 429 CB ALA A 28 18.163 31.466 70.676 1.00 20.98 C ATOM 430 HA ALA A 28 17.955 29.600 69.652 1.00 0.00 H ATOM 431 HB1 ALA A 28 18.354 30.973 71.629 1.00 0.00 H ATOM 432 HB2 ALA A 28 18.767 32.371 70.606 1.00 0.00 H ATOM 433 HB3 ALA A 28 17.107 31.726 70.605 1.00 0.00 H ATOM 434 H ALA A 28 20.628 30.683 70.183 1.00 0.00 H ATOM 435 N THR A 29 19.059 31.873 67.602 1.00 16.87 N ATOM 436 CA THR A 29 18.828 32.383 66.264 1.00 17.71 C ATOM 437 C THR A 29 18.810 31.268 65.247 1.00 14.11 C ATOM 438 O THR A 29 18.005 31.233 64.313 1.00 15.21 O ATOM 439 CB THR A 29 19.902 33.457 65.913 1.00 17.30 C ATOM 440 OG1 THR A 29 19.799 34.530 66.828 1.00 19.85 O ATOM 441 CG2 THR A 29 19.724 34.007 64.504 1.00 18.37 C ATOM 442 HA THR A 29 17.846 32.855 66.236 1.00 0.00 H ATOM 443 HB THR A 29 20.879 32.978 65.972 1.00 0.00 H ATOM 444 HG1 THR A 29 19.951 34.194 67.747 1.00 0.00 H ATOM 445 HG23 THR A 29 19.801 33.192 63.785 1.00 0.00 H ATOM 446 HG21 THR A 29 18.744 34.477 64.420 1.00 0.00 H ATOM 447 HG22 THR A 29 20.500 34.745 64.303 1.00 0.00 H ATOM 448 H THR A 29 19.937 32.115 68.104 1.00 0.00 H ATOM 449 N ARG A 30 19.704 30.282 65.444 1.00 14.44 N ATOM 450 CA ARG A 30 19.732 29.138 64.519 1.00 13.50 C ATOM 451 C ARG A 30 18.444 28.365 64.578 1.00 12.97 C ATOM 452 O ARG A 30 17.924 27.942 63.538 1.00 13.38 O ATOM 453 CB ARG A 30 20.936 28.260 64.800 1.00 14.14 C ATOM 454 CG ARG A 30 22.272 28.882 64.495 1.00 13.62 C ATOM 455 CD ARG A 30 23.432 27.949 64.424 1.00 16.05 C ATOM 456 NE ARG A 30 23.342 26.776 65.339 1.00 19.32 N ATOM 457 CZ ARG A 30 24.009 26.733 66.486 1.00 18.55 C ATOM 458 NH1 ARG A 30 24.735 27.787 66.898 1.00 22.70 N ATOM 459 NH2 ARG A 30 23.967 25.647 67.222 1.00 24.72 N ATOM 460 HA ARG A 30 19.830 29.515 63.501 1.00 0.00 H ATOM 461 HB2 ARG A 30 20.921 27.996 65.857 1.00 0.00 H ATOM 462 HB3 ARG A 30 20.841 27.355 64.200 1.00 0.00 H ATOM 463 HG2 ARG A 30 22.192 29.387 63.532 1.00 0.00 H ATOM 464 HG3 ARG A 30 22.483 29.616 65.273 1.00 0.00 H ATOM 465 HD2 ARG A 30 24.334 28.508 64.675 1.00 0.00 H ATOM 466 HD3 ARG A 30 23.508 27.578 63.402 1.00 0.00 H ATOM 467 HE ARG A 30 22.741 25.970 65.072 1.00 0.00 H ATOM 468 HH12 ARG A 30 25.253 27.741 67.799 1.00 0.00 H ATOM 469 HH11 ARG A 30 24.778 28.648 66.316 1.00 0.00 H ATOM 470 HH22 ARG A 30 24.488 25.608 68.121 1.00 0.00 H ATOM 471 HH21 ARG A 30 23.413 24.826 66.906 1.00 0.00 H ATOM 472 H ARG A 30 20.369 30.328 66.242 1.00 0.00 H ATOM 473 N GLN A 31 17.853 28.221 65.770 1.00 11.58 N ATOM 474 CA GLN A 31 16.549 27.571 65.871 1.00 14.65 C ATOM 475 C GLN A 31 15.532 28.235 64.953 1.00 15.09 C ATOM 476 O GLN A 31 14.822 27.583 64.206 1.00 17.10 O ATOM 477 CB GLN A 31 16.032 27.690 67.298 1.00 17.55 C ATOM 478 CG GLN A 31 16.267 26.729 68.268 1.00 26.83 C ATOM 479 CD GLN A 31 15.700 26.890 69.661 1.00 25.04 C ATOM 480 OE1 GLN A 31 14.615 27.474 69.791 1.00 32.17 O ATOM 481 NE2 GLN A 31 16.478 26.546 70.650 1.00 28.38 N ATOM 482 HA GLN A 31 16.674 26.527 65.582 1.00 0.00 H ATOM 483 HB2 GLN A 31 16.444 28.620 67.690 1.00 0.00 H ATOM 484 HB3 GLN A 31 14.948 27.779 67.219 1.00 0.00 H ATOM 485 HG2 GLN A 31 15.876 25.789 67.878 1.00 0.00 H ATOM 486 HG3 GLN A 31 17.349 26.654 68.378 1.00 0.00 H ATOM 487 HE22 GLN A 31 17.376 26.057 70.459 1.00 0.00 H ATOM 488 HE21 GLN A 31 16.200 26.761 71.629 1.00 0.00 H ATOM 489 H GLN A 31 18.324 28.573 66.628 1.00 0.00 H ATOM 490 N VAL A 32 15.364 29.553 65.109 1.00 15.59 N ATOM 491 CA VAL A 32 14.302 30.229 64.365 1.00 17.35 C ATOM 492 C VAL A 32 14.558 30.194 62.874 1.00 14.72 C ATOM 493 O VAL A 32 13.719 30.025 61.998 1.00 14.94 O ATOM 494 CB VAL A 32 14.194 31.705 64.853 1.00 23.33 C ATOM 495 CG1 VAL A 32 13.014 32.337 64.030 1.00 30.35 C ATOM 496 CG2 VAL A 32 13.840 31.714 66.325 1.00 25.74 C ATOM 497 HA VAL A 32 13.364 29.705 64.550 1.00 0.00 H ATOM 498 HB VAL A 32 15.126 32.254 64.715 1.00 0.00 H ATOM 499 HG11 VAL A 32 13.246 32.286 62.966 1.00 0.00 H ATOM 500 HG12 VAL A 32 12.096 31.784 64.230 1.00 0.00 H ATOM 501 HG13 VAL A 32 12.884 33.378 64.325 1.00 0.00 H ATOM 502 HG21 VAL A 32 12.886 31.208 66.471 1.00 0.00 H ATOM 503 HG22 VAL A 32 14.617 31.197 66.887 1.00 0.00 H ATOM 504 HG23 VAL A 32 13.763 32.744 66.673 1.00 0.00 H ATOM 505 H VAL A 32 15.981 30.090 65.751 1.00 0.00 H ATOM 506 N ALA A 33 15.871 30.376 62.533 1.00 14.25 N ATOM 507 CA ALA A 33 16.248 30.383 61.126 1.00 14.78 C ATOM 508 C ALA A 33 15.985 29.076 60.441 1.00 15.32 C ATOM 509 O ALA A 33 15.745 29.036 59.220 1.00 16.86 O ATOM 510 CB ALA A 33 17.703 30.799 60.973 1.00 18.30 C ATOM 511 HA ALA A 33 15.613 31.117 60.629 1.00 0.00 H ATOM 512 HB1 ALA A 33 17.839 31.799 61.384 1.00 0.00 H ATOM 513 HB2 ALA A 33 18.339 30.095 61.510 1.00 0.00 H ATOM 514 HB3 ALA A 33 17.970 30.800 59.916 1.00 0.00 H ATOM 515 H ALA A 33 16.592 30.508 63.271 1.00 0.00 H ATOM 516 N SER A 34 16.053 27.981 61.156 1.00 13.82 N ATOM 517 CA SER A 34 15.873 26.678 60.571 1.00 15.51 C ATOM 518 C SER A 34 14.437 26.461 60.137 1.00 14.66 C ATOM 519 O SER A 34 14.166 25.584 59.313 1.00 18.45 O ATOM 520 CB SER A 34 16.372 25.573 61.494 1.00 17.58 C ATOM 521 OG SER A 34 15.457 25.362 62.560 1.00 18.91 O ATOM 522 HA SER A 34 16.487 26.632 59.671 1.00 0.00 H ATOM 523 HB2 SER A 34 17.341 25.858 61.904 1.00 0.00 H ATOM 524 HB3 SER A 34 16.478 24.650 60.924 1.00 0.00 H ATOM 525 HG SER A 34 15.361 26.198 63.082 1.00 0.00 H ATOM 526 H SER A 34 16.243 28.055 62.176 1.00 0.00 H ATOM 527 N MET A 35 13.519 27.218 60.705 1.00 14.10 N ATOM 528 CA MET A 35 12.098 27.065 60.374 1.00 16.00 C ATOM 529 C MET A 35 11.544 28.212 59.524 1.00 15.91 C ATOM 530 O MET A 35 10.344 28.325 59.369 1.00 21.86 O ATOM 531 CB MET A 35 11.265 27.000 61.660 1.00 16.89 C ATOM 532 CG MET A 35 11.560 25.802 62.494 1.00 22.09 C ATOM 533 SD MET A 35 11.040 24.277 61.844 1.00 24.00 S ATOM 534 CE MET A 35 9.306 24.324 61.914 1.00 30.65 C ATOM 535 HA MET A 35 12.026 26.144 59.796 1.00 0.00 H ATOM 536 HB2 MET A 35 11.471 27.892 62.251 1.00 0.00 H ATOM 537 HB3 MET A 35 10.210 26.981 61.388 1.00 0.00 H ATOM 538 HG2 MET A 35 11.071 25.938 63.459 1.00 0.00 H ATOM 539 HG3 MET A 35 12.639 25.753 62.638 1.00 0.00 H ATOM 540 HE1 MET A 35 8.989 24.449 62.949 1.00 0.00 H ATOM 541 HE2 MET A 35 8.942 25.161 61.317 1.00 0.00 H ATOM 542 HE3 MET A 35 8.902 23.392 61.519 1.00 0.00 H ATOM 543 H MET A 35 13.807 27.936 61.400 1.00 0.00 H ATOM 544 N THR A 36 12.400 29.139 59.153 1.00 15.33 N ATOM 545 CA THR A 36 11.944 30.292 58.394 1.00 16.77 C ATOM 546 C THR A 36 12.082 30.021 56.901 1.00 16.66 C ATOM 547 O THR A 36 13.066 29.399 56.449 1.00 17.51 O ATOM 548 CB THR A 36 12.907 31.475 58.806 1.00 20.73 C ATOM 549 OG1 THR A 36 12.582 31.715 60.215 1.00 29.30 O ATOM 550 CG2 THR A 36 12.506 32.773 58.110 1.00 25.08 C ATOM 551 HA THR A 36 10.898 30.521 58.597 1.00 0.00 H ATOM 552 HB THR A 36 13.942 31.224 58.575 1.00 0.00 H ATOM 553 HG1 THR A 36 12.754 30.892 60.737 1.00 0.00 H ATOM 554 HG23 THR A 36 12.713 32.691 57.043 1.00 0.00 H ATOM 555 HG21 THR A 36 11.442 32.952 58.262 1.00 0.00 H ATOM 556 HG22 THR A 36 13.078 33.600 58.529 1.00 0.00 H ATOM 557 H THR A 36 13.405 29.047 59.403 1.00 0.00 H ATOM 558 N LYS A 37 11.085 30.444 56.138 1.00 14.78 N ATOM 559 CA LYS A 37 11.180 30.293 54.647 1.00 16.19 C ATOM 560 C LYS A 37 11.054 31.677 54.002 1.00 13.86 C ATOM 561 O LYS A 37 10.026 32.223 53.845 1.00 17.74 O ATOM 562 CB LYS A 37 10.056 29.365 54.197 1.00 17.92 C ATOM 563 CG LYS A 37 10.225 27.970 54.762 1.00 24.25 C ATOM 564 CD LYS A 37 9.643 26.886 53.893 1.00 32.52 C ATOM 565 CE LYS A 37 9.660 25.520 54.599 1.00 39.86 C ATOM 566 NZ LYS A 37 8.551 24.648 54.064 1.00 38.79 N ATOM 567 HA LYS A 37 12.136 29.864 54.347 1.00 0.00 H ATOM 568 HB2 LYS A 37 9.104 29.772 54.537 1.00 0.00 H ATOM 569 HB3 LYS A 37 10.058 29.309 53.108 1.00 0.00 H ATOM 570 HG2 LYS A 37 11.290 27.776 54.886 1.00 0.00 H ATOM 571 HG3 LYS A 37 9.734 27.931 55.735 1.00 0.00 H ATOM 572 HD2 LYS A 37 8.613 27.144 53.648 1.00 0.00 H ATOM 573 HD3 LYS A 37 10.227 26.817 52.975 1.00 0.00 H ATOM 574 HE2 LYS A 37 9.520 25.665 55.670 1.00 0.00 H ATOM 575 HE3 LYS A 37 10.619 25.034 54.422 1.00 0.00 H ATOM 576 HZ1 LYS A 37 7.635 25.110 54.235 1.00 0.00 H ATOM 577 HZ2 LYS A 37 8.685 24.507 53.042 1.00 0.00 H ATOM 578 HZ3 LYS A 37 8.571 23.728 54.548 1.00 0.00 H ATOM 579 H LYS A 37 10.243 30.877 56.568 1.00 0.00 H ATOM 580 N PRO A 38 12.234 32.257 53.693 1.00 12.45 N ATOM 581 CA PRO A 38 12.214 33.630 53.197 1.00 11.02 C ATOM 582 C PRO A 38 11.712 33.752 51.763 1.00 11.65 C ATOM 583 O PRO A 38 11.687 32.808 50.990 1.00 12.10 O ATOM 584 CB PRO A 38 13.671 34.061 53.207 1.00 12.91 C ATOM 585 CG PRO A 38 14.408 33.018 53.979 1.00 16.59 C ATOM 586 CD PRO A 38 13.601 31.798 53.929 1.00 15.10 C ATOM 587 HA PRO A 38 11.545 34.229 53.815 1.00 0.00 H ATOM 588 HD3 PRO A 38 13.934 31.151 53.117 1.00 0.00 H ATOM 589 HD2 PRO A 38 13.666 31.257 54.873 1.00 0.00 H ATOM 590 HG3 PRO A 38 14.538 33.339 55.013 1.00 0.00 H ATOM 591 HG2 PRO A 38 15.385 32.840 53.530 1.00 0.00 H ATOM 592 HB2 PRO A 38 14.055 34.120 52.189 1.00 0.00 H ATOM 593 HB3 PRO A 38 13.775 35.033 53.690 1.00 0.00 H ATOM 594 N THR A 39 11.346 35.004 51.460 1.00 10.45 N ATOM 595 CA THR A 39 11.102 35.413 50.081 1.00 12.15 C ATOM 596 C THR A 39 12.212 36.392 49.682 1.00 10.80 C ATOM 597 O THR A 39 12.492 37.272 50.421 1.00 12.75 O ATOM 598 CB THR A 39 9.742 36.228 50.067 1.00 16.17 C ATOM 599 OG1 THR A 39 8.714 35.363 50.440 1.00 19.72 O ATOM 600 CG2 THR A 39 9.451 36.714 48.612 1.00 17.92 C ATOM 601 HA THR A 39 11.069 34.552 49.414 1.00 0.00 H ATOM 602 HB THR A 39 9.810 37.079 50.745 1.00 0.00 H ATOM 603 HG1 THR A 39 8.893 35.012 51.348 1.00 0.00 H ATOM 604 HG23 THR A 39 10.241 37.394 48.293 1.00 0.00 H ATOM 605 HG21 THR A 39 9.418 35.854 47.943 1.00 0.00 H ATOM 606 HG22 THR A 39 8.492 37.232 48.588 1.00 0.00 H ATOM 607 H THR A 39 11.233 35.700 52.224 1.00 0.00 H ATOM 608 N THR A 40 12.759 36.119 48.502 1.00 9.03 N ATOM 609 CA THR A 40 13.817 37.014 47.954 1.00 10.11 C ATOM 610 C THR A 40 13.249 37.667 46.704 1.00 8.21 C ATOM 611 O THR A 40 12.691 37.009 45.844 1.00 11.45 O ATOM 612 CB THR A 40 15.086 36.238 47.631 1.00 11.37 C ATOM 613 OG1 THR A 40 15.570 35.657 48.855 1.00 15.69 O ATOM 614 CG2 THR A 40 16.204 36.991 46.979 1.00 13.00 C ATOM 615 HA THR A 40 14.093 37.767 48.692 1.00 0.00 H ATOM 616 HB THR A 40 14.787 35.508 46.879 1.00 0.00 H ATOM 617 HG1 THR A 40 16.397 35.145 48.671 1.00 0.00 H ATOM 618 HG23 THR A 40 15.848 37.436 46.050 1.00 0.00 H ATOM 619 HG21 THR A 40 16.551 37.777 47.650 1.00 0.00 H ATOM 620 HG22 THR A 40 17.025 36.307 46.764 1.00 0.00 H ATOM 621 H THR A 40 12.450 35.285 47.964 1.00 0.00 H ATOM 622 N ILE A 41 13.373 38.994 46.673 1.00 9.85 N ATOM 623 CA ILE A 41 12.981 39.805 45.545 1.00 9.44 C ATOM 624 C ILE A 41 14.184 40.476 44.947 1.00 9.64 C ATOM 625 O ILE A 41 14.948 41.119 45.695 1.00 11.12 O ATOM 626 CB ILE A 41 11.924 40.851 45.969 1.00 12.62 C ATOM 627 CG1 ILE A 41 10.704 40.163 46.642 1.00 16.04 C ATOM 628 CG2 ILE A 41 11.496 41.663 44.740 1.00 16.02 C ATOM 629 CD1 ILE A 41 9.884 41.029 47.511 1.00 20.22 C ATOM 630 HA ILE A 41 12.534 39.159 44.789 1.00 0.00 H ATOM 631 HB ILE A 41 12.360 41.527 46.705 1.00 0.00 H ATOM 632 HG12 ILE A 41 10.061 39.773 45.853 1.00 0.00 H ATOM 633 HG13 ILE A 41 11.076 39.336 47.247 1.00 0.00 H ATOM 634 HD11 ILE A 41 10.502 41.419 48.320 1.00 0.00 H ATOM 635 HD12 ILE A 41 9.485 41.857 46.925 1.00 0.00 H ATOM 636 HD13 ILE A 41 9.061 40.448 47.928 1.00 0.00 H ATOM 637 HG21 ILE A 41 12.365 42.170 44.320 1.00 0.00 H ATOM 638 HG22 ILE A 41 11.069 40.993 43.994 1.00 0.00 H ATOM 639 HG23 ILE A 41 10.751 42.401 45.036 1.00 0.00 H ATOM 640 H ILE A 41 13.774 39.470 47.506 1.00 0.00 H ATOM 641 N ILE A 42 14.364 40.321 43.639 1.00 8.76 N ATOM 642 CA ILE A 42 15.488 40.918 42.947 1.00 8.85 C ATOM 643 C ILE A 42 14.946 41.815 41.853 1.00 7.93 C ATOM 644 O ILE A 42 14.169 41.373 41.031 1.00 9.92 O ATOM 645 CB ILE A 42 16.410 39.831 42.299 1.00 11.83 C ATOM 646 CG1 ILE A 42 16.810 38.771 43.331 1.00 12.78 C ATOM 647 CG2 ILE A 42 17.680 40.549 41.812 1.00 15.55 C ATOM 648 CD1 ILE A 42 17.730 37.667 42.891 1.00 16.26 C ATOM 649 HA ILE A 42 16.083 41.480 43.666 1.00 0.00 H ATOM 650 HB ILE A 42 15.883 39.335 41.484 1.00 0.00 H ATOM 651 HG12 ILE A 42 17.298 39.290 44.156 1.00 0.00 H ATOM 652 HG13 ILE A 42 15.892 38.305 43.689 1.00 0.00 H ATOM 653 HD11 ILE A 42 17.264 37.109 42.079 1.00 0.00 H ATOM 654 HD12 ILE A 42 18.671 38.096 42.546 1.00 0.00 H ATOM 655 HD13 ILE A 42 17.920 36.998 43.730 1.00 0.00 H ATOM 656 HG21 ILE A 42 17.408 41.310 41.080 1.00 0.00 H ATOM 657 HG22 ILE A 42 18.177 41.020 42.660 1.00 0.00 H ATOM 658 HG23 ILE A 42 18.352 39.824 41.352 1.00 0.00 H ATOM 659 H ILE A 42 13.679 39.756 43.098 1.00 0.00 H ATOM 660 N GLU A 43 15.300 43.082 41.901 1.00 10.55 N ATOM 661 CA GLU A 43 14.781 44.066 40.977 1.00 10.60 C ATOM 662 C GLU A 43 15.944 44.917 40.415 1.00 10.04 C ATOM 663 O GLU A 43 17.008 44.992 41.078 1.00 10.48 O ATOM 664 CB GLU A 43 13.801 45.029 41.693 1.00 20.06 C ATOM 665 CG GLU A 43 12.564 44.433 42.284 1.00 25.39 C ATOM 666 CD GLU A 43 11.830 45.335 43.301 1.00 25.96 C ATOM 667 OE1 GLU A 43 12.473 46.003 44.076 1.00 30.64 O ATOM 668 OE2 GLU A 43 10.614 45.152 43.414 1.00 41.01 O ATOM 669 HA GLU A 43 14.263 43.534 40.179 1.00 0.00 H ATOM 670 HB2 GLU A 43 14.349 45.514 42.501 1.00 0.00 H ATOM 671 HB3 GLU A 43 13.489 45.779 40.966 1.00 0.00 H ATOM 672 HG2 GLU A 43 11.874 44.208 41.471 1.00 0.00 H ATOM 673 HG3 GLU A 43 12.842 43.508 42.790 1.00 0.00 H ATOM 674 H GLU A 43 15.977 43.386 42.629 1.00 0.00 H ATOM 675 N LYS A 44 15.739 45.501 39.264 1.00 9.69 N ATOM 676 CA LYS A 44 16.738 46.355 38.662 1.00 