Browse entries in the PDBbind-CN Database
HEADER 2V85_COMPLEX COMPND 2V85_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 74 GLY TYR TRP ILE THR CYS CYS PRO THR CYS ASP VAL ASP SEQRES 2 A 74 ILE ASN THR TRP VAL PRO PHE TYR SER THR GLU LEU ASN SEQRES 3 A 74 LYS PRO ALA MET ILE TYR CYS SER HIS GLY ASP GLY HIS SEQRES 4 A 74 TRP VAL HIS ALA GLN CYS MET ASP LEU GLU GLU ARG THR SEQRES 5 A 74 LEU ILE HIS LEU SER GLU GLY SER ASN LYS TYR TYR CYS SEQRES 6 A 74 ASN GLU HIS VAL GLN ILE ALA ARG ALA HET ZN A 1 1 HET ZN A 2 1 HET ALA A 170 199 ATOM 1 N GLY A 414 -41.563 5.789 24.505 1.00 20.33 N ATOM 2 CA GLY A 414 -41.122 7.103 23.980 1.00 20.36 C ATOM 3 C GLY A 414 -39.615 7.195 23.865 1.00 17.92 C ATOM 4 O GLY A 414 -39.095 8.203 23.443 1.00 20.28 O ATOM 5 HA3 GLY A 414 -41.472 7.886 24.653 1.00 0.00 H ATOM 6 HA2 GLY A 414 -41.560 7.252 22.993 1.00 0.00 H ATOM 7 HN3 GLY A 414 -41.156 5.641 25.451 1.00 0.00 H ATOM 8 HN2 GLY A 414 -41.240 5.035 23.865 1.00 0.00 H ATOM 9 HN1 GLY A 414 -42.601 5.772 24.566 1.00 0.00 H ATOM 10 N TYR A 415 -38.919 6.126 24.239 1.00 17.33 N ATOM 11 CA TYR A 415 -37.459 6.104 24.171 1.00 16.65 C ATOM 12 C TYR A 415 -36.916 5.898 22.762 1.00 16.40 C ATOM 13 O TYR A 415 -35.852 6.392 22.428 1.00 15.45 O ATOM 14 CB TYR A 415 -36.887 4.994 25.062 1.00 16.43 C ATOM 15 CG TYR A 415 -36.801 5.325 26.537 1.00 14.76 C ATOM 16 CD1 TYR A 415 -37.741 4.832 27.442 1.00 13.93 C ATOM 17 CD2 TYR A 415 -35.760 6.108 27.030 1.00 13.10 C ATOM 18 CE1 TYR A 415 -37.642 5.111 28.810 1.00 14.37 C ATOM 19 CE2 TYR A 415 -35.650 6.394 28.391 1.00 12.88 C ATOM 20 CZ TYR A 415 -36.592 5.893 29.274 1.00 13.20 C ATOM 21 OH TYR A 415 -36.481 6.176 30.617 1.00 13.35 O ATOM 22 HA TYR A 415 -37.144 7.088 24.518 1.00 0.00 H ATOM 23 HB3 TYR A 415 -35.882 4.764 24.709 1.00 0.00 H ATOM 24 HB2 TYR A 415 -37.520 4.114 24.951 1.00 0.00 H ATOM 25 HD2 TYR A 415 -35.017 6.505 26.339 1.00 0.00 H ATOM 26 HE2 TYR A 415 -34.827 7.008 28.757 1.00 0.00 H ATOM 27 HE1 TYR A 415 -38.383 4.718 29.506 1.00 0.00 H ATOM 28 HD1 TYR A 415 -38.566 4.220 27.078 1.00 0.00 H ATOM 29 HH TYR A 415 -37.227 5.747 31.106 1.00 0.00 H ATOM 30 H TYR A 415 -39.424 5.287 24.588 1.00 0.00 H ATOM 31 N TRP A 416 -37.658 5.166 21.940 1.00 15.71 N ATOM 32 CA TRP A 416 -37.196 4.867 20.595 1.00 16.12 C ATOM 33 C TRP A 416 -37.810 5.690 19.472 1.00 17.26 C ATOM 34 O TRP A 416 -37.982 5.218 18.365 1.00 17.81 O ATOM 35 CB TRP A 416 -37.368 3.370 20.338 1.00 15.07 C ATOM 36 CG TRP A 416 -36.721 2.563 21.420 1.00 14.43 C ATOM 37 CD1 TRP A 416 -37.344 1.777 22.345 1.00 16.16 C ATOM 38 CD2 TRP A 416 -35.323 2.520 21.732 1.00 14.79 C ATOM 39 NE1 TRP A 416 -36.420 1.247 23.218 1.00 14.71 N ATOM 40 CE2 TRP A 416 -35.169 1.690 22.864 1.00 14.67 C ATOM 41 CE3 TRP A 416 -34.180 3.108 21.166 1.00 14.62 C ATOM 42 CZ2 TRP A 416 -33.922 1.429 23.444 1.00 13.18 C ATOM 43 CZ3 TRP A 416 -32.938 2.847 21.744 1.00 14.59 C ATOM 44 CH2 TRP A 416 -32.823 2.015 22.872 1.00 12.24 C ATOM 45 HA TRP A 416 -36.146 5.160 20.571 1.00 0.00 H ATOM 46 HB2 TRP A 416 -38.432 3.134 20.304 1.00 0.00 H ATOM 47 HB3 TRP A 416 -36.910 3.117 19.382 1.00 0.00 H ATOM 48 HE1 TRP A 416 -36.634 0.615 24.015 1.00 0.00 H ATOM 49 HD1 TRP A 416 -38.418 1.595 22.387 1.00 0.00 H ATOM 50 HZ2 TRP A 416 -33.829 0.784 24.318 1.00 0.00 H ATOM 51 HH2 TRP A 416 -31.838 1.832 23.301 1.00 0.00 H ATOM 52 HZ3 TRP A 416 -32.042 3.295 21.315 1.00 0.00 H ATOM 53 HE3 TRP A 416 -34.262 3.755 20.293 1.00 0.00 H ATOM 54 H TRP A 416 -38.578 4.803 22.261 1.00 0.00 H ATOM 55 N ILE A 417 -38.123 6.938 19.784 1.00 17.97 N ATOM 56 CA ILE A 417 -38.681 7.865 18.812 1.00 18.56 C ATOM 57 C ILE A 417 -37.522 8.456 18.014 1.00 19.70 C ATOM 58 O ILE A 417 -36.364 8.280 18.366 1.00 18.04 O ATOM 59 CB ILE A 417 -39.366 9.049 19.507 1.00 19.76 C ATOM 60 CG1 ILE A 417 -38.389 9.660 20.520 1.00 18.82 C ATOM 61 CG2 ILE A 417 -40.642 8.597 20.195 1.00 20.13 C ATOM 62 CD1 ILE A 417 -38.548 11.145 20.730 1.00 19.57 C ATOM 63 HA ILE A 417 -39.400 7.327 18.194 1.00 0.00 H ATOM 64 HB ILE A 417 -39.638 9.801 18.767 1.00 0.00 H ATOM 65 HG12 ILE A 417 -38.538 9.163 21.479 1.00 0.00 H ATOM 66 HG13 ILE A 417 -37.374 9.473 20.169 1.00 0.00 H ATOM 67 HD11 ILE A 417 -38.389 11.663 19.785 1.00 0.00 H ATOM 68 HD12 ILE A 417 -39.554 11.353 21.095 1.00 0.00 H ATOM 69 HD13 ILE A 417 -37.816 11.488 21.462 1.00 0.00 H ATOM 70 HG21 ILE A 417 -41.324 8.178 19.455 1.00 0.00 H ATOM 71 HG22 ILE A 417 -40.402 7.839 20.940 1.00 0.00 H ATOM 72 HG23 ILE A 417 -41.113 9.451 20.682 1.00 0.00 H ATOM 73 H ILE A 417 -37.964 7.267 20.758 1.00 0.00 H ATOM 74 N THR A 418 -37.853 9.148 16.927 1.00 19.65 N ATOM 75 CA THR A 418 -36.857 9.849 16.125 1.00 19.31 C ATOM 76 C THR A 418 -37.068 11.263 16.665 1.00 18.85 C ATOM 77 O THR A 418 -37.984 11.952 16.260 1.00 19.52 O ATOM 78 CB THR A 418 -37.184 9.776 14.616 1.00 20.43 C ATOM 79 OG1 THR A 418 -37.013 8.428 14.159 1.00 20.10 O ATOM 80 CG2 THR A 418 -36.260 10.685 13.821 1.00 21.51 C ATOM 81 HA THR A 418 -35.842 9.458 16.197 1.00 0.00 H ATOM 82 HB THR A 418 -38.214 10.100 14.468 1.00 0.00 H ATOM 83 HG1 THR A 418 -37.623 7.831 14.660 1.00 0.00 H ATOM 84 HG23 THR A 418 -36.383 11.713 14.161 1.00 0.00 H ATOM 85 HG21 THR A 418 -35.227 10.372 13.971 1.00 0.00 H ATOM 86 HG22 THR A 418 -36.510 10.619 12.762 1.00 0.00 H ATOM 87 H THR A 418 -38.852 9.190 16.641 1.00 0.00 H ATOM 88 N CYS A 419 -36.222 11.667 17.610 1.00 17.46 N ATOM 89 CA CYS A 419 -36.355 12.959 18.278 1.00 14.87 C ATOM 90 C CYS A 419 -36.155 14.232 17.470 1.00 15.42 C ATOM 91 O CYS A 419 -36.719 15.261 17.811 1.00 16.84 O ATOM 92 CB CYS A 419 -35.441 13.007 19.511 1.00 13.99 C ATOM 93 SG CYS A 419 -33.690 13.332 19.184 1.00 9.80 S ATOM 94 HA CYS A 419 -37.418 12.980 18.519 1.00 0.00 H ATOM 95 HB2 CYS A 419 -35.513 12.045 20.019 1.00 0.00 H ATOM 96 HB3 CYS A 419 -35.810 13.793 20.170 1.00 0.00 H ATOM 97 HG CYS A 419 -33.560 14.556 18.559 1.00 0.00 H ATOM 98 H CYS A 419 -35.438 11.040 17.882 1.00 0.00 H ATOM 99 N CYS A 420 -35.351 14.174 16.417 1.00 14.30 N ATOM 100 CA CYS A 420 -35.100 15.357 15.602 1.00 14.11 C ATOM 101 C CYS A 420 -34.606 14.944 14.217 1.00 13.33 C ATOM 102 O CYS A 420 -34.258 13.803 14.002 1.00 13.79 O ATOM 103 CB CYS A 420 -34.061 16.249 16.286 1.00 14.92 C ATOM 104 SG CYS A 420 -32.432 15.487 16.412 1.00 15.06 S ATOM 105 HA CYS A 420 -36.029 15.916 15.491 1.00 0.00 H ATOM 106 HB2 CYS A 420 -34.413 16.481 17.291 1.00 0.00 H ATOM 107 HB3 CYS A 420 -33.967 17.172 15.714 1.00 0.00 H ATOM 108 HG CYS A 420 -32.526 14.322 17.146 1.00 0.00 H ATOM 109 H CYS A 420 -34.894 13.273 16.169 1.00 0.00 H ATOM 110 N PRO A 421 -34.570 15.889 13.263 1.00 15.48 N ATOM 111 CA PRO A 421 -34.118 15.601 11.897 1.00 16.35 C ATOM 112 C PRO A 421 -32.794 14.845 11.785 1.00 17.27 C ATOM 113 O PRO A 421 -32.587 14.107 10.839 1.00 18.25 O ATOM 114 CB PRO A 421 -34.050 16.989 11.263 1.00 15.95 C ATOM 115 CG PRO A 421 -35.160 17.707 11.948 1.00 16.28 C ATOM 116 CD PRO A 421 -34.958 17.304 13.387 1.00 14.36 C ATOM 117 HA PRO A 421 -34.798 14.912 11.397 1.00 0.00 H ATOM 118 HD3 PRO A 421 -34.168 17.891 13.855 1.00 0.00 H ATOM 119 HD2 PRO A 421 -35.878 17.413 13.961 1.00 0.00 H ATOM 120 HG3 PRO A 421 -36.131 17.379 11.578 1.00 0.00 H ATOM 121 HG2 PRO A 421 -35.070 18.786 11.823 1.00 0.00 H ATOM 122 HB2 PRO A 421 -33.090 17.466 11.460 1.00 0.00 H ATOM 123 HB3 PRO A 421 -34.216 16.940 10.187 1.00 0.00 H ATOM 124 N THR A 422 -31.906 15.023 12.759 1.00 15.65 N ATOM 125 CA THR A 422 -30.613 14.348 12.714 1.00 15.65 C ATOM 126 C THR A 422 -30.441 13.247 13.768 1.00 15.96 C ATOM 127 O THR A 422 -29.338 12.765 13.990 1.00 15.14 O ATOM 128 CB THR A 422 -29.461 15.371 12.873 1.00 16.11 C ATOM 129 OG1 THR A 422 -29.562 16.010 14.150 1.00 14.90 O ATOM 130 CG2 THR A 422 -29.535 16.435 11.780 1.00 14.98 C ATOM 131 HA THR A 422 -30.577 13.866 11.737 1.00 0.00 H ATOM 132 HB THR A 422 -28.512 14.840 12.792 1.00 0.00 H ATOM 133 HG1 THR A 422 -29.499 15.328 14.865 1.00 0.00 H ATOM 134 HG23 THR A 422 -29.459 15.957 10.803 1.00 0.00 H ATOM 135 HG21 THR A 422 -30.485 16.964 11.854 1.00 0.00 H ATOM 136 HG22 THR A 422 -28.714 17.141 11.905 1.00 0.00 H ATOM 137 H THR A 422 -32.135 15.648 13.558 1.00 0.00 H ATOM 138 N CYS A 423 -31.543 12.848 14.396 1.00 14.92 N ATOM 139 CA CYS A 423 -31.524 11.820 15.441 1.00 14.50 C ATOM 140 C CYS A 423 -30.691 10.587 15.087 1.00 14.62 C ATOM 141 O CYS A 423 -30.894 9.974 14.059 1.00 13.54 O ATOM 142 CB CYS A 423 -32.954 11.389 15.780 1.00 9.84 C ATOM 143 SG CYS A 423 -33.066 10.095 17.030 1.00 11.35 S ATOM 144 HA CYS A 423 -31.044 12.281 16.304 1.00 0.00 H ATOM 145 HB2 CYS A 423 -33.425 11.024 14.868 1.00 0.00 H ATOM 146 HB3 CYS A 423 -33.496 12.262 16.143 1.00 0.00 H ATOM 147 HG CYS A 423 -32.490 10.540 18.203 1.00 0.00 H ATOM 148 H CYS A 423 -32.452 13.281 14.136 1.00 0.00 H ATOM 149 N ASP A 424 -29.764 10.234 15.976 1.00 14.91 N ATOM 150 CA ASP A 424 -28.869 9.092 15.783 1.00 17.96 C ATOM 151 C ASP A 424 -29.235 7.855 16.593 1.00 18.87 C ATOM 152 O ASP A 424 -28.617 6.811 16.437 1.00 19.16 O ATOM 153 CB ASP A 424 -27.438 9.482 16.149 1.00 20.22 C ATOM 154 CG ASP A 424 -26.688 10.101 14.998 1.00 23.11 C ATOM 155 OD1 ASP A 424 -25.658 10.752 15.263 1.00 25.98 O ATOM 156 OD2 ASP A 424 -27.117 9.929 13.836 1.00 23.88 O ATOM 157 HA ASP A 424 -28.968 8.831 14.729 1.00 0.00 H ATOM 158 HB2 ASP A 424 -27.471 10.199 16.969 1.00 0.00 H ATOM 159 HB3 ASP A 424 -26.905 8.588 16.472 1.00 0.00 H ATOM 160 H ASP A 424 -29.672 10.795 16.847 1.00 0.00 H ATOM 161 N VAL A 425 -30.225 7.977 17.467 1.00 17.91 N ATOM 162 CA VAL A 425 -30.624 6.844 18.293 1.00 17.64 C ATOM 163 C VAL A 425 -31.575 5.914 17.558 1.00 18.49 C ATOM 164 O VAL A 425 -32.590 6.336 17.032 1.00 18.30 O ATOM 165 CB VAL A 425 -31.267 7.327 19.608 1.00 17.42 C ATOM 166 CG1 VAL A 425 -31.873 6.150 20.369 1.00 16.01 C ATOM 167 CG2 VAL A 425 -30.212 8.025 20.454 1.00 17.02 C ATOM 168 HA VAL A 425 -29.720 6.281 18.525 1.00 0.00 H ATOM 169 HB VAL A 425 -32.069 8.030 19.382 1.00 0.00 H ATOM 170 HG11 VAL A 425 -32.637 5.676 19.753 1.00 0.00 H ATOM 171 HG12 VAL A 425 -31.091 5.427 20.601 1.00 0.00 H ATOM 172 HG13 VAL A 425 -32.322 6.510 21.295 1.00 0.00 H ATOM 173 HG21 VAL A 425 -29.405 7.326 20.676 1.00 0.00 H ATOM 174 HG22 VAL A 425 -29.815 8.879 19.905 1.00 0.00 H ATOM 175 HG23 VAL A 425 -30.663 8.368 21.385 1.00 0.00 H ATOM 176 H VAL A 425 -30.720 8.887 17.564 1.00 0.00 H ATOM 177 N ASP A 426 -31.221 4.634 17.542 1.00 18.00 N ATOM 178 CA ASP A 426 -32.007 3.614 16.870 1.00 19.25 C ATOM 179 C ASP A 426 -32.047 2.360 17.734 1.00 18.92 C ATOM 180 O ASP A 426 -31.016 1.890 18.201 1.00 17.50 O ATOM 181 CB ASP A 426 -31.381 3.318 15.504 1.00 22.95 C ATOM 182 CG ASP A 426 -32.160 2.295 14.705 1.00 26.78 C ATOM 183 OD1 ASP A 426 -31.932 2.221 13.481 1.00 31.11 O ATOM 184 OD2 ASP A 426 -32.985 1.562 15.287 1.00 28.28 O ATOM 185 HA ASP A 426 -33.029 3.962 16.717 1.00 0.00 H ATOM 186 HB2 ASP A 426 -31.338 4.246 14.933 1.00 0.00 H ATOM 187 HB3 ASP A 426 -30.370 2.941 15.659 1.00 0.00 H ATOM 188 H ASP A 426 -30.347 4.351 18.030 1.00 0.00 H ATOM 189 N ILE A 427 -33.251 1.836 17.947 1.00 17.88 N ATOM 190 CA ILE A 427 -33.441 0.647 18.764 1.00 18.43 C ATOM 191 C ILE A 427 -32.640 -0.545 18.241 1.00 17.69 C ATOM 192 O ILE A 427 -32.388 -1.476 18.966 1.00 18.22 O ATOM 193 CB ILE A 427 -34.954 0.259 18.833 1.00 18.63 C ATOM 194 CG1 ILE A 427 -35.153 -0.858 19.863 1.00 18.11 C ATOM 195 CG2 ILE A 427 -35.431 -0.195 17.453 1.00 19.34 C ATOM 196 CD1 