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 -143:sc= 0.86 USER MOD Set 1.2: A 508 THR OG1 : rot -36:sc= 1.09 USER MOD Single : A 444 SER OG : rot 180:sc= 0 USER MOD Single : A 447 MET CE :methyl 174:sc= -0.219 (180deg=-0.329) USER MOD Single : A 451 ASN : amide:sc= 0.155 X(o=0.16,f=-0.27) USER MOD Single : A 452 MET CE :methyl 163:sc= 0 (180deg=-0.437) USER MOD Single : A 456 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 467 THR OG1 : rot 68:sc= 0.509 USER MOD Single : A 470 CYS SG : rot 73:sc= 0.0312 USER MOD Single : A 472 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 477 ASN : amide:sc=-0.00173 X(o=-0.0017,f=0) USER MOD Single : A 482 TYR OH : rot 180:sc= 0 USER MOD Single : A 483 GLN : amide:sc= -6.82! C(o=-6.8!,f=-8.8!) USER MOD Single : A 485 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.823) USER MOD Single : A 497 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0584) 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= -0.318 X(o=-0.32,f=0.06) USER MOD Single : A 510 LYS NZ :NH3+ -164:sc= -0.0218 (180deg=-0.19) USER MOD Single : A 513 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 516 ASN : amide:sc= -0.873 K(o=-0.87,f=-4!) USER MOD Single : A 524 LYS NZ :NH3+ 160:sc= 1.07 (180deg=0.741) USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 204 N SER A 444 0.906 14.147 9.427 1.00 0.00 N ATOM 205 CA SER A 444 1.360 12.840 8.966 1.00 0.00 C ATOM 206 C SER A 444 0.179 11.970 8.548 1.00 0.00 C ATOM 207 O SER A 444 -0.648 11.585 9.375 1.00 0.00 O ATOM 208 CB SER A 444 2.161 12.139 10.064 1.00 0.00 C ATOM 209 OG SER A 444 3.414 12.770 10.264 1.00 0.00 O ATOM 0 HA SER A 444 2.002 12.991 8.098 1.00 0.00 H new ATOM 0 HB2 SER A 444 1.593 12.148 10.994 1.00 0.00 H new ATOM 0 HB3 SER A 444 2.315 11.094 9.795 1.00 0.00 H new ATOM 0 HG SER A 444 3.906 12.304 10.972 1.00 0.00 H new ATOM 215 N THR A 445 0.106 11.663 7.256 1.00 0.00 N ATOM 216 CA THR A 445 -0.974 10.840 6.727 1.00 0.00 C ATOM 217 C THR A 445 -0.440 9.530 6.160 1.00 0.00 C ATOM 218 O THR A 445 -1.179 8.759 5.547 1.00 0.00 O ATOM 219 CB THR A 445 -1.757 11.580 5.626 1.00 0.00 C ATOM 220 OG1 THR A 445 -2.589 10.659 4.912 1.00 0.00 O ATOM 221 CG2 THR A 445 -0.808 12.270 4.657 1.00 0.00 C ATOM 0 H THR A 445 0.782 11.972 6.558 1.00 0.00 H new ATOM 0 HA THR A 445 -1.645 10.627 7.559 1.00 0.00 H new ATOM 0 HB THR A 445 -2.380 12.338 6.102 1.00 0.00 H new ATOM 0 HG1 THR A 445 -2.611 10.906 3.964 1.00 0.00 H new ATOM 0 HG21 THR A 445 -1.384 12.786 3.889 1.00 0.00 H new ATOM 0 HG22 THR A 445 -0.197 12.992 5.198 1.00 0.00 H new ATOM 0 HG23 THR A 445 -0.162 11.527 4.189 1.00 0.00 H new ATOM 229 N VAL A 446 0.850 9.282 6.370 1.00 0.00 N ATOM 230 CA VAL A 446 1.483 8.063 5.881 1.00 0.00 C ATOM 231 C VAL A 446 1.618 7.030 6.994 1.00 0.00 C ATOM 232 O VAL A 446 2.072 7.344 8.094 1.00 0.00 O ATOM 233 CB VAL A 446 2.876 8.352 5.292 1.00 0.00 C ATOM 234 CG1 VAL A 446 3.420 7.123 4.578 1.00 0.00 C ATOM 235 CG2 VAL A 446 2.819 9.544 4.349 1.00 0.00 C ATOM 0 H VAL A 446 1.476 9.909 6.875 1.00 0.00 H new ATOM 0 HA VAL A 446 0.840 7.665 5.096 1.00 0.00 H new ATOM 0 HB VAL A 446 3.553 8.597 6.110 1.00 0.00 H new ATOM 0 HG11 VAL A 446 4.405 7.346 4.168 1.00 0.00 H new ATOM 0 HG12 VAL A 446 3.500 6.297 5.285 1.00 0.00 H new ATOM 0 HG13 VAL A 446 2.745 6.844 3.769 1.00 0.00 H new ATOM 0 HG21 VAL A 446 3.812 9.734 3.942 1.00 0.00 H new ATOM 0 HG22 VAL A 446 2.128 9.330 3.534 1.00 0.00 H new ATOM 0 HG23 VAL A 446 2.476 10.423 4.894 1.00 0.00 H new ATOM 245 N MET A 447 1.223 5.796 6.700 1.00 0.00 N ATOM 246 CA MET A 447 1.302 4.715 7.676 1.00 0.00 C ATOM 247 C MET A 447 2.163 3.571 7.151 1.00 0.00 C ATOM 248 O MET A 447 2.363 3.434 5.944 1.00 0.00 O ATOM 249 CB MET A 447 -0.099 4.201 8.014 1.00 0.00 C ATOM 250 CG MET A 447 -0.099 2.851 8.713 1.00 0.00 C ATOM 251 SD MET A 447 -1.755 2.309 9.177 1.00 0.00 S ATOM 252 CE MET A 447 -2.443 1.912 7.572 1.00 0.00 C ATOM 0 H MET A 447 0.845 5.519 5.794 1.00 0.00 H new ATOM 0 HA MET A 447 1.765 5.109 8.581 1.00 0.00 H new ATOM 0 HB2 MET A 447 -0.601 4.930 8.650 1.00 0.00 H new ATOM 0 HB3 MET A 447 -0.681 4.125 7.095 1.00 0.00 H new ATOM 0 HG2 MET A 447 0.352 2.107 8.057 1.00 0.00 H new ATOM 0 HG3 MET A 447 0.524 2.908 9.606 1.00 0.00 H new ATOM 0 HE1 MET A 447 -3.427 1.461 7.699 1.00 0.00 H new ATOM 0 HE2 MET A 447 -2.535 2.823 6.980 1.00 0.00 H new ATOM 0 HE3 MET A 447 -1.786 1.210 7.058 1.00 0.00 H new ATOM 262 N VAL A 448 2.671 2.751 8.066 1.00 0.00 N ATOM 263 CA VAL A 448 3.510 1.618 7.695 1.00 0.00 C ATOM 264 C VAL A 448 3.057 0.344 8.400 1.00 0.00 C ATOM 265 O VAL A 448 2.991 0.291 9.629 1.00 0.00 O ATOM 266 CB VAL A 448 4.989 1.880 8.035 1.00 0.00 C ATOM 267 CG1 VAL A 448 5.125 2.423 9.449 1.00 0.00 C ATOM 268 CG2 VAL A 448 5.809 0.610 7.861 1.00 0.00 C ATOM 0 H VAL A 448 2.516 2.850 9.069 1.00 0.00 H new ATOM 0 HA VAL A 448 3.409 1.489 6.617 1.00 0.00 H new ATOM 0 HB VAL A 448 5.374 2.631 7.345 1.00 0.00 H new ATOM 0 HG11 VAL A 448 6.177 2.602 9.670 1.00 0.00 H new ATOM 0 HG12 VAL A 448 4.572 3.359 9.534 1.00 0.00 H new ATOM 0 HG13 VAL A 448 4.723 1.698 10.157 1.00 0.00 H new ATOM 0 HG21 VAL A 448 6.852 0.814 8.105 1.00 0.00 H new ATOM 0 HG22 VAL A 448 5.425 -0.165 8.525 1.00 0.00 H new ATOM 0 HG23 VAL A 448 5.738 0.270 6.828 1.00 0.00 H new ATOM 278 N LEU A 449 2.745 -0.681 7.615 1.00 0.00 N ATOM 279 CA LEU A 449 2.298 -1.957 8.163 1.00 0.00 C ATOM 280 C LEU A 449 3.427 -2.982 8.149 1.00 0.00 C ATOM 281 O LEU A 449 4.139 -3.122 7.154 1.00 0.00 O ATOM 282 CB LEU A 449 1.104 -2.486 7.368 1.00 0.00 C ATOM 283 CG LEU A 449 -0.101 -1.550 7.264 1.00 0.00 C ATOM 284 CD1 LEU A 449 -1.113 -2.091 6.265 1.00 0.00 C ATOM 285 CD2 LEU A 449 -0.747 -1.358 8.628 1.00 0.00 C ATOM 0 H LEU A 449 2.793 -0.654 6.597 1.00 0.00 H new ATOM 0 HA LEU A 449 1.994 -1.793 9.197 1.00 0.00 H new ATOM 0 HB2 LEU A 449 1.442 -2.725 6.359 1.00 0.00 H new ATOM 0 HB3 LEU A 449 0.775 -3.420 7.823 1.00 0.00 H new ATOM 0 HG LEU A 449 0.247 -0.580 6.909 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -1.963 -1.412 6.204 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.646 -2.176 5.284 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.456 -3.073 6.590 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -1.603 -0.689 8.534 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -1.080 -2.322 9.012 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -0.021 -0.925 9.317 1.00 0.00 H new ATOM 297 N ARG A 450 3.584 -3.698 9.257 1.00 0.00 N ATOM 298 CA ARG A 450 4.626 -4.711 9.372 1.00 0.00 C ATOM 299 C ARG A 450 4.068 -6.001 9.966 1.00 0.00 C ATOM 300 O ARG A 450 3.081 -5.981 10.701 1.00 0.00 O ATOM 301 CB ARG A 450 5.777 -4.194 10.237 1.00 0.00 C ATOM 302 CG ARG A 450 6.518 -3.017 9.626 1.00 0.00 C ATOM 303 CD ARG A 450 7.491 -2.396 10.616 1.00 0.00 C ATOM 304 NE ARG A 450 8.814 -3.011 10.542 1.00 0.00 N ATOM 305 CZ ARG A 450 9.140 -4.130 11.179 1.00 0.00 C ATOM 306 NH1 ARG A 450 8.244 -4.754 11.931 1.00 0.00 N ATOM 307 NH2 ARG A 450 10.365 -4.628 11.062 1.00 0.00 N ATOM 0 H ARG A 450 3.002 -3.595 10.089 1.00 0.00 H new ATOM 0 HA ARG A 450 5.001 -4.925 8.371 1.00 0.00 H new ATOM 0 HB2 ARG A 450 5.385 -3.899 11.210 1.00 0.00 H new ATOM 0 HB3 ARG A 450 6.483 -5.006 10.410 1.00 0.00 H new ATOM 0 HG2 ARG A 450 7.060 -3.347 8.740 1.00 0.00 H new ATOM 0 HG3 ARG A 450 5.801 -2.264 9.299 1.00 0.00 H new ATOM 0 HD2 ARG A 450 7.576 -1.327 10.419 1.00 0.00 H new ATOM 0 HD3 ARG A 450 7.097 -2.503 11.627 1.00 0.00 H new ATOM 0 HE ARG A 450 9.526 -2.556 9.970 1.00 0.00 H new ATOM 0 HH11 ARG A 450 7.301 -4.375 12.022 1.00 0.00 H new ATOM 0 HH12 ARG A 450 8.497 -5.613 12.419 1.00 0.00 H new ATOM 0 HH21 ARG A 450 11.056 -4.151 10.483 1.00 0.00 H new ATOM 0 HH22 ARG A 450 10.615 -5.487 11.551 1.00 0.00 H new ATOM 321 N ASN A 451 4.706 -7.121 9.642 1.00 0.00 N ATOM 322 CA ASN A 451 4.272 -8.420 10.143 1.00 0.00 C ATOM 323 C ASN A 451 2.847 -8.727 9.695 1.00 0.00 C ATOM 324 O ASN A 451 2.009 -9.140 10.497 1.00 0.00 O ATOM 325 CB ASN A 451 4.358 -8.456 11.670 1.00 0.00 C ATOM 326 CG ASN A 451 4.578 -9.858 12.204 1.00 0.00 C ATOM 327 OD1 ASN A 451 5.466 -10.576 11.746 1.00 0.00 O ATOM 328 ND2 ASN A 451 3.767 -10.254 13.178 1.00 0.00 N ATOM 0 H ASN A 451 5.525 -7.155 9.035 1.00 0.00 H new ATOM 0 HA ASN A 451 4.935 -9.181 9.731 1.00 0.00 H new ATOM 0 HB2 ASN A 451 5.173 -7.812 12.000 1.00 0.00 H new ATOM 0 HB3 ASN A 451 3.439 -8.049 12.093 1.00 0.00 H new ATOM 0 HD21 ASN A 451 3.867 -11.187 13.577 1.00 0.00 H new ATOM 0 HD22 ASN A 451 3.044 -9.625 13.527 1.00 0.00 H new ATOM 335 N MET A 452 2.579 -8.523 8.410 1.00 0.00 N ATOM 336 CA MET A 452 1.255 -8.780 7.855 1.00 0.00 C ATOM 337 C MET A 452 1.294 -9.947 6.873 1.00 0.00 C ATOM 338 O MET A 452 0.592 -10.942 7.049 1.00 0.00 O ATOM 339 CB MET A 452 0.719 -7.528 7.157 1.00 0.00 C ATOM 340 CG MET A 452 -0.637 -7.732 6.501 1.00 0.00 C ATOM 341 SD MET A 452 -1.005 -6.475 5.262 1.00 0.00 S ATOM 342 CE MET A 452 -2.783 -6.647 5.123 1.00 0.00 C ATOM 0 H MET A 452 3.261 -8.180 7.733 1.00 0.00 H new ATOM 0 HA MET A 452 0.589 -9.042 8.677 1.00 0.00 H new ATOM 0 HB2 MET A 452 0.644 -6.720 7.885 1.00 0.00 H new ATOM 0 HB3 MET A 452 1.435 -7.209 6.400 1.00 0.00 H new ATOM 