USER MOD reduce.3.24.130724 H: found=0, std=0, add=639, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 640 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 445 THR OG1 : rot 11:sc= 0.865 USER MOD Set 1.2: A 508 THR OG1 : rot -114:sc= 1.38 USER MOD Single : A 444 SER OG : rot 32:sc= 0.00687 USER MOD Single : A 447 MET CE :methyl 139:sc= -5.24! (180deg=-6.53!) USER MOD Single : A 451 ASN : amide:sc= -0.12 K(o=-0.12,f=-1.6!) USER MOD Single : A 452 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 456 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 467 THR OG1 : rot 74:sc= 0.89 USER MOD Single : A 470 CYS SG : rot 74:sc= -0.47 USER MOD Single : A 472 LYS NZ :NH3+ 144:sc= -0.195 (180deg=-1.85!) USER MOD Single : A 477 ASN : amide:sc= -0.639 K(o=-0.64,f=-2!) USER MOD Single : A 482 TYR OH : rot 180:sc= 0 USER MOD Single : A 483 GLN : amide:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ -124:sc= -0.464 (180deg=-1.62) USER MOD Single : A 503 SER OG : rot 180:sc= 0 USER MOD Single : A 506 SER OG : rot 180:sc= 0 USER MOD Single : A 509 HIS : no HD1:sc=-0.000238 X(o=-0.00024,f=-0.01) USER MOD Single : A 510 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.629) USER MOD Single : A 513 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 516 ASN : amide:sc= -1.36 K(o=-1.4,f=-6.3!) USER MOD Single : A 524 LYS NZ :NH3+ 158:sc= -0.846 (180deg=-1.39) USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 204 N SER A 444 1.543 13.826 9.561 1.00 0.00 N ATOM 205 CA SER A 444 1.938 12.634 8.819 1.00 0.00 C ATOM 206 C SER A 444 0.723 11.776 8.482 1.00 0.00 C ATOM 207 O SER A 444 0.090 11.200 9.367 1.00 0.00 O ATOM 208 CB SER A 444 2.947 11.815 9.627 1.00 0.00 C ATOM 209 OG SER A 444 4.177 12.506 9.758 1.00 0.00 O ATOM 0 HA SER A 444 2.404 12.954 7.887 1.00 0.00 H new ATOM 0 HB2 SER A 444 2.539 11.602 10.615 1.00 0.00 H new ATOM 0 HB3 SER A 444 3.116 10.855 9.138 1.00 0.00 H new ATOM 0 HG SER A 444 4.009 13.471 9.786 1.00 0.00 H new ATOM 215 N THR A 445 0.401 11.695 7.195 1.00 0.00 N ATOM 216 CA THR A 445 -0.738 10.909 6.739 1.00 0.00 C ATOM 217 C THR A 445 -0.286 9.589 6.125 1.00 0.00 C ATOM 218 O THR A 445 -1.063 8.903 5.462 1.00 0.00 O ATOM 219 CB THR A 445 -1.576 11.683 5.704 1.00 0.00 C ATOM 220 OG1 THR A 445 -2.685 10.884 5.275 1.00 0.00 O ATOM 221 CG2 THR A 445 -0.729 12.070 4.502 1.00 0.00 C ATOM 0 H THR A 445 0.914 12.165 6.449 1.00 0.00 H new ATOM 0 HA THR A 445 -1.353 10.706 7.616 1.00 0.00 H new ATOM 0 HB THR A 445 -1.945 12.593 6.176 1.00 0.00 H new ATOM 0 HG1 THR A 445 -2.765 10.098 5.854 1.00 0.00 H new ATOM 0 HG21 THR A 445 -1.343 12.615 3.785 1.00 0.00 H new ATOM 0 HG22 THR A 445 0.097 12.702 4.827 1.00 0.00 H new ATOM 0 HG23 THR A 445 -0.334 11.170 4.031 1.00 0.00 H new ATOM 229 N VAL A 446 0.976 9.239 6.351 1.00 0.00 N ATOM 230 CA VAL A 446 1.532 7.999 5.822 1.00 0.00 C ATOM 231 C VAL A 446 1.749 6.976 6.931 1.00 0.00 C ATOM 232 O VAL A 446 2.544 7.195 7.844 1.00 0.00 O ATOM 233 CB VAL A 446 2.869 8.247 5.099 1.00 0.00 C ATOM 234 CG1 VAL A 446 3.428 6.944 4.548 1.00 0.00 C ATOM 235 CG2 VAL A 446 2.692 9.272 3.989 1.00 0.00 C ATOM 0 H VAL A 446 1.633 9.797 6.897 1.00 0.00 H new ATOM 0 HA VAL A 446 0.808 7.607 5.108 1.00 0.00 H new ATOM 0 HB VAL A 446 3.583 8.645 5.820 1.00 0.00 H new ATOM 0 HG11 VAL A 446 4.373 7.139 4.041 1.00 0.00 H new ATOM 0 HG12 VAL A 446 3.594 6.244 5.367 1.00 0.00 H new ATOM 0 HG13 VAL A 446 2.719 6.514 3.841 1.00 0.00 H new ATOM 0 HG21 VAL A 446 3.647 9.435 3.489 1.00 0.00 H new ATOM 0 HG22 VAL A 446 1.962 8.905 3.267 1.00 0.00 H new ATOM 0 HG23 VAL A 446 2.340 10.212 4.414 1.00 0.00 H new ATOM 245 N MET A 447 1.037 5.858 6.844 1.00 0.00 N ATOM 246 CA MET A 447 1.153 4.799 7.840 1.00 0.00 C ATOM 247 C MET A 447 1.927 3.609 7.282 1.00 0.00 C ATOM 248 O MET A 447 1.752 3.231 6.123 1.00 0.00 O ATOM 249 CB MET A 447 -0.235 4.349 8.302 1.00 0.00 C ATOM 250 CG MET A 447 -0.243 2.975 8.951 1.00 0.00 C ATOM 251 SD MET A 447 -1.908 2.397 9.333 1.00 0.00 S ATOM 252 CE MET A 447 -2.419 1.759 7.739 1.00 0.00 C ATOM 0 H MET A 447 0.374 5.661 6.094 1.00 0.00 H new ATOM 0 HA MET A 447 1.701 5.197 8.694 1.00 0.00 H new ATOM 0 HB2 MET A 447 -0.628 5.079 9.010 1.00 0.00 H new ATOM 0 HB3 MET A 447 -0.909 4.341 7.446 1.00 0.00 H new ATOM 0 HG2 MET A 447 0.242 2.260 8.286 1.00 0.00 H new ATOM 0 HG3 MET A 447 0.346 3.007 9.868 1.00 0.00 H new ATOM 0 HE1 MET A 447 -2.962 0.824 7.878 1.00 0.00 H new ATOM 0 HE2 MET A 447 -3.067 2.485 7.247 1.00 0.00 H new ATOM 0 HE3 MET A 447 -1.540 1.579 7.120 1.00 0.00 H new ATOM 262 N VAL A 448 2.783 3.023 8.112 1.00 0.00 N ATOM 263 CA VAL A 448 3.583 1.875 7.701 1.00 0.00 C ATOM 264 C VAL A 448 3.105 0.599 8.386 1.00 0.00 C ATOM 265 O VAL A 448 2.866 0.581 9.594 1.00 0.00 O ATOM 266 CB VAL A 448 5.075 2.088 8.020 1.00 0.00 C ATOM 267 CG1 VAL A 448 5.299 2.130 9.523 1.00 0.00 C ATOM 268 CG2 VAL A 448 5.917 0.997 7.377 1.00 0.00 C ATOM 0 H VAL A 448 2.941 3.324 9.074 1.00 0.00 H new ATOM 0 HA VAL A 448 3.461 1.773 6.623 1.00 0.00 H new ATOM 0 HB VAL A 448 5.385 3.047 7.604 1.00 0.00 H new ATOM 0 HG11 VAL A 448 6.359 2.281 9.729 1.00 0.00 H new ATOM 0 HG12 VAL A 448 4.725 2.951 9.954 1.00 0.00 H new ATOM 0 HG13 VAL A 448 4.974 1.188 9.966 1.00 0.00 H new ATOM 0 HG21 VAL A 448 6.968 1.163 7.612 1.00 0.00 H new ATOM 0 HG22 VAL A 448 5.608 0.025 7.761 1.00 0.00 H new ATOM 0 HG23 VAL A 448 5.779 1.020 6.296 1.00 0.00 H new ATOM 278 N LEU A 449 2.969 -0.468 7.606 1.00 0.00 N ATOM 279 CA LEU A 449 2.520 -1.751 8.136 1.00 0.00 C ATOM 280 C LEU A 449 3.636 -2.788 8.068 1.00 0.00 C ATOM 281 O LEU A 449 4.359 -2.873 7.075 1.00 0.00 O ATOM 282 CB LEU A 449 1.299 -2.247 7.360 1.00 0.00 C ATOM 283 CG LEU A 449 0.195 -1.218 7.118 1.00 0.00 C ATOM 284 CD1 LEU A 449 -0.797 -1.732 6.085 1.00 0.00 C ATOM 285 CD2 LEU A 449 -0.516 -0.881 8.420 1.00 0.00 C ATOM 0 H LEU A 449 3.163 -0.470 6.605 1.00 0.00 H new ATOM 0 HA LEU A 449 2.245 -1.608 9.181 1.00 0.00 H new ATOM 0 HB2 LEU A 449 1.636 -2.623 6.394 1.00 0.00 H new ATOM 0 HB3 LEU A 449 0.869 -3.091 7.899 1.00 0.00 H new ATOM 0 HG LEU A 449 0.653 -0.308 6.731 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -1.576 -0.986 5.926 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.278 -1.921 5.145 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.249 -2.657 6.443 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -1.299 -0.147 8.228 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -0.961 -1.785 8.836 1.00 0.00 H new ATOM 0 HD23 LEU A 449 0.201 -0.469 9.130 1.00 0.00 H new ATOM 297 N ARG A 450 3.770 -3.577 9.130 1.00 0.00 N ATOM 298 CA ARG A 450 4.797 -4.609 9.191 1.00 0.00 C ATOM 299 C ARG A 450 4.210 -5.932 9.675 1.00 0.00 C ATOM 300 O ARG A 450 3.046 -5.999 10.067 1.00 0.00 O ATOM 301 CB ARG A 450 5.934 -4.174 10.117 1.00 0.00 C ATOM 302 CG ARG A 450 6.495 -2.800 9.788 1.00 0.00 C ATOM 303 CD ARG A 450 7.215 -2.192 10.982 1.00 0.00 C ATOM 304 NE ARG A 450 6.282 -1.704 11.994 1.00 0.00 N ATOM 305 CZ ARG A 450 6.643 -0.943 13.021 1.00 0.00 C ATOM 306 NH1 ARG A 450 7.911 -0.585 13.171 1.00 0.00 N ATOM 307 NH2 ARG A 450 5.735 -0.539 13.900 1.00 0.00 N ATOM 0 H ARG A 450 3.179 -3.520 9.960 1.00 0.00 H new ATOM 0 HA ARG A 450 5.192 -4.753 8.185 1.00 0.00 H new ATOM 0 HB2 ARG A 450 5.573 -4.173 11.146 1.00 0.00 H new ATOM 0 HB3 ARG A 450 6.738 -4.908 10.061 1.00 0.00 H new ATOM 0 HG2 ARG A 450 7.184 -2.879 8.947 1.00 0.00 H new ATOM 0 HG3 ARG A 450 5.685 -2.140 9.475 1.00 0.00 H new ATOM 0 HD2 ARG A 450 7.874 -2.938 11.426 1.00 0.00 H new ATOM 0 HD3 ARG A 450 7.846 -1.370 10.644 1.00 0.00 H new ATOM 0 HE ARG A 450 5.299 -1.962 11.907 1.00 0.00 H new ATOM 0 HH11 ARG A 450 8.611 -0.894 12.497 1.00 0.00 H new ATOM 0 HH12 ARG A 450 8.186 -0.001 13.960 1.00 0.00 H new ATOM 0 HH21 ARG A 450 4.759 -0.813 13.787 1.00 0.00 H new ATOM 0 HH22 ARG A 450 6.013 0.045 14.688 1.00 0.00 H new ATOM 321 N ASN A 451 5.025 -6.982 9.643 1.00 0.00 N ATOM 322 CA ASN A 451 4.586 -8.303 10.078 1.00 0.00 C ATOM 323 C ASN A 451 3.136 -8.555 9.675 1.00 0.00 C ATOM 324 O ASN A 451 2.333 -9.030 10.477 1.00 0.00 O ATOM 325 CB ASN A 451 4.737 -8.440 11.595 1.00 0.00 C ATOM 326 CG ASN A 451 4.996 -9.871 12.023 1.00 0.00 C ATOM 327 OD1 ASN A 451 5.596 -10.653 11.285 1.00 0.00 O ATOM 328 ND2 ASN A 451 4.542 -10.221 13.221 1.00 0.00 N ATOM 0 H ASN A 451 5.992 -6.944 9.321 1.00 0.00 H new ATOM 0 HA ASN A 451 5.215 -9.047 9.588 1.00 0.00 H new ATOM 0 HB2 ASN A 451 5.558 -7.808 11.934 1.00 0.00 H new ATOM 0 HB3 ASN A 451 3.832 -8.076 12.082 1.00 0.00 H new ATOM 0 HD21 ASN A 451 4.685 -11.171 13.563 1.00 0.00 H new ATOM 0 HD22 ASN A 451 4.050 -9.540 13.799 1.00 0.00 H new ATOM 335 N MET A 452 2.811 -8.233 8.428 1.00 0.00 N ATOM 336 CA MET A 452 1.458 -8.426 7.917 1.00 0.00 C ATOM 337 C MET A 452 1.382 -9.667 7.034 1.00 0.00 C ATOM 338 O MET A 452 0.690 -10.632 7.360 1.00 0.00 O ATOM 339 CB MET A 452 1.007 -7.196 7.128 1.00 0.00 C ATOM 340 CG MET A 452 -0.422 -7.290 6.619 1.00 0.00 C ATOM 341 SD MET A 452 -0.874 -5.905 5.557 1.00 0.00 S ATOM 342 CE MET A 452 -2.632 -6.188 5.361 1.00 0.00 C ATOM 0 H MET A 452 3.465 -7.837 7.752 1.00 0.00 H new ATOM 0 HA MET A 452 0.792 -8.566 8.768 1.00 0.00 H new ATOM 0 HB2 MET A 452 1.101 -6.314 7.761 