USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 989 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 LYS NZ :NH3+ -169:sc= 1.93 (180deg=0.0924) USER MOD Set 1.2: A 141 THR OG1 : rot 176:sc= 1 USER MOD Set 2.1: A 23 ASN : amide:sc= 0.757 K(o=1.9,f=-1.5!) USER MOD Set 2.2: A 49 TYR OH : rot 179:sc= 1.19 USER MOD Single : A 28 TYR OH : rot -146:sc= 1.14 USER MOD Single : A 32 CYS SG : rot 83:sc= 1.24 USER MOD Single : A 33 SER OG : rot -88:sc= 1.38 USER MOD Single : A 37 THR OG1 : rot 150:sc= 0.202 USER MOD Single : A 51 SER OG : rot 180:sc= 0.12 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -137:sc= 1.08 (180deg=-0.653) USER MOD Single : A 57 HIS : no HD1:sc= -2.96! K(o=-3!,f=-0.94) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -171:sc=-0.00176 (180deg=-0.104) USER MOD Single : A 65 THR OG1 : rot -79:sc= -0.926! USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -41:sc= 0.408 USER MOD Single : A 81 SER OG : rot -62:sc= 0.246 USER MOD Single : A 84 MET CE :methyl -170:sc= -0.517 (180deg=-0.803) USER MOD Single : A 87 TYR OH : rot 150:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= -0.649 USER MOD Single : A 95 SER OG : rot -110:sc= 0 USER MOD Single : A 103 HIS : no HD1:sc= -4.33! C(o=-4.3!,f=-5.1!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 MET CE :methyl 142:sc= -0.592 (180deg=-3.58!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 MET CE :methyl -179:sc= -0.306 (180deg=-0.308) USER MOD Single : A 134 LYS NZ :NH3+ -162:sc= 1.23 (180deg=1.19) USER MOD Single : A 137 ASN : amide:sc= -2.6! K(o=-2.6!,f=-0.056) USER MOD Single : A 138 TYR OH : rot 180:sc= 0.959 USER MOD Single : A 142 TYR OH : rot 43:sc= 1.09 USER MOD Single : A 144 TYR OH : rot -81:sc= 1.25 USER MOD Single : A 146 TYR OH : rot -147:sc= 1.13 USER MOD ----------------------------------------------------------------- ATOM 305 N TRP A 22 -4.037 -13.879 1.101 1.00 0.00 N ATOM 306 CA TRP A 22 -3.961 -12.427 1.175 1.00 0.00 C ATOM 307 C TRP A 22 -4.355 -11.919 2.559 1.00 0.00 C ATOM 308 O TRP A 22 -4.018 -10.795 2.932 1.00 0.00 O ATOM 309 CB TRP A 22 -4.875 -11.796 0.127 1.00 0.00 C ATOM 310 CG TRP A 22 -4.563 -12.218 -1.277 1.00 0.00 C ATOM 311 CD1 TRP A 22 -5.187 -13.197 -1.987 1.00 0.00 C ATOM 312 CD2 TRP A 22 -3.551 -11.680 -2.139 1.00 0.00 C ATOM 313 NE1 TRP A 22 -4.639 -13.297 -3.243 1.00 0.00 N ATOM 314 CE2 TRP A 22 -3.628 -12.379 -3.359 1.00 0.00 C ATOM 315 CE3 TRP A 22 -2.589 -10.676 -2.000 1.00 0.00 C ATOM 316 CZ2 TRP A 22 -2.784 -12.101 -4.432 1.00 0.00 C ATOM 317 CZ3 TRP A 22 -1.749 -10.405 -3.063 1.00 0.00 C ATOM 318 CH2 TRP A 22 -1.853 -11.114 -4.265 1.00 0.00 C ATOM 0 HA TRP A 22 -2.927 -12.141 0.982 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -5.908 -12.057 0.354 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -4.798 -10.711 0.196 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -5.997 -13.808 -1.616 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -4.936 -13.948 -3.970 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -2.504 -10.121 -1.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -2.862 -12.645 -5.362 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -1.000 -9.633 -2.965 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -1.183 -10.876 -5.078 1.00 0.00 H new ATOM 329 N ASN A 23 -5.063 -12.753 3.314 1.00 0.00 N ATOM 330 CA ASN A 23 -5.639 -12.336 4.592 1.00 0.00 C ATOM 331 C ASN A 23 -4.563 -11.893 5.582 1.00 0.00 C ATOM 332 O ASN A 23 -4.679 -10.823 6.175 1.00 0.00 O ATOM 333 CB ASN A 23 -6.495 -13.452 5.210 1.00 0.00 C ATOM 334 CG ASN A 23 -7.693 -13.828 4.350 1.00 0.00 C ATOM 335 OD1 ASN A 23 -7.626 -13.818 3.123 1.00 0.00 O ATOM 336 ND2 ASN A 23 -8.812 -14.140 4.987 1.00 0.00 N ATOM 0 H ASN A 23 -5.253 -13.724 3.064 1.00 0.00 H new ATOM 0 HA ASN A 23 -6.281 -11.480 4.383 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -5.875 -14.335 5.365 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -6.845 -13.132 6.191 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -9.650 -14.381 4.458 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -8.836 -14.139 6.007 1.00 0.00 H new ATOM 343 N ASP A 24 -3.517 -12.701 5.747 1.00 0.00 N ATOM 344 CA ASP A 24 -2.439 -12.377 6.689 1.00 0.00 C ATOM 345 C ASP A 24 -1.749 -11.070 6.319 1.00 0.00 C ATOM 346 O ASP A 24 -1.408 -10.268 7.192 1.00 0.00 O ATOM 347 CB ASP A 24 -1.405 -13.505 6.756 1.00 0.00 C ATOM 348 CG ASP A 24 -1.886 -14.686 7.572 1.00 0.00 C ATOM 349 OD1 ASP A 24 -1.888 -14.594 8.821 1.00 0.00 O ATOM 350 OD2 ASP A 24 -2.271 -15.709 6.975 1.00 0.00 O ATOM 0 H ASP A 24 -3.390 -13.580 5.246 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.898 -12.261 7.671 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.170 -13.838 5.745 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.481 -13.121 7.188 1.00 0.00 H new ATOM 355 N LEU A 25 -1.554 -10.861 5.021 1.00 0.00 N ATOM 356 CA LEU A 25 -0.953 -9.630 4.525 1.00 0.00 C ATOM 357 C LEU A 25 -1.770 -8.423 4.967 1.00 0.00 C ATOM 358 O LEU A 25 -1.234 -7.470 5.534 1.00 0.00 O ATOM 359 CB LEU A 25 -0.864 -9.658 2.996 1.00 0.00 C ATOM 360 CG LEU A 25 -0.401 -8.350 2.346 1.00 0.00 C ATOM 361 CD1 LEU A 25 1.031 -8.026 2.742 1.00 0.00 C ATOM 362 CD2 LEU A 25 -0.538 -8.433 0.833 1.00 0.00 C ATOM 0 H LEU A 25 -1.804 -11.530 4.293 1.00 0.00 H new ATOM 0 HA LEU A 25 0.052 -9.550 4.940 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.179 -10.453 2.702 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.844 -9.917 2.596 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.039 -7.543 2.706 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.337 -7.093 2.268 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.094 -7.921 3.825 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.690 -8.831 2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.205 -7.496 0.386 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.074 -9.253 0.457 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.581 -8.610 0.571 1.00 0.00 H new ATOM 374 N ALA A 26 -3.072 -8.489 4.718 1.00 0.00 N ATOM 375 CA ALA A 26 -3.983 -7.407 5.061 1.00 0.00 C ATOM 376 C ALA A 26 -3.960 -7.122 6.555 1.00 0.00 C ATOM 377 O ALA A 26 -3.860 -5.969 6.965 1.00 0.00 O ATOM 378 CB ALA A 26 -5.391 -7.742 4.601 1.00 0.00 C ATOM 0 H ALA A 26 -3.523 -9.290 4.275 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.651 -6.506 4.546 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.063 -6.925 4.863 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.397 -7.884 3.520 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.725 -8.658 5.089 1.00 0.00 H new ATOM 384 N VAL A 27 -4.029 -8.179 7.361 1.00 0.00 N ATOM 385 CA VAL A 27 -4.014 -8.040 8.816 1.00 0.00 C ATOM 386 C VAL A 27 -2.780 -7.269 9.277 1.00 0.00 C ATOM 387 O VAL A 27 -2.877 -6.372 10.115 1.00 0.00 O ATOM 388 CB VAL A 27 -4.054 -9.413 9.522 1.00 0.00 C ATOM 389 CG1 VAL A 27 -3.970 -9.247 11.031 1.00 0.00 C ATOM 390 CG2 VAL A 27 -5.317 -10.169 9.144 1.00 0.00 C ATOM 0 H VAL A 27 -4.096 -9.142 7.031 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.911 -7.484 9.090 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.190 -9.990 9.192 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -4.000 -10.227 11.507 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.037 -8.746 11.291 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.812 -8.649 11.379 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -5.329 -11.134 9.650 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.191 -9.591 9.445 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.339 -10.325 8.065 1.00 0.00 H new ATOM 400 N TYR A 28 -1.627 -7.606 8.710 1.00 0.00 N ATOM 401 CA TYR A 28 -0.383 -6.928 9.051 1.00 0.00 C ATOM 402 C TYR A 28 -0.482 -5.438 8.741 1.00 0.00 C ATOM 403 O TYR A 28 -0.114 -4.599 9.563 1.00 0.00 O ATOM 404 CB TYR A 28 0.790 -7.543 8.288 1.00 0.00 C ATOM 405 CG TYR A 28 2.137 -6.985 8.688 1.00 0.00 C ATOM 406 CD1 TYR A 28 2.705 -7.314 9.911 1.00 0.00 C ATOM 407 CD2 TYR A 28 2.845 -6.143 7.842 1.00 0.00 C ATOM 408 CE1 TYR A 28 3.942 -6.825 10.278 1.00 0.00 C ATOM 409 CE2 TYR A 28 4.083 -5.646 8.204 1.00 0.00 C ATOM 410 CZ TYR A 28 4.625 -5.991 9.423 1.00 0.00 C ATOM 411 OH TYR A 28 5.865 -5.515 9.783 1.00 0.00 O ATOM 0 H TYR A 28 -1.528 -8.344 8.013 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.210 -7.053 10.120 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.791 -8.621 8.449 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.642 -7.381 7.220 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.169 -7.964 10.587 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.422 -5.872 6.886 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.372 -7.095 11.231 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.622 -4.991 7.535 1.00 0.00 H new ATOM 0 HH TYR A 28 5.983 -4.609 9.429 1.00 0.00 H new ATOM 421 N ILE A 29 -0.996 -5.124 7.558 1.00 0.00 N ATOM 422 CA ILE A 29 -1.188 -3.740 7.137 1.00 0.00 C ATOM 423 C ILE A 29 -2.121 -3.013 8.102 1.00 0.00 C ATOM 424 O ILE A 29 -1.861 -1.878 8.502 1.00 0.00 O ATOM 425 CB ILE A 29 -1.770 -3.676 5.706 1.00 0.00 C ATOM 426 CG1 ILE A 29 -0.840 -4.404 4.728 1.00 0.00 C ATOM 427 CG2 ILE A 29 -1.981 -2.232 5.271 1.00 0.00 C ATOM 428 CD1 ILE A 29 -1.430 -4.598 3.347 1.00 0.00 C ATOM 0 H ILE A 29 -1.290 -5.815 6.868 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.214 -3.250 7.143 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.740 -4.173 5.704 1.00 0.00 H new ATOM 0 HG12 ILE A 29 0.089 -3.842 4.639 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.584 -5.379 5.143 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.391 -2.212 4.261 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.676 -1.744 5.954 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -1.027 -1.705 5.286 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.712 -5.120 2.715 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.344 -5.188 3.421 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.660 -3.626 2.910 1.00 0.00 H new ATOM 440 N ILE A 30 -3.190 -3.695 8.490 1.00 0.00 N ATOM 441 CA ILE A 30 -4.188 -3.147 9.403 1.00 0.00 C ATOM 442 C ILE A 30 -3.573 -2.752 10.744 1.00 0.00 C ATOM 443 O ILE A 30 -3.809 -1.653 11.245 1.00 0.00 O ATOM 444 CB ILE A 30 -5.318 -4.170 9.651 1.00 0.00 C ATOM 445 CG1 ILE A 30 -6.056 -4.476 8.346 1.00 0.00 C ATOM 446 CG2 ILE A 30 -6.286 -3.659 10.707 1.00 0.00 C ATOM 447 CD1 ILE A 30 -6.926 -5.714 8.408 1.00 0.00 C ATOM 0 H ILE A 30 -3.391 -4.646 8.181 1.00 0.00 H new ATOM 0 HA ILE A 30 -4.595 -2.254 8.929 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.871 -5.093 10.020 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.677 -3.620 8.082 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.325 -4.597 7.547 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.074 -4.396 10.865 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -5.750 -3.493 11.642 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.729 -2.721 10.371 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.415 -5.863 7.446 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.308 -6.582 8.640 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -7.682 -5.589 9.184 1.00 0.00 H new ATOM 459 N ARG A 31 -2.767 -3.640 11.309 1.00 0.00 N ATOM 460 CA ARG A 31 -2.221 -3.430 12.646 1.00 0.00 C ATOM 461 C ARG A 31 -1.133 -2.361 12.631 1.00 0.00 C ATOM 462 O ARG A 31 -0.845 -1.733 13.652 1.00 0.00 O ATOM 463 CB ARG A 31 -1.666 -4.746 13.197 1.00 0.00 C ATOM 464 CG ARG A 31 -2.674 -5.885 13.159 1.00 0.00 C ATOM 465 CD ARG A 31 -2.102 -7.174 13.725 1.00 0.00 C ATOM 466 NE ARG A 31 -2.342 -7.306 15.158 1.00 0.00 N ATOM 467 CZ ARG A 31 -2.103 -8.420 15.848 1.00 0.00 C ATOM 468 NH1 ARG A 31 -1.541 -9.471 15.255 1.00 0.00 N ATOM 469 NH2 ARG A 31 -2.426 -8.483 17.128 1.00 0.00 N ATOM 0 H ARG A 31 -2.476 -4.511 10.865 1.00 0.00 H new ATOM 0 HA ARG A 31 -3.025 -3.083 13.295 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.785 -5.030 12.622 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.340 -4.593 14.226 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -3.561 -5.603 13.726 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.993 -6.052 12.130 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.544 -8.024 13.205 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.029 -7.207 13.534 1.00 0.00 H new ATOM 0 HE ARG A 31 -2.714 -6.500 15.660 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.291 -9.426 14.267 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -1.360 -10.321 15.789 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -2.857 -7.680 17.585 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.244 -9.335 17.659 1.00 0.00 H new ATOM 483 N CYS A 32 -0.541 -2.147 11.467 1.00 0.00 N ATOM 484 CA CYS A 32 0.519 -1.160 11.324 1.00 0.00 C ATOM 485 C CYS A 32 -0.049 0.219 10.994 1.00 0.00 C ATOM 486 O CYS A 32 0.676 1.214 10.995 1.00 0.00 O ATOM 487 CB CYS A 32 1.499 -1.598 10.240 1.00 0.00 C ATOM 488 SG CYS A 32 2.263 -3.204 10.552 1.00 0.00 S ATOM 0 H CYS A 32 -0.776 -2.643 10.607 1.00 0.00 H new ATOM 0 HA CYS A 32 1.045 -1.088 12.276 1.00 0.00 H new ATOM 0 HB2 CYS A 32 0.976 -1.635 9.284 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.282 -0.846 10.146 1.00 0.00 H new ATOM 0 HG CYS A 32 1.465 -4.149 10.152 1.00 0.00 H new ATOM 494 N SER A 33 -1.343 0.278 10.711 1.00 0.00 N ATOM 495 CA SER A 33 -1.986 1.535 10.360 1.00 0.00 C ATOM 496 C SER A 33 -2.981 1.965 11.437 1.00 0.00 C ATOM 497 O SER A 33 -2.743 2.930 12.166 1.00 0.00 O ATOM 498 CB SER A 33 -2.675 1.408 9.001 1.00 0.00 C ATOM 499 OG SER A 33 -3.464 0.231 8.935 1.00 0.00 O ATOM 0 H SER A 33 -1.967 -0.529 10.718 1.00 0.00 H new ATOM 0 HA SER A 33 -1.220 2.308 10.294 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.304 2.281 8.826 1.00 0.00 H new ATOM 0 HB3 SER A 33 -1.925 1.391 8.210 1.00 0.00 H new ATOM 0 HG SER A 33 -2.913 -0.515 8.620 1.00 0.00 H new ATOM 505 N GLY A 34 -4.084 1.238 11.543 1.00 0.00 N ATOM 506 CA GLY A 34 -5.090 1.558 12.535 1.00 0.00 C ATOM 507 C GLY A 34 -6.178 2.458 11.981 1.00 0.00 C ATOM 508 O GLY A 34 -6.022 3.032 10.903 1.00 0.00 O ATOM 0 H GLY A 34 -4.300 0.431 10.958 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -5.538 0.636 12.906 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -4.616 2.047 13.386 1.00 0.00 H new ATOM 512 N PRO A 35 -7.301 2.597 12.695 1.00 0.00 N ATOM 513 CA PRO A 35 -8.418 3.436 12.257 1.00 0.00 C ATOM 514 C PRO A 35 -8.144 4.930 12.453 1.00 0.00 C ATOM 515 O PRO A 35 -7.331 5.321 13.296 1.00 0.00 O ATOM 516 CB PRO A 35 -9.568 2.981 13.156 1.00 0.00 C ATOM 517 CG PRO A 35 -8.908 2.502 