USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 955 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 87 HIS : no HE2:sc= -1.19 K(o=-2.1,f=-4.5) USER MOD Set 1.2: B 92 GLN : amide:sc= -0.857 K(o=-2.1,f=-2.9!) USER MOD Set 2.1: A 92 GLN : amide:sc= -0.619 K(o=-4.7,f=-5.5!) USER MOD Set 2.2: B 87 HIS : no HD1:sc= -4.06! C(o=-4.7!,f=-5.6!) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 169:sc=-0.00533 (180deg=-0.116) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 53 SER OG : rot 66:sc= 1.17 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0.191 K(o=0.19,f=-2.3) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 67:sc= 1.27 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -177:sc= -1.49 (180deg=-1.52) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HE2:sc= -1.9 K(o=-1.9,f=-6.1!) USER MOD Single : A 73 SER OG : rot 66:sc= 0.922 USER MOD Single : A 74 LYS NZ :NH3+ -157:sc= 1.1 (180deg=-0.324) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -156:sc= -1.43 (180deg=-2.81!) USER MOD Single : A 84 THR OG1 : rot 89:sc= -0.428 USER MOD Single : A 86 LYS NZ :NH3+ 151:sc= 0.86 (180deg=0.356) USER MOD Single : A 90 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 ASN : amide:sc= 0.398 X(o=0.4,f=-0.036) USER MOD Single : B 53 SER OG : rot 91:sc= 1.29 USER MOD Single : B 55 SER OG : rot 85:sc= 0.756 USER MOD Single : B 56 GLN : amide:sc= 0.0512 X(o=0.051,f=-0.068) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 95:sc= 1.23 USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ -175:sc= -0.436 (180deg=-0.514) USER MOD Single : B 69 SER OG : rot 180:sc= 0.0512 USER MOD Single : B 70 SER OG : rot 180:sc= 0 USER MOD Single : B 72 HIS : no HD1:sc= -2.52! C(o=-2.5!,f=-2.4!) USER MOD Single : B 73 SER OG : rot 76:sc= 0.967 USER MOD Single : B 74 LYS NZ :NH3+ -175:sc= 1.24 (180deg=1.18) USER MOD Single : B 77 LYS NZ :NH3+ -116:sc= -0.784 (180deg=-2.75!) USER MOD Single : B 83 MET CE :methyl -110:sc= -1.83 (180deg=-2.48) USER MOD Single : B 84 THR OG1 : rot 90:sc= -0.761! USER MOD Single : B 86 LYS NZ :NH3+ 164:sc= 1.3 (180deg=1.13) USER MOD Single : B 90 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : B 95 GLN : amide:sc= 0.0725 K(o=0.072,f=-0.74) USER MOD ----------------------------------------------------------------- ATOM 268 N MET A 42 -19.523 3.587 10.220 1.00 0.00 N ATOM 269 CA MET A 42 -19.239 2.635 9.155 1.00 0.00 C ATOM 270 C MET A 42 -17.764 2.549 8.870 1.00 0.00 C ATOM 271 O MET A 42 -17.208 1.450 8.730 1.00 0.00 O ATOM 272 CB MET A 42 -20.013 2.989 7.908 1.00 0.00 C ATOM 273 CG MET A 42 -21.495 2.847 8.115 1.00 0.00 C ATOM 274 SD MET A 42 -21.954 1.130 8.428 1.00 0.00 S ATOM 275 CE MET A 42 -23.678 1.297 8.829 1.00 0.00 C ATOM 0 HA MET A 42 -19.562 1.650 9.492 1.00 0.00 H new ATOM 0 HB2 MET A 42 -19.783 4.013 7.615 1.00 0.00 H new ATOM 0 HB3 MET A 42 -19.697 2.344 7.088 1.00 0.00 H new ATOM 0 HG2 MET A 42 -21.808 3.468 8.955 1.00 0.00 H new ATOM 0 HG3 MET A 42 -22.024 3.212 7.234 1.00 0.00 H new ATOM 0 HE1 MET A 42 -24.098 0.315 9.046 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.788 1.940 9.702 1.00 0.00 H new ATOM 0 HE3 MET A 42 -24.207 1.739 7.984 1.00 0.00 H new ATOM 285 N GLU A 43 -17.114 3.699 8.831 1.00 0.00 N ATOM 286 CA GLU A 43 -15.692 3.738 8.585 1.00 0.00 C ATOM 287 C GLU A 43 -14.949 3.145 9.771 1.00 0.00 C ATOM 288 O GLU A 43 -13.971 2.445 9.591 1.00 0.00 O ATOM 289 CB GLU A 43 -15.196 5.168 8.273 1.00 0.00 C ATOM 290 CG GLU A 43 -15.369 6.157 9.412 1.00 0.00 C ATOM 291 CD GLU A 43 -14.940 7.551 9.059 1.00 0.00 C ATOM 292 OE1 GLU A 43 -13.743 7.865 9.155 1.00 0.00 O ATOM 293 OE2 GLU A 43 -15.797 8.383 8.719 1.00 0.00 O ATOM 0 H GLU A 43 -17.550 4.611 8.966 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.485 3.137 7.700 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.140 5.122 8.005 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -15.730 5.542 7.400 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -16.416 6.172 9.715 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.794 5.814 10.272 1.00 0.00 H new ATOM 300 N LYS A 44 -15.485 3.358 10.981 1.00 0.00 N ATOM 301 CA LYS A 44 -14.858 2.880 12.198 1.00 0.00 C ATOM 302 C LYS A 44 -14.910 1.368 12.244 1.00 0.00 C ATOM 303 O LYS A 44 -13.896 0.703 12.496 1.00 0.00 O ATOM 304 CB LYS A 44 -15.566 3.466 13.408 1.00 0.00 C ATOM 305 CG LYS A 44 -14.875 3.177 14.723 1.00 0.00 C ATOM 306 CD LYS A 44 -15.533 3.922 15.861 1.00 0.00 C ATOM 307 CE LYS A 44 -16.894 3.337 16.240 1.00 0.00 C ATOM 308 NZ LYS A 44 -16.770 1.998 16.866 1.00 0.00 N ATOM 0 H LYS A 44 -16.358 3.863 11.132 1.00 0.00 H new ATOM 0 HA LYS A 44 -13.815 3.197 12.212 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -15.648 4.546 13.281 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -16.582 3.072 13.448 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.901 2.106 14.923 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.825 3.463 14.656 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.877 3.900 16.732 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.657 4.968 15.582 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -17.400 4.013 16.929 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -17.518 3.264 15.