1.00 0.00 H new ATOM 0 HB3 MET A 452 1.677 -7.053 6.280 1.00 0.00 H new ATOM 0 HG2 MET A 452 -0.546 -8.222 6.067 1.00 0.00 H new ATOM 0 HG3 MET A 452 -1.104 -7.329 7.468 1.00 0.00 H new ATOM 0 HE1 MET A 452 -3.057 -5.410 4.726 1.00 0.00 H new ATOM 0 HE2 MET A 452 -2.795 -7.162 4.900 1.00 0.00 H new ATOM 0 HE3 MET A 452 -3.115 -6.164 6.338 1.00 0.00 H new ATOM 352 N VAL A 453 2.098 -9.636 5.915 1.00 0.00 N ATOM 353 CA VAL A 453 2.113 -10.759 4.985 1.00 0.00 C ATOM 354 C VAL A 453 3.529 -11.059 4.507 1.00 0.00 C ATOM 355 O VAL A 453 4.237 -10.170 4.034 1.00 0.00 O ATOM 356 CB VAL A 453 1.217 -10.486 3.762 1.00 0.00 C ATOM 357 CG1 VAL A 453 -0.250 -10.653 4.126 1.00 0.00 C ATOM 358 CG2 VAL A 453 1.482 -9.095 3.207 1.00 0.00 C ATOM 0 H VAL A 453 2.676 -8.845 5.630 1.00 0.00 H new ATOM 0 HA VAL A 453 1.725 -11.623 5.525 1.00 0.00 H new ATOM 0 HB VAL A 453 1.459 -11.213 2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -0.867 -10.456 3.249 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -0.425 -11.672 4.472 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -0.511 -9.951 4.918 1.00 0.00 H new ATOM 0 HG21 VAL A 453 0.840 -8.919 2.344 1.00 0.00 H new ATOM 0 HG22 VAL A 453 1.270 -8.351 3.974 1.00 0.00 H new ATOM 0 HG23 VAL A 453 2.526 -9.017 2.905 1.00 0.00 H new ATOM 368 N ASP A 454 3.936 -12.318 4.633 1.00 0.00 N ATOM 369 CA ASP A 454 5.268 -12.736 4.213 1.00 0.00 C ATOM 370 C ASP A 454 5.560 -12.270 2.790 1.00 0.00 C ATOM 371 O ASP A 454 4.656 -11.964 2.013 1.00 0.00 O ATOM 372 CB ASP A 454 5.399 -14.258 4.302 1.00 0.00 C ATOM 373 CG ASP A 454 5.810 -14.724 5.684 1.00 0.00 C ATOM 374 OD1 ASP A 454 6.587 -14.004 6.346 1.00 0.00 O ATOM 375 OD2 ASP A 454 5.355 -15.808 6.105 1.00 0.00 O ATOM 0 H ASP A 454 3.362 -13.066 5.023 1.00 0.00 H new ATOM 0 HA ASP A 454 5.995 -12.276 4.883 1.00 0.00 H new ATOM 0 HB2 ASP A 454 4.448 -14.718 4.035 1.00 0.00 H new ATOM 0 HB3 ASP A 454 6.134 -14.600 3.573 1.00 0.00 H new ATOM 380 N PRO A 455 6.854 -12.213 2.440 1.00 0.00 N ATOM 381 CA PRO A 455 7.296 -11.784 1.110 1.00 0.00 C ATOM 382 C PRO A 455 6.947 -12.800 0.028 1.00 0.00 C ATOM 383 O PRO A 455 7.184 -12.567 -1.158 1.00 0.00 O ATOM 384 CB PRO A 455 8.814 -11.665 1.262 1.00 0.00 C ATOM 385 CG PRO A 455 9.157 -12.593 2.375 1.00 0.00 C ATOM 386 CD PRO A 455 7.985 -12.563 3.316 1.00 0.00 C ATOM 0 HA PRO A 455 6.811 -10.859 0.798 1.00 0.00 H new ATOM 0 HB2 PRO A 455 9.327 -11.944 0.342 1.00 0.00 H new ATOM 0 HB3 PRO A 455 9.110 -10.642 1.494 1.00 0.00 H new ATOM 0 HG2 PRO A 455 9.332 -13.602 2.002 1.00 0.00 H new ATOM 0 HG3 PRO A 455 10.070 -12.277 2.879 1.00 0.00 H new ATOM 0 HD2 PRO A 455 7.834 -13.527 3.801 1.00 0.00 H new ATOM 0 HD3 PRO A 455 8.124 -11.826 4.107 1.00 0.00 H new ATOM 394 N LYS A 456 6.381 -13.929 0.443 1.00 0.00 N ATOM 395 CA LYS A 456 5.997 -14.981 -0.491 1.00 0.00 C ATOM 396 C LYS A 456 4.596 -14.735 -1.041 1.00 0.00 C ATOM 397 O LYS A 456 4.293 -15.098 -2.178 1.00 0.00 O ATOM 398 CB LYS A 456 6.054 -16.347 0.197 1.00 0.00 C ATOM 399 CG LYS A 456 7.417 -16.679 0.779 1.00 0.00 C ATOM 400 CD LYS A 456 7.485 -18.120 1.254 1.00 0.00 C ATOM 401 CE LYS A 456 6.735 -18.311 2.564 1.00 0.00 C ATOM 402 NZ LYS A 456 6.524 -19.752 2.877 1.00 0.00 N ATOM 0 H LYS A 456 6.178 -14.139 1.420 1.00 0.00 H new ATOM 0 HA LYS A 456 6.702 -14.970 -1.323 1.00 0.00 H new ATOM 0 HB2 LYS A 456 5.311 -16.374 0.995 1.00 0.00 H new ATOM 0 HB3 LYS A 456 5.778 -17.118 -0.522 1.00 0.00 H new ATOM 0 HG2 LYS A 456 8.187 -16.506 0.027 1.00 0.00 H new ATOM 0 HG3 LYS A 456 7.630 -16.010 1.613 1.00 0.00 H new ATOM 0 HD2 LYS A 456 7.062 -18.776 0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 456 8.527 -18.413 1.384 1.00 0.00 H new ATOM 0 HE2 LYS A 456 7.293 -17.841 3.374 1.00 0.00 H new ATOM 0 HE3 LYS A 456 5.770 -17.807 2.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 6.010 -19.840 3.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 5.970 -20.195 2.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 7.445 -20.228 2.956 1.00 0.00 H new ATOM 416 N ASP A 457 3.746 -14.116 -0.229 1.00 0.00 N ATOM 417 CA ASP A 457 2.378 -13.819 -0.636 1.00 0.00 C ATOM 418 C ASP A 457 2.314 -12.509 -1.415 1.00 0.00 C ATOM 419 O ASP A 457 1.236 -11.955 -1.631 1.00 0.00 O ATOM 420 CB ASP A 457 1.464 -13.744 0.588 1.00 0.00 C ATOM 421 CG ASP A 457 1.119 -15.114 1.138 1.00 0.00 C ATOM 422 OD1 ASP A 457 2.051 -15.852 1.517 1.00 0.00 O ATOM 423 OD2 ASP A 457 -0.084 -15.447 1.189 1.00 0.00 O ATOM 0 H ASP A 457 3.981 -13.810 0.715 1.00 0.00 H new ATOM 0 HA ASP A 457 2.036 -14.624 -1.286 1.00 0.00 H new ATOM 0 HB2 ASP A 457 1.951 -13.156 1.366 1.00 0.00 H new ATOM 0 HB3 ASP A 457 0.546 -13.221 0.321 1.00 0.00 H new ATOM 428 N ILE A 458 3.476 -12.018 -1.833 1.00 0.00 N ATOM 429 CA ILE A 458 3.552 -10.773 -2.588 1.00 0.00 C ATOM 430 C ILE A 458 3.098 -10.976 -4.029 1.00 0.00 C ATOM 431 O ILE A 458 3.847 -11.487 -4.861 1.00 0.00 O ATOM 432 CB ILE A 458 4.982 -10.201 -2.588 1.00 0.00 C ATOM 433 CG1 ILE A 458 5.435 -9.903 -1.157 1.00 0.00 C ATOM 434 CG2 ILE A 458 5.050 -8.945 -3.443 1.00 0.00 C ATOM 435 CD1 ILE A 458 4.510 -8.966 -0.413 1.00 0.00 C ATOM 0 H ILE A 458 4.378 -12.463 -1.662 1.00 0.00 H new ATOM 0 HA ILE A 458 2.886 -10.064 -2.096 1.00 0.00 H new ATOM 0 HB ILE A 458 5.655 -10.944 -3.015 1.00 0.00 H new ATOM 0 HG12 ILE A 458 5.510 -10.840 -0.606 1.00 0.00 H new ATOM 0 HG13 ILE A 458 6.434 -9.468 -1.184 1.00 0.00 H new ATOM 0 HG21 ILE A 458 6.067 -8.553 -3.433 1.00 0.00 H new ATOM 0 HG22 ILE A 458 4.764 -9.186 -4.467 1.00 0.00 H new ATOM 0 HG23 ILE A 458 4.368 -8.195 -3.043 1.00 0.00 H new ATOM 0 HD11 ILE A 458 4.893 -8.800 0.594 1.00 0.00 H new ATOM 0 HD12 ILE A 458 4.454 -8.014 -0.942 1.00 0.00 H new ATOM 0 HD13 ILE A 458 3.515 -9.408 -0.354 1.00 0.00 H new ATOM 447 N ASP A 459 1.866 -10.569 -4.318 1.00 0.00 N ATOM 448 CA ASP A 459 1.312 -10.702 -5.660 1.00 0.00 C ATOM 449 C ASP A 459 0.516 -9.460 -6.045 1.00 0.00 C ATOM 450 O ASP A 459 0.164 -8.646 -5.191 1.00 0.00 O ATOM 451 CB ASP A 459 0.420 -11.942 -5.745 1.00 0.00 C ATOM 452 CG ASP A 459 1.191 -13.227 -5.517 1.00 0.00 C ATOM 453 OD1 ASP A 459 2.399 -13.259 -5.833 1.00 0.00 O ATOM 454 OD2 ASP A 459 0.587 -14.200 -5.020 1.00 0.00 O ATOM 0 H ASP A 459 1.233 -10.144 -3.641 1.00 0.00 H new ATOM 0 HA ASP A 459 2.141 -10.811 -6.360 1.00 0.00 H new ATOM 0 HB2 ASP A 459 -0.377 -11.864 -5.006 1.00 0.00 H new ATOM 0 HB3 ASP A 459 -0.056 -11.977 -6.725 1.00 0.00 H new ATOM 459 N ASP A 460 0.236 -9.319 -7.336 1.00 0.00 N ATOM 460 CA ASP A 460 -0.519 -8.176 -7.835 1.00 0.00 C ATOM 461 C ASP A 460 -1.892 -8.101 -7.174 1.00 0.00 C ATOM 462 O ASP A 460 -2.384 -7.016 -6.863 1.00 0.00 O ATOM 463 CB ASP A 460 -0.675 -8.263 -9.354 1.00 0.00 C ATOM 464 CG ASP A 460 0.607 -8.687 -10.044 1.00 0.00 C ATOM 465 OD1 ASP A 460 1.625 -7.978 -9.892 1.00 0.00 O ATOM 466 OD2 ASP A 460 0.593 -9.727 -10.734 1.00 0.00 O ATOM 0 H ASP A 460 0.521 -9.983 -8.056 1.00 0.00 H new ATOM 0 HA ASP A 460 0.035 -7.271 -7.586 1.00 0.00 H new ATOM 0 HB2 ASP A 460 -1.466 -8.973 -9.595 1.00 0.00 H new ATOM 0 HB3 ASP A 460 -0.989 -7.293 -9.740 1.00 0.00 H new ATOM 471 N ASP A 461 -2.506 -9.260 -6.964 1.00 0.00 N ATOM 472 CA ASP A 461 -3.822 -9.326 -6.340 1.00 0.00 C ATOM 473 C ASP A 461 -3.790 -8.727 -4.938 1.00 0.00 C ATOM 474 O ASP A 461 -4.704 -8.003 -4.539 1.00 0.00 O ATOM 475 CB ASP A 461 -4.308 -10.775 -6.277 1.00 0.00 C ATOM 476 CG ASP A 461 -3.292 -11.699 -5.635 1.00 0.00 C ATOM 477 OD1 ASP A 461 -2.367 -12.148 -6.343 1.00 0.00 O ATOM 478 OD2 ASP A 461 -3.422 -11.972 -4.423 1.00 0.00 O ATOM 0 H ASP A 461 -2.113 -10.167 -7.217 1.00 0.00 H new ATOM 0 HA ASP A 461 -4.514 -8.744 -6.949 1.00 0.00 H new ATOM 0 HB2 ASP A 461 -5.241 -10.818 -5.714 1.00 0.00 H new ATOM 0 HB3 ASP A 461 -4.528 -11.126 -7.285 1.00 0.00 H new ATOM 483 N LEU A 462 -2.733 -9.032 -4.193 1.00 0.00 N ATOM 484 CA LEU A 462 -2.581 -8.524 -2.834 1.00 0.00 C ATOM 485 C LEU A 462 -2.739 -7.008 -2.799 1.00 0.00 C ATOM 486 O LEU A 462 -3.525 -6.474 -2.017 1.00 0.00 O ATOM 487 CB LEU A 462 -1.216 -8.920 -2.270 1.00 0.00 C ATOM 488 CG LEU A 462 -0.996 -8.638 -0.783 1.00 0.00 C ATOM 489 CD1 LEU A 462 -1.878 -9.539 0.067 1.00 0.00 C ATOM 490 CD2 LEU A 462 0.469 -8.822 -0.416 1.00 0.00 C ATOM 0 H LEU A 462 -1.968 -9.629 -4.507 1.00 0.00 H new ATOM 0 HA LEU A 462 -3.363 -8.966 -2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 462 -1.070 -9.986 -2.443 1.00 0.00 H new ATOM 0 HB3 LEU A 462 -0.446 -8.397 -2.836 1.00 0.00 H new ATOM 0 HG LEU A 462 -1.272 -7.602 -0.585 1.00 0.00 H new ATOM 0 HD11 LEU A 462 -1.708 -9.324 1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 462 -2.925 -9.358 -0.176 1.00 0.00 H new ATOM 0 HD13 LEU A 462 -1.634 -10.582 -0.135 1.00 0.00 H new ATOM 0 HD21 LEU A 462 0.607 -8.617 0.646 1.00 0.00 H new ATOM 0 HD22 LEU A 462 0.772 -9.847 -0.630 1.00 0.00 H new ATOM 0 HD23 LEU A 462 1.080 -8.134 -1.000 1.00 0.00 H new ATOM 502 N GLU A 463 -1.988 -6.320 -3.654 1.00 0.00 N ATOM 503 CA GLU A 463 -2.047 -4.864 -3.721 1.00 0.00 C ATOM 504 C GLU A 463 -3.481 -4.369 -3.557 1.00 0.00 C ATOM 505 O GLU A 463 -3.762 -3.516 -2.716 1.00 0.00 O ATOM 506 CB GLU A 463 -1.473 -4.369 -5.050 1.00 0.00 C ATOM 507 CG GLU A 463 -1.525 -2.859 -5.211 1.00 0.00 C