0 HG2 MET A 452 -0.666 -8.716 6.034 1.00 0.00 H new ATOM 0 HG3 MET A 452 -1.412 -7.720 7.267 1.00 0.00 H new ATOM 0 HE1 MET A 452 -3.197 -5.762 4.639 1.00 0.00 H new ATOM 0 HE2 MET A 452 -3.018 -7.529 4.528 1.00 0.00 H new ATOM 0 HE3 MET A 452 -3.217 -6.754 6.117 1.00 0.00 H new ATOM 352 N VAL A 453 2.119 -9.817 5.839 1.00 0.00 N ATOM 353 CA VAL A 453 2.249 -10.861 4.829 1.00 0.00 C ATOM 354 C VAL A 453 3.707 -11.060 4.431 1.00 0.00 C ATOM 355 O VAL A 453 4.359 -10.139 3.938 1.00 0.00 O ATOM 356 CB VAL A 453 1.426 -10.531 3.570 1.00 0.00 C ATOM 357 CG1 VAL A 453 -0.062 -10.668 3.855 1.00 0.00 C ATOM 358 CG2 VAL A 453 1.754 -9.132 3.071 1.00 0.00 C ATOM 0 H VAL A 453 2.707 -8.999 5.679 1.00 0.00 H new ATOM 0 HA VAL A 453 1.866 -11.780 5.273 1.00 0.00 H new ATOM 0 HB VAL A 453 1.690 -11.242 2.787 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -0.628 -10.431 2.954 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -0.281 -11.690 4.163 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -0.345 -9.981 4.652 1.00 0.00 H new ATOM 0 HG21 VAL A 453 1.163 -8.915 2.181 1.00 0.00 H new ATOM 0 HG22 VAL A 453 1.519 -8.404 3.848 1.00 0.00 H new ATOM 0 HG23 VAL A 453 2.814 -9.072 2.826 1.00 0.00 H new ATOM 368 N ASP A 454 4.214 -12.269 4.648 1.00 0.00 N ATOM 369 CA ASP A 454 5.595 -12.591 4.311 1.00 0.00 C ATOM 370 C ASP A 454 5.891 -12.254 2.853 1.00 0.00 C ATOM 371 O ASP A 454 4.989 -12.114 2.027 1.00 0.00 O ATOM 372 CB ASP A 454 5.874 -14.072 4.571 1.00 0.00 C ATOM 373 CG ASP A 454 6.342 -14.333 5.990 1.00 0.00 C ATOM 374 OD1 ASP A 454 7.566 -14.275 6.230 1.00 0.00 O ATOM 375 OD2 ASP A 454 5.484 -14.595 6.859 1.00 0.00 O ATOM 0 H ASP A 454 3.688 -13.042 5.056 1.00 0.00 H new ATOM 0 HA ASP A 454 6.247 -11.990 4.944 1.00 0.00 H new ATOM 0 HB2 ASP A 454 4.969 -14.648 4.378 1.00 0.00 H new ATOM 0 HB3 ASP A 454 6.632 -14.424 3.871 1.00 0.00 H new ATOM 380 N PRO A 455 7.185 -12.119 2.527 1.00 0.00 N ATOM 381 CA PRO A 455 7.630 -11.796 1.168 1.00 0.00 C ATOM 382 C PRO A 455 7.405 -12.948 0.195 1.00 0.00 C ATOM 383 O PRO A 455 7.707 -12.839 -0.993 1.00 0.00 O ATOM 384 CB PRO A 455 9.127 -11.526 1.340 1.00 0.00 C ATOM 385 CG PRO A 455 9.514 -12.297 2.555 1.00 0.00 C ATOM 386 CD PRO A 455 8.314 -12.272 3.460 1.00 0.00 C ATOM 0 HA PRO A 455 7.077 -10.956 0.747 1.00 0.00 H new ATOM 0 HB2 PRO A 455 9.691 -11.854 0.467 1.00 0.00 H new ATOM 0 HB3 PRO A 455 9.325 -10.462 1.467 1.00 0.00 H new ATOM 0 HG2 PRO A 455 9.787 -13.320 2.297 1.00 0.00 H new ATOM 0 HG3 PRO A 455 10.380 -11.849 3.042 1.00 0.00 H new ATOM 0 HD2 PRO A 455 8.232 -13.189 4.043 1.00 0.00 H new ATOM 0 HD3 PRO A 455 8.363 -11.446 4.170 1.00 0.00 H new ATOM 394 N LYS A 456 6.871 -14.052 0.706 1.00 0.00 N ATOM 395 CA LYS A 456 6.603 -15.225 -0.117 1.00 0.00 C ATOM 396 C LYS A 456 5.192 -15.173 -0.695 1.00 0.00 C ATOM 397 O LYS A 456 4.851 -15.938 -1.597 1.00 0.00 O ATOM 398 CB LYS A 456 6.782 -16.503 0.705 1.00 0.00 C ATOM 399 CG LYS A 456 5.778 -16.645 1.836 1.00 0.00 C ATOM 400 CD LYS A 456 5.662 -18.087 2.301 1.00 0.00 C ATOM 401 CE LYS A 456 4.393 -18.311 3.109 1.00 0.00 C ATOM 402 NZ LYS A 456 4.101 -19.760 3.292 1.00 0.00 N ATOM 0 H LYS A 456 6.615 -14.159 1.688 1.00 0.00 H new ATOM 0 HA LYS A 456 7.315 -15.229 -0.942 1.00 0.00 H new ATOM 0 HB2 LYS A 456 6.696 -17.365 0.044 1.00 0.00 H new ATOM 0 HB3 LYS A 456 7.789 -16.519 1.121 1.00 0.00 H new ATOM 0 HG2 LYS A 456 6.080 -16.015 2.673 1.00 0.00 H new ATOM 0 HG3 LYS A 456 4.803 -16.289 1.505 1.00 0.00 H new ATOM 0 HD2 LYS A 456 5.666 -18.751 1.436 1.00 0.00 H new ATOM 0 HD3 LYS A 456 6.531 -18.346 2.906 1.00 0.00 H new ATOM 0 HE2 LYS A 456 4.495 -17.835 4.084 1.00 0.00 H new ATOM 0 HE3 LYS A 456 3.553 -17.832 2.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 3.229 -19.871 3.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 3.979 -20.210 2.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 4.891 -20.213 3.794 1.00 0.00 H new ATOM 416 N ASP A 457 4.375 -14.266 -0.169 1.00 0.00 N ATOM 417 CA ASP A 457 3.002 -14.113 -0.634 1.00 0.00 C ATOM 418 C ASP A 457 2.868 -12.894 -1.542 1.00 0.00 C ATOM 419 O ASP A 457 1.761 -12.503 -1.914 1.00 0.00 O ATOM 420 CB ASP A 457 2.049 -13.985 0.556 1.00 0.00 C ATOM 421 CG ASP A 457 0.658 -14.498 0.241 1.00 0.00 C ATOM 422 OD1 ASP A 457 0.509 -15.720 0.031 1.00 0.00 O ATOM 423 OD2 ASP A 457 -0.283 -13.676 0.202 1.00 0.00 O ATOM 0 H ASP A 457 4.640 -13.626 0.580 1.00 0.00 H new ATOM 0 HA ASP A 457 2.738 -15.002 -1.207 1.00 0.00 H new ATOM 0 HB2 ASP A 457 2.454 -14.538 1.403 1.00 0.00 H new ATOM 0 HB3 ASP A 457 1.988 -12.939 0.858 1.00 0.00 H new ATOM 428 N ILE A 458 4.002 -12.296 -1.892 1.00 0.00 N ATOM 429 CA ILE A 458 4.011 -11.122 -2.756 1.00 0.00 C ATOM 430 C ILE A 458 3.279 -11.397 -4.065 1.00 0.00 C ATOM 431 O ILE A 458 3.823 -12.027 -4.972 1.00 0.00 O ATOM 432 CB ILE A 458 5.448 -10.665 -3.070 1.00 0.00 C ATOM 433 CG1 ILE A 458 6.194 -10.329 -1.777 1.00 0.00 C ATOM 434 CG2 ILE A 458 5.430 -9.465 -4.004 1.00 0.00 C ATOM 435 CD1 ILE A 458 5.642 -9.118 -1.058 1.00 0.00 C ATOM 0 H ILE A 458 4.926 -12.605 -1.591 1.00 0.00 H new ATOM 0 HA ILE A 458 3.496 -10.328 -2.215 1.00 0.00 H new ATOM 0 HB ILE A 458 5.972 -11.481 -3.568 1.00 0.00 H new ATOM 0 HG12 ILE A 458 6.151 -11.189 -1.109 1.00 0.00 H new ATOM 0 HG13 ILE A 458 7.245 -10.156 -2.008 1.00 0.00 H new ATOM 0 HG21 ILE A 458 6.453 -9.154 -4.216 1.00 0.00 H new ATOM 0 HG22 ILE A 458 4.932 -9.736 -4.935 1.00 0.00 H new ATOM 0 HG23 ILE A 458 4.892 -8.644 -3.531 1.00 0.00 H new ATOM 0 HD11 ILE A 458 6.219 -8.939 -0.151 1.00 0.00 H new ATOM 0 HD12 ILE A 458 5.710 -8.246 -1.709 1.00 0.00 H new ATOM 0 HD13 ILE A 458 4.599 -9.295 -0.796 1.00 0.00 H new ATOM 447 N ASP A 459 2.043 -10.918 -4.157 1.00 0.00 N ATOM 448 CA ASP A 459 1.237 -11.109 -5.357 1.00 0.00 C ATOM 449 C ASP A 459 0.708 -9.775 -5.874 1.00 0.00 C ATOM 450 O ASP A 459 0.788 -8.756 -5.188 1.00 0.00 O ATOM 451 CB ASP A 459 0.072 -12.057 -5.068 1.00 0.00 C ATOM 452 CG ASP A 459 -0.662 -12.473 -6.328 1.00 0.00 C ATOM 453 OD1 ASP A 459 -0.077 -13.227 -7.133 1.00 0.00 O ATOM 454 OD2 ASP A 459 -1.821 -12.043 -6.510 1.00 0.00 O ATOM 0 H ASP A 459 1.578 -10.395 -3.415 1.00 0.00 H new ATOM 0 HA ASP A 459 1.872 -11.550 -6.126 1.00 0.00 H new ATOM 0 HB2 ASP A 459 0.448 -12.945 -4.560 1.00 0.00 H new ATOM 0 HB3 ASP A 459 -0.627 -11.572 -4.387 1.00 0.00 H new ATOM 459 N ASP A 460 0.168 -9.789 -7.088 1.00 0.00 N ATOM 460 CA ASP A 460 -0.375 -8.580 -7.697 1.00 0.00 C ATOM 461 C ASP A 460 -1.754 -8.258 -7.130 1.00 0.00 C ATOM 462 O ASP A 460 -2.063 -7.101 -6.845 1.00 0.00 O ATOM 463 CB ASP A 460 -0.459 -8.743 -9.216 1.00 0.00 C ATOM 464 CG ASP A 460 -0.614 -7.416 -9.932 1.00 0.00 C ATOM 465 OD1 ASP A 460 0.229 -6.521 -9.711 1.00 0.00 O ATOM 466 OD2 ASP A 460 -1.577 -7.272 -10.714 1.00 0.00 O ATOM 0 H ASP A 460 0.095 -10.624 -7.670 1.00 0.00 H new ATOM 0 HA ASP A 460 0.295 -7.752 -7.464 1.00 0.00 H new ATOM 0 HB2 ASP A 460 0.440 -9.244 -9.575 1.00 0.00 H new ATOM 0 HB3 ASP A 460 -1.303 -9.387 -9.463 1.00 0.00 H new ATOM 471 N ASP A 461 -2.578 -9.288 -6.971 1.00 0.00 N ATOM 472 CA ASP A 461 -3.924 -9.114 -6.439 1.00 0.00 C ATOM 473 C ASP A 461 -3.879 -8.561 -5.018 1.00 0.00 C ATOM 474 O ASP A 461 -4.678 -7.698 -4.651 1.00 0.00 O ATOM 475 CB ASP A 461 -4.678 -10.445 -6.458 1.00 0.00 C ATOM 476 CG ASP A 461 -5.267 -10.757 -7.820 1.00 0.00 C ATOM 477 OD1 ASP A 461 -4.493 -10.835 -8.797 1.00 0.00 O ATOM 478 OD2 ASP A 461 -6.502 -10.922 -7.909 1.00 0.00 O ATOM 0 H ASP A 461 -2.337 -10.252 -7.203 1.00 0.00 H new ATOM 0 HA ASP A 461 -4.449 -8.398 -7.072 1.00 0.00 H new ATOM 0 HB2 ASP A 461 -4.000 -11.247 -6.166 1.00 0.00 H new ATOM 0 HB3 ASP A 461 -5.477 -10.417 -5.717 1.00 0.00 H new ATOM 483 N LEU A 462 -2.943 -9.064 -4.222 1.00 0.00 N ATOM 484 CA LEU A 462 -2.794 -8.622 -2.840 1.00 0.00 C ATOM 485 C LEU A 462 -2.918 -7.105 -2.738 1.00 0.00 C ATOM 486 O LEU A 462 -3.739 -6.590 -1.980 1.00 0.00 O ATOM 487 CB LEU A 462 -1.444 -9.073 -2.281 1.00 0.00 C ATOM 488 CG LEU A 462 -1.206 -8.800 -0.796 1.00 0.00 C ATOM 489 CD1 LEU A 462 -2.135 -9.648 0.058 1.00 0.00 C ATOM 490 CD2 LEU A 462 0.247 -9.064 -0.430 1.00 0.00 C ATOM 0 H LEU A 462 -2.275 -9.779 -4.510 1.00 0.00 H new ATOM 0 HA LEU A 462 -3.592 -9.075 -2.252 1.00 0.00 H new ATOM 0 HB2 LEU A 462 -1.342 -10.144 -2.454 1.00 0.00 H new ATOM 0 HB3 LEU A 462 -0.655 -8.582 -2.851 1.00 0.00 H new ATOM 0 HG LEU A 462 -1.423 -7.750 -0.601 1.00 0.00 H new ATOM 0 HD11 LEU A 462 -1.951 -9.440 1.112 1.00 0.00 H new ATOM 0 HD12 LEU A 462 -3.171 -9.409 -0.184 1.00 0.00 H new ATOM 0 HD13 LEU A 462 -1.950 -10.704 -0.141 1.00 0.00 H new ATOM 0 HD21 LEU A 462 0.397 -8.864 0.631 1.00 0.00 H new ATOM 0 HD22 LEU A 462 0.492 -10.105 -0.641 1.00 0.00 H new ATOM 0 HD23 LEU A 462 0.894 -8.412 -1.017 1.00 0.00 H new ATOM 502 N GLU A 463 -2.098 -6.396 -3.507 1.00 0.00 N ATOM 503 CA GLU A 463 -2.117 -4.938 -3.504 1.00 0.00 C ATOM 504 C GLU A 463 -3.549 -4.413 -3.456 1.00 0.00 C ATOM 505 O GLU A 463 -3.924 -3.684 -2.538 1.00 0.00 O ATOM 506 CB GLU A 463 -1.404 -4.393 -4.743 1.00 0.00 C ATOM 507 CG GLU A 463 -1.153 -2.895 -4.692 1.00 0.00 C ATOM 508 CD GLU A 463 -0.349 -2.398 -5.877 1.00 0.00 C ATOM 509 OE1 GLU A 463 0.874 -2.646 -5.909 1.00 0.00 O ATOM 510 OE2 GLU A 463 -0.943 -1.760 -6.772 1.00 0.00 O ATOM 0 H GLU A 463 -1.412 -6.808 -4.140 1.00 0.00 H new ATOM 0 HA GLU A 463 -1.592 -4.596 -2.612 1.00 0.00 H new ATOM 0 HB2 GLU A 463 -0.451 -4.909 -4.859 1.00 0.00 H new ATOM 0 HB3 GLU A 463 -2.001 -4.623 -5.626 1.00 0.00 H new ATOM 0 HG2 GLU A 463 -2.108 -2.371 -4.660 1.00 0.00 H new ATOM 0 HG3 GLU A 463 -0.625 -2.650 -3.771 1.00 0.00 H new ATOM 517 N GLY A 464 -4.345 -4.790 -4.452 1.00 0.00 N ATOM 518 CA GLY A 464 -5.727 -4.348 -4.505 1.00 0.00 C ATOM 519 C GLY A 464 -6.478 -4.637 -3.221 1.00 0.00 C ATOM 520 O GLY A 464 -7.201 -3.781 -2.712 1.00 0.00 O ATOM 0 H GLY A 464 -4.058 -5.393 -5.223 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -5.755 -3.277 -4.705 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -6.231 -4.841 -5.336 1.00 0.00 H new ATOM 524 N GLU A 465 -6.308 -5.847 -2.697 1.00 0.00 N ATOM 525 CA GLU A 465 -6.979 -6.247 -1.466 1.00 0.00 C ATOM 526 C GLU A 465 -6.721 -5.235 -0.353 1.00 0.00 C ATOM 527 O GLU A 465 -7.654 -4.651 0.199 1.00 0.00 O ATOM 528 CB GLU A 465 -6.505 -7.634 -1.028 1.00 0.00 C ATOM 529 CG GLU A 465 -6.665 -8.699 -2.101 1.00 0.00 C ATOM 530 CD GLU A 465 -8.072 -9.261 -2.159 1.00 0.00 C ATOM 531 OE1 GLU A 465 -9.015 -8.477 -2.394 1.00 0.00 O ATOM 532 OE2 GLU A 465 -8.231 -10.485 -1.969 1.00 0.00 O ATOM 0 H GLU A 465 -5.712 -6.567 -3.106 1.00 0.00 H new ATOM 0 HA GLU A 465 -8.051 -6.282 -1.661 1.00 0.00 H new ATOM 0 HB2 GLU A 465 -5.456 -7.576 -0.739 1.00 0.00 H new ATOM 0 HB3 GLU A 465 -7.063 -7.936 -0.142 1.00 0.00 H new ATOM 0 HG2 GLU A 465 -6.407 -8.274 -3.071 1.00 0.00 H new ATOM 0 HG3 GLU A 465 -5.961 -9.510 -1.911 1.00 0.00 H new ATOM 539 N VAL A 466 -5.448 -5.033 -0.028 1.00 0.00 N ATOM 540 CA VAL A 466 -5.066 -4.092 1.018 1.00 0.00 C ATOM 541 C VAL A 466 -5.677 -2.717 0.771 1.00 0.00 C ATOM 542 O VAL A 466 -6.079 -2.026 1.707 1.00 0.00 O ATOM 543 CB VAL A 466 -3.535 -3.951 1.115 1.00 0.00 C ATOM 544 CG1 VAL A 466 -3.158 -2.967 2.211 1.00 0.00 C ATOM 545 CG2 VAL A 466 -2.891 -5.307 1.360 1.00 0.00 C ATOM 0 H VAL A 466 -4.664 -5.509 -0.474 1.00 0.00 H new ATOM 0 HA VAL A 466 -5.447 -4.492 1.958 1.00 0.00 H new ATOM 0 HB VAL A 466 -3.162 -3.562 0.167 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -2.073 -2.880 2.265 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -3.589 -1.991 1.988 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.541 -3.323 3.167 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -1.809 -5.190 1.426 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -3.268 -5.726 2.293 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -3.133 -5.979 0.537 1.00 0.00 H new ATOM 555 N THR A 467 -5.745 -2.326 -0.498 1.00 0.00 N ATOM 556 CA THR A 467 -6.306 -1.033 -0.870 1.00 0.00 C ATOM 557 C THR A 467 -7.765 -0.923 -0.440 1.00 0.00 C ATOM 558 O THR A 467 -8.165 0.060 0.183 1.00 0.00 O ATOM 559 CB THR A 467 -6.212 -0.796 -2.389 1.00 0.00 C ATOM 560 OG1 THR A 467 -4.844 -0.853 -2.809 1.00 0.00 O ATOM 561 CG2 THR A 467 -6.806 0.554 -2.764 1.00 0.00 C ATOM 0 H THR A 467 -5.419 -2.886 -1.285 1.00 0.00 H new ATOM 0 HA THR A 467 -5.719 -0.273 -0.354 1.00 0.00 H new ATOM 0 HB THR A 467 -6.780 -1.578 -2.893 1.00 0.00 H new ATOM 0 HG1 THR A 467 -4.510 -1.770 -2.713 1.00 0.00 H new ATOM 0 HG21 THR A 467 -6.728 0.699 -3.842 1.00 0.00 H new ATOM 0 HG22 THR A 467 -7.855 0.585 -2.468 1.00 0.00 H new ATOM 0 HG23 THR A 467 -6.261 1.346 -2.251 1.00 0.00 H new ATOM 569 N GLU A 468 -8.554 -1.938 -0.776 1.00 0.00 N ATOM 570 CA GLU A 468 -9.969 -1.954 -0.423 1.00 0.00 C ATOM 571 C GLU A 468 -10.158 -2.285 1.054 1.00 0.00 C ATOM 572 O GLU A 468 -11.242 -2.100 1.608 1.00 0.00 O ATOM 573 CB GLU A 468 -10.721 -2.970 -1.285 1.00 0.00 C ATOM 574 CG GLU A 468 -10.205 -4.392 -1.140 1.00 0.00 C ATOM 575 CD GLU A 468 -11.180 -5.424 -1.674 1.00 0.00 C ATOM 576 OE1 GLU A 468 -12.403 -5.206 -1.548 1.00 0.00 O ATOM 577 OE2 GLU A 468 -10.719 -6.449 -2.217 1.00 0.00 O ATOM 0 H GLU A 468 -8.238 -2.759 -1.292 1.00 0.00 H new ATOM 0 HA GLU A 468 -10.375 -0.960 -0.609 1.00 0.00 H new ATOM 0 HB2 GLU A 468 -11.778 -2.947 -1.020 1.00 0.00 H new ATOM 0 HB3 GLU A 468 -10.648 -2.671 -2.331 1.00 0.00 H new ATOM 0 HG2 GLU A 468 -9.257 -4.486 -1.669 1.00 0.00 H new ATOM 0 HG3 GLU A 468 -10.005 -4.597 -0.088 1.00 0.00 H new ATOM 584 N GLU A 469 -9.096 -2.776 1.685 1.00 0.00 N ATOM 585 CA GLU A 469 -9.146 -3.134 3.098 1.00 0.00 C ATOM 586 C GLU A 469 -9.008 -1.896 3.979 1.00 0.00 C ATOM 587 O GLU A 469 -9.662 -1.782 5.016 1.00 0.00 O ATOM 588 CB GLU A 469 -8.040 -4.137 3.432 1.00 0.00 C ATOM 589 CG GLU A 469 -8.290 -4.915 4.713 1.00 0.00 C ATOM 590 CD GLU A 469 -7.259 -6.003 4.945 1.00 0.00 C ATOM 591 OE1 GLU A 469 -6.221 -5.713 5.575 1.00 0.00 O ATOM 592 OE2 GLU A 469 -7.492 -7.145 4.497 1.00 0.00 O ATOM 0 H GLU A 469 -8.192 -2.935 1.241 1.00 0.00 H new ATOM 0 HA GLU A 469 -10.115 -3.593 3.296 1.00 0.00 H new ATOM 0 HB2 GLU A 469 -7.936 -4.839 2.605 1.00 0.00 H new ATOM 0 HB3 GLU A 469 -7.093 -3.605 3.519 1.00 0.00 H new ATOM 0 HG2 GLU A 469 -8.284 -4.227 5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 469 -9.283 -5.363 4.674 1.00 0.00 H new ATOM 599 N CYS A 470 -8.151 -0.971 3.558 1.00 0.00 N ATOM 600 CA CYS A 470 -7.925 0.259 4.309 1.00 0.00 C ATOM 601 C CYS A 470 -9.084 1.233 4.119 1.00 0.00 C ATOM 602 O CYS A 470 -9.410 2.008 5.017 1.00 0.00 O ATOM 603 CB CYS A 470 -6.615 0.915 3.870 1.00 0.00 C ATOM 604 SG CYS A 470 -5.146 -0.095 4.174 1.00 0.00 S ATOM 0 H CYS A 470 -7.602 -1.050 2.702 1.00 0.00 H new ATOM 0 HA CYS A 470 -7.859 0.003 5.366 1.00 0.00 H new ATOM 0 HB2 CYS A 470 -6.673 1.141 2.805 1.00 0.00 H new ATOM 0 HB3 CYS A 470 -6.504 1.865 4.392 1.00 0.00 H new ATOM 0 HG CYS A 470 -5.116 -1.083 3.329 1.00 0.00 H new ATOM 610 N GLY A 471 -9.702 1.187 2.943 1.00 0.00 N ATOM 611 CA GLY A 471 -10.816 2.071 2.655 1.00 0.00 C ATOM 612 C GLY A 471 -11.746 2.236 3.841 1.00 0.00 C ATOM 613 O GLY A 471 -12.326 3.303 4.042 1.00 0.00 O ATOM 0 H GLY A 471 -9.451 0.553 2.184 1.00 0.00 H new ATOM 0 HA2 GLY A 471 -10.434 3.048 2.358 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -11.378 1.678 1.808 1.00 0.00 H new ATOM 617 N LYS A 472 -11.891 1.176 4.629 1.00 0.00 N ATOM 618 CA LYS A 472 -12.758 1.206 5.801 1.00 0.00 C ATOM 619 C LYS A 472 -12.430 2.402 6.689 1.00 0.00 C ATOM 620 O LYS A 472 -13.326 3.117 7.139 1.00 0.00 O ATOM 621 CB LYS A 472 -12.613 -0.091 6.600 1.00 0.00 C ATOM 622 CG LYS A 472 -13.427 -1.245 6.040 1.00 0.00 C ATOM 623 CD LYS A 472 -12.868 -1.728 4.712 1.00 0.00 C ATOM 624 CE LYS A 472 -13.726 -2.833 4.115 1.00 0.00 C ATOM 625 NZ LYS A 472 -14.928 -2.289 3.424 1.00 0.00 N ATOM 0 H LYS A 472 -11.419 0.285 4.477 1.00 0.00 H new ATOM 0 HA LYS A 472 -13.788 1.302 5.459 1.00 0.00 H new ATOM 0 HB2 LYS A 472 -11.562 -0.377 6.624 1.00 0.00 H new ATOM 0 HB3 LYS A 472 -12.918 0.091 7.631 1.00 0.00 H new ATOM 0 HG2 LYS A 472 -13.433 -2.068 6.755 1.00 0.00 H new ATOM 0 HG3 LYS A 472 -14.462 -0.931 5.908 1.00 0.00 H new ATOM 0 HD2 LYS A 472 -12.812 -0.892 4.014 1.00 0.00 H new ATOM 0 HD3 LYS A 472 -11.851 -2.093 4.855 1.00 0.00 H new ATOM 0 HE2 LYS A 472 -13.132 -3.413 3.408 1.00 0.00 H new ATOM 0 HE3 LYS A 472 -14.039 -3.517 4.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 472 -15.487 -3.073 3.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 472 -15.508 -1.757 4.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 472 -14.629 -1.656 2.654 1.00 0.00 H new ATOM 639 N PHE A 473 -11.142 2.614 6.937 1.00 0.00 N ATOM 640 CA PHE A 473 -10.697 3.725 7.771 1.00 0.00 C ATOM 641 C PHE A 473 -11.136 5.060 7.178 1.00 0.00 C ATOM 642 O PHE A 473 -11.856 5.828 7.815 1.00 0.00 O ATOM 643 CB PHE A 473 -9.175 3.697 7.923 1.00 0.00 C ATOM 644 CG PHE A 473 -8.635 2.349 8.305 1.00 0.00 C ATOM 645 CD1 PHE A 473 -8.877 1.823 9.564 1.00 0.00 C ATOM 646 CD2 PHE A 473 -7.884 1.609 7.406 1.00 0.00 C ATOM 647 CE1 PHE A 473 -8.381 0.582 9.919 1.00 0.00 C ATOM 648 CE2 PHE A 473 -7.387 0.367 7.755 1.00 0.00 C ATOM 649 CZ PHE A 473 -7.634 -0.146 9.013 1.00 0.00 C ATOM 0 H PHE A 473 -10.388 2.032 6.573 1.00 0.00 H new ATOM 0 HA PHE A 473 -11.156 3.616 8.754 1.00 0.00 H new ATOM 0 HB2 PHE A 473 -8.718 4.009 6.984 1.00 0.00 H new ATOM 0 HB3 PHE A 473 -8.880 4.425 8.679 1.00 0.00 H new ATOM 0 HD1 PHE A 473 -9.460 2.389 10.276 1.00 0.00 H new ATOM 0 HD2 PHE A 473 -7.685 2.007 6.422 1.00 0.00 H new ATOM 0 HE1 PHE A 473 -8.577 0.182 10.903 1.00 0.00 H new ATOM 0 HE2 PHE A 473 -6.806 -0.202 7.044 1.00 0.00 H new ATOM 0 HZ PHE A 473 -7.244 -1.115 9.288 1.00 0.00 H new ATOM 659 N GLY A 474 -10.697 5.331 5.953 1.00 0.00 N ATOM 660 CA GLY A 474 -11.053 6.574 5.294 1.00 0.00 C ATOM 661 C GLY A 474 -10.712 6.566 3.817 1.00 0.00 C ATOM 662 O GLY A 474 -10.669 5.509 3.189 1.00 0.00 O ATOM 0 H GLY A 474 -10.101 4.711 5.405 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.121 6.753 5.416 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -10.534 7.400 5.779 1.00 0.00 H new ATOM 666 N ALA A 475 -10.469 7.748 3.261 1.00 0.00 N ATOM 667 CA ALA A 475 -10.130 7.874 1.849 1.00 0.00 C ATOM 668 C ALA A 475 -8.670 7.508 1.601 1.00 0.00 C ATOM 669 O ALA A 475 -7.761 8.236 1.999 1.00 0.00 O ATOM 670 CB ALA A 475 -10.412 9.287 1.362 1.00 0.00 C ATOM 0 H ALA A 475 -10.501 8.633 3.767 1.00 0.00 H new ATOM 0 HA ALA A 475 -10.753 7.178 1.288 1.00 0.00 H new ATOM 0 HB1 ALA A 475 -10.154 9.366 0.306 1.00 0.00 H new ATOM 0 HB2 ALA A 475 -11.470 9.513 1.495 1.00 0.00 H new ATOM 0 HB3 ALA A 475 -9.814 9.996 1.936 1.00 0.00 H new ATOM 676 N VAL A 476 -8.453 6.374 0.941 1.00 0.00 N ATOM 677 CA VAL A 476 -7.104 5.912 0.640 1.00 0.00 C ATOM 678 C VAL A 476 -6.425 6.823 -0.376 1.00 0.00 C ATOM 679 O VAL A 476 -7.078 7.393 -1.248 1.00 0.00 O ATOM 680 CB VAL A 476 -7.113 4.471 0.095 1.00 0.00 C ATOM 681 CG1 VAL A 476 -5.699 4.012 -0.226 1.00 0.00 C ATOM 682 CG2 VAL A 476 -7.775 3.530 1.090 1.00 0.00 C ATOM 0 H VAL A 476 -9.194 5.759 0.605 1.00 0.00 H new ATOM 0 HA VAL A 476 -6.545 5.936 1.576 1.00 0.00 H new ATOM 0 HB VAL A 476 -7.693 4.454 -0.828 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.726 2.992 -0.610 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -5.264 4.671 -0.978 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -5.092 4.043 0.679 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -7.773 2.516 0.689 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -7.225 3.549 2.031 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -8.803 3.849 1.264 1.00 0.00 H new ATOM 692 N ASN A 477 -5.108 6.956 -0.256 1.00 0.00 N ATOM 693 CA ASN A 477 -4.339 7.799 -1.165 1.00 0.00 C ATOM 694 C ASN A 477 -3.496 6.950 -2.112 1.00 0.00 C ATOM 695 O ASN A 477 -3.652 7.022 -3.331 1.00 0.00 O ATOM 696 CB ASN A 477 -3.436 8.747 -0.373 1.00 0.00 C ATOM 697 CG ASN A 477 -3.183 10.051 -1.105 1.00 0.00 C ATOM 698 OD1 ASN A 477 -2.124 10.246 -1.701 1.00 0.00 O ATOM 699 ND2 ASN A 477 -4.159 10.951 -1.064 1.00 0.00 N ATOM 0 H ASN A 477 -4.551 6.491 0.461 1.00 0.00 H new ATOM 0 HA ASN A 477 -5.041 8.386 -1.758 1.00 0.00 H new ATOM 0 HB2 ASN A 477 -3.895 8.959 0.593 1.00 0.00 H new ATOM 0 HB3 ASN A 477 -2.484 8.255 -0.173 1.00 0.00 H new ATOM 0 HD21 ASN A 477 -4.047 11.847 -1.539 1.00 0.00 H new ATOM 0 HD22 ASN A 477 -5.020 10.746 -0.558 1.00 0.00 H new ATOM 706 N ARG A 478 -2.603 6.147 -1.543 1.00 0.00 N ATOM 707 CA ARG A 478 -1.735 5.285 -2.336 1.00 0.00 C ATOM 708 C ARG A 478 -1.071 4.227 -1.459 1.00 0.00 C ATOM 709 O ARG A 478 -0.963 4.392 -0.244 1.00 0.00 O ATOM 710 CB ARG A 478 -0.667 6.117 -3.048 1.00 0.00 C ATOM 711 CG ARG A 478 0.352 6.736 -2.105 1.00 0.00 C ATOM 712 CD ARG A 478 1.657 7.045 -2.820 1.00 0.00 C ATOM 713 NE ARG A 478 1.491 8.074 -3.843 1.00 0.00 N ATOM 714 CZ ARG A 478 2.392 8.327 -4.785 1.00 0.00 C ATOM 715 NH1 ARG A 478 3.518 7.628 -4.834 1.00 0.00 N ATOM 716 NH2 ARG A 478 2.168 9.280 -5.681 1.00 0.00 N ATOM 0 H ARG A 478 -2.462 6.075 -0.535 1.00 0.00 H new ATOM 0 HA ARG A 478 -2.349 4.780 -3.082 1.00 0.00 H new ATOM 0 HB2 ARG A 478 -0.147 5.485 -3.768 1.00 0.00 H new ATOM 0 HB3 ARG A 478 -1.154 6.911 -3.614 1.00 0.00 H new ATOM 0 HG2 ARG A 478 -0.056 7.652 -1.678 1.00 0.00 H new ATOM 0 HG3 ARG A 478 0.543 6.055 -1.276 1.00 0.00 H new ATOM 0 HD2 ARG A 478 2.400 7.373 -2.093 1.00 0.00 H new ATOM 0 HD3 ARG A 478 2.042 6.135 -3.280 1.00 0.00 H new ATOM 0 HE ARG A 478 0.635 8.629 -3.833 1.00 0.00 H new ATOM 0 HH11 ARG A 478 3.693 6.894 -4.147 1.00 0.00 H new ATOM 0 HH12 ARG A 478 4.209 7.824 -5.558 1.00 0.00 H new ATOM 0 HH21 ARG A 478 1.303 9.819 -5.647 1.00 0.00 H new ATOM 0 HH22 ARG A 478 2.861 9.473 -6.404 1.00 0.00 H new ATOM 730 N VAL A 479 -0.628 3.141 -2.084 1.00 0.00 N ATOM 731 CA VAL A 479 0.026 2.057 -1.362 1.00 0.00 C ATOM 732 C VAL A 479 1.339 1.665 -2.030 1.00 0.00 C ATOM 733 O VAL A 479 1.398 1.484 -3.247 1.00 0.00 O ATOM 734 CB VAL A 479 -0.881 0.815 -1.270 1.00 0.00 C ATOM 735 CG1 VAL A 479 -0.199 -0.287 -0.475 1.00 0.00 C ATOM 736 CG2 VAL A 479 -2.221 1.180 -0.651 1.00 0.00 C ATOM 0 H VAL A 479 -0.710 2.989 -3.089 1.00 0.00 H new ATOM 0 HA VAL A 479 0.229 2.425 -0.356 1.00 0.00 H new ATOM 0 HB VAL A 479 -1.062 0.443 -2.278 1.00 0.00 H new ATOM 0 HG11 VAL A 479 -0.855 -1.156 -0.421 1.00 0.00 H new ATOM 0 HG12 VAL A 479 0.733 -0.566 -0.966 1.00 0.00 H new ATOM 0 HG13 VAL A 479 0.014 0.070 0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 479 -2.849 0.291 -0.594 1.00 0.00 H new ATOM 0 HG22 VAL A 479 -2.062 1.578 0.351 1.00 0.00 H new ATOM 0 HG23 VAL A 479 -2.713 1.933 -1.267 1.00 0.00 H new ATOM 746 N ILE A 480 2.390 1.535 -1.227 1.00 0.00 N ATOM 747 CA ILE A 480 3.702 1.163 -1.741 1.00 0.00 C ATOM 748 C ILE A 480 4.240 -0.074 -1.029 1.00 0.00 C ATOM 749 O ILE A 480 4.306 -0.117 0.200 1.00 0.00 O ATOM 750 CB ILE A 480 4.715 2.312 -1.584 1.00 0.00 C ATOM 751 CG1 ILE A 480 4.254 3.538 -2.376 1.00 0.00 C ATOM 752 CG2 ILE A 480 6.096 1.867 -2.042 1.00 0.00 C ATOM 753 CD1 ILE A 480 5.051 4.788 -2.073 1.00 0.00 C ATOM 0 H ILE A 480 2.358 1.682 -0.218 1.00 0.00 H new ATOM 0 HA ILE A 480 3.575 0.944 -2.801 1.00 0.00 H new ATOM 0 HB ILE A 480 4.774 2.584 -0.530 1.00 0.00 H new ATOM 0 HG12 ILE A 480 4.326 3.320 -3.442 1.00 0.00 H new ATOM 0 HG13 ILE A 480 3.202 3.726 -2.160 1.00 0.00 H new ATOM 0 HG21 ILE A 480 6.801 2.690 -1.925 1.00 0.00 H new ATOM 0 HG22 ILE A 480 6.424 1.020 -1.439 1.00 0.00 H new ATOM 0 HG23 ILE A 480 6.054 1.572 -3.090 1.00 0.00 H new ATOM 0 HD11 ILE A 480 4.669 5.616 -2.670 1.00 0.00 H new ATOM 0 HD12 ILE A 480 4.959 5.031 -1.014 1.00 0.00 H new ATOM 0 HD13 ILE A 480 6.100 4.619 -2.316 1.00 0.00 H new ATOM 765 N ILE A 481 4.626 -1.078 -1.810 1.00 0.00 N ATOM 766 CA ILE A 481 5.162 -2.315 -1.254 1.00 0.00 C ATOM 767 C ILE A 481 6.684 -2.345 -1.346 1.00 0.00 C ATOM 768 O ILE A 481 7.247 -2.553 -2.421 1.00 0.00 O ATOM 769 CB ILE A 481 4.591 -3.549 -1.976 1.00 0.00 C ATOM 770 CG1 ILE A 481 3.062 -3.541 -1.915 1.00 0.00 C ATOM 771 CG2 ILE A 481 5.144 -4.826 -1.360 1.00 0.00 C ATOM 772 CD1 ILE A 481 2.414 -4.522 -2.867 1.00 0.00 C ATOM 0 H ILE A 481 4.578 -1.059 -2.829 1.00 0.00 H new ATOM 0 HA ILE A 481 4.863 -2.346 -0.206 1.00 0.00 H new ATOM 0 HB ILE A 481 4.894 -3.512 -3.022 1.00 0.00 H new ATOM 0 HG12 ILE A 481 2.746 -3.772 -0.898 1.00 0.00 H new ATOM 0 HG13 ILE A 481 2.703 -2.537 -2.141 1.00 0.00 H new ATOM 0 HG21 ILE A 481 4.731 -5.690 -1.881 1.00 0.00 H new ATOM 0 HG22 ILE A 481 6.230 -4.833 -1.450 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.867 -4.871 -0.307 1.00 0.00 H new ATOM 0 HD11 ILE A 481 1.330 -4.462 -2.769 1.00 0.00 H new ATOM 0 HD12 ILE A 481 2.700 -4.279 -3.890 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.744 -5.533 -2.628 1.00 0.00 H new ATOM 784 N TYR A 482 7.343 -2.137 -0.212 1.00 0.00 N ATOM 785 CA TYR A 482 8.801 -2.140 -0.164 1.00 0.00 C ATOM 786 C TYR A 482 9.319 -3.367 0.580 1.00 0.00 C ATOM 787 O TYR A 482 8.961 -3.604 1.733 1.00 0.00 O ATOM 788 CB TYR A 482 9.312 -0.867 0.512 1.00 0.00 C ATOM 789 CG TYR A 482 10.761 -0.559 0.207 1.00 0.00 C ATOM 790 CD1 TYR A 482 11.120 0.101 -0.962 1.00 0.00 C ATOM 791 CD2 TYR A 482 11.770 -0.929 1.087 1.00 0.00 C ATOM 792 CE1 TYR A 482 12.443 0.383 -1.244 1.00 0.00 C ATOM 793 CE2 TYR A 482 13.095 -0.650 0.813 1.00 0.00 C ATOM 794 CZ TYR A 482 13.426 0.006 -0.354 1.00 0.00 C ATOM 795 OH TYR A 482 14.745 0.285 -0.631 1.00 0.00 O ATOM 0 H TYR A 482 6.892 -1.964 0.686 1.00 0.00 H new ATOM 0 HA TYR A 482 9.173 -2.174 -1.188 1.00 0.00 H new ATOM 0 HB2 TYR A 482 8.696 -0.025 0.196 1.00 0.00 H new ATOM 0 HB3 TYR A 482 9.189 -0.964 1.591 1.00 0.00 H new ATOM 0 HD1 TYR A 482 10.353 0.398 -1.661 1.00 0.00 H new ATOM 0 HD2 TYR A 482 11.514 -1.444 2.001 1.00 0.00 H new ATOM 0 HE1 TYR A 482 12.706 0.896 -2.157 1.00 0.00 H new ATOM 0 HE2 TYR A 482 13.867 -0.944 1.509 1.00 0.00 H new ATOM 0 HH TYR A 482 15.310 -0.047 0.098 1.00 0.00 H new ATOM 805 N GLN A 483 10.164 -4.144 -0.090 1.00 0.00 N ATOM 806 CA GLN A 483 10.733 -5.347 0.506 1.00 0.00 C ATOM 807 C GLN A 483 12.244 -5.391 0.307 1.00 0.00 C ATOM 808 O GLN A 483 12.735 -5.263 -0.814 1.00 0.00 O ATOM 809 CB GLN A 483 10.089 -6.595 -0.100 1.00 0.00 C ATOM 810 CG GLN A 483 10.013 -6.563 -1.618 1.00 0.00 C ATOM 811 CD GLN A 483 9.082 -5.484 -2.133 1.00 0.00 C ATOM 812 OE1 GLN A 483 9.519 -4.391 -2.496 1.00 0.00 O ATOM 813 NE2 GLN A 483 7.789 -5.784 -2.169 1.00 0.00 N ATOM 0 H GLN A 483 10.470 -3.962 -1.046 1.00 0.00 H new ATOM 0 HA GLN A 483 10.527 -5.324 1.576 1.00 0.00 H new ATOM 0 HB2 GLN A 483 10.656 -7.473 0.209 1.00 0.00 H new ATOM 0 HB3 GLN A 483 9.083 -6.707 0.304 1.00 0.00 H new ATOM 0 HG2 GLN A 483 11.011 -6.401 -2.025 1.00 0.00 H new ATOM 0 HG3 GLN A 483 9.675 -7.533 -1.982 1.00 0.00 H new ATOM 0 HE21 GLN A 483 7.470 -6.702 -1.859 1.00 0.00 H new ATOM 0 HE22 GLN A 483 7.115 -5.097 -2.507 1.00 0.00 H new ATOM 822 N GLU A 484 12.975 -5.574 1.402 1.00 0.00 N ATOM 823 CA GLU A 484 14.431 -5.635 1.346 1.00 0.00 C ATOM 824 C GLU A 484 14.999 -6.244 2.625 1.00 0.00 C ATOM 825 O GLU A 484 14.465 -6.040 3.715 1.00 0.00 O ATOM 826 CB GLU A 484 15.014 -4.236 1.132 1.00 0.00 C ATOM 827 CG GLU A 484 16.527 -4.182 1.254 1.00 0.00 C ATOM 828 CD GLU A 484 17.231 -4.734 0.029 1.00 0.00 C ATOM 829 OE1 GLU A 484 17.241 -4.044 -1.011 1.00 0.00 O ATOM 830 OE2 GLU A 484 17.773 -5.857 0.113 1.00 0.00 O ATOM 0 H GLU A 484 12.583 -5.682 2.338 1.00 0.00 H new ATOM 0 HA GLU A 484 14.711 -6.270 0.506 1.00 0.00 H new ATOM 0 HB2 GLU A 484 14.725 -3.878 0.144 1.00 0.00 H new ATOM 0 HB3 GLU A 484 14.575 -3.553 1.859 1.00 0.00 H new ATOM 0 HG2 GLU A 484 16.838 -3.150 1.413 1.00 0.00 H new ATOM 0 HG3 GLU A 484 16.837 -4.748 2.133 1.00 0.00 H new ATOM 837 N LYS A 485 16.087 -6.994 2.483 1.00 0.00 N ATOM 838 CA LYS A 485 16.731 -7.633 3.624 1.00 0.00 C ATOM 839 C LYS A 485 17.248 -6.592 4.611 1.00 0.00 C ATOM 840 O LYS A 485 17.906 -5.627 4.221 1.00 0.00 O ATOM 841 CB LYS A 485 17.884 -8.523 3.154 1.00 0.00 C ATOM 842 CG LYS A 485 18.173 -9.687 4.086 1.00 0.00 C ATOM 843 CD LYS A 485 19.453 -10.407 3.697 1.00 0.00 C ATOM 844 CE LYS A 485 19.201 -11.449 2.619 1.00 0.00 C ATOM 845 NZ LYS A 485 19.299 -10.868 1.251 1.00 0.00 N ATOM 0 H LYS A 485 16.541 -7.174 1.588 1.00 0.00 H new ATOM 0 HA LYS A 485 15.988 -8.249 4.130 1.00 0.00 H new ATOM 0 HB2 LYS A 485 17.651 -8.912 2.163 1.00 0.00 H new ATOM 0 HB3 LYS A 485 18.784 -7.916 3.055 1.00 0.00 H new ATOM 0 HG2 LYS A 485 18.256 -9.323 5.110 1.00 0.00 H new ATOM 0 HG3 LYS A 485 17.339 -10.388 4.064 1.00 0.00 H new ATOM 0 HD2 LYS A 485 20.185 -9.683 3.340 1.00 0.00 H new ATOM 0 HD3 LYS A 485 19.883 -10.888 4.576 1.00 0.00 H new ATOM 0 HE2 LYS A 485 19.923 -12.259 2.722 1.00 0.00 H new ATOM 0 HE3 LYS A 485 18.211 -11.884 2.