USER MOD reduce.3.24.130724 H: found=0, std=0, add=755, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 756 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 Single : A 24 MET CE :methyl -179:sc= -0.579 (180deg=-0.58) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 175:sc= -0.249 (180deg=-0.264) USER MOD Single : A 31 GLN : amide:sc= -0.35 X(o=-0.35,f=-0.011) USER MOD Single : A 33 SER OG : rot 49:sc= 1.11 USER MOD Single : A 37 ASN : amide:sc=-0.00633 K(o=-0.0063,f=-1.2) USER MOD Single : A 38 LYS NZ :NH3+ -113:sc=-0.00477 (180deg=-0.239) USER MOD Single : A 43 LYS NZ :NH3+ 153:sc= 0.776 (180deg=0.387) USER MOD Single : A 49 HIS : no HE2:sc= -0.23 K(o=-0.23,f=-5.1!) USER MOD Single : A 52 GLN : amide:sc= -0.707 K(o=-0.71,f=-3.1!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 72 THR OG1 : rot -16:sc= 0.349 USER MOD Single : A 74 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0208) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 30:sc= -0.3 USER MOD Single : A 87 SER OG : rot -84:sc= 0.00638 USER MOD Single : A 88 CYS SG : rot 160:sc= -1.66 USER MOD Single : A 106 THR OG1 : rot 34:sc= 0.412 USER MOD Single : A 107 LYS NZ :NH3+ 168:sc= -0.0177 (180deg=-0.176) USER MOD Single : A 114 LYS NZ :NH3+ -161:sc= 0.703 (180deg=0.442) USER MOD Single : A 115 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.0272) USER MOD Single : A 120 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0226) USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -9.460 27.055 -18.165 1.00 0.00 N ATOM 297 CA ARG A 22 -10.918 27.029 -18.376 1.00 0.00 C ATOM 298 C ARG A 22 -11.590 26.856 -17.002 1.00 0.00 C ATOM 299 O ARG A 22 -11.054 26.123 -16.159 1.00 0.00 O ATOM 300 CB ARG A 22 -11.336 25.864 -19.345 1.00 0.00 C ATOM 301 CG ARG A 22 -11.356 26.222 -20.855 1.00 0.00 C ATOM 302 CD ARG A 22 -10.014 26.728 -21.403 1.00 0.00 C ATOM 303 NE ARG A 22 -10.099 27.034 -22.845 1.00 0.00 N ATOM 304 CZ ARG A 22 -9.295 27.872 -23.517 1.00 0.00 C ATOM 305 NH1 ARG A 22 -8.344 28.554 -22.899 1.00 0.00 N ATOM 306 NH2 ARG A 22 -9.463 28.031 -24.816 1.00 0.00 N ATOM 0 HA ARG A 22 -11.238 27.960 -18.843 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.651 25.029 -19.197 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.329 25.516 -19.059 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -11.657 25.341 -21.421 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -12.115 26.985 -21.025 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -9.711 27.622 -20.858 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.244 25.975 -21.235 1.00 0.00 H new ATOM 0 HE ARG A 22 -10.834 26.567 -23.377 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.212 28.448 -21.893 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -7.743 29.186 -23.428 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.200 27.519 -25.301 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -8.856 28.666 -25.335 1.00 0.00 H new ATOM 320 N PRO A 23 -12.742 27.564 -16.729 1.00 0.00 N ATOM 321 CA PRO A 23 -13.553 27.305 -15.527 1.00 0.00 C ATOM 322 C PRO A 23 -14.159 25.885 -15.610 1.00 0.00 C ATOM 323 O PRO A 23 -14.949 25.599 -16.521 1.00 0.00 O ATOM 324 CB PRO A 23 -14.638 28.429 -15.546 1.00 0.00 C ATOM 325 CG PRO A 23 -14.703 28.888 -16.976 1.00 0.00 C ATOM 326 CD PRO A 23 -13.319 28.665 -17.557 1.00 0.00 C ATOM 0 HA PRO A 23 -12.987 27.329 -14.596 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -15.603 28.051 -15.209 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -14.368 29.249 -14.881 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -15.453 28.325 -17.531 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -14.985 29.939 -17.035 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -13.370 28.386 -18.609 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -12.712 29.568 -17.496 1.00 0.00 H new ATOM 334 N MET A 24 -13.721 24.994 -14.681 1.00 0.00 N ATOM 335 CA MET A 24 -14.123 23.561 -14.622 1.00 0.00 C ATOM 336 C MET A 24 -15.661 23.401 -14.602 1.00 0.00 C ATOM 337 O MET A 24 -16.375 24.327 -14.191 1.00 0.00 O ATOM 338 CB MET A 24 -13.464 22.870 -13.383 1.00 0.00 C ATOM 339 CG MET A 24 -11.942 22.610 -13.508 1.00 0.00 C ATOM 340 SD MET A 24 -10.950 24.102 -13.790 1.00 0.00 S ATOM 341 CE MET A 24 -11.126 24.995 -12.244 1.00 0.00 C ATOM 0 H MET A 24 -13.069 25.254 -13.941 1.00 0.00 H new ATOM 0 HA MET A 24 -13.765 23.069 -15.526 1.00 0.00 H new ATOM 0 HB2 MET A 24 -13.640 23.490 -12.504 1.00 0.00 H new ATOM 0 HB3 MET A 24 -13.966 21.919 -13.207 1.00 0.00 H new ATOM 0 HG2 MET A 24 -11.593 22.122 -12.598 1.00 0.00 H new ATOM 0 HG3 MET A 24 -11.771 21.913 -14.329 1.00 0.00 H new ATOM 0 HE1 MET A 24 -10.577 25.935 -12.302 1.00 0.00 H new ATOM 0 HE2 MET A 24 -12.181 25.201 -12.061 1.00 0.00 H new ATOM 0 HE3 MET A 24 -10.727 24.392 -11.428 1.00 0.00 H new ATOM 351 N SER A 25 -16.135 22.201 -15.019 1.00 0.00 N ATOM 352 CA SER A 25 -17.547 21.946 -15.387 1.00 0.00 C ATOM 353 C SER A 25 -18.540 22.407 -14.294 1.00 0.00 C ATOM 354 O SER A 25 -18.377 22.064 -13.117 1.00 0.00 O ATOM 355 CB SER A 25 -17.731 20.432 -15.676 1.00 0.00 C ATOM 356 OG SER A 25 -16.795 19.981 -16.647 1.00 0.00 O ATOM 0 H SER A 25 -15.541 21.377 -15.110 1.00 0.00 H new ATOM 0 HA SER A 25 -17.771 22.532 -16.279 1.00 0.00 H new ATOM 0 HB2 SER A 25 -17.606 19.864 -14.754 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.745 20.246 -16.030 1.00 0.00 H new ATOM 0 HG SER A 25 -16.929 19.024 -16.811 1.00 0.00 H new ATOM 362 N TYR A 26 -19.576 23.176 -14.715 1.00 0.00 N ATOM 363 CA TYR A 26 -20.558 23.787 -13.792 1.00 0.00 C ATOM 364 C TYR A 26 -21.411 22.719 -13.096 1.00 0.00 C ATOM 365 O TYR A 26 -21.871 22.941 -11.984 1.00 0.00 O ATOM 366 CB TYR A 26 -21.443 24.857 -14.510 1.00 0.00 C ATOM 367 CG TYR A 26 -22.263 24.355 -15.723 1.00 0.00 C ATOM 368 CD1 TYR A 26 -23.519 23.750 -15.559 1.00 0.00 C ATOM 369 CD2 TYR A 26 -21.787 24.496 -17.034 1.00 0.00 C ATOM 370 CE1 TYR A 26 -24.255 23.313 -16.646 1.00 0.00 C ATOM 371 CE2 TYR A 26 -22.525 24.055 -18.119 1.00 0.00 C ATOM 372 CZ TYR A 26 -23.754 23.467 -17.921 1.00 0.00 C ATOM 373 OH TYR A 26 -24.488 23.034 -19.005 1.00 0.00 O ATOM 0 H TYR A 26 -19.751 23.387 -15.697 1.00 0.00 H new ATOM 0 HA TYR A 26 -19.994 24.309 -13.019 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -22.133 25.279 -13.779 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -20.797 25.669 -14.844 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -23.919 23.623 -14.564 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -20.825 24.958 -17.201 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -25.220 22.852 -16.496 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -22.137 24.172 -19.120 1.00 0.00 H new ATOM 0 HH TYR A 26 -23.993 23.218 -19.830 1.00 0.00 H new ATOM 383 N ASP A 27 -21.593 21.554 -13.758 1.00 0.00 N ATOM 384 CA ASP A 27 -22.268 20.377 -13.157 1.00 0.00 C ATOM 385 C ASP A 27 -21.504 19.894 -11.905 1.00 0.00 C ATOM 386 O ASP A 27 -22.101 19.727 -10.830 1.00 0.00 O ATOM 387 CB ASP A 27 -22.378 19.233 -14.199 1.00 0.00 C ATOM 388 CG ASP A 27 -22.982 17.929 -13.625 1.00 0.00 C ATOM 389 OD1 ASP A 27 -22.215 17.025 -13.224 1.00 0.00 O ATOM 390 OD2 ASP A 27 -24.223 17.812 -13.566 1.00 0.00 O ATOM 0 H ASP A 27 -21.279 21.402 -14.717 1.00 0.00 H new ATOM 0 HA ASP A 27 -23.273 20.671 -12.853 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -22.992 19.571 -15.034 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -21.386 19.019 -14.598 1.00 0.00 H new ATOM 395 N GLU A 28 -20.179 19.698 -12.071 1.00 0.00 N ATOM 396 CA GLU A 28 -19.262 19.316 -10.978 1.00 0.00 C ATOM 397 C GLU A 28 -19.321 20.339 -9.836 1.00 0.00 C ATOM 398 O GLU A 28 -19.347 19.969 -8.672 1.00 0.00 O ATOM 399 CB GLU A 28 -17.796 19.224 -11.499 1.00 0.00 C ATOM 400 CG GLU A 28 -17.550 18.156 -12.570 1.00 0.00 C ATOM 401 CD GLU A 28 -17.790 16.730 -12.054 1.00 0.00 C ATOM 402 OE1 GLU A 28 -18.754 16.069 -12.495 1.00 0.00 O ATOM 403 OE2 GLU A 28 -17.008 16.268 -11.197 1.00 0.00 O ATOM 0 H GLU A 28 -19.713 19.801 -12.973 1.00 0.00 H new ATOM 0 HA GLU A 28 -19.578 18.341 -10.607 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -17.510 20.195 -11.904 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -17.138 19.025 -10.653 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -18.204 18.344 -13.421 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -16.525 18.239 -12.931 1.00 0.00 H new ATOM 410 N LYS A 29 -19.358 21.626 -10.224 1.00 0.00 N ATOM 411 CA LYS A 29 -19.344 22.771 -9.299 1.00 0.00 C ATOM 412 C LYS A 29 -20.674 22.920 -8.533 1.00 0.00 C ATOM 413 O LYS A 29 -20.664 23.364 -7.390 1.00 0.00 O ATOM 414 CB LYS A 29 -18.965 24.080 -10.073 1.00 0.00 C ATOM 415 CG LYS A 29 -17.461 24.472 -10.074 1.00 0.00 C ATOM 416 CD LYS A 29 -16.506 23.500 -10.831 1.00 0.00 C ATOM 417 CE LYS A 29 -15.971 22.333 -9.967 1.00 0.00 C ATOM 418 NZ LYS A 29 -14.954 21.517 -10.686 1.00 0.00 N ATOM 0 H LYS A 29 -19.399 21.903 -11.205 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.582 22.585 -8.542 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -19.290 23.971 -11.108 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -19.533 24.906 -9.645 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -17.364 25.464 -10.516 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -17.125 24.549 -9.040 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -17.033 23.088 -11.691 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -15.660 24.068 -11.218 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -15.533 22.732 -9.052 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -16.802 21.694 -9.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -14.564 20.801 -10.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -15.399 21.045 -11.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.188 22.135 -11.022 1.00 0.00 H new ATOM 432 N ARG A 30 -21.799 22.527 -9.158 1.00 0.00 N ATOM 433 CA ARG A 30 -23.134 22.582 -8.522 1.00 0.00 C ATOM 434 C ARG A 30 -23.283 21.475 -7.471 1.00 0.00 C ATOM 435 O ARG A 30 -23.898 21.688 -6.431 1.00 0.00 O ATOM 436 CB ARG A 30 -24.270 22.506 -9.581 1.00 0.00 C ATOM 437 CG ARG A 30 -24.453 23.786 -10.445 1.00 0.00 C ATOM 438 CD ARG A 30 -25.094 24.973 -9.684 1.00 0.00 C ATOM 439 NE ARG A 30 -24.235 25.565 -8.633 1.00 0.00 N ATOM 440 CZ ARG A 30 -24.572 26.623 -7.879 1.00 0.00 C ATOM 441 NH1 ARG A 30 -25.735 27.240 -8.047 1.00 0.00 N ATOM 442 NH2 ARG A 30 -23.745 27.058 -6.942 1.00 0.00 N ATOM 0 H ARG A 30 -21.812 22.164 -10.111 1.00 0.00 H new ATOM 0 HA ARG A 30 -23.223 23.543 -8.016 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -24.072 21.664 -10.244 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -25.209 22.294 -9.069 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -23.481 24.096 -10.828 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -25.073 23.544 -11.308 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -25.355 25.750 -10.402 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -26.024 24.635 -9.227 1.00 0.00 H new ATOM 0 HE ARG A 30 -23.323 25.139 -8.471 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -26.389 26.912 -8.758 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -25.975 28.043 -7.465 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -22.851 26.589 -6.793 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -24.001 27.862 -6.369 1.00 0.00 H new ATOM 456 N GLN A 31 -22.703 20.298 -7.756 1.00 0.00 N ATOM 457 CA GLN A 31 -22.619 19.190 -6.782 1.00 0.00 C ATOM 458 C GLN A 31 -21.580 19.518 -5.692 1.00 0.00 C ATOM 459 O GLN A 31 -21.730 19.121 -4.526 