USER MOD reduce.3.24.130724 H: found=0, std=0, add=755, rem=0, adj=17 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 -141:sc= -2.41 (180deg=-5!) 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+ -142:sc= 0.644 (180deg=0.194) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -1.14 K(o=-1.1,f=-1.8!) USER MOD Single : A 38 LYS NZ :NH3+ 162:sc= -1.68! (180deg=-2.27!) USER MOD Single : A 43 LYS NZ :NH3+ -152:sc= 0.27 (180deg=0.0543) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= -1.45! C(o=-1.5!,f=-5!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 150:sc= -0.0501 USER MOD Single : A 62 ASN : amide:sc= -1.12 K(o=-1.1,f=-3.7!) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot -30:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= -0.849 USER MOD Single : A 87 SER OG : rot 74:sc= 1.4 USER MOD Single : A 88 CYS SG : rot 150:sc=-0.000967 USER MOD Single : A 106 THR OG1 : rot 29:sc= 0.264 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 173:sc=-0.00285 (180deg=-0.0674) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 GLN : amide:sc= -0.362 X(o=-0.36,f=0) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -8.801 28.557 -17.422 1.00 0.00 N ATOM 297 CA ARG A 22 -10.194 28.619 -17.918 1.00 0.00 C ATOM 298 C ARG A 22 -11.191 28.063 -16.861 1.00 0.00 C ATOM 299 O ARG A 22 -10.769 27.337 -15.940 1.00 0.00 O ATOM 300 CB ARG A 22 -10.313 27.828 -19.257 1.00 0.00 C ATOM 301 CG ARG A 22 -9.609 28.498 -20.449 1.00 0.00 C ATOM 302 CD ARG A 22 -9.777 27.703 -21.754 1.00 0.00 C ATOM 303 NE ARG A 22 -9.143 26.368 -21.677 1.00 0.00 N ATOM 304 CZ ARG A 22 -9.693 25.214 -22.094 1.00 0.00 C ATOM 305 NH1 ARG A 22 -10.933 25.174 -22.554 1.00 0.00 N ATOM 306 NH2 ARG A 22 -8.993 24.092 -22.029 1.00 0.00 N ATOM 0 HA ARG A 22 -10.452 29.663 -18.098 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.895 26.831 -19.116 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.368 27.700 -19.498 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.009 29.503 -20.585 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -8.547 28.605 -20.227 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -10.838 27.588 -21.974 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.340 28.265 -22.579 1.00 0.00 H new ATOM 0 HE ARG A 22 -8.208 26.319 -21.273 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -11.489 26.028 -22.597 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.333 24.289 -22.866 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.041 24.105 -21.664 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.406 23.214 -22.344 1.00 0.00 H new ATOM 320 N PRO A 23 -12.525 28.420 -16.955 1.00 0.00 N ATOM 321 CA PRO A 23 -13.574 27.842 -16.081 1.00 0.00 C ATOM 322 C PRO A 23 -13.561 26.296 -16.139 1.00 0.00 C ATOM 323 O PRO A 23 -13.766 25.694 -17.201 1.00 0.00 O ATOM 324 CB PRO A 23 -14.903 28.430 -16.641 1.00 0.00 C ATOM 325 CG PRO A 23 -14.545 28.952 -18.003 1.00 0.00 C ATOM 326 CD PRO A 23 -13.114 29.419 -17.889 1.00 0.00 C ATOM 0 HA PRO A 23 -13.428 28.089 -15.030 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -15.679 27.667 -16.701 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -15.285 29.225 -16.000 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -14.646 28.175 -18.761 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -15.203 29.770 -18.296 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -12.609 29.419 -18.855 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -13.048 30.433 -17.494 1.00 0.00 H new ATOM 334 N MET A 24 -13.257 25.692 -14.981 1.00 0.00 N ATOM 335 CA MET A 24 -13.143 24.229 -14.804 1.00 0.00 C ATOM 336 C MET A 24 -14.506 23.533 -14.923 1.00 0.00 C ATOM 337 O MET A 24 -15.543 24.201 -15.089 1.00 0.00 O ATOM 338 CB MET A 24 -12.501 23.937 -13.429 1.00 0.00 C ATOM 339 CG MET A 24 -11.069 24.455 -13.276 1.00 0.00 C ATOM 340 SD MET A 24 -10.505 24.366 -11.573 1.00 0.00 S ATOM 341 CE MET A 24 -11.684 25.450 -10.770 1.00 0.00 C ATOM 0 H MET A 24 -13.079 26.213 -14.122 1.00 0.00 H new ATOM 0 HA MET A 24 -12.512 23.830 -15.599 1.00 0.00 H new ATOM 0 HB2 MET A 24 -13.120 24.383 -12.651 1.00 0.00 H new ATOM 0 HB3 MET A 24 -12.504 22.860 -13.262 1.00 0.00 H new ATOM 0 HG2 MET A 24 -10.402 23.872 -13.911 1.00 0.00 H new ATOM 0 HG3 MET A 24 -11.017 25.487 -13.623 1.00 0.00 H new ATOM 0 HE1 MET A 24 -11.175 26.041 -10.008 1.00 0.00 H new ATOM 0 HE2 MET A 24 -12.128 26.116 -11.510 1.00 0.00 H new ATOM 0 HE3 MET A 24 -12.467 24.853 -10.303 1.00 0.00 H new ATOM 351 N SER A 25 -14.490 22.186 -14.812 1.00 0.00 N ATOM 352 CA SER A 25 -15.667 21.352 -15.069 1.00 0.00 C ATOM 353 C SER A 25 -16.851 21.742 -14.149 1.00 0.00 C ATOM 354 O SER A 25 -16.734 21.733 -12.917 1.00 0.00 O ATOM 355 CB SER A 25 -15.291 19.866 -14.859 1.00 0.00 C ATOM 356 OG SER A 25 -14.161 19.509 -15.641 1.00 0.00 O ATOM 0 H SER A 25 -13.661 21.656 -14.543 1.00 0.00 H new ATOM 0 HA SER A 25 -15.988 21.511 -16.099 1.00 0.00 H new ATOM 0 HB2 SER A 25 -15.079 19.687 -13.805 1.00 0.00 H new ATOM 0 HB3 SER A 25 -16.137 19.232 -15.126 1.00 0.00 H new ATOM 0 HG SER A 25 -13.943 18.566 -15.489 1.00 0.00 H new ATOM 362 N TYR A 26 -17.986 22.027 -14.795 1.00 0.00 N ATOM 363 CA TYR A 26 -19.268 22.354 -14.144 1.00 0.00 C ATOM 364 C TYR A 26 -19.784 21.147 -13.359 1.00 0.00 C ATOM 365 O TYR A 26 -20.366 21.300 -12.292 1.00 0.00 O ATOM 366 CB TYR A 26 -20.302 22.800 -15.220 1.00 0.00 C ATOM 367 CG TYR A 26 -20.541 21.758 -16.346 1.00 0.00 C ATOM 368 CD1 TYR A 26 -21.651 20.904 -16.339 1.00 0.00 C ATOM 369 CD2 TYR A 26 -19.632 21.612 -17.405 1.00 0.00 C ATOM 370 CE1 TYR A 26 -21.843 19.966 -17.336 1.00 0.00 C ATOM 371 CE2 TYR A 26 -19.826 20.677 -18.395 1.00 0.00 C ATOM 372 CZ TYR A 26 -20.927 19.858 -18.362 1.00 0.00 C ATOM 373 OH TYR A 26 -21.110 18.924 -19.362 1.00 0.00 O ATOM 0 H TYR A 26 -18.045 22.038 -15.813 1.00 0.00 H new ATOM 0 HA TYR A 26 -19.119 23.175 -13.443 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -21.252 23.011 -14.729 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -19.961 23.732 -15.670 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -22.372 20.980 -15.538 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -18.760 22.248 -17.444 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -22.708 19.319 -17.312 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -19.111 20.587 -19.199 1.00 0.00 H new ATOM 0 HH TYR A 26 -20.373 18.984 -20.005 1.00 0.00 H new ATOM 383 N ASP A 27 -19.518 19.951 -13.909 1.00 0.00 N ATOM 384 CA ASP A 27 -19.897 18.666 -13.309 1.00 0.00 C ATOM 385 C ASP A 27 -19.350 18.540 -11.875 1.00 0.00 C ATOM 386 O ASP A 27 -20.110 18.369 -10.920 1.00 0.00 O ATOM 387 CB ASP A 27 -19.357 17.527 -14.210 1.00 0.00 C ATOM 388 CG ASP A 27 -19.658 16.113 -13.684 1.00 0.00 C ATOM 389 OD1 ASP A 27 -20.761 15.604 -13.935 1.00 0.00 O ATOM 390 OD2 ASP A 27 -18.785 15.505 -13.026 1.00 0.00 O ATOM 0 H ASP A 27 -19.026 19.851 -14.797 1.00 0.00 H new ATOM 0 HA ASP A 27 -20.983 18.600 -13.242 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -19.787 17.632 -15.206 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -18.278 17.642 -14.315 1.00 0.00 H new ATOM 395 N GLU A 28 -18.025 18.700 -11.755 1.00 0.00 N ATOM 396 CA GLU A 28 -17.293 18.452 -10.510 1.00 0.00 C ATOM 397 C GLU A 28 -17.537 19.578 -9.501 1.00 0.00 C ATOM 398 O GLU A 28 -17.836 19.312 -8.350 1.00 0.00 O ATOM 399 CB GLU A 28 -15.783 18.341 -10.811 1.00 0.00 C ATOM 400 CG GLU A 28 -15.432 17.366 -11.952 1.00 0.00 C ATOM 401 CD GLU A 28 -13.926 17.242 -12.222 1.00 0.00 C ATOM 402 OE1 GLU A 28 -13.230 18.280 -12.265 1.00 0.00 O ATOM 403 OE2 GLU A 28 -13.445 16.111 -12.424 1.00 0.00 O ATOM 0 H GLU A 28 -17.430 19.007 -12.524 1.00 0.00 H new ATOM 0 HA GLU A 28 -17.651 17.518 -10.077 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -15.402 19.330 -11.064 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -15.267 18.023 -9.905 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.830 16.381 -11.710 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -15.929 17.696 -12.864 1.00 0.00 H new ATOM 410 N LYS A 29 -17.398 20.837 -9.974 1.00 0.00 N ATOM 411 CA LYS A 29 -17.458 22.051 -9.127 1.00 0.00 C ATOM 412 C LYS A 29 -18.870 22.291 -8.540 1.00 0.00 C ATOM 413 O LYS A 29 -18.997 22.604 -7.356 1.00 0.00 O ATOM 414 CB LYS A 29 -16.949 23.307 -9.925 1.00 0.00 C ATOM 415 CG LYS A 29 -15.420 23.607 -9.869 1.00 0.00 C ATOM 416 CD LYS A 29 -14.495 22.527 -10.517 1.00 0.00 C ATOM 417 CE LYS A 29 -14.026 21.427 -9.539 1.00 0.00 C ATOM 418 NZ LYS A 29 -12.988 20.541 -10.142 1.00 0.00 N ATOM 0 H LYS A 29 -17.240 21.041 -10.961 1.00 0.00 H new ATOM 0 HA LYS A 29 -16.794 21.888 -8.278 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -17.232 23.182 -10.970 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -17.480 24.183 -9.553 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -15.237 24.561 -10.364 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -15.130 23.729 -8.825 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -15.027 22.059 -11.345 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -13.619 23.020 -10.939 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -13.626 21.891 -8.638 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -14.882 20.825 -9.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -13.146 19.561 -9.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -13.049 20.590 -11.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -12.044 20.853 -9.836 1.00 0.00 H new ATOM 432 N ARG A 30 -19.919 22.128 -9.365 1.00 0.00 N ATOM 433 CA ARG A 30 -21.318 22.353 -8.921 1.00 0.00 C ATOM 434 C ARG A 30 -21.845 21.153 -8.099 1.00 0.00 C ATOM 435 O ARG A 30 -22.764 21.315 -7.288 1.00 0.00 O ATOM 436 CB ARG A 30 -22.238 22.666 -10.127 1.00 0.00 C ATOM 437 CG ARG A 30 -21.819 23.927 -10.935 1.00 0.00 C ATOM 438 CD ARG A 30 -22.790 24.246 -12.089 1.00 0.00 C ATOM 439 NE ARG A 30 -24.143 24.561 -11.594 1.00 0.00 N ATOM 440 CZ ARG A 30 -25.297 24.267 -12.220 1.00 0.00 C ATOM 441 NH1 ARG A 30 -25.309 23.554 -13.337 1.00 0.00 N ATOM 442 NH2 ARG A 30 -26.442 24.678 -11.699 1.00 0.00 N ATOM 0 H ARG A 30 -19.832 21.843 -10.340 1.00 0.00 H new ATOM 0 HA ARG A 30 -21.327 23.224 -8.265 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -22.247 21.806 -10.796 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -23.258 22.801 -9.767 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -21.767 24.783 -10.263 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -20.818 23.778 -11.339 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -22.407 25.090 -12.663 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -22.840 23.395 -12.768 1.00 0.00 H new ATOM 0 HE ARG A 30 -24.210 25.044 -10.698 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -24.433 23.218 -13.737 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -26.194 23.341 -13.797 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -26.444 25.213 -10.830 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -27.322 24.460 -12.166 1.00 0.00 H new ATOM 456 N GLN A 31 -21.257 19.953 -8.310 1.00 0.00 N ATOM 457 CA GLN A 31 -21.476 18.797 -7.403 1.00 0.00 C ATOM 458 C GLN A 31 -20.719 19.024 -6.069 1.00 0.00 C ATOM 459 O GLN A 31 -21.179 18.619 -5.001 1.00 0.00 O ATOM 460 CB GLN A 31 -21.017 17.476 -8.078 1.00 0.00 C ATOM 461 CG GLN A 31 -21.241 16.204 -7.224 1.00 0.00 C ATOM 462 CD GLN A 31 -20.926 14.902 -7.965 1.00 0.00 C ATOM 463 OE1 GLN A 31 -19.803 14.407 -7.935 1.00 0.00 O ATOM 464 NE2 GLN A 31 -21.925 14.334 -8.626 1.00 0.00 N ATOM 0 H GLN A 31 -20.632 19.758 -9.092 1.00 0.00 H new ATOM 0 