9.52 C ATOM 677 C LYS A 44 16.152 47.683 38.215 1.00 8.78 C ATOM 678 O LYS A 44 14.993 47.732 37.852 1.00 10.74 O ATOM 679 CB LYS A 44 17.472 45.715 37.487 1.00 16.14 C ATOM 680 CG LYS A 44 17.039 45.953 36.171 1.00 23.04 C ATOM 681 CD LYS A 44 17.904 45.365 35.036 1.00 21.74 C ATOM 682 CE LYS A 44 17.038 45.350 33.744 1.00 24.69 C ATOM 683 NZ LYS A 44 17.930 44.917 32.594 1.00 24.71 N ATOM 684 HA LYS A 44 17.467 46.521 39.455 1.00 0.00 H ATOM 685 HB2 LYS A 44 18.508 46.051 37.543 1.00 0.00 H ATOM 686 HB3 LYS A 44 17.432 44.637 37.641 1.00 0.00 H ATOM 687 HG2 LYS A 44 16.037 45.535 36.073 1.00 0.00 H ATOM 688 HG3 LYS A 44 16.996 47.033 36.028 1.00 0.00 H ATOM 689 HD2 LYS A 44 18.788 45.984 34.884 1.00 0.00 H ATOM 690 HD3 LYS A 44 18.211 44.350 35.290 1.00 0.00 H ATOM 691 HE2 LYS A 44 16.641 46.347 33.551 1.00 0.00 H ATOM 692 HE3 LYS A 44 16.212 44.648 33.858 1.00 0.00 H ATOM 693 HZ1 LYS A 44 18.717 45.590 32.495 1.00 0.00 H ATOM 694 HZ2 LYS A 44 18.307 43.967 32.788 1.00 0.00 H ATOM 695 HZ3 LYS A 44 17.375 44.898 31.715 1.00 0.00 H ATOM 696 H LYS A 44 14.837 45.348 38.770 1.00 0.00 H ATOM 697 N ASN A 45 16.949 48.717 38.363 1.00 9.42 N ATOM 698 CA ASN A 45 16.609 50.057 37.836 1.00 8.97 C ATOM 699 C ASN A 45 17.860 50.563 37.198 1.00 8.39 C ATOM 700 O ASN A 45 18.808 50.984 37.857 1.00 10.19 O ATOM 701 CB ASN A 45 16.107 50.950 38.961 1.00 10.95 C ATOM 702 CG ASN A 45 15.642 52.299 38.539 1.00 12.18 C ATOM 703 OD1 ASN A 45 15.039 53.068 39.322 1.00 15.49 O ATOM 704 ND2 ASN A 45 15.792 52.595 37.260 1.00 11.21 N ATOM 705 HA ASN A 45 15.801 50.035 37.105 1.00 0.00 H ATOM 706 HB2 ASN A 45 15.274 50.443 39.448 1.00 0.00 H ATOM 707 HB3 ASN A 45 16.919 51.081 39.676 1.00 0.00 H ATOM 708 HD22 ASN A 45 16.297 51.939 36.630 1.00 0.00 H ATOM 709 HD21 ASN A 45 15.405 53.484 36.883 1.00 0.00 H ATOM 710 H ASN A 45 17.849 48.589 38.868 1.00 0.00 H ATOM 711 N GLY A 46 17.965 50.400 35.893 1.00 10.76 N ATOM 712 CA GLY A 46 19.248 50.746 35.261 1.00 12.90 C ATOM 713 C GLY A 46 20.339 49.825 35.685 1.00 11.03 C ATOM 714 O GLY A 46 20.143 48.584 35.707 1.00 16.26 O ATOM 715 HA3 GLY A 46 19.517 51.764 35.541 1.00 0.00 H ATOM 716 HA2 GLY A 46 19.136 50.686 34.178 1.00 0.00 H ATOM 717 H GLY A 46 17.168 50.039 35.330 1.00 0.00 H ATOM 718 N ASP A 47 21.469 50.372 36.085 1.00 12.64 N ATOM 719 CA ASP A 47 22.567 49.621 36.585 1.00 14.85 C ATOM 720 C ASP A 47 22.533 49.290 38.049 1.00 12.33 C ATOM 721 O ASP A 47 23.472 48.758 38.620 1.00 15.50 O ATOM 722 CB ASP A 47 23.933 50.173 36.172 1.00 21.00 C ATOM 723 CG ASP A 47 24.215 51.550 36.663 1.00 24.23 C ATOM 724 OD1 ASP A 47 23.306 52.216 37.190 1.00 28.71 O ATOM 725 OD2 ASP A 47 25.353 52.015 36.496 1.00 27.74 O ATOM 726 HA ASP A 47 22.428 48.665 36.080 1.00 0.00 H ATOM 727 HB2 ASP A 47 24.702 49.507 36.563 1.00 0.00 H ATOM 728 HB3 ASP A 47 23.982 50.183 35.083 1.00 0.00 H ATOM 729 H ASP A 47 21.562 51.406 36.032 1.00 0.00 H ATOM 730 N ILE A 48 21.438 49.649 38.739 1.00 10.81 N ATOM 731 CA ILE A 48 21.351 49.423 40.170 1.00 10.54 C ATOM 732 C ILE A 48 20.466 48.210 40.437 1.00 8.50 C ATOM 733 O ILE A 48 19.314 48.218 39.986 1.00 10.08 O ATOM 734 CB ILE A 48 20.765 50.647 40.899 1.00 13.02 C ATOM 735 CG1 ILE A 48 21.567 51.956 40.647 1.00 17.78 C ATOM 736 CG2 ILE A 48 20.759 50.369 42.413 1.00 14.49 C ATOM 737 CD1 ILE A 48 23.027 51.806 40.868 1.00 23.28 C ATOM 738 HA ILE A 48 22.359 49.250 40.548 1.00 0.00 H ATOM 739 HB ILE A 48 19.759 50.798 40.506 1.00 0.00 H ATOM 740 HG12 ILE A 48 21.404 52.268 39.615 1.00 0.00 H ATOM 741 HG13 ILE A 48 21.193 52.726 41.322 1.00 0.00 H ATOM 742 HD11 ILE A 48 23.208 51.505 41.900 1.00 0.00 H ATOM 743 HD12 ILE A 48 23.419 51.046 40.192 1.00 0.00 H ATOM 744 HD13 ILE A 48 23.522 52.757 40.674 1.00 0.00 H ATOM 745 HG21 ILE A 48 20.148 49.490 42.617 1.00 0.00 H ATOM 746 HG22 ILE A 48 21.779 50.191 42.752 1.00 0.00 H ATOM 747 HG23 ILE A 48 20.346 51.230 42.938 1.00 0.00 H ATOM 748 H ILE A 48 20.641 50.095 38.241 1.00 0.00 H ATOM 749 N LEU A 49 20.984 47.207 41.108 1.00 9.67 N ATOM 750 CA LEU A 49 20.189 46.079 41.572 1.00 8.94 C ATOM 751 C LEU A 49 19.781 46.280 43.043 1.00 9.02 C ATOM 752 O LEU A 49 20.533 46.804 43.814 1.00 11.85 O ATOM 753 CB LEU A 49 20.987 44.749 41.420 1.00 11.80 C ATOM 754 CG LEU A 49 21.164 44.265 39.961 1.00 17.06 C ATOM 755 CD1 LEU A 49 22.217 43.176 39.897 1.00 22.21 C ATOM 756 CD2 LEU A 49 19.928 43.802 39.279 1.00 27.12 C ATOM 757 HA LEU A 49 19.289 46.020 40.960 1.00 0.00 H ATOM 758 HB2 LEU A 49 21.977 44.895 41.852 1.00 0.00 H ATOM 759 HB3 LEU A 49 20.461 43.972 41.975 1.00 0.00 H ATOM 760 HG LEU A 49 21.476 45.154 39.413 1.00 0.00 H ATOM 761 HD21 LEU A 49 19.503 42.963 39.830 1.00 0.00 H ATOM 762 HD22 LEU A 49 19.206 44.618 39.244 1.00 0.00 H ATOM 763 HD23 LEU A 49 20.171 43.487 38.264 1.00 0.00 H ATOM 764 HD11 LEU A 49 23.166 43.568 40.262 1.00 0.00 H ATOM 765 HD12 LEU A 49 21.907 42.336 40.518 1.00 0.00 H ATOM 766 HD13 LEU A 49 22.332 42.844 38.865 1.00 0.00 H ATOM 767 H LEU A 49 22.003 47.219 41.316 1.00 0.00 H ATOM 768 N THR A 50 18.579 45.781 43.330 1.00 7.56 N ATOM 769 CA THR A 50 18.083 45.767 44.703 1.00 8.48 C ATOM 770 C THR A 50 17.724 44.326 45.041 1.00 7.88 C ATOM 771 O THR A 50 17.021 43.705 44.276 1.00 9.70 O ATOM 772 CB THR A 50 16.936 46.713 44.966 1.00 8.70 C ATOM 773 OG1 THR A 50 17.370 48.054 44.664 1.00 10.18 O ATOM 774 CG2 THR A 50 16.382 46.675 46.362 1.00 10.68 C ATOM 775 HA THR A 50 18.871 46.140 45.357 1.00 0.00 H ATOM 776 HB THR A 50 16.120 46.385 44.323 1.00 0.00 H ATOM 777 HG1 THR A 50 17.640 48.106 43.713 1.00 0.00 H ATOM 778 HG23 THR A 50 16.053 45.662 46.593 1.00 0.00 H ATOM 779 HG21 THR A 50 17.156 46.977 47.067 1.00 0.00 H ATOM 780 HG22 THR A 50 15.536 47.359 46.435 1.00 0.00 H ATOM 781 H THR A 50 17.987 45.397 42.566 1.00 0.00 H ATOM 782 N LEU A 51 18.232 43.882 46.163 1.00 8.64 N ATOM 783 CA LEU A 51 17.949 42.487 46.608 1.00 8.69 C ATOM 784 C LEU A 51 17.325 42.609 47.985 1.00 8.07 C ATOM 785 O LEU A 51 17.966 43.046 48.942 1.00 9.35 O ATOM 786 CB LEU A 51 19.245 41.702 46.585 1.00 12.08 C ATOM 787 CG LEU A 51 19.105 40.168 46.584 1.00 16.19 C ATOM 788 CD1 LEU A 51 20.299 39.455 46.012 1.00 19.36 C ATOM 789 CD2 LEU A 51 18.907 39.745 48.069 1.00 20.57 C ATOM 790 HA LEU A 51 17.259 41.945 45.961 1.00 0.00 H ATOM 791 HB2 LEU A 51 19.793 41.988 45.687 1.00 0.00 H ATOM 792 HB3 LEU A 51 19.822 41.984 47.466 1.00 0.00 H ATOM 793 HG LEU A 51 18.265 39.891 45.947 1.00 0.00 H ATOM 794 HD21 LEU A 51 19.772 40.059 48.653 1.00 0.00 H ATOM 795 HD22 LEU A 51 18.009 40.220 48.464 1.00 0.00 H ATOM 796 HD23 LEU A 51 18.802 38.662 48.126 1.00 0.00 H ATOM 797 HD11 LEU A 51 20.448 39.770 44.979 1.00 0.00 H ATOM 798 HD12 LEU A 51 21.184 39.701 46.599 1.00 0.00 H ATOM 799 HD13 LEU A 51 20.128 38.379 46.044 1.00 0.00 H ATOM 800 H LEU A 51 18.832 44.502 46.744 1.00 0.00 H ATOM 801 N LYS A 52 16.074 42.197 48.095 1.00 8.50 N ATOM 802 CA LYS A 52 15.303 42.220 49.320 1.00 7.37 C ATOM 803 C LYS A 52 15.130 40.755 49.813 1.00 8.89 C ATOM 804 O LYS A 52 14.792 39.899 48.993 1.00 12.02 O ATOM 805 CB LYS A 52 13.900 42.771 49.094 1.00 11.16 C ATOM 806 CG LYS A 52 13.882 44.283 48.722 1.00 13.26 C ATOM 807 CD LYS A 52 12.532 44.691 48.225 1.00 18.01 C ATOM 808 CE LYS A 52 12.441 46.155 47.808 1.00 23.93 C ATOM 809 NZ LYS A 52 11.076 46.402 47.196 1.00 31.53 N ATOM 810 HA LYS A 52 15.831 42.850 50.036 1.00 0.00 H ATOM 811 HB2 LYS A 52 13.434 42.210 48.284 1.00 0.00 H ATOM 812 HB3 LYS A 52 13.323 42.633 50.008 1.00 0.00 H ATOM 813 HG2 LYS A 52 14.131 44.872 49.605 1.00 0.00 H ATOM 814 HG3 LYS A 52 14.621 44.469 47.943 1.00 0.00 H ATOM 815 HD2 LYS A 52 12.283 44.073 47.363 1.00 0.00 H ATOM 816 HD3 LYS A 52 11.806 44.515 49.019 1.00 0.00 H ATOM 817 HE2 LYS A 52 13.217 46.377 47.076 1.00 0.00 H ATOM 818 HE3 LYS A 52 12.573 46.794 48.681 1.00 0.00 H ATOM 819 HZ1 LYS A 52 10.954 45.789 46.365 1.00 0.00 H ATOM 820 HZ2 LYS A 52 10.339 46.187 47.898 1.00 0.00 H ATOM 821 HZ3 LYS A 52 11.002 47.398 46.907 1.00 0.00 H ATOM 822 H LYS A 52 15.610 41.830 47.240 1.00 0.00 H ATOM 823 N THR A 53 15.343 40.530 51.075 1.00 9.23 N ATOM 824 CA THR A 53 15.039 39.183 51.638 1.00 9.91 C ATOM 825 C THR A 53 14.059 39.384 52.792 1.00 8.52 C ATOM 826 O THR A 53 14.366 40.141 53.735 1.00 11.76 O ATOM 827 CB THR A 53 16.345 38.519 52.178 1.00 10.56 C ATOM 828 OG1 THR A 53 17.317 38.518 51.138 1.00 11.28 O ATOM 829 CG2 THR A 53 16.092 37.072 52.503 1.00 14.50 C ATOM 830 HA THR A 53 14.616 38.536 50.870 1.00 0.00 H ATOM 831 HB THR A 53 16.675 39.069 53.059 1.00 0.00 H ATOM 832 HG1 THR A 53 18.151 38.099 51.468 1.00 0.00 H ATOM 833 HG23 THR A 53 15.350 37.004 53.299 1.00 0.00 H ATOM 834 HG21 THR A 53 15.721 36.561 51.615 1.00 0.00 H ATOM 835 HG22 THR A 53 17.022 36.606 52.830 1.00 0.00 H ATOM 836 H THR A 53 15.722 41.282 51.686 1.00 0.00 H ATOM 837 N HIS A 54 12.864 38.874 52.681 1.00 9.95 N ATOM 838 CA HIS A 54 11.796 39.110 53.643 1.00 9.72 C ATOM 839 C HIS A 54 11.443 37.799 54.350 1.00 11.39 C ATOM 840 O HIS A 54 11.383 36.759 53.759 1.00 11.17 O ATOM 841 CB HIS A 54 10.530 39.592 52.907 1.00 13.69 C ATOM 842 CG HIS A 54 10.688 40.969 52.340 1.00 15.10 C ATOM 843 ND1 HIS A 54 9.803 41.485 51.412 1.00 17.34 N ATOM 844 CD2 HIS A 54 11.577 41.931 52.612 1.00 17.44 C ATOM 845 CE1 HIS A 54 10.155 42.693 51.096 1.00 17.64 C ATOM 846 NE2 HIS A 54 11.234 43.006 51.858 1.00 17.08 N ATOM 847 HA HIS A 54 12.134 39.858 54.360 1.00 0.00 H ATOM 848 HB2 HIS A 54 10.314 38.901 52.093 1.00 0.00 H ATOM 849 HB3 HIS A 54 9.697 39.596 53.610 1.00 0.00 H ATOM 850 HD2 HIS A 54 12.415 41.864 53.306 1.00 0.00 H ATOM 851 HE1 HIS A 54 9.675 43.335 50.358 1.00 0.00 H ATOM 852 H HIS A 54 12.663 38.266 51.862 1.00 0.00 H ATOM 853 N SER A 55 11.174 37.956 55.662 1.00 11.96 N ATOM 854 CA SER A 55 10.674 36.774 56.393 1.00 13.49 C ATOM 855 C SER A 55 9.926 37.223 57.651 1.00 14.83 C ATOM 856 O SER A 55 9.954 38.395 57.976 1.00 19.76 O ATOM 857 CB SER A 55 11.846 35.884 56.782 1.00 13.59 C ATOM 858 OG SER A 55 12.620 36.411 57.838 1.00 14.84 O ATOM 859 HA SER A 55 9.992 36.214 55.753 1.00 0.00 H ATOM 860 HB2 SER A 55 12.489 35.757 55.911 1.00 0.00 H ATOM 861 HB3 SER A 55 11.457 34.913 57.089 1.00 0.00 H ATOM 862 HG SER A 55 12.988 37.290 57.569 1.00 0.00 H ATOM 863 H SER A 55 11.313 38.870 56.139 1.00 0.00 H ATOM 864 N THR A 56 9.325 36.264 58.354 1.00 16.09 N ATOM 865 CA THR A 56 8.730 36.616 59.648 1.00 19.04 C ATOM 866 C THR A 56 9.744 36.969 60.697 1.00 20.84 C ATOM 867 O THR A 56 9.441 37.454 61.771 1.00 25.96 O ATOM 868 CB THR A 56 7.887 35.401 60.137 1.00 18.98 C ATOM 869 OG1 THR A 56 8.683 34.240 60.043 1.00 24.71 O ATOM 870 CG2 THR A 56 6.646 35.266 59.284 1.00 25.41 C ATOM 871 HA THR A 56 8.118 37.506 59.500 1.00 0.00 H ATOM 872 HB THR A 56 7.575 35.546 61.171 1.00 0.00 H ATOM 873 HG1 THR A 56 8.161 33.457 60.351 1.00 0.00 H ATOM 874 HG23 THR A 56 6.046 36.172 59.371 1.00 0.00 H ATOM 875 HG21 THR A 56 6.936 35.119 58.244 1.00 0.00 H ATOM 876 HG22 THR A 56 6.064 34.410 59.625 1.00 0.00 H ATOM 877 H THR A 56 9.279 35.289 57.994 1.00 0.00 H ATOM 878 N PHE A 57 11.021 36.594 60.490 1.00 18.59 N ATOM 879 CA PHE A 57 12.022 36.784 61.542 1.00 19.61 C ATOM 880 C PHE A 57 12.827 38.075 61.287 1.00 19.79 C ATOM 881 O PHE A 57 12.937 38.938 62.110 1.00 21.39 O ATOM 882 CB PHE A 57 12.930 35.571 61.562 1.00 20.12 C ATOM 883 CG PHE A 57 14.076 35.644 62.555 1.00 23.66 C ATOM 884 CD1 PHE A 57 13.936 36.229 63.780 1.00 25.11 C ATOM 885 CD2 PHE A 57 15.293 35.047 62.223 1.00 29.29 C ATOM 886 CE1 PHE A 57 14.978 36.213 64.718 1.00 28.26 C ATOM 887 CE2 PHE A 57 16.302 35.007 63.136 1.00 31.87 C ATOM 888 CZ PHE A 57 16.150 35.586 64.391 1.00 32.02 C ATOM 889 HA PHE A 57 11.535 36.888 62.511 1.00 0.00 H ATOM 890 HB2 PHE A 57 12.324 34.699 61.808 1.00 0.00 H ATOM 891 HB3 PHE A 57 13.353 35.449 60.565 1.00 0.00 H ATOM 892 HD2 PHE A 57 15.436 34.613 61.233 1.00 0.00 H ATOM 893 HE2 PHE A 57 17.240 34.515 62.880 1.00 0.00 H ATOM 894 HZ PHE A 57 16.964 35.541 65.114 1.00 0.00 H ATOM 895 HE1 PHE A 57 14.857 36.691 65.690 1.00 0.00 H ATOM 896 HD1 PHE A 57 12.996 36.718 64.034 1.00 0.00 H ATOM 897 H PHE A 57 11.297 36.169 59.582 1.00 0.00 H ATOM 898 N LYS A 58 13.495 38.193 60.154 1.00 20.63 N ATOM 899 CA LYS A 58 14.312 39.369 59.897 1.00 20.00 C ATOM 900 C LYS A 58 14.147 39.744 58.413 1.00 17.12 C ATOM 901 O LYS A 58 13.809 38.874 57.628 1.00 15.49 O ATOM 902 CB LYS A 58 15.818 38.983 60.086 1.00 27.95 C ATOM 903 CG LYS A 58 16.125 38.679 61.517 1.00 33.73 C ATOM 904 CD LYS A 58 17.574 38.487 61.821 1.00 43.05 C ATOM 905 CE LYS A 58 17.767 38.320 63.353 1.00 45.29 C ATOM 906 NZ LYS A 58 18.717 39.364 63.865 1.00 47.82 N ATOM 907 HA LYS A 58 14.019 40.180 60.564 1.00 0.00 H ATOM 908 HB2 LYS A 58 16.038 38.104 59.481 1.00 0.00 H ATOM 909 HB3 LYS A 58 16.442 39.814 59.757 1.00 0.00 H ATOM 910 HG2 LYS A 58 15.757 39.505 62.126 1.00 0.00 H ATOM 911 HG3 LYS A 58 15.597 37.765 61.790 1.00 0.00 H ATOM 912 HD2 LYS A 58 17.937 37.595 61.310 1.00 0.00 H ATOM 913 HD3 LYS A 58 18.135 39.356 61.477 1.00 0.00 H ATOM 914 HE2 LYS A 58 18.172 37.329 63.561 1.00 0.00 H ATOM 915 HE3 LYS A 58 16.805 38.430 63.853 1.00 0.00 H ATOM 916 HZ1 LYS A 58 19.636 39.258 63.389 1.00 0.00 H ATOM 917 HZ2 LYS A 58 18.330 40.309 63.668 1.00 0.00 H ATOM 918 HZ3 LYS A 58 18.841 39.245 64.891 1.00 0.00 H ATOM 919 H LYS A 58 13.437 37.439 59.440 1.00 0.00 H ATOM 920 N ASN A 59 14.353 40.958 58.088 1.00 15.93 N ATOM 921 CA ASN A 59 14.241 41.428 56.704 1.00 13.63 C ATOM 922 C ASN A 59 15.543 42.190 56.397 1.00 11.91 C ATOM 923 O ASN A 59 16.027 42.937 57.246 1.00 13.59 O ATOM 924 CB ASN A 59 13.083 42.448 56.588 1.00 15.29 C