ILE A 427 -36.608 -1.075 20.264 1.00 20.44 C ATOM 197 HA ILE A 427 -33.078 0.892 19.762 1.00 0.00 H ATOM 198 HB ILE A 427 -35.540 1.126 19.139 1.00 0.00 H ATOM 199 HG12 ILE A 427 -34.771 -1.787 19.441 1.00 0.00 H ATOM 200 HG13 ILE A 427 -34.584 -0.606 20.758 1.00 0.00 H ATOM 201 HD11 ILE A 427 -37.004 -0.158 20.700 1.00 0.00 H ATOM 202 HD12 ILE A 427 -37.191 -1.340 19.382 1.00 0.00 H ATOM 203 HD13 ILE A 427 -36.666 -1.881 20.995 1.00 0.00 H ATOM 204 HG21 ILE A 427 -35.297 0.617 16.738 1.00 0.00 H ATOM 205 HG22 ILE A 427 -34.849 -1.060 17.135 1.00 0.00 H ATOM 206 HG23 ILE A 427 -36.486 -0.465 17.505 1.00 0.00 H ATOM 207 H ILE A 427 -34.082 2.290 17.516 1.00 0.00 H ATOM 208 N ASN A 428 -32.243 -0.480 16.973 1.00 17.44 N ATOM 209 CA ASN A 428 -31.479 -1.556 16.345 1.00 17.60 C ATOM 210 C ASN A 428 -29.960 -1.384 16.424 1.00 16.48 C ATOM 211 O ASN A 428 -29.222 -2.282 16.047 1.00 15.81 O ATOM 212 CB ASN A 428 -31.863 -1.691 14.866 1.00 21.02 C ATOM 213 CG ASN A 428 -33.341 -1.964 14.661 1.00 22.88 C ATOM 214 OD1 ASN A 428 -33.856 -2.980 15.087 1.00 24.37 O ATOM 215 ND2 ASN A 428 -34.024 -1.039 13.996 1.00 25.38 N ATOM 216 HA ASN A 428 -31.737 -2.450 16.913 1.00 0.00 H ATOM 217 HB2 ASN A 428 -31.606 -0.764 14.354 1.00 0.00 H ATOM 218 HB3 ASN A 428 -31.294 -2.513 14.433 1.00 0.00 H ATOM 219 HD22 ASN A 428 -33.542 -0.185 13.650 1.00 0.00 H ATOM 220 HD21 ASN A 428 -35.041 -1.169 13.821 1.00 0.00 H ATOM 221 H ASN A 428 -32.484 0.362 16.412 1.00 0.00 H ATOM 222 N THR A 429 -29.493 -0.235 16.911 1.00 15.84 N ATOM 223 CA THR A 429 -28.051 0.010 16.987 1.00 14.05 C ATOM 224 C THR A 429 -27.543 0.704 18.257 1.00 13.67 C ATOM 225 O THR A 429 -26.349 0.719 18.514 1.00 13.10 O ATOM 226 CB THR A 429 -27.588 0.881 15.811 1.00 15.55 C ATOM 227 OG1 THR A 429 -28.140 2.196 15.957 1.00 15.64 O ATOM 228 CG2 THR A 429 -28.052 0.294 14.483 1.00 16.27 C ATOM 229 HA THR A 429 -27.635 -0.998 16.975 1.00 0.00 H ATOM 230 HB THR A 429 -26.499 0.920 15.815 1.00 0.00 H ATOM 231 HG1 THR A 429 -27.827 2.591 16.809 1.00 0.00 H ATOM 232 HG23 THR A 429 -27.636 -0.707 14.364 1.00 0.00 H ATOM 233 HG21 THR A 429 -29.141 0.240 14.472 1.00 0.00 H ATOM 234 HG22 THR A 429 -27.710 0.930 13.667 1.00 0.00 H ATOM 235 H THR A 429 -30.158 0.494 17.240 1.00 0.00 H ATOM 236 N TRP A 430 -28.451 1.277 19.039 1.00 11.61 N ATOM 237 CA TRP A 430 -28.075 2.014 20.243 1.00 9.60 C ATOM 238 C TRP A 430 -27.197 1.287 21.272 1.00 8.58 C ATOM 239 O TRP A 430 -27.353 0.109 21.511 1.00 7.99 O ATOM 240 CB TRP A 430 -29.331 2.529 20.953 1.00 9.29 C ATOM 241 CG TRP A 430 -29.003 3.385 22.137 1.00 7.94 C ATOM 242 CD1 TRP A 430 -28.731 4.720 22.131 1.00 8.07 C ATOM 243 CD2 TRP A 430 -28.808 2.941 23.485 1.00 8.25 C ATOM 244 NE1 TRP A 430 -28.371 5.138 23.392 1.00 7.59 N ATOM 245 CE2 TRP A 430 -28.409 4.064 24.244 1.00 8.61 C ATOM 246 CE3 TRP A 430 -28.926 1.698 24.125 1.00 7.39 C ATOM 247 CZ2 TRP A 430 -28.127 3.986 25.615 1.00 7.70 C ATOM 248 CZ3 TRP A 430 -28.646 1.617 25.486 1.00 8.44 C ATOM 249 CH2 TRP A 430 -28.250 2.756 26.216 1.00 8.28 C ATOM 250 HA TRP A 430 -27.444 2.815 19.857 1.00 0.00 H ATOM 251 HB2 TRP A 430 -29.917 3.117 20.247 1.00 0.00 H ATOM 252 HB3 TRP A 430 -29.919 1.675 21.289 1.00 0.00 H ATOM 253 HE1 TRP A 430 -28.112 6.110 23.656 1.00 0.00 H ATOM 254 HD1 TRP A 430 -28.790 5.364 21.254 1.00 0.00 H ATOM 255 HZ2 TRP A 430 -27.822 4.866 26.182 1.00 0.00 H ATOM 256 HH2 TRP A 430 -28.037 2.659 27.281 1.00 0.00 H ATOM 257 HZ3 TRP A 430 -28.734 0.657 25.996 1.00 0.00 H ATOM 258 HE3 TRP A 430 -29.231 0.813 23.567 1.00 0.00 H ATOM 259 H TRP A 430 -29.457 1.199 18.787 1.00 0.00 H ATOM 260 N VAL A 431 -26.270 2.034 21.870 1.00 9.06 N ATOM 261 CA VAL A 431 -25.383 1.521 22.915 1.00 8.63 C ATOM 262 C VAL A 431 -25.163 2.666 23.900 1.00 10.44 C ATOM 263 O VAL A 431 -25.213 3.824 23.525 1.00 10.61 O ATOM 264 CB VAL A 431 -24.003 1.061 22.369 1.00 10.14 C ATOM 265 CG1 VAL A 431 -24.188 0.014 21.278 1.00 9.51 C ATOM 266 CG2 VAL A 431 -23.218 2.248 21.851 1.00 11.18 C ATOM 267 HA VAL A 431 -25.846 0.646 23.372 1.00 0.00 H ATOM 268 HB VAL A 431 -23.437 0.609 23.183 1.00 0.00 H ATOM 269 HG11 VAL A 431 -24.714 -0.848 21.689 1.00 0.00 H ATOM 270 HG12 VAL A 431 -24.770 0.441 20.461 1.00 0.00 H ATOM 271 HG13 VAL A 431 -23.212 -0.298 20.906 1.00 0.00 H ATOM 272 HG21 VAL A 431 -23.776 2.728 21.047 1.00 0.00 H ATOM 273 HG22 VAL A 431 -23.061 2.960 22.662 1.00 0.00 H ATOM 274 HG23 VAL A 431 -22.254 1.907 21.472 1.00 0.00 H ATOM 275 H VAL A 431 -26.172 3.028 21.581 1.00 0.00 H ATOM 276 N PRO A 432 -24.921 2.345 25.180 1.00 10.23 N ATOM 277 CA PRO A 432 -24.705 3.395 26.180 1.00 10.42 C ATOM 278 C PRO A 432 -23.544 4.335 25.875 1.00 10.64 C ATOM 279 O PRO A 432 -22.528 3.935 25.342 1.00 9.33 O ATOM 280 CB PRO A 432 -24.526 2.611 27.485 1.00 9.97 C ATOM 281 CG PRO A 432 -24.080 1.249 27.035 1.00 11.52 C ATOM 282 CD PRO A 432 -24.888 1.006 25.792 1.00 9.61 C ATOM 283 HA PRO A 432 -25.541 4.094 26.215 1.00 0.00 H ATOM 284 HD3 PRO A 432 -24.401 0.283 25.138 1.00 0.00 H ATOM 285 HD2 PRO A 432 -25.892 0.656 26.034 1.00 0.00 H ATOM 286 HG3 PRO A 432 -24.297 0.497 27.794 1.00 0.00 H ATOM 287 HG2 PRO A 432 -23.013 1.242 26.813 1.00 0.00 H ATOM 288 HB2 PRO A 432 -23.770 3.077 28.116 1.00 0.00 H ATOM 289 HB3 PRO A 432 -25.467 2.549 28.032 1.00 0.00 H ATOM 290 N PHE A 433 -23.736 5.601 26.221 1.00 10.70 N ATOM 291 CA PHE A 433 -22.740 6.631 25.990 1.00 12.31 C ATOM 292 C PHE A 433 -22.450 7.367 27.295 1.00 11.27 C ATOM 293 O PHE A 433 -21.307 7.479 27.700 1.00 11.36 O ATOM 294 CB PHE A 433 -23.247 7.610 24.929 1.00 14.97 C ATOM 295 CG PHE A 433 -22.343 8.783 24.711 1.00 19.55 C ATOM 296 CD1 PHE A 433 -21.113 8.623 24.077 1.00 21.81 C ATOM 297 CD2 PHE A 433 -22.707 10.045 25.168 1.00 20.29 C ATOM 298 CE1 PHE A 433 -20.254 9.711 23.903 1.00 23.57 C ATOM 299 CE2 PHE A 433 -21.859 11.137 25.001 1.00 22.32 C ATOM 300 CZ PHE A 433 -20.629 10.969 24.367 1.00 24.06 C ATOM 301 HA PHE A 433 -21.818 6.172 25.633 1.00 0.00 H ATOM 302 HB2 PHE A 433 -23.348 7.073 23.986 1.00 0.00 H ATOM 303 HB3 PHE A 433 -24.223 7.981 25.241 1.00 0.00 H ATOM 304 HD2 PHE A 433 -23.668 10.181 25.663 1.00 0.00 H ATOM 305 HE2 PHE A 433 -22.156 12.120 25.365 1.00 0.00 H ATOM 306 HZ PHE A 433 -19.962 11.821 24.235 1.00 0.00 H ATOM 307 HE1 PHE A 433 -19.294 9.575 23.406 1.00 0.00 H ATOM 308 HD1 PHE A 433 -20.818 7.639 23.713 1.00 0.00 H ATOM 309 H PHE A 433 -24.634 5.865 26.675 1.00 0.00 H ATOM 310 N TYR A 434 -23.495 7.867 27.948 1.00 9.41 N ATOM 311 CA TYR A 434 -23.315 8.575 29.214 1.00 10.42 C ATOM 312 C TYR A 434 -23.109 7.546 30.329 1.00 10.91 C ATOM 313 O TYR A 434 -23.539 6.416 30.210 1.00 9.70 O ATOM 314 CB TYR A 434 -24.532 9.454 29.538 1.00 11.12 C ATOM 315 CG TYR A 434 -24.795 10.560 28.535 1.00 11.43 C ATOM 316 CD1 TYR A 434 -25.836 10.454 27.610 1.00 11.52 C ATOM 317 CD2 TYR A 434 -24.008 11.713 28.511 1.00 10.82 C ATOM 318 CE1 TYR A 434 -26.090 11.469 26.690 1.00 10.23 C ATOM 319 CE2 TYR A 434 -24.251 12.738 27.587 1.00 10.24 C ATOM 320 CZ TYR A 434 -25.295 12.605 26.681 1.00 11.04 C ATOM 321 OH TYR A 434 -25.547 13.595 25.756 1.00 11.59 O ATOM 322 HA TYR A 434 -22.445 9.226 29.133 1.00 0.00 H ATOM 323 HB3 TYR A 434 -24.372 9.911 30.515 1.00 0.00 H ATOM 324 HB2 TYR A 434 -25.413 8.814 29.578 1.00 0.00 H ATOM 325 HD2 TYR A 434 -23.190 11.818 29.224 1.00 0.00 H ATOM 326 HE2 TYR A 434 -23.626 13.631 27.579 1.00 0.00 H ATOM 327 HE1 TYR A 434 -26.911 11.370 25.980 1.00 0.00 H ATOM 328 HD1 TYR A 434 -26.461 9.561 27.608 1.00 0.00 H ATOM 329 HH TYR A 434 -25.750 14.442 26.227 1.00 0.00 H ATOM 330 H TYR A 434 -24.451 7.753 27.554 1.00 0.00 H ATOM 331 N SER A 435 -22.451 7.954 31.410 1.00 11.67 N ATOM 332 CA SER A 435 -22.187 7.048 32.523 1.00 11.97 C ATOM 333 C SER A 435 -23.467 6.629 33.248 1.00 13.29 C ATOM 334 O SER A 435 -23.460 5.688 34.020 1.00 13.85 O ATOM 335 CB SER A 435 -21.222 7.703 33.515 1.00 12.61 C ATOM 336 OG SER A 435 -21.848 8.781 34.184 1.00 14.35 O ATOM 337 HA SER A 435 -21.737 6.147 32.106 1.00 0.00 H ATOM 338 HB2 SER A 435 -20.351 8.074 32.975 1.00 0.00 H ATOM 339 HB3 SER A 435 -20.905 6.962 34.249 1.00 0.00 H ATOM 340 HG SER A 435 -22.134 9.458 33.521 1.00 0.00 H ATOM 341 H SER A 435 -22.118 8.938 31.463 1.00 0.00 H ATOM 342 N THR A 436 -24.565 7.332 32.985 1.00 10.98 N ATOM 343 CA THR A 436 -25.839 7.016 33.620 1.00 11.57 C ATOM 344 C THR A 436 -26.714 6.081 32.769 1.00 11.80 C ATOM 345 O THR A 436 -27.791 5.682 33.184 1.00 11.25 O ATOM 346 CB THR A 436 -26.645 8.301 33.917 1.00 10.99 C ATOM 347 OG1 THR A 436 -26.872 9.018 32.697 1.00 10.51 O ATOM 348 CG2 THR A 436 -25.890 9.191 34.890 1.00 10.32 C ATOM 349 HA THR A 436 -25.586 6.503 34.548 1.00 0.00 H ATOM 350 HB THR A 436 -27.598 8.019 34.364 1.00 0.00 H ATOM 351 HG1 THR A 436 -27.382 8.446 32.070 1.00 0.00 H ATOM 352 HG23 THR A 436 -25.717 8.647 35.818 1.00 0.00 H ATOM 353 HG21 THR A 436 -24.934 9.478 34.451 1.00 0.00 H ATOM 354 HG22 THR A 436 -26.480 10.084 35.096 1.00 0.00 H ATOM 355 H THR A 436 -24.514 8.124 32.312 1.00 0.00 H ATOM 356 N GLU A 437 -26.236 5.737 31.579 1.00 11.06 N ATOM 357 CA GLU A 437 -26.986 4.859 30.683 1.00 11.16 C ATOM 358 C GLU A 437 -26.503 3.415 30.737 1.00 11.51 C ATOM 359 O GLU A 437 -25.328 3.152 30.923 1.00 10.88 O ATOM 360 CB GLU A 437 -26.856 5.320 29.226 1.00 10.44 C ATOM 361 CG GLU A 437 -27.356 6.714 28.917 1.00 9.55 C ATOM 362 CD GLU A 437 -27.065 7.125 27.479 1.00 11.07 C ATOM 363 OE1 GLU A 437 -25.908 6.966 27.028 1.00 10.66 O ATOM 364 OE2 GLU A 437 -27.990 7.617 26.798 1.00 11.19 O ATOM 365 HA GLU A 437 -28.020 4.912 31.024 1.00 0.00 H ATOM 366 HB2 GLU A 437 -25.801 5.278 28.957 1.00 0.00 H ATOM 367 HB3 GLU A 437 -27.416 4.621 28.605 1.00 0.00 H ATOM 368 HG2 GLU A 437 -28.433 6.745 29.080 1.00 0.00 H ATOM 369 HG3 GLU A 437 -26.868 7.419 29.590 1.00 0.00 H ATOM 370 H GLU A 437 -25.309 6.100 31.278 1.00 0.00 H ATOM 371 N LEU A 438 -27.433 2.484 30.560 1.00 10.71 N ATOM 372 CA LEU A 438 -27.086 1.071 30.515 1.00 11.67 C ATOM 373 C LEU A 438 -27.868 0.442 29.370 1.00 10.55 C ATOM 374 O LEU A 438 -27.294 0.066 28.367 1.00 10.23 O ATOM 375 CB LEU A 438 -27.416 0.358 31.833 1.00 12.74 C ATOM 376 CG LEU A 438 -26.978 -1.117 31.843 1.00 14.18 C ATOM 377 CD1 LEU A 438 -25.470 -1.215 31.613 1.00 17.45 C ATOM 378 CD2 LEU A 438 -27.362 -1.768 33.156 1.00 14.62 C ATOM 379 HA LEU A 438 -26.012 0.968 30.362 1.00 0.00 H ATOM 380 HB2 LEU A 438 -26.908 0.877 32.646 1.00 0.00 H ATOM 381 HB3 LEU A 438 -28.493 0.402 31.992 1.00 0.00 H ATOM 382 HG LEU A 438 -27.487 -1.645 31.037 1.00 0.00 H ATOM 383 HD21 LEU A 438 -26.872 -1.244 33.977 1.00 0.00 H ATOM 384 HD22 LEU A 438 -28.443 -1.715 33.284 1.00 0.00 H ATOM 385 HD23 LEU A 438 -27.046 -2.811 33.149 1.00 0.00 H ATOM 386 HD11 LEU A 438 -25.221 -0.773 30.648 1.00 0.00 H ATOM 387 HD12 LEU A 438 -24.947 -0.679 32.405 1.00 0.00 H ATOM 388 HD13 LEU A 438 -25.170 -2.263 31.622 1.00 0.00 H ATOM 389 H LEU A 438 -28.427 2.769 30.452 1.00 0.00 H ATOM 390 N ASN A 439 -29.187 0.362 29.514 1.00 9.17 N ATOM 391 CA ASN A 439 -30.019 -0.237 28.472 1.00 8.52 C ATOM 392 C ASN A 439 -30.958 0.724 27.734 1.00 8.06 C ATOM 393 O ASN A 439 -31.640 0.326 26.814 1.00 7.12 O ATOM 394 CB ASN A 439 -30.820 -1.403 29.059 1.00 8.23 C ATOM 395 CG ASN A 439 -29.929 -2.571 29.469 1.00 9.23 C ATOM 396 OD1 ASN A 439 -29.241 -3.146 28.649 1.00 6.60 O ATOM 397 ND2 ASN A 439 -29.945 -2.911 30.754 1.00 6.67 N ATOM 398 HA ASN A 439 -29.317 -0.578 27.711 1.00 0.00 H ATOM 399 HB2 ASN A 439 -31.361 -1.050 