HA GLN A 31 -22.542 18.712 -7.191 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -21.549 17.362 -9.022 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -19.957 17.555 -8.317 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -20.619 16.263 -6.331 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -22.278 16.180 -6.890 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -22.847 14.771 -8.631 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -21.772 13.460 -9.129 1.00 0.00 H new ATOM 473 N LEU A 32 -19.566 19.708 -6.161 1.00 0.00 N ATOM 474 CA LEU A 32 -18.724 20.063 -5.001 1.00 0.00 C ATOM 475 C LEU A 32 -19.401 21.167 -4.163 1.00 0.00 C ATOM 476 O LEU A 32 -19.110 21.320 -2.979 1.00 0.00 O ATOM 477 CB LEU A 32 -17.319 20.501 -5.492 1.00 0.00 C ATOM 478 CG LEU A 32 -16.217 20.731 -4.409 1.00 0.00 C ATOM 479 CD1 LEU A 32 -15.966 19.463 -3.558 1.00 0.00 C ATOM 480 CD2 LEU A 32 -14.908 21.216 -5.072 1.00 0.00 C ATOM 0 H LEU A 32 -19.187 20.034 -7.050 1.00 0.00 H new ATOM 0 HA LEU A 32 -18.605 19.191 -4.358 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -16.955 19.745 -6.188 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.433 21.426 -6.058 1.00 0.00 H new ATOM 0 HG LEU A 32 -16.577 21.505 -3.731 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.192 19.669 -2.818 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.887 19.177 -3.050 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.641 18.649 -4.206 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.148 21.372 -4.306 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.559 20.465 -5.781 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.092 22.153 -5.597 1.00 0.00 H new ATOM 492 N SER A 33 -20.318 21.925 -4.803 1.00 0.00 N ATOM 493 CA SER A 33 -21.167 22.923 -4.120 1.00 0.00 C ATOM 494 C SER A 33 -22.110 22.232 -3.109 1.00 0.00 C ATOM 495 O SER A 33 -22.436 22.802 -2.064 1.00 0.00 O ATOM 496 CB SER A 33 -21.977 23.732 -5.157 1.00 0.00 C ATOM 497 OG SER A 33 -22.576 24.882 -4.577 1.00 0.00 O ATOM 0 H SER A 33 -20.490 21.862 -5.806 1.00 0.00 H new ATOM 0 HA SER A 33 -20.524 23.610 -3.570 1.00 0.00 H new ATOM 0 HB2 SER A 33 -21.322 24.036 -5.973 1.00 0.00 H new ATOM 0 HB3 SER A 33 -22.751 23.098 -5.589 1.00 0.00 H new ATOM 0 HG SER A 33 -23.079 25.370 -5.262 1.00 0.00 H new ATOM 503 N LEU A 34 -22.512 20.986 -3.437 1.00 0.00 N ATOM 504 CA LEU A 34 -23.348 20.131 -2.562 1.00 0.00 C ATOM 505 C LEU A 34 -22.537 19.635 -1.344 1.00 0.00 C ATOM 506 O LEU A 34 -23.101 19.352 -0.286 1.00 0.00 O ATOM 507 CB LEU A 34 -23.917 18.936 -3.374 1.00 0.00 C ATOM 508 CG LEU A 34 -24.652 19.295 -4.712 1.00 0.00 C ATOM 509 CD1 LEU A 34 -25.084 18.019 -5.485 1.00 0.00 C ATOM 510 CD2 LEU A 34 -25.852 20.245 -4.466 1.00 0.00 C ATOM 0 H LEU A 34 -22.265 20.541 -4.321 1.00 0.00 H new ATOM 0 HA LEU A 34 -24.182 20.724 -2.187 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -23.096 18.257 -3.606 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.612 18.389 -2.737 1.00 0.00 H new ATOM 0 HG LEU A 34 -23.939 19.830 -5.340 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -25.590 18.306 -6.407 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -24.203 17.423 -5.725 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -25.762 17.431 -4.867 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -26.337 20.472 -5.415 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -26.567 19.763 -3.799 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -25.497 21.169 -4.010 1.00 0.00 H new ATOM 522 N ASP A 35 -21.207 19.522 -1.531 1.00 0.00 N ATOM 523 CA ASP A 35 -20.253 19.233 -0.440 1.00 0.00 C ATOM 524 C ASP A 35 -20.068 20.464 0.460 1.00 0.00 C ATOM 525 O ASP A 35 -19.838 20.326 1.666 1.00 0.00 O ATOM 526 CB ASP A 35 -18.881 18.767 -0.998 1.00 0.00 C ATOM 527 CG ASP A 35 -18.952 17.423 -1.741 1.00 0.00 C ATOM 528 OD1 ASP A 35 -19.174 17.411 -2.967 1.00 0.00 O ATOM 529 OD2 ASP A 35 -18.801 16.366 -1.099 1.00 0.00 O ATOM 0 H ASP A 35 -20.763 19.628 -2.443 1.00 0.00 H new ATOM 0 HA ASP A 35 -20.671 18.421 0.156 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -18.494 19.529 -1.675 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -18.172 18.682 -0.175 1.00 0.00 H new ATOM 534 N ILE A 36 -20.174 21.670 -0.142 1.00 0.00 N ATOM 535 CA ILE A 36 -20.113 22.944 0.611 1.00 0.00 C ATOM 536 C ILE A 36 -21.400 23.140 1.440 1.00 0.00 C ATOM 537 O ILE A 36 -21.371 23.749 2.516 1.00 0.00 O ATOM 538 CB ILE A 36 -19.882 24.196 -0.339 1.00 0.00 C ATOM 539 CG1 ILE A 36 -18.633 23.983 -1.253 1.00 0.00 C ATOM 540 CG2 ILE A 36 -19.741 25.519 0.472 1.00 0.00 C ATOM 541 CD1 ILE A 36 -18.404 25.062 -2.307 1.00 0.00 C ATOM 0 H ILE A 36 -20.302 21.788 -1.147 1.00 0.00 H new ATOM 0 HA ILE A 36 -19.255 22.879 1.280 1.00 0.00 H new ATOM 0 HB ILE A 36 -20.765 24.285 -0.972 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.747 23.922 -0.621 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.732 23.021 -1.757 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.584 26.351 -0.214 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -20.650 25.691 1.049 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -18.890 25.442 1.149 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -17.514 24.820 -2.887 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -19.267 25.112 -2.971 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -18.267 26.026 -1.817 1.00 0.00 H new ATOM 553 N ASN A 37 -22.517 22.596 0.931 1.00 0.00 N ATOM 554 CA ASN A 37 -23.819 22.598 1.635 1.00 0.00 C ATOM 555 C ASN A 37 -23.771 21.742 2.924 1.00 0.00 C ATOM 556 O ASN A 37 -24.609 21.906 3.812 1.00 0.00 O ATOM 557 CB ASN A 37 -24.937 22.088 0.690 1.00 0.00 C ATOM 558 CG ASN A 37 -25.200 22.978 -0.537 1.00 0.00 C ATOM 559 OD1 ASN A 37 -25.556 22.481 -1.605 1.00 0.00 O ATOM 560 ND2 ASN A 37 -25.046 24.295 -0.397 1.00 0.00 N ATOM 0 H ASN A 37 -22.548 22.141 0.019 1.00 0.00 H new ATOM 0 HA ASN A 37 -24.039 23.624 1.929 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -24.674 21.088 0.346 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -25.862 21.997 1.260 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -25.224 24.916 -1.186 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -24.750 24.681 0.499 1.00 0.00 H new ATOM 567 N LYS A 38 -22.778 20.828 3.001 1.00 0.00 N ATOM 568 CA LYS A 38 -22.532 19.984 4.191 1.00 0.00 C ATOM 569 C LYS A 38 -21.641 20.698 5.217 1.00 0.00 C ATOM 570 O LYS A 38 -21.601 20.297 6.382 1.00 0.00 O ATOM 571 CB LYS A 38 -21.878 18.643 3.780 1.00 0.00 C ATOM 572 CG LYS A 38 -22.689 17.841 2.738 1.00 0.00 C ATOM 573 CD LYS A 38 -22.265 16.340 2.657 1.00 0.00 C ATOM 574 CE LYS A 38 -21.048 16.091 1.758 1.00 0.00 C ATOM 575 NZ LYS A 38 -21.403 16.265 0.333 1.00 0.00 N ATOM 0 H LYS A 38 -22.124 20.655 2.238 1.00 0.00 H new ATOM 0 HA LYS A 38 -23.499 19.789 4.655 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -20.885 18.843 3.377 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -21.742 18.029 4.670 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -23.749 17.900 2.987 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -22.565 18.301 1.758 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -22.043 15.979 3.662 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -23.106 15.754 2.286 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -20.246 16.780 2.024 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -20.669 15.082 1.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -20.537 16.396 -0.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -21.909 15.421 -0.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -22.013 17.100 0.227 1.00 0.00 H new ATOM 589 N LEU A 39 -20.913 21.736 4.770 1.00 0.00 N ATOM 590 CA LEU A 39 -20.015 22.514 5.635 1.00 0.00 C ATOM 591 C LEU A 39 -20.852 23.460 6.541 1.00 0.00 C ATOM 592 O LEU A 39 -21.628 24.258 6.019 1.00 0.00 O ATOM 593 CB LEU A 39 -19.010 23.316 4.762 1.00 0.00 C ATOM 594 CG LEU A 39 -18.048 22.462 3.861 1.00 0.00 C ATOM 595 CD1 LEU A 39 -17.161 23.366 2.967 1.00 0.00 C ATOM 596 CD2 LEU A 39 -17.180 21.497 4.713 1.00 0.00 C ATOM 0 H LEU A 39 -20.932 22.057 3.802 1.00 0.00 H new ATOM 0 HA LEU A 39 -19.446 21.841 6.277 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -19.575 23.990 4.119 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -18.403 23.938 5.420 1.00 0.00 H new ATOM 0 HG LEU A 39 -18.671 21.855 3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -16.507 22.744 2.356 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -17.795 23.971 2.319 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -16.556 24.019 3.596 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -16.526 20.921 4.058 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -16.576 22.074 5.413 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -17.828 20.818 5.267 1.00 0.00 H new ATOM 608 N PRO A 40 -20.734 23.352 7.911 1.00 0.00 N ATOM 609 CA PRO A 40 -21.411 24.272 8.874 1.00 0.00 C ATOM 610 C PRO A 40 -20.917 25.736 8.778 1.00 0.00 C ATOM 611 O PRO A 40 -19.929 26.020 8.093 1.00 0.00 O ATOM 612 CB PRO A 40 -21.077 23.660 10.264 1.00 0.00 C ATOM 613 CG PRO A 40 -20.697 22.240 9.977 1.00 0.00 C ATOM 614 CD PRO A 40 -20.004 22.279 8.639 1.00 0.00 C ATOM 0 HA PRO A 40 -22.480 24.341 8.671 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -20.261 24.198 10.747 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -21.934 23.712 10.935 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -20.038 21.845 10.750 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -21.576 21.596 9.947 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -18.944 22.511 8.741 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -20.073 21.322 8.121 1.00 0.00 H new ATOM 622 N GLY A 41 -21.619 26.640 9.497 1.00 0.00 N ATOM 623 CA GLY A 41 -21.334 28.088 9.498 1.00 0.00 C ATOM 624 C GLY A 41 -19.885 28.434 9.848 1.00 0.00 C ATOM 625 O GLY A 41 -19.332 29.407 9.320 1.00 0.00 O ATOM 0 H GLY A 41 -22.403 26.382 10.096 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -21.567 28.495 8.514 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -21.997 28.578 10.211 1.00 0.00 H new ATOM 629 N GLU A 42 -19.275 27.626 10.749 1.00 0.00 N ATOM 630 CA GLU A 42 -17.851 27.774 11.144 1.00 0.00 C ATOM 631 C GLU A 42 -16.903 27.647 9.929 1.00 0.00 C ATOM 632 O GLU A 42 -15.895 28.355 9.848 1.00 0.00 O ATOM 633 CB GLU A 42 -17.470 26.738 12.238 1.00 0.00 C ATOM 634 CG GLU A 42 -17.690 25.258 11.847 1.00 0.00 C ATOM 635 CD GLU A 42 -17.109 24.276 12.877 1.00 0.00 C ATOM 636 OE1 GLU A 42 -17.717 24.099 13.954 1.00 0.00 O ATOM 637 OE2 GLU A 42 -16.024 23.704 12.631 1.00 0.00 O ATOM 0 H GLU A 42 -19.752 26.858 11.220 1.00 0.00 H new ATOM 0 HA GLU A 42 -17.732 28.777 11.555 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.420 26.877 12.498 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -18.051 26.951 13.135 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -18.758 25.071 11.736 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -17.232 25.072 10.876 1.00 0.00 H new ATOM 644 N LYS A 43 -17.275 26.781 8.969 1.00 0.00 N ATOM 645 CA LYS A 43 -16.461 26.521 7.769 1.00 0.00 C ATOM 646 C LYS A 43 -16.681 27.645 6.753 1.00 0.00 C ATOM 647 O LYS A 43 -15.779 27.977 6.008 1.00 0.00 O ATOM 648 CB LYS A 43 -16.825 25.166 7.099 1.00 0.00 C ATOM 649 CG LYS A 43 -16.878 23.937 8.024 1.00 0.00 C ATOM 650 CD LYS A 43 -15.569 23.672 8.788 1.00 0.00 C ATOM 651 CE LYS A 43 -15.632 22.351 9.576 1.00 0.00 C ATOM 652 NZ LYS A 43 -14.471 22.186 10.481 1.00 0.00 N ATOM 0 H LYS A 43 -18.142 26.245 9.003 1.00 0.00 H new ATOM 0 HA LYS A 43 -15.418 26.477 8.083 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -17.797 25.273 6.618 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -16.099 24.969 6.310 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -17.686 24.071 8.743 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -17.124 23.057 7.429 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -14.737 23.638 8.085 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -15.373 24.497 9.473 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -16.553 22.321 10.159 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -15.669 21.515 8.