ATOM 508 CD GLU A 463 -0.919 -2.391 -6.520 1.00 0.00 C ATOM 509 OE1 GLU A 463 -1.650 -2.351 -7.531 1.00 0.00 O ATOM 510 OE2 GLU A 463 0.286 -2.064 -6.532 1.00 0.00 O ATOM 0 H GLU A 463 -1.333 -6.747 -4.309 1.00 0.00 H new ATOM 0 HA GLU A 463 -1.448 -4.464 -2.903 1.00 0.00 H new ATOM 0 HB2 GLU A 463 -0.438 -4.699 -5.134 1.00 0.00 H new ATOM 0 HB3 GLU A 463 -2.023 -4.832 -5.869 1.00 0.00 H new ATOM 0 HG2 GLU A 463 -2.562 -2.527 -5.156 1.00 0.00 H new ATOM 0 HG3 GLU A 463 -0.995 -2.390 -4.382 1.00 0.00 H new ATOM 517 N GLY A 464 -4.384 -4.910 -4.369 1.00 0.00 N ATOM 518 CA GLY A 464 -5.777 -4.511 -4.299 1.00 0.00 C ATOM 519 C GLY A 464 -6.417 -4.869 -2.973 1.00 0.00 C ATOM 520 O GLY A 464 -7.138 -4.062 -2.387 1.00 0.00 O ATOM 0 H GLY A 464 -4.176 -5.617 -5.074 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -5.852 -3.435 -4.456 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -6.330 -4.990 -5.107 1.00 0.00 H new ATOM 524 N GLU A 465 -6.154 -6.083 -2.499 1.00 0.00 N ATOM 525 CA GLU A 465 -6.713 -6.546 -1.234 1.00 0.00 C ATOM 526 C GLU A 465 -6.479 -5.520 -0.128 1.00 0.00 C ATOM 527 O GLU A 465 -7.408 -5.129 0.578 1.00 0.00 O ATOM 528 CB GLU A 465 -6.094 -7.888 -0.838 1.00 0.00 C ATOM 529 CG GLU A 465 -6.298 -8.981 -1.874 1.00 0.00 C ATOM 530 CD GLU A 465 -6.038 -10.368 -1.318 1.00 0.00 C ATOM 531 OE1 GLU A 465 -6.459 -10.635 -0.173 1.00 0.00 O ATOM 532 OE2 GLU A 465 -5.416 -11.185 -2.027 1.00 0.00 O ATOM 0 H GLU A 465 -5.558 -6.763 -2.971 1.00 0.00 H new ATOM 0 HA GLU A 465 -7.787 -6.674 -1.366 1.00 0.00 H new ATOM 0 HB2 GLU A 465 -5.025 -7.751 -0.672 1.00 0.00 H new ATOM 0 HB3 GLU A 465 -6.525 -8.212 0.109 1.00 0.00 H new ATOM 0 HG2 GLU A 465 -7.319 -8.931 -2.253 1.00 0.00 H new ATOM 0 HG3 GLU A 465 -5.635 -8.803 -2.720 1.00 0.00 H new ATOM 539 N VAL A 466 -5.230 -5.089 0.016 1.00 0.00 N ATOM 540 CA VAL A 466 -4.872 -4.109 1.035 1.00 0.00 C ATOM 541 C VAL A 466 -5.562 -2.774 0.779 1.00 0.00 C ATOM 542 O VAL A 466 -6.038 -2.119 1.707 1.00 0.00 O ATOM 543 CB VAL A 466 -3.349 -3.885 1.089 1.00 0.00 C ATOM 544 CG1 VAL A 466 -3.001 -2.828 2.125 1.00 0.00 C ATOM 545 CG2 VAL A 466 -2.630 -5.192 1.386 1.00 0.00 C ATOM 0 H VAL A 466 -4.449 -5.403 -0.560 1.00 0.00 H new ATOM 0 HA VAL A 466 -5.206 -4.511 1.992 1.00 0.00 H new ATOM 0 HB VAL A 466 -3.017 -3.527 0.115 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -1.921 -2.683 2.149 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -3.487 -1.888 1.863 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.345 -3.154 3.107 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -1.555 -5.016 1.421 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -2.965 -5.581 2.347 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -2.854 -5.917 0.603 1.00 0.00 H new ATOM 555 N THR A 467 -5.614 -2.374 -0.488 1.00 0.00 N ATOM 556 CA THR A 467 -6.245 -1.116 -0.867 1.00 0.00 C ATOM 557 C THR A 467 -7.704 -1.079 -0.429 1.00 0.00 C ATOM 558 O THR A 467 -8.171 -0.081 0.119 1.00 0.00 O ATOM 559 CB THR A 467 -6.172 -0.887 -2.389 1.00 0.00 C ATOM 560 OG1 THR A 467 -4.805 -0.852 -2.814 1.00 0.00 O ATOM 561 CG2 THR A 467 -6.862 0.412 -2.775 1.00 0.00 C ATOM 0 H THR A 467 -5.227 -2.903 -1.269 1.00 0.00 H new ATOM 0 HA THR A 467 -5.696 -0.322 -0.361 1.00 0.00 H new ATOM 0 HB THR A 467 -6.685 -1.712 -2.883 1.00 0.00 H new ATOM 0 HG1 THR A 467 -4.435 -1.759 -2.800 1.00 0.00 H new ATOM 0 HG21 THR A 467 -6.797 0.552 -3.854 1.00 0.00 H new ATOM 0 HG22 THR A 467 -7.910 0.370 -2.477 1.00 0.00 H new ATOM 0 HG23 THR A 467 -6.374 1.247 -2.271 1.00 0.00 H new ATOM 569 N GLU A 468 -8.419 -2.173 -0.672 1.00 0.00 N ATOM 570 CA GLU A 468 -9.826 -2.264 -0.302 1.00 0.00 C ATOM 571 C GLU A 468 -9.984 -2.371 1.212 1.00 0.00 C ATOM 572 O GLU A 468 -10.979 -1.917 1.776 1.00 0.00 O ATOM 573 CB GLU A 468 -10.478 -3.470 -0.980 1.00 0.00 C ATOM 574 CG GLU A 468 -9.786 -4.788 -0.676 1.00 0.00 C ATOM 575 CD GLU A 468 -10.534 -5.983 -1.233 1.00 0.00 C ATOM 576 OE1 GLU A 468 -10.915 -5.941 -2.422 1.00 0.00 O ATOM 577 OE2 GLU A 468 -10.738 -6.959 -0.482 1.00 0.00 O ATOM 0 H GLU A 468 -8.047 -3.008 -1.123 1.00 0.00 H new ATOM 0 HA GLU A 468 -10.323 -1.355 -0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 468 -11.519 -3.535 -0.664 1.00 0.00 H new ATOM 0 HB3 GLU A 468 -10.482 -3.312 -2.058 1.00 0.00 H new ATOM 0 HG2 GLU A 468 -8.779 -4.769 -1.092 1.00 0.00 H new ATOM 0 HG3 GLU A 468 -9.684 -4.899 0.403 1.00 0.00 H new ATOM 584 N GLU A 469 -8.995 -2.975 1.864 1.00 0.00 N ATOM 585 CA GLU A 469 -9.025 -3.143 3.312 1.00 0.00 C ATOM 586 C GLU A 469 -8.936 -1.793 4.018 1.00 0.00 C ATOM 587 O GLU A 469 -9.719 -1.501 4.922 1.00 0.00 O ATOM 588 CB GLU A 469 -7.877 -4.046 3.767 1.00 0.00 C ATOM 589 CG GLU A 469 -7.799 -4.219 5.274 1.00 0.00 C ATOM 590 CD GLU A 469 -6.690 -5.163 5.697 1.00 0.00 C ATOM 591 OE1 GLU A 469 -6.274 -5.998 4.867 1.00 0.00 O ATOM 592 OE2 GLU A 469 -6.238 -5.066 6.857 1.00 0.00 O ATOM 0 H GLU A 469 -8.164 -3.356 1.412 1.00 0.00 H new ATOM 0 HA GLU A 469 -9.973 -3.611 3.578 1.00 0.00 H new ATOM 0 HB2 GLU A 469 -7.991 -5.026 3.303 1.00 0.00 H new ATOM 0 HB3 GLU A 469 -6.935 -3.631 3.408 1.00 0.00 H new ATOM 0 HG2 GLU A 469 -7.640 -3.246 5.740 1.00 0.00 H new ATOM 0 HG3 GLU A 469 -8.753 -4.597 5.642 1.00 0.00 H new ATOM 599 N CYS A 470 -7.976 -0.976 3.599 1.00 0.00 N ATOM 600 CA CYS A 470 -7.782 0.343 4.192 1.00 0.00 C ATOM 601 C CYS A 470 -8.985 1.242 3.924 1.00 0.00 C ATOM 602 O CYS A 470 -9.354 2.068 4.758 1.00 0.00 O ATOM 603 CB CYS A 470 -6.513 0.992 3.639 1.00 0.00 C ATOM 604 SG CYS A 470 -4.995 0.087 4.021 1.00 0.00 S ATOM 0 H CYS A 470 -7.320 -1.203 2.852 1.00 0.00 H new ATOM 0 HA CYS A 470 -7.678 0.218 5.270 1.00 0.00 H new ATOM 0 HB2 CYS A 470 -6.606 1.083 2.557 1.00 0.00 H new ATOM 0 HB3 CYS A 470 -6.431 2.003 4.038 1.00 0.00 H new ATOM 0 HG CYS A 470 -4.933 -0.985 3.289 1.00 0.00 H new ATOM 610 N GLY A 471 -9.593 1.075 2.753 1.00 0.00 N ATOM 611 CA GLY A 471 -10.747 1.879 2.395 1.00 0.00 C ATOM 612 C GLY A 471 -11.641 2.171 3.583 1.00 0.00 C ATOM 613 O GLY A 471 -12.140 3.286 3.736 1.00 0.00 O ATOM 0 H GLY A 471 -9.307 0.397 2.046 1.00 0.00 H new ATOM 0 HA2 GLY A 471 -10.410 2.819 1.958 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -11.324 1.361 1.629 1.00 0.00 H new ATOM 617 N LYS A 472 -11.848 1.166 4.427 1.00 0.00 N ATOM 618 CA LYS A 472 -12.689 1.318 5.609 1.00 0.00 C ATOM 619 C LYS A 472 -12.323 2.584 6.377 1.00 0.00 C ATOM 620 O LYS A 472 -13.118 3.521 6.465 1.00 0.00 O ATOM 621 CB LYS A 472 -12.550 0.097 6.521 1.00 0.00 C ATOM 622 CG LYS A 472 -13.472 -1.050 6.146 1.00 0.00 C ATOM 623 CD LYS A 472 -12.808 -2.000 5.163 1.00 0.00 C ATOM 624 CE LYS A 472 -12.060 -3.112 5.881 1.00 0.00 C ATOM 625 NZ LYS A 472 -11.957 -4.341 5.047 1.00 0.00 N ATOM 0 H LYS A 472 -11.444 0.236 4.314 1.00 0.00 H new ATOM 0 HA LYS A 472 -13.725 1.400 5.279 1.00 0.00 H new ATOM 0 HB2 LYS A 472 -11.518 -0.253 6.491 1.00 0.00 H new ATOM 0 HB3 LYS A 472 -12.756 0.396 7.549 1.00 0.00 H new ATOM 0 HG2 LYS A 472 -13.759 -1.596 7.045 1.00 0.00 H new ATOM 0 HG3 LYS A 472 -14.388 -0.654 5.708 1.00 0.00 H new ATOM 0 HD2 LYS A 472 -13.563 -2.433 4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 472 -12.116 -1.445 4.530 1.00 0.00 H new ATOM 0 HE2 LYS A 472 -11.060 -2.766 6.143 1.00 0.00 H new ATOM 0 HE3 LYS A 472 -12.570 -3.349 6.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 472 -11.038 -4.798 5.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 472 -12.722 -4.998 5.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 472 -12.039 -4.086 4.042 1.00 0.00 H new ATOM 639 N PHE A 473 -11.115 2.607 6.931 1.00 0.00 N ATOM 640 CA PHE A 473 -10.644 3.758 7.691 1.00 0.00 C ATOM 641 C PHE A 473 -10.967 5.060 6.963 1.00 0.00 C ATOM 642 O PHE A 473 -11.604 5.953 7.520 1.00 0.00 O ATOM 643 CB PHE A 473 -9.136 3.655 7.932 1.00 0.00 C ATOM 644 CG PHE A 473 -8.688 2.283 8.345 1.00 0.00 C ATOM 645 CD1 PHE A 473 -8.936 1.814 9.625 1.00 0.00 C ATOM 646 CD2 PHE A 473 -8.017 1.461 7.454 1.00 0.00 C ATOM 647 CE1 PHE A 473 -8.525 0.552 10.009 1.00 0.00 C ATOM 648 CE2 PHE A 473 -7.604 0.197 7.832 1.00 0.00 C ATOM 649 CZ PHE A 473 -7.857 -0.257 9.111 1.00 0.00 C ATOM 0 H PHE A 473 -10.445 1.841 6.867 1.00 0.00 H new ATOM 0 HA PHE A 473 -11.159 3.763 8.652 1.00 0.00 H new ATOM 0 HB2 PHE A 473 -8.610 3.941 7.021 1.00 0.00 H new ATOM 0 HB3 PHE A 473 -8.850 4.370 8.704 1.00 0.00 H new ATOM 0 HD1 PHE A 473 -9.457 2.443 10.332 1.00 0.00 H new ATOM 0 HD2 PHE A 473 -7.814 1.812 6.453 1.00 0.00 H new ATOM 0 HE1 PHE A 473 -8.726 0.199 11.010 1.00 0.00 H new ATOM 0 HE2 PHE A 473 -7.084 -0.435 7.127 1.00 0.00 H new ATOM 0 HZ PHE A 473 -7.533 -1.243 9.409 1.00 0.00 H new ATOM 659 N GLY A 474 -10.521 5.159 5.715 1.00 0.00 N ATOM 660 CA GLY A 474 -10.771 6.354 4.931 1.00 0.00 C ATOM 661 C GLY A 474 -10.405 6.176 3.470 1.00 0.00 C ATOM 662 O GLY A 474 -10.127 5.064 3.024 1.00 0.00 O ATOM 0 H GLY A 474 -9.991 4.433 5.233 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -11.825 6.622 5.008 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -10.200 7.184 5.347 1.00 0.00 H new ATOM 666 N ALA A 475 -10.405 7.276 2.724 1.00 0.00 N ATOM 667 CA ALA A 475 -10.070 7.237 1.306 1.00 0.00 C ATOM 668 C ALA A 475 -8.583 6.967 1.100 1.00 