14.403 1.00 0.00 C ATOM 518 CD PRO A 35 -7.576 1.936 13.986 1.00 0.00 C ATOM 0 HA PRO A 35 -8.617 3.326 11.191 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -10.257 3.800 13.362 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -10.148 2.187 12.685 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -8.778 3.319 15.113 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -9.515 1.744 14.898 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -6.801 2.155 14.720 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -7.618 0.852 13.880 1.00 0.00 H new ATOM 526 N GLY A 36 -8.833 5.757 11.677 1.00 0.00 N ATOM 527 CA GLY A 36 -8.677 7.195 11.800 1.00 0.00 C ATOM 528 C GLY A 36 -7.493 7.730 11.014 1.00 0.00 C ATOM 529 O GLY A 36 -6.779 8.617 11.482 1.00 0.00 O ATOM 0 H GLY A 36 -9.498 5.458 10.964 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.587 7.685 11.455 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.555 7.454 12.852 1.00 0.00 H new ATOM 533 N THR A 37 -7.281 7.187 9.826 1.00 0.00 N ATOM 534 CA THR A 37 -6.210 7.639 8.950 1.00 0.00 C ATOM 535 C THR A 37 -6.457 7.111 7.537 1.00 0.00 C ATOM 536 O THR A 37 -7.539 6.591 7.255 1.00 0.00 O ATOM 537 CB THR A 37 -4.822 7.187 9.472 1.00 0.00 C ATOM 538 OG1 THR A 37 -3.774 7.752 8.668 1.00 0.00 O ATOM 539 CG2 THR A 37 -4.697 5.669 9.480 1.00 0.00 C ATOM 0 H THR A 37 -7.842 6.426 9.443 1.00 0.00 H new ATOM 0 HA THR A 37 -6.208 8.729 8.934 1.00 0.00 H new ATOM 0 HB THR A 37 -4.726 7.546 10.497 1.00 0.00 H new ATOM 0 HG1 THR A 37 -2.974 7.884 9.219 1.00 0.00 H new ATOM 0 HG21 THR A 37 -3.712 5.387 9.852 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.464 5.244 10.127 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.825 5.288 8.467 1.00 0.00 H new ATOM 547 N ARG A 38 -5.480 7.258 6.655 1.00 0.00 N ATOM 548 CA ARG A 38 -5.609 6.789 5.290 1.00 0.00 C ATOM 549 C ARG A 38 -4.549 5.744 4.973 1.00 0.00 C ATOM 550 O ARG A 38 -3.386 5.887 5.351 1.00 0.00 O ATOM 551 CB ARG A 38 -5.503 7.955 4.303 1.00 0.00 C ATOM 552 CG ARG A 38 -6.604 8.987 4.467 1.00 0.00 C ATOM 553 CD ARG A 38 -6.826 9.787 3.192 1.00 0.00 C ATOM 554 NE ARG A 38 -5.653 10.565 2.784 1.00 0.00 N ATOM 555 CZ ARG A 38 -5.606 11.292 1.663 1.00 0.00 C ATOM 556 NH1 ARG A 38 -6.648 11.305 0.837 1.00 0.00 N ATOM 557 NH2 ARG A 38 -4.522 12.008 1.372 1.00 0.00 N ATOM 0 H ARG A 38 -4.586 7.701 6.865 1.00 0.00 H new ATOM 0 HA ARG A 38 -6.593 6.331 5.187 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -4.537 8.443 4.431 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.531 7.564 3.286 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -7.531 8.487 4.748 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -6.348 9.665 5.281 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -7.099 9.105 2.387 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -7.669 10.463 3.337 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.830 10.551 3.386 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -7.482 10.761 1.059 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -6.614 11.859 -0.019 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -3.723 12.003 2.006 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -4.491 12.561 0.516 1.00 0.00 H new ATOM 571 N VAL A 39 -4.969 4.681 4.307 1.00 0.00 N ATOM 572 CA VAL A 39 -4.050 3.663 3.818 1.00 0.00 C ATOM 573 C VAL A 39 -4.165 3.577 2.307 1.00 0.00 C ATOM 574 O VAL A 39 -5.202 3.185 1.781 1.00 0.00 O ATOM 575 CB VAL A 39 -4.329 2.273 4.436 1.00 0.00 C ATOM 576 CG1 VAL A 39 -3.382 1.225 3.865 1.00 0.00 C ATOM 577 CG2 VAL A 39 -4.203 2.325 5.950 1.00 0.00 C ATOM 0 H VAL A 39 -5.949 4.499 4.091 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.042 3.954 4.113 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.350 1.990 4.180 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.598 0.256 4.315 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.517 1.162 2.785 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.352 1.506 4.086 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.403 1.338 6.366 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.194 2.635 6.221 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.922 3.040 6.351 1.00 0.00 H new ATOM 587 N VAL A 40 -3.113 3.959 1.614 1.00 0.00 N ATOM 588 CA VAL A 40 -3.145 4.006 0.163 1.00 0.00 C ATOM 589 C VAL A 40 -2.541 2.746 -0.434 1.00 0.00 C ATOM 590 O VAL A 40 -1.487 2.283 0.000 1.00 0.00 O ATOM 591 CB VAL A 40 -2.392 5.238 -0.385 1.00 0.00 C ATOM 592 CG1 VAL A 40 -2.508 5.307 -1.901 1.00 0.00 C ATOM 593 CG2 VAL A 40 -2.917 6.514 0.251 1.00 0.00 C ATOM 0 H VAL A 40 -2.225 4.242 2.029 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.193 4.080 -0.128 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.338 5.137 -0.127 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.971 6.182 -2.268 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.078 4.407 -2.340 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.558 5.382 -2.183 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.373 7.370 -0.149 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.978 6.622 0.028 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.776 6.467 1.331 1.00 0.00 H new ATOM 603 N GLU A 41 -3.219 2.187 -1.416 1.00 0.00 N ATOM 604 CA GLU A 41 -2.682 1.068 -2.156 1.00 0.00 C ATOM 605 C GLU A 41 -2.443 1.494 -3.594 1.00 0.00 C ATOM 606 O GLU A 41 -3.028 2.474 -4.061 1.00 0.00 O ATOM 607 CB GLU A 41 -3.622 -0.141 -2.074 1.00 0.00 C ATOM 608 CG GLU A 41 -4.978 0.062 -2.728 1.00 0.00 C ATOM 609 CD GLU A 41 -4.965 -0.246 -4.212 1.00 0.00 C ATOM 610 OE1 GLU A 41 -4.771 -1.424 -4.561 1.00 0.00 O ATOM 611 OE2 GLU A 41 -5.144 0.688 -5.024 1.00 0.00 O ATOM 0 H GLU A 41 -4.144 2.491 -1.719 1.00 0.00 H new ATOM 0 HA GLU A 41 -1.732 0.762 -1.718 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.133 -0.996 -2.541 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.774 -0.395 -1.025 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.713 -0.575 -2.236 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.298 1.093 -2.578 1.00 0.00 H new ATOM 618 N VAL A 42 -1.557 0.794 -4.276 1.00 0.00 N ATOM 619 CA VAL A 42 -1.272 1.087 -5.671 1.00 0.00 C ATOM 620 C VAL A 42 -1.464 -0.151 -6.538 1.00 0.00 C ATOM 621 O VAL A 42 -0.712 -1.125 -6.421 1.00 0.00 O ATOM 622 CB VAL A 42 0.167 1.617 -5.857 1.00 0.00 C ATOM 623 CG1 VAL A 42 0.430 1.966 -7.315 1.00 0.00 C ATOM 624 CG2 VAL A 42 0.423 2.826 -4.967 1.00 0.00 C ATOM 0 H VAL A 42 -1.021 0.018 -3.888 1.00 0.00 H new ATOM 0 HA VAL A 42 -1.974 1.860 -5.982 1.00 0.00 H new ATOM 0 HB VAL A 42 0.855 0.825 -5.562 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.449 2.337 -7.422 1.00 0.00 H new ATOM 0 HG12 VAL A 42 0.301 1.076 -7.931 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.272 2.735 -7.637 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.443 3.179 -5.118 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -0.278 3.621 -5.223 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.287 2.544 -3.923 1.00 0.00 H new ATOM 634 N GLY A 43 -2.478 -0.113 -7.397 1.00 0.00 N ATOM 635 CA GLY A 43 -2.670 -1.178 -8.362 1.00 0.00 C ATOM 636 C GLY A 43 -3.915 -2.008 -8.111 1.00 0.00 C ATOM 637 O GLY A 43 -3.927 -3.199 -8.415 1.00 0.00 O ATOM 0 H GLY A 43 -3.169 0.636 -7.441 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.727 -0.746 -9.361 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.798 -1.832 -8.347 1.00 0.00 H new ATOM 641 N ALA A 44 -4.962 -1.375 -7.587 1.00 0.00 N ATOM 642 CA ALA A 44 -6.215 -2.061 -7.258 1.00 0.00 C ATOM 643 C ALA A 44 -6.740 -2.904 -8.421 1.00 0.00 C ATOM 644 O ALA A 44 -6.925 -4.118 -8.291 1.00 0.00 O ATOM 645 CB ALA A 44 -7.267 -1.045 -6.836 1.00 0.00 C ATOM 0 H ALA A 44 -4.969 -0.377 -7.378 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.006 -2.742 -6.433 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.195 -1.562 -6.593 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -6.915 -0.500 -5.960 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -7.445 -0.345 -7.652 1.00 0.00 H new ATOM 651 N GLY A 45 -6.983 -2.254 -9.552 1.00 0.00 N ATOM 652 CA GLY A 45 -7.474 -2.952 -10.726 1.00 0.00 C ATOM 653 C GLY A 45 -8.846 -3.563 -10.512 1.00 0.00 C ATOM 654 O GLY A 45 -9.852 -2.851 -10.446 1.00 0.00 O ATOM 0 H GLY A 45 -6.848 -1.251 -9.678 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -7.517 -2.258 -11.565 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -6.769 -3.738 -10.998 1.00 0.00 H new ATOM 658 N ARG A 46 -8.888 -4.886 -10.410 1.00 0.00 N ATOM 659 CA ARG A 46 -10.145 -5.598 -10.212 1.00 0.00 C ATOM 660 C ARG A 46 -10.070 -6.533 -9.007 1.00 0.00 C ATOM 661 O ARG A 46 -11.002 -7.294 -8.743 1.00 0.00 O ATOM 662 CB ARG A 46 -10.513 -6.396 -11.469 1.00 0.00 C ATOM 663 CG ARG A 46 -9.527 -7.503 -11.803 1.00 0.00 C ATOM 664 CD ARG A 46 -9.879 -8.196 -13.109 1.00 0.00 C ATOM 665 NE ARG A 46 -8.930 -9.263 -13.432 1.00 0.00 N ATOM 666 CZ ARG A 46 -8.449 -9.490 -14.655 1.00 0.00 C ATOM 667 NH1 ARG A 46 -8.804 -8.717 -15.670 1.00 0.00 N ATOM 668 NH2 ARG A 46 -7.604 -10.490 -14.862 1.00 0.00 N ATOM 0 H ARG A 46 -8.066 -5.488 -10.461 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.919 -4.855 -10.020 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -11.503 -6.832 -11.334 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -10.578 -5.713 -12.316 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -8.522 -7.086 -11.872 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -9.514 -8.235 -10.995 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -10.884 -8.612 -13.040 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -9.892 -7.464 -13.917 1.00 0.00 H new ATOM 0 HE ARG A 46 -8.617 -9.870 -12.675 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.449 -7.942 -15.519 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -8.432 -8.897 -16.603 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -7.321 -11.087 -14.085 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -7.237 -10.662 -15.798 1.00 0.00 H new ATOM 682 N PHE A 47 -8.967 -6.478 -8.273 1.00 0.00 N ATOM 683 CA PHE A 47 -8.814 -7.319 -7.096 1.00 0.00 C ATOM 684 C PHE A 47 -8.807 -6.470 -5.831 1.00 0.00 C ATOM 685 O PHE A 47 -7.773 -5.991 -5.376 1.00 0.00 O ATOM 686 CB PHE A 47 -7.566 -8.216 -7.190 1.00 0.00 C ATOM 687 CG PHE A 47 -6.297 -7.519 -7.609 1.00 0.00 C ATOM 688 CD1 PHE A 47 -6.025 -7.301 -8.949 1.00 0.00 C ATOM 689 CD2 PHE A 47 -5.368 -7.105 -6.666 1.00 0.00 C ATOM 690 CE1 PHE A 47 -4.857 -6.678 -9.342 1.00 0.00 C ATOM 691 CE2 PHE A 47 -4.198 -6.485 -7.054 1.00 0.00 C ATOM 692 CZ PHE A 47 -3.942 -6.272 -8.392 1.00 0.00 C ATOM 0 H PHE A 47 -8.174 -5.867 -8.469 1.00 0.00 H new ATOM 0 HA PHE A 47 -9.673 -7.988 -7.048 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -7.401 -8.682 -6.218 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -7.770 -9.019 -7.898 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.735 -7.622 -9.696 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.563 -7.270 -5.617 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -4.660 -6.509 -10.390 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -3.483 -6.167 -6.310 1.00 0.00 H new ATOM 0 HZ PHE A 47 -3.026 -5.788 -8.696 1.00 0.00 H new ATOM 702 N LEU A 48 -9.990 -6.280 -5.274 1.00 0.00 N ATOM 703 CA LEU A 48 -10.164 -5.421 -4.113 1.00 0.00 C ATOM 704 C LEU A 48 -10.300 -6.253 -2.846 1.00 0.00 C ATOM 705 O LEU A 48 -10.736 -5.756 -1.812 1.00 0.00 O ATOM 706 CB LEU A 48 -11.404 -4.539 -4.294 1.00 0.00 C ATOM 707 CG LEU A 48 -11.415 -3.680 -5.562 1.00 0.00 C ATOM 708 CD1 LEU A 48 -12.693 -2.859 -5.642 1.00 0.00 C ATOM 709 CD2 LEU A 48 -10.194 -2.772 -5.604 1.00 0.00 C ATOM 0 H LEU A 48 -10.851 -6.712 -5.609 1.00 0.00 H new ATOM 0 HA LEU A 48 -9.283 -4.786 -4.018 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -12.287 -5.178 -4.300 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -11.492 -3.882 -3.429 1.00 0.00 H new ATOM 0 HG LEU A 48 -11.379 -4.344 -6.425 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -12.682 -2.256 -6.550 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -13.554 -3.527 -5.661 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.760 -2.205 -4.773 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -10.220 -2.170 -6.512 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -10.198 -2.116 -4.733 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -9.289 -3.379 -5.597 1.00 0.00 H new ATOM 721 N TYR A 49 -9.911 -7.521 -2.928 1.00 0.00 N ATOM 722 CA TYR A 49 -10.050 -8.435 -1.804 1.00 0.00 C ATOM 723 C TYR A 49 -9.254 -7.952 -0.594 1.00 0.00 C ATOM 724 O TYR A 49 -9.789 -7.871 0.508 1.00 0.00 O ATOM 725 CB TYR A 49 -9.605 -9.845 -2.200 1.00 0.00 C ATOM 726 CG TYR A 49 -9.741 -10.855 -1.080 1.00 0.00 C ATOM 727 CD1 TYR A 49 -10.994 -11.273 -0.646 1.00 0.00 C ATOM 728 CD2 TYR A 49 -8.619 -11.382 -0.450 1.00 0.00 C ATOM 729 CE1 TYR A 49 -11.125 -12.186 0.382 1.00 0.00 C ATOM 730 CE2 TYR A 49 -8.742 -12.297 0.576 1.00 0.00 C ATOM 731 CZ TYR A 49 -9.997 -12.694 0.991 1.00 0.00 C ATOM 732 OH TYR A 49 -10.121 -13.607 2.012 1.00 0.00 O ATOM 0 H TYR A 49 -9.497 -7.938 -3.762 1.00 0.00 H new ATOM 0 HA TYR A 49 -11.104 -8.462 -1.527 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -10.196 -10.178 -3.053 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -8.565 -9.812 -2.525 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -11.880 -10.877 -1.121 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -7.635 -11.070 -0.769 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -12.106 -12.500 0.707 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -7.860 -12.700 1.052 1.00 0.00 H new ATOM 0 HH TYR A 49 -9.230 -13.877 2.320 1.00 0.00 H new ATOM 742 N VAL A 50 -7.983 -7.623 -0.810 1.00 0.00 N ATOM 743 CA VAL A 50 -7.114 -7.168 0.274 1.00 0.00 C ATOM 744 C VAL A 50 -7.640 -5.871 0.879 1.00 0.00 C ATOM 745 O VAL A 50 -7.785 -5.751 2.096 1.00 0.00 O ATOM 746 CB VAL A 50 -5.667 -6.945 -0.219 1.00 0.00 C ATOM 747 CG1 VAL A 50 -4.769 -6.478 0.919 1.00 0.00 C ATOM 748 CG2 VAL A 50 -5.113 -8.211 -0.852 1.00 0.00 C ATOM 0 H VAL A 50 -7.532 -7.663 -1.724 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.111 -7.950 1.033 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.687 -6.162 -0.977 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.756 -6.328 0.545 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.150 -5.539 1.321 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -4.758 -7.232 1.706 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.093 -8.031 -1.192 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.114 -9.016 -0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.734 -8.495 -1.702 1.00 0.00 H new ATOM 758 N SER A 51 -7.954 -4.920 0.014 1.00 0.00 N ATOM 759 CA SER A 51 -8.410 -3.610 0.438 1.00 0.00 C ATOM 760 C SER A 51 -9.743 -3.691 1.181 1.00 0.00 C ATOM 761 O SER A 51 -9.911 -3.083 2.240 1.00 0.00 O ATOM 762 CB SER A 51 -8.527 -2.706 -0.783 1.00 0.00 C ATOM 763 OG SER A 51 -8.550 -3.473 -1.977 1.00 0.00 O ATOM 0 H SER A 51 -7.900 -5.036 -0.998 1.00 0.00 H new ATOM 0 HA SER A 51 -7.682 -3.194 1.135 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.435 -2.107 -0.712 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.688 -2.011 -0.808 1.00 0.00 H new ATOM 0 HG SER A 51 -8.627 -2.874 -2.749 1.00 0.00 H new ATOM 769 N ASP A 52 -10.682 -4.452 0.636 1.00 0.00 N ATOM 770 CA ASP A 52 -11.996 -4.582 1.252 1.00 0.00 C ATOM 771 C ASP A 52 -11.909 -5.398 2.540 1.00 0.00 C ATOM 772 O ASP A 52 -12.672 -5.175 3.474 1.00 0.00 O ATOM 773 CB ASP A 52 -12.994 -5.213 0.279 1.00 0.00 C ATOM 774 CG ASP A 52 -14.423 -5.140 0.780 1.00 0.00 C ATOM 775 OD1 ASP A 52 -14.991 -4.030 0.818 1.00 0.00 O ATOM 776 OD2 ASP A 52 -14.997 -6.197 1.114 1.00 0.00 O ATOM 0 H ASP A 52 -10.561 -4.985 -0.225 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.353 -3.583 1.503 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -12.925 -4.708 -0.685 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -12.724 -6.256 0.113 1.00 0.00 H new ATOM 781 N TYR A 53 -10.960 -6.329 2.593 1.00 0.00 N ATOM 782 CA TYR A 53 -10.723 -7.113 3.804 1.00 0.00 C ATOM 783 C TYR A 53 -10.311 -6.190 4.951 1.00 0.00 C ATOM 784 O TYR A 53 -10.779 -6.333 6.081 1.00 0.00 O ATOM 785 CB TYR A 53 -9.635 -8.169 3.551 1.00 0.00 C ATOM 786 CG TYR A 53 -9.314 -9.048 4.745 1.00 0.00 C ATOM 787 CD1 TYR A 53 -8.413 -8.629 5.717 1.00 0.00 C ATOM 788 CD2 TYR A 53 -9.908 -10.296 4.901 1.00 0.00 C ATOM 789 CE1 TYR A 53 -8.111 -9.425 6.805 1.00 0.00 C ATOM 790 CE2 TYR A 53 -9.609 -11.097 5.986 1.00 0.00 C ATOM 791 CZ TYR A 53 -8.712 -10.656 6.936 1.00 0.00 C ATOM 792 OH TYR A 53 -8.409 -11.456 8.016 1.00 0.00 O ATOM 0 H TYR A 53 -10.343 -6.559 1.814 1.00 0.00 H new ATOM 0 HA TYR A 53 -11.645 -7.625 4.078 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -9.950 -8.805 2.724 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -8.723 -7.663 3.234 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -7.940 -7.663 5.620 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -10.614 -10.644 4.162 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -7.407 -9.083 7.549 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -10.076 -12.065 6.090 1.00 0.00 H new ATOM 0 HH TYR A 53 -8.920 -12.290 7.959 1.00 0.00 H new ATOM 802 N ILE A 54 -9.446 -5.232 4.640 1.00 0.00 N ATOM 803 CA ILE A 54 -8.959 -4.278 5.627 1.00 0.00 C ATOM 804 C ILE A 54 -10.092 -3.409 6.170 1.00 0.00 C ATOM 805 O ILE A 54 -10.238 -3.264 7.385 1.00 0.00 O ATOM 806 CB ILE A 54 -7.850 -3.384 5.030 1.00 0.00 C ATOM 807 CG1 ILE A 54 -6.634 -4.242 4.668 1.00 0.00 C ATOM 808 CG2 ILE A 54 -7.461 -2.275 6.001 1.00 0.00 C ATOM 809 CD1 ILE A 54 -5.518 -3.477 3.995 1.00 0.00 C ATOM 0 H ILE A 54 -9.065 -5.096 3.704 1.00 0.00 H new ATOM 0 HA ILE A 54 -8.541 -4.853 6.454 1.00 0.00 H new ATOM 0 HB ILE A 54 -8.231 -2.911 4.125 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.247 -4.706 5.575 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.955 -5.049 4.010 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.679 -1.660 5.556 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -8.332 -1.656 6.214 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.094 -2.715 6.928 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.695 -4.156 3.771 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.886 -3.036 3.069 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.167 -2.687 4.659 1.00 0.00 H new ATOM 821 N ARG A 55 -10.909 -2.860 5.276 1.00 0.00 N ATOM 822 CA ARG A 55 -11.989 -1.961 5.683 1.00 0.00 C ATOM 823 C ARG A 55 -13.099 -2.704 6.431 1.00 0.00 C ATOM 824 O ARG A 55 -13.904 -2.083 7.124 1.00 0.00 O ATOM 825 CB ARG A 55 -12.577 -1.219 4.481 1.00 0.00 C ATOM 826 CG ARG A 55 -13.082 -2.138 3.385 1.00 0.00 C ATOM 827 CD ARG A 55 -14.325 -1.580 2.714 1.00 0.00 C ATOM 828 NE ARG A 55 -15.443 -1.476 3.653 1.00 0.00 N ATOM 829 CZ ARG A 55 -16.596 -2.132 3.525 1.00 0.00 C ATOM 830 NH1 ARG A 55 -16.776 -2.987 2.524 1.00 0.00 N ATOM 831 NH2 ARG A 55 -17.557 -1.957 4.423 1.00 0.00 N ATOM 0 H ARG A 55 -10.846 -3.019 4.270 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.549 -1.233 6.364 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.398 -0.588 4.821 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -11.817 -0.557 4.066 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.299 -2.281 2.640 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -13.304 -3.119 3.806 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.105 -0.596 2.299 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.608 -2.222 1.880 1.00 0.00 H new ATOM 0 HE ARG A 55 -15.332 -0.861 4.459 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.029 -3.145 1.847 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -17.661 -3.486 2.432 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -17.412 -1.322 5.208 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -18.441 -2.457 4.328 1.00 0.00 H new ATOM 845 N LYS A 56 -13.157 -4.026 6.282 1.00 0.00 N ATOM 846 CA LYS A 56 -14.129 -4.825 7.024 1.00 0.00 C ATOM 847 C LYS A 56 -13.806 -4.815 8.510 1.00 0.00 C ATOM 848 O LYS A 56 -14.701 -4.767 9.356 1.00 0.00 O ATOM 849 CB LYS A 56 -14.153 -6.280 6.543 1.00 0.00 C ATOM 850 CG LYS A 56 -14.763 -6.487 5.170 1.00 0.00 C ATOM 851 CD LYS A 56 -15.011 -7.964 4.916 1.00 0.00 C ATOM 852 CE LYS A 56 -15.417 -8.246 3.479 1.00 0.00 C ATOM 853 NZ LYS A 56 -16.536 -7.380 3.027 1.00 0.00 N ATOM 0 H LYS A 56 -12.550 -4.561 5.662 1.00 0.00 H new ATOM 0 HA LYS A 56 -15.107 -4.376 6.848 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.132 -6.661 6.532 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -14.709 -6.878 7.266 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -15.701 -5.937 5.095 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.097 -6.087 4.405 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -14.108 -8.527 5.152 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.793 -8.319 5.588 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -14.558 -8.096 2.825 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -15.710 -9.292 3.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -17.222 -7.950 2.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -17.006 -6.960 3.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.165 -6.623 2.418 1.00 0.00 H new ATOM 867 N HIS A 57 -12.520 -4.850 8.822 1.00 0.00 N ATOM 868 CA HIS A 57 -12.072 -5.014 10.185 1.00 0.00 C ATOM 869 C HIS A 57 -11.629 -3.677 10.782 1.00 0.00 C ATOM 870 O HIS A 57 -11.903 -3.390 11.948 1.00 0.00 O ATOM 871 CB HIS A 57 -10.943 -6.054 10.197 1.00 0.00 C ATOM 872 CG HIS A 57 -10.128 -6.082 11.446 1.00 0.00 C ATOM 873 ND1 HIS A 57 -10.328 -7.020 12.429 1.00 0.00 N ATOM 874 CD2 HIS A 57 -9.109 -5.277 11.797 1.00 0.00 C ATOM 875 CE1 HIS A 57 -9.420 -6.761 13.357 1.00 0.00 C ATOM 876 NE2 HIS A 57 -8.661 -5.712 13.015 1.00 0.00 N ATOM 0 H HIS A 57 -11.767 -4.766 8.139 1.00 0.00 H new ATOM 0 HA HIS A 57 -12.891 -5.369 10.810 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -11.377 -7.042 10.041 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -10.281 -5.860 9.353 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -8.719 -4.447 11.227 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -9.306 -7.323 14.272 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -7.895 -5.313 13.558 1.00 0.00 H new ATOM 884 N SER A 58 -10.959 -2.863 9.980 1.00 0.00 N ATOM 885 CA SER A 58 -10.437 -1.589 10.450 1.00 0.00 C ATOM 886 C SER A 58 -11.212 -0.441 9.834 1.00 0.00 C ATOM 887 O SER A 58 -11.544 -0.470 8.650 1.00 0.00 O ATOM 888 CB SER A 58 -8.962 -1.452 10.085 1.00 0.00 C ATOM 889 OG SER A 58 -8.356 -0.376 10.787 1.00 0.00 O ATOM 0 H SER A 58 -10.764 -3.063 8.999 1.00 0.00 H new ATOM 0 HA SER A 58 -10.545 -1.557 11.534 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.440 -2.380 10.316 1.00 0.00 H new ATOM 0 HB3 SER A 58 -8.864 -1.290 9.012 1.00 0.00 H new ATOM 0 HG SER A 58 -7.411 -0.312 10.535 1.00 0.00 H new ATOM 895 N LYS A 59 -11.487 0.575 10.632 1.00 0.00 N ATOM 896 CA LYS A 59 -12.170 1.751 10.131 1.00 0.00 C ATOM 897 C LYS A 59 -11.155 2.780 9.660 1.00 0.00 C ATOM 898 O LYS A 59 -11.066 3.895 10.184 1.00 0.00 O ATOM 899 CB LYS A 59 -13.097 2.344 11.193 1.00 0.00 C ATOM 900 CG LYS A 59 -14.170 1.379 11.672 1.00 0.00 C ATOM 901 CD LYS A 59 -14.989 0.812 10.516 1.00 0.00 C ATOM 902 CE LYS A 59 -15.686 1.902 9.717 1.00 0.00 C ATOM 903 NZ LYS A 59 -16.608 2.711 10.558 1.00 0.00 N ATOM 0 H LYS A 59 -11.249 0.609 11.623 1.00 0.00 H new ATOM 0 HA LYS A 59 -12.789 1.457 9.283 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -12.500 2.663 12.047 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -13.576 3.235 10.788 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -13.703 0.561 12.220 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -14.833 1.892 12.369 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -14.336 0.241 9.856 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -15.733 0.118 10.906 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -14.938 2.556 9.268 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -16.246 1.449 8.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -17.173 3.338 9.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -17.242 2.078 11.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -16.055 3.284 11.227 1.00 0.00 H new ATOM 917 N VAL A 60 -10.360 2.370 8.693 1.00 0.00 N ATOM 918 CA VAL A 60 -9.371 3.235 8.084 1.00 0.00 C ATOM 919 C VAL A 60 -9.774 3.563 6.646 1.00 0.00 C ATOM 920 O VAL A 60 -10.375 2.733 5.961 1.00 0.00 O ATOM 921 CB VAL A 60 -7.978 2.566 8.114 1.00 0.00 C ATOM 922 CG1 VAL A 60 -7.964 1.283 7.296 1.00 0.00 C ATOM 923 CG2 VAL A 60 -6.905 3.522 7.629 1.00 0.00 C ATOM 0 H VAL A 60 -10.382 1.426 8.307 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.320 4.163 8.653 1.00 0.00 H new ATOM 0 HB VAL A 60 -7.760 2.306 9.150 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -6.971 0.836 7.337 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -8.694 0.583 7.704 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.218 1.509 6.260 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -5.935 3.026 7.660 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.124 3.826 6.606 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.884 4.402 8.272 1.00 0.00 H new ATOM 933 N ASP A 61 -9.474 4.776 6.200 1.00 0.00 N ATOM 934 CA ASP A 61 -9.788 5.181 4.834 1.00 0.00 C ATOM 935 C ASP A 61 -8.761 4.610 3.878 1.00 0.00 C ATOM 936 O ASP A 61 -7.639 5.105 3.782 1.00 0.00 O ATOM 937 CB ASP A 61 -9.830 6.705 4.703 1.00 0.00 C ATOM 938 CG ASP A 61 -10.133 7.167 3.284 1.00 0.00 C ATOM 939 OD1 ASP A 61 -11.069 6.623 2.658 1.00 0.00 O ATOM 940 OD2 ASP A 61 -9.460 8.101 2.803 1.00 0.00 O ATOM 0 H ASP A 61 -9.016 5.494 6.761 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.775 4.792 4.584 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -10.587 7.103 5.379 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.872 7.119 5.018 1.00 0.00 H new ATOM 945 N LEU A 62 -9.130 3.547 3.198 1.00 0.00 N ATOM 946 CA LEU A 62 -8.225 2.901 2.274 1.00 0.00 C ATOM 947 C LEU A 62 -8.418 3.482 0.883 1.00 0.00 C ATOM 948 O LEU A 62 -9.509 3.406 0.307 1.00 0.00 O ATOM 949 CB LEU A 62 -8.454 1.391 2.285 1.00 0.00 C ATOM 950 CG LEU A 62 -7.244 0.542 1.889 1.00 0.00 C ATOM 951 CD1 LEU A 62 -7.445 -0.890 2.336 1.00 0.00 C ATOM 952 CD2 LEU A 62 -7.014 0.585 0.389 1.00 0.00 C ATOM 0 H LEU A 62 -10.050 3.112 3.268 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.195 3.083 2.581 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.772 1.096 3.285 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.276 1.160 1.608 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.365 0.955 2.383 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.578 -1.486 2.049 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.564 -0.920 3.419 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.338 -1.297 1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.148 -0.027 0.136 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.894 0.199 -0.125 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.834 1.614 0.078 1.00 0.00 H new ATOM 964 N VAL A 63 -7.358 4.071 0.358 1.00 0.00 N ATOM 965 CA VAL A 63 -7.409 4.730 -0.932 1.00 0.00 C ATOM 966 C VAL A 63 -6.909 3.799 -2.026 1.00 0.00 C ATOM 967 O VAL A 63 -5.764 3.351 -1.999 1.00 0.00 O ATOM 968 CB VAL A 63 -6.571 6.025 -0.938 1.00 0.00 C ATOM 969 CG1 VAL A 63 -6.702 6.738 -2.274 1.00 0.00 C ATOM 970 CG2 VAL A 63 -6.990 6.941 0.205 1.00 0.00 C ATOM 0 H VAL A 63 -6.445 4.105 0.811 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.450 4.991 -1.123 1.00 0.00 H new ATOM 0 HB VAL A 63 -5.524 5.758 -0.794 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.104 7.649 -2.260 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -6.349 6.084 -3.071 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -7.747 6.992 -2.450 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.387 7.849 0.183 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.043 7.202 0.095 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -6.840 6.429 1.155 1.00 0.00 H new ATOM 980 N LEU A 64 -7.783 3.512 -2.973 1.00 0.00 N ATOM 981 CA LEU A 64 -7.455 2.642 -4.093 1.00 0.00 C ATOM 982 C LEU A 64 -6.999 3.481 -5.279 1.00 0.00 C ATOM 983 O LEU A 64 -7.584 4.526 -5.554 1.00 0.00 O ATOM 984 CB LEU A 64 -8.687 1.818 -4.482 1.00 0.00 C ATOM 985 CG LEU A 64 -9.306 0.994 -3.350 1.00 0.00 C ATOM 986 CD1 LEU A 64 -10.636 0.401 -3.778 1.00 0.00 C ATOM 987 CD2 LEU A 64 -8.360 -0.109 -2.920 1.00 0.00 C ATOM 0 H LEU A 64 -8.737 3.872 -2.990 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.649 1.968 -3.802 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.447 2.494 -4.875 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -8.411 1.143 -5.292 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.481 1.659 -2.504 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -11.056 -0.180 -2.957 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.324 1.204 -4.044 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -10.484 -0.247 -4.641 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.815 -0.685 -2.115 