USER MOD reduce.3.24.130724 H: found=0, std=0, add=639, rem=0, adj=13 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 33:sc= 0.531 USER MOD Set 1.2: A 508 THR OG1 : rot 86:sc= 0.0642 USER MOD Single : A 444 SER OG : rot 43:sc= -0.0542 USER MOD Single : A 447 MET CE :methyl 150:sc= -2.82! (180deg=-4.14!) USER MOD Single : A 451 ASN : amide:sc= -0.113 K(o=-0.11,f=-0.95) 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 90:sc= 1.27 USER MOD Single : A 470 CYS SG : rot 67:sc= 0.505 USER MOD Single : A 472 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.984) USER MOD Single : A 477 ASN : amide:sc= -0.666 K(o=-0.67,f=-1.5!) USER MOD Single : A 482 TYR OH : rot 7:sc= 0.413 USER MOD Single : A 483 GLN : amide:sc= -0.378 X(o=-0.38,f=-0.096) USER MOD Single : A 485 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0278) 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= -0.137 X(o=-0.14,f=0.023) USER MOD Single : A 510 LYS NZ :NH3+ 144:sc= -0.64 (180deg=-1.88!) USER MOD Single : A 513 GLN : amide:sc= -0.318 K(o=-0.32,f=-3.4!) USER MOD Single : A 516 ASN : amide:sc= -0.721 X(o=-0.72,f=-0.66) 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 0.564 14.004 9.897 1.00 0.00 N ATOM 205 CA SER A 444 1.097 12.737 9.411 1.00 0.00 C ATOM 206 C SER A 444 -0.026 11.826 8.926 1.00 0.00 C ATOM 207 O SER A 444 -0.786 11.277 9.724 1.00 0.00 O ATOM 208 CB SER A 444 1.895 12.039 10.514 1.00 0.00 C ATOM 209 OG SER A 444 1.073 11.743 11.629 1.00 0.00 O ATOM 0 HA SER A 444 1.759 12.947 8.571 1.00 0.00 H new ATOM 0 HB2 SER A 444 2.331 11.119 10.125 1.00 0.00 H new ATOM 0 HB3 SER A 444 2.722 12.676 10.827 1.00 0.00 H new ATOM 0 HG SER A 444 0.215 11.386 11.317 1.00 0.00 H new ATOM 215 N THR A 445 -0.125 11.668 7.609 1.00 0.00 N ATOM 216 CA THR A 445 -1.155 10.825 7.016 1.00 0.00 C ATOM 217 C THR A 445 -0.542 9.611 6.327 1.00 0.00 C ATOM 218 O THR A 445 -1.220 8.893 5.593 1.00 0.00 O ATOM 219 CB THR A 445 -2.001 11.608 5.994 1.00 0.00 C ATOM 220 OG1 THR A 445 -2.855 10.710 5.276 1.00 0.00 O ATOM 221 CG2 THR A 445 -1.111 12.359 5.016 1.00 0.00 C ATOM 0 H THR A 445 0.496 12.113 6.933 1.00 0.00 H new ATOM 0 HA THR A 445 -1.798 10.491 7.830 1.00 0.00 H new ATOM 0 HB THR A 445 -2.608 12.332 6.537 1.00 0.00 H new ATOM 0 HG1 THR A 445 -3.118 9.970 5.862 1.00 0.00 H new ATOM 0 HG21 THR A 445 -1.731 12.904 4.304 1.00 0.00 H new ATOM 0 HG22 THR A 445 -0.482 13.062 5.562 1.00 0.00 H new ATOM 0 HG23 THR A 445 -0.481 11.650 4.479 1.00 0.00 H new ATOM 229 N VAL A 446 0.746 9.387 6.569 1.00 0.00 N ATOM 230 CA VAL A 446 1.451 8.258 5.973 1.00 0.00 C ATOM 231 C VAL A 446 1.694 7.158 7.000 1.00 0.00 C ATOM 232 O VAL A 446 2.551 7.290 7.874 1.00 0.00 O ATOM 233 CB VAL A 446 2.801 8.692 5.372 1.00 0.00 C ATOM 234 CG1 VAL A 446 3.403 7.568 4.543 1.00 0.00 C ATOM 235 CG2 VAL A 446 2.630 9.951 4.535 1.00 0.00 C ATOM 0 H VAL A 446 1.322 9.972 7.174 1.00 0.00 H new ATOM 0 HA VAL A 446 0.815 7.873 5.176 1.00 0.00 H new ATOM 0 HB VAL A 446 3.488 8.916 6.188 1.00 0.00 H new ATOM 0 HG11 VAL A 446 4.356 7.893 4.127 1.00 0.00 H new ATOM 0 HG12 VAL A 446 3.562 6.695 5.175 1.00 0.00 H new ATOM 0 HG13 VAL A 446 2.722 7.309 3.732 1.00 0.00 H new ATOM 0 HG21 VAL A 446 3.593 10.244 4.118 1.00 0.00 H new ATOM 0 HG22 VAL A 446 1.928 9.757 3.725 1.00 0.00 H new ATOM 0 HG23 VAL A 446 2.246 10.756 5.162 1.00 0.00 H new ATOM 245 N MET A 447 0.936 6.073 6.888 1.00 0.00 N ATOM 246 CA MET A 447 1.071 4.948 7.807 1.00 0.00 C ATOM 247 C MET A 447 1.895 3.829 7.178 1.00 0.00 C ATOM 248 O MET A 447 1.968 3.710 5.955 1.00 0.00 O ATOM 249 CB MET A 447 -0.308 4.420 8.206 1.00 0.00 C ATOM 250 CG MET A 447 -0.268 3.044 8.852 1.00 0.00 C ATOM 251 SD MET A 447 -1.913 2.397 9.209 1.00 0.00 S ATOM 252 CE MET A 447 -2.473 1.970 7.563 1.00 0.00 C ATOM 0 H MET A 447 0.222 5.948 6.170 1.00 0.00 H new ATOM 0 HA MET A 447 1.589 5.299 8.699 1.00 0.00 H new ATOM 0 HB2 MET A 447 -0.771 5.124 8.897 1.00 0.00 H new ATOM 0 HB3 MET A 447 -0.942 4.378 7.321 1.00 0.00 H new ATOM 0 HG2 MET A 447 0.255 2.352 8.192 1.00 0.00 H new ATOM 0 HG3 MET A 447 0.306 3.098 9.777 1.00 0.00 H new ATOM 0 HE1 MET A 447 -3.163 1.128 7.620 1.00 0.00 H new ATOM 0 HE2 MET A 447 -2.981 2.826 7.118 1.00 0.00 H new ATOM 0 HE3 MET A 447 -1.617 1.696 6.947 1.00 0.00 H new ATOM 262 N VAL A 448 2.513 3.009 8.023 1.00 0.00 N ATOM 263 CA VAL A 448 3.331 1.899 7.550 1.00 0.00 C ATOM 264 C VAL A 448 2.971 0.605 8.272 1.00 0.00 C ATOM 265 O VAL A 448 2.887 0.569 9.500 1.00 0.00 O ATOM 266 CB VAL A 448 4.832 2.183 7.746 1.00 0.00 C ATOM 267 CG1 VAL A 448 5.189 2.168 9.225 1.00 0.00 C ATOM 268 CG2 VAL A 448 5.670 1.174 6.976 1.00 0.00 C ATOM 0 H VAL A 448 2.462 3.093 9.038 1.00 0.00 H new ATOM 0 HA VAL A 448 3.127 1.787 6.485 1.00 0.00 H new ATOM 0 HB VAL A 448 5.051 3.176 7.354 1.00 0.00 H new ATOM 0 HG11 VAL A 448 6.253 2.370 9.344 1.00 0.00 H new ATOM 0 HG12 VAL A 448 4.613 2.933 9.746 1.00 0.00 H new ATOM 0 HG13 VAL A 448 4.956 1.190 9.646 1.00 0.00 H new ATOM 0 HG21 VAL A 448 6.728 1.390 7.126 1.00 0.00 H new ATOM 0 HG22 VAL A 448 5.450 0.169 7.335 1.00 0.00 H new ATOM 0 HG23 VAL A 448 5.433 1.239 5.914 1.00 0.00 H new ATOM 278 N LEU A 449 2.760 -0.457 7.502 1.00 0.00 N ATOM 279 CA LEU A 449 2.410 -1.755 8.068 1.00 0.00 C ATOM 280 C LEU A 449 3.610 -2.697 8.054 1.00 0.00 C ATOM 281 O LEU A 449 4.385 -2.717 7.098 1.00 0.00 O ATOM 282 CB LEU A 449 1.251 -2.377 7.288 1.00 0.00 C ATOM 283 CG LEU A 449 0.077 -1.448 6.975 1.00 0.00 C ATOM 284 CD1 LEU A 449 -1.105 -2.243 6.442 1.00 0.00 C ATOM 285 CD2 LEU A 449 -0.323 -0.660 8.214 1.00 0.00 C ATOM 0 H LEU A 449 2.825 -0.445 6.484 1.00 0.00 H new ATOM 0 HA LEU A 449 2.104 -1.602 9.103 1.00 0.00 H new ATOM 0 HB2 LEU A 449 1.640 -2.767 6.348 1.00 0.00 H new ATOM 0 HB3 LEU A 449 0.874 -3.228 7.854 1.00 0.00 H new ATOM 0 HG LEU A 449 0.391 -0.743 6.205 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -1.931 -1.566 6.225 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.812 -2.763 5.530 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.420 -2.971 7.189 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -1.160 -0.004 7.974 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -0.618 -1.350 9.004 1.00 0.00 H new ATOM 0 HD23 LEU A 449 0.522 -0.061 8.553 1.00 0.00 H new ATOM 297 N ARG A 450 3.756 -3.476 9.120 1.00 0.00 N ATOM 298 CA ARG A 450 4.861 -4.421 9.231 1.00 0.00 C ATOM 299 C ARG A 450 4.391 -5.738 9.842 1.00 0.00 C ATOM 300 O ARG A 450 3.576 -5.750 10.763 1.00 0.00 O ATOM 301 CB ARG A 450 5.986 -3.826 10.079 1.00 0.00 C ATOM 302 CG ARG A 450 6.443 -2.454 9.608 1.00 0.00 C ATOM 303 CD ARG A 450 7.339 -1.782 10.637 1.00 0.00 C ATOM 304 NE ARG A 450 6.581 -1.292 11.785 1.00 0.00 N ATOM 305 CZ ARG A 450 7.145 -0.836 12.898 1.00 0.00 C ATOM 306 NH1 ARG A 450 8.466 -0.807 13.011 1.00 0.00 N ATOM 307 NH2 ARG A 450 6.389 -0.407 13.900 1.00 0.00 N ATOM 0 H ARG A 450 3.123 -3.472 9.920 1.00 0.00 H new ATOM 0 HA ARG A 450 5.238 -4.620 8.228 1.00 0.00 H new ATOM 0 HB2 ARG A 450 5.650 -3.753 11.113 1.00 0.00 H new ATOM 0 HB3 ARG A 450 6.837 -4.507 10.068 1.00 0.00 H new ATOM 0 HG2 ARG A 450 6.980 -2.552 8.665 1.00 0.00 H new ATOM 0 HG3 ARG A 450 5.573 -1.826 9.415 1.00 0.00 H new ATOM 0 HD2 ARG A 450 8.095 -2.490 10.977 1.00 0.00 H new ATOM 0 HD3 ARG A 450 7.868 -0.951 10.170 1.00 0.00 H new ATOM 0 HE ARG A 450 5.563 -1.300 11.729 1.00 0.00 H new ATOM 0 HH11 ARG A 450 9.051 -1.135 12.243 1.00 0.00 H new ATOM 0 HH12 ARG A 450 8.897 -0.456 13.866 1.00 0.00 H new ATOM 0 HH21 ARG A 450 5.373 -0.427 13.817 1.00 0.00 H new ATOM 0 HH22 ARG A 450 6.824 -0.057 14.754 1.00 0.00 H new ATOM 321 N ASN A 451 4.912 -6.845 9.322 1.00 0.00 N ATOM 322 CA ASN A 451 4.545 -8.167 9.816 1.00 0.00 C ATOM 323 C ASN A 451 3.110 -8.513 9.429 1.00 0.00 C ATOM 324 O ASN A 451 2.343 -9.023 10.245 1.00 0.00 O ATOM 325 CB ASN A 451 4.705 -8.229 11.336 1.00 0.00 C ATOM 326 CG ASN A 451 5.036 -9.626 11.826 1.00 0.00 C ATOM 327 OD1 ASN A 451 5.789 -10.358 11.185 1.00 0.00 O ATOM 328 ND2 ASN A 451 4.472 -10.001 12.969 1.00 0.00 N ATOM 0 H ASN A 451 5.589 -6.853 8.559 1.00 0.00 H new ATOM 0 HA ASN A 451 5.212 -8.897 9.358 1.00 0.00 H new ATOM 0 HB2 ASN A 451 5.494 -7.543 11.644 1.00 0.00 H new ATOM 0 HB3 ASN A 451 3.784 -7.889 11.810 1.00 0.00 H new ATOM 0 HD21 ASN A 451 4.657 -10.929 13.349 1.00 0.00 H new ATOM 0 HD22 ASN A 451 3.854 -9.360 13.467 1.00 0.00 H new ATOM 335 N MET A 452 2.756 -8.233 8.180 1.00 0.00 N ATOM 336 CA MET A 452 1.414 -8.516 7.685 1.00 0.00 C ATOM 337 C MET A 452 1.391 -9.817 6.887 1.00 0.00 C ATOM 338 O MET A 452 0.592 -10.711 7.162 1.00 0.00 O ATOM 339 CB MET A 452 0.914 -7.362 6.814 1.00 0.00 C ATOM 340 CG MET A 452 -0.396 -7.660 6.102 1.00 0.00 C ATOM 341 SD MET A 452 -1.035 -6.238 5.198 1.00 0.00 S ATOM 342 CE MET A 452 -2.404 -5.755 6.248 1.00 0.00 C ATOM 0 H MET A 452 3.379 -7.810 7.492 1.00 0.00 H new ATOM 0 HA MET A 452 0.753 -8.626 8.545 1.00 0.00 H new ATOM 0 HB2 MET A 452 0.786 -6.477 7.437 1.00 0.00 H new ATOM 0 HB3 MET A 452 1.675 -7.122 6.071 1.00 0.00 H new ATOM 0 HG2 MET A 452 -0.248 -8.489 5.410 1.00 0.00 H new ATOM 0 HG3 MET A 452 -1.137 -7.983 6.833 1.00 0.00 H new ATOM 0 HE1 MET A 452 -2.901 -4.885 5.820 1.00 0.00 