29.937 1.00 0.00 H ATOM 400 HB3 ASN A 439 -31.532 -1.751 28.311 1.00 0.00 H ATOM 401 HD22 ASN A 439 -30.549 -2.391 31.422 1.00 0.00 H ATOM 402 HD21 ASN A 439 -29.353 -3.697 31.091 1.00 0.00 H ATOM 403 H ASN A 439 -29.633 0.730 30.379 1.00 0.00 H ATOM 404 N LYS A 440 -30.976 1.989 28.140 1.00 8.49 N ATOM 405 CA LYS A 440 -31.831 2.986 27.493 1.00 8.41 C ATOM 406 C LYS A 440 -31.155 4.342 27.363 1.00 8.12 C ATOM 407 O LYS A 440 -30.364 4.729 28.206 1.00 6.58 O ATOM 408 CB LYS A 440 -33.128 3.151 28.274 1.00 10.42 C ATOM 409 CG LYS A 440 -34.069 1.983 28.118 1.00 14.13 C ATOM 410 CD LYS A 440 -35.221 2.100 29.084 1.00 19.39 C ATOM 411 CE LYS A 440 -36.317 1.095 28.751 1.00 23.08 C ATOM 412 NZ LYS A 440 -35.854 -0.308 28.908 1.00 23.20 N ATOM 413 HA LYS A 440 -32.035 2.617 26.488 1.00 0.00 H ATOM 414 HB2 LYS A 440 -32.885 3.261 29.331 1.00 0.00 H ATOM 415 HB3 LYS A 440 -33.632 4.051 27.923 1.00 0.00 H ATOM 416 HG2 LYS A 440 -34.455 1.967 27.099 1.00 0.00 H ATOM 417 HG3 LYS A 440 -33.528 1.057 28.315 1.00 0.00 H ATOM 418 HD2 LYS A 440 -34.859 1.912 30.095 1.00 0.00 H ATOM 419 HD3 LYS A 440 -35.632 3.108 29.028 1.00 0.00 H ATOM 420 HE2 LYS A 440 -36.633 1.248 27.719 1.00 0.00 H ATOM 421 HE3 LYS A 440 -37.163 1.263 29.417 1.00 0.00 H ATOM 422 HZ1 LYS A 440 -35.051 -0.480 28.270 1.00 0.00 H ATOM 423 HZ2 LYS A 440 -35.557 -0.466 29.892 1.00 0.00 H ATOM 424 HZ3 LYS A 440 -36.631 -0.957 28.671 1.00 0.00 H ATOM 425 H LYS A 440 -30.370 2.277 28.934 1.00 0.00 H ATOM 426 N PRO A 441 -31.485 5.087 26.294 1.00 8.95 N ATOM 427 CA PRO A 441 -30.913 6.411 26.033 1.00 8.59 C ATOM 428 C PRO A 441 -31.386 7.497 26.983 1.00 8.60 C ATOM 429 O PRO A 441 -32.559 7.578 27.318 1.00 9.83 O ATOM 430 CB PRO A 441 -31.332 6.688 24.589 1.00 10.18 C ATOM 431 CG PRO A 441 -32.633 6.001 24.482 1.00 9.05 C ATOM 432 CD PRO A 441 -32.398 4.690 25.204 1.00 9.48 C ATOM 433 HA PRO A 441 -29.834 6.419 26.189 1.00 0.00 H ATOM 434 HD3 PRO A 441 -33.330 4.284 25.598 1.00 0.00 H ATOM 435 HD2 PRO A 441 -31.932 3.956 24.547 1.00 0.00 H ATOM 436 HG3 PRO A 441 -32.900 5.830 23.439 1.00 0.00 H ATOM 437 HG2 PRO A 441 -33.420 6.578 24.967 1.00 0.00 H ATOM 438 HB2 PRO A 441 -31.438 7.758 24.410 1.00 0.00 H ATOM 439 HB3 PRO A 441 -30.611 6.273 23.885 1.00 0.00 H ATOM 440 N ALA A 442 -30.453 8.325 27.430 1.00 7.46 N ATOM 441 CA ALA A 442 -30.804 9.422 28.317 1.00 7.37 C ATOM 442 C ALA A 442 -31.588 10.416 27.473 1.00 6.57 C ATOM 443 O ALA A 442 -31.288 10.619 26.306 1.00 6.51 O ATOM 444 CB ALA A 442 -29.547 10.078 28.886 1.00 6.48 C ATOM 445 HA ALA A 442 -31.392 9.071 29.165 1.00 0.00 H ATOM 446 HB1 ALA A 442 -28.975 9.339 29.447 1.00 0.00 H ATOM 447 HB2 ALA A 442 -28.939 10.465 28.068 1.00 0.00 H ATOM 448 HB3 ALA A 442 -29.833 10.896 29.547 1.00 0.00 H ATOM 449 H ALA A 442 -29.462 8.189 27.144 1.00 0.00 H ATOM 450 N MET A 443 -32.603 11.020 28.072 1.00 7.04 N ATOM 451 CA MET A 443 -33.426 11.979 27.361 1.00 7.10 C ATOM 452 C MET A 443 -33.695 13.225 28.194 1.00 7.71 C ATOM 453 O MET A 443 -33.611 13.189 29.415 1.00 6.63 O ATOM 454 CB MET A 443 -34.750 11.329 26.956 1.00 6.52 C ATOM 455 CG MET A 443 -34.578 10.131 26.029 1.00 9.67 C ATOM 456 SD MET A 443 -36.153 9.452 25.487 1.00 12.54 S ATOM 457 CE MET A 443 -36.524 10.534 24.131 1.00 6.79 C ATOM 458 HA MET A 443 -32.879 12.288 26.470 1.00 0.00 H ATOM 459 HB2 MET A 443 -35.263 10.997 27.859 1.00 0.00 H ATOM 460 HB3 MET A 443 -35.360 12.075 26.447 1.00 0.00 H ATOM 461 HG2 MET A 443 -34.025 9.355 26.558 1.00 0.00 H ATOM 462 HG3 MET A 443 -34.011 10.445 25.152 1.00 0.00 H ATOM 463 HE1 MET A 443 -36.590 11.560 24.494 1.00 0.00 H ATOM 464 HE2 MET A 443 -35.734 10.462 23.383 1.00 0.00 H ATOM 465 HE3 MET A 443 -37.475 10.243 23.686 1.00 0.00 H ATOM 466 H MET A 443 -32.813 10.803 29.067 1.00 0.00 H ATOM 467 N ILE A 444 -34.011 14.325 27.507 1.00 7.76 N ATOM 468 CA ILE A 444 -34.303 15.589 28.168 1.00 8.34 C ATOM 469 C ILE A 444 -35.481 16.237 27.449 1.00 8.85 C ATOM 470 O ILE A 444 -35.605 16.171 26.243 1.00 8.22 O ATOM 471 CB ILE A 444 -33.084 16.538 28.146 1.00 7.45 C ATOM 472 CG1 ILE A 444 -33.333 17.756 29.057 1.00 8.10 C ATOM 473 CG2 ILE A 444 -32.744 16.922 26.729 1.00 8.02 C ATOM 474 CD1 ILE A 444 -34.343 18.764 28.542 1.00 20.19 C ATOM 475 HA ILE A 444 -34.544 15.399 29.214 1.00 0.00 H ATOM 476 HB ILE A 444 -32.213 16.020 28.548 1.00 0.00 H ATOM 477 HG12 ILE A 444 -33.687 17.388 30.020 1.00 0.00 H ATOM 478 HG13 ILE A 444 -32.383 18.273 29.194 1.00 0.00 H ATOM 479 HD11 ILE A 444 -34.003 19.160 27.585 1.00 0.00 H ATOM 480 HD12 ILE A 444 -35.308 18.275 28.412 1.00 0.00 H ATOM 481 HD13 ILE A 444 -34.440 19.578 29.260 1.00 0.00 H ATOM 482 HG21 ILE A 444 -32.507 16.025 26.158 1.00 0.00 H ATOM 483 HG22 ILE A 444 -33.597 17.428 26.276 1.00 0.00 H ATOM 484 HG23 ILE A 444 -31.883 17.591 26.732 1.00 0.00 H ATOM 485 H ILE A 444 -34.050 14.278 26.469 1.00 0.00 H ATOM 486 N TYR A 445 -36.327 16.904 28.223 1.00 8.70 N ATOM 487 CA TYR A 445 -37.503 17.565 27.672 1.00 9.60 C ATOM 488 C TYR A 445 -37.209 18.971 27.154 1.00 8.96 C ATOM 489 O TYR A 445 -36.606 19.776 27.840 1.00 6.14 O ATOM 490 CB TYR A 445 -38.596 17.643 28.745 1.00 9.61 C ATOM 491 CG TYR A 445 -39.999 17.841 28.207 1.00 11.34 C ATOM 492 CD1 TYR A 445 -40.653 16.812 27.529 1.00 10.56 C ATOM 493 CD2 TYR A 445 -40.676 19.053 28.382 1.00 10.74 C ATOM 494 CE1 TYR A 445 -41.948 16.976 27.039 1.00 11.42 C ATOM 495 CE2 TYR A 445 -41.977 19.229 27.890 1.00 11.80 C ATOM 496 CZ TYR A 445 -42.603 18.181 27.219 1.00 12.04 C ATOM 497 OH TYR A 445 -43.880 18.325 26.725 1.00 14.04 O ATOM 498 HA TYR A 445 -37.833 16.968 26.822 1.00 0.00 H ATOM 499 HB3 TYR A 445 -38.364 18.478 29.406 1.00 0.00 H ATOM 500 HB2 TYR A 445 -38.579 16.714 29.316 1.00 0.00 H ATOM 501 HD2 TYR A 445 -40.185 19.872 28.908 1.00 0.00 H ATOM 502 HE2 TYR A 445 -42.494 20.178 28.031 1.00 0.00 H ATOM 503 HE1 TYR A 445 -42.443 16.158 26.516 1.00 0.00 H ATOM 504 HD1 TYR A 445 -40.142 15.861 27.379 1.00 0.00 H ATOM 505 HH TYR A 445 -43.897 19.066 26.068 1.00 0.00 H ATOM 506 H TYR A 445 -36.147 16.956 29.246 1.00 0.00 H ATOM 507 N CYS A 446 -37.645 19.246 25.927 1.00 8.02 N ATOM 508 CA CYS A 446 -37.491 20.570 25.337 1.00 8.70 C ATOM 509 C CYS A 446 -38.786 21.291 25.693 1.00 9.21 C ATOM 510 O CYS A 446 -39.866 20.777 25.431 1.00 8.94 O ATOM 511 CB CYS A 446 -37.360 20.487 23.816 1.00 9.73 C ATOM 512 SG CYS A 446 -37.515 22.102 23.025 1.00 10.41 S ATOM 513 HA CYS A 446 -36.597 21.074 25.704 1.00 0.00 H ATOM 514 HB2 CYS A 446 -38.142 19.832 23.432 1.00 0.00 H ATOM 515 HB3 CYS A 446 -36.384 20.068 23.570 1.00 0.00 H ATOM 516 HG CYS A 446 -37.388 21.957 21.659 1.00 0.00 H ATOM 517 H CYS A 446 -38.108 18.496 25.374 1.00 0.00 H ATOM 518 N SER A 447 -38.671 22.479 26.283 1.00 9.15 N ATOM 519 CA SER A 447 -39.842 23.231 26.713 1.00 9.42 C ATOM 520 C SER A 447 -40.518 24.109 25.668 1.00 10.94 C ATOM 521 O SER A 447 -41.406 24.877 25.998 1.00 12.16 O ATOM 522 CB SER A 447 -39.483 24.082 27.939 1.00 11.68 C ATOM 523 OG SER A 447 -39.095 23.255 29.029 1.00 11.28 O ATOM 524 HA SER A 447 -40.583 22.465 26.941 1.00 0.00 H ATOM 525 HB2 SER A 447 -40.350 24.674 28.230 1.00 0.00 H ATOM 526 HB3 SER A 447 -38.659 24.748 27.684 1.00 0.00 H ATOM 527 HG SER A 447 -38.305 22.718 28.769 1.00 0.00 H ATOM 528 H SER A 447 -37.724 22.879 26.440 1.00 0.00 H ATOM 529 N HIS A 448 -40.114 23.998 24.407 1.00 9.82 N ATOM 530 CA HIS A 448 -40.735 24.819 23.374 1.00 10.72 C ATOM 531 C HIS A 448 -42.205 24.447 23.162 1.00 11.48 C ATOM 532 O HIS A 448 -42.522 23.304 22.880 1.00 10.65 O ATOM 533 CB HIS A 448 -39.990 24.671 22.051 1.00 11.31 C ATOM 534 CG HIS A 448 -40.644 25.397 20.920 1.00 13.91 C ATOM 535 ND1 HIS A 448 -40.640 26.771 20.816 1.00 15.08 N ATOM 536 CD2 HIS A 448 -41.372 24.943 19.872 1.00 17.37 C ATOM 537 CE1 HIS A 448 -41.337 27.133 19.753 1.00 16.53 C ATOM 538 NE2 HIS A 448 -41.792 26.042 19.164 1.00 17.71 N ATOM 539 HA HIS A 448 -40.682 25.853 23.715 1.00 0.00 H ATOM 540 HB2 HIS A 448 -38.981 25.063 22.176 1.00 0.00 H ATOM 541 HB3 HIS A 448 -39.939 23.612 21.799 1.00 0.00 H ATOM 542 HD2 HIS A 448 -41.585 23.901 19.635 1.00 0.00 H ATOM 543 HE1 HIS A 448 -41.507 28.157 19.420 1.00 0.00 H ATOM 544 H HIS A 448 -39.358 23.329 24.158 1.00 0.00 H ATOM 545 N GLY A 449 -43.095 25.428 23.285 1.00 12.17 N ATOM 546 CA GLY A 449 -44.515 25.164 23.101 1.00 12.44 C ATOM 547 C GLY A 449 -44.994 24.154 24.122 1.00 13.23 C ATOM 548 O GLY A 449 -44.667 24.277 25.286 1.00 13.16 O ATOM 549 HA3 GLY A 449 -44.682 24.770 22.098 1.00 0.00 H ATOM 550 HA2 GLY A 449 -45.073 26.092 23.223 1.00 0.00 H ATOM 551 H GLY A 449 -42.774 26.390 23.514 1.00 0.00 H ATOM 552 N ASP A 450 -45.776 23.164 23.702 1.00 13.03 N ATOM 553 CA ASP A 450 -46.234 22.146 24.647 1.00 13.75 C ATOM 554 C ASP A 450 -45.055 21.278 25.082 1.00 13.32 C ATOM 555 O ASP A 450 -45.139 20.558 26.058 1.00 12.38 O ATOM 556 CB ASP A 450 -47.313 21.251 24.032 1.00 16.46 C ATOM 557 CG ASP A 450 -48.681 21.904 24.026 1.00 17.00 C ATOM 558 OD1 ASP A 450 -48.914 22.831 24.830 1.00 17.51 O ATOM 559 OD2 ASP A 450 -49.529 21.472 23.224 1.00 21.16 O ATOM 560 HA ASP A 450 -46.662 22.661 25.507 1.00 0.00 H ATOM 561 HB2 ASP A 450 -47.032 21.021 23.004 1.00 0.00 H ATOM 562 HB3 ASP A 450 -47.370 20.327 24.607 1.00 0.00 H ATOM 563 H ASP A 450 -46.061 23.114 22.703 1.00 0.00 H ATOM 564 N GLY A 451 -43.962 21.356 24.329 1.00 12.45 N ATOM 565 CA GLY A 451 -42.773 20.594 24.664 1.00 10.58 C ATOM 566 C GLY A 451 -42.665 19.234 24.006 1.00 10.97 C ATOM 567 O GLY A 451 -43.617 18.722 23.447 1.00 11.66 O ATOM 568 HA3 GLY A 451 -42.761 20.447 25.744 1.00 0.00 H ATOM 569 HA2 GLY A 451 -41.903 21.181 24.369 1.00 0.00 H ATOM 570 H GLY A 451 -43.959 21.970 23.490 1.00 0.00 H ATOM 571 N HIS A 452 -41.473 18.651 24.074 1.00 10.96 N ATOM 572 CA HIS A 452 -41.237 17.336 23.498 1.00 9.00 C ATOM 573 C HIS A 452 -39.921 16.744 23.991 1.00 8.44 C ATOM 574 O HIS A 452 -39.000 17.467 24.340 1.00 8.78 O ATOM 575 CB HIS A 452 -41.245 17.428 21.970 1.00 10.16 C ATOM 576 CG HIS A 452 -40.147 18.272 21.402 1.00 11.44 C ATOM 577 ND1 HIS A 452 -39.065 17.731 20.740 1.00 12.54 N ATOM 578 CD2 HIS A 452 -39.966 19.613 21.386 1.00 11.99 C ATOM 579 CE1 HIS A 452 -38.265 18.705 20.340 1.00 11.07 C ATOM 580 NE2 HIS A 452 -38.788 19.856 20.720 1.00 11.44 N ATOM 581 HA HIS A 452 -42.039 16.672 23.820 1.00 0.00 H ATOM 582 HB2 HIS A 452 -41.147 16.421 21.566 1.00 0.00 H ATOM 583 HB3 HIS A 452 -42.199 17.852 21.657 1.00 0.00 H ATOM 584 HD2 HIS A 452 -40.630 20.361 21.820 1.00 0.00 H ATOM 585 HE1 HIS A 452 -37.332 18.579 19.790 1.00 0.00 H ATOM 586 H HIS A 452 -40.691 19.146 24.549 1.00 0.00 H ATOM 587 N TRP A 453 -39.853 15.417 24.027 1.00 8.74 N ATOM 588 CA TRP A 453 -38.654 14.722 24.478 1.00 8.51 C ATOM 589 C TRP A 453 -37.648 14.495 23.356 1.00 8.59 C ATOM 590 O TRP A 453 -38.020 14.160 22.242 1.00 8.23 O ATOM 591 CB TRP A 453 -39.011 13.356 25.078 1.00 8.75 C ATOM 592 CG TRP A 453 -39.713 13.412 26.384 1.00 8.48 C ATOM 593 CD1 TRP A 453 -41.062 13.376 26.596 1.00 9.59 C ATOM 594 CD2 TRP A 453 -39.103 13.513 27.675 1.00 9.26 C ATOM 595 NE1 TRP A 453 -41.330 13.443 27.946 1.00 9.42 N ATOM 596 CE2 TRP A 453 -40.147 13.525 28.629 1.00 10.64 C ATOM 597 CE3 TRP A 453 -37.776 13.584 28.119 1.00 10.34 C ATOM 598 CZ2 TRP A 453 -39.900 13.619 30.006 1.00 11.40 C ATOM 599 CZ3 TRP A 453 -37.532 13.676 29.486 1.00 9.38 C ATOM 600 CH2 TRP A 453 -38.589 13.689 30.412 1.00 10.24 C ATOM 601 HA TRP A 453 -38.200 15.368 25.230 1.00 0.00 H ATOM 602 HB2 TRP A 