0.00 C ATOM 669 O ALA A 475 -7.737 7.781 1.471 1.00 0.00 O ATOM 670 CB ALA A 475 -10.469 8.542 0.633 1.00 0.00 C ATOM 0 H ALA A 475 -10.633 8.205 3.078 1.00 0.00 H new ATOM 0 HA ALA A 475 -10.628 6.420 0.849 1.00 0.00 H new ATOM 0 HB1 ALA A 475 -10.213 8.499 -0.426 1.00 0.00 H new ATOM 0 HB2 ALA A 475 -11.543 8.693 0.741 1.00 0.00 H new ATOM 0 HB3 ALA A 475 -9.937 9.370 1.101 1.00 0.00 H new ATOM 676 N VAL A 476 -8.271 5.818 0.508 1.00 0.00 N ATOM 677 CA VAL A 476 -6.886 5.441 0.253 1.00 0.00 C ATOM 678 C VAL A 476 -6.248 6.362 -0.781 1.00 0.00 C ATOM 679 O VAL A 476 -6.769 6.531 -1.882 1.00 0.00 O ATOM 680 CB VAL A 476 -6.783 3.985 -0.239 1.00 0.00 C ATOM 681 CG1 VAL A 476 -5.333 3.618 -0.520 1.00 0.00 C ATOM 682 CG2 VAL A 476 -7.394 3.035 0.779 1.00 0.00 C ATOM 0 H VAL A 476 -8.959 5.132 0.196 1.00 0.00 H new ATOM 0 HA VAL A 476 -6.352 5.536 1.198 1.00 0.00 H new ATOM 0 HB VAL A 476 -7.343 3.893 -1.170 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.279 2.586 -0.867 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -4.932 4.280 -1.288 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -4.747 3.725 0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -7.313 2.011 0.415 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -6.863 3.127 1.727 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -8.445 3.286 0.926 1.00 0.00 H new ATOM 692 N ASN A 477 -5.115 6.954 -0.418 1.00 0.00 N ATOM 693 CA ASN A 477 -4.404 7.859 -1.314 1.00 0.00 C ATOM 694 C ASN A 477 -3.392 7.097 -2.165 1.00 0.00 C ATOM 695 O ASN A 477 -3.478 7.091 -3.393 1.00 0.00 O ATOM 696 CB ASN A 477 -3.693 8.951 -0.513 1.00 0.00 C ATOM 697 CG ASN A 477 -3.340 10.156 -1.363 1.00 0.00 C ATOM 698 OD1 ASN A 477 -2.883 10.017 -2.497 1.00 0.00 O ATOM 699 ND2 ASN A 477 -3.552 11.348 -0.817 1.00 0.00 N ATOM 0 H ASN A 477 -4.669 6.823 0.490 1.00 0.00 H new ATOM 0 HA ASN A 477 -5.135 8.322 -1.976 1.00 0.00 H new ATOM 0 HB2 ASN A 477 -4.332 9.267 0.312 1.00 0.00 H new ATOM 0 HB3 ASN A 477 -2.784 8.541 -0.073 1.00 0.00 H new ATOM 0 HD21 ASN A 477 -3.334 12.195 -1.342 1.00 0.00 H new ATOM 0 HD22 ASN A 477 -3.933 11.416 0.127 1.00 0.00 H new ATOM 706 N ARG A 478 -2.434 6.456 -1.504 1.00 0.00 N ATOM 707 CA ARG A 478 -1.406 5.691 -2.199 1.00 0.00 C ATOM 708 C ARG A 478 -1.059 4.420 -1.429 1.00 0.00 C ATOM 709 O ARG A 478 -1.156 4.379 -0.202 1.00 0.00 O ATOM 710 CB ARG A 478 -0.149 6.543 -2.390 1.00 0.00 C ATOM 711 CG ARG A 478 -0.200 7.435 -3.620 1.00 0.00 C ATOM 712 CD ARG A 478 1.181 7.955 -3.988 1.00 0.00 C ATOM 713 NE ARG A 478 1.222 8.480 -5.350 1.00 0.00 N ATOM 714 CZ ARG A 478 1.122 7.720 -6.435 1.00 0.00 C ATOM 715 NH1 ARG A 478 0.974 6.408 -6.317 1.00 0.00 N ATOM 716 NH2 ARG A 478 1.168 8.272 -7.641 1.00 0.00 N ATOM 0 H ARG A 478 -2.348 6.451 -0.488 1.00 0.00 H new ATOM 0 HA ARG A 478 -1.798 5.408 -3.176 1.00 0.00 H new ATOM 0 HB2 ARG A 478 -0.004 7.165 -1.506 1.00 0.00 H new ATOM 0 HB3 ARG A 478 0.718 5.886 -2.464 1.00 0.00 H new ATOM 0 HG2 ARG A 478 -0.615 6.877 -4.459 1.00 0.00 H new ATOM 0 HG3 ARG A 478 -0.869 8.275 -3.434 1.00 0.00 H new ATOM 0 HD2 ARG A 478 1.472 8.739 -3.288 1.00 0.00 H new ATOM 0 HD3 ARG A 478 1.910 7.151 -3.887 1.00 0.00 H new ATOM 0 HE ARG A 478 1.334 9.486 -5.475 1.00 0.00 H new ATOM 0 HH11 ARG A 478 0.937 5.980 -5.392 1.00 0.00 H new ATOM 0 HH12 ARG A 478 0.897 5.826 -7.151 1.00 0.00 H new ATOM 0 HH21 ARG A 478 1.280 9.281 -7.736 1.00 0.00 H new ATOM 0 HH22 ARG A 478 1.091 7.687 -8.473 1.00 0.00 H new ATOM 730 N VAL A 479 -0.655 3.385 -2.157 1.00 0.00 N ATOM 731 CA VAL A 479 -0.293 2.113 -1.543 1.00 0.00 C ATOM 732 C VAL A 479 0.917 1.494 -2.233 1.00 0.00 C ATOM 733 O VAL A 479 0.840 1.076 -3.389 1.00 0.00 O ATOM 734 CB VAL A 479 -1.464 1.113 -1.591 1.00 0.00 C ATOM 735 CG1 VAL A 479 -1.053 -0.221 -0.988 1.00 0.00 C ATOM 736 CG2 VAL A 479 -2.678 1.681 -0.872 1.00 0.00 C ATOM 0 H VAL A 479 -0.570 3.402 -3.173 1.00 0.00 H new ATOM 0 HA VAL A 479 -0.046 2.323 -0.502 1.00 0.00 H new ATOM 0 HB VAL A 479 -1.733 0.945 -2.634 1.00 0.00 H new ATOM 0 HG11 VAL A 479 -1.893 -0.914 -1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 479 -0.215 -0.632 -1.551 1.00 0.00 H new ATOM 0 HG13 VAL A 479 -0.756 -0.075 0.051 1.00 0.00 H new ATOM 0 HG21 VAL A 479 -3.496 0.962 -0.915 1.00 0.00 H new ATOM 0 HG22 VAL A 479 -2.424 1.880 0.169 1.00 0.00 H new ATOM 0 HG23 VAL A 479 -2.985 2.609 -1.354 1.00 0.00 H new ATOM 746 N ILE A 480 2.035 1.437 -1.517 1.00 0.00 N ATOM 747 CA ILE A 480 3.262 0.868 -2.060 1.00 0.00 C ATOM 748 C ILE A 480 3.829 -0.202 -1.133 1.00 0.00 C ATOM 749 O ILE A 480 3.976 0.019 0.070 1.00 0.00 O ATOM 750 CB ILE A 480 4.332 1.951 -2.290 1.00 0.00 C ATOM 751 CG1 ILE A 480 3.827 2.994 -3.290 1.00 0.00 C ATOM 752 CG2 ILE A 480 5.627 1.321 -2.781 1.00 0.00 C ATOM 753 CD1 ILE A 480 4.400 4.375 -3.063 1.00 0.00 C ATOM 0 H ILE A 480 2.116 1.778 -0.559 1.00 0.00 H new ATOM 0 HA ILE A 480 3.003 0.416 -3.018 1.00 0.00 H new ATOM 0 HB ILE A 480 4.531 2.451 -1.342 1.00 0.00 H new ATOM 0 HG12 ILE A 480 4.076 2.668 -4.300 1.00 0.00 H new ATOM 0 HG13 ILE A 480 2.740 3.046 -3.231 1.00 0.00 H new ATOM 0 HG21 ILE A 480 6.373 2.100 -2.939 1.00 0.00 H new ATOM 0 HG22 ILE A 480 5.993 0.614 -2.037 1.00 0.00 H new ATOM 0 HG23 ILE A 480 5.444 0.798 -3.720 1.00 0.00 H new ATOM 0 HD11 ILE A 480 3.999 5.062 -3.808 1.00 0.00 H new ATOM 0 HD12 ILE A 480 4.129 4.722 -2.066 1.00 0.00 H new ATOM 0 HD13 ILE A 480 5.486 4.338 -3.152 1.00 0.00 H new ATOM 765 N ILE A 481 4.146 -1.361 -1.700 1.00 0.00 N ATOM 766 CA ILE A 481 4.700 -2.464 -0.925 1.00 0.00 C ATOM 767 C ILE A 481 6.188 -2.641 -1.205 1.00 0.00 C ATOM 768 O ILE A 481 6.575 -3.177 -2.244 1.00 0.00 O ATOM 769 CB ILE A 481 3.971 -3.787 -1.228 1.00 0.00 C ATOM 770 CG1 ILE A 481 2.474 -3.646 -0.943 1.00 0.00 C ATOM 771 CG2 ILE A 481 4.568 -4.920 -0.407 1.00 0.00 C ATOM 772 CD1 ILE A 481 1.627 -4.690 -1.638 1.00 0.00 C ATOM 0 H ILE A 481 4.029 -1.560 -2.693 1.00 0.00 H new ATOM 0 HA ILE A 481 4.558 -2.213 0.126 1.00 0.00 H new ATOM 0 HB ILE A 481 4.100 -4.023 -2.284 1.00 0.00 H new ATOM 0 HG12 ILE A 481 2.309 -3.713 0.132 1.00 0.00 H new ATOM 0 HG13 ILE A 481 2.144 -2.655 -1.255 1.00 0.00 H new ATOM 0 HG21 ILE A 481 4.043 -5.848 -0.632 1.00 0.00 H new ATOM 0 HG22 ILE A 481 5.624 -5.031 -0.654 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.466 -4.693 0.654 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.577 -4.530 -1.392 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.763 -4.610 -2.717 1.00 0.00 H new ATOM 0 HD13 ILE A 481 1.930 -5.683 -1.307 1.00 0.00 H new ATOM 784 N TYR A 482 7.018 -2.187 -0.272 1.00 0.00 N ATOM 785 CA TYR A 482 8.465 -2.295 -0.419 1.00 0.00 C ATOM 786 C TYR A 482 9.021 -3.409 0.463 1.00 0.00 C ATOM 787 O TYR A 482 8.469 -3.711 1.520 1.00 0.00 O ATOM 788 CB TYR A 482 9.134 -0.966 -0.064 1.00 0.00 C ATOM 789 CG TYR A 482 10.540 -0.833 -0.605 1.00 0.00 C ATOM 790 CD1 TYR A 482 10.772 -0.306 -1.870 1.00 0.00 C ATOM 791 CD2 TYR A 482 11.636 -1.235 0.148 1.00 0.00 C ATOM 792 CE1 TYR A 482 12.054 -0.183 -2.368 1.00 0.00 C ATOM 793 CE2 TYR A 482 12.922 -1.114 -0.342 1.00 0.00 C ATOM 794 CZ TYR A 482 13.126 -0.588 -1.601 1.00 0.00 C ATOM 795 OH TYR A 482 14.405 -0.467 -2.093 1.00 0.00 O ATOM 0 H TYR A 482 6.714 -1.741 0.593 1.00 0.00 H new ATOM 0 HA TYR A 482 8.682 -2.538 -1.459 1.00 0.00 H new ATOM 0 HB2 TYR A 482 8.526 -0.148 -0.450 1.00 0.00 H new ATOM 0 HB3 TYR A 482 9.159 -0.860 1.021 1.00 0.00 H new ATOM 0 HD1 TYR A 482 9.935 0.013 -2.474 1.00 0.00 H new ATOM 0 HD2 TYR A 482 11.480 -1.649 1.133 1.00 0.00 H new ATOM 0 HE1 TYR A 482 12.216 0.228 -3.353 1.00 0.00 H new ATOM 0 HE2 TYR A 482 13.763 -1.430 0.257 1.00 0.00 H new ATOM 0 HH TYR A 482 15.044 -0.797 -1.427 1.00 0.00 H new ATOM 805 N GLN A 483 10.117 -4.014 0.019 1.00 0.00 N ATOM 806 CA GLN A 483 10.749 -5.094 0.767 1.00 0.00 C ATOM 807 C GLN A 483 12.265 -5.054 0.607 1.00 0.00 C ATOM 808 O GLN A 483 12.784 -4.420 -0.311 1.00 0.00 O ATOM 809 CB GLN A 483 10.211 -6.448 0.301 1.00 0.00 C ATOM 810 CG GLN A 483 10.681 -6.844 -1.090 1.00 0.00 C ATOM 811 CD GLN A 483 9.725 -7.797 -1.780 1.00 0.00 C ATOM 812 OE1 GLN A 483 10.067 -8.948 -2.052 1.00 0.00 O ATOM 813 NE2 GLN A 483 8.519 -7.321 -2.067 1.00 0.00 N ATOM 0 H GLN A 483 10.586 -3.775 -0.855 1.00 0.00 H new ATOM 0 HA GLN A 483 10.510 -4.959 1.822 1.00 0.00 H new ATOM 0 HB2 GLN A 483 10.518 -7.216 1.011 1.00 0.00 H new ATOM 0 HB3 GLN A 483 9.121 -6.420 0.313 1.00 0.00 H new ATOM 0 HG2 GLN A 483 10.797 -5.947 -1.699 1.00 0.00 H new ATOM 0 HG3 GLN A 483 11.664 -7.310 -1.018 1.00 0.00 H new ATOM 0 HE21 GLN A 483 8.279 -6.360 -1.823 1.00 0.00 H new ATOM 0 HE22 GLN A 483 7.833 -7.916 -2.531 1.00 0.00 H new ATOM 822 N GLU A 484 12.969 -5.735 1.506 1.00 0.00 N ATOM 823 CA GLU A 484 14.426 -5.775 1.464 1.00 0.00 C ATOM 824 C GLU A 484 14.968 -6.847 2.404 1.00 0.00 C ATOM 825 O GLU A 484 14.263 -7.324 3.294 1.00 0.00 O ATOM 826 CB GLU A 484 15.007 -4.410 1.839 1.00 0.00 C ATOM 827 CG GLU A 484 16.523 -4.354 1.768 1.00 0.00 C ATOM 828 CD GLU A 484 17.060 -4.765 0.411 1.00 0.00 C ATOM 829 OE1 GLU A 484 16.818 -4.032 -0.571 1.00 0.00 O ATOM 830 OE2 GLU A 484 17.721 -5.821 0.330 1.00 0.00 O ATOM 0 H GLU A 484 12.554 -6.266 2.272 1.00 0.00 H new ATOM 0 HA GLU A 484 14.728 -6.023 0.446 1.00 0.00 H new ATOM 0 HB2 GLU A 484 14.592 -3.653 1.174 1.00 0.00 H new ATOM 0 HB3 GLU A 484 14.689 -4.155 2.850 1.00 0.00 H new ATOM 0 HG2 GLU A 484 16.856 -3.341 1.995 1.00 0.00 H new ATOM 0 HG3 GLU A 484 16.943 -5.007 2.533 1.00 0.00 H new ATOM 837 N LYS A 485 16.226 -7.223 2.201 1.00 0.00 N ATOM 838 CA LYS A 485 16.866 -8.237 3.030 1.00 0.00 C ATOM 839 C LYS A 485 17.733 -7.593 4.107 1.00 0.00 C ATOM 840 O LYS A 485 18.552 -6.722 3.817 1.00 0.00 O ATOM 841 CB LYS A 485 17.717 -9.170 2.165 1.00 0.00 C ATOM 842 CG LYS A 485 18.276 -10.361 2.923 1.00 0.00 C ATOM 843 CD LYS A 485 18.451 -11.567 2.016 1.00 0.00 C ATOM 844 CE LYS A 485 19.772 -11.512 1.264 1.00 0.00 C ATOM 845 NZ LYS A 485 19.691 -12.204 -0.052 1.00 0.00 N ATOM 0 H LYS A 485 16.823 -6.840 1.468 1.00 0.00 H new ATOM 0 HA LYS A 485 16.083 -8.817 3.518 1.00 0.00 H new ATOM 0 HB2 LYS A 485 17.113 -9.531 1.332 1.00 0.00 H new ATOM 0 HB3 LYS A 485 18.543 -8.602 1.737 1.00 0.00 H new ATOM 0 HG2 LYS A 485 19.236 -10.094 3.364 1.00 0.00 H new ATOM 0 HG3 LYS A 485 17.607 -10.617 3.745 1.00 0.00 H new ATOM 0 HD2 LYS A 485 18.407 -12.480 2.610 1.00 0.00 H new ATOM 0 HD3 LYS A 485 17.627 -11.610 1.304 1.00 0.00 H new ATOM 0 HE2 LYS A 485 20.059 -10.472 1.110 1.00 0.00 H new ATOM 0 HE3 LYS A 485 20.553 -11.972 1.