USER MOD reduce.3.24.130724 H: found=0, std=0, add=639, rem=0, adj=11 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 5:sc= 0.939 USER MOD Set 1.2: A 508 THR OG1 : rot 82:sc= 0.82 USER MOD Single : A 444 SER OG : rot -170:sc= 0.655 USER MOD Single : A 447 MET CE :methyl -150:sc= -0.724 (180deg=-1.85) USER MOD Single : A 451 ASN : amide:sc= 0.673 K(o=0.67,f=-0.19) USER MOD Single : A 452 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 456 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0522) USER MOD Single : A 467 THR OG1 : rot 72:sc= 0.543 USER MOD Single : A 470 CYS SG : rot 65:sc= -0.646 USER MOD Single : A 472 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 477 ASN : amide:sc= -0.0994 K(o=-0.099,f=-1) USER MOD Single : A 482 TYR OH : rot 180:sc= 0 USER MOD Single : A 483 GLN : amide:sc= -2.35! C(o=-2.4!,f=-2.7!) USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.234 X(o=-0.23,f=0.045) USER MOD Single : A 510 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 513 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 516 ASN : amide:sc= -0.0485 K(o=-0.048,f=-1) USER MOD Single : A 524 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 204 N SER A 444 1.496 13.280 10.034 1.00 0.00 N ATOM 205 CA SER A 444 1.914 12.381 8.965 1.00 0.00 C ATOM 206 C SER A 444 0.781 11.438 8.574 1.00 0.00 C ATOM 207 O SER A 444 0.437 10.518 9.317 1.00 0.00 O ATOM 208 CB SER A 444 3.138 11.572 9.400 1.00 0.00 C ATOM 209 OG SER A 444 3.767 10.961 8.286 1.00 0.00 O ATOM 0 HA SER A 444 2.176 12.986 8.097 1.00 0.00 H new ATOM 0 HB2 SER A 444 3.847 12.225 9.909 1.00 0.00 H new ATOM 0 HB3 SER A 444 2.837 10.808 10.116 1.00 0.00 H new ATOM 0 HG SER A 444 4.450 10.333 8.600 1.00 0.00 H new ATOM 215 N THR A 445 0.201 11.674 7.401 1.00 0.00 N ATOM 216 CA THR A 445 -0.894 10.848 6.909 1.00 0.00 C ATOM 217 C THR A 445 -0.371 9.597 6.213 1.00 0.00 C ATOM 218 O THR A 445 -1.077 8.975 5.419 1.00 0.00 O ATOM 219 CB THR A 445 -1.792 11.629 5.931 1.00 0.00 C ATOM 220 OG1 THR A 445 -2.928 10.836 5.569 1.00 0.00 O ATOM 221 CG2 THR A 445 -1.019 12.017 4.680 1.00 0.00 C ATOM 0 H THR A 445 0.472 12.431 6.774 1.00 0.00 H new ATOM 0 HA THR A 445 -1.484 10.556 7.778 1.00 0.00 H new ATOM 0 HB THR A 445 -2.128 12.539 6.428 1.00 0.00 H new ATOM 0 HG1 THR A 445 -2.925 10.004 6.087 1.00 0.00 H new ATOM 0 HG21 THR A 445 -1.673 12.567 4.004 1.00 0.00 H new ATOM 0 HG22 THR A 445 -0.172 12.645 4.956 1.00 0.00 H new ATOM 0 HG23 THR A 445 -0.657 11.117 4.182 1.00 0.00 H new ATOM 229 N VAL A 446 0.871 9.233 6.515 1.00 0.00 N ATOM 230 CA VAL A 446 1.489 8.055 5.919 1.00 0.00 C ATOM 231 C VAL A 446 1.636 6.934 6.943 1.00 0.00 C ATOM 232 O VAL A 446 2.555 6.946 7.762 1.00 0.00 O ATOM 233 CB VAL A 446 2.874 8.384 5.331 1.00 0.00 C ATOM 234 CG1 VAL A 446 3.463 7.165 4.638 1.00 0.00 C ATOM 235 CG2 VAL A 446 2.779 9.560 4.371 1.00 0.00 C ATOM 0 H VAL A 446 1.469 9.737 7.169 1.00 0.00 H new ATOM 0 HA VAL A 446 0.831 7.725 5.115 1.00 0.00 H new ATOM 0 HB VAL A 446 3.539 8.664 6.148 1.00 0.00 H new ATOM 0 HG11 VAL A 446 4.441 7.416 4.229 1.00 0.00 H new ATOM 0 HG12 VAL A 446 3.568 6.353 5.357 1.00 0.00 H new ATOM 0 HG13 VAL A 446 2.802 6.851 3.830 1.00 0.00 H new ATOM 0 HG21 VAL A 446 3.767 9.779 3.965 1.00 0.00 H new ATOM 0 HG22 VAL A 446 2.099 9.311 3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 446 2.403 10.434 4.903 1.00 0.00 H new ATOM 245 N MET A 447 0.726 5.968 6.889 1.00 0.00 N ATOM 246 CA MET A 447 0.756 4.838 7.811 1.00 0.00 C ATOM 247 C MET A 447 1.454 3.638 7.179 1.00 0.00 C ATOM 248 O MET A 447 1.184 3.285 6.031 1.00 0.00 O ATOM 249 CB MET A 447 -0.665 4.455 8.228 1.00 0.00 C ATOM 250 CG MET A 447 -0.769 3.059 8.822 1.00 0.00 C ATOM 251 SD MET A 447 -0.826 1.771 7.561 1.00 0.00 S ATOM 252 CE MET A 447 -2.560 1.808 7.117 1.00 0.00 C ATOM 0 H MET A 447 -0.041 5.944 6.217 1.00 0.00 H new ATOM 0 HA MET A 447 1.318 5.138 8.695 1.00 0.00 H new ATOM 0 HB2 MET A 447 -1.029 5.179 8.957 1.00 0.00 H new ATOM 0 HB3 MET A 447 -1.320 4.521 7.359 1.00 0.00 H new ATOM 0 HG2 MET A 447 0.084 2.883 9.478 1.00 0.00 H new ATOM 0 HG3 MET A 447 -1.665 2.997 9.440 1.00 0.00 H new ATOM 0 HE1 MET A 447 -2.875 0.815 6.798 1.00 0.00 H new ATOM 0 HE2 MET A 447 -3.150 2.116 7.980 1.00 0.00 H new ATOM 0 HE3 MET A 447 -2.712 2.516 6.302 1.00 0.00 H new ATOM 262 N VAL A 448 2.353 3.016 7.934 1.00 0.00 N ATOM 263 CA VAL A 448 3.089 1.855 7.448 1.00 0.00 C ATOM 264 C VAL A 448 2.832 0.634 8.324 1.00 0.00 C ATOM 265 O VAL A 448 2.801 0.732 9.551 1.00 0.00 O ATOM 266 CB VAL A 448 4.604 2.130 7.401 1.00 0.00 C ATOM 267 CG1 VAL A 448 5.147 2.367 8.802 1.00 0.00 C ATOM 268 CG2 VAL A 448 5.333 0.979 6.725 1.00 0.00 C ATOM 0 H VAL A 448 2.590 3.297 8.886 1.00 0.00 H new ATOM 0 HA VAL A 448 2.732 1.655 6.438 1.00 0.00 H new ATOM 0 HB VAL A 448 4.774 3.032 6.814 1.00 0.00 H new ATOM 0 HG11 VAL A 448 6.219 2.560 8.749 1.00 0.00 H new ATOM 0 HG12 VAL A 448 4.645 3.227 9.246 1.00 0.00 H new ATOM 0 HG13 VAL A 448 4.967 1.485 9.416 1.00 0.00 H new ATOM 0 HG21 VAL A 448 6.402 1.190 6.700 1.00 0.00 H new ATOM 0 HG22 VAL A 448 5.157 0.059 7.283 1.00 0.00 H new ATOM 0 HG23 VAL A 448 4.963 0.862 5.707 1.00 0.00 H new ATOM 278 N LEU A 449 2.648 -0.516 7.686 1.00 0.00 N ATOM 279 CA LEU A 449 2.393 -1.759 8.407 1.00 0.00 C ATOM 280 C LEU A 449 3.609 -2.678 8.353 1.00 0.00 C ATOM 281 O LEU A 449 4.327 -2.717 7.353 1.00 0.00 O ATOM 282 CB LEU A 449 1.174 -2.472 7.820 1.00 0.00 C ATOM 283 CG LEU A 449 -0.057 -1.600 7.570 1.00 0.00 C ATOM 284 CD1 LEU A 449 -1.084 -2.352 6.738 1.00 0.00 C ATOM 285 CD2 LEU A 449 -0.666 -1.146 8.889 1.00 0.00 C ATOM 0 H LEU A 449 2.670 -0.614 6.671 1.00 0.00 H new ATOM 0 HA LEU A 449 2.193 -1.511 9.450 1.00 0.00 H new ATOM 0 HB2 LEU A 449 1.467 -2.932 6.876 1.00 0.00 H new ATOM 0 HB3 LEU A 449 0.891 -3.280 8.494 1.00 0.00 H new ATOM 0 HG LEU A 449 0.255 -0.716 7.013 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -1.953 -1.716 6.570 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.645 -2.626 5.779 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.391 -3.254 7.268 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -1.541 -0.527 8.692 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -0.963 -2.018 9.472 1.00 0.00 H new ATOM 0 HD23 LEU A 449 0.069 -0.568 9.449 1.00 0.00 H new ATOM 297 N ARG A 450 3.833 -3.419 9.433 1.00 0.00 N ATOM 298 CA ARG A 450 4.961 -4.340 9.508 1.00 0.00 C ATOM 299 C ARG A 450 4.520 -5.697 10.048 1.00 0.00 C ATOM 300 O ARG A 450 3.593 -5.785 10.852 1.00 0.00 O ATOM 301 CB ARG A 450 6.062 -3.759 10.397 1.00 0.00 C ATOM 302 CG ARG A 450 6.181 -2.246 10.309 1.00 0.00 C ATOM 303 CD ARG A 450 7.485 -1.754 10.917 1.00 0.00 C ATOM 304 NE ARG A 450 7.349 -1.466 12.343 1.00 0.00 N ATOM 305 CZ ARG A 450 8.383 -1.299 13.160 1.00 0.00 C ATOM 306 NH1 ARG A 450 9.621 -1.391 12.696 1.00 0.00 N ATOM 307 NH2 ARG A 450 8.179 -1.040 14.445 1.00 0.00 N ATOM 0 H ARG A 450 3.248 -3.400 10.268 1.00 0.00 H new ATOM 0 HA ARG A 450 5.352 -4.479 8.500 1.00 0.00 H new ATOM 0 HB2 ARG A 450 5.868 -4.040 11.432 1.00 0.00 H new ATOM 0 HB3 ARG A 450 7.016 -4.207 10.119 1.00 0.00 H new ATOM 0 HG2 ARG A 450 6.125 -1.936 9.266 1.00 0.00 H new ATOM 0 HG3 ARG A 450 5.340 -1.783 10.825 1.00 0.00 H new ATOM 0 HD2 ARG A 450 8.260 -2.507 10.771 1.00 0.00 H new ATOM 0 HD3 ARG A 450 7.812 -0.855 10.395 1.00 0.00 H new ATOM 0 HE ARG A 450 6.409 -1.389 12.732 1.00 0.00 H new ATOM 0 HH11 ARG A 450 9.782 -1.591 11.709 1.00 0.00 H new ATOM 0 HH12 ARG A 450 10.413 -1.262 13.326 1.00 0.00 H new ATOM 0 HH21 ARG A 450 7.228 -0.969 14.806 1.00 0.00 H new ATOM 0 HH22 ARG A 450 8.973 -0.912 15.072 1.00 0.00 H new ATOM 321 N ASN A 451 5.191 -6.753 9.599 1.00 0.00 N ATOM 322 CA ASN A 451 4.868 -8.106 10.037 1.00 0.00 C ATOM 323 C ASN A 451 3.403 -8.432 9.760 1.00 0.00 C ATOM 324 O ASN A 451 2.756 -9.135 10.536 1.00 0.00 O ATOM 325 CB ASN A 451 5.165 -8.267 11.529 1.00 0.00 C ATOM 326 CG ASN A 451 5.526 -9.694 11.896 1.00 0.00 C ATOM 327 OD1 ASN A 451 6.691 -10.087 11.833 1.00 0.00 O ATOM 328 ND2 ASN A 451 4.525 -10.476 12.282 1.00 0.00 N ATOM 0 H ASN A 451 5.961 -6.698 8.933 1.00 0.00 H new ATOM 0 HA ASN A 451 5.490 -8.802 9.473 1.00 0.00 H new ATOM 0 HB2 ASN A 451 5.985 -7.605 11.807 1.00 0.00 H new ATOM 0 HB3 ASN A 451 4.294 -7.956 12.106 1.00 0.00 H new ATOM 0 HD21 ASN A 451 4.706 -11.446 12.542 1.00 0.00 H new ATOM 0 HD22 ASN A 451 3.575 -10.107 12.319 1.00 0.00 H new ATOM 335 N MET A 452 2.887 -7.916 8.649 1.00 0.00 N ATOM 336 CA MET A 452 1.500 -8.154 8.269 1.00 0.00 C ATOM 337 C MET A 452 1.390 -9.354 7.334 1.00 0.00 C ATOM 338 O MET A 452 0.570 -10.248 7.548 1.00 0.00 O ATOM 339 CB MET A 452 0.913 -6.912 7.596 1.00 0.00 C ATOM 340 CG MET A 452 -0.435 -7.157 6.937 1.00 0.00 C ATOM 341 SD MET A 452 -0.839 -5.911 5.698 1.00 0.00 S ATOM 342 CE MET A 452 -2.444 -6.487 5.150 1.00 0.00 C ATOM 0 H MET A 452 3.409 -7.331 7.997 1.00 0.00 H new ATOM 0 HA MET A 452 0.933 -8.369 9.175 1.00 0.00 H new ATOM 0 HB2 MET A 452 0.806 -6.122 8.340 1.00 0.00 H new ATOM 0 HB3 MET A 452 1.615 -6.550 6.845 1.00 0.00 H new ATOM 0 HG2 MET A 452 -0.433 -8.142 6.469 1.00 0.00 H new ATOM 0 HG3 MET A 452 -1.212 -7.169 7.701 1.00 0.00 H new ATOM 