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.685 1.719 17.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.486 1.303 16.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.052 2.031 17.617 1.00 0.00 H new ATOM 322 N ARG A 45 -16.100 0.846 11.953 1.00 0.00 N ATOM 323 CA ARG A 45 -16.372 -0.585 11.914 1.00 0.00 C ATOM 324 C ARG A 45 -15.402 -1.297 11.001 1.00 0.00 C ATOM 325 O ARG A 45 -14.731 -2.262 11.403 1.00 0.00 O ATOM 326 CB ARG A 45 -17.787 -0.838 11.406 1.00 0.00 C ATOM 327 CG ARG A 45 -18.897 -0.471 12.370 1.00 0.00 C ATOM 328 CD ARG A 45 -20.252 -0.539 11.681 1.00 0.00 C ATOM 329 NE ARG A 45 -20.508 -1.865 11.083 1.00 0.00 N ATOM 330 CZ ARG A 45 -21.701 -2.335 10.681 1.00 0.00 C ATOM 331 NH1 ARG A 45 -22.807 -1.638 10.895 1.00 0.00 N ATOM 332 NH2 ARG A 45 -21.783 -3.531 10.103 1.00 0.00 N ATOM 0 H ARG A 45 -16.915 1.418 11.734 1.00 0.00 H new ATOM 0 HA ARG A 45 -16.261 -0.969 12.928 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -17.930 -0.276 10.483 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -17.881 -1.894 11.154 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -18.883 -1.149 13.224 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -18.731 0.534 12.758 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -21.036 -0.310 12.402 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -20.301 0.224 10.904 1.00 0.00 H new ATOM 0 HE ARG A 45 -19.704 -2.482 10.964 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -22.758 -0.736 11.369 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -23.708 -2.003 10.586 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.941 -4.090 9.966 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -22.688 -3.889 9.797 1.00 0.00 H new ATOM 346 N ARG A 46 -15.312 -0.803 9.787 1.00 0.00 N ATOM 347 CA ARG A 46 -14.472 -1.395 8.788 1.00 0.00 C ATOM 348 C ARG A 46 -13.003 -1.218 9.129 1.00 0.00 C ATOM 349 O ARG A 46 -12.257 -2.180 9.103 1.00 0.00 O ATOM 350 CB ARG A 46 -14.792 -0.807 7.424 1.00 0.00 C ATOM 351 CG ARG A 46 -14.026 -1.431 6.276 1.00 0.00 C ATOM 352 CD ARG A 46 -14.480 -0.839 4.961 1.00 0.00 C ATOM 353 NE ARG A 46 -15.910 -1.110 4.722 1.00 0.00 N ATOM 354 CZ ARG A 46 -16.737 -0.397 3.947 1.00 0.00 C ATOM 355 NH1 ARG A 46 -16.277 0.589 3.188 1.00 0.00 N ATOM 356 NH2 ARG A 46 -18.024 -0.719 3.913 1.00 0.00 N ATOM 0 H ARG A 46 -15.822 0.022 9.471 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.672 -2.466 8.760 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -15.860 -0.919 7.235 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.583 0.263 7.445 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.957 -1.263 6.409 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -14.181 -2.510 6.270 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.306 0.237 4.964 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -13.887 -1.256 4.147 1.00 0.00 H new ATOM 0 HE ARG A 46 -16.309 -1.921 5.194 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -15.282 0.812 3.190 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -16.919 1.124 2.603 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -18.369 -1.499 4.472 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -18.668 -0.186 3.328 1.00 0.00 H new ATOM 370 N ARG A 47 -12.611 0.009 9.481 1.00 0.00 N ATOM 371 CA ARG A 47 -11.216 0.354 9.807 1.00 0.00 C ATOM 372 C ARG A 47 -10.648 -0.560 10.870 1.00 0.00 C ATOM 373 O ARG A 47 -9.562 -1.113 10.700 1.00 0.00 O ATOM 374 CB ARG A 47 -11.116 1.808 10.269 1.00 0.00 C ATOM 375 CG ARG A 47 -9.722 2.274 10.654 1.00 0.00 C ATOM 376 CD ARG A 47 -9.765 3.724 11.085 1.00 0.00 C ATOM 377 NE ARG A 47 -8.477 4.202 11.581 1.00 0.00 N ATOM 378 CZ ARG A 47 -8.222 5.462 11.953 1.00 0.00 C ATOM 379 NH1 ARG A 47 -9.115 6.428 11.736 1.00 0.00 N ATOM 380 NH2 ARG A 47 -7.063 5.754 12.512 1.00 0.00 N ATOM 0 H ARG A 47 -13.253 0.799 9.550 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.629 0.223 8.898 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.489 2.451 9.472 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -11.776 1.946 11.125 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.333 1.656 11.463 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -9.043 2.157 9.809 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -10.077 4.340 10.242 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -10.518 3.845 11.864 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.716 3.526 11.649 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.002 6.210 11.283 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.911 7.385 12.023 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -6.368 5.022 12.658 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -6.862 6.712 12.798 1.00 0.00 H new ATOM 394 N ALA A 48 -11.397 -0.737 11.947 1.00 0.00 N ATOM 395 CA ALA A 48 -10.976 -1.574 13.039 1.00 0.00 C ATOM 396 C ALA A 48 -10.776 -2.991 12.561 1.00 0.00 C ATOM 397 O ALA A 48 -9.715 -3.566 12.767 1.00 0.00 O ATOM 398 CB ALA A 48 -11.984 -1.529 14.163 1.00 0.00 C ATOM 0 H ALA A 48 -12.310 -0.302 12.080 1.00 0.00 H new ATOM 0 HA ALA