453 -39.653 12.832 24.370 1.00 0.00 H ATOM 603 HB3 TRP A 453 -38.087 12.793 25.214 1.00 0.00 H ATOM 604 HE1 TRP A 453 -42.277 13.433 28.376 1.00 0.00 H ATOM 605 HD1 TRP A 453 -41.816 13.305 25.812 1.00 0.00 H ATOM 606 HZ2 TRP A 453 -40.717 13.636 30.727 1.00 0.00 H ATOM 607 HH2 TRP A 453 -38.364 13.756 31.476 1.00 0.00 H ATOM 608 HZ3 TRP A 453 -36.504 13.739 29.844 1.00 0.00 H ATOM 609 HE3 TRP A 453 -36.951 13.567 27.407 1.00 0.00 H ATOM 610 H TRP A 453 -40.678 14.860 23.725 1.00 0.00 H ATOM 611 N VAL A 454 -36.369 14.683 23.675 1.00 8.49 N ATOM 612 CA VAL A 454 -35.289 14.448 22.719 1.00 6.93 C ATOM 613 C VAL A 454 -34.204 13.634 23.427 1.00 7.24 C ATOM 614 O VAL A 454 -34.151 13.602 24.649 1.00 4.10 O ATOM 615 CB VAL A 454 -34.649 15.769 22.209 1.00 8.83 C ATOM 616 CG1 VAL A 454 -35.651 16.553 21.364 1.00 7.53 C ATOM 617 CG2 VAL A 454 -34.157 16.602 23.385 1.00 9.18 C ATOM 618 HA VAL A 454 -35.706 13.925 21.858 1.00 0.00 H ATOM 619 HB VAL A 454 -33.792 15.527 21.580 1.00 0.00 H ATOM 620 HG11 VAL A 454 -35.953 15.950 20.508 1.00 0.00 H ATOM 621 HG12 VAL A 454 -36.526 16.791 21.969 1.00 0.00 H ATOM 622 HG13 VAL A 454 -35.187 17.475 21.015 1.00 0.00 H ATOM 623 HG21 VAL A 454 -34.998 16.840 24.037 1.00 0.00 H ATOM 624 HG22 VAL A 454 -33.412 16.036 23.943 1.00 0.00 H ATOM 625 HG23 VAL A 454 -33.711 17.525 23.014 1.00 0.00 H ATOM 626 H VAL A 454 -36.131 15.007 24.634 1.00 0.00 H ATOM 627 N HIS A 455 -33.357 12.963 22.651 1.00 6.72 N ATOM 628 CA HIS A 455 -32.262 12.184 23.225 1.00 6.95 C ATOM 629 C HIS A 455 -31.139 13.173 23.507 1.00 6.64 C ATOM 630 O HIS A 455 -30.770 13.961 22.647 1.00 4.78 O ATOM 631 CB HIS A 455 -31.762 11.116 22.242 1.00 6.00 C ATOM 632 CG HIS A 455 -32.812 10.133 21.823 1.00 6.13 C ATOM 633 ND1 HIS A 455 -33.285 10.059 20.530 1.00 5.32 N ATOM 634 CD2 HIS A 455 -33.467 9.174 22.519 1.00 5.88 C ATOM 635 CE1 HIS A 455 -34.188 9.098 20.449 1.00 6.77 C ATOM 636 NE2 HIS A 455 -34.318 8.544 21.640 1.00 6.62 N ATOM 637 HA HIS A 455 -32.595 11.667 24.125 1.00 0.00 H ATOM 638 HB2 HIS A 455 -31.388 11.619 21.350 1.00 0.00 H ATOM 639 HB3 HIS A 455 -30.948 10.567 22.716 1.00 0.00 H ATOM 640 HD2 HIS A 455 -33.343 8.944 23.577 1.00 0.00 H ATOM 641 HE1 HIS A 455 -34.734 8.811 19.550 1.00 0.00 H ATOM 642 H HIS A 455 -33.476 12.993 21.618 1.00 0.00 H ATOM 643 N ALA A 456 -30.606 13.128 24.723 1.00 6.45 N ATOM 644 CA ALA A 456 -29.532 14.035 25.110 1.00 6.32 C ATOM 645 C ALA A 456 -28.357 13.987 24.139 1.00 6.85 C ATOM 646 O ALA A 456 -27.817 15.014 23.769 1.00 7.40 O ATOM 647 CB ALA A 456 -29.059 13.704 26.516 1.00 5.86 C ATOM 648 HA ALA A 456 -29.933 15.048 25.083 1.00 0.00 H ATOM 649 HB1 ALA A 456 -29.891 13.812 27.212 1.00 0.00 H ATOM 650 HB2 ALA A 456 -28.692 12.678 26.542 1.00 0.00 H ATOM 651 HB3 ALA A 456 -28.257 14.386 26.798 1.00 0.00 H ATOM 652 H ALA A 456 -30.961 12.434 25.411 1.00 0.00 H ATOM 653 N GLN A 457 -27.977 12.780 23.727 1.00 7.72 N ATOM 654 CA GLN A 457 -26.856 12.603 22.814 1.00 8.35 C ATOM 655 C GLN A 457 -27.080 13.283 21.465 1.00 8.64 C ATOM 656 O GLN A 457 -26.155 13.792 20.862 1.00 8.02 O ATOM 657 CB GLN A 457 -26.585 11.111 22.586 1.00 10.39 C ATOM 658 CG GLN A 457 -25.232 10.844 21.943 1.00 14.27 C ATOM 659 CD GLN A 457 -24.932 9.369 21.759 1.00 17.58 C ATOM 660 OE1 GLN A 457 -25.629 8.512 22.277 1.00 13.90 O ATOM 661 NE2 GLN A 457 -23.865 9.075 21.018 1.00 19.28 N ATOM 662 HA GLN A 457 -25.995 13.076 23.286 1.00 0.00 H ATOM 663 HB2 GLN A 457 -26.619 10.600 23.548 1.00 0.00 H ATOM 664 HB3 GLN A 457 -27.364 10.712 21.936 1.00 0.00 H ATOM 665 HG2 GLN A 457 -25.213 11.325 20.965 1.00 0.00 H ATOM 666 HG3 GLN A 457 -24.457 11.278 22.575 1.00 0.00 H ATOM 667 HE22 GLN A 457 -23.299 9.838 20.595 1.00 0.00 H ATOM 668 HE21 GLN A 457 -23.598 8.082 20.862 1.00 0.00 H ATOM 669 H GLN A 457 -28.493 11.943 24.065 1.00 0.00 H ATOM 670 N CYS A 458 -28.321 13.278 20.993 1.00 8.64 N ATOM 671 CA CYS A 458 -28.631 13.893 19.709 1.00 9.19 C ATOM 672 C CYS A 458 -28.476 15.415 19.747 1.00 10.60 C ATOM 673 O CYS A 458 -28.393 16.063 18.709 1.00 7.79 O ATOM 674 CB CYS A 458 -30.049 13.495 19.278 1.00 8.30 C ATOM 675 SG CYS A 458 -30.226 11.707 18.971 1.00 10.67 S ATOM 676 HA CYS A 458 -27.914 13.525 18.975 1.00 0.00 H ATOM 677 HB2 CYS A 458 -30.297 14.031 18.362 1.00 0.00 H ATOM 678 HB3 CYS A 458 -30.745 13.783 20.066 1.00 0.00 H ATOM 679 HG CYS A 458 -31.524 11.434 18.590 1.00 0.00 H ATOM 680 H CYS A 458 -29.080 12.830 21.546 1.00 0.00 H ATOM 681 N MET A 459 -28.413 15.966 20.959 1.00 10.72 N ATOM 682 CA MET A 459 -28.265 17.411 21.164 1.00 11.28 C ATOM 683 C MET A 459 -26.803 17.788 21.403 1.00 10.36 C ATOM 684 O MET A 459 -26.484 18.942 21.621 1.00 9.28 O ATOM 685 CB MET A 459 -29.075 17.848 22.378 1.00 11.00 C ATOM 686 CG MET A 459 -30.523 17.419 22.328 1.00 13.59 C ATOM 687 SD MET A 459 -31.526 18.597 21.418 1.00 18.13 S ATOM 688 CE MET A 459 -31.457 18.038 19.944 1.00 11.90 C ATOM 689 HA MET A 459 -28.623 17.911 20.264 1.00 0.00 H ATOM 690 HB2 MET A 459 -28.619 17.418 23.270 1.00 0.00 H ATOM 691 HB3 MET A 459 -29.040 18.936 22.442 1.00 0.00 H ATOM 692 HG2 MET A 459 -30.905 17.340 23.346 1.00 0.00 H ATOM 693 HG3 MET A 459 -30.588 16.446 21.840 1.00 0.00 H ATOM 694 HE1 MET A 459 -30.419 18.020 19.612 1.00 0.00 H ATOM 695 HE2 MET A 459 -31.865 17.027 19.921 1.00 0.00 H ATOM 696 HE3 MET A 459 -32.040 18.682 19.285 1.00 0.00 H ATOM 697 H MET A 459 -28.471 15.347 21.793 1.00 0.00 H ATOM 698 N ASP A 460 -25.926 16.792 21.376 1.00 11.27 N ATOM 699 CA ASP A 460 -24.505 17.021 21.595 1.00 12.80 C ATOM 700 C ASP A 460 -24.236 17.608 22.983 1.00 11.62 C ATOM 701 O ASP A 460 -23.320 18.390 23.171 1.00 10.13 O ATOM 702 CB ASP A 460 -23.943 17.942 20.508 1.00 17.79 C ATOM 703 CG ASP A 460 -24.008 17.316 19.115 1.00 26.35 C ATOM 704 OD1 ASP A 460 -23.657 16.122 18.971 1.00 29.18 O ATOM 705 OD2 ASP A 460 -24.396 18.022 18.159 1.00 29.92 O ATOM 706 HA ASP A 460 -24.000 16.057 21.541 1.00 0.00 H ATOM 707 HB2 ASP A 460 -24.519 18.867 20.502 1.00 0.00 H ATOM 708 HB3 ASP A 460 -22.902 18.165 20.743 1.00 0.00 H ATOM 709 H ASP A 460 -26.262 15.825 21.194 1.00 0.00 H ATOM 710 N LEU A 461 -25.060 17.222 23.953 1.00 9.64 N ATOM 711 CA LEU A 461 -24.884 17.692 25.322 1.00 11.03 C ATOM 712 C LEU A 461 -23.821 16.853 26.020 1.00 10.61 C ATOM 713 O LEU A 461 -23.885 15.632 26.000 1.00 8.77 O ATOM 714 CB LEU A 461 -26.190 17.574 26.111 1.00 10.29 C ATOM 715 CG LEU A 461 -27.294 18.619 25.932 1.00 11.78 C ATOM 716 CD1 LEU A 461 -28.587 18.098 26.555 1.00 10.95 C ATOM 717 CD2 LEU A 461 -26.874 19.928 26.585 1.00 10.41 C ATOM 718 HA LEU A 461 -24.580 18.738 25.284 1.00 0.00 H ATOM 719 HB2 LEU A 461 -26.626 16.609 25.854 1.00 0.00 H ATOM 720 HB3 LEU A 461 -25.921 17.579 27.167 1.00 0.00 H ATOM 721 HG LEU A 461 -27.461 18.801 24.870 1.00 0.00 H ATOM 722 HD21 LEU A 461 -26.701 19.763 27.649 1.00 0.00 H ATOM 723 HD22 LEU A 461 -25.957 20.288 26.118 1.00 0.00 H ATOM 724 HD23 LEU A 461 -27.664 20.668 26.454 1.00 0.00 H ATOM 725 HD11 LEU A 461 -28.878 17.170 26.062 1.00 0.00 H ATOM 726 HD12 LEU A 461 -28.428 17.912 27.617 1.00 0.00 H ATOM 727 HD13 LEU A 461 -29.375 18.841 26.429 1.00 0.00 H ATOM 728 H LEU A 461 -25.843 16.574 23.731 1.00 0.00 H ATOM 729 N GLU A 462 -22.838 17.515 26.623 1.00 10.07 N ATOM 730 CA GLU A 462 -21.799 16.802 27.359 1.00 11.43 C ATOM 731 C GLU A 462 -22.482 16.253 28.599 1.00 11.31 C ATOM 732 O GLU A 462 -23.494 16.790 29.036 1.00 10.44 O ATOM 733 CB GLU A 462 -20.671 17.749 27.772 1.00 11.44 C ATOM 734 CG GLU A 462 -19.859 18.274 26.609 1.00 18.26 C ATOM 735 CD GLU A 462 -18.819 19.293 27.029 1.00 21.17 C ATOM 736 OE1 GLU A 462 -18.713 19.591 28.238 1.00 24.51 O ATOM 737 OE2 GLU A 462 -18.104 19.800 26.143 1.00 26.00 O ATOM 738 HA GLU A 462 -21.353 16.018 26.747 1.00 0.00 H ATOM 739 HB2 GLU A 462 -21.109 18.598 28.297 1.00 0.00 H ATOM 740 HB3 GLU A 462 -20.001 17.214 28.445 1.00 0.00 H ATOM 741 HG2 GLU A 462 -19.352 17.435 26.132 1.00 0.00 H ATOM 742 HG3 GLU A 462 -20.536 18.742 25.895 1.00 0.00 H ATOM 743 H GLU A 462 -22.809 18.553 26.569 1.00 0.00 H ATOM 744 N GLU A 463 -21.924 15.189 29.166 1.00 11.11 N ATOM 745 CA GLU A 463 -22.521 14.588 30.348 1.00 10.58 C ATOM 746 C GLU A 463 -22.702 15.550 31.520 1.00 9.87 C ATOM 747 O GLU A 463 -23.742 15.555 32.147 1.00 8.33 O ATOM 748 CB GLU A 463 -21.707 13.377 30.806 1.00 11.21 C ATOM 749 CG GLU A 463 -22.247 12.757 32.077 1.00 16.56 C ATOM 750 CD GLU A 463 -21.745 11.350 32.313 1.00 19.19 C ATOM 751 OE1 GLU A 463 -21.520 11.003 33.489 1.00 20.27 O ATOM 752 OE2 GLU A 463 -21.588 10.591 31.334 1.00 19.40 O ATOM 753 HA GLU A 463 -23.521 14.283 30.040 1.00 0.00 H ATOM 754 HB2 GLU A 463 -21.725 12.626 30.016 1.00 0.00 H ATOM 755 HB3 GLU A 463 -20.679 13.694 30.982 1.00 0.00 H ATOM 756 HG2 GLU A 463 -21.947 13.378 32.921 1.00 0.00 H ATOM 757 HG3 GLU A 463 -23.335 12.731 32.015 1.00 0.00 H ATOM 758 H GLU A 463 -21.055 14.784 28.762 1.00 0.00 H ATOM 759 N ARG A 464 -21.703 16.373 31.819 1.00 10.74 N ATOM 760 CA ARG A 464 -21.871 17.277 32.954 1.00 12.22 C ATOM 761 C ARG A 464 -23.002 18.284 32.730 1.00 10.79 C ATOM 762 O ARG A 464 -23.715 18.619 33.658 1.00 11.07 O ATOM 763 CB ARG A 464 -20.562 18.010 33.302 1.00 15.80 C ATOM 764 CG ARG A 464 -20.080 19.038 32.298 1.00 20.22 C ATOM 765 CD ARG A 464 -18.919 19.865 32.873 1.00 22.73 C ATOM 766 NE ARG A 464 -18.277 20.646 31.821 1.00 26.59 N ATOM 767 CZ ARG A 464 -16.972 20.898 31.762 1.00 29.12 C ATOM 768 NH1 ARG A 464 -16.482 21.616 30.759 1.00 28.19 N ATOM 769 NH2 ARG A 464 -16.154 20.429 32.697 1.00 28.24 N ATOM 770 HA ARG A 464 -22.146 16.651 33.802 1.00 0.00 H ATOM 771 HB2 ARG A 464 -20.709 18.519 34.254 1.00 0.00 H ATOM 772 HB3 ARG A 464 -19.779 17.259 33.410 1.00 0.00 H ATOM 773 HG2 ARG A 464 -19.742 18.526 31.397 1.00 0.00 H ATOM 774 HG3 ARG A 464 -20.904 19.706 32.047 1.00 0.00 H ATOM 775 HD2 ARG A 464 -18.186 19.193 33.319 1.00 0.00 H ATOM 776 HD3 ARG A 464 -19.303 20.540 33.637 1.00 0.00 H ATOM 777 HE ARG A 464 -18.880 21.032 31.067 1.00 0.00 H ATOM 778 HH12 ARG A 464 -15.462 21.814 30.711 1.00 0.00 H ATOM 779 HH11 ARG A 464 -17.118 21.980 30.021 1.00 0.00 H ATOM 780 HH22 ARG A 464 -15.135 20.630 32.645 1.00 0.00 H ATOM 781 HH21 ARG A 464 -16.532 19.861 33.482 1.00 0.00 H ATOM 782 H ARG A 464 -20.826 16.374 31.261 1.00 0.00 H ATOM 783 N THR A 465 -23.167 18.755 31.495 1.00 8.92 N ATOM 784 CA THR A 465 -24.232 19.710 31.192 1.00 8.40 C ATOM 785 C THR A 465 -25.583 19.030 31.427 1.00 8.89 C ATOM 786 O THR A 465 -26.477 19.590 32.048 1.00 9.41 O ATOM 787 CB THR A 465 -24.174 20.181 29.717 1.00 7.58 C ATOM 788 OG1 THR A 465 -22.839 20.594 29.396 1.00 7.94 O ATOM 789 CG2 THR A 465 -25.122 21.359 29.499 1.00 6.31 C ATOM 790 HA THR A 465 -24.104 20.578 31.839 1.00 0.00 H ATOM 791 HB THR A 465 -24.474 19.353 29.075 1.00 0.00 H ATOM 792 HG1 THR A 465 -22.574 21.340 29.991 1.00 0.00 H ATOM 793 HG23 THR A 465 -26.140 21.054 29.741 1.00 0.00 H ATOM 794 HG21 THR A 465 -24.826 22.186 30.144 1.00 0.00 H ATOM 795 HG22 THR A 465 -25.074 21.675 28.457 1.00 0.00 H ATOM 796 H THR A 465 -22.530 18.439 30.736 1.00 0.00 H ATOM 797 N LEU A 466 -25.704 17.806 30.922 1.00 9.34 N ATOM 798 CA LEU A 466 -26.916 17.005 31.050 1.00 9.47 C ATOM 799 C LEU A 466 -27.258 16.772 32.528 1.00 9.24 C ATOM 800 O LEU A 466 -28.386 16.960 32.943 1.00 7.05 O ATOM 801 CB LEU A 466 -26.696 15.646 30.399 1.00 10.58 C ATOM 802 CG LEU A 466 -27.867 14.896 29.703 1.00 14.51 C ATOM 803 CD1 LEU A 466 -27.608 13.404 29.857 1.00 10.91 C ATOM 804 