H new ATOM 0 HE2 MET A 452 -3.114 -6.579 6.322 1.00 0.00 H new ATOM 0 HE3 MET A 452 -2.031 -5.507 7.242 1.00 0.00 H new ATOM 352 N VAL A 453 2.274 -9.915 5.899 1.00 0.00 N ATOM 353 CA VAL A 453 2.356 -11.106 5.062 1.00 0.00 C ATOM 354 C VAL A 453 3.781 -11.335 4.570 1.00 0.00 C ATOM 355 O VAL A 453 4.500 -10.386 4.255 1.00 0.00 O ATOM 356 CB VAL A 453 1.415 -11.005 3.847 1.00 0.00 C ATOM 357 CG1 VAL A 453 -0.023 -11.273 4.262 1.00 0.00 C ATOM 358 CG2 VAL A 453 1.543 -9.640 3.188 1.00 0.00 C ATOM 0 H VAL A 453 2.943 -9.184 5.658 1.00 0.00 H new ATOM 0 HA VAL A 453 2.048 -11.949 5.681 1.00 0.00 H new ATOM 0 HB VAL A 453 1.705 -11.763 3.120 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -0.673 -11.197 3.391 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -0.099 -12.275 4.685 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -0.329 -10.540 5.008 1.00 0.00 H new ATOM 0 HG21 VAL A 453 0.871 -9.585 2.331 1.00 0.00 H new ATOM 0 HG22 VAL A 453 1.279 -8.863 3.906 1.00 0.00 H new ATOM 0 HG23 VAL A 453 2.570 -9.492 2.854 1.00 0.00 H new ATOM 368 N ASP A 454 4.183 -12.600 4.506 1.00 0.00 N ATOM 369 CA ASP A 454 5.522 -12.954 4.050 1.00 0.00 C ATOM 370 C ASP A 454 5.747 -12.494 2.613 1.00 0.00 C ATOM 371 O ASP A 454 4.805 -12.229 1.866 1.00 0.00 O ATOM 372 CB ASP A 454 5.735 -14.465 4.154 1.00 0.00 C ATOM 373 CG ASP A 454 6.276 -14.882 5.508 1.00 0.00 C ATOM 374 OD1 ASP A 454 5.660 -14.518 6.531 1.00 0.00 O ATOM 375 OD2 ASP A 454 7.316 -15.572 5.544 1.00 0.00 O ATOM 0 H ASP A 454 3.601 -13.397 4.764 1.00 0.00 H new ATOM 0 HA ASP A 454 6.243 -12.447 4.691 1.00 0.00 H new ATOM 0 HB2 ASP A 454 4.790 -14.976 3.971 1.00 0.00 H new ATOM 0 HB3 ASP A 454 6.427 -14.786 3.375 1.00 0.00 H new ATOM 380 N PRO A 455 7.024 -12.394 2.217 1.00 0.00 N ATOM 381 CA PRO A 455 7.403 -11.964 0.867 1.00 0.00 C ATOM 382 C PRO A 455 7.053 -13.005 -0.191 1.00 0.00 C ATOM 383 O PRO A 455 7.270 -12.789 -1.384 1.00 0.00 O ATOM 384 CB PRO A 455 8.920 -11.789 0.964 1.00 0.00 C ATOM 385 CG PRO A 455 9.336 -12.691 2.073 1.00 0.00 C ATOM 386 CD PRO A 455 8.197 -12.693 3.055 1.00 0.00 C ATOM 0 HA PRO A 455 6.875 -11.060 0.563 1.00 0.00 H new ATOM 0 HB2 PRO A 455 9.410 -12.060 0.029 1.00 0.00 H new ATOM 0 HB3 PRO A 455 9.186 -10.753 1.175 1.00 0.00 H new ATOM 0 HG2 PRO A 455 9.535 -13.697 1.704 1.00 0.00 H new ATOM 0 HG3 PRO A 455 10.254 -12.336 2.541 1.00 0.00 H new ATOM 0 HD2 PRO A 455 8.099 -13.657 3.555 1.00 0.00 H new ATOM 0 HD3 PRO A 455 8.336 -11.943 3.834 1.00 0.00 H new ATOM 394 N LYS A 456 6.510 -14.133 0.251 1.00 0.00 N ATOM 395 CA LYS A 456 6.127 -15.207 -0.658 1.00 0.00 C ATOM 396 C LYS A 456 4.676 -15.054 -1.101 1.00 0.00 C ATOM 397 O LYS A 456 4.334 -15.343 -2.248 1.00 0.00 O ATOM 398 CB LYS A 456 6.325 -16.567 0.015 1.00 0.00 C ATOM 399 CG LYS A 456 5.420 -16.790 1.214 1.00 0.00 C ATOM 400 CD LYS A 456 5.409 -18.249 1.641 1.00 0.00 C ATOM 401 CE LYS A 456 4.865 -18.412 3.052 1.00 0.00 C ATOM 402 NZ LYS A 456 3.406 -18.120 3.122 1.00 0.00 N ATOM 0 H LYS A 456 6.325 -14.328 1.235 1.00 0.00 H new ATOM 0 HA LYS A 456 6.765 -15.148 -1.539 1.00 0.00 H new ATOM 0 HB2 LYS A 456 6.145 -17.355 -0.717 1.00 0.00 H new ATOM 0 HB3 LYS A 456 7.364 -16.658 0.333 1.00 0.00 H new ATOM 0 HG2 LYS A 456 5.756 -16.169 2.045 1.00 0.00 H new ATOM 0 HG3 LYS A 456 4.406 -16.474 0.969 1.00 0.00 H new ATOM 0 HD2 LYS A 456 4.801 -18.828 0.946 1.00 0.00 H new ATOM 0 HD3 LYS A 456 6.421 -18.652 1.591 1.00 0.00 H new ATOM 0 HE2 LYS A 456 5.048 -19.430 3.396 1.00 0.00 H new ATOM 0 HE3 LYS A 456 5.401 -17.745 3.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 3.074 -18.242 4.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 3.233 -17.141 2.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 2.891 -18.773 2.497 1.00 0.00 H new ATOM 416 N ASP A 457 3.828 -14.597 -0.186 1.00 0.00 N ATOM 417 CA ASP A 457 2.414 -14.403 -0.484 1.00 0.00 C ATOM 418 C ASP A 457 2.214 -13.223 -1.430 1.00 0.00 C ATOM 419 O ASP A 457 1.255 -13.188 -2.202 1.00 0.00 O ATOM 420 CB ASP A 457 1.625 -14.177 0.806 1.00 0.00 C ATOM 421 CG ASP A 457 0.161 -14.546 0.663 1.00 0.00 C ATOM 422 OD1 ASP A 457 -0.146 -15.448 -0.143 1.00 0.00 O ATOM 423 OD2 ASP A 457 -0.676 -13.931 1.356 1.00 0.00 O ATOM 0 H ASP A 457 4.095 -14.354 0.768 1.00 0.00 H new ATOM 0 HA ASP A 457 2.045 -15.304 -0.973 1.00 0.00 H new ATOM 0 HB2 ASP A 457 2.069 -14.767 1.608 1.00 0.00 H new ATOM 0 HB3 ASP A 457 1.706 -13.130 1.099 1.00 0.00 H new ATOM 428 N ILE A 458 3.126 -12.258 -1.364 1.00 0.00 N ATOM 429 CA ILE A 458 3.049 -11.076 -2.214 1.00 0.00 C ATOM 430 C ILE A 458 2.523 -11.430 -3.601 1.00 0.00 C ATOM 431 O ILE A 458 3.089 -12.276 -4.293 1.00 0.00 O ATOM 432 CB ILE A 458 4.424 -10.396 -2.357 1.00 0.00 C ATOM 433 CG1 ILE A 458 5.001 -10.068 -0.978 1.00 0.00 C ATOM 434 CG2 ILE A 458 4.306 -9.136 -3.201 1.00 0.00 C ATOM 435 CD1 ILE A 458 4.084 -9.218 -0.126 1.00 0.00 C ATOM 0 H ILE A 458 3.926 -12.272 -0.731 1.00 0.00 H new ATOM 0 HA ILE A 458 2.358 -10.384 -1.732 1.00 0.00 H new ATOM 0 HB ILE A 458 5.103 -11.085 -2.860 1.00 0.00 H new ATOM 0 HG12 ILE A 458 5.214 -10.998 -0.452 1.00 0.00 H new ATOM 0 HG13 ILE A 458 5.951 -9.549 -1.105 1.00 0.00 H new ATOM 0 HG21 ILE A 458 5.285 -8.667 -3.293 1.00 0.00 H new ATOM 0 HG22 ILE A 458 3.933 -9.395 -4.192 1.00 0.00 H new ATOM 0 HG23 ILE A 458 3.614 -8.442 -2.724 1.00 0.00 H new ATOM 0 HD11 ILE A 458 4.557 -9.025 0.837 1.00 0.00 H new ATOM 0 HD12 ILE A 458 3.891 -8.272 -0.632 1.00 0.00 H new ATOM 0 HD13 ILE A 458 3.142 -9.744 0.032 1.00 0.00 H new ATOM 447 N ASP A 459 1.439 -10.775 -4.000 1.00 0.00 N ATOM 448 CA ASP A 459 0.837 -11.018 -5.306 1.00 0.00 C ATOM 449 C ASP A 459 0.135 -9.765 -5.823 1.00 0.00 C ATOM 450 O ASP A 459 -0.315 -8.928 -5.041 1.00 0.00 O ATOM 451 CB ASP A 459 -0.157 -12.178 -5.226 1.00 0.00 C ATOM 452 CG ASP A 459 0.530 -13.517 -5.048 1.00 0.00 C ATOM 453 OD1 ASP A 459 1.619 -13.708 -5.629 1.00 0.00 O ATOM 454 OD2 ASP A 459 -0.021 -14.374 -4.326 1.00 0.00 O ATOM 0 H ASP A 459 0.959 -10.072 -3.438 1.00 0.00 H new ATOM 0 HA ASP A 459 1.634 -11.280 -6.002 1.00 0.00 H new ATOM 0 HB2 ASP A 459 -0.841 -12.010 -4.394 1.00 0.00 H new ATOM 0 HB3 ASP A 459 -0.759 -12.200 -6.134 1.00 0.00 H new ATOM 459 N ASP A 460 0.048 -9.644 -7.143 1.00 0.00 N ATOM 460 CA ASP A 460 -0.598 -8.494 -7.764 1.00 0.00 C ATOM 461 C ASP A 460 -1.993 -8.277 -7.186 1.00 0.00 C ATOM 462 O ASP A 460 -2.522 -7.166 -7.214 1.00 0.00 O ATOM 463 CB ASP A 460 -0.684 -8.687 -9.279 1.00 0.00 C ATOM 464 CG ASP A 460 -1.346 -9.996 -9.659 1.00 0.00 C ATOM 465 OD1 ASP A 460 -0.787 -11.063 -9.329 1.00 0.00 O ATOM 466 OD2 ASP A 460 -2.425 -9.954 -10.287 1.00 0.00 O ATOM 0 H ASP A 460 0.417 -10.328 -7.803 1.00 0.00 H new ATOM 0 HA ASP A 460 0.005 -7.611 -7.552 1.00 0.00 H new ATOM 0 HB2 ASP A 460 -1.243 -7.860 -9.716 1.00 0.00 H new ATOM 0 HB3 ASP A 460 0.319 -8.654 -9.704 1.00 0.00 H new ATOM 471 N ASP A 461 -2.585 -9.346 -6.665 1.00 0.00 N ATOM 472 CA ASP A 461 -3.919 -9.274 -6.081 1.00 0.00 C ATOM 473 C ASP A 461 -3.865 -8.686 -4.674 1.00 0.00 C ATOM 474 O ASP A 461 -4.785 -7.989 -4.245 1.00 0.00 O ATOM 475 CB ASP A 461 -4.559 -10.662 -6.043 1.00 0.00 C ATOM 476 CG ASP A 461 -5.330 -10.979 -7.309 1.00 0.00 C ATOM 477 OD1 ASP A 461 -6.493 -10.537 -7.422 1.00 0.00 O ATOM 478 OD2 ASP A 461 -4.771 -11.669 -8.187 1.00 0.00 O ATOM 0 H ASP A 461 -2.162 -10.273 -6.635 1.00 0.00 H new ATOM 0 HA ASP A 461 -4.527 -8.620 -6.706 1.00 0.00 H new ATOM 0 HB2 ASP A 461 -3.783 -11.413 -5.896 1.00 0.00 H new ATOM 0 HB3 ASP A 461 -5.230 -10.726 -5.187 1.00 0.00 H new ATOM 483 N LEU A 462 -2.782 -8.973 -3.960 1.00 0.00 N ATOM 484 CA LEU A 462 -2.608 -8.474 -2.600 1.00 0.00 C ATOM 485 C LEU A 462 -2.844 -6.969 -2.538 1.00 0.00 C ATOM 486 O LEU A 462 -3.714 -6.498 -1.806 1.00 0.00 O ATOM 487 CB LEU A 462 -1.203 -8.803 -2.092 1.00 0.00 C ATOM 488 CG LEU A 462 -0.946 -8.531 -0.609 1.00 0.00 C ATOM 489 CD1 LEU A 462 -1.858 -9.386 0.257 1.00 0.00 C ATOM 490 CD2 LEU A 462 0.514 -8.789 -0.265 1.00 0.00 C ATOM 0 H LEU A 462 -2.011 -9.548 -4.300 1.00 0.00 H new ATOM 0 HA LEU A 462 -3.343 -8.965 -1.962 1.00 0.00 H new ATOM 0 HB2 LEU A 462 -1.005 -9.857 -2.287 1.00 0.00 H new ATOM 0 HB3 LEU A 462 -0.483 -8.230 -2.676 1.00 0.00 H new ATOM 0 HG LEU A 462 -1.167 -7.483 -0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 462 -1.661 -9.179 1.309 1.00 0.00 H new ATOM 0 HD12 LEU A 462 -2.898 -9.153 0.030 1.00 0.00 H new ATOM 0 HD13 LEU A 462 -1.670 -10.440 0.054 1.00 0.00 H new ATOM 0 HD21 LEU A 462 0.679 -8.590 0.794 1.00 0.00 H new ATOM 0 HD22 LEU A 462 0.761 -9.828 -0.482 1.00 0.00 H new ATOM 0 HD23 LEU A 462 1.149 -8.133 -0.860 1.00 0.00 H new ATOM 502 N GLU A 463 -2.066 -6.220 -3.314 1.00 0.00 N ATOM 503 CA GLU A 463 -2.193 -4.768 -3.347 1.00 0.00 C ATOM 504 C GLU A 463 -3.659 -4.348 -3.285 1.00 0.00 C ATOM 505 O GLU A 463 -4.041 -3.504 -2.476 1.00 0.00 O ATOM 506 CB GLU A 463 -1.543 -4.206 -4.613 1.00 0.00 C ATOM 507 CG GLU A 463 -1.217 -2.724 -4.524 1.00 0.00 C ATOM 508 CD GLU A 463 -0.835 -2.129 -5.865 1.00 0.00 C ATOM 509 OE1 GLU A 463 -1.739 -1.910 -6.697 1.00 0.00 O ATOM 510 OE2 GLU A 463 0.370 -1.883 -6.082 1.00 0.00 O ATOM 0 H GLU A 463 -1.342 -6.595 -3.927 1.00 0.00 H