USER MOD reduce.3.24.130724 H: found=0, std=0, add=639, rem=0, adj=15 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 6:sc= 1.09 USER MOD Set 1.2: A 508 THR OG1 : rot 84:sc= 0.466 USER MOD Single : A 444 SER OG : rot 44:sc= 0.217 USER MOD Single : A 447 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 451 ASN : amide:sc= 0.812 K(o=0.81,f=-0.65) USER MOD Single : A 452 MET CE :methyl -111:sc= -0.483 (180deg=-3.77!) USER MOD Single : A 456 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0238) USER MOD Single : A 467 THR OG1 : rot 75:sc= -0.402 USER MOD Single : A 470 CYS SG : rot 81:sc= -2.09! USER MOD Single : A 472 LYS NZ :NH3+ -126:sc= 0.13 (180deg=-0.0176) USER MOD Single : A 477 ASN : amide:sc= -0.544 X(o=-0.54,f=-0.56) USER MOD Single : A 482 TYR OH : rot 180:sc= 0 USER MOD Single : A 483 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 485 LYS NZ :NH3+ -156:sc= -0.0403 (180deg=-0.527) USER MOD Single : A 497 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0602) 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 X(o=0,f=-0.00016) USER MOD Single : A 510 LYS NZ :NH3+ -163:sc= -0.0172 (180deg=-0.204) USER MOD Single : A 513 GLN : amide:sc= -0.146 X(o=-0.15,f=-0.0068) USER MOD Single : A 516 ASN : amide:sc= -2.39! C(o=-2.4!,f=-1.3!) 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 1.433 13.719 10.043 1.00 0.00 N ATOM 205 CA SER A 444 1.852 12.544 9.287 1.00 0.00 C ATOM 206 C SER A 444 0.645 11.721 8.848 1.00 0.00 C ATOM 207 O SER A 444 0.035 11.014 9.651 1.00 0.00 O ATOM 208 CB SER A 444 2.795 11.680 10.127 1.00 0.00 C ATOM 209 OG SER A 444 2.268 11.463 11.424 1.00 0.00 O ATOM 0 HA SER A 444 2.380 12.885 8.397 1.00 0.00 H new ATOM 0 HB2 SER A 444 2.955 10.723 9.631 1.00 0.00 H new ATOM 0 HB3 SER A 444 3.768 12.166 10.203 1.00 0.00 H new ATOM 0 HG SER A 444 1.315 11.245 11.358 1.00 0.00 H new ATOM 215 N THR A 445 0.304 11.819 7.567 1.00 0.00 N ATOM 216 CA THR A 445 -0.830 11.086 7.020 1.00 0.00 C ATOM 217 C THR A 445 -0.374 9.813 6.315 1.00 0.00 C ATOM 218 O THR A 445 -1.144 9.184 5.589 1.00 0.00 O ATOM 219 CB THR A 445 -1.632 11.949 6.028 1.00 0.00 C ATOM 220 OG1 THR A 445 -2.607 11.145 5.354 1.00 0.00 O ATOM 221 CG2 THR A 445 -0.709 12.598 5.007 1.00 0.00 C ATOM 0 H THR A 445 0.798 12.399 6.889 1.00 0.00 H new ATOM 0 HA THR A 445 -1.471 10.823 7.861 1.00 0.00 H new ATOM 0 HB THR A 445 -2.137 12.735 6.590 1.00 0.00 H new ATOM 0 HG1 THR A 445 -2.607 10.242 5.736 1.00 0.00 H new ATOM 0 HG21 THR A 445 -1.298 13.203 4.317 1.00 0.00 H new ATOM 0 HG22 THR A 445 0.013 13.233 5.521 1.00 0.00 H new ATOM 0 HG23 THR A 445 -0.180 11.824 4.451 1.00 0.00 H new ATOM 229 N VAL A 446 0.882 9.438 6.535 1.00 0.00 N ATOM 230 CA VAL A 446 1.440 8.239 5.922 1.00 0.00 C ATOM 231 C VAL A 446 1.674 7.148 6.961 1.00 0.00 C ATOM 232 O VAL A 446 2.489 7.307 7.869 1.00 0.00 O ATOM 233 CB VAL A 446 2.768 8.542 5.204 1.00 0.00 C ATOM 234 CG1 VAL A 446 3.356 7.271 4.609 1.00 0.00 C ATOM 235 CG2 VAL A 446 2.564 9.598 4.129 1.00 0.00 C ATOM 0 H VAL A 446 1.532 9.947 7.133 1.00 0.00 H new ATOM 0 HA VAL A 446 0.711 7.889 5.190 1.00 0.00 H new ATOM 0 HB VAL A 446 3.475 8.933 5.936 1.00 0.00 H new ATOM 0 HG11 VAL A 446 4.294 7.505 4.106 1.00 0.00 H new ATOM 0 HG12 VAL A 446 3.541 6.549 5.404 1.00 0.00 H new ATOM 0 HG13 VAL A 446 2.655 6.847 3.890 1.00 0.00 H new ATOM 0 HG21 VAL A 446 3.513 9.799 3.632 1.00 0.00 H new ATOM 0 HG22 VAL A 446 1.841 9.238 3.398 1.00 0.00 H new ATOM 0 HG23 VAL A 446 2.192 10.515 4.586 1.00 0.00 H new ATOM 245 N MET A 447 0.953 6.041 6.821 1.00 0.00 N ATOM 246 CA MET A 447 1.084 4.922 7.748 1.00 0.00 C ATOM 247 C MET A 447 1.852 3.771 7.106 1.00 0.00 C ATOM 248 O MET A 447 1.830 3.600 5.887 1.00 0.00 O ATOM 249 CB MET A 447 -0.297 4.441 8.198 1.00 0.00 C ATOM 250 CG MET A 447 -0.288 3.045 8.800 1.00 0.00 C ATOM 251 SD MET A 447 -0.395 1.750 7.551 1.00 0.00 S ATOM 252 CE MET A 447 -2.160 1.719 7.246 1.00 0.00 C ATOM 0 H MET A 447 0.272 5.894 6.076 1.00 0.00 H new ATOM 0 HA MET A 447 1.642 5.267 8.618 1.00 0.00 H new ATOM 0 HB2 MET A 447 -0.695 5.142 8.932 1.00 0.00 H new ATOM 0 HB3 MET A 447 -0.974 4.455 7.344 1.00 0.00 H new ATOM 0 HG2 MET A 447 0.624 2.910 9.381 1.00 0.00 H new ATOM 0 HG3 MET A 447 -1.124 2.947 9.492 1.00 0.00 H new ATOM 0 HE1 MET A 447 -2.386 0.964 6.493 1.00 0.00 H new ATOM 0 HE2 MET A 447 -2.685 1.477 8.170 1.00 0.00 H new ATOM 0 HE3 MET A 447 -2.485 2.696 6.889 1.00 0.00 H new ATOM 262 N VAL A 448 2.531 2.984 7.934 1.00 0.00 N ATOM 263 CA VAL A 448 3.305 1.848 7.447 1.00 0.00 C ATOM 264 C VAL A 448 2.966 0.579 8.220 1.00 0.00 C ATOM 265 O VAL A 448 2.899 0.588 9.450 1.00 0.00 O ATOM 266 CB VAL A 448 4.819 2.113 7.556 1.00 0.00 C ATOM 267 CG1 VAL A 448 5.200 2.453 8.989 1.00 0.00 C ATOM 268 CG2 VAL A 448 5.607 0.911 7.056 1.00 0.00 C ATOM 0 H VAL A 448 2.561 3.112 8.945 1.00 0.00 H new ATOM 0 HA VAL A 448 3.041 1.712 6.398 1.00 0.00 H new ATOM 0 HB VAL A 448 5.067 2.968 6.927 1.00 0.00 H new ATOM 0 HG11 VAL A 448 6.273 2.637 9.046 1.00 0.00 H new ATOM 0 HG12 VAL A 448 4.661 3.346 9.307 1.00 0.00 H new ATOM 0 HG13 VAL A 448 4.939 1.620 9.642 1.00 0.00 H new ATOM 0 HG21 VAL A 448 6.674 1.115 7.140 1.00 0.00 H new ATOM 0 HG22 VAL A 448 5.356 0.036 7.656 1.00 0.00 H new ATOM 0 HG23 VAL A 448 5.355 0.719 6.013 1.00 0.00 H new ATOM 278 N LEU A 449 2.752 -0.511 7.492 1.00 0.00 N ATOM 279 CA LEU A 449 2.419 -1.790 8.110 1.00 0.00 C ATOM 280 C LEU A 449 3.627 -2.722 8.116 1.00 0.00 C ATOM 281 O LEU A 449 4.385 -2.778 7.148 1.00 0.00 O ATOM 282 CB LEU A 449 1.255 -2.450 7.367 1.00 0.00 C ATOM 283 CG LEU A 449 -0.101 -1.757 7.495 1.00 0.00 C ATOM 284 CD1 LEU A 449 -1.189 -2.586 6.832 1.00 0.00 C ATOM 285 CD2 LEU A 449 -0.437 -1.507 8.958 1.00 0.00 C ATOM 0 H LEU A 449 2.803 -0.535 6.474 1.00 0.00 H new ATOM 0 HA LEU A 449 2.123 -1.601 9.142 1.00 0.00 H new ATOM 0 HB2 LEU A 449 1.512 -2.509 6.309 1.00 0.00 H new ATOM 0 HB3 LEU A 449 1.153 -3.473 7.728 1.00 0.00 H new ATOM 0 HG LEU A 449 -0.044 -0.795 6.986 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -2.147 -2.077 6.933 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.956 -2.714 5.775 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.245 -3.563 7.312 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -1.406 -1.013 9.029 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -0.474 -2.457 9.490 1.00 0.00 H new ATOM 0 HD23 LEU A 449 0.328 -0.871 9.404 1.00 0.00 H new ATOM 297 N ARG A 450 3.797 -3.454 9.212 1.00 0.00 N ATOM 298 CA ARG A 450 4.912 -4.384 9.344 1.00 0.00 C ATOM 299 C ARG A 450 4.426 -5.751 9.816 1.00 0.00 C ATOM 300 O ARG A 450 3.353 -5.870 10.406 1.00 0.00 O ATOM 301 CB ARG A 450 5.950 -3.834 10.324 1.00 0.00 C ATOM 302 CG ARG A 450 6.312 -2.379 10.074 1.00 0.00 C ATOM 303 CD ARG A 450 7.344 -1.882 11.074 1.00 0.00 C ATOM 304 NE ARG A 450 6.738 -1.519 12.352 1.00 0.00 N ATOM 305 CZ ARG A 450 7.435 -1.321 13.466 1.00 0.00 C ATOM 306 NH1 ARG A 450 8.754 -1.449 13.458 1.00 0.00 N ATOM 307 NH2 ARG A 450 6.811 -0.993 14.590 1.00 0.00 N ATOM 0 H ARG A 450 3.177 -3.421 10.021 1.00 0.00 H new ATOM 0 HA ARG A 450 5.374 -4.500 8.363 1.00 0.00 H new ATOM 0 HB2 ARG A 450 5.568 -3.935 11.340 1.00 0.00 H new ATOM 0 HB3 ARG A 450 6.854 -4.440 10.261 1.00 0.00 H new ATOM 0 HG2 ARG A 450 6.702 -2.269 9.062 1.00 0.00 H new ATOM 0 HG3 ARG A 450 5.415 -1.763 10.139 1.00 0.00 H new ATOM 0 HD2 ARG A 450 8.094 -2.656 11.236 1.00 0.00 H new ATOM 0 HD3 ARG A 450 7.862 -1.017 10.660 1.00 0.00 H new ATOM 0 HE ARG A 450 5.724 -1.412 12.392 1.00 0.00 H new ATOM 0 HH11 ARG A 450 9.237 -1.700 12.595 1.00 0.00 H new ATOM 0 HH12 ARG A 450 9.286 -1.296 14.315 1.00 0.00 H new ATOM 0 HH21 ARG A 450 5.796 -0.893 14.599 1.00 0.00 H new ATOM 0 HH22 ARG A 450 7.346 -0.841 15.445 1.00 0.00 H new ATOM 321 N ASN A 451 5.223 -6.781 9.552 1.00 0.00 N ATOM 322 CA ASN A 451 4.874 -8.140 9.948 1.00 0.00 C ATOM 323 C ASN A 451 3.465 -8.497 9.485 1.00 0.00 C ATOM 324 O ASN A 451 2.766 -9.277 10.132 1.00 0.00 O ATOM 325 CB ASN A 451 4.977 -8.293 11.467 1.00 0.00 C ATOM 326 CG ASN A 451 5.305 -9.713 11.885 1.00 0.00 C ATOM 327 OD1 ASN A 451 6.449 -10.028 12.212 1.00 0.00 O ATOM 328 ND2 ASN A 451 4.298 -10.580 11.875 1.00 0.00 N ATOM 0 H ASN A 451 6.116 -6.700 9.065 1.00 0.00 H new ATOM 0 HA ASN A 451 5.578 -8.822 9.472 1.00 0.00 H new ATOM 0 HB2 ASN A 451 5.745 -7.619 11.846 1.00 0.00 H new ATOM 0 HB3 ASN A 451 4.035 -7.991 11.924 1.00 0.00 H new ATOM 0 HD21 ASN A 451 4.458 -11.550 12.146 1.00 0.00 H new ATOM 0 HD22 ASN A 451 3.365 -10.275 11.597 1.00 0.00 H new ATOM 335 N MET A 452 3.054 -7.921 8.359 1.00 0.00 N ATOM 336 CA MET A 452 1.729 -8.180 7.808 1.00 0.00 C ATOM 337 C MET A 452 1.679 -9.547 7.133 1.00 0.00 C ATOM 338 O MET A 452 1.026 -10.469 7.623 1.00 0.00 O ATOM 339 CB MET A 452 1.349 -7.089 6.805 1.00 0.00 C ATOM 340 CG MET A 452 -0.052 -7.248 6.237 1.00 0.00 C ATOM 341 SD MET A 452 -0.566 -5.829 5.250 1.00 0.00 S ATOM 342 CE MET A 452 -1.409 -6.646 3.897 1.00 0.00 C ATOM 0 H MET A 452 3.619 -7.272 7.811 1.00 0.00 H new ATOM 0 HA MET A 452 1.013 -8.174 8.630 1.00 0.00 H new ATOM 0 HB2 MET A 452 1.427 -6.117 7.291 1.00 0.00 H new ATOM 0 HB3 MET A 452 2.067 -7.094 5.985 1.00 0.00 H new ATOM 0 HG2 MET A 452 -0.091 -8.147 5.622 1.00 0.00 H new ATOM 0 HG3 MET A 452 -0.758 -7.391 7.055 1.00 0.00 H new ATOM 0 HE1 MET A 452 -0.829 -6.526 2.982 1.00 0.00 H new ATOM 0 HE2 MET A 452 -1.516 -7.707 4.122 1.00 0.00 H new ATOM 0 HE3 MET A 452 -2.396 -6.203 3.762 1.00 0.00 H new ATOM 352 N VAL A 453 2.372 -9.672 6.006 1.00 0.00 N ATOM 353 CA VAL A 453 2.407 -10.927 5.265 1.00 0.00 C ATOM 354 C VAL A 453 3.791 -11.181 4.679 1.00 0.00 C ATOM 355 O VAL A 453 4.382 -10.303 4.052 1.00 0.00 O ATOM 356 CB VAL A 453 1.371 -10.934 4.125 1.00 0.00 C ATOM 357 CG1 VAL A 453 -0.042 -10.991 4.688 1.00 0.00 C ATOM 358 CG2 VAL A 453 1.550 -9.714 3.235 1.00 0.00 C ATOM 0 H VAL A 453 2.917 -8.919 5.586 1.00 0.00 H new ATOM 0 HA VAL A 453 2.164 -11.719 5.973 1.00 0.00 H new ATOM 0 HB VAL A 453 1.531 -11.825 3.518 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -0.760 -10.995 3.868 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -0.162 -11.898 5.280 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -0.217 -10.120 5.320 1.00 0.00 H new ATOM 0 HG21 VAL A 453 0.810 -9.735 2.435 1.00 0.00 H new ATOM 0 HG22 VAL A 453 1.418 -8.809 3.828 1.00 0.00 H new ATOM 0 HG23 VAL A 453 2.551 -9.722 2.803 1.00 0.00 H new ATOM 368 N ASP A 454 4.303 -12.389 4.889 1.00 0.00 N ATOM 369 CA ASP A 454 5.618 -12.761 4.381 1.00 0.00 C ATOM 370 C ASP A 454 5.736 -12.444 2.893 1.00 0.00 C ATOM 371 O ASP A 454 4.740 -12.315 2.181 1.00 0.00 O ATOM 372 CB ASP A 454 5.879 -14.249 4.620 1.00 0.00 C ATOM 373 CG ASP A 454 6.399 -14.529 6.016 1.00 0.00 C ATOM 374 OD1 ASP A 454 7.380 -13.874 6.426 1.00 0.00 O ATOM 375 OD2 ASP A 454 5.825 -15.404 6.699 1.00 0.00 O ATOM 0 H ASP A 454 3.827 -13.127 5.408 1.00 0.00 H new ATOM 0 HA ASP A 454 6.366 -12.178 4.919 1.00 0.00 H new ATOM 0 HB2 ASP A 454 4.956 -14.807 4.461 1.00 0.00 H new ATOM 0 HB3 ASP A 454 6.601 -14.610 3.887 1.00 0.00 H new ATOM 380 N PRO A 455 6.981 -12.314 2.412 1.00 0.00 N ATOM 381 CA PRO A 455 7.258 -12.010 1.005 1.00 0.00 C ATOM 382 C PRO A 455 6.918 -13.175 0.082 1.00 0.00 C ATOM 383 O PRO A 455 7.130 -13.103 -1.129 1.00 0.00 O ATOM 384 CB PRO A 455 8.765 -11.739 0.991 1.00 0.00 C ATOM 385 CG PRO A 455 9.296 -12.493 2.161 1.00 0.00 C ATOM 386 CD PRO A 455 8.214 -12.455 3.205 1.00 0.00 C ATOM 0 HA PRO A 455 6.657 -11.176 0.642 1.00 0.00 H new ATOM 0 HB2 PRO A 455 9.220 -12.080 0.061 1.00 0.00 H new ATOM 0 HB3 PRO A 455 8.976 -10.673 1.078 1.00 0.00 H new ATOM 0 HG2 PRO A 455 9.537 -13.520 1.886 1.00 0.00 H new ATOM 0 HG3 PRO A 455 10.214 -12.039 2.534 1.00 0.00 H new ATOM 0 HD2 PRO A 455 8.203 -13.364 3.806 1.00 0.00 H new ATOM 0 HD3 PRO A 455 8.348 -11.620 3.892 1.00 0.00 H new ATOM 394 N LYS A 456 6.389 -14.247 0.661 1.00 0.00 N ATOM 395 CA LYS A 456 6.017 -15.428 -0.109 1.00 0.00 C ATOM 396 C LYS A 456 4.592 -15.305 -0.640 1.00 0.00 C ATOM 397 O LYS A 456 4.274 -15.814 -1.715 1.00 0.00 O ATOM 398 CB LYS A 456 6.145 -16.686 0.753 1.00 0.00 C ATOM 399 CG LYS A 456 7.528 -16.875 1.352 1.00 0.00 C ATOM 400 CD LYS A 456 7.706 -18.276 1.913 1.00 0.00 C ATOM 401 CE LYS A 456 7.950 -19.291 0.807 1.00 0.00 C ATOM 402 NZ LYS A 456 9.340 -19.214 0.279 1.00 0.00 N ATOM 0 H LYS A 456 6.208 -14.322 1.662 1.00 0.00 H new ATOM 0 HA LYS A 456 6.697 -15.506 -0.958 1.00 0.00 H new ATOM 0 HB2 LYS A 456 5.412 -16.640 1.559 1.00 0.00 H new ATOM 0 HB3 LYS A 456 5.898 -17.558 0.147 1.00 0.00 H new ATOM 0 HG2 LYS A 456 8.284 -16.689 0.590 1.00 0.00 H new ATOM 0 HG3 LYS A 456 7.686 -16.142 2.143 1.00 0.00 H new ATOM 0 HD2 LYS A 456 8.544 -18.287 2.610 1.00 0.00 H new ATOM 0 HD3 LYS A 456 6.818 -18.558 2.478 1.00 0.00 H new ATOM 0 HE2 LYS A 456 7.761 -20.295 1.188 1.00 0.00 H new ATOM 0 HE3 LYS A 456 7.243 -19.120 -0.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 9.497 -19.986 -0.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 9.480 -18.300 -0.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 10.015 -19.301 1.065 1.00 0.00 H new ATOM 416 N ASP A 457 3.740 -14.627 0.120 1.00 0.00 N ATOM 417 CA ASP A 457 2.349 -14.435 -0.275 1.00 0.00 C ATOM 418 C ASP A 457 2.201 -13.202 -1.161 1.00 0.00 C ATOM 419 O ASP A 457 1.099 -12.683 -1.341 1.00 0.00 O ATOM 420 CB ASP A 457 1.459 -14.298 0.962 1.00 0.00 C ATOM 421 CG ASP A 457 0.993 -15.640 1.491 1.00 0.00 C ATOM 422 OD1 ASP A 457 1.825 -16.568 1.571 1.00 0.00 O ATOM 423 OD2 ASP A 457 -0.205 -15.764 1.823 1.00 0.00 O ATOM 0 H ASP A 457 3.988 -14.201 1.013 1.00 0.00 H new ATOM 0 HA ASP A 457 2.035 -15.310 -0.844 1.00 0.00 H new ATOM 0 HB2 ASP A 457 2.007 -13.773 1.744 1.00 0.00 H new ATOM 0 HB3 ASP A 457 0.591 -13.686 0.716 1.00 0.00 H new ATOM 428 N ILE A 458 3.318 -12.739 -1.712 1.00 0.00 N ATOM 429 CA ILE A 458 3.312 -11.568 -2.580 1.00 0.00 C ATOM 430 C ILE A 458 2.637 -11.874 -3.913 1.00 0.00 C ATOM 431 O ILE A 458 3.132 -12.680 -4.701 1.00 0.00 O ATOM 432 CB ILE A 458 4.740 -11.057 -2.847 1.00 0.00 C ATOM 433 CG1 ILE A 458 5.466 -10.794 -1.526 1.00 0.00 C ATOM 434 CG2 ILE A 458 4.702 -9.796 -3.697 1.00 0.00 C ATOM 435 CD1 ILE A 458 4.944 -9.585 -0.780 1.00 0.00 C ATOM 0 H ILE A 458 4.238 -13.157 -1.573 1.00 0.00 H new ATOM 0 HA ILE A 458 2.749 -10.794 -2.059 1.00 0.00 H new ATOM 0 HB ILE A 458 5.288 -11.824 -3.395 1.00 0.00 H new ATOM 0 HG12 ILE A 458 5.372 -11.673 -0.888 1.00 0.00 H new ATOM 0 HG13 ILE A 458 6.529 -10.657 -1.726 1.00 0.00 H new ATOM 0 HG21 ILE A 458 5.719 -9.448 -3.877 1.00 0.00 H new ATOM 0 HG22 ILE A 458 4.219 -10.014 -4.650 1.00 0.00 H new ATOM 0 HG23 ILE A 458 4.140 -9.022 -3.174 1.00 0.00 H new ATOM 0 HD11 ILE A 458 5.504 -9.459 0.146 1.00 0.00 H new ATOM 0 HD12 ILE A 458 5.063 -8.696 -1.400 1.00 0.00 H new ATOM 0 HD13 ILE A 458 3.888 -9.728 -0.549 1.00 0.00 H new ATOM 447 N ASP A 459 1.504 -11.225 -4.159 1.00 0.00 N ATOM 448 CA ASP A 459 0.761 -11.426 -5.397 1.00 0.00 C ATOM 449 C ASP A 459 0.138 -10.118 -5.875 1.00 0.00 C ATOM 450 O ASP A 459 -0.047 -9.185 -5.094 1.00 0.00 O ATOM 451 CB ASP A 459 -0.328 -12.481 -5.199 1.00 0.00 C ATOM 452 CG ASP A 459 0.232 -13.811 -4.734 1.00 0.00 C ATOM 453 OD1 ASP A 459 1.105 -14.365 -5.435 1.00 0.00 O ATOM 454 OD2 ASP A 459 -0.201 -14.297 -3.669 1.00 0.00 O ATOM 0 H ASP A 459 1.080 -10.555 -3.517 1.00 0.00 H new ATOM 0 HA ASP A 459 1.459 -11.775 -6.158 1.00 0.00 H new ATOM 0 HB2 ASP A 459 -1.052 -12.119 -4.468 1.00 0.00 H new ATOM 0 HB3 ASP A 459 -0.866 -12.624 -6.136 1.00 0.00 H new ATOM 459 N ASP A 460 -0.181 -10.057 -7.163 1.00 0.00 N ATOM 460 CA ASP A 460 -0.783 -8.863 -7.746 1.00 0.00 C ATOM 461 C ASP A 460 -2.073 -8.495 -7.019 1.00 0.00 C ATOM 462 O ASP A 460 -2.396 -7.317 -6.867 1.00 0.00 O ATOM 463 CB ASP A 460 -1.067 -9.083 -9.233 1.00 0.00 C ATOM 464 CG ASP A 460 0.183 -9.441 -10.013 1.00 0.00 C ATOM 465 OD1 ASP A 460 0.649 -10.593 -9.890 1.00 0.00 O ATOM 466 OD2 ASP A 460 0.695 -8.570 -10.747 1.00 0.00 O ATOM 0 H ASP A 460 -0.033 -10.820 -7.823 1.00 0.00 H new ATOM 0 HA ASP A 460 -0.077 -8.040 -7.637 1.00 0.00 H new ATOM 0 HB2 ASP A 460 -1.803 -9.879 -9.346 1.00 0.00 H new ATOM 0 HB3 ASP A 460 -1.508 -8.179 -9.654 1.00 0.00 H new ATOM 471 N ASP A 461 -2.805 -9.509 -6.573 1.00 0.00 N ATOM 472 CA ASP A 461 -4.060 -9.292 -5.862 1.00 0.00 C ATOM 473 C ASP A 461 -3.820 -8.547 -4.553 1.00 0.00 C ATOM 474 O ASP A 461 -4.579 -7.647 -4.191 1.00 0.00 O ATOM 475 CB ASP A 461 -4.750 -10.628 -5.583 1.00 0.00 C ATOM 476 CG ASP A 461 -3.831 -11.625 -4.906 1.00 0.00 C ATOM 477 OD1 ASP A 461 -2.954 -12.188 -5.596 1.00 0.00 O ATOM 478 OD2 ASP A 461 -3.987 -11.842 -3.686 1.00 0.00 O ATOM 0 H ASP A 461 -2.551 -10.490 -6.691 1.00 0.00 H new ATOM 0 HA ASP A 461 -4.707 -8.683 -6.493 1.00 0.00 H new ATOM 0 HB2 ASP A 461 -5.623 -10.458 -4.953 1.00 0.00 H new ATOM 0 HB3 ASP A 461 -5.111 -11.050 -6.521 1.00 0.00 H new ATOM 483 N LEU A 462 -2.761 -8.927 -3.846 1.00 0.00 N ATOM 484 CA LEU A 462 -2.422 -8.295 -2.576 1.00 0.00 C ATOM 485 C LEU A 462 -2.658 -6.789 -2.637 1.00 0.00 C ATOM 486 O LEU A 462 -3.449 -6.244 -1.868 1.00 0.00 O ATOM 487 CB LEU A 462 -0.963 -8.580 -2.216 1.00 0.00 C ATOM 488 CG LEU A 462 -0.509 -8.114 -0.832 1.00 0.00 C ATOM 489 CD1 LEU A 462 -1.179 -8.940 0.255 1.00 0.00 C ATOM 490 CD2 LEU A 462 1.005 -8.197 -0.711 1.00 0.00 C ATOM 0 H LEU A 462 -2.123 -9.670 -4.131 1.00 0.00 H new ATOM 0 HA LEU A 462 -3.069 -8.714 -1.805 1.00 0.00 H new ATOM 0 HB2 LEU A 462 -0.795 -9.655 -2.289 1.00 0.00 H new ATOM 0 HB3 LEU A 462 -0.326 -8.107 -2.963 1.00 0.00 H new ATOM 0 HG LEU A 462 -0.806 -7.073 -0.704 1.00 0.00 H new ATOM 0 HD11 LEU A 462 -0.844 -8.594 1.233 1.00 0.00 H new ATOM 0 HD12 LEU A 462 -2.261 -8.829 0.182 1.00 0.00 H new ATOM 0 HD13 LEU A 462 -0.913 -9.990 0.130 1.00 0.00 H new ATOM 0 HD21 LEU A 462 1.310 -7.861 0.280 1.00 0.00 H new ATOM 0 HD22 LEU A 462 1.326 -9.228 -0.860 1.00 0.00 H new ATOM 0 HD23 LEU A 462 1.466 -7.561 -1.467 1.00 0.00 H new ATOM 502 N GLU A 463 -1.967 -6.124 -3.557 1.00 0.00 N ATOM 503 CA GLU A 463 -2.103 -4.681 -3.719 1.00 0.00 C ATOM 504 C GLU A 463 -3.545 -4.240 -3.479 1.00 0.00 C ATOM 505 O GLU A 463 -3.800 -3.294 -2.737 1.00 0.00 O ATOM 506 CB GLU A 463 -1.655 -4.258 -5.119 1.00 0.00 C ATOM 507 CG GLU A 463 -1.783 -2.765 -5.374 1.00 0.00 C ATOM 508 CD GLU A 463 -1.045 -2.321 -6.622 1.00 0.00 C ATOM 509 OE1 GLU A 463 0.201 -2.250 -6.579 1.00 