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 20.611 -12.144 -0.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 19.442 -13.203 0.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 18.963 -11.749 -0.639 1.00 0.00 H new ATOM 950 N GLU A 493 16.384 -12.737 7.677 1.00 0.00 N ATOM 951 CA GLU A 493 14.940 -12.539 7.613 1.00 0.00 C ATOM 952 C GLU A 493 14.583 -11.466 6.588 1.00 0.00 C ATOM 953 O GLU A 493 15.293 -10.470 6.444 1.00 0.00 O ATOM 954 CB GLU A 493 14.396 -12.147 8.988 1.00 0.00 C ATOM 955 CG GLU A 493 12.879 -12.090 9.049 1.00 0.00 C ATOM 956 CD GLU A 493 12.368 -11.498 10.348 1.00 0.00 C ATOM 957 OE1 GLU A 493 12.539 -12.144 11.403 1.00 0.00 O ATOM 958 OE2 GLU A 493 11.798 -10.387 10.309 1.00 0.00 O ATOM 0 HA GLU A 493 14.483 -13.479 7.304 1.00 0.00 H new ATOM 0 HB2 GLU A 493 14.754 -12.862 9.728 1.00 0.00 H new ATOM 0 HB3 GLU A 493 14.799 -11.173 9.265 1.00 0.00 H new ATOM 0 HG2 GLU A 493 12.508 -11.497 8.213 1.00 0.00 H new ATOM 0 HG3 GLU A 493 12.476 -13.096 8.930 1.00 0.00 H new ATOM 965 N ILE A 494 13.479 -11.678 5.880 1.00 0.00 N ATOM 966 CA ILE A 494 13.027 -10.729 4.869 1.00 0.00 C ATOM 967 C ILE A 494 11.725 -10.057 5.290 1.00 0.00 C ATOM 968 O ILE A 494 10.647 -10.640 5.172 1.00 0.00 O ATOM 969 CB ILE A 494 12.820 -11.415 3.506 1.00 0.00 C ATOM 970 CG1 ILE A 494 14.070 -12.206 3.114 1.00 0.00 C ATOM 971 CG2 ILE A 494 12.483 -10.384 2.440 1.00 0.00 C ATOM 972 CD1 ILE A 494 15.341 -11.386 3.155 1.00 0.00 C ATOM 0 H ILE A 494 12.881 -12.497 5.987 1.00 0.00 H new ATOM 0 HA ILE A 494 13.808 -9.975 4.772 1.00 0.00 H new ATOM 0 HB ILE A 494 11.984 -12.110 3.588 1.00 0.00 H new ATOM 0 HG12 ILE A 494 14.176 -13.059 3.784 1.00 0.00 H new ATOM 0 HG13 ILE A 494 13.937 -12.605 2.109 1.00 0.00 H new ATOM 0 HG21 ILE A 494 12.340 -10.884 1.482 1.00 0.00 H new ATOM 0 HG22 ILE A 494 11.568 -9.861 2.717 1.00 0.00 H new ATOM 0 HG23 ILE A 494 13.300 -9.667 2.356 1.00 0.00 H new ATOM 0 HD11 ILE A 494 16.186 -12.010 2.866 1.00 0.00 H new ATOM 0 HD12 ILE A 494 15.256 -10.548 2.464 1.00 0.00 H new ATOM 0 HD13 ILE A 494 15.498 -11.008 4.165 1.00 0.00 H new ATOM 984 N ILE A 495 11.832 -8.826 5.780 1.00 0.00 N ATOM 985 CA ILE A 495 10.663 -8.073 6.215 1.00 0.00 C ATOM 986 C ILE A 495 10.147 -7.167 5.102 1.00 0.00 C ATOM 987 O ILE A 495 10.894 -6.784 4.201 1.00 0.00 O ATOM 988 CB ILE A 495 10.975 -7.215 7.455 1.00 0.00 C ATOM 989 CG1 ILE A 495 12.003 -6.135 7.110 1.00 0.00 C ATOM 990 CG2 ILE A 495 11.481 -8.091 8.592 1.00 0.00 C ATOM 991 CD1 ILE A 495 11.424 -4.978 6.328 1.00 0.00 C ATOM 0 H ILE A 495 12.717 -8.330 5.885 1.00 0.00 H new ATOM 0 HA ILE A 495 9.896 -8.803 6.472 1.00 0.00 H new ATOM 0 HB ILE A 495 10.057 -6.726 7.780 1.00 0.00 H new ATOM 0 HG12 ILE A 495 12.443 -5.756 8.032 1.00 0.00 H new ATOM 0 HG13 ILE A 495 12.811 -6.585 6.533 1.00 0.00 H new ATOM 0 HG21 ILE A 495 11.697 -7.470 9.461 1.00 0.00 H new ATOM 0 HG22 ILE A 495 10.719 -8.826 8.852 1.00 0.00 H new ATOM 0 HG23 ILE A 495 12.390 -8.605 8.279 1.00 0.00 H new ATOM 0 HD11 ILE A 495 12.209 -4.251 6.119 1.00 0.00 H new ATOM 0 HD12 ILE A 495 11.009 -5.345 5.389 1.00 0.00 H new ATOM 0 HD13 ILE A 495 10.636 -4.503 6.912 1.00 0.00 H new ATOM 1003 N VAL A 496 8.864 -6.827 5.170 1.00 0.00 N ATOM 1004 CA VAL A 496 8.247 -5.963 4.170 1.00 0.00 C ATOM 1005 C VAL A 496 7.607 -4.741 4.819 1.00 0.00 C ATOM 1006 O VAL A 496 6.993 -4.838 5.882 1.00 0.00 O ATOM 1007 CB VAL A 496 7.178 -6.719 3.358 1.00 0.00 C ATOM 1008 CG1 VAL A 496 6.583 -5.817 2.288 1.00 0.00 C ATOM 1009 CG2 VAL A 496 7.771 -7.976 2.739 1.00 0.00 C ATOM 0 H VAL A 496 8.231 -7.137 5.907 1.00 0.00 H new ATOM 0 HA VAL A 496 9.042 -5.639 3.498 1.00 0.00 H new ATOM 0 HB VAL A 496 6.376 -7.017 4.034 1.00 0.00 H new ATOM 0 HG11 VAL A 496 5.830 -6.368 1.725 1.00 0.00 H new ATOM 0 HG12 VAL A 496 6.121 -4.950 2.759 1.00 0.00 H new ATOM 0 HG13 VAL A 496 7.371 -5.486 1.612 1.00 0.00 H new ATOM 0 HG21 VAL A 496 7.003 -8.498 2.169 1.00 0.00 H new ATOM 0 HG22 VAL A 496 8.592 -7.703 2.076 1.00 0.00 H new ATOM 0 HG23 VAL A 496 8.144 -8.629 3.528 1.00 0.00 H new ATOM 1019 N LYS A 497 7.753 -3.590 4.172 1.00 0.00 N ATOM 1020 CA LYS A 497 7.188 -2.347 4.683 1.00 0.00 C ATOM 1021 C LYS A 497 6.129 -1.799 3.732 1.00 0.00 C ATOM 1022 O LYS A 497 6.451 -1.273 2.666 1.00 0.00 O ATOM 1023 CB LYS A 497 8.292 -1.307 4.888 1.00 0.00 C ATOM 1024 CG LYS A 497 9.030 -1.455 6.208 1.00 0.00 C ATOM 1025 CD LYS A 497 10.104 -0.392 6.368 1.00 0.00 C ATOM 1026 CE LYS A 497 9.532 0.897 6.938 1.00 0.00 C ATOM 1027 NZ LYS A 497 9.047 1.810 5.866 1.00 0.00 N ATOM 0 H LYS A 497 8.259 -3.492 3.292 1.00 0.00 H new ATOM 0 HA LYS A 497 6.715 -2.559 5.642 1.00 0.00 H new ATOM 0 HB2 LYS A 497 9.008 -1.384 4.070 1.00 0.00 H new ATOM 0 HB3 LYS A 497 7.855 -0.310 4.836 1.00 0.00 H new ATOM 0 HG2 LYS A 497 8.321 -1.384 7.033 1.00 0.00 H new ATOM 0 HG3 LYS A 497 9.485 -2.444 6.263 1.00 0.00 H new ATOM 0 HD2 LYS A 497 10.891 -0.764 7.025 1.00 0.00 H new ATOM 0 HD3 LYS A 497 10.565 -0.190 5.401 1.00 0.00 H new ATOM 0 HE2 LYS A 497 8.710 0.662 7.614 1.00 0.00 H new ATOM 0 HE3 LYS A 497 10.296 1.403 7.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 9.519 2.732 5.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 9.264 1.399 4.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 8.019 1.937 5.957 1.00 0.00 H new ATOM 1041 N ILE A 498 4.866 -1.924 4.125 1.00 0.00 N ATOM 1042 CA ILE A 498 3.761 -1.438 3.308 1.00 0.00 C ATOM 1043 C ILE A 498 3.409 0.003 3.660 1.00 0.00 C ATOM 1044 O ILE A 498 3.110 0.317 4.812 1.00 0.00 O ATOM 1045 CB ILE A 498 2.507 -2.317 3.478 1.00 0.00 C ATOM 1046 CG1 ILE A 498 2.837 -3.779 3.172 1.00 0.00 C ATOM 1047 CG2 ILE A 498 1.387 -1.821 2.576 1.00 0.00 C ATOM 1048 CD1 ILE A 498 1.793 -4.752 3.672 1.00 0.00 C ATOM 0 H ILE A 498 4.582 -2.357 5.004 1.00 0.00 H new ATOM 0 HA ILE A 498 4.091 -1.486 2.270 1.00 0.00 H new ATOM 0 HB ILE A 498 2.171 -2.249 4.513 1.00 0.00 H new ATOM 0 HG12 ILE A 498 2.948 -3.900 2.094 1.00 0.00 H new ATOM 0 HG13 ILE A 498 3.798 -4.028 3.621 1.00 0.00 H new ATOM 0 HG21 ILE A 498 0.508 -2.452 2.707 1.00 0.00 H new ATOM 0 HG22 ILE A 498 1.138 -0.793 2.837 1.00 0.00 H new ATOM 0 HG23 ILE A 498 1.712 -1.863 1.536 1.00 0.00 H new ATOM 0 HD11 ILE A 498 2.093 -5.769 3.420 1.00 0.00 H new ATOM 0 HD12 ILE A 498 1.698 -4.659 4.754 1.00 0.00 H new ATOM 0 HD13 ILE A 498 0.834 -4.530 3.203 1.00 0.00 H new ATOM 1060 N PHE A 499 3.446 0.877 2.659 1.00 0.00 N ATOM 1061 CA PHE A 499 3.130 2.286 2.862 1.00 0.00 C ATOM 1062 C PHE A 499 1.676 2.575 2.499 1.00 0.00 C ATOM 1063 O PHE A 499 1.240 2.312 1.378 1.00 0.00 O ATOM 1064 CB PHE A 499 4.061 3.165 2.024 1.00 0.00 C ATOM 1065 CG PHE A 499 5.519 2.904 2.276 1.00 0.00 C ATOM 1066 CD1 PHE A 499 6.167 3.498 3.347 1.00 0.00 C ATOM 1067 CD2 PHE A 499 6.240 2.065 1.443 1.00 0.00 C ATOM 1068 CE1 PHE A 499 7.508 3.261 3.581 1.00 0.00 C ATOM 1069 CE2 PHE A 499 7.582 1.824 1.672 1.00 0.00 C ATOM 1070 CZ PHE A 499 8.216 2.422 2.743 1.00 0.00 C ATOM 0 H PHE A 499 3.692 0.634 1.699 1.00 0.00 H new ATOM 0 HA PHE A 499 3.276 2.517 3.917 1.00 0.00 H new ATOM 0 HB2 PHE A 499 3.848 3.002 0.967 1.00 0.00 H new ATOM 0 HB3 PHE A 499 3.846 4.213 2.235 1.00 0.00 H new ATOM 0 HD1 PHE A 499 5.618 4.154 4.006 1.00 0.00 H new ATOM 0 HD2 PHE A 499 5.748 1.594 0.605 1.00 0.00 H new ATOM 0 HE1 PHE A 499 8.002 3.731 4.418 1.00 0.00 H new ATOM 0 HE2 PHE A 499 8.134 1.169 1.014 1.00 0.00 H new ATOM 0 HZ PHE A 499 9.264 2.234 2.925 1.00 0.00 H new ATOM 1080 N VAL A 500 0.930 3.117 3.456 1.00 0.00 N ATOM 1081 CA VAL A 500 -0.474 3.443 3.239 1.00 0.00 C ATOM 1082 C VAL A 500 -0.742 4.921 3.500 1.00 0.00 C ATOM 1083 O VAL A 500 -0.856 5.348 4.648 1.00 0.00 O ATOM 1084 CB VAL A 500 -1.393 2.599 4.142 1.00 0.00 C ATOM 1085 CG1 VAL A 500 -2.854 2.918 3.865 1.00 0.00 C ATOM 1086 CG2 VAL A 500 -1.116 1.116 3.945 1.00 0.00 C ATOM 0 H VAL A 500 1.275 3.340 4.390 1.00 0.00 H new ATOM 0 HA VAL A 500 -0.694 3.215 2.196 1.00 0.00 H new ATOM 0 HB VAL A 500 -1.182 2.850 5.182 1.00 0.00 H new ATOM 0 HG11 VAL A 500 -3.488 2.312 4.512 1.00 0.00 H new ATOM 0 HG12 VAL A 500 -3.039 3.974 4.061 1.00 0.00 H new ATOM 0 HG13 VAL A 500 -3.083 2.697 2.823 1.00 0.00 H new ATOM 0 HG21 VAL A 500 -1.774 0.534 4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 500 -1.298 0.847 2.904 1.00 0.00 H new ATOM 0 HG23 VAL A 500 -0.078 0.903 4.199 1.00 0.00 H new ATOM 1096 N GLU A 501 -0.842 5.698 2.425 1.00 0.00 N ATOM 1097 CA GLU A 501 -1.096 7.129 2.539 1.00 0.00 C ATOM 1098 C GLU A 501 -2.574 7.438 2.316 1.00 0.00 C ATOM 1099 O GLU A 501 -3.186 6.949 1.366 1.00 0.00 O ATOM 1100 CB GLU A 501 -0.244 7.903 1.531 1.00 0.00 C ATOM 1101 CG GLU A 501 -0.572 9.385 1.468 1.00 0.00 C ATOM 1102 CD GLU A 501 0.135 10.091 0.327 1.00 0.00 C ATOM 1103 OE1 GLU A 501 -0.330 9.967 -0.826 1.00 0.00 O ATOM 1104 OE2 GLU A 501 1.152 10.767 0.586 1.00 0.00 O ATOM 0 H GLU A 501 -0.751 5.360 1.467 1.00 0.00 H new ATOM 0 HA GLU A 501 -0.825 7.441 3.548 1.00 0.00 H new ATOM 0 HB2 GLU A 501 0.808 7.783 1.789 1.00 0.00 H new ATOM 0 HB3 GLU A 501 -0.381 7.467 0.542 1.00 0.00 H new ATOM 0 HG2 GLU A 501 -1.649 9.511 1.356 1.00 0.00 H new ATOM 0 HG3 GLU A 501 -0.292 9.856 2.411 1.00 0.00 H new ATOM 1111 N PHE A 502 -3.141 8.253 3.199 1.00 0.00 N ATOM 1112 CA PHE A 502 -4.547 8.627 3.101 1.00 0.00 C ATOM 1113 C PHE A 502 -4.694 10.086 2.677 1.00 0.00 C ATOM 1114 O PHE A 502 -3.732 10.853 2.713 1.00 0.00 O ATOM 1115 CB PHE A 502 -5.252 8.400 4.440 1.00 0.00 C ATOM 1116 CG PHE A 502 -5.372 6.950 4.816 1.00 0.00 C ATOM 1117 CD1 PHE A 502 -4.278 6.257 5.308 1.00 0.00 C ATOM 1118 CD2 PHE A 502 -6.578 6.282 4.678 1.00 0.00 C ATOM 1119 CE1 PHE A 502 -4.385 4.923 5.654 1.00 0.00 C ATOM 1120 CE2 PHE A 502 -6.691 4.949 5.023 1.00 0.00 C ATOM 1121 CZ PHE A 502 -5.593 4.268 5.512 1.00 0.00 C ATOM 0 H PHE A 502 -2.649 8.667 3.990 1.00 0.00 H new ATOM 0 HA PHE A 502 -5.012 7.998 2.342 1.00 0.00 H new ATOM 0 HB2 PHE A 502 -4.706 8.926 5.223 1.00 0.00 H new ATOM 0 HB3 PHE A 502 -6.249 8.839 4.396 1.00 0.00 H new ATOM 0 HD1 PHE A 502 -3.331 6.764 5.422 1.00 0.00 H new ATOM 0 HD2 PHE A 502 -7.440 6.809 4.296 1.00 0.00 H new ATOM 0 HE1 PHE A 502 -3.525 4.393 6.035 1.00 0.00 H new ATOM 0 HE2 PHE A 502 -7.637 4.440 4.911 1.00 0.00 H new ATOM 0 HZ PHE A 502 -5.679 3.226 5.783 1.00 0.00 H new ATOM 1131 N SER A 503 -5.904 10.461 2.276 1.00 0.00 N ATOM 1132 CA SER A 503 -6.177 11.825 1.841 1.00 0.00 C ATOM 1133 C SER A 503 -5.951 12.814 2.981 1.00 0.00 C ATOM 1134 O SER A 503 -5.685 13.994 2.750 1.00 0.00 O ATOM 1135 CB SER A 503 -7.613 11.942 1.327 1.00 0.00 C ATOM 1136 OG SER A 503 -7.777 11.238 0.108 1.00 0.00 O ATOM 0 H SER A 503 -6.711 9.839 2.243 1.00 0.00 H new ATOM 0 HA SER A 503 -5.488 12.066 1.031 1.00 0.00 H new ATOM 0 HB2 SER A 503 -8.303 11.549 2.073 1.00 0.00 H new ATOM 0 HB3 SER A 503 -7.866 12.992 1.181 1.00 0.00 H new ATOM 0 HG SER A 503 -8.703 11.327 -0.199 1.00 0.00 H new ATOM 1142 N ILE A 504 -6.059 12.324 4.211 1.00 0.00 N ATOM 1143 CA ILE A 504 -5.866 13.163 5.387 1.00 0.00 C ATOM 1144 C ILE A 504 -5.186 12.387 6.510 1.00 0.00 C ATOM 1145 O ILE A 504 -5.352 11.173 6.629 1.00 0.00 O ATOM 1146 CB ILE A 504 -7.204 13.725 5.903 1.00 0.00 C ATOM 1147 CG1 ILE A 504 -8.240 12.606 6.023 1.00 0.00 C ATOM 1148 CG2 ILE A 504 -7.707 14.825 4.980 1.00 0.00 C ATOM 1149 CD1 ILE A 504 -9.508 13.030 6.731 1.00 0.00 C ATOM 0 H ILE A 504 -6.279 11.350 4.419 1.00 0.00 H new ATOM 0 HA ILE A 504 -5.227 13.992 5.082 1.00 0.00 H new ATOM 0 HB ILE A 504 -7.044 14.153 6.893 1.00 0.00 H new ATOM 0 HG12 ILE A 504 -8.493 12.248 5.025 1.00 0.00 H new ATOM 0 HG13 ILE A 504 -7.797 11.767 6.560 1.00 0.00 H new ATOM 0 HG21 ILE A 504 -8.653 15.212 5.358 1.00 0.00 H new ATOM 0 HG22 ILE A 504 -6.974 15.631 4.942 1.00 0.00 H new ATOM 0 HG23 ILE A 504 -7.854 14.421 3.979 1.00 0.00 H new ATOM 0 HD11 ILE A 504 -10.197 12.187 6.780 1.00 0.00 H new ATOM 0 HD12 ILE A 504 -9.267 13.361 7.741 1.00 0.00 H new ATOM 0 HD13 ILE A 504 -9.975 13.848 6.183 1.00 0.00 H new ATOM 1161 N ALA A 505 -4.422 13.097 7.334 1.00 0.00 N ATOM 1162 CA ALA A 505 -3.720 12.476 8.450 1.00 0.00 C ATOM 1163 C ALA A 505 -4.692 11.746 9.372 1.00 0.00 C ATOM 1164 O ALA A 505 -4.397 10.656 9.863 1.00 0.00 O ATOM 1165 CB ALA A 505 -2.936 13.522 9.229 1.00 0.00 C ATOM 0 H ALA A 505 -4.274 14.103 7.249 1.00 0.00 H new ATOM 0 HA ALA A 505 -3.023 11.742 8.045 1.00 0.00 H new ATOM 0 HB1 ALA A 505 -2.417 13.044 10.060 1.00 0.00 H new ATOM 0 HB2 ALA A 505 -2.208 13.996 8.571 1.00 0.00 H new ATOM 0 HB3 ALA A 505 -3.621 14.277 9.616 1.00 0.00 H new ATOM 1171 N SER A 506 -5.851 12.354 9.603 1.00 0.00 N ATOM 1172 CA SER A 506 -6.864 11.763 10.470 1.00 0.00 C ATOM 1173 C SER A 506 -7.055 10.283 10.153 1.00 0.00 C ATOM 1174 O SER A 506 -6.804 9.421 10.993 1.00 0.00 O ATOM 1175 CB SER A 506 -8.193 12.505 10.315 1.00 0.00 C ATOM 1176 OG SER A 506 -8.150 13.768 10.956 1.00 0.00 O ATOM 0 H SER A 506 -6.112 13.255 9.202 1.00 0.00 H new ATOM 0 HA SER A 506 -6.522 11.854 11.501 1.00 0.00 H new ATOM 0 HB2 SER A 506 -8.417 12.638 9.257 1.00 0.00 H new ATOM 0 HB3 SER A 506 -8.999 11.906 10.739 1.00 0.00 H new ATOM 0 HG SER A 506 -9.010 14.223 10.841 1.00 0.00 H new ATOM 1182 N GLU A 507 -7.500 9.999 8.933 1.00 0.00 N ATOM 1183 CA GLU A 507 -7.726 8.623 8.505 1.00 0.00 C ATOM 1184 C GLU A 507 -6.522 7.746 8.835 1.00 0.00 C ATOM 1185 O GLU A 507 -6.669 6.576 9.189 1.00 0.00 O ATOM 1186 CB GLU A 507 -8.009 8.574 7.002 1.00 0.00 C ATOM 1187 CG GLU A 507 -9.277 9.307 6.597 1.00 0.00 C ATOM 1188 CD GLU A 507 -9.449 9.388 5.093 1.00 0.00 C ATOM 1189 OE1 GLU A 507 -8.452 9.179 4.370 1.00 0.00 O ATOM 1190 OE2 GLU A 507 -10.579 9.662 4.638 1.00 0.00 O ATOM 0 H GLU A 507 -7.711 10.702 8.225 1.00 0.00 H new ATOM 0 HA GLU A 507 -8.592 8.239 9.044 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -7.163 9.006 6.467 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -8.086 7.533 6.689 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -10.139 8.800 7.031 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -9.258 10.315 7.011 1.00 0.00 H new ATOM 1197 N THR A 508 -5.328 8.320 8.717 1.00 0.00 N ATOM 1198 CA THR A 508 -4.098 7.592 9.001 1.00 0.00 C ATOM 1199 C THR A 508 -4.001 7.232 10.479 1.00 0.00 C ATOM 1200 O THR A 508 -3.892 6.058 10.836 1.00 0.00 O ATOM 1201 CB THR A 508 -2.856 8.410 8.601 1.00 0.00 C ATOM 1202 OG1 THR A 508 -3.019 8.934 7.278 1.00 0.00 O ATOM 1203 CG2 THR A 508 -1.601 7.552 8.660 1.00 0.00 C ATOM 0 H THR A 508 -5.187 9.288 8.426 1.00 0.00 H new ATOM 0 HA THR A 508 -4.128 6.678 8.408 1.00 0.00 H new ATOM 0 HB THR A 508 -2.748 9.233 9.307 1.00 0.00 H new ATOM 0 HG1 THR A 508 -2.364 8.519 6.679 1.00 0.00 H new ATOM 0 HG21 THR A 508 -0.737 8.151 8.373 1.00 0.00 H new ATOM 0 HG22 THR A 508 -1.463 7.178 9.675 1.00 0.00 H new ATOM 0 HG23 THR A 508 -1.703 6.711 7.974 1.00 0.00 H new ATOM 1211 N HIS A 509 -4.043 8.248 11.335 1.00 0.00 N ATOM 1212 CA HIS A 509 -3.961 8.038 12.776 1.00 0.00 C ATOM 1213 C HIS A 509 -4.864 6.887 13.209 1.00 0.00 C ATOM 1214 O HIS A 509 -4.456 6.019 13.981 1.00 0.00 O ATOM 1215 CB HIS A 509 -4.348 9.315 13.522 1.00 0.00 C ATOM 1216 CG HIS A 509 -3.227 10.301 13.643 1.00 0.00 C ATOM 1217 ND1 HIS A 509 -2.533 10.511 14.815 1.00 0.00 N ATOM 1218 CD2 HIS A 509 -2.680 11.136 12.728 1.00 0.00 C ATOM 1219 CE1 HIS A 509 -1.608 11.433 14.618 1.00 0.00 C ATOM 1220 NE2 HIS A 509 -1.676 11.828 13.359 1.00 0.00 N ATOM 0 H HIS A 509 -4.133 9.225 11.056 1.00 0.00 H new ATOM 0 HA HIS A 509 -2.931 7.781 13.023 1.00 0.00 H new ATOM 0 HB2 HIS A 509 -5.183 9.788 13.006 1.00 0.00 H new ATOM 0 HB3 HIS A 509 -4.698 9.051 14.520 1.00 0.00 H new ATOM 0 HD2 HIS A 509 -2.978 11.238 11.695 1.00 0.00 H new ATOM 0 HE1 HIS A 509 -0.914 11.801 15.359 1.00 0.00 H new ATOM 0 HE2 HIS A 509 -1.079 12.533 12.926 1.00 0.00 H new ATOM 1228 N LYS A 510 -6.095 6.888 12.709 1.00 0.00 N ATOM 1229 CA LYS A 510 -7.058 5.845 13.043 1.00 0.00 C ATOM 1230 C LYS A 510 -6.538 4.472 12.629 1.00 0.00 C ATOM 1231 O LYS A 510 -6.257 3.623 13.475 1.00 0.00 O ATOM 1232 CB LYS A 510 -8.399 6.121 12.359 1.00 0.00 C ATOM 1233 CG LYS A 510 -9.469 5.093 12.681 1.00 0.00 C ATOM 1234 CD LYS A 510 -10.817 5.491 12.102 1.00 0.00 C ATOM 1235 CE LYS A 510 -11.624 6.322 13.088 1.00 0.00 C ATOM 1236 NZ LYS A 510 -11.378 7.781 12.915 1.00 0.00 N ATOM 0 H LYS A 510 -6.450 7.600 12.071 1.00 0.00 H new ATOM 0 HA LYS A 510 -7.201 5.850 14.124 1.00 0.00 H new ATOM 0 HB2 LYS A 510 -8.753 7.108 12.658 1.00 0.00 H new ATOM 0 HB3 LYS A 510 -8.248 6.150 11.280 1.00 0.00 H new ATOM 0 HG2 LYS A 510 -9.174 4.122 12.283 1.00 0.00 H new ATOM 0 HG3 LYS A 510 -9.555 4.982 13.762 1.00 0.00 H new ATOM 0 HD2 LYS A 510 -10.666 6.059 11.184 1.00 0.00 H new ATOM 0 HD3 LYS A 510 -11.378 4.596 11.835 1.00 0.00 H new ATOM 0 HE2 LYS A 510 -12.686 6.114 12.955 1.00 0.00 H new ATOM 0 HE3 LYS A 510 -11.367 6.029 14.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 -11.010 8.179 13.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 -10.683 7.928 12.