0 HE1 MET A 452 -2.827 -5.817 4.380 1.00 0.00 H new ATOM 0 HE2 MET A 452 -2.350 -7.493 4.742 1.00 0.00 H new ATOM 0 HE3 MET A 452 -3.133 -6.501 5.994 1.00 0.00 H new ATOM 352 N VAL A 453 2.220 -9.367 6.296 1.00 0.00 N ATOM 353 CA VAL A 453 2.216 -10.458 5.328 1.00 0.00 C ATOM 354 C VAL A 453 3.632 -10.791 4.870 1.00 0.00 C ATOM 355 O VAL A 453 4.416 -9.899 4.546 1.00 0.00 O ATOM 356 CB VAL A 453 1.357 -10.113 4.097 1.00 0.00 C ATOM 357 CG1 VAL A 453 -0.122 -10.264 4.418 1.00 0.00 C ATOM 358 CG2 VAL A 453 1.664 -8.704 3.612 1.00 0.00 C ATOM 0 H VAL A 453 2.904 -8.635 6.104 1.00 0.00 H new ATOM 0 HA VAL A 453 1.786 -11.325 5.830 1.00 0.00 H new ATOM 0 HB VAL A 453 1.603 -10.811 3.297 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -0.713 -10.016 3.536 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -0.327 -11.293 4.714 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -0.388 -9.592 5.234 1.00 0.00 H new ATOM 0 HG21 VAL A 453 1.048 -8.477 2.742 1.00 0.00 H new ATOM 0 HG22 VAL A 453 1.447 -7.990 4.407 1.00 0.00 H new ATOM 0 HG23 VAL A 453 2.717 -8.634 3.340 1.00 0.00 H new ATOM 368 N ASP A 454 3.951 -12.080 4.844 1.00 0.00 N ATOM 369 CA ASP A 454 5.272 -12.531 4.423 1.00 0.00 C ATOM 370 C ASP A 454 5.562 -12.104 2.988 1.00 0.00 C ATOM 371 O ASP A 454 4.655 -11.818 2.205 1.00 0.00 O ATOM 372 CB ASP A 454 5.378 -14.052 4.546 1.00 0.00 C ATOM 373 CG ASP A 454 5.790 -14.493 5.937 1.00 0.00 C ATOM 374 OD1 ASP A 454 6.324 -13.654 6.691 1.00 0.00 O ATOM 375 OD2 ASP A 454 5.579 -15.678 6.271 1.00 0.00 O ATOM 0 H ASP A 454 3.313 -12.831 5.109 1.00 0.00 H new ATOM 0 HA ASP A 454 6.011 -12.068 5.077 1.00 0.00 H new ATOM 0 HB2 ASP A 454 4.417 -14.502 4.295 1.00 0.00 H new ATOM 0 HB3 ASP A 454 6.103 -14.423 3.821 1.00 0.00 H new ATOM 380 N PRO A 455 6.854 -12.057 2.633 1.00 0.00 N ATOM 381 CA PRO A 455 7.293 -11.665 1.290 1.00 0.00 C ATOM 382 C PRO A 455 6.940 -12.709 0.236 1.00 0.00 C ATOM 383 O PRO A 455 7.274 -12.558 -0.939 1.00 0.00 O ATOM 384 CB PRO A 455 8.812 -11.543 1.435 1.00 0.00 C ATOM 385 CG PRO A 455 9.157 -12.442 2.572 1.00 0.00 C ATOM 386 CD PRO A 455 7.987 -12.385 3.514 1.00 0.00 C ATOM 0 HA PRO A 455 6.808 -10.748 0.954 1.00 0.00 H new ATOM 0 HB2 PRO A 455 9.323 -11.847 0.521 1.00 0.00 H new ATOM 0 HB3 PRO A 455 9.109 -10.514 1.639 1.00 0.00 H new ATOM 0 HG2 PRO A 455 9.330 -13.461 2.225 1.00 0.00 H new ATOM 0 HG3 PRO A 455 10.072 -12.114 3.065 1.00 0.00 H new ATOM 0 HD2 PRO A 455 7.836 -13.336 4.025 1.00 0.00 H new ATOM 0 HD3 PRO A 455 8.129 -11.628 4.285 1.00 0.00 H new ATOM 394 N LYS A 456 6.261 -13.768 0.664 1.00 0.00 N ATOM 395 CA LYS A 456 5.860 -14.838 -0.242 1.00 0.00 C ATOM 396 C LYS A 456 4.465 -14.582 -0.802 1.00 0.00 C ATOM 397 O LYS A 456 4.198 -14.847 -1.974 1.00 0.00 O ATOM 398 CB LYS A 456 5.891 -16.186 0.481 1.00 0.00 C ATOM 399 CG LYS A 456 4.776 -16.356 1.498 1.00 0.00 C ATOM 400 CD LYS A 456 4.866 -17.699 2.204 1.00 0.00 C ATOM 401 CE LYS A 456 4.180 -18.796 1.404 1.00 0.00 C ATOM 402 NZ LYS A 456 2.697 -18.706 1.497 1.00 0.00 N ATOM 0 H LYS A 456 5.977 -13.908 1.633 1.00 0.00 H new ATOM 0 HA LYS A 456 6.567 -14.861 -1.071 1.00 0.00 H new ATOM 0 HB2 LYS A 456 5.824 -16.986 -0.256 1.00 0.00 H new ATOM 0 HB3 LYS A 456 6.851 -16.297 0.985 1.00 0.00 H new ATOM 0 HG2 LYS A 456 4.827 -15.553 2.233 1.00 0.00 H new ATOM 0 HG3 LYS A 456 3.811 -16.270 0.999 1.00 0.00 H new ATOM 0 HD2 LYS A 456 5.913 -17.960 2.359 1.00 0.00 H new ATOM 0 HD3 LYS A 456 4.407 -17.625 3.190 1.00 0.00 H new ATOM 0 HE2 LYS A 456 4.483 -18.727 0.359 1.00 0.00 H new ATOM 0 HE3 LYS A 456 4.508 -19.770 1.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 2.272 -19.575 1.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 2.418 -18.593 2.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 2.364 -17.888 0.949 1.00 0.00 H new ATOM 416 N ASP A 457 3.579 -14.063 0.042 1.00 0.00 N ATOM 417 CA ASP A 457 2.212 -13.769 -0.370 1.00 0.00 C ATOM 418 C ASP A 457 2.182 -12.625 -1.379 1.00 0.00 C ATOM 419 O ASP A 457 1.311 -12.574 -2.248 1.00 0.00 O ATOM 420 CB ASP A 457 1.355 -13.414 0.846 1.00 0.00 C ATOM 421 CG ASP A 457 0.734 -14.636 1.493 1.00 0.00 C ATOM 422 OD1 ASP A 457 1.426 -15.301 2.292 1.00 0.00 O ATOM 423 OD2 ASP A 457 -0.445 -14.929 1.199 1.00 0.00 O ATOM 0 H ASP A 457 3.784 -13.837 1.015 1.00 0.00 H new ATOM 0 HA ASP A 457 1.803 -14.660 -0.846 1.00 0.00 H new ATOM 0 HB2 ASP A 457 1.969 -12.891 1.579 1.00 0.00 H new ATOM 0 HB3 ASP A 457 0.566 -12.727 0.542 1.00 0.00 H new ATOM 428 N ILE A 458 3.138 -11.711 -1.257 1.00 0.00 N ATOM 429 CA ILE A 458 3.222 -10.568 -2.159 1.00 0.00 C ATOM 430 C ILE A 458 2.834 -10.961 -3.580 1.00 0.00 C ATOM 431 O ILE A 458 3.531 -11.738 -4.233 1.00 0.00 O ATOM 432 CB ILE A 458 4.638 -9.964 -2.173 1.00 0.00 C ATOM 433 CG1 ILE A 458 5.081 -9.613 -0.751 1.00 0.00 C ATOM 434 CG2 ILE A 458 4.680 -8.734 -3.067 1.00 0.00 C ATOM 435 CD1 ILE A 458 4.090 -8.745 -0.008 1.00 0.00 C ATOM 0 H ILE A 458 3.866 -11.739 -0.543 1.00 0.00 H new ATOM 0 HA ILE A 458 2.522 -9.820 -1.787 1.00 0.00 H new ATOM 0 HB ILE A 458 5.329 -10.705 -2.575 1.00 0.00 H new ATOM 0 HG12 ILE A 458 5.238 -10.534 -0.190 1.00 0.00 H new ATOM 0 HG13 ILE A 458 6.041 -9.099 -0.794 1.00 0.00 H new ATOM 0 HG21 ILE A 458 5.688 -8.318 -3.067 1.00 0.00 H new ATOM 0 HG22 ILE A 458 4.403 -9.013 -4.084 1.00 0.00 H new ATOM 0 HG23 ILE A 458 3.979 -7.988 -2.692 1.00 0.00 H new ATOM 0 HD11 ILE A 458 4.468 -8.535 0.993 1.00 0.00 H new ATOM 0 HD12 ILE A 458 3.951 -7.808 -0.547 1.00 0.00 H new ATOM 0 HD13 ILE A 458 3.135 -9.265 0.067 1.00 0.00 H new ATOM 447 N ASP A 459 1.719 -10.416 -4.055 1.00 0.00 N ATOM 448 CA ASP A 459 1.239 -10.706 -5.401 1.00 0.00 C ATOM 449 C ASP A 459 0.371 -9.567 -5.926 1.00 0.00 C ATOM 450 O ASP A 459 -0.195 -8.797 -5.151 1.00 0.00 O ATOM 451 CB ASP A 459 0.447 -12.015 -5.412 1.00 0.00 C ATOM 452 CG ASP A 459 1.346 -13.235 -5.448 1.00 0.00 C ATOM 453 OD1 ASP A 459 1.927 -13.574 -4.396 1.00 0.00 O ATOM 454 OD2 ASP A 459 1.469 -13.851 -6.527 1.00 0.00 O ATOM 0 H ASP A 459 1.131 -9.771 -3.528 1.00 0.00 H new ATOM 0 HA ASP A 459 2.105 -10.809 -6.055 1.00 0.00 H new ATOM 0 HB2 ASP A 459 -0.187 -12.060 -4.526 1.00 0.00 H new ATOM 0 HB3 ASP A 459 -0.214 -12.029 -6.278 1.00 0.00 H new ATOM 459 N ASP A 460 0.272 -9.467 -7.247 1.00 0.00 N ATOM 460 CA ASP A 460 -0.528 -8.422 -7.876 1.00 0.00 C ATOM 461 C ASP A 460 -1.945 -8.407 -7.312 1.00 0.00 C ATOM 462 O ASP A 460 -2.607 -7.369 -7.296 1.00 0.00 O ATOM 463 CB ASP A 460 -0.571 -8.625 -9.391 1.00 0.00 C ATOM 464 CG ASP A 460 0.742 -8.272 -10.061 1.00 0.00 C ATOM 465 OD1 ASP A 460 1.448 -7.378 -9.549 1.00 0.00 O ATOM 466 OD2 ASP A 460 1.065 -8.891 -11.097 1.00 0.00 O ATOM 0 H ASP A 460 0.735 -10.096 -7.903 1.00 0.00 H new ATOM 0 HA ASP A 460 -0.060 -7.462 -7.659 1.00 0.00 H new ATOM 0 HB2 ASP A 460 -0.818 -9.664 -9.608 1.00 0.00 H new ATOM 0 HB3 ASP A 460 -1.367 -8.013 -9.814 1.00 0.00 H new ATOM 471 N ASP A 461 -2.404 -9.565 -6.850 1.00 0.00 N ATOM 472 CA ASP A 461 -3.743 -9.686 -6.284 1.00 0.00 C ATOM 473 C ASP A 461 -3.804 -9.059 -4.895 1.00 0.00 C ATOM 474 O ASP A 461 -4.778 -8.389 -4.548 1.00 0.00 O ATOM 475 CB ASP A 461 -4.158 -11.156 -6.212 1.00 0.00 C ATOM 476 CG ASP A 461 -4.866 -11.620 -7.470 1.00 0.00 C ATOM 477 OD1 ASP A 461 -5.959 -11.092 -7.765 1.00 0.00 O ATOM 478 OD2 ASP A 461 -4.328 -12.511 -8.160 1.00 0.00 O ATOM 0 H ASP A 461 -1.869 -10.433 -6.856 1.00 0.00 H new ATOM 0 HA ASP A 461 -4.436 -9.152 -6.935 1.00 0.00 H new ATOM 0 HB2 ASP A 461 -3.274 -11.772 -6.048 1.00 0.00 H new ATOM 0 HB3 ASP A 461 -4.814 -11.304 -5.354 1.00 0.00 H new ATOM 483 N LEU A 462 -2.760 -9.280 -4.105 1.00 0.00 N ATOM 484 CA LEU A 462 -2.696 -8.738 -2.752 1.00 0.00 C ATOM 485 C LEU A 462 -2.800 -7.216 -2.770 1.00 0.00 C ATOM 486 O LEU A 462 -3.691 -6.638 -2.148 1.00 0.00 O ATOM 487 CB LEU A 462 -1.393 -9.163 -2.072 1.00 0.00 C ATOM 488 CG LEU A 462 -1.255 -8.794 -0.595 1.00 0.00 C ATOM 489 CD1 LEU A 462 -2.092 -9.725 0.268 1.00 0.00 C ATOM 490 CD2 LEU A 462 0.205 -8.837 -0.168 1.00 0.00 C ATOM 0 H LEU A 462 -1.946 -9.831 -4.378 1.00 0.00 H new ATOM 0 HA LEU A 462 -3.540 -9.135 -2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 462 -1.293 -10.244 -2.166 1.00 0.00 H new ATOM 0 HB3 LEU A 462 -0.560 -8.717 -2.616 1.00 0.00 H new ATOM 0 HG LEU A 462 -1.623 -7.777 -0.459 1.00 0.00 H new ATOM 0 HD11 LEU A 462 -1.981 -9.447 1.316 1.00 0.00 H new ATOM 0 HD12 LEU A 462 -3.140 -9.644 -0.020 1.00 0.00 H new ATOM 0 HD13 LEU A 462 -1.755 -10.752 0.127 1.00 0.00 H new ATOM 0 HD21 LEU A 462 0.284 -8.572 0.886 1.00 0.00 H new ATOM 0 HD22 LEU A 462 0.599 -9.842 -0.320 1.00 0.00 H new ATOM 0 HD23 LEU A 462 0.780 -8.128 -0.764 1.00 0.00 H new ATOM 502 N GLU A 463 -1.885 -6.574 -3.490 1.00 0.00 N ATOM 503 CA GLU A 463 -1.876 -5.119 -3.590 1.00 0.00 C ATOM 504 C GLU A 463 -3.298 -4.568 -3.632 1.00 0.00 C ATOM 505 O GLU A 463 -3.683 -3.747 -2.800 1.00 0.00 O ATOM 506 CB GLU A 463 -1.108 -4.676 -4.837 1.00 0.00 C ATOM 507 CG GLU A 463 -0.764 -3.196 -4.847 1.00 0.00 C ATOM 508 CD GLU A 463 -0.678 -2.626 -6.249 1.00 0.00 C ATOM 509 OE1 GLU A 463 0.420 -2.673 -6.842 1.00 0.00 O ATOM 510 OE2 GLU A 463 -1.709 -2.133 -6.754 1.00 0.00 O ATOM 0 H GLU A 463 -1.141 -7.038 -4.012 1.00 0.00 H new ATOM 0 HA GLU A 463 -1.377 -4.723 -2.706 1.00 0.00 H new ATOM 0 HB2 GLU A 463 -0.187 -5.255 -4.911 1.00 0.00 H new ATOM 0 HB3 GLU A 463 -1.702 -4.908 -5.721 1.00 0.00 H new ATOM 0 HG2 GLU A 463 -1.518 -2.648 -4.282 1.00 0.00 H new ATOM 0 HG3 GLU A 463 0.188 -3.045 -4.338 1.00 0.00 H new ATOM 517 N GLY A 464 -4.075 -5.025 -4.610 1.00 0.00 N ATOM 518 CA GLY A 464 -5.445 -4.567 -4.744 1.00 0.00 C ATOM 519 C GLY A 464 -6.276 -4.854 -3.509 1.00 0.00 C ATOM 520 O GLY A 464 -7.014 -3.991 -3.036 1.00 0.00 O ATOM 0 H GLY A 464 -3.780 -5.704 -5.311 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -5.449 -3.495 -4.940 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -5.903 -5.050 -5.607 1.00 0.00 H new ATOM 524 N GLU A 465 -6.158 -6.072 -2.988 1.00 0.00 N ATOM 525 CA GLU A 465 -6.907 -6.470 -1.802 1.00 0.00 C ATOM 526 C GLU A 465 -6.702 -5.471 -0.668 1.00 0.00 C ATOM 527 O GLU A 465 -7.660 -5.037 -0.027 1.00 0.00 O ATOM 528 CB GLU A 465 -6.480 -7.868 -1.348 1.00 0.00 C ATOM 529 CG GLU A 465 -7.053 -8.987 -2.202 1.00 0.00 C ATOM 530 CD GLU A 465 -8.473 -9.350 -1.811 1.00 0.00 C ATOM 531 OE1 GLU A 465 -9.275 -8.426 -1.563 1.00 0.00 O ATOM 532 OE2 GLU A 465 -8.781 -10.559 -1.753 1.00 0.00 O ATOM 0 H GLU A 465 -5.552 -6.799 -3.368 1.00 0.00 H new ATOM 0 HA GLU A 465 -7.966 -6.487 -2.061 1.00 0.00 H new ATOM 0 HB2 GLU A 465 -5.392 -7.930 -1.365 1.00 0.00 H new ATOM 0 HB3 GLU A 465 -6.791 -8.016 -0.314 1.00 0.00 H new ATOM 0 HG2 GLU A 465 -7.034 -8.686 -3.249 1.00 0.00 H new ATOM 0 HG3 GLU A 465 -6.419 -9.869 -2.112 1.00 0.00 H new ATOM 539 N VAL A 466 -5.446 -5.109 -0.425 1.00 0.00 N ATOM 540 CA VAL A 466 -5.115 -4.160 0.631 1.00 0.00 C ATOM 541 C VAL A 466 -5.714 -2.788 0.345 1.00 0.00 C ATOM 542 O VAL A 466 -6.278 -2.146 1.232 1.00 0.00 O ATOM 543 CB VAL A 466 -3.590 -4.018 0.799 1.00 0.00 C ATOM 544 CG1 VAL A 466 -3.265 -3.051 1.928 1.00 0.00 C ATOM 545 CG2 VAL A 466 -2.953 -5.377 1.050 1.00 0.00 C ATOM 0 H VAL A 466 -4.641 -5.459 -0.945 1.00 0.00 H new ATOM 0 HA VAL A 466 -5.540 -4.553 1.555 1.00 0.00 H new ATOM 0 HB VAL A 466 -3.176 -3.613 -0.125 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -2.184 -2.963 2.032 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -3.688 -2.072 1.702 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.690 -3.424 2.860 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -1.876 -5.258 1.166 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -3.370 -5.812 1.958 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -3.156 -6.036 0.206 1.00 0.00 H new ATOM 555 N THR A 467 -5.588 -2.341 -0.901 1.00 0.00 N ATOM 556 CA THR A 467 -6.116 -1.044 -1.305 1.00 0.00 C ATOM 557 C THR A 467 -7.611 -0.948 -1.025 1.00 0.00 C ATOM 558 O THR A 467 -8.126 0.127 -0.719 1.00 0.00 O ATOM 559 CB THR A 467 -5.867 -0.778 -2.801 1.00 0.00 C ATOM 560 OG1 THR A 467 -4.470 -0.898 -3.094 1.00 0.00 O ATOM 561 CG2 THR A 467 -6.355 0.609 -3.193 1.00 0.00 C ATOM 0 H THR A 467 -5.125 -2.859 -1.648 1.00 0.00 H new ATOM 0 HA THR A 467 -5.590 -0.291 -0.717 1.00 0.00 H new ATOM 0 HB THR A 467 -6.424 -1.518 -3.376 1.00 0.00 H new ATOM 0 HG1 THR A 467 -4.209 -1.842 -3.062 1.00 0.00 H new ATOM 0 HG21 THR A 467 -6.168 0.774 -4.254 1.00 0.00 H new ATOM 0 HG22 THR A 467 -7.424 0.688 -2.996 1.00 0.00 H new ATOM 0 HG23 THR A 467 -5.822 1.360 -2.610 1.00 0.00 H new ATOM 569 N GLU A 468 -8.303 -2.079 -1.133 1.00 0.00 N ATOM 570 CA GLU A 468 -9.740 -2.120 -0.891 1.00 0.00 C ATOM 571 C GLU A 468 -10.039 -2.182 0.604 1.00 0.00 C ATOM 572 O GLU A 468 -11.005 -1.586 1.079 1.00 0.00 O ATOM 573 CB GLU A 468 -10.364 -3.325 -1.597 1.00 0.00 C ATOM 574 CG GLU A 468 -10.120 -3.345 -3.097 1.00 0.00 C ATOM 575 CD GLU A 468 -11.047 -2.412 -3.851 1.00 0.00 C ATOM 576 OE1 GLU A 468 -12.247 -2.363 -3.509 1.00 0.00 O ATOM 577 OE2 GLU A 468 -10.571 -1.729 -4.783 1.00 0.00 O ATOM 0 H GLU A 468 -7.892 -2.977 -1.386 1.00 0.00 H new ATOM 0 HA GLU A 468 -10.176 -1.206 -1.293 1.00 0.00 H new ATOM 0 HB2 GLU A 468 -9.963 -4.239 -1.160 1.00 0.00 H new ATOM 0 HB3 GLU A 468 -11.438 -3.328 -1.412 1.00 0.00 H new ATOM 0 HG2 GLU A 468 -9.086 -3.064 -3.297 1.00 0.00 H new ATOM 0 HG3 GLU A 468 -10.252 -4.361 -3.469 1.00 0.00 H new ATOM 584 N GLU A 469 -9.203 -2.908 1.339 1.00 0.00 N ATOM 585 CA GLU A 469 -9.378 -3.049 2.780 1.00 0.00 C ATOM 586 C GLU A 469 -9.011 -1.756 3.502 1.00 0.00 C ATOM 587 O GLU A 469 -9.476 -1.500 4.614 1.00 0.00 O ATOM 588 CB GLU A 469 -8.523 -4.202 3.310 1.00 0.00 C ATOM 589 CG GLU A 469 -9.227 -5.548 3.276 1.00 0.00 C ATOM 590 CD GLU A 469 -8.405 -6.653 3.911 1.00 0.00 C ATOM 591 OE1 GLU A 469 -7.344 -6.999 3.350 1.00 0.00 O ATOM 592 OE2 GLU A 469 -8.823 -7.172 4.967 1.00 0.00 O ATOM 0 H GLU A 469 -8.398 -3.408 0.961 1.00 0.00 H new ATOM 0 HA GLU A 469 -10.429 -3.267 2.973 1.00 0.00 H new ATOM 0 HB2 GLU A 469 -7.608 -4.265 2.721 1.00 0.00 H new ATOM 0 HB3 GLU A 469 -8.227 -3.982 4.336 1.00 0.00 H new ATOM 0 HG2 GLU A 469 -10.182 -5.467 3.795 1.00 0.00 H new ATOM 0 HG3 GLU A 469 -9.447 -5.813 2.242 1.00 0.00 H new ATOM 599 N CYS A 470 -8.176 -0.945 2.863 1.00 0.00 N ATOM 600 CA CYS A 470 -7.745 0.322 3.444 1.00 0.00 C ATOM 601 C CYS A 470 -8.763 1.422 3.163 1.00 0.00 C ATOM 602 O CYS A 470 -8.603 2.558 3.610 1.00 0.00 O ATOM 603 CB CYS A 470 -6.377 0.722 2.889 1.00 0.00 C ATOM 604 SG CYS A 470 -5.067 -0.480 3.218 1.00 0.00 S ATOM 0 H CYS A 470 -7.784 -1.142 1.942 1.00 0.00 H new ATOM 0 HA CYS A 470 -7.667 0.191 4.523 1.00 0.00 H new ATOM 0 HB2 CYS A 470 -6.462 0.865 1.812 1.00 0.00 H new ATOM 0 HB3 CYS A 470 -6.090 1.683 3.317 1.00 0.00 H new ATOM 0 HG CYS A 470 -5.324 -1.586 2.586 1.00 0.00 H new ATOM 610 N GLY A 471 -9.809 1.078 2.419 1.00 0.00 N ATOM 611 CA GLY A 471 -10.837 2.049 2.090 1.00 0.00 C ATOM 612 C GLY A 471 -11.791 2.296 3.242 1.00 0.00 C ATOM 613 O GLY A 471 -12.407 3.358 3.332 1.00 0.00 O ATOM 0 H GLY A 471 -9.963 0.145 2.038 1.00 0.00 H new ATOM 0 HA2 GLY A 471 -10.366 2.990 1.804 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -11.400 1.699 1.225 1.00 0.00 H new ATOM 617 N LYS A 472 -11.916 1.312 4.126 1.00 0.00 N ATOM 618 CA LYS A 472 -12.802 1.426 5.279 1.00 0.00 C ATOM 619 C LYS A 472 -12.402 2.607 6.157 1.00 0.00 C ATOM 620 O LYS A 472 -13.230 3.457 6.486 1.00 0.00 O ATOM 621 CB LYS A 472 -12.775 0.134 6.099 1.00 0.00 C ATOM 622 CG LYS A 472 -12.868 -1.124 5.254 1.00 0.00 C ATOM 623 CD LYS A 472 -13.678 -0.889 3.990 1.00 0.00 C ATOM 624 CE LYS A 472 -14.326 -2.173 3.496 1.00 0.00 C ATOM 625 NZ LYS A 472 -15.657 -2.400 4.124 1.00 0.00 N ATOM 0 H LYS A 472 -11.415 0.426 4.066 1.00 0.00 H new ATOM 0 HA LYS A 472 -13.815 1.595 4.913 1.00 0.00 H new ATOM 0 HB2 LYS A 472 -11.855 0.103 6.682 1.00 0.00 H new ATOM 0 HB3 LYS A 472 -13.602 0.147 6.809 1.00 0.00 H new ATOM 0 HG2 LYS A 472 -11.866 -1.459 4.988 1.00 0.00 H new ATOM 0 HG3 LYS A 472 -13.326 -1.922 5.838 1.00 0.00 H new ATOM 0 HD2 LYS A 472 -14.448 -0.143 4.184 1.00 0.00 H new ATOM 0 HD3 LYS A 472 -13.031 -0.484 3.212 1.00 0.00 H new ATOM 0 HE2 LYS A 472 -14.438 -2.130 2.413 1.00 0.00 H new ATOM 0 HE3 LYS A 472 -13.672 -3.017 3.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 472 -16.066 -3.285 3.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 472 -15.547 -2.467 5.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 472 -16.289 -1.607 3.894 1.00 0.00 H new ATOM 639 N PHE A 473 -11.128 2.655 6.533 1.00 0.00 N ATOM 640 CA PHE A 473 -10.619 3.732 7.373 1.00 0.00 C ATOM 641 C PHE A 473 -11.065 5.092 6.844 1.00 0.00 C ATOM 642 O PHE A 473 -11.516 5.949 7.603 1.00 0.00 O ATOM 643 CB PHE A 473 -9.091 3.676 7.442 1.00 0.00 C ATOM 644 CG PHE A 473 -8.558 2.319 7.806 1.00 0.00 C ATOM 645 CD1 PHE A 473 -8.420 1.948 9.133 1.00 0.00 C ATOM 646 CD2 PHE A 473 -8.194 1.417 6.820 1.00 0.00 C ATOM 647 CE1 PHE A 473 -7.929 0.701 9.471 1.00 0.00 C ATOM 648 CE2 PHE A 473 -7.703 0.168 7.152 1.00 0.00 C ATOM 649 CZ PHE A 473 -7.570 -0.190 8.479 1.00 0.00 C ATOM 0 H PHE A 473 -10.429 1.960 6.269 1.00 0.00 H new ATOM 0 HA PHE A 473 -11.026 3.600 8.375 1.00 0.00 H new ATOM 0 HB2 PHE A 473 -8.680 3.972 6.477 1.00 0.00 H new ATOM 0 HB3 PHE A 473 -8.741 4.404 8.174 1.00 0.00 H new ATOM 0 HD1 PHE A 473 -8.699 2.641 9.913 1.00 0.00 H new ATOM 0 HD2 PHE A 473 -8.295 1.692 5.781 1.00 0.00 H new ATOM 0 HE1 PHE A 473 -7.826 0.424 10.510 1.00 0.00 H new ATOM 0 HE2 PHE A 473 -7.424 -0.527 6.374 1.00 0.00 H new ATOM 0 HZ PHE A 473 -7.186 -1.165 8.741 1.00 0.00 H new ATOM 659 N GLY A 474 -10.934 5.283 5.534 1.00 0.00 N ATOM 660 CA GLY A 474 -11.327 6.540 4.925 1.00 0.00 C ATOM 661 C GLY A 474 -11.015 6.588 3.442 1.00 0.00 C ATOM 662 O GLY A 474 -11.372 5.678 2.696 1.00 0.00 O ATOM 0 H GLY A 474 -10.563 4.590 4.884 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.396 6.694 5.073 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -10.814 7.360 5.428 1.00 0.00 H new ATOM 666 N ALA A 475 -10.346 7.655 3.015 1.00 0.00 N ATOM 667 CA ALA A 475 -9.986 7.818 1.612 1.00 0.00 C ATOM 668 C ALA A 475 -8.523 7.455 1.375 1.00 0.00 C ATOM 669 O ALA A 475 -7.618 8.148 1.840 1.00 0.00 O ATOM 670 CB ALA A 475 -10.257 9.245 1.160 1.00 0.00 C ATOM 0 H ALA A 475 -10.043 8.418 3.620 1.00 0.00 H new ATOM 0 