ATOM 925 CG ASN A 59 11.731 41.786 56.858 1.00 18.87 C ATOM 926 OD1 ASN A 59 11.142 42.110 57.951 1.00 27.81 O ATOM 927 ND2 ASN A 59 11.286 40.917 56.103 1.00 12.82 N ATOM 928 HA ASN A 59 14.066 40.589 56.030 1.00 0.00 H ATOM 929 HB2 ASN A 59 13.239 43.247 57.313 1.00 0.00 H ATOM 930 HB3 ASN A 59 13.079 42.868 55.582 1.00 0.00 H ATOM 931 HD22 ASN A 59 11.792 40.682 55.225 1.00 0.00 H ATOM 932 HD21 ASN A 59 10.405 40.420 56.344 1.00 0.00 H ATOM 933 H ASN A 59 14.610 41.640 58.830 1.00 0.00 H ATOM 934 N THR A 60 16.055 42.047 55.203 1.00 9.47 N ATOM 935 CA THR A 60 17.216 42.841 54.748 1.00 10.19 C ATOM 936 C THR A 60 16.942 43.409 53.365 1.00 8.89 C ATOM 937 O THR A 60 16.132 42.893 52.575 1.00 8.99 O ATOM 938 CB THR A 60 18.473 41.993 54.701 1.00 10.38 C ATOM 939 OG1 THR A 60 18.266 40.851 53.852 1.00 10.87 O ATOM 940 CG2 THR A 60 18.853 41.443 56.075 1.00 13.25 C ATOM 941 HA THR A 60 17.370 43.653 55.459 1.00 0.00 H ATOM 942 HB THR A 60 19.265 42.644 54.329 1.00 0.00 H ATOM 943 HG1 THR A 60 18.045 41.157 52.937 1.00 0.00 H ATOM 944 HG23 THR A 60 19.022 42.272 56.763 1.00 0.00 H ATOM 945 HG21 THR A 60 18.044 40.817 56.451 1.00 0.00 H ATOM 946 HG22 THR A 60 19.763 40.849 55.988 1.00 0.00 H ATOM 947 H THR A 60 15.633 41.353 54.553 1.00 0.00 H ATOM 948 N GLU A 61 17.662 44.489 53.052 1.00 8.32 N ATOM 949 CA GLU A 61 17.585 45.069 51.706 1.00 8.42 C ATOM 950 C GLU A 61 18.939 45.671 51.403 1.00 8.04 C ATOM 951 O GLU A 61 19.467 46.422 52.237 1.00 10.02 O ATOM 952 CB GLU A 61 16.514 46.202 51.661 1.00 9.03 C ATOM 953 CG GLU A 61 16.442 46.859 50.300 1.00 10.17 C ATOM 954 CD GLU A 61 15.289 47.820 50.163 1.00 9.62 C ATOM 955 OE1 GLU A 61 14.172 47.527 50.676 1.00 9.83 O ATOM 956 OE2 GLU A 61 15.487 48.907 49.554 1.00 11.77 O ATOM 957 HA GLU A 61 17.310 44.302 50.982 1.00 0.00 H ATOM 958 HB2 GLU A 61 15.539 45.775 51.898 1.00 0.00 H ATOM 959 HB3 GLU A 61 16.769 46.958 52.404 1.00 0.00 H ATOM 960 HG2 GLU A 61 17.370 47.405 50.129 1.00 0.00 H ATOM 961 HG3 GLU A 61 16.336 46.080 49.545 1.00 0.00 H ATOM 962 H GLU A 61 18.281 44.922 53.767 1.00 0.00 H ATOM 963 N ILE A 62 19.475 45.403 50.226 1.00 8.67 N ATOM 964 CA ILE A 62 20.695 46.024 49.759 1.00 8.30 C ATOM 965 C ILE A 62 20.500 46.499 48.323 1.00 8.57 C ATOM 966 O ILE A 62 19.769 45.834 47.562 1.00 10.09 O ATOM 967 CB ILE A 62 21.899 45.040 49.786 1.00 9.64 C ATOM 968 CG1 ILE A 62 21.711 43.729 49.040 1.00 11.38 C ATOM 969 CG2 ILE A 62 22.281 44.803 51.238 1.00 15.08 C ATOM 970 CD1 ILE A 62 22.923 42.836 48.961 1.00 13.20 C ATOM 971 HA ILE A 62 20.914 46.857 50.427 1.00 0.00 H ATOM 972 HB ILE A 62 22.704 45.520 49.229 1.00 0.00 H ATOM 973 HG12 ILE A 62 20.917 43.172 49.538 1.00 0.00 H ATOM 974 HG13 ILE A 62 21.403 43.965 48.021 1.00 0.00 H ATOM 975 HD11 ILE A 62 23.729 43.363 48.450 1.00 0.00 H ATOM 976 HD12 ILE A 62 23.243 42.569 49.968 1.00 0.00 H ATOM 977 HD13 ILE A 62 22.671 41.932 48.407 1.00 0.00 H ATOM 978 HG21 ILE A 62 22.559 45.751 51.699 1.00 0.00 H ATOM 979 HG22 ILE A 62 21.432 44.374 51.770 1.00 0.00 H ATOM 980 HG23 ILE A 62 23.125 44.115 51.283 1.00 0.00 H ATOM 981 H ILE A 62 18.999 44.715 49.608 1.00 0.00 H ATOM 982 N SER A 63 21.124 47.579 47.979 1.00 8.51 N ATOM 983 CA SER A 63 21.171 48.021 46.576 1.00 8.23 C ATOM 984 C SER A 63 22.653 48.186 46.201 1.00 7.12 C ATOM 985 O SER A 63 23.441 48.644 47.067 1.00 9.48 O ATOM 986 CB SER A 63 20.456 49.340 46.323 1.00 9.19 C ATOM 987 OG SER A 63 19.066 49.278 46.565 1.00 10.82 O ATOM 988 HA SER A 63 20.658 47.272 45.973 1.00 0.00 H ATOM 989 HB2 SER A 63 20.614 49.625 45.283 1.00 0.00 H ATOM 990 HB3 SER A 63 20.888 50.099 46.976 1.00 0.00 H ATOM 991 HG SER A 63 18.908 49.029 47.510 1.00 0.00 H ATOM 992 H SER A 63 21.602 48.146 48.708 1.00 0.00 H ATOM 993 N PHE A 64 22.988 47.858 44.971 1.00 8.38 N ATOM 994 CA PHE A 64 24.396 47.891 44.566 1.00 9.46 C ATOM 995 C PHE A 64 24.503 47.923 43.035 1.00 8.91 C ATOM 996 O PHE A 64 23.530 47.646 42.329 1.00 9.08 O ATOM 997 CB PHE A 64 25.094 46.628 45.111 1.00 9.98 C ATOM 998 CG PHE A 64 24.450 45.326 44.713 1.00 10.28 C ATOM 999 CD1 PHE A 64 24.758 44.687 43.524 1.00 10.55 C ATOM 1000 CD2 PHE A 64 23.501 44.746 45.503 1.00 9.95 C ATOM 1001 CE1 PHE A 64 24.128 43.511 43.135 1.00 12.07 C ATOM 1002 CE2 PHE A 64 22.886 43.546 45.174 1.00 13.57 C ATOM 1003 CZ PHE A 64 23.186 42.968 43.950 1.00 13.00 C ATOM 1004 HA PHE A 64 24.874 48.785 44.967 1.00 0.00 H ATOM 1005 HB2 PHE A 64 26.121 46.624 44.745 1.00 0.00 H ATOM 1006 HB3 PHE A 64 25.097 46.686 46.199 1.00 0.00 H ATOM 1007 HD2 PHE A 64 23.214 45.245 46.429 1.00 0.00 H ATOM 1008 HE2 PHE A 64 22.185 43.070 45.860 1.00 0.00 H ATOM 1009 HZ PHE A 64 22.659 42.066 43.637 1.00 0.00 H ATOM 1010 HE1 PHE A 64 24.386 43.032 42.191 1.00 0.00 H ATOM 1011 HD1 PHE A 64 25.518 45.120 42.873 1.00 0.00 H ATOM 1012 H PHE A 64 22.256 47.576 44.289 1.00 0.00 H ATOM 1013 N LYS A 65 25.678 48.319 42.582 1.00 9.29 N ATOM 1014 CA LYS A 65 26.036 48.192 41.183 1.00 9.32 C ATOM 1015 C LYS A 65 26.975 46.983 41.067 1.00 9.60 C ATOM 1016 O LYS A 65 27.820 46.799 41.943 1.00 9.90 O ATOM 1017 CB LYS A 65 26.818 49.441 40.734 1.00 12.59 C ATOM 1018 CG LYS A 65 25.969 50.688 40.628 1.00 22.56 C ATOM 1019 CD LYS A 65 26.820 51.824 40.028 1.00 31.76 C ATOM 1020 CE LYS A 65 26.271 53.173 40.567 1.00 40.27 C ATOM 1021 NZ LYS A 65 26.858 54.321 39.882 1.00 49.11 N ATOM 1022 HA LYS A 65 25.142 48.078 40.570 1.00 0.00 H ATOM 1023 HB2 LYS A 65 27.613 49.627 41.456 1.00 0.00 H ATOM 1024 HB3 LYS A 65 27.256 49.239 39.757 1.00 0.00 H ATOM 1025 HG2 LYS A 65 25.112 50.493 39.983 1.00 0.00 H ATOM 1026 HG3 LYS A 65 25.619 50.977 41.619 1.00 0.00 H ATOM 1027 HD2 LYS A 65 27.862 51.703 40.326 1.00 0.00 H ATOM 1028 HD3 LYS A 65 26.750 51.804 38.940 1.00 0.00 H ATOM 1029 HE2 LYS A 65 26.498 53.245 41.631 1.00 0.00 H ATOM 1030 HE3 LYS A 65 25.190 53.194 40.425 1.00 0.00 H ATOM 1031 HZ1 LYS A 65 27.889 54.314 40.018 1.00 0.00 H ATOM 1032 HZ2 LYS A 65 26.640 54.266 38.867 1.00 0.00 H ATOM 1033 HZ3 LYS A 65 26.461 55.198 40.276 1.00 0.00 H ATOM 1034 H LYS A 65 26.364 48.732 43.245 1.00 0.00 H ATOM 1035 N LEU A 66 26.868 46.222 39.988 1.00 10.17 N ATOM 1036 CA LEU A 66 27.792 45.115 39.805 1.00 11.37 C ATOM 1037 C LEU A 66 29.231 45.624 39.752 1.00 11.22 C ATOM 1038 O LEU A 66 29.507 46.647 39.056 1.00 12.05 O ATOM 1039 CB LEU A 66 27.447 44.320 38.554 1.00 12.17 C ATOM 1040 CG LEU A 66 26.138 43.542 38.553 1.00 12.96 C ATOM 1041 CD1 LEU A 66 25.827 42.972 37.179 1.00 21.00 C ATOM 1042 CD2 LEU A 66 26.132 42.435 39.600 1.00 14.87 C ATOM 1043 HA LEU A 66 27.699 44.445 40.660 1.00 0.00 H ATOM 1044 HB2 LEU A 66 27.410 45.022 37.721 1.00 0.00 H ATOM 1045 HB3 LEU A 66 28.252 43.604 38.389 1.00 0.00 H ATOM 1046 HG LEU A 66 25.354 44.253 38.813 1.00 0.00 H ATOM 1047 HD21 LEU A 66 26.944 41.737 39.394 1.00 0.00 H ATOM 1048 HD22 LEU A 66 26.269 42.872 40.589 1.00 0.00 H ATOM 1049 HD23 LEU A 66 25.179 41.907 39.563 1.00 0.00 H ATOM 1050 HD11 LEU A 66 25.744 43.786 36.459 1.00 0.00 H ATOM 1051 HD12 LEU A 66 26.629 42.298 36.877 1.00 0.00 H ATOM 1052 HD13 LEU A 66 24.886 42.424 37.219 1.00 0.00 H ATOM 1053 H LEU A 66 26.131 46.414 39.280 1.00 0.00 H ATOM 1054 N GLY A 67 30.137 44.955 40.418 1.00 9.92 N ATOM 1055 CA GLY A 67 31.563 45.236 40.321 1.00 12.25 C ATOM 1056 C GLY A 67 32.013 46.426 41.118 1.00 12.06 C ATOM 1057 O GLY A 67 33.210 46.800 40.978 1.00 15.12 O ATOM 1058 HA3 GLY A 67 31.806 45.415 39.273 1.00 0.00 H ATOM 1059 HA2 GLY A 67 32.109 44.361 40.675 1.00 0.00 H ATOM 1060 H GLY A 67 29.825 44.187 41.046 1.00 0.00 H ATOM 1061 N VAL A 68 31.181 46.968 41.987 1.00 9.75 N ATOM 1062 CA VAL A 68 31.557 48.152 42.786 1.00 10.88 C ATOM 1063 C VAL A 68 31.331 47.792 44.271 1.00 10.87 C ATOM 1064 O VAL A 68 30.246 47.384 44.669 1.00 10.22 O ATOM 1065 CB VAL A 68 30.706 49.394 42.445 1.00 12.77 C ATOM 1066 CG1 VAL A 68 31.132 50.598 43.286 1.00 14.94 C ATOM 1067 CG2 VAL A 68 30.887 49.758 40.968 1.00 15.53 C ATOM 1068 HA VAL A 68 32.595 48.403 42.568 1.00 0.00 H ATOM 1069 HB VAL A 68 29.665 49.152 42.657 1.00 0.00 H ATOM 1070 HG11 VAL A 68 31.004 50.365 44.343 1.00 0.00 H ATOM 1071 HG12 VAL A 68 32.179 50.826 43.088 1.00 0.00 H ATOM 1072 HG13 VAL A 68 30.516 51.458 43.025 1.00 0.00 H ATOM 1073 HG21 VAL A 68 31.937 49.976 40.775 1.00 0.00 H ATOM 1074 HG22 VAL A 68 30.568 48.921 40.347 1.00 0.00 H ATOM 1075 HG23 VAL A 68 30.284 50.635 40.735 1.00 0.00 H ATOM 1076 H VAL A 68 30.237 46.551 42.113 1.00 0.00 H ATOM 1077 N GLU A 69 32.376 47.921 45.065 1.00 10.91 N ATOM 1078 CA GLU A 69 32.322 47.571 46.476 1.00 10.52 C ATOM 1079 C GLU A 69 31.297 48.437 47.201 1.00 10.70 C ATOM 1080 O GLU A 69 31.143 49.621 46.922 1.00 11.20 O ATOM 1081 CB GLU A 69 33.700 47.708 47.075 1.00 14.70 C ATOM 1082 CG GLU A 69 33.859 47.168 48.516 1.00 17.02 C ATOM 1083 CD GLU A 69 35.297 47.257 48.972 1.00 16.36 C ATOM 1084 OE1 GLU A 69 35.813 48.392 49.102 1.00 22.51 O ATOM 1085 OE2 GLU A 69 35.942 46.234 49.070 1.00 21.34 O ATOM 1086 HA GLU A 69 32.001 46.535 46.588 1.00 0.00 H ATOM 1087 HB2 GLU A 69 34.399 47.169 46.436 1.00 0.00 H ATOM 1088 HB3 GLU A 69 33.959 48.767 47.083 1.00 0.00 H ATOM 1089 HG2 GLU A 69 33.234 47.756 49.188 1.00 0.00 H ATOM 1090 HG3 GLU A 69 33.540 46.126 48.544 1.00 0.00 H ATOM 1091 H GLU A 69 33.267 48.284 44.670 1.00 0.00 H ATOM 1092 N PHE A 70 30.634 47.844 48.187 1.00 9.63 N ATOM 1093 CA PHE A 70 29.700 48.553 49.033 1.00 9.35 C ATOM 1094 C PHE A 70 29.790 48.017 50.476 1.00 9.19 C ATOM 1095 O PHE A 70 30.170 46.862 50.703 1.00 11.35 O ATOM 1096 CB PHE A 70 28.254 48.427 48.535 1.00 9.95 C ATOM 1097 CG PHE A 70 27.678 47.042 48.396 1.00 8.34 C ATOM 1098 CD1 PHE A 70 27.963 46.226 47.315 1.00 10.04 C ATOM 1099 CD2 PHE A 70 26.777 46.559 49.339 1.00 11.59 C ATOM 1100 CE1 PHE A 70 27.409 45.001 47.156 1.00 9.84 C ATOM 1101 CE2 PHE A 70 26.203 45.318 49.184 1.00 11.46 C ATOM 1102 CZ PHE A 70 26.514 44.541 48.100 1.00 10.51 C ATOM 1103 HA PHE A 70 29.973 49.608 49.003 1.00 0.00 H ATOM 1104 HB2 PHE A 70 27.620 48.975 49.233 1.00 0.00 H ATOM 1105 HB3 PHE A 70 28.205 48.900 47.554 1.00 0.00 H ATOM 1106 HD2 PHE A 70 26.524 47.168 50.207 1.00 0.00 H ATOM 1107 HE2 PHE A 70 25.496 44.951 49.929 1.00 0.00 H ATOM 1108 HZ PHE A 70 26.055 43.559 47.983 1.00 0.00 H ATOM 1109 HE1 PHE A 70 27.667 44.386 46.294 1.00 0.00 H ATOM 1110 HD1 PHE A 70 28.663 46.585 46.560 1.00 0.00 H ATOM 1111 H PHE A 70 30.793 46.830 48.357 1.00 0.00 H ATOM 1112 N ASP A 71 29.418 48.834 51.427 1.00 12.35 N ATOM 1113 CA ASP A 71 29.293 48.442 52.829 1.00 11.47 C ATOM 1114 C ASP A 71 27.914 47.784 53.048 1.00 12.56 C ATOM 1115 O ASP A 71 26.919 48.189 52.497 1.00 12.63 O ATOM 1116 CB ASP A 71 29.319 49.733 53.689 1.00 14.19 C ATOM 1117 CG ASP A 71 30.733 50.279 53.854 1.00 16.85 C ATOM 1118 OD1 ASP A 71 31.679 49.481 53.950 1.00 21.70 O ATOM 1119 OD2 ASP A 71 30.856 51.498 53.872 1.00 22.68 O ATOM 1120 HA ASP A 71 30.097 47.757 53.097 1.00 0.00 H ATOM 1121 HB2 ASP A 71 28.703 50.491 53.206 1.00 0.00 H ATOM 1122 HB3 ASP A 71 28.911 49.508 54.674 1.00 0.00 H ATOM 1123 H ASP A 71 29.199 49.818 51.171 1.00 0.00 H ATOM 1124 N GLU A 72 27.942 46.688 53.790 1.00 10.46 N ATOM 1125 CA GLU A 72 26.709 45.940 54.033 1.00 10.24 C ATOM 1126 C GLU A 72 26.662 45.525 55.505 1.00 9.99 C ATOM 1127 O GLU A 72 27.717 45.172 56.031 1.00 12.44 O ATOM 1128 CB GLU A 72 26.722 44.657 53.161 1.00 10.26 C ATOM 1129 CG GLU A 72 25.572 43.719 53.377 1.00 11.11 C ATOM 1130 CD GLU A 72 25.573 42.484 52.506 1.00 10.49 C ATOM 1131 OE1 GLU A 72 26.541 42.252 51.777 1.00 10.33 O ATOM 1132 OE2 GLU A 72 24.559 41.693 52.565 1.00 12.16 O ATOM 1133 HA GLU A 72 25.845 46.558 53.787 1.00 0.00 H ATOM 1134 HB2 GLU A 72 26.716 44.962 52.114 1.00 0.00 H ATOM 1135 HB3 GLU A 72 27.643 44.115 53.375 1.00 0.00 H ATOM 1136 HG2 GLU A 72 25.591 43.397 54.418 1.00 0.00 H ATOM 1137 HG3 GLU A 72 24.650 44.267 53.184 1.00 0.00 H ATOM 1138 H GLU A 72 28.840 46.359 54.200 1.00 0.00 H ATOM 1139 N THR A 73 25.503 45.590 56.103 1.00 10.61 N ATOM 1140 CA THR A 73 25.298 44.978 57.440 1.00 11.27 C ATOM 1141 C THR A 73 24.366 43.794 57.289 1.00 10.97 C ATOM 1142 O THR A 73 23.225 43.897 56.794 1.00 13.74 O ATOM 1143 CB THR A 73 24.673 46.009 58.399 1.00 13.34 C ATOM 1144 OG1 THR A 73 25.545 47.143 58.513 1.00 15.90 O ATOM 1145 CG2 THR A 73 24.453 45.431 59.757 1.00 19.05 C ATOM 1146 HA THR A 73 26.255 44.653 57.849 1.00 0.00 H ATOM 1147 HB THR A 73 23.707 46.306 57.990 1.00 0.00 H ATOM 1148 HG1 THR A 73 25.669 47.553 57.621 1.00 0.00 H ATOM 1149 HG23 THR A 73 23.791 44.568 59.680 1.00 0.00 H ATOM 1150 HG21 THR A 73 25.409 45.121 60.178 1.00 0.00 H ATOM 1151 HG22 THR A 73 23.998 46.183 60.401 1.00 0.00 H ATOM 1152 H THR A 73 24.712 46.078 55.636 1.00 0.00 H ATOM 1153 N THR A 74 24.873 42.623 57.584 1.00 11.34 N ATOM 1154 CA THR A 74 24.159 41.369 57.262 1.00 12.17 C ATOM 1155 C THR A 74 23.092 41.075 58.307 1.00 11.69 C ATOM 1156 O THR A 74 23.025 41.706 59.376 1.00 13.86 O ATOM 1157 CB THR A 74 25.188 40.209 57.278 1.00 11.04 C ATOM 1158 OG1 THR A 74 25.741 40.046 58.604 1.00 11.65 O ATOM 1159 CG2 THR A 74 26.314 40.500 56.323 1.00 11.99 C ATOM 1160 HA THR A 74 23.684 41.468 56.286 1.00 0.00 H ATOM 1161 HB THR A 74 24.673 39.296 56.978 1.00 0.00 H ATOM 1162 HG1 THR A 74 25.012 39.840 59.241 1.00 0.00 H ATOM 1163 HG23 THR A 74 25.913 40.626 55.317 1.00 0.00 H ATOM 1164 HG21 THR A 74 26.822 41.414 56.630 1.00 0.00 H ATOM 1165 HG22 THR A 74 27.020 39.670 56.332 1.00 0.00 H ATOM 1166 H THR A 74 25.799 42.574 58.055 1.00 0.00 H ATOM 1167 N ALA A 75 22.268 40.067 58.048 1.00 10.60 N ATOM 1168 CA ALA A 75 21.189 39.690 58.947 1.00 11.50 C ATOM 1169 C ALA A 75 21.650 39.279 60.320 1.00 