Browse entries in the PDBbind-CN Database
HEADER 5ENE_COMPLEX COMPND 5ENE_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 123 SER MET SER TYR ASP ILE GLN ALA TRP LYS LYS GLN CYS SEQRES 2 A 123 GLU GLU LEU LEU ASN LEU ILE PHE GLN CYS GLU ASP SER SEQRES 3 A 123 GLU PRO PHE ARG GLN PRO VAL ASP LEU LEU GLU TYR PRO SEQRES 4 A 123 ASP TYR ARG ASP ILE ILE ASP THR PRO MET ASP PHE ALA SEQRES 5 A 123 THR VAL ARG GLU THR LEU GLU ALA GLY ASN TYR GLU SER SEQRES 6 A 123 PRO MET GLU LEU CYS LYS ASP VAL ARG LEU ILE PHE SER SEQRES 7 A 123 ASN SER LYS ALA TYR THR PRO SER LYS ARG SER ARG ILE SEQRES 8 A 123 TYR SER MET SER LEU ARG LEU SER ALA PHE PHE GLU GLU SEQRES 9 A 123 HIS ILE SER SER VAL LEU SER ASP TYR LYS SER ALA LEU SEQRES 10 A 123 ARG PHE HIS LYS ARG ASN HET UNN A 293 24 ATOM 1 N SER A1313 13.908 23.080 -9.782 1.00 49.06 N ATOM 2 CA SER A1313 12.822 22.934 -8.797 1.00 44.15 C ATOM 3 C SER A1313 11.453 23.385 -9.332 1.00 45.03 C ATOM 4 O SER A1313 10.852 22.615 -10.083 1.00 50.08 O ATOM 5 CB SER A1313 13.158 23.616 -7.467 1.00 46.29 C ATOM 6 HN3 SER A1313 13.992 24.079 -10.058 1.00 0.00 H ATOM 7 HN2 SER A1313 13.693 22.504 -10.621 1.00 0.00 H ATOM 8 HN1 SER A1313 14.803 22.759 -9.360 1.00 0.00 H ATOM 9 N MET A1314 10.932 24.572 -8.989 1.00 41.56 N ATOM 10 CA MET A1314 9.457 24.740 -9.120 1.00 39.40 C ATOM 11 C MET A1314 8.875 24.765 -10.545 1.00 33.25 C ATOM 12 O MET A1314 7.986 23.981 -10.773 1.00 31.28 O ATOM 13 CB MET A1314 8.840 25.803 -8.220 1.00 46.32 C ATOM 14 CG MET A1314 7.381 25.513 -7.867 1.00 46.84 C ATOM 15 SD MET A1314 7.163 24.295 -6.528 1.00 57.96 S ATOM 16 CE MET A1314 5.983 23.137 -7.244 1.00 54.08 C ATOM 17 H MET A1314 11.535 25.346 -8.644 1.00 0.00 H ATOM 18 N SER A1315 9.345 25.586 -11.496 1.00 28.19 N ATOM 19 CA SER A1315 8.945 25.397 -12.895 1.00 25.67 C ATOM 20 C SER A1315 9.203 23.963 -13.358 1.00 25.76 C ATOM 21 O SER A1315 10.271 23.409 -13.087 1.00 25.76 O ATOM 22 CB SER A1315 9.697 26.350 -13.854 1.00 25.52 C ATOM 23 OG SER A1315 9.442 27.716 -13.585 1.00 24.41 O ATOM 24 HG SER A1315 9.947 28.277 -14.226 1.00 0.00 H ATOM 25 H SER A1315 9.994 26.358 -11.241 1.00 0.00 H ATOM 26 N TYR A1316 8.217 23.382 -14.051 1.00 26.44 N ATOM 27 CA TYR A1316 8.304 22.036 -14.614 1.00 26.43 C ATOM 28 C TYR A1316 8.580 20.941 -13.571 1.00 27.15 C ATOM 29 O TYR A1316 9.177 19.921 -13.864 1.00 26.83 O ATOM 30 CB TYR A1316 9.326 21.982 -15.791 1.00 26.58 C ATOM 31 CG TYR A1316 8.940 22.823 -16.998 1.00 27.31 C ATOM 32 CD1 TYR A1316 7.627 22.854 -17.486 1.00 28.92 C ATOM 33 CD2 TYR A1316 9.899 23.588 -17.670 1.00 27.45 C ATOM 34 CE1 TYR A1316 7.290 23.628 -18.598 1.00 29.84 C ATOM 35 CE2 TYR A1316 9.553 24.351 -18.778 1.00 27.48 C ATOM 36 CZ TYR A1316 8.255 24.377 -19.227 1.00 29.29 C ATOM 37 OH TYR A1316 7.931 25.140 -20.327 1.00 32.27 O ATOM 38 HH TYR A1316 6.964 25.049 -20.517 1.00 0.00 H ATOM 39 H TYR A1316 7.338 23.919 -14.197 1.00 0.00 H ATOM 40 N ASP A1317 8.097 21.145 -12.349 1.00 28.96 N ATOM 41 CA ASP A1317 8.226 20.189 -11.266 1.00 29.83 C ATOM 42 C ASP A1317 7.373 18.971 -11.664 1.00 28.28 C ATOM 43 O ASP A1317 6.163 19.090 -11.823 1.00 28.84 O ATOM 44 CB ASP A1317 7.726 20.844 -9.977 1.00 31.92 C ATOM 45 CG ASP A1317 7.710 19.903 -8.765 1.00 33.72 C ATOM 46 OD1 ASP A1317 8.082 18.703 -8.820 1.00 33.91 O ATOM 47 OD2 ASP A1317 7.280 20.413 -7.713 1.00 37.86 O ATOM 48 H ASP A1317 7.600 22.039 -12.160 1.00 0.00 H ATOM 49 N ILE A1318 8.020 17.822 -11.875 1.00 27.21 N ATOM 50 CA ILE A1318 7.285 16.603 -12.292 1.00 27.48 C ATOM 51 C ILE A1318 6.528 15.899 -11.163 1.00 26.33 C ATOM 52 O ILE A1318 5.823 14.895 -11.441 1.00 26.32 O ATOM 53 CB ILE A1318 8.181 15.551 -13.001 1.00 30.00 C ATOM 54 CG1 ILE A1318 9.248 15.008 -12.045 1.00 30.90 C ATOM 55 CG2 ILE A1318 8.763 16.121 -14.285 1.00 30.83 C ATOM 56 CD1 ILE A1318 9.975 13.816 -12.629 1.00 32.20 C ATOM 57 H ILE A1318 9.051 17.781 -11.745 1.00 0.00 H ATOM 58 N GLN A1319 6.661 16.389 -9.921 1.00 26.06 N ATOM 59 CA GLN A1319 5.880 15.871 -8.774 1.00 26.92 C ATOM 60 C GLN A1319 4.685 16.761 -8.354 1.00 24.32 C ATOM 61 O GLN A1319 3.869 16.351 -7.499 1.00 23.57 O ATOM 62 CB GLN A1319 6.775 15.681 -7.540 1.00 29.51 C ATOM 63 CG GLN A1319 8.017 14.805 -7.721 1.00 32.07 C ATOM 64 CD GLN A1319 7.743 13.413 -8.281 1.00 35.94 C ATOM 65 OE1 GLN A1319 6.644 12.863 -8.136 1.00 38.35 O ATOM 66 NE2 GLN A1319 8.749 12.832 -8.944 1.00 39.20 N ATOM 67 HE22 GLN A1319 9.659 13.326 -9.045 1.00 0.00 H ATOM 68 HE21 GLN A1319 8.621 11.887 -9.358 1.00 0.00 H ATOM 69 H GLN A1319 7.338 17.161 -9.758 1.00 0.00 H ATOM 70 N ALA A1320 4.560 17.950 -8.937 1.00 23.13 N ATOM 71 CA ALA A1320 3.514 18.929 -8.533 1.00 22.62 C ATOM 72 C ALA A1320 2.099 18.401 -8.735 1.00 22.02 C ATOM 73 O ALA A1320 1.191 18.747 -7.987 1.00 21.01 O ATOM 74 CB ALA A1320 3.722 20.256 -9.253 1.00 22.94 C ATOM 75 H ALA A1320 5.216 18.205 -9.702 1.00 0.00 H ATOM 76 N TRP A1321 1.916 17.537 -9.735 1.00 20.70 N ATOM 77 CA TRP A1321 0.594 16.951 -9.988 1.00 20.53 C ATOM 78 C TRP A1321 -0.016 16.241 -8.790 1.00 20.33 C ATOM 79 O TRP A1321 -1.226 16.164 -8.672 1.00 19.98 O ATOM 80 CB TRP A1321 0.605 16.006 -11.161 1.00 20.49 C ATOM 81 CG TRP A1321 1.389 14.722 -10.928 1.00 20.02 C ATOM 82 CD1 TRP A1321 2.706 14.553 -11.112 1.00 20.38 C ATOM 83 CD2 TRP A1321 0.883 13.450 -10.466 1.00 19.69 C ATOM 84 NE1 TRP A1321 3.092 13.259 -10.845 1.00 20.74 N ATOM 85 CE2 TRP A1321 1.983 12.559 -10.443 1.00 19.75 C ATOM 86 CE3 TRP A1321 -0.364 12.974 -10.080 1.00 19.99 C ATOM 87 CZ2 TRP A1321 1.845 11.225 -10.037 1.00 20.34 C ATOM 88 CZ3 TRP A1321 -0.500 11.643 -9.737 1.00 20.08 C ATOM 89 CH2 TRP A1321 0.601 10.805 -9.692 1.00 19.95 C ATOM 90 HE1 TRP A1321 4.056 12.879 -10.933 1.00 0.00 H ATOM 91 H TRP A1321 2.719 17.276 -10.342 1.00 0.00 H ATOM 92 N LYS A1322 0.814 15.711 -7.888 1.00 20.50 N ATOM 93 CA LYS A1322 0.254 14.940 -6.794 1.00 21.03 C ATOM 94 C LYS A1322 -0.586 15.787 -5.839 1.00 21.26 C ATOM 95 O LYS A1322 -1.731 15.486 -5.523 1.00 20.66 O ATOM 96 CB LYS A1322 1.346 14.190 -6.049 1.00 22.23 C ATOM 97 CG LYS A1322 2.090 13.188 -6.907 1.00 23.35 C ATOM 98 CD LYS A1322 3.305 12.649 -6.174 1.00 26.11 C ATOM 99 CE LYS A1322 3.986 11.621 -7.047 1.00 28.10 C ATOM 100 NZ LYS A1322 5.248 11.092 -6.425 1.00 29.35 N ATOM 101 HZ1 LYS A1322 5.913 11.877 -6.272 1.00 0.00 H ATOM 102 HZ2 LYS A1322 5.023 10.644 -5.514 1.00 0.00 H ATOM 103 HZ3 LYS A1322 5.679 10.391 -7.061 1.00 0.00 H ATOM 104 H LYS A1322 1.842 15.848 -7.968 1.00 0.00 H ATOM 105 N LYS A1323 -0.006 16.903 -5.402 1.00 21.08 N ATOM 106 CA LYS A1323 -0.755 17.816 -4.579 1.00 21.51 C ATOM 107 C LYS A1323 -1.935 18.432 -5.329 1.00 21.56 C ATOM 108 O LYS A1323 -2.990 18.606 -4.762 1.00 21.79 O ATOM 109 CB LYS A1323 0.168 18.901 -4.027 1.00 22.60 C ATOM 110 CG LYS A1323 -0.502 19.870 -3.071 1.00 24.69 C ATOM 111 CD LYS A1323 0.531 20.756 -2.383 1.00 26.15 C ATOM 112 H LYS A1323 0.981 17.113 -5.653 1.00 0.00 H ATOM 113 N GLN A1324 -1.768 18.737 -6.619 1.00 20.50 N ATOM 114 CA GLN A1324 -2.877 19.242 -7.421 1.00 20.64 C ATOM 115 C GLN A1324 -4.055 18.230 -7.483 1.00 19.63 C ATOM 116 O GLN A1324 -5.218 18.596 -7.379 1.00 20.74 O ATOM 117 CB GLN A1324 -2.410 19.562 -8.830 1.00 20.54 C ATOM 118 CG GLN A1324 -1.452 20.745 -8.927 1.00 21.46 C ATOM 119 CD GLN A1324 -0.749 20.851 -10.248 1.00 23.15 C ATOM 120 OE1 GLN A1324 -0.974 20.075 -11.173 1.00 27.09 O ATOM 121 NE2 GLN A1324 0.158 21.824 -10.341 1.00 25.46 N ATOM 122 HE22 GLN A1324 0.321 22.462 -9.536 1.00 0.00 H ATOM 123 HE21 GLN A1324 0.703 21.945 -11.219 1.00 0.00 H ATOM 124 H GLN A1324 -0.833 18.613 -7.058 1.00 0.00 H ATOM 125 N CYS A1325 -3.730 16.942 -7.590 1.00 19.28 N ATOM 126 CA CYS A1325 -4.766 15.910 -7.590 1.00 18.81 C ATOM 127 C CYS A1325 -5.413 15.723 -6.227 1.00 19.05 C ATOM 128 O CYS A1325 -6.600 15.485 -6.161 1.00 18.69 O ATOM 129 CB CYS A1325 -4.219 14.576 -8.143 1.00 18.53 C ATOM 130 SG CYS A1325 -3.977 14.641 -9.950 1.00 20.45 S ATOM 131 H CYS A1325 -2.730 16.668 -7.674 1.00 0.00 H ATOM 132 N GLU A1326 -4.627 15.827 -5.154 1.00 20.19 N ATOM 133 CA GLU A1326 -5.174 15.789 -3.828 1.00 22.71 C ATOM 134 C GLU A1326 -6.184 16.915 -3.662 1.00 21.94 C ATOM 135 O GLU A1326 -7.274 16.690 -3.117 1.00 22.93 O ATOM 136 CB GLU A1326 -4.047 15.922 -2.779 1.00 25.96 C ATOM 137 CG GLU A1326 -4.445 15.314 -1.449 1.00 30.64 C ATOM 138 CD GLU A1326 -3.299 15.269 -0.467 1.00 32.48 C ATOM 139 OE1 GLU A1326 -2.128 15.541 -0.895 1.00 37.29 O ATOM 140 OE2 GLU A1326 -3.598 14.971 0.727 1.00 35.42 O ATOM 141 H GLU A1326 -3.601 15.937 -5.281 1.00 0.00 H ATOM 142 N GLU A1327 -5.823 18.135 -4.072 1.00 23.60 N ATOM 143 CA GLU A1327 -6.753 19.289 -4.007 1.00 24.51 C ATOM 144 C GLU A1327 -8.021 19.103 -4.846 1.00 23.38 C ATOM 145 O GLU A1327 -9.125 19.429 -4.392 1.00 23.70 O ATOM 146 CB GLU A1327 -6.001 20.574 -4.423 1.00 26.73 C ATOM 147 CG GLU A1327 -5.013 20.974 -3.337 1.00 30.41 C ATOM 148 CD GLU A1327 -3.975 21.996 -3.730 1.00 34.35 C ATOM 149 OE1 GLU A1327 -3.756 22.258 -4.941 1.00 37.93 O ATOM 150 OE2 GLU A1327 -3.318 22.480 -2.789 1.00 37.55 O ATOM 151 H GLU A1327 -4.864 18.279 -4.447 1.00 0.00 H ATOM 152 N LEU A1328 -7.893 18.541 -6.036 1.00 22.36 N ATOM 153 CA LEU A1328 -9.073 18.291 -6.871 1.00 21.18 C ATOM 154 C LEU A1328 -9.975 17.231 -6.232 1.00 21.94 C ATOM 155 O LEU A1328 -11.178 17.379 -6.217 1.00 21.80 O ATOM 156 CB LEU A1328 -8.638 17.861 -8.247 1.00 21.21 C ATOM 157 CG LEU A1328 -9.755 17.539 -9.261 1.00 21.20 C ATOM 158 CD1 LEU A1328 -10.822 18.671 -9.336 1.00 21.42 C ATOM 159 CD2 LEU A1328 -9.110 17.342 -10.609 1.00 21.63 C ATOM 160 H LEU A1328 -6.949 18.274 -6.382 1.00 0.00 H ATOM 161 N LEU A1329 -9.382 16.158 -5.710 1.00 21.31 N ATOM 162 CA LEU A1329 -10.191 15.188 -4.977 1.00 21.44 C ATOM 163 C LEU A1329 -10.928 15.774 -3.784 1.00 22.93 C ATOM 164 O LEU A1329 -12.083 15.392 -3.553 1.00 22.68 O ATOM 165 CB LEU A1329 -9.347 13.992 -4.562 1.00 21.78 C ATOM 166 CG LEU A1329 -8.889 13.125 -5.721 1.00 21.26 C ATOM 167 CD1 LEU A1329 -7.822 12.175 -5.201 1.00 21.77 C ATOM 168 CD2 LEU A1329 -9.991 12.297 -6.376 1.00 22.14 C ATOM 169 H LEU A1329 -8.358 16.013 -5.823 1.00 0.00 H ATOM 170 N ASN A1330 -10.290 16.703 -3.070 1.00 23.11 N ATOM 171 CA ASN A1330 -10.992 17.454 -1.996 1.00 25.15 C ATOM 172 C ASN A1330 -12.211 18.199 -2.520 1.00 25.20 C ATOM 173 O ASN A1330 -13.313 18.057 -1.956 1.00 25.84 O ATOM 174 CB ASN A1330 -9.996 18.415 -1.337 1.00 26.32 C ATOM 175 CG ASN A1330 -10.560 