1.00 0.00 O ATOM 460 CB GLN A 31 -22.261 17.872 -7.512 1.00 0.00 C ATOM 461 CG GLN A 31 -23.293 17.445 -8.582 1.00 0.00 C ATOM 462 CD GLN A 31 -24.704 17.159 -8.034 1.00 0.00 C ATOM 463 OE1 GLN A 31 -25.694 17.399 -8.714 1.00 0.00 O ATOM 464 NE2 GLN A 31 -24.802 16.598 -6.829 1.00 0.00 N ATOM 0 H GLN A 31 -22.281 20.085 -8.660 1.00 0.00 H new ATOM 0 HA GLN A 31 -23.588 19.063 -6.299 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -21.286 17.985 -7.987 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -22.166 17.075 -6.775 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -23.362 18.230 -9.335 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -22.925 16.551 -9.086 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -23.960 16.409 -6.284 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -25.719 16.357 -6.452 1.00 0.00 H new ATOM 473 N LEU A 32 -20.541 20.275 -6.100 1.00 0.00 N ATOM 474 CA LEU A 32 -19.493 20.766 -5.197 1.00 0.00 C ATOM 475 C LEU A 32 -20.056 21.845 -4.254 1.00 0.00 C ATOM 476 O LEU A 32 -19.520 22.048 -3.183 1.00 0.00 O ATOM 477 CB LEU A 32 -18.298 21.340 -5.998 1.00 0.00 C ATOM 478 CG LEU A 32 -17.033 21.737 -5.170 1.00 0.00 C ATOM 479 CD1 LEU A 32 -16.338 20.492 -4.558 1.00 0.00 C ATOM 480 CD2 LEU A 32 -16.056 22.583 -6.017 1.00 0.00 C ATOM 0 H LEU A 32 -20.410 20.561 -7.070 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.141 19.923 -4.602 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.001 20.603 -6.744 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -18.642 22.221 -6.540 1.00 0.00 H new ATOM 0 HG LEU A 32 -17.363 22.357 -4.337 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.463 20.807 -3.989 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -17.034 19.975 -3.897 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.029 19.818 -5.357 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.186 22.845 -5.415 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.737 22.008 -6.886 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.556 23.494 -6.347 1.00 0.00 H new ATOM 492 N SER A 33 -21.141 22.531 -4.675 1.00 0.00 N ATOM 493 CA SER A 33 -21.830 23.538 -3.841 1.00 0.00 C ATOM 494 C SER A 33 -22.361 22.896 -2.546 1.00 0.00 C ATOM 495 O SER A 33 -22.189 23.452 -1.475 1.00 0.00 O ATOM 496 CB SER A 33 -22.977 24.216 -4.627 1.00 0.00 C ATOM 497 OG SER A 33 -22.493 24.808 -5.821 1.00 0.00 O ATOM 0 H SER A 33 -21.561 22.403 -5.596 1.00 0.00 H new ATOM 0 HA SER A 33 -21.107 24.308 -3.571 1.00 0.00 H new ATOM 0 HB2 SER A 33 -23.744 23.479 -4.867 1.00 0.00 H new ATOM 0 HB3 SER A 33 -23.449 24.976 -4.005 1.00 0.00 H new ATOM 0 HG SER A 33 -21.943 24.159 -6.308 1.00 0.00 H new ATOM 503 N LEU A 34 -22.951 21.690 -2.673 1.00 0.00 N ATOM 504 CA LEU A 34 -23.440 20.901 -1.517 1.00 0.00 C ATOM 505 C LEU A 34 -22.251 20.345 -0.708 1.00 0.00 C ATOM 506 O LEU A 34 -22.342 20.178 0.506 1.00 0.00 O ATOM 507 CB LEU A 34 -24.379 19.727 -1.965 1.00 0.00 C ATOM 508 CG LEU A 34 -25.773 20.111 -2.581 1.00 0.00 C ATOM 509 CD1 LEU A 34 -26.539 21.093 -1.668 1.00 0.00 C ATOM 510 CD2 LEU A 34 -25.639 20.650 -4.022 1.00 0.00 C ATOM 0 H LEU A 34 -23.103 21.235 -3.573 1.00 0.00 H new ATOM 0 HA LEU A 34 -24.025 21.572 -0.888 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -23.841 19.126 -2.698 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.557 19.089 -1.099 1.00 0.00 H new ATOM 0 HG LEU A 34 -26.363 19.196 -2.643 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -27.499 21.339 -2.122 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -26.706 20.631 -0.695 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -25.954 22.004 -1.541 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -26.626 20.903 -4.409 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -25.011 21.541 -4.020 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -25.186 19.887 -4.655 1.00 0.00 H new ATOM 522 N ASP A 35 -21.143 20.065 -1.410 1.00 0.00 N ATOM 523 CA ASP A 35 -19.900 19.547 -0.800 1.00 0.00 C ATOM 524 C ASP A 35 -19.177 20.647 0.011 1.00 0.00 C ATOM 525 O ASP A 35 -18.414 20.359 0.933 1.00 0.00 O ATOM 526 CB ASP A 35 -18.985 18.977 -1.908 1.00 0.00 C ATOM 527 CG ASP A 35 -17.766 18.219 -1.368 1.00 0.00 C ATOM 528 OD1 ASP A 35 -16.638 18.760 -1.384 1.00 0.00 O ATOM 529 OD2 ASP A 35 -17.952 17.076 -0.899 1.00 0.00 O ATOM 0 H ASP A 35 -21.079 20.190 -2.420 1.00 0.00 H new ATOM 0 HA ASP A 35 -20.152 18.748 -0.103 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -19.568 18.307 -2.540 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -18.642 19.795 -2.541 1.00 0.00 H new ATOM 534 N ILE A 36 -19.401 21.907 -0.371 1.00 0.00 N ATOM 535 CA ILE A 36 -18.939 23.080 0.392 1.00 0.00 C ATOM 536 C ILE A 36 -19.907 23.334 1.562 1.00 0.00 C ATOM 537 O ILE A 36 -19.489 23.613 2.678 1.00 0.00 O ATOM 538 CB ILE A 36 -18.836 24.352 -0.542 1.00 0.00 C ATOM 539 CG1 ILE A 36 -17.745 24.125 -1.650 1.00 0.00 C ATOM 540 CG2 ILE A 36 -18.554 25.656 0.258 1.00 0.00 C ATOM 541 CD1 ILE A 36 -17.686 25.200 -2.723 1.00 0.00 C ATOM 0 H ILE A 36 -19.910 22.148 -1.221 1.00 0.00 H new ATOM 0 HA ILE A 36 -17.943 22.883 0.788 1.00 0.00 H new ATOM 0 HB ILE A 36 -19.806 24.484 -1.021 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -16.769 24.059 -1.169 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -17.930 23.164 -2.130 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -18.493 26.499 -0.430 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -19.361 25.827 0.971 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -17.611 25.557 0.795 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -16.903 24.955 -3.441 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -18.646 25.254 -3.237 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -17.466 26.163 -2.262 1.00 0.00 H new ATOM 553 N ASN A 37 -21.213 23.180 1.280 1.00 0.00 N ATOM 554 CA ASN A 37 -22.307 23.433 2.249 1.00 0.00 C ATOM 555 C ASN A 37 -22.466 22.291 3.276 1.00 0.00 C ATOM 556 O ASN A 37 -23.278 22.406 4.200 1.00 0.00 O ATOM 557 CB ASN A 37 -23.641 23.681 1.487 1.00 0.00 C ATOM 558 CG ASN A 37 -23.686 25.014 0.712 1.00 0.00 C ATOM 559 OD1 ASN A 37 -22.658 25.600 0.362 1.00 0.00 O ATOM 560 ND2 ASN A 37 -24.890 25.485 0.404 1.00 0.00 N ATOM 0 H ASN A 37 -21.547 22.874 0.366 1.00 0.00 H new ATOM 0 HA ASN A 37 -22.043 24.325 2.817 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -23.805 22.861 0.788 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -24.464 23.661 2.201 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -24.978 26.348 -0.133 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -25.726 24.983 0.704 1.00 0.00 H new ATOM 567 N LYS A 38 -21.710 21.182 3.102 1.00 0.00 N ATOM 568 CA LYS A 38 -21.667 20.081 4.096 1.00 0.00 C ATOM 569 C LYS A 38 -20.798 20.491 5.304 1.00 0.00 C ATOM 570 O LYS A 38 -20.930 19.927 6.396 1.00 0.00 O ATOM 571 CB LYS A 38 -21.130 18.760 3.463 1.00 0.00 C ATOM 572 CG LYS A 38 -19.594 18.693 3.301 1.00 0.00 C ATOM 573 CD LYS A 38 -19.107 17.427 2.559 1.00 0.00 C ATOM 574 CE LYS A 38 -17.569 17.360 2.465 1.00 0.00 C ATOM 575 NZ LYS A 38 -16.931 17.268 3.802 1.00 0.00 N ATOM 0 H LYS A 38 -21.122 21.025 2.284 1.00 0.00 H new ATOM 0 HA LYS A 38 -22.686 19.894 4.436 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -21.453 17.921 4.080 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -21.590 18.630 2.483 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -19.255 19.576 2.758 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -19.131 18.727 4.287 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -19.476 16.541 3.075 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -19.531 17.411 1.555 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -17.280 16.496 1.866 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -17.199 18.245 1.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -16.395 18.139 3.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -17.665 17.148 4.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -16.286 16.452 3.823 1.00 0.00 H new ATOM 589 N LEU A 39 -19.895 21.471 5.074 1.00 0.00 N ATOM 590 CA LEU A 39 -19.005 22.015 6.107 1.00 0.00 C ATOM 591 C LEU A 39 -19.835 22.808 7.151 1.00 0.00 C ATOM 592 O LEU A 39 -20.890 23.353 6.798 1.00 0.00 O ATOM 593 CB LEU A 39 -17.922 22.926 5.453 1.00 0.00 C ATOM 594 CG LEU A 39 -17.013 22.254 4.368 1.00 0.00 C ATOM 595 CD1 LEU A 39 -16.011 23.273 3.767 1.00 0.00 C ATOM 596 CD2 LEU A 39 -16.277 21.003 4.920 1.00 0.00 C ATOM 0 H LEU A 39 -19.768 21.904 4.159 1.00 0.00 H new ATOM 0 HA LEU A 39 -18.500 21.195 6.617 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -18.423 23.781 4.998 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -17.280 23.316 6.243 1.00 0.00 H new ATOM 0 HG LEU A 39 -17.669 21.913 3.567 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -15.394 22.778 3.017 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -16.560 24.092 3.302 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -15.374 23.667 4.559 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -15.658 20.569 4.135 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.646 21.293 5.760 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -17.009 20.268 5.253 1.00 0.00 H new ATOM 608 N PRO A 40 -19.389 22.866 8.452 1.00 0.00 N ATOM 609 CA PRO A 40 -20.091 23.641 9.512 1.00 0.00 C ATOM 610 C PRO A 40 -20.014 25.164 9.263 1.00 0.00 C ATOM 611 O PRO A 40 -19.205 25.611 8.448 1.00 0.00 O ATOM 612 CB PRO A 40 -19.337 23.230 10.807 1.00 0.00 C ATOM 613 CG PRO A 40 -17.968 22.837 10.339 1.00 0.00 C ATOM 614 CD PRO A 40 -18.174 22.181 8.995 1.00 0.00 C ATOM 0 HA PRO A 40 -21.159 23.428 9.554 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -19.291 24.055 11.518 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -19.836 22.402 11.311 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -17.317 23.707 10.255 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -17.495 22.151 11.042 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -17.311 22.320 8.344 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -18.329 21.107 9.093 1.00 0.00 H new ATOM 622 N GLY A 41 -20.846 25.936 9.994 1.00 0.00 N ATOM 623 CA GLY A 41 -20.982 27.393 9.810 1.00 0.00 C ATOM 624 C GLY A 41 -19.674 28.160 10.004 1.00 0.00 C ATOM 625 O GLY A 41 -19.433 29.170 9.332 1.00 0.00 O ATOM 0 H GLY A 41 -21.444 25.562 10.731 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -21.364 27.590 8.808 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -21.723 27.772 10.514 1.00 0.00 H new ATOM 629 N GLU A 42 -18.844 27.671 10.941 1.00 0.00 N ATOM 630 CA GLU A 42 -17.475 28.181 11.189 1.00 0.00 C ATOM 631 C GLU A 42 -16.594 28.095 9.913 1.00 0.00 C ATOM 632 O GLU A 42 -15.807 29.001 9.629 1.00 0.00 O ATOM 633 CB GLU A 42 -16.837 27.373 12.357 1.00 0.00 C ATOM 634 CG GLU A 42 -16.908 25.841 12.167 1.00 0.00 C ATOM 635 CD GLU A 42 -16.337 25.028 13.331 1.00 0.00 C ATOM 636 OE1 GLU A 42 -17.004 24.927 14.383 1.00 0.00 O ATOM 637 OE2 GLU A 42 -15.223 24.478 13.203 1.00 0.00 O ATOM 0 H GLU A 42 -19.103 26.901 11.558 1.00 0.00 H new ATOM 0 HA GLU A 42 -17.536 29.234 11.463 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -15.793 27.669 12.463 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -17.340 27.638 13.287 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -17.949 25.554 12.017 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -16.370 25.576 11.257 1.00 0.00 H new ATOM 644 N LYS A 43 -16.762 27.008 9.144 1.00 0.00 N ATOM 645 CA LYS A 43 -16.009 26.769 7.891 1.00 0.00 C ATOM 646 C LYS A 43 -16.670 27.492 6.714 1.00 0.00 C ATOM 647 O LYS A 43 -15.968 27.932 5.813 1.00 0.00 O ATOM 648 CB LYS A 43 -15.857 25.233 7.600 1.00 0.00 C ATOM 649 CG LYS A 43 -14.545 24.590 8.122 1.00 0.00 C ATOM 650 CD LYS A 43 -14.326 24.771 9.639 1.00 0.00 C ATOM 651 CE LYS A 43 -12.995 24.173 10.123 1.00 0.00 C ATOM 652 NZ LYS A 43 -12.770 24.421 11.572 1.00 0.00 N ATOM 0 H LYS A 43 -17.424 26.265 9.369 1.00 0.00 H new ATOM 0 HA LYS A 43 -15.007 27.178 8.019 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -16.702 24.709 8.046 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -15.917 25.076 6.523 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -14.555 23.525 7.890 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -13.700 25.024 7.588 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -14.351 25.833 9.881 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -15.148 24.301 10.179 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -12.989 23.100 9.933 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -12.174 24.603 9.