A 48 -10.026 -1.198 13.420 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -11.648 -2.168 14.979 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -12.083 -0.505 14.522 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -12.949 -1.882 13.800 1.00 0.00 H new ATOM 404 N ARG A 49 -11.763 -3.519 11.844 1.00 0.00 N ATOM 405 CA ARG A 49 -11.684 -4.881 11.352 1.00 0.00 C ATOM 406 C ARG A 49 -10.532 -5.066 10.370 1.00 0.00 C ATOM 407 O ARG A 49 -9.936 -6.133 10.330 1.00 0.00 O ATOM 408 CB ARG A 49 -13.005 -5.365 10.749 1.00 0.00 C ATOM 409 CG ARG A 49 -14.141 -5.529 11.746 1.00 0.00 C ATOM 410 CD ARG A 49 -13.771 -6.494 12.865 1.00 0.00 C ATOM 411 NE ARG A 49 -13.367 -7.827 12.372 1.00 0.00 N ATOM 412 CZ ARG A 49 -12.592 -8.686 13.054 1.00 0.00 C ATOM 413 NH1 ARG A 49 -11.986 -8.301 14.176 1.00 0.00 N ATOM 414 NH2 ARG A 49 -12.367 -9.909 12.581 1.00 0.00 N ATOM 0 H ARG A 49 -12.620 -3.025 11.594 1.00 0.00 H new ATOM 0 HA ARG A 49 -11.482 -5.506 12.222 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.316 -4.660 9.979 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -12.833 -6.321 10.255 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -14.395 -4.558 12.171 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -15.029 -5.893 11.230 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -12.956 -6.067 13.450 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -14.622 -6.605 13.537 1.00 0.00 H new ATOM 0 HE ARG A 49 -13.699 -8.114 11.451 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -12.109 -7.349 14.522 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -11.399 -8.958 14.690 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -12.784 -10.198 11.696 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -11.778 -10.557 13.103 1.00 0.00 H new ATOM 428 N ILE A 50 -10.222 -4.028 9.589 1.00 0.00 N ATOM 429 CA ILE A 50 -9.073 -4.048 8.688 1.00 0.00 C ATOM 430 C ILE A 50 -7.804 -4.321 9.492 1.00 0.00 C ATOM 431 O ILE A 50 -7.101 -5.306 9.256 1.00 0.00 O ATOM 432 CB ILE A 50 -8.923 -2.686 7.941 1.00 0.00 C ATOM 433 CG1 ILE A 50 -10.113 -2.462 7.007 1.00 0.00 C ATOM 434 CG2 ILE A 50 -7.605 -2.615 7.168 1.00 0.00 C ATOM 435 CD1 ILE A 50 -10.178 -1.082 6.399 1.00 0.00 C ATOM 0 H ILE A 50 -10.756 -3.159 9.565 1.00 0.00 H new ATOM 0 HA ILE A 50 -9.229 -4.834 7.949 1.00 0.00 H new ATOM 0 HB ILE A 50 -8.908 -1.891 8.686 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -10.072 -3.198 6.204 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -11.034 -2.645 7.561 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -7.533 -1.654 6.660 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.771 -2.723 7.861 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.571 -3.418 6.432 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -11.052 -1.011 5.751 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.253 -0.338 7.192 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -9.277 -0.899 5.814 1.00 0.00 H new ATOM 447 N ASN A 51 -7.583 -3.493 10.485 1.00 0.00 N ATOM 448 CA ASN A 51 -6.393 -3.566 11.326 1.00 0.00 C ATOM 449 C ASN A 51 -6.351 -4.879 12.079 1.00 0.00 C ATOM 450 O ASN A 51 -5.322 -5.555 12.120 1.00 0.00 O ATOM 451 CB ASN A 51 -6.372 -2.401 12.315 1.00 0.00 C ATOM 452 CG ASN A 51 -6.378 -1.053 11.630 1.00 0.00 C ATOM 453 OD1 ASN A 51 -5.818 -0.882 10.547 1.00 0.00 O ATOM 454 ND2 ASN A 51 -7.025 -0.097 12.228 1.00 0.00 N ATOM 0 H ASN A 51 -8.223 -2.741 10.741 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.516 -3.504 10.682 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -7.238 -2.473 12.973 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -5.486 -2.480 12.944 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -7.079 0.827 11.800 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -7.478 -0.271 13.125 1.00 0.00 H new ATOM 461 N GLU A 52 -7.483 -5.250 12.649 1.00 0.00 N ATOM 462 CA GLU A 52 -7.598 -6.498 13.407 1.00 0.00 C ATOM 463 C GLU A 52 -7.361 -7.739 12.527 1.00 0.00 C ATOM 464 O GLU A 52 -6.712 -8.698 12.963 1.00 0.00 O ATOM 465 CB GLU A 52 -8.951 -6.605 14.113 1.00 0.00 C ATOM 466 CG GLU A 52 -9.253 -5.450 15.055 1.00 0.00 C ATOM 467 CD GLU A 52 -10.557 -5.617 15.785 1.00 0.00 C ATOM 468 OE1 GLU A 52 -11.598 -5.837 15.140 1.00 0.00 O ATOM 469 OE2 GLU A 52 -10.563 -5.545 17.029 1.00 0.00 O ATOM 0 H GLU A 52 -8.345 -4.706 12.605 1.00 0.00 H new ATOM 0 HA GLU A 52 -6.813 -6.469 14.163 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.738 -6.661 13.361 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.982 -7.537 14.677 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.445 -5.359 15.781 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.277 -4.520 14.486 1.00 0.00 H new ATOM 476 N SER A 53 -7.837 -7.711 11.287 1.00 0.00 N ATOM 477 CA SER A 53 -7.686 -8.853 10.414 1.00 0.00 C ATOM 478 C SER A 53 -6.264 -8.933 9.895 1.00 0.00 C ATOM 479 O SER A 53 -5.687 -10.006 9.841 1.00 0.00 O ATOM 480 CB SER A 53 -8.688 -8.805 9.259 1.00 0.00 C ATOM 481 OG SER A 53 -10.021 -8.735 9.742 1.00 0.00 O ATOM 0 H SER A 53 -8.324 -6.916 10.874 1.00 0.00 H new ATOM 0 HA SER A 53 -7.895 -9.753 10.992 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.480 -7.940 8.629 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.570 -9.690 8.634 1.00 0.00 H new ATOM 0 HG SER A 53 -10.158 -7.881 10.203 1.00 0.00 H new ATOM 487 N LEU A 54 -5.686 -7.780 9.566 1.00 0.00 N ATOM 488 CA LEU A 54 -4.322 -7.715 9.057 1.00 0.00 C ATOM 489 C LEU A 54 -3.356 -8.167 10.160 1.00 0.00 C ATOM 490 O LEU A 54 -2.372 -8.863 9.898 1.00 0.00 O ATOM 491 CB LEU A 54 -4.008 -6.273 8.612 1.00 0.00 C ATOM 492 CG LEU A 54 -3.085 -6.089 7.388 1.00 0.00 C ATOM 493 CD1 LEU A 54 -2.975 -4.620 7.034 1.00 0.00 C ATOM 494 CD2 LEU A 54 -1.697 -6.672 7.609 1.00 0.00 C ATOM 0 H LEU A 54 -6.147 -6.873 9.644 1.00 0.00 H new ATOM 0 HA LEU A 54 -4.209 -8.374 8.196 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.953 -5.774 8.398 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.556 -5.752 9.456 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.539 -6.637 6.562 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.322 -4.502 6.169 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.964 -4.228 6.798 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.560 -4.072 7.880 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.090 -6.515 6.717 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.227 -6.179 8.460 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.779 -7.740 7.809 1.00 0.00 H new ATOM 506 N SER A 55 -3.684 -7.795 11.391 1.00 0.00 N ATOM 507 CA SER A 55 -2.909 -8.148 12.561 1.00 0.00 C ATOM 508 C SER A 55 -2.786 -9.667 12.693 1.00 0.00 C ATOM 509 O SER A 55 -1.673 -10.206 12.733 1.00 0.00 O ATOM 510 CB SER A 55 -3.555 -7.532 13.820 1.00 0.00 C ATOM 511 OG SER A 55 -2.870 -7.889 15.013 1.00 0.00 O ATOM 0 H SER A 55 -4.508 -7.232 11.601 1.00 0.00 H new ATOM 0 HA SER A 55 -1.902 -7.745 12.453 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.568 -6.446 13.723 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.593 -7.859 13.889 1.00 0.00 H new ATOM 0 HG SER A 55 -3.314 -7.475 15.782 1.00 0.00 H new ATOM 517 N GLN A 56 -3.913 -10.363 12.707 1.00 0.00 N ATOM 518 CA GLN A 56 -3.897 -11.809 12.859 1.00 0.00 C ATOM 519 C GLN A 56 -3.339 -12.481 11.609 1.00 0.00 C ATOM 520 O GLN A 56 -2.679 -13.513 11.701 1.00 0.00 O ATOM 521 CB GLN A 56 -5.284 -12.356 13.218 1.00 0.00 C ATOM 522 CG GLN A 56 -6.352 -12.138 12.163 1.00 0.00 C ATOM 523 CD GLN A 56 -7.699 -12.678 12.580 1.00 0.00 C ATOM 524 OE1 GLN A 56 -8.039 -13.839 12.322 1.00 0.00 O ATOM 525 NE2 GLN A 56 -8.469 -11.853 13.235 1.00 0.00 N ATOM 0 H GLN A 56 -4.843 -9.954 12.616 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.234 -12.047 13.691 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.198 -13.425 13.410 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -5.612 -11.890 14.147 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -6.441 -11.072 11.956 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -6.044 -12.618 11.234 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -8.151 -10.903 13.428 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.388 -12.158 13.554 1.00 0.00 H new ATOM 534 N LEU A 57 -3.571 -11.855 10.462 1.00 0.00 N ATOM 535 CA LEU A 57 -3.102 -12.343 9.177 1.00 0.00 C ATOM 536 C LEU A 57 -1.588 -12.505 9.192 1.00 0.00 C ATOM 537 O LEU A 57 -1.083 -13.616 9.084 1.00 0.00 O ATOM 538 CB LEU A 57 -3.590 -11.359 8.075 1.00 0.00 C ATOM 539 CG LEU A 57 -3.168 -11.582 6.622 1.00 0.00 C ATOM 540 CD1 LEU A 57 -4.247 -11.040 5.692 1.00 0.00 C ATOM 541 CD2 LEU A 57 -1.882 -10.834 6.338 1.00 0.00 C ATOM 0 H LEU A 57 -4.097 -10.983 10.400 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.512 -13.330 8.964 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.680 -11.355 8.101 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -3.260 -10.360 8.361 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.023 -12.650 6.459 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.947 -11.198 4.656 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.186 -11.560 5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.380 -9.973 5.872 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.587 -10.997 5.301 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.036 -9.768 6.508 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.096 -11.197 7.000 1.00 0.00 H new ATOM 553 N LYS A 58 -0.882 -11.416 9.433 1.00 0.00 N ATOM 554 CA LYS A 58 0.575 -11.449 9.476 1.00 0.00 C ATOM 555 C LYS A 58 1.113 -12.298 10.630 1.00 0.00 C ATOM 556 O LYS A 58 2.190 -12.884 10.524 1.00 0.00 O ATOM 557 CB LYS A 58 1.192 -10.023 9.409 1.00 0.00 C ATOM 558 CG LYS A 58 0.788 -9.024 10.501 1.00 0.00 C ATOM 559 CD LYS A 58 1.540 -9.237 11.796 1.00 0.00 C ATOM 560 CE LYS A 58 1.131 -8.222 12.838 1.00 0.00 C ATOM 561 NZ LYS A 58 1.927 -8.358 14.066 1.00 0.00 N ATOM 0 H LYS A 58 -1.290 -10.497 9.602 1.00 0.00 H new ATOM 0 HA LYS A 58 0.908 -11.959 8.572 1.00 0.00 H new ATOM 0 HB2 LYS A 58 2.277 -10.125 9.431 1.00 0.00 H new ATOM 0 HB3 LYS A 58 0.932 -9.589 8.443 1.00 0.00 H new ATOM 0 HG2 LYS A 58 0.968 -8.010 10.144 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -0.282 -9.111 10.689 1.00 0.00 H new ATOM 0 HD2 LYS A 58 1.349 -10.243 12.170 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.612 -9.163 11.614 1.00 0.00 H new ATOM 0 HE2 LYS A 58 1.252 -7.217 12.435 1.00 0.00 H new ATOM 0 HE3 LYS A 58 0.074 -8.346 13.