19.227 -0.150 1.00 29.70 C ATOM 176 OD1 ASN A1330 -11.397 20.117 -0.291 1.00 31.15 O ATOM 177 ND2 ASN A1330 -9.950 19.032 1.009 1.00 32.07 N ATOM 178 HD22 ASN A1330 -9.245 18.273 1.105 1.00 0.00 H ATOM 179 HD21 ASN A1330 -10.175 19.638 1.824 1.00 0.00 H ATOM 180 H ASN A1330 -9.289 16.904 -3.267 1.00 0.00 H ATOM 181 N LEU A1331 -12.066 18.911 -3.636 1.00 24.66 N ATOM 182 CA LEU A1331 -13.236 19.555 -4.278 1.00 25.12 C ATOM 183 C LEU A1331 -14.319 18.544 -4.656 1.00 24.12 C ATOM 184 O LEU A1331 -15.507 18.802 -4.443 1.00 24.02 O ATOM 185 CB LEU A1331 -12.850 20.374 -5.525 1.00 26.15 C ATOM 186 CG LEU A1331 -11.929 21.569 -5.375 1.00 27.70 C ATOM 187 CD1 LEU A1331 -11.666 22.141 -6.744 1.00 27.06 C ATOM 188 CD2 LEU A1331 -12.518 22.585 -4.423 1.00 28.87 C ATOM 189 H LEU A1331 -11.123 19.016 -4.061 1.00 0.00 H ATOM 190 N ILE A1332 -13.911 17.424 -5.244 1.00 21.74 N ATOM 191 CA ILE A1332 -14.869 16.392 -5.638 1.00 21.98 C ATOM 192 C ILE A1332 -15.651 15.844 -4.438 1.00 22.50 C ATOM 193 O ILE A1332 -16.873 15.687 -4.514 1.00 22.10 O ATOM 194 CB ILE A1332 -14.173 15.291 -6.458 1.00 22.11 C ATOM 195 CG1 ILE A1332 -13.897 15.873 -7.845 1.00 23.83 C ATOM 196 CG2 ILE A1332 -15.030 14.041 -6.558 1.00 21.54 C ATOM 197 CD1 ILE A1332 -12.949 15.104 -8.684 1.00 25.19 C ATOM 198 H ILE A1332 -12.897 17.280 -5.426 1.00 0.00 H ATOM 199 N PHE A1333 -14.963 15.546 -3.332 1.00 22.48 N ATOM 200 CA PHE A1333 -15.659 15.046 -2.139 1.00 23.33 C ATOM 201 C PHE A1333 -16.622 16.102 -1.582 1.00 25.26 C ATOM 202 O PHE A1333 -17.659 15.725 -1.043 1.00 26.42 O ATOM 203 CB PHE A1333 -14.669 14.592 -1.056 1.00 22.57 C ATOM 204 CG PHE A1333 -14.246 13.149 -1.193 1.00 22.25 C ATOM 205 CD1 PHE A1333 -14.995 12.120 -0.566 1.00 23.12 C ATOM 206 CD2 PHE A1333 -13.183 12.790 -1.992 1.00 22.62 C ATOM 207 CE1 PHE A1333 -14.643 10.773 -0.727 1.00 22.90 C ATOM 208 CE2 PHE A1333 -12.823 11.464 -2.121 1.00 21.73 C ATOM 209 CZ PHE A1333 -13.560 10.453 -1.526 1.00 22.01 C ATOM 210 H PHE A1333 -13.930 15.669 -3.316 1.00 0.00 H ATOM 211 N GLN A1334 -16.322 17.388 -1.738 1.00 26.11 N ATOM 212 CA GLN A1334 -17.300 18.456 -1.358 1.00 27.34 C ATOM 213 C GLN A1334 -18.578 18.517 -2.187 1.00 28.23 C ATOM 214 O GLN A1334 -19.646 18.919 -1.686 1.00 29.80 O ATOM 215 CB GLN A1334 -16.665 19.835 -1.446 1.00 28.37 C ATOM 216 CG GLN A1334 -15.597 20.109 -0.404 1.00 29.01 C ATOM 217 CD GLN A1334 -15.076 21.520 -0.572 1.00 30.36 C ATOM 218 OE1 GLN A1334 -15.866 22.479 -0.647 1.00 31.46 O ATOM 219 NE2 GLN A1334 -13.769 21.663 -0.668 1.00 31.33 N ATOM 220 HE22 GLN A1334 -13.148 20.831 -0.599 1.00 0.00 H ATOM 221 HE21 GLN A1334 -13.358 22.608 -0.813 1.00 0.00 H ATOM 222 H GLN A1334 -15.396 17.655 -2.129 1.00 0.00 H ATOM 223 N CYS A1335 -18.478 18.157 -3.455 1.00 26.07 N ATOM 224 CA CYS A1335 -19.610 18.240 -4.362 1.00 27.04 C ATOM 225 C CYS A1335 -20.730 17.282 -3.996 1.00 26.92 C ATOM 226 O CYS A1335 -20.505 16.080 -3.873 1.00 26.69 O ATOM 227 CB CYS A1335 -19.157 17.897 -5.782 1.00 25.79 C ATOM 228 SG CYS A1335 -18.083 19.115 -6.573 1.00 27.92 S ATOM 229 H CYS A1335 -17.567 17.806 -3.812 1.00 0.00 H ATOM 230 N GLU A1336 -21.955 17.797 -3.917 1.00 27.22 N ATOM 231 CA GLU A1336 -23.112 16.941 -3.644 1.00 29.67 C ATOM 232 C GLU A1336 -23.227 15.866 -4.732 1.00 27.47 C ATOM 233 O GLU A1336 -23.611 14.710 -4.457 1.00 29.45 O ATOM 234 CB GLU A1336 -24.389 17.779 -3.584 1.00 32.18 C ATOM 235 CG GLU A1336 -24.460 18.775 -2.425 1.00 35.14 C ATOM 236 CD GLU A1336 -25.393 19.947 -2.738 1.00 38.79 C ATOM 237 OE1 GLU A1336 -26.615 19.789 -2.499 1.00 42.15 O ATOM 238 OE2 GLU A1336 -24.918 21.021 -3.223 1.00 39.59 O ATOM 239 H GLU A1336 -22.092 18.819 -4.051 1.00 0.00 H ATOM 240 N ASP A1337 -22.848 16.216 -5.969 1.00 26.36 N ATOM 241 CA ASP A1337 -22.897 15.273 -7.075 1.00 25.36 C ATOM 242 C ASP A1337 -21.973 14.046 -6.921 1.00 24.11 C ATOM 243 O ASP A1337 -22.137 13.065 -7.652 1.00 25.26 O ATOM 244 CB ASP A1337 -22.597 15.964 -8.421 1.00 25.30 C ATOM 245 CG ASP A1337 -23.725 16.896 -8.902 1.00 26.19 C ATOM 246 OD1 ASP A1337 -24.893 16.814 -8.441 1.00 26.90 O ATOM 247 OD2 ASP A1337 -23.429 17.707 -9.802 1.00 26.36 O ATOM 248 H ASP A1337 -22.511 17.185 -6.142 1.00 0.00 H ATOM 249 N SER A1338 -20.964 14.110 -6.027 1.00 23.55 N ATOM 250 CA SER A1338 -20.116 12.932 -5.833 1.00 23.22 C ATOM 251 C SER A1338 -20.657 11.883 -4.868 1.00 22.90 C ATOM 252 O SER A1338 -20.079 10.793 -4.787 1.00 22.87 O ATOM 253 CB SER A1338 -18.706 13.324 -5.400 1.00 23.37 C ATOM 254 OG SER A1338 -18.682 13.768 -4.043 1.00 23.78 O ATOM 255 HG SER A1338 -19.272 14.557 -3.945 1.00 0.00 H ATOM 256 H SER A1338 -20.792 14.981 -5.485 1.00 0.00 H ATOM 257 N GLU A1339 -21.739 12.195 -4.151 1.00 24.97 N ATOM 258 CA GLU A1339 -22.239 11.304 -3.091 1.00 26.29 C ATOM 259 C GLU A1339 -22.378 9.833 -3.459 1.00 26.31 C ATOM 260 O GLU A1339 -21.902 8.971 -2.718 1.00 26.68 O ATOM 261 CB GLU A1339 -23.541 11.879 -2.502 1.00 28.88 C ATOM 262 CG GLU A1339 -24.056 11.153 -1.254 1.00 31.80 C ATOM 263 CD GLU A1339 -24.722 9.810 -1.540 1.00 32.56 C ATOM 264 OE1 GLU A1339 -25.400 9.690 -2.570 1.00 32.78 O ATOM 265 OE2 GLU A1339 -24.548 8.859 -0.732 1.00 36.27 O ATOM 266 H GLU A1339 -22.239 13.086 -4.345 1.00 0.00 H ATOM 267 N PRO A1340 -22.954 9.529 -4.636 1.00 25.79 N ATOM 268 CA PRO A1340 -23.018 8.096 -4.996 1.00 26.05 C ATOM 269 C PRO A1340 -21.699 7.396 -5.337 1.00 24.60 C ATOM 270 O PRO A1340 -21.678 6.163 -5.419 1.00 24.71 O ATOM 271 CB PRO A1340 -23.927 8.102 -6.230 1.00 26.21 C ATOM 272 CG PRO A1340 -24.631 9.405 -6.222 1.00 26.43 C ATOM 273 CD PRO A1340 -23.629 10.357 -5.643 1.00 26.08 C ATOM 274 N PHE A1341 -20.638 8.188 -5.554 1.00 23.74 N ATOM 275 CA PHE A1341 -19.368 7.727 -6.057 1.00 23.23 C ATOM 276 C PHE A1341 -18.226 7.773 -5.065 1.00 23.10 C ATOM 277 O PHE A1341 -17.109 7.437 -5.433 1.00 23.14 O ATOM 278 CB PHE A1341 -19.012 8.546 -7.322 1.00 23.48 C ATOM 279 CG PHE A1341 -20.159 8.650 -8.284 1.00 23.30 C ATOM 280 CD1 PHE A1341 -20.578 7.544 -8.984 1.00 24.94 C ATOM 281 CD2 PHE A1341 -20.878 9.839 -8.407 1.00 23.11 C ATOM 282 CE1 PHE A1341 -21.683 7.618 -9.850 1.00 24.75 C ATOM 283 CE2 PHE A1341 -21.952 9.928 -9.264 1.00 24.15 C ATOM 284 CZ PHE A1341 -22.375 8.806 -9.954 1.00 23.44 C ATOM 285 H PHE A1341 -20.738 9.202 -5.345 1.00 0.00 H ATOM 286 N ARG A1342 -18.498 8.111 -3.803 1.00 35.41 N ATOM 287 CA ARG A1342 -17.440 8.267 -2.794 1.00 35.66 C ATOM 288 C ARG A1342 -16.845 6.969 -2.303 1.00 36.48 C ATOM 289 O ARG A1342 -15.651 6.915 -2.047 1.00 38.53 O ATOM 290 CB ARG A1342 -17.951 9.102 -1.625 1.00 35.57 C ATOM 291 CG ARG A1342 -18.168 10.555 -2.015 1.00 34.48 C ATOM 292 CD ARG A1342 -18.902 11.341 -0.966 1.00 35.01 C ATOM 293 NE ARG A1342 -19.362 12.616 -1.448 1.00 34.91 N ATOM 294 CZ ARG A1342 -20.302 13.354 -0.875 1.00 35.75 C ATOM 295 NH1 ARG A1342 -20.867 12.986 0.285 1.00 37.64 N ATOM 296 NH2 ARG A1342 -20.677 14.491 -1.468 1.00 35.85 N ATOM 297 HE ARG A1342 -18.922 12.988 -2.314 1.00 0.00 H ATOM 298 HH12 ARG A1342 -21.603 13.581 0.717 1.00 0.00 H ATOM 299 HH11 ARG A1342 -20.569 12.106 0.752 1.00 0.00 H ATOM 300 HH22 ARG A1342 -21.413 15.085 -1.035 1.00 0.00 H ATOM 301 HH21 ARG A1342 -20.233 14.782 -2.362 1.00 0.00 H ATOM 302 H ARG A1342 -19.488 8.269 -3.525 1.00 0.00 H ATOM 303 N GLN A1343 -17.672 5.933 -2.186 1.00 36.55 N ATOM 304 CA GLN A1343 -17.271 4.653 -1.620 1.00 37.59 C ATOM 305 C GLN A1343 -17.636 3.533 -2.583 1.00 37.26 C ATOM 306 O GLN A1343 -18.517 3.726 -3.425 1.00 36.11 O ATOM 307 CB GLN A1343 -18.006 4.442 -0.299 1.00 38.46 C ATOM 308 CG GLN A1343 -19.524 4.492 -0.428 1.00 38.37 C ATOM 309 CD GLN A1343 -20.050 5.881 -0.759 1.00 37.80 C ATOM 310 OE1 GLN A1343 -20.573 6.155 -1.861 1.00 36.72 O ATOM 311 NE2 GLN A1343 -19.902 6.778 0.197 1.00 38.40 N ATOM 312 HE22 GLN A1343 -19.461 6.508 1.100 1.00 0.00 H ATOM 313 HE21 GLN A1343 -20.226 7.755 0.048 1.00 0.00 H ATOM 314 H GLN A1343 -18.652 6.043 -2.515 1.00 0.00 H ATOM 315 N PRO A1344 -16.978 2.358 -2.458 1.00 38.45 N ATOM 316 CA PRO A1344 -17.333 1.196 -3.270 1.00 39.02 C ATOM 317 C PRO A1344 -18.816 0.833 -3.160 1.00 40.41 C ATOM 318 O PRO A1344 -19.432 0.995 -2.091 1.00 41.79 O ATOM 319 CB PRO A1344 -16.485 0.067 -2.664 1.00 39.93 C ATOM 320 CG PRO A1344 -15.298 0.751 -2.111 1.00 40.00 C ATOM 321 CD PRO A1344 -15.840 2.037 -1.559 1.00 39.32 C ATOM 322 N VAL A1345 -19.393 0.393 -4.270 1.00 41.64 N ATOM 323 CA VAL A1345 -20.745 -0.149 -4.255 1.00 43.84 C ATOM 324 C VAL A1345 -20.772 -1.376 -3.328 1.00 46.39 C ATOM 325 O VAL A1345 -19.833 -2.173 -3.314 1.00 46.55 O ATOM 326 CB VAL A1345 -21.210 -0.490 -5.687 1.00 43.48 C ATOM 327 CG1 VAL A1345 -22.540 -1.236 -5.669 1.00 44.05 C ATOM 328 CG2 VAL A1345 -21.340 0.786 -6.502 1.00 42.75 C ATOM 329 H VAL A1345 -18.870 0.436 -5.168 1.00 0.00 H ATOM 330 N ASP A1346 -21.818 -1.475 -2.511 1.00 49.11 N ATOM 331 CA ASP A1346 -22.009 -2.615 -1.615 1.00 52.63 C ATOM 332 C ASP A1346 -22.582 -3.769 -2.421 1.00 53.16 C ATOM 333 O ASP A1346 -23.723 -3.697 -2.903 1.00 51.28 O ATOM 334 CB ASP A1346 -22.942 -2.250 -0.464 1.00 54.42 C ATOM 335 CG ASP A1346 -22.931 -3.289 0.669 1.00 57.12 C ATOM 336 OD1 ASP A1346 -22.093 -4.223 0.672 1.00 58.81 O ATOM 337 OD2 ASP A1346 -23.769 -3.156 1.579 1.00 60.44 O ATOM 338 H ASP A1346 -22.526 -0.713 -2.510 1.00 0.00 H ATOM 339 N LEU A1347 -21.773 -4.818 -2.575 1.00 56.55 N ATOM 340 CA LEU A1347 -22.111 -5.953 -3.443 1.00 59.71 C ATOM 341 C LEU A1347 -23.264 -6.844 -2.930 1.00 62.43 C ATOM 342 O LEU A1347 -23.652 -7.774 -3.628 1.00 65.52 O ATOM 343 CB LEU A1347 -20.854 -6.795 -3.736 1.00 60.71 C ATOM 344 H LEU A1347 -20.869 -4.833 -2.061 1.00 0.00 H ATOM 345 N LEU A1348 -23.808 -6.565 -1.736 1.00 64.46 N ATOM 346 CA LEU A1348 -25.026 -7.219 -1.229 1.00 65.50 C ATOM 347 C LEU A1348 -26.286 -6.309 -1.294 1.00 65.04 C ATOM 348 O LEU A1348 -27.391 -6.802 -1.516 1.00 64.98 O ATOM 349 CB LEU A1348 -24.767 -7.742 0.188 1.00 67.78 C ATOM 350 CG LEU A1348 -25.763 -8.700 0.872 1.00 69.95 C ATOM 351 CD1 LEU A1348 -26.362 -9.739 -0.072 1.00 69.73 C ATOM 352 CD2 LEU A1348 -25.091 -9.394 2.045 1.00 72.03 C ATOM 353 H LEU A1348 -23.346 -5.850 -1.138 1.00 0.00 H ATOM 354 N GLU A1349 -26.127 -4.997 -1.119 1.00 64.09 N ATOM 355 CA GLU A1349 -27.209 -4.037 -1.410 1.00 63.47 C ATOM 356 C GLU A1349 -27.523 -3.958 -2.912 1.00 61.68 C ATOM 357 O GLU A1349 -28.665 -3.681 -3.293 1.00 61.20 O ATOM 358 CB GLU A1349 -26.849 -2.635 -0.911 1.00 63.46 C ATOM 359 H GLU A1349 -25.215 -4.640 -0.768 1.00 0.00 H ATOM 360 N TYR A1350 -26.502 -4.164 -3.754 1.00 59.50 N ATOM 361 CA TYR A1350 -26.667 -4.280 -5.210 1.00 57.36 C ATOM 362 C TYR A1350 -26.010 -5.579 -5.713 1.00 55.26 C ATOM 363 O TYR A1350 -24.877 -5.553 -6.210 1.00 53.30 O ATOM 364 CB TYR A1350 -26.049 -3.059 -5.904 1.00 57.88 C ATOM 365 CG TYR A1350 -26.846 -1.788 -5.721 1.00 59.52 C ATOM 366 CD1 TYR A1350 -27.694 -1.334 -6.726 1.00 60.49 C ATOM 367 CD2 TYR A1350 -26.770 -1.047 -4.541 1.00 61.91 C ATOM 368 CE1 TYR A1350 -28.435 -0.172 -6.580 1.00 61.93 C ATOM 369 CE2 TYR A1350 -27.513 0.120 -4.379 1.00 63.27 C ATOM 370 CZ TYR A1350 -28.352 0.551 -5.401 1.00 63.08 C ATOM 371 OH TYR A1350 -29.105 1.708 -5.279 1.00 64.21 O ATOM 372 HH TYR A1350 -29.634 1.845 -6.105 1.00 0.00 H ATOM 373 H TYR A1350 -25.544 -4.246 -3.358 1.00 0.00 H ATOM 374 N PRO A1351 -26.719 -6.727 -5.583 1.00 53.13 N ATOM 375 CA PRO A1351 -26.079 -8.012 -5.912 1.00 52.25 C ATOM 376 C PRO A1351 -25.871 -8.235 -7.409 1.00 48.58 C ATOM 377 O PRO A1351 -25.048 -9.074 -7.773 1.00 50.00 O ATOM 378 CB PRO A1351 -27.042 -9.052 -5.311 1.00 54.44 C ATOM 379 CG PRO A1351 -28.367 -8.382 -5.321 1.00 53.97 C ATOM 380 CD PRO A1351 -28.089 -6.925 -5.059 1.00 53.56 C ATOM 381 N ASP A1352 -26.582 -7.491 -8.257 1.00 45.56 N ATOM 382 CA ASP A1352 -26.351 -7.565 -9.678 1.00 43.75 C ATOM 383 C ASP A1352 -25.234 -6.600 -10.143 1.00 41.43 C ATOM 384 O ASP A1352 -24.965 -6.560 -11.341 1.00 40.32 O ATOM 385 CB ASP A1352 -27.664 -7.415 -10.486 1.00 43.56 C ATOM 386 CG ASP A1352 -28.106 -5.971 -10.676 1.00 43.97 C ATOM 387 OD1 ASP A1352 -27.654 -5.103 -9.907 1.00 46.18 O ATOM 388 OD2 ASP A1352 -28.947 -5.704 -11.574 1.00 41.71 O ATOM 389 H ASP A1352 -27.313 -6.849 -7.888 1.00 0.00 H ATOM 390 N TYR A1353 -24.586 -5.858 -9.225 1.00 40.11 N ATOM 391 CA TYR A1353 -23.561 -4.852 -9.660 1.00 39.44 C ATOM 392 C TYR A1353 -22.415 -5.528 -10.401 1.00 40.06 C ATOM 393 O TYR A1353 -22.012 -5.086 -11.502 1.00 38.09 O ATOM 394 CB TYR A1353 -22.981 -4.013 -8.490 1.00 39.18 C ATOM 395 CG TYR A1353 -22.213 -2.787 -9.001 1.00 37.92 C ATOM 396 CD1 TYR A1353 -22.895 -1.704 -9.542 1.00 35.99 C ATOM 397 CD2 TYR A1353 -20.814 -2.739 -8.982 1.00 38.19 C ATOM 398 CE1 TYR A1353 -22.208 -0.589 -10.070 1.00 36.26 C ATOM 399 CE2 TYR A1353 -20.124 -1.632 -9.507 1.00 37.42 C ATOM 400 CZ TYR A1353 -20.834 -0.562 -10.027 1.00 36.56 C ATOM 401 OH TYR A1353 -20.194 0.541 -10.541 1.00 36.44 O ATOM 402 HH TYR A1353 -20.867 1.192 -10.861 1.00 0.00 H ATOM 403 H TYR A1353 -24.796 -5.982 -8.214 1.00 0.00 H ATOM 404 N ARG A1354 -21.881 -6.586 -9.810 1.00 42.62 N ATOM 405 CA ARG A1354 -20.778 -7.327 -10.428 1.00 44.54 C ATOM 406 C ARG A1354 -21.191 -8.151 -11.641 1.00 42.76 C ATOM 407 O ARG A1354 -20.336 -8.577 -12.383 1.00 42.02 O ATOM 408 CB ARG A1354 -20.073 -8.212 -9.395 1.00 48.69 C ATOM 409 CG ARG A1354 -19.423 -7.442 -8.243 1.00 50.99 C ATOM 410 CD ARG A1354 -18.526 -6.304 -8.735 1.00 51.85 C ATOM 411 NE ARG A1354 -17.574 -6.766 -9.757 1.00 54.18 N ATOM 412 CZ ARG A1354 -16.423 -7.410 -9.519 1.00 56.79 C ATOM 413 NH1 ARG A1354 -16.007 -7.673 -8.281 1.00 58.11 N ATOM 414 NH2 ARG A1354 -15.655 -7.778 -10.541 1.00 58.55 N ATOM 415 HE ARG A1354 -17.815 -6.576 -10.751 1.00 0.00 H ATOM 416 HH12 ARG A1354 -15.109 -8.175 -8.130 1.00 0.00 H ATOM 417 HH11 ARG A1354 -16.581 -7.377 -7.466 1.00 0.00 H ATOM 418 HH22 ARG A1354 -14.760 -8.278 -10.365 1.00 0.00 H ATOM 419 HH21 ARG A1354 -15.949 -7.566 -11.516 1.00 0.00 H ATOM 420 H ARG A1354 -22.252 -6.897 -8.889 1.00 0.00 H ATOM 421 N ASP A1355 -22.492 -8.408 -11.818 1.00 41.08 N ATOM 422 CA ASP A1355 -22.984 -8.981 -13.080 1.00 40.68 C ATOM 423 C ASP A1355 -22.771 -8.044 -14.241 1.00 38.61 C ATOM 424 O ASP A1355 -22.538 -8.488 -15.359 1.00 38.47 O ATOM 425 CB ASP A1355 -24.484 -9.328 -13.007 1.00 40.06 C ATOM 426 CG ASP A1355 -24.798 -10.362 -11.954 1.00 41.29 C ATOM 427 OD1 ASP A1355 -23.892 -11.133 -11.578 1.00 42.90 O ATOM 428 OD2 ASP A1355 -25.960 -10.408 -11.487 1.00 41.37 O ATOM 429 H ASP A1355 -23.165 -8.200 -11.053 1.00 0.00 H ATOM 430 N ILE A1356 -22.867 -6.737 -13.972 1.00 37.45 N ATOM 431 CA ILE A1356 -22.740 -5.687 -14.987 1.00 35.81 C ATOM 432 C ILE A1356 -21.334 -5.083 -15.133 1.00 35.31 C ATOM 433 O ILE A1356 -20.879 -4.851 -16.243 1.00 34.53 O ATOM 434 CB ILE A1356 -23.771 -4.577 -14.696 1.00 35.13 C ATOM 435 CG1 ILE A1356 -25.182 -5.202 -14.577 1.00 35.85 C ATOM 436 CG2 ILE A1356 -23.754 -3.505 -15.769 1.00 34.65 C ATOM 437 CD1 ILE A1356 -25.615 -5.889 -15.849 1.00 36.40 C ATOM 438 H ILE A1356 -23.041 -6.450 -12.988 1.00 0.00 H ATOM 439 N ILE A1357 -20.660 -4.887 -14.006 1.00 35.37 N ATOM 440 CA ILE A1357 -19.413 -4.101 -13.933 1.00 35.78 C ATOM 441 C ILE A1357 -18.231 -5.009 -13.612 1.00 37.61 C ATOM 442 O ILE A1357 -18.202 -5.665 -12.570 1.00 37.72 O ATOM 443 CB ILE A1357 -19.567 -2.952 -12.880 1.00 34.91 C ATOM 444 CG1 ILE A1357 -20.639 -1.957 -13.341 1.00 34.29 C ATOM 445 CG2 ILE A1357 -18.247 -2.208 -12.621 1.00 35.09 C ATOM 446 CD1 ILE A1357 -20.395 -1.326 -14.683 1.00 34.43 C ATOM 447 H ILE A1357 -21.030 -5.309 -13.130 1.00 0.00 H ATOM 448 N ASP A1358 -17.226 -4.992 -14.496 1.00 39.42 N ATOM 449 CA ASP A1358 -16.023 -5.824 -14.329 1.00 42.00 C ATOM 450 C ASP A1358 -15.043 -5.279 -13.291 1.00 41.37 C ATOM 451 O ASP A1358 -14.399 -6.057 -12.572 1.00 42.63 O ATOM 452 CB ASP A1358 -15.279 -6.044 -15.673 1.00 44.78 C ATOM 453 CG ASP A1358 -15.704 -7.352 -16.396 1.00 47.01 C ATOM 454 OD1 ASP A1358 -16.852 -7.842 -16.216 1.00 49.45 O ATOM 455 OD2 ASP A1358 -14.871 -7.889 -17.157 1.00 51.09 O ATOM 456 H ASP A1358 -17.297 -4.371 -15.327 1.00 0.00 H ATOM 457 N THR A1359 -14.888 -3.951 -13.270 1.00 39.94 N ATOM 458 CA THR A1359 -13.856 -3.286 -12.444 1.00 39.79 C ATOM 459 C THR A1359 -14.475 -2.103 -11.692 1.00 37.70 C ATOM 460 O THR A1359 -14.550 -0.975 -12.241 1.00 37.17 O ATOM 461 CB THR A1359 -12.665 -2.827 -13.290 1.00 40.89 C ATOM 462 OG1 THR A1359 -12.225 -3.898 -14.130 1.00 42.73 O ATOM 463 CG2 THR A1359 -11.484 -2.387 -12.397 1.00 41.81 C ATOM 464 HG1 THR A1359 -11.455 -3.595 -14.674 1.00 0.00 H ATOM 465 H THR A1359 -15.516 -3.364 -13.856 1.00 0.00 H ATOM 466 N PRO A1360 -14.958 -2.348 -10.458 1.00 37.26 N ATOM 467 CA PRO A1360 -15.537 -1.263 -9.674 1.00 35.55 C ATOM 468 C PRO A1360 -14.442 -0.222 -9.349 1.00 34.27 C ATOM 469 O PRO A1360 -13.274 -0.544 -9.234 1.00 35.05 O ATOM 470 CB PRO A1360 -16.009 -1.951 -8.390 1.00 36.76 C ATOM 471 CG PRO A1360 -16.133 -3.381 -8.738 1.00 37.91 C ATOM 472 CD PRO A1360 -15.041 -3.630 -9.728 1.00 38.57 C ATOM 473 N MET A1361 -14.866 1.017 -9.230 1.00 32.71 N ATOM 474 CA MET A1361 -13.937 2.098 -8.863 1.00 31.81 C ATOM 475 C MET A1361 -14.781 3.179 -8.170 1.00 31.45 C ATOM 476 O MET A1361 -15.951 3.351 -8.444 1.00 30.93 O ATOM 477 CB MET A1361 -13.219 2.655 -10.076 1.00 31.50 C ATOM 478 CG MET A1361 -12.039 3.580 -9.758 1.00 30.93 C ATOM 479 SD MET A1361 -10.888 3.093 -8.454 1.00 31.73 S ATOM 480 CE MET A1361 -10.196 1.621 -9.188 1.00 32.67 C ATOM 481 H MET A1361 -15.869 1.236 -9.397 1.00 0.00 H ATOM 482 N ASP A1362 -14.153 3.886 -7.236 1.00 32.07 N ATOM 483 CA ASP A1362 -14.861 4.919 -6.451 1.00 31.83 C ATOM 484 C ASP A1362 -13.796 5.962 -6.024 1.00 31.42 C ATOM 485 O ASP A1362 -12.605 5.685 -6.094 1.00 31.08 O ATOM 486 CB ASP A1362 -15.521 4.292 -5.243 1.00 33.25 C ATOM 487 CG ASP A1362 -14.523 3.724 -4.303 1.00 34.43 C ATOM 488 OD1 ASP A1362 -13.941 2.644 -4.559 1.00 34.97 O ATOM 489 OD2 ASP A1362 -14.194 4.451 -3.348 1.00 35.96 O ATOM 490 H ASP A1362 -13.144 3.709 -7.054 1.00 0.00 H ATOM 491 N PHE A1363 -14.244 7.130 -5.574 1.00 19.78 N ATOM 492 CA PHE A1363 -13.297 8.186 -5.240 1.00 18.97 C ATOM 493 C PHE A1363 -12.463 7.939 -3.960 1.00 20.05 C ATOM 494 O PHE A1363 -11.359 8.451 -3.913 1.00 19.46 O ATOM 495 CB PHE A1363 -13.949 9.592 -5.182 1.00 19.13 C ATOM 496 CG PHE A1363 -14.303 10.156 -6.542 1.00 19.34 C ATOM 497 CD1 PHE A1363 -13.314 10.673 -7.371 1.00 19.22 C ATOM 498 CD2 PHE A1363 -15.626 10.156 -6.982 1.00 20.04 C ATOM 499 CE1 PHE A1363 -13.612 11.149 -8.656 1.00 20.06 C ATOM 500 CE2 PHE A1363 -15.933 10.676 -8.256 1.00 20.30 C ATOM 501 CZ PHE A1363 -14.936 11.130 -9.097 1.00 19.97 C ATOM 502 H PHE A1363 -15.265 7.289 -5.461 1.00 0.00 H ATOM 503 N ALA A1364 -12.976 7.201 -2.968 1.00 21.03 N ATOM 504 CA ALA A1364 -12.136 6.869 -1.802 1.00 21.29 C ATOM 505 C ALA A1364 -10.958 5.960 -2.227 1.00 21.39 C ATOM 506 O ALA A1364 -9.804 6.134 -1.795 1.00 21.62 O ATOM 507 CB ALA A1364 -12.956 6.229 -0.734 1.00 21.78 C ATOM 508 H ALA A1364 -13.959 6.865 -3.019 1.00 0.00 H ATOM 509 N THR A1365 -11.221 5.033 -3.129 1.00 21.38 N ATOM 510 CA THR A1365 -10.181 4.150 -3.621 1.00 21.37 C ATOM 511 C THR A1365 -9.134 4.975 -4.387 1.00 20.62 C ATOM 512 O THR A1365 -7.938 4.808 -4.195 1.00 20.12 O ATOM 513 CB THR A1365 -10.783 3.040 -4.511 1.00 22.33 C ATOM 514 OG1 THR A1365 -11.615 2.212 -3.689 1.00 24.05 O ATOM 515 CG2 THR A1365 -9.694 2.212 -5.121 1.00 22.90 C ATOM 516 HG1 THR A1365 -12.011 1.493 -4.242 1.00 0.00 H ATOM 517 H THR A1365 -12.190 4.934 -3.493 1.00 0.00 H ATOM 518 N VAL A1366 -9.561 5.882 -5.290 1.00 19.33 N ATOM 519 CA VAL A1366 -8.622 6.761 -5.982 1.00 19.29 C ATOM 520 C VAL A1366 -7.774 7.589 -4.993 1.00 18.83 C ATOM 521 O VAL A1366 -6.570 7.625 -5.122 1.00 18.61 O ATOM 522 CB VAL A1366 -9.356 7.699 -7.003 1.00 18.95 C ATOM 523 CG1 VAL A1366 -8.423 8.736 -7.624 1.00 19.15 C ATOM 524 CG2 VAL A1366 -10.082 6.892 -8.100 1.00 19.56 C ATOM 525 H VAL A1366 -10.577 5.957 -5.497 1.00 0.00 H ATOM 526 N ARG A1367 -8.424 8.181 -3.996 1.00 18.40 N ATOM 527 CA ARG A1367 -7.742 9.013 -3.015 1.00 18.72 C ATOM 528 C ARG A1367 -6.721 8.180 -2.214 1.00 19.22 C ATOM 529 O ARG A1367 -5.592 8.670 -2.016 1.00 18.82 O ATOM 530 CB ARG A1367 -8.768 9.695 -2.123 1.00 19.56 C ATOM 531 CG ARG A1367 -8.174 10.631 -1.107 1.00 20.32 C ATOM 532 CD ARG A1367 -9.274 11.372 -0.350 1.00 21.41 C ATOM 533 NE ARG A1367 -10.112 10.478 0.433 1.00 22.36 N ATOM 534 CZ ARG A1367 -11.186 10.864 1.164 1.00 23.50 C ATOM 535 NH1 ARG A1367 -11.901 9.973 1.819 1.00 25.53 N ATOM 536 NH2 ARG A1367 -11.584 12.128 1.149 1.00 23.78 N ATOM 537 HE ARG A1367 -9.869 9.467 0.432 1.00 0.00 H ATOM 538 HH12 ARG A1367 -12.724 10.276 2.378 1.00 0.00 H ATOM 539 HH11 ARG A1367 -11.643 8.966 1.777 1.00 0.00 H ATOM 540 HH22 ARG A1367 -12.409 12.420 1.711 1.00 0.00 H ATOM 541 HH21 ARG A1367 -11.072 12.828 0.575 1.00 0.00 H ATOM 542 H ARG A1367 -9.452 8.046 -3.914 1.00 0.00 H ATOM 543 N GLU A1368 -7.041 6.930 -1.884 1.00 20.50 N ATOM 544 CA GLU A1368 -6.089 6.073 -1.163 1.00 21.86 C ATOM 545 C GLU A1368 -4.939 5.611 -2.049 1.00 21.53 C ATOM 546 O GLU A1368 -3.781 5.594 -1.616 1.00 22.12 O ATOM 547 CB GLU A1368 -6.814 4.869 -0.544 1.00 24.35 C ATOM 548 CG GLU A1368 -5.936 3.896 0.211 1.00 27.44 C ATOM 549 CD GLU A1368 -5.167 4.479 1.377 1.00 30.35 C ATOM 550 OE1 GLU A1368 -5.538 5.525 1.977 1.00 32.04 O ATOM 551 OE2 GLU A1368 -4.146 3.839 1.726 1.00 35.24 O ATOM 552 H GLU A1368 -7.977 6.555 -2.140 1.00 0.00 H ATOM 553 N THR A1369 -5.241 5.291 -3.302 1.00 21.27 N ATOM 554 CA THR A1369 -4.189 4.910 -4.266 1.00 21.52 C ATOM 555 C THR A1369 -3.174 6.021 -4.444 1.00 21.06 C ATOM 556 O THR A1369 -1.976 5.783 -4.450 1.00 21.46 O ATOM 557 CB THR A1369 -4.809 4.497 -5.604 1.00 21.76 C ATOM 558 OG1 THR A1369 -5.695 3.402 -5.349 1.00 23.10 O ATOM 559 CG2 THR A1369 -3.755 4.051 -6.583 1.00 22.40 C ATOM 560 HG1 THR A1369 -6.112 3.112 -6.199 1.00 0.00 H ATOM 561 H THR A1369 -6.234 5.309 -3.609 1.00 0.00 H ATOM 562 N LEU A1370 -3.649 7.274 -4.508 1.00 20.21 N ATOM 563 CA LEU A1370 -2.764 8.418 -4.612 1.00 20.37 C ATOM 564 C LEU A1370 -1.940 8.586 -3.333 1.00 21.20 C ATOM 565 O LEU A1370 -0.729 8.739 -3.408 1.00 22.53 O ATOM 566 CB LEU A1370 -3.590 9.681 -4.924 1.00 19.76 C ATOM 567 CG LEU A1370 -2.796 10.995 -5.009 1.00 19.17 C ATOM 568 CD1 LEU A1370 -1.897 11.002 -6.235 1.00 19.52 C ATOM 569 CD2 LEU A1370 -3.733 12.179 -5.056 1.00 18.87 C ATOM 570 H LEU A1370 -4.677 7.429 -4.482 1.00 0.00 H ATOM 571 N GLU A1371 -2.607 8.537 -2.189 1.00 21.69 N ATOM 572 CA GLU A1371 -1.916 8.674 -0.900 1.00 23.08 C ATOM 573 C GLU A1371 -0.847 7.593 -0.730 1.00 23.94 C ATOM 574 O GLU A1371 0.207 7.876 -0.172 1.00 24.42 O ATOM 575 CB GLU A1371 -2.924 8.585 0.240 1.00 24.33 C ATOM 576 CG GLU A1371 -2.353 8.748 1.652 1.00 26.49 C ATOM 577 CD GLU A1371 -1.528 9.996 1.829 1.00 28.24 C ATOM 578 OE1 GLU A1371 -1.891 11.063 1.256 1.00 29.65 O ATOM 579 OE2 GLU A1371 -0.495 9.952 2.567 1.00 30.04 O ATOM 580 H GLU A1371 -3.638 8.399 -2.204 1.00 0.00 H ATOM 581 N ALA A1372 -1.143 6.377 -1.149 1.00 25.48 N ATOM 582 CA ALA A1372 -0.170 5.257 -1.059 1.00 27.43 C ATOM 583 C ALA A1372 1.013 5.386 -2.030 1.00 29.67 C ATOM 584 O ALA A1372 1.941 4.588 -1.964 1.00 31.99 O ATOM 585 CB ALA A1372 -0.880 3.947 -1.287 1.00 28.88 C ATOM 586 H ALA A1372 -2.084 6.197 -1.554 1.00 0.00 H ATOM 587 N GLY A1373 0.984 6.344 -2.967 1.00 28.97 N ATOM 588 CA GLY A1373 2.037 6.492 -3.987 1.00 27.96 C ATOM 589 C GLY A1373 1.965 5.545 -5.175 1.00 28.71 C ATOM 590 O GLY A1373 2.945 5.408 -5.916 1.00 30.50 O ATOM 591 H GLY A1373 0.185 7.010 -2.974 1.00 0.00 H ATOM 592 N ASN A1374 0.798 4.949 -5.399 1.00 27.90 N ATOM 593 CA ASN A1374 0.611 3.912 -6.434 1.00 28.79 C ATOM 594 C ASN A1374 0.099 4.409 -7.822 1.00 27.22 C ATOM 595 O ASN A1374 -0.261 3.606 -8.689 1.00 27.49 O ATOM 596 CB ASN A1374 -0.308 2.831 -5.874 1.00 30.29 C ATOM 597 CG ASN A1374 0.331 2.042 -4.740 1.00 33.33 C ATOM 598 OD1 ASN A1374 1.514 1.777 -4.762 1.00 36.29 O ATOM 599 ND2 ASN A1374 -0.458 1.695 -3.750 1.00 35.47 N ATOM 600 HD22 ASN A1374 -1.467 1.946 -3.777 1.00 0.00 H ATOM 601 HD21 ASN A1374 -0.074 1.170 -2.939 1.00 0.00 H ATOM 602 H ASN A1374 -0.020 5.225 -4.819 1.00 0.00 H ATOM 603 N TYR A1375 0.114 5.725 -8.062 1.00 24.94 N ATOM 604 CA TYR A1375 -0.073 6.268 -9.416 1.00 23.32 C ATOM 605 C TYR A1375 1.277 6.838 -9.885 1.00 24.79 C ATOM 606 O TYR A1375 1.899 7.614 -9.170 1.00 25.49 O ATOM 607 CB TYR A1375 -1.126 7.406 -9.411 1.00 21.74 C ATOM 608 CG TYR A1375 -2.549 6.933 -9.205 1.00 20.13 C ATOM 609 CD1 TYR A1375 -3.123 5.986 -10.044 1.00 19.84 C ATOM 610 CD2 TYR A1375 -3.365 7.524 -8.236 1.00 19.89 C ATOM 611 CE1 TYR A1375 -4.415 5.561 -9.850 1.00 19.28 C ATOM 612 CE2 TYR A1375 -4.663 7.116 -8.038 1.00 19.56 C ATOM 613 CZ TYR A1375 -5.205 6.145 -8.867 1.00 19.55 C ATOM 614 OH TYR A1375 -6.486 5.727 -8.664 1.00 19.57 O ATOM 615 HH TYR A1375 -6.717 5.037 -9.335 1.00 0.00 H ATOM 616 H TYR A1375 0.262 6.382 -7.270 1.00 0.00 H ATOM 617 N GLU A1376 1.715 6.402 -11.063 1.00 25.94 N ATOM 618 CA GLU A1376 2.961 6.830 -11.658 1.00 27.91 C ATOM 619 C GLU A1376 2.847 8.179 -12.326 1.00 25.52 C ATOM 620 O GLU A1376 3.861 8.850 -12.495 1.00 27.17 O ATOM 621 CB GLU A1376 3.466 5.833 -12.701 1.00 31.72 C ATOM 622 CG GLU A1376 4.007 4.524 -12.168 1.00 37.08 C ATOM 623 CD GLU A1376 4.571 3.673 -13.306 1.00 42.35 C ATOM 624 OE1 GLU A1376 5.522 4.154 -13.990 1.00 45.71 O ATOM 625 OE2 GLU A1376 4.049 2.544 -13.547 1.00 47.30 O ATOM 626 H GLU A1376 1.130 5.717 -11.583 1.00 0.00 H ATOM 627 N SER A1377 1.624 8.603 -12.657 1.00 23.51 N ATOM 628 CA SER A1377 1.404 9.874 -13.363 1.00 22.37 C ATOM 629 C SER A1377 -0.032 10.290 -13.134 1.00 20.56 C ATOM 630 O SER A1377 -0.867 9.450 -12.745 1.00 20.45 O ATOM 631 CB SER A1377 1.608 9.680 -14.873 1.00 23.01 C ATOM 632 OG SER A1377 0.589 8.838 -15.421 1.00 23.99 O ATOM 633 HG SER A1377 -0.297 9.253 -15.269 1.00 0.00 H ATOM 634 H SER A1377 0.802 8.016 -12.408 1.00 0.00 H ATOM 635 N PRO A1378 -0.339 11.567 -13.426 1.00 20.25 N ATOM 636 CA PRO A1378 -1.736 11.980 -13.329 1.00 19.51 C ATOM 637 C PRO A1378 -2.604 11.320 -14.414 1.00 19.94 C ATOM 638 O PRO A1378 -3.786 11.154 -14.197 1.00 19.38 O ATOM 639 CB PRO A1378 -1.654 13.504 -13.469 1.00 19.79 C ATOM 640 CG PRO A1378 -0.431 13.804 -14.273 1.00 20.38 C ATOM 641 CD PRO A1378 0.539 12.694 -13.829 1.00 20.10 C ATOM 642 N MET A1379 -2.023 10.828 -15.501 1.00 21.36 N ATOM 643 CA MET A1379 -2.816 10.092 -16.516 1.00 21.96 C ATOM 644 C MET A1379 -3.356 8.794 -15.899 1.00 21.72 C ATOM 645 O MET A1379 -4.494 8.404 -16.159 1.00 22.50 O ATOM 646 CB MET A1379 -2.001 9.792 -17.771 1.00 22.88 C ATOM 647 CG MET A1379 -1.579 11.035 -18.544 1.00 23.87 C ATOM 648 SD MET A1379 -0.119 11.909 -17.955 1.00 24.87 S ATOM 649 CE MET A1379 1.160 10.856 -18.625 1.00 25.55 C ATOM 650 H MET A1379 -1.001 10.960 -15.643 1.00 0.00 H ATOM 651 N GLU A1380 -2.552 8.119 -15.058 1.00 21.50 N ATOM 652 CA GLU A1380 -3.032 6.911 -14.365 1.00 21.85 C ATOM 653 C GLU A1380 -4.202 7.190 -13.440 1.00 20.07 C ATOM 654 O GLU A1380 -5.163 6.408 -13.391 1.00 20.08 O ATOM 655 CB GLU A1380 -1.919 6.211 -13.568 1.00 24.01 C ATOM 656 CG GLU A1380 -0.826 5.606 -14.442 1.00 27.21 C ATOM 657 CD GLU A1380 0.077 4.607 -13.716 1.00 30.26 C ATOM 658 OE1 GLU A1380 0.106 4.534 -12.456 1.00 32.33 O ATOM 659 OE2 GLU A1380 0.794 3.871 -14.449 1.00 34.44 O ATOM 660 H GLU A1380 -1.581 8.454 -14.895 1.00 0.00 H ATOM 661 N LEU A1381 -4.128 8.302 -12.691 1.00 18.49 N ATOM 662 CA LEU A1381 -5.207 8.684 -11.806 1.00 18.44 C ATOM 663 C LEU A1381 -6.456 9.020 -12.642 1.00 18.68 C ATOM 664 O LEU A1381 -7.572 8.620 -12.299 1.00 17.61 O ATOM 665 CB LEU A1381 -4.774 9.858 -10.928 1.00 18.35 C ATOM 666 CG LEU A1381 -5.872 10.437 -10.027 1.00 17.98 C ATOM 667 CD1 LEU A1381 -5.200 10.916 -8.750 1.00 18.81 C ATOM 668 CD2 LEU A1381 -6.687 11.550 -10.702 1.00 18.40 C ATOM 669 H LEU A1381 -3.279 8.900 -12.748 1.00 0.00 H ATOM 670 N CYS A1382 -6.221 9.740 -13.746 1.00 18.85 N ATOM 671 CA CYS A1382 -7.311 10.131 -14.616 1.00 20.25 C ATOM 672 C CYS A1382 -8.028 8.885 -15.210 1.00 20.15 C ATOM 673 O CYS A1382 -9.265 8.867 -15.308 1.00 20.23 O ATOM 674 CB CYS A1382 -6.787 11.118 -15.683 1.00 20.32 C ATOM 675 SG CYS A1382 -8.061 11.763 -16.783 1.00 22.45 S ATOM 676 H CYS A1382 -5.248 10.021 -13.981 1.00 0.00 H ATOM 677 N LYS A1383 -7.291 7.825 -15.534 1.00 20.65 N ATOM 678 CA LYS A1383 -7.873 6.587 -16.048 1.00 21.65 C ATOM 679 C LYS A1383 -8.817 5.993 -15.007 1.00 20.40 C ATOM 680 O LYS A1383 -9.919 5.558 -15.336 1.00 21.36 O ATOM 681 CB LYS A1383 -6.770 5.604 -16.364 1.00 25.69 C ATOM 682 CG LYS A1383 -7.216 4.307 -17.021 1.00 29.04 C ATOM 683 CD LYS A1383 -6.003 3.554 -17.577 1.00 32.32 C ATOM 684 CE LYS A1383 -5.587 4.012 -18.964 1.00 35.78 C ATOM 685 NZ LYS A1383 -6.397 3.337 -20.029 1.00 39.73 N ATOM 686 HZ1 LYS A1383 -6.261 2.308 -19.966 1.00 0.00 H ATOM 687 HZ2 LYS A1383 -7.403 3.564 -19.894 1.00 0.00 H ATOM 688 HZ3 LYS A1383 -6.087 3.672 -20.963 1.00 0.00 H ATOM 689 H LYS A1383 -6.259 7.880 -15.417 1.00 0.00 H ATOM 690 N ASP A1384 -8.384 5.947 -13.747 1.00 19.17 N ATOM 691 CA ASP A1384 -9.271 5.413 -12.740 1.00 19.40 C ATOM 692 C ASP A1384 -10.508 6.277 -12.501 1.00 17.86 C ATOM 693 O ASP A1384 -11.594 5.730 -12.291 1.00 18.27 O ATOM 694 CB ASP A1384 -8.522 5.215 -11.399 1.00 19.56 C ATOM 695 CG ASP A1384 -7.830 3.847 -11.271 1.00 21.52 C ATOM 696 OD1 ASP A1384 -8.105 2.911 -12.068 1.00 25.66 O ATOM 697 OD2 ASP A1384 -7.071 3.717 -10.272 1.00 21.93 O ATOM 698 H ASP A1384 -7.433 6.286 -13.496 1.00 0.00 H ATOM 699 N VAL A1385 -10.372 7.607 -12.523 1.00 17.89 N ATOM 700 CA VAL A1385 -11.540 8.473 -12.342 1.00 17.11 C ATOM 701 C VAL A1385 -12.534 8.262 -13.512 1.00 17.35 C ATOM 702 O VAL A1385 -13.753 8.177 -13.310 1.00 17.52 O ATOM 703 CB VAL A1385 -11.177 9.946 -12.185 1.00 16.72 C ATOM 704 CG1 VAL A1385 -12.421 10.803 -12.171 1.00 17.12 C ATOM 705 CG2 VAL A1385 -10.405 10.132 -10.866 1.00 16.90 C ATOM 706 H VAL A1385 -9.433 8.029 -12.669 1.00 0.00 H ATOM 707 N ARG A1386 -12.001 8.214 -14.728 1.00 18.28 N ATOM 708 CA ARG A1386 -12.853 7.972 -15.909 1.00 18.37 C ATOM 709 C ARG A1386 -13.589 6.662 -15.800 1.00 19.14 C ATOM 710 O ARG A1386 -14.721 6.541 -16.320 1.00 20.67 O ATOM 711 CB ARG A1386 -12.051 8.096 -17.187 1.00 18.29 C ATOM 712 CG ARG A1386 -11.681 9.522 -17.490 1.00 19.00 C ATOM 713 CD ARG A1386 -10.751 9.676 -18.673 1.00 19.15 C ATOM 714 NE ARG A1386 -10.536 11.062 -19.024 1.00 19.87 N ATOM 715 CZ ARG A1386 -9.605 11.508 -19.855 1.00 20.34 C ATOM 716 NH1 ARG A1386 -8.738 10.688 -20.411 1.00 21.04 N ATOM 717 NH2 ARG A1386 -9.534 12.816 -20.082 1.00 21.03 N ATOM 718 HE ARG A1386 -11.164 11.767 -18.588 1.00 0.00 H ATOM 719 HH12 ARG A1386 -8.015 11.058 -21.061 1.00 0.00 H ATOM 720 HH11 ARG A1386 -8.776 9.670 -20.201 1.00 0.00 H ATOM 721 HH22 ARG A1386 -8.813 13.193 -20.730 1.00 0.00 H ATOM 722 HH21 ARG A1386 -10.200 13.462 -19.612 1.00 0.00 H ATOM 723 H ARG A1386 -10.977 8.348 -14.849 1.00 0.00 H ATOM 724 N LEU A1387 -12.977 5.654 -15.173 1.00 19.37 N ATOM 725 CA LEU A1387 -13.644 4.365 -14.928 1.00 19.56 C ATOM 726 C LEU A1387 -14.857 4.524 -14.009 1.00 19.53 C ATOM 727 O LEU A1387 -15.875 3.828 -14.170 1.00 19.79 O ATOM 728 CB LEU A1387 -12.616 3.405 -14.353 1.00 21.48 C ATOM 729 CG LEU A1387 -13.052 1.998 -13.995 1.00 21.93 C ATOM 730 CD1 LEU A1387 -13.628 1.283 -15.222 1.00 22.84 C ATOM 731 CD2 LEU A1387 -11.845 1.263 -13.437 1.00 22.17 C ATOM 732 H LEU A1387 -11.998 5.784 -14.847 1.00 0.00 H ATOM 733 N ILE A1388 -14.765 5.402 -13.002 1.00 19.17 N ATOM 734 CA ILE A1388 -15.918 5.680 -12.156 1.00 19.37 C ATOM 735 C ILE A1388 -17.121 6.092 -13.022 1.00 19.86 C ATOM 736 O ILE A1388 -18.230 5.559 -12.879 1.00 21.06 O ATOM 737 CB ILE A1388 -15.619 6.787 -11.104 1.00 19.63 C ATOM 738 CG1 ILE A1388 -14.453 6.347 -10.173 1.00 19.68 C ATOM 739 CG2 ILE A1388 -16.889 7.119 -10.317 1.00 19.64 C ATOM 740 CD1 ILE A1388 -13.947 7.397 -9.206 1.00 20.16 C ATOM 741 H ILE A1388 -13.864 5.889 -12.823 1.00 0.00 H ATOM 742 N PHE A1389 -16.882 6.958 -13.988 1.00 20.34 N ATOM 743 CA PHE A1389 -17.953 7.506 -14.798 1.00 21.28 C ATOM 744 C PHE A1389 -18.412 6.592 -15.926 1.00 21.70 C ATOM 745 O PHE A1389 -19.617 6.523 -16.205 1.00 22.38 O ATOM 746 CB PHE A1389 -17.547 8.850 -15.348 1.00 20.83 C ATOM 747 CG PHE A1389 -17.320 9.878 -14.264 1.00 21.05 C ATOM 748 CD1 PHE A1389 -18.341 10.243 -13.394 1.00 20.93 C ATOM 749 CD2 PHE A1389 -16.088 10.506 -14.115 1.00 21.60 C ATOM 750 CE1 PHE A1389 -18.134 11.171 -12.394 1.00 22.75 C ATOM 751 CE2 PHE A1389 -15.882 11.454 -13.141 1.00 21.57 C ATOM 752 CZ PHE A1389 -16.905 11.771 -12.260 1.00 21.64 C ATOM 753 H PHE A1389 -15.903 7.255 -14.173 1.00 0.00 H ATOM 754 N SER A1390 -17.496 5.807 -16.470 1.00 21.59 N ATOM 755 CA SER A1390 -17.890 4.826 -17.483 1.00 22.86 C ATOM 756 C SER A1390 -18.653 3.705 -16.809 1.00 22.72 C ATOM 757 O SER A1390 -19.618 3.191 -17.407 1.00 24.50 O ATOM 758 CB SER A1390 -16.690 4.312 -18.294 1.00 24.54 C ATOM 759 OG SER A1390 -15.782 3.536 -17.570 1.00 25.33 O ATOM 760 HG SER A1390 -16.245 2.739 -17.209 1.00 0.00 H ATOM 761 H SER A1390 -16.501 5.887 -16.179 1.00 0.00 H ATOM 762 N ASN A1391 -18.314 3.335 -15.563 1.00 22.25 N ATOM 763 CA ASN A1391 -19.072 2.302 -14.858 1.00 23.32 C ATOM 764 C ASN A1391 -20.478 2.826 -14.583 1.00 23.70 C ATOM 765 O ASN A1391 -21.459 2.051 -14.693 1.00 25.82 O ATOM 766 CB ASN A1391 -18.439 1.957 -13.520 1.00 23.57 C ATOM 767 CG ASN A1391 -17.212 1.095 -13.632 1.00 23.40 C ATOM 768 OD1 ASN A1391 -16.909 0.505 -14.658 1.00 23.43 O ATOM 769 ND2 ASN A1391 -16.491 1.001 -12.508 1.00 23.28 N ATOM 770 HD22 ASN A1391 -16.785 1.521 -11.657 1.00 0.00 H ATOM 771 HD21 ASN A1391 -15.637 0.408 -12.486 1.00 0.00 H ATOM 772 H ASN A1391 -17.504 3.788 -15.095 1.00 0.00 H ATOM 773 N SER A1392 -20.629 4.095 -14.231 1.00 23.71 N ATOM 774 CA SER A1392 -21.943 4.656 -13.936 1.00 24.25 C ATOM 775 C SER A1392 -22.808 4.642 -15.203 1.00 26.20 C ATOM 776 O SER A1392 -23.959 4.272 -15.143 1.00 26.17 O ATOM 777 CB SER A1392 -21.861 6.073 -13.377 1.00 23.94 C ATOM 778 OG SER A1392 -23.168 6.549 -13.033 1.00 25.36 O ATOM 779 HG SER A1392 -23.740 6.553 -13.841 1.00 0.00 H ATOM 780 H SER A1392 -19.790 4.706 -14.163 1.00 0.00 H ATOM 781 N LYS A1393 -22.223 4.980 -16.342 1.00 26.23 N ATOM 782 CA LYS A1393 -22.949 4.999 -17.625 1.00 27.93 C ATOM 783 C LYS A1393 -23.441 3.598 -17.989 1.00 28.13 C ATOM 784 O LYS A1393 -24.477 3.468 -18.641 1.00 30.92 O ATOM 785 CB LYS A1393 -22.089 5.581 -18.737 1.00 28.66 C ATOM 786 CG LYS A1393 -22.892 5.900 -20.023 1.00 31.15 C ATOM 787 CD LYS A1393 -22.142 6.764 -21.024 1.00 33.35 C ATOM 788 CE LYS A1393 -23.066 7.304 -22.110 1.00 34.89 C ATOM 789 NZ LYS A1393 -22.388 8.128 -23.163 1.00 37.19 N ATOM 790 HZ1 LYS A1393 -21.935 8.952 -22.718 1.00 0.00 H ATOM 791 HZ2 LYS A1393 -21.668 7.551 -23.642 1.00 0.00 H ATOM 792 HZ3 LYS A1393 -23.093 8.451 -23.856 1.00 0.00 H ATOM 793 H LYS A1393 -21.216 5.241 -16.331 1.00 0.00 H ATOM 794 N ALA A1394 -22.698 2.549 -17.624 1.00 28.04 N ATOM 795 CA ALA A1394 -23.102 1.168 -17.922 1.00 29.42 C ATOM 796 C ALA A1394 -24.187 0.741 -16.960 1.00 29.94 C ATOM 797 O ALA A1394 -25.174 0.082 -17.356 1.00 31.78 O ATOM 798 CB ALA A1394 -21.894 0.227 -17.863 1.00 29.49 C ATOM 799 H ALA A1394 -21.807 2.715 -17.114 1.00 0.00 H ATOM 800 N TYR A1395 -24.052 1.077 -15.691 1.00 29.60 N ATOM 801 CA TYR A1395 -25.001 0.590 -14.675 1.00 29.95 C ATOM 802 C TYR A1395 -26.316 1.388 -14.650 1.00 30.54 C ATOM 803 O TYR A1395 -27.412 0.832 -14.331 1.00 33.17 O ATOM 804 CB TYR A1395 -24.355 0.550 -13.281 1.00 30.88 C ATOM 805 CG TYR A1395 -25.202 -0.233 -12.315 1.00 32.00 C ATOM 806 CD1 TYR A1395 -25.230 -1.628 -12.366 1.00 32.59 C ATOM 807 CD2 TYR A1395 -26.024 0.411 -11.394 1.00 32.68 C ATOM 808 CE1 TYR A1395 -26.054 -2.363 -11.525 1.00 33.61 C ATOM 809 CE2 TYR A1395 -26.837 -0.321 -10.523 1.00 34.15 C ATOM 810 CZ TYR A1395 -26.833 -1.703 -10.591 1.00 34.67 C ATOM 811 OH TYR A1395 -27.649 -2.459 -9.776 1.00 36.53 O ATOM 812 HH TYR A1395 -27.507 -3.420 -9.968 1.00 0.00 H ATOM 813 H TYR A1395 -23.265 1.694 -15.404 1.00 0.00 H ATOM 814 N THR A1396 -26.216 2.675 -14.947 1.00 30.31 N ATOM 815 CA THR A1396 -27.317 3.592 -14.982 1.00 29.99 C ATOM 816 C THR A1396 -27.279 4.265 -16.361 1.00 31.37 C ATOM 817 O THR A1396 -26.902 5.412 -16.502 1.00 30.82 O ATOM 818 CB THR A1396 -27.197 4.613 -13.819 1.00 30.38 C ATOM 819 OG1 THR A1396 -27.134 3.891 -12.588 1.00 32.77 O ATOM 820 CG2 THR A1396 -28.358 5.589 -13.806 1.00 30.59 C ATOM 821 HG1 THR A1396 -26.345 3.294 -12.597 1.00 0.00 H ATOM 822 H THR A1396 -25.271 3.047 -15.171 1.00 0.00 H ATOM 823 N PRO A1397 -27.668 3.522 -17.421 1.00 33.78 N ATOM 824 CA PRO A1397 -27.584 4.045 -18.794 1.00 35.43 C ATOM 825 C PRO A1397 -28.677 5.053 -19.180 1.00 35.99 C ATOM 826 O PRO A1397 -28.488 5.779 -20.157 1.00 35.90 O ATOM 827 CB PRO A1397 -27.697 2.781 -19.645 1.00 36.02 C ATOM 828 CG PRO A1397 -28.558 1.896 -18.815 1.00 36.20 C ATOM 829 CD PRO A1397 -28.086 2.113 -17.409 1.00 35.22 C ATOM 830 N SER A1398 -29.769 5.129 -18.417 1.00 36.99 N ATOM 831 CA SER A1398 -30.911 5.968 -18.795 1.00 37.79 C ATOM 832 C SER A1398 -30.676 7.439 -18.533 1.00 38.34 C ATOM 833 O SER A1398 -30.411 7.823 -17.400 1.00 34.80 O ATOM 834 CB SER A1398 -32.175 5.554 -18.040 1.00 38.51 C ATOM 835 OG SER A1398 -33.240 6.410 -18.400 1.00 39.72 O ATOM 836 HG SER A1398 -34.058 6.141 -17.911 1.00 0.00 H ATOM 837 H SER A1398 -29.811 4.581 -17.534 1.00 0.00 H ATOM 838 N LYS A1399 -30.849 8.254 -19.570 1.00 39.26 N ATOM 839 CA LYS A1399 -30.686 9.702 -19.494 1.00 42.14 C ATOM 840 C LYS A1399 -31.800 10.347 -18.648 1.00 41.44 C ATOM 841 O LYS A1399 -31.624 11.468 -18.182 1.00 43.95 O ATOM 842 CB LYS A1399 -30.633 10.313 -20.906 1.00 44.71 C ATOM 843 CG LYS A1399 -29.487 9.757 -21.745 1.00 46.47 C ATOM 844 CD LYS A1399 -29.494 10.238 -23.183 1.00 49.55 C ATOM 845 CE LYS A1399 -28.714 9.293 -24.104 1.00 51.13 C ATOM 846 NZ LYS A1399 -27.402 8.834 -23.541 1.00 50.46 N ATOM 847 HZ1 LYS A1399 -26.795 9.659 -23.363 1.00 0.00 H ATOM 848 HZ2 LYS A1399 -27.568 8.325 -22.649 1.00 0.00 H ATOM 849 HZ3 LYS A1399 -26.937 8.200 -24.222 1.00 0.00 H ATOM 850 H LYS A1399 -31.115 7.836 -20.485 1.00 0.00 H ATOM 851 N ARG A1400 -32.917 9.631 -18.467 1.00 42.85 N ATOM 852 CA ARG A1400 -33.984 9.990 -17.521 1.00 41.54 C ATOM 853 C ARG A1400 -33.499 10.048 -16.051 1.00 38.73 C ATOM 854 O ARG A1400 -34.052 10.793 -15.262 1.00 38.01 O ATOM 855 CB ARG A1400 -35.143 8.964 -17.534 1.00 43.35 C ATOM 856 CG ARG A1400 -35.881 8.640 -18.833 1.00 44.97 C ATOM 857 CD ARG A1400 -36.941 7.547 -18.597 1.00 45.12 C ATOM 858 NE ARG A1400 -37.824 7.360 -19.750 1.00 45.19 N ATOM 859 CZ ARG A1400 -37.675 6.475 -20.744 1.00 45.05 C ATOM 860 NH1 ARG A1400 -36.680 5.591 -20.772 1.00 44.09 N ATOM 861 NH2 ARG A1400 -38.561 6.465 -21.744 1.00 45.94 N ATOM 862 HE ARG A1400 -38.656 7.981 -19.803 1.00 0.00 H ATOM 863 HH12 ARG A1400 -36.602 4.921 -21.564 1.00 0.00 H ATOM 864 HH11 ARG A1400 -35.981 5.570 -20.002 1.00 0.00 H ATOM 865 HH22 ARG A1400 -38.458 5.784 -22.523 1.00 0.00 H ATOM 866 HH21 ARG A1400 -39.353 7.139 -21.744 1.00 0.00 H ATOM 867 H ARG A1400 -33.038 8.766 -19.031 1.00 0.00 H ATOM 868 N SER A1401 -32.525 9.212 -15.684 1.00 35.14 N ATOM 869 CA SER A1401 -32.124 9.039 -14.280 1.00 31.32 C ATOM 870 C SER A1401 -31.404 10.237 -13.702 1.00 30.58 C ATOM 871 O SER A1401 -30.439 10.701 -14.274 1.00 29.77 O ATOM 872 CB SER A1401 -31.204 7.852 -14.112 1.00 30.33 C ATOM 873 OG SER A1401 -30.703 7.775 -12.785 1.00 29.76 O ATOM 874 HG SER A1401 -30.105 6.990 -12.704 1.00 0.00 H ATOM 875 H SER A1401 -32.032 8.663 -16.417 1.00 0.00 H ATOM 876 N ARG A1402 -31.860 10.711 -12.549 1.00 29.73 N ATOM 877 CA ARG A1402 -31.106 11.766 -11.864 1.00 30.61 C ATOM 878 C ARG A1402 -29.675 11.371 -11.521 1.00 30.25 C ATOM 879 O ARG A1402 -28.833 12.265 -11.397 1.00 29.04 O ATOM 880 CB ARG A1402 -31.831 12.230 -10.620 1.00 31.84 C ATOM 881 CG ARG A1402 -31.896 11.226 -9.486 1.00 33.33 C ATOM 882 CD ARG A1402 -32.913 11.706 -8.449 1.00 35.46 C ATOM 883 NE ARG A1402 -34.260 11.792 -9.013 1.00 37.53 N ATOM 884 CZ ARG A1402 -35.308 12.385 -8.428 1.00 40.16 C ATOM 885 NH1 ARG A1402 -35.207 12.955 -7.232 1.00 41.55 N ATOM 886 NH2 ARG A1402 -36.476 12.397 -9.052 1.00 43.09 N ATOM 887 HE ARG A1402 -34.416 11.357 -9.945 1.00 0.00 H ATOM 888 HH12 ARG A1402 -36.037 13.409 -6.800 1.00 0.00 H ATOM 889 HH11 ARG A1402 -34.298 12.947 -6.727 1.00 0.00 H ATOM 890 HH22 ARG A1402 -37.298 12.854 -8.608 1.00 0.00 H ATOM 891 HH21 ARG A1402 -36.571 11.949 -9.986 1.00 0.00 H ATOM 892 H ARG A1402 -32.740 10.339 -12.137 1.00 0.00 H ATOM 893 N ILE A1403 -29.399 10.078 -11.334 1.00 28.45 N ATOM 894 CA ILE A1403 -28.051 9.575 -11.075 1.00 27.08 C ATOM 895 C ILE A1403 -27.193 9.708 -12.329 1.00 26.16 C ATOM 896 O ILE A1403 -26.011 10.106 -12.266 1.00 24.96 O ATOM 897 CB ILE A1403 -28.061 8.116 -10.564 1.00 27.61 C ATOM 898 CG1 ILE A1403 -28.874 7.990 -9.262 1.00 29.92 C ATOM 899 CG2 ILE A1403 -26.650 7.599 -10.398 1.00 26.99 C ATOM 900 CD1 ILE A1403 -28.441 8.879 -8.115 1.00 31.66 C ATOM 901 H ILE A1403 -30.182 9.395 -11.375 1.00 0.00 H ATOM 902 N TYR A1404 -27.791 9.436 -13.486 1.00 25.06 N ATOM 903 CA TYR A1404 -27.116 9.723 -14.774 1.00 25.67 C ATOM 904 C TYR A1404 -26.694 11.204 -14.886 1.00 25.61 C ATOM 905 O TYR A1404 -25.562 11.506 -15.247 1.00 24.29 O ATOM 906 CB TYR A1404 -28.014 9.304 -15.976 1.00 27.31 C ATOM 907 CG TYR A1404 -27.435 9.532 -17.374 1.00 28.45 C ATOM 908 CD1 TYR A1404 -27.378 10.816 -17.924 1.00 29.98 C ATOM 909 CD2 TYR A1404 -26.935 8.483 -18.141 1.00 30.04 C ATOM 910 CE1 TYR A1404 -26.859 11.048 -19.198 1.00 32.18 C ATOM 911 CE2 TYR A1404 -26.394 8.710 -19.422 1.00 