HA ALA A 475 -10.602 7.139 1.023 1.00 0.00 H new ATOM 0 HB1 ALA A 475 -9.984 9.352 0.110 1.00 0.00 H new ATOM 0 HB2 ALA A 475 -11.316 9.471 1.284 1.00 0.00 H new ATOM 0 HB3 ALA A 475 -9.666 9.936 1.761 1.00 0.00 H new ATOM 676 N VAL A 476 -8.299 6.364 0.650 1.00 0.00 N ATOM 677 CA VAL A 476 -6.947 5.909 0.351 1.00 0.00 C ATOM 678 C VAL A 476 -6.250 6.856 -0.619 1.00 0.00 C ATOM 679 O VAL A 476 -6.853 7.330 -1.581 1.00 0.00 O ATOM 680 CB VAL A 476 -6.951 4.490 -0.248 1.00 0.00 C ATOM 681 CG1 VAL A 476 -5.529 4.006 -0.485 1.00 0.00 C ATOM 682 CG2 VAL A 476 -7.705 3.531 0.660 1.00 0.00 C ATOM 0 H VAL A 476 -9.037 5.779 0.259 1.00 0.00 H new ATOM 0 HA VAL A 476 -6.403 5.895 1.295 1.00 0.00 H new ATOM 0 HB VAL A 476 -7.463 4.522 -1.210 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.552 3.002 -0.908 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -5.026 4.680 -1.178 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -4.988 3.988 0.461 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -7.698 2.533 0.221 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -7.224 3.501 1.638 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -8.735 3.870 0.773 1.00 0.00 H new ATOM 692 N ASN A 477 -4.975 7.129 -0.359 1.00 0.00 N ATOM 693 CA ASN A 477 -4.195 8.020 -1.209 1.00 0.00 C ATOM 694 C ASN A 477 -3.269 7.226 -2.125 1.00 0.00 C ATOM 695 O ASN A 477 -3.387 7.287 -3.349 1.00 0.00 O ATOM 696 CB ASN A 477 -3.377 8.989 -0.353 1.00 0.00 C ATOM 697 CG ASN A 477 -3.033 10.267 -1.095 1.00 0.00 C ATOM 698 OD1 ASN A 477 -2.537 10.230 -2.221 1.00 0.00 O ATOM 699 ND2 ASN A 477 -3.295 11.405 -0.464 1.00 0.00 N ATOM 0 H ASN A 477 -4.461 6.745 0.434 1.00 0.00 H new ATOM 0 HA ASN A 477 -4.888 8.589 -1.828 1.00 0.00 H new ATOM 0 HB2 ASN A 477 -3.938 9.235 0.549 1.00 0.00 H new ATOM 0 HB3 ASN A 477 -2.457 8.499 -0.033 1.00 0.00 H new ATOM 0 HD21 ASN A 477 -3.085 12.297 -0.912 1.00 0.00 H new ATOM 0 HD22 ASN A 477 -3.707 11.388 0.469 1.00 0.00 H new ATOM 706 N ARG A 478 -2.348 6.480 -1.523 1.00 0.00 N ATOM 707 CA ARG A 478 -1.401 5.674 -2.284 1.00 0.00 C ATOM 708 C ARG A 478 -1.061 4.387 -1.539 1.00 0.00 C ATOM 709 O ARG A 478 -1.208 4.306 -0.319 1.00 0.00 O ATOM 710 CB ARG A 478 -0.123 6.471 -2.556 1.00 0.00 C ATOM 711 CG ARG A 478 -0.164 7.263 -3.853 1.00 0.00 C ATOM 712 CD ARG A 478 1.232 7.497 -4.407 1.00 0.00 C ATOM 713 NE ARG A 478 1.225 8.428 -5.533 1.00 0.00 N ATOM 714 CZ ARG A 478 1.009 9.732 -5.407 1.00 0.00 C ATOM 715 NH1 ARG A 478 0.783 10.257 -4.210 1.00 0.00 N ATOM 716 NH2 ARG A 478 1.019 10.514 -6.479 1.00 0.00 N ATOM 0 H ARG A 478 -2.238 6.417 -0.511 1.00 0.00 H new ATOM 0 HA ARG A 478 -1.867 5.412 -3.234 1.00 0.00 H new ATOM 0 HB2 ARG A 478 0.051 7.157 -1.727 1.00 0.00 H new ATOM 0 HB3 ARG A 478 0.724 5.785 -2.586 1.00 0.00 H new ATOM 0 HG2 ARG A 478 -0.764 6.727 -4.589 1.00 0.00 H new ATOM 0 HG3 ARG A 478 -0.653 8.221 -3.680 1.00 0.00 H new ATOM 0 HD2 ARG A 478 1.875 7.887 -3.618 1.00 0.00 H new ATOM 0 HD3 ARG A 478 1.660 6.546 -4.725 1.00 0.00 H new ATOM 0 HE ARG A 478 1.395 8.056 -6.467 1.00 0.00 H new ATOM 0 HH11 ARG A 478 0.775 9.659 -3.384 1.00 0.00 H new ATOM 0 HH12 ARG A 478 0.617 11.259 -4.116 1.00 0.00 H new ATOM 0 HH21 ARG A 478 1.193 10.113 -7.401 1.00 0.00 H new ATOM 0 HH22 ARG A 478 0.853 11.516 -6.381 1.00 0.00 H new ATOM 730 N VAL A 479 -0.606 3.382 -2.281 1.00 0.00 N ATOM 731 CA VAL A 479 -0.244 2.099 -1.691 1.00 0.00 C ATOM 732 C VAL A 479 1.018 1.534 -2.333 1.00 0.00 C ATOM 733 O VAL A 479 1.022 1.187 -3.515 1.00 0.00 O ATOM 734 CB VAL A 479 -1.384 1.073 -1.836 1.00 0.00 C ATOM 735 CG1 VAL A 479 -1.040 -0.216 -1.106 1.00 0.00 C ATOM 736 CG2 VAL A 479 -2.692 1.654 -1.321 1.00 0.00 C ATOM 0 H VAL A 479 -0.479 3.432 -3.292 1.00 0.00 H new ATOM 0 HA VAL A 479 -0.059 2.279 -0.632 1.00 0.00 H new ATOM 0 HB VAL A 479 -1.507 0.841 -2.894 1.00 0.00 H new ATOM 0 HG11 VAL A 479 -1.857 -0.928 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL A 479 -0.128 -0.640 -1.526 1.00 0.00 H new ATOM 0 HG13 VAL A 479 -0.888 -0.005 -0.048 1.00 0.00 H new ATOM 0 HG21 VAL A 479 -3.486 0.916 -1.431 1.00 0.00 H new ATOM 0 HG22 VAL A 479 -2.584 1.917 -0.269 1.00 0.00 H new ATOM 0 HG23 VAL A 479 -2.944 2.546 -1.894 1.00 0.00 H new ATOM 746 N ILE A 480 2.086 1.445 -1.548 1.00 0.00 N ATOM 747 CA ILE A 480 3.354 0.921 -2.040 1.00 0.00 C ATOM 748 C ILE A 480 3.906 -0.150 -1.106 1.00 0.00 C ATOM 749 O ILE A 480 4.076 0.084 0.091 1.00 0.00 O ATOM 750 CB ILE A 480 4.401 2.039 -2.198 1.00 0.00 C ATOM 751 CG1 ILE A 480 4.063 2.919 -3.403 1.00 0.00 C ATOM 752 CG2 ILE A 480 5.793 1.442 -2.345 1.00 0.00 C ATOM 753 CD1 ILE A 480 4.524 4.352 -3.253 1.00 0.00 C ATOM 0 H ILE A 480 2.099 1.729 -0.568 1.00 0.00 H new ATOM 0 HA ILE A 480 3.156 0.480 -3.017 1.00 0.00 H new ATOM 0 HB ILE A 480 4.385 2.661 -1.303 1.00 0.00 H new ATOM 0 HG12 ILE A 480 4.520 2.490 -4.295 1.00 0.00 H new ATOM 0 HG13 ILE A 480 2.984 2.907 -3.560 1.00 0.00 H new ATOM 0 HG21 ILE A 480 6.523 2.244 -2.456 1.00 0.00 H new ATOM 0 HG22 ILE A 480 6.032 0.854 -1.459 1.00 0.00 H new ATOM 0 HG23 ILE A 480 5.823 0.800 -3.226 1.00 0.00 H new ATOM 0 HD11 ILE A 480 4.251 4.917 -4.144 1.00 0.00 H new ATOM 0 HD12 ILE A 480 4.047 4.798 -2.380 1.00 0.00 H new ATOM 0 HD13 ILE A 480 5.606 4.375 -3.127 1.00 0.00 H new ATOM 765 N ILE A 481 4.185 -1.325 -1.661 1.00 0.00 N ATOM 766 CA ILE A 481 4.721 -2.431 -0.877 1.00 0.00 C ATOM 767 C ILE A 481 6.210 -2.624 -1.145 1.00 0.00 C ATOM 768 O ILE A 481 6.597 -3.247 -2.134 1.00 0.00 O ATOM 769 CB ILE A 481 3.981 -3.747 -1.182 1.00 0.00 C ATOM 770 CG1 ILE A 481 2.487 -3.597 -0.889 1.00 0.00 C ATOM 771 CG2 ILE A 481 4.574 -4.888 -0.369 1.00 0.00 C ATOM 772 CD1 ILE A 481 1.655 -4.759 -1.384 1.00 0.00 C ATOM 0 H ILE A 481 4.049 -1.535 -2.650 1.00 0.00 H new ATOM 0 HA ILE A 481 4.573 -2.175 0.172 1.00 0.00 H new ATOM 0 HB ILE A 481 4.103 -3.979 -2.240 1.00 0.00 H new ATOM 0 HG12 ILE A 481 2.345 -3.491 0.186 1.00 0.00 H new ATOM 0 HG13 ILE A 481 2.125 -2.678 -1.351 1.00 0.00 H new ATOM 0 HG21 ILE A 481 4.041 -5.811 -0.595 1.00 0.00 H new ATOM 0 HG22 ILE A 481 5.628 -5.006 -0.622 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.479 -4.665 0.694 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.607 -4.585 -1.142 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.767 -4.853 -2.464 1.00 0.00 H new ATOM 0 HD13 ILE A 481 1.991 -5.678 -0.903 1.00 0.00 H new ATOM 784 N TYR A 482 7.040 -2.087 -0.258 1.00 0.00 N ATOM 785 CA TYR A 482 8.486 -2.199 -0.399 1.00 0.00 C ATOM 786 C TYR A 482 9.031 -3.334 0.463 1.00 0.00 C ATOM 787 O TYR A 482 8.699 -3.445 1.643 1.00 0.00 O ATOM 788 CB TYR A 482 9.161 -0.882 -0.013 1.00 0.00 C ATOM 789 CG TYR A 482 10.549 -0.719 -0.592 1.00 0.00 C ATOM 790 CD1 TYR A 482 10.730 -0.415 -1.936 1.00 0.00 C ATOM 791 CD2 TYR A 482 11.677 -0.872 0.203 1.00 0.00 C ATOM 792 CE1 TYR A 482 11.996 -0.267 -2.470 1.00 0.00 C ATOM 793 CE2 TYR A 482 12.946 -0.724 -0.322 1.00 0.00 C ATOM 794 CZ TYR A 482 13.101 -0.421 -1.659 1.00 0.00 C ATOM 795 OH TYR A 482 14.363 -0.274 -2.186 1.00 0.00 O ATOM 0 H TYR A 482 6.736 -1.570 0.567 1.00 0.00 H new ATOM 0 HA TYR A 482 8.707 -2.421 -1.443 1.00 0.00 H new ATOM 0 HB2 TYR A 482 8.538 -0.053 -0.347 1.00 0.00 H new ATOM 0 HB3 TYR A 482 9.220 -0.819 1.074 1.00 0.00 H new ATOM 0 HD1 TYR A 482 9.867 -0.292 -2.574 1.00 0.00 H new ATOM 0 HD2 TYR A 482 11.560 -1.111 1.250 1.00 0.00 H new ATOM 0 HE1 TYR A 482 12.120 -0.032 -3.517 1.00 0.00 H new ATOM 0 HE2 TYR A 482 13.813 -0.845 0.311 1.00 0.00 H new ATOM 0 HH TYR A 482 15.030 -0.414 -1.482 1.00 0.00 H new ATOM 805 N GLN A 483 9.870 -4.173 -0.137 1.00 0.00 N ATOM 806 CA GLN A 483 10.461 -5.300 0.575 1.00 0.00 C ATOM 807 C GLN A 483 11.976 -5.319 0.401 1.00 0.00 C ATOM 808 O GLN A 483 12.482 -5.242 -0.718 1.00 0.00 O ATOM 809 CB GLN A 483 9.861 -6.616 0.078 1.00 0.00 C ATOM 810 CG GLN A 483 9.834 -6.738 -1.437 1.00 0.00 C ATOM 811 CD GLN A 483 8.765 -5.870 -2.073 1.00 0.00 C ATOM 812 OE1 GLN A 483 9.067 -4.952 -2.836 1.00 0.00 O ATOM 813 NE2 GLN A 483 7.506 -6.158 -1.762 1.00 0.00 N ATOM 0 H GLN A 483 10.155 -4.094 -1.113 1.00 0.00 H new ATOM 0 HA GLN A 483 10.237 -5.186 1.636 1.00 0.00 H new ATOM 0 HB2 GLN A 483 10.434 -7.446 0.491 1.00 0.00 H new ATOM 0 HB3 GLN A 483 8.844 -6.709 0.460 1.00 0.00 H new ATOM 0 HG2 GLN A 483 10.809 -6.460 -1.838 1.00 0.00 H new ATOM 0 HG3 GLN A 483 9.662 -7.779 -1.711 1.00 0.00 H new ATOM 0 HE21 GLN A 483 7.301 -6.928 -1.125 1.00 0.00 H new ATOM 0 HE22 GLN A 483 6.744 -5.609 -2.160 1.00 0.00 H new ATOM 822 N GLU A 484 12.694 -5.423 1.515 1.00 0.00 N ATOM 823 CA GLU A 484 14.151 -5.452 1.485 1.00 0.00 C ATOM 824 C GLU A 484 14.700 -6.381 2.563 1.00 0.00 C ATOM 825 O GLU A 484 14.018 -6.690 3.540 1.00 0.00 O ATOM 826 CB GLU A 484 14.715 -4.042 1.676 1.00 0.00 C ATOM 827 CG GLU A 484 16.201 -3.935 1.376 1.00 0.00 C ATOM 828 CD GLU A 484 16.540 -4.338 -0.045 1.00 0.00 C ATOM 829 OE1 GLU A 484 15.786 -3.960 -0.966 1.00 0.00 O ATOM 830 OE2 GLU A 484 17.561 -5.032 -0.237 1.00 0.00 O ATOM 0 H GLU A 484 12.290 -5.489 2.449 1.00 0.00 H new ATOM 0 HA GLU A 484 14.461 -5.831 0.511 1.00 0.00 H new ATOM 0 HB2 GLU A 484 14.172 -3.352 1.030 1.00 0.00 H new ATOM 0 HB3 GLU A 484 14.537 -3.724 2.703 1.00 0.00 H new ATOM 0 HG2 GLU A 484 16.529 -2.910 1.547 1.00 0.00 H new ATOM 0 HG3 GLU A 484 16.754 -4.567 2.071 1.00 0.00 H new ATOM 837 N LYS A 485 15.939 -6.826 2.378 1.00 0.00 N ATOM 838 CA LYS A 485 16.582 -7.720 3.333 1.00 0.00 C ATOM 839 C LYS A 485 17.241 -6.930 4.460 1.00 0.00 C ATOM 840 O LYS A 485 17.759 -5.835 4.240 1.00 0.00 O ATOM 841 CB LYS A 485 17.625 -8.589 2.627 1.00 0.00 C ATOM 842 CG LYS A 485 18.076 -9.785 3.447 1.00 0.00 C ATOM 843 CD LYS A 485 18.507 -10.940 2.559 1.00 0.00 C ATOM 844 CE LYS A 485 19.799 -10.624 1.821 1.00 0.00 C ATOM 845 NZ LYS A 485 19.874 -11.325 0.510 1.00 0.00 N ATOM 0 H LYS A 485 16.518 -6.581 1.574 1.00 0.00 H new ATOM 0 HA LYS A 485 15.815 -8.363 3.764 1.00 0.00 H new ATOM 0 HB2 LYS A 485 17.212 -8.942 1.682 1.00 0.00 H new ATOM 0 HB3 LYS A 485 18.493 -7.976 2.386 1.00 0.00 H new ATOM 0 HG2 LYS A 485 18.904 -9.493 4.093 1.00 0.00 H new ATOM 0 HG3 LYS A 485 17.263 -10.109 4.097 1.00 0.00 H new ATOM 0 HD2 LYS A 485 18.643 -11.835 3.165 1.00 0.00 H new ATOM 0 HD3 LYS A 485 17.719 -11.160 1.838 1.00 0.00 H new ATOM 0 HE2 LYS A 485 19.873 -9.548 1.662 1.00 0.00 H new ATOM 0 HE3 LYS A 485 20.650 -10.914 2.