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 1.620 -7.646 14.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 1.792 -9.309 14.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.933 -8.215 13.845 1.00 0.00 H new ATOM 575 N THR A 59 0.337 -12.398 11.698 1.00 0.00 N ATOM 576 CA THR A 59 0.713 -13.203 12.837 1.00 0.00 C ATOM 577 C THR A 59 0.724 -14.694 12.462 1.00 0.00 C ATOM 578 O THR A 59 1.729 -15.387 12.655 1.00 0.00 O ATOM 579 CB THR A 59 -0.237 -12.943 14.034 1.00 0.00 C ATOM 580 OG1 THR A 59 -0.150 -11.551 14.405 1.00 0.00 O ATOM 581 CG2 THR A 59 0.135 -13.800 15.239 1.00 0.00 C ATOM 0 H THR A 59 -0.562 -11.926 11.794 1.00 0.00 H new ATOM 0 HA THR A 59 1.721 -12.918 13.140 1.00 0.00 H new ATOM 0 HB THR A 59 -1.251 -13.203 13.730 1.00 0.00 H new ATOM 0 HG1 THR A 59 -0.514 -10.997 13.683 1.00 0.00 H new ATOM 0 HG21 THR A 59 -0.552 -13.592 16.059 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.070 -14.854 14.970 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.153 -13.567 15.550 1.00 0.00 H new ATOM 589 N LEU A 60 -0.360 -15.173 11.872 1.00 0.00 N ATOM 590 CA LEU A 60 -0.430 -16.567 11.486 1.00 0.00 C ATOM 591 C LEU A 60 0.442 -16.854 10.286 1.00 0.00 C ATOM 592 O LEU A 60 1.003 -17.923 10.175 1.00 0.00 O ATOM 593 CB LEU A 60 -1.873 -17.082 11.292 1.00 0.00 C ATOM 594 CG LEU A 60 -2.678 -17.420 12.576 1.00 0.00 C ATOM 595 CD1 LEU A 60 -1.946 -18.451 13.428 1.00 0.00 C ATOM 596 CD2 LEU A 60 -3.010 -16.182 13.397 1.00 0.00 C ATOM 0 H LEU A 60 -1.191 -14.623 11.654 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.032 -17.133 12.328 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.429 -16.330 10.732 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.833 -17.977 10.671 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.624 -17.850 12.247 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.533 -18.668 14.320 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.808 -19.366 12.853 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.973 -18.056 13.721 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.573 -16.474 14.284 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.087 -15.688 13.700 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.608 -15.497 12.796 1.00 0.00 H new ATOM 608 N ILE A 61 0.588 -15.884 9.414 1.00 0.00 N ATOM 609 CA ILE A 61 1.470 -16.021 8.271 1.00 0.00 C ATOM 610 C ILE A 61 2.934 -16.163 8.720 1.00 0.00 C ATOM 611 O ILE A 61 3.743 -16.904 8.108 1.00 0.00 O ATOM 612 CB ILE A 61 1.296 -14.834 7.277 1.00 0.00 C ATOM 613 CG1 ILE A 61 -0.035 -14.952 6.530 1.00 0.00 C ATOM 614 CG2 ILE A 61 2.450 -14.719 6.302 1.00 0.00 C ATOM 615 CD1 ILE A 61 -0.180 -16.232 5.734 1.00 0.00 C ATOM 0 H ILE A 61 0.107 -14.987 9.472 1.00 0.00 H new ATOM 0 HA ILE A 61 1.193 -16.933 7.743 1.00 0.00 H new ATOM 0 HB ILE A 61 1.291 -13.919 7.869 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.851 -14.889 7.250 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -0.138 -14.102 5.855 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.278 -13.876 5.633 1.00 0.00 H new ATOM 0 HG22 ILE A 61 3.377 -14.562 6.853 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.526 -15.636 5.718 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.148 -16.242 5.234 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.614 -16.289 4.989 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.110 -17.088 6.405 1.00 0.00 H new ATOM 627 N LEU A 62 3.297 -15.480 9.767 1.00 0.00 N ATOM 628 CA LEU A 62 4.635 -15.583 10.244 1.00 0.00 C ATOM 629 C LEU A 62 4.817 -16.916 10.971 1.00 0.00 C ATOM 630 O LEU A 62 5.789 -17.574 10.763 1.00 0.00 O ATOM 631 CB LEU A 62 5.034 -14.358 11.100 1.00 0.00 C ATOM 632 CG LEU A 62 6.548 -13.999 11.175 1.00 0.00 C ATOM 633 CD1 LEU A 62 7.365 -15.013 11.959 1.00 0.00 C ATOM 634 CD2 LEU A 62 7.131 -13.819 9.769 1.00 0.00 C ATOM 0 H LEU A 62 2.690 -14.855 10.297 1.00 0.00 H new ATOM 0 HA LEU A 62 5.321 -15.574 9.397 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.500 -13.489 10.714 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.677 -14.526 12.116 1.00 0.00 H new ATOM 0 HG LEU A 62 6.613 -13.056 11.718 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.410 -14.705 11.974 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.989 -15.071 12.981 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.282 -15.991 11.486 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.189 -13.569 9.843 1.00 0.00 H new ATOM 0 HD22 LEU A 62 7.016 -14.745 9.206 1.00 0.00 H new ATOM 0 HD23 LEU A 62 6.603 -13.015 9.256 1.00 0.00 H new ATOM 646 N ASP A 63 3.818 -17.334 11.718 1.00 0.00 N ATOM 647 CA ASP A 63 3.875 -18.585 12.528 1.00 0.00 C ATOM 648 C ASP A 63 3.771 -19.833 11.660 1.00 0.00 C ATOM 649 O ASP A 63 4.256 -20.891 12.012 1.00 0.00 O ATOM 650 CB ASP A 63 2.710 -18.605 13.474 1.00 0.00 C ATOM 651 CG ASP A 63 2.864 -19.563 14.655 1.00 0.00 C ATOM 652 OD1 ASP A 63 2.466 -20.748 14.556 1.00 0.00 O ATOM 653 OD2 ASP A 63 3.349 -19.127 15.726 1.00 0.00 O