0.00 O ATOM 510 OE2 GLU A 463 -1.713 -2.044 -7.640 1.00 0.00 O ATOM 0 H GLU A 463 -1.308 -6.561 -4.201 1.00 0.00 H new ATOM 0 HA GLU A 463 -1.465 -4.196 -2.980 1.00 0.00 H new ATOM 0 HB2 GLU A 463 -0.616 -4.555 -5.264 1.00 0.00 H new ATOM 0 HB3 GLU A 463 -2.247 -4.797 -5.859 1.00 0.00 H new ATOM 0 HG2 GLU A 463 -2.837 -2.505 -5.468 1.00 0.00 H new ATOM 0 HG3 GLU A 463 -1.396 -2.219 -4.514 1.00 0.00 H new ATOM 517 N GLY A 464 -4.483 -4.935 -4.115 1.00 0.00 N ATOM 518 CA GLY A 464 -5.887 -4.601 -3.960 1.00 0.00 C ATOM 519 C GLY A 464 -6.388 -4.846 -2.550 1.00 0.00 C ATOM 520 O GLY A 464 -7.143 -4.041 -2.005 1.00 0.00 O ATOM 0 H GLY A 464 -4.296 -5.723 -4.735 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -6.039 -3.553 -4.220 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -6.478 -5.192 -4.660 1.00 0.00 H new ATOM 524 N GLU A 465 -5.969 -5.961 -1.960 1.00 0.00 N ATOM 525 CA GLU A 465 -6.384 -6.309 -0.606 1.00 0.00 C ATOM 526 C GLU A 465 -6.003 -5.209 0.380 1.00 0.00 C ATOM 527 O GLU A 465 -6.748 -4.911 1.314 1.00 0.00 O ATOM 528 CB GLU A 465 -5.748 -7.634 -0.180 1.00 0.00 C ATOM 529 CG GLU A 465 -6.118 -8.804 -1.076 1.00 0.00 C ATOM 530 CD GLU A 465 -5.848 -10.146 -0.424 1.00 0.00 C ATOM 531 OE1 GLU A 465 -6.755 -10.666 0.260 1.00 0.00 O ATOM 532 OE2 GLU A 465 -4.731 -10.677 -0.598 1.00 0.00 O ATOM 0 H GLU A 465 -5.344 -6.638 -2.397 1.00 0.00 H new ATOM 0 HA GLU A 465 -7.469 -6.416 -0.602 1.00 0.00 H new ATOM 0 HB2 GLU A 465 -4.664 -7.521 -0.174 1.00 0.00 H new ATOM 0 HB3 GLU A 465 -6.051 -7.860 0.842 1.00 0.00 H new ATOM 0 HG2 GLU A 465 -7.174 -8.737 -1.337 1.00 0.00 H new ATOM 0 HG3 GLU A 465 -5.555 -8.736 -2.007 1.00 0.00 H new ATOM 539 N VAL A 466 -4.837 -4.608 0.165 1.00 0.00 N ATOM 540 CA VAL A 466 -4.356 -3.540 1.034 1.00 0.00 C ATOM 541 C VAL A 466 -5.133 -2.249 0.799 1.00 0.00 C ATOM 542 O VAL A 466 -5.458 -1.526 1.742 1.00 0.00 O ATOM 543 CB VAL A 466 -2.856 -3.270 0.814 1.00 0.00 C ATOM 544 CG1 VAL A 466 -2.352 -2.224 1.797 1.00 0.00 C ATOM 545 CG2 VAL A 466 -2.059 -4.560 0.941 1.00 0.00 C ATOM 0 H VAL A 466 -4.208 -4.842 -0.603 1.00 0.00 H new ATOM 0 HA VAL A 466 -4.511 -3.873 2.060 1.00 0.00 H new ATOM 0 HB VAL A 466 -2.718 -2.882 -0.195 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -1.290 -2.046 1.627 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -2.903 -1.295 1.654 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -2.501 -2.581 2.816 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -1.001 -4.351 0.783 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -2.201 -4.979 1.937 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -2.403 -5.275 0.194 1.00 0.00 H new ATOM 555 N THR A 467 -5.429 -1.964 -0.465 1.00 0.00 N ATOM 556 CA THR A 467 -6.167 -0.760 -0.825 1.00 0.00 C ATOM 557 C THR A 467 -7.581 -0.792 -0.258 1.00 0.00 C ATOM 558 O THR A 467 -8.030 0.168 0.367 1.00 0.00 O ATOM 559 CB THR A 467 -6.243 -0.583 -2.354 1.00 0.00 C ATOM 560 OG1 THR A 467 -4.927 -0.416 -2.894 1.00 0.00 O ATOM 561 CG2 THR A 467 -7.102 0.618 -2.717 1.00 0.00 C ATOM 0 H THR A 467 -5.169 -2.551 -1.257 1.00 0.00 H new ATOM 0 HA THR A 467 -5.625 0.083 -0.396 1.00 0.00 H new ATOM 0 HB THR A 467 -6.699 -1.477 -2.779 1.00 0.00 H new ATOM 0 HG1 THR A 467 -4.467 -1.281 -2.909 1.00 0.00 H new ATOM 0 HG21 THR A 467 -7.141 0.723 -3.801 1.00 0.00 H new ATOM 0 HG22 THR A 467 -8.111 0.474 -2.330 1.00 0.00 H new ATOM 0 HG23 THR A 467 -6.671 1.519 -2.280 1.00 0.00 H new ATOM 569 N GLU A 468 -8.278 -1.902 -0.479 1.00 0.00 N ATOM 570 CA GLU A 468 -9.642 -2.058 0.011 1.00 0.00 C ATOM 571 C GLU A 468 -9.676 -2.054 1.537 1.00 0.00 C ATOM 572 O GLU A 468 -10.475 -1.345 2.148 1.00 0.00 O ATOM 573 CB GLU A 468 -10.254 -3.356 -0.520 1.00 0.00 C ATOM 574 CG GLU A 468 -9.469 -4.600 -0.138 1.00 0.00 C ATOM 575 CD GLU A 468 -9.765 -5.778 -1.045 1.00 0.00 C ATOM 576 OE1 GLU A 468 -9.146 -5.862 -2.127 1.00 0.00 O ATOM 577 OE2 GLU A 468 -10.615 -6.614 -0.675 1.00 0.00 O ATOM 0 H GLU A 468 -7.920 -2.706 -0.994 1.00 0.00 H new ATOM 0 HA GLU A 468 -10.229 -1.214 -0.351 1.00 0.00 H new ATOM 0 HB2 GLU A 468 -11.272 -3.449 -0.142 1.00 0.00 H new ATOM 0 HB3 GLU A 468 -10.321 -3.298 -1.606 1.00 0.00 H new ATOM 0 HG2 GLU A 468 -8.403 -4.377 -0.174 1.00 0.00 H new ATOM 0 HG3 GLU A 468 -9.703 -4.871 0.891 1.00 0.00 H new ATOM 584 N GLU A 469 -8.803 -2.852 2.144 1.00 0.00 N ATOM 585 CA GLU A 469 -8.734 -2.941 3.598 1.00 0.00 C ATOM 586 C GLU A 469 -8.539 -1.561 4.220 1.00 0.00 C ATOM 587 O GLU A 469 -9.186 -1.217 5.209 1.00 0.00 O ATOM 588 CB GLU A 469 -7.592 -3.869 4.021 1.00 0.00 C ATOM 589 CG GLU A 469 -8.004 -5.327 4.135 1.00 0.00 C ATOM 590 CD GLU A 469 -6.858 -6.225 4.560 1.00 0.00 C ATOM 591 OE1 GLU A 469 -5.799 -6.187 3.899 1.00 0.00 O ATOM 592 OE2 GLU A 469 -7.020 -6.965 5.552 1.00 0.00 O ATOM 0 H GLU A 469 -8.135 -3.445 1.652 1.00 0.00 H new ATOM 0 HA GLU A 469 -9.678 -3.351 3.956 1.00 0.00 H new ATOM 0 HB2 GLU A 469 -6.780 -3.785 3.299 1.00 0.00 H new ATOM 0 HB3 GLU A 469 -7.200 -3.535 4.982 1.00 0.00 H new ATOM 0 HG2 GLU A 469 -8.817 -5.416 4.856 1.00 0.00 H new ATOM 0 HG3 GLU A 469 -8.391 -5.668 3.175 1.00 0.00 H new ATOM 599 N CYS A 470 -7.642 -0.776 3.632 1.00 0.00 N ATOM 600 CA CYS A 470 -7.360 0.566 4.129 1.00 0.00 C ATOM 601 C CYS A 470 -8.519 1.512 3.828 1.00 0.00 C ATOM 602 O CYS A 470 -8.783 2.446 4.584 1.00 0.00 O ATOM 603 CB CYS A 470 -6.072 1.104 3.503 1.00 0.00 C ATOM 604 SG CYS A 470 -4.600 0.128 3.890 1.00 0.00 S ATOM 0 H CYS A 470 -7.099 -1.045 2.812 1.00 0.00 H new ATOM 0 HA CYS A 470 -7.233 0.507 5.210 1.00 0.00 H new ATOM 0 HB2 CYS A 470 -6.195 1.142 2.421 1.00 0.00 H new ATOM 0 HB3 CYS A 470 -5.916 2.128 3.843 1.00 0.00 H new ATOM 0 HG CYS A 470 -4.549 -0.909 3.107 1.00 0.00 H new ATOM 610 N GLY A 471 -9.207 1.262 2.718 1.00 0.00 N ATOM 611 CA GLY A 471 -10.328 2.101 2.337 1.00 0.00 C ATOM 612 C GLY A 471 -11.319 2.294 3.467 1.00 0.00 C ATOM 613 O GLY A 471 -11.814 3.399 3.688 1.00 0.00 O ATOM 0 H GLY A 471 -9.008 0.494 2.077 1.00 0.00 H new ATOM 0 HA2 GLY A 471 -9.956 3.073 2.014 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -10.838 1.655 1.483 1.00 0.00 H new ATOM 617 N LYS A 472 -11.612 1.215 4.185 1.00 0.00 N ATOM 618 CA LYS A 472 -12.551 1.268 5.299 1.00 0.00 C ATOM 619 C LYS A 472 -12.301 2.500 6.163 1.00 0.00 C ATOM 620 O LYS A 472 -13.199 3.316 6.373 1.00 0.00 O ATOM 621 CB LYS A 472 -12.435 0.003 6.152 1.00 0.00 C ATOM 622 CG LYS A 472 -13.164 -1.194 5.566 1.00 0.00 C ATOM 623 CD LYS A 472 -12.361 -1.844 4.451 1.00 0.00 C ATOM 624 CE LYS A 472 -12.941 -3.195 4.061 1.00 0.00 C ATOM 625 NZ LYS A 472 -12.572 -3.577 2.670 1.00 0.00 N ATOM 0 H LYS A 472 -11.212 0.292 4.015 1.00 0.00 H new ATOM 0 HA LYS A 472 -13.559 1.331 4.889 1.00 0.00 H new ATOM 0 HB2 LYS A 472 -11.381 -0.248 6.274 1.00 0.00 H new ATOM 0 HB3 LYS A 472 -12.831 0.208 7.147 1.00 0.00 H new ATOM 0 HG2 LYS A 472 -13.356 -1.925 6.352 1.00 0.00 H new ATOM 0 HG3 LYS A 472 -14.134 -0.878 5.181 1.00 0.00 H new ATOM 0 HD2 LYS A 472 -12.347 -1.188 3.581 1.00 0.00 H new ATOM 0 HD3 LYS A 472 -11.327 -1.970 4.772 1.00 0.00 H new ATOM 0 HE2 LYS A 472 -12.584 -3.957 4.754 1.00 0.00 H new ATOM 0 HE3 LYS A 472 -14.027 -3.164 4.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 472 -13.433 -3.799 2.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 472 -12.072 -2.787 2.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 472 -11.952 -4.412 2.692 1.00 0.00 H new ATOM 639 N PHE A 473 -11.076 2.630 6.660 1.00 0.00 N ATOM 640 CA PHE A 473 -10.708 3.764 7.500 1.00 0.00 C ATOM 641 C PHE A 473 -11.102 5.082 6.840 1.00 0.00 C ATOM 642 O PHE A 473 -11.822 5.890 7.424 1.00 0.00 O ATOM 643 CB PHE A 473 -9.203 3.751 7.780 1.00 0.00 C ATOM 644 CG PHE A 473 -8.681 2.404 8.191 1.00 0.00 C ATOM 645 CD1 PHE A 473 -9.024 1.858 9.417 1.00 0.00 C ATOM 646 CD2 PHE A 473 -7.847 1.684 7.351 1.00 0.00 C ATOM 647 CE1 PHE A 473 -8.546 0.618 9.798 1.00 0.00 C ATOM 648 CE2 PHE A 473 -7.366 0.444 7.726 1.00 0.00 C ATOM 649 CZ PHE A 473 -7.715 -0.089 8.951 1.00 0.00 C ATOM 0 H PHE A 473 -10.321 1.964 6.496 1.00 0.00 H new ATOM 0 HA PHE A 473 -11.248 3.675 8.443 1.00 0.00 H new ATOM 0 HB2 PHE A 473 -8.673 4.080 6.886 1.00 0.00 H new ATOM 0 HB3 PHE A 473 -8.982 4.473 8.566 1.00 0.00 H new ATOM 0 HD1 PHE A 473 -9.673 2.408 10.083 1.00 0.00 H new ATOM 0 HD2 PHE A 473 -7.570 2.097 6.392 1.00 0.00 H new ATOM 0 HE1 PHE A 473 -8.822 0.203 10.756 1.00 0.00 H new ATOM 0 HE2 PHE A 473 -6.718 -0.108 7.061 1.00 0.00 H new ATOM 0 HZ PHE A 473 -7.339 -1.057 9.246 1.00 0.00 H new ATOM 659 N GLY A 474 -10.624 5.290 5.617 1.00 0.00 N ATOM 660 CA GLY A 474 -10.936 6.511 4.897 1.00 0.00 C ATOM 661 C GLY A 474 -10.602 6.415 3.421 1.00 0.00 C ATOM 662 O GLY A 474 -10.461 5.319 2.880 1.00 0.00 O ATOM 0 H GLY A 474 -10.027 4.635 5.112 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -11.996 6.737 5.013 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -10.384 7.341 5.338 1.00 0.00 H new ATOM 666 N ALA A 475 -10.478 7.565 2.768 1.00 0.00 N ATOM 667 CA ALA A 475 -10.160 7.606 1.346 1.00 0.00 C ATOM 668 C ALA A 475 -8.670 7.381 1.111 1.00 0.00 C ATOM 669 O ALA A 475 -7.840 8.211 1.480 1.00 0.00 O ATOM 670 CB ALA A 475 -10.596 8.934 0.745 1.00 0.00 C ATOM 0 