CD2 LEU A 466 -29.199 15.280 30.305 1.00 12.93 C ATOM 805 HA LEU A 466 -27.732 17.541 30.565 1.00 0.00 H ATOM 806 HB2 LEU A 466 -25.923 15.785 29.643 1.00 0.00 H ATOM 807 HB3 LEU A 466 -26.323 14.984 31.180 1.00 0.00 H ATOM 808 HG LEU A 466 -27.914 15.168 28.648 1.00 0.00 H ATOM 809 HD21 LEU A 466 -29.204 15.025 31.365 1.00 0.00 H ATOM 810 HD22 LEU A 466 -29.354 16.352 30.187 1.00 0.00 H ATOM 811 HD23 LEU A 466 -29.996 14.738 29.796 1.00 0.00 H ATOM 812 HD11 LEU A 466 -26.658 13.151 29.386 1.00 0.00 H ATOM 813 HD12 LEU A 466 -27.568 13.151 30.916 1.00 0.00 H ATOM 814 HD13 LEU A 466 -28.413 12.846 29.379 1.00 0.00 H ATOM 815 H LEU A 466 -24.895 17.400 30.411 1.00 0.00 H ATOM 816 N ILE A 467 -26.271 16.346 33.314 1.00 8.77 N ATOM 817 CA ILE A 467 -26.489 16.094 34.731 1.00 9.89 C ATOM 818 C ILE A 467 -26.889 17.388 35.433 1.00 9.48 C ATOM 819 O ILE A 467 -27.757 17.383 36.292 1.00 10.46 O ATOM 820 CB ILE A 467 -25.227 15.522 35.406 1.00 11.98 C ATOM 821 CG1 ILE A 467 -24.891 14.161 34.785 1.00 13.79 C ATOM 822 CG2 ILE A 467 -25.489 15.363 36.913 1.00 12.45 C ATOM 823 CD1 ILE A 467 -23.481 13.668 35.138 1.00 20.24 C ATOM 824 HA ILE A 467 -27.289 15.358 34.816 1.00 0.00 H ATOM 825 HB ILE A 467 -24.386 16.199 35.256 1.00 0.00 H ATOM 826 HG12 ILE A 467 -25.614 13.428 35.143 1.00 0.00 H ATOM 827 HG13 ILE A 467 -24.968 14.246 33.701 1.00 0.00 H ATOM 828 HD11 ILE A 467 -22.745 14.387 34.777 1.00 0.00 H ATOM 829 HD12 ILE A 467 -23.393 13.568 36.220 1.00 0.00 H ATOM 830 HD13 ILE A 467 -23.307 12.700 34.667 1.00 0.00 H ATOM 831 HG21 ILE A 467 -25.727 16.336 37.344 1.00 0.00 H ATOM 832 HG22 ILE A 467 -26.327 14.682 37.065 1.00 0.00 H ATOM 833 HG23 ILE A 467 -24.599 14.959 37.395 1.00 0.00 H ATOM 834 H ILE A 467 -25.326 16.190 32.908 1.00 0.00 H ATOM 835 N HIS A 468 -26.238 18.493 35.088 1.00 8.57 N ATOM 836 CA HIS A 468 -26.587 19.759 35.714 1.00 10.32 C ATOM 837 C HIS A 468 -28.048 20.075 35.356 1.00 10.60 C ATOM 838 O HIS A 468 -28.854 20.391 36.210 1.00 11.40 O ATOM 839 CB HIS A 468 -25.676 20.905 35.234 1.00 11.16 C ATOM 840 CG HIS A 468 -24.229 20.742 35.595 1.00 13.22 C ATOM 841 ND1 HIS A 468 -23.780 19.774 36.471 1.00 14.15 N ATOM 842 CD2 HIS A 468 -23.131 21.415 35.183 1.00 13.31 C ATOM 843 CE1 HIS A 468 -22.465 19.861 36.577 1.00 14.22 C ATOM 844 NE2 HIS A 468 -22.045 20.847 35.808 1.00 14.33 N ATOM 845 HA HIS A 468 -26.455 19.671 36.792 1.00 0.00 H ATOM 846 HB2 HIS A 468 -25.751 20.968 34.148 1.00 0.00 H ATOM 847 HB3 HIS A 468 -26.035 21.834 35.677 1.00 0.00 H ATOM 848 HD2 HIS A 468 -23.110 22.252 34.485 1.00 0.00 H ATOM 849 HE1 HIS A 468 -21.833 19.224 37.196 1.00 0.00 H ATOM 850 H HIS A 468 -25.483 18.453 34.374 1.00 0.00 H ATOM 851 N LEU A 469 -28.409 19.983 34.089 1.00 9.45 N ATOM 852 CA LEU A 469 -29.796 20.269 33.752 1.00 8.81 C ATOM 853 C LEU A 469 -30.765 19.407 34.561 1.00 9.85 C ATOM 854 O LEU A 469 -31.791 19.890 35.010 1.00 11.44 O ATOM 855 CB LEU A 469 -30.025 20.071 32.254 1.00 8.53 C ATOM 856 CG LEU A 469 -29.466 21.228 31.418 1.00 7.45 C ATOM 857 CD1 LEU A 469 -29.334 20.812 29.970 1.00 8.89 C ATOM 858 CD2 LEU A 469 -30.375 22.441 31.558 1.00 8.31 C ATOM 859 HA LEU A 469 -29.994 21.310 34.009 1.00 0.00 H ATOM 860 HB2 LEU A 469 -29.536 19.147 31.944 1.00 0.00 H ATOM 861 HB3 LEU A 469 -31.097 19.993 32.071 1.00 0.00 H ATOM 862 HG LEU A 469 -28.473 21.493 31.782 1.00 0.00 H ATOM 863 HD21 LEU A 469 -31.375 22.187 31.205 1.00 0.00 H ATOM 864 HD22 LEU A 469 -30.423 22.739 32.605 1.00 0.00 H ATOM 865 HD23 LEU A 469 -29.976 23.263 30.963 1.00 0.00 H ATOM 866 HD11 LEU A 469 -28.657 19.960 29.898 1.00 0.00 H ATOM 867 HD12 LEU A 469 -30.314 20.533 29.583 1.00 0.00 H ATOM 868 HD13 LEU A 469 -28.936 21.644 29.389 1.00 0.00 H ATOM 869 H LEU A 469 -27.723 19.714 33.355 1.00 0.00 H ATOM 870 N SER A 470 -30.415 18.139 34.764 1.00 10.68 N ATOM 871 CA SER A 470 -31.275 17.209 35.501 1.00 12.51 C ATOM 872 C SER A 470 -31.391 17.528 36.989 1.00 14.35 C ATOM 873 O SER A 470 -32.345 17.122 37.636 1.00 14.13 O ATOM 874 CB SER A 470 -30.764 15.769 35.350 1.00 12.83 C ATOM 875 OG SER A 470 -29.637 15.533 36.183 1.00 11.42 O ATOM 876 HA SER A 470 -32.266 17.320 35.062 1.00 0.00 H ATOM 877 HB2 SER A 470 -30.480 15.599 34.311 1.00 0.00 H ATOM 878 HB3 SER A 470 -31.561 15.078 35.625 1.00 0.00 H ATOM 879 HG SER A 470 -28.908 16.155 35.934 1.00 0.00 H ATOM 880 H SER A 470 -29.506 17.799 34.389 1.00 0.00 H ATOM 881 N GLU A 471 -30.413 18.257 37.521 1.00 14.70 N ATOM 882 CA GLU A 471 -30.399 18.600 38.942 1.00 15.97 C ATOM 883 C GLU A 471 -30.931 19.996 39.257 1.00 16.62 C ATOM 884 O GLU A 471 -30.806 20.461 40.377 1.00 17.27 O ATOM 885 CB GLU A 471 -28.971 18.466 39.496 1.00 17.78 C ATOM 886 CG GLU A 471 -28.433 17.038 39.502 1.00 23.81 C ATOM 887 CD GLU A 471 -26.967 16.956 39.899 1.00 27.46 C ATOM 888 OE1 GLU A 471 -26.222 17.924 39.643 1.00 29.42 O ATOM 889 OE2 GLU A 471 -26.547 15.914 40.445 1.00 30.57 O ATOM 890 HA GLU A 471 -31.077 17.896 39.424 1.00 0.00 H ATOM 891 HB2 GLU A 471 -28.308 19.079 38.885 1.00 0.00 H ATOM 892 HB3 GLU A 471 -28.965 18.838 40.521 1.00 0.00 H ATOM 893 HG2 GLU A 471 -29.018 16.449 40.209 1.00 0.00 H ATOM 894 HG3 GLU A 471 -28.546 16.620 38.502 1.00 0.00 H ATOM 895 H GLU A 471 -29.640 18.591 36.911 1.00 0.00 H ATOM 896 N GLY A 472 -31.528 20.657 38.268 1.00 14.61 N ATOM 897 CA GLY A 472 -32.044 21.995 38.492 1.00 13.01 C ATOM 898 C GLY A 472 -33.406 22.230 37.871 1.00 13.29 C ATOM 899 O GLY A 472 -33.953 21.350 37.233 1.00 11.01 O ATOM 900 HA3 GLY A 472 -31.342 22.712 38.066 1.00 0.00 H ATOM 901 HA2 GLY A 472 -32.122 22.160 39.567 1.00 0.00 H ATOM 902 H GLY A 472 -31.625 20.214 37.332 1.00 0.00 H ATOM 903 N SER A 473 -33.945 23.432 38.054 1.00 12.86 N ATOM 904 CA SER A 473 -35.266 23.759 37.517 1.00 12.91 C ATOM 905 C SER A 473 -35.229 24.499 36.187 1.00 12.16 C ATOM 906 O SER A 473 -36.265 24.811 35.628 1.00 11.46 O ATOM 907 CB SER A 473 -36.065 24.578 38.541 1.00 12.46 C ATOM 908 OG SER A 473 -35.397 25.778 38.878 1.00 14.05 O ATOM 909 HA SER A 473 -35.754 22.804 37.325 1.00 0.00 H ATOM 910 HB2 SER A 473 -36.201 23.982 39.444 1.00 0.00 H ATOM 911 HB3 SER A 473 -37.040 24.821 38.118 1.00 0.00 H ATOM 912 HG SER A 473 -35.275 26.327 38.063 1.00 0.00 H ATOM 913 H SER A 473 -33.418 24.152 38.588 1.00 0.00 H ATOM 914 N ASN A 474 -34.029 24.771 35.685 1.00 11.35 N ATOM 915 CA ASN A 474 -33.887 25.470 34.411 1.00 12.28 C ATOM 916 C ASN A 474 -34.515 24.666 33.289 1.00 12.57 C ATOM 917 O ASN A 474 -34.417 23.448 33.255 1.00 11.27 O ATOM 918 CB ASN A 474 -32.415 25.708 34.069 1.00 13.93 C ATOM 919 CG ASN A 474 -31.752 26.695 34.999 1.00 16.44 C ATOM 920 OD1 ASN A 474 -31.694 26.479 36.191 1.00 19.84 O ATOM 921 ND2 ASN A 474 -31.243 27.787 34.442 1.00 17.01 N ATOM 922 HA ASN A 474 -34.394 26.430 34.513 1.00 0.00 H ATOM 923 HB2 ASN A 474 -31.884 24.758 34.132 1.00 0.00 H ATOM 924 HB3 ASN A 474 -32.351 26.091 33.051 1.00 0.00 H ATOM 925 HD22 ASN A 474 -31.317 27.929 33.414 1.00 0.00 H ATOM 926 HD21 ASN A 474 -30.770 28.500 35.033 1.00 0.00 H ATOM 927 H ASN A 474 -33.178 24.481 36.208 1.00 0.00 H ATOM 928 N LYS A 475 -35.162 25.364 32.365 1.00 10.26 N ATOM 929 CA LYS A 475 -35.783 24.692 31.244 1.00 11.94 C ATOM 930 C LYS A 475 -34.740 24.505 30.155 1.00 11.43 C ATOM 931 O LYS A 475 -33.787 25.265 30.058 1.00 11.44 O ATOM 932 CB LYS A 475 -36.944 25.517 30.698 1.00 15.92 C ATOM 933 CG LYS A 475 -38.004 25.881 31.737 1.00 17.95 C ATOM 934 CD LYS A 475 -38.417 24.677 32.576 1.00 24.02 C ATOM 935 CE LYS A 475 -39.893 24.763 32.982 1.00 27.72 C ATOM 936 NZ LYS A 475 -40.373 23.573 33.750 1.00 29.63 N ATOM 937 HA LYS A 475 -36.171 23.727 31.572 1.00 0.00 H ATOM 938 HB2 LYS A 475 -36.541 26.441 30.284 1.00 0.00 H ATOM 939 HB3 LYS A 475 -37.426 24.945 29.905 1.00 0.00 H ATOM 940 HG2 LYS A 475 -37.601 26.649 32.397 1.00 0.00 H ATOM 941 HG3 LYS A 475 -38.883 26.270 31.223 1.00 0.00 H ATOM 942 HD2 LYS A 475 -38.260 23.768 31.995 1.00 0.00 H ATOM 943 HD3 LYS A 475 -37.802 24.642 33.475 1.00 0.00 H ATOM 944 HE2 LYS A 475 -40.495 24.856 32.078 1.00 0.00 H ATOM 945 HE3 LYS A 475 -40.030 25.650 33.600 1.00 0.00 H ATOM 946 HZ1 LYS A 475 -40.259 22.718 33.169 1.00 0.00 H ATOM 947 HZ2 LYS A 475 -39.815 23.477 34.623 1.00 0.00 H ATOM 948 HZ3 LYS A 475 -41.377 23.699 33.991 1.00 0.00 H ATOM 949 H LYS A 475 -35.223 26.399 32.447 1.00 0.00 H ATOM 950 N TYR A 476 -34.926 23.467 29.349 1.00 9.97 N ATOM 951 CA TYR A 476 -34.024 23.188 28.249 1.00 10.65 C ATOM 952 C TYR A 476 -34.768 23.366 26.929 1.00 11.04 C ATOM 953 O TYR A 476 -35.960 23.094 26.841 1.00 8.74 O ATOM 954 CB TYR A 476 -33.477 21.760 28.343 1.00 10.52 C ATOM 955 CG TYR A 476 -32.648 21.374 27.137 1.00 10.12 C ATOM 956 CD1 TYR A 476 -33.151 20.512 26.161 1.00 11.18 C ATOM 957 CD2 TYR A 476 -31.393 21.940 26.930 1.00 10.53 C ATOM 958 CE1 TYR A 476 -32.423 20.229 25.004 1.00 10.77 C ATOM 959 CE2 TYR A 476 -30.659 21.669 25.775 1.00 10.74 C ATOM 960 CZ TYR A 476 -31.184 20.816 24.816 1.00 11.17 C ATOM 961 OH TYR A 476 -30.490 20.582 23.651 1.00 12.56 O ATOM 962 HA TYR A 476 -33.185 23.882 28.299 1.00 0.00 H ATOM 963 HB3 TYR A 476 -34.316 21.069 28.426 1.00 0.00 H ATOM 964 HB2 TYR A 476 -32.854 21.682 29.234 1.00 0.00 H ATOM 965 HD2 TYR A 476 -30.976 22.607 27.684 1.00 0.00 H ATOM 966 HE2 TYR A 476 -29.680 22.125 25.627 1.00 0.00 H ATOM 967 HE1 TYR A 476 -32.828 19.550 24.254 1.00 0.00 H ATOM 968 HD1 TYR A 476 -34.129 20.052 26.305 1.00 0.00 H ATOM 969 HH TYR A 476 -30.361 21.436 23.168 1.00 0.00 H ATOM 970 H TYR A 476 -35.739 22.838 29.511 1.00 0.00 H ATOM 971 N TYR A 477 -34.050 23.847 25.917 1.00 10.88 N ATOM 972 CA TYR A 477 -34.627 24.044 24.593 1.00 11.98 C ATOM 973 C TYR A 477 -33.710 23.381 23.577 1.00 12.80 C ATOM 974 O TYR A 477 -32.535 23.683 23.515 1.00 11.64 O ATOM 975 CB TYR A 477 -34.791 25.538 24.290 1.00 13.20 C ATOM 976 CG TYR A 477 -35.808 26.205 25.188 1.00 13.56 C ATOM 977 CD1 TYR A 477 -35.426 26.782 26.398 1.00 13.70 C ATOM 978 CD2 TYR A 477 -37.164 26.202 24.859 1.00 15.64 C ATOM 979 CE1 TYR A 477 -36.368 27.339 27.260 1.00 16.54 C ATOM 980 CE2 TYR A 477 -38.117 26.758 25.716 1.00 17.21 C ATOM 981 CZ TYR A 477 -37.708 27.322 26.915 1.00 16.72 C ATOM 982 OH TYR A 477 -38.628 27.875 27.774 1.00 19.39 O ATOM 983 HA TYR A 477 -35.619 23.595 24.546 1.00 0.00 H ATOM 984 HB3 TYR A 477 -35.112 25.651 23.254 1.00 0.00 H ATOM 985 HB2 TYR A 477 -33.828 26.030 24.427 1.00 0.00 H ATOM 986 HD2 TYR A 477 -37.485 25.758 23.917 1.00 0.00 H ATOM 987 HE2 TYR A 477 -39.173 26.749 25.445 1.00 0.00 H ATOM 988 HE1 TYR A 477 -36.051 27.786 28.202 1.00 0.00 H ATOM 989 HD1 TYR A 477 -34.372 26.798 26.675 1.00 0.00 H ATOM 990 HH TYR A 477 -39.279 27.182 28.049 1.00 0.00 H ATOM 991 H TYR A 477 -33.051 24.089 26.075 1.00 0.00 H ATOM 992 N CYS A 478 -34.265 22.460 22.792 1.00 13.41 N ATOM 993 CA CYS A 478 -33.474 21.732 21.807 1.00 14.06 C ATOM 994 C CYS A 478 -32.856 22.653 20.763 1.00 14.64 C ATOM 995 O CYS A 478 -33.268 23.794 20.598 1.00 12.80 O ATOM 996 CB CYS A 478 -34.318 20.648 21.123 1.00 13.69 C ATOM 997 SG CYS A 478 -35.445 21.247 19.854 1.00 12.67 S ATOM 998 HA CYS A 478 -32.656 21.258 22.350 1.00 0.00 H ATOM 999 HB2 CYS A 478 -34.908 20.145 21.889 1.00 0.00 H ATOM 1000 HB3 CYS A 478 -33.639 19.932 20.661 1.00 0.00 H ATOM 1001 HG CYS A 478 -36.141 20.182 19.319 1.00 0.00 H ATOM 1002 H CYS A 478 -35.281 22.256 22.883 1.00 0.00 H ATOM 1003 N ASN A 479 -31.855 22.128 20.067 1.00 15.98 N ATOM 1004 CA ASN A 479 -31.128 22.880 19.055 1.00 18.49 C ATOM 