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -14.280 21.173 10.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -13.636 22.641 10.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -14.681 22.628 11.399 1.00 0.00 H new ATOM 666 N LEU A 44 -17.902 28.216 6.743 1.00 0.00 N ATOM 667 CA LEU A 44 -18.268 29.357 5.873 1.00 0.00 C ATOM 668 C LEU A 44 -17.451 30.615 6.244 1.00 0.00 C ATOM 669 O LEU A 44 -17.195 31.465 5.393 1.00 0.00 O ATOM 670 CB LEU A 44 -19.805 29.618 5.943 1.00 0.00 C ATOM 671 CG LEU A 44 -20.710 28.727 5.009 1.00 0.00 C ATOM 672 CD1 LEU A 44 -20.418 27.213 5.148 1.00 0.00 C ATOM 673 CD2 LEU A 44 -22.208 29.027 5.254 1.00 0.00 C ATOM 0 H LEU A 44 -18.666 27.899 7.339 1.00 0.00 H new ATOM 0 HA LEU A 44 -18.021 29.108 4.841 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -20.130 29.473 6.973 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -19.986 30.664 5.697 1.00 0.00 H new ATOM 0 HG LEU A 44 -20.459 28.994 3.982 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -21.073 26.653 4.480 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -19.378 27.017 4.885 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -20.597 26.901 6.177 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -22.816 28.402 4.600 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -22.457 28.814 6.294 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -22.408 30.077 5.041 1.00 0.00 H new ATOM 685 N GLY A 45 -17.020 30.697 7.522 1.00 0.00 N ATOM 686 CA GLY A 45 -16.092 31.749 7.977 1.00 0.00 C ATOM 687 C GLY A 45 -14.718 31.706 7.283 1.00 0.00 C ATOM 688 O GLY A 45 -13.908 32.630 7.439 1.00 0.00 O ATOM 0 H GLY A 45 -17.302 30.046 8.255 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -16.547 32.724 7.801 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -15.949 31.654 9.053 1.00 0.00 H new ATOM 692 N ARG A 46 -14.447 30.602 6.553 1.00 0.00 N ATOM 693 CA ARG A 46 -13.223 30.407 5.747 1.00 0.00 C ATOM 694 C ARG A 46 -13.568 30.306 4.238 1.00 0.00 C ATOM 695 O ARG A 46 -13.112 31.117 3.428 1.00 0.00 O ATOM 696 CB ARG A 46 -12.492 29.116 6.227 1.00 0.00 C ATOM 697 CG ARG A 46 -12.198 29.060 7.745 1.00 0.00 C ATOM 698 CD ARG A 46 -11.317 30.228 8.231 1.00 0.00 C ATOM 699 NE ARG A 46 -11.221 30.256 9.702 1.00 0.00 N ATOM 700 CZ ARG A 46 -11.621 31.262 10.495 1.00 0.00 C ATOM 701 NH1 ARG A 46 -12.173 32.362 9.988 1.00 0.00 N ATOM 702 NH2 ARG A 46 -11.479 31.155 11.809 1.00 0.00 N ATOM 0 H ARG A 46 -15.085 29.807 6.507 1.00 0.00 H new ATOM 0 HA ARG A 46 -12.566 31.266 5.882 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.098 28.251 5.957 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -11.550 29.027 5.686 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.140 29.071 8.293 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.704 28.117 7.979 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -10.319 30.136 7.802 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.732 31.171 7.874 1.00 0.00 H new ATOM 0 HE ARG A 46 -10.815 29.439 10.157 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -12.299 32.451 8.980 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -12.470 33.116 10.608 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -11.068 30.312 12.211 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -11.781 31.915 12.418 1.00 0.00 H new ATOM 716 N VAL A 47 -14.390 29.293 3.905 1.00 0.00 N ATOM 717 CA VAL A 47 -14.797 28.927 2.525 1.00 0.00 C ATOM 718 C VAL A 47 -15.496 30.090 1.785 1.00 0.00 C ATOM 719 O VAL A 47 -15.190 30.367 0.627 1.00 0.00 O ATOM 720 CB VAL A 47 -15.738 27.653 2.555 1.00 0.00 C ATOM 721 CG1 VAL A 47 -16.292 27.283 1.155 1.00 0.00 C ATOM 722 CG2 VAL A 47 -15.001 26.446 3.192 1.00 0.00 C ATOM 0 H VAL A 47 -14.806 28.683 4.609 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.887 28.697 1.971 1.00 0.00 H new ATOM 0 HB VAL A 47 -16.598 27.910 3.173 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.930 26.403 1.237 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.873 28.117 0.762 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -15.463 27.069 0.481 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.663 25.580 3.204 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.111 26.214 2.608 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -14.710 26.695 4.213 1.00 0.00 H new ATOM 732 N VAL A 48 -16.444 30.751 2.460 1.00 0.00 N ATOM 733 CA VAL A 48 -17.142 31.927 1.900 1.00 0.00 C ATOM 734 C VAL A 48 -16.225 33.167 1.957 1.00 0.00 C ATOM 735 O VAL A 48 -16.275 34.011 1.064 1.00 0.00 O ATOM 736 CB VAL A 48 -18.506 32.186 2.658 1.00 0.00 C ATOM 737 CG1 VAL A 48 -19.113 33.569 2.347 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.525 31.058 2.357 1.00 0.00 C ATOM 0 H VAL A 48 -16.750 30.494 3.399 1.00 0.00 H new ATOM 0 HA VAL A 48 -17.380 31.727 0.855 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.276 32.180 3.723 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.047 33.688 2.896 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -18.414 34.349 2.647 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -19.308 33.649 1.278 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.456 31.257 2.889 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.720 31.021 1.285 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.117 30.102 2.685 1.00 0.00 H new ATOM 748 N HIS A 49 -15.373 33.238 2.994 1.00 0.00 N ATOM 749 CA HIS A 49 -14.480 34.392 3.234 1.00 0.00 C ATOM 750 C HIS A 49 -13.454 34.588 2.090 1.00 0.00 C ATOM 751 O HIS A 49 -13.198 35.721 1.677 1.00 0.00 O ATOM 752 CB HIS A 49 -13.752 34.233 4.587 1.00 0.00 C ATOM 753 CG HIS A 49 -12.909 35.423 4.974 1.00 0.00 C ATOM 754 ND1 HIS A 49 -11.547 35.381 5.185 1.00 0.00 N ATOM 755 CD2 HIS A 49 -13.276 36.712 5.164 1.00 0.00 C ATOM 756 CE1 HIS A 49 -11.141 36.622 5.498 1.00 0.00 C ATOM 757 NE2 HIS A 49 -12.155 37.467 5.498 1.00 0.00 N ATOM 0 H HIS A 49 -15.282 32.499 3.691 1.00 0.00 H new ATOM 0 HA HIS A 49 -15.105 35.285 3.263 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -14.492 34.056 5.367 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -13.116 33.349 4.544 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -14.282 37.095 5.071 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -10.119 36.893 5.720 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -12.124 38.466 5.701 1.00 0.00 H new ATOM 765 N ILE A 50 -12.882 33.470 1.593 1.00 0.00 N ATOM 766 CA ILE A 50 -11.891 33.492 0.490 1.00 0.00 C ATOM 767 C ILE A 50 -12.552 33.951 -0.833 1.00 0.00 C ATOM 768 O ILE A 50 -11.907 34.600 -1.669 1.00 0.00 O ATOM 769 CB ILE A 50 -11.176 32.091 0.299 1.00 0.00 C ATOM 770 CG1 ILE A 50 -12.202 30.952 -0.027 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.316 31.726 1.544 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.593 29.595 -0.343 1.00 0.00 C ATOM 0 H ILE A 50 -13.090 32.534 1.940 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.121 34.213 0.766 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.510 32.184 -0.559 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.876 30.840 0.822 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.809 31.265 -0.876 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -9.837 30.760 1.385 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -9.552 32.489 1.695 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -10.955 31.673 2.425 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.388 28.880 -0.554 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.943 29.682 -1.214 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -11.011 29.249 0.511 1.00 0.00 H new ATOM 784 N ILE A 51 -13.844 33.614 -0.996 1.00 0.00 N ATOM 785 CA ILE A 51 -14.662 34.058 -2.139 1.00 0.00 C ATOM 786 C ILE A 51 -14.911 35.572 -2.056 1.00 0.00 C ATOM 787 O ILE A 51 -14.735 36.281 -3.039 1.00 0.00 O ATOM 788 CB ILE A 51 -16.038 33.283 -2.187 1.00 0.00 C ATOM 789 CG1 ILE A 51 -15.785 31.746 -2.357 1.00 0.00 C ATOM 790 CG2 ILE A 51 -16.984 33.821 -3.303 1.00 0.00 C ATOM 791 CD1 ILE A 51 -17.033 30.892 -2.257 1.00 0.00 C ATOM 0 H ILE A 51 -14.352 33.024 -0.337 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.114 33.836 -3.055 1.00 0.00 H new ATOM 0 HB ILE A 51 -16.546 33.456 -1.238 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -15.317 31.572 -3.326 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -15.075 31.421 -1.597 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.916 33.255 -3.294 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -17.197 34.875 -3.122 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -16.501 33.710 -4.274 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -16.767 29.843 -2.386 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -17.492 31.032 -1.279 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.738 31.186 -3.034 1.00 0.00 H new ATOM 803 N GLN A 52 -15.297 36.039 -0.858 1.00 0.00 N ATOM 804 CA GLN A 52 -15.601 37.455 -0.587 1.00 0.00 C ATOM 805 C GLN A 52 -14.367 38.351 -0.813 1.00 0.00 C ATOM 806 O GLN A 52 -14.483 39.450 -1.361 1.00 0.00 O ATOM 807 CB GLN A 52 -16.113 37.615 0.871 1.00 0.00 C ATOM 808 CG GLN A 52 -17.510 37.008 1.134 1.00 0.00 C ATOM 809 CD GLN A 52 -17.995 37.243 2.567 1.00 0.00 C ATOM 810 OE1 GLN A 52 -18.655 38.239 2.862 1.00 0.00 O ATOM 811 NE2 GLN A 52 -17.657 36.333 3.470 1.00 0.00 N ATOM 0 H GLN A 52 -15.408 35.439 -0.041 1.00 0.00 H new ATOM 0 HA GLN A 52 -16.377 37.772 -1.284 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -15.396 37.149 1.547 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -16.140 38.676 1.118 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -18.227 37.441 0.436 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -17.479 35.937 0.936 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -17.109 35.518 3.193 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -17.945 36.447 4.442 1.00 0.00 H new ATOM 820 N ALA A 53 -13.189 37.847 -0.397 1.00 0.00 N ATOM 821 CA ALA A 53 -11.901 38.561 -0.509 1.00 0.00 C ATOM 822 C ALA A 53 -11.529 38.842 -1.982 1.00 0.00 C ATOM 823 O ALA A 53 -10.843 39.828 -2.283 1.00 0.00 O ATOM 824 CB ALA A 53 -10.794 37.757 0.197 1.00 0.00 C ATOM 0 H ALA A 53 -13.103 36.925 0.030 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.004 39.528 -0.017 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.847 38.289 0.111 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -11.048 37.636 1.250 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -10.703 36.776 -0.269 1.00 0.00 H new ATOM 830 N ARG A 54 -11.997 37.960 -2.883 1.00 0.00 N ATOM 831 CA ARG A 54 -11.776 38.080 -4.341 1.00 0.00 C ATOM 832 C ARG A 54 -12.936 38.830 -5.023 1.00 0.00 C ATOM 833 O ARG A 54 -12.704 39.606 -5.950 1.00 0.00 O ATOM 834 CB ARG A 54 -11.555 36.656 -4.975 1.00 0.00 C ATOM 835 CG ARG A 54 -10.068 36.314 -5.257 1.00 0.00 C ATOM 836 CD ARG A 54 -9.192 36.373 -3.990 1.00 0.00 C ATOM 837 NE ARG A 54 -7.754 36.386 -4.321 1.00 0.00 N ATOM 