14.58 C ATOM 1170 O ALA A 75 20.886 39.393 61.289 1.00 18.23 O ATOM 1171 CB ALA A 75 20.389 38.557 58.311 1.00 13.59 C ATOM 1172 HA ALA A 75 20.574 40.578 59.092 1.00 0.00 H ATOM 1173 HB1 ALA A 75 19.976 38.894 57.360 1.00 0.00 H ATOM 1174 HB2 ALA A 75 21.044 37.702 58.141 1.00 0.00 H ATOM 1175 HB3 ALA A 75 19.577 38.268 58.979 1.00 0.00 H ATOM 1176 H ALA A 75 22.399 39.527 57.169 1.00 0.00 H ATOM 1177 N ASP A 76 22.857 38.739 60.410 1.00 12.61 N ATOM 1178 CA ASP A 76 23.498 38.387 61.658 1.00 13.75 C ATOM 1179 C ASP A 76 24.385 39.478 62.225 1.00 15.20 C ATOM 1180 O ASP A 76 25.200 39.235 63.131 1.00 16.43 O ATOM 1181 CB ASP A 76 24.239 37.053 61.582 1.00 13.11 C ATOM 1182 CG ASP A 76 25.333 37.074 60.546 1.00 13.49 C ATOM 1183 OD1 ASP A 76 25.122 37.585 59.410 1.00 12.95 O ATOM 1184 OD2 ASP A 76 26.445 36.532 60.848 1.00 15.43 O ATOM 1185 HA ASP A 76 22.676 38.269 62.364 1.00 0.00 H ATOM 1186 HB2 ASP A 76 24.680 36.839 62.556 1.00 0.00 H ATOM 1187 HB3 ASP A 76 23.527 36.268 61.327 1.00 0.00 H ATOM 1188 H ASP A 76 23.376 38.557 59.527 1.00 0.00 H ATOM 1189 N ASP A 77 24.243 40.698 61.724 1.00 13.94 N ATOM 1190 CA ASP A 77 24.894 41.847 62.245 1.00 15.31 C ATOM 1191 C ASP A 77 26.409 41.808 62.081 1.00 17.55 C ATOM 1192 O ASP A 77 27.110 42.502 62.823 1.00 22.07 O ATOM 1193 CB ASP A 77 24.571 42.003 63.761 1.00 18.66 C ATOM 1194 CG ASP A 77 23.070 42.151 63.947 1.00 28.61 C ATOM 1195 OD1 ASP A 77 22.496 43.002 63.233 1.00 31.39 O ATOM 1196 OD2 ASP A 77 22.495 41.408 64.759 1.00 30.28 O ATOM 1197 HA ASP A 77 24.516 42.693 61.671 1.00 0.00 H ATOM 1198 HB2 ASP A 77 24.919 41.121 64.299 1.00 0.00 H ATOM 1199 HB3 ASP A 77 25.075 42.888 64.151 1.00 0.00 H ATOM 1200 H ASP A 77 23.618 40.820 60.902 1.00 0.00 H ATOM 1201 N ARG A 78 26.927 41.257 61.002 1.00 15.00 N ATOM 1202 CA ARG A 78 28.311 41.545 60.620 1.00 15.27 C ATOM 1203 C ARG A 78 28.373 42.831 59.794 1.00 13.50 C ATOM 1204 O ARG A 78 27.491 42.996 58.957 1.00 15.63 O ATOM 1205 CB ARG A 78 28.874 40.396 59.787 1.00 14.81 C ATOM 1206 CG ARG A 78 29.183 39.144 60.667 1.00 15.96 C ATOM 1207 CD ARG A 78 29.569 37.991 59.731 1.00 14.61 C ATOM 1208 NE ARG A 78 28.450 37.437 59.055 1.00 11.97 N ATOM 1209 CZ ARG A 78 28.223 37.351 57.742 1.00 11.11 C ATOM 1210 NH1 ARG A 78 29.208 37.584 56.838 1.00 12.42 N ATOM 1211 NH2 ARG A 78 27.016 37.029 57.325 1.00 11.61 N ATOM 1212 HA ARG A 78 28.901 41.665 61.528 1.00 0.00 H ATOM 1213 HB2 ARG A 78 28.145 40.121 59.025 1.00 0.00 H ATOM 1214 HB3 ARG A 78 29.795 40.726 59.306 1.00 0.00 H ATOM 1215 HG2 ARG A 78 30.008 39.362 61.345 1.00 0.00 H ATOM 1216 HG3 ARG A 78 28.301 38.871 61.246 1.00 0.00 H ATOM 1217 HD2 ARG A 78 30.044 37.207 60.320 1.00 0.00 H ATOM 1218 HD3 ARG A 78 30.275 38.365 58.989 1.00 0.00 H ATOM 1219 HE ARG A 78 27.705 37.045 59.666 1.00 0.00 H ATOM 1220 HH12 ARG A 78 29.008 37.511 55.820 1.00 0.00 H ATOM 1221 HH11 ARG A 78 30.163 37.835 57.163 1.00 0.00 H ATOM 1222 HH22 ARG A 78 26.820 36.957 56.306 1.00 0.00 H ATOM 1223 HH21 ARG A 78 26.259 36.847 58.014 1.00 0.00 H ATOM 1224 H ARG A 78 26.351 40.616 60.420 1.00 0.00 H ATOM 1225 N LYS A 79 29.378 43.635 59.937 1.00 13.99 N ATOM 1226 CA LYS A 79 29.668 44.735 59.050 1.00 14.21 C ATOM 1227 C LYS A 79 30.742 44.364 58.075 1.00 11.97 C ATOM 1228 O LYS A 79 31.900 44.126 58.478 1.00 16.07 O ATOM 1229 CB LYS A 79 30.065 45.982 59.877 1.00 18.69 C ATOM 1230 CG LYS A 79 29.254 46.055 61.138 1.00 25.79 C ATOM 1231 CD LYS A 79 29.522 44.703 61.934 1.00 26.36 C ATOM 1232 CE LYS A 79 30.892 44.188 61.565 1.00 29.11 C ATOM 1233 NZ LYS A 79 31.174 42.779 61.973 1.00 27.78 N ATOM 1234 HA LYS A 79 28.774 44.972 58.474 1.00 0.00 H ATOM 1235 HB2 LYS A 79 31.123 45.921 60.133 1.00 0.00 H ATOM 1236 HB3 LYS A 79 29.887 46.878 59.283 1.00 0.00 H ATOM 1237 HG2 LYS A 79 29.565 46.911 61.736 1.00 0.00 H ATOM 1238 HG3 LYS A 79 28.195 46.147 60.899 1.00 0.00 H ATOM 1239 HD2 LYS A 79 29.478 44.893 63.006 1.00 0.00 H ATOM 1240 HD3 LYS A 79 28.767 43.963 61.666 1.00 0.00 H ATOM 1241 HE2 LYS A 79 31.633 44.831 62.039 1.00 0.00 H ATOM 1242 HE3 LYS A 79 30.996 44.253 60.482 1.00 0.00 H ATOM 1243 HZ1 LYS A 79 31.095 42.696 63.007 1.00 0.00 H ATOM 1244 HZ2 LYS A 79 30.487 42.144 61.519 1.00 0.00 H ATOM 1245 HZ3 LYS A 79 32.136 42.519 61.676 1.00 0.00 H ATOM 1246 H LYS A 79 30.017 43.478 60.743 1.00 0.00 H ATOM 1247 N VAL A 80 30.367 44.206 56.810 1.00 11.71 N ATOM 1248 CA VAL A 80 31.236 43.647 55.818 1.00 12.25 C ATOM 1249 C VAL A 80 31.400 44.583 54.609 1.00 10.11 C ATOM 1250 O VAL A 80 30.638 45.504 54.442 1.00 13.36 O ATOM 1251 CB VAL A 80 30.722 42.279 55.334 1.00 11.96 C ATOM 1252 CG1 VAL A 80 29.499 42.424 54.493 1.00 13.92 C ATOM 1253 CG2 VAL A 80 31.667 41.761 54.364 1.00 26.71 C ATOM 1254 HA VAL A 80 32.208 43.518 56.294 1.00 0.00 H ATOM 1255 HB VAL A 80 30.562 41.670 56.224 1.00 0.00 H ATOM 1256 HG11 VAL A 80 28.713 42.903 55.077 1.00 0.00 H ATOM 1257 HG12 VAL A 80 29.730 43.036 53.621 1.00 0.00 H ATOM 1258 HG13 VAL A 80 29.164 41.439 54.169 1.00 0.00 H ATOM 1259 HG21 VAL A 80 31.741 42.453 53.525 1.00 0.00 H ATOM 1260 HG22 VAL A 80 32.644 41.651 54.834 1.00 0.00 H ATOM 1261 HG23 VAL A 80 31.323 40.790 54.006 1.00 0.00 H ATOM 1262 H VAL A 80 29.409 44.498 56.530 1.00 0.00 H ATOM 1263 N LYS A 81 32.456 44.349 53.841 1.00 11.78 N ATOM 1264 CA LYS A 81 32.733 44.937 52.549 1.00 11.77 C ATOM 1265 C LYS A 81 32.337 43.908 51.495 1.00 10.22 C ATOM 1266 O LYS A 81 32.804 42.781 51.504 1.00 11.38 O ATOM 1267 CB LYS A 81 34.205 45.268 52.371 1.00 16.68 C ATOM 1268 CG LYS A 81 34.818 46.130 53.452 1.00 19.85 C ATOM 1269 CD LYS A 81 34.358 47.583 53.257 1.00 25.78 C ATOM 1270 CE LYS A 81 35.120 48.486 54.235 1.00 26.71 C ATOM 1271 NZ LYS A 81 34.492 49.804 54.350 1.00 26.93 N ATOM 1272 HA LYS A 81 32.174 45.868 52.457 1.00 0.00 H ATOM 1273 HB2 LYS A 81 34.758 44.329 52.337 1.00 0.00 H ATOM 1274 HB3 LYS A 81 34.319 45.790 51.421 1.00 0.00 H ATOM 1275 HG2 LYS A 81 34.496 45.773 54.430 1.00 0.00 H ATOM 1276 HG3 LYS A 81 35.905 46.079 53.388 1.00 0.00 H ATOM 1277 HD2 LYS A 81 34.564 47.897 52.234 1.00 0.00 H ATOM 1278 HD3 LYS A 81 33.288 47.656 53.450 1.00 0.00 H ATOM 1279 HE2 LYS A 81 36.143 48.611 53.879 1.00 0.00 H ATOM 1280 HE3 LYS A 81 35.134 48.013 55.217 1.00 0.00 H ATOM 1281 HZ1 LYS A 81 34.481 50.264 53.417 1.00 0.00 H ATOM 1282 HZ2 LYS A 81 33.517 49.693 54.695 1.00 0.00 H ATOM 1283 HZ3 LYS A 81 35.034 50.388 55.019 1.00 0.00 H ATOM 1284 H LYS A 81 33.157 43.673 54.206 1.00 0.00 H ATOM 1285 N SER A 82 31.426 44.305 50.602 1.00 8.94 N ATOM 1286 CA SER A 82 30.834 43.363 49.671 1.00 8.51 C ATOM 1287 C SER A 82 31.080 43.810 48.226 1.00 8.12 C ATOM 1288 O SER A 82 31.119 44.988 47.924 1.00 9.62 O ATOM 1289 CB SER A 82 29.313 43.274 49.891 1.00 10.39 C ATOM 1290 OG SER A 82 29.079 42.635 51.113 1.00 11.65 O ATOM 1291 HA SER A 82 31.296 42.391 49.845 1.00 0.00 H ATOM 1292 HB2 SER A 82 28.857 42.702 49.083 1.00 0.00 H ATOM 1293 HB3 SER A 82 28.885 44.276 49.912 1.00 0.00 H ATOM 1294 HG SER A 82 28.103 42.570 51.269 1.00 0.00 H ATOM 1295 H SER A 82 31.137 45.304 50.574 1.00 0.00 H ATOM 1296 N ILE A 83 31.102 42.824 47.347 1.00 9.02 N ATOM 1297 CA ILE A 83 31.063 43.061 45.923 1.00 9.75 C ATOM 1298 C ILE A 83 30.273 41.949 45.253 1.00 8.69 C ATOM 1299 O ILE A 83 30.398 40.822 45.689 1.00 10.35 O ATOM 1300 CB ILE A 83 32.449 43.193 45.330 1.00 11.81 C ATOM 1301 CG1 ILE A 83 32.468 43.657 43.873 1.00 15.18 C ATOM 1302 CG2 ILE A 83 33.283 41.942 45.505 1.00 16.76 C ATOM 1303 CD1 ILE A 83 33.795 44.279 43.475 1.00 21.52 C ATOM 1304 HA ILE A 83 30.565 44.013 45.742 1.00 0.00 H ATOM 1305 HB ILE A 83 32.910 43.991 45.912 1.00 0.00 H ATOM 1306 HG12 ILE A 83 32.278 42.797 43.230 1.00 0.00 H ATOM 1307 HG13 ILE A 83 31.679 44.396 43.731 1.00 0.00 H ATOM 1308 HD11 ILE A 83 33.992 45.146 44.105 1.00 0.00 H ATOM 1309 HD12 ILE A 83 34.591 43.546 43.604 1.00 0.00 H ATOM 1310 HD13 ILE A 83 33.751 44.590 42.431 1.00 0.00 H ATOM 1311 HG21 ILE A 83 33.394 41.726 46.568 1.00 0.00 H ATOM 1312 HG22 ILE A 83 32.788 41.105 45.013 1.00 0.00 H ATOM 1313 HG23 ILE A 83 34.266 42.097 45.060 1.00 0.00 H ATOM 1314 H ILE A 83 31.149 41.844 47.692 1.00 0.00 H ATOM 1315 N VAL A 84 29.472 42.291 44.274 1.00 8.23 N ATOM 1316 CA VAL A 84 28.662 41.311 43.508 1.00 8.22 C ATOM 1317 C VAL A 84 29.069 41.474 42.042 1.00 9.54 C ATOM 1318 O VAL A 84 29.219 42.542 41.515 1.00 10.76 O ATOM 1319 CB VAL A 84 27.158 41.631 43.644 1.00 9.07 C ATOM 1320 CG1 VAL A 84 26.324 40.568 42.927 1.00 12.53 C ATOM 1321 CG2 VAL A 84 26.776 41.635 45.140 1.00 10.62 C ATOM 1322 HA VAL A 84 28.831 40.299 43.876 1.00 0.00 H ATOM 1323 HB VAL A 84 26.961 42.606 43.198 1.00 0.00 H ATOM 1324 HG11 VAL A 84 26.591 40.550 41.870 1.00 0.00 H ATOM 1325 HG12 VAL A 84 26.523 39.592 43.370 1.00 0.00 H ATOM 1326 HG13 VAL A 84 25.266 40.807 43.031 1.00 0.00 H ATOM 1327 HG21 VAL A 84 26.983 40.655 45.569 1.00 0.00 H ATOM 1328 HG22 VAL A 84 27.361 42.392 45.661 1.00 0.00 H ATOM 1329 HG23 VAL A 84 25.714 41.861 45.242 1.00 0.00 H ATOM 1330 H VAL A 84 29.400 43.297 44.022 1.00 0.00 H ATOM 1331 N THR A 85 29.346 40.322 41.424 1.00 10.03 N ATOM 1332 CA THR A 85 29.733 40.283 40.017 1.00 10.77 C ATOM 1333 C THR A 85 28.964 39.112 39.348 1.00 9.39 C ATOM 1334 O THR A 85 28.365 38.292 39.984 1.00 11.92 O ATOM 1335 CB THR A 85 31.203 40.095 39.827 1.00 16.91 C ATOM 1336 OG1 THR A 85 31.648 38.850 40.409 1.00 20.78 O ATOM 1337 CG2 THR A 85 32.105 41.202 40.254 1.00 26.61 C ATOM 1338 HA THR A 85 29.482 41.241 39.562 1.00 0.00 H ATOM 1339 HB THR A 85 31.297 40.086 38.741 1.00 0.00 H ATOM 1340 HG1 THR A 85 31.451 38.852 41.379 1.00 0.00 H ATOM 1341 HG23 THR A 85 31.764 42.138 39.812 1.00 0.00 H ATOM 1342 HG21 THR A 85 32.087 41.285 41.341 1.00 0.00 H ATOM 1343 HG22 THR A 85 33.121 40.990 39.921 1.00 0.00 H ATOM 1344 H THR A 85 29.284 39.432 41.958 1.00 0.00 H ATOM 1345 N LEU A 86 28.947 39.131 38.011 1.00 10.13 N ATOM 1346 CA LEU A 86 28.477 38.085 37.170 1.00 11.15 C ATOM 1347 C LEU A 86 29.649 37.270 36.660 1.00 11.00 C ATOM 1348 O LEU A 86 30.615 37.861 36.149 1.00 13.32 O ATOM 1349 CB LEU A 86 27.659 38.690 36.041 1.00 16.00 C ATOM 1350 CG LEU A 86 26.733 37.852 35.225 1.00 22.98 C ATOM 1351 CD1 LEU A 86 25.570 37.344 36.145 1.00 21.17 C ATOM 1352 CD2 LEU A 86 26.134 38.632 34.063 1.00 24.64 C ATOM 1353 HA LEU A 86 27.832 37.405 37.727 1.00 0.00 H ATOM 1354 HB2 LEU A 86 27.052 39.478 36.486 1.00 0.00 H ATOM 1355 HB3 LEU A 86 28.372 39.132 35.345 1.00 0.00 H ATOM 1356 HG LEU A 86 27.304 37.020 34.814 1.00 0.00 H ATOM 1357 HD21 LEU A 86 25.573 39.483 34.449 1.00 0.00 H ATOM 1358 HD22 LEU A 86 26.935 38.987 33.414 1.00 0.00 H ATOM 1359 HD23 LEU A 86 25.467 37.982 33.497 1.00 0.00 H ATOM 1360 HD11 LEU A 86 25.986 36.751 36.960 1.00 0.00 H ATOM 1361 HD12 LEU A 86 25.032 38.199 36.554 1.00 0.00 H ATOM 1362 HD13 LEU A 86 24.886 36.730 35.559 1.00 0.00 H ATOM 1363 H LEU A 86 29.310 39.987 37.545 1.00 0.00 H ATOM 1364 N ASP A 87 29.659 35.971 36.917 1.00 9.99 N ATOM 1365 CA ASP A 87 30.827 35.150 36.575 1.00 9.21 C ATOM 1366 C ASP A 87 30.264 33.800 36.087 1.00 9.63 C ATOM 1367 O ASP A 87 29.610 33.078 36.818 1.00 11.09 O ATOM 1368 CB ASP A 87 31.629 34.892 37.860 1.00 12.74 C ATOM 1369 CG ASP A 87 32.865 34.066 37.657 1.00 16.09 C ATOM 1370 OD1 ASP A 87 33.037 33.432 36.625 1.00 16.06 O ATOM 1371 OD2 ASP A 87 33.710 34.029 38.609 1.00 24.40 O ATOM 1372 HA ASP A 87 31.460 35.630 35.829 1.00 0.00 H ATOM 1373 HB2 ASP A 87 31.925 35.854 38.278 1.00 0.00 H ATOM 1374 HB3 ASP A 87 30.983 34.373 38.568 1.00 0.00 H ATOM 1375 H ASP A 87 28.832 35.528 37.365 1.00 0.00 H ATOM 1376 N GLY A 88 30.463 33.551 34.783 1.00 8.42 N ATOM 1377 CA GLY A 88 29.912 32.318 34.223 1.00 12.06 C ATOM 1378 C GLY A 88 28.404 32.221 34.330 1.00 12.92 C ATOM 1379 O GLY A 88 27.894 31.131 34.367 1.00 15.51 O ATOM 1380 HA3 GLY A 88 30.350 31.473 34.754 1.00 0.00 H ATOM 1381 HA2 GLY A 88 30.187 32.265 33.169 1.00 0.00 H ATOM 1382 H GLY A 88 30.995 34.217 34.187 1.00 0.00 H ATOM 1383 N GLY A 89 27.708 33.375 34.308 1.00 11.73 N ATOM 1384 CA GLY A 89 26.296 33.396 34.390 1.00 11.73 C ATOM 1385 C GLY A 89 25.725 33.271 35.779 1.00 11.79 C ATOM 1386 O GLY A 89 24.506 33.357 35.936 1.00 16.22 O ATOM 1387 HA3 GLY A 89 25.912 32.569 33.793 1.00 0.00 H ATOM 1388 HA2 GLY A 89 25.949 34.339 33.967 1.00 0.00 H ATOM 1389 H GLY A 89 28.223 34.275 34.229 1.00 0.00 H ATOM 1390 N LYS A 90 26.588 33.174 36.782 1.00 10.73 N ATOM 1391 CA LYS A 90 26.274 33.148 38.188 1.00 10.52 C ATOM 1392 C LYS A 90 26.410 34.535 38.782 1.00 10.34 C ATOM 1393 O LYS A 90 27.290 35.306 38.433 1.00 11.77 O ATOM 1394 CB LYS A 90 27.197 32.169 38.935 1.00 12.25 C ATOM 1395 CG LYS A 90 27.225 30.790 38.428 1.00 20.62 C ATOM 1396 CD LYS A 90 28.267 29.886 39.085 1.00 24.57 C ATOM 1397 CE LYS A 90 29.676 30.444 38.699 1.00 34.66 C ATOM 1398 NZ LYS A 90 30.738 29.434 39.092 1.00 46.52 N ATOM 1399 HA LYS A 90 25.244 32.810 38.300 1.00 0.00 H ATOM 1400 HB2 LYS A 90 28.212 32.563 38.884 1.00 0.00 H ATOM 1401 HB3 LYS A 90 26.874 32.135 39.975 1.00 0.00 H ATOM 1402 HG2 LYS A 90 26.242 30.349 38.591 1.00 0.00 H ATOM 1403 HG3 LYS A 90 27.433 30.826 37.359 1.00 0.00 H ATOM 1404 HD2 LYS A 90 28.144 29.900 40.168 1.00 0.00 H ATOM 1405 HD3 LYS A 90 28.158 28.864 38.721 1.00 0.00 H ATOM 1406 HE2 LYS A 90 29.853 31.383 39.224 1.00 0.00 H ATOM 1407 HE3 LYS A 90 29.718 30.617 37.624 1.00 0.00 H ATOM 1408 HZ1 LYS A 90 30.696 29.270 40.118 1.00 0.00 H ATOM 1409 HZ2 LYS A 90 30.567 28.540 38.590 1.00 0.00 H ATOM 1410 HZ3 LYS A 90 31.676 29.802 38.836 1.00 0.00 H ATOM 1411 H LYS A 90 27.594 33.110 36.527 1.00 0.00 H ATOM 1412 N LEU A 91 25.551 34.828 39.739 1.00 9.48 N ATOM 