1005 C ASN A 479 -32.040 23.445 17.955 1.00 19.46 C ATOM 1006 O ASN A 479 -31.743 24.464 17.371 1.00 20.05 O ATOM 1007 CB ASN A 479 -30.003 21.991 18.490 1.00 21.03 C ATOM 1008 CG ASN A 479 -28.929 21.655 19.550 1.00 25.89 C ATOM 1009 OD1 ASN A 479 -28.072 20.805 19.350 1.00 26.80 O ATOM 1010 ND2 ASN A 479 -28.985 22.347 20.677 1.00 26.62 N ATOM 1011 HA ASN A 479 -30.688 23.760 19.524 1.00 0.00 H ATOM 1012 HB2 ASN A 479 -30.440 21.061 18.127 1.00 0.00 H ATOM 1013 HB3 ASN A 479 -29.526 22.514 17.661 1.00 0.00 H ATOM 1014 HD22 ASN A 479 -29.728 23.062 20.812 1.00 0.00 H ATOM 1015 HD21 ASN A 479 -28.286 22.176 21.428 1.00 0.00 H ATOM 1016 H ASN A 479 -31.580 21.142 20.252 1.00 0.00 H ATOM 1017 N GLU A 480 -33.172 22.790 17.712 1.00 19.38 N ATOM 1018 CA GLU A 480 -34.127 23.243 16.699 1.00 19.80 C ATOM 1019 C GLU A 480 -35.004 24.426 17.129 1.00 18.67 C ATOM 1020 O GLU A 480 -35.449 25.199 16.301 1.00 17.14 O ATOM 1021 CB GLU A 480 -35.063 22.096 16.304 1.00 22.94 C ATOM 1022 CG GLU A 480 -34.557 21.188 15.206 1.00 29.20 C ATOM 1023 CD GLU A 480 -35.585 20.140 14.817 1.00 32.30 C ATOM 1024 OE1 GLU A 480 -35.719 19.132 15.545 1.00 34.12 O ATOM 1025 OE2 GLU A 480 -36.272 20.333 13.790 1.00 33.75 O ATOM 1026 HA GLU A 480 -33.509 23.578 15.866 1.00 0.00 H ATOM 1027 HB2 GLU A 480 -35.238 21.486 17.190 1.00 0.00 H ATOM 1028 HB3 GLU A 480 -36.006 22.531 15.972 1.00 0.00 H ATOM 1029 HG2 GLU A 480 -34.321 21.792 14.330 1.00 0.00 H ATOM 1030 HG3 GLU A 480 -33.655 20.685 15.553 1.00 0.00 H ATOM 1031 H GLU A 480 -33.385 21.931 18.258 1.00 0.00 H ATOM 1032 N HIS A 481 -35.248 24.557 18.428 1.00 16.84 N ATOM 1033 CA HIS A 481 -36.128 25.611 18.935 1.00 16.60 C ATOM 1034 C HIS A 481 -35.472 26.665 19.819 1.00 18.48 C ATOM 1035 O HIS A 481 -36.089 27.653 20.168 1.00 17.69 O ATOM 1036 CB HIS A 481 -37.266 24.963 19.730 1.00 15.59 C ATOM 1037 CG HIS A 481 -38.140 24.063 18.921 1.00 15.12 C ATOM 1038 ND1 HIS A 481 -38.551 22.825 19.356 1.00 16.32 N ATOM 1039 CD2 HIS A 481 -38.703 24.231 17.692 1.00 15.82 C ATOM 1040 CE1 HIS A 481 -39.324 22.263 18.441 1.00 17.11 C ATOM 1041 NE2 HIS A 481 -39.429 23.104 17.424 1.00 17.64 N ATOM 1042 HA HIS A 481 -36.469 26.144 18.047 1.00 0.00 H ATOM 1043 HB2 HIS A 481 -36.829 24.379 20.540 1.00 0.00 H ATOM 1044 HB3 HIS A 481 -37.886 25.756 20.149 1.00 0.00 H ATOM 1045 HD2 HIS A 481 -38.595 25.101 17.044 1.00 0.00 H ATOM 1046 HE1 HIS A 481 -39.792 21.281 18.512 1.00 0.00 H ATOM 1047 H HIS A 481 -34.805 23.897 19.099 1.00 0.00 H ATOM 1048 N VAL A 482 -34.217 26.443 20.176 1.00 19.31 N ATOM 1049 CA VAL A 482 -33.512 27.349 21.066 1.00 21.37 C ATOM 1050 C VAL A 482 -33.410 28.817 20.631 1.00 23.51 C ATOM 1051 O VAL A 482 -33.385 29.691 21.471 1.00 24.42 O ATOM 1052 CB VAL A 482 -32.106 26.781 21.383 1.00 20.47 C ATOM 1053 CG1 VAL A 482 -31.193 26.930 20.185 1.00 19.05 C ATOM 1054 CG2 VAL A 482 -31.540 27.447 22.614 1.00 20.47 C ATOM 1055 HA VAL A 482 -34.141 27.392 21.955 1.00 0.00 H ATOM 1056 HB VAL A 482 -32.189 25.715 21.596 1.00 0.00 H ATOM 1057 HG11 VAL A 482 -31.614 26.386 19.339 1.00 0.00 H ATOM 1058 HG12 VAL A 482 -31.100 27.986 19.930 1.00 0.00 H ATOM 1059 HG13 VAL A 482 -30.210 26.526 20.426 1.00 0.00 H ATOM 1060 HG21 VAL A 482 -31.461 28.520 22.441 1.00 0.00 H ATOM 1061 HG22 VAL A 482 -32.200 27.262 23.462 1.00 0.00 H ATOM 1062 HG23 VAL A 482 -30.552 27.038 22.825 1.00 0.00 H ATOM 1063 H VAL A 482 -33.725 25.602 19.812 1.00 0.00 H ATOM 1064 N GLN A 483 -33.374 29.089 19.329 1.00 26.04 N ATOM 1065 CA GLN A 483 -33.264 30.475 18.860 1.00 30.01 C ATOM 1066 C GLN A 483 -34.604 31.175 18.732 1.00 30.86 C ATOM 1067 O GLN A 483 -34.652 32.365 18.480 1.00 31.67 O ATOM 1068 CB GLN A 483 -32.600 30.547 17.492 1.00 32.60 C ATOM 1069 CG GLN A 483 -31.273 29.861 17.371 1.00 37.41 C ATOM 1070 CD GLN A 483 -31.042 29.403 15.952 1.00 41.21 C ATOM 1071 OE1 GLN A 483 -31.088 28.220 15.661 1.00 43.68 O ATOM 1072 NE2 GLN A 483 -30.823 30.356 15.053 1.00 42.51 N ATOM 1073 HA GLN A 483 -32.665 30.975 19.621 1.00 0.00 H ATOM 1074 HB2 GLN A 483 -33.277 30.095 16.768 1.00 0.00 H ATOM 1075 HB3 GLN A 483 -32.456 31.599 17.245 1.00 0.00 H ATOM 1076 HG2 GLN A 483 -30.483 30.555 17.657 1.00 0.00 H ATOM 1077 HG3 GLN A 483 -31.254 28.997 18.035 1.00 0.00 H ATOM 1078 HE22 GLN A 483 -30.792 31.353 15.349 1.00 0.00 H ATOM 1079 HE21 GLN A 483 -30.682 30.106 14.053 1.00 0.00 H ATOM 1080 H GLN A 483 -33.424 28.313 18.638 1.00 0.00 H ATOM 1081 N ILE A 484 -35.689 30.429 18.878 1.00 31.07 N ATOM 1082 CA ILE A 484 -37.007 31.026 18.755 1.00 32.46 C ATOM 1083 C ILE A 484 -37.245 31.986 19.908 1.00 33.35 C ATOM 1084 O ILE A 484 -37.025 31.659 21.063 1.00 30.99 O ATOM 1085 CB ILE A 484 -38.104 29.950 18.714 1.00 33.71 C ATOM 1086 CG1 ILE A 484 -37.835 29.001 17.539 1.00 33.99 C ATOM 1087 CG2 ILE A 484 -39.472 30.602 18.559 1.00 33.68 C ATOM 1088 CD1 ILE A 484 -38.839 27.881 17.391 1.00 34.96 C ATOM 1089 HA ILE A 484 -37.050 31.577 17.815 1.00 0.00 H ATOM 1090 HB ILE A 484 -38.094 29.385 19.646 1.00 0.00 H ATOM 1091 HG12 ILE A 484 -37.841 29.587 16.620 1.00 0.00 H ATOM 1092 HG13 ILE A 484 -36.849 28.558 17.679 1.00 0.00 H ATOM 1093 HD11 ILE A 484 -38.839 27.273 18.295 1.00 0.00 H ATOM 1094 HD12 ILE A 484 -39.832 28.303 17.236 1.00 0.00 H ATOM 1095 HD13 ILE A 484 -38.568 27.262 16.535 1.00 0.00 H ATOM 1096 HG21 ILE A 484 -39.654 31.267 19.403 1.00 0.00 H ATOM 1097 HG22 ILE A 484 -39.497 31.175 17.632 1.00 0.00 H ATOM 1098 HG23 ILE A 484 -40.240 29.829 18.531 1.00 0.00 H ATOM 1099 H ILE A 484 -35.597 29.413 19.081 1.00 0.00 H ATOM 1100 N ALA A 485 -37.689 33.187 19.567 1.00 34.75 N ATOM 1101 CA ALA A 485 -37.927 34.191 20.573 1.00 37.15 C ATOM 1102 C ALA A 485 -38.791 33.697 21.701 1.00 38.85 C ATOM 1103 O ALA A 485 -39.901 33.221 21.487 1.00 37.24 O ATOM 1104 CB ALA A 485 -38.575 35.432 19.954 1.00 37.71 C ATOM 1105 HA ALA A 485 -36.950 34.442 20.987 1.00 0.00 H ATOM 1106 HB1 ALA A 485 -37.913 35.844 19.193 1.00 0.00 H ATOM 1107 HB2 ALA A 485 -39.526 35.155 19.499 1.00 0.00 H ATOM 1108 HB3 ALA A 485 -38.746 36.177 20.731 1.00 0.00 H ATOM 1109 H ALA A 485 -37.867 33.407 18.566 1.00 0.00 H ATOM 1110 N ARG A 486 -38.243 33.729 22.908 1.00 41.29 N ATOM 1111 CA ARG A 486 -39.128 33.419 23.978 1.00 44.63 C ATOM 1112 C ARG A 486 -39.384 34.462 24.967 1.00 47.09 C ATOM 1113 O ARG A 486 -38.571 35.226 25.510 1.00 47.93 O ATOM 1114 CB ARG A 486 -38.957 32.086 24.667 1.00 43.84 C ATOM 1115 CG ARG A 486 -37.644 31.630 24.757 1.00 44.50 C ATOM 1116 CD ARG A 486 -37.660 30.398 25.560 1.00 43.66 C ATOM 1117 NE ARG A 486 -36.296 29.945 25.522 1.00 44.71 N ATOM 1118 CZ ARG A 486 -35.347 30.420 26.312 1.00 43.56 C ATOM 1119 NH1 ARG A 486 -35.624 31.344 27.227 1.00 42.63 N ATOM 1120 NH2 ARG A 486 -34.104 30.017 26.135 1.00 44.18 N ATOM 1121 HA ARG A 486 -40.026 33.339 23.366 1.00 0.00 H ATOM 1122 HB2 ARG A 486 -39.354 32.175 25.678 1.00 0.00 H ATOM 1123 HB3 ARG A 486 -39.535 31.344 24.116 1.00 0.00 H ATOM 1124 HG2 ARG A 486 -37.253 31.421 23.761 1.00 0.00 H ATOM 1125 HG3 ARG A 486 -37.020 32.382 25.240 1.00 0.00 H ATOM 1126 HD2 ARG A 486 -38.328 29.657 25.121 1.00 0.00 H ATOM 1127 HD3 ARG A 486 -37.972 30.605 26.584 1.00 0.00 H ATOM 1128 HE ARG A 486 -36.042 29.205 24.837 1.00 0.00 H ATOM 1129 HH12 ARG A 486 -34.869 31.709 27.842 1.00 0.00 H ATOM 1130 HH11 ARG A 486 -36.595 31.701 27.328 1.00 0.00 H ATOM 1131 HH22 ARG A 486 -33.347 30.381 26.748 1.00 0.00 H ATOM 1132 HH21 ARG A 486 -33.881 29.335 25.382 1.00 0.00 H ATOM 1133 H ARG A 486 -37.241 33.963 23.061 1.00 0.00 H ATOM 1134 N ALA A 487 -40.688 34.450 24.933 1.00 49.41 N ATOM 1135 CA ALA A 487 -41.759 35.149 25.512 1.00 51.09 C ATOM 1136 C ALA A 487 -41.889 36.007 26.730 1.00 51.96 C ATOM 1137 O ALA A 487 -41.174 35.941 27.753 1.00 52.23 O ATOM 1138 CB ALA A 487 -42.901 34.175 25.482 1.00 50.93 C ATOM 1139 HA ALA A 487 -41.626 36.049 24.912 1.00 0.00 H ATOM 1140 OXT ALA A 487 -42.867 36.757 26.573 1.00 53.81 O ATOM 1141 HB1 ALA A 487 -43.109 33.892 24.450 1.00 0.00 H ATOM 1142 HB2 ALA A 487 -42.635 33.288 26.056 1.00 0.00 H ATOM 1143 HB3 ALA A 487 -43.785 34.640 25.918 1.00 0.00 H ATOM 1144 H ALA A 487 -41.034 33.708 24.292 1.00 0.00 H TER 1145 ALA A 487 HETATM 1146 ZN ZN A 1 -32.546 11.333 18.989 1.00 9.76 ZN HETATM 1147 ZN ZN A 2 -37.529 21.518 20.847 1.00 11.15 ZN HETATM 1148 O HOH 3 -44.292 15.030 23.060 1.00 44.43 O HETATM 1149 O HOH 4 -40.707 10.338 24.009 1.00 22.96 O HETATM 1150 O HOH 5 -38.752 5.764 31.791 1.00 24.33 O HETATM 1151 O HOH 6 -40.467 4.331 21.923 1.00 21.40 O HETATM 1152 O HOH 7 -38.335 5.860 15.671 1.00 30.00 O HETATM 1153 O HOH 8 -37.924 -0.614 24.851 1.00 33.06 O HETATM 1154 O HOH 9 -35.102 5.995 18.125 1.00 28.33 O HETATM 1155 O HOH 10 -40.727 9.210 16.040 1.00 32.02 O HETATM 1156 O HOH 11 -37.867 17.462 16.839 1.00 37.43 O HETATM 1157 O HOH 12 -32.811 14.305 7.758 1.00 40.39 O HETATM 1158 O HOH 13 -28.820 14.668 16.230 1.00 19.48 O HETATM 1159 O HOH 14 -31.592 17.915 14.342 1.00 33.83 O HETATM 1160 O HOH 15 -32.281 10.678 11.585 1.00 30.58 O HETATM 1161 O HOH 16 -32.593 7.299 13.987 1.00 29.43 O HETATM 1162 O HOH 17 -28.171 8.847 11.654 1.00 24.03 O HETATM 1163 O HOH 18 -26.531 13.132 16.730 1.00 27.05 O HETATM 1164 O HOH 19 -28.352 4.406 17.816 1.00 7.75 O HETATM 1165 O HOH 20 -24.460 9.587 17.255 1.00 37.27 O HETATM 1166 O HOH 21 -35.573 3.520 17.118 1.00 19.73 O HETATM 1167 O HOH 22 -29.550 -4.606 13.991 1.00 42.18 O HETATM 1168 O HOH 23 -24.392 2.955 18.173 1.00 40.95 O HETATM 1169 O HOH 24 -26.214 3.694 13.545 1.00 44.84 O HETATM 1170 O HOH 25 -24.982 5.846 21.838 1.00 14.36 O HETATM 1171 O HOH 26 -20.838 1.817 26.124 1.00 14.21 O HETATM 1172 O HOH 27 -21.277 4.343 30.074 1.00 31.33 O HETATM 1173 O HOH 28 -24.728 3.075 34.107 1.00 29.53 O HETATM 1174 O HOH 29 -27.677 7.956 24.187 1.00 14.81 O HETATM 1175 O HOH 30 -22.779 1.385 30.408 1.00 15.52 O HETATM 1176 O HOH 31 -31.139 0.737 31.822 1.00 19.39 O HETATM 1177 O HOH 32 -33.937 -1.122 26.924 1.00 31.17 O HETATM 1178 O HOH 33 -32.119 -2.178 32.771 1.00 43.10 O HETATM 1179 O HOH 34 -30.053 3.587 30.464 1.00 11.75 O HETATM 1180 O HOH 35 -29.163 10.240 24.588 1.00 8.04 O HETATM 1181 O HOH 36 -44.966 16.006 25.243 1.00 31.16 O HETATM 1182 O HOH 37 -36.983 21.759 29.709 1.00 8.97 O HETATM 1183 O HOH 38 -43.294 26.182 16.792 1.00 44.19 O HETATM 1184 O HOH 39 -39.748 28.544 22.803 1.00 25.56 O HETATM 1185 O HOH 40 -41.939 28.252 24.138 1.00 42.78 O HETATM 1186 O HOH 41 -51.855 20.385 23.617 1.00 14.34 O HETATM 1187 O HOH 42 -46.839 23.172 20.995 1.00 36.48 O HETATM 1188 O HOH 43 -47.573 25.310 25.424 1.00 35.83 O HETATM 1189 O HOH 44 -41.923 19.796 18.744 1.00 35.07 O HETATM 1190 O HOH 45 -38.722 14.834 19.782 1.00 12.73 O HETATM 1191 O HOH 46 -42.119 13.787 22.953 1.00 24.21 O HETATM 1192 O HOH 47 -43.953 13.162 29.150 1.00 44.12 O HETATM 1193 O HOH 48 -24.635 13.445 18.496 1.00 36.83 O HETATM 1194 O HOH 49 -22.999 11.025 18.810 1.00 22.67 O HETATM 1195 O HOH 50 -17.423 17.846 29.625 1.00 35.94 O HETATM 1196 O HOH 51 -18.929 15.943 30.883 1.00 11.15 O HETATM 1197 O HOH 52 -20.764 22.034 30.725 1.00 18.74 O HETATM 1198 O HOH 53 -20.489 18.188 37.733 1.00 22.70 O HETATM 1199 O HOH 54 -20.854 22.632 33.543 1.00 18.82 O HETATM 1200 O HOH 55 -31.446 22.617 35.591 1.00 25.01 O HETATM 1201 O HOH 56 -25.408 20.198 39.825 1.00 26.56 O HETATM 1202 O HOH 57 -30.125 19.939 43.159 1.00 33.13 O HETATM 1203 O HOH 58 -34.886 18.841 38.534 1.00 39.45 O HETATM 1204 O HOH 59 -37.002 28.189 38.439 1.00 30.75 O HETATM 1205 