838 CZ ARG A 54 -6.752 36.587 -3.446 1.00 0.00 C ATOM 839 NH1 ARG A 54 -6.986 36.674 -2.144 1.00 0.00 N ATOM 840 NH2 ARG A 54 -5.504 36.684 -3.887 1.00 0.00 N ATOM 0 H ARG A 54 -12.542 37.139 -2.622 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.875 38.670 -4.507 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.969 35.903 -4.305 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.115 36.594 -5.908 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.005 35.316 -5.691 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -9.674 37.009 -5.998 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.441 37.266 -3.416 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -9.412 35.514 -3.355 1.00 0.00 H new ATOM 0 HE ARG A 54 -7.498 36.229 -5.296 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -7.939 36.588 -1.790 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -6.213 36.827 -1.496 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -5.308 36.606 -4.885 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -4.741 36.836 -3.228 1.00 0.00 H new ATOM 854 N GLU A 55 -14.171 38.611 -4.540 1.00 0.00 N ATOM 855 CA GLU A 55 -15.412 39.102 -5.186 1.00 0.00 C ATOM 856 C GLU A 55 -16.095 40.149 -4.271 1.00 0.00 C ATOM 857 O GLU A 55 -16.818 39.766 -3.342 1.00 0.00 O ATOM 858 CB GLU A 55 -16.374 37.904 -5.467 1.00 0.00 C ATOM 859 CG GLU A 55 -15.736 36.716 -6.221 1.00 0.00 C ATOM 860 CD GLU A 55 -15.338 37.024 -7.677 1.00 0.00 C ATOM 861 OE1 GLU A 55 -16.172 36.833 -8.584 1.00 0.00 O ATOM 862 OE2 GLU A 55 -14.186 37.442 -7.923 1.00 0.00 O ATOM 0 H GLU A 55 -14.343 38.084 -3.684 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.165 39.576 -6.136 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -16.767 37.543 -4.517 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -17.223 38.268 -6.045 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.850 36.390 -5.676 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -16.437 35.881 -6.218 1.00 0.00 H new ATOM 869 N PRO A 56 -15.854 41.497 -4.497 1.00 0.00 N ATOM 870 CA PRO A 56 -16.458 42.592 -3.675 1.00 0.00 C ATOM 871 C PRO A 56 -17.997 42.651 -3.766 1.00 0.00 C ATOM 872 O PRO A 56 -18.667 43.122 -2.840 1.00 0.00 O ATOM 873 CB PRO A 56 -15.799 43.889 -4.241 1.00 0.00 C ATOM 874 CG PRO A 56 -14.570 43.402 -4.947 1.00 0.00 C ATOM 875 CD PRO A 56 -14.950 42.060 -5.530 1.00 0.00 C ATOM 0 HA PRO A 56 -16.270 42.442 -2.612 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.470 44.411 -4.924 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -15.549 44.589 -3.444 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -14.264 44.098 -5.728 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -13.731 43.308 -4.257 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.451 42.164 -6.492 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -14.077 41.428 -5.692 1.00 0.00 H new ATOM 883 N SER A 57 -18.535 42.148 -4.894 1.00 0.00 N ATOM 884 CA SER A 57 -19.986 42.048 -5.138 1.00 0.00 C ATOM 885 C SER A 57 -20.646 41.114 -4.097 1.00 0.00 C ATOM 886 O SER A 57 -21.699 41.425 -3.535 1.00 0.00 O ATOM 887 CB SER A 57 -20.243 41.518 -6.575 1.00 0.00 C ATOM 888 OG SER A 57 -19.451 42.210 -7.528 1.00 0.00 O ATOM 0 H SER A 57 -17.970 41.797 -5.667 1.00 0.00 H new ATOM 0 HA SER A 57 -20.428 43.039 -5.040 1.00 0.00 H new ATOM 0 HB2 SER A 57 -20.019 40.452 -6.618 1.00 0.00 H new ATOM 0 HB3 SER A 57 -21.298 41.632 -6.824 1.00 0.00 H new ATOM 0 HG SER A 57 -19.632 41.855 -8.423 1.00 0.00 H new ATOM 894 N LEU A 58 -19.965 39.984 -3.832 1.00 0.00 N ATOM 895 CA LEU A 58 -20.432 38.939 -2.899 1.00 0.00 C ATOM 896 C LEU A 58 -19.887 39.185 -1.476 1.00 0.00 C ATOM 897 O LEU A 58 -20.346 38.556 -0.521 1.00 0.00 O ATOM 898 CB LEU A 58 -20.017 37.519 -3.419 1.00 0.00 C ATOM 899 CG LEU A 58 -20.719 36.993 -4.731 1.00 0.00 C ATOM 900 CD1 LEU A 58 -22.258 37.084 -4.627 1.00 0.00 C ATOM 901 CD2 LEU A 58 -20.193 37.698 -6.002 1.00 0.00 C ATOM 0 H LEU A 58 -19.066 39.768 -4.263 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.520 38.984 -2.851 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -18.941 37.525 -3.592 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -20.208 36.799 -2.623 1.00 0.00 H new ATOM 0 HG LEU A 58 -20.457 35.939 -4.826 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -22.707 36.713 -5.548 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -22.602 36.481 -3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.551 38.122 -4.472 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -20.707 37.301 -6.877 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.379 38.769 -5.927 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -19.122 37.521 -6.099 1.00 0.00 H new ATOM 913 N ARG A 59 -18.910 40.111 -1.351 1.00 0.00 N ATOM 914 CA ARG A 59 -18.341 40.527 -0.050 1.00 0.00 C ATOM 915 C ARG A 59 -19.419 41.293 0.748 1.00 0.00 C ATOM 916 O ARG A 59 -19.586 41.098 1.958 1.00 0.00 O ATOM 917 CB ARG A 59 -17.070 41.415 -0.290 1.00 0.00 C ATOM 918 CG ARG A 59 -15.949 41.409 0.792 1.00 0.00 C ATOM 919 CD ARG A 59 -16.348 41.946 2.183 1.00 0.00 C ATOM 920 NE ARG A 59 -17.027 40.935 3.012 1.00 0.00 N ATOM 921 CZ ARG A 59 -17.122 40.969 4.349 1.00 0.00 C ATOM 922 NH1 ARG A 59 -16.627 41.989 5.039 1.00 0.00 N ATOM 923 NH2 ARG A 59 -17.737 39.990 4.984 1.00 0.00 N ATOM 0 H ARG A 59 -18.494 40.591 -2.149 1.00 0.00 H new ATOM 0 HA ARG A 59 -18.036 39.654 0.527 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -16.622 41.106 -1.234 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -17.403 42.445 -0.417 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -15.590 40.387 0.909 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -15.112 42.001 0.422 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -15.456 42.295 2.702 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -17.003 42.808 2.060 1.00 0.00 H new ATOM 0 HE ARG A 59 -17.459 40.146 2.531 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -16.168 42.759 4.552 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -16.706 42.003 6.056 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -18.137 39.213 4.458 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -17.813 40.010 6.001 1.00 0.00 H new ATOM 937 N ASP A 60 -20.152 42.157 0.027 1.00 0.00 N ATOM 938 CA ASP A 60 -21.232 42.976 0.597 1.00 0.00 C ATOM 939 C ASP A 60 -22.422 42.104 1.059 1.00 0.00 C ATOM 940 O ASP A 60 -23.208 42.519 1.924 1.00 0.00 O ATOM 941 CB ASP A 60 -21.689 44.030 -0.445 1.00 0.00 C ATOM 942 CG ASP A 60 -22.742 45.012 0.100 1.00 0.00 C ATOM 943 OD1 ASP A 60 -22.394 45.844 0.960 1.00 0.00 O ATOM 944 OD2 ASP A 60 -23.916 44.956 -0.319 1.00 0.00 O ATOM 0 H ASP A 60 -20.011 42.307 -0.972 1.00 0.00 H new ATOM 0 HA ASP A 60 -20.849 43.488 1.480 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -20.820 44.593 -0.786 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.098 43.516 -1.315 1.00 0.00 H new ATOM 949 N SER A 61 -22.535 40.896 0.479 1.00 0.00 N ATOM 950 CA SER A 61 -23.593 39.935 0.810 1.00 0.00 C ATOM 951 C SER A 61 -23.292 39.230 2.153 1.00 0.00 C ATOM 952 O SER A 61 -22.127 39.104 2.563 1.00 0.00 O ATOM 953 CB SER A 61 -23.740 38.903 -0.334 1.00 0.00 C ATOM 954 OG SER A 61 -24.883 38.080 -0.156 1.00 0.00 O ATOM 0 H SER A 61 -21.890 40.561 -0.236 1.00 0.00 H new ATOM 0 HA SER A 61 -24.535 40.472 0.921 1.00 0.00 H new ATOM 0 HB2 SER A 61 -23.813 39.425 -1.288 1.00 0.00 H new ATOM 0 HB3 SER A 61 -22.847 38.280 -0.379 1.00 0.00 H new ATOM 0 HG SER A 61 -25.227 37.804 -1.031 1.00 0.00 H new ATOM 960 N ASN A 62 -24.366 38.798 2.829 1.00 0.00 N ATOM 961 CA ASN A 62 -24.294 38.056 4.099 1.00 0.00 C ATOM 962 C ASN A 62 -23.832 36.606 3.820 1.00 0.00 C ATOM 963 O ASN A 62 -24.426 35.960 2.965 1.00 0.00 O ATOM 964 CB ASN A 62 -25.703 38.089 4.777 1.00 0.00 C ATOM 965 CG ASN A 62 -25.841 37.262 6.058 1.00 0.00 C ATOM 966 OD1 ASN A 62 -24.882 37.018 6.779 1.00 0.00 O ATOM 967 ND2 ASN A 62 -27.061 36.857 6.375 1.00 0.00 N ATOM 0 H ASN A 62 -25.321 38.955 2.507 1.00 0.00 H new ATOM 0 HA ASN A 62 -23.571 38.513 4.775 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -25.952 39.125 5.006 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -26.441 37.736 4.057 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -27.216 36.331 7.235 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -27.846 37.071 5.760 1.00 0.00 H new ATOM 974 N PRO A 63 -22.758 36.078 4.521 1.00 0.00 N ATOM 975 CA PRO A 63 -22.251 34.672 4.358 1.00 0.00 C ATOM 976 C PRO A 63 -23.335 33.565 4.527 1.00 0.00 C ATOM 977 O PRO A 63 -23.121 32.419 4.106 1.00 0.00 O ATOM 978 CB PRO A 63 -21.145 34.559 5.457 1.00 0.00 C ATOM 979 CG PRO A 63 -21.411 35.714 6.380 1.00 0.00 C ATOM 980 CD PRO A 63 -21.922 36.817 5.499 1.00 0.00 C ATOM 0 HA PRO A 63 -21.892 34.504 3.343 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.206 33.607 5.985 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.147 34.620 5.023 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -22.144 35.448 7.142 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -20.504 36.017 6.903 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -22.503 37.549 6.060 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -21.110 37.359 5.013 1.00 0.00 H new ATOM 988 N GLU A 64 -24.464 33.905 5.175 1.00 0.00 N ATOM 989 CA GLU A 64 -25.640 33.013 5.280 1.00 0.00 C ATOM 990 C GLU A 64 -26.411 32.979 3.939 1.00 0.00 C ATOM 991 O GLU A 64 -26.776 31.910 3.435 1.00 0.00 O ATOM 992 CB GLU A 64 -26.575 33.523 6.410 1.00 0.00 C ATOM 993 CG GLU A 64 -25.916 33.567 7.809 1.00 0.00 C ATOM 994 CD GLU A 64 -26.740 34.361 8.843 1.00 0.00 C ATOM 995 OE1 GLU A 64 -27.728 33.823 9.371 1.00 0.00 O ATOM 996 OE2 GLU A 64 -26.405 35.533 9.122 1.00 0.00 O ATOM 0 H GLU A 64 -24.590 34.804 5.641 1.00 0.00 H new ATOM 0 HA GLU A 64 -25.301 32.004 5.513 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -26.923 34.523 6.154 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -27.455 32.881 6.455 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -25.776 32.548 8.170 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -24.925 34.013 7.723 1.00 0.00 H new ATOM 1003 N GLU A 65 -26.629 34.178 3.368 1.00 0.00 N ATOM 1004 CA GLU A 65 -27.500 34.390 2.182 1.00 0.00 C ATOM 1005 C GLU A 65 -26.684 34.604 0.886 1.00 0.00 C ATOM 1006 O GLU A 65 -27.258 34.942 -0.159 1.00 0.00 O ATOM 1007 CB GLU A 65 -28.411 35.622 2.436 1.00 0.00 C ATOM 1008 CG GLU A 65 -29.287 35.523 3.704 1.00 0.00 C ATOM 1009 CD GLU A 65 -30.123 36.789 3.950 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -31.267 36.874 3.459 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -29.618 37.723 4.607 1.00 0.00 O ATOM 0 H GLU A 65 -26.205 35.038 3.715 1.00 0.00 H new ATOM 0 HA GLU A 65 -28.100 33.491 2.042 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -27.785 36.511 2.511 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -29.060 35.762 1.572 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -29.953 34.665 3.614 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -28.648 35.341 4.568 1.00 0.00 H new ATOM 1018 N ILE A 66 -25.360 34.390 0.952 1.00 0.00 N ATOM 1019 CA ILE A 66 -24.448 34.642 -0.182 1.00 0.00 C ATOM 1020 C ILE A 66 -24.654 33.600 -1.299 1.00 0.00 C ATOM 1021 O ILE A 66 -24.850 32.401 -1.034 1.00 0.00 O ATOM 1022 CB ILE A 66 -22.938 34.646 0.282 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -21.994 35.077 -0.894 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -22.521 33.264 0.866 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -20.525 35.165 -0.540 1.00 0.00 C ATOM 0 H