1413 CA LEU A 91 25.677 36.051 40.509 1.00 9.48 C ATOM 1414 C LEU A 91 26.491 35.731 41.782 1.00 9.19 C ATOM 1415 O LEU A 91 26.032 34.894 42.585 1.00 12.23 O ATOM 1416 CB LEU A 91 24.264 36.530 40.864 1.00 15.42 C ATOM 1417 CG LEU A 91 23.994 37.928 41.179 1.00 21.48 C ATOM 1418 CD1 LEU A 91 24.407 38.902 40.040 1.00 20.41 C ATOM 1419 CD2 LEU A 91 22.462 38.118 41.397 1.00 25.66 C ATOM 1420 HA LEU A 91 26.188 36.835 39.951 1.00 0.00 H ATOM 1421 HB2 LEU A 91 23.630 36.277 40.014 1.00 0.00 H ATOM 1422 HB3 LEU A 91 23.952 35.952 41.734 1.00 0.00 H ATOM 1423 HG LEU A 91 24.579 38.159 42.069 1.00 0.00 H ATOM 1424 HD21 LEU A 91 21.929 37.838 40.488 1.00 0.00 H ATOM 1425 HD22 LEU A 91 22.133 37.486 42.222 1.00 0.00 H ATOM 1426 HD23 LEU A 91 22.257 39.162 41.633 1.00 0.00 H ATOM 1427 HD11 LEU A 91 25.476 38.806 39.852 1.00 0.00 H ATOM 1428 HD12 LEU A 91 23.854 38.655 39.134 1.00 0.00 H ATOM 1429 HD13 LEU A 91 24.179 39.925 40.338 1.00 0.00 H ATOM 1430 H LEU A 91 24.771 34.172 39.945 1.00 0.00 H ATOM 1431 N VAL A 92 27.649 36.274 41.887 1.00 9.79 N ATOM 1432 CA VAL A 92 28.592 35.933 42.953 1.00 9.72 C ATOM 1433 C VAL A 92 28.704 37.144 43.881 1.00 11.12 C ATOM 1434 O VAL A 92 29.156 38.199 43.450 1.00 11.04 O ATOM 1435 CB VAL A 92 29.982 35.590 42.316 1.00 10.45 C ATOM 1436 CG1 VAL A 92 30.972 35.342 43.425 1.00 13.23 C ATOM 1437 CG2 VAL A 92 29.836 34.410 41.398 1.00 13.35 C ATOM 1438 HA VAL A 92 28.252 35.067 43.521 1.00 0.00 H ATOM 1439 HB VAL A 92 30.353 36.419 41.714 1.00 0.00 H ATOM 1440 HG11 VAL A 92 31.057 36.237 44.042 1.00 0.00 H ATOM 1441 HG12 VAL A 92 30.628 34.508 44.037 1.00 0.00 H ATOM 1442 HG13 VAL A 92 31.945 35.102 42.995 1.00 0.00 H ATOM 1443 HG21 VAL A 92 29.475 33.552 41.965 1.00 0.00 H ATOM 1444 HG22 VAL A 92 29.124 34.651 40.609 1.00 0.00 H ATOM 1445 HG23 VAL A 92 30.804 34.173 40.956 1.00 0.00 H ATOM 1446 H VAL A 92 27.930 36.987 41.184 1.00 0.00 H ATOM 1447 N HIS A 93 28.327 36.936 45.137 1.00 9.31 N ATOM 1448 CA HIS A 93 28.387 37.928 46.189 1.00 10.21 C ATOM 1449 C HIS A 93 29.485 37.554 47.175 1.00 9.85 C ATOM 1450 O HIS A 93 29.417 36.512 47.811 1.00 11.91 O ATOM 1451 CB HIS A 93 27.020 38.038 46.849 1.00 12.17 C ATOM 1452 CG HIS A 93 26.853 39.023 47.923 1.00 11.06 C ATOM 1453 ND1 HIS A 93 25.640 39.224 48.523 1.00 15.45 N ATOM 1454 CD2 HIS A 93 27.719 39.919 48.494 1.00 12.78 C ATOM 1455 CE1 HIS A 93 25.790 40.186 49.435 1.00 15.15 C ATOM 1456 NE2 HIS A 93 27.027 40.559 49.464 1.00 12.35 N ATOM 1457 HA HIS A 93 28.636 38.909 45.784 1.00 0.00 H ATOM 1458 HB2 HIS A 93 26.301 38.284 46.068 1.00 0.00 H ATOM 1459 HB3 HIS A 93 26.781 37.060 47.266 1.00 0.00 H ATOM 1460 HD2 HIS A 93 28.761 40.084 48.220 1.00 0.00 H ATOM 1461 HE1 HIS A 93 24.994 40.594 50.058 1.00 0.00 H ATOM 1462 H HIS A 93 27.963 35.993 45.382 1.00 0.00 H ATOM 1463 N LEU A 94 30.546 38.380 47.225 1.00 9.42 N ATOM 1464 CA LEU A 94 31.649 38.151 48.149 1.00 9.68 C ATOM 1465 C LEU A 94 31.585 39.123 49.324 1.00 9.44 C ATOM 1466 O LEU A 94 31.469 40.329 49.043 1.00 11.75 O ATOM 1467 CB LEU A 94 32.984 38.281 47.455 1.00 13.01 C ATOM 1468 CG LEU A 94 34.270 38.250 48.245 1.00 15.44 C ATOM 1469 CD1 LEU A 94 34.560 36.944 48.943 1.00 20.70 C ATOM 1470 CD2 LEU A 94 35.445 38.644 47.346 1.00 24.06 C ATOM 1471 HA LEU A 94 31.551 37.132 48.524 1.00 0.00 H ATOM 1472 HB2 LEU A 94 33.041 37.465 46.734 1.00 0.00 H ATOM 1473 HB3 LEU A 94 32.968 39.233 46.924 1.00 0.00 H ATOM 1474 HG LEU A 94 34.137 38.977 49.046 1.00 0.00 H ATOM 1475 HD21 LEU A 94 35.516 37.942 46.515 1.00 0.00 H ATOM 1476 HD22 LEU A 94 35.284 39.651 46.960 1.00 0.00 H ATOM 1477 HD23 LEU A 94 36.368 38.619 47.925 1.00 0.00 H ATOM 1478 HD11 LEU A 94 33.757 36.723 49.646 1.00 0.00 H ATOM 1479 HD12 LEU A 94 34.628 36.146 48.204 1.00 0.00 H ATOM 1480 HD13 LEU A 94 35.504 37.023 49.482 1.00 0.00 H ATOM 1481 H LEU A 94 30.580 39.202 46.589 1.00 0.00 H ATOM 1482 N GLN A 95 31.620 38.644 50.535 1.00 8.94 N ATOM 1483 CA GLN A 95 31.666 39.477 51.746 1.00 8.61 C ATOM 1484 C GLN A 95 33.027 39.303 52.441 1.00 10.60 C ATOM 1485 O GLN A 95 33.425 38.155 52.639 1.00 12.06 O ATOM 1486 CB GLN A 95 30.554 39.095 52.748 1.00 8.69 C ATOM 1487 CG GLN A 95 29.144 39.314 52.172 1.00 8.48 C ATOM 1488 CD GLN A 95 28.090 38.795 53.103 1.00 9.59 C ATOM 1489 OE1 GLN A 95 28.343 37.934 53.956 1.00 10.86 O ATOM 1490 NE2 GLN A 95 26.879 39.310 52.920 1.00 11.52 N ATOM 1491 HA GLN A 95 31.517 40.512 51.437 1.00 0.00 H ATOM 1492 HB2 GLN A 95 30.666 38.043 53.011 1.00 0.00 H ATOM 1493 HB3 GLN A 95 30.665 39.706 53.644 1.00 0.00 H ATOM 1494 HG2 GLN A 95 28.986 40.381 52.015 1.00 0.00 H ATOM 1495 HG3 GLN A 95 29.064 38.792 51.218 1.00 0.00 H ATOM 1496 HE22 GLN A 95 26.726 40.032 52.187 1.00 0.00 H ATOM 1497 HE21 GLN A 95 26.084 38.992 53.510 1.00 0.00 H ATOM 1498 H GLN A 95 31.615 37.611 50.652 1.00 0.00 H ATOM 1499 N LYS A 96 33.629 40.450 52.800 1.00 11.86 N ATOM 1500 CA LYS A 96 34.920 40.378 53.526 1.00 13.08 C ATOM 1501 C LYS A 96 34.830 41.153 54.829 1.00 13.41 C ATOM 1502 O LYS A 96 34.320 42.302 54.828 1.00 13.63 O ATOM 1503 CB LYS A 96 36.026 40.997 52.666 1.00 14.92 C ATOM 1504 CG LYS A 96 36.348 40.299 51.399 1.00 20.18 C ATOM 1505 CD LYS A 96 37.380 41.021 50.543 1.00 28.19 C ATOM 1506 CE LYS A 96 38.514 40.094 50.152 1.00 36.59 C ATOM 1507 NZ LYS A 96 38.060 39.016 49.218 1.00 42.20 N ATOM 1508 HA LYS A 96 35.146 39.332 53.736 1.00 0.00 H ATOM 1509 HB2 LYS A 96 35.722 42.013 52.416 1.00 0.00 H ATOM 1510 HB3 LYS A 96 36.935 41.028 53.267 1.00 0.00 H ATOM 1511 HG2 LYS A 96 36.734 39.309 51.641 1.00 0.00 H ATOM 1512 HG3 LYS A 96 35.430 40.198 50.819 1.00 0.00 H ATOM 1513 HD2 LYS A 96 36.896 41.392 49.639 1.00 0.00 H ATOM 1514 HD3 LYS A 96 37.785 41.861 51.107 1.00 0.00 H ATOM 1515 HE2 LYS A 96 38.918 39.632 51.053 1.00 0.00 H ATOM 1516 HE3 LYS A 96 39.294 40.678 49.663 1.00 0.00 H ATOM 1517 HZ1 LYS A 96 37.320 38.449 49.679 1.00 0.00 H ATOM 1518 HZ2 LYS A 96 37.679 39.447 48.352 1.00 0.00 H ATOM 1519 HZ3 LYS A 96 38.867 38.406 48.977 1.00 0.00 H ATOM 1520 H LYS A 96 33.198 41.369 52.573 1.00 0.00 H ATOM 1521 N TRP A 97 35.355 40.605 55.907 1.00 14.30 N ATOM 1522 CA TRP A 97 35.399 41.275 57.204 1.00 17.45 C ATOM 1523 C TRP A 97 36.482 40.606 58.059 1.00 18.95 C ATOM 1524 O TRP A 97 36.559 39.396 58.102 1.00 18.47 O ATOM 1525 CB TRP A 97 34.052 41.276 57.896 1.00 17.15 C ATOM 1526 CG TRP A 97 33.659 40.009 58.535 1.00 17.28 C ATOM 1527 CD1 TRP A 97 33.606 39.742 59.875 1.00 19.89 C ATOM 1528 CD2 TRP A 97 33.256 38.774 57.892 1.00 13.69 C ATOM 1529 NE1 TRP A 97 33.211 38.455 60.094 1.00 18.60 N ATOM 1530 CE2 TRP A 97 32.998 37.833 58.885 1.00 15.22 C ATOM 1531 CE3 TRP A 97 33.115 38.399 56.554 1.00 13.65 C ATOM 1532 CZ2 TRP A 97 32.601 36.522 58.571 1.00 15.48 C ATOM 1533 CZ3 TRP A 97 32.719 37.124 56.245 1.00 15.06 C ATOM 1534 CH2 TRP A 97 32.471 36.193 57.263 1.00 15.88 C ATOM 1535 HA TRP A 97 35.650 42.325 57.055 1.00 0.00 H ATOM 1536 HB2 TRP A 97 34.072 42.047 58.666 1.00 0.00 H ATOM 1537 HB3 TRP A 97 33.294 41.525 57.153 1.00 0.00 H ATOM 1538 HE1 TRP A 97 33.090 38.013 61.028 1.00 0.00 H ATOM 1539 HD1 TRP A 97 33.846 40.459 60.660 1.00 0.00 H ATOM 1540 HZ2 TRP A 97 32.404 35.792 59.356 1.00 0.00 H ATOM 1541 HH2 TRP A 97 32.167 35.181 56.996 1.00 0.00 H ATOM 1542 HZ3 TRP A 97 32.596 36.832 55.202 1.00 0.00 H ATOM 1543 HE3 TRP A 97 33.319 39.117 55.760 1.00 0.00 H ATOM 1544 H TRP A 97 35.757 39.649 55.830 1.00 0.00 H ATOM 1545 N ASP A 98 37.253 41.412 58.737 1.00 20.94 N ATOM 1546 CA ASP A 98 38.208 40.888 59.727 1.00 23.74 C ATOM 1547 C ASP A 98 39.093 39.807 59.143 1.00 23.53 C ATOM 1548 O ASP A 98 39.510 38.855 59.840 1.00 27.12 O ATOM 1549 CB ASP A 98 37.400 40.349 60.899 1.00 31.39 C ATOM 1550 CG ASP A 98 36.574 41.392 61.608 1.00 31.43 C ATOM 1551 OD1 ASP A 98 37.096 42.504 61.838 1.00 37.60 O ATOM 1552 OD2 ASP A 98 35.403 41.119 61.924 1.00 41.23 O ATOM 1553 HA ASP A 98 38.876 41.687 60.050 1.00 0.00 H ATOM 1554 HB2 ASP A 98 36.729 39.576 60.526 1.00 0.00 H ATOM 1555 HB3 ASP A 98 38.091 39.911 61.619 1.00 0.00 H ATOM 1556 H ASP A 98 37.192 42.438 58.576 1.00 0.00 H ATOM 1557 N GLY A 99 39.494 39.931 57.896 1.00 20.02 N ATOM 1558 CA GLY A 99 40.330 38.975 57.244 1.00 20.19 C ATOM 1559 C GLY A 99 39.660 37.696 56.820 1.00 17.84 C ATOM 1560 O GLY A 99 40.305 36.813 56.230 1.00 18.69 O ATOM 1561 HA3 GLY A 99 41.139 38.718 57.927 1.00 0.00 H ATOM 1562 HA2 GLY A 99 40.745 39.446 56.353 1.00 0.00 H ATOM 1563 H GLY A 99 39.187 40.767 57.359 1.00 0.00 H ATOM 1564 N GLN A 100 38.363 37.587 57.083 1.00 16.50 N ATOM 1565 CA GLN A 100 37.601 36.420 56.677 1.00 15.95 C ATOM 1566 C GLN A 100 36.782 36.751 55.399 1.00 13.86 C ATOM 1567 O GLN A 100 36.611 37.907 55.086 1.00 13.66 O ATOM 1568 CB GLN A 100 36.485 36.144 57.760 1.00 19.04 C ATOM 1569 CG GLN A 100 37.080 35.824 59.091 1.00 25.19 C ATOM 1570 CD GLN A 100 36.065 35.255 60.066 1.00 24.78 C ATOM 1571 OE1 GLN A 100 35.880 35.859 61.136 1.00 32.69 O ATOM 1572 NE2 GLN A 100 35.431 34.198 59.648 1.00 29.78 N ATOM 1573 HA GLN A 100 38.297 35.593 56.537 1.00 0.00 H ATOM 1574 HB2 GLN A 100 35.858 37.030 57.856 1.00 0.00 H ATOM 1575 HB3 GLN A 100 35.875 35.302 57.433 1.00 0.00 H ATOM 1576 HG2 GLN A 100 37.876 35.093 58.950 1.00 0.00 H ATOM 1577 HG3 GLN A 100 37.497 36.737 59.515 1.00 0.00 H ATOM 1578 HE22 GLN A 100 35.673 33.776 58.729 1.00 0.00 H ATOM 1579 HE21 GLN A 100 34.682 33.775 60.233 1.00 0.00 H ATOM 1580 H GLN A 100 37.882 38.356 57.592 1.00 0.00 H ATOM 1581 N GLU A 101 36.241 35.703 54.812 1.00 13.65 N ATOM 1582 CA GLU A 101 35.435 35.869 53.600 1.00 13.48 C ATOM 1583 C GLU A 101 34.309 34.807 53.608 1.00 11.26 C ATOM 1584 O GLU A 101 34.465 33.709 54.096 1.00 12.55 O ATOM 1585 CB GLU A 101 36.136 35.801 52.326 1.00 25.00 C ATOM 1586 CG GLU A 101 37.125 34.763 51.967 1.00 29.94 C ATOM 1587 CD GLU A 101 38.016 35.281 50.773 1.00 31.43 C ATOM 1588 OE1 GLU A 101 38.784 36.202 50.996 1.00 40.40 O ATOM 1589 OE2 GLU A 101 37.658 34.863 49.682 1.00 42.19 O ATOM 1590 HA GLU A 101 35.067 36.894 53.652 1.00 0.00 H ATOM 1591 HB2 GLU A 101 35.357 35.739 51.566 1.00 0.00 H ATOM 1592 HB3 GLU A 101 36.661 36.751 52.229 1.00 0.00 H ATOM 1593 HG2 GLU A 101 37.758 34.550 52.828 1.00 0.00 H ATOM 1594 HG3 GLU A 101 36.605 33.853 51.666 1.00 0.00 H ATOM 1595 H GLU A 101 36.387 34.754 55.211 1.00 0.00 H ATOM 1596 N THR A 102 33.210 35.184 52.993 1.00 9.52 N ATOM 1597 CA THR A 102 32.195 34.193 52.665 1.00 10.51 C ATOM 1598 C THR A 102 31.616 34.524 51.294 1.00 9.84 C ATOM 1599 O THR A 102 31.545 35.728 50.974 1.00 10.50 O ATOM 1600 CB THR A 102 31.061 34.204 53.713 1.00 10.75 C ATOM 1601 OG1 THR A 102 30.215 33.093 53.526 1.00 14.06 O ATOM 1602 CG2 THR A 102 30.261 35.418 53.848 1.00 12.25 C ATOM 1603 HA THR A 102 32.651 33.203 52.660 1.00 0.00 H ATOM 1604 HB THR A 102 31.604 34.157 54.657 1.00 0.00 H ATOM 1605 HG1 THR A 102 30.740 32.260 53.625 1.00 0.00 H ATOM 1606 HG23 THR A 102 30.922 36.273 53.992 1.00 0.00 H ATOM 1607 HG21 THR A 102 29.669 35.563 52.945 1.00 0.00 H ATOM 1608 HG22 THR A 102 29.598 35.321 54.707 1.00 0.00 H ATOM 1609 H THR A 102 33.067 36.183 52.742 1.00 0.00 H ATOM 1610 N THR A 103 31.200 33.525 50.560 1.00 10.22 N ATOM 1611 CA THR A 103 30.594 33.661 49.275 1.00 8.85 C ATOM 1612 C THR A 103 29.150 33.174 49.243 1.00 10.63 C ATOM 1613 O THR A 103 28.826 32.177 49.879 1.00 11.12 O ATOM 1614 CB THR A 103 31.398 32.986 48.129 1.00 12.61 C ATOM 1615 OG1 THR A 103 31.448 31.592 48.381 1.00 16.08 O ATOM 1616 CG2 THR A 103 32.792 33.539 48.098 1.00 15.08 C ATOM 1617 HA THR A 103 30.601 34.736 49.095 1.00 0.00 H ATOM 1618 HB THR A 103 30.918 33.180 47.170 1.00 0.00 H ATOM 1619 HG1 THR A 103 30.527 31.230 48.409 1.00 0.00 H ATOM 1620 HG23 THR A 103 32.752 34.611 47.904 1.00 0.00 H ATOM 1621 HG21 THR A 103 33.274 33.360 49.059 1.00 0.00 H ATOM 1622 HG22 THR A 103 33.359 33.047 47.308 1.00 0.00 H ATOM 1623 H THR A 103 31.319 32.564 50.939 1.00 0.00 H ATOM 1624 N LEU A 104 28.333 33.966 48.574 1.00 7.90 N ATOM 1625 CA LEU A 104 26.915 33.661 48.330 1.00 8.22 C ATOM 1626 C LEU A 104 26.765 33.644 46.781 1.00 8.48 C ATOM 1627 O LEU A 104 26.829 34.686 46.177 1.00 10.74 O ATOM 1628 CB LEU A 104 26.023 34.687 48.944 1.00 10.36 C ATOM 1629 CG LEU A 104 26.146 34.926 50.456 1.00 14.51 C ATOM 1630 CD1 LEU A 104 27.263 35.980 50.686 1.00 17.86 C ATOM 1631 CD2 LEU A 104 24.834 35.503 51.003 1.00 20.44 C ATOM 1632 HA LEU A 104 26.625 32.711 48.779 1.00 0.00 H ATOM 1633 HB2 LEU A 104 26.226 35.635 48.447 1.00 0.00 H ATOM 1634 HB3 LEU A 104 24.995 34.386 48.744 1.00 0.00 H ATOM 1635 HG LEU A 104 26.372 33.985 50.958 1.00 0.00 H ATOM 1636 HD21 LEU A 104 24.619 36.449 50.506 1.00 0.00 H ATOM 1637 HD22 LEU A 104 24.023 34.800 50.815 1.00 0.00 H ATOM 1638 HD23 LEU A 104 24.931 35.669 52.076 1.00 0.00 H ATOM 1639 HD11 LEU A 104 28.204 35.603 50.286 1.00 0.00 H ATOM 1640 HD12 LEU A 104 26.996 36.907 50.178 1.00 0.00 H ATOM 1641 HD13 LEU A 104 27.370 36.167 51.754 1.00 0.00 H ATOM 1642 H LEU A 104 28.714 34.857 48.198 1.00 0.00 H ATOM 1643 N VAL A 105 26.615 32.427 46.256 1.00 8.22 N ATOM 1644 CA VAL A 105 26.590 32.284 44.797 1.00 7.87 C ATOM 1645 C VAL A 105 25.201 31.858 44.366 1.00 7.61 C ATOM 1646 O VAL A 105 24.652 30.858 44.888 1.00 9.97 O ATOM 1647 CB VAL A 105 27.650 31.280 44.348 1.00 10.18 C ATOM 1648 CG1 VAL A 105 27.609 31.022 42.866 1.00 14.01 C ATOM 1649 CG2 VAL A 105 29.009 31.700 44.800 1.00 14.66 C ATOM 1650 HA VAL A 105 26.823 33.238 44.324 1.00 0.00 H ATOM 1651 HB VAL A 105 27.416 30.330 44.828 1.00 0.00 H ATOM 1652 HG11 VAL A 105 26.632 30.623 42.595 1.00 0.00 H ATOM 1653 HG12 VAL A 105 27.783 31.956 42.331 1.00 0.00 H ATOM 1654 HG13 VAL A 105 