H ALA A 475 -10.593 8.481 3.201 1.00 0.00 H new ATOM 0 HA ALA A 475 -10.705 6.801 0.854 1.00 0.00 H new ATOM 0 HB1 ALA A 475 -10.352 8.950 -0.317 1.00 0.00 H new ATOM 0 HB2 ALA A 475 -11.672 9.055 0.872 1.00 0.00 H new ATOM 0 HB3 ALA A 475 -10.077 9.749 1.249 1.00 0.00 H new ATOM 676 N VAL A 476 -8.337 6.251 0.494 1.00 0.00 N ATOM 677 CA VAL A 476 -6.947 5.916 0.210 1.00 0.00 C ATOM 678 C VAL A 476 -6.324 6.924 -0.749 1.00 0.00 C ATOM 679 O VAL A 476 -6.961 7.360 -1.707 1.00 0.00 O ATOM 680 CB VAL A 476 -6.822 4.505 -0.395 1.00 0.00 C ATOM 681 CG1 VAL A 476 -5.371 4.191 -0.724 1.00 0.00 C ATOM 682 CG2 VAL A 476 -7.398 3.466 0.555 1.00 0.00 C ATOM 0 H VAL A 476 -9.011 5.552 0.181 1.00 0.00 H new ATOM 0 HA VAL A 476 -6.414 5.945 1.160 1.00 0.00 H new ATOM 0 HB VAL A 476 -7.394 4.474 -1.322 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.303 3.190 -1.150 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -4.996 4.918 -1.444 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -4.773 4.239 0.186 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -7.302 2.475 0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -6.855 3.496 1.499 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -8.451 3.682 0.735 1.00 0.00 H new ATOM 692 N ASN A 477 -5.075 7.291 -0.483 1.00 0.00 N ATOM 693 CA ASN A 477 -4.365 8.250 -1.323 1.00 0.00 C ATOM 694 C ASN A 477 -3.323 7.547 -2.189 1.00 0.00 C ATOM 695 O ASN A 477 -3.292 7.725 -3.407 1.00 0.00 O ATOM 696 CB ASN A 477 -3.690 9.316 -0.458 1.00 0.00 C ATOM 697 CG ASN A 477 -3.332 10.560 -1.247 1.00 0.00 C ATOM 698 OD1 ASN A 477 -2.342 10.581 -1.978 1.00 0.00 O ATOM 699 ND2 ASN A 477 -4.139 11.605 -1.102 1.00 0.00 N ATOM 0 H ASN A 477 -4.533 6.940 0.307 1.00 0.00 H new ATOM 0 HA ASN A 477 -5.092 8.730 -1.978 1.00 0.00 H new ATOM 0 HB2 ASN A 477 -4.354 9.588 0.362 1.00 0.00 H new ATOM 0 HB3 ASN A 477 -2.787 8.900 -0.012 1.00 0.00 H new ATOM 0 HD21 ASN A 477 -3.949 12.470 -1.608 1.00 0.00 H new ATOM 0 HD22 ASN A 477 -4.949 11.542 -0.485 1.00 0.00 H new ATOM 706 N ARG A 478 -2.473 6.749 -1.551 1.00 0.00 N ATOM 707 CA ARG A 478 -1.430 6.020 -2.263 1.00 0.00 C ATOM 708 C ARG A 478 -1.153 4.677 -1.594 1.00 0.00 C ATOM 709 O ARG A 478 -1.338 4.522 -0.387 1.00 0.00 O ATOM 710 CB ARG A 478 -0.145 6.849 -2.317 1.00 0.00 C ATOM 711 CG ARG A 478 -0.103 7.832 -3.476 1.00 0.00 C ATOM 712 CD ARG A 478 1.322 8.082 -3.943 1.00 0.00 C ATOM 713 NE ARG A 478 1.464 9.380 -4.597 1.00 0.00 N ATOM 714 CZ ARG A 478 1.386 10.540 -3.953 1.00 0.00 C ATOM 715 NH1 ARG A 478 1.169 10.562 -2.645 1.00 0.00 N ATOM 716 NH2 ARG A 478 1.526 11.680 -4.617 1.00 0.00 N ATOM 0 H ARG A 478 -2.486 6.591 -0.543 1.00 0.00 H new ATOM 0 HA ARG A 478 -1.779 5.836 -3.279 1.00 0.00 H new ATOM 0 HB2 ARG A 478 -0.037 7.398 -1.382 1.00 0.00 H new ATOM 0 HB3 ARG A 478 0.709 6.176 -2.391 1.00 0.00 H new ATOM 0 HG2 ARG A 478 -0.696 7.445 -4.305 1.00 0.00 H new ATOM 0 HG3 ARG A 478 -0.558 8.775 -3.172 1.00 0.00 H new ATOM 0 HD2 ARG A 478 1.998 8.031 -3.089 1.00 0.00 H new ATOM 0 HD3 ARG A 478 1.621 7.293 -4.634 1.00 0.00 H new ATOM 0 HE ARG A 478 1.632 9.397 -5.603 1.00 0.00 H new ATOM 0 HH11 ARG A 478 1.062 9.688 -2.131 1.00 0.00 H new ATOM 0 HH12 ARG A 478 1.110 11.453 -2.153 1.00 0.00 H new ATOM 0 HH21 ARG A 478 1.694 11.667 -5.623 1.00 0.00 H new ATOM 0 HH22 ARG A 478 1.466 12.570 -4.121 1.00 0.00 H new ATOM 730 N VAL A 479 -0.708 3.707 -2.387 1.00 0.00 N ATOM 731 CA VAL A 479 -0.405 2.377 -1.873 1.00 0.00 C ATOM 732 C VAL A 479 0.899 1.846 -2.458 1.00 0.00 C ATOM 733 O VAL A 479 1.008 1.634 -3.666 1.00 0.00 O ATOM 734 CB VAL A 479 -1.538 1.383 -2.186 1.00 0.00 C ATOM 735 CG1 VAL A 479 -1.181 -0.009 -1.686 1.00 0.00 C ATOM 736 CG2 VAL A 479 -2.848 1.858 -1.576 1.00 0.00 C ATOM 0 H VAL A 479 -0.549 3.818 -3.388 1.00 0.00 H new ATOM 0 HA VAL A 479 -0.303 2.471 -0.792 1.00 0.00 H new ATOM 0 HB VAL A 479 -1.665 1.333 -3.267 1.00 0.00 H new ATOM 0 HG11 VAL A 479 -1.994 -0.698 -1.916 1.00 0.00 H new ATOM 0 HG12 VAL A 479 -0.268 -0.348 -2.175 1.00 0.00 H new ATOM 0 HG13 VAL A 479 -1.025 0.021 -0.608 1.00 0.00 H new ATOM 0 HG21 VAL A 479 -3.638 1.143 -1.807 1.00 0.00 H new ATOM 0 HG22 VAL A 479 -2.738 1.939 -0.495 1.00 0.00 H new ATOM 0 HG23 VAL A 479 -3.109 2.833 -1.988 1.00 0.00 H new ATOM 746 N ILE A 480 1.885 1.633 -1.593 1.00 0.00 N ATOM 747 CA ILE A 480 3.182 1.124 -2.024 1.00 0.00 C ATOM 748 C ILE A 480 3.670 0.013 -1.102 1.00 0.00 C ATOM 749 O ILE A 480 3.519 0.093 0.118 1.00 0.00 O ATOM 750 CB ILE A 480 4.239 2.243 -2.066 1.00 0.00 C ATOM 751 CG1 ILE A 480 3.835 3.319 -3.076 1.00 0.00 C ATOM 752 CG2 ILE A 480 5.605 1.669 -2.413 1.00 0.00 C ATOM 753 CD1 ILE A 480 4.343 4.700 -2.724 1.00 0.00 C ATOM 0 H ILE A 480 1.811 1.805 -0.590 1.00 0.00 H new ATOM 0 HA ILE A 480 3.047 0.725 -3.029 1.00 0.00 H new ATOM 0 HB ILE A 480 4.300 2.702 -1.079 1.00 0.00 H new ATOM 0 HG12 ILE A 480 4.212 3.042 -4.060 1.00 0.00 H new ATOM 0 HG13 ILE A 480 2.748 3.348 -3.148 1.00 0.00 H new ATOM 0 HG21 ILE A 480 6.341 2.472 -2.439 1.00 0.00 H new ATOM 0 HG22 ILE A 480 5.894 0.936 -1.660 1.00 0.00 H new ATOM 0 HG23 ILE A 480 5.560 1.187 -3.390 1.00 0.00 H new ATOM 0 HD11 ILE A 480 4.019 5.411 -3.483 1.00 0.00 H new ATOM 0 HD12 ILE A 480 3.945 4.998 -1.754 1.00 0.00 H new ATOM 0 HD13 ILE A 480 5.432 4.687 -2.680 1.00 0.00 H new ATOM 765 N ILE A 481 4.259 -1.022 -1.692 1.00 0.00 N ATOM 766 CA ILE A 481 4.773 -2.149 -0.923 1.00 0.00 C ATOM 767 C ILE A 481 6.263 -2.352 -1.174 1.00 0.00 C ATOM 768 O ILE A 481 6.666 -2.798 -2.249 1.00 0.00 O ATOM 769 CB ILE A 481 4.024 -3.451 -1.263 1.00 0.00 C ATOM 770 CG1 ILE A 481 2.524 -3.283 -1.010 1.00 0.00 C ATOM 771 CG2 ILE A 481 4.577 -4.609 -0.446 1.00 0.00 C ATOM 772 CD1 ILE A 481 1.673 -4.315 -1.716 1.00 0.00 C ATOM 0 H ILE A 481 4.392 -1.103 -2.700 1.00 0.00 H new ATOM 0 HA ILE A 481 4.613 -1.912 0.129 1.00 0.00 H new ATOM 0 HB ILE A 481 4.173 -3.673 -2.320 1.00 0.00 H new ATOM 0 HG12 ILE A 481 2.336 -3.341 0.062 1.00 0.00 H new ATOM 0 HG13 ILE A 481 2.218 -2.288 -1.334 1.00 0.00 H new ATOM 0 HG21 ILE A 481 4.037 -5.522 -0.698 1.00 0.00 H new ATOM 0 HG22 ILE A 481 5.636 -4.740 -0.670 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.455 -4.396 0.616 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.622 -4.135 -1.492 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.832 -4.243 -2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 481 1.951 -5.312 -1.374 1.00 0.00 H new ATOM 784 N TYR A 482 7.076 -2.024 -0.176 1.00 0.00 N ATOM 785 CA TYR A 482 8.522 -2.170 -0.289 1.00 0.00 C ATOM 786 C TYR A 482 9.029 -3.291 0.614 1.00 0.00 C ATOM 787 O TYR A 482 8.454 -3.559 1.668 1.00 0.00 O ATOM 788 CB TYR A 482 9.218 -0.856 0.070 1.00 0.00 C ATOM 789 CG TYR A 482 10.574 -0.693 -0.577 1.00 0.00 C ATOM 790 CD1 TYR A 482 10.695 -0.175 -1.861 1.00 0.00 C ATOM 791 CD2 TYR A 482 11.735 -1.056 0.094 1.00 0.00 C ATOM 792 CE1 TYR A 482 11.932 -0.025 -2.457 1.00 0.00 C ATOM 793 CE2 TYR A 482 12.976 -0.908 -0.493 1.00 0.00 C ATOM 794 CZ TYR A 482 13.070 -0.392 -1.769 1.00 0.00 C ATOM 795 OH TYR A 482 14.305 -0.244 -2.358 1.00 0.00 O ATOM 0 H TYR A 482 6.758 -1.655 0.720 1.00 0.00 H new ATOM 0 HA TYR A 482 8.756 -2.427 -1.322 1.00 0.00 H new ATOM 0 HB2 TYR A 482 8.580 -0.024 -0.228 1.00 0.00 H new ATOM 0 HB3 TYR A 482 9.332 -0.799 1.153 1.00 0.00 H new ATOM 0 HD1 TYR A 482 9.807 0.115 -2.402 1.00 0.00 H new ATOM 0 HD2 TYR A 482 11.666 -1.461 1.093 1.00 0.00 H new ATOM 0 HE1 TYR A 482 12.008 0.377 -3.456 1.00 0.00 H new ATOM 0 HE2 TYR A 482 13.868 -1.195 0.044 1.00 0.00 H new ATOM 0 HH TYR A 482 15.001 -0.548 -1.739 1.00 0.00 H new ATOM 805 N GLN A 483 10.109 -3.939 0.192 1.00 0.00 N ATOM 806 CA GLN A 483 10.694 -5.031 0.961 1.00 0.00 C ATOM 807 C GLN A 483 12.214 -5.030 0.838 1.00 0.00 C ATOM 808 O GLN A 483 12.761 -4.662 -0.200 1.00 0.00 O ATOM 809 CB GLN A 483 10.132 -6.373 0.490 1.00 0.00 C ATOM 810 CG GLN A 483 10.478 -6.705 -0.952 1.00 0.00 C ATOM 811 CD GLN A 483 9.791 -7.964 -1.443 1.00 0.00 C ATOM 812 OE1 GLN A 483 10.083 -9.066 -0.977 1.00 0.00 O ATOM 813 NE2 GLN A 483 8.872 -7.807 -2.388 1.00 0.00 N ATOM 0 H GLN A 483 10.597 -3.727 -0.678 1.00 0.00 H new ATOM 0 HA GLN A 483 10.433 -4.885 2.009 1.00 0.00 H new ATOM 0 HB2 GLN A 483 10.512 -7.164 1.137 1.00 0.00 H new ATOM 0 HB3 GLN A 483 9.048 -6.363 0.602 1.00 0.00 H new ATOM 0 HG2 GLN A 483 10.195 -5.869 -1.591 1.00 0.00 H new ATOM 0 HG3 GLN A 483 11.557 -6.825 -1.044 1.00 0.00 H new ATOM 0 HE21 GLN A 483 8.662 -6.875 -2.745 1.00 0.00 H new ATOM 0 HE22 GLN A 483 8.376 -8.618 -2.757 1.00 0.00 H new ATOM 822 N GLU A 484 12.889 -5.445 1.905 1.00 0.00 N ATOM 823 CA GLU A 484 14.347 -5.491 1.916 1.00 0.00 C ATOM 824 C GLU A 484 14.855 -6.397 3.034 1.00 0.00 C ATOM 825 O GLU A 484 14.109 -6.753 3.947 1.00 0.00 O ATOM 826 CB GLU A 484 14.922 -4.084 2.084 1.00 0.00 C ATOM 827 CG GLU A 484 16.421 -4.007 1.847 1.00 0.00 C ATOM 828 CD GLU A 484 16.834 -4.618 0.522 1.00 0.00 C ATOM 829 OE1 GLU A 484 17.068 -5.845 0.483 1.00 0.00 O ATOM 830 OE2 GLU A 484 16.925 -3.872 -0.475 1.00 0.00 O ATOM 0 H GLU A 484 12.450 -5.754 2.772 1.00 0.00 H new ATOM 0 HA GLU A 484 14.679 -5.900 0.962 1.00 0.00 H new ATOM 0 HB2 GLU A 484 14.418 -3.410 1.392 1.00 0.00 H new ATOM 0 HB3 GLU A 484 14.703 -3.729 3.091 1.00 0.00 H new ATOM 0 HG2 GLU A 484 16.737 -2.964 1.876 1.00 0.00 H new ATOM 0 HG3 GLU A 484 16.940 -4.520 2.657 1.00 0.00 H new ATOM 837 N LYS A 485 16.128 -6.767 2.955 1.00 0.00 N ATOM 838 CA LYS A 485 16.738 -7.631 3.959 1.00 0.00 C ATOM 839 C LYS A 485 17.291 -6.810 5.119 1.00 0.00 C ATOM 840 O LYS A 485 17.839 -5.726 4.919 1.00 0.00 O ATOM 841 CB LYS A 485 17.857 -8.465 3.332 1.00 0.00 C ATOM 842 CG LYS A 485 18.268 -9.662 4.173 1.00 0.00 C ATOM 843 CD LYS A 485 18.770 -10.806 3.307 1.00 0.00 C ATOM 844 CE LYS A 485 20.104 -10.471 2.659 1.00 0.00 C ATOM 845 NZ LYS A 485 19.929 -9.814 1.334 1.00 0.00 N ATOM 0 H LYS A 485 16.758 -6.482 2.205 1.00 0.00 H new ATOM 0 HA LYS A 485 15.967 -8.299 4.344 1.00 0.00 H new ATOM 0 HB2 LYS A 485 17.533 -8.814 2.352 1.00 0.00 H new ATOM 0 HB3 LYS A 485 18.727 -7.828 3.172 1.00 0.00 H new ATOM 0 HG2 LYS A 485 19.049 -9.365 4.873 1.00 0.00 H new ATOM 0 HG3 LYS A 485 17.419 -10.000 4.767 1.00 0.00 H new ATOM 0 HD2 LYS A 485 18.875 -11.705 3.915 1.00 0.00 H new ATOM 0 HD3 LYS A 485 18.034 -11.028 2.534 1.00 0.00 H new ATOM 0 HE2 LYS A 485 20.673 -9.814 3.317 1.00 0.00 H new ATOM 0 HE3 LYS A 485 20.688 -11.383 2.