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 18.429 -11.079 0.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 19.422 -9.838 1.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 20.115 -11.282 0.756 1.00 0.00 H new ATOM 950 N GLU A 493 16.232 -12.656 7.334 1.00 0.00 N ATOM 951 CA GLU A 493 15.054 -12.905 6.511 1.00 0.00 C ATOM 952 C GLU A 493 14.526 -11.606 5.910 1.00 0.00 C ATOM 953 O GLU A 493 14.537 -10.560 6.559 1.00 0.00 O ATOM 954 CB GLU A 493 13.959 -13.580 7.339 1.00 0.00 C ATOM 955 CG GLU A 493 12.765 -14.034 6.515 1.00 0.00 C ATOM 956 CD GLU A 493 13.056 -15.282 5.705 1.00 0.00 C ATOM 957 OE1 GLU A 493 14.207 -15.435 5.244 1.00 0.00 O ATOM 958 OE2 GLU A 493 12.133 -16.105 5.532 1.00 0.00 O ATOM 0 HA GLU A 493 15.345 -13.569 5.697 1.00 0.00 H new ATOM 0 HB2 GLU A 493 14.384 -14.442 7.853 1.00 0.00 H new ATOM 0 HB3 GLU A 493 13.617 -12.887 8.107 1.00 0.00 H new ATOM 0 HG2 GLU A 493 11.922 -14.225 7.179 1.00 0.00 H new ATOM 0 HG3 GLU A 493 12.466 -13.230 5.842 1.00 0.00 H new ATOM 965 N ILE A 494 14.065 -11.681 4.666 1.00 0.00 N ATOM 966 CA ILE A 494 13.532 -10.512 3.977 1.00 0.00 C ATOM 967 C ILE A 494 12.232 -10.041 4.620 1.00 0.00 C ATOM 968 O ILE A 494 11.306 -10.828 4.821 1.00 0.00 O ATOM 969 CB ILE A 494 13.278 -10.804 2.487 1.00 0.00 C ATOM 970 CG1 ILE A 494 14.589 -11.161 1.784 1.00 0.00 C ATOM 971 CG2 ILE A 494 12.621 -9.606 1.817 1.00 0.00 C ATOM 972 CD1 ILE A 494 15.485 -9.968 1.533 1.00 0.00 C ATOM 0 H ILE A 494 14.050 -12.539 4.115 1.00 0.00 H new ATOM 0 HA ILE A 494 14.283 -9.726 4.062 1.00 0.00 H new ATOM 0 HB ILE A 494 12.602 -11.656 2.409 1.00 0.00 H new ATOM 0 HG12 ILE A 494 15.129 -11.890 2.388 1.00 0.00 H new ATOM 0 HG13 ILE A 494 14.362 -11.641 0.832 1.00 0.00 H new ATOM 0 HG21 ILE A 494 12.448 -9.828 0.764 1.00 0.00 H new ATOM 0 HG22 ILE A 494 11.670 -9.393 2.304 1.00 0.00 H new ATOM 0 HG23 ILE A 494 13.274 -8.738 1.902 1.00 0.00 H new ATOM 0 HD11 ILE A 494 16.396 -10.296 1.032 1.00 0.00 H new ATOM 0 HD12 ILE A 494 14.964 -9.247 0.903 1.00 0.00 H new ATOM 0 HD13 ILE A 494 15.742 -9.500 2.483 1.00 0.00 H new ATOM 984 N ILE A 495 12.169 -8.752 4.939 1.00 0.00 N ATOM 985 CA ILE A 495 10.981 -8.176 5.556 1.00 0.00 C ATOM 986 C ILE A 495 10.074 -7.535 4.510 1.00 0.00 C ATOM 987 O ILE A 495 10.480 -7.324 3.367 1.00 0.00 O ATOM 988 CB ILE A 495 11.352 -7.120 6.613 1.00 0.00 C ATOM 989 CG1 ILE A 495 11.952 -5.882 5.942 1.00 0.00 C ATOM 990 CG2 ILE A 495 12.327 -7.704 7.626 1.00 0.00 C ATOM 991 CD1 ILE A 495 10.915 -4.960 5.339 1.00 0.00 C ATOM 0 H ILE A 495 12.927 -8.088 4.780 1.00 0.00 H new ATOM 0 HA ILE A 495 10.450 -8.994 6.042 1.00 0.00 H new ATOM 0 HB ILE A 495 10.445 -6.821 7.139 1.00 0.00 H new ATOM 0 HG12 ILE A 495 12.536 -5.328 6.676 1.00 0.00 H new ATOM 0 HG13 ILE A 495 12.642 -6.200 5.160 1.00 0.00 H new ATOM 0 HG21 ILE A 495 12.580 -6.945 8.367 1.00 0.00 H new ATOM 0 HG22 ILE A 495 11.867 -8.558 8.123 1.00 0.00 H new ATOM 0 HG23 ILE A 495 13.233 -8.027 7.114 1.00 0.00 H new ATOM 0 HD11 ILE A 495 11.411 -4.104 4.881 1.00 0.00 H new ATOM 0 HD12 ILE A 495 10.346 -5.498 4.581 1.00 0.00 H new ATOM 0 HD13 ILE A 495 10.239 -4.612 6.120 1.00 0.00 H new ATOM 1003 N VAL A 496 8.845 -7.226 4.911 1.00 0.00 N ATOM 1004 CA VAL A 496 7.881 -6.606 4.010 1.00 0.00 C ATOM 1005 C VAL A 496 7.273 -5.354 4.632 1.00 0.00 C ATOM 1006 O VAL A 496 6.375 -5.438 5.471 1.00 0.00 O ATOM 1007 CB VAL A 496 6.750 -7.584 3.639 1.00 0.00 C ATOM 1008 CG1 VAL A 496 5.713 -6.895 2.765 1.00 0.00 C ATOM 1009 CG2 VAL A 496 7.315 -8.813 2.943 1.00 0.00 C ATOM 0 H VAL A 496 8.494 -7.395 5.854 1.00 0.00 H new ATOM 0 HA VAL A 496 8.424 -6.331 3.106 1.00 0.00 H new ATOM 0 HB VAL A 496 6.259 -7.908 4.556 1.00 0.00 H new ATOM 0 HG11 VAL A 496 4.922 -7.602 2.513 1.00 0.00 H new ATOM 0 HG12 VAL A 496 5.286 -6.050 3.305 1.00 0.00 H new ATOM 0 HG13 VAL A 496 6.187 -6.539 1.850 1.00 0.00 H new ATOM 0 HG21 VAL A 496 6.502 -9.493 2.688 1.00 0.00 H new ATOM 0 HG22 VAL A 496 7.833 -8.510 2.033 1.00 0.00 H new ATOM 0 HG23 VAL A 496 8.015 -9.318 3.608 1.00 0.00 H new ATOM 1019 N LYS A 497 7.767 -4.193 4.217 1.00 0.00 N ATOM 1020 CA LYS A 497 7.272 -2.922 4.731 1.00 0.00 C ATOM 1021 C LYS A 497 6.242 -2.316 3.784 1.00 0.00 C ATOM 1022 O LYS A 497 6.579 -1.879 2.683 1.00 0.00 O ATOM 1023 CB LYS A 497 8.432 -1.944 4.934 1.00 0.00 C ATOM 1024 CG LYS A 497 8.139 -0.857 5.953 1.00 0.00 C ATOM 1025 CD LYS A 497 8.547 -1.282 7.354 1.00 0.00 C ATOM 1026 CE LYS A 497 10.047 -1.142 7.565 1.00 0.00 C ATOM 1027 NZ LYS A 497 10.453 0.281 7.729 1.00 0.00 N ATOM 0 H LYS A 497 8.511 -4.106 3.525 1.00 0.00 H new ATOM 0 HA LYS A 497 6.791 -3.110 5.691 1.00 0.00 H new ATOM 0 HB2 LYS A 497 9.314 -2.500 5.252 1.00 0.00 H new ATOM 0 HB3 LYS A 497 8.676 -1.479 3.979 1.00 0.00 H new ATOM 0 HG2 LYS A 497 8.671 0.054 5.678 1.00 0.00 H new ATOM 0 HG3 LYS A 497 7.075 -0.621 5.939 1.00 0.00 H new ATOM 0 HD2 LYS A 497 8.017 -0.675 8.088 1.00 0.00 H new ATOM 0 HD3 LYS A 497 8.250 -2.317 7.522 1.00 0.00 H new ATOM 0 HE2 LYS A 497 10.344 -1.709 8.448 1.00 0.00 H new ATOM 0 HE3 LYS A 497 10.575 -1.575 6.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 11.435 0.325 8.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 10.382 0.770 6.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 9.826 0.744 8.418 1.00 0.00 H new ATOM 1041 N ILE A 498 4.987 -2.291 4.219 1.00 0.00 N ATOM 1042 CA ILE A 498 3.909 -1.736 3.411 1.00 0.00 C ATOM 1043 C ILE A 498 3.580 -0.310 3.838 1.00 0.00 C ATOM 1044 O ILE A 498 3.405 -0.030 5.024 1.00 0.00 O ATOM 1045 CB ILE A 498 2.634 -2.595 3.505 1.00 0.00 C ATOM 1046 CG1 ILE A 498 2.904 -4.006 2.978 1.00 0.00 C ATOM 1047 CG2 ILE A 498 1.497 -1.943 2.732 1.00 0.00 C ATOM 1048 CD1 ILE A 498 1.888 -5.028 3.439 1.00 0.00 C ATOM 0 H ILE A 498 4.692 -2.649 5.127 1.00 0.00 H new ATOM 0 HA ILE A 498 4.259 -1.732 2.379 1.00 0.00 H new ATOM 0 HB ILE A 498 2.339 -2.668 4.552 1.00 0.00 H new ATOM 0 HG12 ILE A 498 2.915 -3.982 1.888 1.00 0.00 H new ATOM 0 HG13 ILE A 498 3.896 -4.322 3.300 1.00 0.00 H new ATOM 0 HG21 ILE A 498 0.603 -2.562 2.808 1.00 0.00 H new ATOM 0 HG22 ILE A 498 1.292 -0.957 3.149 1.00 0.00 H new ATOM 0 HG23 ILE A 498 1.780 -1.842 1.684 1.00 0.00 H new ATOM 0 HD11 ILE A 498 2.142 -6.005 3.027 1.00 0.00 H new ATOM 0 HD12 ILE A 498 1.893 -5.080 4.528 1.00 0.00 H new ATOM 0 HD13 ILE A 498 0.896 -4.736 3.094 1.00 0.00 H new ATOM 1060 N PHE A 499 3.494 0.589 2.863 1.00 0.00 N ATOM 1061 CA PHE A 499 3.185 1.988 3.138 1.00 0.00 C ATOM 1062 C PHE A 499 1.800 2.352 2.610 1.00 0.00 C ATOM 1063 O PHE A 499 1.494 2.137 1.437 1.00 0.00 O ATOM 1064 CB PHE A 499 4.240 2.899 2.507 1.00 0.00 C ATOM 1065 CG PHE A 499 5.641 2.592 2.952 1.00 0.00 C ATOM 1066 CD1 PHE A 499 6.083 2.980 4.207 1.00 0.00 C ATOM 1067 CD2 PHE A 499 6.515 1.917 2.117 1.00 0.00 C ATOM 1068 CE1 PHE A 499 7.372 2.700 4.619 1.00 0.00 C ATOM 1069 CE2 PHE A 499 7.806 1.633 2.524 1.00 0.00 C ATOM 1070 CZ PHE A 499 8.234 2.024 3.777 1.00 0.00 C ATOM 0 H PHE A 499 3.634 0.374 1.876 1.00 0.00 H new ATOM 0 HA PHE A 499 3.192 2.131 4.219 1.00 0.00 H new ATOM 0 HB2 PHE A 499 4.184 2.809 1.422 1.00 0.00 H new ATOM 0 HB3 PHE A 499 4.008 3.935 2.753 1.00 0.00 H new ATOM 0 HD1 PHE A 499 5.413 3.507 4.870 1.00 0.00 H new ATOM 0 HD2 PHE A 499 6.185 1.609 1.136 1.00 0.00 H new ATOM 0 HE1 PHE A 499 7.705 3.009 5.599 1.00 0.00 H new ATOM 0 HE2 PHE A 499 8.478 1.106 1.863 1.00 0.00 H new ATOM 0 HZ PHE A 499 9.241 1.802 4.098 1.00 0.00 H new ATOM 1080 N VAL A 500 0.967 2.905 3.486 1.00 0.00 N ATOM 1081 CA VAL A 500 -0.386 3.300 3.109 1.00 0.00 C ATOM 1082 C VAL A 500 -0.650 4.759 3.463 1.00 0.00 C ATOM 1083 O VAL A 500 -0.718 5.121 4.637 1.00 0.00 O ATOM 1084 CB VAL A 500 -1.441 2.417 3.800 1.00 0.00 C ATOM 1085 CG1 VAL A 500 -2.844 2.865 3.421 1.00 0.00 C ATOM 1086 CG2 VAL A 500 -1.226 0.953 3.445 1.00 0.00 C ATOM 0 H VAL A 500 1.205 3.090 4.461 1.00 0.00 H new ATOM 0 HA VAL A 500 -0.465 3.170 2.030 1.00 0.00 H new ATOM 0 HB VAL A 500 -1.330 2.526 