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 20.769 -11.084 0.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 19.829 -12.353 0.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 19.076 -11.029 -0.088 1.00 0.00 H new ATOM 950 N GLU A 493 16.472 -12.940 7.405 1.00 0.00 N ATOM 951 CA GLU A 493 15.046 -12.968 7.105 1.00 0.00 C ATOM 952 C GLU A 493 14.650 -11.780 6.233 1.00 0.00 C ATOM 953 O GLU A 493 15.202 -10.687 6.367 1.00 0.00 O ATOM 954 CB GLU A 493 14.229 -12.960 8.399 1.00 0.00 C ATOM 955 CG GLU A 493 12.728 -13.029 8.172 1.00 0.00 C ATOM 956 CD GLU A 493 12.264 -14.412 7.758 1.00 0.00 C ATOM 957 OE1 GLU A 493 12.674 -15.395 8.411 1.00 0.00 O ATOM 958 OE2 GLU A 493 11.493 -14.512 6.781 1.00 0.00 O ATOM 0 HA GLU A 493 14.835 -13.886 6.556 1.00 0.00 H new ATOM 0 HB2 GLU A 493 14.534 -13.805 9.016 1.00 0.00 H new ATOM 0 HB3 GLU A 493 14.462 -12.055 8.960 1.00 0.00 H new ATOM 0 HG2 GLU A 493 12.212 -12.735 9.086 1.00 0.00 H new ATOM 0 HG3 GLU A 493 12.447 -12.310 7.402 1.00 0.00 H new ATOM 965 N ILE A 494 13.692 -12.002 5.340 1.00 0.00 N ATOM 966 CA ILE A 494 13.222 -10.951 4.447 1.00 0.00 C ATOM 967 C ILE A 494 11.953 -10.299 4.985 1.00 0.00 C ATOM 968 O ILE A 494 10.910 -10.944 5.096 1.00 0.00 O ATOM 969 CB ILE A 494 12.946 -11.495 3.033 1.00 0.00 C ATOM 970 CG1 ILE A 494 14.117 -12.357 2.557 1.00 0.00 C ATOM 971 CG2 ILE A 494 12.696 -10.349 2.064 1.00 0.00 C ATOM 972 CD1 ILE A 494 15.371 -11.563 2.262 1.00 0.00 C ATOM 0 H ILE A 494 13.226 -12.901 5.216 1.00 0.00 H new ATOM 0 HA ILE A 494 14.016 -10.206 4.392 1.00 0.00 H new ATOM 0 HB ILE A 494 12.052 -12.117 3.067 1.00 0.00 H new ATOM 0 HG12 ILE A 494 14.341 -13.104 3.318 1.00 0.00 H new ATOM 0 HG13 ILE A 494 13.819 -12.897 1.658 1.00 0.00 H new ATOM 0 HG21 ILE A 494 12.503 -10.750 1.069 1.00 0.00 H new ATOM 0 HG22 ILE A 494 11.833 -9.772 2.397 1.00 0.00 H new ATOM 0 HG23 ILE A 494 13.573 -9.703 2.031 1.00 0.00 H new ATOM 0 HD11 ILE A 494 16.159 -12.238 1.930 1.00 0.00 H new ATOM 0 HD12 ILE A 494 15.164 -10.834 1.479 1.00 0.00 H new ATOM 0 HD13 ILE A 494 15.694 -11.044 3.165 1.00 0.00 H new ATOM 984 N ILE A 495 12.048 -9.015 5.316 1.00 0.00 N ATOM 985 CA ILE A 495 10.907 -8.275 5.839 1.00 0.00 C ATOM 986 C ILE A 495 10.135 -7.590 4.717 1.00 0.00 C ATOM 987 O ILE A 495 10.606 -7.510 3.583 1.00 0.00 O ATOM 988 CB ILE A 495 11.347 -7.214 6.866 1.00 0.00 C ATOM 989 CG1 ILE A 495 12.199 -6.140 6.188 1.00 0.00 C ATOM 990 CG2 ILE A 495 12.115 -7.867 8.005 1.00 0.00 C ATOM 991 CD1 ILE A 495 11.387 -5.111 5.434 1.00 0.00 C ATOM 0 H ILE A 495 12.904 -8.466 5.231 1.00 0.00 H new ATOM 0 HA ILE A 495 10.260 -9.000 6.332 1.00 0.00 H new ATOM 0 HB ILE A 495 10.458 -6.738 7.279 1.00 0.00 H new ATOM 0 HG12 ILE A 495 12.800 -5.634 6.944 1.00 0.00 H new ATOM 0 HG13 ILE A 495 12.893 -6.620 5.498 1.00 0.00 H new ATOM 0 HG21 ILE A 495 12.419 -7.105 8.723 1.00 0.00 H new ATOM 0 HG22 ILE A 495 11.478 -8.599 8.501 1.00 0.00 H new ATOM 0 HG23 ILE A 495 12.999 -8.366 7.609 1.00 0.00 H new ATOM 0 HD11 ILE A 495 12.057 -4.381 4.979 1.00 0.00 H new ATOM 0 HD12 ILE A 495 10.806 -5.605 4.655 1.00 0.00 H new ATOM 0 HD13 ILE A 495 10.712 -4.604 6.123 1.00 0.00 H new ATOM 1003 N VAL A 496 8.944 -7.095 5.042 1.00 0.00 N ATOM 1004 CA VAL A 496 8.107 -6.413 4.062 1.00 0.00 C ATOM 1005 C VAL A 496 7.432 -5.190 4.672 1.00 0.00 C ATOM 1006 O VAL A 496 6.639 -5.306 5.607 1.00 0.00 O ATOM 1007 CB VAL A 496 7.026 -7.354 3.497 1.00 0.00 C ATOM 1008 CG1 VAL A 496 6.116 -6.605 2.535 1.00 0.00 C ATOM 1009 CG2 VAL A 496 7.667 -8.553 2.815 1.00 0.00 C ATOM 0 H VAL A 496 8.538 -7.154 5.976 1.00 0.00 H new ATOM 0 HA VAL A 496 8.763 -6.096 3.251 1.00 0.00 H new ATOM 0 HB VAL A 496 6.418 -7.719 4.324 1.00 0.00 H new ATOM 0 HG11 VAL A 496 5.359 -7.286 2.146 1.00 0.00 H new ATOM 0 HG12 VAL A 496 5.630 -5.783 3.060 1.00 0.00 H new ATOM 0 HG13 VAL A 496 6.707 -6.209 1.709 1.00 0.00 H new ATOM 0 HG21 VAL A 496 6.889 -9.207 2.422 1.00 0.00 H new ATOM 0 HG22 VAL A 496 8.301 -8.210 1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 496 8.272 -9.102 3.537 1.00 0.00 H new ATOM 1019 N LYS A 497 7.751 -4.017 4.137 1.00 0.00 N ATOM 1020 CA LYS A 497 7.175 -2.770 4.627 1.00 0.00 C ATOM 1021 C LYS A 497 6.050 -2.294 3.713 1.00 0.00 C ATOM 1022 O LYS A 497 6.271 -2.022 2.532 1.00 0.00 O ATOM 1023 CB LYS A 497 8.255 -1.690 4.728 1.00 0.00 C ATOM 1024 CG LYS A 497 9.188 -1.873 5.912 1.00 0.00 C ATOM 1025 CD LYS A 497 10.162 -0.713 6.038 1.00 0.00 C ATOM 1026 CE LYS A 497 10.695 -0.585 7.457 1.00 0.00 C ATOM 1027 NZ LYS A 497 9.733 0.121 8.349 1.00 0.00 N ATOM 0 H LYS A 497 8.406 -3.903 3.363 1.00 0.00 H new ATOM 0 HA LYS A 497 6.761 -2.955 5.618 1.00 0.00 H new ATOM 0 HB2 LYS A 497 8.842 -1.688 3.810 1.00 0.00 H new ATOM 0 HB3 LYS A 497 7.775 -0.714 4.801 1.00 0.00 H new ATOM 0 HG2 LYS A 497 8.603 -1.959 6.828 1.00 0.00 H new ATOM 0 HG3 LYS A 497 9.743 -2.805 5.799 1.00 0.00 H new ATOM 0 HD2 LYS A 497 10.993 -0.858 5.348 1.00 0.00 H new ATOM 0 HD3 LYS A 497 9.665 0.214 5.750 1.00 0.00 H new ATOM 0 HE2 LYS A 497 10.902 -1.577 7.858 1.00 0.00 H new ATOM 0 HE3 LYS A 497 11.641 -0.044 7.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 10.133 0.188 9.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 9.555 1.077 7.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 8.839 -0.409 8.383 1.00 0.00 H new ATOM 1041 N ILE A 498 4.846 -2.195 4.266 1.00 0.00 N ATOM 1042 CA ILE A 498 3.689 -1.750 3.500 1.00 0.00 C ATOM 1043 C ILE A 498 3.380 -0.282 3.775 1.00 0.00 C ATOM 1044 O ILE A 498 3.093 0.102 4.909 1.00 0.00 O ATOM 1045 CB ILE A 498 2.442 -2.594 3.823 1.00 0.00 C ATOM 1046 CG1 ILE A 498 2.705 -4.070 3.515 1.00 0.00 C ATOM 1047 CG2 ILE A 498 1.242 -2.089 3.036 1.00 0.00 C ATOM 1048 CD1 ILE A 498 1.663 -5.003 4.093 1.00 0.00 C ATOM 0 H ILE A 498 4.647 -2.417 5.241 1.00 0.00 H new ATOM 0 HA ILE A 498 3.940 -1.875 2.447 1.00 0.00 H new ATOM 0 HB ILE A 498 2.221 -2.497 4.886 1.00 0.00 H new ATOM 0 HG12 ILE A 498 2.743 -4.206 2.434 1.00 0.00 H new ATOM 0 HG13 ILE A 498 3.685 -4.345 3.906 1.00 0.00 H new ATOM 0 HG21 ILE A 498 0.369 -2.696 3.275 1.00 0.00 H new ATOM 0 HG22 ILE A 498 1.045 -1.050 3.300 1.00 0.00 H new ATOM 0 HG23 ILE A 498 1.451 -2.159 1.969 1.00 0.00 H new ATOM 0 HD11 ILE A 498 1.913 -6.032 3.835 1.00 0.00 H new ATOM 0 HD12 ILE A 498 1.640 -4.896 5.177 1.00 0.00 H new ATOM 0 HD13 ILE A 498 0.684 -4.754 3.683 1.00 0.00 H new ATOM 1060 N PHE A 499 3.439 0.535 2.728 1.00 0.00 N ATOM 1061 CA PHE A 499 3.165 1.961 2.856 1.00 0.00 C ATOM 1062 C PHE A 499 1.737 2.281 2.424 1.00 0.00 C ATOM 1063 O PHE A 499 1.329 1.969 1.305 1.00 0.00 O ATOM 1064 CB PHE A 499 4.156 2.770 2.017 1.00 0.00 C ATOM 1065 CG PHE A 499 5.589 2.568 2.421 1.00 0.00 C ATOM 1066 CD1 PHE A 499 6.243 1.381 2.131 1.00 0.00 C ATOM 1067 CD2 PHE A 499 6.280 3.563 3.092 1.00 0.00 C ATOM 1068 CE1 PHE A 499 7.561 1.192 2.501 1.00 0.00 C ATOM 1069 CE2 PHE A 499 7.598 3.380 3.465 1.00 0.00 C ATOM 1070 CZ PHE A 499 8.239 2.192 3.170 1.00 0.00 C ATOM 0 H PHE A 499 3.674 0.234 1.782 1.00 0.00 H new ATOM 0 HA PHE A 499 3.279 2.235 3.905 1.00 0.00 H new ATOM 0 HB2 PHE A 499 4.040 2.496 0.968 1.00 0.00 H new ATOM 0 HB3 PHE A 499 3.910 3.829 2.099 1.00 0.00 H new ATOM 0 HD1 PHE A 499 5.717 0.595 1.610 1.00 0.00 H new ATOM 0 HD2 PHE A 499 5.783 4.493 3.327 1.00 0.00 H new ATOM 0 HE1 PHE A 499 8.060 0.263 2.267 1.00 0.00 H new ATOM 0 HE2 PHE A 499 8.126 4.164 3.986 1.00 0.00 H new ATOM 0 HZ PHE A 499 9.268 2.046 3.462 1.00 0.00 H new ATOM 1080 N VAL A 500 0.980 2.907 3.320 1.00 0.00 N ATOM 1081 CA VAL A 500 -0.403 3.270 3.033 1.00 0.00 C ATOM 1082 C VAL A 500 -0.692 4.707 3.453 1.00 0.00 C ATOM 1083 O VAL A 500 -0.839 4.999 4.640 1.00 0.00 O ATOM 1084 CB VAL A 500 -1.390 2.329 3.749 1.00 0.00 C ATOM 1085 CG1 VAL A 500 -2.826 2.751 3.473 1.00 0.00 C ATOM 1086 CG2 VAL A 500 -1.158 0.888 3.320 1.00 0.00 C ATOM 0 H VAL A 500 1.301 3.173 4.251 1.00 0.00 H new ATOM 0 HA VAL A 500 -0.539 3.175 1.956 1.00 0.00 H new ATOM 0 HB VAL A 500 -1.216 2.397 4.823 