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 20.781 -9.964 0.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 19.105 -10.224 0.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 19.778 -8.794 1.470 1.00 0.00 H new ATOM 950 N GLU A 493 16.458 -13.050 7.248 1.00 0.00 N ATOM 951 CA GLU A 493 15.015 -12.871 7.138 1.00 0.00 C ATOM 952 C GLU A 493 14.680 -11.733 6.179 1.00 0.00 C ATOM 953 O GLU A 493 15.421 -10.755 6.077 1.00 0.00 O ATOM 954 CB GLU A 493 14.408 -12.590 8.514 1.00 0.00 C ATOM 955 CG GLU A 493 12.893 -12.704 8.545 1.00 0.00 C ATOM 956 CD GLU A 493 12.416 -14.143 8.579 1.00 0.00 C ATOM 957 OE1 GLU A 493 12.702 -14.886 7.616 1.00 0.00 O ATOM 958 OE2 GLU A 493 11.758 -14.526 9.568 1.00 0.00 O ATOM 0 HA GLU A 493 14.589 -13.793 6.743 1.00 0.00 H new ATOM 0 HB2 GLU A 493 14.831 -13.286 9.238 1.00 0.00 H new ATOM 0 HB3 GLU A 493 14.695 -11.587 8.831 1.00 0.00 H new ATOM 0 HG2 GLU A 493 12.511 -12.178 9.420 1.00 0.00 H new ATOM 0 HG3 GLU A 493 12.477 -12.208 7.668 1.00 0.00 H new ATOM 965 N ILE A 494 13.559 -11.868 5.479 1.00 0.00 N ATOM 966 CA ILE A 494 13.125 -10.851 4.529 1.00 0.00 C ATOM 967 C ILE A 494 11.808 -10.218 4.965 1.00 0.00 C ATOM 968 O ILE A 494 10.748 -10.839 4.870 1.00 0.00 O ATOM 969 CB ILE A 494 12.957 -11.437 3.115 1.00 0.00 C ATOM 970 CG1 ILE A 494 14.209 -12.219 2.711 1.00 0.00 C ATOM 971 CG2 ILE A 494 12.673 -10.328 2.112 1.00 0.00 C ATOM 972 CD1 ILE A 494 15.408 -11.339 2.434 1.00 0.00 C ATOM 0 H ILE A 494 12.935 -12.671 5.552 1.00 0.00 H new ATOM 0 HA ILE A 494 13.902 -10.087 4.507 1.00 0.00 H new ATOM 0 HB ILE A 494 12.109 -12.122 3.120 1.00 0.00 H new ATOM 0 HG12 ILE A 494 14.460 -12.922 3.505 1.00 0.00 H new ATOM 0 HG13 ILE A 494 13.988 -12.809 1.821 1.00 0.00 H new ATOM 0 HG21 ILE A 494 12.557 -10.758 1.117 1.00 0.00 H new ATOM 0 HG22 ILE A 494 11.756 -9.810 2.393 1.00 0.00 H new ATOM 0 HG23 ILE A 494 13.502 -9.621 2.107 1.00 0.00 H new ATOM 0 HD11 ILE A 494 16.258 -11.960 2.154 1.00 0.00 H new ATOM 0 HD12 ILE A 494 15.175 -10.653 1.619 1.00 0.00 H new ATOM 0 HD13 ILE A 494 15.655 -10.768 3.329 1.00 0.00 H new ATOM 984 N ILE A 495 11.881 -8.980 5.441 1.00 0.00 N ATOM 985 CA ILE A 495 10.694 -8.262 5.888 1.00 0.00 C ATOM 986 C ILE A 495 9.994 -7.575 4.720 1.00 0.00 C ATOM 987 O ILE A 495 10.479 -7.603 3.589 1.00 0.00 O ATOM 988 CB ILE A 495 11.043 -7.208 6.955 1.00 0.00 C ATOM 989 CG1 ILE A 495 11.995 -6.160 6.376 1.00 0.00 C ATOM 990 CG2 ILE A 495 11.659 -7.874 8.177 1.00 0.00 C ATOM 991 CD1 ILE A 495 11.312 -5.158 5.470 1.00 0.00 C ATOM 0 H ILE A 495 12.750 -8.453 5.527 1.00 0.00 H new ATOM 0 HA ILE A 495 10.024 -9.002 6.325 1.00 0.00 H new ATOM 0 HB ILE A 495 10.125 -6.707 7.263 1.00 0.00 H new ATOM 0 HG12 ILE A 495 12.478 -5.627 7.195 1.00 0.00 H new ATOM 0 HG13 ILE A 495 12.782 -6.666 5.817 1.00 0.00 H new ATOM 0 HG21 ILE A 495 11.900 -7.116 8.922 1.00 0.00 H new ATOM 0 HG22 ILE A 495 10.950 -8.586 8.600 1.00 0.00 H new ATOM 0 HG23 ILE A 495 12.569 -8.398 7.886 1.00 0.00 H new ATOM 0 HD11 ILE A 495 12.047 -4.446 5.096 1.00 0.00 H new ATOM 0 HD12 ILE A 495 10.853 -5.680 4.631 1.00 0.00 H new ATOM 0 HD13 ILE A 495 10.543 -4.626 6.030 1.00 0.00 H new ATOM 1003 N VAL A 496 8.851 -6.958 5.003 1.00 0.00 N ATOM 1004 CA VAL A 496 8.085 -6.261 3.976 1.00 0.00 C ATOM 1005 C VAL A 496 7.374 -5.043 4.554 1.00 0.00 C ATOM 1006 O VAL A 496 6.457 -5.172 5.366 1.00 0.00 O ATOM 1007 CB VAL A 496 7.043 -7.190 3.326 1.00 0.00 C ATOM 1008 CG1 VAL A 496 6.235 -6.436 2.281 1.00 0.00 C ATOM 1009 CG2 VAL A 496 7.722 -8.405 2.713 1.00 0.00 C ATOM 0 H VAL A 496 8.435 -6.927 5.934 1.00 0.00 H new ATOM 0 HA VAL A 496 8.796 -5.937 3.216 1.00 0.00 H new ATOM 0 HB VAL A 496 6.358 -7.537 4.099 1.00 0.00 H new ATOM 0 HG11 VAL A 496 5.504 -7.108 1.832 1.00 0.00 H new ATOM 0 HG12 VAL A 496 5.718 -5.601 2.754 1.00 0.00 H new ATOM 0 HG13 VAL A 496 6.903 -6.058 1.507 1.00 0.00 H new ATOM 0 HG21 VAL A 496 6.971 -9.051 2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 496 8.431 -8.080 1.951 1.00 0.00 H new ATOM 0 HG23 VAL A 496 8.252 -8.956 3.490 1.00 0.00 H new ATOM 1019 N LYS A 497 7.803 -3.858 4.131 1.00 0.00 N ATOM 1020 CA LYS A 497 7.207 -2.615 4.604 1.00 0.00 C ATOM 1021 C LYS A 497 6.144 -2.116 3.630 1.00 0.00 C ATOM 1022 O LYS A 497 6.445 -1.796 2.480 1.00 0.00 O ATOM 1023 CB LYS A 497 8.286 -1.546 4.789 1.00 0.00 C ATOM 1024 CG LYS A 497 9.096 -1.713 6.063 1.00 0.00 C ATOM 1025 CD LYS A 497 9.723 -0.401 6.502 1.00 0.00 C ATOM 1026 CE LYS A 497 10.392 -0.529 7.862 1.00 0.00 C ATOM 1027 NZ LYS A 497 11.507 -1.515 7.841 1.00 0.00 N ATOM 0 H LYS A 497 8.562 -3.733 3.461 1.00 0.00 H new ATOM 0 HA LYS A 497 6.731 -2.812 5.565 1.00 0.00 H new ATOM 0 HB2 LYS A 497 8.961 -1.571 3.933 1.00 0.00 H new ATOM 0 HB3 LYS A 497 7.815 -0.563 4.794 1.00 0.00 H new ATOM 0 HG2 LYS A 497 8.453 -2.093 6.857 1.00 0.00 H new ATOM 0 HG3 LYS A 497 9.878 -2.455 5.903 1.00 0.00 H new ATOM 0 HD2 LYS A 497 10.458 -0.083 5.763 1.00 0.00 H new ATOM 0 HD3 LYS A 497 8.957 0.373 6.544 1.00 0.00 H new ATOM 0 HE2 LYS A 497 10.773 0.444 8.172 1.00 0.00 H new ATOM 0 HE3 LYS A 497 9.653 -0.833 8.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 12.001 -1.499 8.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 11.125 -2.467 7.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 12.174 -1.268 7.083 1.00 0.00 H new ATOM 1041 N ILE A 498 4.902 -2.051 4.099 1.00 0.00 N ATOM 1042 CA ILE A 498 3.797 -1.588 3.269 1.00 0.00 C ATOM 1043 C ILE A 498 3.376 -0.173 3.653 1.00 0.00 C ATOM 1044 O ILE A 498 2.931 0.071 4.775 1.00 0.00 O ATOM 1045 CB ILE A 498 2.578 -2.522 3.384 1.00 0.00 C ATOM 1046 CG1 ILE A 498 2.973 -3.958 3.030 1.00 0.00 C ATOM 1047 CG2 ILE A 498 1.454 -2.039 2.480 1.00 0.00 C ATOM 1048 CD1 ILE A 498 2.004 -4.997 3.549 1.00 0.00 C ATOM 0 H ILE A 498 4.636 -2.313 5.048 1.00 0.00 H new ATOM 0 HA ILE A 498 4.153 -1.592 2.239 1.00 0.00 H new ATOM 0 HB ILE A 498 2.222 -2.506 4.414 1.00 0.00 H new ATOM 0 HG12 ILE A 498 3.045 -4.050 1.946 1.00 0.00 H new ATOM 0 HG13 ILE A 498 3.964 -4.164 3.434 1.00 0.00 H new ATOM 0 HG21 ILE A 498 0.599 -2.709 2.572 1.00 0.00 H new ATOM 0 HG22 ILE A 498 1.158 -1.032 2.773 1.00 0.00 H new ATOM 0 HG23 ILE A 498 1.798 -2.029 1.446 1.00 0.00 H new ATOM 0 HD11 ILE A 498 2.347 -5.991 3.261 1.00 0.00 H new ATOM 0 HD12 ILE A 498 1.949 -4.933 4.636 1.00 0.00 H new ATOM 0 HD13 ILE A 498 1.016 -4.817 3.125 1.00 0.00 H new ATOM 1060 N PHE A 499 3.518 0.756 2.714 1.00 0.00 N ATOM 1061 CA PHE A 499 3.152 2.147 2.953 1.00 0.00 C ATOM 1062 C PHE A 499 1.730 2.425 2.475 1.00 0.00 C ATOM 1063 O PHE A 499 1.314 1.951 1.418 1.00 0.00 O ATOM 1064 CB PHE A 499 4.133 3.084 2.244 1.00 0.00 C ATOM 1065 CG PHE A 499 5.571 2.811 2.579 1.00 0.00 C ATOM 1066 CD1 PHE A 499 6.250 1.763 1.978 1.00 0.00 C ATOM 1067 CD2 PHE A 499 6.245 3.603 3.495 1.00 0.00 C ATOM 1068 CE1 PHE A 499 7.574 1.510 2.284 1.00 0.00 C ATOM 1069 CE2 PHE A 499 7.569 3.354 3.805 1.00 0.00 C ATOM 1070 CZ PHE A 499 8.234 2.306 3.199 1.00 0.00 C ATOM 0 H PHE A 499 3.884 0.571 1.780 1.00 0.00 H new ATOM 0 HA PHE A 499 3.198 2.329 4.027 1.00 0.00 H new ATOM 0 HB2 PHE A 499 3.996 2.993 1.167 1.00 0.00 H new ATOM 0 HB3 PHE A 499 3.896 4.114 2.510 1.00 0.00 H new ATOM 0 HD1 PHE A 499 5.739 1.137 1.262 1.00 0.00 H new ATOM 0 HD2 PHE A 499 5.730 4.424 3.972 1.00 0.00 H new ATOM 0 HE1 PHE A 499 8.092 0.690 1.808 1.00 0.00 H new ATOM 0 HE2 PHE A 499 8.083 3.979 4.521 1.00 0.00 H new ATOM 0 HZ PHE A 499 9.268 2.110 3.440 1.00 0.00 H new ATOM 1080 N VAL A 500 0.988 3.197 3.263 1.00 0.00 N ATOM 1081 CA VAL A 500 -0.388 3.539 2.922 1.00 0.00 C ATOM 1082 C VAL A 500 -0.709 4.977 3.314 1.00 0.00 C ATOM 1083 O VAL A 500 -0.875 5.287 4.493 1.00 0.00 O ATOM 1084 CB VAL A 500 -1.389 2.594 3.613 1.00 0.00 C ATOM 1085 CG1 VAL A 500 -2.817 2.976 3.256 1.00 0.00 C ATOM 1086 CG2 VAL A 500 -1.105 1.149 3.235 1.00 0.00 C ATOM 0 H VAL A 500 1.317 3.597 4.142 1.00 0.00 H new ATOM 0 HA VAL A 500 -0.484 3.430 1.842 1.00 0.00 H new ATOM 0 HB VAL A 500 -1.270 