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.163 23.672 11.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -12.307 25.344 11.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -13.683 24.421 12.070 1.00 0.00 H new ATOM 666 N LEU A 44 -18.012 27.620 6.747 1.00 0.00 N ATOM 667 CA LEU A 44 -18.786 28.312 5.697 1.00 0.00 C ATOM 668 C LEU A 44 -18.422 29.799 5.660 1.00 0.00 C ATOM 669 O LEU A 44 -18.174 30.352 4.598 1.00 0.00 O ATOM 670 CB LEU A 44 -20.316 28.113 5.891 1.00 0.00 C ATOM 671 CG LEU A 44 -20.841 26.664 5.633 1.00 0.00 C ATOM 672 CD1 LEU A 44 -22.352 26.534 5.957 1.00 0.00 C ATOM 673 CD2 LEU A 44 -20.538 26.221 4.180 1.00 0.00 C ATOM 0 H LEU A 44 -18.589 27.247 7.501 1.00 0.00 H new ATOM 0 HA LEU A 44 -18.523 27.869 4.736 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -20.576 28.400 6.910 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -20.842 28.796 5.224 1.00 0.00 H new ATOM 0 HG LEU A 44 -20.310 25.995 6.310 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -22.679 25.512 5.765 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -22.522 26.778 7.006 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -22.919 27.221 5.329 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -20.912 25.209 4.023 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -21.027 26.901 3.483 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -19.461 26.240 4.011 1.00 0.00 H new ATOM 685 N GLY A 45 -18.316 30.413 6.851 1.00 0.00 N ATOM 686 CA GLY A 45 -17.958 31.829 6.987 1.00 0.00 C ATOM 687 C GLY A 45 -16.499 32.136 6.625 1.00 0.00 C ATOM 688 O GLY A 45 -16.090 33.302 6.659 1.00 0.00 O ATOM 0 H GLY A 45 -18.476 29.941 7.741 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -18.613 32.423 6.350 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -18.142 32.144 8.014 1.00 0.00 H new ATOM 692 N ARG A 46 -15.718 31.086 6.294 1.00 0.00 N ATOM 693 CA ARG A 46 -14.295 31.207 5.929 1.00 0.00 C ATOM 694 C ARG A 46 -14.092 30.865 4.432 1.00 0.00 C ATOM 695 O ARG A 46 -13.372 31.576 3.719 1.00 0.00 O ATOM 696 CB ARG A 46 -13.444 30.275 6.844 1.00 0.00 C ATOM 697 CG ARG A 46 -11.920 30.542 6.806 1.00 0.00 C ATOM 698 CD ARG A 46 -11.126 29.582 7.716 1.00 0.00 C ATOM 699 NE ARG A 46 -9.680 29.884 7.716 1.00 0.00 N ATOM 700 CZ ARG A 46 -8.696 29.035 7.366 1.00 0.00 C ATOM 701 NH1 ARG A 46 -8.966 27.832 6.883 1.00 0.00 N ATOM 702 NH2 ARG A 46 -7.435 29.411 7.488 1.00 0.00 N ATOM 0 H ARG A 46 -16.061 30.126 6.273 1.00 0.00 H new ATOM 0 HA ARG A 46 -13.966 32.235 6.080 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.792 30.382 7.871 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -13.625 29.240 6.553 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.563 30.443 5.781 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.727 31.570 7.113 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -11.510 29.648 8.734 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.281 28.556 7.383 1.00 0.00 H new ATOM 0 HE ARG A 46 -9.402 30.821 8.008 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.935 27.533 6.770 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -8.205 27.204 6.624 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -7.212 30.340 7.846 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.685 28.772 7.225 1.00 0.00 H new ATOM 716 N VAL A 47 -14.767 29.791 3.963 1.00 0.00 N ATOM 717 CA VAL A 47 -14.665 29.296 2.567 1.00 0.00 C ATOM 718 C VAL A 47 -15.420 30.240 1.610 1.00 0.00 C ATOM 719 O VAL A 47 -15.044 30.408 0.448 1.00 0.00 O ATOM 720 CB VAL A 47 -15.210 27.812 2.423 1.00 0.00 C ATOM 721 CG1 VAL A 47 -16.727 27.710 2.699 1.00 0.00 C ATOM 722 CG2 VAL A 47 -14.866 27.205 1.039 1.00 0.00 C ATOM 0 H VAL A 47 -15.400 29.240 4.542 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.609 29.283 2.299 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.699 27.227 3.188 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -17.048 26.674 2.587 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.936 28.047 3.714 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -17.269 28.337 1.990 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.256 26.189 0.980 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -15.316 27.812 0.253 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.784 27.186 0.909 1.00 0.00 H new ATOM 732 N VAL A 48 -16.501 30.844 2.120 1.00 0.00 N ATOM 733 CA VAL A 48 -17.248 31.872 1.396 1.00 0.00 C ATOM 734 C VAL A 48 -16.494 33.213 1.462 1.00 0.00 C ATOM 735 O VAL A 48 -16.541 33.969 0.507 1.00 0.00 O ATOM 736 CB VAL A 48 -18.732 32.019 1.927 1.00 0.00 C ATOM 737 CG1 VAL A 48 -19.486 33.182 1.233 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.507 30.680 1.758 1.00 0.00 C ATOM 0 H VAL A 48 -16.879 30.632 3.044 1.00 0.00 H new ATOM 0 HA VAL A 48 -17.323 31.561 0.354 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.676 32.261 2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.500 33.246 1.628 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -18.963 34.119 1.423 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -19.526 33.000 0.159 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.525 30.800 2.128 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.534 30.406 0.703 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.005 29.895 2.324 1.00 0.00 H new ATOM 748 N HIS A 49 -15.754 33.483 2.565 1.00 0.00 N ATOM 749 CA HIS A 49 -15.097 34.802 2.766 1.00 0.00 C ATOM 750 C HIS A 49 -13.959 35.064 1.748 1.00 0.00 C ATOM 751 O HIS A 49 -13.704 36.220 1.384 1.00 0.00 O ATOM 752 CB HIS A 49 -14.580 35.001 4.207 1.00 0.00 C ATOM 753 CG HIS A 49 -14.205 36.443 4.486 1.00 0.00 C ATOM 754 ND1 HIS A 49 -12.912 36.912 4.547 1.00 0.00 N ATOM 755 CD2 HIS A 49 -15.002 37.536 4.652 1.00 0.00 C ATOM 756 CE1 HIS A 49 -12.958 38.236 4.748 1.00 0.00 C ATOM 757 NE2 HIS A 49 -14.203 38.665 4.816 1.00 0.00 N ATOM 0 H HIS A 49 -15.597 32.816 3.321 1.00 0.00 H new ATOM 0 HA HIS A 49 -15.881 35.538 2.590 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -15.347 34.683 4.914 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -13.712 34.363 4.371 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -12.066 36.349 4.455 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -16.082 37.528 4.656 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -12.088 38.869 4.842 1.00 0.00 H new ATOM 765 N ILE A 50 -13.284 33.990 1.290 1.00 0.00 N ATOM 766 CA ILE A 50 -12.257 34.092 0.221 1.00 0.00 C ATOM 767 C ILE A 50 -12.916 34.486 -1.127 1.00 0.00 C ATOM 768 O ILE A 50 -12.294 35.140 -1.960 1.00 0.00 O ATOM 769 CB ILE A 50 -11.394 32.772 0.066 1.00 0.00 C ATOM 770 CG1 ILE A 50 -12.260 31.556 -0.418 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.664 32.445 1.402 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.493 30.262 -0.649 1.00 0.00 C ATOM 0 H ILE A 50 -13.428 33.043 1.640 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.564 34.878 0.521 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.646 32.953 -0.706 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.040 31.370 0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.760 31.834 -1.346 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -10.075 31.536 1.282 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -10.005 33.272 1.669 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.400 32.298 2.192 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.182 29.485 -0.981 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.731 30.422 -1.412 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -11.016 29.951 0.280 1.00 0.00 H new ATOM 784 N ILE A 51 -14.183 34.074 -1.305 1.00 0.00 N ATOM 785 CA ILE A 51 -15.037 34.448 -2.461 1.00 0.00 C ATOM 786 C ILE A 51 -15.489 35.925 -2.342 1.00 0.00 C ATOM 787 O ILE A 51 -15.519 36.661 -3.342 1.00 0.00 O ATOM 788 CB ILE A 51 -16.286 33.479 -2.511 1.00 0.00 C ATOM 789 CG1 ILE A 51 -15.807 31.995 -2.689 1.00 0.00 C ATOM 790 CG2 ILE A 51 -17.335 33.879 -3.585 1.00 0.00 C ATOM 791 CD1 ILE A 51 -16.887 30.952 -2.476 1.00 0.00 C ATOM 0 H ILE A 51 -14.657 33.461 -0.642 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.468 34.348 -3.386 1.00 0.00 H new ATOM 0 HB ILE A 51 -16.804 33.572 -1.557 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -15.399 31.877 -3.693 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -14.993 31.804 -1.990 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -18.164 33.172 -3.564 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -17.707 34.882 -3.374 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -16.870 33.864 -4.571 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -16.465 29.957 -2.619 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -17.280 31.037 -1.463 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.693 31.111 -3.192 1.00 0.00 H new ATOM 803 N GLN A 52 -15.804 36.343 -1.090 1.00 0.00 N ATOM 804 CA GLN A 52 -16.220 37.728 -0.752 1.00 0.00 C ATOM 805 C GLN A 52 -15.077 38.721 -1.049 1.00 0.00 C ATOM 806 O GLN A 52 -15.317 39.875 -1.419 1.00 0.00 O ATOM 807 CB GLN A 52 -16.629 37.838 0.756 1.00 0.00 C ATOM 808 CG GLN A 52 -17.667 36.817 1.253 1.00 0.00 C ATOM 809 CD GLN A 52 -19.002 36.864 0.526 1.00 0.00 C ATOM 810 OE1 GLN A 52 -19.156 36.262 -0.531 1.00 0.00 O ATOM 811 NE2 GLN A 52 -19.989 37.531 1.115 1.00 0.00 N ATOM 0 H GLN A 52 -15.776 35.723 -0.280 1.00 0.00 H new ATOM 0 HA GLN A 52 -17.084 37.977 -1.369 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -15.730 37.736 1.363 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -17.021 38.839 0.933 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -17.249 35.815 1.152 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -17.841 36.984 2.316 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -19.821 38.019 1.994 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -20.915 37.554 0.688 1.00 0.00 H new ATOM 820 N ALA A 53 -13.828 38.235 -0.872 1.00 0.00 N ATOM 821 CA ALA A 53 -12.596 39.008 -1.127 1.00 0.00 C ATOM 822 C ALA A 53 -12.418 39.335 -2.629 1.00 0.00 C ATOM 823 O ALA A 53 -11.770 40.327 -2.976 1.00 0.00 O ATOM 824 CB ALA A 53 -11.376 38.237 -0.584 1.00 0.00 C ATOM 0 H ALA A 53 -13.647 37.286 -0.545 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.680 39.961 -0.604 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -10.469 38.811 -0.774 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -11.490 38.084 0.489 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.305 37.270 -1.083 1.00 0.00 H new ATOM 830 N ARG A 54 -12.988 38.483 -3.508 1.00 0.00 N ATOM 831 CA ARG A 54 -12.955 38.697 -4.979 1.00 0.00 C ATOM 832 C ARG A 54 -14.090 39.630 -5.403 1.00 0.00 C ATOM 833 O ARG A 54 -13.875 40.574 -6.166 1.00 0.00 O ATOM 834 CB ARG A 54 -13.044 37.342 -5.767 1.00 0.00 C ATOM 835 CG ARG A 54 -11.695 36.605 -5.950 1.00 0.00 C ATOM 836 CD ARG A 54 -11.048 36.199 -4.623 1.00 0.00 C ATOM 837 NE ARG A 54 -9.727 35.602 -4.830 1.00 0.00 N ATOM 838 CZ ARG A 54 -9.228 34.557 -4.166 1.00 0.00 C ATOM 839 NH1 ARG A 54 -9.934 33.929 -3.230 1.00 0.00 N ATOM 840 NH2 ARG A 54 -8.006 34.145 -4.449 1.00 0.00 N ATOM 0 H ARG A 54 -13.480 37.635 -3.227 1.00 0.00 H new ATOM 0 HA ARG A 54 -11.999 39.159 -5.224 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -13.735 36.680 -5.246 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -13.471 37.538 -6.751 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.854 35.714 -6.558 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -11.008 37.248 -6.501 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -10.956 37.074 -3.979 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -11.692 35.488 -4.105 1.00 0.00 H new ATOM 0 HE ARG A 54 -9.135 36.023 -5.546 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -10.878 34.244 -3.006 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -9.531 33.133 -2.736 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -7.459 34.624 -5.165 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -7.608 33.348 -3.952 1.00 0.00 H new ATOM 854 N GLU A 55 -15.297 39.355 -4.893 1.00 0.00 N ATOM 855 CA GLU A 55 -16.526 40.042 -5.314 1.00 0.00 C ATOM 856 C GLU A 55 -17.077 40.925 -4.173 1.00 0.00 C ATOM 857 O GLU A 55 -17.733 40.404 -3.268 1.00 0.00 O ATOM 858 CB GLU A 55 -17.579 38.990 -5.763 1.00 0.00 C ATOM 859 CG GLU A 55 -17.134 38.077 -6.929 1.00 0.00 C ATOM 860 CD GLU A 55 -16.757 38.857 -8.204 1.00 0.00 C ATOM 861 OE1 GLU A 55 -17.670 39.351 -8.900 1.00 0.00 O ATOM 862 OE2 GLU A 55 -15.549 38.998 -8.504 1.00 0.00 O ATOM 0 H GLU A 55 -15.450 38.648 -4.174 1.00 0.00 H new ATOM 0 HA GLU A 55 -16.300 40.696 -6.156 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -17.833 38.364 -4.908 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -18.490 39.512 -6.057 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -16.279 37.482 -6.609 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.938 37.379 -7.163 1.00 0.00 H new ATOM 869 N PRO A 56 -16.793 42.282 -4.182 1.00 0.00 N ATOM 870 CA PRO A 56 -17.346 43.239 -3.183 1.00 0.00 C ATOM 871 C PRO A 56 -18.888 43.331 -3.234 1.00 0.00 C ATOM 872 O PRO A 56 -19.533 43.637 -2.220 1.00 0.00 O ATOM 873 CB PRO A 56 -16.674 44.598 -3.546 1.00 0.00 C ATOM 874 CG PRO A 56 -15.467 44.216 -4.349 1.00 0.00 C ATOM 875 CD PRO A 56 -15.874 42.979 -5.121 1.00 0.00 C ATOM 0 HA PRO A 56 -17.133 42.924 -2.162 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -17.348 45.233 -4.120 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -16.396 45.155 -2.651 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -15.172 45.021 -5.023 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.613 44.013 -3.703 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -16.371 43.234 -6.057 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -15.013 42.361 -5.375 1.00 0.00 H new ATOM 883 N SER A 57 -19.456 43.054 -4.424 1.00 0.00 N ATOM 884 CA SER A 57 -20.913 43.000 -4.638 1.00 0.00 C ATOM 885 C SER A 57 -21.536 41.846 -3.823 1.00 0.00 C ATOM 886 O SER A 57 -22.561 42.020 -3.144 1.00 0.00 O ATOM 887 CB SER A 57 -21.212 42.831 -6.151 1.00 0.00 C ATOM 888 OG SER A 57 -22.604 42.839 -6.422 1.00 0.00 O ATOM 0 H SER A 57 -18.914 42.861 -5.266 1.00 0.00 H new ATOM 0 HA SER A 57 -21.360 43.933 -4.294 1.00 0.00 H new ATOM 0 HB2 SER A 57 -20.730 43.634 -6.708 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.779 41.895 -6.504 1.00 0.00 H new ATOM 0 HG SER A 57 -22.750 42.732 -7.385 1.00 0.00 H new ATOM 894 N LEU A 58 -20.871 40.679 -3.877 1.00 0.00 N ATOM 895 CA LEU A 58 -21.295 39.474 -3.146 1.00 0.00 C ATOM 896 C LEU A 58 -20.848 39.543 -1.672 1.00 0.00 C ATOM 897 O LEU A 58 -21.399 38.829 -0.841 1.00 0.00 O ATOM 898 CB LEU A 58 -20.757 38.170 -3.831 1.00 0.00 C ATOM 899 CG LEU A 58 -21.489 37.687 -5.136 1.00 0.00 C ATOM 900 CD1 LEU A 58 -22.988 37.417 -4.870 1.00 0.00 C ATOM 901 CD2 LEU A 58 -21.291 38.663 -6.319 1.00 0.00 C ATOM 0 H LEU A 58 -20.024 40.545 -4.429 1.00 0.00 H new ATOM 0 HA LEU A 58 -22.384 39.436 -3.173 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -19.705 38.325 -4.072 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -20.801 37.362 -3.101 1.00 0.00 H new ATOM 0 HG LEU A 58 -21.025 36.745 -5.428 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -23.467 37.085 -5.791 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.089 36.643 -4.109 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -23.467 38.333 -4.522 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.816 38.284 -7.196 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -21.689 39.642 -6.053 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -20.228 38.752 -6.543 1.00 0.00 H new ATOM 913 N ARG A 59 -19.855 40.412 -1.358 1.00 0.00 N ATOM 914 CA ARG A 59 -19.368 40.630 0.030 1.00 0.00 C ATOM 915 C ARG A 59 -20.516 41.196 0.892 1.00 0.00 C ATOM 916 O ARG A 59 -20.670 40.826 2.062 1.00 0.00 O ATOM 917 CB ARG A 59 -18.130 41.594 0.027 1.00 0.00 C ATOM 918 CG ARG A 59 -17.096 41.414 1.172 1.00 0.00 C ATOM 919 CD ARG A 59 -17.629 41.699 2.585 1.00 0.00 C ATOM 920 NE ARG A 59 -16.618 41.372 3.612 1.00 0.00 N ATOM 921 CZ ARG A 59 -16.866 41.161 4.916 1.00 0.00 C ATOM 922 NH1 ARG A 59 -18.099 41.258 5.408 1.00 0.00 N ATOM 923 NH2 ARG A 59 -15.866 40.846 5.729 1.00 0.00 N ATOM 0 H ARG A 59 -19.371 40.979 -2.054 1.00 0.00 H new ATOM 0 HA ARG A 59 -19.047 39.681 0.459 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -17.609 41.474 -0.923 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -18.498 42.619 0.061 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -16.719 40.392 1.142 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -16.248 42.072 0.981 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -17.908 42.750 2.667 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -18.532 41.115 2.761 1.00 0.00 H new ATOM 0 HE ARG A 59 -15.648 41.300 3.305 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -18.877 41.496 4.792 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -18.266 41.094 6.401 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -14.917 40.766 5.363 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -16.046 40.684 6.720 1.00 0.00 H new ATOM 937 N ASP A 60 -21.314 42.083 0.274 1.00 0.00 N ATOM 938 CA ASP A 60 -22.501 42.689 0.904 1.00 0.00 C ATOM 939 C ASP A 60 -23.573 41.627 1.240 1.00 0.00 C ATOM 940 O ASP A 60 -24.324 41.778 2.212 1.00 0.00 O ATOM 941 CB ASP A 60 -23.090 43.782 -0.028 1.00 0.00 C ATOM 942 CG ASP A 60 -24.377 44.445 0.518 1.00 0.00 C ATOM 943 OD1 ASP A 60 -24.310 45.112 1.573 1.00 0.00 O ATOM 944 OD2 ASP A 60 -25.455 44.296 -0.098 1.00 0.00 O ATOM 0 H ASP A 60 -21.154 42.402 -0.682 1.00 0.00 H new ATOM 0 HA ASP A 60 -22.191 43.146 1.844 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -22.336 44.553 -0.189 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -23.306 43.339 -1.000 1.00 0.00 H new ATOM 949 N SER A 61 -23.615 40.549 0.435 1.00 0.00 N ATOM 950 CA SER A 61 -24.571 39.446 0.608 1.00 0.00 C ATOM 951 C SER A 61 -24.250 38.637 1.882 1.00 0.00 C ATOM 952 O SER A 61 -23.078 38.483 2.261 1.00 0.00 O ATOM 953 CB SER A 61 -24.541 38.545 -0.641 1.00 0.00 C ATOM 954 OG SER A 61 -24.712 39.307 -1.830 1.00 0.00 O ATOM 0 H SER A 61 -22.983 40.421 -0.356 1.00 0.00 H new ATOM 0 HA SER A 61 -25.574 39.856 0.726 1.00 0.00 H new ATOM 0 HB2 SER A 61 -23.593 38.009 -0.683 1.00 0.00 H new ATOM 0 HB3 SER A 61 -25.329 37.795 -0.570 1.00 0.00 H new ATOM 0 HG SER A 61 -24.687 38.711 -2.607 1.00 0.00 H new ATOM 960 N ASN A 62 -25.315 38.146 2.534 1.00 0.00 N ATOM 961 CA ASN A 62 -25.227 37.382 3.787 1.00 0.00 C ATOM 962 C ASN A 62 -24.566 36.009 3.515 1.00 0.00 C ATOM 963 O ASN A 62 -25.134 35.216 2.769 1.00 0.00 O ATOM 964 CB ASN A 62 -26.654 37.206 4.385 1.00 0.00 C ATOM 965 CG ASN A 62 -27.404 38.537 4.589 1.00 0.00 C ATOM 966 OD1 ASN A 62 -26.802 39.592 4.774 1.00 0.00 O ATOM 967 ND2 ASN A 62 -28.725 38.493 4.557 1.00 0.00 N ATOM 0 H ASN A 62 -26.272 38.270 2.202 1.00 0.00 H new ATOM 0 HA ASN A 62 -24.612 37.920 4.508 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -27.239 36.566 3.725 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -26.577 36.691 5.343 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -29.267 39.347 4.687 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -29.202 37.605 4.402 1.00 0.00 H new ATOM 974 N PRO A 63 -23.373 35.701 4.139 1.00 0.00 N ATOM 975 CA PRO A 63 -22.512 34.546 3.733 1.00 0.00 C ATOM 976 C PRO A 63 -23.135 33.154 4.013 1.00 0.00 C ATOM 977 O PRO A 63 -22.592 32.132 3.577 1.00 0.00 O ATOM 978 CB PRO A 63 -21.209 34.775 4.547 1.00 0.00 C ATOM 979 CG PRO A 63 -21.659 35.523 5.764 1.00 0.00 C ATOM 980 CD PRO A 63 -22.779 36.433 5.297 1.00 0.00 C ATOM 0 HA PRO A 63 -22.359 34.522 2.654 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -20.735 33.830 4.813 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.479 35.348 3.976 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -22.008 34.839 6.537 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -20.840 36.099 6.194 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -23.514 36.599 6.085 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -22.402 37.412 5.001 1.00 0.00 H new ATOM 988 N GLU A 64 -24.261 33.135 4.746 1.00 0.00 N ATOM 989 CA GLU A 64 -25.051 31.912 4.991 1.00 0.00 C ATOM 990 C GLU A 64 -26.078 31.689 3.861 1.00 0.00 C ATOM 991 O GLU A 64 -26.275 30.563 3.382 1.00 0.00 O ATOM 992 CB GLU A 64 -25.783 32.036 6.347 1.00 0.00 C ATOM 993 CG GLU A 64 -24.853 32.232 7.564 1.00 0.00 C ATOM 994 CD GLU A 64 -25.630 32.432 8.874 1.00 0.00 C ATOM 995 OE1 GLU A 64 -25.891 31.443 9.588 1.00 0.00 O ATOM 996 OE2 GLU A 64 -26.003 33.583 9.187 1.00 0.00 O ATOM 0 H GLU A 64 -24.651 33.968 5.187 1.00 0.00 H new ATOM 0 HA GLU A 64 -24.375 31.057 5.015 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -26.475 32.877 6.296 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -26.382 31.139 6.505 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -24.200 31.364 7.662 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -24.211 33.096 7.391 1.00 0.00 H new ATOM 1003 N GLU A 65 -26.720 32.795 3.444 1.00 0.00 N ATOM 1004 CA GLU A 65 -27.841 32.789 2.476 1.00 0.00 C ATOM 1005 C GLU A 65 -27.338 32.910 1.026 1.00 0.00 C ATOM 1006 O GLU A 65 -28.088 32.637 0.085 1.00 0.00 O ATOM 1007 CB GLU A 65 -28.815 33.962 2.802 1.00 0.00 C ATOM 1008 CG GLU A 65 -29.285 34.027 4.272 1.00 0.00 C ATOM 1009 CD GLU A 65 -29.945 32.725 4.768 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -31.102 32.451 4.386 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -29.303 31.967 5.536 1.00 0.00 O ATOM 0 H GLU A 65 -26.475 33.730 3.771 1.00 0.00 H new ATOM 0 HA GLU A 65 -28.364 31.837 2.566 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -28.325 34.903 2.550 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -29.691 33.877 2.159 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -28.430 34.256 4.908 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -29.993 34.848 4.382 1.00 0.00 H new ATOM 1018 N ILE A 66 -26.063 33.307 0.878 1.00 0.00 N ATOM 1019 CA ILE A 66 -25.454 33.669 -0.411 1.00 0.00 C ATOM 1020 C ILE A 66 -25.389 32.477 -1.401 1.00 0.00 C ATOM 1021 O ILE A 66 -25.383 31.303 -1.002 1.00 0.00 O ATOM 1022 CB ILE A 66 -24.005 34.254 -0.177 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -23.440 34.942 -1.465 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -23.038 33.151 0.334 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -22.057 35.544 -1.311 1.00 0.00 C ATOM 0 H ILE A 66 -25.417 33.386 1.664 1.00 0.00 H new ATOM 0 HA ILE A 66 -26.094 34.426 -0.864 1.00 0.00 H new ATOM 0 HB ILE A 66 -24.085 35.022 0.592 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -23.413 34.208 -2.270 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -24.130 35.727 -1.773 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -22.047 33.578 0.487 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -23.410 32.749 1.277 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -22.977 32.350 -0.403 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -21.750 35.997 -2.254 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -22.076 36.306 -0.532 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -21.348 34.762 -1.037 1.00 0.00 H new ATOM 1037 N GLU A 67 -25.342 32.814 -2.690 1.00 0.00 N ATOM 1038 CA GLU A 67 -25.096 31.872 -3.778 1.00 0.00 C ATOM 1039 C GLU A 67 -23.667 32.081 -4.306 1.00 0.00 C ATOM 1040 O GLU A 67 -23.200 33.222 -4.446 1.00 0.00 O ATOM 1041 CB GLU A 67 -26.129 32.035 -4.925 1.00 0.00 C ATOM 1042 CG GLU A 67 -26.206 33.430 -5.601 1.00 0.00 C ATOM 1043 CD GLU A 67 -26.922 34.495 -4.742 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -28.174 34.502 -4.713 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -26.243 35.319 -4.087 1.00 0.00 O ATOM 0 H GLU A 67 -25.477 33.772 -3.012 1.00 0.00 H new ATOM 0 HA GLU A 67 -25.205 30.858 -3.392 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -25.903 31.296 -5.694 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -27.116 31.793 -4.531 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -25.195 33.773 -5.822 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -26.726 33.334 -6.554 1.00 0.00 H new ATOM 1052 N ILE A 68 -22.977 30.972 -4.584 1.00 0.00 N ATOM 1053 CA ILE A 68 -21.602 30.998 -5.107 1.00 0.00 C ATOM 1054 C ILE A 68 -21.657 30.869 -6.642 1.00 0.00 C ATOM 1055 O ILE A 68 -21.772 29.756 -7.182 1.00 0.00 O ATOM 1056 CB ILE A 68 -20.717 29.852 -4.475 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -20.735 29.937 -2.903 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -19.260 29.909 -5.027 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -20.009 28.805 -2.187 1.00 0.00 C ATOM 0 H ILE A 68 -23.351 30.032 -4.455 1.00 0.00 H new ATOM 0 HA ILE A 68 -21.133 31.943 -4.832 1.00 0.00 H new ATOM 0 HB ILE A 68 -21.144 28.891 -4.763 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -20.287 30.884 -2.601 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -21.772 29.953 -2.567 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -18.669 29.111 -4.578 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -19.276 29.783 -6.110 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -18.815 30.873 -4.780 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -20.078 28.953 -1.109 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.468 27.853 -2.452 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -18.961 28.798 -2.486 1.00 0.00 H new ATOM 1071 N ASP A 69 -21.639 32.028 -7.329 1.00 0.00 N ATOM 1072 CA ASP A 69 -21.622 32.080 -8.795 1.00 0.00 C ATOM 1073 C ASP A 69 -20.175 31.863 -9.273 1.00 0.00 C ATOM 1074 O ASP A 69 -19.295 32.702 -9.041 1.00 0.00 O ATOM 1075 CB ASP A 69 -22.190 33.423 -9.329 1.00 0.00 C ATOM 1076 CG ASP A 69 -22.372 33.397 -10.860 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -23.429 32.919 -11.332 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -21.447 33.796 -11.599 1.00 0.00 O ATOM 0 H ASP A 69 -21.636 32.945 -6.883 1.00 0.00 H new ATOM 0 HA ASP A 69 -22.265 31.293 -9.189 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -23.148 33.628 -8.852 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -21.518 34.237 -9.056 1.00 0.00 H new ATOM 1083 N PHE A 70 -19.949 30.717 -9.915 1.00 0.00 N ATOM 1084 CA PHE A 70 -18.613 30.262 -10.337 1.00 0.00 C ATOM 1085 C PHE A 70 -18.105 31.011 -11.586 1.00 0.00 C ATOM 1086 O PHE A 70 -16.931 30.900 -11.948 1.00 0.00 O ATOM 1087 CB PHE A 70 -18.668 28.732 -10.579 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.134 27.954 -9.342 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -18.277 27.759 -8.255 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -20.422 27.425 -9.264 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -18.690 27.055 -7.141 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -20.830 26.724 -8.149 1.00 0.00 C ATOM 1093 CZ PHE A 70 -19.967 26.539 -7.087 1.00 0.00 C ATOM 0 H PHE A 70 -20.694 30.066 -10.162 1.00 0.00 H new ATOM 0 HA PHE A 70 -17.898 30.487 -9.545 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -19.342 28.524 -11.410 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -17.680 28.379 -10.874 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -17.277 28.165 -8.287 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.108 27.566 -10.086 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -18.013 26.909 -6.313 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -21.830 26.318 -8.106 1.00 0.00 H new ATOM 0 HZ PHE A 70 -20.292 25.991 -6.215 1.00 0.00 H new ATOM 1103 N GLU A 71 -18.990 31.779 -12.238 1.00 0.00 N ATOM 1104 CA GLU A 71 -18.653 32.518 -13.469 1.00 0.00 C ATOM 1105 C GLU A 71 -18.176 33.955 -13.150 1.00 0.00 C ATOM 1106 O GLU A 71 -17.460 34.560 -13.954 1.00 0.00 O ATOM 1107 CB GLU A 71 -19.867 32.510 -14.427 1.00 0.00 C ATOM 1108 CG GLU A 71 -20.330 31.088 -14.825 1.00 0.00 C ATOM 1109 CD GLU A 71 -21.497 31.088 -15.823 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -22.665 30.929 -15.403 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -21.250 31.272 -17.032 1.00 0.00 O ATOM 0 H GLU A 71 -19.954 31.907 -11.931 1.00 0.00 H new ATOM 0 HA GLU A 71 -17.821 32.020 -13.966 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -20.697 33.034 -13.953 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -19.612 33.066 -15.329 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -19.489 30.548 -15.260 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -20.628 30.546 -13.928 1.00 0.00 H new ATOM 1118 N THR A 72 -18.576 34.487 -11.972 1.00 0.00 N ATOM 1119 CA THR A 72 -18.066 35.779 -11.452 1.00 0.00 C ATOM 1120 C THR A 72 -16.656 35.601 -10.855 1.00 0.00 C ATOM 1121 O THR A 72 -15.856 36.541 -10.842 1.00 0.00 O ATOM 1122 CB THR A 72 -19.020 36.411 -10.373 1.00 0.00 C ATOM 1123 OG1 THR A 72 -19.275 35.469 -9.320 1.00 0.00 O ATOM 1124 CG2 THR A 72 -20.358 36.877 -10.978 1.00 0.00 C ATOM 0 H THR A 72 -19.256 34.038 -11.359 1.00 0.00 H new ATOM 0 HA THR A 72 -18.024 36.464 -12.299 1.00 0.00 H new ATOM 0 HB THR A 72 -18.510 37.287 -9.973 1.00 0.00 H new ATOM 0 HG1 THR A 72 -19.017 34.571 -9.615 1.00 0.00 H new ATOM 0 HG21 THR A 72 -20.982 37.306 -10.194 1.00 0.00 H new ATOM 0 HG22 THR A 72 -20.169 37.630 -11.744 1.00 0.00 H new ATOM 0 HG23 THR A 72 -20.871 36.026 -11.425 1.00 0.00 H new ATOM 1132 N LEU A 73 -16.371 34.377 -10.366 1.00 0.00 N ATOM 1133 CA LEU A 73 -15.048 34.000 -9.839 1.00 0.00 C ATOM 1134 C LEU A 73 -14.109 33.593 -10.989 1.00 0.00 C ATOM 1135 O LEU A 73 -14.562 33.077 -12.019 1.00 0.00 O ATOM 1136 CB LEU A 73 -15.192 32.842 -8.822 1.00 0.00 C ATOM 1137 CG LEU A 73 -16.043 33.155 -7.553 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -16.146 31.908 -6.636 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -15.475 34.388 -6.788 1.00 0.00 C ATOM 0 H LEU A 73 -17.055 33.622 -10.326 1.00 0.00 H new ATOM 0 HA LEU A 73 -14.614 34.861 -9.330 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.637 31.988 -9.333 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.195 32.538 -8.502 1.00 0.00 H new ATOM 0 HG LEU A 73 -17.053 33.410 -7.874 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -16.744 32.151 -5.758 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -16.619 31.092 -7.183 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -15.147 31.604 -6.322 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -16.087 34.584 -5.908 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.450 34.184 -6.479 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.490 35.260 -7.442 1.00 0.00 H new ATOM 1151 N LYS A 74 -12.801 33.824 -10.787 1.00 0.00 N ATOM 1152 CA LYS A 74 -11.750 33.497 -11.770 1.00 0.00 C ATOM 1153 C LYS A 74 -11.492 31.966 -11.760 1.00 0.00 C ATOM 1154 O LYS A 74 -11.609 31.364 -10.697 1.00 0.00 O ATOM 1155 CB LYS A 74 -10.454 34.284 -11.395 1.00 0.00 C ATOM 1156 CG LYS A 74 -9.385 34.336 -12.508 1.00 0.00 C ATOM 1157 CD LYS A 74 -8.137 35.166 -12.117 1.00 0.00 C ATOM 1158 CE LYS A 74 -7.223 35.463 -13.322 1.00 0.00 C ATOM 1159 NZ LYS A 74 -6.800 34.228 -14.031 1.00 0.00 N ATOM 0 H LYS A 74 -12.439 34.246 -9.932 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.062 33.784 -12.774 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -10.730 35.304 -11.127 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.013 33.829 -10.508 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -9.075 33.320 -12.753 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.828 34.761 -13.409 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -8.456 36.106 -11.667 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -7.569 34.627 -11.359 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -7.747 36.117 -14.019 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -6.340 36.003 -12.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -6.108 34.471 -14.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -6.367 33.569 -13.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -7.629 33.778 -14.469 1.00 0.00 H new ATOM 1173 N PRO A 75 -11.171 31.303 -12.932 1.00 0.00 N ATOM 1174 CA PRO A 75 -10.800 29.850 -12.986 1.00 0.00 C ATOM 1175 C PRO A 75 -9.684 29.433 -11.986 1.00 0.00 C ATOM 1176 O PRO A 75 -9.629 28.275 -11.554 1.00 0.00 O ATOM 1177 CB PRO A 75 -10.342 29.656 -14.454 1.00 0.00 C ATOM 1178 CG PRO A 75 -11.117 30.684 -15.220 1.00 0.00 C ATOM 1179 CD PRO A 75 -11.225 31.885 -14.303 1.00 0.00 C ATOM 0 HA PRO A 75 -11.639 29.220 -12.692 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.268 29.807 -14.559 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.558 28.648 -14.809 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -10.609 30.945 -16.149 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -12.104 30.308 -15.491 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.409 32.588 -14.470 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -12.154 32.430 -14.468 1.00 0.00 H new ATOM 1187 N SER A 76 -8.799 30.392 -11.650 1.00 0.00 N ATOM 1188 CA SER A 76 -7.771 30.214 -10.608 1.00 0.00 C ATOM 1189 C SER A 76 -8.431 30.109 -9.213 1.00 0.00 C ATOM 1190 O SER A 76 -8.076 29.233 -8.420 1.00 0.00 O ATOM 1191 CB SER A 76 -6.762 31.384 -10.643 1.00 0.00 C ATOM 1192 OG SER A 76 -5.750 31.227 -9.662 1.00 0.00 O ATOM 0 H SER A 76 -8.777 31.310 -12.093 1.00 0.00 H new ATOM 0 HA SER A 76 -7.232 29.287 -10.805 1.00 0.00 H new ATOM 0 HB2 SER A 76 -6.306 31.443 -11.631 1.00 0.00 H new ATOM 0 HB3 SER A 76 -7.288 32.324 -10.478 1.00 0.00 H new ATOM 0 HG SER A 76 -5.127 31.982 -9.711 1.00 0.00 H new ATOM 1198 N THR A 77 -9.402 31.015 -8.950 1.00 0.00 N ATOM 1199 CA THR A 77 -10.196 31.041 -7.696 1.00 0.00 C ATOM 1200 C THR A 77 -11.113 29.795 -7.600 1.00 0.00 C ATOM 1201 O THR A 77 -11.464 29.364 -6.501 1.00 