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.158 -0.765 -3.766 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.426 0.329 -2.569 1.00 0.00 H new ATOM 999 N THR A 65 -5.963 3.038 -5.972 1.00 0.00 N ATOM 1000 CA THR A 65 -5.481 3.751 -7.145 1.00 0.00 C ATOM 1001 C THR A 65 -5.353 2.807 -8.337 1.00 0.00 C ATOM 1002 O THR A 65 -4.783 1.717 -8.224 1.00 0.00 O ATOM 1003 CB THR A 65 -4.123 4.443 -6.887 1.00 0.00 C ATOM 1004 OG1 THR A 65 -3.140 3.487 -6.475 1.00 0.00 O ATOM 1005 CG2 THR A 65 -4.254 5.527 -5.826 1.00 0.00 C ATOM 0 H THR A 65 -5.441 2.192 -5.745 1.00 0.00 H new ATOM 0 HA THR A 65 -6.218 4.523 -7.369 1.00 0.00 H new ATOM 0 HB THR A 65 -3.805 4.904 -7.822 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.268 3.274 -5.527 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.284 5.997 -5.664 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.970 6.278 -6.160 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.602 5.083 -4.893 1.00 0.00 H new ATOM 1013 N ASP A 66 -5.905 3.219 -9.472 1.00 0.00 N ATOM 1014 CA ASP A 66 -5.839 2.421 -10.690 1.00 0.00 C ATOM 1015 C ASP A 66 -6.111 3.302 -11.899 1.00 0.00 C ATOM 1016 O ASP A 66 -6.880 4.262 -11.811 1.00 0.00 O ATOM 1017 CB ASP A 66 -6.846 1.265 -10.632 1.00 0.00 C ATOM 1018 CG ASP A 66 -6.814 0.388 -11.869 1.00 0.00 C ATOM 1019 OD1 ASP A 66 -5.871 -0.423 -12.009 1.00 0.00 O ATOM 1020 OD2 ASP A 66 -7.739 0.492 -12.698 1.00 0.00 O ATOM 0 H ASP A 66 -6.404 4.103 -9.574 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.839 1.997 -10.779 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.638 0.653 -9.754 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.850 1.671 -10.507 1.00 0.00 H new ATOM 1025 N ILE A 67 -5.468 2.999 -13.018 1.00 0.00 N ATOM 1026 CA ILE A 67 -5.667 3.773 -14.230 1.00 0.00 C ATOM 1027 C ILE A 67 -7.002 3.424 -14.878 1.00 0.00 C ATOM 1028 O ILE A 67 -7.165 2.351 -15.463 1.00 0.00 O ATOM 1029 CB ILE A 67 -4.526 3.565 -15.253 1.00 0.00 C ATOM 1030 CG1 ILE A 67 -3.180 3.965 -14.641 1.00 0.00 C ATOM 1031 CG2 ILE A 67 -4.794 4.374 -16.516 1.00 0.00 C ATOM 1032 CD1 ILE A 67 -2.020 3.853 -15.605 1.00 0.00 C ATOM 0 H ILE A 67 -4.808 2.227 -13.110 1.00 0.00 H new ATOM 0 HA ILE A 67 -5.666 4.822 -13.935 1.00 0.00 H new ATOM 0 HB ILE A 67 -4.486 2.508 -15.518 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -3.245 4.992 -14.281 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.983 3.335 -13.774 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -3.983 4.218 -17.227 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.735 4.051 -16.962 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.857 5.433 -16.264 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -1.100 4.152 -15.103 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -1.929 2.822 -15.946 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -2.194 4.504 -16.461 1.00 0.00 H new ATOM 1044 N LYS A 68 -7.951 4.348 -14.753 1.00 0.00 N ATOM 1045 CA LYS A 68 -9.281 4.212 -15.350 1.00 0.00 C ATOM 1046 C LYS A 68 -10.071 3.057 -14.724 1.00 0.00 C ATOM 1047 O LYS A 68 -10.376 2.068 -15.395 1.00 0.00 O ATOM 1048 CB LYS A 68 -9.177 4.009 -16.868 1.00 0.00 C ATOM 1049 CG LYS A 68 -8.380 5.088 -17.587 1.00 0.00 C ATOM 1050 CD LYS A 68 -8.227 4.773 -19.068 1.00 0.00 C ATOM 1051 CE LYS A 68 -7.449 3.483 -19.292 1.00 0.00 C ATOM 1052 NZ LYS A 68 -7.387 3.113 -20.732 1.00 0.00 N ATOM 0 H LYS A 68 -7.821 5.216 -14.233 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.819 5.138 -15.148 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -8.716 3.041 -17.063 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.182 3.974 -17.289 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -8.878 6.050 -17.468 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -7.395 5.180 -17.130 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -9.213 4.688 -19.526 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.715 5.597 -19.564 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.437 3.598 -18.903 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.917 2.675 -18.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.849 2.230 -20.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.351 2.978 -21.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -6.917 3.872 -21.266 1.00 0.00 H new ATOM 1066 N PRO A 69 -10.414 3.164 -13.429 1.00 0.00 N ATOM 1067 CA PRO A 69 -11.222 2.159 -12.732 1.00 0.00 C ATOM 1068 C PRO A 69 -12.698 2.269 -13.097 1.00 0.00 C ATOM 1069 O PRO A 69 -13.197 3.360 -13.388 1.00 0.00 O ATOM 1070 CB PRO A 69 -11.020 2.484 -11.242 1.00 0.00 C ATOM 1071 CG PRO A 69 -9.995 3.574 -11.195 1.00 0.00 C ATOM 1072 CD PRO A 69 -10.039 4.254 -12.531 1.00 0.00 C ATOM 0 HA PRO A 69 -10.923 1.145 -12.997 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -11.954 2.806 -10.782 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -10.681 1.605 -10.693 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -10.214 4.279 -10.393 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -9.003 3.166 -10.999 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -10.768 5.064 -12.550 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -9.075 4.686 -12.798 1.00 0.00 H new ATOM 1122 N ILE A 74 -12.549 3.607 -6.208 1.00 0.00 N ATOM 1123 CA ILE A 74 -11.162 3.623 -6.628 1.00 0.00 C ATOM 1124 C ILE A 74 -10.842 4.989 -7.221 1.00 0.00 C ATOM 1125 O ILE A 74 -11.637 5.536 -7.989 1.00 0.00 O ATOM 1126 CB ILE A 74 -10.869 2.527 -7.677 1.00 0.00 C ATOM 1127 CG1 ILE A 74 -11.404 1.171 -7.205 1.00 0.00 C ATOM 1128 CG2 ILE A 74 -9.372 2.440 -7.947 1.00 0.00 C ATOM 1129 CD1 ILE A 74 -11.229 0.057 -8.218 1.00 0.00 C ATOM 0 HA ILE A 74 -10.538 3.425 -5.756 1.00 0.00 H new ATOM 0 HB ILE A 74 -11.377 2.793 -8.604 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.896 0.892 -6.281 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -12.463 1.271 -6.969 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -9.180 1.664 -8.688 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.014 3.398 -8.324 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -8.849 2.196 -7.022 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -11.632 -0.871 -7.812 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -11.760 0.312 -9.135 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -10.169 -0.073 -8.437 1.00 0.00 H new ATOM 1141 N VAL A 75 -9.702 5.545 -6.857 1.00 0.00 N ATOM 1142 CA VAL A 75 -9.307 6.851 -7.347 1.00 0.00 C ATOM 1143 C VAL A 75 -8.758 6.737 -8.755 1.00 0.00 C ATOM 1144 O VAL A 75 -7.980 5.836 -9.070 1.00 0.00 O ATOM 1145 CB VAL A 75 -8.272 7.521 -6.415 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -7.839 8.874 -6.958 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -8.841 7.668 -5.011 1.00 0.00 C ATOM 0 H VAL A 75 -9.032 5.111 -6.222 1.00 0.00 H new ATOM 0 HA VAL A 75 -10.194 7.485 -7.361 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.392 6.880 -6.371 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.111 9.321 -6.281 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.388 8.744 -7.942 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.707 9.528 -7.040 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.101 8.141 -4.366 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -9.739 8.284 -5.045 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.091 6.684 -4.615 1.00 0.00 H new ATOM 1157 N ARG A 76 -9.177 7.664 -9.594 1.00 0.00 N ATOM 1158 CA ARG A 76 -8.871 7.620 -11.010 1.00 0.00 C ATOM 1159 C ARG A 76 -7.578 8.370 -11.309 1.00 0.00 C ATOM 1160 O ARG A 76 -7.426 8.975 -12.371 1.00 0.00 O ATOM 1161 CB ARG A 76 -10.042 8.209 -11.813 1.00 0.00 C ATOM 1162 CG ARG A 76 -11.276 7.310 -11.849 1.00 0.00 C ATOM 1163 CD ARG A 76 -12.019 7.252 -10.522 1.00 0.00 C ATOM 1164 NE ARG A 76 -12.845 8.432 -10.281 1.00 0.00 N ATOM 1165 CZ ARG A 76 -13.243 8.822 -9.070 1.00 0.00 C ATOM 1166 NH1 ARG A 76 -12.885 8.126 -7.994 1.00 0.00 N ATOM 1167 NH2 ARG A 76 -14.016 9.891 -8.933 1.00 0.00 N ATOM 0 H ARG A 76 -9.739 8.468 -9.313 1.00 0.00 H new ATOM 0 HA ARG A 76 -8.728 6.581 -11.307 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -10.318 9.172 -11.383 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -9.712 8.398 -12.834 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -11.955 7.669 -12.622 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -10.974 6.302 -12.133 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -12.650 6.363 -10.503 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -11.297 7.148 -9.712 1.00 0.00 H new ATOM 0 HE ARG A 76 -13.134 8.989 -11.085 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -12.305 7.293 -8.095 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -13.190 8.426 -7.068 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -14.308 10.418 -9.756 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -14.318 10.186 -8.005 1.00 0.00 H new ATOM 1181 N ASP A 77 -6.646 8.306 -10.372 1.00 0.00 N ATOM 1182 CA ASP A 77 -5.346 8.935 -10.540 1.00 0.00 C ATOM 1183 C ASP A 77 -4.394 7.943 -11.189 1.00 0.00 C ATOM 1184 O ASP A 77 -4.381 6.765 -10.831 1.00 0.00 O ATOM 1185 CB ASP A 77 -4.797 9.403 -9.189 1.00 0.00 C ATOM 1186 CG ASP A 77 -3.638 10.368 -9.337 1.00 0.00 C ATOM 1187 OD1 ASP A 77 -3.700 11.230 -10.243 1.00 0.00 O ATOM 1188 OD2 ASP A 77 -2.679 10.282 -8.544 1.00 0.00 O ATOM 0 H ASP A 77 -6.767 7.822 -9.482 1.00 0.00 H new ATOM 0 HA ASP A 77 -5.448 9.811 -11.181 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.595 9.883 -8.623 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -4.473 8.537 -8.612 1.00 0.00 H new ATOM 1193 N ASP A 78 -3.614 8.406 -12.149 1.00 0.00 N ATOM 1194 CA ASP A 78 -2.793 7.507 -12.949 1.00 0.00 C ATOM 1195 C ASP A 78 -1.372 7.418 -12.402 1.00 0.00 C ATOM 1196 O ASP A 78 -0.868 8.354 -11.786 1.00 0.00 O ATOM 1197 CB ASP A 78 -2.786 7.947 -14.414 1.00 0.00 C ATOM 1198 CG ASP A 78 -2.064 9.251 -14.648 1.00 0.00 C ATOM 1199 OD1 ASP A 78 -2.620 10.317 -14.311 1.00 0.00 O ATOM 1200 OD2 ASP A 78 -0.950 9.217 -15.205 1.00 0.00 O ATOM 0 H ASP A 78 -3.530 9.392 -12.395 1.00 0.00 H new ATOM 0 HA ASP A 78 -3.232 6.511 -12.890 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -2.318 7.169 -15.017 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.815 8.043 -14.761 1.00 0.00 H new ATOM 1205 N ILE A 79 -0.727 6.286 -12.659 1.00 0.00 N ATOM 1206 CA ILE A 79 0.558 5.967 -12.044 1.00 0.00 C ATOM 1207 C ILE A 79 1.701 6.827 -12.595 1.00 0.00 C ATOM 1208 O ILE A 79 2.683 7.074 -11.899 1.00 0.00 O ATOM 1209 CB ILE A 79 0.902 4.463 -12.213 1.00 0.00 C ATOM 1210 CG1 ILE A 79 2.156 4.095 -11.411 1.00 0.00 C ATOM 1211 CG2 ILE A 79 1.094 4.110 -13.684 1.00 0.00 C ATOM 1212 CD1 ILE A 79 2.006 4.294 -9.916 1.00 0.00 C ATOM 0 H ILE A 79 -1.076 5.568 -13.294 1.00 0.00 H new ATOM 0 HA ILE A 79 0.454 6.193 -10.983 1.00 0.00 H new ATOM 0 HB ILE A 79 0.063 3.885 -11.826 1.00 0.00 H new ATOM 0 HG12 ILE A 79 2.408 3.053 -11.606 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.993 4.697 -11.766 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.334 3.051 -13.776 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.176 4.323 -14.232 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.909 4.704 -14.097 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.933 4.013 -9.417 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.785 5.341 -9.709 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.191 3.671 -9.546 1.00 0.00 H new ATOM 1224 N THR A 80 1.580 7.299 -13.830 1.00 0.00 N ATOM 1225 CA THR A 80 2.640 8.105 -14.415 1.00 0.00 C ATOM 1226 C THR A 80 2.419 9.586 -14.097 1.00 0.00 C ATOM 1227 O THR A 80 3.143 10.460 -14.578 1.00 0.00 O ATOM 1228 CB THR A 80 2.762 7.881 -15.942 1.00 0.00 C ATOM 1229 OG1 THR A 80 3.948 8.511 -16.444 1.00 0.00 O ATOM 1230 CG2 THR A 80 1.553 8.421 -16.687 1.00 0.00 C ATOM 0 H THR A 80 0.774 7.141 -14.435 1.00 0.00 H new ATOM 0 HA THR A 80 3.582 7.786 -13.969 1.00 0.00 H new ATOM 0 HB THR A 80 2.816 6.805 -16.109 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.060 9.385 -16.016 1.00 0.00 H new ATOM 0 HG21 THR A 80 1.676 8.245 -17.756 1.00 0.00 H new ATOM 0 HG22 THR A 80 0.654 7.914 -16.337 1.00 0.00 H new ATOM 0 HG23 THR A 80 1.461 9.492 -16.504 1.00 0.00 H new ATOM 1238 N SER A 81 1.421 9.850 -13.267 1.00 0.00 N ATOM 1239 CA SER A 81 1.157 11.190 -12.774 1.00 0.00 C ATOM 1240 C SER A 81 0.477 11.117 -11.404 1.00 0.00 C ATOM 1241 O SER A 81 -0.622 11.645 -11.221 1.00 0.00 O ATOM 1242 CB SER A 81 0.279 11.956 -13.769 1.00 0.00 C ATOM 1243 OG SER A 81 0.079 13.301 -13.357 1.00 0.00 O ATOM 0 H SER A 81 0.774 9.143 -12.918 1.00 0.00 H new ATOM 0 HA SER A 81 2.102 11.722 -12.667 1.00 0.00 H new ATOM 0 HB2 SER A 81 0.745 11.941 -14.754 1.00 0.00 H new ATOM 0 HB3 SER A 81 -0.685 11.456 -13.865 1.00 0.00 H new ATOM 0 HG SER A 81 -0.386 13.313 -12.494 1.00 0.00 H new ATOM 1249 N PRO A 82 1.128 10.478 -10.413 1.00 0.00 N ATOM 1250 CA PRO A 82 0.526 10.260 -9.101 1.00 0.00 C ATOM 1251 C PRO A 82 0.496 11.533 -8.266 1.00 0.00 C ATOM 1252 O PRO A 82 1.503 12.244 -8.151 1.00 0.00 O ATOM 1253 CB PRO A 82 1.436 9.215 -8.460 1.00 0.00 C ATOM 1254 CG PRO A 82 2.768 9.429 -9.092 1.00 0.00 C ATOM 1255 CD PRO A 82 2.504 9.946 -10.482 1.00 0.00 C ATOM 0 HA PRO A 82 -0.514 9.943 -9.174 1.00 0.00 H new ATOM 0 HB2 PRO A 82 1.486 9.344 -7.379 1.00 0.00 H new ATOM 0 HB3 PRO A 82 1.069 8.205 -8.644 1.00 0.00 H new ATOM 0 HG2 PRO A 82 3.359 10.143 -8.518 1.00 0.00 H new ATOM 0 HG3 PRO A 82 3.335 8.499 -9.125 1.00 0.00 H new ATOM 0 HD2 PRO A 82 3.218 10.721 -10.761 1.00 0.00 H new ATOM 0 HD3 PRO A 82 2.588 9.153 -11.225 1.00 0.00 H new ATOM 1263 N ARG A 83 -0.660 11.830 -7.699 1.00 0.00 N ATOM 1264 CA ARG A 83 -0.819 13.027 -6.895 1.00 0.00 C ATOM 1265 C ARG A 83 -0.395 12.781 -5.464 1.00 0.00 C ATOM 1266 O ARG A 83 -0.958 11.932 -4.769 1.00 0.00 O ATOM 1267 CB ARG A 83 -2.261 13.521 -6.937 1.00 0.00 C ATOM 1268 CG ARG A 83 -2.743 13.737 -8.347 1.00 0.00 C ATOM 1269 CD ARG A 83 -3.999 14.585 -8.409 1.00 0.00 C ATOM 1270 NE ARG A 83 -3.730 15.973 -8.036 1.00 0.00 N ATOM 1271 CZ ARG A 83 -2.976 16.812 -8.748 1.00 0.00 C ATOM 1272 NH1 ARG A 83 -2.396 16.414 -9.879 1.00 0.00 N ATOM 1273 NH2 ARG A 83 -2.796 18.052 -8.317 1.00 0.00 N ATOM 0 H ARG A 83 -1.501 11.259 -7.781 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.174 13.797 -7.318 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.907 12.797 -6.440 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.341 14.454 -6.380 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.955 14.218 -8.927 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.938 12.771 -8.813 