ILE A 66 -24.891 34.039 1.787 1.00 0.00 H new ATOM 0 HA ILE A 66 -24.688 35.630 -0.576 1.00 0.00 H new ATOM 0 HB ILE A 66 -22.835 35.381 1.080 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -22.112 34.367 -1.713 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -22.321 36.049 -1.264 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -21.477 33.300 1.176 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -23.147 33.029 1.727 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -22.647 32.494 0.105 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -19.957 35.470 -1.419 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -20.386 35.898 0.255 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -20.173 34.191 -0.201 1.00 0.00 H new ATOM 1037 N GLU A 67 -24.627 34.070 -2.549 1.00 0.00 N ATOM 1038 CA GLU A 67 -24.690 33.205 -3.723 1.00 0.00 C ATOM 1039 C GLU A 67 -23.287 32.853 -4.204 1.00 0.00 C ATOM 1040 O GLU A 67 -22.486 33.727 -4.555 1.00 0.00 O ATOM 1041 CB GLU A 67 -25.522 33.859 -4.858 1.00 0.00 C ATOM 1042 CG GLU A 67 -27.042 33.708 -4.671 1.00 0.00 C ATOM 1043 CD GLU A 67 -27.477 32.236 -4.519 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -28.040 31.864 -3.466 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -27.238 31.433 -5.453 1.00 0.00 O ATOM 0 H GLU A 67 -24.561 35.063 -2.772 1.00 0.00 H new ATOM 0 HA GLU A 67 -25.194 32.282 -3.437 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -25.275 34.919 -4.914 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -25.235 33.414 -5.811 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -27.353 34.268 -3.789 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -27.555 34.148 -5.526 1.00 0.00 H new ATOM 1052 N ILE A 68 -23.011 31.548 -4.226 1.00 0.00 N ATOM 1053 CA ILE A 68 -21.758 30.996 -4.741 1.00 0.00 C ATOM 1054 C ILE A 68 -22.077 30.225 -6.040 1.00 0.00 C ATOM 1055 O ILE A 68 -22.355 29.018 -6.063 1.00 0.00 O ATOM 1056 CB ILE A 68 -21.010 30.123 -3.650 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -21.884 28.930 -3.112 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -20.558 31.037 -2.470 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -21.143 27.981 -2.182 1.00 0.00 C ATOM 0 H ILE A 68 -23.658 30.838 -3.883 1.00 0.00 H new ATOM 0 HA ILE A 68 -21.056 31.795 -4.977 1.00 0.00 H new ATOM 0 HB ILE A 68 -20.141 29.677 -4.133 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -22.747 29.336 -2.585 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -22.266 28.363 -3.961 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -20.044 30.436 -1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -19.882 31.806 -2.844 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -21.432 31.509 -2.020 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -21.818 27.189 -1.858 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.296 27.543 -2.709 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -20.784 28.531 -1.312 1.00 0.00 H new ATOM 1071 N ASP A 69 -22.077 30.986 -7.137 1.00 0.00 N ATOM 1072 CA ASP A 69 -22.444 30.501 -8.474 1.00 0.00 C ATOM 1073 C ASP A 69 -21.199 30.537 -9.356 1.00 0.00 C ATOM 1074 O ASP A 69 -20.653 31.610 -9.618 1.00 0.00 O ATOM 1075 CB ASP A 69 -23.593 31.374 -9.054 1.00 0.00 C ATOM 1076 CG ASP A 69 -23.972 31.003 -10.499 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -23.525 31.688 -11.443 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -24.705 30.008 -10.694 1.00 0.00 O ATOM 0 H ASP A 69 -21.818 31.973 -7.123 1.00 0.00 H new ATOM 0 HA ASP A 69 -22.810 29.475 -8.428 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -24.473 31.273 -8.418 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -23.295 32.422 -9.022 1.00 0.00 H new ATOM 1083 N PHE A 70 -20.783 29.362 -9.830 1.00 0.00 N ATOM 1084 CA PHE A 70 -19.483 29.163 -10.500 1.00 0.00 C ATOM 1085 C PHE A 70 -19.416 29.844 -11.881 1.00 0.00 C ATOM 1086 O PHE A 70 -18.341 29.926 -12.477 1.00 0.00 O ATOM 1087 CB PHE A 70 -19.183 27.643 -10.602 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.114 26.945 -9.233 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -17.895 26.734 -8.586 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -20.277 26.531 -8.582 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -17.843 26.129 -7.345 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -20.225 25.929 -7.347 1.00 0.00 C ATOM 1093 CZ PHE A 70 -19.010 25.727 -6.723 1.00 0.00 C ATOM 0 H PHE A 70 -21.339 28.510 -9.762 1.00 0.00 H new ATOM 0 HA PHE A 70 -18.714 29.643 -9.894 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -19.955 27.167 -11.207 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -18.236 27.500 -11.123 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -16.979 27.049 -9.063 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.235 26.686 -9.057 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -16.891 25.970 -6.861 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -21.138 25.613 -6.863 1.00 0.00 H new ATOM 0 HZ PHE A 70 -18.972 25.256 -5.752 1.00 0.00 H new ATOM 1103 N GLU A 71 -20.570 30.333 -12.374 1.00 0.00 N ATOM 1104 CA GLU A 71 -20.642 31.093 -13.634 1.00 0.00 C ATOM 1105 C GLU A 71 -20.409 32.597 -13.383 1.00 0.00 C ATOM 1106 O GLU A 71 -19.687 33.249 -14.146 1.00 0.00 O ATOM 1107 CB GLU A 71 -22.010 30.872 -14.332 1.00 0.00 C ATOM 1108 CG GLU A 71 -22.346 29.397 -14.638 1.00 0.00 C ATOM 1109 CD GLU A 71 -23.632 29.232 -15.470 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -24.687 28.880 -14.909 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -23.590 29.473 -16.693 1.00 0.00 O ATOM 0 H GLU A 71 -21.472 30.213 -11.913 1.00 0.00 H new ATOM 0 HA GLU A 71 -19.853 30.727 -14.291 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -22.796 31.286 -13.701 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -22.021 31.434 -15.266 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -21.512 28.944 -15.175 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -22.455 28.853 -13.700 1.00 0.00 H new ATOM 1118 N THR A 72 -21.028 33.142 -12.312 1.00 0.00 N ATOM 1119 CA THR A 72 -20.942 34.584 -11.985 1.00 0.00 C ATOM 1120 C THR A 72 -19.588 34.919 -11.332 1.00 0.00 C ATOM 1121 O THR A 72 -19.127 36.053 -11.424 1.00 0.00 O ATOM 1122 CB THR A 72 -22.119 35.068 -11.051 1.00 0.00 C ATOM 1123 OG1 THR A 72 -22.198 36.507 -11.056 1.00 0.00 O ATOM 1124 CG2 THR A 72 -21.970 34.588 -9.588 1.00 0.00 C ATOM 0 H THR A 72 -21.595 32.603 -11.657 1.00 0.00 H new ATOM 0 HA THR A 72 -21.032 35.119 -12.931 1.00 0.00 H new ATOM 0 HB THR A 72 -23.029 34.627 -11.457 1.00 0.00 H new ATOM 0 HG1 THR A 72 -22.932 36.796 -10.475 1.00 0.00 H new ATOM 0 HG21 THR A 72 -22.810 34.954 -8.998 1.00 0.00 H new ATOM 0 HG22 THR A 72 -21.955 33.498 -9.562 1.00 0.00 H new ATOM 0 HG23 THR A 72 -21.039 34.973 -9.172 1.00 0.00 H new ATOM 1132 N LEU A 73 -18.977 33.917 -10.664 1.00 0.00 N ATOM 1133 CA LEU A 73 -17.664 34.064 -10.014 1.00 0.00 C ATOM 1134 C LEU A 73 -16.536 33.877 -11.044 1.00 0.00 C ATOM 1135 O LEU A 73 -16.710 33.169 -12.048 1.00 0.00 O ATOM 1136 CB LEU A 73 -17.504 33.041 -8.851 1.00 0.00 C ATOM 1137 CG LEU A 73 -18.588 33.086 -7.718 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -18.334 32.003 -6.635 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -18.695 34.492 -7.091 1.00 0.00 C ATOM 0 H LEU A 73 -19.382 32.986 -10.562 1.00 0.00 H new ATOM 0 HA LEU A 73 -17.600 35.069 -9.598 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -17.500 32.038 -9.278 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.527 33.196 -8.393 1.00 0.00 H new ATOM 0 HG LEU A 73 -19.547 32.860 -8.184 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -19.106 32.067 -5.868 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -18.361 31.015 -7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -17.357 32.165 -6.180 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -19.456 34.485 -6.310 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -17.734 34.772 -6.659 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -18.971 35.213 -7.860 1.00 0.00 H new ATOM 1151 N LYS A 74 -15.388 34.519 -10.779 1.00 0.00 N ATOM 1152 CA LYS A 74 -14.175 34.398 -11.611 1.00 0.00 C ATOM 1153 C LYS A 74 -13.537 32.997 -11.463 1.00 0.00 C ATOM 1154 O LYS A 74 -13.550 32.449 -10.359 1.00 0.00 O ATOM 1155 CB LYS A 74 -13.158 35.498 -11.206 1.00 0.00 C ATOM 1156 CG LYS A 74 -13.591 36.938 -11.588 1.00 0.00 C ATOM 1157 CD LYS A 74 -12.596 38.017 -11.088 1.00 0.00 C ATOM 1158 CE LYS A 74 -11.146 37.776 -11.551 1.00 0.00 C ATOM 1159 NZ LYS A 74 -10.203 38.766 -10.968 1.00 0.00 N ATOM 0 H LYS A 74 -15.272 35.140 -9.978 1.00 0.00 H new ATOM 0 HA LYS A 74 -14.454 34.529 -12.656 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -13.000 35.452 -10.128 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.199 35.282 -11.678 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -13.683 37.009 -12.672 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -14.578 37.139 -11.170 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.924 38.995 -11.441 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -12.621 38.047 -9.999 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.837 36.770 -11.267 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -11.099 37.828 -12.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -9.239 38.568 -11.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -10.482 39.725 -11.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -10.227 38.699 -9.930 1.00 0.00 H new ATOM 1173 N PRO A 75 -12.962 32.401 -12.571 1.00 0.00 N ATOM 1174 CA PRO A 75 -12.254 31.086 -12.519 1.00 0.00 C ATOM 1175 C PRO A 75 -11.087 31.045 -11.494 1.00 0.00 C ATOM 1176 O PRO A 75 -10.707 29.967 -11.036 1.00 0.00 O ATOM 1177 CB PRO A 75 -11.743 30.886 -13.975 1.00 0.00 C ATOM 1178 CG PRO A 75 -12.658 31.723 -14.816 1.00 0.00 C ATOM 1179 CD PRO A 75 -12.988 32.932 -13.965 1.00 0.00 C ATOM 0 HA PRO A 75 -12.918 30.291 -12.178 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -10.706 31.206 -14.079 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -11.784 29.837 -14.269 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -12.176 32.018 -15.748 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -13.560 31.172 -15.084 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -12.259 33.730 -14.103 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -13.964 33.345 -14.218 1.00 0.00 H new ATOM 1187 N SER A 76 -10.539 32.232 -11.172 1.00 0.00 N ATOM 1188 CA SER A 76 -9.540 32.418 -10.099 1.00 0.00 C ATOM 1189 C SER A 76 -10.137 32.040 -8.722 1.00 0.00 C ATOM 1190 O SER A 76 -9.531 31.290 -7.933 1.00 0.00 O ATOM 1191 CB SER A 76 -9.087 33.898 -10.096 1.00 0.00 C ATOM 1192 OG SER A 76 -8.687 34.322 -11.391 1.00 0.00 O ATOM 0 H SER A 76 -10.779 33.099 -11.654 1.00 0.00 H new ATOM 0 HA SER A 76 -8.686 31.767 -10.283 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.902 34.528 -9.741 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.259 34.025 -9.398 1.00 0.00 H new ATOM 0 HG SER A 76 -8.408 35.261 -11.356 1.00 0.00 H new ATOM 1198 N THR A 77 -11.344 32.578 -8.473 1.00 0.00 N ATOM 1199 CA THR A 77 -12.123 32.324 -7.254 1.00 0.00 C ATOM 1200 C THR A 77 -12.549 30.842 -7.187 1.00 0.00 C ATOM 1201 O THR A 77 -12.533 30.238 -6.112 1.00 0.00 O ATOM 1202 CB THR A 77 -13.374 33.268 -7.220 1.00 0.00 C ATOM 1203 OG1 THR A 77 -12.938 34.620 -7.449 1.00 0.00 O ATOM 1204 CG2 THR A 77 -14.144 33.196 -5.886 1.00 0.00 C ATOM 0 H THR A 77 -11.810 33.210 -9.124 1.00 0.00 H new ATOM 0 HA THR A 77 -11.503 32.535 -6.382 1.00 