new ATOM 0 HA GLU A 463 -1.680 -4.364 -2.474 1.00 0.00 H new ATOM 0 HB2 GLU A 463 -0.626 -4.759 -4.817 1.00 0.00 H new ATOM 0 HB3 GLU A 463 -2.211 -4.372 -5.458 1.00 0.00 H new ATOM 0 HG2 GLU A 463 -2.080 -2.189 -4.126 1.00 0.00 H new ATOM 0 HG3 GLU A 463 -0.398 -2.578 -3.819 1.00 0.00 H new ATOM 517 N GLY A 464 -4.476 -4.944 -4.148 1.00 0.00 N ATOM 518 CA GLY A 464 -5.891 -4.620 -4.176 1.00 0.00 C ATOM 519 C GLY A 464 -6.578 -4.908 -2.856 1.00 0.00 C ATOM 520 O GLY A 464 -7.296 -4.061 -2.325 1.00 0.00 O ATOM 0 H GLY A 464 -4.184 -5.645 -4.828 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -6.014 -3.566 -4.424 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -6.376 -5.192 -4.967 1.00 0.00 H new ATOM 524 N GLU A 465 -6.359 -6.107 -2.326 1.00 0.00 N ATOM 525 CA GLU A 465 -6.965 -6.505 -1.061 1.00 0.00 C ATOM 526 C GLU A 465 -6.692 -5.467 0.024 1.00 0.00 C ATOM 527 O GLU A 465 -7.609 -5.012 0.708 1.00 0.00 O ATOM 528 CB GLU A 465 -6.432 -7.871 -0.622 1.00 0.00 C ATOM 529 CG GLU A 465 -6.940 -9.024 -1.470 1.00 0.00 C ATOM 530 CD GLU A 465 -8.432 -9.250 -1.316 1.00 0.00 C ATOM 531 OE1 GLU A 465 -8.992 -8.830 -0.282 1.00 0.00 O ATOM 532 OE2 GLU A 465 -9.039 -9.847 -2.230 1.00 0.00 O ATOM 0 H GLU A 465 -5.767 -6.819 -2.753 1.00 0.00 H new ATOM 0 HA GLU A 465 -8.043 -6.574 -1.210 1.00 0.00 H new ATOM 0 HB2 GLU A 465 -5.343 -7.856 -0.660 1.00 0.00 H new ATOM 0 HB3 GLU A 465 -6.712 -8.044 0.417 1.00 0.00 H new ATOM 0 HG2 GLU A 465 -6.713 -8.827 -2.518 1.00 0.00 H new ATOM 0 HG3 GLU A 465 -6.408 -9.935 -1.194 1.00 0.00 H new ATOM 539 N VAL A 466 -5.424 -5.098 0.175 1.00 0.00 N ATOM 540 CA VAL A 466 -5.029 -4.113 1.175 1.00 0.00 C ATOM 541 C VAL A 466 -5.673 -2.760 0.899 1.00 0.00 C ATOM 542 O VAL A 466 -6.154 -2.090 1.814 1.00 0.00 O ATOM 543 CB VAL A 466 -3.499 -3.942 1.220 1.00 0.00 C ATOM 544 CG1 VAL A 466 -3.110 -2.881 2.239 1.00 0.00 C ATOM 545 CG2 VAL A 466 -2.823 -5.268 1.534 1.00 0.00 C ATOM 0 H VAL A 466 -4.653 -5.466 -0.382 1.00 0.00 H new ATOM 0 HA VAL A 466 -5.374 -4.485 2.139 1.00 0.00 H new ATOM 0 HB VAL A 466 -3.159 -3.611 0.239 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -2.025 -2.774 2.257 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -3.564 -1.929 1.964 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.461 -3.179 3.227 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -1.742 -5.128 1.562 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -3.167 -5.631 2.502 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -3.075 -5.996 0.763 1.00 0.00 H new ATOM 555 N THR A 467 -5.681 -2.362 -0.369 1.00 0.00 N ATOM 556 CA THR A 467 -6.266 -1.088 -0.767 1.00 0.00 C ATOM 557 C THR A 467 -7.744 -1.021 -0.397 1.00 0.00 C ATOM 558 O THR A 467 -8.214 -0.017 0.136 1.00 0.00 O ATOM 559 CB THR A 467 -6.117 -0.849 -2.281 1.00 0.00 C ATOM 560 OG1 THR A 467 -4.739 -0.948 -2.660 1.00 0.00 O ATOM 561 CG2 THR A 467 -6.657 0.519 -2.670 1.00 0.00 C ATOM 0 H THR A 467 -5.289 -2.904 -1.139 1.00 0.00 H new ATOM 0 HA THR A 467 -5.724 -0.311 -0.229 1.00 0.00 H new ATOM 0 HB THR A 467 -6.694 -1.612 -2.804 1.00 0.00 H new ATOM 0 HG1 THR A 467 -4.530 -1.876 -2.895 1.00 0.00 H new ATOM 0 HG21 THR A 467 -6.541 0.664 -3.744 1.00 0.00 H new ATOM 0 HG22 THR A 467 -7.713 0.581 -2.408 1.00 0.00 H new ATOM 0 HG23 THR A 467 -6.105 1.293 -2.137 1.00 0.00 H new ATOM 569 N GLU A 468 -8.469 -2.098 -0.683 1.00 0.00 N ATOM 570 CA GLU A 468 -9.894 -2.160 -0.379 1.00 0.00 C ATOM 571 C GLU A 468 -10.125 -2.301 1.123 1.00 0.00 C ATOM 572 O GLU A 468 -11.147 -1.861 1.648 1.00 0.00 O ATOM 573 CB GLU A 468 -10.545 -3.331 -1.118 1.00 0.00 C ATOM 574 CG GLU A 468 -10.042 -4.692 -0.666 1.00 0.00 C ATOM 575 CD GLU A 468 -10.855 -5.835 -1.241 1.00 0.00 C ATOM 576 OE1 GLU A 468 -11.376 -5.685 -2.366 1.00 0.00 O ATOM 577 OE2 GLU A 468 -10.970 -6.880 -0.566 1.00 0.00 O ATOM 0 H GLU A 468 -8.094 -2.938 -1.124 1.00 0.00 H new ATOM 0 HA GLU A 468 -10.351 -1.229 -0.713 1.00 0.00 H new ATOM 0 HB2 GLU A 468 -11.624 -3.286 -0.973 1.00 0.00 H new ATOM 0 HB3 GLU A 468 -10.362 -3.222 -2.187 1.00 0.00 H new ATOM 0 HG2 GLU A 468 -9.000 -4.807 -0.963 1.00 0.00 H new ATOM 0 HG3 GLU A 468 -10.070 -4.742 0.422 1.00 0.00 H new ATOM 584 N GLU A 469 -9.167 -2.918 1.808 1.00 0.00 N ATOM 585 CA GLU A 469 -9.266 -3.118 3.248 1.00 0.00 C ATOM 586 C GLU A 469 -8.993 -1.817 3.999 1.00 0.00 C ATOM 587 O GLU A 469 -9.598 -1.549 5.037 1.00 0.00 O ATOM 588 CB GLU A 469 -8.284 -4.199 3.705 1.00 0.00 C ATOM 589 CG GLU A 469 -8.470 -4.618 5.153 1.00 0.00 C ATOM 590 CD GLU A 469 -7.393 -5.576 5.626 1.00 0.00 C ATOM 591 OE1 GLU A 469 -6.230 -5.142 5.760 1.00 0.00 O ATOM 592 OE2 GLU A 469 -7.715 -6.759 5.863 1.00 0.00 O ATOM 0 H GLU A 469 -8.314 -3.288 1.388 1.00 0.00 H new ATOM 0 HA GLU A 469 -10.282 -3.442 3.474 1.00 0.00 H new ATOM 0 HB2 GLU A 469 -8.397 -5.074 3.065 1.00 0.00 H new ATOM 0 HB3 GLU A 469 -7.266 -3.834 3.569 1.00 0.00 H new ATOM 0 HG2 GLU A 469 -8.467 -3.732 5.787 1.00 0.00 H new ATOM 0 HG3 GLU A 469 -9.446 -5.089 5.269 1.00 0.00 H new ATOM 599 N CYS A 470 -8.078 -1.015 3.466 1.00 0.00 N ATOM 600 CA CYS A 470 -7.723 0.257 4.085 1.00 0.00 C ATOM 601 C CYS A 470 -8.812 1.298 3.850 1.00 0.00 C ATOM 602 O CYS A 470 -9.100 2.117 4.722 1.00 0.00 O ATOM 603 CB CYS A 470 -6.390 0.762 3.531 1.00 0.00 C ATOM 604 SG CYS A 470 -4.981 -0.307 3.909 1.00 0.00 S ATOM 0 H CYS A 470 -7.569 -1.223 2.607 1.00 0.00 H new ATOM 0 HA CYS A 470 -7.625 0.096 5.159 1.00 0.00 H new ATOM 0 HB2 CYS A 470 -6.474 0.865 2.449 1.00 0.00 H new ATOM 0 HB3 CYS A 470 -6.196 1.757 3.932 1.00 0.00 H new ATOM 0 HG CYS A 470 -5.110 -1.435 3.275 1.00 0.00 H new ATOM 610 N GLY A 471 -9.414 1.262 2.665 1.00 0.00 N ATOM 611 CA GLY A 471 -10.464 2.209 2.336 1.00 0.00 C ATOM 612 C GLY A 471 -11.362 2.513 3.519 1.00 0.00 C ATOM 613 O GLY A 471 -11.814 3.645 3.690 1.00 0.00 O ATOM 0 H GLY A 471 -9.193 0.594 1.927 1.00 0.00 H new ATOM 0 HA2 GLY A 471 -10.015 3.135 1.978 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -11.066 1.810 1.520 1.00 0.00 H new ATOM 617 N LYS A 472 -11.622 1.499 4.338 1.00 0.00 N ATOM 618 CA LYS A 472 -12.473 1.662 5.511 1.00 0.00 C ATOM 619 C LYS A 472 -12.014 2.847 6.355 1.00 0.00 C ATOM 620 O LYS A 472 -12.808 3.724 6.694 1.00 0.00 O ATOM 621 CB LYS A 472 -12.461 0.386 6.356 1.00 0.00 C ATOM 622 CG LYS A 472 -13.363 -0.710 5.814 1.00 0.00 C ATOM 623 CD LYS A 472 -12.856 -1.243 4.484 1.00 0.00 C ATOM 624 CE LYS A 472 -13.406 -2.631 4.194 1.00 0.00 C ATOM 625 NZ LYS A 472 -12.651 -3.689 4.920 1.00 0.00 N ATOM 0 H LYS A 472 -11.255 0.556 4.211 1.00 0.00 H new ATOM 0 HA LYS A 472 -13.490 1.854 5.168 1.00 0.00 H new ATOM 0 HB2 LYS A 472 -11.440 0.009 6.415 1.00 0.00 H new ATOM 0 HB3 LYS A 472 -12.770 0.630 7.372 1.00 0.00 H new ATOM 0 HG2 LYS A 472 -13.421 -1.525 6.535 1.00 0.00 H new ATOM 0 HG3 LYS A 472 -14.374 -0.322 5.690 1.00 0.00 H new ATOM 0 HD2 LYS A 472 -13.145 -0.562 3.684 1.00 0.00 H new ATOM 0 HD3 LYS A 472 -11.767 -1.277 4.496 1.00 0.00 H new ATOM 0 HE2 LYS A 472 -14.457 -2.673 4.481 1.00 0.00 H new ATOM 0 HE3 LYS A 472 -13.361 -2.823 3.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 472 -12.599 -4.545 4.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 472 -11.689 -3.351 5.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 472 -13.137 -3.912 5.812 1.00 0.00 H new ATOM 639 N PHE A 473 -10.728 2.866 6.690 1.00 0.00 N ATOM 640 CA PHE A 473 -10.164 3.944 7.494 1.00 0.00 C ATOM 641 C PHE A 473 -10.382 5.296 6.822 1.00 0.00 C ATOM 642 O PHE A 473 -10.771 6.268 7.468 1.00 0.00 O ATOM 643 CB PHE A 473 -8.669 3.710 7.721 1.00 0.00 C ATOM 644 CG PHE A 473 -8.337 2.304 8.130 1.00 0.00 C ATOM 645 CD1 PHE A 473 -8.716 1.821 9.372 1.00 0.00 C ATOM 646 CD2 PHE A 473 -7.646 1.464 7.271 1.00 0.00 C ATOM 647 CE1 PHE A 473 -8.413 0.527 9.751 1.00 0.00 C ATOM 648 CE2 PHE A 473 -7.341 0.168 7.645 1.00 0.00 C ATOM 649 CZ PHE A 473 -7.723 -0.300 8.886 1.00 0.00 C ATOM 0 H PHE A 473 -10.057 2.148 6.417 1.00 0.00 H new ATOM 0 HA PHE A 473 -10.675 3.951 8.457 1.00 0.00 H new ATOM 0 HB2 PHE A 473 -8.129 3.951 6.805 1.00 0.00 H new ATOM 0 HB3 PHE A 473 -8.315 4.397 8.490 1.00 0.00 H new ATOM 0 HD1 PHE A 473 -9.255 2.464 10.052 1.00 0.00 H new ATOM 0 HD2 PHE A 473 -7.343 1.825 6.300 1.00 0.00 H new ATOM 0 HE1 PHE A 473 -8.715 0.163 10.722 1.00 0.00 H new ATOM 0 HE2 PHE A 473 -6.804 -0.478 6.966 1.00 0.00 H new ATOM 0 HZ PHE A 473 -7.483 -1.311 9.180 1.00 0.00 H new ATOM 659 N GLY A 474 -10.129 5.350 5.517 1.00 0.00 N ATOM 660 CA GLY A 474 -10.303 6.586 4.778 1.00 0.00 C ATOM 661 C GLY A 474 -9.881 6.459 3.328 1.00 0.00 C ATOM 662 O GLY A 474 -9.178 5.518 2.959 1.00 0.00 O ATOM 0 H GLY A 474 -9.807 4.559 4.959 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -11.349 6.889 4.823 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -9.722 7.375 5.254 1.00 0.00 H new ATOM 666 N ALA A 475 -10.312 7.407 2.502 1.00 0.00 N ATOM 667 CA ALA A 475 -9.974 7.397 1.084 1.00 0.00 C ATOM 668 C ALA A 475 -8.483 7.153 0.877 1.00 0.00 C ATOM 669 O ALA A 475 -7.655 8.009 1.187 1.00 0.00 O ATOM 670 CB ALA A 475 -10.392 8.707 0.433 1.00 0.00 C ATOM 0 H ALA A 475 -10.896 8.192 2.791 1.00 0.00 H new ATOM 0 HA ALA A 475 -10.518 6.579 0.611 1.00 