4.879 1.00 0.00 H new ATOM 0 HG11 VAL A 500 -3.576 2.229 3.919 1.00 0.00 H new ATOM 0 HG12 VAL A 500 -2.992 3.900 3.731 1.00 0.00 H new ATOM 0 HG13 VAL A 500 -2.971 2.788 2.341 1.00 0.00 H new ATOM 0 HG21 VAL A 500 -1.981 0.343 3.942 1.00 0.00 H new ATOM 0 HG22 VAL A 500 -1.309 0.824 2.366 1.00 0.00 H new ATOM 0 HG23 VAL A 500 -0.234 0.641 3.772 1.00 0.00 H new ATOM 1096 N GLU A 501 -0.799 5.593 2.438 1.00 0.00 N ATOM 1097 CA GLU A 501 -1.055 7.014 2.641 1.00 0.00 C ATOM 1098 C GLU A 501 -2.514 7.351 2.345 1.00 0.00 C ATOM 1099 O GLU A 501 -3.118 6.793 1.429 1.00 0.00 O ATOM 1100 CB GLU A 501 -0.136 7.854 1.752 1.00 0.00 C ATOM 1101 CG GLU A 501 -0.428 9.344 1.809 1.00 0.00 C ATOM 1102 CD GLU A 501 0.386 10.137 0.805 1.00 0.00 C ATOM 1103 OE1 GLU A 501 0.640 9.611 -0.299 1.00 0.00 O ATOM 1104 OE2 GLU A 501 0.769 11.282 1.123 1.00 0.00 O ATOM 0 H GLU A 501 -0.747 5.309 1.460 1.00 0.00 H new ATOM 0 HA GLU A 501 -0.850 7.248 3.686 1.00 0.00 H new ATOM 0 HB2 GLU A 501 0.899 7.684 2.050 1.00 0.00 H new ATOM 0 HB3 GLU A 501 -0.231 7.513 0.721 1.00 0.00 H new ATOM 0 HG2 GLU A 501 -1.489 9.510 1.623 1.00 0.00 H new ATOM 0 HG3 GLU A 501 -0.219 9.713 2.813 1.00 0.00 H new ATOM 1111 N PHE A 502 -3.074 8.267 3.128 1.00 0.00 N ATOM 1112 CA PHE A 502 -4.462 8.678 2.952 1.00 0.00 C ATOM 1113 C PHE A 502 -4.548 10.153 2.569 1.00 0.00 C ATOM 1114 O PHE A 502 -3.544 10.864 2.567 1.00 0.00 O ATOM 1115 CB PHE A 502 -5.258 8.425 4.234 1.00 0.00 C ATOM 1116 CG PHE A 502 -5.120 7.025 4.758 1.00 0.00 C ATOM 1117 CD1 PHE A 502 -3.911 6.576 5.265 1.00 0.00 C ATOM 1118 CD2 PHE A 502 -6.200 6.157 4.745 1.00 0.00 C ATOM 1119 CE1 PHE A 502 -3.782 5.287 5.747 1.00 0.00 C ATOM 1120 CE2 PHE A 502 -6.077 4.867 5.226 1.00 0.00 C ATOM 1121 CZ PHE A 502 -4.866 4.432 5.729 1.00 0.00 C ATOM 0 H PHE A 502 -2.588 8.739 3.891 1.00 0.00 H new ATOM 0 HA PHE A 502 -4.891 8.085 2.144 1.00 0.00 H new ATOM 0 HB2 PHE A 502 -4.928 9.126 5.001 1.00 0.00 H new ATOM 0 HB3 PHE A 502 -6.311 8.632 4.045 1.00 0.00 H new ATOM 0 HD1 PHE A 502 -3.060 7.241 5.284 1.00 0.00 H new ATOM 0 HD2 PHE A 502 -7.149 6.492 4.354 1.00 0.00 H new ATOM 0 HE1 PHE A 502 -2.834 4.949 6.138 1.00 0.00 H new ATOM 0 HE2 PHE A 502 -6.926 4.200 5.209 1.00 0.00 H new ATOM 0 HZ PHE A 502 -4.767 3.425 6.107 1.00 0.00 H new ATOM 1131 N SER A 503 -5.756 10.605 2.245 1.00 0.00 N ATOM 1132 CA SER A 503 -5.974 11.993 1.856 1.00 0.00 C ATOM 1133 C SER A 503 -5.666 12.936 3.015 1.00 0.00 C ATOM 1134 O SER A 503 -4.946 13.922 2.853 1.00 0.00 O ATOM 1135 CB SER A 503 -7.417 12.193 1.389 1.00 0.00 C ATOM 1136 OG SER A 503 -7.646 13.538 1.004 1.00 0.00 O ATOM 0 H SER A 503 -6.598 10.030 2.244 1.00 0.00 H new ATOM 0 HA SER A 503 -5.298 12.225 1.033 1.00 0.00 H new ATOM 0 HB2 SER A 503 -7.626 11.530 0.549 1.00 0.00 H new ATOM 0 HB3 SER A 503 -8.103 11.919 2.190 1.00 0.00 H new ATOM 0 HG SER A 503 -8.575 13.640 0.708 1.00 0.00 H new ATOM 1142 N ILE A 504 -6.218 12.627 4.184 1.00 0.00 N ATOM 1143 CA ILE A 504 -6.003 13.446 5.370 1.00 0.00 C ATOM 1144 C ILE A 504 -5.210 12.685 6.427 1.00 0.00 C ATOM 1145 O ILE A 504 -4.963 11.487 6.289 1.00 0.00 O ATOM 1146 CB ILE A 504 -7.337 13.912 5.982 1.00 0.00 C ATOM 1147 CG1 ILE A 504 -8.276 12.720 6.181 1.00 0.00 C ATOM 1148 CG2 ILE A 504 -7.988 14.963 5.096 1.00 0.00 C ATOM 1149 CD1 ILE A 504 -9.624 13.101 6.752 1.00 0.00 C ATOM 0 H ILE A 504 -6.817 11.815 4.335 1.00 0.00 H new ATOM 0 HA ILE A 504 -5.434 14.320 5.051 1.00 0.00 H new ATOM 0 HB ILE A 504 -7.136 14.359 6.956 1.00 0.00 H new ATOM 0 HG12 ILE A 504 -8.424 12.221 5.223 1.00 0.00 H new ATOM 0 HG13 ILE A 504 -7.799 12.000 6.846 1.00 0.00 H new ATOM 0 HG21 ILE A 504 -8.930 15.282 5.542 1.00 0.00 H new ATOM 0 HG22 ILE A 504 -7.323 15.821 5.000 1.00 0.00 H new ATOM 0 HG23 ILE A 504 -8.179 14.540 4.110 1.00 0.00 H new ATOM 0 HD11 ILE A 504 -10.237 12.207 6.866 1.00 0.00 H new ATOM 0 HD12 ILE A 504 -9.487 13.573 7.725 1.00 0.00 H new ATOM 0 HD13 ILE A 504 -10.121 13.798 6.077 1.00 0.00 H new ATOM 1161 N ALA A 505 -4.816 13.388 7.484 1.00 0.00 N ATOM 1162 CA ALA A 505 -4.055 12.778 8.567 1.00 0.00 C ATOM 1163 C ALA A 505 -4.974 12.048 9.540 1.00 0.00 C ATOM 1164 O ALA A 505 -4.581 11.055 10.154 1.00 0.00 O ATOM 1165 CB ALA A 505 -3.239 13.833 9.298 1.00 0.00 C ATOM 0 H ALA A 505 -5.011 14.381 7.613 1.00 0.00 H new ATOM 0 HA ALA A 505 -3.375 12.046 8.133 1.00 0.00 H new ATOM 0 HB1 ALA A 505 -2.676 13.363 10.104 1.00 0.00 H new ATOM 0 HB2 ALA A 505 -2.548 14.306 8.600 1.00 0.00 H new ATOM 0 HB3 ALA A 505 -3.908 14.587 9.714 1.00 0.00 H new ATOM 1171 N SER A 506 -6.198 12.547 9.678 1.00 0.00 N ATOM 1172 CA SER A 506 -7.171 11.944 10.582 1.00 0.00 C ATOM 1173 C SER A 506 -7.349 10.460 10.278 1.00 0.00 C ATOM 1174 O SER A 506 -7.002 9.604 11.091 1.00 0.00 O ATOM 1175 CB SER A 506 -8.517 12.664 10.469 1.00 0.00 C ATOM 1176 OG SER A 506 -9.288 12.490 11.645 1.00 0.00 O ATOM 0 H SER A 506 -6.540 13.367 9.176 1.00 0.00 H new ATOM 0 HA SER A 506 -6.796 12.046 11.600 1.00 0.00 H new ATOM 0 HB2 SER A 506 -8.351 13.727 10.293 1.00 0.00 H new ATOM 0 HB3 SER A 506 -9.067 12.281 9.610 1.00 0.00 H new ATOM 0 HG SER A 506 -10.142 12.961 11.549 1.00 0.00 H new ATOM 1182 N GLU A 507 -7.891 10.164 9.100 1.00 0.00 N ATOM 1183 CA GLU A 507 -8.115 8.783 8.689 1.00 0.00 C ATOM 1184 C GLU A 507 -6.894 7.920 8.991 1.00 0.00 C ATOM 1185 O GLU A 507 -7.010 6.839 9.569 1.00 0.00 O ATOM 1186 CB GLU A 507 -8.441 8.719 7.195 1.00 0.00 C ATOM 1187 CG GLU A 507 -9.618 9.592 6.791 1.00 0.00 C ATOM 1188 CD GLU A 507 -10.824 9.397 7.689 1.00 0.00 C ATOM 1189 OE1 GLU A 507 -11.493 8.350 7.564 1.00 0.00 O ATOM 1190 OE2 GLU A 507 -11.099 10.291 8.517 1.00 0.00 O ATOM 0 H GLU A 507 -8.182 10.861 8.415 1.00 0.00 H new ATOM 0 HA GLU A 507 -8.961 8.395 9.256 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -7.562 9.023 6.627 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -8.655 7.686 6.922 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -9.315 10.639 6.818 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -9.896 9.367 5.761 1.00 0.00 H new ATOM 1197 N THR A 508 -5.721 8.405 8.596 1.00 0.00 N ATOM 1198 CA THR A 508 -4.478 7.679 8.822 1.00 0.00 C ATOM 1199 C THR A 508 -4.309 7.324 10.295 1.00 0.00 C ATOM 1200 O THR A 508 -4.247 6.149 10.658 1.00 0.00 O ATOM 1201 CB THR A 508 -3.257 8.497 8.360 1.00 0.00 C ATOM 1202 OG1 THR A 508 -3.420 8.890 6.992 1.00 0.00 O ATOM 1203 CG2 THR A 508 -1.976 7.690 8.511 1.00 0.00 C ATOM 0 H THR A 508 -5.606 9.298 8.118 1.00 0.00 H new ATOM 0 HA THR A 508 -4.536 6.763 8.234 1.00 0.00 H new ATOM 0 HB THR A 508 -3.184 9.385 8.987 1.00 0.00 H new ATOM 0 HG1 THR A 508 -3.873 8.175 6.498 1.00 0.00 H new ATOM 0 HG21 THR A 508 -1.128 8.288 8.179 1.00 0.00 H new ATOM 0 HG22 THR A 508 -1.839 7.417 9.557 1.00 0.00 H new ATOM 0 HG23 THR A 508 -2.042 6.786 7.905 1.00 0.00 H new ATOM 1211 N HIS A 509 -4.235 8.347 11.141 1.00 0.00 N ATOM 1212 CA HIS A 509 -4.074 8.142 12.576 1.00 0.00 C ATOM 1213 C HIS A 509 -4.956 6.997 13.064 1.00 0.00 C ATOM 1214 O HIS A 509 -4.531 6.172 13.873 1.00 0.00 O ATOM 1215 CB HIS A 509 -4.415 9.424 13.337 1.00 0.00 C ATOM 1216 CG HIS A 509 -3.264 10.375 13.454 1.00 0.00 C ATOM 1217 ND1 HIS A 509 -2.669 10.692 14.657 1.00 0.00 N ATOM 1218 CD2 HIS A 509 -2.597 11.078 12.509 1.00 0.00 C ATOM 1219 CE1 HIS A 509 -1.688 11.551 14.447 1.00 0.00 C ATOM 1220 NE2 HIS A 509 -1.623 11.801 13.152 1.00 0.00 N ATOM 0 H HIS A 509 -4.284 9.326 10.858 1.00 0.00 H new ATOM 0 HA HIS A 509 -3.033 7.881 12.766 1.00 0.00 H new ATOM 0 HB2 HIS A 509 -5.241 9.927 12.834 1.00 0.00 H new ATOM 0 HB3 HIS A 509 -4.762 9.162 14.336 1.00 0.00 H new ATOM 0 HD2 HIS A 509 -2.794 11.071 11.447 1.00 0.00 H new ATOM 0 HE1 HIS A 509 -1.048 11.977 15.206 1.00 0.00 H new ATOM 0 HE2 HIS A 509 -0.957 12.429 12.702 1.00 0.00 H new ATOM 1228 N LYS A 510 -6.188 6.953 12.567 1.00 0.00 N ATOM 1229 CA LYS A 510 -7.131 5.909 12.951 1.00 0.00 C ATOM 1230 C LYS A 510 -6.629 4.536 12.516 1.00 0.00 C ATOM 1231 O LYS A 510 -6.368 3.668 13.348 1.00 0.00 O ATOM 1232 CB LYS A 510 -8.504 6.182 12.332 1.00 0.00 C ATOM 1233 CG LYS A 510 -9.574 5.195 12.767 1.00 0.00 C ATOM 1234 CD LYS A 510 -10.965 5.685 12.405 1.00 0.00 C ATOM 1235 CE LYS A 510 -11.458 6.738 13.385 1.00 0.00 C ATOM 1236 NZ LYS A 510 -11.765 6.152 14.720 1.00 0.00 N ATOM 0 H LYS A 510 -6.557 7.628 11.897 1.00 0.00 H new ATOM 0 HA LYS A 510 -7.221 5.916 14.037 1.00 0.00 H new ATOM 0 HB2 LYS A 510 -8.820 7.190 12.600 1.00 0.00 H new ATOM 0 HB3 LYS A 510 -8.416 6.154 11.246 1.00 0.00 H new ATOM 0 HG2 LYS A 510 -9.393 4.229 12.295 1.00 0.00 H new ATOM 0 HG3 LYS A 510 -9.511 5.040 13.844 1.00 0.00 H new ATOM 0 HD2 LYS A 510 -10.955 6.101 11.397 1.00 0.00 H new ATOM 0 HD3 LYS A 510 -11.657 4.843 12.395 1.00 0.00 H new ATOM 0 HE2 LYS A 510 -10.701 7.515 13.495 1.00 0.00 H new ATOM 0 HE3 LYS A 510 -12.351 7.217 12.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 -12.342 6.821 15.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 -12.289 5.262 14.