30.94 C ATOM 912 CZ TYR A1404 -26.345 9.999 -19.938 1.00 31.99 C ATOM 913 OH TYR A1404 -25.838 10.257 -21.221 1.00 35.08 O ATOM 914 HH TYR A1404 -25.887 11.229 -21.405 1.00 0.00 H ATOM 915 H TYR A1404 -28.743 9.017 -13.487 1.00 0.00 H ATOM 916 N SER A1405 -27.599 12.106 -14.550 1.00 26.68 N ATOM 917 CA SER A1405 -27.346 13.540 -14.625 1.00 27.32 C ATOM 918 C SER A1405 -26.252 13.957 -13.671 1.00 26.56 C ATOM 919 O SER A1405 -25.415 14.788 -14.035 1.00 26.57 O ATOM 920 CB SER A1405 -28.636 14.322 -14.341 1.00 29.36 C ATOM 921 OG SER A1405 -29.544 14.118 -15.412 1.00 33.85 O ATOM 922 HG SER A1405 -30.379 14.620 -15.235 1.00 0.00 H ATOM 923 H SER A1405 -28.529 11.780 -14.219 1.00 0.00 H ATOM 924 N MET A1406 -26.253 13.363 -12.481 1.00 26.66 N ATOM 925 CA MET A1406 -25.201 13.605 -11.470 1.00 27.02 C ATOM 926 C MET A1406 -23.822 13.253 -11.989 1.00 25.77 C ATOM 927 O MET A1406 -22.858 14.037 -11.844 1.00 25.11 O ATOM 928 CB MET A1406 -25.463 12.801 -10.185 1.00 29.94 C ATOM 929 CG MET A1406 -26.646 13.323 -9.401 1.00 33.65 C ATOM 930 SD MET A1406 -27.063 12.277 -7.984 1.00 39.49 S ATOM 931 CE MET A1406 -25.588 12.718 -7.134 1.00 34.64 C ATOM 932 H MET A1406 -27.023 12.703 -12.253 1.00 0.00 H ATOM 933 N SER A1407 -23.718 12.082 -12.587 1.00 23.42 N ATOM 934 CA SER A1407 -22.495 11.549 -13.130 1.00 24.53 C ATOM 935 C SER A1407 -21.995 12.465 -14.246 1.00 23.36 C ATOM 936 O SER A1407 -20.821 12.761 -14.330 1.00 21.52 O ATOM 937 CB SER A1407 -22.778 10.149 -13.686 1.00 26.20 C ATOM 938 OG SER A1407 -21.594 9.530 -14.140 1.00 28.37 O ATOM 939 HG SER A1407 -21.190 10.079 -14.858 1.00 0.00 H ATOM 940 H SER A1407 -24.578 11.504 -12.672 1.00 0.00 H ATOM 941 N LEU A1408 -22.890 12.882 -15.146 1.00 24.17 N ATOM 942 CA LEU A1408 -22.516 13.764 -16.242 1.00 25.88 C ATOM 943 C LEU A1408 -21.970 15.090 -15.733 1.00 24.08 C ATOM 944 O LEU A1408 -20.959 15.554 -16.249 1.00 23.43 O ATOM 945 CB LEU A1408 -23.691 14.101 -17.157 1.00 28.64 C ATOM 946 CG LEU A1408 -24.000 13.267 -18.387 1.00 33.15 C ATOM 947 CD1 LEU A1408 -25.032 14.035 -19.191 1.00 34.23 C ATOM 948 CD2 LEU A1408 -22.802 13.010 -19.272 1.00 34.58 C ATOM 949 H LEU A1408 -23.878 12.569 -15.061 1.00 0.00 H ATOM 950 N ARG A1409 -22.655 15.709 -14.771 1.00 23.09 N ATOM 951 CA ARG A1409 -22.200 16.979 -14.198 1.00 23.35 C ATOM 952 C ARG A1409 -20.832 16.829 -13.542 1.00 21.83 C ATOM 953 O ARG A1409 -19.930 17.659 -13.774 1.00 21.63 O ATOM 954 CB ARG A1409 -23.185 17.541 -13.161 1.00 23.52 C ATOM 955 CG ARG A1409 -24.491 18.041 -13.754 1.00 25.27 C ATOM 956 CD ARG A1409 -25.273 18.870 -12.755 1.00 25.76 C ATOM 957 NE ARG A1409 -25.671 18.077 -11.608 1.00 26.13 N ATOM 958 CZ ARG A1409 -26.796 17.364 -11.530 1.00 26.16 C ATOM 959 NH1 ARG A1409 -27.045 16.670 -10.434 1.00 26.29 N ATOM 960 NH2 ARG A1409 -27.688 17.356 -12.531 1.00 27.94 N ATOM 961 HE ARG A1409 -25.033 18.063 -10.787 1.00 0.00 H ATOM 962 HH12 ARG A1409 -27.918 16.110 -10.360 1.00 0.00 H ATOM 963 HH11 ARG A1409 -26.368 16.684 -9.645 1.00 0.00 H ATOM 964 HH22 ARG A1409 -28.558 16.792 -12.448 1.00 0.00 H ATOM 965 HH21 ARG A1409 -27.510 17.913 -13.391 1.00 0.00 H ATOM 966 H ARG A1409 -23.534 15.280 -14.418 1.00 0.00 H ATOM 967 N LEU A1410 -20.656 15.790 -12.721 1.00 21.28 N ATOM 968 CA LEU A1410 -19.410 15.631 -11.979 1.00 20.94 C ATOM 969 C LEU A1410 -18.262 15.285 -12.928 1.00 20.68 C ATOM 970 O LEU A1410 -17.159 15.747 -12.758 1.00 19.71 O ATOM 971 CB LEU A1410 -19.559 14.575 -10.882 1.00 20.85 C ATOM 972 CG LEU A1410 -18.375 14.514 -9.901 1.00 21.19 C ATOM 973 CD1 LEU A1410 -18.370 15.764 -9.046 1.00 22.50 C ATOM 974 CD2 LEU A1410 -18.546 13.256 -9.078 1.00 21.62 C ATOM 975 H LEU A1410 -21.415 15.087 -12.610 1.00 0.00 H ATOM 976 N SER A1411 -18.524 14.464 -13.944 1.00 19.71 N ATOM 977 CA SER A1411 -17.535 14.142 -14.981 1.00 19.70 C ATOM 978 C SER A1411 -17.007 15.428 -15.661 1.00 20.31 C ATOM 979 O SER A1411 -15.814 15.612 -15.848 1.00 21.16 O ATOM 980 CB SER A1411 -18.118 13.146 -15.989 1.00 20.75 C ATOM 981 OG SER A1411 -17.156 12.886 -16.984 1.00 22.10 O ATOM 982 HG SER A1411 -17.526 12.243 -17.639 1.00 0.00 H ATOM 983 H SER A1411 -19.469 14.033 -14.005 1.00 0.00 H ATOM 984 N ALA A1412 -17.939 16.268 -16.074 1.00 20.82 N ATOM 985 CA ALA A1412 -17.594 17.523 -16.728 1.00 21.59 C ATOM 986 C ALA A1412 -16.779 18.411 -15.802 1.00 21.30 C ATOM 987 O ALA A1412 -15.825 19.025 -16.238 1.00 23.17 O ATOM 988 CB ALA A1412 -18.822 18.247 -17.213 1.00 22.20 C ATOM 989 H ALA A1412 -18.941 16.028 -15.929 1.00 0.00 H ATOM 990 N PHE A1413 -17.131 18.465 -14.512 1.00 21.65 N ATOM 991 CA PHE A1413 -16.341 19.239 -13.520 1.00 21.57 C ATOM 992 C PHE A1413 -14.912 18.656 -13.435 1.00 21.38 C ATOM 993 O PHE A1413 -13.913 19.372 -13.484 1.00 21.31 O ATOM 994 CB PHE A1413 -17.051 19.216 -12.171 1.00 22.66 C ATOM 995 CG PHE A1413 -16.322 19.910 -11.060 1.00 23.86 C ATOM 996 CD1 PHE A1413 -16.576 21.236 -10.778 1.00 25.57 C ATOM 997 CD2 PHE A1413 -15.446 19.205 -10.229 1.00 24.26 C ATOM 998 CE1 PHE A1413 -15.939 21.868 -9.730 1.00 26.78 C ATOM 999 CE2 PHE A1413 -14.811 19.848 -9.163 1.00 24.84 C ATOM 1000 CZ PHE A1413 -15.045 21.182 -8.927 1.00 26.22 C ATOM 1001 H PHE A1413 -17.979 17.952 -14.196 1.00 0.00 H ATOM 1002 N PHE A1414 -14.818 17.346 -13.313 1.00 19.99 N ATOM 1003 CA PHE A1414 -13.512 16.702 -13.235 1.00 20.30 C ATOM 1004 C PHE A1414 -12.673 16.959 -14.483 1.00 20.61 C ATOM 1005 O PHE A1414 -11.486 17.315 -14.377 1.00 21.37 O ATOM 1006 CB PHE A1414 -13.662 15.182 -13.024 1.00 19.69 C ATOM 1007 CG PHE A1414 -12.366 14.441 -13.143 1.00 20.59 C ATOM 1008 CD1 PHE A1414 -11.447 14.491 -12.102 1.00 20.27 C ATOM 1009 CD2 PHE A1414 -12.013 13.770 -14.300 1.00 20.45 C ATOM 1010 CE1 PHE A1414 -10.200 13.836 -12.214 1.00 21.14 C ATOM 1011 CE2 PHE A1414 -10.791 13.127 -14.409 1.00 20.63 C ATOM 1012 CZ PHE A1414 -9.876 13.198 -13.385 1.00 20.80 C ATOM 1013 H PHE A1414 -15.682 16.768 -13.272 1.00 0.00 H ATOM 1014 N GLU A1415 -13.262 16.801 -15.668 1.00 21.01 N ATOM 1015 CA GLU A1415 -12.515 16.958 -16.913 1.00 22.32 C ATOM 1016 C GLU A1415 -12.028 18.402 -17.100 1.00 23.53 C ATOM 1017 O GLU A1415 -10.941 18.620 -17.641 1.00 24.62 O ATOM 1018 CB GLU A1415 -13.367 16.513 -18.087 1.00 23.52 C ATOM 1019 CG GLU A1415 -13.673 15.025 -18.122 1.00 23.49 C ATOM 1020 CD GLU A1415 -12.487 14.151 -18.455 1.00 23.38 C ATOM 1021 OE1 GLU A1415 -11.452 14.640 -18.935 1.00 24.67 O ATOM 1022 OE2 GLU A1415 -12.599 12.940 -18.237 1.00 26.51 O ATOM 1023 H GLU A1415 -14.273 16.561 -15.707 1.00 0.00 H ATOM 1024 N GLU A1416 -12.820 19.373 -16.646 1.00 23.09 N ATOM 1025 CA GLU A1416 -12.427 20.780 -16.688 1.00 25.81 C ATOM 1026 C GLU A1416 -11.188 21.049 -15.881 1.00 24.54 C ATOM 1027 O GLU A1416 -10.277 21.765 -16.344 1.00 27.68 O ATOM 1028 CB GLU A1416 -13.553 21.679 -16.164 1.00 27.43 C ATOM 1029 CG GLU A1416 -13.196 23.172 -16.038 1.00 30.83 C ATOM 1030 CD GLU A1416 -12.785 23.811 -17.339 1.00 32.81 C ATOM 1031 OE1 GLU A1416 -13.198 23.329 -18.403 1.00 37.32 O ATOM 1032 OE2 GLU A1416 -12.029 24.810 -17.310 1.00 38.17 O ATOM 1033 H GLU A1416 -13.748 19.121 -16.249 1.00 0.00 H ATOM 1034 N HIS A1417 -11.134 20.464 -14.686 1.00 24.53 N ATOM 1035 CA HIS A1417 -10.077 20.764 -13.711 1.00 25.81 C ATOM 1036 C HIS A1417 -8.833 19.918 -13.954 1.00 24.52 C ATOM 1037 O HIS A1417 -7.703 20.395 -13.724 1.00 26.56 O ATOM 1038 CB HIS A1417 -10.599 20.628 -12.283 1.00 27.27 C ATOM 1039 CG HIS A1417 -11.432 21.792 -11.866 1.00 29.82 C ATOM 1040 ND1 HIS A1417 -12.803 21.812 -11.985 1.00 32.25 N ATOM 1041 CD2 HIS A1417 -11.074 23.025 -11.433 1.00 32.44 C ATOM 1042 CE1 HIS A1417 -13.267 22.982 -11.586 1.00 32.73 C ATOM 1043 NE2 HIS A1417 -12.234 23.748 -11.266 1.00 34.87 N ATOM 1044 H HIS A1417 -11.866 19.770 -14.434 1.00 0.00 H ATOM 1045 N ILE A1418 -8.991 18.692 -14.430 1.00 22.72 N ATOM 1046 CA ILE A1418 -7.829 17.820 -14.667 1.00 22.68 C ATOM 1047 C ILE A1418 -7.019 18.281 -15.897 1.00 24.60 C ATOM 1048 O ILE A1418 -5.849 17.957 -16.024 1.00 23.84 O ATOM 1049 CB ILE A1418 -8.276 16.323 -14.768 1.00 21.89 C ATOM 1050 CG1 ILE A1418 -7.118 15.347 -14.477 1.00 22.25 C ATOM 1051 CG2 ILE A1418 -8.815 16.023 -16.135 1.00 21.91 C ATOM 1052 CD1 ILE A1418 -6.541 15.384 -13.082 1.00 22.10 C ATOM 1053 H ILE A1418 -9.948 18.341 -14.639 1.00 0.00 H ATOM 1054 N SER A1419 -7.661 19.023 -16.801 1.00 25.25 N ATOM 1055 CA SER A1419 -7.064 19.416 -18.062 1.00 26.11 C ATOM 1056 C SER A1419 -5.672 20.056 -17.888 1.00 25.29 C ATOM 1057 O SER A1419 -4.675 19.615 -18.498 1.00 25.60 O ATOM 1058 CB SER A1419 -8.023 20.390 -18.777 1.00 27.41 C ATOM 1059 OG SER A1419 -7.429 20.760 -19.979 1.00 31.73 O ATOM 1060 HG SER A1419 -6.562 21.202 -19.795 1.00 0.00 H ATOM 1061 H SER A1419 -8.632 19.333 -16.592 1.00 0.00 H ATOM 1062 N SER A1420 -5.615 21.066 -17.040 1.00 25.57 N ATOM 1063 CA SER A1420 -4.351 21.803 -16.785 1.00 25.86 C ATOM 1064 C SER A1420 -3.314 20.941 -16.020 1.00 24.25 C ATOM 1065 O SER A1420 -2.115 21.038 -16.247 1.00 23.27 O ATOM 1066 CB SER A1420 -4.572 23.142 -16.084 1.00 27.81 C ATOM 1067 OG SER A1420 -4.908 22.945 -14.720 1.00 31.65 O ATOM 1068 HG SER A1420 -4.172 22.464 -14.266 1.00 0.00 H ATOM 1069 H SER A1420 -6.479 21.353 -16.537 1.00 0.00 H ATOM 1070 N VAL A1421 -3.794 20.059 -15.162 1.00 22.74 N ATOM 1071 CA VAL A1421 -2.888 19.172 -14.428 1.00 21.22 C ATOM 1072 C VAL A1421 -2.141 18.276 -15.415 1.00 21.26 C ATOM 1073 O VAL A1421 -0.940 18.072 -15.308 1.00 21.06 O ATOM 1074 CB VAL A1421 -3.662 18.343 -13.381 1.00 20.78 C ATOM 1075 CG1 VAL A1421 -2.755 17.330 -12.670 1.00 20.92 C ATOM 1076 CG2 VAL A1421 -4.328 19.276 -12.373 1.00 20.87 C ATOM 1077 H VAL A1421 -4.820 19.994 -15.007 1.00 0.00 H ATOM 1078 N LEU A1422 -2.871 17.705 -16.366 1.00 21.94 N ATOM 1079 CA LEU A1422 -2.289 16.827 -17.371 1.00 21.85 C ATOM 1080 C LEU A1422 -1.365 17.586 -18.329 1.00 23.15 C ATOM 1081 O LEU A1422 -0.262 17.114 -18.590 1.00 23.16 O ATOM 1082 CB LEU A1422 -3.398 16.154 -18.169 1.00 22.64 C ATOM 1083 CG LEU A1422 -4.301 15.219 -17.384 1.00 23.38 C ATOM 1084 CD1 LEU A1422 -5.530 14.790 -18.196 1.00 24.47 C ATOM 1085 CD2 LEU A1422 -3.522 14.004 -16.942 1.00 23.90 C ATOM 1086 H LEU A1422 -3.894 17.891 -16.394 1.00 0.00 H ATOM 1087 N SER A1423 -1.828 18.727 -18.832 1.00 23.24 N ATOM 1088 CA SER A1423 -1.045 19.465 -19.822 1.00 24.72 C ATOM 1089 C SER A1423 0.243 19.981 -19.185 1.00 25.10 C ATOM 1090 O SER A1423 1.305 19.880 -19.767 1.00 26.62 O ATOM 1091 