2.693 4.692 1.00 0.00 H new ATOM 0 HG11 VAL A 500 -3.510 2.298 3.753 1.00 0.00 H new ATOM 0 HG12 VAL A 500 -3.013 3.998 3.582 1.00 0.00 H new ATOM 0 HG13 VAL A 500 -2.953 2.907 2.177 1.00 0.00 H new ATOM 0 HG21 VAL A 500 -1.822 0.495 3.732 1.00 0.00 H new ATOM 0 HG22 VAL A 500 -1.195 1.031 2.155 1.00 0.00 H new ATOM 0 HG23 VAL A 500 -0.095 0.883 3.546 1.00 0.00 H new ATOM 1096 N GLU A 501 -0.796 5.851 2.316 1.00 0.00 N ATOM 1097 CA GLU A 501 -1.098 7.257 2.556 1.00 0.00 C ATOM 1098 C GLU A 501 -2.590 7.531 2.385 1.00 0.00 C ATOM 1099 O GLU A 501 -3.224 7.020 1.462 1.00 0.00 O ATOM 1100 CB GLU A 501 -0.293 8.145 1.605 1.00 0.00 C ATOM 1101 CG GLU A 501 -0.387 9.626 1.929 1.00 0.00 C ATOM 1102 CD GLU A 501 0.754 10.427 1.332 1.00 0.00 C ATOM 1103 OE1 GLU A 501 1.100 10.182 0.157 1.00 0.00 O ATOM 1104 OE2 GLU A 501 1.301 11.299 2.039 1.00 0.00 O ATOM 0 H GLU A 501 -0.662 5.610 1.334 1.00 0.00 H new ATOM 0 HA GLU A 501 -0.819 7.491 3.583 1.00 0.00 H new ATOM 0 HB2 GLU A 501 0.753 7.841 1.636 1.00 0.00 H new ATOM 0 HB3 GLU A 501 -0.643 7.982 0.586 1.00 0.00 H new ATOM 0 HG2 GLU A 501 -1.334 10.016 1.556 1.00 0.00 H new ATOM 0 HG3 GLU A 501 -0.392 9.758 3.011 1.00 0.00 H new ATOM 1111 N PHE A 502 -3.144 8.339 3.282 1.00 0.00 N ATOM 1112 CA PHE A 502 -4.561 8.680 3.232 1.00 0.00 C ATOM 1113 C PHE A 502 -4.755 10.139 2.830 1.00 0.00 C ATOM 1114 O PHE A 502 -3.812 10.930 2.846 1.00 0.00 O ATOM 1115 CB PHE A 502 -5.217 8.422 4.590 1.00 0.00 C ATOM 1116 CG PHE A 502 -5.311 6.966 4.944 1.00 0.00 C ATOM 1117 CD1 PHE A 502 -6.398 6.209 4.537 1.00 0.00 C ATOM 1118 CD2 PHE A 502 -4.312 6.353 5.683 1.00 0.00 C ATOM 1119 CE1 PHE A 502 -6.488 4.868 4.861 1.00 0.00 C ATOM 1120 CE2 PHE A 502 -4.396 5.012 6.009 1.00 0.00 C ATOM 1121 CZ PHE A 502 -5.486 4.269 5.598 1.00 0.00 C ATOM 0 H PHE A 502 -2.633 8.770 4.053 1.00 0.00 H new ATOM 0 HA PHE A 502 -5.035 8.048 2.481 1.00 0.00 H new ATOM 0 HB2 PHE A 502 -4.649 8.940 5.363 1.00 0.00 H new ATOM 0 HB3 PHE A 502 -6.218 8.853 4.588 1.00 0.00 H new ATOM 0 HD1 PHE A 502 -7.184 6.672 3.960 1.00 0.00 H new ATOM 0 HD2 PHE A 502 -3.458 6.929 6.008 1.00 0.00 H new ATOM 0 HE1 PHE A 502 -7.341 4.290 4.538 1.00 0.00 H new ATOM 0 HE2 PHE A 502 -3.610 4.546 6.585 1.00 0.00 H new ATOM 0 HZ PHE A 502 -5.554 3.222 5.853 1.00 0.00 H new ATOM 1131 N SER A 503 -5.986 10.487 2.467 1.00 0.00 N ATOM 1132 CA SER A 503 -6.305 11.849 2.055 1.00 0.00 C ATOM 1133 C SER A 503 -5.933 12.848 3.147 1.00 0.00 C ATOM 1134 O SER A 503 -5.362 13.904 2.870 1.00 0.00 O ATOM 1135 CB SER A 503 -7.793 11.969 1.724 1.00 0.00 C ATOM 1136 OG SER A 503 -8.594 11.563 2.821 1.00 0.00 O ATOM 0 H SER A 503 -6.778 9.845 2.450 1.00 0.00 H new ATOM 0 HA SER A 503 -5.722 12.078 1.163 1.00 0.00 H new ATOM 0 HB2 SER A 503 -8.028 13.000 1.460 1.00 0.00 H new ATOM 0 HB3 SER A 503 -8.026 11.356 0.853 1.00 0.00 H new ATOM 0 HG SER A 503 -9.541 11.651 2.585 1.00 0.00 H new ATOM 1142 N ILE A 504 -6.260 12.507 4.389 1.00 0.00 N ATOM 1143 CA ILE A 504 -5.960 13.372 5.523 1.00 0.00 C ATOM 1144 C ILE A 504 -5.188 12.618 6.601 1.00 0.00 C ATOM 1145 O ILE A 504 -5.032 11.399 6.529 1.00 0.00 O ATOM 1146 CB ILE A 504 -7.244 13.956 6.140 1.00 0.00 C ATOM 1147 CG1 ILE A 504 -8.285 12.853 6.346 1.00 0.00 C ATOM 1148 CG2 ILE A 504 -7.802 15.060 5.256 1.00 0.00 C ATOM 1149 CD1 ILE A 504 -9.493 13.303 7.137 1.00 0.00 C ATOM 0 H ILE A 504 -6.733 11.637 4.635 1.00 0.00 H new ATOM 0 HA ILE A 504 -5.345 14.188 5.144 1.00 0.00 H new ATOM 0 HB ILE A 504 -7.000 14.385 7.112 1.00 0.00 H new ATOM 0 HG12 ILE A 504 -8.613 12.488 5.373 1.00 0.00 H new ATOM 0 HG13 ILE A 504 -7.816 12.014 6.860 1.00 0.00 H new ATOM 0 HG21 ILE A 504 -8.710 15.463 5.706 1.00 0.00 H new ATOM 0 HG22 ILE A 504 -7.063 15.855 5.156 1.00 0.00 H new ATOM 0 HG23 ILE A 504 -8.034 14.655 4.271 1.00 0.00 H new ATOM 0 HD11 ILE A 504 -10.188 12.471 7.244 1.00 0.00 H new ATOM 0 HD12 ILE A 504 -9.177 13.641 8.124 1.00 0.00 H new ATOM 0 HD13 ILE A 504 -9.986 14.122 6.614 1.00 0.00 H new ATOM 1161 N ALA A 505 -4.709 13.351 7.600 1.00 0.00 N ATOM 1162 CA ALA A 505 -3.957 12.751 8.695 1.00 0.00 C ATOM 1163 C ALA A 505 -4.874 11.963 9.624 1.00 0.00 C ATOM 1164 O ALA A 505 -4.530 10.868 10.069 1.00 0.00 O ATOM 1165 CB ALA A 505 -3.212 13.825 9.474 1.00 0.00 C ATOM 0 H ALA A 505 -4.828 14.361 7.674 1.00 0.00 H new ATOM 0 HA ALA A 505 -3.232 12.058 8.268 1.00 0.00 H new ATOM 0 HB1 ALA A 505 -2.655 13.363 10.289 1.00 0.00 H new ATOM 0 HB2 ALA A 505 -2.521 14.343 8.809 1.00 0.00 H new ATOM 0 HB3 ALA A 505 -3.926 14.540 9.883 1.00 0.00 H new ATOM 1171 N SER A 506 -6.043 12.527 9.913 1.00 0.00 N ATOM 1172 CA SER A 506 -7.008 11.878 10.792 1.00 0.00 C ATOM 1173 C SER A 506 -7.207 10.417 10.398 1.00 0.00 C ATOM 1174 O SER A 506 -6.853 9.508 11.147 1.00 0.00 O ATOM 1175 CB SER A 506 -8.347 12.617 10.749 1.00 0.00 C ATOM 1176 OG SER A 506 -9.203 12.184 11.792 1.00 0.00 O ATOM 0 H SER A 506 -6.344 13.432 9.551 1.00 0.00 H new ATOM 0 HA SER A 506 -6.615 11.911 11.808 1.00 0.00 H new ATOM 0 HB2 SER A 506 -8.177 13.690 10.836 1.00 0.00 H new ATOM 0 HB3 SER A 506 -8.828 12.448 9.786 1.00 0.00 H new ATOM 0 HG SER A 506 -10.051 12.673 11.743 1.00 0.00 H new ATOM 1182 N GLU A 507 -7.776 10.203 9.215 1.00 0.00 N ATOM 1183 CA GLU A 507 -8.023 8.853 8.721 1.00 0.00 C ATOM 1184 C GLU A 507 -6.827 7.946 8.997 1.00 0.00 C ATOM 1185 O GLU A 507 -6.987 6.798 9.413 1.00 0.00 O ATOM 1186 CB GLU A 507 -8.320 8.882 7.221 1.00 0.00 C ATOM 1187 CG GLU A 507 -9.615 9.595 6.870 1.00 0.00 C ATOM 1188 CD GLU A 507 -10.684 9.417 7.930 1.00 0.00 C ATOM 1189 OE1 GLU A 507 -10.992 8.256 8.272 1.00 0.00 O ATOM 1190 OE2 GLU A 507 -11.213 10.437 8.418 1.00 0.00 O ATOM 0 H GLU A 507 -8.074 10.946 8.582 1.00 0.00 H new ATOM 0 HA GLU A 507 -8.889 8.453 9.248 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -7.494 9.372 6.705 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -8.366 7.859 6.849 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -9.415 10.658 6.736 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -9.987 9.218 5.917 1.00 0.00 H new ATOM 1197 N THR A 508 -5.628 8.468 8.761 1.00 0.00 N ATOM 1198 CA THR A 508 -4.405 7.706 8.981 1.00 0.00 C ATOM 1199 C THR A 508 -4.314 7.218 10.422 1.00 0.00 C ATOM 1200 O THR A 508 -4.399 6.019 10.689 1.00 0.00 O ATOM 1201 CB THR A 508 -3.155 8.544 8.655 1.00 0.00 C ATOM 1202 OG1 THR A 508 -3.330 9.219 7.404 1.00 0.00 O ATOM 1203 CG2 THR A 508 -1.915 7.665 8.593 1.00 0.00 C ATOM 0 H THR A 508 -5.477 9.416 8.417 1.00 0.00 H new ATOM 0 HA THR A 508 -4.442 6.847 8.311 1.00 0.00 H new ATOM 0 HB THR A 508 -3.021 9.279 9.449 1.00 0.00 H new ATOM 0 HG1 THR A 508 -3.829 10.050 7.548 1.00 0.00 H new ATOM 0 HG21 THR A 508 -1.045 8.279 8.361 1.00 0.00 H new ATOM 0 HG22 THR A 508 -1.768 7.175 9.556 1.00 0.00 H new ATOM 0 HG23 THR A 508 -2.043 6.910 7.818 1.00 0.00 H new ATOM 1211 N HIS A 509 -4.141 8.155 11.350 1.00 0.00 N ATOM 1212 CA HIS A 509 -4.039 7.819 12.766 1.00 0.00 C ATOM 1213 C HIS A 509 -5.025 6.715 13.134 1.00 0.00 C ATOM 1214 O HIS A 509 -4.705 5.815 13.911 1.00 0.00 O ATOM 1215 CB HIS A 509 -4.297 9.058 13.625 1.00 0.00 C ATOM 1216 CG HIS A 509 -3.097 9.939 13.781 1.00 0.00 C ATOM 1217 ND1 HIS A 509 -2.574 10.290 15.008 1.00 0.00 N ATOM 1218 CD2 HIS A 509 -2.314 10.542 12.855 1.00 0.00 C ATOM 1219 CE1 HIS A 509 -1.524 11.070 14.830 1.00 0.00 C ATOM 1220 NE2 HIS A 509 -1.344 11.238 13.532 1.00 0.00 N ATOM 0 H HIS A 509 -4.069 9.152 11.147 1.00 0.00 H new ATOM 0 HA HIS A 509 -3.029 7.458 12.957 1.00 0.00 H new ATOM 0 HB2 HIS A 509 -5.107 9.636 13.180 1.00 0.00 H new ATOM 0 HB3 HIS A 509 -4.636 8.742 14.611 1.00 0.00 H new ATOM 0 HD2 HIS A 509 -2.431 10.486 11.783 1.00 0.00 H new ATOM 0 HE1 HIS A 509 -0.915 11.498 15.613 1.00 0.00 H new ATOM 0 HE2 HIS A 509 -0.605 11.794 13.103 1.00 0.00 H new ATOM 1228 N LYS A 510 -6.227 6.790 12.573 1.00 0.00 N ATOM 1229 CA LYS A 510 -7.261 5.798 12.841 1.00 0.00 C ATOM 1230 C LYS A 510 -6.814 4.411 12.392 1.00 0.00 C ATOM 1231 O LYS A 510 -6.709 3.490 13.201 1.00 0.00 O ATOM 1232 CB LYS A 510 -8.561 6.181 12.131 1.00 0.00 C ATOM 1233 CG LYS A 510 -9.686 5.182 12.341 1.00 0.00 C ATOM 1234 CD LYS A 510 -11.006 5.706 11.798 1.00 0.00 C ATOM 1235 CE LYS A 510 -11.656 6.685 12.764 1.00 0.00 C ATOM 1236 NZ LYS A 510 -12.181 6.001 13.978 1.00 0.00 N ATOM 0 H LYS A 510 -6.509 7.529 11.929 1.00 0.00 H new ATOM 0 HA LYS A 510 -7.435 5.774 13.917 1.00 0.00 H new ATOM 0 HB2 LYS A 510 -8.884 7.160 12.486 1.00 0.00 H new ATOM 0 HB3 LYS A 510 -8.367 6.278 11.063 1.00 0.00 H new ATOM 0 HG2 LYS A 510 -9.436 4.242 11.848 1.00 0.00 H new ATOM 0 HG3 LYS A 510 -9.789 4.967 13.405 1.00 0.00 H new ATOM 0 HD2 LYS A 510 -10.837 6.197 10.839 1.00 0.00 H new ATOM 0 HD3 LYS A 510 -11.682 4.871 11.614 1.00 0.00 H new ATOM 0 HE2 LYS A 510 -10.928 7.441 13.059 1.00 0.00 H new ATOM 0 HE3 LYS A 510 -12.470 7.206 12.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 -12.855 6.626 14.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 -12.663 5.122 13.