0.00 H new ATOM 0 HB1 ALA A 475 -10.134 8.686 -0.626 1.00 0.00 H new ATOM 0 HB2 ALA A 475 -11.468 8.840 0.541 1.00 0.00 H new ATOM 0 HB3 ALA A 475 -9.874 9.535 0.916 1.00 0.00 H new ATOM 676 N VAL A 476 -8.148 5.979 0.352 1.00 0.00 N ATOM 677 CA VAL A 476 -6.756 5.622 0.102 1.00 0.00 C ATOM 678 C VAL A 476 -6.084 6.640 -0.812 1.00 0.00 C ATOM 679 O VAL A 476 -6.657 7.062 -1.816 1.00 0.00 O ATOM 680 CB VAL A 476 -6.640 4.223 -0.531 1.00 0.00 C ATOM 681 CG1 VAL A 476 -5.185 3.884 -0.814 1.00 0.00 C ATOM 682 CG2 VAL A 476 -7.275 3.176 0.371 1.00 0.00 C ATOM 0 H VAL A 476 -8.821 5.259 0.091 1.00 0.00 H new ATOM 0 HA VAL A 476 -6.252 5.617 1.068 1.00 0.00 H new ATOM 0 HB VAL A 476 -7.178 4.226 -1.479 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.123 2.892 -1.261 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -4.767 4.619 -1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -4.620 3.898 0.118 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -7.184 2.193 -0.092 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -6.768 3.171 1.336 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -8.329 3.412 0.517 1.00 0.00 H new ATOM 692 N ASN A 477 -4.863 7.029 -0.458 1.00 0.00 N ATOM 693 CA ASN A 477 -4.111 7.998 -1.248 1.00 0.00 C ATOM 694 C ASN A 477 -3.039 7.304 -2.083 1.00 0.00 C ATOM 695 O ASN A 477 -2.999 7.451 -3.305 1.00 0.00 O ATOM 696 CB ASN A 477 -3.465 9.041 -0.333 1.00 0.00 C ATOM 697 CG ASN A 477 -3.074 10.302 -1.079 1.00 0.00 C ATOM 698 OD1 ASN A 477 -2.378 10.246 -2.093 1.00 0.00 O ATOM 699 ND2 ASN A 477 -3.522 11.448 -0.580 1.00 0.00 N ATOM 0 H ASN A 477 -4.374 6.689 0.370 1.00 0.00 H new ATOM 0 HA ASN A 477 -4.806 8.497 -1.923 1.00 0.00 H new ATOM 0 HB2 ASN A 477 -4.158 9.296 0.468 1.00 0.00 H new ATOM 0 HB3 ASN A 477 -2.580 8.611 0.136 1.00 0.00 H new ATOM 0 HD21 ASN A 477 -3.292 12.329 -1.040 1.00 0.00 H new ATOM 0 HD22 ASN A 477 -4.096 11.447 0.263 1.00 0.00 H new ATOM 706 N ARG A 478 -2.173 6.549 -1.415 1.00 0.00 N ATOM 707 CA ARG A 478 -1.101 5.833 -2.096 1.00 0.00 C ATOM 708 C ARG A 478 -0.811 4.504 -1.405 1.00 0.00 C ATOM 709 O ARG A 478 -1.016 4.361 -0.199 1.00 0.00 O ATOM 710 CB ARG A 478 0.167 6.688 -2.134 1.00 0.00 C ATOM 711 CG ARG A 478 0.239 7.619 -3.333 1.00 0.00 C ATOM 712 CD ARG A 478 1.677 7.875 -3.754 1.00 0.00 C ATOM 713 NE ARG A 478 1.798 9.066 -4.591 1.00 0.00 N ATOM 714 CZ ARG A 478 2.962 9.573 -4.984 1.00 0.00 C ATOM 715 NH1 ARG A 478 4.098 8.995 -4.618 1.00 0.00 N ATOM 716 NH2 ARG A 478 2.990 10.660 -5.745 1.00 0.00 N ATOM 0 H ARG A 478 -2.193 6.417 -0.404 1.00 0.00 H new ATOM 0 HA ARG A 478 -1.424 5.629 -3.117 1.00 0.00 H new ATOM 0 HB2 ARG A 478 0.223 7.281 -1.221 1.00 0.00 H new ATOM 0 HB3 ARG A 478 1.037 6.032 -2.142 1.00 0.00 H new ATOM 0 HG2 ARG A 478 -0.313 7.184 -4.166 1.00 0.00 H new ATOM 0 HG3 ARG A 478 -0.244 8.565 -3.090 1.00 0.00 H new ATOM 0 HD2 ARG A 478 2.299 7.991 -2.867 1.00 0.00 H new ATOM 0 HD3 ARG A 478 2.055 7.009 -4.298 1.00 0.00 H new ATOM 0 HE ARG A 478 0.943 9.534 -4.890 1.00 0.00 H new ATOM 0 HH11 ARG A 478 4.080 8.159 -4.034 1.00 0.00 H new ATOM 0 HH12 ARG A 478 4.990 9.386 -4.921 1.00 0.00 H new ATOM 0 HH21 ARG A 478 2.118 11.107 -6.028 1.00 0.00 H new ATOM 0 HH22 ARG A 478 3.884 11.049 -6.046 1.00 0.00 H new ATOM 730 N VAL A 479 -0.333 3.533 -2.177 1.00 0.00 N ATOM 731 CA VAL A 479 -0.014 2.216 -1.640 1.00 0.00 C ATOM 732 C VAL A 479 1.233 1.640 -2.302 1.00 0.00 C ATOM 733 O VAL A 479 1.245 1.380 -3.505 1.00 0.00 O ATOM 734 CB VAL A 479 -1.184 1.233 -1.832 1.00 0.00 C ATOM 735 CG1 VAL A 479 -0.825 -0.140 -1.285 1.00 0.00 C ATOM 736 CG2 VAL A 479 -2.444 1.768 -1.167 1.00 0.00 C ATOM 0 H VAL A 479 -0.158 3.634 -3.177 1.00 0.00 H new ATOM 0 HA VAL A 479 0.171 2.345 -0.574 1.00 0.00 H new ATOM 0 HB VAL A 479 -1.378 1.132 -2.900 1.00 0.00 H new ATOM 0 HG11 VAL A 479 -1.664 -0.820 -1.430 1.00 0.00 H new ATOM 0 HG12 VAL A 479 0.049 -0.524 -1.811 1.00 0.00 H new ATOM 0 HG13 VAL A 479 -0.602 -0.061 -0.221 1.00 0.00 H new ATOM 0 HG21 VAL A 479 -3.261 1.061 -1.313 1.00 0.00 H new ATOM 0 HG22 VAL A 479 -2.264 1.900 -0.100 1.00 0.00 H new ATOM 0 HG23 VAL A 479 -2.711 2.727 -1.611 1.00 0.00 H new ATOM 746 N ILE A 480 2.280 1.442 -1.507 1.00 0.00 N ATOM 747 CA ILE A 480 3.531 0.895 -2.016 1.00 0.00 C ATOM 748 C ILE A 480 4.042 -0.230 -1.123 1.00 0.00 C ATOM 749 O ILE A 480 4.088 -0.093 0.100 1.00 0.00 O ATOM 750 CB ILE A 480 4.617 1.981 -2.126 1.00 0.00 C ATOM 751 CG1 ILE A 480 4.169 3.086 -3.084 1.00 0.00 C ATOM 752 CG2 ILE A 480 5.932 1.372 -2.589 1.00 0.00 C ATOM 753 CD1 ILE A 480 4.759 4.442 -2.762 1.00 0.00 C ATOM 0 H ILE A 480 2.286 1.652 -0.509 1.00 0.00 H new ATOM 0 HA ILE A 480 3.322 0.500 -3.010 1.00 0.00 H new ATOM 0 HB ILE A 480 4.771 2.421 -1.140 1.00 0.00 H new ATOM 0 HG12 ILE A 480 4.448 2.809 -4.101 1.00 0.00 H new ATOM 0 HG13 ILE A 480 3.082 3.157 -3.060 1.00 0.00 H new ATOM 0 HG21 ILE A 480 6.689 2.153 -2.662 1.00 0.00 H new ATOM 0 HG22 ILE A 480 6.256 0.618 -1.872 1.00 0.00 H new ATOM 0 HG23 ILE A 480 5.794 0.908 -3.566 1.00 0.00 H new ATOM 0 HD11 ILE A 480 4.398 5.176 -3.482 1.00 0.00 H new ATOM 0 HD12 ILE A 480 4.458 4.740 -1.758 1.00 0.00 H new ATOM 0 HD13 ILE A 480 5.846 4.387 -2.814 1.00 0.00 H new ATOM 765 N ILE A 481 4.427 -1.341 -1.742 1.00 0.00 N ATOM 766 CA ILE A 481 4.938 -2.489 -1.003 1.00 0.00 C ATOM 767 C ILE A 481 6.427 -2.690 -1.260 1.00 0.00 C ATOM 768 O ILE A 481 6.824 -3.186 -2.315 1.00 0.00 O ATOM 769 CB ILE A 481 4.185 -3.780 -1.377 1.00 0.00 C ATOM 770 CG1 ILE A 481 2.703 -3.654 -1.018 1.00 0.00 C ATOM 771 CG2 ILE A 481 4.806 -4.978 -0.674 1.00 0.00 C ATOM 772 CD1 ILE A 481 1.832 -4.708 -1.666 1.00 0.00 C ATOM 0 H ILE A 481 4.395 -1.471 -2.753 1.00 0.00 H new ATOM 0 HA ILE A 481 4.780 -2.279 0.055 1.00 0.00 H new ATOM 0 HB ILE A 481 4.267 -3.932 -2.453 1.00 0.00 H new ATOM 0 HG12 ILE A 481 2.593 -3.719 0.065 1.00 0.00 H new ATOM 0 HG13 ILE A 481 2.348 -2.667 -1.316 1.00 0.00 H new ATOM 0 HG21 ILE A 481 4.263 -5.882 -0.948 1.00 0.00 H new ATOM 0 HG22 ILE A 481 5.849 -5.076 -0.975 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.751 -4.835 0.405 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.795 -4.557 -1.367 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.912 -4.630 -2.750 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.161 -5.697 -1.348 1.00 0.00 H new ATOM 784 N TYR A 482 7.247 -2.303 -0.289 1.00 0.00 N ATOM 785 CA TYR A 482 8.693 -2.440 -0.410 1.00 0.00 C ATOM 786 C TYR A 482 9.214 -3.550 0.498 1.00 0.00 C ATOM 787 O TYR A 482 8.686 -3.773 1.587 1.00 0.00 O ATOM 788 CB TYR A 482 9.382 -1.119 -0.066 1.00 0.00 C ATOM 789 CG TYR A 482 10.792 -1.013 -0.603 1.00 0.00 C ATOM 790 CD1 TYR A 482 11.859 -1.592 0.073 1.00 0.00 C ATOM 791 CD2 TYR A 482 11.056 -0.335 -1.786 1.00 0.00 C ATOM 792 CE1 TYR A 482 13.149 -1.497 -0.414 1.00 0.00 C ATOM 793 CE2 TYR A 482 12.343 -0.236 -2.281 1.00 0.00 C ATOM 794 CZ TYR A 482 13.385 -0.818 -1.591 1.00 0.00 C ATOM 795 OH TYR A 482 14.668 -0.723 -2.079 1.00 0.00 O ATOM 0 H TYR A 482 6.935 -1.892 0.591 1.00 0.00 H new ATOM 0 HA TYR A 482 8.922 -2.703 -1.443 1.00 0.00 H new ATOM 0 HB2 TYR A 482 8.788 -0.295 -0.463 1.00 0.00 H new ATOM 0 HB3 TYR A 482 9.405 -1.002 1.018 1.00 0.00 H new ATOM 0 HD1 TYR A 482 11.677 -2.125 0.994 1.00 0.00 H new ATOM 0 HD2 TYR A 482 10.242 0.123 -2.328 1.00 0.00 H new ATOM 0 HE1 TYR A 482 13.968 -1.952 0.124 1.00 0.00 H new ATOM 0 HE2 TYR A 482 12.531 0.294 -3.203 1.00 0.00 H new ATOM 0 HH TYR A 482 15.266 -1.279 -1.537 1.00 0.00 H new ATOM 805 N GLN A 483 10.252 -4.242 0.041 1.00 0.00 N ATOM 806 CA GLN A 483 10.845 -5.328 0.812 1.00 0.00 C ATOM 807 C GLN A 483 12.348 -5.413 0.567 1.00 0.00 C ATOM 808 O GLN A 483 12.813 -5.238 -0.558 1.00 0.00 O ATOM 809 CB GLN A 483 10.182 -6.659 0.451 1.00 0.00 C ATOM 810 CG GLN A 483 10.455 -7.107 -0.976 1.00 0.00 C ATOM 811 CD GLN A 483 9.327 -7.940 -1.552 1.00 0.00 C ATOM 812 OE1 GLN A 483 9.551 -9.029 -2.081 1.00 0.00 O ATOM 813 NE2 GLN A 483 8.105 -7.430 -1.453 1.00 0.00 N ATOM 0 H GLN A 483 10.700 -4.070 -0.859 1.00 0.00 H new ATOM 0 HA GLN A 483 10.679 -5.122 1.869 1.00 0.00 H new ATOM 0 HB2 GLN A 483 10.533 -7.429 1.138 1.00 0.00 H new ATOM 0 HB3 GLN A 483 9.105 -6.570 0.595 1.00 0.00 H new ATOM 0 HG2 GLN A 483 10.612 -6.230 -1.604 1.00 0.00 H new ATOM 0 HG3 GLN A 483 11.378 -7.686 -1.001 1.00 0.00 H new ATOM 0 HE21 GLN A 483 7.965 -6.524 -1.006 1.00 0.00 H new ATOM 0 HE22 GLN A 483 7.306 -7.945 -1.823 1.00 0.00 H new ATOM 822 N GLU A 484 13.101 -5.682 1.629 1.00 0.00 N ATOM 823 CA GLU A 484 14.552 -5.788 1.529 1.00 0.00 C ATOM 824 C GLU A 484 15.123 -6.568 2.709 1.00 0.00 C ATOM 825 O GLU A 484 14.417 -6.863 3.674 1.00 0.00 O ATOM 826 CB GLU A 484 15.185 -4.396 1.469 1.00 0.00 C ATOM 827 CG GLU A 484 16.626 -4.403 0.987 1.00 0.00 C ATOM 828 CD GLU A 484 17.096 -3.034 0.536 1.00 0.00 C ATOM 829 OE1 GLU A 484 16.462 -2.459 -0.373 1.00 0.00 O ATOM 830 OE2 GLU A 484 18.098 -2.537 1.091 1.00 0.00 O ATOM 0 H GLU A 484 12.731 -5.830 2.568 1.00 0.00 H new ATOM 0 HA GLU A 484 14.789 -6.326 0.611 1.00 0.00 H new ATOM 0 HB2 GLU A 484 14.592 -3.765 0.807 1.00 0.00 H new ATOM 0 HB3 GLU A 484 15.144 -3.945 2.460 1.00 0.00 H new ATOM 0 HG2 GLU A 484 17.272 -4.759 1.790 1.00 0.00 H new ATOM 0 HG3 GLU A 484 16.726 -5.108 0.161 1.00 0.00 H new ATOM 837 N LYS A 485 16.407 -6.900 2.625 1.00 0.00 N ATOM 838 CA LYS A 485 17.076 -7.645 3.685 1.00 0.00 C ATOM 839 C LYS A 485 17.613 -6.703 4.758 1.00 0.00 C ATOM 840 O LYS A 485 18.230 -5.684 4.448 1.00 0.00 O ATOM 841 CB LYS A 485 18.221 -8.480 3.106 1.00 0.00 C ATOM 842 CG LYS A 485 18.773 -9.511 4.075 1.00 0.00 C ATOM 843 CD LYS A 485 19.341 -10.716 3.344 1.00 0.00 C ATOM 844 CE LYS A 485 20.512 -10.327 2.454 1.00 0.00 C ATOM 845 NZ LYS A 485 21.717 -9.966 3.250 1.00 0.00 N ATOM 0 H LYS A 485 17.005 -6.665 1.833 1.00 0.00 H new ATOM 0 HA LYS A 485 16.344 -8.310 4.143 1.00 0.00 H new ATOM 0 HB2 LYS A 485 17.870 -8.989 2.208 1.00 0.00 H new ATOM 0 HB3 LYS A 485 19.027 -7.813 2.800 1.00 0.00 H new ATOM 0 HG2 LYS A 485 19.551 -9.056 4.687 1.00 0.00 H new ATOM 0 HG3 LYS A 485 17.983 -9.835 4.752 1.00 0.00 H new ATOM 0 HD2 LYS A 485 19.666 -11.463 4.069 1.00 0.00 H new ATOM 0 HD3 LYS A 485 18.560 -11.177 2.739 1.00 0.00 H new ATOM 0 HE2 LYS A 485 20.752 -11.155 1.787 1.00 0.00 H new ATOM 0 HE3 LYS A 485 20.226 -9.484 1.