0.00 O ATOM 1202 CB THR A 77 -11.056 32.355 -7.620 1.00 0.00 C ATOM 1203 OG1 THR A 77 -10.211 33.493 -7.862 1.00 0.00 O ATOM 1204 CG2 THR A 77 -11.767 32.538 -6.255 1.00 0.00 C ATOM 0 H THR A 77 -9.659 31.753 -9.605 1.00 0.00 H new ATOM 0 HA THR A 77 -9.504 31.025 -6.854 1.00 0.00 H new ATOM 0 HB THR A 77 -11.831 32.270 -8.382 1.00 0.00 H new ATOM 0 HG1 THR A 77 -10.746 34.313 -7.817 1.00 0.00 H new ATOM 0 HG21 THR A 77 -12.344 33.463 -6.266 1.00 0.00 H new ATOM 0 HG22 THR A 77 -12.435 31.696 -6.077 1.00 0.00 H new ATOM 0 HG23 THR A 77 -11.022 32.585 -5.460 1.00 0.00 H new ATOM 1212 N LEU A 78 -11.478 29.232 -8.778 1.00 0.00 N ATOM 1213 CA LEU A 78 -12.287 27.999 -8.897 1.00 0.00 C ATOM 1214 C LEU A 78 -11.513 26.792 -8.355 1.00 0.00 C ATOM 1215 O LEU A 78 -11.979 26.113 -7.444 1.00 0.00 O ATOM 1216 CB LEU A 78 -12.722 27.750 -10.390 1.00 0.00 C ATOM 1217 CG LEU A 78 -14.167 28.179 -10.765 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -15.189 27.319 -10.002 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -14.387 29.682 -10.508 1.00 0.00 C ATOM 0 H LEU A 78 -11.215 29.628 -9.681 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.189 28.129 -8.299 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.027 28.280 -11.042 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.614 26.687 -10.605 1.00 0.00 H new ATOM 0 HG LEU A 78 -14.312 28.013 -11.832 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.199 27.628 -10.272 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -15.049 26.270 -10.263 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -15.045 27.449 -8.929 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -15.407 29.952 -10.780 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -14.224 29.898 -9.452 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -13.686 30.260 -11.110 1.00 0.00 H new ATOM 1231 N ARG A 79 -10.319 26.560 -8.921 1.00 0.00 N ATOM 1232 CA ARG A 79 -9.459 25.420 -8.546 1.00 0.00 C ATOM 1233 C ARG A 79 -8.872 25.622 -7.132 1.00 0.00 C ATOM 1234 O ARG A 79 -8.524 24.654 -6.448 1.00 0.00 O ATOM 1235 CB ARG A 79 -8.352 25.224 -9.614 1.00 0.00 C ATOM 1236 CG ARG A 79 -7.550 23.900 -9.497 1.00 0.00 C ATOM 1237 CD ARG A 79 -6.596 23.677 -10.688 1.00 0.00 C ATOM 1238 NE ARG A 79 -5.636 24.791 -10.842 1.00 0.00 N ATOM 1239 CZ ARG A 79 -5.515 25.576 -11.922 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -6.278 25.396 -12.992 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -4.622 26.551 -11.924 1.00 0.00 N ATOM 0 H ARG A 79 -9.921 27.153 -9.649 1.00 0.00 H new ATOM 0 HA ARG A 79 -10.058 24.510 -8.514 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -8.811 25.267 -10.602 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.655 26.060 -9.550 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -6.974 23.909 -8.572 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -8.245 23.063 -9.432 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -6.050 22.744 -10.546 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.177 23.570 -11.604 1.00 0.00 H new ATOM 0 HE ARG A 79 -5.011 24.979 -10.058 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -6.973 24.649 -13.003 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -6.170 26.004 -13.804 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -4.030 26.702 -11.107 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -4.525 27.152 -12.742 1.00 0.00 H new ATOM 1255 N GLU A 80 -8.797 26.903 -6.710 1.00 0.00 N ATOM 1256 CA GLU A 80 -8.448 27.293 -5.331 1.00 0.00 C ATOM 1257 C GLU A 80 -9.548 26.846 -4.360 1.00 0.00 C ATOM 1258 O GLU A 80 -9.264 26.298 -3.293 1.00 0.00 O ATOM 1259 CB GLU A 80 -8.249 28.828 -5.228 1.00 0.00 C ATOM 1260 CG GLU A 80 -7.876 29.337 -3.817 1.00 0.00 C ATOM 1261 CD GLU A 80 -7.796 30.866 -3.721 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -8.453 31.469 -2.839 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -7.070 31.478 -4.532 1.00 0.00 O ATOM 0 H GLU A 80 -8.978 27.699 -7.322 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.512 26.801 -5.064 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.467 29.127 -5.926 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.167 29.322 -5.547 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -8.614 28.974 -3.101 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.915 28.912 -3.528 1.00 0.00 H new ATOM 1270 N LEU A 81 -10.799 27.092 -4.764 1.00 0.00 N ATOM 1271 CA LEU A 81 -11.994 26.746 -3.983 1.00 0.00 C ATOM 1272 C LEU A 81 -12.122 25.214 -3.857 1.00 0.00 C ATOM 1273 O LEU A 81 -12.481 24.698 -2.789 1.00 0.00 O ATOM 1274 CB LEU A 81 -13.247 27.365 -4.669 1.00 0.00 C ATOM 1275 CG LEU A 81 -14.600 27.256 -3.900 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -14.516 27.929 -2.509 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -15.770 27.840 -4.739 1.00 0.00 C ATOM 0 H LEU A 81 -11.014 27.543 -5.654 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.910 27.153 -2.975 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -13.046 28.420 -4.853 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.371 26.889 -5.642 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.803 26.197 -3.739 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -15.476 27.835 -2.001 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.742 27.443 -1.916 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -14.272 28.984 -2.630 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -16.700 27.750 -4.178 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -15.575 28.891 -4.953 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -15.857 27.289 -5.675 1.00 0.00 H new ATOM 1289 N GLU A 82 -11.781 24.509 -4.962 1.00 0.00 N ATOM 1290 CA GLU A 82 -11.818 23.036 -5.039 1.00 0.00 C ATOM 1291 C GLU A 82 -10.789 22.399 -4.097 1.00 0.00 C ATOM 1292 O GLU A 82 -11.139 21.509 -3.331 1.00 0.00 O ATOM 1293 CB GLU A 82 -11.588 22.541 -6.494 1.00 0.00 C ATOM 1294 CG GLU A 82 -12.704 22.955 -7.473 1.00 0.00 C ATOM 1295 CD GLU A 82 -12.549 22.379 -8.891 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -12.645 21.139 -9.048 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -12.411 23.157 -9.858 1.00 0.00 O ATOM 0 H GLU A 82 -11.472 24.952 -5.827 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.813 22.724 -4.721 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.637 22.932 -6.855 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.505 21.454 -6.490 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -13.664 22.636 -7.067 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -12.730 24.043 -7.536 1.00 0.00 H new ATOM 1304 N ARG A 83 -9.523 22.869 -4.157 1.00 0.00 N ATOM 1305 CA ARG A 83 -8.419 22.314 -3.322 1.00 0.00 C ATOM 1306 C ARG A 83 -8.627 22.654 -1.823 1.00 0.00 C ATOM 1307 O ARG A 83 -8.182 21.910 -0.937 1.00 0.00 O ATOM 1308 CB ARG A 83 -7.029 22.823 -3.829 1.00 0.00 C ATOM 1309 CG ARG A 83 -6.763 24.325 -3.592 1.00 0.00 C ATOM 1310 CD ARG A 83 -5.464 24.839 -4.243 1.00 0.00 C ATOM 1311 NE ARG A 83 -5.247 26.277 -3.963 1.00 0.00 N ATOM 1312 CZ ARG A 83 -4.774 27.193 -4.833 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -4.481 26.865 -6.085 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -4.622 28.451 -4.444 1.00 0.00 N ATOM 0 H ARG A 83 -9.234 23.630 -4.772 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.436 21.229 -3.420 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -6.245 22.248 -3.336 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -6.951 22.619 -4.897 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -7.604 24.899 -3.981 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -6.719 24.511 -2.519 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.617 24.263 -3.870 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.508 24.680 -5.320 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.477 26.605 -3.025 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.612 25.905 -6.405 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.124 27.572 -6.727 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.862 28.723 -3.491 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.265 29.147 -5.098 1.00 0.00 H new ATOM 1328 N TYR A 84 -9.340 23.771 -1.570 1.00 0.00 N ATOM 1329 CA TYR A 84 -9.634 24.261 -0.216 1.00 0.00 C ATOM 1330 C TYR A 84 -10.648 23.333 0.490 1.00 0.00 C ATOM 1331 O TYR A 84 -10.437 22.922 1.634 1.00 0.00 O ATOM 1332 CB TYR A 84 -10.167 25.717 -0.292 1.00 0.00 C ATOM 1333 CG TYR A 84 -10.290 26.440 1.067 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -11.457 26.357 1.833 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -9.239 27.211 1.580 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -11.569 27.009 3.042 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -9.353 27.863 2.792 1.00 0.00 C ATOM 1338 CZ TYR A 84 -10.521 27.759 3.513 1.00 0.00 C ATOM 1339 OH TYR A 84 -10.643 28.403 4.712 1.00 0.00 O ATOM 0 H TYR A 84 -9.728 24.359 -2.307 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.717 24.256 0.373 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.506 26.297 -0.936 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -11.147 25.705 -0.770 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -12.288 25.770 1.470 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.322 27.297 1.017 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -12.480 26.930 3.617 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -8.531 28.451 3.172 1.00 0.00 H new ATOM 0 HH TYR A 84 -11.246 27.897 5.295 1.00 0.00 H new ATOM 1349 N VAL A 85 -11.752 23.015 -0.203 1.00 0.00 N ATOM 1350 CA VAL A 85 -12.804 22.131 0.338 1.00 0.00 C ATOM 1351 C VAL A 85 -12.347 20.650 0.302 1.00 0.00 C ATOM 1352 O VAL A 85 -12.755 19.857 1.153 1.00 0.00 O ATOM 1353 CB VAL A 85 -14.185 22.328 -0.414 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -14.089 21.959 -1.913 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -15.329 21.544 0.283 1.00 0.00 C ATOM 0 H VAL A 85 -11.943 23.357 -1.145 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.967 22.411 1.379 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.425 23.390 -0.358 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -15.059 22.110 -2.388 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -13.346 22.593 -2.397 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -13.795 20.914 -2.012 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -16.261 21.702 -0.259 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.089 20.481 0.291 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -15.441 21.898 1.308 1.00 0.00 H new ATOM 1365 N LEU A 86 -11.455 20.316 -0.662 1.00 0.00 N ATOM 1366 CA LEU A 86 -10.897 18.957 -0.828 1.00 0.00 C ATOM 1367 C LEU A 86 -10.015 18.559 0.371 1.00 0.00 C ATOM 1368 O LEU A 86 -10.039 17.409 0.794 1.00 0.00 O ATOM 1369 CB LEU A 86 -10.078 18.860 -2.149 1.00 0.00 C ATOM 1370 CG LEU A 86 -9.384 17.487 -2.449 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -10.413 16.331 -2.493 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -8.555 17.551 -3.758 1.00 0.00 C ATOM 0 H LEU A 86 -11.103 20.985 -1.347 1.00 0.00 H new ATOM 0 HA LEU A 86 -11.735 18.261 -0.877 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.744 19.093 -2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.309 19.633 -2.130 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.695 17.282 -1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.898 15.393 -2.703 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -10.920 16.259 -1.531 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -11.146 