0.00 H new ATOM 0 HB THR A 77 -14.060 32.937 -8.000 1.00 0.00 H new ATOM 0 HG1 THR A 77 -12.027 34.732 -7.106 1.00 0.00 H new ATOM 0 HG21 THR A 77 -14.999 33.871 -5.923 1.00 0.00 H new ATOM 0 HG22 THR A 77 -14.493 32.177 -5.722 1.00 0.00 H new ATOM 0 HG23 THR A 77 -13.485 33.489 -5.069 1.00 0.00 H new ATOM 1212 N LEU A 78 -12.896 30.272 -8.364 1.00 0.00 N ATOM 1213 CA LEU A 78 -13.223 28.837 -8.511 1.00 0.00 C ATOM 1214 C LEU A 78 -12.027 27.945 -8.122 1.00 0.00 C ATOM 1215 O LEU A 78 -12.223 26.920 -7.473 1.00 0.00 O ATOM 1216 CB LEU A 78 -13.682 28.507 -9.974 1.00 0.00 C ATOM 1217 CG LEU A 78 -15.201 28.683 -10.310 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -15.699 30.119 -10.054 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -15.498 28.235 -11.771 1.00 0.00 C ATOM 0 H LEU A 78 -12.957 30.795 -9.238 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.048 28.625 -7.830 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.111 29.137 -10.656 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.407 27.474 -10.188 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.756 28.036 -9.631 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.758 30.187 -10.303 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -15.556 30.372 -9.003 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -15.135 30.816 -10.674 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.559 28.366 -11.983 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -14.912 28.840 -12.463 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -15.231 27.185 -11.891 1.00 0.00 H new ATOM 1231 N ARG A 79 -10.806 28.350 -8.548 1.00 0.00 N ATOM 1232 CA ARG A 79 -9.558 27.593 -8.299 1.00 0.00 C ATOM 1233 C ARG A 79 -9.306 27.408 -6.798 1.00 0.00 C ATOM 1234 O ARG A 79 -9.119 26.277 -6.324 1.00 0.00 O ATOM 1235 CB ARG A 79 -8.315 28.285 -8.966 1.00 0.00 C ATOM 1236 CG ARG A 79 -8.076 27.950 -10.457 1.00 0.00 C ATOM 1237 CD ARG A 79 -7.951 26.424 -10.716 1.00 0.00 C ATOM 1238 NE ARG A 79 -7.168 25.715 -9.667 1.00 0.00 N ATOM 1239 CZ ARG A 79 -7.406 24.451 -9.244 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -8.240 23.654 -9.899 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -6.783 23.979 -8.173 1.00 0.00 N ATOM 0 H ARG A 79 -10.660 29.212 -9.074 1.00 0.00 H new ATOM 0 HA ARG A 79 -9.691 26.612 -8.755 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -8.429 29.365 -8.870 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.424 28.007 -8.404 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -8.898 28.349 -11.051 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -7.167 28.447 -10.796 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -8.949 25.988 -10.773 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.478 26.264 -11.685 1.00 0.00 H new ATOM 0 HE ARG A 79 -6.394 26.219 -9.234 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -8.715 23.990 -10.737 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -8.406 22.705 -9.565 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -6.123 24.568 -7.666 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -6.964 23.026 -7.856 1.00 0.00 H new ATOM 1255 N GLU A 80 -9.312 28.532 -6.066 1.00 0.00 N ATOM 1256 CA GLU A 80 -9.036 28.536 -4.622 1.00 0.00 C ATOM 1257 C GLU A 80 -10.163 27.837 -3.837 1.00 0.00 C ATOM 1258 O GLU A 80 -9.891 27.119 -2.868 1.00 0.00 O ATOM 1259 CB GLU A 80 -8.823 29.990 -4.138 1.00 0.00 C ATOM 1260 CG GLU A 80 -8.444 30.130 -2.644 1.00 0.00 C ATOM 1261 CD GLU A 80 -7.987 31.550 -2.270 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -8.837 32.454 -2.172 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -6.771 31.772 -2.093 1.00 0.00 O ATOM 0 H GLU A 80 -9.506 29.455 -6.454 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.123 27.971 -4.435 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.039 30.447 -4.741 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.736 30.556 -4.321 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -9.302 29.857 -2.030 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.647 29.424 -2.409 1.00 0.00 H new ATOM 1270 N LEU A 81 -11.414 28.035 -4.293 1.00 0.00 N ATOM 1271 CA LEU A 81 -12.616 27.439 -3.673 1.00 0.00 C ATOM 1272 C LEU A 81 -12.577 25.895 -3.741 1.00 0.00 C ATOM 1273 O LEU A 81 -12.675 25.227 -2.713 1.00 0.00 O ATOM 1274 CB LEU A 81 -13.905 27.988 -4.357 1.00 0.00 C ATOM 1275 CG LEU A 81 -15.268 27.390 -3.875 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -15.454 27.560 -2.349 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -16.457 28.009 -4.653 1.00 0.00 C ATOM 0 H LEU A 81 -11.622 28.615 -5.106 1.00 0.00 H new ATOM 0 HA LEU A 81 -12.630 27.723 -2.621 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -13.936 29.067 -4.208 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.819 27.817 -5.430 1.00 0.00 H new ATOM 0 HG LEU A 81 -15.249 26.321 -4.087 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -16.411 27.133 -2.049 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -14.648 27.047 -1.825 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -15.434 28.620 -2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -17.391 27.574 -4.297 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -16.474 29.087 -4.493 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -16.343 27.802 -5.717 1.00 0.00 H new ATOM 1289 N GLU A 82 -12.401 25.354 -4.962 1.00 0.00 N ATOM 1290 CA GLU A 82 -12.491 23.900 -5.222 1.00 0.00 C ATOM 1291 C GLU A 82 -11.368 23.134 -4.506 1.00 0.00 C ATOM 1292 O GLU A 82 -11.593 22.039 -4.004 1.00 0.00 O ATOM 1293 CB GLU A 82 -12.507 23.595 -6.751 1.00 0.00 C ATOM 1294 CG GLU A 82 -11.184 23.875 -7.527 1.00 0.00 C ATOM 1295 CD GLU A 82 -10.376 22.615 -7.903 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -9.385 22.290 -7.218 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -10.719 21.957 -8.908 1.00 0.00 O ATOM 0 H GLU A 82 -12.193 25.907 -5.793 1.00 0.00 H new ATOM 0 HA GLU A 82 -13.438 23.550 -4.811 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -12.768 22.545 -6.887 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.303 24.183 -7.209 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.423 24.422 -8.439 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -10.554 24.526 -6.921 1.00 0.00 H new ATOM 1304 N ARG A 83 -10.173 23.753 -4.458 1.00 0.00 N ATOM 1305 CA ARG A 83 -8.992 23.197 -3.779 1.00 0.00 C ATOM 1306 C ARG A 83 -9.254 23.141 -2.257 1.00 0.00 C ATOM 1307 O ARG A 83 -8.997 22.118 -1.619 1.00 0.00 O ATOM 1308 CB ARG A 83 -7.734 24.064 -4.138 1.00 0.00 C ATOM 1309 CG ARG A 83 -6.331 23.449 -3.823 1.00 0.00 C ATOM 1310 CD ARG A 83 -5.949 23.471 -2.328 1.00 0.00 C ATOM 1311 NE ARG A 83 -4.561 23.012 -2.114 1.00 0.00 N ATOM 1312 CZ ARG A 83 -4.085 22.431 -0.997 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -4.879 22.156 0.029 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -2.796 22.105 -0.922 1.00 0.00 N ATOM 0 H ARG A 83 -10.001 24.659 -4.893 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.798 22.178 -4.115 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.772 24.291 -5.203 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -7.814 25.013 -3.607 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -6.312 22.418 -4.176 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.574 23.993 -4.387 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -6.062 24.482 -1.938 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -6.634 22.834 -1.768 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.904 23.148 -2.882 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.872 22.385 -0.019 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.497 21.715 0.866 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -2.175 22.296 -1.708 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.430 21.665 -0.078 1.00 0.00 H new ATOM 1328 N TYR A 84 -9.796 24.246 -1.713 1.00 0.00 N ATOM 1329 CA TYR A 84 -10.013 24.433 -0.263 1.00 0.00 C ATOM 1330 C TYR A 84 -11.024 23.404 0.282 1.00 0.00 C ATOM 1331 O TYR A 84 -10.800 22.773 1.323 1.00 0.00 O ATOM 1332 CB TYR A 84 -10.514 25.887 0.002 1.00 0.00 C ATOM 1333 CG TYR A 84 -10.328 26.385 1.452 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -11.290 26.156 2.443 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -9.173 27.080 1.819 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -11.099 26.596 3.739 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -8.983 27.523 3.110 1.00 0.00 C ATOM 1338 CZ TYR A 84 -9.944 27.279 4.066 1.00 0.00 C ATOM 1339 OH TYR A 84 -9.742 27.717 5.356 1.00 0.00 O ATOM 0 H TYR A 84 -10.099 25.043 -2.272 1.00 0.00 H new ATOM 0 HA TYR A 84 -9.069 24.276 0.258 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.988 26.565 -0.670 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -11.572 25.943 -0.253 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -12.197 25.627 2.190 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.414 27.274 1.076 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -11.849 26.407 4.492 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -8.083 28.060 3.371 1.00 0.00 H new ATOM 0 HH TYR A 84 -8.879 28.178 5.414 1.00 0.00 H new ATOM 1349 N VAL A 85 -12.136 23.254 -0.447 1.00 0.00 N ATOM 1350 CA VAL A 85 -13.227 22.346 -0.077 1.00 0.00 C ATOM 1351 C VAL A 85 -12.802 20.877 -0.272 1.00 0.00 C ATOM 1352 O VAL A 85 -13.082 20.039 0.583 1.00 0.00 O ATOM 1353 CB VAL A 85 -14.537 22.674 -0.892 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -15.709 21.728 -0.515 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -14.942 24.157 -0.691 1.00 0.00 C ATOM 0 H VAL A 85 -12.305 23.762 -1.315 1.00 0.00 H new ATOM 0 HA VAL A 85 -13.450 22.495 0.980 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.317 22.509 -1.947 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.591 21.990 -1.100 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.426 20.697 -0.726 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -15.934 21.832 0.546 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.848 24.367 -1.260 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.127 24.344 0.367 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.137 24.804 -1.039 1.00 0.00 H new ATOM 1365 N LEU A 86 -12.082 20.585 -1.377 1.00 0.00 N ATOM 1366 CA LEU A 86 -11.582 19.216 -1.674 1.00 0.00 C ATOM 1367 C LEU A 86 -10.560 18.744 -0.604 1.00 0.00 C ATOM 1368 O LEU A 86 -10.399 17.541 -0.382 1.00 0.00 O ATOM 1369 CB LEU A 86 -10.952 19.156 -3.091 1.00 0.00 C ATOM 1370 CG LEU A 86 -10.542 17.736 -3.613 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -11.777 16.799 -3.723 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -9.777 17.830 -4.963 1.00 0.00 C ATOM 0 H LEU A 86 -11.831 21.278 -2.082 1.00 0.00 H new ATOM 0 HA LEU A 86 -12.435 18.538 -1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.660 19.588 -3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -10.066 19.791 -3.098 1.00 0.00 H new ATOM 0 HG LEU A 86 -9.862 17.298 -2.882 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -11.461 15.822 -4.088 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -12.238 16.688 -2.742 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -12.499 17.229 -4.417 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -9.507 16.829 -5.298 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -10.414 18.303 -5.710 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -8.873 18.424 -4.828 1.00 0.00 H new ATOM 1384 N SER A 87 -9.890 19.712 0.060 1.00 0.00 N ATOM 1385 CA SER A 87 -8.968 19.435 1.185 1.00 