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 22.516 -9.789 2.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 21.522 -9.108 3.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 21.955 -10.748 3.893 1.00 0.00 H new ATOM 950 N GLU A 493 16.943 -12.734 6.967 1.00 0.00 N ATOM 951 CA GLU A 493 15.492 -12.645 6.849 1.00 0.00 C ATOM 952 C GLU A 493 15.090 -11.459 5.977 1.00 0.00 C ATOM 953 O GLU A 493 15.797 -10.454 5.913 1.00 0.00 O ATOM 954 CB GLU A 493 14.852 -12.514 8.233 1.00 0.00 C ATOM 955 CG GLU A 493 13.350 -12.742 8.233 1.00 0.00 C ATOM 956 CD GLU A 493 12.983 -14.214 8.241 1.00 0.00 C ATOM 957 OE1 GLU A 493 13.385 -14.931 7.302 1.00 0.00 O ATOM 958 OE2 GLU A 493 12.294 -14.647 9.188 1.00 0.00 O ATOM 0 HA GLU A 493 15.135 -13.560 6.377 1.00 0.00 H new ATOM 0 HB2 GLU A 493 15.320 -13.229 8.909 1.00 0.00 H new ATOM 0 HB3 GLU A 493 15.060 -11.519 8.628 1.00 0.00 H new ATOM 0 HG2 GLU A 493 12.913 -12.258 9.106 1.00 0.00 H new ATOM 0 HG3 GLU A 493 12.914 -12.268 7.354 1.00 0.00 H new ATOM 965 N ILE A 494 13.949 -11.586 5.306 1.00 0.00 N ATOM 966 CA ILE A 494 13.452 -10.526 4.438 1.00 0.00 C ATOM 967 C ILE A 494 12.157 -9.933 4.981 1.00 0.00 C ATOM 968 O ILE A 494 11.127 -10.606 5.029 1.00 0.00 O ATOM 969 CB ILE A 494 13.209 -11.038 3.006 1.00 0.00 C ATOM 970 CG1 ILE A 494 14.509 -11.576 2.406 1.00 0.00 C ATOM 971 CG2 ILE A 494 12.636 -9.928 2.137 1.00 0.00 C ATOM 972 CD1 ILE A 494 15.624 -10.554 2.365 1.00 0.00 C ATOM 0 H ILE A 494 13.352 -12.412 5.347 1.00 0.00 H new ATOM 0 HA ILE A 494 14.220 -9.753 4.413 1.00 0.00 H new ATOM 0 HB ILE A 494 12.485 -11.852 3.044 1.00 0.00 H new ATOM 0 HG12 ILE A 494 14.838 -12.438 2.986 1.00 0.00 H new ATOM 0 HG13 ILE A 494 14.314 -11.929 1.394 1.00 0.00 H new ATOM 0 HG21 ILE A 494 12.470 -10.305 1.128 1.00 0.00 H new ATOM 0 HG22 ILE A 494 11.690 -9.588 2.558 1.00 0.00 H new ATOM 0 HG23 ILE A 494 13.338 -9.095 2.102 1.00 0.00 H new ATOM 0 HD11 ILE A 494 16.515 -11.005 1.928 1.00 0.00 H new ATOM 0 HD12 ILE A 494 15.314 -9.702 1.760 1.00 0.00 H new ATOM 0 HD13 ILE A 494 15.847 -10.218 3.378 1.00 0.00 H new ATOM 984 N ILE A 495 12.216 -8.669 5.388 1.00 0.00 N ATOM 985 CA ILE A 495 11.046 -7.984 5.924 1.00 0.00 C ATOM 986 C ILE A 495 10.197 -7.388 4.807 1.00 0.00 C ATOM 987 O ILE A 495 10.603 -7.373 3.645 1.00 0.00 O ATOM 988 CB ILE A 495 11.448 -6.865 6.902 1.00 0.00 C ATOM 989 CG1 ILE A 495 12.279 -5.802 6.180 1.00 0.00 C ATOM 990 CG2 ILE A 495 12.223 -7.441 8.078 1.00 0.00 C ATOM 991 CD1 ILE A 495 11.458 -4.893 5.292 1.00 0.00 C ATOM 0 H ILE A 495 13.061 -8.099 5.357 1.00 0.00 H new ATOM 0 HA ILE A 495 10.462 -8.731 6.461 1.00 0.00 H new ATOM 0 HB ILE A 495 10.542 -6.395 7.285 1.00 0.00 H new ATOM 0 HG12 ILE A 495 12.803 -5.197 6.920 1.00 0.00 H new ATOM 0 HG13 ILE A 495 13.040 -6.296 5.576 1.00 0.00 H new ATOM 0 HG21 ILE A 495 12.500 -6.637 8.760 1.00 0.00 H new ATOM 0 HG22 ILE A 495 11.601 -8.165 8.604 1.00 0.00 H new ATOM 0 HG23 ILE A 495 13.124 -7.934 7.713 1.00 0.00 H new ATOM 0 HD11 ILE A 495 12.112 -4.165 4.813 1.00 0.00 H new ATOM 0 HD12 ILE A 495 10.955 -5.487 4.529 1.00 0.00 H new ATOM 0 HD13 ILE A 495 10.714 -4.371 5.894 1.00 0.00 H new ATOM 1003 N VAL A 496 9.016 -6.895 5.167 1.00 0.00 N ATOM 1004 CA VAL A 496 8.111 -6.294 4.195 1.00 0.00 C ATOM 1005 C VAL A 496 7.529 -4.986 4.721 1.00 0.00 C ATOM 1006 O VAL A 496 6.713 -4.983 5.643 1.00 0.00 O ATOM 1007 CB VAL A 496 6.956 -7.249 3.838 1.00 0.00 C ATOM 1008 CG1 VAL A 496 5.962 -6.563 2.913 1.00 0.00 C ATOM 1009 CG2 VAL A 496 7.496 -8.523 3.205 1.00 0.00 C ATOM 0 H VAL A 496 8.664 -6.900 6.124 1.00 0.00 H new ATOM 0 HA VAL A 496 8.698 -6.093 3.299 1.00 0.00 H new ATOM 0 HB VAL A 496 6.433 -7.519 4.756 1.00 0.00 H new ATOM 0 HG11 VAL A 496 5.153 -7.253 2.672 1.00 0.00 H new ATOM 0 HG12 VAL A 496 5.552 -5.683 3.408 1.00 0.00 H new ATOM 0 HG13 VAL A 496 6.467 -6.261 1.996 1.00 0.00 H new ATOM 0 HG21 VAL A 496 6.667 -9.187 2.959 1.00 0.00 H new ATOM 0 HG22 VAL A 496 8.044 -8.274 2.296 1.00 0.00 H new ATOM 0 HG23 VAL A 496 8.165 -9.022 3.906 1.00 0.00 H new ATOM 1019 N LYS A 497 7.955 -3.876 4.130 1.00 0.00 N ATOM 1020 CA LYS A 497 7.476 -2.560 4.536 1.00 0.00 C ATOM 1021 C LYS A 497 6.380 -2.066 3.599 1.00 0.00 C ATOM 1022 O LYS A 497 6.624 -1.825 2.416 1.00 0.00 O ATOM 1023 CB LYS A 497 8.633 -1.558 4.558 1.00 0.00 C ATOM 1024 CG LYS A 497 9.509 -1.667 5.794 1.00 0.00 C ATOM 1025 CD LYS A 497 8.969 -0.824 6.937 1.00 0.00 C ATOM 1026 CE LYS A 497 9.514 0.595 6.888 1.00 0.00 C ATOM 1027 NZ LYS A 497 9.616 1.197 8.247 1.00 0.00 N ATOM 0 H LYS A 497 8.632 -3.861 3.367 1.00 0.00 H new ATOM 0 HA LYS A 497 7.059 -2.647 5.539 1.00 0.00 H new ATOM 0 HB2 LYS A 497 9.249 -1.708 3.672 1.00 0.00 H new ATOM 0 HB3 LYS A 497 8.229 -0.548 4.498 1.00 0.00 H new ATOM 0 HG2 LYS A 497 9.570 -2.709 6.107 1.00 0.00 H new ATOM 0 HG3 LYS A 497 10.522 -1.347 5.552 1.00 0.00 H new ATOM 0 HD2 LYS A 497 7.880 -0.799 6.889 1.00 0.00 H new ATOM 0 HD3 LYS A 497 9.236 -1.285 7.888 1.00 0.00 H new ATOM 0 HE2 LYS A 497 10.497 0.590 6.418 1.00 0.00 H new ATOM 0 HE3 LYS A 497 8.866 1.212 6.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 9.991 2.164 8.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 8.674 1.225 8.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 10.254 0.623 8.834 1.00 0.00 H new ATOM 1041 N ILE A 498 5.173 -1.916 4.134 1.00 0.00 N ATOM 1042 CA ILE A 498 4.040 -1.449 3.344 1.00 0.00 C ATOM 1043 C ILE A 498 3.677 -0.012 3.702 1.00 0.00 C ATOM 1044 O ILE A 498 3.494 0.321 4.874 1.00 0.00 O ATOM 1045 CB ILE A 498 2.804 -2.345 3.548 1.00 0.00 C ATOM 1046 CG1 ILE A 498 3.140 -3.799 3.210 1.00 0.00 C ATOM 1047 CG2 ILE A 498 1.646 -1.851 2.693 1.00 0.00 C ATOM 1048 CD1 ILE A 498 2.150 -4.794 3.773 1.00 0.00 C ATOM 0 H ILE A 498 4.954 -2.111 5.111 1.00 0.00 H new ATOM 0 HA ILE A 498 4.343 -1.495 2.298 1.00 0.00 H new ATOM 0 HB ILE A 498 2.505 -2.295 4.595 1.00 0.00 H new ATOM 0 HG12 ILE A 498 3.180 -3.912 2.127 1.00 0.00 H new ATOM 0 HG13 ILE A 498 4.134 -4.032 3.592 1.00 0.00 H new ATOM 0 HG21 ILE A 498 0.779 -2.494 2.848 1.00 0.00 H new ATOM 0 HG22 ILE A 498 1.395 -0.829 2.976 1.00 0.00 H new ATOM 0 HG23 ILE A 498 1.933 -1.876 1.642 1.00 0.00 H new ATOM 0 HD11 ILE A 498 2.451 -5.804 3.494 1.00 0.00 H new ATOM 0 HD12 ILE A 498 2.127 -4.709 4.859 1.00 0.00 H new ATOM 0 HD13 ILE A 498 1.158 -4.587 3.372 1.00 0.00 H new ATOM 1060 N PHE A 499 3.571 0.837 2.685 1.00 0.00 N ATOM 1061 CA PHE A 499 3.228 2.239 2.892 1.00 0.00 C ATOM 1062 C PHE A 499 1.783 2.511 2.485 1.00 0.00 C ATOM 1063 O PHE A 499 1.378 2.223 1.359 1.00 0.00 O ATOM 1064 CB PHE A 499 4.173 3.140 2.094 1.00 0.00 C ATOM 1065 CG PHE A 499 5.624 2.915 2.408 1.00 0.00 C ATOM 1066 CD1 PHE A 499 6.228 3.572 3.467 1.00 0.00 C ATOM 1067 CD2 PHE A 499 6.385 2.044 1.643 1.00 0.00 C ATOM 1068 CE1 PHE A 499 7.564 3.367 3.758 1.00 0.00 C ATOM 1069 CE2 PHE A 499 7.721 1.835 1.929 1.00 0.00 C ATOM 1070 CZ PHE A 499 8.311 2.496 2.988 1.00 0.00 C ATOM 0 H PHE A 499 3.718 0.578 1.709 1.00 0.00 H new ATOM 0 HA PHE A 499 3.336 2.461 3.954 1.00 0.00 H new ATOM 0 HB2 PHE A 499 4.010 2.972 1.030 1.00 0.00 H new ATOM 0 HB3 PHE A 499 3.924 4.182 2.294 1.00 0.00 H new ATOM 0 HD1 PHE A 499 5.648 4.253 4.073 1.00 0.00 H new ATOM 0 HD2 PHE A 499 5.929 1.523 0.814 1.00 0.00 H new ATOM 0 HE1 PHE A 499 8.023 3.887 4.586 1.00 0.00 H new ATOM 0 HE2 PHE A 499 8.303 1.155 1.325 1.00 0.00 H new ATOM 0 HZ PHE A 499 9.354 2.333 3.214 1.00 0.00 H new ATOM 1080 N VAL A 500 1.009 3.069 3.411 1.00 0.00 N ATOM 1081 CA VAL A 500 -0.391 3.381 3.150 1.00 0.00 C ATOM 1082 C VAL A 500 -0.721 4.811 3.562 1.00 0.00 C ATOM 1083 O VAL A 500 -0.905 5.099 4.744 1.00 0.00 O ATOM 1084 CB VAL A 500 -1.330 2.414 3.895 1.00 0.00 C ATOM 1085 CG1 VAL A 500 -2.781 2.835 3.717 1.00 0.00 C ATOM 1086 CG2 VAL A 500 -1.118 0.987 3.411 1.00 0.00 C ATOM 0 H VAL A 500 1.328 3.314 4.348 1.00 0.00 H new ATOM 0 HA VAL A 500 -0.545 3.270 2.077 1.00 0.00 H new ATOM 0 HB VAL A 500 -1.093 2.452 4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 500 -3.430 2.140 4.250 