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.412 14.552 -9.417 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.754 14.168 -7.742 1.00 0.00 H new ATOM 0 HE ARG A 83 -4.147 16.323 -7.173 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -2.526 15.458 -10.210 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -1.822 17.065 -10.414 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.232 18.358 -7.447 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.221 18.700 -8.855 1.00 0.00 H new ATOM 1287 N MET A 84 0.588 13.549 -5.023 1.00 0.00 N ATOM 1288 CA MET A 84 1.101 13.437 -3.670 1.00 0.00 C ATOM 1289 C MET A 84 0.015 13.770 -2.659 1.00 0.00 C ATOM 1290 O MET A 84 0.082 13.345 -1.510 1.00 0.00 O ATOM 1291 CB MET A 84 2.304 14.364 -3.466 1.00 0.00 C ATOM 1292 CG MET A 84 3.516 13.985 -4.302 1.00 0.00 C ATOM 1293 SD MET A 84 4.143 12.339 -3.911 1.00 0.00 S ATOM 1294 CE MET A 84 4.609 12.547 -2.191 1.00 0.00 C ATOM 0 H MET A 84 1.049 14.262 -5.589 1.00 0.00 H new ATOM 0 HA MET A 84 1.424 12.407 -3.517 1.00 0.00 H new ATOM 0 HB2 MET A 84 2.010 15.385 -3.710 1.00 0.00 H new ATOM 0 HB3 MET A 84 2.583 14.356 -2.412 1.00 0.00 H new ATOM 0 HG2 MET A 84 3.251 14.027 -5.359 1.00 0.00 H new ATOM 0 HG3 MET A 84 4.307 14.718 -4.142 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.174 11.676 -1.859 1.00 0.00 H new ATOM 0 HE2 MET A 84 5.225 13.440 -2.086 1.00 0.00 H new ATOM 0 HE3 MET A 84 3.712 12.651 -1.581 1.00 0.00 H new ATOM 1304 N GLU A 85 -1.007 14.501 -3.102 1.00 0.00 N ATOM 1305 CA GLU A 85 -2.096 14.903 -2.214 1.00 0.00 C ATOM 1306 C GLU A 85 -2.896 13.686 -1.751 1.00 0.00 C ATOM 1307 O GLU A 85 -3.570 13.720 -0.721 1.00 0.00 O ATOM 1308 CB GLU A 85 -3.018 15.898 -2.921 1.00 0.00 C ATOM 1309 CG GLU A 85 -3.665 15.343 -4.177 1.00 0.00 C ATOM 1310 CD GLU A 85 -4.665 16.299 -4.782 1.00 0.00 C ATOM 1311 OE1 GLU A 85 -5.836 16.289 -4.349 1.00 0.00 O ATOM 1312 OE2 GLU A 85 -4.290 17.059 -5.694 1.00 0.00 O ATOM 0 H GLU A 85 -1.103 14.825 -4.064 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.661 15.384 -1.338 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.799 16.211 -2.228 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -2.446 16.789 -3.181 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.892 15.118 -4.911 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -4.163 14.403 -3.940 1.00 0.00 H new ATOM 1319 N ILE A 86 -2.801 12.611 -2.515 1.00 0.00 N ATOM 1320 CA ILE A 86 -3.514 11.387 -2.207 1.00 0.00 C ATOM 1321 C ILE A 86 -2.708 10.529 -1.236 1.00 0.00 C ATOM 1322 O ILE A 86 -3.267 9.816 -0.406 1.00 0.00 O ATOM 1323 CB ILE A 86 -3.801 10.588 -3.497 1.00 0.00 C ATOM 1324 CG1 ILE A 86 -4.580 11.458 -4.488 1.00 0.00 C ATOM 1325 CG2 ILE A 86 -4.572 9.314 -3.185 1.00 0.00 C ATOM 1326 CD1 ILE A 86 -4.820 10.797 -5.826 1.00 0.00 C ATOM 0 H ILE A 86 -2.231 12.564 -3.360 1.00 0.00 H new ATOM 0 HA ILE A 86 -4.462 11.654 -1.740 1.00 0.00 H new ATOM 0 HB ILE A 86 -2.850 10.304 -3.948 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -5.541 11.722 -4.047 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -4.035 12.389 -4.646 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.762 8.768 -4.109 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.986 8.690 -2.509 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.521 9.569 -2.712 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.377 11.475 -6.472 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.863 10.557 -6.290 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.393 9.881 -5.682 1.00 0.00 H new ATOM 1338 N TYR A 87 -1.388 10.623 -1.327 1.00 0.00 N ATOM 1339 CA TYR A 87 -0.509 9.799 -0.505 1.00 0.00 C ATOM 1340 C TYR A 87 -0.196 10.474 0.825 1.00 0.00 C ATOM 1341 O TYR A 87 0.111 9.806 1.812 1.00 0.00 O ATOM 1342 CB TYR A 87 0.794 9.502 -1.248 1.00 0.00 C ATOM 1343 CG TYR A 87 0.596 8.813 -2.581 1.00 0.00 C ATOM 1344 CD1 TYR A 87 0.257 7.468 -2.643 1.00 0.00 C ATOM 1345 CD2 TYR A 87 0.750 9.506 -3.774 1.00 0.00 C ATOM 1346 CE1 TYR A 87 0.075 6.834 -3.856 1.00 0.00 C ATOM 1347 CE2 TYR A 87 0.571 8.878 -4.992 1.00 0.00 C ATOM 1348 CZ TYR A 87 0.234 7.542 -5.028 1.00 0.00 C ATOM 1349 OH TYR A 87 0.053 6.913 -6.236 1.00 0.00 O ATOM 0 H TYR A 87 -0.903 11.259 -1.959 1.00 0.00 H new ATOM 0 HA TYR A 87 -1.032 8.864 -0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.330 10.437 -1.409 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.426 8.877 -0.617 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.134 6.909 -1.727 1.00 0.00 H new ATOM 0 HD2 TYR A 87 1.014 10.553 -3.750 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -0.191 5.788 -3.886 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.695 9.431 -5.911 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.272 7.560 -6.896 1.00 0.00 H new ATOM 1359 N ARG A 88 -0.262 11.798 0.850 1.00 0.00 N ATOM 1360 CA ARG A 88 0.041 12.546 2.064 1.00 0.00 C ATOM 1361 C ARG A 88 -1.057 12.379 3.094 1.00 0.00 C ATOM 1362 O ARG A 88 -2.238 12.289 2.757 1.00 0.00 O ATOM 1363 CB ARG A 88 0.259 14.028 1.767 1.00 0.00 C ATOM 1364 CG ARG A 88 1.507 14.293 0.952 1.00 0.00 C ATOM 1365 CD ARG A 88 1.750 15.777 0.760 1.00 0.00 C ATOM 1366 NE ARG A 88 2.190 16.418 1.996 1.00 0.00 N ATOM 1367 CZ ARG A 88 2.299 17.734 2.156 1.00 0.00 C ATOM 1368 NH1 ARG A 88 1.983 18.561 1.165 1.00 0.00 N ATOM 1369 NH2 ARG A 88 2.720 18.228 3.313 1.00 0.00 N ATOM 0 H ARG A 88 -0.521 12.374 0.049 1.00 0.00 H new ATOM 0 HA ARG A 88 0.967 12.139 2.471 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -0.607 14.416 1.231 1.00 0.00 H new ATOM 0 HB3 ARG A 88 0.323 14.575 2.707 1.00 0.00 H new ATOM 0 HG2 ARG A 88 2.368 13.845 1.449 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.415 13.811 -0.021 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.503 15.925 -0.014 1.00 0.00 H new ATOM 0 HD3 ARG A 88 0.834 16.253 0.409 1.00 0.00 H new ATOM 0 HE ARG A 88 2.429 15.819 2.786 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.654 18.188 0.274 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.069 19.569 1.295 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.960 17.599 4.079 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.804 19.237 3.436 1.00 0.00 H new ATOM 1383 N GLY A 89 -0.650 12.325 4.347 1.00 0.00 N ATOM 1384 CA GLY A 89 -1.592 12.137 5.433 1.00 0.00 C ATOM 1385 C GLY A 89 -1.985 10.685 5.599 1.00 0.00 C ATOM 1386 O GLY A 89 -2.928 10.363 6.326 1.00 0.00 O ATOM 0 H GLY A 89 0.324 12.408 4.638 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.152 12.502 6.361 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -2.484 12.735 5.246 1.00 0.00 H new ATOM 1390 N ALA A 90 -1.263 9.807 4.917 1.00 0.00 N ATOM 1391 CA ALA A 90 -1.508 8.378 5.003 1.00 0.00 C ATOM 1392 C ALA A 90 -0.575 7.742 6.020 1.00 0.00 C ATOM 1393 O ALA A 90 0.504 8.267 6.303 1.00 0.00 O ATOM 1394 CB ALA A 90 -1.331 7.719 3.643 1.00 0.00 C ATOM 0 H ALA A 90 -0.497 10.064 4.294 1.00 0.00 H new ATOM 0 HA ALA A 90 -2.537 8.227 5.328 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -1.519 6.649 3.730 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.034 8.155 2.933 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.312 7.881 3.290 1.00 0.00 H new ATOM 1400 N ALA A 91 -0.996 6.618 6.572 1.00 0.00 N ATOM 1401 CA ALA A 91 -0.196 5.912 7.557 1.00 0.00 C ATOM 1402 C ALA A 91 0.574 4.768 6.916 1.00 0.00 C ATOM 1403 O ALA A 91 1.607 4.334 7.429 1.00 0.00 O ATOM 1404 CB ALA A 91 -1.079 5.391 8.680 1.00 0.00 C ATOM 0 H ALA A 91 -1.888 6.174 6.355 1.00 0.00 H new ATOM 0 HA ALA A 91 0.526 6.615 7.974 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -0.465 4.864 9.411 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.583 6.227 9.165 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.823 4.708 8.271 1.00 0.00 H new ATOM 1410 N LEU A 92 0.079 4.280 5.785 1.00 0.00 N ATOM 1411 CA LEU A 92 0.706 3.150 5.124 1.00 0.00 C ATOM 1412 C LEU A 92 0.353 3.126 3.640 1.00 0.00 C ATOM 1413 O LEU A 92 -0.749 3.511 3.246 1.00 0.00 O ATOM 1414 CB LEU A 92 0.271 1.850 5.809 1.00 0.00 C ATOM 1415 CG LEU A 92 1.209 0.660 5.610 1.00 0.00 C ATOM 1416 CD1 LEU A 92 1.111 -0.290 6.791 1.00 0.00 C ATOM 1417 CD2 LEU A 92 0.880 -0.084 4.323 1.00 0.00 C ATOM 0 H LEU A 92 -0.747 4.647 5.313 1.00 0.00 H new ATOM 0 HA LEU A 92 1.789 3.248 5.204 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.171 2.038 6.878 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.718 1.578 5.440 1.00 0.00 H new ATOM 0 HG LEU A 92 2.227 1.042 5.539 1.00 0.00 H new ATOM 0 HD11 LEU A 92 1.784 -1.133 6.636 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.391 0.235 7.704 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.088 -0.654 6.881 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.562 -0.926 4.205 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.145 -0.451 4.367 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.988 0.592 3.474 1.00 0.00 H new ATOM 1429 N ILE A 93 1.309 2.690 2.827 1.00 0.00 N ATOM 1430 CA ILE A 93 1.123 2.568 1.389 1.00 0.00 C ATOM 1431 C ILE A 93 1.634 1.203 0.935 1.00 0.00 C ATOM 1432 O ILE A 93 2.739 0.806 1.299 1.00 0.00 O ATOM 1433 CB ILE A 93 1.886 3.677 0.623 1.00 0.00 C ATOM 1434 CG1 ILE A 93 1.492 5.066 1.146 1.00 0.00 C ATOM 1435 CG2 ILE A 93 1.610 3.578 -0.872 1.00 0.00 C ATOM 1436 CD1 ILE A 93 2.336 6.194 0.585 1.00 0.00 C ATOM 0 H ILE A 93 2.236 2.411 3.149 1.00 0.00 H new ATOM 0 HA ILE A 93 0.060 2.673 1.171 1.00 0.00 H new ATOM 0 HB ILE A 93 2.954 3.535 0.791 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.446 5.252 0.903 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.572 5.071 2.233 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.154 4.365 -1.395 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.937 2.605 -1.239 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.541 3.694 -1.053 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.998 7.143 1.001 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.381 6.033 0.851 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.237 6.218 -0.500 1.00 0.00 H new ATOM 1448 N TYR A 94 0.842 0.476 0.158 1.00 0.00 N ATOM 1449 CA TYR A 94 1.259 -0.841 -0.305 1.00 0.00 C ATOM 1450 C TYR A 94 0.855 -1.052 -1.756 1.00 0.00 C ATOM 1451 O TYR A 94 -0.075 -0.418 -2.243 1.00 0.00 O ATOM 1452 CB TYR A 94 0.690 -1.952 0.595 1.00 0.00 C ATOM 1453 CG TYR A 94 -0.822 -2.063 0.613 1.00 0.00 C ATOM 1454 CD1 TYR A 94 -1.596 -1.184 1.363 1.00 0.00 C ATOM 1455 CD2 TYR A 94 -1.472 -3.061 -0.105 1.00 0.00 C ATOM 1456 CE1 TYR A 94 -2.972 -1.297 1.392 1.00 0.00 C ATOM 1457 CE2 TYR A 94 -2.847 -3.179 -0.077 1.00 0.00 C ATOM 1458 CZ TYR A 94 -3.591 -2.295 0.672 1.00 0.00 C ATOM 1459 OH TYR A 94 -4.960 -2.408 0.702 1.00 0.00 O ATOM 0 H TYR A 94 -0.081 0.771 -0.162 1.00 0.00 H new ATOM 0 HA TYR A 94 2.346 -0.892 -0.244 1.00 0.00 H new ATOM 0 HB2 TYR A 94 1.104 -2.907 0.270 1.00 0.00 H new ATOM 0 HB3 TYR A 94 1.037 -1.784 1.614 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -1.114 -0.402 1.931 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.891 -3.755 -0.694 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -3.561 -0.606 1.977 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -3.337 -3.960 -0.639 1.00 0.00 H new ATOM 0 HH TYR A 94 -5.238 -3.162 0.141 1.00 0.00 H new ATOM 1469 N SER A 95 1.559 -1.933 -2.446 1.00 0.00 N ATOM 1470 CA SER A 95 1.302 -2.166 -3.858 1.00 0.00 C ATOM 1471 C SER A 95 1.458 -3.642 -4.208 1.00 0.00 C ATOM 1472 O SER A 95 2.263 -4.353 -3.600 1.00 0.00 O ATOM 1473 CB SER A 95 2.246 -1.308 -4.702 1.00 0.00 C ATOM 1474 OG SER A 95 3.577 -1.393 -4.217 1.00 0.00 O ATOM 0 H SER A 95 2.312 -2.498 -2.053 1.00 0.00 H new ATOM 0 HA SER A 95 0.272 -1.883 -4.076 1.00 0.00 H new ATOM 0 HB2 SER A 95 2.212 -1.636 -5.741 1.00 0.00 H new ATOM 0 HB3 SER A 95 1.914 -0.270 -4.685 1.00 0.00 H new ATOM 0 HG SER A 95 3.833 -0.538 -3.811 1.00 0.00 H new ATOM 1480 N ILE A 96 0.680 -4.100 -5.178 1.00 0.00 N ATOM 1481 CA ILE A 96 0.732 -5.492 -5.599 1.00 0.00 C ATOM 1482 C ILE A 96 1.585 -5.641 -6.857 1.00 0.00 C ATOM 1483 O ILE A 96 1.093 -5.477 -7.972 1.00 0.00 O ATOM 1484 CB ILE A 96 -0.680 -6.060 -5.869 1.00 0.00 C ATOM 1485 CG1 ILE A 96 -1.603 -5.821 -4.667 1.00 0.00 C ATOM 1486 CG2 ILE A 96 -0.603 -7.549 -6.191 1.00 0.00 C ATOM 1487 CD1 ILE A 96 -1.157 -6.515 -3.396 1.00 0.00 C ATOM 0 H ILE A 96 0.006 -3.529 -5.688 1.00 0.00 H new ATOM 0 HA ILE A 96 1.182 -6.058 -4.783 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.098 -5.538 -6.730 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -1.667 -4.749 -4.479 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -2.607 -6.161 -4.921 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -1.606 -7.933 -6.378 1.00 0.00 H new ATOM 0 HG22 ILE A 96 0.014 -7.698 -7.077 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.162 -8.081 -5.348 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -1.863 -6.295 -2.595 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.121 -7.592 -3.563 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -0.166 -6.158 -3.115 1.00 0.00 H new ATOM 1499 N ARG A 97 2.871 -5.925 -6.653 1.00 0.00 N ATOM 1500 CA ARG A 97 3.827 -6.145 -7.745 1.00 0.00 C ATOM 1501 C ARG A 97 3.852 -4.984 -8.742 1.00 0.00 C ATOM 1502 O ARG A 97 3.296 -5.078 -9.838 1.00 0.00 O ATOM 1503 CB ARG A 97 3.531 -7.462 -8.472 1.00 0.00 C ATOM 1504 CG ARG A 97 3.703 -8.688 -7.593 1.00 0.00 C ATOM 1505 CD ARG A 97 3.433 -9.970 -8.359 1.00 0.00 C ATOM 1506 NE ARG A 97 3.609 -11.147 -7.517 1.00 0.00 N ATOM 1507 CZ ARG A 97 3.573 -12.399 -7.965 1.00 0.00 C ATOM 1508 NH1 ARG A 97 3.403 -12.649 -9.261 1.00 0.00 N ATOM 1509 NH2 ARG A 97 3.724 -13.404 -7.112 1.00 0.00 N ATOM 0 H ARG A 97 3.283 -6.010 -5.724 1.00 0.00 H new ATOM 0 HA ARG A 97 4.815 -6.204 -7.289 1.00 0.00 H new ATOM 0 HB2 ARG A 97 2.510 -7.437 -8.852 1.00 0.00 H new ATOM 0 HB3 ARG A 97 4.190 -7.548 -9.336 1.00 0.00 H new ATOM 0 HG2 ARG A 97 4.717 -8.710 -7.193 1.00 0.00 H new ATOM 0 HG3 ARG A 97 3.026 -8.623 -6.741 1.00 0.00 H new ATOM 0 HD2 ARG A 97 2.416 -9.952 -8.752 1.00 0.00 H new ATOM 0 HD3 ARG A 97 4.105 -10.031 -9.215 1.00 0.00 H new ATOM 0 HE ARG A 97 3.770 -11.001 -6.520 1.00 0.00 H new ATOM 0 HH11 ARG A 97 3.299 -11.877 -9.920 1.00 0.00 H new ATOM 0 HH12 ARG A 97 3.377 -13.612 -9.595 1.00 0.00 H new ATOM 0 HH21 ARG A 97 3.867 -13.214 -6.120 1.00 0.00 H new ATOM 0 HH22 ARG A 97 3.698 -14.367 -7.448 1.00 0.00 H new ATOM 1523 N PRO A 98 4.498 -3.871 -8.369 1.00 0.00 N ATOM 1524 CA PRO A 98 4.611 -2.701 -9.235 1.00 0.00 C ATOM 1525 C PRO A 98 5.724 -2.855 -10.276 1.00 0.00 C ATOM 1526 O PRO A 98 6.640 -3.665 -10.100 1.00 0.00 O ATOM 1527 CB PRO A 98 4.943 -1.583 -8.249 1.00 0.00 C ATOM 1528 CG PRO A 98 5.702 -2.255 -7.156 1.00 0.00 C ATOM 1529 CD PRO A 98 5.173 -3.664 -7.072 1.00 0.00 C ATOM 0 HA PRO A 98 3.707 -2.524 -9.818 1.00 0.00 H new ATOM 0 HB2 PRO A 98 5.538 -0.802 -8.722 1.00 0.00 H new ATOM 0 HB3 PRO A 98 4.038 -1.109 -7.869 1.00 0.00 H new ATOM 0 HG2 PRO A 98 6.771 -2.254 -7.369 1.00 0.00 H new ATOM 0 HG3 PRO A 98 5.565 -1.732 -6.210 1.00 0.00 H new ATOM 0 HD2 PRO A 98 5.977 -4.384 -6.922 1.00 0.00 H new ATOM 0 HD3 PRO A 98 4.480 -3.781 -6.239 1.00 0.00 H new ATOM 1537 N PRO A 99 5.637 -2.104 -11.389 1.00 0.00 N ATOM 1538 CA PRO A 99 6.691 -2.069 -12.409 1.00 0.00 C ATOM 1539 C PRO A 99 8.031 -1.642 -11.820 1.00 0.00 C ATOM 1540 O PRO A 99 8.086 -0.757 -10.965 1.00 0.00 O ATOM 1541 CB PRO A 99 6.199 -1.025 -13.414 1.00 0.00 C ATOM 1542 CG PRO A 99 4.729 -0.939 -13.200 1.00 0.00 C ATOM 1543 CD PRO A 99 4.497 -1.249 -11.747 1.00 0.00 C ATOM 0 HA PRO A 99 6.859 -3.050 -12.853 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.678 -0.061 -13.246 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.431 -1.323 -14.436 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.357 0.054 -13.450 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.201 -1.647 -13.838 1.00 0.00 H new ATOM 0 HD2 PRO A 99 4.471 -0.342 -11.143 1.00 0.00 H new ATOM 0 HD3 PRO A 99 3.548 -1.762 -11.593 1.00 0.00 H new ATOM 1551 N ALA A 100 9.103 -2.253 -12.297 1.00 0.00 N ATOM 1552 CA ALA A 100 10.437 -2.006 -11.759 1.00 0.00 C ATOM 1553 C ALA A 100 10.876 -0.558 -11.959 1.00 0.00 C ATOM 1554 O ALA A 100 11.724 -0.051 -11.225 1.00 0.00 O ATOM 1555 CB ALA A 100 11.437 -2.960 -12.392 1.00 0.00 C ATOM 0 H ALA A 100 9.078 -2.929 -13.061 1.00 0.00 H new ATOM 0 HA ALA A 100 10.400 -2.184 -10.684 1.00 0.00 H new ATOM 0 HB1 ALA A 100 12.430 -2.769 -11.985 1.00 0.00 H new ATOM 0 HB2 ALA A 100 11.147 -3.988 -12.174 1.00 0.00 H new ATOM 0 HB3 ALA A 100 11.452 -2.808 -13.471 1.00 0.00 H new ATOM 1561 N GLU A 101 10.280 0.109 -12.935 1.00 0.00 N ATOM 1562 CA GLU A 101 10.663 1.475 -13.270 1.00 0.00 C ATOM 1563 C GLU A 101 10.146 2.485 -12.244 1.00 0.00 C ATOM 1564 O GLU A 101 10.537 3.652 -12.270 1.00 0.00 O ATOM 1565 CB GLU A 101 10.144 1.836 -14.658 1.00 0.00 C ATOM 1566 CG GLU A 101 8.627 1.873 -14.755 1.00 0.00 C ATOM 1567 CD GLU A 101 8.147 1.938 -16.186 1.00 0.00 C ATOM 1568 OE1 GLU A 101 8.286 3.006 -16.819 1.00 0.00 O ATOM 1569 OE2 GLU A 101 7.631 0.917 -16.681 1.00 0.00 O ATOM 0 H GLU A 101 9.529 -0.272 -13.510 1.00 0.00 H new ATOM 0 HA GLU A 101 11.752 1.521 -13.259 1.00 0.00 H new ATOM 0 HB2 GLU A 101 10.541 2.811 -14.942 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.527 1.113 -15.378 1.00 0.00 H new ATOM 0 HG2 GLU A 101 8.212 0.987 -14.275 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.251 2.737 -14.208 1.00 0.00 H new ATOM 1576 N ILE A 102 9.267 2.052 -11.344 1.00 0.00 N ATOM 1577 CA ILE A 102 8.695 2.974 -10.365 1.00 0.00 C ATOM 1578 C ILE A 102 8.988 2.556 -8.930 1.00 0.00 C ATOM 1579 O ILE A 102 8.447 3.140 -7.992 1.00 0.00 O ATOM 1580 CB ILE A 102 7.174 3.131 -10.523 1.00 0.00 C ATOM 1581 CG1 ILE A 102 6.470 1.780 -10.398 1.00 0.00 C ATOM 1582 CG2 ILE A 102 6.836 3.799 -11.850 1.00 0.00 C ATOM 1583 CD1 ILE A 102 4.962 1.890 -10.349 1.00 0.00 C ATOM 0 H ILE A 102 8.940 1.089 -11.271 1.00 0.00 H new ATOM 0 HA ILE A 102 9.178 3.930 -10.567 1.00 0.00 H new ATOM 0 HB ILE A 102 6.814 3.773 -9.719 1.00 0.00 H new ATOM 0 HG12 ILE A 102 6.754 1.151 -11.242 1.00 0.00 H new ATOM 0 HG13 ILE A 102 6.820 1.279 -9.496 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.755 3.900 -11.941 1.00 0.00 H new ATOM 0 HG22 ILE A 102 7.297 4.786 -11.889 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.214 3.189 -12.671 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.527 0.894 -10.260 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.669 2.492 -9.489 1.00 0.00 H new ATOM 0 HD13 ILE A 102 4.602 2.363 -11.263 1.00 0.00 H new ATOM 1595 N HIS A 103 9.844 1.562 -8.762 1.00 0.00 N ATOM 1596 CA HIS A 103 10.235 1.102 -7.426 1.00 0.00 C ATOM 1597 C HIS A 103 10.754 2.262 -6.581 1.00 0.00 C ATOM 1598 O HIS A 103 10.288 2.493 -5.464 1.00 0.00 O ATOM 1599 CB HIS A 103 11.311 0.013 -7.509 1.00 0.00 C ATOM 1600 CG HIS A 103 10.818 -1.303 -8.028 1.00 0.00 C ATOM 1601 ND1 HIS A 103 9.482 -1.623 -8.034 1.00 0.00 N ATOM 1602 CD2 HIS A 103 11.522 -2.340 -8.536 1.00 0.00 C ATOM 1603 CE1 HIS A 103 9.405 -2.840 -8.544 1.00 0.00 C ATOM 1604 NE2 HIS A 103 10.617 -3.317 -8.860 1.00 0.00 N ATOM 0 H HIS A 103 10.285 1.054 -9.529 1.00 0.00 H new ATOM 0 HA HIS A 103 9.346 0.685 -6.954 1.00 0.00 H new ATOM 0 HB2 HIS A 103 12.118 0.364 -8.152 1.00 0.00 H new ATOM 0 HB3 HIS A 103 11.736 -0.137 -6.517 1.00 0.00 H new ATOM 0 HD2 HIS A 103 12.593 -2.389 -8.662 1.00 0.00 H new ATOM 0 HE1 HIS A 103 8.482 -3.382 -8.688 1.00 0.00 H new ATOM 0 HE2 HIS A 103 10.826 -4.230 -9.263 1.00 0.00 H new ATOM 1612 N SER A 104 11.697 3.011 -7.136 1.00 0.00 N ATOM 1613 CA SER A 104 12.283 4.145 -6.438 1.00 0.00 C ATOM 1614 C SER A 104 11.253 5.258 -6.276 1.00 0.00 C ATOM 1615 O SER A 104 11.303 6.030 -5.317 1.00 0.00 O ATOM 1616 CB SER A 104 13.512 4.657 -7.199 1.00 0.00 C ATOM 1617 OG SER A 104 14.073 5.806 -6.579 1.00 0.00 O ATOM 0 H SER A 104 12.073 2.852 -8.071 1.00 0.00 H new ATOM 0 HA SER A 104 12.599 3.821 -5.446 1.00 0.00 H new ATOM 0 HB2 SER A 104 14.263 3.868 -7.251 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.231 4.897 -8.224 1.00 0.00 H new ATOM 0 HG SER A 104 14.855 6.104 -7.089 1.00 0.00 H new ATOM 1623 N SER A 105 10.309 5.316 -7.207 1.00 0.00 N ATOM 1624 CA SER A 105 9.269 6.329 -7.180 1.00 0.00 C ATOM 1625 C SER A 105 8.330 6.077 -6.008 1.00 0.00 C ATOM 1626 O SER A 105 8.001 6.989 -5.257 1.00 0.00 O ATOM 1627 CB SER A 105 8.495 6.329 -8.503 1.00 0.00 C ATOM 1628 OG SER A 105 7.549 7.381 -8.548 1.00 0.00 O ATOM 0 H SER A 105 10.245 4.669 -7.993 1.00 0.00 H new ATOM 0 HA SER A 105 9.729 7.309 -7.053 1.00 0.00 H new ATOM 0 HB2 SER A 105 9.193 6.429 -9.334 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.985 5.374 -8.628 1.00 0.00 H new ATOM 0 HG SER A 105 7.072 7.356 -9.404 1.00 0.00 H new ATOM 1634 N LEU A 106 7.929 4.829 -5.834 1.00 0.00 N ATOM 1635 CA LEU A 106 7.053 4.460 -4.735 1.00 0.00 C ATOM 1636 C LEU A 106 7.739 4.681 -3.390 1.00 0.00 C ATOM 1637 O LEU A 106 7.119 5.159 -2.436 1.00 0.00 O ATOM 1638 CB LEU A 106 6.624 3.003 -4.877 1.00 0.00 C ATOM 1639 CG LEU A 106 5.701 2.711 -6.061 1.00 0.00 C ATOM 1640 CD1 LEU A 106 5.328 1.239 -6.093 1.00 0.00 C ATOM 1641 CD2 LEU A 106 4.449 3.578 -5.999 1.00 0.00 C ATOM 0 H LEU A 106 8.196 4.054 -6.440 1.00 0.00 H new ATOM 0 HA LEU A 106 6.170 5.097 -4.772 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.517 2.385 -4.971 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.120 2.698 -3.960 1.00 0.00 H new ATOM 0 HG LEU A 106 6.237 2.953 -6.979 1.00 0.00 H new ATOM 0 HD11 LEU A 106 4.671 1.049 -6.942 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.231 0.637 -6.191 1.00 0.00 H new ATOM 0 HD13 LEU A 106 4.814 0.974 -5.169 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.808 3.353 -6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.909 3.372 -5.075 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.733 4.630 -6.027 1.00 0.00 H new ATOM 1653 N MET A 107 9.022 4.345 -3.321 1.00 0.00 N ATOM 1654 CA MET A 107 9.783 4.503 -2.088 1.00 0.00 C ATOM 1655 C MET A 107 9.926 5.975 -1.711 1.00 0.00 C ATOM 1656 O MET A 107 9.769 6.339 -0.545 1.00 0.00 O ATOM 1657 CB MET A 107 11.166 3.853 -2.206 1.00 0.00 C ATOM 1658 CG MET A 107 11.123 2.343 -2.405 1.00 0.00 C ATOM 1659 SD MET A 107 12.729 1.564 -2.141 1.00 0.00 S ATOM 1660 CE MET A 107 12.973 1.904 -0.399 1.00 0.00 C ATOM 0 H MET A 107 9.555 3.963 -4.102 1.00 0.00 H new ATOM 0 HA MET A 107 9.229 3.998 -1.297 1.00 0.00 H new ATOM 0 HB2 MET A 107 11.699 4.305 -3.043 1.00 0.00 H new ATOM 0 HB3 MET A 107 11.739 4.075 -1.306 1.00 0.00 H new ATOM 0 HG2 MET A 107 10.396 1.910 -1.718 1.00 0.00 H new ATOM 0 HG3 MET A 107 10.778 2.123 -3.415 1.00 0.00 H new ATOM 0 HE1 MET A 107 13.447 1.045 0.076 1.00 0.00 H new ATOM 0 HE2 MET A 107 13.611 2.780 -0.285 1.00 0.00 H new ATOM 0 HE3 MET A 107 12.009 2.094 0.073 1.00 0.00 H new ATOM 1670 N ARG A 108 10.203 6.828 -2.697 1.00 0.00 N ATOM 1671 CA ARG A 108 10.383 8.254 -2.429 1.00 0.00 C ATOM 1672 C ARG A 108 9.066 8.897 -1.999 1.00 0.00 C ATOM 1673 O ARG A 108 9.061 9.830 -1.200 1.00 0.00 O ATOM 1674 CB ARG A 108 10.965 8.985 -3.642 1.00 0.00 C ATOM 1675 CG ARG A 108 10.039 9.041 -4.839 1.00 0.00 C ATOM 1676 CD ARG A 108 10.694 9.730 -6.017 1.00 0.00 C ATOM 1677 NE ARG A 108 10.904 11.155 -5.777 1.00 0.00 N ATOM 1678 CZ ARG A 108 10.822 12.089 -6.722 1.00 0.00 C ATOM 1679 NH1 ARG A 108 10.454 11.768 -7.959 1.00 0.00 N ATOM 1680 NH2 ARG A 108 11.088 13.351 -6.420 1.00 0.00 N ATOM 0 H ARG A 108 10.307 6.561 -3.676 1.00 0.00 H new ATOM 0 HA ARG A 108 11.097 8.345 -1.610 1.00 0.00 H new ATOM 0 HB2 ARG A 108 11.223 10.003 -3.349 1.00 0.00 H new ATOM 0 HB3 ARG A 108 11.892 8.494 -3.937 1.00 0.00 H new ATOM 0 HG2 ARG A 108 9.749 8.029 -5.123 1.00 0.00 H new ATOM 0 HG3 ARG A 108 9.125 9.570 -4.569 1.00 0.00 H new ATOM 0 HD2 ARG A 108 11.652 9.254 -6.227 1.00 0.00 H new ATOM 0 HD3 ARG A 108 10.072 9.600 -6.903 1.00 0.00 H new ATOM 0 HE ARG A 108 11.127 11.453 -4.827 1.00 0.00 H new ATOM 0 HH11 ARG A 108 10.232 10.800 -8.190 1.00 0.00 H new ATOM 0 HH12 ARG A 108 10.394 12.490 -8.677 1.00 0.00 H new ATOM 0 HH21 ARG A 108 11.354 13.602 -5.468 1.00 0.00 H new ATOM 0 HH22 ARG A 108 11.027 14.071 -7.140 1.00 0.00 H new ATOM 1694 N VAL A 109 7.952 8.383 -2.523 1.00 0.00 N ATOM 1695 CA VAL A 109 6.630 8.867 -2.136 1.00 0.00 C ATOM 1696 C VAL A 109 6.350 8.528 -0.681 1.00 0.00 C ATOM 1697 O VAL A 109 5.900 9.379 0.088 1.00 0.00 O ATOM 1698 CB VAL A 109 5.513 8.272 -3.021 1.00 0.00 C ATOM 1699 CG1 VAL A 109 4.143 8.654 -2.485 1.00 0.00 C ATOM 1700 CG2 VAL A 109 5.663 8.736 -4.461 1.00 0.00 C ATOM 0 H VAL A 109 7.941 7.633 -3.215 1.00 0.00 H new ATOM 0 HA VAL A 109 6.632 9.948 -2.273 1.00 0.00 H new ATOM 0 HB VAL A 109 5.605 7.186 -2.996 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.370 8.225 -3.123 1.00 0.00 H new ATOM 0 HG12 VAL A 109 4.030 8.272 -1.470 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.045 9.740 -2.477 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.866 8.305 -5.067 1.00 0.00 H new ATOM 0 HG22 VAL A 109 5.602 9.824 -4.501 1.00 0.00 H new ATOM 0 HG23 VAL A 109 6.629 8.412 -4.849 1.00 0.00 H new ATOM 1710 N ALA A 110 6.629 7.283 -0.305 1.00 0.00 N ATOM 1711 CA ALA A 110 6.457 6.852 1.075 1.00 0.00 C ATOM 1712 C ALA A 110 7.278 7.726 2.000 1.00 0.00 C ATOM 1713 O ALA A 110 6.788 8.188 3.026 1.00 0.00 O ATOM 1714 CB ALA A 110 6.866 5.397 1.251 1.00 0.00 C ATOM 0 H ALA A 110 6.974 6.559 -0.935 1.00 0.00 H new ATOM 0 HA ALA A 110 5.401 6.946 1.327 1.00 0.00 H new ATOM 0 HB1 ALA A 110 6.727 5.103 2.291 1.00 0.00 H new ATOM 0 HB2 ALA A 110 6.250 4.766 0.610 1.00 0.00 H new ATOM 0 HB3 ALA A 110 7.914 5.278 0.978 1.00 0.00 H new ATOM 1720 N ASP A 111 8.524 7.962 1.614 1.00 0.00 N ATOM 1721 CA ASP A 111 9.452 8.739 2.422 1.00 0.00 C ATOM 1722 C ASP A 111 8.997 10.195 2.516 1.00 0.00 C ATOM 1723 O ASP A 111 9.164 10.846 3.544 1.00 0.00 O ATOM 1724 CB ASP A 111 10.855 8.656 1.815 1.00 0.00 C ATOM 1725 CG ASP A 111 11.950 8.934 2.821 1.00 0.00 C ATOM 1726 OD1 ASP A 111 12.428 7.969 3.454 1.00 0.00 O ATOM 1727 OD2 ASP A 111 12.350 10.108 2.966 1.00 0.00 O ATOM 0 H ASP A 111 8.918 7.622 0.737 1.00 0.00 H new ATOM 0 HA ASP A 111 9.473 8.326 3.431 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.003 7.663 1.390 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.933 9.369 0.994 1.00 0.00 H new ATOM 1732 N ALA A 112 8.394 10.685 1.439 1.00 0.00 N ATOM 1733 CA ALA A 112 7.913 12.059 1.380 1.00 0.00 C ATOM 1734 C ALA A 112 6.704 12.279 2.284 1.00 0.00 C ATOM 1735 O ALA A 112 6.544 13.350 2.873 1.00 0.00 O ATOM 1736 CB ALA A 112 7.554 12.418 -0.049 1.00 0.00 C ATOM 0 H ALA A 112 8.226 10.146 0.589 1.00 0.00 H new ATOM 0 HA ALA A 112 8.716 12.705 1.735 1.00 0.00 H new ATOM 0 HB1 ALA A 112 7.195 13.447 -0.087 1.00 0.00 H new ATOM 0 HB2 ALA A 112 8.436 12.318 -0.682 1.00 0.00 H new ATOM 0 HB3 ALA A 112 6.773 11.748 -0.407 1.00 0.00 H new ATOM 1742 N VAL A 113 5.843 11.274 2.374 1.00 0.00 N ATOM 1743 CA VAL A 113 4.632 11.387 3.177 1.00 0.00 C ATOM 1744 C VAL A 113 4.845 10.850 4.589 1.00 0.00 C ATOM 1745 O VAL A 113 4.165 11.264 5.529 1.00 0.00 O ATOM 1746 CB VAL A 113 3.441 10.663 2.510 1.00 0.00 C ATOM 1747 CG1 VAL A 113 3.228 11.196 1.105 1.00 0.00 C ATOM 1748 CG2 VAL A 113 3.649 9.156 2.480 1.00 0.00 C ATOM 0 H VAL A 113 5.959 10.376 1.904 1.00 0.00 H new ATOM 0 HA VAL A 113 4.396 12.449 3.245 1.00 0.00 H new ATOM 0 HB VAL A 113 2.550 10.861 3.106 1.00 0.00 H new ATOM 0 HG11 VAL A 113 2.386 10.679 0.644 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.018 12.265 1.149 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.127 11.027 0.512 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.792 8.680 2.004 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.552 8.925 1.916 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.752 8.783 3.499 1.00 0.00 H new ATOM 1758 N GLY A 114 5.790 9.935 4.729 1.00 0.00 N ATOM 1759 CA GLY A 114 6.103 9.382 6.033 1.00 0.00 C ATOM 1760 C GLY A 114 5.248 8.181 6.377 1.00 0.00 C ATOM 1761 O GLY A 114 4.792 8.037 7.513 1.00 0.00 O ATOM 0 H GLY A 114 6.349 9.563 3.961 1.00 0.00 H new ATOM 0 HA2 GLY A 114 7.154 9.094 6.059 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.964 10.151 6.793 1.00 0.00 H new ATOM 1765 N ALA A 115 5.031 7.312 5.400 1.00 0.00 N ATOM 1766 CA ALA A 115 4.198 6.134 5.597 1.00 0.00 C ATOM 1767 C ALA A 115 4.989 4.863 5.347 1.00 0.00 C ATOM 1768 O ALA A 115 6.013 4.881 4.666 1.00 0.00 O ATOM 1769 CB ALA A 115 2.989 6.178 4.681 1.00 0.00 C ATOM 0 H ALA A 115 5.421 7.401 4.462 1.00 0.00 H new ATOM 0 HA ALA A 115 3.858 6.133 6.633 1.00 0.00 H new ATOM 0 HB1 ALA A 115 2.378 5.290 4.842 1.00 0.00 H new ATOM 0 HB2 ALA A 115 2.399 7.068 4.899 1.00 0.00 H new ATOM 0 HB3 ALA A 115 3.320 6.207 3.643 1.00 0.00 H new ATOM 1775 N ARG A 116 4.511 3.758 5.896 1.00 0.00 N ATOM 1776 CA ARG A 116 5.164 2.475 5.698 1.00 0.00 C ATOM 1777 C ARG A 116 4.800 1.918 4.328 1.00 0.00 C ATOM 1778 O ARG A 116 3.624 1.773 4.005 1.00 0.00 O ATOM 1779 CB ARG A 116 4.756 1.483 6.789 1.00 0.00 C ATOM 1780 CG ARG A 116 5.588 0.207 6.797 1.00 0.00 C ATOM 1781 CD ARG A 116 5.111 -0.764 7.863 1.00 0.00 C ATOM 1782 NE ARG A 116 5.050 -0.146 9.187 1.00 0.00 N ATOM 1783 CZ ARG A 116 5.327 -0.784 10.322 1.00 0.00 C ATOM 1784 NH1 ARG