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 -11.393 5.776 14.618 1.00 0.00 H new ATOM 1250 N ALA A 511 -6.550 4.270 11.097 1.00 0.00 N ATOM 1251 CA ALA A 511 -6.110 2.996 10.541 1.00 0.00 C ATOM 1252 C ALA A 511 -5.027 2.363 11.409 1.00 0.00 C ATOM 1253 O ALA A 511 -5.037 1.155 11.647 1.00 0.00 O ATOM 1254 CB ALA A 511 -5.604 3.187 9.119 1.00 0.00 C ATOM 0 H ALA A 511 -6.633 5.022 10.413 1.00 0.00 H new ATOM 0 HA ALA A 511 -6.966 2.321 10.523 1.00 0.00 H new ATOM 0 HB1 ALA A 511 -5.279 2.228 8.717 1.00 0.00 H new ATOM 0 HB2 ALA A 511 -6.405 3.588 8.498 1.00 0.00 H new ATOM 0 HB3 ALA A 511 -4.765 3.882 9.122 1.00 0.00 H new ATOM 1260 N ILE A 512 -4.095 3.186 11.878 1.00 0.00 N ATOM 1261 CA ILE A 512 -3.006 2.705 12.719 1.00 0.00 C ATOM 1262 C ILE A 512 -3.534 2.150 14.038 1.00 0.00 C ATOM 1263 O ILE A 512 -3.377 0.966 14.331 1.00 0.00 O ATOM 1264 CB ILE A 512 -1.989 3.823 13.016 1.00 0.00 C ATOM 1265 CG1 ILE A 512 -1.266 4.238 11.733 1.00 0.00 C ATOM 1266 CG2 ILE A 512 -0.990 3.364 14.068 1.00 0.00 C ATOM 1267 CD1 ILE A 512 -0.357 5.434 11.911 1.00 0.00 C ATOM 0 H ILE A 512 -4.072 4.188 11.690 1.00 0.00 H new ATOM 0 HA ILE A 512 -2.508 1.909 12.166 1.00 0.00 H new ATOM 0 HB ILE A 512 -2.525 4.688 13.405 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -0.678 3.396 11.369 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -2.006 4.465 10.966 1.00 0.00 H new ATOM 0 HG21 ILE A 512 -0.278 4.165 14.267 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -1.519 3.112 14.987 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -0.456 2.486 13.704 1.00 0.00 H new ATOM 0 HD11 ILE A 512 0.122 5.671 10.961 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -0.943 6.290 12.246 1.00 0.00 H new ATOM 0 HD13 ILE A 512 0.406 5.204 12.655 1.00 0.00 H new ATOM 1279 N GLN A 513 -4.162 3.015 14.828 1.00 0.00 N ATOM 1280 CA GLN A 513 -4.714 2.611 16.116 1.00 0.00 C ATOM 1281 C GLN A 513 -5.482 1.299 15.991 1.00 0.00 C ATOM 1282 O GLN A 513 -5.561 0.522 16.941 1.00 0.00 O ATOM 1283 CB GLN A 513 -5.633 3.703 16.666 1.00 0.00 C ATOM 1284 CG GLN A 513 -4.886 4.912 17.205 1.00 0.00 C ATOM 1285 CD GLN A 513 -4.492 4.753 18.660 1.00 0.00 C ATOM 1286 OE1 GLN A 513 -3.313 4.822 19.007 1.00 0.00 O ATOM 1287 NE2 GLN A 513 -5.480 4.539 19.521 1.00 0.00 N ATOM 0 H GLN A 513 -4.301 3.999 14.599 1.00 0.00 H new ATOM 0 HA GLN A 513 -3.885 2.462 16.808 1.00 0.00 H new ATOM 0 HB2 GLN A 513 -6.311 4.027 15.877 1.00 0.00 H new ATOM 0 HB3 GLN A 513 -6.248 3.282 17.461 1.00 0.00 H new ATOM 0 HG2 GLN A 513 -3.991 5.078 16.606 1.00 0.00 H new ATOM 0 HG3 GLN A 513 -5.511 5.799 17.096 1.00 0.00 H new ATOM 0 HE21 GLN A 513 -6.443 4.489 19.190 1.00 0.00 H new ATOM 0 HE22 GLN A 513 -5.276 4.425 20.514 1.00 0.00 H new ATOM 1296 N ALA A 514 -6.047 1.060 14.812 1.00 0.00 N ATOM 1297 CA ALA A 514 -6.807 -0.159 14.562 1.00 0.00 C ATOM 1298 C ALA A 514 -5.883 -1.323 14.221 1.00 0.00 C ATOM 1299 O ALA A 514 -5.994 -2.406 14.796 1.00 0.00 O ATOM 1300 CB ALA A 514 -7.811 0.066 13.441 1.00 0.00 C ATOM 0 H ALA A 514 -5.993 1.694 14.015 1.00 0.00 H new ATOM 0 HA ALA A 514 -7.347 -0.414 15.474 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -8.371 -0.852 13.265 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -8.499 0.863 13.723 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -7.283 0.349 12.531 1.00 0.00 H new ATOM 1306 N LEU A 515 -4.971 -1.092 13.283 1.00 0.00 N ATOM 1307 CA LEU A 515 -4.027 -2.123 12.865 1.00 0.00 C ATOM 1308 C LEU A 515 -2.718 -2.008 13.639 1.00 0.00 C ATOM 1309 O LEU A 515 -1.655 -2.375 13.139 1.00 0.00 O ATOM 1310 CB LEU A 515 -3.755 -2.014 11.363 1.00 0.00 C ATOM 1311 CG LEU A 515 -4.987 -1.893 10.465 1.00 0.00 C ATOM 1312 CD1 LEU A 515 -4.583 -1.486 9.057 1.00 0.00 C ATOM 1313 CD2 LEU A 515 -5.762 -3.202 10.442 1.00 0.00 C ATOM 0 H LEU A 515 -4.865 -0.201 12.798 1.00 0.00 H new ATOM 0 HA LEU A 515 -4.470 -3.096 13.079 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -3.118 -1.146 11.191 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -3.188 -2.892 11.052 1.00 0.00 H new ATOM 0 HG LEU A 515 -5.635 -1.118 10.874 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -5.473 -1.405 8.432 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -4.073 -0.523 9.089 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -3.913 -2.238 8.639 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -6.635 -3.097 9.798 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -5.122 -3.997 10.059 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -6.085 -3.452 11.453 1.00 0.00 H new ATOM 1325 N ASN A 516 -2.803 -1.498 14.864 1.00 0.00 N ATOM 1326 CA ASN A 516 -1.625 -1.337 15.708 1.00 0.00 C ATOM 1327 C ASN A 516 -1.384 -2.587 16.549 1.00 0.00 C ATOM 1328 O ASN A 516 -0.391 -2.682 17.269 1.00 0.00 O ATOM 1329 CB ASN A 516 -1.789 -0.120 16.620 1.00 0.00 C ATOM 1330 CG ASN A 516 -0.933 -0.213 17.869 1.00 0.00 C ATOM 1331 OD1 ASN A 516 0.153 0.363 17.935 1.00 0.00 O ATOM 1332 ND2 ASN A 516 -1.420 -0.942 18.866 1.00 0.00 N ATOM 0 H ASN A 516 -3.675 -1.189 15.294 1.00 0.00 H new ATOM 0 HA ASN A 516 -0.762 -1.184 15.060 1.00 0.00 H new ATOM 0 HB2 ASN A 516 -1.525 0.782 16.068 1.00 0.00 H new ATOM 0 HB3 ASN A 516 -2.836 -0.023 16.907 1.00 0.00 H new ATOM 0 HD21 ASN A 516 -0.889 -1.042 19.731 1.00 0.00 H new ATOM 0 HD22 ASN A 516 -2.325 -1.402 18.767 1.00 0.00 H new ATOM 1339 N GLY A 517 -2.300 -3.546 16.451 1.00 0.00 N ATOM 1340 CA GLY A 517 -2.168 -4.778 17.207 1.00 0.00 C ATOM 1341 C GLY A 517 -3.105 -5.863 16.715 1.00 0.00 C ATOM 1342 O GLY A 517 -3.445 -6.783 17.459 1.00 0.00 O ATOM 0 H GLY A 517 -3.131 -3.492 15.862 1.00 0.00 H new ATOM 0 HA2 GLY A 517 -1.140 -5.133 17.141 1.00 0.00 H new ATOM 0 HA3 GLY A 517 -2.369 -4.578 18.259 1.00 0.00 H new ATOM 1346 N ARG A 518 -3.524 -5.756 15.458 1.00 0.00 N ATOM 1347 CA ARG A 518 -4.430 -6.735 14.869 1.00 0.00 C ATOM 1348 C ARG A 518 -3.756 -8.099 14.754 1.00 0.00 C ATOM 1349 O ARG A 518 -2.529 -8.196 14.730 1.00 0.00 O ATOM 1350 CB ARG A 518 -4.894 -6.265 13.488 1.00 0.00 C ATOM 1351 CG ARG A 518 -6.169 -5.439 13.523 1.00 0.00 C ATOM 1352 CD ARG A 518 -7.021 -5.678 12.287 1.00 0.00 C ATOM 1353 NE ARG A 518 -7.796 -6.912 12.387 1.00 0.00 N ATOM 1354 CZ ARG A 518 -8.796 -7.221 11.569 1.00 0.00 C ATOM 1355 NH1 ARG A 518 -9.140 -6.391 10.594 1.00 0.00 N ATOM 1356 NH2 ARG A 518 -9.453 -8.363 11.724 1.00 0.00 N ATOM 0 H ARG A 518 -3.251 -5.002 14.828 1.00 0.00 H new ATOM 0 HA ARG A 518 -5.297 -6.831 15.523 1.00 0.00 H new ATOM 0 HB2 ARG A 518 -4.101 -5.675 13.029 1.00 0.00 H new ATOM 0 HB3 ARG A 518 -5.052 -7.136 12.851 1.00 0.00 H new ATOM 0 HG2 ARG A 518 -6.742 -5.690 14.416 1.00 0.00 H new ATOM 0 HG3 ARG A 518 -5.917 -4.381 13.593 1.00 0.00 H new ATOM 0 HD2 ARG A 518 -7.698 -4.835 12.145 1.00 0.00 H new ATOM 0 HD3 ARG A 518 -6.379 -5.723 11.407 1.00 0.00 H new ATOM 0 HE ARG A 518 -7.556 -7.573 13.126 1.00 0.00 H new ATOM 0 HH11 ARG A 518 -8.636 -5.513 10.471 1.00 0.00 H new ATOM 0 HH12 ARG A 518 -9.908 -6.631 9.967 1.00 0.00 H new ATOM 0 HH21 ARG A 518 -9.190 -9.005 12.472 1.00 0.00 H new ATOM 0 HH22 ARG A 518 -10.221 -8.599 11.095 1.00 0.00 H new ATOM 1370 N TRP A 519 -4.567 -9.149 14.685 1.00 0.00 N ATOM 1371 CA TRP A 519 -4.049 -10.508 14.573 1.00 0.00 C ATOM 1372 C TRP A 519 -4.248 -11.052 13.163 1.00 0.00 C ATOM 1373 O TRP A 519 -5.376 -11.156 12.681 1.00 0.00 O ATOM 1374 CB TRP A 519 -4.737 -11.422 15.588 1.00 0.00 C ATOM 1375 CG TRP A 519 -3.993 -11.536 16.885 1.00 0.00 C ATOM 1376 CD1 TRP A 519 -4.273 -10.883 18.051 1.00 0.00 C ATOM 1377 CD2 TRP A 519 -2.845 -12.351 17.145 1.00 0.00 C ATOM 1378 NE1 TRP A 519 -3.369 -11.243 19.020 1.00 0.00 N ATOM 1379 CE2 TRP A 519 -2.483 -12.143 18.490 1.00 0.00 C ATOM 1380 CE3 TRP A 519 -2.089 -13.238 16.373 1.00 0.00 C ATOM 1381 CZ2 TRP A 519 -1.398 -12.789 19.077 1.00 0.00 C ATOM 1382 CZ3 TRP A 519 -1.012 -13.878 16.957 1.00 0.00 C ATOM 1383 CH2 TRP A 519 -0.675 -13.652 18.299 1.00 0.00 C ATOM 0 H TRP A 519 -5.585 -9.086 14.705 1.00 0.00 H new ATOM 0 HA TRP A 519 -2.980 -10.482 14.784 1.00 0.00 H new ATOM 0 HB2 TRP A 519 -5.740 -11.044 15.785 1.00 0.00 H new ATOM 0 HB3 TRP A 519 -4.850 -12.415 15.154 1.00 0.00 H new ATOM 0 HD1 TRP A 519 -5.086 -10.186 18.191 1.00 0.00 H new ATOM 0 HE1 TRP A 519 -3.359 -10.896 19.979 1.00 0.00 H new ATOM 0 HE3 TRP A 519 -2.342 -13.420 15.