1.00 0.00 H new ATOM 0 HG11 VAL A 500 -3.509 2.075 3.987 1.00 0.00 H new ATOM 0 HG12 VAL A 500 -2.982 3.768 3.834 1.00 0.00 H new ATOM 0 HG13 VAL A 500 -3.017 2.713 2.400 1.00 0.00 H new ATOM 0 HG21 VAL A 500 -1.864 0.237 3.836 1.00 0.00 H new ATOM 0 HG22 VAL A 500 -1.304 0.801 2.243 1.00 0.00 H new ATOM 0 HG23 VAL A 500 -0.140 0.592 3.573 1.00 0.00 H new ATOM 1096 N GLU A 501 -0.773 5.600 2.472 1.00 0.00 N ATOM 1097 CA GLU A 501 -1.044 7.007 2.741 1.00 0.00 C ATOM 1098 C GLU A 501 -2.510 7.339 2.473 1.00 0.00 C ATOM 1099 O GLU A 501 -3.072 6.942 1.452 1.00 0.00 O ATOM 1100 CB GLU A 501 -0.144 7.896 1.881 1.00 0.00 C ATOM 1101 CG GLU A 501 -0.578 9.352 1.849 1.00 0.00 C ATOM 1102 CD GLU A 501 0.100 10.138 0.744 1.00 0.00 C ATOM 1103 OE1 GLU A 501 0.095 9.663 -0.411 1.00 0.00 O ATOM 1104 OE2 GLU A 501 0.635 11.229 1.033 1.00 0.00 O ATOM 0 H GLU A 501 -0.655 5.374 1.484 1.00 0.00 H new ATOM 0 HA GLU A 501 -0.832 7.197 3.793 1.00 0.00 H new ATOM 0 HB2 GLU A 501 0.877 7.838 2.258 1.00 0.00 H new ATOM 0 HB3 GLU A 501 -0.130 7.507 0.863 1.00 0.00 H new ATOM 0 HG2 GLU A 501 -1.659 9.402 1.715 1.00 0.00 H new ATOM 0 HG3 GLU A 501 -0.354 9.815 2.810 1.00 0.00 H new ATOM 1111 N PHE A 502 -3.123 8.069 3.399 1.00 0.00 N ATOM 1112 CA PHE A 502 -4.523 8.454 3.265 1.00 0.00 C ATOM 1113 C PHE A 502 -4.649 9.925 2.879 1.00 0.00 C ATOM 1114 O PHE A 502 -3.665 10.664 2.882 1.00 0.00 O ATOM 1115 CB PHE A 502 -5.273 8.193 4.572 1.00 0.00 C ATOM 1116 CG PHE A 502 -5.255 6.752 4.996 1.00 0.00 C ATOM 1117 CD1 PHE A 502 -4.170 6.232 5.685 1.00 0.00 C ATOM 1118 CD2 PHE A 502 -6.322 5.917 4.707 1.00 0.00 C ATOM 1119 CE1 PHE A 502 -4.151 4.907 6.075 1.00 0.00 C ATOM 1120 CE2 PHE A 502 -6.308 4.590 5.095 1.00 0.00 C ATOM 1121 CZ PHE A 502 -5.221 4.085 5.781 1.00 0.00 C ATOM 0 H PHE A 502 -2.672 8.406 4.250 1.00 0.00 H new ATOM 0 HA PHE A 502 -4.965 7.850 2.473 1.00 0.00 H new ATOM 0 HB2 PHE A 502 -4.833 8.801 5.362 1.00 0.00 H new ATOM 0 HB3 PHE A 502 -6.307 8.517 4.459 1.00 0.00 H new ATOM 0 HD1 PHE A 502 -3.331 6.870 5.919 1.00 0.00 H new ATOM 0 HD2 PHE A 502 -7.175 6.307 4.172 1.00 0.00 H new ATOM 0 HE1 PHE A 502 -3.299 4.514 6.610 1.00 0.00 H new ATOM 0 HE2 PHE A 502 -7.146 3.949 4.862 1.00 0.00 H new ATOM 0 HZ PHE A 502 -5.208 3.049 6.087 1.00 0.00 H new ATOM 1131 N SER A 503 -5.866 10.342 2.546 1.00 0.00 N ATOM 1132 CA SER A 503 -6.121 11.722 2.153 1.00 0.00 C ATOM 1133 C SER A 503 -5.706 12.687 3.260 1.00 0.00 C ATOM 1134 O SER A 503 -4.959 13.637 3.022 1.00 0.00 O ATOM 1135 CB SER A 503 -7.602 11.916 1.821 1.00 0.00 C ATOM 1136 OG SER A 503 -7.874 13.261 1.470 1.00 0.00 O ATOM 0 H SER A 503 -6.692 9.743 2.541 1.00 0.00 H new ATOM 0 HA SER A 503 -5.526 11.936 1.265 1.00 0.00 H new ATOM 0 HB2 SER A 503 -7.883 11.258 0.998 1.00 0.00 H new ATOM 0 HB3 SER A 503 -8.211 11.631 2.679 1.00 0.00 H new ATOM 0 HG SER A 503 -8.826 13.358 1.261 1.00 0.00 H new ATOM 1142 N ILE A 504 -6.197 12.437 4.469 1.00 0.00 N ATOM 1143 CA ILE A 504 -5.877 13.282 5.613 1.00 0.00 C ATOM 1144 C ILE A 504 -5.178 12.483 6.708 1.00 0.00 C ATOM 1145 O ILE A 504 -5.336 11.266 6.800 1.00 0.00 O ATOM 1146 CB ILE A 504 -7.141 13.938 6.199 1.00 0.00 C ATOM 1147 CG1 ILE A 504 -8.197 12.875 6.509 1.00 0.00 C ATOM 1148 CG2 ILE A 504 -7.694 14.976 5.235 1.00 0.00 C ATOM 1149 CD1 ILE A 504 -9.369 13.402 7.307 1.00 0.00 C ATOM 0 H ILE A 504 -6.818 11.656 4.682 1.00 0.00 H new ATOM 0 HA ILE A 504 -5.207 14.062 5.252 1.00 0.00 H new ATOM 0 HB ILE A 504 -6.874 14.440 7.129 1.00 0.00 H new ATOM 0 HG12 ILE A 504 -8.565 12.456 5.572 1.00 0.00 H new ATOM 0 HG13 ILE A 504 -7.729 12.060 7.061 1.00 0.00 H new ATOM 0 HG21 ILE A 504 -8.587 15.431 5.663 1.00 0.00 H new ATOM 0 HG22 ILE A 504 -6.943 15.746 5.060 1.00 0.00 H new ATOM 0 HG23 ILE A 504 -7.949 14.496 4.290 1.00 0.00 H new ATOM 0 HD11 ILE A 504 -10.077 12.594 7.490 1.00 0.00 H new ATOM 0 HD12 ILE A 504 -9.013 13.795 8.259 1.00 0.00 H new ATOM 0 HD13 ILE A 504 -9.862 14.197 6.748 1.00 0.00 H new ATOM 1161 N ALA A 505 -4.405 13.177 7.537 1.00 0.00 N ATOM 1162 CA ALA A 505 -3.685 12.534 8.629 1.00 0.00 C ATOM 1163 C ALA A 505 -4.647 11.840 9.588 1.00 0.00 C ATOM 1164 O ALA A 505 -4.362 10.753 10.089 1.00 0.00 O ATOM 1165 CB ALA A 505 -2.837 13.553 9.374 1.00 0.00 C ATOM 0 H ALA A 505 -4.261 14.185 7.473 1.00 0.00 H new ATOM 0 HA ALA A 505 -3.029 11.775 8.202 1.00 0.00 H new ATOM 0 HB1 ALA A 505 -2.305 13.059 10.187 1.00 0.00 H new ATOM 0 HB2 ALA A 505 -2.117 13.999 8.687 1.00 0.00 H new ATOM 0 HB3 ALA A 505 -3.480 14.333 9.782 1.00 0.00 H new ATOM 1171 N SER A 506 -5.786 12.477 9.839 1.00 0.00 N ATOM 1172 CA SER A 506 -6.788 11.923 10.742 1.00 0.00 C ATOM 1173 C SER A 506 -7.075 10.463 10.405 1.00 0.00 C ATOM 1174 O SER A 506 -6.769 9.563 11.186 1.00 0.00 O ATOM 1175 CB SER A 506 -8.080 12.739 10.667 1.00 0.00 C ATOM 1176 OG SER A 506 -9.058 12.229 11.556 1.00 0.00 O ATOM 0 H SER A 506 -6.038 13.377 9.430 1.00 0.00 H new ATOM 0 HA SER A 506 -6.394 11.973 11.757 1.00 0.00 H new ATOM 0 HB2 SER A 506 -7.871 13.781 10.911 1.00 0.00 H new ATOM 0 HB3 SER A 506 -8.466 12.721 9.648 1.00 0.00 H new ATOM 0 HG SER A 506 -9.873 12.769 11.490 1.00 0.00 H new ATOM 1182 N GLU A 507 -7.666 10.238 9.235 1.00 0.00 N ATOM 1183 CA GLU A 507 -7.996 8.887 8.795 1.00 0.00 C ATOM 1184 C GLU A 507 -6.835 7.932 9.054 1.00 0.00 C ATOM 1185 O GLU A 507 -7.028 6.820 9.547 1.00 0.00 O ATOM 1186 CB GLU A 507 -8.350 8.885 7.306 1.00 0.00 C ATOM 1187 CG GLU A 507 -9.606 9.675 6.978 1.00 0.00 C ATOM 1188 CD GLU A 507 -10.734 9.408 7.955 1.00 0.00 C ATOM 1189 OE1 GLU A 507 -10.920 8.235 8.340 1.00 0.00 O ATOM 1190 OE2 GLU A 507 -11.432 10.372 8.334 1.00 0.00 O ATOM 0 H GLU A 507 -7.926 10.972 8.576 1.00 0.00 H new ATOM 0 HA GLU A 507 -8.859 8.546 9.367 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -7.514 9.298 6.742 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -8.481 7.855 6.974 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -9.372 10.740 6.981 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -9.936 9.424 5.970 1.00 0.00 H new ATOM 1197 N THR A 508 -5.626 8.373 8.718 1.00 0.00 N ATOM 1198 CA THR A 508 -4.434 7.558 8.913 1.00 0.00 C ATOM 1199 C THR A 508 -4.284 7.141 10.371 1.00 0.00 C ATOM 1200 O THR A 508 -4.299 5.953 10.693 1.00 0.00 O ATOM 1201 CB THR A 508 -3.163 8.307 8.471 1.00 0.00 C ATOM 1202 OG1 THR A 508 -3.453 9.142 7.345 1.00 0.00 O ATOM 1203 CG2 THR A 508 -2.055 7.329 8.112 1.00 0.00 C ATOM 0 H THR A 508 -5.447 9.290 8.309 1.00 0.00 H new ATOM 0 HA THR A 508 -4.556 6.668 8.295 1.00 0.00 H new ATOM 0 HB THR A 508 -2.824 8.925 9.303 1.00 0.00 H new ATOM 0 HG1 THR A 508 -3.849 9.983 7.655 1.00 0.00 H new ATOM 0 HG21 THR A 508 -1.168 7.882 7.803 1.00 0.00 H new ATOM 0 HG22 THR A 508 -1.816 6.715 8.980 1.00 0.00 H new ATOM 0 HG23 THR A 508 -2.386 6.688 7.295 1.00 0.00 H new ATOM 1211 N HIS A 509 -4.140 8.127 11.252 1.00 0.00 N ATOM 1212 CA HIS A 509 -3.989 7.863 12.678 1.00 0.00 C ATOM 1213 C HIS A 509 -4.953 6.771 13.133 1.00 0.00 C ATOM 1214 O HIS A 509 -4.575 5.864 13.875 1.00 0.00 O ATOM 1215 CB HIS A 509 -4.230 9.140 13.483 1.00 0.00 C ATOM 1216 CG HIS A 509 -3.024 10.022 13.582 1.00 0.00 C ATOM 1217 ND1 HIS A 509 -2.242 10.104 14.716 1.00 0.00 N ATOM 1218 CD2 HIS A 509 -2.464 10.861 12.680 1.00 0.00 C ATOM 1219 CE1 HIS A 509 -1.256 10.958 14.507 1.00 0.00 C ATOM 1220 NE2 HIS A 509 -1.368 11.431 13.279 1.00 0.00 N ATOM 0 H HIS A 509 -4.125 9.116 11.003 1.00 0.00 H new ATOM 0 HA HIS A 509 -2.969 7.519 12.853 1.00 0.00 H new ATOM 0 HB2 HIS A 509 -5.044 9.701 13.024 1.00 0.00 H new ATOM 0 HB3 HIS A 509 -4.556 8.870 14.487 1.00 0.00 H new ATOM 0 HD2 HIS A 509 -2.814 11.048 11.676 1.00 0.00 H new ATOM 0 HE1 HIS A 509 -0.489 11.224 15.219 1.00 0.00 H new ATOM 0 HE2 HIS A 509 -0.742 12.110 12.846 1.00 0.00 H new ATOM 1228 N LYS A 510 -6.200 6.864 12.684 1.00 0.00 N ATOM 1229 CA LYS A 510 -7.218 5.885 13.044 1.00 0.00 C ATOM 1230 C LYS A 510 -6.786 4.478 12.643 1.00 0.00 C ATOM 1231 O LYS A 510 -6.751 3.570 13.473 1.00 0.00 O ATOM 1232 CB LYS A 510 -8.549 6.232 12.372 1.00 0.00 C ATOM 1233 CG LYS A 510 -9.597 5.140 12.498 1.00 0.00 C ATOM 1234 CD LYS A 510 -10.681 5.284 11.443 1.00 0.00 C ATOM 1235 CE LYS A 510 -11.994 4.671 11.906 1.00 0.00 C ATOM 1236 NZ LYS A 510 -12.984 4.579 10.798 1.00 0.00 N ATOM 0 H LYS A 510 -6.530 7.608 12.070 1.00 0.00 H new ATOM 0 HA LYS A 510 -7.346 5.912 14.126 1.00 0.00 H new ATOM 0 HB2 LYS A 510 -8.939 7.151 12.810 1.00 0.00 H new ATOM 0 HB3 LYS A 510 -8.371 6.433 11.316 1.00 0.00 H new ATOM 0 HG2 LYS A 510 -9.121 4.164 12.401 1.00 0.00 H new ATOM 0 HG3 LYS A 510 -10.046 5.178 13.490 1.00 0.00 H new ATOM 0 HD2 LYS A 510 -10.831 6.339 11.216 1.00 0.00 H new ATOM 0 HD3 LYS A 510 -10.358 4.802 10.520 1.00 0.00 H new ATOM 0 HE2 LYS A 510 -11.808 3.676 12.310 1.00 0.00 H new ATOM 0 HE3 LYS A 510 -12.410 5.271 12.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 -13.865 4.156 11.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 -13.181 5.531 10.