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 -12.269 8.256 12.666 1.00 0.00 H new ATOM 1250 N ALA A 511 -6.411 4.261 11.323 1.00 0.00 N ATOM 1251 CA ALA A 511 -5.921 2.992 10.798 1.00 0.00 C ATOM 1252 C ALA A 511 -4.778 2.450 11.650 1.00 0.00 C ATOM 1253 O ALA A 511 -4.594 1.237 11.758 1.00 0.00 O ATOM 1254 CB ALA A 511 -5.472 3.157 9.353 1.00 0.00 C ATOM 0 H ALA A 511 -6.641 4.952 10.609 1.00 0.00 H new ATOM 0 HA ALA A 511 -6.739 2.272 10.833 1.00 0.00 H new ATOM 0 HB1 ALA A 511 -5.109 2.202 8.974 1.00 0.00 H new ATOM 0 HB2 ALA A 511 -6.314 3.492 8.746 1.00 0.00 H new ATOM 0 HB3 ALA A 511 -4.672 3.896 9.303 1.00 0.00 H new ATOM 1260 N ILE A 512 -4.015 3.355 12.253 1.00 0.00 N ATOM 1261 CA ILE A 512 -2.891 2.966 13.095 1.00 0.00 C ATOM 1262 C ILE A 512 -3.361 2.573 14.492 1.00 0.00 C ATOM 1263 O ILE A 512 -3.156 1.441 14.930 1.00 0.00 O ATOM 1264 CB ILE A 512 -1.857 4.102 13.215 1.00 0.00 C ATOM 1265 CG1 ILE A 512 -1.255 4.419 11.844 1.00 0.00 C ATOM 1266 CG2 ILE A 512 -0.765 3.722 14.204 1.00 0.00 C ATOM 1267 CD1 ILE A 512 -0.520 5.740 11.798 1.00 0.00 C ATOM 0 H ILE A 512 -4.155 4.362 12.174 1.00 0.00 H new ATOM 0 HA ILE A 512 -2.421 2.107 12.616 1.00 0.00 H new ATOM 0 HB ILE A 512 -2.361 4.995 13.585 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -0.568 3.620 11.564 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -2.052 4.429 11.100 1.00 0.00 H new ATOM 0 HG21 ILE A 512 -0.042 4.535 14.278 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -1.208 3.540 15.183 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -0.261 2.818 13.860 1.00 0.00 H new ATOM 0 HD11 ILE A 512 -0.120 5.899 10.797 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -1.208 6.548 12.046 1.00 0.00 H new ATOM 0 HD13 ILE A 512 0.298 5.726 12.518 1.00 0.00 H new ATOM 1279 N GLN A 513 -3.993 3.515 15.185 1.00 0.00 N ATOM 1280 CA GLN A 513 -4.493 3.266 16.531 1.00 0.00 C ATOM 1281 C GLN A 513 -5.173 1.903 16.616 1.00 0.00 C ATOM 1282 O GLN A 513 -5.281 1.319 17.694 1.00 0.00 O ATOM 1283 CB GLN A 513 -5.474 4.364 16.945 1.00 0.00 C ATOM 1284 CG GLN A 513 -4.818 5.721 17.147 1.00 0.00 C ATOM 1285 CD GLN A 513 -5.671 6.665 17.971 1.00 0.00 C ATOM 1286 OE1 GLN A 513 -6.863 6.428 18.171 1.00 0.00 O ATOM 1287 NE2 GLN A 513 -5.064 7.742 18.454 1.00 0.00 N ATOM 0 H GLN A 513 -4.171 4.457 14.836 1.00 0.00 H new ATOM 0 HA GLN A 513 -3.643 3.271 17.213 1.00 0.00 H new ATOM 0 HB2 GLN A 513 -6.249 4.454 16.183 1.00 0.00 H new ATOM 0 HB3 GLN A 513 -5.969 4.068 17.870 1.00 0.00 H new ATOM 0 HG2 GLN A 513 -3.855 5.585 17.639 1.00 0.00 H new ATOM 0 HG3 GLN A 513 -4.619 6.172 16.175 1.00 0.00 H new ATOM 0 HE21 GLN A 513 -4.074 7.898 18.263 1.00 0.00 H new ATOM 0 HE22 GLN A 513 -5.587 8.413 19.016 1.00 0.00 H new ATOM 1296 N ALA A 514 -5.629 1.402 15.473 1.00 0.00 N ATOM 1297 CA ALA A 514 -6.296 0.108 15.418 1.00 0.00 C ATOM 1298 C ALA A 514 -5.342 -0.982 14.942 1.00 0.00 C ATOM 1299 O ALA A 514 -5.117 -1.973 15.639 1.00 0.00 O ATOM 1300 CB ALA A 514 -7.514 0.180 14.509 1.00 0.00 C ATOM 0 H ALA A 514 -5.548 1.873 14.572 1.00 0.00 H new ATOM 0 HA ALA A 514 -6.623 -0.147 16.426 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -8.002 -0.794 14.477 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -8.212 0.924 14.894 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -7.201 0.462 13.504 1.00 0.00 H new ATOM 1306 N LEU A 515 -4.783 -0.794 13.752 1.00 0.00 N ATOM 1307 CA LEU A 515 -3.852 -1.762 13.182 1.00 0.00 C ATOM 1308 C LEU A 515 -2.606 -1.897 14.052 1.00 0.00 C ATOM 1309 O LEU A 515 -1.769 -2.768 13.822 1.00 0.00 O ATOM 1310 CB LEU A 515 -3.456 -1.345 11.765 1.00 0.00 C ATOM 1311 CG LEU A 515 -4.579 -1.342 10.727 1.00 0.00 C ATOM 1312 CD1 LEU A 515 -4.207 -0.466 9.540 1.00 0.00 C ATOM 1313 CD2 LEU A 515 -4.887 -2.760 10.270 1.00 0.00 C ATOM 0 H LEU A 515 -4.958 0.020 13.163 1.00 0.00 H new ATOM 0 HA LEU A 515 -4.352 -2.730 13.143 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -3.027 -0.344 11.809 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -2.669 -2.014 11.417 1.00 0.00 H new ATOM 0 HG LEU A 515 -5.475 -0.929 11.191 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -5.018 -0.476 8.812 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -4.038 0.556 9.881 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -3.298 -0.849 9.076 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -5.688 -2.738 9.532 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -3.995 -3.201 9.825 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -5.198 -3.359 11.126 1.00 0.00 H new ATOM 1325 N ASN A 516 -2.492 -1.029 15.052 1.00 0.00 N ATOM 1326 CA ASN A 516 -1.349 -1.052 15.957 1.00 0.00 C ATOM 1327 C ASN A 516 -1.288 -2.371 16.722 1.00 0.00 C ATOM 1328 O ASN A 516 -0.303 -2.664 17.398 1.00 0.00 O ATOM 1329 CB ASN A 516 -1.427 0.117 16.940 1.00 0.00 C ATOM 1330 CG ASN A 516 -2.584 -0.019 17.911 1.00 0.00 C ATOM 1331 OD1 ASN A 516 -3.655 -0.509 17.553 1.00 0.00 O ATOM 1332 ND2 ASN A 516 -2.373 0.415 19.148 1.00 0.00 N ATOM 0 H ASN A 516 -3.177 -0.301 15.256 1.00 0.00 H new ATOM 0 HA ASN A 516 -0.442 -0.956 15.360 1.00 0.00 H new ATOM 0 HB2 ASN A 516 -0.493 0.181 17.499 1.00 0.00 H new ATOM 0 HB3 ASN A 516 -1.531 1.049 16.384 1.00 0.00 H new ATOM 0 HD21 ASN A 516 -3.115 0.349 19.845 1.00 0.00 H new ATOM 0 HD22 ASN A 516 -1.469 0.814 19.401 1.00 0.00 H new ATOM 1339 N GLY A 517 -2.350 -3.164 16.610 1.00 0.00 N ATOM 1340 CA GLY A 517 -2.396 -4.442 17.295 1.00 0.00 C ATOM 1341 C GLY A 517 -3.446 -5.372 16.719 1.00 0.00 C ATOM 1342 O GLY A 517 -4.140 -6.070 17.458 1.00 0.00 O ATOM 0 H GLY A 517 -3.178 -2.944 16.057 1.00 0.00 H new ATOM 0 HA2 GLY A 517 -1.418 -4.920 17.232 1.00 0.00 H new ATOM 0 HA3 GLY A 517 -2.602 -4.277 18.352 1.00 0.00 H new ATOM 1346 N ARG A 518 -3.564 -5.379 15.395 1.00 0.00 N ATOM 1347 CA ARG A 518 -4.539 -6.227 14.720 1.00 0.00 C ATOM 1348 C ARG A 518 -4.105 -7.690 14.756 1.00 0.00 C ATOM 1349 O ARG A 518 -2.938 -7.995 15.001 1.00 0.00 O ATOM 1350 CB ARG A 518 -4.724 -5.775 13.270 1.00 0.00 C ATOM 1351 CG ARG A 518 -5.817 -4.734 13.092 1.00 0.00 C ATOM 1352 CD ARG A 518 -7.196 -5.374 13.061 1.00 0.00 C ATOM 1353 NE ARG A 518 -7.328 -6.338 11.971 1.00 0.00 N ATOM 1354 CZ ARG A 518 -8.434 -7.035 11.737 1.00 0.00 C ATOM 1355 NH1 ARG A 518 -9.498 -6.877 12.512 1.00 0.00 N ATOM 1356 NH2 ARG A 518 -8.477 -7.893 10.726 1.00 0.00 N ATOM 0 H ARG A 518 -2.997 -4.807 14.769 1.00 0.00 H new ATOM 0 HA ARG A 518 -5.489 -6.134 15.246 1.00 0.00 H new ATOM 0 HB2 ARG A 518 -3.782 -5.367 12.902 1.00 0.00 H new ATOM 0 HB3 ARG A 518 -4.957 -6.644 12.654 1.00 0.00 H new ATOM 0 HG2 ARG A 518 -5.768 -4.011 13.906 1.00 0.00 H new ATOM 0 HG3 ARG A 518 -5.649 -4.183 12.166 1.00 0.00 H new ATOM 0 HD2 ARG A 518 -7.385 -5.873 14.011 1.00 0.00 H new ATOM 0 HD3 ARG A 518 -7.953 -4.598 12.952 1.00 0.00 H new ATOM 0 HE ARG A 518 -6.527 -6.484 11.356 1.00 0.00 H new ATOM 0 HH11 ARG A 518 -9.469 -6.219 13.291 1.00 0.00 H new ATOM 0 HH12 ARG A 518 -10.346 -7.414 12.330 1.00 0.00 H new ATOM 0 HH21 ARG A 518 -7.660 -8.018 10.128 1.00 0.00 H new ATOM 0 HH22 ARG A 518 -9.327 -8.428 10.547 1.00 0.00 H new ATOM 1370 N TRP A 519 -5.051 -8.588 14.511 1.00 0.00 N ATOM 1371 CA TRP A 519 -4.766 -10.019 14.516 1.00 0.00 C ATOM 1372 C TRP A 519 -4.915 -10.608 13.117 1.00 0.00 C ATOM 1373 O TRP A 519 -6.014 -10.649 12.564 1.00 0.00 O ATOM 1374 CB TRP A 519 -5.699 -10.742 15.489 1.00 0.00 C ATOM 1375 CG TRP A 519 -5.109 -10.919 16.856 1.00 0.00 C ATOM 1376 CD1 TRP A 519 -5.436 -10.225 17.986 1.00 0.00 C ATOM 1377 CD2 TRP A 519 -4.089 -11.849 17.235 1.00 0.00 C ATOM 1378 NE1 TRP A 519 -4.680 -10.668 19.044 1.00 0.00 N ATOM 1379 CE2 TRP A 519 -3.847 -11.664 18.610 1.00 0.00 C ATOM 1380 CE3 TRP A 519 -3.357 -12.821 16.547 1.00 0.00 C ATOM 1381 CZ2 TRP A 519 -2.904 -12.415 19.307 1.00 0.00 C ATOM 1382 CZ3 TRP A 519 -2.422 -13.565 17.240 1.00 0.00 C ATOM 1383 CH2 TRP A 519 -2.202 -13.360 18.609 1.00 0.00 C ATOM 0 H TRP A 519 -6.022 -8.352 14.306 1.00 0.00 H new ATOM 0 HA TRP A 519 -3.735 -10.158 14.841 1.00 0.00 H new ATOM 0 HB2 TRP A 519 -6.630 -10.182 15.573 1.00 0.00 H new ATOM 0 HB3 TRP A 519 -5.951 -11.720 15.080 1.00 0.00 H new ATOM 0 HD1 TRP A 519 -6.179 -9.443 18.040 1.00 0.00 H new ATOM 0 HE1 TRP A 519 -4.731 -10.312 19.999 1.00 0.00 H new ATOM 0 HE3 TRP A 519 -3.520 -12.987 15.492 1.00 0.00 H new ATOM 0 HZ2 TRP A 519 -2.733 -12.257 20.362 1.00 0.00 H new ATOM 0 HZ3 TRP A 519 -1.850 -14.318 16.718 1.00 0.00 H new ATOM 0 HH2 TRP A 519 -1.465 -13.959 19.123 1.00 0.00 H new ATOM 1394 N PHE A 520 -3.803 -11.065 12.551 1.00 0.00 N ATOM 1395 CA PHE A 520 -3.810 -11.652 11.216 1.00 0.00 C ATOM 1396 C PHE A 520 -4.135 -13.141 11.279 1.00 0.00 C ATOM 1397 O PHE A 520 -3.966 -13.781 12.316 1.00 0.00 O ATOM 1398 CB PHE A 520 -2.455 -11.442 10.537 1.00 0.00 C ATOM 1399 CG PHE A 520 -2.481 -11.696 9.056 1.00 0.00 C ATOM 1400 CD1 PHE A 520 -2.858 -10.695 8.176 1.00 0.00 C ATOM 1401 CD2 PHE A 520 -2.129 -12.935 8.546 1.00 0.00 C ATOM 1402 CE1 PHE A 520 -2.884 -10.926 6.813 1.00 0.00 C ATOM 1403 CE2 PHE A 520 -2.152 -13.171 7.184 1.00 0.00 C ATOM 1404 CZ PHE A 520 -2.529 -12.165 6.317 1.00 0.00 C ATOM 0 H PHE A 520 -2.885 -11.040 12.996 1.00 0.00 H new ATOM 0 HA PHE A 520 -4.583 -11.154 10.631 1.00 0.00 H new ATOM 0 HB2 PHE A 520 -2.122 -10.420 10.717 1.00 0.00 H new ATOM 0 HB3 PHE A 520 -1.720 -12.102 10.998 1.00 0.00 H new