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 519 -1.136 -12.615 20.110 1.00 0.00 H new ATOM 0 HZ3 TRP A 519 -0.420 -14.564 16.369 1.00 0.00 H new ATOM 0 HH2 TRP A 519 0.171 -14.169 18.727 1.00 0.00 H new ATOM 1394 N PHE A 520 -3.146 -11.399 12.506 1.00 0.00 N ATOM 1395 CA PHE A 520 -3.201 -11.933 11.150 1.00 0.00 C ATOM 1396 C PHE A 520 -3.336 -13.452 11.169 1.00 0.00 C ATOM 1397 O PHE A 520 -2.991 -14.105 12.153 1.00 0.00 O ATOM 1398 CB PHE A 520 -1.947 -11.530 10.370 1.00 0.00 C ATOM 1399 CG PHE A 520 -2.080 -11.715 8.886 1.00 0.00 C ATOM 1400 CD1 PHE A 520 -2.603 -10.706 8.093 1.00 0.00 C ATOM 1401 CD2 PHE A 520 -1.680 -12.897 8.283 1.00 0.00 C ATOM 1402 CE1 PHE A 520 -2.726 -10.874 6.726 1.00 0.00 C ATOM 1403 CE2 PHE A 520 -1.801 -13.071 6.917 1.00 0.00 C ATOM 1404 CZ PHE A 520 -2.324 -12.057 6.138 1.00 0.00 C ATOM 0 H PHE A 520 -2.205 -11.320 12.890 1.00 0.00 H new ATOM 0 HA PHE A 520 -4.078 -11.515 10.656 1.00 0.00 H new ATOM 0 HB2 PHE A 520 -1.719 -10.485 10.579 1.00 0.00 H new ATOM 0 HB3 PHE A 520 -1.102 -12.118 10.727 1.00 0.00 H new ATOM 0 HD1 PHE A 520 -2.918 -9.778 8.548 1.00 0.00 H new ATOM 0 HD2 PHE A 520 -1.269 -13.692 8.888 1.00 0.00 H new ATOM 0 HE1 PHE A 520 -3.136 -10.081 6.119 1.00 0.00 H new ATOM 0 HE2 PHE A 520 -1.487 -13.998 6.460 1.00 0.00 H new ATOM 0 HZ PHE A 520 -2.418 -12.189 5.070 1.00 0.00 H new ATOM 1414 N ALA A 521 -3.841 -14.009 10.073 1.00 0.00 N ATOM 1415 CA ALA A 521 -4.020 -15.451 9.961 1.00 0.00 C ATOM 1416 C ALA A 521 -2.725 -16.192 10.276 1.00 0.00 C ATOM 1417 O ALA A 521 -1.969 -16.550 9.374 1.00 0.00 O ATOM 1418 CB ALA A 521 -4.515 -15.816 8.569 1.00 0.00 C ATOM 0 H ALA A 521 -4.133 -13.483 9.250 1.00 0.00 H new ATOM 0 HA ALA A 521 -4.769 -15.756 10.692 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -4.644 -16.896 8.500 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -5.469 -15.324 8.382 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -3.787 -15.490 7.827 1.00 0.00 H new ATOM 1424 N GLY A 522 -2.474 -16.417 11.562 1.00 0.00 N ATOM 1425 CA GLY A 522 -1.269 -17.113 11.972 1.00 0.00 C ATOM 1426 C GLY A 522 -0.076 -16.185 12.093 1.00 0.00 C ATOM 1427 O GLY A 522 1.068 -16.637 12.140 1.00 0.00 O ATOM 0 H GLY A 522 -3.084 -16.129 12.327 1.00 0.00 H new ATOM 0 HA2 GLY A 522 -1.444 -17.602 12.930 1.00 0.00 H new ATOM 0 HA3 GLY A 522 -1.043 -17.898 11.250 1.00 0.00 H new ATOM 1431 N ARG A 523 -0.343 -14.884 12.142 1.00 0.00 N ATOM 1432 CA ARG A 523 0.717 -13.890 12.255 1.00 0.00 C ATOM 1433 C ARG A 523 0.229 -12.658 13.012 1.00 0.00 C ATOM 1434 O ARG A 523 -0.961 -12.522 13.298 1.00 0.00 O ATOM 1435 CB ARG A 523 1.215 -13.484 10.867 1.00 0.00 C ATOM 1436 CG ARG A 523 2.172 -14.489 10.246 1.00 0.00 C ATOM 1437 CD ARG A 523 3.561 -14.385 10.855 1.00 0.00 C ATOM 1438 NE ARG A 523 4.362 -15.579 10.598 1.00 0.00 N ATOM 1439 CZ ARG A 523 5.685 -15.616 10.715 1.00 0.00 C ATOM 1440 NH1 ARG A 523 6.352 -14.531 11.082 1.00 0.00 N ATOM 1441 NH2 ARG A 523 6.343 -16.741 10.464 1.00 0.00 N ATOM 0 H ARG A 523 -1.285 -14.494 12.105 1.00 0.00 H new ATOM 0 HA ARG A 523 1.540 -14.336 12.813 1.00 0.00 H new ATOM 0 HB2 ARG A 523 0.358 -13.355 10.206 1.00 0.00 H new ATOM 0 HB3 ARG A 523 1.712 -12.517 10.937 1.00 0.00 H new ATOM 0 HG2 ARG A 523 1.785 -15.498 10.389 1.00 0.00 H new ATOM 0 HG3 ARG A 523 2.231 -14.320 9.171 1.00 0.00 H new ATOM 0 HD2 ARG A 523 4.071 -13.512 10.448 1.00 0.00 H new ATOM 0 HD3 ARG A 523 3.475 -14.231 11.931 1.00 0.00 H new ATOM 0 HE ARG A 523 3.879 -16.431 10.313 1.00 0.00 H new ATOM 0 HH11 ARG A 523 5.850 -13.665 11.275 1.00 0.00 H new ATOM 0 HH12 ARG A 523 7.368 -14.562 11.171 1.00 0.00 H new ATOM 0 HH21 ARG A 523 5.833 -17.578 10.181 1.00 0.00 H new ATOM 0 HH22 ARG A 523 7.359 -16.769 10.554 1.00 0.00 H new ATOM 1455 N LYS A 524 1.156 -11.763 13.335 1.00 0.00 N ATOM 1456 CA LYS A 524 0.823 -10.541 14.058 1.00 0.00 C ATOM 1457 C LYS A 524 1.155 -9.308 13.225 1.00 0.00 C ATOM 1458 O LYS A 524 2.223 -9.225 12.618 1.00 0.00 O ATOM 1459 CB LYS A 524 1.577 -10.490 15.388 1.00 0.00 C ATOM 1460 CG LYS A 524 1.136 -9.352 16.294 1.00 0.00 C ATOM 1461 CD LYS A 524 1.344 -9.694 17.760 1.00 0.00 C ATOM 1462 CE LYS A 524 0.534 -8.780 18.665 1.00 0.00 C ATOM 1463 NZ LYS A 524 1.183 -8.596 19.993 1.00 0.00 N ATOM 0 H LYS A 524 2.145 -11.861 13.107 1.00 0.00 H new ATOM 0 HA LYS A 524 -0.249 -10.546 14.255 1.00 0.00 H new ATOM 0 HB2 LYS A 524 1.437 -11.436 15.912 1.00 0.00 H new ATOM 0 HB3 LYS A 524 2.644 -10.391 15.188 1.00 0.00 H new ATOM 0 HG2 LYS A 524 1.697 -8.451 16.047 1.00 0.00 H new ATOM 0 HG3 LYS A 524 0.083 -9.131 16.117 1.00 0.00 H new ATOM 0 HD2 LYS A 524 1.057 -10.731 17.937 1.00 0.00 H new ATOM 0 HD3 LYS A 524 2.402 -9.609 18.008 1.00 0.00 H new ATOM 0 HE2 LYS A 524 0.410 -7.810 18.184 1.00 0.00 H new ATOM 0 HE3 LYS A 524 -0.464 -9.197 18.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 0.600 -7.966 20.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 1.278 -9.519 20.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 2.125 -8.174 19.864 1.00 0.00 H new ATOM 1477 N VAL A 525 0.233 -8.350 13.201 1.00 0.00 N ATOM 1478 CA VAL A 525 0.429 -7.119 12.444 1.00 0.00 C ATOM 1479 C VAL A 525 0.854 -5.974 13.357 1.00 0.00 C ATOM 1480 O VAL A 525 0.471 -5.924 14.526 1.00 0.00 O ATOM 1481 CB VAL A 525 -0.852 -6.713 11.691 1.00 0.00 C ATOM 1482 CG1 VAL A 525 -0.663 -5.371 11.001 1.00 0.00 C ATOM 1483 CG2 VAL A 525 -1.243 -7.787 10.688 1.00 0.00 C ATOM 0 H VAL A 525 -0.657 -8.403 13.697 1.00 0.00 H new ATOM 0 HA VAL A 525 1.220 -7.315 11.720 1.00 0.00 H new ATOM 0 HB VAL A 525 -1.661 -6.612 12.414 1.00 0.00 H new ATOM 0 HG11 VAL A 525 -1.578 -5.101 10.474 1.00 0.00 H new ATOM 0 HG12 VAL A 525 -0.434 -4.608 11.745 1.00 0.00 H new ATOM 0 HG13 VAL A 525 0.159 -5.441 10.288 1.00 0.00 H new ATOM 0 HG21 VAL A 525 -2.150 -7.484 10.165 1.00 0.00 H new ATOM 0 HG22 VAL A 525 -0.437 -7.923 9.967 1.00 0.00 H new ATOM 0 HG23 VAL A 525 -1.423 -8.726 11.212 1.00 0.00 H new ATOM 1493 N VAL A 526 1.647 -5.056 12.815 1.00 0.00 N ATOM 1494 CA VAL A 526 2.123 -3.910 13.581 1.00 0.00 C ATOM 1495 C VAL A 526 2.137 -2.647 12.727 1.00 0.00 C ATOM 1496 O VAL A 526 2.969 -2.498 11.833 1.00 0.00 O ATOM 1497 CB VAL A 526 3.538 -4.155 14.137 1.00 0.00 C ATOM 1498 CG1 VAL A 526 4.180 -2.843 14.563 1.00 0.00 C ATOM 1499 CG2 VAL A 526 3.491 -5.136 15.299 1.00 0.00 C ATOM 0 H VAL A 526 1.973 -5.083 11.849 1.00 0.00 H new ATOM 0 HA VAL A 526 1.432 -3.776 14.413 1.00 0.00 H new ATOM 0 HB VAL A 526 4.149 -4.591 13.347 1.00 0.00 H new ATOM 0 HG11 VAL A 526 5.179 -3.037 14.953 1.00 0.00 H new ATOM 0 HG12 VAL A 526 4.249 -2.176 13.704 1.00 0.00 H new ATOM 0 HG13 VAL A 526 3.572 -2.375 15.338 1.00 0.00 H new ATOM 0 HG21 VAL A 526 4.499 -5.298 15.680 1.00 0.00 H new ATOM 0 HG22 VAL A 526 2.864 -4.730 16.093 1.00 0.00 H new ATOM 0 HG23 VAL A 526 3.076 -6.084 14.958 1.00 0.00 H new ATOM 1509 N ALA A 527 1.209 -1.738 13.010 1.00 0.00 N ATOM 1510 CA ALA A 527 1.115 -0.486 12.270 1.00 0.00 C ATOM 1511 C ALA A 527 1.839 0.640 13.002 1.00 0.00 C ATOM 1512 O ALA A 527 1.881 0.666 14.232 1.00 0.00 O ATOM 1513 CB ALA A 527 -0.343 -0.116 12.040 1.00 0.00 C ATOM 0 H ALA A 527 0.512 -1.846 13.747 1.00 0.00 H new ATOM 0 HA ALA A 527 1.599 -0.627 11.304 1.00 0.00 H new ATOM 0 HB1 ALA A 527 -0.398 0.821 11.486 1.00 0.00 H new ATOM 0 HB2 ALA A 527 -0.833 -0.904 11.468 1.00 0.00 H new ATOM 0 HB3 ALA A 527 -0.845 0.001 13.001 1.00 0.00 H new ATOM 1519 N GLU A 528 2.407 1.567 12.238 1.00 0.00 N ATOM 1520 CA GLU A 528 3.130 2.694 12.815 1.00 0.00 C ATOM 1521 C GLU A 528 3.312 3.808 11.788 1.00 0.00 C ATOM 1522 O GLU A 528 2.917 3.670 10.630 1.00 0.00 O ATOM 1523 CB GLU A 528 4.495 2.239 13.337 1.00 0.00 C ATOM 1524 CG GLU A 528 5.452 1.806 12.240 1.00 0.00 C ATOM 1525 CD GLU A 528 6.879 1.665 12.733 1.00 0.00 C ATOM 1526 OE1 GLU A 528 7.099 1.794 13.956 1.00 0.00 O ATOM 1527 OE2 GLU A 528 7.776 1.425 11.898 1.00 0.00 O ATOM 0 H GLU A 528 2.381 1.560 11.218 1.00 0.00 H new ATOM 0 HA GLU A 528 2.542 3.083 13.646 1.00 0.00 H new ATOM 0 HB2 GLU A 528 4.948 3.053 13.902 1.00 0.00 H new ATOM 0 HB3 GLU A 528 4.352 1.410 14.031 1.00 0.00 H new ATOM 0 HG2 GLU A 528 5.119 0.854 11.827 1.00 0.00 H new ATOM 0 HG3 GLU A 528 5.422 2.533 11.429 1.00 0.00 H new ATOM 1534 N VAL A 529 3.911 4.913 12.222 1.00 0.00 N ATOM 1535 CA VAL A 529 4.146 6.051 11.341 1.00 0.00 C ATOM 1536 C VAL A 529 5.544 5.998 10.735 1.00 0.00 C ATOM 1537 O VAL A 529 6.530 5.785 11.441 1.00 0.00 O ATOM 1538 CB VAL A 529 3.973 7.385 12.091 1.00 0.00 C ATOM 1539 CG1 VAL A 529 4.227 8.559 11.157 1.00 0.00 C ATOM 1540 CG2 VAL A 529 2.586 7.474 12.707 1.00 0.00 C ATOM 0 H VAL A 529 4.242 5.044 13.178 1.00 0.00 H new ATOM 0 HA VAL A 529 3.406 5.992 10.543 1.00 0.00 H new ATOM 0 HB VAL A 529 4.706 7.427 12.897 1.00 0.00 H new ATOM 0 HG11 VAL A 529 4.100 9.493 11.704 1.00 0.00 H new ATOM 0 HG12 VAL A 529 5.244 8.501 10.768 1.00 0.00 H new ATOM 0 HG13 VAL A 529 3.519 8.525 10.329 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.482 8.423 13.233 1.00 0.00 H new ATOM 0 HG22 VAL A 529 1.834 7.410 11.921 1.00 0.00 H new ATOM 0 HG23 VAL A 529 2.447 6.653 13.410 1.00 0.00 H new ATOM 1550 N TYR A 530 5.621 6.193 9.424 1.00 0.00 N ATOM 1551 CA TYR A 530 6.899 6.166 8.721 1.00 0.00 C ATOM 1552 C TYR A 530 7.478 7.571 8.590 1.00 0.00 C ATOM 1553 O TYR A 530 6.802 8.562 8.865 1.00 0.00 O ATOM 1554 CB TYR A 530 6.729 5.540 7.336 1.00 0.00 C ATOM 1555 CG TYR A 530 8.025 5.047 6.732 1.00 0.00 C ATOM 1556 CD1 TYR A 530 8.496 3.768 6.999 1.00 0.00 C ATOM 1557 CD2 TYR A 530 8.777 5.861 5.893 1.00 0.00 C ATOM 1558 CE1 TYR A 530 9.680 3.314 6.449 1.00 0.00 C ATOM 1559 CE2 TYR A 530 9.961 5.414 5.338 1.00 0.00 C ATOM 1560 CZ TYR A 530 10.408 4.140 5.620 1.00 0.00 C ATOM 1561 OH TYR A 530 11.587 3.691 5.070 1.00 0.00 O ATOM 0 H TYR A 530 4.814 6.372 8.826 1.00 0.00 H new ATOM 0 HA TYR A 530 7.593 5.560 9.303 1.00 0.00 H new ATOM 0 HB2 TYR A 530 6.030 4.706 7.406 1.00 0.00 H new ATOM 0 HB3 TYR A 530 6.282 6.275 6.666 1.00 0.00 H new ATOM 0 HD1 TYR A 530 7.928 3.117 7.647 1.00 0.00 H new ATOM 0 HD2 TYR A 530 8.430 6.859 5.671 1.00 0.00 H new ATOM 0 HE1 TYR A 530 10.033 2.317 6.668 1.00 0.00 H new ATOM 0 HE2 TYR A 530 10.533 6.059 4.687 1.00 0.00 H new ATOM 0 HH TYR A 530 11.975 4.395 4.509 1.00 0.00 H new