ATOM 0 H ASP A 63 2.933 -16.834 11.798 1.00 0.00 H new ATOM 0 HA ASP A 63 4.831 -18.592 13.051 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.554 -17.597 13.859 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.812 -18.876 12.918 1.00 0.00 H new ATOM 658 N ALA A 64 3.097 -19.716 10.554 1.00 0.00 N ATOM 659 CA ALA A 64 2.915 -20.833 9.663 1.00 0.00 C ATOM 660 C ALA A 64 4.145 -21.039 8.843 1.00 0.00 C ATOM 661 O ALA A 64 4.565 -22.161 8.619 1.00 0.00 O ATOM 662 CB ALA A 64 1.708 -20.629 8.766 1.00 0.00 C ATOM 0 H ALA A 64 2.658 -18.850 10.242 1.00 0.00 H new ATOM 0 HA ALA A 64 2.736 -21.724 10.265 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.597 -21.488 8.105 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.813 -20.524 9.379 1.00 0.00 H new ATOM 0 HB3 ALA A 64 1.847 -19.728 8.169 1.00 0.00 H new ATOM 668 N LEU A 65 4.750 -19.954 8.418 1.00 0.00 N ATOM 669 CA LEU A 65 5.934 -20.077 7.586 1.00 0.00 C ATOM 670 C LEU A 65 7.210 -20.092 8.407 1.00 0.00 C ATOM 671 O LEU A 65 8.184 -20.713 8.010 1.00 0.00 O ATOM 672 CB LEU A 65 6.003 -19.024 6.459 1.00 0.00 C ATOM 673 CG LEU A 65 4.988 -19.160 5.299 1.00 0.00 C ATOM 674 CD1 LEU A 65 3.581 -18.803 5.717 1.00 0.00 C ATOM 675 CD2 LEU A 65 5.419 -18.347 4.094 1.00 0.00 C ATOM 0 H LEU A 65 4.456 -18.999 8.625 1.00 0.00 H new ATOM 0 HA LEU A 65 5.844 -21.046 7.095 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.872 -18.040 6.908 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.006 -19.050 6.034 1.00 0.00 H new ATOM 0 HG LEU A 65 4.977 -20.212 5.016 1.00 0.00 H new ATOM 0 HD11 LEU A 65 2.909 -18.915 4.866 1.00 0.00 H new ATOM 0 HD12 LEU A 65 3.261 -19.465 6.522 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.556 -17.770 6.065 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.686 -18.463 3.296 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.490 -17.295 4.371 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.391 -18.698 3.747 1.00 0.00 H new ATOM 687 N LYS A 66 7.188 -19.396 9.554 1.00 0.00 N ATOM 688 CA LYS A 66 8.320 -19.313 10.505 1.00 0.00 C ATOM 689 C LYS A 66 9.589 -18.828 9.823 1.00 0.00 C ATOM 690 O LYS A 66 10.702 -19.252 10.147 1.00 0.00 O ATOM 691 CB LYS A 66 8.484 -20.651 11.213 1.00 0.00 C ATOM 692 CG LYS A 66 7.349 -20.930 12.207 1.00 0.00 C ATOM 693 CD LYS A 66 7.128 -22.418 12.418 1.00 0.00 C ATOM 694 CE LYS A 66 6.516 -23.044 11.169 1.00 0.00 C ATOM 695 NZ LYS A 66 6.239 -24.493 11.334 1.00 0.00 N ATOM 0 H LYS A 66 6.372 -18.864 9.857 1.00 0.00 H new ATOM 0 HA LYS A 66 8.103 -18.564 11.267 1.00 0.00 H new ATOM 0 HB2 LYS A 66 8.518 -21.449 10.472 1.00 0.00 H new ATOM 0 HB3 LYS A 66 9.437 -20.665 11.741 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.580 -20.459 13.162 1.00 0.00 H new ATOM 0 HG3 LYS A 66 6.428 -20.475 11.842 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.076 -22.904 12.650 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.470 -22.577 13.273 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.589 -22.526 10.925 1.00 0.00 H new ATOM 0 HE3 LYS A 66 7.193 -22.901 10.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 5.824 -24.869 10.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 7.126 -24.995 11.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 5.572 -24.632 12.120 1.00 0.00 H new ATOM 709 N LYS A 67 9.379 -17.878 8.906 1.00 0.00 N ATOM 710 CA LYS A 67 10.420 -17.278 8.091 1.00 0.00 C ATOM 711 C LYS A 67 11.530 -16.682 8.937 1.00 0.00 C ATOM 712 O LYS A 67 12.627 -17.234 8.989 1.00 0.00 O ATOM 713 CB LYS A 67 9.812 -16.209 7.186 1.00 0.00 C ATOM 714 CG LYS A 67 8.773 -16.743 6.210 1.00 0.00 C ATOM 715 CD LYS A 67 8.193 -15.639 5.351 1.00 0.00 C ATOM 716 CE LYS A 67 7.227 -14.727 6.109 1.00 0.00 C ATOM 717 NZ LYS A 67 5.963 -15.429 6.482 1.00 0.00 N ATOM 0 H LYS A 67 8.452 -17.500 8.711 1.00 0.00 H new ATOM 0 HA LYS A 67 10.864 -18.065 7.482 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.351 -15.441 7.807 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.611 -15.727 6.623 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.228 -17.500 5.571 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.972 -17.233 6.763 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.007 -15.038 4.946 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.672 -16.084 4.503 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.713 -14.355 7.011 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.990 -13.859 5.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 5.319 -14.759 6.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 5.510 -15.806 5.