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 -12.598 3.985 10.036 1.00 0.00 H new ATOM 1250 N ALA A 511 -6.458 4.306 11.367 1.00 0.00 N ATOM 1251 CA ALA A 511 -6.025 3.011 10.858 1.00 0.00 C ATOM 1252 C ALA A 511 -4.933 2.412 11.738 1.00 0.00 C ATOM 1253 O ALA A 511 -4.902 1.203 11.969 1.00 0.00 O ATOM 1254 CB ALA A 511 -5.535 3.144 9.424 1.00 0.00 C ATOM 0 H ALA A 511 -6.484 5.047 10.667 1.00 0.00 H new ATOM 0 HA ALA A 511 -6.881 2.337 10.877 1.00 0.00 H new ATOM 0 HB1 ALA A 511 -5.215 2.169 9.057 1.00 0.00 H new ATOM 0 HB2 ALA A 511 -6.343 3.520 8.797 1.00 0.00 H new ATOM 0 HB3 ALA A 511 -4.695 3.838 9.389 1.00 0.00 H new ATOM 1260 N ILE A 512 -4.038 3.265 12.226 1.00 0.00 N ATOM 1261 CA ILE A 512 -2.945 2.820 13.080 1.00 0.00 C ATOM 1262 C ILE A 512 -3.462 2.354 14.437 1.00 0.00 C ATOM 1263 O ILE A 512 -3.354 1.178 14.783 1.00 0.00 O ATOM 1264 CB ILE A 512 -1.907 3.937 13.295 1.00 0.00 C ATOM 1265 CG1 ILE A 512 -1.348 4.409 11.951 1.00 0.00 C ATOM 1266 CG2 ILE A 512 -0.785 3.451 14.200 1.00 0.00 C ATOM 1267 CD1 ILE A 512 -0.444 5.616 12.063 1.00 0.00 C ATOM 0 H ILE A 512 -4.049 4.269 12.044 1.00 0.00 H new ATOM 0 HA ILE A 512 -2.467 1.984 12.569 1.00 0.00 H new ATOM 0 HB ILE A 512 -2.398 4.781 13.780 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -0.794 3.592 11.490 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -2.177 4.647 11.285 1.00 0.00 H new ATOM 0 HG21 ILE A 512 -0.059 4.252 14.342 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -1.197 3.159 15.166 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -0.293 2.593 13.741 1.00 0.00 H new ATOM 0 HD11 ILE A 512 -0.085 5.895 11.072 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -1.000 6.448 12.495 1.00 0.00 H new ATOM 0 HD13 ILE A 512 0.405 5.376 12.703 1.00 0.00 H new ATOM 1279 N GLN A 513 -4.027 3.285 15.200 1.00 0.00 N ATOM 1280 CA GLN A 513 -4.563 2.969 16.519 1.00 0.00 C ATOM 1281 C GLN A 513 -5.372 1.677 16.483 1.00 0.00 C ATOM 1282 O GLN A 513 -5.521 0.998 17.498 1.00 0.00 O ATOM 1283 CB GLN A 513 -5.437 4.118 17.026 1.00 0.00 C ATOM 1284 CG GLN A 513 -4.661 5.396 17.302 1.00 0.00 C ATOM 1285 CD GLN A 513 -3.979 5.384 18.655 1.00 0.00 C ATOM 1286 OE1 GLN A 513 -2.798 5.052 18.765 1.00 0.00 O ATOM 1287 NE2 GLN A 513 -4.720 5.747 19.696 1.00 0.00 N ATOM 0 H GLN A 513 -4.125 4.263 14.928 1.00 0.00 H new ATOM 0 HA GLN A 513 -3.724 2.832 17.201 1.00 0.00 H new ATOM 0 HB2 GLN A 513 -6.213 4.326 16.289 1.00 0.00 H new ATOM 0 HB3 GLN A 513 -5.941 3.804 17.940 1.00 0.00 H new ATOM 0 HG2 GLN A 513 -3.912 5.537 16.523 1.00 0.00 H new ATOM 0 HG3 GLN A 513 -5.340 6.247 17.249 1.00 0.00 H new ATOM 0 HE21 GLN A 513 -5.695 6.015 19.560 1.00 0.00 H new ATOM 0 HE22 GLN A 513 -4.314 5.758 20.632 1.00 0.00 H new ATOM 1296 N ALA A 514 -5.893 1.343 15.306 1.00 0.00 N ATOM 1297 CA ALA A 514 -6.685 0.132 15.138 1.00 0.00 C ATOM 1298 C ALA A 514 -5.799 -1.059 14.788 1.00 0.00 C ATOM 1299 O ALA A 514 -5.955 -2.147 15.345 1.00 0.00 O ATOM 1300 CB ALA A 514 -7.743 0.338 14.064 1.00 0.00 C ATOM 0 H ALA A 514 -5.780 1.895 14.456 1.00 0.00 H new ATOM 0 HA ALA A 514 -7.181 -0.083 16.085 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -8.327 -0.575 13.949 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -8.402 1.156 14.354 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -7.259 0.580 13.118 1.00 0.00 H new ATOM 1306 N LEU A 515 -4.871 -0.848 13.861 1.00 0.00 N ATOM 1307 CA LEU A 515 -3.960 -1.905 13.436 1.00 0.00 C ATOM 1308 C LEU A 515 -2.615 -1.782 14.143 1.00 0.00 C ATOM 1309 O LEU A 515 -1.576 -2.136 13.588 1.00 0.00 O ATOM 1310 CB LEU A 515 -3.759 -1.853 11.920 1.00 0.00 C ATOM 1311 CG LEU A 515 -4.996 -1.506 11.091 1.00 0.00 C ATOM 1312 CD1 LEU A 515 -4.597 -0.779 9.816 1.00 0.00 C ATOM 1313 CD2 LEU A 515 -5.789 -2.763 10.764 1.00 0.00 C ATOM 0 H LEU A 515 -4.730 0.045 13.389 1.00 0.00 H new ATOM 0 HA LEU A 515 -4.404 -2.863 13.705 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -2.982 -1.120 11.701 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -3.385 -2.822 11.590 1.00 0.00 H new ATOM 0 HG LEU A 515 -5.630 -0.843 11.680 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -5.490 -0.540 9.239 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -4.073 0.142 10.071 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -3.942 -1.417 9.223 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -6.666 -2.497 10.174 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -5.163 -3.450 10.195 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -6.107 -3.244 11.689 1.00 0.00 H new ATOM 1325 N ASN A 516 -2.642 -1.278 15.373 1.00 0.00 N ATOM 1326 CA ASN A 516 -1.424 -1.109 16.158 1.00 0.00 C ATOM 1327 C ASN A 516 -1.130 -2.359 16.981 1.00 0.00 C ATOM 1328 O ASN A 516 -0.109 -2.441 17.662 1.00 0.00 O ATOM 1329 CB ASN A 516 -1.551 0.105 17.080 1.00 0.00 C ATOM 1330 CG ASN A 516 -2.239 -0.233 18.389 1.00 0.00 C ATOM 1331 OD1 ASN A 516 -3.261 -0.918 18.407 1.00 0.00 O ATOM 1332 ND2 ASN A 516 -1.678 0.248 19.493 1.00 0.00 N ATOM 0 H ASN A 516 -3.494 -0.980 15.848 1.00 0.00 H new ATOM 0 HA ASN A 516 -0.596 -0.947 15.468 1.00 0.00 H new ATOM 0 HB2 ASN A 516 -0.559 0.506 17.287 1.00 0.00 H new ATOM 0 HB3 ASN A 516 -2.111 0.888 16.570 1.00 0.00 H new ATOM 0 HD21 ASN A 516 -2.095 0.054 20.403 1.00 0.00 H new ATOM 0 HD22 ASN A 516 -0.830 0.812 19.430 1.00 0.00 H new ATOM 1339 N GLY A 517 -2.033 -3.333 16.913 1.00 0.00 N ATOM 1340 CA GLY A 517 -1.853 -4.566 17.656 1.00 0.00 C ATOM 1341 C GLY A 517 -2.744 -5.683 17.151 1.00 0.00 C ATOM 1342 O GLY A 517 -3.136 -6.566 17.914 1.00 0.00 O ATOM 0 H GLY A 517 -2.886 -3.290 16.356 1.00 0.00 H new ATOM 0 HA2 GLY A 517 -0.811 -4.878 17.589 1.00 0.00 H new ATOM 0 HA3 GLY A 517 -2.064 -4.385 18.710 1.00 0.00 H new ATOM 1346 N ARG A 518 -3.068 -5.644 15.863 1.00 0.00 N ATOM 1347 CA ARG A 518 -3.922 -6.659 15.258 1.00 0.00 C ATOM 1348 C ARG A 518 -3.229 -8.019 15.253 1.00 0.00 C ATOM 1349 O ARG A 518 -2.004 -8.103 15.337 1.00 0.00 O ATOM 1350 CB ARG A 518 -4.293 -6.258 13.829 1.00 0.00 C ATOM 1351 CG ARG A 518 -5.560 -5.425 13.740 1.00 0.00 C ATOM 1352 CD ARG A 518 -6.805 -6.289 13.858 1.00 0.00 C ATOM 1353 NE ARG A 518 -7.283 -6.742 12.554 1.00 0.00 N ATOM 1354 CZ ARG A 518 -6.931 -7.899 12.004 1.00 0.00 C ATOM 1355 NH1 ARG A 518 -6.103 -8.715 12.641 1.00 0.00 N ATOM 1356 NH2 ARG A 518 -7.408 -8.241 10.814 1.00 0.00 N ATOM 0 H ARG A 518 -2.752 -4.920 15.218 1.00 0.00 H new ATOM 0 HA ARG A 518 -4.831 -6.736 15.854 1.00 0.00 H new ATOM 0 HB2 ARG A 518 -3.467 -5.696 13.392 1.00 0.00 H new ATOM 0 HB3 ARG A 518 -4.418 -7.159 13.229 1.00 0.00 H new ATOM 0 HG2 ARG A 518 -5.560 -4.675 14.531 1.00 0.00 H new ATOM 0 HG3 ARG A 518 -5.577 -4.888 12.792 1.00 0.00 H new ATOM 0 HD2 ARG A 518 -6.588 -7.154 14.485 1.00 0.00 H new ATOM 0 HD3 ARG A 518 -7.593 -5.724 14.356 1.00 0.00 H new ATOM 0 HE ARG A 518 -7.922 -6.137 12.038 1.00 0.00 H new ATOM 0 HH11 ARG A 518 -5.734 -8.455 13.556 1.00 0.00 H new ATOM 0 HH12 ARG A 518 -5.835 -9.603 12.216 1.00 0.00 H new ATOM 0 HH21 ARG A 518 -8.045 -7.615 10.321 1.00 0.00 H new ATOM 0 HH22 ARG A 518 -7.137 -9.129 10.392 1.00 0.00 H new ATOM 1370 N TRP A 519 -4.022 -9.080 15.154 1.00 0.00 N ATOM 1371 CA TRP A 519 -3.486 -10.436 15.139 1.00 0.00 C ATOM 1372 C TRP A 519 -3.805 -11.133 13.821 1.00 0.00 C ATOM 1373 O TRP A 519 -4.918 -11.621 13.620 1.00 0.00 O ATOM 1374 CB TRP A 519 -4.052 -11.243 16.308 1.00 0.00 C ATOM 1375 CG TRP A 519 -3.212 -11.163 17.547 1.00 0.00 C ATOM 1376 CD1 TRP A 519 -3.509 -10.487 18.696 1.00 0.00 C ATOM 1377 CD2 TRP A 519 -1.938 -11.780 17.760 1.00 0.00 C ATOM 1378 NE1 TRP A 519 -2.496 -10.647 19.610 1.00 0.00 N ATOM 1379 CE2 TRP A 519 -1.521 -11.436 19.061 1.00 0.00 C ATOM 1380 CE3 TRP A 519 -1.110 -12.591 16.979 1.00 0.00 C ATOM 1381 CZ2 TRP A 519 -0.312 -11.874 19.595 1.00 0.00 C ATOM 1382 CZ3 TRP A 519 0.090 -13.025 17.511 1.00 0.00 C ATOM 1383 CH2 TRP A 519 0.479 -12.667 18.808 1.00 0.00 C ATOM 0 H TRP A 519 -5.038 -9.027 15.083 1.00 0.00 H new ATOM 0 HA TRP A 519 -2.403 -10.373 15.242 1.00 0.00 H new ATOM 0 HB2 TRP A 519 -5.056 -10.885 16.535 1.00 0.00 H new ATOM 0 HB3 TRP A 519 -4.146 -12.287 16.008 1.00 0.00 H new ATOM 0 HD1 TRP A 519 -4.408 -9.911 18.862 1.00 0.00 H new ATOM 0 HE1 TRP A 519 -2.474 -10.243 20.546 1.00 0.00 H new ATOM 0 HE3 TRP A 519 -1.402 -12.873 15.978 1.00 0.00 H new ATOM 0 HZ2 TRP A 519 -0.009 -11.598 20.594 1.00 0.00 H new ATOM 0 HZ3 TRP A 519 0.739 -13.651 16.916 1.00 0.00 H new ATOM 0 HH2 TRP A 519 1.422 -13.024 19.195 1.00 0.00 H new ATOM 1394 N PHE A 520 -2.824 -11.177 12.927 1.00 0.00 N ATOM 1395 CA PHE A 520 -3.001 -11.814 11.627 1.00 0.00 C ATOM 1396 C PHE A 520 -2.940 -13.333 11.754 1.00 0.00 C ATOM 1397 O PHE A 520 -2.404 -13.865 12.726 1.00 0.00 O ATOM 1398 CB PHE A 520 -1.932 -11.329 10.647 1.00 0.00 C ATOM 1399 CG PHE A 520 -2.300 -11.538 9.206 1.00 0.00 C ATOM 1400 CD1 PHE A 520 -1.997 -12.729 8.565 1.00 0.00 C ATOM 1401 CD2 PHE A 520 -2.949 -10.544 8.491 1.00 0.00 C ATOM 1402 CE1 PHE A 520 -2.335 -12.925 7.239 1.00 0.00 C ATOM 1403 CE2 PHE A 520 -3.290 -10.735 7.166 1.00 0.00 C ATOM 1404 CZ PHE A 520 -2.981 -11.926 6.538 1.00 0.00 C ATOM 0 H PHE A 520 -1.897 -10.779 13.079 1.00 0.00 H new ATOM 0 HA PHE A 520 -3.984 -11.538 11.246 1.00 0.00 H new ATOM 0 HB2 PHE A 520 -1.750 -10.268 10.817 1.00 0.00 H new ATOM 0 HB3 PHE A 520 -0.997 -11.850 10.854 1.00 0.00 H new ATOM 0 HD1 