1.00 0.00 H new ATOM 0 HG12 VAL A 500 -2.920 3.840 4.116 1.00 0.00 H new ATOM 0 HG13 VAL A 500 -3.035 2.827 2.657 1.00 0.00 H new ATOM 0 HG21 VAL A 500 -1.790 0.317 3.948 1.00 0.00 H new ATOM 0 HG22 VAL A 500 -1.327 0.930 2.343 1.00 0.00 H new ATOM 0 HG23 VAL A 500 -0.086 0.690 3.595 1.00 0.00 H new ATOM 1096 N GLU A 501 -0.795 5.703 2.579 1.00 0.00 N ATOM 1097 CA GLU A 501 -1.104 7.104 2.840 1.00 0.00 C ATOM 1098 C GLU A 501 -2.554 7.417 2.486 1.00 0.00 C ATOM 1099 O GLU A 501 -3.087 6.910 1.498 1.00 0.00 O ATOM 1100 CB GLU A 501 -0.165 8.013 2.045 1.00 0.00 C ATOM 1101 CG GLU A 501 -0.368 9.492 2.325 1.00 0.00 C ATOM 1102 CD GLU A 501 0.183 10.376 1.222 1.00 0.00 C ATOM 1103 OE1 GLU A 501 0.005 10.025 0.037 1.00 0.00 O ATOM 1104 OE2 GLU A 501 0.792 11.417 1.544 1.00 0.00 O ATOM 0 H GLU A 501 -0.645 5.480 1.595 1.00 0.00 H new ATOM 0 HA GLU A 501 -0.961 7.288 3.905 1.00 0.00 H new ATOM 0 HB2 GLU A 501 0.866 7.746 2.276 1.00 0.00 H new ATOM 0 HB3 GLU A 501 -0.311 7.830 0.980 1.00 0.00 H new ATOM 0 HG2 GLU A 501 -1.432 9.692 2.448 1.00 0.00 H new ATOM 0 HG3 GLU A 501 0.116 9.749 3.267 1.00 0.00 H new ATOM 1111 N PHE A 502 -3.188 8.256 3.299 1.00 0.00 N ATOM 1112 CA PHE A 502 -4.578 8.636 3.073 1.00 0.00 C ATOM 1113 C PHE A 502 -4.684 10.114 2.707 1.00 0.00 C ATOM 1114 O PHE A 502 -3.679 10.821 2.638 1.00 0.00 O ATOM 1115 CB PHE A 502 -5.417 8.346 4.318 1.00 0.00 C ATOM 1116 CG PHE A 502 -5.421 6.897 4.714 1.00 0.00 C ATOM 1117 CD1 PHE A 502 -4.448 6.394 5.563 1.00 0.00 C ATOM 1118 CD2 PHE A 502 -6.398 6.037 4.237 1.00 0.00 C ATOM 1119 CE1 PHE A 502 -4.449 5.061 5.928 1.00 0.00 C ATOM 1120 CE2 PHE A 502 -6.404 4.703 4.599 1.00 0.00 C ATOM 1121 CZ PHE A 502 -5.429 4.215 5.447 1.00 0.00 C ATOM 0 H PHE A 502 -2.761 8.686 4.120 1.00 0.00 H new ATOM 0 HA PHE A 502 -4.960 8.045 2.241 1.00 0.00 H new ATOM 0 HB2 PHE A 502 -5.037 8.940 5.149 1.00 0.00 H new ATOM 0 HB3 PHE A 502 -6.443 8.668 4.138 1.00 0.00 H new ATOM 0 HD1 PHE A 502 -3.680 7.051 5.944 1.00 0.00 H new ATOM 0 HD2 PHE A 502 -7.163 6.414 3.575 1.00 0.00 H new ATOM 0 HE1 PHE A 502 -3.684 4.681 6.589 1.00 0.00 H new ATOM 0 HE2 PHE A 502 -7.170 4.043 4.219 1.00 0.00 H new ATOM 0 HZ PHE A 502 -5.433 3.174 5.733 1.00 0.00 H new ATOM 1131 N SER A 503 -5.910 10.572 2.473 1.00 0.00 N ATOM 1132 CA SER A 503 -6.148 11.964 2.109 1.00 0.00 C ATOM 1133 C SER A 503 -5.853 12.891 3.285 1.00 0.00 C ATOM 1134 O SER A 503 -5.162 13.899 3.136 1.00 0.00 O ATOM 1135 CB SER A 503 -7.595 12.152 1.648 1.00 0.00 C ATOM 1136 OG SER A 503 -7.798 13.452 1.122 1.00 0.00 O ATOM 0 H SER A 503 -6.753 10.000 2.529 1.00 0.00 H new ATOM 0 HA SER A 503 -5.476 12.220 1.289 1.00 0.00 H new ATOM 0 HB2 SER A 503 -7.838 11.408 0.890 1.00 0.00 H new ATOM 0 HB3 SER A 503 -8.272 11.986 2.486 1.00 0.00 H new ATOM 0 HG SER A 503 -8.730 13.546 0.833 1.00 0.00 H new ATOM 1142 N ILE A 504 -6.382 12.541 4.453 1.00 0.00 N ATOM 1143 CA ILE A 504 -6.175 13.340 5.654 1.00 0.00 C ATOM 1144 C ILE A 504 -5.459 12.535 6.733 1.00 0.00 C ATOM 1145 O ILE A 504 -5.355 11.312 6.643 1.00 0.00 O ATOM 1146 CB ILE A 504 -7.509 13.862 6.220 1.00 0.00 C ATOM 1147 CG1 ILE A 504 -8.440 12.694 6.550 1.00 0.00 C ATOM 1148 CG2 ILE A 504 -8.170 14.809 5.229 1.00 0.00 C ATOM 1149 CD1 ILE A 504 -9.652 13.098 7.360 1.00 0.00 C ATOM 0 H ILE A 504 -6.957 11.710 4.593 1.00 0.00 H new ATOM 0 HA ILE A 504 -5.555 14.189 5.365 1.00 0.00 H new ATOM 0 HB ILE A 504 -7.306 14.412 7.139 1.00 0.00 H new ATOM 0 HG12 ILE A 504 -8.772 12.231 5.621 1.00 0.00 H new ATOM 0 HG13 ILE A 504 -7.880 11.938 7.101 1.00 0.00 H new ATOM 0 HG21 ILE A 504 -9.112 15.170 5.643 1.00 0.00 H new ATOM 0 HG22 ILE A 504 -7.510 15.655 5.038 1.00 0.00 H new ATOM 0 HG23 ILE A 504 -8.363 14.282 4.295 1.00 0.00 H new ATOM 0 HD11 ILE A 504 -10.267 12.220 7.557 1.00 0.00 H new ATOM 0 HD12 ILE A 504 -9.329 13.534 8.305 1.00 0.00 H new ATOM 0 HD13 ILE A 504 -10.234 13.831 6.802 1.00 0.00 H new ATOM 1161 N ALA A 505 -4.968 13.230 7.754 1.00 0.00 N ATOM 1162 CA ALA A 505 -4.265 12.579 8.853 1.00 0.00 C ATOM 1163 C ALA A 505 -5.233 11.810 9.746 1.00 0.00 C ATOM 1164 O ALA A 505 -4.893 10.758 10.286 1.00 0.00 O ATOM 1165 CB ALA A 505 -3.495 13.607 9.669 1.00 0.00 C ATOM 0 H ALA A 505 -5.044 14.243 7.843 1.00 0.00 H new ATOM 0 HA ALA A 505 -3.559 11.865 8.428 1.00 0.00 H new ATOM 0 HB1 ALA A 505 -2.975 13.107 10.486 1.00 0.00 H new ATOM 0 HB2 ALA A 505 -2.769 14.109 9.030 1.00 0.00 H new ATOM 0 HB3 ALA A 505 -4.189 14.342 10.076 1.00 0.00 H new ATOM 1171 N SER A 506 -6.442 12.343 9.897 1.00 0.00 N ATOM 1172 CA SER A 506 -7.458 11.709 10.729 1.00 0.00 C ATOM 1173 C SER A 506 -7.589 10.227 10.392 1.00 0.00 C ATOM 1174 O SER A 506 -7.341 9.364 11.233 1.00 0.00 O ATOM 1175 CB SER A 506 -8.807 12.407 10.543 1.00 0.00 C ATOM 1176 OG SER A 506 -9.611 12.278 11.703 1.00 0.00 O ATOM 0 H SER A 506 -6.741 13.212 9.454 1.00 0.00 H new ATOM 0 HA SER A 506 -7.149 11.801 11.770 1.00 0.00 H new ATOM 0 HB2 SER A 506 -8.647 13.462 10.323 1.00 0.00 H new ATOM 0 HB3 SER A 506 -9.327 11.978 9.686 1.00 0.00 H new ATOM 0 HG SER A 506 -10.467 12.734 11.560 1.00 0.00 H new ATOM 1182 N GLU A 507 -7.980 9.940 9.154 1.00 0.00 N ATOM 1183 CA GLU A 507 -8.144 8.563 8.705 1.00 0.00 C ATOM 1184 C GLU A 507 -6.931 7.718 9.085 1.00 0.00 C ATOM 1185 O GLU A 507 -7.067 6.641 9.667 1.00 0.00 O ATOM 1186 CB GLU A 507 -8.356 8.518 7.190 1.00 0.00 C ATOM 1187 CG GLU A 507 -9.514 9.378 6.712 1.00 0.00 C ATOM 1188 CD GLU A 507 -10.859 8.858 7.181 1.00 0.00 C ATOM 1189 OE1 GLU A 507 -11.035 8.688 8.405 1.00 0.00 O ATOM 1190 OE2 GLU A 507 -11.735 8.622 6.323 1.00 0.00 O ATOM 0 H GLU A 507 -8.189 10.643 8.445 1.00 0.00 H new ATOM 0 HA GLU A 507 -9.023 8.150 9.200 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -7.442 8.845 6.694 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -8.531 7.486 6.887 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -9.377 10.398 7.072 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -9.505 9.421 5.623 1.00 0.00 H new ATOM 1197 N THR A 508 -5.744 8.214 8.752 1.00 0.00 N ATOM 1198 CA THR A 508 -4.507 7.506 9.056 1.00 0.00 C ATOM 1199 C THR A 508 -4.410 7.183 10.543 1.00 0.00 C ATOM 1200 O THR A 508 -4.309 6.018 10.929 1.00 0.00 O ATOM 1201 CB THR A 508 -3.272 8.328 8.640 1.00 0.00 C ATOM 1202 OG1 THR A 508 -3.570 9.101 7.471 1.00 0.00 O ATOM 1203 CG2 THR A 508 -2.085 7.418 8.363 1.00 0.00 C ATOM 0 H THR A 508 -5.613 9.104 8.271 1.00 0.00 H new ATOM 0 HA THR A 508 -4.526 6.578 8.485 1.00 0.00 H new ATOM 0 HB THR A 508 -3.013 8.996 9.461 1.00 0.00 H new ATOM 0 HG1 THR A 508 -3.983 9.949 7.736 1.00 0.00 H new ATOM 0 HG21 THR A 508 -1.225 8.021 8.071 1.00 0.00 H new ATOM 0 HG22 THR A 508 -1.843 6.852 9.262 1.00 0.00 H new ATOM 0 HG23 THR A 508 -2.335 6.729 7.557 1.00 0.00 H new ATOM 1211 N HIS A 509 -4.441 8.221 11.373 1.00 0.00 N ATOM 1212 CA HIS A 509 -4.358 8.046 12.819 1.00 0.00 C ATOM 1213 C HIS A 509 -5.223 6.875 13.275 1.00 0.00 C ATOM 1214 O HIS A 509 -4.800 6.060 14.096 1.00 0.00 O ATOM 1215 CB HIS A 509 -4.792 9.325 13.534 1.00 0.00 C ATOM 1216 CG HIS A 509 -3.685 10.318 13.711 1.00 0.00 C ATOM 1217 ND1 HIS A 509 -3.146 10.634 14.940 1.00 0.00 N ATOM 1218 CD2 HIS A 509 -3.013 11.066 12.804 1.00 0.00 C ATOM 1219 CE1 HIS A 509 -2.193 11.535 14.782 1.00 0.00 C ATOM 1220 NE2 HIS A 509 -2.092 11.814 13.495 1.00 0.00 N ATOM 0 H HIS A 509 -4.523 9.191 11.069 1.00 0.00 H new ATOM 0 HA HIS A 509 -3.321 7.830 13.075 1.00 0.00 H new ATOM 0 HB2 HIS A 509 -5.600 9.791 12.969 1.00 0.00 H new ATOM 0 HB3 HIS A 509 -5.196 9.065 14.513 1.00 0.00 H new ATOM 0 HD2 HIS A 509 -3.172 11.073 11.736 1.00 0.00 H new ATOM 0 HE1 HIS A 509 -1.598 11.970 15.571 1.00 0.00 H new ATOM 0 HE2 HIS A 509 -1.436 12.477 13.082 1.00 0.00 H new ATOM 1228 N LYS A 510 -6.436 6.797 12.739 1.00 0.00 N ATOM 1229 CA LYS A 510 -7.361 5.727 13.090 1.00 0.00 C ATOM 1230 C LYS A 510 -6.810 4.370 12.663 1.00 0.00 C ATOM 1231 O LYS A 510 -6.573 3.496 13.497 1.00 0.00 O ATOM 1232 CB LYS A 510 -8.722 5.965 12.432 1.00 0.00 C ATOM 1233 CG LYS A 510 -9.740 4.878 12.730 1.00 0.00 C ATOM 1234 CD LYS A 510 -11.163 5.389 12.576 1.00 0.00 C ATOM 1235 CE LYS A 510 -11.658 6.052 13.852 1.00 0.00 C ATOM 1236 NZ LYS A 510 -11.200 7.465 13.956 1.00 0.00 N ATOM 0 H LYS A 510 -6.802 7.463 12.059 1.00 0.00 H new ATOM 0 HA LYS A 510 -7.482 5.727 14.173 1.00 0.00 H new ATOM 0 HB2 LYS A 510 -9.117 6.923 12.770 1.00 0.00 H new ATOM 0 HB3 LYS A 510 -8.587 6.038 11.353 1.00 0.00 H new ATOM 0 HG2 LYS A 510 -9.581 4.035 12.058 1.00 0.00 H new ATOM 0 HG3 LYS A 510 -9.593 4.509 13.745 1.00 0.00 H new ATOM 0 HD2 LYS A 510 -11.207 6.102 11.753 1.00 0.00 H new ATOM 0 HD3 LYS A 510 -11.822 4.561 12.316 1.00 0.00 H new ATOM 0 HE2 LYS A 510 -12.747 6.020 13.879 1.00 0.00 H new ATOM 0 HE3 LYS A 510 -11.301 5.490 14.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 -11.945 8.039 14.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 -10.337 7.509 14.