A 116 5.797 -2.026 10.294 1.00 0.00 N ATOM 1785 NH2 ARG A 116 5.163 -0.163 11.481 1.00 0.00 N ATOM 0 H ARG A 116 3.676 3.724 6.480 1.00 0.00 H new ATOM 0 HA ARG A 116 6.242 2.623 5.755 1.00 0.00 H new ATOM 0 HB2 ARG A 116 4.843 1.969 7.761 1.00 0.00 H new ATOM 0 HB3 ARG A 116 3.706 1.221 6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 116 5.533 -0.270 5.818 1.00 0.00 H new ATOM 0 HG3 ARG A 116 6.635 0.455 6.972 1.00 0.00 H new ATOM 0 HD2 ARG A 116 4.124 -1.140 7.594 1.00 0.00 H new ATOM 0 HD3 ARG A 116 5.781 -1.623 7.896 1.00 0.00 H new ATOM 0 HE ARG A 116 4.778 0.835 9.244 1.00 0.00 H new ATOM 0 HH11 ARG A 116 5.947 -2.495 9.400 1.00 0.00 H new ATOM 0 HH12 ARG A 116 6.008 -2.511 11.166 1.00 0.00 H new ATOM 0 HH21 ARG A 116 4.826 0.799 11.501 1.00 0.00 H new ATOM 0 HH22 ARG A 116 5.374 -0.647 12.353 1.00 0.00 H new ATOM 1799 N LEU A 117 5.807 1.627 3.525 1.00 0.00 N ATOM 1800 CA LEU A 117 5.590 1.071 2.198 1.00 0.00 C ATOM 1801 C LEU A 117 5.736 -0.442 2.234 1.00 0.00 C ATOM 1802 O LEU A 117 6.768 -0.955 2.650 1.00 0.00 O ATOM 1803 CB LEU A 117 6.589 1.666 1.202 1.00 0.00 C ATOM 1804 CG LEU A 117 6.462 1.166 -0.241 1.00 0.00 C ATOM 1805 CD1 LEU A 117 5.157 1.636 -0.867 1.00 0.00 C ATOM 1806 CD2 LEU A 117 7.651 1.628 -1.069 1.00 0.00 C ATOM 0 H LEU A 117 6.788 1.766 3.768 1.00 0.00 H new ATOM 0 HA LEU A 117 4.579 1.324 1.877 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.474 2.750 1.203 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.598 1.452 1.555 1.00 0.00 H new ATOM 0 HG LEU A 117 6.454 0.076 -0.225 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.091 1.268 -1.891 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.317 1.252 -0.289 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.127 2.726 -0.871 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.546 1.265 -2.091 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.690 2.717 -1.073 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.571 1.234 -0.637 1.00 0.00 H new ATOM 1818 N ILE A 118 4.705 -1.152 1.812 1.00 0.00 N ATOM 1819 CA ILE A 118 4.744 -2.607 1.793 1.00 0.00 C ATOM 1820 C ILE A 118 4.586 -3.129 0.368 1.00 0.00 C ATOM 1821 O ILE A 118 3.666 -2.737 -0.353 1.00 0.00 O ATOM 1822 CB ILE A 118 3.650 -3.220 2.698 1.00 0.00 C ATOM 1823 CG1 ILE A 118 3.815 -2.720 4.140 1.00 0.00 C ATOM 1824 CG2 ILE A 118 3.706 -4.744 2.652 1.00 0.00 C ATOM 1825 CD1 ILE A 118 2.812 -3.306 5.110 1.00 0.00 C ATOM 0 H ILE A 118 3.830 -0.747 1.478 1.00 0.00 H new ATOM 0 HA ILE A 118 5.716 -2.910 2.182 1.00 0.00 H new ATOM 0 HB ILE A 118 2.675 -2.903 2.327 1.00 0.00 H new ATOM 0 HG12 ILE A 118 4.821 -2.959 4.484 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.724 -1.634 4.150 1.00 0.00 H new ATOM 0 HG21 ILE A 118 2.929 -5.156 3.295 1.00 0.00 H new ATOM 0 HG22 ILE A 118 3.548 -5.083 1.628 1.00 0.00 H new ATOM 0 HG23 ILE A 118 4.682 -5.083 3.000 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.993 -2.905 6.107 1.00 0.00 H new ATOM 0 HD12 ILE A 118 1.803 -3.045 4.792 1.00 0.00 H new ATOM 0 HD13 ILE A 118 2.917 -4.391 5.131 1.00 0.00 H new ATOM 1837 N ILE A 119 5.496 -4.001 -0.035 1.00 0.00 N ATOM 1838 CA ILE A 119 5.471 -4.578 -1.370 1.00 0.00 C ATOM 1839 C ILE A 119 5.543 -6.098 -1.292 1.00 0.00 C ATOM 1840 O ILE A 119 6.342 -6.654 -0.533 1.00 0.00 O ATOM 1841 CB ILE A 119 6.649 -4.068 -2.235 1.00 0.00 C ATOM 1842 CG1 ILE A 119 6.613 -2.543 -2.357 1.00 0.00 C ATOM 1843 CG2 ILE A 119 6.622 -4.710 -3.620 1.00 0.00 C ATOM 1844 CD1 ILE A 119 7.764 -1.977 -3.159 1.00 0.00 C ATOM 0 H ILE A 119 6.267 -4.327 0.548 1.00 0.00 H new ATOM 0 HA ILE A 119 4.535 -4.270 -1.835 1.00 0.00 H new ATOM 0 HB ILE A 119 7.577 -4.353 -1.740 1.00 0.00 H new ATOM 0 HG12 ILE A 119 5.674 -2.245 -2.823 1.00 0.00 H new ATOM 0 HG13 ILE A 119 6.626 -2.106 -1.359 1.00 0.00 H new ATOM 0 HG21 ILE A 119 7.459 -4.337 -4.210 1.00 0.00 H new ATOM 0 HG22 ILE A 119 6.702 -5.793 -3.521 1.00 0.00 H new ATOM 0 HG23 ILE A 119 5.686 -4.460 -4.119 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.676 -0.892 -3.205 1.00 0.00 H new ATOM 0 HD12 ILE A 119 8.707 -2.245 -2.681 1.00 0.00 H new ATOM 0 HD13 ILE A 119 7.740 -2.386 -4.169 1.00 0.00 H new ATOM 1856 N LYS A 120 4.697 -6.766 -2.061 1.00 0.00 N ATOM 1857 CA LYS A 120 4.770 -8.211 -2.183 1.00 0.00 C ATOM 1858 C LYS A 120 5.176 -8.607 -3.598 1.00 0.00 C ATOM 1859 O LYS A 120 4.377 -8.512 -4.531 1.00 0.00 O ATOM 1860 CB LYS A 120 3.441 -8.871 -1.815 1.00 0.00 C ATOM 1861 CG LYS A 120 3.508 -9.661 -0.519 1.00 0.00 C ATOM 1862 CD LYS A 120 2.230 -10.442 -0.274 1.00 0.00 C ATOM 1863 CE LYS A 120 2.328 -11.298 0.981 1.00 0.00 C ATOM 1864 NZ LYS A 120 3.435 -12.290 0.895 1.00 0.00 N ATOM 0 H LYS A 120 3.954 -6.331 -2.608 1.00 0.00 H new ATOM 0 HA LYS A 120 5.528 -8.563 -1.483 1.00 0.00 H new ATOM 0 HB2 LYS A 120 2.673 -8.103 -1.726 1.00 0.00 H new ATOM 0 HB3 LYS A 120 3.136 -9.535 -2.623 1.00 0.00 H new ATOM 0 HG2 LYS A 120 4.354 -10.348 -0.554 1.00 0.00 H new ATOM 0 HG3 LYS A 120 3.685 -8.980 0.314 1.00 0.00 H new ATOM 0 HD2 LYS A 120 1.393 -9.750 -0.179 1.00 0.00 H new ATOM 0 HD3 LYS A 120 2.021 -11.079 -1.134 1.00 0.00 H new ATOM 0 HE2 LYS A 120 2.484 -10.655 1.847 1.00 0.00 H new ATOM 0 HE3 LYS A 120 1.384 -11.821 1.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.353 -12.970 1.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.378 -12.796 -0.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 4.349 -11.797 0.959 1.00 0.00 H new ATOM 1878 N PRO A 121 6.440 -9.018 -3.770 1.00 0.00 N ATOM 1879 CA PRO A 121 6.963 -9.493 -5.057 1.00 0.00 C ATOM 1880 C PRO A 121 6.423 -10.877 -5.443 1.00 0.00 C ATOM 1881 O PRO A 121 5.275 -11.221 -5.139 1.00 0.00 O ATOM 1882 CB PRO A 121 8.473 -9.548 -4.817 1.00 0.00 C ATOM 1883 CG PRO A 121 8.618 -9.755 -3.351 1.00 0.00 C ATOM 1884 CD PRO A 121 7.475 -9.019 -2.717 1.00 0.00 C ATOM 0 HA PRO A 121 6.669 -8.845 -5.882 1.00 0.00 H new ATOM 0 HB2 PRO A 121 8.933 -10.361 -5.379 1.00 0.00 H new ATOM 0 HB3 PRO A 121 8.958 -8.625 -5.136 1.00 0.00 H new ATOM 0 HG2 PRO A 121 8.586 -10.816 -3.101 1.00 0.00 H new ATOM 0 HG3 PRO A 121 9.575 -9.372 -2.995 1.00 0.00 H new ATOM 0 HD2 PRO A 121 7.128 -9.519 -1.813 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.759 -8.006 -2.432 1.00 0.00 H new ATOM 1892 N LEU A 122 7.250 -11.667 -6.120 1.00 0.00 N ATOM 1893 CA LEU A 122 6.826 -12.968 -6.620 1.00 0.00 C ATOM 1894 C LEU A 122 7.030 -14.055 -5.570 1.00 0.00 C ATOM 1895 O LEU A 122 7.430 -13.773 -4.441 1.00 0.00 O ATOM 1896 CB LEU A 122 7.574 -13.334 -7.909 1.00 0.00 C ATOM 1897 CG LEU A 122 7.198 -12.526 -9.161 1.00 0.00 C ATOM 1898 CD1 LEU A 122 7.740 -11.105 -9.089 1.00 0.00 C ATOM 1899 CD2 LEU A 122 7.707 -13.226 -10.411 1.00 0.00 C ATOM 0 H LEU A 122 8.218 -11.428 -6.335 1.00 0.00 H new ATOM 0 HA LEU A 122 5.761 -12.900 -6.844 1.00 0.00 H new ATOM 0 HB2 LEU A 122 8.643 -13.214 -7.731 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.402 -14.390 -8.118 1.00 0.00 H new ATOM 0 HG LEU A 122 6.111 -12.465 -9.207 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.456 -10.561 -9.990 1.00 0.00 H new ATOM 0 HD12 LEU A 122 7.326 -10.601 -8.216 1.00 0.00 H new ATOM 0 HD13 LEU A 122 8.827 -11.134 -9.010 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.434 -12.643 -11.291 1.00 0.00 H new ATOM 0 HD22 LEU A 122 8.792 -13.319 -10.360 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.261 -14.218 -10.480 1.00 0.00 H new ATOM 1911 N THR A 123 6.746 -15.296 -5.954 1.00 0.00 N ATOM 1912 CA THR A 123 6.841 -16.433 -5.046 1.00 0.00 C ATOM 1913 C THR A 123 8.267 -16.628 -4.523 1.00 0.00 C ATOM 1914 O THR A 123 8.469 -16.951 -3.353 1.00 0.00 O ATOM 1915 CB THR A 123 6.369 -17.718 -5.749 1.00 0.00 C ATOM 1916 OG1 THR A 123 5.094 -17.486 -6.367 1.00 0.00 O ATOM 1917 CG2 THR A 123 6.261 -18.876 -4.767 1.00 0.00 C ATOM 0 H THR A 123 6.445 -15.540 -6.898 1.00 0.00 H new ATOM 0 HA THR A 123 6.195 -16.222 -4.194 1.00 0.00 H new ATOM 0 HB THR A 123 7.105 -17.984 -6.507 1.00 0.00 H new ATOM 0 HG1 THR A 123 4.794 -18.304 -6.816 1.00 0.00 H new ATOM 0 HG21 THR A 123 5.925 -19.769 -5.294 1.00 0.00 H new ATOM 0 HG22 THR A 123 7.236 -19.064 -4.318 1.00 0.00 H new ATOM 0 HG23 THR A 123 5.544 -18.625 -3.985 1.00 0.00 H new ATOM 1925 N GLY A 124 9.250 -16.431 -5.395 1.00 0.00 N ATOM 1926 CA GLY A 124 10.639 -16.557 -4.996 1.00 0.00 C ATOM 1927 C GLY A 124 11.520 -15.565 -5.724 1.00 0.00 C ATOM 1928 O GLY A 124 12.623 -15.896 -6.155 1.00 0.00 O ATOM 0 H GLY A 124 9.108 -16.185 -6.375 1.00 0.00 H new ATOM 0 HA2 GLY A 124 10.725 -16.400 -3.921 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.986 -17.570 -5.199 1.00 0.00 H new ATOM 1932 N GLU A 125 11.030 -14.344 -5.849 1.00 0.00 N ATOM 1933 CA GLU A 125 11.726 -13.311 -6.591 1.00 0.00 C ATOM 1934 C GLU A 125 11.772 -12.037 -5.762 1.00 0.00 C ATOM 1935 O GLU A 125 10.775 -11.658 -5.149 1.00 0.00 O ATOM 1936 CB GLU A 125 11.002 -13.046 -7.912 1.00 0.00 C ATOM 1937 CG GLU A 125 11.817 -12.271 -8.933 1.00 0.00 C ATOM 1938 CD GLU A 125 12.844 -13.135 -9.634 1.00 0.00 C ATOM 1939 OE1 GLU A 125 12.458 -13.890 -10.552 1.00 0.00 O ATOM 1940 OE2 GLU A 125 14.039 -13.060 -9.279 1.00 0.00 O ATOM 0 H GLU A 125 10.145 -14.043 -5.442 1.00 0.00 H new ATOM 0 HA GLU A 125 12.743 -13.640 -6.804 1.00 0.00 H new ATOM 0 HB2 GLU A 125 10.709 -14.001 -8.349 1.00 0.00 H new ATOM 0 HB3 GLU A 125 10.084 -12.495 -7.705 1.00 0.00 H new ATOM 0 HG2 GLU A 125 11.146 -11.837 -9.674 1.00 0.00 H new ATOM 0 HG3 GLU A 125 12.322 -11.443 -8.436 1.00 0.00 H new ATOM 1947 N ASP A 126 12.926 -11.395 -5.740 1.00 0.00 N ATOM 1948 CA ASP A 126 13.100 -10.141 -5.013 1.00 0.00 C ATOM 1949 C ASP A 126 12.465 -8.993 -5.799 1.00 0.00 C ATOM 1950 O ASP A 126 11.908 -9.202 -6.878 1.00 0.00 O ATOM 1951 CB ASP A 126 14.600 -9.872 -4.779 1.00 0.00 C ATOM 1952 CG ASP A 126 14.866 -8.701 -3.842 1.00 0.00 C ATOM 1953 OD1 ASP A 126 14.811 -8.893 -2.611 1.00 0.00 O ATOM 1954 OD2 ASP A 126 15.123 -7.585 -4.338 1.00 0.00 O ATOM 0 H ASP A 126 13.765 -11.721 -6.220 1.00 0.00 H new ATOM 0 HA ASP A 126 12.606 -10.216 -4.044 1.00 0.00 H new ATOM 0 HB2 ASP A 126 15.062 -10.769 -4.368 1.00 0.00 H new ATOM 0 HB3 ASP A 126 15.080 -9.677 -5.738 1.00 0.00 H new ATOM 1959 N ILE A 127 12.556 -7.783 -5.268 1.00 0.00 N ATOM 1960 CA ILE A 127 12.037 -6.606 -5.944 1.00 0.00 C ATOM 1961 C ILE A 127 13.088 -6.088 -6.930 1.00 0.00 C ATOM 1962 O ILE A 127 12.940 -5.016 -7.510 1.00 0.00 O ATOM 1963 CB ILE A 127 11.673 -5.491 -4.929 1.00 0.00 C ATOM 1964 CG1 ILE A 127 10.973 -6.085 -3.705 1.00 0.00 C ATOM 1965 CG2 ILE A 127 10.775 -4.443 -5.578 1.00 0.00 C ATOM 1966 CD1 ILE A 127 10.643 -5.057 -2.646 1.00 0.00 C ATOM 0 H ILE A 127 12.988 -7.591 -4.364 1.00 0.00 H new ATOM 0 HA ILE A 127 11.128 -6.884 -6.478 1.00 0.00 H new ATOM 0 HB ILE A 127 12.599 -5.012 -4.610 1.00 0.00 H new ATOM 0 HG12 ILE A 127 10.053 -6.576 -4.024 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.610 -6.854 -3.269 1.00 0.00 H new ATOM 0 HG21 ILE A 127 10.532 -3.670 -4.849 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.294 -3.993 -6.424 1.00 0.00 H new ATOM 0 HG23 ILE A 127 9.856 -4.916 -5.926 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.148 -5.545 -1.806 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.562 -4.583 -2.300 1.00 0.00 H new ATOM 0 HD13 ILE A 127 9.981 -4.301 -3.067 1.00 0.00 H new ATOM 2047 N LYS A 132 16.530 -1.342 -0.137 1.00 0.00 N ATOM 2048 CA LYS A 132 16.535 -0.368 0.951 1.00 0.00 C ATOM 2049 C LYS A 132 15.410 -0.680 1.924 1.00 0.00 C ATOM 2050 O LYS A 132 15.222 0.005 2.930 1.00 0.00 O ATOM 2051 CB LYS A 132 16.366 1.047 0.401 1.00 0.00 C ATOM 2052 CG LYS A 132 17.655 1.675 -0.099 1.00 0.00 C ATOM 2053 CD LYS A 132 18.590 2.014 1.056 1.00 0.00 C ATOM 2054 CE LYS A 132 17.920 2.949 2.055 1.00 0.00 C ATOM 2055 NZ LYS A 132 18.815 3.295 3.191 1.00 0.00 N ATOM 0 HA LYS A 132 17.491 -0.428 1.471 1.00 0.00 H new ATOM 0 HB2 LYS A 132 15.645 1.024 -0.416 1.00 0.00 H new ATOM 0 HB3 LYS A 132 15.944 1.681 1.181 1.00 0.00 H new ATOM 0 HG2 LYS A 132 18.154 0.990 -0.784 1.00 0.00 H new ATOM 0 HG3 LYS A 132 17.427 2.580 -0.662 1.00 0.00 H new ATOM 0 HD2 LYS A 132 18.895 1.097 1.561 1.00 0.00 H new ATOM 0 HD3 LYS A 132 19.496 2.481 0.669 1.00 0.00 H new ATOM 0 HE2 LYS A 132 17.614 3.862 1.545 1.00 0.00 H new ATOM 0 HE3 LYS A 132 17.015 2.479 2.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 18.316 3.933 3.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 19.088 2.427 3.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 19.668 3.768 2.829 1.00 0.00 H new ATOM 2069 N MET A 133 14.659 -1.716 1.596 1.00 0.00 N ATOM 2070 CA MET A 133 13.534 -2.149 2.407 1.00 0.00 C ATOM 2071 C MET A 133 13.939 -3.341 3.260 1.00 0.00 C ATOM 2072 O MET A 133 15.055 -3.845 3.140 1.00 0.00 O ATOM 2073 CB MET A 133 12.349 -2.519 1.512 1.00 0.00 C ATOM 2074 CG MET A 133 11.906 -1.379 0.614 1.00 0.00 C ATOM 2075 SD MET A 133 10.591 -1.844 -0.526 1.00 0.00 S ATOM 2076 CE MET A 133 9.226 -2.078 0.609 1.00 0.00 C ATOM 0 H MET A 133 14.811 -2.281 0.761 1.00 0.00 H new ATOM 0 HA MET A 133 13.234 -1.331 3.062 1.00 0.00 H new ATOM 0 HB2 MET A 133 12.620 -3.376 0.895 1.00 0.00 H new ATOM 0 HB3 MET A 133 11.511 -2.829 2.137 1.00 0.00 H new ATOM 0 HG2 MET A 133 11.565 -0.549 1.233 1.00 0.00 H new ATOM 0 HG3 MET A 133 12.763 -1.020 0.044 1.00 0.00 H new ATOM 0 HE1 MET A 133 8.340 -2.387 0.054 1.00 0.00 H new ATOM 0 HE2 MET A 133 9.485 -2.847 1.336 1.00 0.00 H new ATOM 0 HE3 MET A 133 9.020 -1.142 1.129 1.00 0.00 H new ATOM 2086 N LYS A 134 13.033 -3.791 4.107 1.00 0.00 N ATOM 2087 CA LYS A 134 13.310 -4.903 5.002 1.00 0.00 C ATOM 2088 C LYS A 134 12.325 -6.040 4.766 1.00 0.00 C ATOM 2089 O LYS A 134 11.142 -5.810 4.505 1.00 0.00 O ATOM 2090 CB LYS A 134 13.247 -4.439 6.459 1.00 0.00 C ATOM 2091 CG LYS A 134 12.026 -3.588 6.767 1.00 0.00 C ATOM 2092 CD LYS A 134 11.841 -3.368 8.257 1.00 0.00 C ATOM 2093 CE LYS A 134 11.598 -4.681 8.981 1.00 0.00 C ATOM 2094 NZ LYS A 134 10.926 -4.478 10.288 1.00 0.00 N ATOM 0 H LYS A 134 12.094 -3.403 4.196 1.00 0.00 H new ATOM 0 HA LYS A 134 14.315 -5.270 4.794 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.246 -5.312 7.111 1.00 0.00 H new ATOM 0 HB3 LYS A 134 14.147 -3.869 6.691 1.00 0.00 H new ATOM 0 HG2 LYS A 134 12.122 -2.624 6.268 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.137 -4.070 6.360 1.00 0.00 H new ATOM 0 HD2 LYS A 134 12.726 -2.882 8.668 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.000 -2.696 8.426 1.00 0.00 H new ATOM 0 HE2 LYS A 134 10.987 -5.332 8.356 1.00 0.00 H new ATOM 0 HE3 LYS A 134 12.549 -5.190 9.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.048 -5.326 10.