O HOH 60 -31.647 25.069 38.990 1.00 23.59 O HETATM 1206 O HOH 61 -34.595 28.069 37.434 1.00 42.80 O HETATM 1207 O HOH 62 -29.044 29.709 34.648 1.00 36.12 O HETATM 1208 O HOH 63 -42.524 25.994 34.597 1.00 37.00 O HETATM 1209 O HOH 64 -35.506 28.236 32.814 1.00 22.64 O HETATM 1210 O HOH 65 -38.619 23.430 35.668 1.00 26.58 O HETATM 1211 O HOH 66 -31.453 25.439 26.445 1.00 9.72 O HETATM 1212 O HOH 67 -40.901 27.778 27.069 1.00 31.83 O HETATM 1213 O HOH 68 -38.872 2.147 31.646 1.00 41.51 O HETATM 1214 O HOH 69 -42.893 10.150 25.450 1.00 37.84 O HETATM 1215 O HOH 70 -28.135 24.470 20.826 1.00 28.72 O HETATM 1216 O HOH 71 -29.822 23.387 22.791 1.00 16.06 O HETATM 1217 O HOH 72 -39.949 0.602 18.949 1.00 41.45 O HETATM 1218 O HOH 73 -35.191 18.683 17.945 1.00 40.79 O HETATM 1219 O HOH 74 -37.051 25.649 13.495 1.00 51.33 O HETATM 1220 O HOH 75 -31.436 19.880 12.267 1.00 36.19 O HETATM 1221 O HOH 76 -41.709 22.743 15.574 1.00 42.20 O HETATM 1222 O HOH 77 -24.605 6.991 17.794 1.00 29.48 O HETATM 1223 O HOH 78 -25.012 5.901 15.189 1.00 49.48 O HETATM 1224 O HOH 79 -29.549 26.390 17.091 1.00 45.20 O HETATM 1225 O HOH 80 -36.762 29.270 22.421 1.00 23.83 O HETATM 1226 O HOH 81 -41.637 30.766 21.945 1.00 34.55 O HETATM 1227 O HOH 82 -38.346 33.856 16.990 1.00 43.54 O HETATM 1228 O HOH 83 -32.849 29.485 24.030 1.00 40.97 O HETATM 1229 O HOH 84 -36.839 20.624 36.086 1.00 15.64 O HETATM 1230 O HOH 85 -34.520 15.826 35.763 1.00 21.82 O HETATM 1231 O HOH 86 -42.811 16.516 30.344 1.00 23.96 O HETATM 1232 O HOH 87 -38.648 11.043 33.989 1.00 39.37 O HETATM 1233 O HOH 88 -35.254 12.022 36.443 1.00 49.57 O HETATM 1234 O HOH 89 -37.030 14.561 35.547 1.00 22.93 O HETATM 1235 O HOH 90 -35.318 7.702 34.015 1.00 16.92 O HETATM 1236 O HOH 91 -32.230 12.291 37.557 1.00 38.31 O HETATM 1237 O HOH 92 -33.141 9.271 35.636 1.00 22.66 O HETATM 1238 O HOH 93 -29.787 6.396 34.859 1.00 21.18 O HETATM 1239 O HOH 94 -21.921 -0.292 48.272 1.00 42.82 O HETATM 1240 O HOH 95 -33.347 6.582 36.204 1.00 43.63 O HETATM 1241 N ALA A 96 -34.558 20.942 34.505 1.00 0.24 N HETATM 1242 CA ALA A 96 -35.238 20.335 33.321 1.00 0.06 C HETATM 1243 C ALA A 96 -35.566 18.866 33.567 1.00 0.23 C HETATM 1244 O ALA A 96 -34.837 18.167 34.261 1.00 -0.39 O HETATM 1245 N ALA A 96 -36.681 18.413 32.999 1.00 -0.26 N HETATM 1246 CA ALA A 96 -37.097 17.018 33.140 1.00 0.13 C HETATM 1247 CB ALA A 96 -38.546 16.843 32.699 1.00 -0.01 C HETATM 1248 CG ALA A 96 -39.470 17.704 33.539 1.00 -0.02 C HETATM 1249 CD ALA A 96 -40.904 17.518 33.103 1.00 0.06 C HETATM 1250 NE ALA A 96 -41.802 18.174 34.082 1.00 -0.27 N HETATM 1251 CZ ALA A 96 -43.106 18.435 33.877 1.00 0.29 C HETATM 1252 NH2 ALA A 96 -43.814 19.021 34.814 1.00 -0.27 N HETATM 1253 CAA ALA A 96 -45.234 19.322 34.634 1.00 0.05 C HETATM 1254 H8 ALA A 96 -45.623 19.810 35.540 1.00 0.07 H HETATM 1255 H9 ALA A 96 -45.787 18.388 34.454 1.00 0.07 H HETATM 1256 H10 ALA A 96 -45.360 19.994 33.773 1.00 0.07 H HETATM 1257 H11 ALA A 96 -43.357 19.276 35.701 1.00 0.26 H HETATM 1258 NH1 ALA A 96 -43.667 18.086 32.706 1.00 -0.28 N HETATM 1259 H12 ALA A 96 -43.099 17.627 31.980 1.00 0.26 H HETATM 1260 H13 ALA A 96 -44.664 18.278 32.535 1.00 0.26 H HETATM 1261 H14 ALA A 96 -41.398 18.451 34.988 1.00 0.26 H HETATM 1262 H15 ALA A 96 -41.048 17.971 32.111 1.00 0.07 H HETATM 1263 H16 ALA A 96 -41.137 16.444 33.053 1.00 0.07 H HETATM 1264 H17 ALA A 96 -39.372 17.416 34.596 1.00 0.03 H HETATM 1265 H18 ALA A 96 -39.189 18.761 33.419 1.00 0.03 H HETATM 1266 H19 ALA A 96 -38.640 17.136 31.643 1.00 0.03 H HETATM 1267 H20 ALA A 96 -38.833 15.787 32.813 1.00 0.03 H HETATM 1268 C ALA A 96 -36.196 16.140 32.287 1.00 0.20 C HETATM 1269 O ALA A 96 -35.911 16.465 31.146 1.00 -0.39 O HETATM 1270 N ALA A 96 -35.758 15.019 32.854 1.00 -0.26 N HETATM 1271 CA ALA A 96 -34.875 14.107 32.134 1.00 0.16 C HETATM 1272 C ALA A 96 -35.207 12.645 32.406 1.00 0.21 C HETATM 1273 O ALA A 96 -36.005 12.335 33.274 1.00 -0.39 O HETATM 1274 N ALA A 96 -34.557 11.765 31.647 1.00 -0.26 N HETATM 1275 CA ALA A 96 -34.703 10.318 31.780 1.00 0.13 C HETATM 1276 CB ALA A 96 -35.546 9.739 30.640 1.00 -0.01 C HETATM 1277 CG ALA A 96 -36.994 10.180 30.629 1.00 -0.04 C HETATM 1278 CD ALA A 96 -37.749 9.507 29.498 1.00 -0.01 C HETATM 1279 CE ALA A 96 -39.210 9.957 29.455 1.00 -0.03 C HETATM 1280 NZ ALA A 96 -40.029 9.331 28.358 1.00 0.24 N HETATM 1281 CM1 ALA A 96 -40.108 7.841 28.557 1.00 -0.04 C HETATM 1282 H40 ALA A 96 -40.708 7.395 27.750 1.00 0.08 H HETATM 1283 H41 ALA A 96 -40.579 7.625 29.527 1.00 0.08 H HETATM 1284 H42 ALA A 96 -39.094 7.414 28.539 1.00 0.08 H HETATM 1285 CM2 ALA A 96 -41.406 9.923 28.488 1.00 -0.04 C HETATM 1286 H43 ALA A 96 -41.352 11.012 28.343 1.00 0.08 H HETATM 1287 H44 ALA A 96 -41.806 9.706 29.490 1.00 0.08 H HETATM 1288 H45 ALA A 96 -42.067 9.484 27.726 1.00 0.08 H HETATM 1289 CM3 ALA A 96 -39.479 9.612 26.990 1.00 -0.04 C HETATM 1290 H46 ALA A 96 -38.473 9.176 26.903 1.00 0.08 H HETATM 1291 H47 ALA A 96 -39.422 10.699 26.834 1.00 0.08 H HETATM 1292 H48 ALA A 96 -40.139 9.166 26.231 1.00 0.08 H HETATM 1293 H38 ALA A 96 -39.228 11.048 29.316 1.00 0.08 H HETATM 1294 H39 ALA A 96 -39.676 9.702 30.418 1.00 0.08 H HETATM 1295 H36 ALA A 96 -37.715 8.417 29.644 1.00 0.03 H HETATM 1296 H37 ALA A 96 -37.267 9.765 28.543 1.00 0.03 H HETATM 1297 H34 ALA A 96 -37.039 11.271 30.494 1.00 0.03 H HETATM 1298 H35 ALA A 96 -37.462 9.909 31.587 1.00 0.03 H HETATM 1299 H32 ALA A 96 -35.524 8.642 30.722 1.00 0.03 H HETATM 1300 H33 ALA A 96 -35.089 10.045 29.688 1.00 0.03 H HETATM 1301 C ALA A 96 -33.319 9.678 31.732 1.00 0.20 C HETATM 1302 O ALA A 96 -32.458 10.115 30.988 1.00 -0.39 O HETATM 1303 N ALA A 96 -33.130 8.632 32.531 1.00 -0.26 N HETATM 1304 CA ALA A 96 -31.865 7.902 32.594 1.00 0.13 C HETATM 1305 C ALA A 96 -30.679 8.786 32.954 1.00 0.20 C HETATM 1306 O ALA A 96 -29.619 8.659 32.373 1.00 -0.39 O HETATM 1307 N ALA A 96 -30.867 9.693 33.904 1.00 -0.26 N HETATM 1308 CA ALA A 96 -29.774 10.563 34.324 1.00 0.16 C HETATM 1309 C ALA A 96 -29.397 10.241 35.759 1.00 0.21 C HETATM 1310 O ALA A 96 -28.608 10.932 36.370 1.00 -0.39 O HETATM 1311 N ALA A 96 -29.985 9.173 36.285 1.00 -0.26 N HETATM 1312 CA ALA A 96 -29.694 8.751 37.640 1.00 0.13 C HETATM 1313 C ALA A 96 -28.502 7.812 37.624 1.00 0.20 C HETATM 1314 O ALA A 96 -28.420 6.877 36.849 1.00 -0.39 O HETATM 1315 N ALA A 96 -27.580 8.113 38.516 1.00 -0.26 N HETATM 1316 CA ALA A 96 -26.341 7.391 38.709 1.00 0.13 C HETATM 1317 C ALA A 96 -26.668 5.976 39.276 1.00 0.20 C HETATM 1318 O ALA A 96 -27.318 5.875 40.299 1.00 -0.39 O HETATM 1319 N ALA A 96 -26.248 4.896 38.593 1.00 -0.26 N HETATM 1320 CA ALA A 96 -26.532 3.512 39.050 1.00 0.13 C HETATM 1321 C ALA A 96 -25.651 3.052 40.210 1.00 0.20 C HETATM 1322 O ALA A 96 -24.459 3.296 40.232 1.00 -0.39 O HETATM 1323 N ALA A 96 -26.265 2.350 41.156 1.00 -0.26 N HETATM 1324 CA ALA A 96 -25.572 1.871 42.349 1.00 0.13 C HETATM 1325 C ALA A 96 -24.521 0.776 42.196 1.00 0.20 C HETATM 1326 O ALA A 96 -24.746 -0.261 41.614 1.00 -0.39 O HETATM 1327 N ALA A 96 -23.375 1.072 42.782 1.00 -0.26 N HETATM 1328 CA ALA A 96 -22.209 0.232 42.859 1.00 0.13 C HETATM 1329 C ALA A 96 -21.026 1.152 42.897 1.00 0.20 C HETATM 1330 O ALA A 96 -20.344 1.480 41.907 1.00 -0.39 O HETATM 1331 N ALA A 96 -20.964 1.615 44.131 1.00 -0.27 N HETATM 1332 CA ALA A 96 -20.029 2.526 44.695 1.00 0.08 C HETATM 1333 C ALA A 96 -20.372 2.197 46.147 1.00 0.06 C HETATM 1334 O ALA A 96 -21.559 1.886 46.431 1.00 -0.57 O HETATM 1335 OXT ALA A 96 -19.474 2.250 47.019 1.00 -0.57 O HETATM 1336 H106 ALA A 96 -20.240 3.573 44.432 1.00 0.07 H HETATM 1337 H107 ALA A 96 -18.987 2.285 44.436 1.00 0.07 H HETATM 1338 H105 ALA A 96 -21.671 1.280 44.754 1.00 0.19 H HETATM 1339 CB ALA A 96 -22.129 -0.748 41.744 1.00 -0.02 C HETATM 1340 H102 ALA A 96 -21.221 -1.359 41.857 1.00 0.03 H HETATM 1341 H103 ALA A 96 -22.092 -0.210 40.785 1.00 0.03 H HETATM 1342 H104 ALA A 96 -23.014 -1.400 41.765 1.00 0.03 H HETATM 1343 H101 ALA A 96 -22.246 -0.338 43.799 1.00 0.08 H HETATM 1344 H100 ALA A 96 -23.311 1.971 43.216 1.00 0.19 H HETATM 1345 CB ALA A 96 -26.591 1.433 43.398 1.00 -0.02 C HETATM 1346 H97 ALA A 96 -26.064 1.073 44.294 1.00 0.03 H HETATM 1347 H98 ALA A 96 -27.213 0.623 42.989 1.00 0.03 H HETATM 1348 H99 ALA A 96 -27.230 2.287 43.667 1.00 0.03 H HETATM 1349 H96 ALA A 96 -25.037 2.744 42.751 1.00 0.08 H HETATM 1350 H95 ALA A 96 -27.237 2.142 41.047 1.00 0.19 H HETATM 1351 CB ALA A 96 -26.416 2.487 37.890 1.00 -0.01 C HETATM 1352 CG ALA A 96 -26.338 0.992 38.341 1.00 -0.04 C HETATM 1353 CD ALA A 96 -26.486 -0.043 37.190 1.00 -0.01 C HETATM 1354 CE ALA A 96 -26.164 -1.476 37.674 1.00 -0.04 C HETATM 1355 NZ ALA A 96 -26.713 -2.595 36.837 1.00 0.22 N HETATM 1356 H92 ALA A 96 -26.445 -3.479 37.241 1.00 0.20 H HETATM 1357 H93 ALA A 96 -26.344 -2.527 35.901 1.00 0.20 H HETATM 1358 H94 ALA A 96 -27.718 -2.530 36.807 1.00 0.20 H HETATM 1359 H90 ALA A 96 -26.570 -1.587 38.691 1.00 0.08 H HETATM 1360 H91 ALA A 96 -25.070 -1.583 37.702 1.00 0.08 H HETATM 1361 H88 ALA A 96 -25.794 0.224 36.377 1.00 0.03 H HETATM 1362 H89 ALA A 96 -27.520 -0.016 36.815 1.00 0.03 H HETATM 1363 H86 ALA A 96 -27.142 0.811 39.069 1.00 0.03 H HETATM 1364 H87 ALA A 96 -25.363 0.830 38.824 1.00 0.03 H HETATM 1365 H84 ALA A 96 -25.506 2.720 37.318 1.00 0.03 H HETATM 1366 H85 ALA A 96 -27.297 2.603 37.241 1.00 0.03 H HETATM 1367 H83 ALA A 96 -27.573 3.501 39.404 1.00 0.08 H HETATM 1368 H82 ALA A 96 -25.727 5.029 37.750 1.00 0.19 H HETATM 1369 CB ALA A 96 -25.523 8.277 39.664 1.00 -0.01 C HETATM 1370 CG ALA A 96 -26.188 9.716 39.885 1.00 -0.02 C HETATM 1371 CD ALA A 96 -25.904 10.777 38.759 1.00 0.06 C HETATM 1372 NE ALA A 96 -27.062 11.578 38.301 1.00 -0.27 N HETATM 1373 CZ ALA A 96 -27.479 12.741 38.816 1.00 0.29 C HETATM 1374 NH1 ALA A 96 -26.850 13.298 39.842 1.00 -0.28 N HETATM 1375 H78 ALA A 96 -27.184 14.193 40.226 1.00 0.26 H HETATM 1376 H79 ALA A 96 -26.027 12.835 40.255 1.00 0.26 H HETATM 1377 NH2 ALA A 96 -28.528 13.365 38.283 1.00 -0.28 N HETATM 1378 H80 ALA A 96 -29.027 12.945 37.486 1.00 0.26 H HETATM 1379 H81 ALA A 96 -28.840 14.268 38.668 1.00 0.26 H HETATM 1380 H77 ALA A 96 -27.600 11.203 37.507 1.00 0.26 H HETATM 1381 H75 ALA A 96 -25.503 10.240 37.887 1.00 0.07 H HETATM 1382 H76 ALA A 96 -25.145 11.475 39.141 1.00 0.07 H HETATM 1383 H73 ALA A 96 -25.809 10.121 40.835 1.00 0.03 H HETATM 1384 H74 ALA A 96 -27.277 9.579 39.953 1.00 0.03 H HETATM 1385 H71 ALA A 96 -24.516 8.415 39.242 1.00 0.03 H HETATM 1386 H72 ALA A 96 -25.447 7.770 40.637 1.00 0.03 H HETATM 1387 H70 ALA A 96 -25.803 7.277 37.757 1.00 0.08 H HETATM 1388 H69 ALA A 96 -27.750 8.902 39.106 1.00 0.19 H HETATM 1389 CB ALA A 96 -30.900 8.066 38.264 1.00 -0.02 C HETATM 1390 H66 ALA A 96 -30.655 7.755 39.290 1.00 0.03 H HETATM 1391 H67 ALA A 96 -31.169 7.182 37.668 1.00 0.03 H HETATM 1392 H68 ALA A 96 -31.749 8.765 38.285 1.00 0.03 H HETATM 1393 H65 ALA A 96 -29.443 9.637 38.242 1.00 0.08 H HETATM 1394 H64 ALA A 96 -30.639 8.652 35.737 1.00 0.19 H HETATM 1395 CB ALA A 96 -30.139 12.059 34.219 1.00 0.09 C HETATM 1396 OG1 ALA A 96 -31.430 12.280 34.791 1.00 -0.39 O HETATM 1397 H60 ALA A 96 -31.651 13.201 34.724 1.00 0.21 H HETATM 1398 CG2 ALA A 96 -30.133 12.512 32.770 1.00 -0.03 C HETATM 1399 H61 ALA A 96 -30.395 13.579 32.718 1.00 0.03 H HETATM 1400 H62 ALA A 96 -30.868 11.926 32.200 1.00 0.03 H HETATM 1401 H63 ALA A 96 -29.131 12.360 32.342 1.00 0.03 H HETATM 1402 H59 ALA A 96 -29.395 12.646 34.777 