PHE A 520 -1.491 -13.513 9.108 1.00 0.00 H new ATOM 0 HD2 PHE A 520 -3.191 -9.609 8.975 1.00 0.00 H new ATOM 0 HE1 PHE A 520 -2.094 -13.858 6.752 1.00 0.00 H new ATOM 0 HE2 PHE A 520 -3.798 -9.953 6.621 1.00 0.00 H new ATOM 0 HZ PHE A 520 -3.244 -12.075 5.501 1.00 0.00 H new ATOM 1414 N ALA A 521 -3.493 -14.027 10.764 1.00 0.00 N ATOM 1415 CA ALA A 521 -3.500 -15.484 10.762 1.00 0.00 C ATOM 1416 C ALA A 521 -2.118 -16.040 11.089 1.00 0.00 C ATOM 1417 O ALA A 521 -1.307 -16.278 10.195 1.00 0.00 O ATOM 1418 CB ALA A 521 -3.977 -16.009 9.416 1.00 0.00 C ATOM 0 H ALA A 521 -3.942 -13.602 9.953 1.00 0.00 H new ATOM 0 HA ALA A 521 -4.191 -15.820 11.535 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -3.977 -17.099 9.430 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -4.987 -15.649 9.222 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -3.309 -15.656 8.630 1.00 0.00 H new ATOM 1424 N GLY A 522 -1.856 -16.244 12.376 1.00 0.00 N ATOM 1425 CA GLY A 522 -0.570 -16.770 12.797 1.00 0.00 C ATOM 1426 C GLY A 522 0.556 -15.774 12.601 1.00 0.00 C ATOM 1427 O GLY A 522 1.705 -16.161 12.385 1.00 0.00 O ATOM 0 H GLY A 522 -2.511 -16.055 13.135 1.00 0.00 H new ATOM 0 HA2 GLY A 522 -0.623 -17.052 13.849 1.00 0.00 H new ATOM 0 HA3 GLY A 522 -0.350 -17.677 12.235 1.00 0.00 H new ATOM 1431 N ARG A 523 0.226 -14.488 12.673 1.00 0.00 N ATOM 1432 CA ARG A 523 1.218 -13.435 12.499 1.00 0.00 C ATOM 1433 C ARG A 523 0.767 -12.145 13.178 1.00 0.00 C ATOM 1434 O ARG A 523 -0.312 -11.625 12.894 1.00 0.00 O ATOM 1435 CB ARG A 523 1.466 -13.179 11.011 1.00 0.00 C ATOM 1436 CG ARG A 523 2.273 -14.273 10.331 1.00 0.00 C ATOM 1437 CD ARG A 523 2.495 -13.969 8.858 1.00 0.00 C ATOM 1438 NE ARG A 523 2.891 -15.157 8.107 1.00 0.00 N ATOM 1439 CZ ARG A 523 2.701 -15.298 6.800 1.00 0.00 C ATOM 1440 NH1 ARG A 523 2.123 -14.329 6.103 1.00 0.00 N ATOM 1441 NH2 ARG A 523 3.089 -16.409 6.188 1.00 0.00 N ATOM 0 H ARG A 523 -0.720 -14.151 12.851 1.00 0.00 H new ATOM 0 HA ARG A 523 2.147 -13.766 12.964 1.00 0.00 H new ATOM 0 HB2 ARG A 523 0.507 -13.078 10.504 1.00 0.00 H new ATOM 0 HB3 ARG A 523 1.989 -12.229 10.897 1.00 0.00 H new ATOM 0 HG2 ARG A 523 3.236 -14.380 10.830 1.00 0.00 H new ATOM 0 HG3 ARG A 523 1.754 -15.226 10.433 1.00 0.00 H new ATOM 0 HD2 ARG A 523 1.580 -13.559 8.431 1.00 0.00 H new ATOM 0 HD3 ARG A 523 3.265 -13.204 8.758 1.00 0.00 H new ATOM 0 HE ARG A 523 3.338 -15.921 8.614 1.00 0.00 H new ATOM 0 HH11 ARG A 523 1.823 -13.473 6.571 1.00 0.00 H new ATOM 0 HH12 ARG A 523 1.978 -14.439 5.099 1.00 0.00 H new ATOM 0 HH21 ARG A 523 3.534 -17.156 6.721 1.00 0.00 H new ATOM 0 HH22 ARG A 523 2.943 -16.516 5.184 1.00 0.00 H new ATOM 1455 N LYS A 524 1.600 -11.634 14.079 1.00 0.00 N ATOM 1456 CA LYS A 524 1.289 -10.406 14.800 1.00 0.00 C ATOM 1457 C LYS A 524 1.592 -9.181 13.943 1.00 0.00 C ATOM 1458 O LYS A 524 2.735 -8.956 13.545 1.00 0.00 O ATOM 1459 CB LYS A 524 2.087 -10.339 16.104 1.00 0.00 C ATOM 1460 CG LYS A 524 1.924 -9.026 16.850 1.00 0.00 C ATOM 1461 CD LYS A 524 2.055 -9.219 18.352 1.00 0.00 C ATOM 1462 CE LYS A 524 1.223 -8.202 19.118 1.00 0.00 C ATOM 1463 NZ LYS A 524 1.469 -8.277 20.585 1.00 0.00 N ATOM 0 H LYS A 524 2.497 -12.052 14.327 1.00 0.00 H new ATOM 0 HA LYS A 524 0.224 -10.411 15.033 1.00 0.00 H new ATOM 0 HB2 LYS A 524 1.775 -11.157 16.753 1.00 0.00 H new ATOM 0 HB3 LYS A 524 3.143 -10.493 15.882 1.00 0.00 H new ATOM 0 HG2 LYS A 524 2.676 -8.315 16.506 1.00 0.00 H new ATOM 0 HG3 LYS A 524 0.949 -8.595 16.621 1.00 0.00 H new ATOM 0 HD2 LYS A 524 1.737 -10.227 18.620 1.00 0.00 H new ATOM 0 HD3 LYS A 524 3.102 -9.127 18.642 1.00 0.00 H new ATOM 0 HE2 LYS A 524 1.457 -7.199 18.761 1.00 0.00 H new ATOM 0 HE3 LYS A 524 0.165 -8.373 18.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 0.884 -7.568 21.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 1.222 -9.226 20.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 2.473 -8.089 20.779 1.00 0.00 H new ATOM 1477 N VAL A 525 0.560 -8.390 13.663 1.00 0.00 N ATOM 1478 CA VAL A 525 0.717 -7.186 12.856 1.00 0.00 C ATOM 1479 C VAL A 525 1.157 -6.004 13.712 1.00 0.00 C ATOM 1480 O VAL A 525 0.949 -5.991 14.925 1.00 0.00 O ATOM 1481 CB VAL A 525 -0.592 -6.822 12.131 1.00 0.00 C ATOM 1482 CG1 VAL A 525 -0.421 -5.540 11.331 1.00 0.00 C ATOM 1483 CG2 VAL A 525 -1.039 -7.965 11.232 1.00 0.00 C ATOM 0 H VAL A 525 -0.393 -8.562 13.983 1.00 0.00 H new ATOM 0 HA VAL A 525 1.487 -7.400 12.115 1.00 0.00 H new ATOM 0 HB VAL A 525 -1.366 -6.654 12.879 1.00 0.00 H new ATOM 0 HG11 VAL A 525 -1.356 -5.299 10.826 1.00 0.00 H new ATOM 0 HG12 VAL A 525 -0.151 -4.725 12.003 1.00 0.00 H new ATOM 0 HG13 VAL A 525 0.367 -5.676 10.590 1.00 0.00 H new ATOM 0 HG21 VAL A 525 -1.965 -7.690 10.728 1.00 0.00 H new ATOM 0 HG22 VAL A 525 -0.267 -8.167 10.489 1.00 0.00 H new ATOM 0 HG23 VAL A 525 -1.205 -8.858 11.834 1.00 0.00 H new ATOM 1493 N VAL A 526 1.765 -5.010 13.071 1.00 0.00 N ATOM 1494 CA VAL A 526 2.234 -3.821 13.774 1.00 0.00 C ATOM 1495 C VAL A 526 2.176 -2.593 12.873 1.00 0.00 C ATOM 1496 O VAL A 526 2.871 -2.521 11.860 1.00 0.00 O ATOM 1497 CB VAL A 526 3.675 -4.003 14.285 1.00 0.00 C ATOM 1498 CG1 VAL A 526 4.295 -2.656 14.625 1.00 0.00 C ATOM 1499 CG2 VAL A 526 3.700 -4.930 15.490 1.00 0.00 C ATOM 0 H VAL A 526 1.944 -5.005 12.067 1.00 0.00 H new ATOM 0 HA VAL A 526 1.571 -3.674 14.627 1.00 0.00 H new ATOM 0 HB VAL A 526 4.268 -4.459 13.492 1.00 0.00 H new ATOM 0 HG11 VAL A 526 5.313 -2.804 14.984 1.00 0.00 H new ATOM 0 HG12 VAL A 526 4.313 -2.028 13.734 1.00 0.00 H new ATOM 0 HG13 VAL A 526 3.704 -2.169 15.400 1.00 0.00 H new ATOM 0 HG21 VAL A 526 4.726 -5.047 15.838 1.00 0.00 H new ATOM 0 HG22 VAL A 526 3.093 -4.505 16.289 1.00 0.00 H new ATOM 0 HG23 VAL A 526 3.299 -5.904 15.208 1.00 0.00 H new ATOM 1509 N ALA A 527 1.344 -1.628 13.250 1.00 0.00 N ATOM 1510 CA ALA A 527 1.197 -0.401 12.477 1.00 0.00 C ATOM 1511 C ALA A 527 2.032 0.727 13.074 1.00 0.00 C ATOM 1512 O ALA A 527 2.111 0.874 14.294 1.00 0.00 O ATOM 1513 CB ALA A 527 -0.267 0.006 12.405 1.00 0.00 C ATOM 0 H ALA A 527 0.761 -1.672 14.086 1.00 0.00 H new ATOM 0 HA ALA A 527 1.560 -0.592 11.467 1.00 0.00 H new ATOM 0 HB1 ALA A 527 -0.361 0.924 11.825 1.00 0.00 H new ATOM 0 HB2 ALA A 527 -0.842 -0.787 11.926 1.00 0.00 H new ATOM 0 HB3 ALA A 527 -0.648 0.173 13.412 1.00 0.00 H new ATOM 1519 N GLU A 528 2.656 1.519 12.207 1.00 0.00 N ATOM 1520 CA GLU A 528 3.487 2.632 12.651 1.00 0.00 C ATOM 1521 C GLU A 528 3.344 3.826 11.711 1.00 0.00 C ATOM 1522 O GLU A 528 2.926 3.679 10.563 1.00 0.00 O ATOM 1523 CB GLU A 528 4.953 2.203 12.729 1.00 0.00 C ATOM 1524 CG GLU A 528 5.190 1.005 13.633 1.00 0.00 C ATOM 1525 CD GLU A 528 5.474 1.404 15.068 1.00 0.00 C ATOM 1526 OE1 GLU A 528 6.561 1.963 15.324 1.00 0.00 O ATOM 1527 OE2 GLU A 528 4.610 1.158 15.935 1.00 0.00 O ATOM 0 H GLU A 528 2.602 1.410 11.194 1.00 0.00 H new ATOM 0 HA GLU A 528 3.150 2.931 13.644 1.00 0.00 H new ATOM 0 HB2 GLU A 528 5.307 1.966 11.726 1.00 0.00 H new ATOM 0 HB3 GLU A 528 5.550 3.042 13.088 1.00 0.00 H new ATOM 0 HG2 GLU A 528 4.315 0.356 13.607 1.00 0.00 H new ATOM 0 HG3 GLU A 528 6.029 0.425 13.248 1.00 0.00 H new ATOM 1534 N VAL A 529 3.693 5.008 12.209 1.00 0.00 N ATOM 1535 CA VAL A 529 3.605 6.228 11.415 1.00 0.00 C ATOM 1536 C VAL A 529 4.939 6.548 10.750 1.00 0.00 C ATOM 1537 O VAL A 529 5.938 6.795 11.425 1.00 0.00 O ATOM 1538 CB VAL A 529 3.172 7.428 12.277 1.00 0.00 C ATOM 1539 CG1 VAL A 529 4.278 7.816 13.246 1.00 0.00 C ATOM 1540 CG2 VAL A 529 2.788 8.607 11.394 1.00 0.00 C ATOM 0 H VAL A 529 4.039 5.147 13.158 1.00 0.00 H new ATOM 0 HA VAL A 529 2.852 6.052 10.646 1.00 0.00 H new ATOM 0 HB VAL A 529 2.297 7.138 12.859 1.00 0.00 H new ATOM 0 HG11 VAL A 529 3.954 8.666 13.847 1.00 0.00 H new ATOM 0 HG12 VAL A 529 4.501 6.973 13.900 1.00 0.00 H new ATOM 0 HG13 VAL A 529 5.173 8.088 12.687 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.485 9.446 12.020 1.00 0.00 H new ATOM 0 HG22 VAL A 529 3.643 8.899 10.785 1.00 0.00 H new ATOM 0 HG23 VAL A 529 1.961 8.321 10.744 1.00 0.00 H new ATOM 1550 N TYR A 530 4.947 6.543 9.421 1.00 0.00 N ATOM 1551 CA TYR A 530 6.159 6.831 8.664 1.00 0.00 C ATOM 1552 C TYR A 530 6.501 8.316 8.727 1.00 0.00 C ATOM 1553 O TYR A 530 5.781 9.105 9.340 1.00 0.00 O ATOM 1554 CB TYR A 530 5.990 6.397 7.207 1.00 0.00 C ATOM 1555 CG TYR A 530 7.299 6.136 6.497 1.00 0.00 C ATOM 1556 CD1 TYR A 530 8.017 4.969 6.728 1.00 0.00 C ATOM 1557 CD2 TYR A 530 7.818 7.056 5.594 1.00 0.00 C ATOM 1558 CE1 TYR A 530 9.214 4.726 6.083 1.00 0.00 C ATOM 1559 CE2 TYR A 530 9.014 6.821 4.942 1.00 0.00 C ATOM 1560 CZ TYR A 530 9.708 5.655 5.190 1.00 0.00 C ATOM 1561 OH TYR A 530 10.899 5.417 4.544 1.00 0.00 O ATOM 0 H TYR A 530 4.128 6.343 8.847 1.00 0.00 H new ATOM 0 HA TYR A 530 6.979 6.269 9.112 1.00 0.00 H new ATOM 0 HB2 TYR A 530 5.382 5.493 7.174 1.00 0.00 H new ATOM 0 HB3 TYR A 530 5.442 7.170 6.668 1.00 0.00 H new ATOM 0 HD1 TYR A 530 7.632 4.239 7.424 1.00 0.00 H new ATOM 0 HD2 TYR A 530 7.278 7.970 5.398 1.00 0.00 H new ATOM 0 HE1 TYR A 530 9.760 3.814 6.276 1.00 0.00 H new ATOM 0 HE2 TYR A 530 9.403 7.546 4.242 1.00 0.00 H new ATOM 0 HH TYR A 530 11.104 6.168 3.949 1.00 0.00 H new