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 -10.878 5.963 15.228 1.00 0.00 H new ATOM 1250 N ALA A 511 -6.497 4.346 11.207 1.00 0.00 N ATOM 1251 CA ALA A 511 -6.023 3.080 10.663 1.00 0.00 C ATOM 1252 C ALA A 511 -4.876 2.519 11.496 1.00 0.00 C ATOM 1253 O ALA A 511 -4.761 1.305 11.673 1.00 0.00 O ATOM 1254 CB ALA A 511 -5.588 3.257 9.215 1.00 0.00 C ATOM 0 H ALA A 511 -6.712 5.053 10.504 1.00 0.00 H new ATOM 0 HA ALA A 511 -6.847 2.367 10.699 1.00 0.00 H new ATOM 0 HB1 ALA A 511 -5.236 2.303 8.822 1.00 0.00 H new ATOM 0 HB2 ALA A 511 -6.433 3.605 8.621 1.00 0.00 H new ATOM 0 HB3 ALA A 511 -4.783 3.990 9.164 1.00 0.00 H new ATOM 1260 N ILE A 512 -4.030 3.408 12.005 1.00 0.00 N ATOM 1261 CA ILE A 512 -2.893 3.000 12.821 1.00 0.00 C ATOM 1262 C ILE A 512 -3.331 2.643 14.237 1.00 0.00 C ATOM 1263 O ILE A 512 -3.108 1.526 14.702 1.00 0.00 O ATOM 1264 CB ILE A 512 -1.825 4.108 12.890 1.00 0.00 C ATOM 1265 CG1 ILE A 512 -1.358 4.486 11.483 1.00 0.00 C ATOM 1266 CG2 ILE A 512 -0.647 3.655 13.740 1.00 0.00 C ATOM 1267 CD1 ILE A 512 -0.610 5.799 11.427 1.00 0.00 C ATOM 0 H ILE A 512 -4.110 4.415 11.867 1.00 0.00 H new ATOM 0 HA ILE A 512 -2.462 2.119 12.345 1.00 0.00 H new ATOM 0 HB ILE A 512 -2.267 4.989 13.355 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -0.716 3.694 11.097 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -2.225 4.542 10.824 1.00 0.00 H new ATOM 0 HG21 ILE A 512 0.100 4.448 13.780 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -0.992 3.430 14.749 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -0.204 2.761 13.301 1.00 0.00 H new ATOM 0 HD11 ILE A 512 -0.309 6.003 10.399 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -1.257 6.602 11.782 1.00 0.00 H new ATOM 0 HD13 ILE A 512 0.276 5.740 12.059 1.00 0.00 H new ATOM 1279 N GLN A 513 -3.958 3.599 14.915 1.00 0.00 N ATOM 1280 CA GLN A 513 -4.429 3.384 16.278 1.00 0.00 C ATOM 1281 C GLN A 513 -5.128 2.034 16.406 1.00 0.00 C ATOM 1282 O GLN A 513 -5.200 1.462 17.494 1.00 0.00 O ATOM 1283 CB GLN A 513 -5.382 4.506 16.694 1.00 0.00 C ATOM 1284 CG GLN A 513 -4.689 5.841 16.916 1.00 0.00 C ATOM 1285 CD GLN A 513 -4.194 6.012 18.338 1.00 0.00 C ATOM 1286 OE1 GLN A 513 -3.623 5.092 18.924 1.00 0.00 O ATOM 1287 NE2 GLN A 513 -4.410 7.195 18.903 1.00 0.00 N ATOM 0 H GLN A 513 -4.151 4.529 14.543 1.00 0.00 H new ATOM 0 HA GLN A 513 -3.563 3.389 16.940 1.00 0.00 H new ATOM 0 HB2 GLN A 513 -6.146 4.626 15.926 1.00 0.00 H new ATOM 0 HB3 GLN A 513 -5.894 4.215 17.611 1.00 0.00 H new ATOM 0 HG2 GLN A 513 -3.847 5.927 16.229 1.00 0.00 H new ATOM 0 HG3 GLN A 513 -5.380 6.649 16.676 1.00 0.00 H new ATOM 0 HE21 GLN A 513 -4.887 7.930 18.381 1.00 0.00 H new ATOM 0 HE22 GLN A 513 -4.098 7.368 19.859 1.00 0.00 H new ATOM 1296 N ALA A 514 -5.642 1.531 15.289 1.00 0.00 N ATOM 1297 CA ALA A 514 -6.333 0.248 15.276 1.00 0.00 C ATOM 1298 C ALA A 514 -5.395 -0.877 14.854 1.00 0.00 C ATOM 1299 O ALA A 514 -5.221 -1.858 15.578 1.00 0.00 O ATOM 1300 CB ALA A 514 -7.539 0.308 14.350 1.00 0.00 C ATOM 0 H ALA A 514 -5.593 1.993 14.381 1.00 0.00 H new ATOM 0 HA ALA A 514 -6.676 0.038 16.289 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -8.046 -0.657 14.350 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -8.227 1.079 14.698 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -7.210 0.545 13.338 1.00 0.00 H new ATOM 1306 N LEU A 515 -4.793 -0.730 13.679 1.00 0.00 N ATOM 1307 CA LEU A 515 -3.871 -1.735 13.160 1.00 0.00 C ATOM 1308 C LEU A 515 -2.645 -1.864 14.058 1.00 0.00 C ATOM 1309 O LEU A 515 -1.833 -2.773 13.889 1.00 0.00 O ATOM 1310 CB LEU A 515 -3.441 -1.374 11.737 1.00 0.00 C ATOM 1311 CG LEU A 515 -4.548 -1.362 10.683 1.00 0.00 C ATOM 1312 CD1 LEU A 515 -4.235 -0.351 9.591 1.00 0.00 C ATOM 1313 CD2 LEU A 515 -4.735 -2.751 10.090 1.00 0.00 C ATOM 0 H LEU A 515 -4.927 0.075 13.067 1.00 0.00 H new ATOM 0 HA LEU A 515 -4.388 -2.694 13.144 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -2.977 -0.388 11.758 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -2.674 -2.081 11.421 1.00 0.00 H new ATOM 0 HG LEU A 515 -5.480 -1.067 11.166 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -5.034 -0.357 8.850 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -4.153 0.644 10.029 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -3.293 -0.614 9.111 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -5.527 -2.724 9.342 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -3.805 -3.075 9.623 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -5.007 -3.450 10.880 1.00 0.00 H new ATOM 1325 N ASN A 516 -2.518 -0.950 15.014 1.00 0.00 N ATOM 1326 CA ASN A 516 -1.391 -0.963 15.939 1.00 0.00 C ATOM 1327 C ASN A 516 -1.356 -2.264 16.736 1.00 0.00 C ATOM 1328 O ASN A 516 -0.374 -2.563 17.412 1.00 0.00 O ATOM 1329 CB ASN A 516 -1.475 0.230 16.894 1.00 0.00 C ATOM 1330 CG ASN A 516 -2.568 0.065 17.932 1.00 0.00 C ATOM 1331 OD1 ASN A 516 -3.629 -0.492 17.648 1.00 0.00 O ATOM 1332 ND2 ASN A 516 -2.314 0.550 19.141 1.00 0.00 N ATOM 0 H ASN A 516 -3.182 -0.191 15.168 1.00 0.00 H new ATOM 0 HA ASN A 516 -0.473 -0.890 15.355 1.00 0.00 H new ATOM 0 HB2 ASN A 516 -0.516 0.357 17.397 1.00 0.00 H new ATOM 0 HB3 ASN A 516 -1.657 1.139 16.320 1.00 0.00 H new ATOM 0 HD21 ASN A 516 -3.012 0.469 19.880 1.00 0.00 H new ATOM 0 HD22 ASN A 516 -1.421 1.004 19.331 1.00 0.00 H new ATOM 1339 N GLY A 517 -2.437 -3.034 16.649 1.00 0.00 N ATOM 1340 CA GLY A 517 -2.509 -4.294 17.365 1.00 0.00 C ATOM 1341 C GLY A 517 -3.560 -5.226 16.794 1.00 0.00 C ATOM 1342 O GLY A 517 -4.111 -6.063 17.509 1.00 0.00 O ATOM 0 H GLY A 517 -3.263 -2.807 16.096 1.00 0.00 H new ATOM 0 HA2 GLY A 517 -1.536 -4.784 17.331 1.00 0.00 H new ATOM 0 HA3 GLY A 517 -2.731 -4.100 18.414 1.00 0.00 H new ATOM 1346 N ARG A 518 -3.839 -5.080 15.503 1.00 0.00 N ATOM 1347 CA ARG A 518 -4.833 -5.914 14.838 1.00 0.00 C ATOM 1348 C ARG A 518 -4.396 -7.376 14.826 1.00 0.00 C ATOM 1349 O ARG A 518 -3.215 -7.682 14.990 1.00 0.00 O ATOM 1350 CB ARG A 518 -5.061 -5.427 13.406 1.00 0.00 C ATOM 1351 CG ARG A 518 -6.163 -4.387 13.284 1.00 0.00 C ATOM 1352 CD ARG A 518 -7.521 -5.036 13.070 1.00 0.00 C ATOM 1353 NE ARG A 518 -8.564 -4.049 12.802 1.00 0.00 N ATOM 1354 CZ ARG A 518 -9.788 -4.365 12.395 1.00 0.00 C ATOM 1355 NH1 ARG A 518 -10.122 -5.635 12.211 1.00 0.00 N ATOM 1356 NH2 ARG A 518 -10.682 -3.410 12.172 1.00 0.00 N ATOM 0 H ARG A 518 -3.391 -4.393 14.897 1.00 0.00 H new ATOM 0 HA ARG A 518 -5.767 -5.837 15.394 1.00 0.00 H new ATOM 0 HB2 ARG A 518 -4.132 -5.006 13.022 1.00 0.00 H new ATOM 0 HB3 ARG A 518 -5.308 -6.281 12.776 1.00 0.00 H new ATOM 0 HG2 ARG A 518 -6.189 -3.776 14.186 1.00 0.00 H new ATOM 0 HG3 ARG A 518 -5.943 -3.718 12.452 1.00 0.00 H new ATOM 0 HD2 ARG A 518 -7.461 -5.735 12.236 1.00 0.00 H new ATOM 0 HD3 ARG A 518 -7.789 -5.616 13.953 1.00 0.00 H new ATOM 0 HE ARG A 518 -8.340 -3.063 12.935 1.00 0.00 H new ATOM 0 HH11 ARG A 518 -9.438 -6.372 12.382 1.00 0.00 H new ATOM 0 HH12 ARG A 518 -11.063 -5.875 11.898 1.00 0.00 H new ATOM 0 HH21 ARG A 518 -10.429 -2.432 12.313 1.00 0.00 H new ATOM 0 HH22 ARG A 518 -11.622 -3.654 11.859 1.00 0.00 H new ATOM 1370 N TRP A 519 -5.356 -8.273 14.631 1.00 0.00 N ATOM 1371 CA TRP A 519 -5.070 -9.703 14.598 1.00 0.00 C ATOM 1372 C TRP A 519 -5.195 -10.250 13.181 1.00 0.00 C ATOM 1373 O TRP A 519 -6.264 -10.188 12.573 1.00 0.00 O ATOM 1374 CB TRP A 519 -6.017 -10.454 15.535 1.00 0.00 C ATOM 1375 CG TRP A 519 -5.454 -10.663 16.908 1.00 0.00 C ATOM 1376 CD1 TRP A 519 -5.790 -9.982 18.043 1.00 0.00 C ATOM 1377 CD2 TRP A 519 -4.454 -11.615 17.289 1.00 0.00 C ATOM 1378 NE1 TRP A 519 -5.059 -10.453 19.107 1.00 0.00 N ATOM 1379 CE2 TRP A 519 -4.233 -11.456 18.671 1.00 0.00 C ATOM 1380 CE3 TRP A 519 -3.727 -12.587 16.598 1.00 0.00 C ATOM 1381 CZ2 TRP A 519 -3.315 -12.232 19.372 1.00 0.00 C ATOM 1382 CZ3 TRP A 519 -2.815 -13.357 17.295 1.00 0.00 C ATOM 1383 CH2 TRP A 519 -2.616 -13.177 18.670 1.00 0.00 C ATOM 0 H TRP A 519 -6.338 -8.036 14.493 1.00 0.00 H new ATOM 0 HA TRP A 519 -4.044 -9.852 14.935 1.00 0.00 H new ATOM 0 HB2 TRP A 519 -6.952 -9.900 15.614 1.00 0.00 H new ATOM 0 HB3 TRP A 519 -6.257 -11.423 15.097 1.00 0.00 H new ATOM 0 HD1 TRP A 519 -6.522 -9.190 18.096 1.00 0.00 H new ATOM 0 HE1 TRP A 519 -5.121 -10.111 20.066 1.00 0.00 H new ATOM 0 HE3 TRP A 519 -3.875 -12.734 15.538 1.00 0.00 H new ATOM 0 HZ2 TRP A 519 -3.159 -12.094 20.