28.383 30.301 42.602 1.00 0.00 H ATOM 1655 HG21 VAL A 105 29.247 32.675 44.374 1.00 0.00 H ATOM 1656 HG22 VAL A 105 29.025 31.764 45.888 1.00 0.00 H ATOM 1657 HG23 VAL A 105 29.744 30.967 44.467 1.00 0.00 H ATOM 1658 H VAL A 105 26.517 31.594 46.871 1.00 0.00 H ATOM 1659 N ARG A 106 24.620 32.553 43.407 1.00 8.09 N ATOM 1660 CA ARG A 106 23.328 32.215 42.892 1.00 8.03 C ATOM 1661 C ARG A 106 23.404 31.770 41.442 1.00 9.39 C ATOM 1662 O ARG A 106 24.027 32.434 40.622 1.00 9.89 O ATOM 1663 CB ARG A 106 22.373 33.407 43.049 1.00 10.26 C ATOM 1664 CG ARG A 106 21.938 33.690 44.475 1.00 9.34 C ATOM 1665 CD ARG A 106 21.129 34.949 44.584 1.00 12.88 C ATOM 1666 NE ARG A 106 20.608 35.123 45.939 1.00 12.03 N ATOM 1667 CZ ARG A 106 21.178 35.870 46.867 1.00 9.83 C ATOM 1668 NH1 ARG A 106 22.328 36.453 46.580 1.00 12.32 N ATOM 1669 NH2 ARG A 106 20.626 36.046 48.073 1.00 12.19 N ATOM 1670 HA ARG A 106 22.941 31.374 43.468 1.00 0.00 H ATOM 1671 HB2 ARG A 106 22.873 34.296 42.664 1.00 0.00 H ATOM 1672 HB3 ARG A 106 21.481 33.208 42.455 1.00 0.00 H ATOM 1673 HG2 ARG A 106 21.336 32.854 44.831 1.00 0.00 H ATOM 1674 HG3 ARG A 106 22.826 33.788 45.100 1.00 0.00 H ATOM 1675 HD2 ARG A 106 20.294 34.898 43.885 1.00 0.00 H ATOM 1676 HD3 ARG A 106 21.760 35.801 44.333 1.00 0.00 H ATOM 1677 HE ARG A 106 19.730 34.625 46.189 1.00 0.00 H ATOM 1678 HH12 ARG A 106 22.801 37.047 47.290 1.00 0.00 H ATOM 1679 HH11 ARG A 106 22.760 36.318 45.644 1.00 0.00 H ATOM 1680 HH22 ARG A 106 21.102 36.641 48.781 1.00 0.00 H ATOM 1681 HH21 ARG A 106 19.721 35.588 48.303 1.00 0.00 H ATOM 1682 H ARG A 106 25.118 33.376 43.011 1.00 0.00 H ATOM 1683 N GLU A 107 22.796 30.605 41.168 1.00 10.62 N ATOM 1684 CA GLU A 107 22.797 30.125 39.793 1.00 13.07 C ATOM 1685 C GLU A 107 21.393 29.659 39.441 1.00 12.09 C ATOM 1686 O GLU A 107 20.674 29.183 40.318 1.00 15.25 O ATOM 1687 CB GLU A 107 23.788 29.018 39.614 1.00 17.44 C ATOM 1688 CG GLU A 107 23.619 27.717 40.204 1.00 26.00 C ATOM 1689 CD GLU A 107 24.941 26.938 40.253 1.00 26.28 C ATOM 1690 OE1 GLU A 107 25.550 26.760 39.154 1.00 28.16 O ATOM 1691 OE2 GLU A 107 25.311 26.629 41.417 1.00 34.73 O ATOM 1692 HA GLU A 107 23.092 30.933 39.124 1.00 0.00 H ATOM 1693 HB2 GLU A 107 23.865 28.854 38.539 1.00 0.00 H ATOM 1694 HB3 GLU A 107 24.737 29.399 39.991 1.00 0.00 H ATOM 1695 HG2 GLU A 107 23.241 27.836 41.219 1.00 0.00 H ATOM 1696 HG3 GLU A 107 22.898 27.152 39.613 1.00 0.00 H ATOM 1697 H GLU A 107 22.334 30.057 41.922 1.00 0.00 H ATOM 1698 N LEU A 108 21.037 29.761 38.191 1.00 14.04 N ATOM 1699 CA LEU A 108 19.730 29.219 37.762 1.00 15.76 C ATOM 1700 C LEU A 108 20.005 27.878 37.030 1.00 16.44 C ATOM 1701 O LEU A 108 20.764 27.791 36.093 1.00 16.35 O ATOM 1702 CB LEU A 108 19.208 30.224 36.694 1.00 19.63 C ATOM 1703 CG LEU A 108 18.794 31.571 37.375 1.00 20.31 C ATOM 1704 CD1 LEU A 108 17.550 31.348 38.183 1.00 26.37 C ATOM 1705 CD2 LEU A 108 19.941 32.076 38.212 1.00 23.64 C ATOM 1706 HA LEU A 108 19.036 29.077 38.591 1.00 0.00 H ATOM 1707 HB2 LEU A 108 19.995 30.416 35.965 1.00 0.00 H ATOM 1708 HB3 LEU A 108 18.343 29.795 36.188 1.00 0.00 H ATOM 1709 HG LEU A 108 18.572 32.334 36.629 1.00 0.00 H ATOM 1710 HD21 LEU A 108 20.184 31.338 38.977 1.00 0.00 H ATOM 1711 HD22 LEU A 108 20.810 32.240 37.575 1.00 0.00 H ATOM 1712 HD23 LEU A 108 19.656 33.014 38.688 1.00 0.00 H ATOM 1713 HD11 LEU A 108 16.749 31.006 37.528 1.00 0.00 H ATOM 1714 HD12 LEU A 108 17.744 30.594 38.946 1.00 0.00 H ATOM 1715 HD13 LEU A 108 17.256 32.283 38.660 1.00 0.00 H ATOM 1716 H LEU A 108 21.667 30.219 37.502 1.00 0.00 H ATOM 1717 N ILE A 109 19.286 26.893 37.544 1.00 16.92 N ATOM 1718 CA ILE A 109 19.391 25.495 37.030 1.00 22.35 C ATOM 1719 C ILE A 109 17.945 24.986 36.899 1.00 24.00 C ATOM 1720 O ILE A 109 17.237 24.946 37.922 1.00 23.44 O ATOM 1721 CB ILE A 109 20.086 24.623 38.104 1.00 23.27 C ATOM 1722 CG1 ILE A 109 21.569 25.078 38.370 1.00 28.00 C ATOM 1723 CG2 ILE A 109 20.146 23.175 37.567 1.00 31.70 C ATOM 1724 CD1 ILE A 109 22.407 24.996 37.127 1.00 34.57 C ATOM 1725 HA ILE A 109 19.944 25.453 36.092 1.00 0.00 H ATOM 1726 HB ILE A 109 19.520 24.713 39.031 1.00 0.00 H ATOM 1727 HG12 ILE A 109 21.564 26.108 38.726 1.00 0.00 H ATOM 1728 HG13 ILE A 109 22.005 24.433 39.133 1.00 0.00 H ATOM 1729 HD11 ILE A 109 22.423 23.967 36.768 1.00 0.00 H ATOM 1730 HD12 ILE A 109 21.981 25.643 36.360 1.00 0.00 H ATOM 1731 HD13 ILE A 109 23.423 25.319 37.354 1.00 0.00 H ATOM 1732 HG21 ILE A 109 19.134 22.815 37.383 1.00 0.00 H ATOM 1733 HG22 ILE A 109 20.715 23.157 36.637 1.00 0.00 H ATOM 1734 HG23 ILE A 109 20.632 22.535 38.304 1.00 0.00 H ATOM 1735 H ILE A 109 18.631 27.098 38.326 1.00 0.00 H ATOM 1736 N ASP A 110 17.518 24.702 35.681 1.00 27.21 N ATOM 1737 CA ASP A 110 16.181 24.168 35.475 1.00 28.65 C ATOM 1738 C ASP A 110 15.067 25.072 35.986 1.00 26.49 C ATOM 1739 O ASP A 110 14.067 24.573 36.499 1.00 30.40 O ATOM 1740 CB ASP A 110 16.107 22.851 36.330 1.00 35.00 C ATOM 1741 CG ASP A 110 16.515 21.692 35.435 1.00 42.00 C ATOM 1742 OD1 ASP A 110 16.230 21.795 34.223 1.00 54.78 O ATOM 1743 OD2 ASP A 110 17.099 20.722 35.957 1.00 46.26 O ATOM 1744 HA ASP A 110 16.033 24.039 34.403 1.00 0.00 H ATOM 1745 HB2 ASP A 110 16.787 22.921 37.179 1.00 0.00 H ATOM 1746 HB3 ASP A 110 15.090 22.700 36.692 1.00 0.00 H ATOM 1747 H ASP A 110 18.142 24.861 34.864 1.00 0.00 H ATOM 1748 N GLY A 111 15.268 26.383 35.901 1.00 25.68 N ATOM 1749 CA GLY A 111 14.285 27.350 36.292 1.00 24.25 C ATOM 1750 C GLY A 111 14.243 27.666 37.768 1.00 21.64 C ATOM 1751 O GLY A 111 13.483 28.553 38.176 1.00 21.69 O ATOM 1752 HA3 GLY A 111 13.305 26.972 36.000 1.00 0.00 H ATOM 1753 HA2 GLY A 111 14.490 28.276 35.755 1.00 0.00 H ATOM 1754 H GLY A 111 16.180 26.723 35.534 1.00 0.00 H ATOM 1755 N LYS A 112 15.072 26.998 38.556 1.00 17.14 N ATOM 1756 CA LYS A 112 15.124 27.215 39.988 1.00 16.19 C ATOM 1757 C LYS A 112 16.374 28.079 40.296 1.00 15.10 C ATOM 1758 O LYS A 112 17.359 27.995 39.584 1.00 16.63 O ATOM 1759 CB LYS A 112 15.204 25.941 40.782 1.00 18.33 C ATOM 1760 CG LYS A 112 13.991 25.006 40.662 1.00 25.20 C ATOM 1761 CD LYS A 112 14.082 23.829 41.590 1.00 32.02 C ATOM 1762 CE LYS A 112 12.856 22.959 41.618 1.00 40.30 C ATOM 1763 NZ LYS A 112 12.151 22.949 40.306 1.00 42.56 N ATOM 1764 HA LYS A 112 14.198 27.710 40.282 1.00 0.00 H ATOM 1765 HB2 LYS A 112 16.085 25.392 40.448 1.00 0.00 H ATOM 1766 HB3 LYS A 112 15.320 26.207 41.833 1.00 0.00 H ATOM 1767 HG2 LYS A 112 13.089 25.570 40.899 1.00 0.00 H ATOM 1768 HG3 LYS A 112 13.931 24.640 39.637 1.00 0.00 H ATOM 1769 HD2 LYS A 112 14.928 23.215 41.280 1.00 0.00 H ATOM 1770 HD3 LYS A 112 14.257 24.203 42.599 1.00 0.00 H ATOM 1771 HE2 LYS A 112 12.175 23.334 42.381 1.00 0.00 H ATOM 1772 HE3 LYS A 112 13.152 21.940 41.867 1.00 0.00 H ATOM 1773 HZ1 LYS A 112 11.858 23.917 40.064 1.00 0.00 H ATOM 1774 HZ2 LYS A 112 12.792 22.585 39.572 1.00 0.00 H ATOM 1775 HZ3 LYS A 112 11.312 22.337 40.369 1.00 0.00 H ATOM 1776 H LYS A 112 15.708 26.293 38.132 1.00 0.00 H ATOM 1777 N LEU A 113 16.319 28.812 41.383 1.00 12.88 N ATOM 1778 CA LEU A 113 17.476 29.612 41.782 1.00 12.05 C ATOM 1779 C LEU A 113 18.188 28.871 42.904 1.00 11.74 C ATOM 1780 O LEU A 113 17.552 28.595 43.949 1.00 12.45 O ATOM 1781 CB LEU A 113 16.988 30.979 42.202 1.00 16.70 C ATOM 1782 CG LEU A 113 18.001 32.031 42.623 1.00 22.32 C ATOM 1783 CD1 LEU A 113 18.942 31.791 43.713 1.00 36.13 C ATOM 1784 CD2 LEU A 113 18.966 32.335 41.462 1.00 31.82 C ATOM 1785 HA LEU A 113 18.186 29.754 40.967 1.00 0.00 H ATOM 1786 HB2 LEU A 113 16.432 31.391 41.360 1.00 0.00 H ATOM 1787 HB3 LEU A 113 16.313 30.831 43.045 1.00 0.00 H ATOM 1788 HG LEU A 113 17.299 32.796 42.953 1.00 0.00 H ATOM 1789 HD21 LEU A 113 19.493 31.423 41.181 1.00 0.00 H ATOM 1790 HD22 LEU A 113 18.399 32.706 40.608 1.00 0.00 H ATOM 1791 HD23 LEU A 113 19.686 33.090 41.778 1.00 0.00 H ATOM 1792 HD11 LEU A 113 18.389 31.596 44.632 1.00 0.00 H ATOM 1793 HD12 LEU A 113 19.564 30.929 43.471 1.00 0.00 H ATOM 1794 HD13 LEU A 113 19.573 32.670 43.847 1.00 0.00 H ATOM 1795 H LEU A 113 15.454 28.824 41.960 1.00 0.00 H ATOM 1796 N ILE A 114 19.426 28.483 42.679 1.00 10.73 N ATOM 1797 CA ILE A 114 20.201 27.746 43.678 1.00 11.37 C ATOM 1798 C ILE A 114 21.231 28.686 44.309 1.00 9.59 C ATOM 1799 O ILE A 114 22.037 29.292 43.617 1.00 12.32 O ATOM 1800 CB ILE A 114 20.926 26.537 43.093 1.00 13.20 C ATOM 1801 CG1 ILE A 114 20.019 25.581 42.335 1.00 16.66 C ATOM 1802 CG2 ILE A 114 21.736 25.823 44.172 1.00 14.84 C ATOM 1803 CD1 ILE A 114 18.668 25.359 42.995 1.00 25.70 C ATOM 1804 HA ILE A 114 19.497 27.375 44.423 1.00 0.00 H ATOM 1805 HB ILE A 114 21.614 26.924 42.341 1.00 0.00 H ATOM 1806 HG12 ILE A 114 19.851 25.986 41.337 1.00 0.00 H ATOM 1807 HG13 ILE A 114 20.524 24.619 42.255 1.00 0.00 H ATOM 1808 HD11 ILE A 114 18.816 24.942 43.991 1.00 0.00 H ATOM 1809 HD12 ILE A 114 18.142 26.311 43.072 1.00 0.00 H ATOM 1810 HD13 ILE A 114 18.081 24.665 42.393 1.00 0.00 H ATOM 1811 HG21 ILE A 114 22.473 26.511 44.586 1.00 0.00 H ATOM 1812 HG22 ILE A 114 21.067 25.486 44.963 1.00 0.00 H ATOM 1813 HG23 ILE A 114 22.245 24.964 43.734 1.00 0.00 H ATOM 1814 H ILE A 114 19.866 28.707 41.764 1.00 0.00 H ATOM 1815 N LEU A 115 21.111 28.842 45.629 1.00 8.55 N ATOM 1816 CA LEU A 115 21.994 29.698 46.406 1.00 8.56 C ATOM 1817 C LEU A 115 22.944 28.816 47.217 1.00 8.87 C ATOM 1818 O LEU A 115 22.511 28.005 48.015 1.00 9.80 O ATOM 1819 CB LEU A 115 21.156 30.558 47.384 1.00 9.59 C ATOM 1820 CG LEU A 115 21.915 31.341 48.431 1.00 10.24 C ATOM 1821 CD1 LEU A 115 22.865 32.339 47.808 1.00 12.91 C ATOM 1822 CD2 LEU A 115 21.026 31.967 49.485 1.00 14.51 C ATOM 1823 HA LEU A 115 22.556 30.349 45.736 1.00 0.00 H ATOM 1824 HB2 LEU A 115 20.585 31.271 46.789 1.00 0.00 H ATOM 1825 HB3 LEU A 115 20.470 29.890 47.905 1.00 0.00 H ATOM 1826 HG LEU A 115 22.521 30.611 48.968 1.00 0.00 H ATOM 1827 HD21 LEU A 115 20.327 32.654 49.008 1.00 0.00 H ATOM 1828 HD22 LEU A 115 20.472 31.184 50.002 1.00 0.00 H ATOM 1829 HD23 LEU A 115 21.642 32.512 50.201 1.00 0.00 H ATOM 1830 HD11 LEU A 115 23.587 31.811 47.185 1.00 0.00 H ATOM 1831 HD12 LEU A 115 22.301 33.043 47.196 1.00 0.00 H ATOM 1832 HD13 LEU A 115 23.390 32.880 48.596 1.00 0.00 H ATOM 1833 H LEU A 115 20.353 28.329 46.124 1.00 0.00 H ATOM 1834 N THR A 116 24.227 28.972 46.933 1.00 8.98 N ATOM 1835 CA THR A 116 25.246 28.218 47.660 1.00 9.52 C ATOM 1836 C THR A 116 26.063 29.194 48.529 1.00 8.73 C ATOM 1837 O THR A 116 26.580 30.171 48.025 1.00 10.39 O ATOM 1838 CB THR A 116 26.249 27.590 46.674 1.00 11.93 C ATOM 1839 OG1 THR A 116 25.452 26.655 45.842 1.00 24.19 O ATOM 1840 CG2 THR A 116 27.190 26.731 47.463 1.00 22.04 C ATOM 1841 HA THR A 116 24.746 27.452 48.253 1.00 0.00 H ATOM 1842 HB THR A 116 26.782 28.347 46.098 1.00 0.00 H ATOM 1843 HG1 THR A 116 24.744 27.159 45.367 1.00 0.00 H ATOM 1844 HG23 THR A 116 27.809 27.363 48.100 1.00 0.00 H ATOM 1845 HG21 THR A 116 26.617 26.040 48.081 1.00 0.00 H ATOM 1846 HG22 THR A 116 27.826 26.168 46.780 1.00 0.00 H ATOM 1847 H THR A 116 24.513 29.637 46.186 1.00 0.00 H ATOM 1848 N LEU A 117 26.118 28.888 49.819 1.00 8.88 N ATOM 1849 CA LEU A 117 26.781 29.680 50.822 1.00 9.02 C ATOM 1850 C LEU A 117 27.980 28.914 51.378 1.00 8.25 C ATOM 1851 O LEU A 117 27.811 27.785 51.811 1.00 10.88 O ATOM 1852 CB LEU A 117 25.796 29.945 51.995 1.00 10.03 C ATOM 1853 CG LEU A 117 24.436 30.578 51.648 1.00 10.57 C ATOM 1854 CD1 LEU A 117 23.465 30.296 52.787 1.00 19.42 C ATOM 1855 CD2 LEU A 117 24.581 32.041 51.479 1.00 21.85 C ATOM 1856 HA LEU A 117 27.110 30.617 50.373 1.00 0.00 H ATOM 1857 HB2 LEU A 117 25.598 28.988 52.479 1.00 0.00 H ATOM 1858 HB3 LEU A 117 26.297 30.610 52.699 1.00 0.00 H ATOM 1859 HG LEU A 117 24.063 30.152 50.716 1.00 0.00 H ATOM 1860 HD21 LEU A 117 24.952 32.478 52.406 1.00 0.00 H ATOM 1861 HD22 LEU A 117 25.286 32.244 50.673 1.00 0.00 H ATOM 1862 HD23 LEU A 117 23.612 32.475 51.234 1.00 0.00 H ATOM 1863 HD11 LEU A 117 23.353 29.219 52.909 1.00 0.00 H ATOM 1864 HD12 LEU A 117 23.853 30.729 53.709 1.00 0.00 H ATOM 1865 HD13 LEU A 117 22.496 30.739 52.555 1.00 0.00 H ATOM 1866 H LEU A 117 25.648 28.013 50.128 1.00 0.00 H ATOM 1867 N THR A 118 29.167 29.539 51.335 1.00 8.53 N ATOM 1868 CA THR A 118 30.384 28.859 51.748 1.00 8.75 C ATOM 1869 C THR A 118 31.088 29.754 52.775 1.00 9.48 C ATOM 1870 O THR A 118 31.320 30.939 52.477 1.00 11.35 O ATOM 1871 CB THR A 118 31.326 28.643 50.527 1.00 11.32 C ATOM 1872 OG1 THR A 118 30.653 27.769 49.596 1.00 13.37 O ATOM 1873 CG2 THR A 118 32.549 27.824 50.954 1.00 16.45 C ATOM 1874 HA THR A 118 30.142 27.885 52.173 1.00 0.00 H ATOM 1875 HB THR A 118 31.592 29.618 50.120 1.00 0.00 H ATOM 1876 HG1 THR A 118 31.234 27.617 48.809 1.00 0.00 H ATOM 1877 HG23 THR A 118 33.138 28.399 51.669 1.00 0.00 H ATOM 1878 HG21 THR A 118 32.218 26.895 51.418 1.00 0.00 H ATOM 1879 HG22 THR A 118 33.157 27.598 50.078 1.00 0.00 H ATOM 1880 H THR A 118 29.217 30.523 51.002 1.00 0.00 H ATOM 1881 N HIS A 119 31.461 29.181 53.905 1.00 9.61 N ATOM 1882 CA HIS A 119 32.363 29.884 54.845 1.00 11.06 C ATOM 1883 C HIS A 119 33.197 28.810 55.540 1.00 12.96 C ATOM 1884 O HIS A 119 32.596 27.862 56.039 1.00 12.78 O ATOM 1885 CB HIS A 119 31.598 30.654 55.909 1.00 11.91 C ATOM 1886 CG HIS A 119 32.444 31.235 56.984 1.00 12.72 C ATOM 1887 ND1 HIS A 119 33.244 32.344 56.858 1.00 16.46 N ATOM 1888 CD2 HIS A 119 32.539 30.818 58.269 1.00 12.98 C ATOM 1889 CE1 HIS A 119 33.847 32.565 58.054 1.00 13.81 C ATOM 1890 NE2 HIS A 119 33.401 31.663 58.889 1.00 17.73 N ATOM 1891 HA HIS A 119 32.968 30.601 54.290 1.00 0.00 H ATOM 1892 HB2 HIS A 119 31.063 31.468 55.420 1.00 