CB SER A1423 -1.867 20.568 -20.478 1.00 26.05 C ATOM 1092 OG SER A1423 -2.378 21.511 -19.586 1.00 28.24 O ATOM 1093 HG SER A1423 -2.897 22.190 -20.086 1.00 0.00 H ATOM 1094 H SER A1423 -2.749 19.095 -18.520 1.00 0.00 H ATOM 1095 N ASP A1424 0.151 20.496 -17.965 1.00 24.51 N ATOM 1096 CA ASP A1424 1.346 20.916 -17.240 1.00 23.78 C ATOM 1097 C ASP A1424 2.340 19.762 -17.037 1.00 23.58 C ATOM 1098 O ASP A1424 3.553 19.943 -17.199 1.00 24.85 O ATOM 1099 CB ASP A1424 0.971 21.463 -15.847 1.00 25.25 C ATOM 1100 CG ASP A1424 0.328 22.870 -15.897 1.00 27.74 C ATOM 1101 OD1 ASP A1424 0.215 23.483 -16.994 1.00 30.41 O ATOM 1102 OD2 ASP A1424 -0.040 23.352 -14.787 1.00 32.11 O ATOM 1103 H ASP A1424 -0.783 20.601 -17.521 1.00 0.00 H ATOM 1104 N TYR A1425 1.842 18.593 -16.655 1.00 22.44 N ATOM 1105 CA TYR A1425 2.690 17.431 -16.407 1.00 22.22 C ATOM 1106 C TYR A1425 3.418 17.008 -17.684 1.00 24.26 C ATOM 1107 O TYR A1425 4.642 16.829 -17.652 1.00 24.52 O ATOM 1108 CB TYR A1425 1.874 16.255 -15.863 1.00 21.63 C ATOM 1109 CG TYR A1425 2.701 15.019 -15.656 1.00 21.79 C ATOM 1110 CD1 TYR A1425 3.550 14.871 -14.548 1.00 22.14 C ATOM 1111 CD2 TYR A1425 2.666 14.000 -16.579 1.00 22.26 C ATOM 1112 CE1 TYR A1425 4.307 13.738 -14.365 1.00 23.05 C ATOM 1113 CE2 TYR A1425 3.398 12.848 -16.384 1.00 23.37 C ATOM 1114 CZ TYR A1425 4.235 12.728 -15.293 1.00 24.13 C ATOM 1115 OH TYR A1425 4.968 11.567 -15.108 1.00 27.03 O ATOM 1116 HH TYR A1425 5.511 11.649 -14.284 1.00 0.00 H ATOM 1117 H TYR A1425 0.814 18.502 -16.528 1.00 0.00 H ATOM 1118 N LYS A1426 2.667 16.897 -18.784 1.00 25.64 N ATOM 1119 CA LYS A1426 3.246 16.482 -20.064 1.00 27.20 C ATOM 1120 C LYS A1426 4.254 17.516 -20.573 1.00 27.98 C ATOM 1121 O LYS A1426 5.295 17.135 -21.117 1.00 30.39 O ATOM 1122 CB LYS A1426 2.156 16.221 -21.094 1.00 29.00 C ATOM 1123 CG LYS A1426 1.380 14.948 -20.830 1.00 30.75 C ATOM 1124 CD LYS A1426 0.204 14.830 -21.779 1.00 33.07 C ATOM 1125 CE LYS A1426 -0.605 13.591 -21.482 1.00 34.29 C ATOM 1126 NZ LYS A1426 -1.576 13.285 -22.568 1.00 36.34 N ATOM 1127 HZ1 LYS A1426 -2.233 14.084 -22.679 1.00 0.00 H ATOM 1128 HZ2 LYS A1426 -1.061 13.132 -23.459 1.00 0.00 H ATOM 1129 HZ3 LYS A1426 -2.110 12.427 -22.322 1.00 0.00 H ATOM 1130 H LYS A1426 1.650 17.110 -18.730 1.00 0.00 H ATOM 1131 N SER A1427 3.978 18.808 -20.389 1.00 26.23 N ATOM 1132 CA SER A1427 4.971 19.839 -20.711 1.00 27.61 C ATOM 1133 C SER A1427 6.252 19.680 -19.912 1.00 27.21 C ATOM 1134 O SER A1427 7.359 19.846 -20.455 1.00 28.36 O ATOM 1135 CB SER A1427 4.431 21.249 -20.526 1.00 28.72 C ATOM 1136 OG SER A1427 3.446 21.503 -21.515 1.00 31.98 O ATOM 1137 HG SER A1427 2.709 20.849 -21.421 1.00 0.00 H ATOM 1138 H SER A1427 3.049 19.087 -20.013 1.00 0.00 H ATOM 1139 N ALA A1428 6.122 19.367 -18.635 1.00 27.30 N ATOM 1140 CA ALA A1428 7.284 19.141 -17.760 1.00 26.62 C ATOM 1141 C ALA A1428 8.080 17.966 -18.253 1.00 28.04 C ATOM 1142 O ALA A1428 9.303 18.064 -18.388 1.00 28.08 O ATOM 1143 CB ALA A1428 6.878 18.934 -16.318 1.00 26.85 C ATOM 1144 H ALA A1428 5.166 19.277 -18.234 1.00 0.00 H ATOM 1145 N LEU A1429 7.381 16.879 -18.595 1.00 28.32 N ATOM 1146 CA LEU A1429 8.044 15.704 -19.145 1.00 30.01 C ATOM 1147 C LEU A1429 8.827 16.031 -20.411 1.00 29.16 C ATOM 1148 O LEU A1429 9.965 15.583 -20.551 1.00 29.22 O ATOM 1149 CB LEU A1429 7.046 14.570 -19.453 1.00 32.44 C ATOM 1150 CG LEU A1429 7.059 13.319 -18.574 1.00 35.33 C ATOM 1151 CD1 LEU A1429 7.117 13.545 -17.073 1.00 36.76 C ATOM 1152 CD2 LEU A1429 5.828 12.508 -18.937 1.00 35.45 C ATOM 1153 H LEU A1429 6.349 16.872 -18.467 1.00 0.00 H ATOM 1154 N ARG A1430 8.206 16.757 -21.336 1.00 28.75 N ATOM 1155 CA ARG A1430 8.852 17.080 -22.606 1.00 29.80 C ATOM 1156 C ARG A1430 10.103 17.912 -22.350 1.00 29.46 C ATOM 1157 O ARG A1430 11.143 17.699 -22.995 1.00 29.63 O ATOM 1158 CB ARG A1430 7.915 17.863 -23.540 1.00 31.89 C ATOM 1159 CG ARG A1430 6.847 17.040 -24.265 1.00 34.80 C ATOM 1160 CD ARG A1430 6.170 17.840 -25.387 1.00 38.27 C ATOM 1161 NE ARG A1430 5.194 18.821 -24.893 1.00 41.05 N ATOM 1162 CZ ARG A1430 3.945 18.537 -24.490 1.00 40.92 C ATOM 1163 NH1 ARG A1430 3.446 17.291 -24.526 1.00 43.32 N ATOM 1164 NH2 ARG A1430 3.171 19.525 -24.065 1.00 41.65 N ATOM 1165 HE ARG A1430 5.495 19.816 -24.852 1.00 0.00 H ATOM 1166 HH12 ARG A1430 2.473 17.111 -24.205 1.00 0.00 H ATOM 1167 HH11 ARG A1430 4.032 16.506 -24.875 1.00 0.00 H ATOM 1168 HH22 ARG A1430 2.200 19.326 -23.749 1.00 0.00 H ATOM 1169 HH21 ARG A1430 3.534 20.499 -24.048 1.00 0.00 H ATOM 1170 H ARG A1430 7.242 17.101 -21.152 1.00 0.00 H ATOM 1171 N PHE A1431 10.011 18.887 -21.448 1.00 27.62 N ATOM 1172 CA PHE A1431 11.158 19.741 -21.113 1.00 27.01 C ATOM 1173 C PHE A1431 12.313 18.931 -20.538 1.00 27.40 C ATOM 1174 O PHE A1431 13.450 19.083 -20.986 1.00 27.85 O ATOM 1175 CB PHE A1431 10.730 20.826 -20.102 1.00 26.33 C ATOM 1176 CG PHE A1431 11.867 21.622 -19.524 1.00 27.24 C ATOM 1177 CD1 PHE A1431 12.310 22.790 -20.149 1.00 28.55 C ATOM 1178 CD2 PHE A1431 12.454 21.246 -18.316 1.00 27.10 C ATOM 1179 CE1 PHE A1431 13.330 23.539 -19.600 1.00 28.10 C ATOM 1180 CE2 PHE A1431 13.457 22.020 -17.753 1.00 28.62 C ATOM 1181 CZ PHE A1431 13.890 23.160 -18.400 1.00 29.09 C ATOM 1182 H PHE A1431 9.103 19.048 -20.968 1.00 0.00 H ATOM 1183 N HIS A1432 12.056 18.093 -19.544 1.00 27.75 N ATOM 1184 CA HIS A1432 13.134 17.293 -18.943 1.00 29.21 C ATOM 1185 C HIS A1432 13.754 16.283 -19.926 1.00 30.54 C ATOM 1186 O HIS A1432 14.984 16.119 -19.934 1.00 33.04 O ATOM 1187 CB HIS A1432 12.673 16.631 -17.653 1.00 30.41 C ATOM 1188 CG HIS A1432 12.444 17.621 -16.559 1.00 31.25 C ATOM 1189 ND1 HIS A1432 13.474 18.307 -15.949 1.00 32.65 N ATOM 1190 CD2 HIS A1432 11.300 18.091 -16.004 1.00 32.21 C ATOM 1191 CE1 HIS A1432 12.974 19.145 -15.057 1.00 33.56 C ATOM 1192 NE2 HIS A1432 11.658 19.039 -15.078 1.00 33.65 N ATOM 1193 H HIS A1432 11.084 18.000 -19.186 1.00 0.00 H ATOM 1194 N LYS A1433 12.933 15.691 -20.801 1.00 31.55 N ATOM 1195 CA LYS A1433 13.429 14.778 -21.845 1.00 32.66 C ATOM 1196 C LYS A1433 14.345 15.513 -22.839 1.00 34.10 C ATOM 1197 O LYS A1433 15.364 14.973 -23.296 1.00 34.64 O ATOM 1198 CB LYS A1433 12.260 14.113 -22.602 1.00 33.55 C ATOM 1199 H LYS A1433 11.912 15.882 -20.742 1.00 0.00 H ATOM 1200 N ARG A1434 13.967 16.735 -23.206 1.00 33.17 N ATOM 1201 CA ARG A1434 14.731 17.513 -24.207 1.00 32.87 C ATOM 1202 C ARG A1434 16.100 17.931 -23.674 1.00 32.77 C ATOM 1203 O ARG A1434 17.052 18.080 -24.439 1.00 34.10 O ATOM 1204 CB ARG A1434 13.923 18.769 -24.625 1.00 33.35 C ATOM 1205 CG ARG A1434 14.516 19.574 -25.784 1.00 34.86 C ATOM 1206 CD ARG A1434 13.885 20.956 -25.923 1.00 35.55 C ATOM 1207 NE ARG A1434 14.573 21.753 -26.952 1.00 37.58 N ATOM 1208 CZ ARG A1434 14.184 22.961 -27.368 1.00 38.82 C ATOM 1209 NH1 ARG A1434 13.105 23.551 -26.830 1.00 38.01 N ATOM 1210 NH2 ARG A1434 14.869 23.584 -28.336 1.00 39.83 N ATOM 1211 HE ARG A1434 15.425 21.345 -27.387 1.00 0.00 H ATOM 1212 HH12 ARG A1434 12.808 24.492 -27.159 1.00 0.00 H ATOM 1213 HH11 ARG A1434 12.566 23.067 -26.084 1.00 0.00 H ATOM 1214 HH22 ARG A1434 14.569 24.525 -28.662 1.00 0.00 H ATOM 1215 HH21 ARG A1434 15.701 23.127 -28.761 1.00 0.00 H ATOM 1216 H ARG A1434 13.115 17.153 -22.780 1.00 0.00 H ATOM 1217 N ASN A1435 16.187 18.125 -22.363 1.00 32.85 N ATOM 1218 CA ASN A1435 17.360 18.693 -21.690 1.00 33.75 C ATOM 1219 C ASN A1435 17.983 17.646 -20.771 1.00 36.69 C ATOM 1220 O ASN A1435 18.996 17.919 -20.141 1.00 41.35 O ATOM 1221 CB ASN A1435 16.928 19.931 -20.896 1.00 31.38 C ATOM 1222 CG ASN A1435 16.442 21.037 -21.802 1.00 30.83 C ATOM 1223 OD1 ASN A1435 17.219 21.590 -22.581 1.00 32.20 O ATOM 1224 ND2 ASN A1435 15.164 21.346 -21.748 1.00 29.56 N ATOM 1225 HD22 ASN A1435 14.539 20.857 -21.076 1.00 0.00 H ATOM 1226 HD21 ASN A1435 14.779 22.080 -22.377 1.00 0.00 H ATOM 1227 H ASN A1435 15.371 17.857 -21.776 1.00 0.00 H TER 1228 ASN A1435 HETATM 1229 O HOH 1 -14.021 7.236 3.265 1.00 41.59 O HETATM 1230 O HOH 2 -20.935 9.002 -16.576 1.00 40.31 O HETATM 1231 O HOH 3 1.018 19.808 -22.671 1.00 35.79 O HETATM 1232 O HOH 4 -8.055 2.187 -14.547 1.00 42.30 O HETATM 1233 O HOH 5 -18.322 15.417 1.439 1.00 51.38 O HETATM 1234 O HOH 6 -11.952 -2.414 -8.028 1.00 40.95 O HETATM 1235 O HOH 7 -11.820 -0.398 -3.436 1.00 37.68 O HETATM 1236 O HOH 8 -21.587 2.673 -11.238 1.00 29.42 O HETATM 1237 O HOH 9 -7.063 7.679 1.768 1.00 24.42 O HETATM 1238 O HOH 10 -5.094 18.390 -20.827 1.00 31.55 O HETATM 1239 O HOH 11 -27.084 11.503 -3.564 1.00 40.78 O HETATM 1240 O HOH 12 -16.526 0.975 -17.357 1.00 27.96 O HETATM 1241 O HOH 13 -17.870 1.405 -9.516 1.00 28.04 O HETATM 1242 O HOH 14 -8.559 3.914 -21.520 1.00 43.00 O HETATM 1243 O HOH 15 -15.610 9.223 1.914 1.00 69.18 O HETATM 1244 O HOH 16 -14.975 0.661 -6.057 1.00 26.31 O HETATM 1245 O HOH 17 -33.084 12.982 -5.576 1.00 44.43 O HETATM 1246 O HOH 18 6.889 11.494 -13.213 1.00 42.03 O HETATM 1247 O HOH 19 -13.426 4.358 -18.609 1.00 29.11 O HETATM 1248 O HOH 20 -26.094 14.257 -3.488 1.00 43.77 O HETATM 1249 O HOH 21 -5.617 1.089 -6.747 1.00 41.59 O HETATM 1250 O HOH 22 3.024 17.292 -5.105 1.00 25.56 O HETATM 1251 O HOH 23 -7.892 14.960 -1.120 1.00 29.61 O HETATM 1252 O HOH 24 -26.155 12.701 -22.362 1.00 37.30 O HETATM 1253 O HOH 25 -25.511 -1.530 -19.518 1.00 38.01 O HETATM 1254 O HOH 26 -19.789 4.097 -5.816 1.00 25.32 O HETATM 1255 O HOH 27 6.405 19.054 -5.521 1.00 44.55 O HETATM 1256 O HOH 28 -14.592 11.684 -16.869 1.00 27.40 O HETATM 1257 O HOH 29 -18.233 10.902 -18.518 1.00 41.34 O HETATM 1258 O HOH 30 1.651 22.550 -12.511 1.00 46.39 O HETATM 1259 O HOH 31 -15.440 7.550 -18.765 1.00 33.24 O HETATM 1260 O HOH 32 5.214 9.511 -16.906 1.00 38.06 O HETATM 1261 O HOH 33 -20.089 14.909 -18.770 1.00 32.93 O HETATM 1262 O HOH 34 5.301 23.408 -10.753 1.00 37.69 O HETATM 1263 O HOH 35 -24.851 2.932 -21.308 1.00 44.96 O HETATM 1264 O HOH 36 -26.637 16.376 -6.354 1.00 44.47 O HETATM 1265 O HOH 37 -18.548 4.245 -8.213 1.00 29.62 O HETATM 1266 O HOH 38 8.014 21.449 -22.608 1.00 33.11 O HETATM 1267 O HOH 39 -9.973 16.877 -19.602 1.00 32.77 O HETATM 1268 O HOH 40 -3.910 12.499 -21.312 1.00 48.45 O HETATM 1269 O HOH 41 4.991 14.757 -22.510 1.00 39.80 O HETATM 1270 O HOH 42 11.052 16.242 -25.353 1.00 39.87 O HETATM 1271 O HOH 43 -2.833 16.984 2.476 1.00 34.33 O HETATM 1272 O HOH 44 -10.825 4.463 -17.721 1.00 21.95 O HETATM 1273 O HOH 45 -15.621 -1.887 -15.233 1.00 30.05 O HETATM 1274 O HOH 46 -6.791 22.303 -11.922 1.00 45.25 O HETATM 1275 O HOH 47 -3.485 1.547 0.288 1.00 43.28 O HETATM 1276 O HOH 48 3.475 1.275 -2.845 1.00 52.92 O HETATM 1277 O HOH 49 1.473 21.049 -6.433 1.00 30.33 O HETATM 1278 O HOH 50 20.007 21.440 -22.519 1.00 52.53 O HETATM 1279 O HOH 51 -29.150 -3.494 -13.274 1.00 37.46 O HETATM 1280 O HOH 52 4.485 8.583 -8.717 1.00 36.87 O HETATM 1281 O HOH 53 -5.310 1.647 -9.594 1.00 39.97 O HETATM 1282 O HOH 54 4.798 21.984 -15.739 1.00 34.26 O HETATM 1283 O HOH 55 11.766 23.369 -24.376 1.00 37.90 O HETATM 1284 O HOH 56 -19.268 -8.808 -15.168 1.00 48.75 O HETATM 1285 O HOH 57 -2.430 2.192 -9.776 1.00 42.42 O HETATM 1286 O HOH 58 -2.214 22.425 -13.266 1.00 36.45 O HETATM 1287 O HOH 59 -9.603 7.537 0.634 1.00 21.35 O HETATM 1288 O HOH 60 -7.698 22.783 -15.848 1.00 35.08 O HETATM 1289 O HOH 61 2.641 2.493 -0.210 1.00 47.94 O HETATM 1290 O HOH 62 -5.542 8.881 -18.735 1.00 27.93 O HETATM 1291 O HOH 63 -10.626 14.464 -0.112 1.00 31.54 O HETATM 1292 O HOH 64 -19.664 4.502 -10.690 1.00 26.67 O HETATM 1293 O HOH 65 -24.810 7.115 -15.265 1.00 27.24 O HETATM 1294 O HOH 66 -17.277 14.832 -19.041 1.00 29.16 O HETATM 1295 O HOH 67 -5.922 21.184 -8.300 1.00 35.18 O HETATM 1296 O HOH 68 -5.231 3.582 -13.641 1.00 37.47 O HETATM 1297 O HOH 69 -6.193 1.813 -3.046 1.00 41.94 O HETATM 1298 O HOH 70 5.386 11.608 -10.543 1.00 42.68 O HETATM 1299 O HOH 71 11.928 21.142 -12.608 1.00 29.45 O HETATM 1300 O HOH 72 -7.751 17.248 0.698 1.00 33.50 O HETATM 1301 O HOH 73 -2.252 11.973 -1.422 1.00 31.16 O HETATM 1302 O HOH 74 -29.415 14.909 -10.501 1.00 30.22 O HETATM 1303 O HOH 75 14.614 26.327 -29.076 1.00 31.70 O HETATM 1304 O HOH 76 0.358 7.507 3.779 1.00 39.25 O HETATM 1305 O HOH 77 3.120 -0.445 -5.598 1.00 56.66 O HETATM 1306 O HOH 78 -21.854 16.860 -0.364 1.00 46.66 O HETATM 1307 O HOH 79 -4.954 11.452 -1.691 1.00 29.56 O HETATM 1308 O HOH 80 -17.816 -2.168 -5.364 1.00 37.28 O HETATM 1309 O HOH 81 -7.329 2.637 -7.614 1.00 41.16 O HETATM 1310 O HOH 82 11.071 13.377 -19.062 1.00 38.47 O HETATM 1311 O HOH 83 0.732 8.212 -6.603 1.00 27.85 O HETATM 1312 O HOH 84 -5.060 22.343 -20.416 1.00 40.88 O HETATM 1313 O HOH 85 -3.942 6.885 3.956 1.00 39.39 O HETATM 1314 O HOH 86 0.779 18.927 -13.155 1.00 24.54 O HETATM 1315 O HOH 87 1.402 10.124 -4.773 1.00 30.62 O HETATM 1316 O HOH 88 4.241 9.645 -4.140 1.00 39.67 O HETATM 1317 O HOH 89 -0.941 22.526 -5.531 1.00 42.44 O HETATM 1318 O HOH 90 -7.044 13.461 -21.414 1.00 34.82 O HETATM 1319 O HOH 91 -23.965 20.462 -9.048 1.00 34.48 O HETATM 1320 O HOH 92 10.055 17.564 -7.002 1.00 48.08 O HETATM 1321 O HOH 93 -23.909 -0.388 2.484 1.00 46.23 O HETATM 1322 O HOH 94 4.551 21.290 -12.883 1.00 39.44 O HETATM 1323 O HOH 95 -18.389 8.448 2.064 1.00 38.24 O HETATM 1324 O HOH 96 -13.605 17.498 0.907 1.00 36.06 O HETATM 1325 O HOH 97 -21.553 3.511 -2.673 1.00 43.45 O HETATM 1326 O HOH 98 -26.274 5.866 -22.095 1.00 48.21 O HETATM 1327 O HOH 99 -11.045 20.211 3.485 1.00 42.83 O HETATM 1328 O HOH 100 -30.739 3.624 -16.068 1.00 45.81 O HETATM 1329 O HOH 101 -24.423 4.291 -11.481 1.00 33.14 O HETATM 1330 O HOH 102 -8.224 -0.027 -11.736 1.00 47.00 O HETATM 1331 O HOH 103 3.349 4.401 -8.670 1.00 50.02 O HETATM 1332 O HOH 104 -17.646 0.499 -6.664 1.00 29.48 O HETATM 1333 O HOH 105 -7.916 7.944 -19.614 1.00 25.48 O HETATM 1334 O HOH 106 -27.674 18.428 -15.312 1.00 33.39 O HETATM 1335 O HOH 107 3.512 17.719 -12.251 1.00 24.65 O HETATM 1336 O HOH 108 1.442 23.176 -8.002 1.00 45.62 O HETATM 1337 O HOH 109 -11.359 7.143 2.654 1.00 28.78 O HETATM 1338 O HOH 110 -13.882 11.748 3.212 1.00 35.97 O HETATM 1339 O HOH 111 11.001 18.260 -11.767 1.00 33.62 O HETATM 1340 O HOH 112 5.187 7.393 -6.328 1.00 54.01 O HETATM 1341 O HOH 113 17.282 21.755 -25.605 1.00 58.88 O HETATM 1342 O HOH 114 -22.322 19.033 -6.947 1.00 29.67 O HETATM 1343 O HOH 115 -6.082 13.381 0.032 1.00 30.09 O HETATM 1344 O HOH 116 1.714 11.677 1.408 1.00 54.97 O HETATM 1345 O HOH 117 -17.509 -3.130 -16.875 1.00 38.08 O HETATM 1346 O HOH 118 -9.135 21.877 -2.593 1.00 40.93 O HETATM 1347 O HOH 119 -19.724 3.437 -20.439 1.00 43.62 O HETATM 1348 O HOH 120 -30.357 -1.099 -9.434 1.00 50.08 O HETATM 1349 O HOH 121 -27.510 -2.124 -15.191 1.00 40.53 O HETATM 1350 O HOH 122 -20.796 10.562 2.197 1.00 44.08 O HETATM 1351 O HOH 123 -3.324 1.602 -2.575 1.00 44.01 O HETATM 1352 O HOH 124 -1.792 25.721 -16.174 1.00 47.52 O HETATM 1353 O HOH 125 -6.179 10.527 -22.197 1.00 31.83 O HETATM 1354 O HOH 126 -13.520 14.309 2.507 1.00 47.95 O HETATM 1355 O HOH 127 2.116 25.626 -13.979 1.00 44.40 O HETATM 1356 O HOH 128 -1.350 18.383 0.510 1.00 47.20 O HETATM 1357 O HOH 129 14.709 21.161 -12.466 1.00 39.72 O HETATM 1358 O HOH 130 -13.267 -1.922 -16.813 1.00 41.69 O HETATM 1359 O HOH 131 1.487 0.235 -7.909 1.00 48.39 O HETATM 1360 O HOH 132 10.389 20.968 -24.259 1.00 40.46 O HETATM 1361 O HOH 133 -11.634 16.007 -22.187 1.00 36.91 O HETATM 1362 O HOH 134 -18.198 7.712 -19.383 1.00 39.46 O HETATM 1363 O HOH 135 -5.178 20.674 -22.748 1.00 42.56 O HETATM 1364 O HOH 136 -23.612 8.988 -17.064 1.00 38.60 O HETATM 1365 O HOH 137 7.685 13.620 -23.028 1.00 46.41 O HETATM 1366 O HOH 138 -5.882 19.025 -0.533 1.00 43.05 O HETATM 1367 O HOH 139 12.869 16.386 -12.880 1.00 40.04 O HETATM 1368 O HOH 140 -27.698 -4.517 2.158 1.00 48.66 O HETATM 1369 O HOH 141 -5.137 11.446 -19.443 1.00 44.55 O HETATM 1370 O HOH 142 -10.467 3.039 0.336 1.00 50.91 O HETATM 1371 O HOH 143 -1.216 24.410 -7.868 1.00 51.39 O HETATM 1372 O HOH 144 -13.231 -1.475 -5.499 1.00 39.78 O HETATM 1373 O HOH 145 -15.225 10.062 -18.881 1.00 47.99 O HETATM 1374 O HOH 146 -22.378 9.863 -19.389 1.00 54.63 O HETATM 1375 O HOH 147 -8.435 23.290 -4.934 1.00 49.51 O HETATM 1376 O HOH 148 3.961 24.586 -16.143 1.00 44.01 O HETATM 1377 O HOH 149 -1.673 23.512 -23.055 1.00 44.70 O HETATM 1378 O HOH 150 -9.613 5.862 -19.660 1.00 28.55 O HETATM 1379 O HOH 151 -8.400 1.804 -1.117 1.00 43.67 O HETATM 1380 O HOH 152 3.905 19.865 -28.692 1.00 34.37 O HETATM 1381 O HOH 153 13.056 14.342 -14.765 1.00 47.89 O HETATM 1382 O HOH 154 -32.006 1.863 -19.839 1.00 45.89 O HETATM 1383 O HOH 155 -7.443 16.416 -20.684 1.00 31.21 O HETATM 1384 O HOH 156 -16.318 13.807 2.484 1.00 49.43 O HETATM 1385 O HOH 157 -3.015 25.644 -18.875 1.00 53.17 O HETATM 1386 O HOH 158 -9.812 1.818 -17.422 1.00 38.69 O HETATM 1387 O HOH 159 -5.702 -0.131 1.286 1.00 56.59 O HETATM 1388 O HOH 160 -17.980 -1.177 -18.607 1.00 57.53 O HETATM 1389 O HOH 161 -8.760 -1.049 -14.468 1.00 46.59 O HETATM 1390 O HOH 162 10.570 13.876 -16.261 1.00 39.29 O HETATM 1391 O HOH 163 -8.748 -1.784 -9.725 1.00 53.49 O HETATM 1392 O HOH 164 3.608 24.758 -8.852 1.00 41.13 O HETATM 1393 O HOH 165 9.766 11.469 -14.777 1.00 51.36 O HETATM 1394 O HOH 166 6.794 15.270 -27.791 1.00 45.42 O HETATM 1395 O HOH 167 -15.285 -3.188 -4.717 1.00 39.25 O HETATM 1396 O HOH 168 8.928 14.150 -25.520 1.00 47.83 O HETATM 1397 O HOH 169 3.564 22.659 -5.351 1.00 79.74 O HETATM 1398 N1 UNN A 170 -31.651 5.236 -7.501 1.00 -0.39 N HETATM 1399 C9 UNN A 170 -30.683 4.747 -7.857 1.00 0.05 C HETATM 1400 C8 UNN A 170 -29.430 4.105 -8.324 1.00 0.15 C HETATM 1401 C10 UNN A 170 -28.936 3.983 -9.684 1.00 0.25 C HETATM 1402 N2 UNN A 170 -29.328 4.338 -10.898 1.00 -0.29 N HETATM 1403 H4 UNN A 170 -28.746 4.106 -11.716 1.00 0.19 H HETATM 1404 H5 UNN A 170 -30.215 4.846 -11.025 1.00 0.19 H HETATM 1405 O UNN A 170 -27.730 3.288 -9.484 1.00 -0.18 O HETATM 1406 C7 UNN A 170 -27.657 3.063 -8.001 1.00 0.19 C HETATM 1407 N UNN A 170 -28.672 3.579 -7.371 1.00 -0.31 N HETATM 1408 C UNN A 170 -26.437 2.361 -7.507 1.00 0.07 C HETATM 1409 C1 UNN A 170 -25.187 3.117 -7.890 1.00 -0.02 C HETATM 1410 C6 UNN A 170 -24.005 2.445 -8.153 1.00 -0.06 C HETATM 1411 C5 UNN A 170 -22.855 3.140 -8.498 1.00 -0.07 C HETATM 1412 C4 UNN A 170 -22.877 4.513 -8.589 1.00 -0.07 C HETATM 1413 C3 UNN A 170 -24.046 5.196 -8.334 1.00 -0.07 C HETATM 1414 C2 UNN A 170 -25.193 4.503 -7.980 1.00 -0.06 C HETATM 1415 H9 UNN A 170 -26.106 5.049 -7.771 1.00 0.06 H HETATM 1416 H8 UNN A 170 -24.069 6.277 -8.410 1.00 0.06 H HETATM 1417 H1 UNN A 170 -21.978 5.055 -8.860 1.00 0.06 H HETATM 1418 H2 UNN A 170 -21.936 2.600 -8.697 1.00 0.06 H HETATM 1419 H3 UNN A 170 -23.978 1.363 -8.088 1.00 0.06 H HETATM 1420 H6 UNN A 170 -26.398 1.354 -7.948 1.00 0.07 H HETATM 1421 H7 UNN A 170 -26.487 2.280 -6.411 1.00 0.07 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1398 1399 CONECT 1399 1398 1400 CONECT 1400 1399 1401 1407 CONECT 1401 1400 1402 1405 CONECT 1402 1401 1403 1404 CONECT 1403 1402 CONECT 1404 1402 CONECT 1405 1401 1406 CONECT 1406 1405 1407 1408 CONECT 1407 1400 1406 CONECT 1408 1406 1409 1420 1421 CONECT 1409 1408 1410 1414 CONECT 1410 1409 1411 1419 CONECT 1411 1410 1412 1418 CONECT 1412 1411 1413 1417 CONECT 1413 1412 1414 1416 CONECT 1414 1409 1413 1415 CONECT 1415 1414 CONECT 1416 1413 CONECT 1417 1412 CONECT 1418 1411 CONECT 1419 1410 CONECT 1420 1408 CONECT 1421 1408 MASTER 0 0 0 0 0 0 0 0 1420 1 28 10 END
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Structure:
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Related entries of code: 5ene
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5enb
RCSB PDB
PDBbind
131aa, >5ENB_1|Chain... *
5enc
RCSB PDB
PDBbind
131aa, >5ENC_1|Chain... at 100%
5enf
RCSB PDB
PDBbind
131aa, >5ENF_1|Chain... at 100%
5enh
RCSB PDB
PDBbind
131aa, >5ENH_1|Chain... at 100%
5eni
RCSB PDB
PDBbind
131aa, >5ENI_1|Chain... at 100%
5enj
RCSB PDB
PDBbind
131aa, >5ENJ_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5ene
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
second bromodomain of Pleckstrin homology domain interacting protein (PHIP2)
Ligand Name
5Q8
EC.Number
E.C.-.-.-.-
Resolution
1.49(Å)
Affinity (Kd/Ki/IC50)
IC50=0.59mM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Chem Sci Vol. 7: pp. 2322-2330
Ligand Properties
Formula
C
1
1
H
9
N
3
O
Molecular Weight
199.209
Exact Mass
199.075
No. of atoms
24
No. of bonds
25
Polar Surface Area
75.84
LOGP Value
2.55 (
Computed with XLOGP3
)
2.30 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 2
Canonical SMILES
N#Cc1nc(oc1N)Cc1ccccc1
InChI String
InChI=1S/C11H9N3O/c12-7-9-11(13)15-10(14-9)6-8-4-2-1-3-5-8/h1-5H,6,13H2
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):
Q8WWQ0
Entrez Gene ID
NCBI Entrez Gene ID:
55023
ASD
Information of known allosteric effects of PDB entries
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