0.00 C ATOM 1386 C SER A 87 -9.740 18.938 2.426 1.00 0.00 C ATOM 1387 O SER A 87 -9.209 18.150 3.209 1.00 0.00 O ATOM 1388 CB SER A 87 -8.150 20.699 1.526 1.00 0.00 C ATOM 1389 OG SER A 87 -7.407 21.138 0.406 1.00 0.00 O ATOM 0 H SER A 87 -9.972 20.703 -0.167 1.00 0.00 H new ATOM 0 HA SER A 87 -8.283 18.645 0.879 1.00 0.00 H new ATOM 0 HB2 SER A 87 -8.820 21.493 1.856 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.475 20.487 2.355 1.00 0.00 H new ATOM 0 HG SER A 87 -8.010 21.561 -0.241 1.00 0.00 H new ATOM 1395 N CYS A 88 -10.996 19.413 2.587 1.00 0.00 N ATOM 1396 CA CYS A 88 -11.882 18.998 3.695 1.00 0.00 C ATOM 1397 C CYS A 88 -12.416 17.574 3.451 1.00 0.00 C ATOM 1398 O CYS A 88 -12.352 16.724 4.341 1.00 0.00 O ATOM 1399 CB CYS A 88 -13.058 19.988 3.870 1.00 0.00 C ATOM 1400 SG CYS A 88 -14.159 19.594 5.253 1.00 0.00 S ATOM 0 H CYS A 88 -11.421 20.092 1.955 1.00 0.00 H new ATOM 0 HA CYS A 88 -11.296 19.002 4.614 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -12.656 20.991 4.014 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -13.642 20.008 2.950 1.00 0.00 H new ATOM 0 HG CYS A 88 -14.671 20.691 5.726 1.00 0.00 H new ATOM 1406 N LEU A 89 -12.919 17.320 2.224 1.00 0.00 N ATOM 1407 CA LEU A 89 -13.477 16.001 1.839 1.00 0.00 C ATOM 1408 C LEU A 89 -12.364 14.939 1.692 1.00 0.00 C ATOM 1409 O LEU A 89 -12.633 13.750 1.862 1.00 0.00 O ATOM 1410 CB LEU A 89 -14.326 16.092 0.528 1.00 0.00 C ATOM 1411 CG LEU A 89 -15.738 16.778 0.640 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -16.602 16.141 1.756 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -15.635 18.302 0.834 1.00 0.00 C ATOM 0 H LEU A 89 -12.951 18.014 1.477 1.00 0.00 H new ATOM 0 HA LEU A 89 -14.140 15.689 2.646 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.743 16.635 -0.216 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -14.469 15.081 0.146 1.00 0.00 H new ATOM 0 HG LEU A 89 -16.237 16.603 -0.313 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -17.568 16.644 1.800 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -16.753 15.083 1.540 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -16.094 16.247 2.715 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -16.636 18.728 0.906 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.083 18.516 1.749 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -15.113 18.742 -0.016 1.00 0.00 H new ATOM 1425 N ARG A 90 -11.129 15.398 1.370 1.00 0.00 N ATOM 1426 CA ARG A 90 -9.916 14.554 1.233 1.00 0.00 C ATOM 1427 C ARG A 90 -10.063 13.465 0.143 1.00 0.00 C ATOM 1428 O ARG A 90 -10.537 12.349 0.431 1.00 0.00 O ATOM 1429 CB ARG A 90 -9.495 13.904 2.593 1.00 0.00 C ATOM 1430 CG ARG A 90 -8.743 14.839 3.564 1.00 0.00 C ATOM 1431 CD ARG A 90 -8.344 14.110 4.858 1.00 0.00 C ATOM 1432 NE ARG A 90 -7.344 14.851 5.649 1.00 0.00 N ATOM 1433 CZ ARG A 90 -6.190 14.335 6.119 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -5.867 13.059 5.905 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -5.354 15.100 6.812 1.00 0.00 N ATOM 0 H ARG A 90 -10.945 16.386 1.195 1.00 0.00 H new ATOM 0 HA ARG A 90 -9.123 15.232 0.916 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -10.390 13.532 3.092 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.864 13.040 2.384 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.850 15.229 3.076 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.373 15.695 3.807 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.234 13.948 5.467 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -7.946 13.127 4.607 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.540 15.830 5.857 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.497 12.455 5.378 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -4.990 12.687 6.269 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.585 16.078 6.989 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -4.481 14.710 7.167 1.00 0.00 H new ATOM 1724 N THR A 106 8.039 14.062 -30.164 1.00 0.00 N ATOM 1725 CA THR A 106 9.319 14.386 -29.521 1.00 0.00 C ATOM 1726 C THR A 106 10.033 15.470 -30.348 1.00 0.00 C ATOM 1727 O THR A 106 9.823 15.560 -31.572 1.00 0.00 O ATOM 1728 CB THR A 106 10.232 13.118 -29.389 1.00 0.00 C ATOM 1729 OG1 THR A 106 9.458 11.994 -28.951 1.00 0.00 O ATOM 1730 CG2 THR A 106 11.394 13.334 -28.413 1.00 0.00 C ATOM 0 HA THR A 106 9.122 14.753 -28.514 1.00 0.00 H new ATOM 0 HB THR A 106 10.651 12.928 -30.377 1.00 0.00 H new ATOM 0 HG1 THR A 106 8.533 12.095 -29.257 1.00 0.00 H new ATOM 0 HG21 THR A 106 11.996 12.427 -28.357 1.00 0.00 H new ATOM 0 HG22 THR A 106 12.014 14.160 -28.762 1.00 0.00 H new ATOM 0 HG23 THR A 106 11.000 13.569 -27.424 1.00 0.00 H new ATOM 1738 N LYS A 107 10.889 16.254 -29.675 1.00 0.00 N ATOM 1739 CA LYS A 107 11.496 17.472 -30.230 1.00 0.00 C ATOM 1740 C LYS A 107 12.324 17.203 -31.500 1.00 0.00 C ATOM 1741 O LYS A 107 12.444 18.078 -32.354 1.00 0.00 O ATOM 1742 CB LYS A 107 12.351 18.168 -29.137 1.00 0.00 C ATOM 1743 CG LYS A 107 11.593 18.429 -27.811 1.00 0.00 C ATOM 1744 CD LYS A 107 10.317 19.283 -28.002 1.00 0.00 C ATOM 1745 CE LYS A 107 9.529 19.462 -26.695 1.00 0.00 C ATOM 1746 NZ LYS A 107 8.330 20.316 -26.880 1.00 0.00 N ATOM 0 H LYS A 107 11.182 16.057 -28.718 1.00 0.00 H new ATOM 0 HA LYS A 107 10.688 18.136 -30.537 1.00 0.00 H new ATOM 0 HB2 LYS A 107 13.225 17.552 -28.928 1.00 0.00 H new ATOM 0 HB3 LYS A 107 12.716 19.118 -29.527 1.00 0.00 H new ATOM 0 HG2 LYS A 107 11.321 17.474 -27.361 1.00 0.00 H new ATOM 0 HG3 LYS A 107 12.259 18.933 -27.111 1.00 0.00 H new ATOM 0 HD2 LYS A 107 10.594 20.262 -28.393 1.00 0.00 H new ATOM 0 HD3 LYS A 107 9.676 18.812 -28.747 1.00 0.00 H new ATOM 0 HE2 LYS A 107 9.224 18.485 -26.319 1.00 0.00 H new ATOM 0 HE3 LYS A 107 10.177 19.906 -25.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 7.828 20.410 -25.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 8.622 21.257 -27.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 7.698 19.880 -27.582 1.00 0.00 H new ATOM 1760 N GLU A 108 12.852 15.979 -31.625 1.00 0.00 N ATOM 1761 CA GLU A 108 13.687 15.569 -32.769 1.00 0.00 C ATOM 1762 C GLU A 108 12.845 15.416 -34.055 1.00 0.00 C ATOM 1763 O GLU A 108 13.253 15.904 -35.113 1.00 0.00 O ATOM 1764 CB GLU A 108 14.453 14.256 -32.448 1.00 0.00 C ATOM 1765 CG GLU A 108 15.578 14.389 -31.384 1.00 0.00 C ATOM 1766 CD GLU A 108 15.094 14.843 -29.991 1.00 0.00 C ATOM 1767 OE1 GLU A 108 15.238 16.041 -29.650 1.00 0.00 O ATOM 1768 OE2 GLU A 108 14.544 14.010 -29.248 1.00 0.00 O ATOM 0 H GLU A 108 12.714 15.240 -30.935 1.00 0.00 H new ATOM 0 HA GLU A 108 14.419 16.357 -32.946 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.736 13.511 -32.104 1.00 0.00 H new ATOM 0 HB3 GLU A 108 14.891 13.875 -33.371 1.00 0.00 H new ATOM 0 HG2 GLU A 108 16.081 13.427 -31.284 1.00 0.00 H new ATOM 0 HG3 GLU A 108 16.320 15.100 -31.746 1.00 0.00 H new ATOM 1775 N GLU A 109 11.667 14.747 -33.953 1.00 0.00 N ATOM 1776 CA GLU A 109 10.760 14.556 -35.111 1.00 0.00 C ATOM 1777 C GLU A 109 10.338 15.916 -35.686 1.00 0.00 C ATOM 1778 O GLU A 109 10.640 16.231 -36.842 1.00 0.00 O ATOM 1779 CB GLU A 109 9.488 13.720 -34.756 1.00 0.00 C ATOM 1780 CG GLU A 109 9.743 12.236 -34.383 1.00 0.00 C ATOM 1781 CD GLU A 109 10.053 12.013 -32.899 1.00 0.00 C ATOM 1782 OE1 GLU A 109 11.243 12.017 -32.510 1.00 0.00 O ATOM 1783 OE2 GLU A 109 9.094 11.833 -32.119 1.00 0.00 O ATOM 0 H GLU A 109 11.326 14.334 -33.085 1.00 0.00 H new ATOM 0 HA GLU A 109 11.321 13.992 -35.856 1.00 0.00 H new ATOM 0 HB2 GLU A 109 8.979 14.203 -33.922 1.00 0.00 H new ATOM 0 HB3 GLU A 109 8.807 13.750 -35.606 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.866 11.648 -34.653 1.00 0.00 H new ATOM 0 HG3 GLU A 109 10.575 11.860 -34.978 1.00 0.00 H new ATOM 1790 N LEU A 110 9.709 16.738 -34.823 1.00 0.00 N ATOM 1791 CA LEU A 110 9.159 18.052 -35.209 1.00 0.00 C ATOM 1792 C LEU A 110 10.263 19.030 -35.658 1.00 0.00 C ATOM 1793 O LEU A 110 9.984 19.947 -36.429 1.00 0.00 O ATOM 1794 CB LEU A 110 8.277 18.627 -34.061 1.00 0.00 C ATOM 1795 CG LEU A 110 8.934 18.782 -32.638 1.00 0.00 C ATOM 1796 CD1 LEU A 110 9.705 20.117 -32.475 1.00 0.00 C ATOM 1797 CD2 LEU A 110 7.886 18.612 -31.518 1.00 0.00 C ATOM 0 H LEU A 110 9.568 16.509 -33.839 1.00 0.00 H new ATOM 0 HA LEU A 110 8.517 17.913 -36.079 1.00 0.00 H new ATOM 0 HB2 LEU A 110 7.919 19.608 -34.373 1.00 0.00 H new ATOM 0 HB3 LEU A 110 7.402 17.986 -33.958 1.00 0.00 H new ATOM 0 HG LEU A 110 9.669 17.982 -32.549 1.00 0.00 H new ATOM 0 HD11 LEU A 110 10.136 20.168 -31.475 1.00 0.00 H new ATOM 0 HD12 LEU A 110 10.502 20.170 -33.217 1.00 0.00 H new ATOM 0 HD13 LEU A 110 9.020 20.953 -32.618 1.00 0.00 H new ATOM 0 HD21 LEU A 110 8.369 18.724 -30.547 1.00 0.00 H new ATOM 0 HD22 LEU A 110 7.111 19.370 -31.627 1.00 0.00 H new ATOM 0 HD23 LEU A 110 7.437 17.621 -31.587 1.00 0.00 H new ATOM 1809 N ALA A 111 11.517 18.806 -35.189 1.00 0.00 N ATOM 1810 CA ALA A 111 12.692 19.583 -35.640 1.00 0.00 C ATOM 1811 C ALA A 111 12.912 19.403 -37.148 1.00 0.00 C ATOM 1812 O ALA A 111 13.009 20.384 -37.888 1.00 0.00 O ATOM 1813 CB ALA A 111 13.956 19.184 -34.854 1.00 0.00 C ATOM 0 H ALA A 111 11.737 18.090 -34.496 1.00 0.00 H new ATOM 0 HA ALA A 111 12.494 20.637 -35.444 1.00 0.00 H new ATOM 0 HB1 ALA A 111 14.804 19.771 -35.207 1.00 0.00 H new ATOM 0 HB2 ALA A 111 13.799 19.374 -33.792 1.00 0.00 H new ATOM 0 HB3 ALA A 111 14.160 18.124 -35.007 1.00 0.00 H new ATOM 1819 N LEU A 112 12.952 18.135 -37.584 1.00 0.00 N ATOM 1820 CA LEU A 112 13.152 17.782 -39.002 1.00 0.00 C ATOM 1821 C LEU A 112 11.918 18.133 -39.862 1.00 0.00 C ATOM 1822 O LEU A 112 12.067 18.398 -41.052 1.00 0.00 O ATOM 1823 CB LEU A 112 13.533 16.273 -39.155 1.00 0.00 C ATOM 1824 CG LEU A 112 15.032 15.898 -38.881 1.00 0.00 C ATOM 1825 CD1 LEU A 112 15.987 16.701 -39.798 1.00 0.00 C ATOM 1826 CD2 LEU A 112 15.412 16.056 -37.392 1.00 0.00 C ATOM 0 H LEU A 112 12.848 17.328 -36.969 1.00 0.00 H new ATOM 0 HA LEU A 112 13.984 18.382 -39.371 1.00 0.00 H new ATOM 0 HB2 LEU A 112 12.907 15.693 -38.477 1.00 0.00 H new ATOM 0 HB3 LEU A 112 13.282 15.959 -40.168 1.00 0.00 H new ATOM 0 HG LEU A 112 15.146 14.841 -39.123 1.00 0.00 H new ATOM 0 HD11 LEU A 112 17.018 16.420 -39.585 1.00 0.00 H new ATOM 0 HD12 LEU A 112 15.759 16.482 -40.841 1.00 0.00 H new ATOM 0 HD13 LEU A 112 15.857 17.767 -39.614 1.00 0.00 H new ATOM 0 HD21 LEU A 112 16.459 15.785 -37.253 1.00 0.00 H new ATOM 0 HD22 LEU A 112 15.262 17.091 -37.086 1.00 0.00 H new ATOM 0 HD23 LEU A 112 14.784 15.403 -36.785 1.00 0.00 H new ATOM 1838 N GLU A 113 10.710 18.133 -39.254 1.00 0.00 N ATOM 1839 CA GLU A 113 9.456 18.484 -39.960 1.00 0.00 C ATOM 1840 C GLU A 113 9.411 19.987 -40.302 1.00 0.00 C ATOM 1841 O GLU A 113 9.015 20.376 -41.407 1.00 0.00 O ATOM 1842 CB GLU A 113 8.221 18.070 -39.114 1.00 0.00 C ATOM 1843 CG GLU A 113 8.111 16.552 -38.847 1.00 0.00 C ATOM 1844 CD GLU A 113 8.029 15.718 -40.141 1.00 0.00 C ATOM 1845 OE1 GLU A 113 6.925 15.612 -40.714 1.00 0.00 O ATOM 1846 OE2 GLU A 113 9.059 15.170 -40.591 1.00 0.00 O ATOM 0 H GLU A 113 10.577 17.893 -38.272 1.00 0.00 H new ATOM 0 HA GLU A 113 9.430 17.931 -40.899 1.00 0.00 H new ATOM 0 HB2 GLU A 113 8.258 18.593 -38.158 1.00 0.00 H new ATOM 0 HB3 GLU A 113 7.318 18.403 -39.625 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.974 16.227 -38.266 1.00 0.00 H new ATOM 0 HG3 GLU A 113 7.227 16.358 -38.240 1.00 0.00 H new ATOM 1853 N LYS A 114 9.832 20.824 -39.347 1.00 0.00 N ATOM 1854 CA LYS A 114 9.910 22.282 -39.555 1.00 0.00 C ATOM 1855 C LYS A 114 11.106 22.641 -40.453 1.00 0.00 C ATOM 1856 O LYS A 114 11.021 23.571 -41.261 1.00 0.00 O ATOM 1857 CB LYS A 114 9.983 23.028 -38.203 1.00 0.00 C ATOM 1858 CG LYS A 114 8.765 22.788 -37.277 1.00 0.00 C ATOM 1859 CD LYS A 114 7.427 23.229 -37.912 1.00 0.00 C ATOM 1860 CE LYS A 114 6.217 22.913 -37.023 1.00 0.00 C ATOM 1861 NZ LYS A 114 6.309 23.568 -35.701 1.00 0.00 N ATOM 0 H LYS A 114 10.126 20.520 -38.419 1.00 0.00 H new ATOM 0 HA LYS A 114 9.001 22.603 -40.063 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.889 22.721 -37.680 1.00 0.00 H new ATOM 0 HB3 LYS A 114 10.073 24.097 -38.395 1.00 0.00 H new ATOM 0 HG2 LYS A 114 8.710 21.729 -37.026 1.00 0.00 H new ATOM 0 HG3 LYS A 114 8.913 23.330 -36.343 1.00 0.00 H new ATOM 0 HD2 LYS A 114 7.458 24.301 -38.108 1.00 0.00 H new ATOM 0 HD3 LYS A 114 7.305 22.732 -38.875 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.305 23.237 -37.525 1.00 0.00 H new ATOM 0 HE3 LYS A 114 6.140 21.834 -36.