0.00 H ATOM 1893 HB3 HIS A 119 30.881 29.975 56.370 1.00 0.00 H ATOM 1894 HD2 HIS A 119 32.023 29.969 58.718 1.00 0.00 H ATOM 1895 HE1 HIS A 119 34.570 33.350 58.277 1.00 0.00 H ATOM 1896 H HIS A 119 31.118 28.227 54.137 1.00 0.00 H ATOM 1897 N GLY A 120 34.474 28.987 55.631 1.00 15.43 N ATOM 1898 CA GLY A 120 35.326 27.937 56.202 1.00 16.45 C ATOM 1899 C GLY A 120 35.169 26.649 55.466 1.00 15.27 C ATOM 1900 O GLY A 120 35.238 26.666 54.237 1.00 19.68 O ATOM 1901 HA3 GLY A 120 35.051 27.785 57.246 1.00 0.00 H ATOM 1902 HA2 GLY A 120 36.367 28.254 56.144 1.00 0.00 H ATOM 1903 H GLY A 120 34.899 29.876 55.299 1.00 0.00 H ATOM 1904 N THR A 121 34.817 25.556 56.118 1.00 16.10 N ATOM 1905 CA THR A 121 34.548 24.297 55.435 1.00 15.81 C ATOM 1906 C THR A 121 33.075 24.030 55.248 1.00 14.49 C ATOM 1907 O THR A 121 32.706 23.061 54.586 1.00 17.37 O ATOM 1908 CB THR A 121 35.147 23.095 56.236 1.00 16.00 C ATOM 1909 OG1 THR A 121 34.568 23.100 57.542 1.00 15.91 O ATOM 1910 CG2 THR A 121 36.633 23.209 56.344 1.00 20.00 C ATOM 1911 HA THR A 121 35.016 24.391 54.455 1.00 0.00 H ATOM 1912 HB THR A 121 34.921 22.164 55.716 1.00 0.00 H ATOM 1913 HG1 THR A 121 34.935 22.345 58.067 1.00 0.00 H ATOM 1914 HG23 THR A 121 37.070 23.205 55.345 1.00 0.00 H ATOM 1915 HG21 THR A 121 36.889 24.140 56.850 1.00 0.00 H ATOM 1916 HG22 THR A 121 37.020 22.365 56.915 1.00 0.00 H ATOM 1917 H THR A 121 34.729 25.595 57.154 1.00 0.00 H ATOM 1918 N ALA A 122 32.217 24.964 55.718 1.00 12.54 N ATOM 1919 CA ALA A 122 30.771 24.756 55.675 1.00 11.81 C ATOM 1920 C ALA A 122 30.243 25.169 54.311 1.00 10.84 C ATOM 1921 O ALA A 122 30.481 26.284 53.873 1.00 15.15 O ATOM 1922 CB ALA A 122 30.116 25.604 56.786 1.00 16.12 C ATOM 1923 HA ALA A 122 30.534 23.705 55.837 1.00 0.00 H ATOM 1924 HB1 ALA A 122 30.507 25.295 57.755 1.00 0.00 H ATOM 1925 HB2 ALA A 122 30.344 26.657 56.620 1.00 0.00 H ATOM 1926 HB3 ALA A 122 29.036 25.457 56.764 1.00 0.00 H ATOM 1927 H ALA A 122 32.593 25.847 56.118 1.00 0.00 H ATOM 1928 N VAL A 123 29.408 24.338 53.740 1.00 11.48 N ATOM 1929 CA VAL A 123 28.746 24.611 52.479 1.00 12.09 C ATOM 1930 C VAL A 123 27.244 24.270 52.609 1.00 9.95 C ATOM 1931 O VAL A 123 26.872 23.169 52.937 1.00 14.08 O ATOM 1932 CB VAL A 123 29.351 23.829 51.324 1.00 12.94 C ATOM 1933 CG1 VAL A 123 28.634 24.049 50.021 1.00 20.12 C ATOM 1934 CG2 VAL A 123 30.837 23.967 51.215 1.00 18.85 C ATOM 1935 HA VAL A 123 28.880 25.670 52.257 1.00 0.00 H ATOM 1936 HB VAL A 123 29.186 22.781 51.574 1.00 0.00 H ATOM 1937 HG11 VAL A 123 27.595 23.737 50.123 1.00 0.00 H ATOM 1938 HG12 VAL A 123 28.673 25.107 49.760 1.00 0.00 H ATOM 1939 HG13 VAL A 123 29.116 23.462 49.239 1.00 0.00 H ATOM 1940 HG21 VAL A 123 31.093 25.016 51.066 1.00 0.00 H ATOM 1941 HG22 VAL A 123 31.302 23.604 52.131 1.00 0.00 H ATOM 1942 HG23 VAL A 123 31.194 23.381 50.368 1.00 0.00 H ATOM 1943 H VAL A 123 29.209 23.435 54.216 1.00 0.00 H ATOM 1944 N CYS A 124 26.431 25.295 52.352 1.00 9.31 N ATOM 1945 CA CYS A 124 24.985 25.189 52.445 1.00 8.58 C ATOM 1946 C CYS A 124 24.378 25.423 51.079 1.00 8.90 C ATOM 1947 O CYS A 124 24.830 26.339 50.333 1.00 10.31 O ATOM 1948 CB CYS A 124 24.482 26.205 53.476 1.00 11.23 C ATOM 1949 SG CYS A 124 22.736 26.646 53.389 1.00 10.92 S ATOM 1950 HA CYS A 124 24.688 24.193 52.774 1.00 0.00 H ATOM 1951 HB2 CYS A 124 25.061 27.120 53.349 1.00 0.00 H ATOM 1952 HB3 CYS A 124 24.670 25.792 54.467 1.00 0.00 H ATOM 1953 HG CYS A 124 21.968 25.514 53.570 1.00 0.00 H ATOM 1954 H CYS A 124 26.848 26.206 52.074 1.00 0.00 H ATOM 1955 N THR A 125 23.342 24.680 50.728 1.00 9.31 N ATOM 1956 CA THR A 125 22.641 24.871 49.476 1.00 11.05 C ATOM 1957 C THR A 125 21.160 25.150 49.778 1.00 8.85 C ATOM 1958 O THR A 125 20.508 24.365 50.439 1.00 11.21 O ATOM 1959 CB THR A 125 22.769 23.702 48.563 1.00 14.17 C ATOM 1960 OG1 THR A 125 24.081 23.252 48.413 1.00 22.99 O ATOM 1961 CG2 THR A 125 22.143 23.880 47.233 1.00 17.51 C ATOM 1962 HA THR A 125 23.094 25.718 48.960 1.00 0.00 H ATOM 1963 HB THR A 125 22.198 22.932 49.082 1.00 0.00 H ATOM 1964 HG1 THR A 125 24.438 22.979 49.295 1.00 0.00 H ATOM 1965 HG23 THR A 125 21.119 24.231 47.359 1.00 0.00 H ATOM 1966 HG21 THR A 125 22.712 24.612 46.660 1.00 0.00 H ATOM 1967 HG22 THR A 125 22.139 22.927 46.704 1.00 0.00 H ATOM 1968 H THR A 125 23.019 23.932 51.374 1.00 0.00 H ATOM 1969 N ARG A 126 20.700 26.289 49.237 1.00 8.65 N ATOM 1970 CA ARG A 126 19.314 26.655 49.403 1.00 9.67 C ATOM 1971 C ARG A 126 18.640 26.786 48.058 1.00 8.78 C ATOM 1972 O ARG A 126 19.224 27.398 47.164 1.00 12.90 O ATOM 1973 CB ARG A 126 19.264 27.996 50.180 1.00 13.60 C ATOM 1974 CG ARG A 126 19.625 27.628 51.662 1.00 15.57 C ATOM 1975 CD ARG A 126 19.852 28.704 52.545 1.00 14.10 C ATOM 1976 NE ARG A 126 18.709 29.561 52.857 1.00 11.78 N ATOM 1977 CZ ARG A 126 17.866 29.445 53.873 1.00 9.46 C ATOM 1978 NH1 ARG A 126 17.719 28.348 54.553 1.00 12.12 N ATOM 1979 NH2 ARG A 126 17.145 30.492 54.224 1.00 12.14 N ATOM 1980 HA ARG A 126 18.782 25.884 49.960 1.00 0.00 H ATOM 1981 HB2 ARG A 126 19.989 28.701 49.773 1.00 0.00 H ATOM 1982 HB3 ARG A 126 18.266 28.432 50.126 1.00 0.00 H ATOM 1983 HG2 ARG A 126 18.803 27.037 52.066 1.00 0.00 H ATOM 1984 HG3 ARG A 126 20.530 27.021 51.641 1.00 0.00 H ATOM 1985 HD2 ARG A 126 20.625 29.334 52.104 1.00 0.00 H ATOM 1986 HD3 ARG A 126 20.217 28.288 53.484 1.00 0.00 H ATOM 1987 HE ARG A 126 18.538 30.354 52.206 1.00 0.00 H ATOM 1988 HH12 ARG A 126 17.042 28.312 55.342 1.00 0.00 H ATOM 1989 HH11 ARG A 126 18.278 27.506 54.309 1.00 0.00 H ATOM 1990 HH22 ARG A 126 16.478 30.421 55.019 1.00 0.00 H ATOM 1991 HH21 ARG A 126 17.244 31.389 53.706 1.00 0.00 H ATOM 1992 H ARG A 126 21.341 26.907 48.699 1.00 0.00 H ATOM 1993 N THR A 127 17.459 26.209 47.917 1.00 9.72 N ATOM 1994 CA THR A 127 16.792 26.211 46.627 1.00 10.36 C ATOM 1995 C THR A 127 15.552 27.103 46.683 1.00 10.08 C ATOM 1996 O THR A 127 14.735 26.944 47.622 1.00 11.09 O ATOM 1997 CB THR A 127 16.376 24.787 46.217 1.00 11.26 C ATOM 1998 OG1 THR A 127 17.570 23.951 46.166 1.00 15.19 O ATOM 1999 CG2 THR A 127 15.791 24.783 44.834 1.00 15.51 C ATOM 2000 HA THR A 127 17.492 26.597 45.886 1.00 0.00 H ATOM 2001 HB THR A 127 15.645 24.422 46.938 1.00 0.00 H ATOM 2002 HG1 THR A 127 17.316 23.031 45.903 1.00 0.00 H ATOM 2003 HG23 THR A 127 14.891 25.398 44.820 1.00 0.00 H ATOM 2004 HG21 THR A 127 16.520 25.187 44.131 1.00 0.00 H ATOM 2005 HG22 THR A 127 15.539 23.761 44.550 1.00 0.00 H ATOM 2006 H THR A 127 17.006 25.752 48.734 1.00 0.00 H ATOM 2007 N TYR A 128 15.416 28.016 45.752 1.00 11.06 N ATOM 2008 CA TYR A 128 14.306 28.917 45.612 1.00 11.22 C ATOM 2009 C TYR A 128 13.522 28.655 44.327 1.00 12.12 C ATOM 2010 O TYR A 128 14.098 28.399 43.264 1.00 13.03 O ATOM 2011 CB TYR A 128 14.810 30.378 45.606 1.00 11.12 C ATOM 2012 CG TYR A 128 15.261 30.868 46.949 1.00 10.07 C ATOM 2013 CD1 TYR A 128 16.497 30.661 47.524 1.00 10.43 C ATOM 2014 CD2 TYR A 128 14.377 31.702 47.650 1.00 10.16 C ATOM 2015 CE1 TYR A 128 16.808 31.188 48.793 1.00 11.96 C ATOM 2016 CE2 TYR A 128 14.680 32.209 48.870 1.00 11.43 C ATOM 2017 CZ TYR A 128 15.881 31.950 49.452 1.00 10.83 C ATOM 2018 OH TYR A 128 16.105 32.522 50.697 1.00 12.67 O ATOM 2019 HA TYR A 128 13.642 28.751 46.460 1.00 0.00 H ATOM 2020 HB3 TYR A 128 14.000 31.020 45.260 1.00 0.00 H ATOM 2021 HB2 TYR A 128 15.649 30.449 44.914 1.00 0.00 H ATOM 2022 HD2 TYR A 128 13.416 31.950 47.199 1.00 0.00 H ATOM 2023 HE2 TYR A 128 13.952 32.832 49.390 1.00 0.00 H ATOM 2024 HE1 TYR A 128 17.779 30.991 49.247 1.00 0.00 H ATOM 2025 HD1 TYR A 128 17.247 30.079 46.987 1.00 0.00 H ATOM 2026 HH TYR A 128 17.005 32.266 51.019 1.00 0.00 H ATOM 2027 H TYR A 128 16.181 28.095 45.052 1.00 0.00 H ATOM 2028 N GLU A 129 12.197 28.805 44.420 1.00 12.48 N ATOM 2029 CA GLU A 129 11.363 28.677 43.218 1.00 13.67 C ATOM 2030 C GLU A 129 10.656 29.982 42.924 1.00 12.37 C ATOM 2031 O GLU A 129 10.311 30.725 43.834 1.00 12.96 O ATOM 2032 CB GLU A 129 10.347 27.539 43.468 1.00 18.37 C ATOM 2033 CG GLU A 129 10.982 26.185 43.276 1.00 24.00 C ATOM 2034 CD GLU A 129 9.956 25.053 43.345 1.00 26.73 C ATOM 2035 OE1 GLU A 129 8.772 25.320 43.594 1.00 30.52 O ATOM 2036 OE2 GLU A 129 10.425 23.913 43.248 1.00 38.41 O ATOM 2037 HA GLU A 129 11.978 28.441 42.350 1.00 0.00 H ATOM 2038 HB2 GLU A 129 9.973 27.614 44.489 1.00 0.00 H ATOM 2039 HB3 GLU A 129 9.517 27.644 42.770 1.00 0.00 H ATOM 2040 HG2 GLU A 129 11.469 26.160 42.301 1.00 0.00 H ATOM 2041 HG3 GLU A 129 11.727 26.032 44.057 1.00 0.00 H ATOM 2042 H GLU A 129 11.758 29.012 45.340 1.00 0.00 H ATOM 2043 N LYS A 130 10.416 30.233 41.632 1.00 13.99 N ATOM 2044 CA LYS A 130 9.878 31.535 41.230 1.00 16.02 C ATOM 2045 C LYS A 130 8.385 31.625 41.548 1.00 19.70 C ATOM 2046 O LYS A 130 7.647 30.663 41.284 1.00 25.75 O ATOM 2047 CB LYS A 130 10.111 31.740 39.721 1.00 22.49 C ATOM 2048 CG LYS A 130 9.994 33.186 39.302 1.00 30.30 C ATOM 2049 CD LYS A 130 10.261 33.308 37.798 1.00 32.81 C ATOM 2050 CE LYS A 130 11.509 34.160 37.587 1.00 34.51 C ATOM 2051 NZ LYS A 130 11.149 35.558 37.438 1.00 37.37 N ATOM 2052 HA LYS A 130 10.392 32.317 41.788 1.00 0.00 H ATOM 2053 HB2 LYS A 130 11.111 31.385 39.471 1.00 0.00 H ATOM 2054 HB3 LYS A 130 9.372 31.157 39.172 1.00 0.00 H ATOM 2055 HG2 LYS A 130 8.990 33.548 39.523 1.00 0.00 H ATOM 2056 HG3 LYS A 130 10.723 33.783 39.850 1.00 0.00 H ATOM 2057 HD2 LYS A 130 10.417 32.317 37.372 1.00 0.00 H ATOM 2058 HD3 LYS A 130 9.408 33.781 37.311 1.00 0.00 H ATOM 2059 HE2 LYS A 130 12.025 33.824 36.688 1.00 0.00 H ATOM 2060 HE3 LYS A 130 12.170 34.049 38.447 1.00 0.00 H ATOM 2061 HZ1 LYS A 130 10.521 35.667 36.616 1.00 0.00 H ATOM 2062 HZ2 LYS A 130 10.659 35.882 38.296 1.00 0.00 H ATOM 2063 HZ3 LYS A 130 12.010 36.123 37.295 1.00 0.00 H ATOM 2064 H LYS A 130 10.611 29.506 40.915 1.00 0.00 H ATOM 2065 N GLU A 131 7.995 32.733 42.155 1.00 21.65 N ATOM 2066 CA GLU A 131 6.598 33.107 42.400 1.00 25.29 C ATOM 2067 C GLU A 131 6.158 34.090 41.272 1.00 24.24 C ATOM 2068 O GLU A 131 6.856 35.082 41.017 1.00 30.76 O ATOM 2069 CB GLU A 131 6.553 33.852 43.740 1.00 30.48 C ATOM 2070 CG GLU A 131 5.249 34.440 44.206 1.00 35.10 C ATOM 2071 CD GLU A 131 5.348 35.035 45.603 1.00 41.76 C ATOM 2072 OE1 GLU A 131 6.203 34.571 46.390 1.00 46.40 O ATOM 2073 OE2 GLU A 131 4.607 36.008 45.916 1.00 50.08 O ATOM 2074 HA GLU A 131 5.947 32.233 42.417 1.00 0.00 H ATOM 2075 HB2 GLU A 131 6.879 33.149 44.507 1.00 0.00 H ATOM 2076 HB3 GLU A 131 7.268 34.672 43.673 1.00 0.00 H ATOM 2077 HG2 GLU A 131 4.950 35.225 43.511 1.00 0.00 H ATOM 2078 HG3 GLU A 131 4.493 33.655 44.212 1.00 0.00 H ATOM 2079 H GLU A 131 8.733 33.388 42.483 1.00 0.00 H TER 2080 GLU A 131 HETATM 2081 O HOH 1 24.588 36.022 44.844 1.00 13.03 O HETATM 2082 O HOH 2 15.719 30.095 56.632 1.00 23.29 O HETATM 2083 O HOH 3 22.217 39.328 55.173 1.00 14.36 O HETATM 2084 O HOH 4 23.221 38.114 48.601 1.00 21.12 O HETATM 2085 O HOH 5 19.735 38.405 54.273 1.00 13.55 O HETATM 2086 O HOH 6 19.544 36.948 51.735 1.00 14.63 O HETATM 2087 O HOH 7 18.216 34.835 49.097 1.00 13.40 O HETATM 2088 O HOH 8 22.016 38.072 50.932 1.00 29.92 O HETATM 2089 O HOH 9 18.333 33.578 46.700 1.00 17.13 O HETATM 2090 O HOH 10 28.866 45.090 43.875 1.00 10.15 O HETATM 2091 O HOH 11 22.279 41.863 53.913 1.00 14.41 O HETATM 2092 O HOH 12 18.638 41.238 51.106 1.00 13.56 O HETATM 2093 O HOH 13 21.266 40.811 51.300 1.00 19.86 O HETATM 2094 O HOH 14 26.582 35.936 54.611 1.00 13.11 O HETATM 2095 O HOH 15 23.782 39.175 52.002 1.00 30.91 O HETATM 2096 O HOH 16 24.435 38.015 54.034 1.00 19.30 O HETATM 2097 O HOH 17 33.042 51.542 46.794 1.00 20.06 O HETATM 2098 O HOH 18 28.686 51.556 50.413 1.00 21.85 O HETATM 2099 O HOH 19 9.829 22.846 58.041 1.00 25.27 O HETATM 2100 O HOH 20 10.949 40.593 37.020 1.00 28.74 O HETATM 2101 O HOH 21 11.995 42.462 39.094 1.00 16.17 O HETATM 2102 O HOH 22 13.223 44.756 37.887 1.00 11.95 O HETATM 2103 O HOH 23 11.496 47.034 38.238 1.00 15.39 O HETATM 2104 O HOH 24 8.606 36.873 39.872 1.00 27.08 O HETATM 2105 O HOH 25 33.753 36.421 40.602 1.00 33.16 O HETATM 2106 O HOH 26 25.174 29.617 70.781 1.00 35.80 O HETATM 2107 O HOH 27 11.396 27.283 68.433 1.00 70.87 O HETATM 2108 O HOH 28 8.162 26.885 58.853 1.00 24.02 O HETATM 2109 O HOH 29 12.456 20.501 50.302 1.00 21.71 O HETATM 2110 O HOH 30 34.680 35.148 45.018 1.00 46.41 O HETATM 2111 O HOH 31 21.273 46.145 35.427 1.00 47.40 O HETATM 2112 O HOH 32 8.692 22.727 55.547 1.00 31.91 O HETATM 2113 O HOH 33 14.921 30.859 69.501 1.00 48.90 O HETATM 2114 O HOH 34 10.558 20.374 54.493 1.00 31.95 O HETATM 2115 O HOH 35 14.748 21.240 53.159 1.00 21.59 O HETATM 2116 O HOH 36 11.990 21.270 46.740 1.00 75.41 O HETATM 2117 O HOH 37 15.615 17.905 51.159 1.00 16.61 O HETATM 2118 O HOH 38 21.420 44.403 54.802 1.00 17.93 O HETATM 2119 O HOH 39 18.195 21.866 44.649 1.00 36.97 O HETATM 2120 O HOH 40 14.561 48.966 41.884 1.00 18.93 O HETATM 2121 O HOH 41 12.499 45.735 51.917 1.00 16.79 O HETATM 2122 O HOH 42 7.191 33.180 63.067 1.00 50.87 O HETATM 2123 O HOH 43 11.261 28.210 39.861 1.00 23.91 O HETATM 2124 O HOH 44 34.049 37.508 43.422 1.00 38.62 O HETATM 2125 O HOH 45 18.443 36.923 30.272 1.00 46.71 O HETATM 2126 O HOH 46 11.116 50.745 40.711 1.00 22.32 O HETATM 2127 O HOH 47 35.608 31.254 54.044 1.00 25.35 O HETATM 2128 O HOH 48 37.237 33.045 55.991 1.00 32.35 O HETATM 2129 O HOH 49 41.079 38.372 52.555 1.00 43.27 O HETATM 2130 O HOH 50 34.068 31.287 50.620 1.00 43.89 O HETATM 2131 O HOH 51 16.535 16.906 48.330 1.00 28.07 O HETATM 2132 O HOH 52 35.753 24.793 52.013 1.00 33.04 O HETATM 2133 O HOH 53 25.915 36.514 65.085 1.00 32.53 O HETATM 2134 O HOH 54 18.651 22.977 48.629 1.00 