ATOM 0 HD1 PHE A 520 -3.135 -9.724 8.559 1.00 0.00 H new ATOM 0 HD2 PHE A 520 -1.833 -13.725 9.220 1.00 0.00 H new ATOM 0 HE1 PHE A 520 -3.182 -10.138 6.137 1.00 0.00 H new ATOM 0 HE2 PHE A 520 -1.875 -14.141 6.799 1.00 0.00 H new ATOM 0 HZ PHE A 520 -2.546 -12.347 5.253 1.00 0.00 H new ATOM 1414 N ALA A 521 -4.605 -13.686 10.161 1.00 0.00 N ATOM 1415 CA ALA A 521 -4.953 -15.099 10.087 1.00 0.00 C ATOM 1416 C ALA A 521 -3.801 -15.974 10.569 1.00 0.00 C ATOM 1417 O ALA A 521 -2.998 -16.456 9.771 1.00 0.00 O ATOM 1418 CB ALA A 521 -5.343 -15.473 8.665 1.00 0.00 C ATOM 0 H ALA A 521 -4.753 -13.169 9.294 1.00 0.00 H new ATOM 0 HA ALA A 521 -5.806 -15.272 10.743 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -5.600 -16.531 8.625 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -6.202 -14.878 8.355 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -4.506 -15.277 7.995 1.00 0.00 H new ATOM 1424 N GLY A 522 -3.725 -16.175 11.882 1.00 0.00 N ATOM 1425 CA GLY A 522 -2.666 -16.991 12.447 1.00 0.00 C ATOM 1426 C GLY A 522 -1.377 -16.217 12.639 1.00 0.00 C ATOM 1427 O GLY A 522 -0.318 -16.806 12.857 1.00 0.00 O ATOM 0 H GLY A 522 -4.378 -15.787 12.563 1.00 0.00 H new ATOM 0 HA2 GLY A 522 -2.993 -17.391 13.407 1.00 0.00 H new ATOM 0 HA3 GLY A 522 -2.480 -17.843 11.793 1.00 0.00 H new ATOM 1431 N ARG A 523 -1.465 -14.894 12.557 1.00 0.00 N ATOM 1432 CA ARG A 523 -0.296 -14.038 12.721 1.00 0.00 C ATOM 1433 C ARG A 523 -0.680 -12.711 13.367 1.00 0.00 C ATOM 1434 O ARG A 523 -1.861 -12.408 13.537 1.00 0.00 O ATOM 1435 CB ARG A 523 0.370 -13.785 11.367 1.00 0.00 C ATOM 1436 CG ARG A 523 1.177 -14.967 10.855 1.00 0.00 C ATOM 1437 CD ARG A 523 2.583 -14.974 11.433 1.00 0.00 C ATOM 1438 NE ARG A 523 3.138 -16.323 11.508 1.00 0.00 N ATOM 1439 CZ ARG A 523 4.134 -16.664 12.317 1.00 0.00 C ATOM 1440 NH1 ARG A 523 4.682 -15.760 13.117 1.00 0.00 N ATOM 1441 NH2 ARG A 523 4.583 -17.913 12.328 1.00 0.00 N ATOM 0 H ARG A 523 -2.334 -14.391 12.378 1.00 0.00 H new ATOM 0 HA ARG A 523 0.409 -14.550 13.376 1.00 0.00 H new ATOM 0 HB2 ARG A 523 -0.398 -13.536 10.635 1.00 0.00 H new ATOM 0 HB3 ARG A 523 1.025 -12.918 11.450 1.00 0.00 H new ATOM 0 HG2 ARG A 523 0.670 -15.896 11.117 1.00 0.00 H new ATOM 0 HG3 ARG A 523 1.230 -14.929 9.767 1.00 0.00 H new ATOM 0 HD2 ARG A 523 3.231 -14.349 10.818 1.00 0.00 H new ATOM 0 HD3 ARG A 523 2.567 -14.533 12.430 1.00 0.00 H new ATOM 0 HE ARG A 523 2.738 -17.043 10.906 1.00 0.00 H new ATOM 0 HH11 ARG A 523 4.339 -14.800 13.112 1.00 0.00 H new ATOM 0 HH12 ARG A 523 5.447 -16.025 13.737 1.00 0.00 H new ATOM 0 HH21 ARG A 523 4.163 -18.611 11.715 1.00 0.00 H new ATOM 0 HH22 ARG A 523 5.348 -18.174 12.950 1.00 0.00 H new ATOM 1455 N LYS A 524 0.327 -11.921 13.727 1.00 0.00 N ATOM 1456 CA LYS A 524 0.096 -10.625 14.354 1.00 0.00 C ATOM 1457 C LYS A 524 0.548 -9.490 13.440 1.00 0.00 C ATOM 1458 O LYS A 524 1.568 -9.596 12.760 1.00 0.00 O ATOM 1459 CB LYS A 524 0.838 -10.543 15.691 1.00 0.00 C ATOM 1460 CG LYS A 524 0.496 -9.305 16.501 1.00 0.00 C ATOM 1461 CD LYS A 524 -0.847 -9.447 17.197 1.00 0.00 C ATOM 1462 CE LYS A 524 -0.979 -8.474 18.358 1.00 0.00 C ATOM 1463 NZ LYS A 524 -0.608 -7.086 17.964 1.00 0.00 N ATOM 0 H LYS A 524 1.311 -12.156 13.595 1.00 0.00 H new ATOM 0 HA LYS A 524 -0.974 -10.521 14.532 1.00 0.00 H new ATOM 0 HB2 LYS A 524 0.605 -11.429 16.281 1.00 0.00 H new ATOM 0 HB3 LYS A 524 1.912 -10.559 15.503 1.00 0.00 H new ATOM 0 HG2 LYS A 524 1.274 -9.128 17.243 1.00 0.00 H new ATOM 0 HG3 LYS A 524 0.477 -8.434 15.846 1.00 0.00 H new ATOM 0 HD2 LYS A 524 -1.650 -9.271 16.481 1.00 0.00 H new ATOM 0 HD3 LYS A 524 -0.963 -10.468 17.561 1.00 0.00 H new ATOM 0 HE2 LYS A 524 -2.005 -8.485 18.726 1.00 0.00 H new ATOM 0 HE3 LYS A 524 -0.342 -8.801 19.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 -1.046 -6.410 18.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 0.426 -6.981 17.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 -0.945 -6.897 16.998 1.00 0.00 H new ATOM 1477 N VAL A 525 -0.219 -8.404 13.430 1.00 0.00 N ATOM 1478 CA VAL A 525 0.104 -7.248 12.602 1.00 0.00 C ATOM 1479 C VAL A 525 0.548 -6.067 13.457 1.00 0.00 C ATOM 1480 O VAL A 525 0.137 -5.930 14.609 1.00 0.00 O ATOM 1481 CB VAL A 525 -1.100 -6.821 11.741 1.00 0.00 C ATOM 1482 CG1 VAL A 525 -0.792 -5.532 10.994 1.00 0.00 C ATOM 1483 CG2 VAL A 525 -1.481 -7.930 10.772 1.00 0.00 C ATOM 0 H VAL A 525 -1.068 -8.301 13.986 1.00 0.00 H new ATOM 0 HA VAL A 525 0.922 -7.546 11.947 1.00 0.00 H new ATOM 0 HB VAL A 525 -1.949 -6.637 12.400 1.00 0.00 H new ATOM 0 HG11 VAL A 525 -1.654 -5.246 10.391 1.00 0.00 H new ATOM 0 HG12 VAL A 525 -0.571 -4.740 11.710 1.00 0.00 H new ATOM 0 HG13 VAL A 525 0.070 -5.685 10.345 1.00 0.00 H new ATOM 0 HG21 VAL A 525 -2.333 -7.612 10.172 1.00 0.00 H new ATOM 0 HG22 VAL A 525 -0.637 -8.147 10.117 1.00 0.00 H new ATOM 0 HG23 VAL A 525 -1.746 -8.827 11.332 1.00 0.00 H new ATOM 1493 N VAL A 526 1.391 -5.213 12.884 1.00 0.00 N ATOM 1494 CA VAL A 526 1.891 -4.041 13.592 1.00 0.00 C ATOM 1495 C VAL A 526 1.834 -2.800 12.709 1.00 0.00 C ATOM 1496 O VAL A 526 2.455 -2.750 11.649 1.00 0.00 O ATOM 1497 CB VAL A 526 3.340 -4.250 14.071 1.00 0.00 C ATOM 1498 CG1 VAL A 526 3.886 -2.974 14.693 1.00 0.00 C ATOM 1499 CG2 VAL A 526 3.413 -5.407 15.056 1.00 0.00 C ATOM 0 H VAL A 526 1.742 -5.311 11.931 1.00 0.00 H new ATOM 0 HA VAL A 526 1.247 -3.897 14.459 1.00 0.00 H new ATOM 0 HB VAL A 526 3.958 -4.498 13.208 1.00 0.00 H new ATOM 0 HG11 VAL A 526 4.911 -3.141 15.026 1.00 0.00 H new ATOM 0 HG12 VAL A 526 3.870 -2.173 13.954 1.00 0.00 H new ATOM 0 HG13 VAL A 526 3.269 -2.692 15.546 1.00 0.00 H new ATOM 0 HG21 VAL A 526 4.444 -5.541 15.384 1.00 0.00 H new ATOM 0 HG22 VAL A 526 2.783 -5.191 15.919 1.00 0.00 H new ATOM 0 HG23 VAL A 526 3.065 -6.319 14.572 1.00 0.00 H new ATOM 1509 N ALA A 527 1.083 -1.797 13.155 1.00 0.00 N ATOM 1510 CA ALA A 527 0.946 -0.554 12.407 1.00 0.00 C ATOM 1511 C ALA A 527 1.535 0.620 13.182 1.00 0.00 C ATOM 1512 O ALA A 527 1.451 0.670 14.408 1.00 0.00 O ATOM 1513 CB ALA A 527 -0.517 -0.293 12.080 1.00 0.00 C ATOM 0 H ALA A 527 0.561 -1.822 14.031 1.00 0.00 H new ATOM 0 HA ALA A 527 1.502 -0.656 11.475 1.00 0.00 H new ATOM 0 HB1 ALA A 527 -0.604 0.639 11.521 1.00 0.00 H new ATOM 0 HB2 ALA A 527 -0.908 -1.114 11.479 1.00 0.00 H new ATOM 0 HB3 ALA A 527 -1.088 -0.216 13.005 1.00 0.00 H new ATOM 1519 N GLU A 528 2.130 1.563 12.457 1.00 0.00 N ATOM 1520 CA GLU A 528 2.734 2.736 13.078 1.00 0.00 C ATOM 1521 C GLU A 528 2.877 3.872 12.069 1.00 0.00 C ATOM 1522 O GLU A 528 2.827 3.653 10.859 1.00 0.00 O ATOM 1523 CB GLU A 528 4.102 2.383 13.663 1.00 0.00 C ATOM 1524 CG GLU A 528 5.173 2.149 12.611 1.00 0.00 C ATOM 1525 CD GLU A 528 6.576 2.331 13.155 1.00 0.00 C ATOM 1526 OE1 GLU A 528 6.809 1.974 14.329 1.00 0.00 O ATOM 1527 OE2 GLU A 528 7.442 2.832 12.407 1.00 0.00 O ATOM 0 H GLU A 528 2.206 1.537 11.440 1.00 0.00 H new ATOM 0 HA GLU A 528 2.078 3.068 13.883 1.00 0.00 H new ATOM 0 HB2 GLU A 528 4.424 3.188 14.324 1.00 0.00 H new ATOM 0 HB3 GLU A 528 4.005 1.487 14.276 1.00 0.00 H new ATOM 0 HG2 GLU A 528 5.070 1.140 12.212 1.00 0.00 H new ATOM 0 HG3 GLU A 528 5.017 2.838 11.780 1.00 0.00 H new ATOM 1534 N VAL A 529 3.056 5.087 12.577 1.00 0.00 N ATOM 1535 CA VAL A 529 3.207 6.259 11.722 1.00 0.00 C ATOM 1536 C VAL A 529 4.570 6.268 11.039 1.00 0.00 C ATOM 1537 O VAL A 529 5.544 5.731 11.567 1.00 0.00 O ATOM 1538 CB VAL A 529 3.038 7.563 12.523 1.00 0.00 C ATOM 1539 CG1 VAL A 529 4.236 7.792 13.431 1.00 0.00 C ATOM 1540 CG2 VAL A 529 2.838 8.743 11.583 1.00 0.00 C ATOM 0 H VAL A 529 3.100 5.286 13.576 1.00 0.00 H new ATOM 0 HA VAL A 529 2.425 6.202 10.965 1.00 0.00 H new ATOM 0 HB VAL A 529 2.151 7.471 13.149 1.00 0.00 H new ATOM 0 HG11 VAL A 529 4.098 8.718 13.989 1.00 0.00 H new ATOM 0 HG12 VAL A 529 4.329 6.959 14.128 1.00 0.00 H new ATOM 0 HG13 VAL A 529 5.141 7.863 12.828 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.720 9.657 12.166 1.00 0.00 H new ATOM 0 HG22 VAL A 529 3.705 8.839 10.930 1.00 0.00 H new ATOM 0 HG23 VAL A 529 1.945 8.580 10.979 1.00 0.00 H new ATOM 1550 N TYR A 530 4.632 6.881 9.863 1.00 0.00 N ATOM 1551 CA TYR A 530 5.875 6.959 9.105 1.00 0.00 C ATOM 1552 C TYR A 530 6.285 8.411 8.879 1.00 0.00 C ATOM 1553 O TYR A 530 5.496 9.331 9.093 1.00 0.00 O ATOM 1554 CB TYR A 530 5.724 6.245 7.761 1.00 0.00 C ATOM 1555 CG TYR A 530 6.926 6.395 6.857 1.00 0.00 C ATOM 1556 CD1 TYR A 530 8.045 5.586 7.015 1.00 0.00 C ATOM 1557 CD2 TYR A 530 6.944 7.345 5.843 1.00 0.00 C ATOM 1558 CE1 TYR A 530 9.146 5.720 6.192 1.00 0.00 C ATOM 1559 CE2 TYR A 530 8.040 7.485 5.014 1.00 0.00 C ATOM 1560 CZ TYR A 530 9.139 6.671 5.193 1.00 0.00 C ATOM 1561 OH TYR A 530 10.233 6.806 4.370 1.00 0.00 O ATOM 0 H TYR A 530 3.835 7.332 9.413 1.00 0.00 H new ATOM 0 HA TYR A 530 6.655 6.466 9.685 1.00 0.00 H new ATOM 0 HB2 TYR A 530 5.545 5.185 7.940 1.00 0.00 H new ATOM 0 HB3 TYR A 530 4.844 6.635 7.249 1.00 0.00 H new ATOM 0 HD1 TYR A 530 8.054 4.839 7.795 1.00 0.00 H new ATOM 0 HD2 TYR A 530 6.086 7.985 5.701 1.00 0.00 H new ATOM 0 HE1 TYR A 530 10.008 5.084 6.330 1.00 0.00 H new ATOM 0 HE2 TYR A 530 8.036 8.228 4.230 1.00 0.00 H new ATOM 0 HH TYR A 530 10.067 7.519 3.719 1.00 0.00 H new