16.526 -3.276 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -8.086 16.584 -3.939 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -9.211 17.798 -4.593 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -7.784 18.316 -3.664 1.00 0.00 H new ATOM 1384 N SER A 87 -9.235 19.516 0.896 1.00 0.00 N ATOM 1385 CA SER A 87 -8.342 19.273 2.050 1.00 0.00 C ATOM 1386 C SER A 87 -9.147 19.043 3.351 1.00 0.00 C ATOM 1387 O SER A 87 -8.710 18.287 4.228 1.00 0.00 O ATOM 1388 CB SER A 87 -7.357 20.448 2.201 1.00 0.00 C ATOM 1389 OG SER A 87 -8.054 21.678 2.303 1.00 0.00 O ATOM 0 H SER A 87 -9.202 20.472 0.541 1.00 0.00 H new ATOM 0 HA SER A 87 -7.774 18.361 1.864 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.740 20.300 3.087 1.00 0.00 H new ATOM 0 HB3 SER A 87 -6.683 20.476 1.345 1.00 0.00 H new ATOM 0 HG SER A 87 -8.274 22.005 1.406 1.00 0.00 H new ATOM 1395 N CYS A 88 -10.327 19.698 3.454 1.00 0.00 N ATOM 1396 CA CYS A 88 -11.248 19.528 4.600 1.00 0.00 C ATOM 1397 C CYS A 88 -12.038 18.204 4.478 1.00 0.00 C ATOM 1398 O CYS A 88 -12.346 17.562 5.490 1.00 0.00 O ATOM 1399 CB CYS A 88 -12.227 20.722 4.708 1.00 0.00 C ATOM 1400 SG CYS A 88 -13.198 20.721 6.235 1.00 0.00 S ATOM 0 H CYS A 88 -10.665 20.354 2.750 1.00 0.00 H new ATOM 0 HA CYS A 88 -10.645 19.493 5.507 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -11.662 21.652 4.646 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -12.905 20.704 3.855 1.00 0.00 H new ATOM 0 HG CYS A 88 -13.658 21.916 6.458 1.00 0.00 H new ATOM 1406 N LEU A 89 -12.358 17.828 3.218 1.00 0.00 N ATOM 1407 CA LEU A 89 -13.076 16.583 2.874 1.00 0.00 C ATOM 1408 C LEU A 89 -12.189 15.380 3.220 1.00 0.00 C ATOM 1409 O LEU A 89 -12.602 14.465 3.942 1.00 0.00 O ATOM 1410 CB LEU A 89 -13.435 16.615 1.349 1.00 0.00 C ATOM 1411 CG LEU A 89 -14.315 15.453 0.743 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -14.899 15.883 -0.613 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -13.542 14.119 0.559 1.00 0.00 C ATOM 0 H LEU A 89 -12.120 18.391 2.401 1.00 0.00 H new ATOM 0 HA LEU A 89 -14.001 16.496 3.444 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.951 17.555 1.153 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -12.499 16.643 0.792 1.00 0.00 H new ATOM 0 HG LEU A 89 -15.109 15.269 1.467 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -15.504 15.074 -1.022 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -15.521 16.768 -0.477 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -14.087 16.113 -1.303 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.209 13.367 0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -12.701 14.276 -0.116 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -13.172 13.777 1.525 1.00 0.00 H new ATOM 1425 N ARG A 90 -10.962 15.428 2.689 1.00 0.00 N ATOM 1426 CA ARG A 90 -9.979 14.347 2.783 1.00 0.00 C ATOM 1427 C ARG A 90 -9.419 14.278 4.214 1.00 0.00 C ATOM 1428 O ARG A 90 -9.534 15.236 4.987 1.00 0.00 O ATOM 1429 CB ARG A 90 -8.868 14.575 1.716 1.00 0.00 C ATOM 1430 CG ARG A 90 -7.893 13.393 1.496 1.00 0.00 C ATOM 1431 CD ARG A 90 -7.007 13.582 0.247 1.00 0.00 C ATOM 1432 NE ARG A 90 -7.812 13.690 -0.990 1.00 0.00 N ATOM 1433 CZ ARG A 90 -7.328 13.665 -2.244 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -6.029 13.497 -2.476 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -8.161 13.778 -3.272 1.00 0.00 N ATOM 0 H ARG A 90 -10.619 16.237 2.171 1.00 0.00 H new ATOM 0 HA ARG A 90 -10.445 13.384 2.576 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.346 14.809 0.765 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.288 15.451 2.005 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.258 13.282 2.375 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -8.463 12.470 1.396 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -6.400 14.480 0.365 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -6.319 12.741 0.160 1.00 0.00 H new ATOM 0 HE ARG A 90 -8.821 13.792 -0.882 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.382 13.384 -1.696 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.680 13.481 -3.434 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -9.162 13.883 -3.108 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.800 13.760 -4.226 1.00 0.00 H new ATOM 1724 N THR A 106 12.884 29.664 -2.499 1.00 0.00 N ATOM 1725 CA THR A 106 12.508 30.992 -1.997 1.00 0.00 C ATOM 1726 C THR A 106 13.158 32.080 -2.872 1.00 0.00 C ATOM 1727 O THR A 106 14.205 31.843 -3.490 1.00 0.00 O ATOM 1728 CB THR A 106 12.951 31.146 -0.499 1.00 0.00 C ATOM 1729 OG1 THR A 106 12.717 29.910 0.195 1.00 0.00 O ATOM 1730 CG2 THR A 106 12.188 32.263 0.229 1.00 0.00 C ATOM 0 HA THR A 106 11.425 31.104 -2.047 1.00 0.00 H new ATOM 0 HB THR A 106 14.010 31.406 -0.502 1.00 0.00 H new ATOM 0 HG1 THR A 106 12.862 29.159 -0.417 1.00 0.00 H new ATOM 0 HG21 THR A 106 12.533 32.327 1.261 1.00 0.00 H new ATOM 0 HG22 THR A 106 12.368 33.214 -0.273 1.00 0.00 H new ATOM 0 HG23 THR A 106 11.121 32.043 0.216 1.00 0.00 H new ATOM 1738 N LYS A 107 12.523 33.267 -2.901 1.00 0.00 N ATOM 1739 CA LYS A 107 12.956 34.421 -3.717 1.00 0.00 C ATOM 1740 C LYS A 107 14.375 34.895 -3.333 1.00 0.00 C ATOM 1741 O LYS A 107 15.172 35.287 -4.195 1.00 0.00 O ATOM 1742 CB LYS A 107 11.929 35.578 -3.550 1.00 0.00 C ATOM 1743 CG LYS A 107 12.166 36.799 -4.474 1.00 0.00 C ATOM 1744 CD LYS A 107 11.097 37.907 -4.300 1.00 0.00 C ATOM 1745 CE LYS A 107 11.300 39.080 -5.271 1.00 0.00 C ATOM 1746 NZ LYS A 107 11.202 38.647 -6.690 1.00 0.00 N ATOM 0 H LYS A 107 11.684 33.455 -2.352 1.00 0.00 H new ATOM 0 HA LYS A 107 12.995 34.111 -4.761 1.00 0.00 H new ATOM 0 HB2 LYS A 107 10.929 35.187 -3.738 1.00 0.00 H new ATOM 0 HB3 LYS A 107 11.949 35.916 -2.514 1.00 0.00 H new ATOM 0 HG2 LYS A 107 13.151 37.217 -4.269 1.00 0.00 H new ATOM 0 HG3 LYS A 107 12.171 36.466 -5.512 1.00 0.00 H new ATOM 0 HD2 LYS A 107 10.107 37.479 -4.455 1.00 0.00 H new ATOM 0 HD3 LYS A 107 11.127 38.278 -3.276 1.00 0.00 H new ATOM 0 HE2 LYS A 107 10.553 39.849 -5.073 1.00 0.00 H new ATOM 0 HE3 LYS A 107 12.276 39.532 -5.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 11.141 39.484 -7.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 12.045 38.093 -6.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 10.352 38.061 -6.816 1.00 0.00 H new ATOM 1760 N GLU A 108 14.663 34.837 -2.025 1.00 0.00 N ATOM 1761 CA GLU A 108 15.969 35.213 -1.451 1.00 0.00 C ATOM 1762 C GLU A 108 17.086 34.289 -1.971 1.00 0.00 C ATOM 1763 O GLU A 108 18.182 34.759 -2.267 1.00 0.00 O ATOM 1764 CB GLU A 108 15.912 35.185 0.112 1.00 0.00 C ATOM 1765 CG GLU A 108 15.102 36.335 0.778 1.00 0.00 C ATOM 1766 CD GLU A 108 13.647 36.468 0.282 1.00 0.00 C ATOM 1767 OE1 GLU A 108 12.877 35.500 0.424 1.00 0.00 O ATOM 1768 OE2 GLU A 108 13.270 37.530 -0.251 1.00 0.00 O ATOM 0 H GLU A 108 13.990 34.524 -1.325 1.00 0.00 H new ATOM 0 HA GLU A 108 16.198 36.230 -1.769 1.00 0.00 H new ATOM 0 HB2 GLU A 108 15.481 34.234 0.425 1.00 0.00 H new ATOM 0 HB3 GLU A 108 16.932 35.215 0.495 1.00 0.00 H new ATOM 0 HG2 GLU A 108 15.091 36.177 1.856 1.00 0.00 H new ATOM 0 HG3 GLU A 108 15.620 37.277 0.599 1.00 0.00 H new ATOM 1775 N GLU A 109 16.769 32.986 -2.105 1.00 0.00 N ATOM 1776 CA GLU A 109 17.712 31.971 -2.624 1.00 0.00 C ATOM 1777 C GLU A 109 18.019 32.213 -4.118 1.00 0.00 C ATOM 1778 O GLU A 109 19.162 32.048 -4.561 1.00 0.00 O ATOM 1779 CB GLU A 109 17.135 30.547 -2.426 1.00 0.00 C ATOM 1780 CG GLU A 109 16.841 30.147 -0.960 1.00 0.00 C ATOM 1781 CD GLU A 109 16.377 28.681 -0.829 1.00 0.00 C ATOM 1782 OE1 GLU A 109 17.228 27.788 -0.621 1.00 0.00 O ATOM 1783 OE2 GLU A 109 15.164 28.409 -0.977 1.00 0.00 O ATOM 0 H GLU A 109 15.855 32.607 -1.858 1.00 0.00 H new ATOM 0 HA GLU A 109 18.643 32.059 -2.063 1.00 0.00 H new ATOM 0 HB2 GLU A 109 16.212 30.465 -2.999 1.00 0.00 H new ATOM 0 HB3 GLU A 109 17.837 29.827 -2.847 1.00 0.00 H new ATOM 0 HG2 GLU A 109 17.738 30.296 -0.359 1.00 0.00 H new ATOM 0 HG3 GLU A 109 16.073 30.805 -0.554 1.00 0.00 H new ATOM 1790 N LEU A 110 16.977 32.619 -4.871 1.00 0.00 N ATOM 1791 CA LEU A 110 17.093 32.976 -6.303 1.00 0.00 C ATOM 1792 C LEU A 110 17.990 34.215 -6.513 1.00 0.00 C ATOM 1793 O LEU A 110 18.577 34.383 -7.577 1.00 0.00 O ATOM 1794 CB LEU A 110 15.690 33.243 -6.902 1.00 0.00 C ATOM 1795 CG LEU A 110 14.708 32.029 -6.941 1.00 0.00 C ATOM 1796 CD1 LEU A 110 13.292 32.477 -7.384 1.00 0.00 C ATOM 1797 CD2 LEU A 110 15.257 30.901 -7.854 1.00 0.00 C ATOM 0 H LEU A 110 16.029 32.709 -4.505 1.00 0.00 H new ATOM 0 HA LEU A 110 17.557 32.132 -6.814 1.00 0.00 H new ATOM 0 HB2 LEU A 110 15.221 34.043 -6.330 1.00 0.00 H new ATOM 0 HB3 LEU A 110 15.818 33.612 -7.920 1.00 0.00 H new ATOM 0 HG LEU A 110 14.626 31.626 -5.932 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.627 31.614 -7.403 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.908 33.216 -6.681 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.345 32.917 -8.380 1.00 0.00 H new ATOM 0 HD21 LEU A 110 14.555 30.067 -7.864 1.00 0.00 H new ATOM 0 HD22 LEU A 110 15.383 31.282 -8.867 1.00 0.00 H new ATOM 0 HD23 LEU A 110 16.220 30.560 -7.473 1.00 0.00 H new ATOM 1809 N ALA A 111 18.023 35.099 -5.506 1.00 0.00 N ATOM 1810 CA ALA A 111 18.881 36.294 -5.501 1.00 0.00 C ATOM 1811 C ALA A 111 20.290 35.977 -4.958 1.00 0.00 C ATOM 1812 O ALA A 111 21.251 36.655 -5.311 1.00 0.00 O ATOM 1813 CB ALA A 111 18.221 37.403 -4.668 1.00 0.00 C ATOM 0 H ALA A 111 17.452 35.005 -4.666 1.00 0.00 H new ATOM 0 HA ALA A 111 18.996 36.636 -6.530 1.00 0.00 H new ATOM 0 HB1 ALA A 111 18.860 38.286 -4.667 1.00 0.00 H new ATOM 0 HB2 ALA A 111 17.253 37.656 -5.101 1.00 0.00 H new ATOM 0 HB3 ALA A 111 18.081 37.055 -3.645 1.00 0.00 H new ATOM 1819 N LEU A 112 20.386 34.962 -4.076 1.00 0.00 N ATOM 1820 CA LEU A 112 21.621 34.650 -3.318 1.00 0.00 C ATOM 1821 C LEU A 112 22.638 33.821 -4.141 1.00 0.00 C ATOM 1822 O LEU A 112 23.842 33.989 -3.956 1.00 0.00 O ATOM 1823 CB LEU A 112 21.252 33.937 -1.966 1.00 0.00 C ATOM 1824 CG LEU A 112 22.159 34.246 -0.715 1.00 0.00 C ATOM 1825 CD1 LEU A 112 23.537 33.555 -0.784 1.00 0.00 C ATOM 1826 CD2 LEU A 112 22.304 35.772 -0.516 1.00 0.00 C ATOM 0 H LEU A 112 19.611 34.333 -3.867 1.00 0.00 H new ATOM 0 HA LEU A 112 22.120 35.594 -3.096 1.00 0.00 H new ATOM 0 HB2 LEU A 112 20.226 34.204 -1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 112 21.268 32.861 -2.137 1.00 0.00 H new ATOM 0 HG LEU A 112 21.655 33.825 0.155 1.00 0.00 H new ATOM 0 HD11 LEU A 112 24.115 33.806 0.105 1.00 0.00 H new ATOM 0 HD12 LEU A 112 23.400 32.475 -0.835 1.00 0.00 H new ATOM 0 HD13 LEU A 112 24.071 33.895 -1.672 1.00 0.00 H new ATOM 0 HD21 LEU A 112 22.933 35.968 0.352 1.00 0.00 H new ATOM 0 HD22 LEU A 112 22.761 36.213 -1.402 1.00 0.00 H new ATOM 0 HD23 LEU A 112 21.320 36.213 -0.358 1.00 0.00 H new ATOM 1838 N GLU A 113 22.136 32.951 -5.045 1.00 0.00 N ATOM 1839 CA GLU A 113 22.952 31.944 -5.812 1.00 0.00 C ATOM 1840 C GLU A 113 24.198 32.539 -6.543 1.00 0.00 C ATOM 1841 O GLU A 113 25.178 31.826 -6.796 1.00 0.00 O ATOM 1842 CB GLU A 113 22.041 31.128 -6.795 1.00 0.00 C ATOM 1843 CG GLU A 113 20.941 31.926 -7.544 1.00 0.00 C ATOM 1844 CD GLU A 113 21.463 33.054 -8.455 1.00 0.00 C ATOM 1845 OE1 GLU A 113 21.520 34.225 -8.010 1.00 0.00 O ATOM 1846 OE2 GLU A 113 21.815 32.778 -9.621 1.00 0.00 O ATOM 0 H GLU A 113 21.143 32.916 -5.276 1.00 0.00 H new ATOM 0 HA GLU A 113 23.367 31.268 -5.065 1.00 0.00 H new ATOM 0 HB2 GLU A 113 22.681 30.651 -7.537 1.00 0.00 H new ATOM 0 HB3 GLU A 113 21.559 30.330 -6.230 1.00 0.00 H new ATOM 0 HG2 GLU A 113 20.357 31.232 -8.148 1.00 0.00 H new ATOM 0 HG3 GLU A 113 20.262 32.358 -6.809 1.00 0.00 H new ATOM 1853 N LYS A 114 24.127 33.847 -6.863 1.00 0.00 N ATOM 1854 CA LYS A 114 25.220 34.629 -7.488 1.00 0.00 C ATOM 1855 C LYS A 114 26.514 34.663 -6.641 1.00 0.00 C ATOM 1856 O LYS A 114 27.549 35.081 -7.138 1.00 0.00 O ATOM 1857 CB LYS A 114 24.716 36.074 -7.790 1.00 0.00 C ATOM 1858 CG LYS A 114 24.036 36.804 -6.599 1.00 0.00 C ATOM 1859 CD LYS A 114 25.008 37.424 -5.559 1.00 0.00 C ATOM 1860 CE LYS A 114 24.293 37.846 -4.262 1.00 0.00 C ATOM 1861 NZ LYS A 114 23.142 38.756 -4.513 1.00 0.00 N ATOM 0 H LYS A 114 23.290 34.404 -6.691 1.00 0.00 H new ATOM 0 HA LYS A 114 25.488 34.125 -8.417 1.00 0.00 H new ATOM 0 HB2 LYS A 114 25.562 36.673 -8.126 1.00 0.00 H new ATOM 0 HB3 LYS A 114 24.009 36.028 -8.618 1.00 0.00 H new ATOM 0 HG2 LYS A 114 23.400 37.596 -6.995 1.00 0.00 H new ATOM 0 HG3 LYS A 114 23.383 36.098 -6.086 1.00 0.00 H new ATOM 0 HD2 LYS A 114 25.789 36.702 -5.321 1.00 0.00 H new ATOM 0 HD3 LYS A 114 25.499 38.292 -5.998 1.00 0.00 H new ATOM 0 HE2 LYS A 114 23.941 36.956 -3.740 1.00 0.00 H new ATOM 0 HE3 LYS A 114 25.006 38.341 -3.