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 -10.998 7.835 13.005 1.00 0.00 H new ATOM 1250 N ALA A 511 -6.606 4.201 11.361 1.00 0.00 N ATOM 1251 CA ALA A 511 -6.080 2.952 10.825 1.00 0.00 C ATOM 1252 C ALA A 511 -4.938 2.424 11.687 1.00 0.00 C ATOM 1253 O ALA A 511 -4.809 1.216 11.890 1.00 0.00 O ATOM 1254 CB ALA A 511 -5.614 3.148 9.390 1.00 0.00 C ATOM 0 H ALA A 511 -6.797 4.914 10.657 1.00 0.00 H new ATOM 0 HA ALA A 511 -6.882 2.213 10.837 1.00 0.00 H new ATOM 0 HB1 ALA A 511 -5.224 2.207 9.002 1.00 0.00 H new ATOM 0 HB2 ALA A 511 -6.454 3.473 8.776 1.00 0.00 H new ATOM 0 HB3 ALA A 511 -4.830 3.905 9.362 1.00 0.00 H new ATOM 1260 N ILE A 512 -4.111 3.335 12.189 1.00 0.00 N ATOM 1261 CA ILE A 512 -2.980 2.960 13.028 1.00 0.00 C ATOM 1262 C ILE A 512 -3.444 2.535 14.417 1.00 0.00 C ATOM 1263 O ILE A 512 -3.067 1.471 14.909 1.00 0.00 O ATOM 1264 CB ILE A 512 -1.974 4.117 13.167 1.00 0.00 C ATOM 1265 CG1 ILE A 512 -1.530 4.605 11.787 1.00 0.00 C ATOM 1266 CG2 ILE A 512 -0.772 3.678 13.991 1.00 0.00 C ATOM 1267 CD1 ILE A 512 -1.015 6.028 11.785 1.00 0.00 C ATOM 0 H ILE A 512 -4.203 4.338 12.029 1.00 0.00 H new ATOM 0 HA ILE A 512 -2.489 2.119 12.538 1.00 0.00 H new ATOM 0 HB ILE A 512 -2.463 4.943 13.684 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -0.749 3.944 11.411 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -2.370 4.530 11.097 1.00 0.00 H new ATOM 0 HG21 ILE A 512 -0.070 4.507 14.080 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -1.103 3.374 14.984 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -0.281 2.838 13.499 1.00 0.00 H new ATOM 0 HD11 ILE A 512 -0.718 6.306 10.774 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -1.801 6.700 12.130 1.00 0.00 H new ATOM 0 HD13 ILE A 512 -0.154 6.104 12.450 1.00 0.00 H new ATOM 1279 N GLN A 513 -4.265 3.371 15.043 1.00 0.00 N ATOM 1280 CA GLN A 513 -4.782 3.081 16.375 1.00 0.00 C ATOM 1281 C GLN A 513 -5.351 1.668 16.442 1.00 0.00 C ATOM 1282 O GLN A 513 -5.339 1.033 17.496 1.00 0.00 O ATOM 1283 CB GLN A 513 -5.859 4.097 16.760 1.00 0.00 C ATOM 1284 CG GLN A 513 -5.314 5.492 17.021 1.00 0.00 C ATOM 1285 CD GLN A 513 -4.686 5.626 18.395 1.00 0.00 C ATOM 1286 OE1 GLN A 513 -3.855 4.808 18.792 1.00 0.00 O ATOM 1287 NE2 GLN A 513 -5.081 6.660 19.128 1.00 0.00 N ATOM 0 H GLN A 513 -4.587 4.255 14.649 1.00 0.00 H new ATOM 0 HA GLN A 513 -3.956 3.154 17.082 1.00 0.00 H new ATOM 0 HB2 GLN A 513 -6.600 4.149 15.962 1.00 0.00 H new ATOM 0 HB3 GLN A 513 -6.376 3.745 17.653 1.00 0.00 H new ATOM 0 HG2 GLN A 513 -4.572 5.736 16.261 1.00 0.00 H new ATOM 0 HG3 GLN A 513 -6.121 6.218 16.922 1.00 0.00 H new ATOM 0 HE21 GLN A 513 -5.772 7.313 18.758 1.00 0.00 H new ATOM 0 HE22 GLN A 513 -4.693 6.802 20.061 1.00 0.00 H new ATOM 1296 N ALA A 514 -5.850 1.182 15.310 1.00 0.00 N ATOM 1297 CA ALA A 514 -6.422 -0.157 15.240 1.00 0.00 C ATOM 1298 C ALA A 514 -5.391 -1.170 14.756 1.00 0.00 C ATOM 1299 O ALA A 514 -5.140 -2.180 15.416 1.00 0.00 O ATOM 1300 CB ALA A 514 -7.640 -0.163 14.328 1.00 0.00 C ATOM 0 H ALA A 514 -5.870 1.696 14.429 1.00 0.00 H new ATOM 0 HA ALA A 514 -6.732 -0.446 16.244 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -8.057 -1.169 14.285 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -8.390 0.525 14.718 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -7.346 0.151 13.326 1.00 0.00 H new ATOM 1306 N LEU A 515 -4.796 -0.896 13.601 1.00 0.00 N ATOM 1307 CA LEU A 515 -3.791 -1.785 13.028 1.00 0.00 C ATOM 1308 C LEU A 515 -2.544 -1.834 13.904 1.00 0.00 C ATOM 1309 O LEU A 515 -1.649 -2.649 13.683 1.00 0.00 O ATOM 1310 CB LEU A 515 -3.419 -1.324 11.617 1.00 0.00 C ATOM 1311 CG LEU A 515 -4.514 -1.454 10.558 1.00 0.00 C ATOM 1312 CD1 LEU A 515 -4.302 -0.441 9.444 1.00 0.00 C ATOM 1313 CD2 LEU A 515 -4.546 -2.868 9.996 1.00 0.00 C ATOM 0 H LEU A 515 -4.992 -0.065 13.042 1.00 0.00 H new ATOM 0 HA LEU A 515 -4.216 -2.788 12.976 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -3.112 -0.279 11.667 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -2.552 -1.896 11.286 1.00 0.00 H new ATOM 0 HG LEU A 515 -5.475 -1.249 11.029 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -5.091 -0.548 8.700 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -4.329 0.567 9.859 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -3.334 -0.614 8.974 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -5.331 -2.943 9.244 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -3.583 -3.100 9.540 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -4.746 -3.575 10.801 1.00 0.00 H new ATOM 1325 N ASN A 516 -2.493 -0.958 14.902 1.00 0.00 N ATOM 1326 CA ASN A 516 -1.356 -0.903 15.814 1.00 0.00 C ATOM 1327 C ASN A 516 -1.241 -2.194 16.618 1.00 0.00 C ATOM 1328 O ASN A 516 -0.272 -2.399 17.348 1.00 0.00 O ATOM 1329 CB ASN A 516 -1.493 0.291 16.761 1.00 0.00 C ATOM 1330 CG ASN A 516 -0.838 0.040 18.106 1.00 0.00 C ATOM 1331 OD1 ASN A 516 0.363 0.255 18.274 1.00 0.00 O ATOM 1332 ND2 ASN A 516 -1.626 -0.418 19.072 1.00 0.00 N ATOM 0 H ASN A 516 -3.226 -0.276 15.100 1.00 0.00 H new ATOM 0 HA ASN A 516 -0.450 -0.785 15.220 1.00 0.00 H new ATOM 0 HB2 ASN A 516 -1.044 1.171 16.300 1.00 0.00 H new ATOM 0 HB3 ASN A 516 -2.550 0.514 16.910 1.00 0.00 H new ATOM 0 HD21 ASN A 516 -1.241 -0.606 19.998 1.00 0.00 H new ATOM 0 HD22 ASN A 516 -2.616 -0.582 18.888 1.00 0.00 H new ATOM 1339 N GLY A 517 -2.237 -3.063 16.478 1.00 0.00 N ATOM 1340 CA GLY A 517 -2.228 -4.324 17.197 1.00 0.00 C ATOM 1341 C GLY A 517 -3.283 -5.288 16.689 1.00 0.00 C ATOM 1342 O GLY A 517 -3.837 -6.073 17.459 1.00 0.00 O ATOM 0 H GLY A 517 -3.050 -2.917 15.880 1.00 0.00 H new ATOM 0 HA2 GLY A 517 -1.244 -4.785 17.104 1.00 0.00 H new ATOM 0 HA3 GLY A 517 -2.393 -4.135 18.258 1.00 0.00 H new ATOM 1346 N ARG A 518 -3.561 -5.229 15.391 1.00 0.00 N ATOM 1347 CA ARG A 518 -4.558 -6.101 14.783 1.00 0.00 C ATOM 1348 C ARG A 518 -4.068 -7.546 14.750 1.00 0.00 C ATOM 1349 O ARG A 518 -2.864 -7.804 14.746 1.00 0.00 O ATOM 1350 CB ARG A 518 -4.882 -5.629 13.364 1.00 0.00 C ATOM 1351 CG ARG A 518 -6.025 -4.629 13.302 1.00 0.00 C ATOM 1352 CD ARG A 518 -7.377 -5.325 13.345 1.00 0.00 C ATOM 1353 NE ARG A 518 -7.746 -5.719 14.701 1.00 0.00 N ATOM 1354 CZ ARG A 518 -8.744 -6.551 14.978 1.00 0.00 C ATOM 1355 NH1 ARG A 518 -9.468 -7.074 13.998 1.00 0.00 N ATOM 1356 NH2 ARG A 518 -9.019 -6.863 16.239 1.00 0.00 N ATOM 0 H ARG A 518 -3.110 -4.586 14.740 1.00 0.00 H new ATOM 0 HA ARG A 518 -5.463 -6.055 15.389 1.00 0.00 H new ATOM 0 HB2 ARG A 518 -3.991 -5.177 12.928 1.00 0.00 H new ATOM 0 HB3 ARG A 518 -5.134 -6.494 12.751 1.00 0.00 H new ATOM 0 HG2 ARG A 518 -5.946 -3.933 14.137 1.00 0.00 H new ATOM 0 HG3 ARG A 518 -5.946 -4.041 12.388 1.00 0.00 H new ATOM 0 HD2 ARG A 518 -8.140 -4.660 12.940 1.00 0.00 H new ATOM 0 HD3 ARG A 518 -7.351 -6.207 12.705 1.00 0.00 H new ATOM 0 HE ARG A 518 -7.209 -5.335 15.478 1.00 0.00 H new ATOM 0 HH11 ARG A 518 -9.259 -6.838 13.028 1.00 0.00 H new ATOM 0 HH12 ARG A 518 -10.234 -7.712 14.214 1.00 0.00 H new ATOM 0 HH21 ARG A 518 -8.464 -6.464 16.996 1.00 0.00 H new ATOM 0 HH22 ARG A 518 -9.785 -7.502 16.451 1.00 0.00 H new ATOM 1370 N TRP A 519 -5.009 -8.483 14.727 1.00 0.00 N ATOM 1371 CA TRP A 519 -4.673 -9.902 14.695 1.00 0.00 C ATOM 1372 C TRP A 519 -4.957 -10.499 13.321 1.00 0.00 C ATOM 1373 O TRP A 519 -6.110 -10.577 12.895 1.00 0.00 O ATOM 1374 CB TRP A 519 -5.461 -10.658 15.766 1.00 0.00 C ATOM 1375 CG TRP A 519 -4.725 -10.787 17.066 1.00 0.00 C ATOM 1376 CD1 TRP A 519 -4.915 -10.040 18.193 1.00 0.00 C ATOM 1377 CD2 TRP A 519 -3.681 -11.718 17.370 1.00 0.00 C ATOM 1378 NE1 TRP A 519 -4.052 -10.450 19.180 1.00 0.00 N ATOM 1379 CE2 TRP A 519 -3.285 -11.479 18.701 1.00 0.00 C ATOM 1380 CE3 TRP A 519 -3.043 -12.732 16.650 1.00 0.00 C ATOM 1381 CZ2 TRP A 519 -2.280 -12.216 19.322 1.00 0.00 C ATOM 1382 CZ3 TRP A 519 -2.046 -13.462 17.268 1.00 0.00 C ATOM 1383 CH2 TRP A 519 -1.673 -13.202 18.593 1.00 0.00 C ATOM 0 H TRP A 519 -6.010 -8.286 14.730 1.00 0.00 H new ATOM 0 HA TRP A 519 -3.607 -10.002 14.900 1.00 0.00 H new ATOM 0 HB2 TRP A 519 -6.406 -10.144 15.941 1.00 0.00 H new ATOM 0 HB3 TRP A 519 -5.703 -11.653 15.394 1.00 0.00 H new ATOM 0 HD1 TRP A 519 -5.638 -9.244 18.294 1.00 0.00 H new ATOM 0 HE1 TRP A 519 -3.992 -10.053 20.118 1.00 0.00 H new ATOM 0 HE3 TRP A 519 -3.324 -12.941 15.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 519 -1.990 -12.016 20.