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 11.346 -3.658 10.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 9.912 -4.307 10.134 1.00 0.00 H new ATOM 2108 N LEU A 135 12.821 -7.265 4.851 1.00 0.00 N ATOM 2109 CA LEU A 135 11.994 -8.442 4.648 1.00 0.00 C ATOM 2110 C LEU A 135 11.312 -8.842 5.949 1.00 0.00 C ATOM 2111 O LEU A 135 11.972 -9.050 6.968 1.00 0.00 O ATOM 2112 CB LEU A 135 12.845 -9.599 4.119 1.00 0.00 C ATOM 2113 CG LEU A 135 12.068 -10.870 3.773 1.00 0.00 C ATOM 2114 CD1 LEU A 135 11.052 -10.590 2.680 1.00 0.00 C ATOM 2115 CD2 LEU A 135 13.017 -11.976 3.343 1.00 0.00 C ATOM 0 H LEU A 135 13.798 -7.469 5.061 1.00 0.00 H new ATOM 0 HA LEU A 135 11.226 -8.205 3.912 1.00 0.00 H new ATOM 0 HB2 LEU A 135 13.375 -9.262 3.228 1.00 0.00 H new ATOM 0 HB3 LEU A 135 13.600 -9.845 4.865 1.00 0.00 H new ATOM 0 HG LEU A 135 11.536 -11.200 4.665 1.00 0.00 H new ATOM 0 HD11 LEU A 135 10.508 -11.505 2.446 1.00 0.00 H new ATOM 0 HD12 LEU A 135 10.351 -9.828 3.021 1.00 0.00 H new ATOM 0 HD13 LEU A 135 11.567 -10.235 1.787 1.00 0.00 H new ATOM 0 HD21 LEU A 135 12.446 -12.872 3.101 1.00 0.00 H new ATOM 0 HD22 LEU A 135 13.577 -11.654 2.465 1.00 0.00 H new ATOM 0 HD23 LEU A 135 13.711 -12.196 4.154 1.00 0.00 H new ATOM 2127 N VAL A 136 9.996 -8.936 5.911 1.00 0.00 N ATOM 2128 CA VAL A 136 9.216 -9.303 7.082 1.00 0.00 C ATOM 2129 C VAL A 136 8.400 -10.560 6.826 1.00 0.00 C ATOM 2130 O VAL A 136 7.822 -10.732 5.753 1.00 0.00 O ATOM 2131 CB VAL A 136 8.259 -8.172 7.514 1.00 0.00 C ATOM 2132 CG1 VAL A 136 8.848 -7.372 8.661 1.00 0.00 C ATOM 2133 CG2 VAL A 136 7.938 -7.253 6.349 1.00 0.00 C ATOM 0 H VAL A 136 9.439 -8.762 5.074 1.00 0.00 H new ATOM 0 HA VAL A 136 9.932 -9.486 7.883 1.00 0.00 H new ATOM 0 HB VAL A 136 7.333 -8.637 7.853 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.155 -6.581 8.947 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.019 -8.030 9.513 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.794 -6.930 8.348 1.00 0.00 H new ATOM 0 HG21 VAL A 136 7.262 -6.466 6.682 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.859 -6.806 5.974 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.463 -7.827 5.553 1.00 0.00 H new ATOM 2143 N ASN A 137 8.377 -11.448 7.809 1.00 0.00 N ATOM 2144 CA ASN A 137 7.549 -12.645 7.749 1.00 0.00 C ATOM 2145 C ASN A 137 6.379 -12.493 8.705 1.00 0.00 C ATOM 2146 O ASN A 137 6.576 -12.246 9.897 1.00 0.00 O ATOM 2147 CB ASN A 137 8.341 -13.908 8.121 1.00 0.00 C ATOM 2148 CG ASN A 137 9.367 -14.326 7.078 1.00 0.00 C ATOM 2149 OD1 ASN A 137 9.575 -15.518 6.846 1.00 0.00 O ATOM 2150 ND2 ASN A 137 10.034 -13.364 6.464 1.00 0.00 N ATOM 0 H ASN A 137 8.926 -11.361 8.664 1.00 0.00 H new ATOM 0 HA ASN A 137 7.197 -12.757 6.724 1.00 0.00 H new ATOM 0 HB2 ASN A 137 8.851 -13.738 9.069 1.00 0.00 H new ATOM 0 HB3 ASN A 137 7.642 -14.730 8.277 1.00 0.00 H new ATOM 0 HD21 ASN A 137 10.747 -13.598 5.773 1.00 0.00 H new ATOM 0 HD22 ASN A 137 9.836 -12.387 6.681 1.00 0.00 H new ATOM 2157 N TYR A 138 5.171 -12.623 8.188 1.00 0.00 N ATOM 2158 CA TYR A 138 3.977 -12.510 9.009 1.00 0.00 C ATOM 2159 C TYR A 138 2.931 -13.503 8.531 1.00 0.00 C ATOM 2160 O TYR A 138 2.463 -13.425 7.397 1.00 0.00 O ATOM 2161 CB TYR A 138 3.421 -11.083 8.954 1.00 0.00 C ATOM 2162 CG TYR A 138 2.305 -10.813 9.940 1.00 0.00 C ATOM 2163 CD1 TYR A 138 2.586 -10.474 11.257 1.00 0.00 C ATOM 2164 CD2 TYR A 138 0.971 -10.883 9.552 1.00 0.00 C ATOM 2165 CE1 TYR A 138 1.574 -10.215 12.160 1.00 0.00 C ATOM 2166 CE2 TYR A 138 -0.047 -10.622 10.449 1.00 0.00 C ATOM 2167 CZ TYR A 138 0.260 -10.288 11.751 1.00 0.00 C ATOM 2168 OH TYR A 138 -0.751 -10.026 12.648 1.00 0.00 O ATOM 0 H TYR A 138 4.989 -12.807 7.201 1.00 0.00 H new ATOM 0 HA TYR A 138 4.237 -12.736 10.043 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.234 -10.381 9.141 1.00 0.00 H new ATOM 0 HB3 TYR A 138 3.056 -10.886 7.946 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.614 -10.412 11.581 1.00 0.00 H new ATOM 0 HD2 TYR A 138 0.727 -11.146 8.533 1.00 0.00 H new ATOM 0 HE1 TYR A 138 1.811 -9.957 13.181 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -1.078 -10.679 10.132 1.00 0.00 H new ATOM 0 HH TYR A 138 -1.618 -10.120 12.200 1.00 0.00 H new ATOM 2178 N GLY A 139 2.584 -14.444 9.393 1.00 0.00 N ATOM 2179 CA GLY A 139 1.632 -15.468 9.021 1.00 0.00 C ATOM 2180 C GLY A 139 2.202 -16.425 7.994 1.00 0.00 C ATOM 2181 O GLY A 139 1.509 -16.824 7.057 1.00 0.00 O ATOM 0 H GLY A 139 2.945 -14.517 10.344 1.00 0.00 H new ATOM 0 HA2 GLY A 139 1.333 -16.025 9.909 1.00 0.00 H new ATOM 0 HA3 GLY A 139 0.733 -14.999 8.621 1.00 0.00 H new ATOM 2185 N ARG A 140 3.484 -16.761 8.165 1.00 0.00 N ATOM 2186 CA ARG A 140 4.194 -17.704 7.308 1.00 0.00 C ATOM 2187 C ARG A 140 4.517 -17.118 5.931 1.00 0.00 C ATOM 2188 O ARG A 140 5.424 -17.588 5.247 1.00 0.00 O ATOM 2189 CB ARG A 140 3.417 -19.009 7.182 1.00 0.00 C ATOM 2190 CG ARG A 140 4.243 -20.111 6.570 1.00 0.00 C ATOM 2191 CD ARG A 140 3.745 -21.481 6.986 1.00 0.00 C ATOM 2192 NE ARG A 140 2.335 -21.691 6.657 1.00 0.00 N ATOM 2193 CZ ARG A 140 1.377 -21.860 7.571 1.00 0.00 C ATOM 2194 NH1 ARG A 140 1.663 -21.777 8.865 1.00 0.00 N ATOM 2195 NH2 ARG A 140 0.128 -22.101 7.191 1.00 0.00 N ATOM 0 H ARG A 140 4.062 -16.378 8.913 1.00 0.00 H new ATOM 0 HA ARG A 140 5.150 -17.914 7.788 1.00 0.00 H new ATOM 0 HB2 ARG A 140 3.073 -19.321 8.168 1.00 0.00 H new ATOM 0 HB3 ARG A 140 2.529 -18.843 6.573 1.00 0.00 H new ATOM 0 HG2 ARG A 140 4.214 -20.027 5.484 1.00 0.00 H new ATOM 0 HG3 ARG A 140 5.284 -19.995 6.871 1.00 0.00 H new ATOM 0 HD2 ARG A 140 4.347 -22.246 6.496 1.00 0.00 H new ATOM 0 HD3 ARG A 140 3.886 -21.604 8.060 1.00 0.00 H new ATOM 0 HE ARG A 140 2.069 -21.709 5.673 1.00 0.00 H new ATOM 0 HH11 ARG A 140 2.619 -21.583 9.165 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.927 -21.907 9.559 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -0.101 -22.157 6.199 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -0.602 -22.230 7.891 1.00 0.00 H new ATOM 2209 N THR A 141 3.794 -16.087 5.525 1.00 0.00 N ATOM 2210 CA THR A 141 4.070 -15.436 4.261 1.00 0.00 C ATOM 2211 C THR A 141 5.035 -14.274 4.480 1.00 0.00 C ATOM 2212 O THR A 141 4.967 -13.577 5.496 1.00 0.00 O ATOM 2213 CB THR A 141 2.769 -14.952 3.569 1.00 0.00 C ATOM 2214 OG1 THR A 141 3.034 -14.633 2.196 1.00 0.00 O ATOM 2215 CG2 THR A 141 2.168 -13.734 4.264 1.00 0.00 C ATOM 0 H THR A 141 3.017 -15.687 6.051 1.00 0.00 H new ATOM 0 HA THR A 141 4.534 -16.164 3.596 1.00 0.00 H new ATOM 0 HB THR A 141 2.046 -15.765 3.633 1.00 0.00 H new ATOM 0 HG1 THR A 141 2.196 -14.391 1.749 1.00 0.00 H new ATOM 0 HG21 THR A 141 1.259 -13.431 3.745 1.00 0.00 H new ATOM 0 HG22 THR A 141 1.929 -13.986 5.297 1.00 0.00 H new ATOM 0 HG23 THR A 141 2.886 -12.914 4.247 1.00 0.00 H new ATOM 2223 N TYR A 142 5.956 -14.082 3.549 1.00 0.00 N ATOM 2224 CA TYR A 142 6.934 -13.020 3.683 1.00 0.00 C ATOM 2225 C TYR A 142 6.682 -11.918 2.665 1.00 0.00 C ATOM 2226 O TYR A 142 6.096 -12.153 1.602 1.00 0.00 O ATOM 2227 CB TYR A 142 8.366 -13.562 3.557 1.00 0.00 C ATOM 2228 CG TYR A 142 8.748 -14.072 2.179 1.00 0.00 C ATOM 2229 CD1 TYR A 142 8.444 -15.369 1.779 1.00 0.00 C ATOM 2230 CD2 TYR A 142 9.434 -13.257 1.286 1.00 0.00 C ATOM 2231 CE1 TYR A 142 8.817 -15.837 0.529 1.00 0.00 C ATOM 2232 CE2 TYR A 142 9.804 -13.716 0.037 1.00 0.00 C ATOM 2233 CZ TYR A 142 9.494 -15.004 -0.337 1.00 0.00 C ATOM 2234 OH TYR A 142 9.875 -15.462 -1.577 1.00 0.00 O ATOM 0 H TYR A 142 6.045 -14.642 2.701 1.00 0.00 H new ATOM 0 HA TYR A 142 6.825 -12.593 4.680 1.00 0.00 H new ATOM 0 HB2 TYR A 142 9.062 -12.772 3.840 1.00 0.00 H new ATOM 0 HB3 TYR A 142 8.495 -14.372 4.275 1.00 0.00 H new ATOM 0 HD1 TYR A 142 7.909 -16.022 2.453 1.00 0.00 H new ATOM 0 HD2 TYR A 142 9.682 -12.246 1.574 1.00 0.00 H new ATOM 0 HE1 TYR A 142 8.579 -16.848 0.235 1.00 0.00 H new ATOM 0 HE2 TYR A 142 10.335 -13.067 -0.644 1.00 0.00 H new ATOM 0 HH TYR A 142 9.142 -15.976 -1.976 1.00 0.00 H new ATOM 2244 N PHE A 143 7.089 -10.712 3.020 1.00 0.00 N ATOM 2245 CA PHE A 143 6.954 -9.549 2.157 1.00 0.00 C ATOM 2246 C PHE A 143 7.958 -8.484 2.566 1.00 0.00 C ATOM 2247 O PHE A 143 8.684 -8.660 3.541 1.00 0.00 O ATOM 2248 CB PHE A 143 5.524 -8.995 2.212 1.00 0.00 C ATOM 2249 CG PHE A 143 4.915 -9.018 3.585 1.00 0.00 C ATOM 2250 CD1 PHE A 143 5.233 -8.047 4.514 1.00 0.00 C ATOM 2251 CD2 PHE A 143 4.026 -10.020 3.943 1.00 0.00 C ATOM 2252 CE1 PHE A 143 4.677 -8.070 5.775 1.00 0.00 C ATOM 2253 CE2 PHE A 143 3.465 -10.049 5.203 1.00 0.00 C ATOM 2254 CZ PHE A 143 3.792 -9.072 6.121 1.00 0.00 C ATOM 0 H PHE A 143 7.525 -10.510 3.920 1.00 0.00 H new ATOM 0 HA PHE A 143 7.158 -9.849 1.129 1.00 0.00 H new ATOM 0 HB2 PHE A 143 5.528 -7.969 1.844 1.00 0.00 H new ATOM 0 HB3 PHE A 143 4.894 -9.574 1.536 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.925 -7.261 4.250 1.00 0.00 H new ATOM 0 HD2 PHE A 143 3.770 -10.787 3.227 1.00 0.00 H new ATOM 0 HE1 PHE A 143 4.933 -7.304 6.492 1.00 0.00 H new ATOM 0 HE2 PHE A 143 2.772 -10.834 5.470 1.00 0.00 H new ATOM 0 HZ PHE A 143 3.356 -9.091 7.109 1.00 0.00 H new ATOM 2264 N TYR A 144 8.013 -7.393 1.827 1.00 0.00 N ATOM 2265 CA TYR A 144 8.948 -6.327 2.136 1.00 0.00 C ATOM 2266 C TYR A 144 8.215 -5.093 2.629 1.00 0.00 C ATOM 2267 O TYR A 144 7.237 -4.662 2.019 1.00 0.00 O ATOM 2268 CB TYR A 144 9.785 -5.967 0.907 1.00 0.00 C ATOM 2269 CG TYR A 144 10.834 -6.991 0.549 1.00 0.00 C ATOM 2270 CD1 TYR A 144 12.077 -6.975 1.163 1.00 0.00 C ATOM 2271 CD2 TYR A 144 10.586 -7.967 -0.408 1.00 0.00 C ATOM 2272 CE1 TYR A 144 13.045 -7.903 0.836 1.00 0.00 C ATOM 2273 CE2 TYR A 144 11.550 -8.898 -0.741 1.00 0.00 C ATOM 2274 CZ TYR A 144 12.776 -8.861 -0.116 1.00 0.00 C ATOM 2275 OH TYR A 144 13.739 -9.782 -0.444 1.00 0.00 O ATOM 0 H TYR A 144 7.424 -7.221 1.012 1.00 0.00 H new ATOM 0 HA TYR A 144 9.610 -6.685 2.925 1.00 0.00 H new ATOM 0 HB2 TYR A 144 9.119 -5.833 0.055 1.00 0.00 H new ATOM 0 HB3 TYR A 144 10.274 -5.009 1.083 1.00 0.00 H new ATOM 0 HD1 TYR A 144 12.291 -6.224 1.909 1.00 0.00 H new ATOM 0 HD2 TYR A 144 9.625 -7.998 -0.899 1.00 0.00 H new ATOM 0 HE1 TYR A 144 14.008 -7.878 1.324 1.00 0.00 H new ATOM 0 HE2 TYR A 144 11.343 -9.651 -1.487 1.00 0.00 H new ATOM 0 HH TYR A 144 14.371 -9.383 -1.077 1.00 0.00 H new ATOM 2285 N GLU A 145 8.684 -4.531 3.729 1.00 0.00 N ATOM 2286 CA GLU A 145 8.141 -3.279 4.224 1.00 0.00 C ATOM 2287 C GLU A 145 9.253 -2.236 4.287 1.00 0.00 C ATOM 2288 O GLU A 145 10.438 -2.574 4.263 1.00 0.00 O ATOM 2289 CB GLU A 145 7.485 -3.449 5.604 1.00 0.00 C ATOM 2290 CG GLU A 145 8.478 -3.672 6.735 1.00 0.00 C ATOM 2291 CD GLU A 145 7.841 -3.649 8.115 1.00 0.00 C ATOM 2292 OE1 GLU A 145 6.603 -3.508 8.212 1.00 0.00 O ATOM 2293 OE2 GLU A 145 8.582 -3.771 9.115 1.00 0.00 O ATOM 0 H GLU A 145 9.438 -4.921 4.295 1.00 0.00 H new ATOM 0 HA GLU A 145 7.363 -2.946 3.536 1.00 0.00 H new ATOM 0 HB2 GLU A 145 6.891 -2.562 5.825 1.00 0.00 H new ATOM 0 HB3 GLU A 145 6.796 -4.293 5.567 1.00 0.00 H new ATOM 0 HG2 GLU A 145 8.974 -4.632 6.588 1.00 0.00 H new ATOM 0 HG3 GLU A 145 9.250 -2.904 6.687 1.00 0.00 H new ATOM 2300 N TYR A 146 8.866 -0.978 4.335 1.00 0.00 N ATOM 2301 CA TYR A 146 9.812 0.115 4.440 1.00 0.00 C ATOM 2302 C TYR A 146 9.271 1.172 5.384 1.00 0.00 C ATOM 2303 O TYR A 146 8.162 1.675 5.194 1.00 0.00 O ATOM 2304 CB TYR A 146 10.084 0.728 3.061 1.00 0.00 C ATOM 2305 CG TYR A 146 10.940 1.972 3.109 1.00 0.00 C ATOM 2306 CD1 TYR A 146 12.197 1.951 3.699 1.00 0.00 C ATOM 2307 CD2 TYR A 146 10.490 3.168 2.563 1.00 0.00 C ATOM 2308 CE1 TYR A 146 12.982 3.085 3.743 1.00 0.00 C ATOM 2309 CE2 TYR A 146 11.269 4.309 2.604 1.00 0.00 C ATOM 2310 CZ TYR A 146 12.515 4.263 3.195 1.00 0.00 C ATOM 2311 OH TYR A 146 13.305 5.393 3.224 1.00 0.00 O ATOM 0 H TYR A 146 7.890 -0.684 4.302 1.00 0.00 H new ATOM 0 HA TYR A 146 10.752 -0.272 4.835 1.00 0.00 H new ATOM 0 HB2 TYR A 146 10.574 -0.016 2.433 1.00 0.00 H new ATOM 0 HB3 TYR A 146 9.133 0.970 2.586 1.00 0.00 H new ATOM 0 HD1 TYR A 146 12.566 1.032 4.130 1.00 0.00 H new ATOM 0 HD2 TYR A 146 9.516 3.207 2.099 1.00 0.00 H new ATOM 0 HE1 TYR A 146 13.958 3.051 4.204 1.00 0.00 H new ATOM 0 HE2 TYR A 146 10.905 5.231 2.176 1.00 0.00 H new ATOM 0 HH TYR A 146 12.737 6.187 3.312 1.00 0.00 H new ATOM 2321 N ILE A 147 10.043 1.499 6.405 1.00 0.00 N ATOM 2322 CA ILE A 147 9.630 2.502 7.367 1.00 0.00 C ATOM 2323 C ILE A 147 10.143 3.867 6.934 1.00 0.00 C ATOM 2324 O ILE A 147 11.324 4.185 7.093 1.00 0.00 O ATOM 2325 CB ILE A 147 10.106 2.181 8.811 1.00 0.00 C ATOM 2326 CG1 ILE A 147 9.385 0.944 9.372 1.00 0.00 C ATOM 2327 CG2 ILE A 147 9.871 3.373 9.732 1.00 0.00 C ATOM 2328 CD1 ILE A 147 9.809 -0.371 8.751 1.00 0.00 C ATOM 0 H ILE A 147 10.957 1.085 6.588 1.00 0.00 H new ATOM 0 HA ILE A 147 8.540 2.503 7.389 1.00 0.00 H new ATOM 0 HB ILE A 147 11.174 1.969 8.765 1.00 0.00 H new ATOM 0 HG12 ILE A 147 9.559 0.895 10.447 1.00 0.00 H new ATOM 0 HG13 ILE A 147 8.312 1.069 9.228 1.00 0.00 H new ATOM 0 HG21 ILE A 147 10.211 3.128 10.738 1.00 0.00 H new ATOM 0 HG22 ILE A 147 10.426 4.234 9.361 1.00 0.00 H new ATOM 0 HG23 ILE A 147 8.807 3.610 9.756 1.00 0.00 H new ATOM 0 HD11 ILE A 147 9.249 -1.187 9.208 1.00 0.00 H new ATOM 0 HD12 ILE A 147 9.609 -0.349 7.680 1.00 0.00 H new ATOM 0 HD13 ILE A 147 10.875 -0.525 8.918 1.00 0.00 H new ATOM 2340 N ALA A 148 9.255 4.645 6.339 1.00 0.00 N ATOM 2341 CA ALA A 148 9.577 5.992 5.919 1.00 0.00 C ATOM 2342 C ALA A 148 9.450 6.948 7.097 1.00 0.00 C ATOM 2343 O ALA A 148 8.390 7.037 7.721 1.00 0.00 O ATOM 2344 CB ALA A 148 8.665 6.420 4.791 1.00 0.00 C ATOM 0 H ALA A 148 8.297 4.360 6.136 1.00 0.00 H new ATOM 0 HA ALA A 148 10.606 6.014 5.559 1.00 0.00 H new ATOM 0 HB1 ALA A 148 8.917 7.435 4.484 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.790 5.744 3.945 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.629 6.390 5.129 1.00 0.00 H new ATOM 2350 N GLU A 149 10.529 7.639 7.417 1.00 0.00 N ATOM 2351 CA GLU A 149 10.526 8.572 8.532 1.00 0.00 C ATOM 2352 C GLU A 149 9.845 9.879 8.139 1.00 0.00 C ATOM 2353 O GLU A 149 9.649 10.157 6.955 1.00 0.00 O ATOM 2354 CB GLU A 149 11.957 8.847 8.992 1.00 0.00 C ATOM 2355 CG GLU A 149 12.767 9.658 7.994 1.00 0.00 C ATOM 2356 CD GLU A 149 14.213 9.817 8.401 1.00 0.00 C ATOM 2357 OE1 GLU A 149 14.475 10.474 9.428 1.00 0.00 O ATOM 2358 OE2 GLU A 149 15.097 9.297 7.691 1.00 0.00 O ATOM 0 H GLU A 149 11.418 7.573 6.922 1.00 0.00 H new ATOM 0 HA GLU A 149 9.967 8.123 9.353 1.00 0.00 H new ATOM 0 HB2 GLU A 149 11.929 9.379 9.943 1.00 0.00 H new ATOM 0 HB3 GLU A 149 12.462 7.898 9.172 1.00 0.00 H new ATOM 0 HG2 GLU A 149 12.721 9.175 7.018 1.00 0.00 H new ATOM 0 HG3 GLU A 149 12.316 10.644 7.883 1.00 0.00 H new