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 22.900 39.260 -3.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 23.398 39.445 -5.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 22.322 38.200 -4.830 1.00 0.00 H new ATOM 1875 N LYS A 115 26.418 34.264 -5.361 1.00 0.00 N ATOM 1876 CA LYS A 115 27.558 34.175 -4.431 1.00 0.00 C ATOM 1877 C LYS A 115 28.568 33.102 -4.905 1.00 0.00 C ATOM 1878 O LYS A 115 29.776 33.226 -4.690 1.00 0.00 O ATOM 1879 CB LYS A 115 27.021 33.847 -3.015 1.00 0.00 C ATOM 1880 CG LYS A 115 28.086 33.805 -1.888 1.00 0.00 C ATOM 1881 CD LYS A 115 27.481 33.396 -0.523 1.00 0.00 C ATOM 1882 CE LYS A 115 26.880 31.976 -0.535 1.00 0.00 C ATOM 1883 NZ LYS A 115 26.189 31.660 0.738 1.00 0.00 N ATOM 0 H LYS A 115 25.532 33.990 -4.936 1.00 0.00 H new ATOM 0 HA LYS A 115 28.086 35.128 -4.405 1.00 0.00 H new ATOM 0 HB2 LYS A 115 26.267 34.589 -2.751 1.00 0.00 H new ATOM 0 HB3 LYS A 115 26.518 32.881 -3.051 1.00 0.00 H new ATOM 0 HG2 LYS A 115 28.872 33.101 -2.160 1.00 0.00 H new ATOM 0 HG3 LYS A 115 28.554 34.785 -1.797 1.00 0.00 H new ATOM 0 HD2 LYS A 115 28.255 33.451 0.243 1.00 0.00 H new ATOM 0 HD3 LYS A 115 26.706 34.111 -0.246 1.00 0.00 H new ATOM 0 HE2 LYS A 115 26.176 31.886 -1.363 1.00 0.00 H new ATOM 0 HE3 LYS A 115 27.672 31.248 -0.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 26.144 30.628 0.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 26.713 32.081 1.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 25.225 32.049 0.715 1.00 0.00 H new ATOM 1897 N ARG A 116 28.048 32.045 -5.559 1.00 0.00 N ATOM 1898 CA ARG A 116 28.881 30.999 -6.187 1.00 0.00 C ATOM 1899 C ARG A 116 29.480 31.510 -7.510 1.00 0.00 C ATOM 1900 O ARG A 116 30.611 31.188 -7.859 1.00 0.00 O ATOM 1901 CB ARG A 116 28.040 29.722 -6.449 1.00 0.00 C ATOM 1902 CG ARG A 116 27.523 29.022 -5.170 1.00 0.00 C ATOM 1903 CD ARG A 116 26.765 27.717 -5.479 1.00 0.00 C ATOM 1904 NE ARG A 116 27.595 26.768 -6.260 1.00 0.00 N ATOM 1905 CZ ARG A 116 27.437 25.436 -6.303 1.00 0.00 C ATOM 1906 NH1 ARG A 116 26.522 24.828 -5.560 1.00 0.00 N ATOM 1907 NH2 ARG A 116 28.224 24.711 -7.083 1.00 0.00 N ATOM 0 H ARG A 116 27.045 31.892 -5.667 1.00 0.00 H new ATOM 0 HA ARG A 116 29.694 30.753 -5.503 1.00 0.00 H new ATOM 0 HB2 ARG A 116 27.187 29.986 -7.074 1.00 0.00 H new ATOM 0 HB3 ARG A 116 28.644 29.014 -7.017 1.00 0.00 H new ATOM 0 HG2 ARG A 116 28.365 28.803 -4.514 1.00 0.00 H new ATOM 0 HG3 ARG A 116 26.865 29.701 -4.628 1.00 0.00 H new ATOM 0 HD2 ARG A 116 26.456 27.246 -4.545 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.856 27.948 -6.035 1.00 0.00 H new ATOM 0 HE ARG A 116 28.354 27.163 -6.814 1.00 0.00 H new ATOM 0 HH11 ARG A 116 25.922 25.374 -4.941 1.00 0.00 H new ATOM 0 HH12 ARG A 116 26.418 23.814 -5.607 1.00 0.00 H new ATOM 0 HH21 ARG A 116 28.944 25.165 -7.645 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.111 23.698 -7.122 1.00 0.00 H new ATOM 1921 N GLU A 117 28.689 32.316 -8.226 1.00 0.00 N ATOM 1922 CA GLU A 117 29.039 32.849 -9.556 1.00 0.00 C ATOM 1923 C GLU A 117 30.159 33.908 -9.464 1.00 0.00 C ATOM 1924 O GLU A 117 31.136 33.878 -10.230 1.00 0.00 O ATOM 1925 CB GLU A 117 27.761 33.464 -10.188 1.00 0.00 C ATOM 1926 CG GLU A 117 27.938 34.090 -11.584 1.00 0.00 C ATOM 1927 CD GLU A 117 28.319 33.071 -12.676 1.00 0.00 C ATOM 1928 OE1 GLU A 117 29.509 32.979 -13.052 1.00 0.00 O ATOM 1929 OE2 GLU A 117 27.418 32.358 -13.164 1.00 0.00 O ATOM 0 H GLU A 117 27.774 32.623 -7.897 1.00 0.00 H new ATOM 0 HA GLU A 117 29.416 32.038 -10.180 1.00 0.00 H new ATOM 0 HB2 GLU A 117 27.000 32.686 -10.253 1.00 0.00 H new ATOM 0 HB3 GLU A 117 27.377 34.229 -9.513 1.00 0.00 H new ATOM 0 HG2 GLU A 117 27.011 34.586 -11.870 1.00 0.00 H new ATOM 0 HG3 GLU A 117 28.708 34.859 -11.533 1.00 0.00 H new ATOM 1936 N LEU A 118 30.015 34.802 -8.470 1.00 0.00 N ATOM 1937 CA LEU A 118 30.827 36.017 -8.327 1.00 0.00 C ATOM 1938 C LEU A 118 32.301 35.669 -8.071 1.00 0.00 C ATOM 1939 O LEU A 118 33.177 36.160 -8.771 1.00 0.00 O ATOM 1940 CB LEU A 118 30.268 36.898 -7.173 1.00 0.00 C ATOM 1941 CG LEU A 118 30.986 38.268 -6.935 1.00 0.00 C ATOM 1942 CD1 LEU A 118 30.787 39.234 -8.132 1.00 0.00 C ATOM 1943 CD2 LEU A 118 30.528 38.913 -5.602 1.00 0.00 C ATOM 0 H LEU A 118 29.318 34.696 -7.732 1.00 0.00 H new ATOM 0 HA LEU A 118 30.773 36.578 -9.260 1.00 0.00 H new ATOM 0 HB2 LEU A 118 29.214 37.094 -7.372 1.00 0.00 H new ATOM 0 HB3 LEU A 118 30.316 36.322 -6.249 1.00 0.00 H new ATOM 0 HG LEU A 118 32.055 38.070 -6.858 1.00 0.00 H new ATOM 0 HD11 LEU A 118 31.300 40.174 -7.930 1.00 0.00 H new ATOM 0 HD12 LEU A 118 31.198 38.783 -9.035 1.00 0.00 H new ATOM 0 HD13 LEU A 118 29.723 39.424 -8.273 1.00 0.00 H new ATOM 0 HD21 LEU A 118 31.043 39.864 -5.462 1.00 0.00 H new ATOM 0 HD22 LEU A 118 29.452 39.084 -5.631 1.00 0.00 H new ATOM 0 HD23 LEU A 118 30.767 38.246 -4.774 1.00 0.00 H new ATOM 1955 N GLU A 119 32.547 34.796 -7.071 1.00 0.00 N ATOM 1956 CA GLU A 119 33.912 34.379 -6.669 1.00 0.00 C ATOM 1957 C GLU A 119 34.645 33.594 -7.789 1.00 0.00 C ATOM 1958 O GLU A 119 35.874 33.603 -7.836 1.00 0.00 O ATOM 1959 CB GLU A 119 33.875 33.530 -5.371 1.00 0.00 C ATOM 1960 CG GLU A 119 32.991 32.265 -5.462 1.00 0.00 C ATOM 1961 CD GLU A 119 33.285 31.243 -4.360 1.00 0.00 C ATOM 1962 OE1 GLU A 119 34.230 30.440 -4.532 1.00 0.00 O ATOM 1963 OE2 GLU A 119 32.604 31.244 -3.316 1.00 0.00 O ATOM 0 H GLU A 119 31.808 34.360 -6.519 1.00 0.00 H new ATOM 0 HA GLU A 119 34.472 35.295 -6.484 1.00 0.00 H new ATOM 0 HB2 GLU A 119 34.892 33.231 -5.118 1.00 0.00 H new ATOM 0 HB3 GLU A 119 33.513 34.153 -4.553 1.00 0.00 H new ATOM 0 HG2 GLU A 119 31.942 32.558 -5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 119 33.140 31.795 -6.434 1.00 0.00 H new ATOM 1970 N LYS A 120 33.880 32.903 -8.661 1.00 0.00 N ATOM 1971 CA LYS A 120 34.445 32.142 -9.814 1.00 0.00 C ATOM 1972 C LYS A 120 34.910 33.097 -10.929 1.00 0.00 C ATOM 1973 O LYS A 120 35.869 32.801 -11.652 1.00 0.00 O ATOM 1974 CB LYS A 120 33.416 31.077 -10.345 1.00 0.00 C ATOM 1975 CG LYS A 120 33.517 29.678 -9.664 1.00 0.00 C ATOM 1976 CD LYS A 120 33.391 29.729 -8.121 1.00 0.00 C ATOM 1977 CE LYS A 120 33.520 28.357 -7.441 1.00 0.00 C ATOM 1978 NZ LYS A 120 34.861 27.765 -7.629 1.00 0.00 N ATOM 0 H LYS A 120 32.863 32.852 -8.594 1.00 0.00 H new ATOM 0 HA LYS A 120 35.323 31.598 -9.467 1.00 0.00 H new ATOM 0 HB2 LYS A 120 32.407 31.464 -10.202 1.00 0.00 H new ATOM 0 HB3 LYS A 120 33.561 30.955 -11.418 1.00 0.00 H new ATOM 0 HG2 LYS A 120 32.735 29.032 -10.063 1.00 0.00 H new ATOM 0 HG3 LYS A 120 34.472 29.223 -9.927 1.00 0.00 H new ATOM 0 HD2 LYS A 120 34.159 30.394 -7.725 1.00 0.00 H new ATOM 0 HD3 LYS A 120 32.427 30.164 -7.859 1.00 0.00 H new ATOM 0 HE2 LYS A 120 33.317 28.461 -6.375 1.00 0.00 H new ATOM 0 HE3 LYS A 120 32.766 27.681 -7.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 34.924 26.873 -7.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 35.019 27.578 -8.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 35.584 28.427 -7.282 1.00 0.00 H new ATOM 1992 N ARG A 121 34.222 34.243 -11.052 1.00 0.00 N ATOM 1993 CA ARG A 121 34.635 35.331 -11.964 1.00 0.00 C ATOM 1994 C ARG A 121 35.823 36.105 -11.358 1.00 0.00 C ATOM 1995 O ARG A 121 36.781 36.456 -12.050 1.00 0.00 O ATOM 1996 CB ARG A 121 33.440 36.286 -12.226 1.00 0.00 C ATOM 1997 CG ARG A 121 32.227 35.603 -12.900 1.00 0.00 C ATOM 1998 CD ARG A 121 31.039 36.559 -13.101 1.00 0.00 C ATOM 1999 NE ARG A 121 29.926 35.891 -13.786 1.00 0.00 N ATOM 2000 CZ ARG A 121 28.762 36.459 -14.123 1.00 0.00 C ATOM 2001 NH1 ARG A 121 28.526 37.739 -13.875 1.00 0.00 N ATOM 2002 NH2 ARG A 121 27.827 35.723 -14.702 1.00 0.00 N ATOM 0 H ARG A 121 33.370 34.445 -10.528 1.00 0.00 H new ATOM 0 HA ARG A 121 34.950 34.900 -12.914 1.00 0.00 H new ATOM 0 HB2 ARG A 121 33.120 36.720 -11.279 1.00 0.00 H new ATOM 0 HB3 ARG A 121 33.777 37.109 -12.856 1.00 0.00 H new ATOM 0 HG2 ARG A 121 32.532 35.202 -13.867 1.00 0.00 H new ATOM 0 HG3 ARG A 121 31.908 34.757 -12.291 1.00 0.00 H new ATOM 0 HD2 ARG A 121 30.702 36.932 -12.134 1.00 0.00 H new ATOM 0 HD3 ARG A 121 31.360 37.424 -13.682 1.00 0.00 H new ATOM 0 HE ARG A 121 30.051 34.908 -14.026 1.00 0.00 H new ATOM 0 HH11 ARG A 121 29.238 38.310 -13.419 1.00 0.00 H new ATOM 0 HH12 ARG A 121 27.632 38.153 -14.140 1.00 0.00 H new ATOM 0 HH21 ARG A 121 27.998 34.734 -14.887 1.00 0.00 H new ATOM 0 HH22 ARG A 121 26.936 36.144 -14.964 1.00 0.00 H new ATOM 2016 N LEU A 122 35.740 36.320 -10.036 1.00 0.00 N ATOM 2017 CA LEU A 122 36.742 37.049 -9.228 1.00 0.00 C ATOM 2018 C LEU A 122 37.803 36.079 -8.666 1.00 0.00 C ATOM 2019 O LEU A 122 38.435 36.384 -7.667 1.00 0.00 O ATOM 2020 CB LEU A 122 36.023 37.829 -8.068 1.00 0.00 C ATOM 2021 CG LEU A 122 35.317 39.193 -8.432 1.00 0.00 C ATOM 2022 CD1 LEU A 122 34.258 39.051 -9.547 1.00 0.00 C ATOM 2023 CD2 LEU A 122 34.701 39.846 -7.169 1.00 0.00 C ATOM 0 H LEU A 122 34.954 35.984 -9.480 1.00 0.00 H new ATOM 0 HA LEU A 122 37.256 37.767 -9.867 1.00 0.00 H new ATOM 0 HB2 LEU A 122 35.273 37.168 -7.633 1.00 0.00 H new ATOM 0 HB3 LEU A 122 36.760 38.029 -7.291 1.00 0.00 H new ATOM 0 HG LEU A 122 36.094 39.847 -8.828 1.00 0.00 H new ATOM 0 HD11 LEU A 122 33.810 40.024 -9.750 1.00 0.00 H new ATOM 0 HD12 LEU A 122 34.732 38.674 -10.453 1.00 0.00 H new ATOM 0 HD13 LEU A 122 33.483 38.355 -9.226 1.00 0.00 H new ATOM 0 HD21 LEU A 122 34.220 40.785 -7.443 1.00 0.00 H new ATOM 0 HD22 LEU A 122 33.962 39.172 -6.735 1.00 0.00 H new ATOM 0 HD23 LEU A 122 35.487 40.041 -6.440 1.00 0.00 H new ATOM 2035 N GLN A 123 38.032 34.942 -9.364 1.00 0.00 N ATOM 2036 CA GLN A 123 38.975 33.870 -8.932 1.00 0.00 C ATOM 2037 C GLN A 123 40.439 34.355 -8.847 1.00 0.00 C ATOM 2038 O GLN A 123 41.289 33.679 -8.269 1.00 0.00 O ATOM 2039 CB GLN A 123 38.859 32.659 -9.892 1.00 0.00 C ATOM 2040 CG GLN A 123 39.240 32.973 -11.354 1.00 0.00 C ATOM 2041 CD GLN A 123 39.087 31.774 -12.298 1.00 0.00 C ATOM 2042 OE1 GLN A 123 39.252 30.623 -11.903 1.00 0.00 O ATOM 2043 NE2 GLN A 123 38.773 32.031 -13.549 1.00 0.00 N ATOM 0 H GLN A 123 37.568 34.736 -10.249 1.00 0.00 H new ATOM 0 HA GLN A 123 38.690 33.573 -7.923 1.00 0.00 H new ATOM 0 HB2 GLN A 123 39.499 31.856 -9.526 1.00 0.00 H new ATOM 0 HB3 GLN A 123 37.835 32.286 -9.867 1.00 0.00 H new ATOM 0 HG2 GLN A 123 38.617 33.791 -11.715 1.00 0.00 H new ATOM 0 HG3 GLN A 123 40.273 33.320 -11.385 1.00 0.00 H new ATOM 0 HE21 GLN A 123 38.641 32.995 -13.854 1.00 0.00 H new ATOM 0 HE22 GLN A 123 38.661 31.266 -14.214 1.00 0.00 H new