16.17 O HETATM 2135 O HOH 55 19.330 23.820 56.140 1.00 10.28 O HETATM 2136 O HOH 56 17.314 48.843 42.023 1.00 11.33 O HETATM 2137 O HOH 57 13.583 49.996 47.929 1.00 15.25 O HETATM 2138 O HOH 58 30.043 24.625 61.219 1.00 28.45 O HETATM 2139 O HOH 59 30.836 21.966 57.957 1.00 32.44 O HETATM 2140 O HOH 60 36.888 31.173 60.025 1.00 65.65 O HETATM 2141 O HOH 61 31.819 23.879 59.458 1.00 33.68 O HETATM 2142 O HOH 62 8.470 40.529 55.856 1.00 33.62 O HETATM 2143 O HOH 63 37.050 43.808 55.010 1.00 44.25 O HETATM 2144 O HOH 64 38.859 39.442 54.309 1.00 27.18 O HETATM 2145 O HOH 65 25.236 46.960 37.744 1.00 20.67 O HETATM 2146 O HOH 66 17.837 34.023 29.990 1.00 33.99 O HETATM 2147 O HOH 67 33.669 26.167 58.890 1.00 23.73 O HETATM 2148 O HOH 68 34.883 49.125 44.017 1.00 21.33 O HETATM 2149 O HOH 69 13.058 25.810 71.819 1.00 54.47 O HETATM 2150 O HOH 70 19.265 24.559 72.262 1.00 24.96 O HETATM 2151 O HOH 71 30.130 27.860 41.520 1.00 42.11 O HETATM 2152 O HOH 72 21.554 31.944 71.407 1.00 26.15 O HETATM 2153 O HOH 73 16.120 27.067 56.705 1.00 32.68 O HETATM 2154 O HOH 74 17.177 23.989 64.420 1.00 16.21 O HETATM 2155 O HOH 75 16.874 52.551 48.842 1.00 26.38 O HETATM 2156 O HOH 76 17.881 49.895 48.791 1.00 18.79 O HETATM 2157 O HOH 77 28.737 51.192 46.130 1.00 22.03 O HETATM 2158 O HOH 78 15.324 22.302 55.628 1.00 33.38 O HETATM 2159 O HOH 79 27.707 49.043 44.589 1.00 12.74 O HETATM 2160 O HOH 80 12.093 24.229 57.885 1.00 30.46 O HETATM 2161 O HOH 81 23.051 17.799 48.840 1.00 45.49 O HETATM 2162 O HOH 82 23.266 46.603 54.533 1.00 19.20 O HETATM 2163 O HOH 83 12.373 21.410 56.435 1.00 30.80 O HETATM 2164 O HOH 84 6.901 40.402 45.220 1.00 35.14 O HETATM 2165 O HOH 85 8.742 40.474 41.306 1.00 35.88 O HETATM 2166 O HOH 86 14.705 51.982 41.919 1.00 20.09 O HETATM 2167 O HOH 87 37.460 30.230 56.658 1.00 57.99 O HETATM 2168 O HOH 88 30.143 28.252 45.582 1.00 26.58 O HETATM 2169 O HOH 89 29.421 29.770 47.856 1.00 13.95 O HETATM 2170 O HOH 90 23.004 30.917 36.270 1.00 20.60 O HETATM 2171 O HOH 91 24.705 27.974 43.577 1.00 16.26 O HETATM 2172 O HOH 92 25.183 21.746 50.795 1.00 27.82 O HETATM 2173 O HOH 93 12.259 41.097 34.524 1.00 26.79 O HETATM 2174 O HOH 94 12.559 30.721 36.349 1.00 38.29 O HETATM 2175 O HOH 95 31.588 50.063 35.689 1.00 37.23 O HETATM 2176 O HOH 96 15.510 50.142 45.430 1.00 27.44 O HETATM 2177 O HOH 97 28.740 21.803 55.413 1.00 29.63 O HETATM 2178 O HOH 98 39.270 32.466 60.601 1.00 61.19 O HETATM 2179 O HOH 99 31.071 47.698 56.141 1.00 29.15 O HETATM 2180 O HOH 100 12.806 48.861 39.946 1.00 26.91 O HETATM 2181 O HOH 101 29.390 30.352 69.191 1.00 46.48 O HETATM 2182 O HOH 102 15.141 45.573 59.577 1.00 46.90 O HETATM 2183 O HOH 103 8.892 40.731 59.186 1.00 46.62 O HETATM 2184 O HOH 104 9.030 33.736 56.421 1.00 28.17 O HETATM 2185 O HOH 105 7.583 24.336 58.547 1.00 22.62 O HETATM 2186 O HOH 106 25.890 29.420 34.930 1.00 38.81 O HETATM 2187 O HOH 107 5.790 34.003 55.244 1.00 64.41 O HETATM 2188 O HOH 108 7.540 40.134 50.662 1.00 36.79 O HETATM 2189 O HOH 109 32.190 39.010 43.651 1.00 21.67 O HETATM 2190 O HOH 110 34.090 41.867 49.247 1.00 21.00 O HETATM 2191 O HOH 111 31.690 26.030 47.894 1.00 31.55 O HETATM 2192 O HOH 112 28.399 27.443 43.052 1.00 50.69 O HETATM 2193 O HOH 113 36.290 28.726 52.687 1.00 42.90 O HETATM 2194 O HOH 114 19.764 37.259 65.925 1.00 33.91 O HETATM 2195 O HOH 115 27.514 39.359 64.542 1.00 50.53 O HETATM 2196 O HOH 116 27.572 36.063 63.190 1.00 22.59 O HETATM 2197 O HOH 117 38.629 37.318 62.132 1.00 40.31 O HETATM 2198 O HOH 118 31.607 35.971 62.301 1.00 41.07 O HETATM 2199 O HOH 119 23.404 32.648 31.837 1.00 51.27 O HETATM 2200 O HOH 120 9.559 42.295 40.616 1.00 58.03 O HETATM 2201 O HOH 121 7.495 28.587 39.864 1.00 42.00 O HETATM 2202 O HOH 122 13.364 39.535 33.834 1.00 30.42 O HETATM 2203 O HOH 123 25.481 23.938 45.917 1.00 28.60 O HETATM 2204 O HOH 124 8.143 39.892 38.282 1.00 52.07 O HETATM 2205 O HOH 125 5.388 33.764 52.657 1.00 38.68 O HETATM 2206 O HOH 126 3.911 29.971 48.232 1.00 68.01 O HETATM 2207 O HOH 127 8.407 34.757 53.148 1.00 34.35 O HETATM 2208 O HOH 128 8.602 31.235 57.370 1.00 29.04 O HETATM 2209 O HOH 129 39.310 36.943 48.031 1.00 41.93 O HETATM 2210 O HOH 130 8.073 28.144 50.421 1.00 37.17 O HETATM 2211 O HOH 131 23.861 21.046 62.142 1.00 34.08 O HETATM 2212 O HOH 132 27.536 48.550 36.350 1.00 57.41 O HETATM 2213 O HOH 133 7.848 37.535 54.547 1.00 36.89 O HETATM 2214 O HOH 134 29.287 53.412 44.935 1.00 42.98 O HETATM 2215 O HOH 135 33.084 32.155 43.552 1.00 54.22 O HETATM 2216 O HOH 136 38.825 41.943 55.979 1.00 31.04 O HETATM 2217 O HOH 137 22.624 34.341 33.986 1.00 32.47 O HETATM 2218 O HOH 138 18.611 43.461 29.350 1.00 51.69 O HETATM 2219 O HOH 139 5.894 42.909 51.763 1.00 56.79 O HETATM 2220 O HOH 140 20.785 44.346 59.155 1.00 52.46 O HETATM 2221 O HOH 141 13.424 44.184 53.861 1.00 43.50 O HETATM 2222 O HOH 142 11.004 45.095 54.711 1.00 32.63 O HETATM 2223 O HOH 143 19.969 20.913 47.037 1.00 34.41 O HETATM 2224 O HOH 144 26.290 48.776 56.322 1.00 49.11 O HETATM 2225 O HOH 145 35.919 45.759 64.851 1.00103.63 O HETATM 2226 O HOH 146 6.424 39.371 47.966 1.00 42.60 O HETATM 2227 O HOH 147 13.683 24.637 54.419 1.00 49.59 O HETATM 2228 O HOH 148 16.514 21.045 45.595 1.00 64.51 O HETATM 2229 O HOH 149 33.863 28.675 40.131 1.00 47.93 O HETATM 2230 O HOH 150 23.819 21.632 59.171 1.00 33.84 O HETATM 2231 O HOH 151 33.306 33.241 62.134 1.00 46.60 O HETATM 2232 O HOH 152 33.062 27.792 41.424 1.00 51.08 O HETATM 2233 O HOH 153 32.414 30.453 69.080 1.00 41.57 O HETATM 2234 O HOH 154 3.690 34.600 39.670 1.00 48.27 O HETATM 2235 O HOH 155 21.023 33.606 69.272 1.00 32.61 O HETATM 2236 O HOH 156 30.951 21.068 54.437 1.00 40.52 O HETATM 2237 O HOH 157 30.530 53.710 49.160 1.00 45.27 O HETATM 2238 O HOH 158 9.954 34.505 63.950 1.00 43.37 O HETATM 2239 O HOH 159 9.222 46.411 39.474 1.00 41.82 O HETATM 2240 O HOH 160 31.728 40.641 63.313 1.00 36.49 O HETATM 2241 O HOH 161 34.118 45.541 57.399 1.00 33.38 O HETATM 2242 O HOH 162 17.190 27.971 34.435 1.00 40.07 O HETATM 2243 O HOH 163 17.147 22.852 39.766 1.00 39.89 O HETATM 2244 O HOH 164 7.999 36.883 38.035 1.00 42.23 O HETATM 2245 O HOH 165 34.942 51.035 57.014 1.00 53.08 O HETATM 2246 O HOH 166 29.322 48.644 37.015 1.00 40.11 O HETATM 2247 O HOH 167 31.722 53.728 44.950 1.00 57.14 O HETATM 2248 O HOH 168 13.805 43.492 60.309 1.00 75.06 O HETATM 2249 O HOH 169 13.172 48.263 44.926 1.00 68.33 O HETATM 2250 O HOH 170 33.668 44.137 60.388 1.00 77.92 O HETATM 2251 O HOH 171 12.980 37.552 35.354 1.00 85.46 O HETATM 2252 O HOH 172 29.487 53.223 52.585 1.00 79.20 O HETATM 2253 O HOH 173 19.768 39.685 30.321 1.00 68.05 O HETATM 2254 O HOH 174 12.095 22.736 53.360 1.00 68.50 O HETATM 2255 O HOH 175 24.293 31.772 72.044 1.00 69.72 O HETATM 2256 O HOH 176 36.911 44.729 58.117 1.00 69.85 O HETATM 2257 O HOH 177 30.808 23.654 46.925 1.00 72.02 O HETATM 2258 O HOH 178 23.780 20.419 47.169 1.00 92.60 O HETATM 2259 O HOH 179 36.150 28.669 37.656 1.00 76.57 O HETATM 2260 O HOH 180 32.325 54.157 47.369 1.00 86.69 O HETATM 2261 O HOH 181 27.107 24.413 38.999 1.00 75.48 O HETATM 2262 O HOH 182 33.778 30.220 48.255 1.00 85.84 O HETATM 2263 O HOH 183 27.961 22.738 46.136 1.00 67.78 O HETATM 2264 O HOH 184 31.540 25.271 63.738 1.00 87.32 O HETATM 2265 O HOH 185 19.253 42.067 26.783 1.00 78.52 O HETATM 2266 O HOH 186 20.270 34.799 30.266 1.00 86.20 O HETATM 2267 O HOH 187 27.216 20.551 48.869 1.00 88.53 O HETATM 2268 O HOH 188 21.198 36.930 33.604 1.00 78.63 O HETATM 2269 C1 STE A 189 19.059 33.240 52.247 1.00 0.03 C HETATM 2270 C2 STE A 189 20.059 33.155 53.319 1.00 0.00 C HETATM 2271 C3 STE A 189 20.932 34.263 53.667 1.00 -0.04 C HETATM 2272 C4 STE A 189 21.956 34.081 54.790 1.00 -0.05 C HETATM 2273 C5 STE A 189 22.334 35.382 55.440 1.00 -0.05 C HETATM 2274 C6 STE A 189 23.534 35.332 56.339 1.00 -0.05 C HETATM 2275 C7 STE A 189 23.417 34.451 57.545 1.00 -0.05 C HETATM 2276 C8 STE A 189 22.312 34.887 58.510 1.00 -0.05 C HETATM 2277 C9 STE A 189 22.118 33.940 59.640 1.00 -0.05 C HETATM 2278 C10 STE A 189 21.237 34.529 60.741 1.00 -0.05 C HETATM 2279 C11 STE A 189 19.925 35.023 60.159 1.00 -0.05 C HETATM 2280 C12 STE A 189 19.184 34.008 59.369 1.00 -0.05 C HETATM 2281 C13 STE A 189 17.705 34.094 59.394 1.00 -0.05 C HETATM 2282 C14 STE A 189 17.002 34.893 58.383 1.00 -0.05 C HETATM 2283 C15 STE A 189 17.078 34.335 56.971 1.00 -0.05 C HETATM 2284 C16 STE A 189 16.780 35.466 55.970 1.00 -0.05 C HETATM 2285 C17 STE A 189 16.099 36.593 56.719 1.00 -0.06 C HETATM 2286 C18 STE A 189 16.704 37.939 56.339 1.00 -0.07 C HETATM 2287 H33 STE A 189 16.194 38.740 56.895 1.00 0.02 H HETATM 2288 H34 STE A 189 16.579 38.105 55.259 1.00 0.02 H HETATM 2289 H35 STE A 189 17.775 37.943 56.590 1.00 0.02 H HETATM 2290 H31 STE A 189 16.223 36.434 57.800 1.00 0.03 H HETATM 2291 H32 STE A 189 15.028 36.596 56.470 1.00 0.03 H HETATM 2292 H29 STE A 189 16.118 35.094 55.174 1.00 0.03 H HETATM 2293 H30 STE A 189 17.719 35.828 55.526 1.00 0.03 H HETATM 2294 H27 STE A 189 16.337 33.531 56.851 1.00 0.03 H HETATM 2295 H28 STE A 189 18.086 33.935 56.786 1.00 0.03 H HETATM 2296 H25 STE A 189 17.440 35.902 58.377 1.00 0.03 H HETATM 2297 H26 STE A 189 15.942 34.955 58.671 1.00 0.03 H HETATM 2298 H23 STE A 189 17.427 34.506 60.375 1.00 0.03 H HETATM 2299 H24 STE A 189 17.325 33.065 59.307 1.00 0.03 H HETATM 2300 H21 STE A 189 19.466 33.016 59.752 1.00 0.03 H HETATM 2301 H22 STE A 189 19.505 34.102 58.321 1.00 0.03 H HETATM 2302 H19 STE A 189 20.140 35.879 59.503 1.00 0.03 H HETATM 2303 H20 STE A 189 19.282 35.350 60.989 1.00 0.03 H HETATM 2304 H17 STE A 189 21.763 35.371 61.215 1.00 0.03 H HETATM 2305 H18 STE A 189 21.031 33.754 61.494 1.00 0.03 H HETATM 2306 H15 STE A 189 23.101 33.692 60.067 1.00 0.03 H HETATM 2307 H16 STE A 189 21.643 33.025 59.258 1.00 0.03 H HETATM 2308 H13 STE A 189 21.368 34.962 57.950 1.00 0.03 H HETATM 2309 H14 STE A 189 22.575 35.873 58.921 1.00 0.03 H HETATM 2310 H11 STE A 189 24.376 34.467 58.083 1.00 0.03 H HETATM 2311 H12 STE A 189 23.202 33.426 57.209 1.00 0.03 H HETATM 2312 H9 STE A 189 23.735 36.355 56.689 1.00 0.03 H HETATM 2313 H10 STE A 189 24.386 34.974 55.743 1.00 0.03 H HETATM 2314 H7 STE A 189 21.477 35.723 56.039 1.00 0.03 H HETATM 2315 H8 STE A 189 22.538 36.112 54.643 1.00 0.03 H HETATM 2316 H5 STE A 189 22.862 33.620 54.370 1.00 0.03 H HETATM 2317 H6 STE A 189 21.527 33.416 55.554 1.00 0.03 H HETATM 2318 H3 STE A 189 20.285 35.104 53.955 1.00 0.03 H HETATM 2319 H4 STE A 189 21.494 34.527 52.759 1.00 0.03 H HETATM 2320 H1 STE A 189 20.721 32.318 53.053 1.00 0.04 H HETATM 2321 H2 STE A 189 19.503 32.906 54.235 1.00 0.04 H HETATM 2322 OXT STE A 189 18.999 34.252 51.570 1.00 -0.57 O HETATM 2323 O STE A 189 18.383 32.247 52.074 1.00 -0.57 O CONECT 1 2 16 17 18 CONECT 16 1 CONECT 17 1 CONECT 18 1 CONECT 2269 2270 2322 2323 CONECT 2270 2269 2271 2320 2321 CONECT 2271 2270 2272 2318 2319 CONECT 2272 2271 2273 2316 2317 CONECT 2273 2272 2274 2314 2315 CONECT 2274 2273 2275 2312 2313 CONECT 2275 2274 2276 2310 2311 CONECT 2276 2275 2277 2308 2309 CONECT 2277 2276 2278 2306 2307 CONECT 2278 2277 2279 2304 2305 CONECT 2279 2278 2280 2302 2303 CONECT 2280 2279 2281 2300 2301 CONECT 2281 2280 2282 2298 2299 CONECT 2282 2281 2283 2296 2297 CONECT 2283 2282 2284 2294 2295 CONECT 2284 2283 2285 2292 2293 CONECT 2285 2284 2286 2290 2291 CONECT 2286 2285 2287 2288 2289 CONECT 2287 2286 CONECT 2288 2286 CONECT 2289 2286 CONECT 2290 2285 CONECT 2291 2285 CONECT 2292 2284 CONECT 2293 2284 CONECT 2294 2283 CONECT 2295 2283 CONECT 2296 2282 CONECT 2297 2282 CONECT 2298 2281 CONECT 2299 2281 CONECT 2300 2280 CONECT 2301 2280 CONECT 2302 2279 CONECT 2303 2279 CONECT 2304 2278 CONECT 2305 2278 CONECT 2306 2277 CONECT 2307 2277 CONECT 2308 2276 CONECT 2309 2276 CONECT 2310 2275 CONECT 2311 2275 CONECT 2312 2274 CONECT 2313 2274 CONECT 2314 2273 CONECT 2315 2273 CONECT 2316 2272 CONECT 2317 2272 CONECT 2318 2271 CONECT 2319 2271 CONECT 2320 2270 CONECT 2321 2270 CONECT 2322 2269 CONECT 2323 2269 MASTER 0 0 0 0 0 0 0 0 2322 1 59 11 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 1hmt
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1hmr
RCSB PDB
PDBbind
132aa, >1HMR_1|Chain... at 100%
1hms
RCSB PDB
PDBbind
132aa, >1HMS_1|Chain... at 100%
2hmb
RCSB PDB
PDBbind
132aa, >2HMB_1|Chain... at 100%
3wvm
RCSB PDB
PDBbind
133aa, >3WVM_1|Chain... at 100%
4tjz
RCSB PDB
PDBbind
133aa, >4TJZ_1|Chain... at 100%
4tkb
RCSB PDB
PDBbind
133aa, >4TKB_1|Chain... at 100%
4tkh
RCSB PDB
PDBbind
133aa, >4TKH_1|Chain... at 100%
4tkj
RCSB PDB
PDBbind
133aa, >4TKJ_1|Chain... at 100%
5hz9
RCSB PDB
PDBbind
135aa, >5HZ9_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3uex
RCSB PDB
PDBbind
STE
3v2p
RCSB PDB
PDBbind
STE
3wvm
RCSB PDB
PDBbind
STE
4fnn
RCSB PDB
PDBbind
STE
Entry Information
PDB ID
1hmt
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
fatty acid-binding protein
Ligand Name
STE
EC.Number
E.C.-.-.-.-
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
Kd=1.64uM
Release Year
1995
Protein/NA Sequence
Check fasta file
Primary Reference
Structure v2 pp. 523-34, 1994
Ligand Properties
Formula
C
1
8
H
3
6
O
2
Molecular Weight
284.477
Exact Mass
284.272
No. of atoms
56
No. of bonds
55
Polar Surface Area
37.3
LOGP Value
9.64 (
Computed with XLOGP3
)
6.33 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 15
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 0
Canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)O
InChI String
InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P05413
Entrez Gene ID
NCBI Entrez Gene ID:
2170
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