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 519 -1.546 -14.247 16.720 1.00 0.00 H new ATOM 0 HH2 TRP A 519 -0.891 -13.791 19.048 1.00 0.00 H new ATOM 1394 N PHE A 520 -3.901 -10.918 12.633 1.00 0.00 N ATOM 1395 CA PHE A 520 -4.039 -11.507 11.305 1.00 0.00 C ATOM 1396 C PHE A 520 -4.366 -12.994 11.402 1.00 0.00 C ATOM 1397 O PHE A 520 -4.092 -13.636 12.415 1.00 0.00 O ATOM 1398 CB PHE A 520 -2.753 -11.307 10.500 1.00 0.00 C ATOM 1399 CG PHE A 520 -2.921 -11.562 9.030 1.00 0.00 C ATOM 1400 CD1 PHE A 520 -2.906 -12.855 8.531 1.00 0.00 C ATOM 1401 CD2 PHE A 520 -3.093 -10.510 8.145 1.00 0.00 C ATOM 1402 CE1 PHE A 520 -3.061 -13.094 7.179 1.00 0.00 C ATOM 1403 CE2 PHE A 520 -3.249 -10.742 6.792 1.00 0.00 C ATOM 1404 CZ PHE A 520 -3.231 -12.036 6.308 1.00 0.00 C ATOM 0 H PHE A 520 -2.941 -10.861 12.972 1.00 0.00 H new ATOM 0 HA PHE A 520 -4.861 -11.005 10.795 1.00 0.00 H new ATOM 0 HB2 PHE A 520 -2.398 -10.287 10.645 1.00 0.00 H new ATOM 0 HB3 PHE A 520 -1.982 -11.972 10.890 1.00 0.00 H new ATOM 0 HD1 PHE A 520 -2.771 -13.686 9.207 1.00 0.00 H new ATOM 0 HD2 PHE A 520 -3.105 -9.496 8.517 1.00 0.00 H new ATOM 0 HE1 PHE A 520 -3.049 -14.107 6.804 1.00 0.00 H new ATOM 0 HE2 PHE A 520 -3.385 -9.913 6.113 1.00 0.00 H new ATOM 0 HZ PHE A 520 -3.350 -12.220 5.250 1.00 0.00 H new ATOM 1414 N ALA A 521 -4.954 -13.534 10.339 1.00 0.00 N ATOM 1415 CA ALA A 521 -5.318 -14.945 10.302 1.00 0.00 C ATOM 1416 C ALA A 521 -4.121 -15.829 10.637 1.00 0.00 C ATOM 1417 O ALA A 521 -3.436 -16.327 9.745 1.00 0.00 O ATOM 1418 CB ALA A 521 -5.880 -15.310 8.937 1.00 0.00 C ATOM 0 H ALA A 521 -5.188 -13.016 9.492 1.00 0.00 H new ATOM 0 HA ALA A 521 -6.086 -15.116 11.056 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -6.147 -16.367 8.924 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -6.767 -14.709 8.736 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -5.129 -15.117 8.171 1.00 0.00 H new ATOM 1424 N GLY A 522 -3.875 -16.020 11.930 1.00 0.00 N ATOM 1425 CA GLY A 522 -2.760 -16.844 12.359 1.00 0.00 C ATOM 1426 C GLY A 522 -1.458 -16.070 12.421 1.00 0.00 C ATOM 1427 O GLY A 522 -0.377 -16.660 12.426 1.00 0.00 O ATOM 0 H GLY A 522 -4.428 -15.619 12.688 1.00 0.00 H new ATOM 0 HA2 GLY A 522 -2.978 -17.262 13.342 1.00 0.00 H new ATOM 0 HA3 GLY A 522 -2.648 -17.684 11.673 1.00 0.00 H new ATOM 1431 N ARG A 523 -1.560 -14.746 12.467 1.00 0.00 N ATOM 1432 CA ARG A 523 -0.381 -13.890 12.526 1.00 0.00 C ATOM 1433 C ARG A 523 -0.702 -12.569 13.220 1.00 0.00 C ATOM 1434 O ARG A 523 -1.862 -12.268 13.500 1.00 0.00 O ATOM 1435 CB ARG A 523 0.153 -13.622 11.117 1.00 0.00 C ATOM 1436 CG ARG A 523 0.988 -14.761 10.555 1.00 0.00 C ATOM 1437 CD ARG A 523 2.294 -14.923 11.317 1.00 0.00 C ATOM 1438 NE ARG A 523 2.147 -15.803 12.474 1.00 0.00 N ATOM 1439 CZ ARG A 523 2.952 -15.769 13.530 1.00 0.00 C ATOM 1440 NH1 ARG A 523 3.955 -14.903 13.575 1.00 0.00 N ATOM 1441 NH2 ARG A 523 2.754 -16.602 14.543 1.00 0.00 N ATOM 0 H ARG A 523 -2.447 -14.242 12.465 1.00 0.00 H new ATOM 0 HA ARG A 523 0.384 -14.408 13.104 1.00 0.00 H new ATOM 0 HB2 ARG A 523 -0.687 -13.435 10.449 1.00 0.00 H new ATOM 0 HB3 ARG A 523 0.756 -12.714 11.133 1.00 0.00 H new ATOM 0 HG2 ARG A 523 0.419 -15.689 10.604 1.00 0.00 H new ATOM 0 HG3 ARG A 523 1.200 -14.573 9.503 1.00 0.00 H new ATOM 0 HD2 ARG A 523 3.056 -15.326 10.649 1.00 0.00 H new ATOM 0 HD3 ARG A 523 2.645 -13.945 11.647 1.00 0.00 H new ATOM 0 HE ARG A 523 1.385 -16.481 12.471 1.00 0.00 H new ATOM 0 HH11 ARG A 523 4.110 -14.261 12.798 1.00 0.00 H new ATOM 0 HH12 ARG A 523 4.572 -14.879 14.387 1.00 0.00 H new ATOM 0 HH21 ARG A 523 1.983 -17.269 14.511 1.00 0.00 H new ATOM 0 HH22 ARG A 523 3.373 -16.575 15.354 1.00 0.00 H new ATOM 1455 N LYS A 524 0.335 -11.785 13.495 1.00 0.00 N ATOM 1456 CA LYS A 524 0.165 -10.496 14.155 1.00 0.00 C ATOM 1457 C LYS A 524 0.618 -9.356 13.248 1.00 0.00 C ATOM 1458 O LYS A 524 1.591 -9.489 12.506 1.00 0.00 O ATOM 1459 CB LYS A 524 0.954 -10.463 15.466 1.00 0.00 C ATOM 1460 CG LYS A 524 0.624 -9.269 16.345 1.00 0.00 C ATOM 1461 CD LYS A 524 0.796 -9.597 17.818 1.00 0.00 C ATOM 1462 CE LYS A 524 0.123 -8.558 18.703 1.00 0.00 C ATOM 1463 NZ LYS A 524 0.800 -8.431 20.023 1.00 0.00 N ATOM 0 H LYS A 524 1.302 -12.020 13.271 1.00 0.00 H new ATOM 0 HA LYS A 524 -0.895 -10.365 14.372 1.00 0.00 H new ATOM 0 HB2 LYS A 524 0.756 -11.379 16.023 1.00 0.00 H new ATOM 0 HB3 LYS A 524 2.020 -10.452 15.239 1.00 0.00 H new ATOM 0 HG2 LYS A 524 1.269 -8.432 16.080 1.00 0.00 H new ATOM 0 HG3 LYS A 524 -0.402 -8.952 16.159 1.00 0.00 H new ATOM 0 HD2 LYS A 524 0.374 -10.581 18.024 1.00 0.00 H new ATOM 0 HD3 LYS A 524 1.858 -9.649 18.059 1.00 0.00 H new ATOM 0 HE2 LYS A 524 0.129 -7.592 18.198 1.00 0.00 H new ATOM 0 HE3 LYS A 524 -0.921 -8.832 18.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 0.312 -7.714 20.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 0.773 -9.346 20.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 1.789 -8.145 19.880 1.00 0.00 H new ATOM 1477 N VAL A 525 -0.092 -8.235 13.314 1.00 0.00 N ATOM 1478 CA VAL A 525 0.239 -7.071 12.501 1.00 0.00 C ATOM 1479 C VAL A 525 0.743 -5.921 13.366 1.00 0.00 C ATOM 1480 O VAL A 525 0.441 -5.848 14.558 1.00 0.00 O ATOM 1481 CB VAL A 525 -0.977 -6.591 11.686 1.00 0.00 C ATOM 1482 CG1 VAL A 525 -0.645 -5.311 10.934 1.00 0.00 C ATOM 1483 CG2 VAL A 525 -1.439 -7.678 10.728 1.00 0.00 C ATOM 0 H VAL A 525 -0.901 -8.108 13.922 1.00 0.00 H new ATOM 0 HA VAL A 525 1.028 -7.379 11.815 1.00 0.00 H new ATOM 0 HB VAL A 525 -1.793 -6.377 12.376 1.00 0.00 H new ATOM 0 HG11 VAL A 525 -1.516 -4.987 10.364 1.00 0.00 H new ATOM 0 HG12 VAL A 525 -0.367 -4.533 11.645 1.00 0.00 H new ATOM 0 HG13 VAL A 525 0.186 -5.494 10.253 1.00 0.00 H new ATOM 0 HG21 VAL A 525 -2.299 -7.322 10.161 1.00 0.00 H new ATOM 0 HG22 VAL A 525 -0.629 -7.927 10.042 1.00 0.00 H new ATOM 0 HG23 VAL A 525 -1.721 -8.566 11.294 1.00 0.00 H new ATOM 1493 N VAL A 526 1.512 -5.023 12.759 1.00 0.00 N ATOM 1494 CA VAL A 526 2.057 -3.875 13.473 1.00 0.00 C ATOM 1495 C VAL A 526 2.039 -2.626 12.600 1.00 0.00 C ATOM 1496 O VAL A 526 2.806 -2.512 11.645 1.00 0.00 O ATOM 1497 CB VAL A 526 3.500 -4.139 13.942 1.00 0.00 C ATOM 1498 CG1 VAL A 526 4.122 -2.867 14.498 1.00 0.00 C ATOM 1499 CG2 VAL A 526 3.528 -5.253 14.978 1.00 0.00 C ATOM 0 H VAL A 526 1.772 -5.069 11.774 1.00 0.00 H new ATOM 0 HA VAL A 526 1.423 -3.715 14.345 1.00 0.00 H new ATOM 0 HB VAL A 526 4.090 -4.458 13.083 1.00 0.00 H new ATOM 0 HG11 VAL A 526 5.141 -3.073 14.824 1.00 0.00 H new ATOM 0 HG12 VAL A 526 4.137 -2.101 13.723 1.00 0.00 H new ATOM 0 HG13 VAL A 526 3.534 -2.515 15.345 1.00 0.00 H new ATOM 0 HG21 VAL A 526 4.555 -5.426 15.298 1.00 0.00 H new ATOM 0 HG22 VAL A 526 2.923 -4.965 15.838 1.00 0.00 H new ATOM 0 HG23 VAL A 526 3.125 -6.167 14.541 1.00 0.00 H new ATOM 1509 N ALA A 527 1.157 -1.689 12.935 1.00 0.00 N ATOM 1510 CA ALA A 527 1.040 -0.446 12.183 1.00 0.00 C ATOM 1511 C ALA A 527 1.609 0.728 12.972 1.00 0.00 C ATOM 1512 O ALA A 527 1.560 0.743 14.202 1.00 0.00 O ATOM 1513 CB ALA A 527 -0.414 -0.185 11.818 1.00 0.00 C ATOM 0 H ALA A 527 0.513 -1.768 13.722 1.00 0.00 H new ATOM 0 HA ALA A 527 1.620 -0.548 11.266 1.00 0.00 H new ATOM 0 HB1 ALA A 527 -0.487 0.747 11.257 1.00 0.00 H new ATOM 0 HB2 ALA A 527 -0.789 -1.007 11.208 1.00 0.00 H new ATOM 0 HB3 ALA A 527 -1.009 -0.108 12.728 1.00 0.00 H new ATOM 1519 N GLU A 528 2.148 1.710 12.257 1.00 0.00 N ATOM 1520 CA GLU A 528 2.728 2.888 12.892 1.00 0.00 C ATOM 1521 C GLU A 528 2.678 4.092 11.956 1.00 0.00 C ATOM 1522 O GLU A 528 2.349 3.962 10.776 1.00 0.00 O ATOM 1523 CB GLU A 528 4.174 2.611 13.308 1.00 0.00 C ATOM 1524 CG GLU A 528 5.142 2.549 12.139 1.00 0.00 C ATOM 1525 CD GLU A 528 6.588 2.707 12.570 1.00 0.00 C ATOM 1526 OE1 GLU A 528 6.984 2.064 13.564 1.00 0.00 O ATOM 1527 OE2 GLU A 528 7.322 3.473 11.911 1.00 0.00 O ATOM 0 H GLU A 528 2.195 1.714 11.238 1.00 0.00 H new ATOM 0 HA GLU A 528 2.139 3.116 13.781 1.00 0.00 H new ATOM 0 HB2 GLU A 528 4.500 3.389 13.998 1.00 0.00 H new ATOM 0 HB3 GLU A 528 4.212 1.667 13.851 1.00 0.00 H new ATOM 0 HG2 GLU A 528 5.023 1.596 11.623 1.00 0.00 H new ATOM 0 HG3 GLU A 528 4.892 3.332 11.423 1.00 0.00 H new ATOM 1534 N VAL A 529 3.007 5.264 12.490 1.00 0.00 N ATOM 1535 CA VAL A 529 3.000 6.491 11.702 1.00 0.00 C ATOM 1536 C VAL A 529 4.387 6.795 11.147 1.00 0.00 C ATOM 1537 O VAL A 529 5.311 7.116 11.896 1.00 0.00 O ATOM 1538 CB VAL A 529 2.520 7.692 12.539 1.00 0.00 C ATOM 1539 CG1 VAL A 529 3.529 8.023 13.628 1.00 0.00 C ATOM 1540 CG2 VAL A 529 2.272 8.898 11.645 1.00 0.00 C ATOM 0 H VAL A 529 3.282 5.390 13.464 1.00 0.00 H new ATOM 0 HA VAL A 529 2.307 6.333 10.875 1.00 0.00 H new ATOM 0 HB VAL A 529 1.579 7.425 13.020 1.00 0.00 H new ATOM 0 HG11 VAL A 529 3.172 8.874 14.208 1.00 0.00 H new ATOM 0 HG12 VAL A 529 3.651 7.162 14.285 1.00 0.00 H new ATOM 0 HG13 VAL A 529 4.488 8.271 13.173 1.00 0.00 H new ATOM 0 HG21 VAL A 529 1.933 9.738 12.252 1.00 0.00 H new ATOM 0 HG22 VAL A 529 3.196 9.169 11.135 1.00 0.00 H new ATOM 0 HG23 VAL A 529 1.508 8.653 10.907 1.00 0.00 H new ATOM 1550 N TYR A 530 4.527 6.693 9.831 1.00 0.00 N ATOM 1551 CA TYR A 530 5.802 6.955 9.174 1.00 0.00 C ATOM 1552 C TYR A 530 5.936 8.431 8.814 1.00 0.00 C ATOM 1553 O TYR A 530 4.963 9.184 8.861 1.00 0.00 O ATOM 1554 CB TYR A 530 5.938 6.096 7.915 1.00 0.00 C ATOM 1555 CG TYR A 530 7.341 6.065 7.352 1.00 0.00 C ATOM 1556 CD1 TYR A 530 8.312 5.234 7.898 1.00 0.00 C ATOM 1557 CD2 TYR A 530 7.695 6.866 6.274 1.00 0.00 C ATOM 1558 CE1 TYR A 530 9.595 5.203 7.387 1.00 0.00 C ATOM 1559 CE2 TYR A 530 8.976 6.841 5.755 1.00 0.00 C ATOM 1560 CZ TYR A 530 9.922 6.008 6.315 1.00 0.00 C ATOM 1561 OH TYR A 530 11.198 5.979 5.803 1.00 0.00 O ATOM 0 H TYR A 530 3.772 6.430 9.197 1.00 0.00 H new ATOM 0 HA TYR A 530 6.600 6.696 9.870 1.00 0.00 H new ATOM 0 HB2 TYR A 530 5.625 5.077 8.145 1.00 0.00 H new ATOM 0 HB3 TYR A 530 5.258 6.474 7.152 1.00 0.00 H new ATOM 0 HD1 TYR A 530 8.059 4.602 8.736 1.00 0.00 H new ATOM 0 HD2 TYR A 530 6.957 7.520 5.834 1.00 0.00 H new ATOM 0 HE1 TYR A 530 10.338 4.552 7.824 1.00 0.00 H new ATOM 0 HE2 TYR A 530 9.235 7.470 4.916 1.00 0.00 H new ATOM 0 HH TYR A 530 11.263 6.603 5.050 1.00 0.00 H new