1.00 0.06 H HETATM 1403 H58 ALA A 96 -28.908 10.370 33.674 1.00 0.08 H HETATM 1404 H57 ALA A 96 -31.765 9.781 34.335 1.00 0.19 H HETATM 1405 CB ALA A 96 -31.585 7.207 31.255 1.00 0.00 C HETATM 1406 CG ALA A 96 -32.691 6.272 30.784 1.00 0.04 C HETATM 1407 CD ALA A 96 -32.982 5.169 31.779 1.00 0.17 C HETATM 1408 OE1 ALA A 96 -32.080 4.500 32.250 1.00 -0.40 O HETATM 1409 NE2 ALA A 96 -34.258 4.971 32.090 1.00 -0.30 N HETATM 1410 H55 ALA A 96 -34.508 4.255 32.742 1.00 0.18 H HETATM 1411 H56 ALA A 96 -34.968 5.537 31.672 1.00 0.18 H HETATM 1412 H53 ALA A 96 -32.385 5.816 29.831 1.00 0.05 H HETATM 1413 H54 ALA A 96 -33.608 6.860 30.631 1.00 0.05 H HETATM 1414 H51 ALA A 96 -30.661 6.620 31.360 1.00 0.03 H HETATM 1415 H52 ALA A 96 -31.442 7.983 30.489 1.00 0.03 H HETATM 1416 H50 ALA A 96 -31.962 7.132 33.373 1.00 0.08 H HETATM 1417 H49 ALA A 96 -33.885 8.332 33.114 1.00 0.19 H HETATM 1418 H31 ALA A 96 -35.186 10.089 32.742 1.00 0.08 H HETATM 1419 H30 ALA A 96 -33.934 12.114 30.947 1.00 0.19 H HETATM 1420 CB ALA A 96 -33.403 14.316 32.550 1.00 0.09 C HETATM 1421 OG1 ALA A 96 -33.263 14.008 33.944 1.00 -0.39 O HETATM 1422 H26 ALA A 96 -33.825 14.582 34.452 1.00 0.21 H HETATM 1423 CG2 ALA A 96 -32.962 15.755 32.307 1.00 -0.03 C HETATM 1424 H27 ALA A 96 -31.912 15.873 32.612 1.00 0.03 H HETATM 1425 H28 ALA A 96 -33.594 16.436 32.896 1.00 0.03 H HETATM 1426 H29 ALA A 96 -33.062 15.994 31.238 1.00 0.03 H HETATM 1427 H25 ALA A 96 -32.764 13.642 31.961 1.00 0.06 H HETATM 1428 H24 ALA A 96 -34.980 14.305 31.057 1.00 0.08 H HETATM 1429 H23 ALA A 96 -36.038 14.798 33.788 1.00 0.19 H HETATM 1430 H21 ALA A 96 -37.004 16.719 34.194 1.00 0.08 H HETATM 1431 H22 ALA A 96 -37.247 19.040 32.464 1.00 0.19 H HETATM 1432 CB ALA A 96 -34.348 20.470 32.081 1.00 -0.00 C HETATM 1433 H5 ALA A 96 -34.856 20.021 31.215 1.00 0.03 H HETATM 1434 H6 ALA A 96 -33.394 19.951 32.256 1.00 0.03 H HETATM 1435 H7 ALA A 96 -34.156 21.535 31.882 1.00 0.03 H HETATM 1436 H4 ALA A 96 -36.178 20.878 33.142 1.00 0.11 H HETATM 1437 H1 ALA A 96 -34.353 21.911 34.315 1.00 0.20 H HETATM 1438 H2 ALA A 96 -33.699 20.447 34.690 1.00 0.20 H HETATM 1439 H3 ALA A 96 -35.162 20.878 35.309 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 93 92 97 1146 CONECT 143 142 147 1146 CONECT 512 511 516 1147 CONECT 580 578 579 1147 CONECT 633 632 635 1146 CONECT 675 674 679 1146 CONECT 997 996 1001 1147 CONECT 1038 1037 1040 1147 CONECT 1146 93 143 633 675 CONECT 1147 512 580 997 1038 CONECT 1241 1242 1437 1438 1439 CONECT 1242 1241 1243 1432 1436 CONECT 1243 1242 1244 1245 CONECT 1244 1243 CONECT 1245 1243 1246 1431 CONECT 1246 1245 1247 1268 1430 CONECT 1247 1246 1248 1266 1267 CONECT 1248 1247 1249 1264 1265 CONECT 1249 1248 1250 1262 1263 CONECT 1250 1249 1251 1261 CONECT 1251 1250 1252 1258 CONECT 1252 1251 1253 1257 CONECT 1253 1252 1254 1255 1256 CONECT 1254 1253 CONECT 1255 1253 CONECT 1256 1253 CONECT 1257 1252 CONECT 1258 1251 1259 1260 CONECT 1259 1258 CONECT 1260 1258 CONECT 1261 1250 CONECT 1262 1249 CONECT 1263 1249 CONECT 1264 1248 CONECT 1265 1248 CONECT 1266 1247 CONECT 1267 1247 CONECT 1268 1246 1269 1270 CONECT 1269 1268 CONECT 1270 1268 1271 1429 CONECT 1271 1270 1272 1420 1428 CONECT 1272 1271 1273 1274 CONECT 1273 1272 CONECT 1274 1272 1275 1419 CONECT 1275 1274 1276 1301 1418 CONECT 1276 1275 1277 1299 1300 CONECT 1277 1276 1278 1297 1298 CONECT 1278 1277 1279 1295 1296 CONECT 1279 1278 1280 1293 1294 CONECT 1280 1279 1281 1285 1289 CONECT 1281 1280 1282 1283 1284 CONECT 1282 1281 CONECT 1283 1281 CONECT 1284 1281 CONECT 1285 1280 1286 1287 1288 CONECT 1286 1285 CONECT 1287 1285 CONECT 1288 1285 CONECT 1289 1280 1290 1291 1292 CONECT 1290 1289 CONECT 1291 1289 CONECT 1292 1289 CONECT 1293 1279 CONECT 1294 1279 CONECT 1295 1278 CONECT 1296 1278 CONECT 1297 1277 CONECT 1298 1277 CONECT 1299 1276 CONECT 1300 1276 CONECT 1301 1275 1302 1303 CONECT 1302 1301 CONECT 1303 1301 1304 1417 CONECT 1304 1303 1305 1405 1416 CONECT 1305 1304 1306 1307 CONECT 1306 1305 CONECT 1307 1305 1308 1404 CONECT 1308 1307 1309 1395 1403 CONECT 1309 1308 1310 1311 CONECT 1310 1309 CONECT 1311 1309 1312 1394 CONECT 1312 1311 1313 1389 1393 CONECT 1313 1312 1314 1315 CONECT 1314 1313 CONECT 1315 1313 1316 1388 CONECT 1316 1315 1317 1369 1387 CONECT 1317 1316 1318 1319 CONECT 1318 1317 CONECT 1319 1317 1320 1368 CONECT 1320 1319 1321 1351 1367 CONECT 1321 1320 1322 1323 CONECT 1322 1321 CONECT 1323 1321 1324 1350 CONECT 1324 1323 1325 1345 1349 CONECT 1325 1324 1326 1327 CONECT 1326 1325 CONECT 1327 1325 1328 1344 CONECT 1328 1327 1329 1339 1343 CONECT 1329 1328 1330 1331 CONECT 1330 1329 CONECT 1331 1329 1332 1338 CONECT 1332 1331 1333 1336 1337 CONECT 1333 1332 1334 1335 CONECT 1334 1333 CONECT 1335 1333 CONECT 1336 1332 CONECT 1337 1332 CONECT 1338 1331 CONECT 1339 1328 1340 1341 1342 CONECT 1340 1339 CONECT 1341 1339 CONECT 1342 1339 CONECT 1343 1328 CONECT 1344 1327 CONECT 1345 1324 1346 1347 1348 CONECT 1346 1345 CONECT 1347 1345 CONECT 1348 1345 CONECT 1349 1324 CONECT 1350 1323 CONECT 1351 1320 1352 1365 1366 CONECT 1352 1351 1353 1363 1364 CONECT 1353 1352 1354 1361 1362 CONECT 1354 1353 1355 1359 1360 CONECT 1355 1354 1356 1357 1358 CONECT 1356 1355 CONECT 1357 1355 CONECT 1358 1355 CONECT 1359 1354 CONECT 1360 1354 CONECT 1361 1353 CONECT 1362 1353 CONECT 1363 1352 CONECT 1364 1352 CONECT 1365 1351 CONECT 1366 1351 CONECT 1367 1320 CONECT 1368 1319 CONECT 1369 1316 1370 1385 1386 CONECT 1370 1369 1371 1383 1384 CONECT 1371 1370 1372 1381 1382 CONECT 1372 1371 1373 1380 CONECT 1373 1372 1374 1377 CONECT 1374 1373 1375 1376 CONECT 1375 1374 CONECT 1376 1374 CONECT 1377 1373 1378 1379 CONECT 1378 1377 CONECT 1379 1377 CONECT 1380 1372 CONECT 1381 1371 CONECT 1382 1371 CONECT 1383 1370 CONECT 1384 1370 CONECT 1385 1369 CONECT 1386 1369 CONECT 1387 1316 CONECT 1388 1315 CONECT 1389 1312 1390 1391 1392 CONECT 1390 1389 CONECT 1391 1389 CONECT 1392 1389 CONECT 1393 1312 CONECT 1394 1311 CONECT 1395 1308 1396 1398 1402 CONECT 1396 1395 1397 CONECT 1397 1396 CONECT 1398 1395 1399 1400 1401 CONECT 1399 1398 CONECT 1400 1398 CONECT 1401 1398 CONECT 1402 1395 CONECT 1403 1308 CONECT 1404 1307 CONECT 1405 1304 1406 1414 1415 CONECT 1406 1405 1407 1412 1413 CONECT 1407 1406 1408 1409 CONECT 1408 1407 CONECT 1409 1407 1410 1411 CONECT 1410 1409 CONECT 1411 1409 CONECT 1412 1406 CONECT 1413 1406 CONECT 1414 1405 CONECT 1415 1405 CONECT 1416 1304 CONECT 1417 1303 CONECT 1418 1275 CONECT 1419 1274 CONECT 1420 1271 1421 1423 1427 CONECT 1421 1420 1422 CONECT 1422 1421 CONECT 1423 1420 1424 1425 1426 CONECT 1424 1423 CONECT 1425 1423 CONECT 1426 1423 CONECT 1427 1420 CONECT 1428 1271 CONECT 1429 1270 CONECT 1430 1246 CONECT 1431 1245 CONECT 1432 1242 1433 1434 1435 CONECT 1433 1432 CONECT 1434 1432 CONECT 1435 1432 CONECT 1436 1242 CONECT 1437 1241 CONECT 1438 1241 CONECT 1439 1241 MASTER 0 0 0 0 0 0 0 0 1438 1 213 6 END
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12-mer
4cc7
RCSB PDB
PDBbind
12-mer
4dow
RCSB PDB
PDBbind
12-mer
4gao
RCSB PDB
PDBbind
12-mer
4gq6
RCSB PDB
PDBbind
12-mer
4gw1
RCSB PDB
PDBbind
12-mer
4gw5
RCSB PDB
PDBbind
12-mer
4hy9
RCSB PDB
PDBbind
12-mer
4j26
RCSB PDB
PDBbind
12-mer
4jfx
RCSB PDB
PDBbind
12-mer
4jfz
RCSB PDB
PDBbind
12-mer
4jg0
RCSB PDB
PDBbind
12-mer
4jg1
RCSB PDB
PDBbind
12-mer
4l58
RCSB PDB
PDBbind
12-mer
4qh7
RCSB PDB
PDBbind
12-mer
4rxz
RCSB PDB
PDBbind
12-mer
4twt
RCSB PDB
PDBbind
12-mer
4u7t
RCSB PDB
PDBbind
12-mer
4ux9
RCSB PDB
PDBbind
12-mer
4w50
RCSB PDB
PDBbind
12-mer
4wht
RCSB PDB
PDBbind
12-mer
4why
RCSB PDB
PDBbind
12-mer
4x8p
RCSB PDB
PDBbind
12-mer
4yhz
RCSB PDB
PDBbind
12-mer
4ym4
RCSB PDB
PDBbind
12-mer
4z2o
RCSB PDB
PDBbind
12-mer
4z2p
RCSB PDB
PDBbind
12-mer
4z68
RCSB PDB
PDBbind
12-mer
4znx
RCSB PDB
PDBbind
12-mer
5b56
RCSB PDB
PDBbind
12-mer
5d2a
RCSB PDB
PDBbind
12-mer
5eeq
RCSB PDB
PDBbind
12-mer
5esq
RCSB PDB
PDBbind
12-mer
5etu
RCSB PDB
PDBbind
12-mer
5euk
RCSB PDB
PDBbind
12-mer
5f88
RCSB PDB
PDBbind
12-mer
5ff6
RCSB PDB
PDBbind
12-mer
5ggp
RCSB PDB
PDBbind
12-mer
5gr9
RCSB PDB
PDBbind
12-mer
5huw
RCSB PDB
PDBbind
12-mer
5huy
RCSB PDB
PDBbind
12-mer
5hyq
RCSB PDB
PDBbind
12-mer
5i2i
RCSB PDB
PDBbind
12-mer
5icy
RCSB PDB
PDBbind
12-mer
5icz
RCSB PDB
PDBbind
12-mer
5id1
RCSB PDB
PDBbind
12-mer
5ih2
RCSB PDB
PDBbind
12-mer
5iop
RCSB PDB
PDBbind
12-mer
5ir1
RCSB PDB
PDBbind
12-mer
5itf
RCSB PDB
PDBbind
12-mer
5iv2
RCSB PDB
PDBbind
12-mer
5ivn
RCSB PDB
PDBbind
12-mer
5ivz
RCSB PDB
PDBbind
12-mer
5ixq
RCSB PDB
PDBbind
12-mer
5iyv
RCSB PDB
PDBbind
12-mer
5lgr
RCSB PDB
PDBbind
12-mer
5moc
RCSB PDB
PDBbind
12-mer
5n7x
RCSB PDB
PDBbind
12-mer
5n8j
RCSB PDB
PDBbind
12-mer
5t1k
RCSB PDB
PDBbind
12-mer
5t1l
RCSB PDB
PDBbind
12-mer
5t1m
RCSB PDB
PDBbind
12-mer
5tbn
RCSB PDB
PDBbind
12-mer
5th2
RCSB PDB
PDBbind
12-mer
5v1d
RCSB PDB
PDBbind
12-mer
5w4s
RCSB PDB
PDBbind
12-mer
5w5s
RCSB PDB
PDBbind
12-mer
5w5u
RCSB PDB
PDBbind
12-mer
5w6i
RCSB PDB
PDBbind
12-mer
5w6r
RCSB PDB
PDBbind
12-mer
5w6t
RCSB PDB
PDBbind
12-mer
5w6u
RCSB PDB
PDBbind
12-mer
5wle
RCSB PDB
PDBbind
12-mer
5wxf
RCSB PDB
PDBbind
12-mer
5wxo
RCSB PDB
PDBbind
12-mer
5xup
RCSB PDB
PDBbind
12-mer
5xwr
RCSB PDB
PDBbind
12-mer
5xxk
RCSB PDB
PDBbind
12-mer
5y1u
RCSB PDB
PDBbind
12-mer
5y59
RCSB PDB
PDBbind
12-mer
6bgg
RCSB PDB
PDBbind
12-mer
6e83
RCSB PDB
PDBbind
12-mer
6f7t
RCSB PDB
PDBbind
12-mer
6f8g
RCSB PDB
PDBbind
12-mer
6rr0
RCSB PDB
PDBbind
12-mer
6qtr
RCSB PDB
PDBbind
12-mer
6qto
RCSB PDB
PDBbind
12-mer
6pit
RCSB PDB
PDBbind
12-mer
6peu
RCSB PDB
PDBbind
12-mer
6o3x
RCSB PDB
PDBbind
12-mer
6nk0
RCSB PDB
PDBbind
12-mer
6mm5
RCSB PDB
PDBbind
12-mer
6k5t
RCSB PDB
PDBbind
12-mer
6k5r
RCSB PDB
PDBbind
12-mer
6iam
RCSB PDB
PDBbind
12-mer
6hy2
RCSB PDB
PDBbind
12-mer
6byk
RCSB PDB
PDBbind
12-mer
6bw4
RCSB PDB
PDBbind
12-mer
6bw3
RCSB PDB
PDBbind
12-mer
6a8g
RCSB PDB
PDBbind
12-mer
5zop
RCSB PDB
PDBbind
12-mer
Entry Information
PDB ID
2v85
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
RAG2-PHD
Ligand Name
12-mer
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=34.6uM
Release Year
2007
Protein/NA Sequence
Check fasta file
Primary Reference
(2007) Proc.Natl.Acad.Sci.USA Vol. 104: pp. 18993
Ligand Properties
Formula
C
5
5
H
1
0
8
N
2
1
O
1
6
Molecular Weight
1319.580
Exact Mass
1318.830
No. of atoms
200
No. of bonds
199
Polar Surface Area
614.26
LOGP Value
-6.18 (
Computed with XLOGP3
)
-6.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 16
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 57
No. of Nitrogen and Oxygen Atoms: 37
No. of Rings: 0
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCCN/C(=[NH+]/C)/N)CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N
InChI String
InChI=1S/C55H103N21O16/c1-28(57)43(82)69-37(20-16-25-64-55(61)62-7)50(89)75-42(33(6)78)53(92)73-35(18-12-14-26-76(8,9)10)48(87)72-38(21-22-39(58)79)51(90)74-41(32(5)77)52(91)68-31(4)46(85)70-36(19-15-24-63-54(59)60)49(88)71-34(17-11-13-23-56)47(86)67-30(3)45(84)66-29(2)44(83)65-27-40(80)81/h28-38,41-42,77-78H,11-27,56-57H2,1-10H3,(H20-,58,59,60,61,62,63,64,65,66,67,68,69,70,71,72,73,74,75,79,80,81,82,83,84,85,86,87,88,89,90,91,92)/p+5/t28-,29-,30-,31-,32+,33+,34-,35-,36-,37-,38-,41-,42-/m0/s1
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):
P21784
P68431
Entrez Gene ID
NCBI Entrez Gene ID:
19374
8350
8351
8352
8353
8354
8355
8356
8357
8358
8968
ASD
Information of known allosteric effects of PDB entries
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