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.179 -16.211 7.132 1.00 0.00 H new ATOM 731 N ASP A 68 11.238 -15.571 9.599 1.00 0.00 N ATOM 732 CA ASP A 68 12.197 -14.899 10.464 1.00 0.00 C ATOM 733 C ASP A 68 11.518 -13.753 11.074 1.00 0.00 C ATOM 734 O ASP A 68 10.584 -13.197 10.475 1.00 0.00 O ATOM 735 CB ASP A 68 13.393 -14.367 9.699 1.00 0.00 C ATOM 736 CG ASP A 68 14.565 -14.117 10.596 1.00 0.00 C ATOM 737 OD1 ASP A 68 14.660 -13.035 11.162 1.00 0.00 O ATOM 738 OD2 ASP A 68 15.391 -15.026 10.782 1.00 0.00 O ATOM 0 H ASP A 68 10.329 -15.110 9.551 1.00 0.00 H new ATOM 0 HA ASP A 68 12.555 -15.621 11.198 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.675 -15.080 8.924 1.00 0.00 H new ATOM 0 HB3 ASP A 68 13.118 -13.441 9.195 1.00 0.00 H new ATOM 743 N SER A 69 11.959 -13.381 12.219 1.00 0.00 N ATOM 744 CA SER A 69 11.394 -12.287 12.902 1.00 0.00 C ATOM 745 C SER A 69 11.959 -10.948 12.391 1.00 0.00 C ATOM 746 O SER A 69 11.272 -9.942 12.398 1.00 0.00 O ATOM 747 CB SER A 69 11.590 -12.454 14.398 1.00 0.00 C ATOM 748 OG SER A 69 10.976 -13.655 14.851 1.00 0.00 O ATOM 0 H SER A 69 12.730 -13.834 12.710 1.00 0.00 H new ATOM 0 HA SER A 69 10.323 -12.266 12.701 1.00 0.00 H new ATOM 0 HB2 SER A 69 12.655 -12.473 14.631 1.00 0.00 H new ATOM 0 HB3 SER A 69 11.163 -11.600 14.924 1.00 0.00 H new ATOM 0 HG SER A 69 11.113 -13.748 15.817 1.00 0.00 H new ATOM 754 N SER A 70 13.177 -10.965 11.884 1.00 0.00 N ATOM 755 CA SER A 70 13.827 -9.761 11.400 1.00 0.00 C ATOM 756 C SER A 70 13.134 -9.291 10.125 1.00 0.00 C ATOM 757 O SER A 70 12.808 -8.113 9.968 1.00 0.00 O ATOM 758 CB SER A 70 15.321 -10.050 11.154 1.00 0.00 C ATOM 759 OG SER A 70 16.058 -8.873 10.854 1.00 0.00 O ATOM 0 H SER A 70 13.742 -11.810 11.796 1.00 0.00 H new ATOM 0 HA SER A 70 13.752 -8.966 12.142 1.00 0.00 H new ATOM 0 HB2 SER A 70 15.746 -10.527 12.037 1.00 0.00 H new ATOM 0 HB3 SER A 70 15.421 -10.758 10.331 1.00 0.00 H new ATOM 0 HG SER A 70 16.999 -9.105 10.708 1.00 0.00 H new ATOM 765 N ARG A 71 12.822 -10.239 9.262 1.00 0.00 N ATOM 766 CA ARG A 71 12.160 -9.940 8.005 1.00 0.00 C ATOM 767 C ARG A 71 10.662 -9.692 8.244 1.00 0.00 C ATOM 768 O ARG A 71 9.933 -9.345 7.326 1.00 0.00 O ATOM 769 CB ARG A 71 12.432 -11.069 6.979 1.00 0.00 C ATOM 770 CG ARG A 71 11.739 -12.395 7.261 1.00 0.00 C ATOM 771 CD ARG A 71 10.394 -12.484 6.560 1.00 0.00 C ATOM 772 NE ARG A 71 10.540 -12.668 5.111 1.00 0.00 N ATOM 773 CZ ARG A 71 10.377 -11.732 4.152 1.00 0.00 C ATOM 774 NH1 ARG A 71 10.193 -10.445 4.465 1.00 0.00 N ATOM 775 NH2 ARG A 71 10.446 -12.094 2.879 1.00 0.00 N ATOM 0 H ARG A 71 13.018 -11.229 9.409 1.00 0.00 H new ATOM 0 HA ARG A 71 12.567 -9.023 7.579 1.00 0.00 H new ATOM 0 HB2 ARG A 71 12.124 -10.721 5.993 1.00 0.00 H new ATOM 0 HB3 ARG A 71 13.507 -11.244 6.934 1.00 0.00 H new ATOM 0 HG2 ARG A 71 12.376 -13.216 6.932 1.00 0.00 H new ATOM 0 HG3 ARG A 71 11.598 -12.511 8.336 1.00 0.00 H new ATOM 0 HD2 ARG A 71 9.823 -13.315 6.975 1.00 0.00 H new ATOM 0 HD3 ARG A 71 9.823 -11.576 6.754 1.00 0.00 H new ATOM 0 HE ARG A 71 10.792 -13.604 4.795 1.00 0.00 H new ATOM 0 HH11 ARG A 71 10.174 -10.156 5.443 1.00 0.00 H new ATOM 0 HH12 ARG A 71 10.072 -9.753 3.726 1.00 0.00 H new ATOM 0 HH21 ARG A 71 10.620 -13.069 2.635 1.00 0.00 H new ATOM 0 HH22 ARG A 71 10.325 -11.398 2.144 1.00 0.00 H new ATOM 789 N HIS A 72 10.220 -9.944 9.478 1.00 0.00 N ATOM 790 CA HIS A 72 8.868 -9.642 9.914 1.00 0.00 C ATOM 791 C HIS A 72 8.825 -8.211 10.482 1.00 0.00 C ATOM 792 O HIS A 72 7.877 -7.466 10.245 1.00 0.00 O ATOM 793 CB HIS A 72 8.418 -10.661 10.972 1.00 0.00 C ATOM 794 CG HIS A 72 7.006 -10.495 11.488 1.00 0.00 C ATOM 795 ND1 HIS A 72 6.631 -10.807 12.765 1.00 0.00 N ATOM 796 CD2 HIS A 72 5.872 -10.085 10.861 1.00 0.00 C ATOM 797 CE1 HIS A 72 5.325 -10.589 12.888 1.00 0.00 C ATOM 798 NE2 HIS A 72 4.808 -10.147 11.759 1.00 0.00 N ATOM 0 H HIS A 72 10.800 -10.367 10.203 1.00 0.00 H new ATOM 0 HA HIS A 72 8.185 -9.707 9.067 1.00 0.00 H new ATOM 0 HB2 HIS A 72 8.515 -11.661 10.550 1.00 0.00 H new ATOM 0 HB3 HIS A 72 9.103 -10.604 11.818 1.00 0.00 H new ATOM 0 HD1 HIS A 72 7.249 -11.150 13.500 1.00 0.00 H new ATOM 0 HD2 HIS A 72 5.806 -9.763 9.832 1.00 0.00 H new ATOM 0 HE1 HIS A 72 4.761 -10.753 13.795 1.00 0.00 H new ATOM 806 N SER A 73 9.898 -7.811 11.166 1.00 0.00 N ATOM 807 CA SER A 73 9.994 -6.475 11.773 1.00 0.00 C ATOM 808 C SER A 73 10.147 -5.384 10.711 1.00 0.00 C ATOM 809 O SER A 73 10.033 -4.188 10.983 1.00 0.00 O ATOM 810 CB SER A 73 11.163 -6.426 12.766 1.00 0.00 C ATOM 811 OG SER A 73 11.050 -7.449 13.755 1.00 0.00 O ATOM 0 H SER A 73 10.720 -8.395 11.316 1.00 0.00 H new ATOM 0 HA SER A 73 9.065 -6.284 12.309 1.00 0.00 H new ATOM 0 HB2 SER A 73 12.104 -6.540 12.228 1.00 0.00 H new ATOM 0 HB3 SER A 73 11.190 -5.450 13.251 1.00 0.00 H new ATOM 0 HG SER A 73 11.136 -8.327 13.329 1.00 0.00 H new ATOM 817 N LYS A 74 10.388 -5.812 9.521 1.00 0.00 N ATOM 818 CA LYS A 74 10.574 -4.929 8.402 1.00 0.00 C ATOM 819 C LYS A 74 9.663 -5.388 7.257 1.00 0.00 C ATOM 820 O LYS A 74 9.869 -5.066 6.086 1.00 0.00 O ATOM 821 CB LYS A 74 12.069 -4.925 8.004 1.00 0.00 C ATOM 822 CG LYS A 74 12.507 -3.963 6.870 1.00 0.00 C ATOM 823 CD LYS A 74 12.204 -2.483 7.156 1.00 0.00 C ATOM 824 CE LYS A 74 10.775 -2.089 6.784 1.00 0.00 C ATOM 825 NZ LYS A 74 10.485 -2.389 5.370 1.00 0.00 N ATOM 0 H LYS A 74 10.464 -6.801 9.284 1.00 0.00 H new ATOM 0 HA LYS A 74 10.301 -3.905 8.656 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.653 -4.685 8.893 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.341 -5.938 7.709 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.578 -4.079 6.702 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.007 -4.254 5.946 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.368 -2.281 8.215 1.00 0.00 H new ATOM 0 HD3 LYS A 74 12.904 -1.859 6.600 1.00 0.00 H new ATOM 0 HE2 LYS A 74 10.071 -2.623 7.423 1.00 0.00 H new ATOM 0 HE3 LYS A 74 10.630 -1.025 6.