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 519 -2.246 -14.110 16.771 1.00 0.00 H new ATOM 0 HH2 TRP A 519 -1.897 -13.796 19.186 1.00 0.00 H new ATOM 1394 N PHE A 520 -4.097 -10.787 12.660 1.00 0.00 N ATOM 1395 CA PHE A 520 -4.084 -11.345 11.313 1.00 0.00 C ATOM 1396 C PHE A 520 -4.462 -12.824 11.333 1.00 0.00 C ATOM 1397 O PHE A 520 -4.340 -13.492 12.359 1.00 0.00 O ATOM 1398 CB PHE A 520 -2.703 -11.169 10.677 1.00 0.00 C ATOM 1399 CG PHE A 520 -2.683 -11.446 9.201 1.00 0.00 C ATOM 1400 CD1 PHE A 520 -2.604 -12.746 8.728 1.00 0.00 C ATOM 1401 CD2 PHE A 520 -2.741 -10.407 8.287 1.00 0.00 C ATOM 1402 CE1 PHE A 520 -2.585 -13.005 7.370 1.00 0.00 C ATOM 1403 CE2 PHE A 520 -2.723 -10.659 6.928 1.00 0.00 C ATOM 1404 CZ PHE A 520 -2.644 -11.959 6.469 1.00 0.00 C ATOM 0 H PHE A 520 -3.205 -10.848 13.150 1.00 0.00 H new ATOM 0 HA PHE A 520 -4.822 -10.807 10.717 1.00 0.00 H new ATOM 0 HB2 PHE A 520 -2.359 -10.150 10.852 1.00 0.00 H new ATOM 0 HB3 PHE A 520 -1.996 -11.834 11.173 1.00 0.00 H new ATOM 0 HD1 PHE A 520 -2.557 -13.567 9.428 1.00 0.00 H new ATOM 0 HD2 PHE A 520 -2.801 -9.388 8.640 1.00 0.00 H new ATOM 0 HE1 PHE A 520 -2.524 -14.023 7.014 1.00 0.00 H new ATOM 0 HE2 PHE A 520 -2.771 -9.840 6.226 1.00 0.00 H new ATOM 0 HZ PHE A 520 -2.628 -12.158 5.408 1.00 0.00 H new ATOM 1414 N ALA A 521 -4.922 -13.327 10.192 1.00 0.00 N ATOM 1415 CA ALA A 521 -5.316 -14.725 10.077 1.00 0.00 C ATOM 1416 C ALA A 521 -4.211 -15.650 10.575 1.00 0.00 C ATOM 1417 O ALA A 521 -3.395 -16.135 9.793 1.00 0.00 O ATOM 1418 CB ALA A 521 -5.675 -15.056 8.636 1.00 0.00 C ATOM 0 H ALA A 521 -5.031 -12.786 9.334 1.00 0.00 H new ATOM 0 HA ALA A 521 -6.194 -14.881 10.703 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -5.967 -16.104 8.565 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -6.504 -14.426 8.313 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -4.812 -14.876 7.995 1.00 0.00 H new ATOM 1424 N GLY A 522 -4.190 -15.889 11.883 1.00 0.00 N ATOM 1425 CA GLY A 522 -3.179 -16.755 12.463 1.00 0.00 C ATOM 1426 C GLY A 522 -1.858 -16.042 12.676 1.00 0.00 C ATOM 1427 O GLY A 522 -0.828 -16.681 12.891 1.00 0.00 O ATOM 0 H GLY A 522 -4.855 -15.499 12.551 1.00 0.00 H new ATOM 0 HA2 GLY A 522 -3.539 -17.140 13.417 1.00 0.00 H new ATOM 0 HA3 GLY A 522 -3.024 -17.614 11.811 1.00 0.00 H new ATOM 1431 N ARG A 523 -1.887 -14.715 12.614 1.00 0.00 N ATOM 1432 CA ARG A 523 -0.682 -13.915 12.798 1.00 0.00 C ATOM 1433 C ARG A 523 -1.012 -12.579 13.458 1.00 0.00 C ATOM 1434 O ARG A 523 -2.180 -12.224 13.617 1.00 0.00 O ATOM 1435 CB ARG A 523 0.008 -13.676 11.454 1.00 0.00 C ATOM 1436 CG ARG A 523 0.659 -14.920 10.874 1.00 0.00 C ATOM 1437 CD ARG A 523 0.842 -14.803 9.369 1.00 0.00 C ATOM 1438 NE ARG A 523 1.924 -15.654 8.881 1.00 0.00 N ATOM 1439 CZ ARG A 523 2.170 -15.864 7.593 1.00 0.00 C ATOM 1440 NH1 ARG A 523 1.415 -15.288 6.668 1.00 0.00 N ATOM 1441 NH2 ARG A 523 3.173 -16.652 7.228 1.00 0.00 N ATOM 0 H ARG A 523 -2.732 -14.171 12.438 1.00 0.00 H new ATOM 0 HA ARG A 523 -0.006 -14.467 13.452 1.00 0.00 H new ATOM 0 HB2 ARG A 523 -0.724 -13.294 10.742 1.00 0.00 H new ATOM 0 HB3 ARG A 523 0.767 -12.903 11.577 1.00 0.00 H new ATOM 0 HG2 ARG A 523 1.627 -15.080 11.348 1.00 0.00 H new ATOM 0 HG3 ARG A 523 0.046 -15.792 11.100 1.00 0.00 H new ATOM 0 HD2 ARG A 523 -0.087 -15.076 8.869 1.00 0.00 H new ATOM 0 HD3 ARG A 523 1.052 -13.765 9.109 1.00 0.00 H new ATOM 0 HE ARG A 523 2.524 -16.112 9.567 1.00 0.00 H new ATOM 0 HH11 ARG A 523 0.643 -14.682 6.945 1.00 0.00 H new ATOM 0 HH12 ARG A 523 1.606 -15.451 5.679 1.00 0.00 H new ATOM 0 HH21 ARG A 523 3.756 -17.097 7.937 1.00 0.00 H new ATOM 0 HH22 ARG A 523 3.361 -16.813 6.238 1.00 0.00 H new ATOM 1455 N LYS A 524 0.025 -11.842 13.841 1.00 0.00 N ATOM 1456 CA LYS A 524 -0.153 -10.545 14.483 1.00 0.00 C ATOM 1457 C LYS A 524 0.227 -9.412 13.535 1.00 0.00 C ATOM 1458 O LYS A 524 1.137 -9.552 12.718 1.00 0.00 O ATOM 1459 CB LYS A 524 0.692 -10.464 15.757 1.00 0.00 C ATOM 1460 CG LYS A 524 0.293 -9.325 16.679 1.00 0.00 C ATOM 1461 CD LYS A 524 -1.004 -9.628 17.411 1.00 0.00 C ATOM 1462 CE LYS A 524 -1.193 -8.714 18.612 1.00 0.00 C ATOM 1463 NZ LYS A 524 -2.633 -8.515 18.935 1.00 0.00 N ATOM 0 H LYS A 524 0.998 -12.121 13.718 1.00 0.00 H new ATOM 0 HA LYS A 524 -1.206 -10.438 14.745 1.00 0.00 H new ATOM 0 HB2 LYS A 524 0.608 -11.406 16.299 1.00 0.00 H new ATOM 0 HB3 LYS A 524 1.740 -10.347 15.481 1.00 0.00 H new ATOM 0 HG2 LYS A 524 1.088 -9.147 17.404 1.00 0.00 H new ATOM 0 HG3 LYS A 524 0.179 -8.409 16.099 1.00 0.00 H new ATOM 0 HD2 LYS A 524 -1.845 -9.511 16.727 1.00 0.00 H new ATOM 0 HD3 LYS A 524 -1.003 -10.667 17.740 1.00 0.00 H new ATOM 0 HE2 LYS A 524 -0.682 -9.139 19.476 1.00 0.00 H new ATOM 0 HE3 LYS A 524 -0.729 -7.749 18.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 -2.726 -8.188 19.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 -3.038 -7.804 18.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 -3.142 -9.415 18.820 1.00 0.00 H new ATOM 1477 N VAL A 525 -0.475 -8.290 13.650 1.00 0.00 N ATOM 1478 CA VAL A 525 -0.210 -7.132 12.805 1.00 0.00 C ATOM 1479 C VAL A 525 0.326 -5.964 13.626 1.00 0.00 C ATOM 1480 O VAL A 525 -0.032 -5.794 14.791 1.00 0.00 O ATOM 1481 CB VAL A 525 -1.478 -6.680 12.057 1.00 0.00 C ATOM 1482 CG1 VAL A 525 -1.230 -5.368 11.329 1.00 0.00 C ATOM 1483 CG2 VAL A 525 -1.938 -7.759 11.088 1.00 0.00 C ATOM 0 H VAL A 525 -1.232 -8.158 14.321 1.00 0.00 H new ATOM 0 HA VAL A 525 0.542 -7.437 12.077 1.00 0.00 H new ATOM 0 HB VAL A 525 -2.271 -6.518 12.787 1.00 0.00 H new ATOM 0 HG11 VAL A 525 -2.137 -5.065 10.806 1.00 0.00 H new ATOM 0 HG12 VAL A 525 -0.952 -4.599 12.050 1.00 0.00 H new ATOM 0 HG13 VAL A 525 -0.423 -5.499 10.608 1.00 0.00 H new ATOM 0 HG21 VAL A 525 -2.835 -7.423 10.568 1.00 0.00 H new ATOM 0 HG22 VAL A 525 -1.150 -7.956 10.361 1.00 0.00 H new ATOM 0 HG23 VAL A 525 -2.159 -8.673 11.639 1.00 0.00 H new ATOM 1493 N VAL A 526 1.187 -5.160 13.009 1.00 0.00 N ATOM 1494 CA VAL A 526 1.772 -4.007 13.681 1.00 0.00 C ATOM 1495 C VAL A 526 1.742 -2.774 12.784 1.00 0.00 C ATOM 1496 O VAL A 526 2.281 -2.785 11.678 1.00 0.00 O ATOM 1497 CB VAL A 526 3.227 -4.283 14.106 1.00 0.00 C ATOM 1498 CG1 VAL A 526 3.898 -3.002 14.578 1.00 0.00 C ATOM 1499 CG2 VAL A 526 3.271 -5.349 15.191 1.00 0.00 C ATOM 0 H VAL A 526 1.494 -5.287 12.045 1.00 0.00 H new ATOM 0 HA VAL A 526 1.170 -3.821 14.571 1.00 0.00 H new ATOM 0 HB VAL A 526 3.776 -4.654 13.241 1.00 0.00 H new ATOM 0 HG11 VAL A 526 4.925 -3.217 14.874 1.00 0.00 H new ATOM 0 HG12 VAL A 526 3.899 -2.272 13.768 1.00 0.00 H new ATOM 0 HG13 VAL A 526 3.352 -2.598 15.430 1.00 0.00 H new ATOM 0 HG21 VAL A 526 4.306 -5.532 15.480 1.00 0.00 H new ATOM 0 HG22 VAL A 526 2.707 -5.008 16.059 1.00 0.00 H new ATOM 0 HG23 VAL A 526 2.831 -6.272 14.812 1.00 0.00 H new ATOM 1509 N ALA A 527 1.107 -1.712 13.269 1.00 0.00 N ATOM 1510 CA ALA A 527 1.008 -0.470 12.513 1.00 0.00 C ATOM 1511 C ALA A 527 1.880 0.619 13.129 1.00 0.00 C ATOM 1512 O ALA A 527 2.077 0.655 14.343 1.00 0.00 O ATOM 1513 CB ALA A 527 -0.441 -0.011 12.439 1.00 0.00 C ATOM 0 H ALA A 527 0.653 -1.687 14.182 1.00 0.00 H new ATOM 0 HA ALA A 527 1.369 -0.659 11.502 1.00 0.00 H new ATOM 0 HB1 ALA A 527 -0.500 0.918 11.872 1.00 0.00 H new ATOM 0 HB2 ALA A 527 -1.040 -0.776 11.946 1.00 0.00 H new ATOM 0 HB3 ALA A 527 -0.822 0.155 13.447 1.00 0.00 H new ATOM 1519 N GLU A 528 2.399 1.504 12.284 1.00 0.00 N ATOM 1520 CA GLU A 528 3.251 2.593 12.747 1.00 0.00 C ATOM 1521 C GLU A 528 3.123 3.810 11.835 1.00 0.00 C ATOM 1522 O GLU A 528 2.729 3.692 10.675 1.00 0.00 O ATOM 1523 CB GLU A 528 4.710 2.139 12.807 1.00 0.00 C ATOM 1524 CG GLU A 528 4.952 0.993 13.775 1.00 0.00 C ATOM 1525 CD GLU A 528 6.370 0.972 14.312 1.00 0.00 C ATOM 1526 OE1 GLU A 528 6.689 1.811 15.179 1.00 0.00 O ATOM 1527 OE2 GLU A 528 7.160 0.115 13.864 1.00 0.00 O ATOM 0 H GLU A 528 2.245 1.488 11.276 1.00 0.00 H new ATOM 0 HA GLU A 528 2.924 2.875 13.748 1.00 0.00 H new ATOM 0 HB2 GLU A 528 5.028 1.834 11.810 1.00 0.00 H new ATOM 0 HB3 GLU A 528 5.333 2.985 13.096 1.00 0.00 H new ATOM 0 HG2 GLU A 528 4.253 1.072 14.608 1.00 0.00 H new ATOM 0 HG3 GLU A 528 4.744 0.048 13.273 1.00 0.00 H new ATOM 1534 N VAL A 529 3.457 4.981 12.369 1.00 0.00 N ATOM 1535 CA VAL A 529 3.380 6.220 11.605 1.00 0.00 C ATOM 1536 C VAL A 529 4.724 6.557 10.969 1.00 0.00 C ATOM 1537 O VAL A 529 5.722 6.746 11.665 1.00 0.00 O ATOM 1538 CB VAL A 529 2.933 7.398 12.489 1.00 0.00 C ATOM 1539 CG1 VAL A 529 4.095 7.909 13.327 1.00 0.00 C ATOM 1540 CG2 VAL A 529 2.350 8.514 11.635 1.00 0.00 C ATOM 0 H VAL A 529 3.784 5.097 13.328 1.00 0.00 H new ATOM 0 HA VAL A 529 2.639 6.063 10.821 1.00 0.00 H new ATOM 0 HB VAL A 529 2.155 7.046 13.167 1.00 0.00 H new ATOM 0 HG11 VAL A 529 3.759 8.742 13.945 1.00 0.00 H new ATOM 0 HG12 VAL A 529 4.462 7.107 13.967 1.00 0.00 H new ATOM 0 HG13 VAL A 529 4.897 8.245 12.670 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.039 9.339 12.277 1.00 0.00 H new ATOM 0 HG22 VAL A 529 3.105 8.866 10.932 1.00 0.00 H new ATOM 0 HG23 VAL A 529 1.488 8.138 11.084 1.00 0.00 H new ATOM 1550 N TYR A 530 4.743 6.632 9.643 1.00 0.00 N ATOM 1551 CA TYR A 530 5.965 6.945 8.912 1.00 0.00 C ATOM 1552 C TYR A 530 6.289 8.433 9.005 1.00 0.00 C ATOM 1553 O TYR A 530 5.465 9.233 9.448 1.00 0.00 O ATOM 1554 CB TYR A 530 5.828 6.532 7.446 1.00 0.00 C ATOM 1555 CG TYR A 530 7.153 6.346 6.742 1.00 0.00 C ATOM 1556 CD1 TYR A 530 7.969 5.259 7.032 1.00 0.00 C ATOM 1557 CD2 TYR A 530 7.589 7.256 5.787 1.00 0.00 C ATOM 1558 CE1 TYR A 530 9.181 5.086 6.392 1.00 0.00 C ATOM 1559 CE2 TYR A 530 8.799 7.090 5.141 1.00 0.00 C ATOM 1560 CZ TYR A 530 9.591 6.003 5.448 1.00 0.00 C ATOM 1561 OH TYR A 530 10.797 5.833 4.807 1.00 0.00 O ATOM 0 H TYR A 530 3.926 6.480 9.052 1.00 0.00 H new ATOM 0 HA TYR A 530 6.783 6.384 9.365 1.00 0.00 H new ATOM 0 HB2 TYR A 530 5.263 5.601 7.391 1.00 0.00 H new ATOM 0 HB3 TYR A 530 5.248 7.288 6.917 1.00 0.00 H new ATOM 0 HD1 TYR A 530 7.650 4.538 7.770 1.00 0.00 H new ATOM 0 HD2 TYR A 530 6.971 8.108 5.545 1.00 0.00 H new ATOM 0 HE1 TYR A 530 9.804 4.237 6.630 1.00 0.00 H new ATOM 0 HE2 TYR A 530 9.123 7.807 4.401 1.00 0.00 H new ATOM 0 HH TYR A 530 10.936 6.566 4.171 1.00 0.00 H new