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.420 23.425 -35.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 7.096 23.154 -35.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 6.475 24.587 -35.829 1.00 0.00 H new ATOM 1875 N LYS A 115 12.208 21.868 -40.326 1.00 0.00 N ATOM 1876 CA LYS A 115 13.393 22.029 -41.190 1.00 0.00 C ATOM 1877 C LYS A 115 13.053 21.629 -42.639 1.00 0.00 C ATOM 1878 O LYS A 115 13.637 22.155 -43.586 1.00 0.00 O ATOM 1879 CB LYS A 115 14.604 21.201 -40.683 1.00 0.00 C ATOM 1880 CG LYS A 115 15.902 21.457 -41.493 1.00 0.00 C ATOM 1881 CD LYS A 115 17.089 20.569 -41.074 1.00 0.00 C ATOM 1882 CE LYS A 115 18.354 20.872 -41.907 1.00 0.00 C ATOM 1883 NZ LYS A 115 19.497 20.015 -41.517 1.00 0.00 N ATOM 0 H LYS A 115 12.299 21.126 -39.632 1.00 0.00 H new ATOM 0 HA LYS A 115 13.677 23.081 -41.157 1.00 0.00 H new ATOM 0 HB2 LYS A 115 14.785 21.439 -39.635 1.00 0.00 H new ATOM 0 HB3 LYS A 115 14.357 20.141 -40.731 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.696 21.294 -42.551 1.00 0.00 H new ATOM 0 HG3 LYS A 115 16.187 22.503 -41.381 1.00 0.00 H new ATOM 0 HD2 LYS A 115 17.304 20.725 -40.017 1.00 0.00 H new ATOM 0 HD3 LYS A 115 16.818 19.520 -41.193 1.00 0.00 H new ATOM 0 HE2 LYS A 115 18.135 20.724 -42.964 1.00 0.00 H new ATOM 0 HE3 LYS A 115 18.628 21.920 -41.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 20.324 20.252 -42.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 19.724 20.174 -40.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 19.247 19.016 -41.661 1.00 0.00 H new ATOM 1897 N ARG A 116 12.081 20.715 -42.788 1.00 0.00 N ATOM 1898 CA ARG A 116 11.611 20.247 -44.105 1.00 0.00 C ATOM 1899 C ARG A 116 10.981 21.423 -44.893 1.00 0.00 C ATOM 1900 O ARG A 116 11.199 21.568 -46.104 1.00 0.00 O ATOM 1901 CB ARG A 116 10.584 19.089 -43.923 1.00 0.00 C ATOM 1902 CG ARG A 116 10.488 18.107 -45.108 1.00 0.00 C ATOM 1903 CD ARG A 116 11.764 17.267 -45.265 1.00 0.00 C ATOM 1904 NE ARG A 116 11.690 16.389 -46.438 1.00 0.00 N ATOM 1905 CZ ARG A 116 11.878 15.060 -46.437 1.00 0.00 C ATOM 1906 NH1 ARG A 116 12.091 14.404 -45.303 1.00 0.00 N ATOM 1907 NH2 ARG A 116 11.827 14.393 -47.583 1.00 0.00 N ATOM 0 H ARG A 116 11.599 20.279 -42.002 1.00 0.00 H new ATOM 0 HA ARG A 116 12.460 19.868 -44.675 1.00 0.00 H new ATOM 0 HB2 ARG A 116 10.848 18.528 -43.027 1.00 0.00 H new ATOM 0 HB3 ARG A 116 9.599 19.522 -43.749 1.00 0.00 H new ATOM 0 HG2 ARG A 116 9.634 17.445 -44.962 1.00 0.00 H new ATOM 0 HG3 ARG A 116 10.306 18.664 -46.027 1.00 0.00 H new ATOM 0 HD2 ARG A 116 12.626 17.927 -45.358 1.00 0.00 H new ATOM 0 HD3 ARG A 116 11.918 16.666 -44.369 1.00 0.00 H new ATOM 0 HE ARG A 116 11.477 16.827 -47.334 1.00 0.00 H new ATOM 0 HH11 ARG A 116 12.113 14.910 -44.418 1.00 0.00 H new ATOM 0 HH12 ARG A 116 12.232 13.394 -45.317 1.00 0.00 H new ATOM 0 HH21 ARG A 116 11.646 14.890 -48.455 1.00 0.00 H new ATOM 0 HH22 ARG A 116 11.969 13.383 -47.592 1.00 0.00 H new ATOM 1921 N GLU A 117 10.215 22.259 -44.163 1.00 0.00 N ATOM 1922 CA GLU A 117 9.643 23.511 -44.692 1.00 0.00 C ATOM 1923 C GLU A 117 10.746 24.562 -44.926 1.00 0.00 C ATOM 1924 O GLU A 117 10.674 25.343 -45.865 1.00 0.00 O ATOM 1925 CB GLU A 117 8.611 24.101 -43.698 1.00 0.00 C ATOM 1926 CG GLU A 117 7.408 23.190 -43.363 1.00 0.00 C ATOM 1927 CD GLU A 117 6.447 23.839 -42.350 1.00 0.00 C ATOM 1928 OE1 GLU A 117 6.625 23.634 -41.133 1.00 0.00 O ATOM 1929 OE2 GLU A 117 5.540 24.595 -42.763 1.00 0.00 O ATOM 0 H GLU A 117 9.976 22.083 -43.187 1.00 0.00 H new ATOM 0 HA GLU A 117 9.155 23.273 -45.637 1.00 0.00 H new ATOM 0 HB2 GLU A 117 9.127 24.347 -42.770 1.00 0.00 H new ATOM 0 HB3 GLU A 117 8.232 25.037 -44.109 1.00 0.00 H new ATOM 0 HG2 GLU A 117 6.864 22.958 -44.279 1.00 0.00 H new ATOM 0 HG3 GLU A 117 7.772 22.245 -42.961 1.00 0.00 H new ATOM 1936 N LEU A 118 11.741 24.565 -44.019 1.00 0.00 N ATOM 1937 CA LEU A 118 12.868 25.530 -44.021 1.00 0.00 C ATOM 1938 C LEU A 118 13.751 25.358 -45.285 1.00 0.00 C ATOM 1939 O LEU A 118 14.364 26.320 -45.766 1.00 0.00 O ATOM 1940 CB LEU A 118 13.695 25.335 -42.722 1.00 0.00 C ATOM 1941 CG LEU A 118 14.762 26.421 -42.371 1.00 0.00 C ATOM 1942 CD1 LEU A 118 14.102 27.787 -42.072 1.00 0.00 C ATOM 1943 CD2 LEU A 118 15.641 25.956 -41.184 1.00 0.00 C ATOM 0 H LEU A 118 11.790 23.892 -43.254 1.00 0.00 H new ATOM 0 HA LEU A 118 12.476 26.547 -44.048 1.00 0.00 H new ATOM 0 HB2 LEU A 118 12.997 25.268 -41.887 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.204 24.374 -42.790 1.00 0.00 H new ATOM 0 HG LEU A 118 15.404 26.554 -43.242 1.00 0.00 H new ATOM 0 HD11 LEU A 118 14.873 28.519 -41.832 1.00 0.00 H new ATOM 0 HD12 LEU A 118 13.545 28.121 -42.947 1.00 0.00 H new ATOM 0 HD13 LEU A 118 13.422 27.685 -41.226 1.00 0.00 H new ATOM 0 HD21 LEU A 118 16.378 26.725 -40.954 1.00 0.00 H new ATOM 0 HD22 LEU A 118 15.012 25.784 -40.311 1.00 0.00 H new ATOM 0 HD23 LEU A 118 16.153 25.031 -41.451 1.00 0.00 H new ATOM 1955 N GLU A 119 13.789 24.114 -45.811 1.00 0.00 N ATOM 1956 CA GLU A 119 14.404 23.794 -47.116 1.00 0.00 C ATOM 1957 C GLU A 119 13.608 24.473 -48.252 1.00 0.00 C ATOM 1958 O GLU A 119 14.178 25.144 -49.116 1.00 0.00 O ATOM 1959 CB GLU A 119 14.433 22.255 -47.333 1.00 0.00 C ATOM 1960 CG GLU A 119 15.253 21.456 -46.294 1.00 0.00 C ATOM 1961 CD GLU A 119 16.765 21.745 -46.343 1.00 0.00 C ATOM 1962 OE1 GLU A 119 17.276 22.513 -45.505 1.00 0.00 O ATOM 1963 OE2 GLU A 119 17.453 21.202 -47.235 1.00 0.00 O ATOM 0 H GLU A 119 13.392 23.301 -45.340 1.00 0.00 H new ATOM 0 HA GLU A 119 15.428 24.168 -47.125 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.408 21.884 -47.325 1.00 0.00 H new ATOM 0 HB3 GLU A 119 14.838 22.052 -48.325 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.880 21.686 -45.296 1.00 0.00 H new ATOM 0 HG3 GLU A 119 15.090 20.391 -46.457 1.00 0.00 H new ATOM 1970 N LYS A 120 12.274 24.297 -48.208 1.00 0.00 N ATOM 1971 CA LYS A 120 11.332 24.887 -49.193 1.00 0.00 C ATOM 1972 C LYS A 120 11.187 26.410 -49.016 1.00 0.00 C ATOM 1973 O LYS A 120 10.624 27.071 -49.876 1.00 0.00 O ATOM 1974 CB LYS A 120 9.926 24.192 -49.102 1.00 0.00 C ATOM 1975 CG LYS A 120 9.741 22.951 -50.010 1.00 0.00 C ATOM 1976 CD LYS A 120 10.746 21.813 -49.731 1.00 0.00 C ATOM 1977 CE LYS A 120 10.542 20.624 -50.684 1.00 0.00 C ATOM 1978 NZ LYS A 120 11.517 19.539 -50.441 1.00 0.00 N ATOM 0 H LYS A 120 11.812 23.741 -47.488 1.00 0.00 H new ATOM 0 HA LYS A 120 11.752 24.710 -50.183 1.00 0.00 H new ATOM 0 HB2 LYS A 120 9.753 23.894 -48.068 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.160 24.925 -49.356 1.00 0.00 H new ATOM 0 HG2 LYS A 120 8.729 22.567 -49.882 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.836 23.258 -51.051 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.763 22.192 -49.836 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.636 21.476 -48.700 1.00 0.00 H new ATOM 0 HE2 LYS A 120 9.531 20.235 -50.565 1.00 0.00 H new ATOM 0 HE3 LYS A 120 10.632 20.967 -51.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 11.341 18.759 -51.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 12.482 19.902 -50.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 11.414 19.192 -49.466 1.00 0.00 H new ATOM 1992 N ARG A 121 11.678 26.950 -47.891 1.00 0.00 N ATOM 1993 CA ARG A 121 11.612 28.390 -47.609 1.00 0.00 C ATOM 1994 C ARG A 121 12.560 29.154 -48.552 1.00 0.00 C ATOM 1995 O ARG A 121 12.148 30.068 -49.252 1.00 0.00 O ATOM 1996 CB ARG A 121 11.982 28.663 -46.125 1.00 0.00 C ATOM 1997 CG ARG A 121 11.704 30.102 -45.646 1.00 0.00 C ATOM 1998 CD ARG A 121 12.190 30.356 -44.204 1.00 0.00 C ATOM 1999 NE ARG A 121 13.665 30.397 -44.116 1.00 0.00 N ATOM 2000 CZ ARG A 121 14.388 31.432 -43.655 1.00 0.00 C ATOM 2001 NH1 ARG A 121 13.802 32.549 -43.242 1.00 0.00 N ATOM 2002 NH2 ARG A 121 15.704 31.342 -43.615 1.00 0.00 N ATOM 0 H ARG A 121 12.129 26.405 -47.156 1.00 0.00 H new ATOM 0 HA ARG A 121 10.594 28.740 -47.780 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.426 27.970 -45.493 1.00 0.00 H new ATOM 0 HB3 ARG A 121 13.041 28.445 -45.983 1.00 0.00 H new ATOM 0 HG2 ARG A 121 12.194 30.805 -46.319 1.00 0.00 H new ATOM 0 HG3 ARG A 121 10.634 30.299 -45.704 1.00 0.00 H new ATOM 0 HD2 ARG A 121 11.779 31.299 -43.844 1.00 0.00 H new ATOM 0 HD3 ARG A 121 11.809 29.572 -43.550 1.00 0.00 H new ATOM 0 HE ARG A 121 14.176 29.572 -44.431 1.00 0.00 H new ATOM 0 HH11 ARG A 121 12.786 32.633 -43.271 1.00 0.00 H new ATOM 0 HH12 ARG A 121 14.368 33.324 -42.895 1.00 0.00 H new ATOM 0 HH21 ARG A 121 16.167 30.490 -43.933 1.00 0.00 H new ATOM 0 HH22 ARG A 121 16.258 32.124 -43.266 1.00 0.00 H new ATOM 2016 N LEU A 122 13.819 28.697 -48.599 1.00 0.00 N ATOM 2017 CA LEU A 122 14.920 29.367 -49.338 1.00 0.00 C ATOM 2018 C LEU A 122 14.946 29.017 -50.847 1.00 0.00 C ATOM 2019 O LEU A 122 15.892 29.402 -51.540 1.00 0.00 O ATOM 2020 CB LEU A 122 16.281 29.042 -48.623 1.00 0.00 C ATOM 2021 CG LEU A 122 16.598 27.522 -48.316 1.00 0.00 C ATOM 2022 CD1 LEU A 122 17.050 26.728 -49.569 1.00 0.00 C ATOM 2023 CD2 LEU A 122 17.637 27.379 -47.182 1.00 0.00 C ATOM 0 H LEU A 122 14.114 27.844 -48.123 1.00 0.00 H new ATOM 0 HA LEU A 122 14.747 30.443 -49.312 1.00 0.00 H new ATOM 0 HB2 LEU A 122 17.088 29.436 -49.240 1.00 0.00 H new ATOM 0 HB3 LEU A 122 16.305 29.588 -47.680 1.00 0.00 H new ATOM 0 HG LEU A 122 15.656 27.083 -47.986 1.00 0.00 H new ATOM 0 HD11 LEU A 122 17.252 25.694 -49.291 1.00 0.00 H new ATOM 0 HD12 LEU A 122 16.261 26.754 -50.321 1.00 0.00 H new ATOM 0 HD13 LEU A 122 17.955 27.177 -49.977 1.00 0.00 H new ATOM 0 HD21 LEU A 122 17.831 26.322 -46.997 1.00 0.00 H new ATOM 0 HD22 LEU A 122 18.564 27.873 -47.474 1.00 0.00 H new ATOM 0 HD23 LEU A 122 17.250 27.841 -46.274 1.00 0.00 H new ATOM 2035 N GLN A 123 13.886 28.338 -51.355 1.00 0.00 N ATOM 2036 CA GLN A 123 13.813 27.843 -52.759 1.00 0.00 C ATOM 2037 C GLN A 123 13.888 28.998 -53.795 1.00 0.00 C ATOM 2038 O GLN A 123 14.352 28.816 -54.925 1.00 0.00 O ATOM 2039 CB GLN A 123 12.502 27.032 -52.968 1.00 0.00 C ATOM 2040 CG GLN A 123 11.204 27.870 -52.862 1.00 0.00 C ATOM 2041 CD GLN A 123 9.902 27.077 -53.046 1.00 0.00 C ATOM 2042 OE1 GLN A 123 8.881 27.412 -52.456 1.00 0.00 O ATOM 2043 NE2 GLN A 123 9.915 26.045 -53.879 1.00 0.00 N ATOM 0 H GLN A 123 13.056 28.117 -50.805 1.00 0.00 H new ATOM 0 HA GLN A 123 14.678 27.200 -52.922 1.00 0.00 H new ATOM 0 HB2 GLN A 123 12.535 26.559 -53.950 1.00 0.00 H new ATOM 0 HB3 GLN A 123 12.464 26.231 -52.230 1.00 0.00 H new ATOM 0 HG2 GLN A 123 11.181 28.355 -51.886 1.00 0.00 H new ATOM 0 HG3 GLN A 123 11.238 28.662 -53.611 1.00 0.00 H new ATOM 0 HE21 GLN A 123 10.778 25.787 -54.358 1.00 0.00 H new ATOM 0 HE22 GLN A 123 9.062 25.510 -54.041 1.00 0.00 H new