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.702 -1.788 5.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 11.331 -2.201 4.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 10.217 -3.389 5.275 1.00 0.00 H new ATOM 839 N LEU A 75 8.625 -6.075 7.617 1.00 0.00 N ATOM 840 CA LEU A 75 7.724 -6.623 6.649 1.00 0.00 C ATOM 841 C LEU A 75 6.752 -5.555 6.195 1.00 0.00 C ATOM 842 O LEU A 75 5.979 -5.012 6.982 1.00 0.00 O ATOM 843 CB LEU A 75 7.032 -7.849 7.231 1.00 0.00 C ATOM 844 CG LEU A 75 6.380 -8.829 6.260 1.00 0.00 C ATOM 845 CD1 LEU A 75 7.337 -9.226 5.166 1.00 0.00 C ATOM 846 CD2 LEU A 75 5.906 -10.066 7.009 1.00 0.00 C ATOM 0 H LEU A 75 8.377 -6.272 8.587 1.00 0.00 H new ATOM 0 HA LEU A 75 8.269 -6.954 5.765 1.00 0.00 H new ATOM 0 HB2 LEU A 75 7.766 -8.400 7.819 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.264 -7.503 7.923 1.00 0.00 H new ATOM 0 HG LEU A 75 5.524 -8.334 5.801 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.846 -9.925 4.489 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.644 -8.339 4.612 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.214 -9.702 5.605 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.442 -10.760 6.308 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.757 -10.549 7.489 1.00 0.00 H new ATOM 0 HD23 LEU A 75 5.179 -9.776 7.767 1.00 0.00 H new ATOM 858 N GLU A 76 6.858 -5.223 4.937 1.00 0.00 N ATOM 859 CA GLU A 76 6.043 -4.214 4.305 1.00 0.00 C ATOM 860 C GLU A 76 4.647 -4.735 4.123 1.00 0.00 C ATOM 861 O GLU A 76 4.476 -5.916 3.878 1.00 0.00 O ATOM 862 CB GLU A 76 6.639 -3.899 2.937 1.00 0.00 C ATOM 863 CG GLU A 76 8.024 -3.301 3.004 1.00 0.00 C ATOM 864 CD GLU A 76 7.978 -1.900 3.479 1.00 0.00 C ATOM 865 OE1 GLU A 76 7.982 -1.670 4.695 1.00 0.00 O ATOM 866 OE2 GLU A 76 7.889 -0.999 2.646 1.00 0.00 O ATOM 0 H GLU A 76 7.530 -5.657 4.304 1.00 0.00 H new ATOM 0 HA GLU A 76 6.016 -3.317 4.924 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.676 -4.814 2.347 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.979 -3.208 2.413 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.648 -3.894 3.673 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.488 -3.339 2.018 1.00 0.00 H new ATOM 873 N LYS A 77 3.652 -3.858 4.226 1.00 0.00 N ATOM 874 CA LYS A 77 2.246 -4.228 4.008 1.00 0.00 C ATOM 875 C LYS A 77 2.069 -4.992 2.699 1.00 0.00 C ATOM 876 O LYS A 77 1.393 -6.015 2.645 1.00 0.00 O ATOM 877 CB LYS A 77 1.366 -2.981 4.024 1.00 0.00 C ATOM 878 CG LYS A 77 -0.063 -3.250 3.591 1.00 0.00 C ATOM 879 CD LYS A 77 -1.011 -2.089 3.881 1.00 0.00 C ATOM 880 CE LYS A 77 -1.116 -1.764 5.369 1.00 0.00 C ATOM 881 NZ LYS A 77 -2.058 -0.658 5.617 1.00 0.00 N ATOM 0 H LYS A 77 3.790 -2.875 4.461 1.00 0.00 H new ATOM 0 HA LYS A 77 1.940 -4.888 4.820 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.361 -2.561 5.030 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.802 -2.228 3.367 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.077 -3.463 2.522 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.427 -4.143 4.099 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.668 -1.204 3.345 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.002 -2.331 3.496 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.443 -2.650 5.913 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.132 -1.498 5.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.105 -0.464 6.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.732 0.194 5.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.003 -0.922 5.271 1.00 0.00 H new ATOM 895 N ALA A 78 2.725 -4.498 1.685 1.00 0.00 N ATOM 896 CA ALA A 78 2.742 -5.094 0.361 1.00 0.00 C ATOM 897 C ALA A 78 3.262 -6.536 0.399 1.00 0.00 C ATOM 898 O ALA A 78 2.767 -7.409 -0.311 1.00 0.00 O ATOM 899 CB ALA A 78 3.635 -4.261 -0.521 1.00 0.00 C ATOM 0 H ALA A 78 3.281 -3.645 1.750 1.00 0.00 H new ATOM 0 HA ALA A 78 1.724 -5.119 -0.027 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.662 -4.692 -1.522 1.00 0.00 H new ATOM 0 HB2 ALA A 78 3.247 -3.244 -0.574 1.00 0.00 H new ATOM 0 HB3 ALA A 78 4.643 -4.244 -0.106 1.00 0.00 H new ATOM 905 N ASP A 79 4.209 -6.775 1.283 1.00 0.00 N ATOM 906 CA ASP A 79 4.858 -8.083 1.402 1.00 0.00 C ATOM 907 C ASP A 79 3.979 -9.001 2.158 1.00 0.00 C ATOM 908 O ASP A 79 3.801 -10.139 1.792 1.00 0.00 O ATOM 909 CB ASP A 79 6.210 -7.998 2.112 1.00 0.00 C ATOM 910 CG ASP A 79 7.290 -7.338 1.288 1.00 0.00 C ATOM 911 OD1 ASP A 79 7.480 -7.714 0.112 1.00 0.00 O ATOM 912 OD2 ASP A 79 8.000 -6.462 1.810 1.00 0.00 O ATOM 0 H ASP A 79 4.556 -6.077 1.941 1.00 0.00 H new ATOM 0 HA ASP A 79 5.031 -8.453 0.392 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.087 -7.445 3.043 1.00 0.00 H new ATOM 0 HB3 ASP A 79 6.533 -9.004 2.379 1.00 0.00 H new ATOM 917 N ILE A 80 3.447 -8.481 3.229 1.00 0.00 N ATOM 918 CA ILE A 80 2.516 -9.173 4.095 1.00 0.00 C ATOM 919 C ILE A 80 1.325 -9.711 3.308 1.00 0.00 C ATOM 920 O ILE A 80 1.033 -10.905 3.372 1.00 0.00 O ATOM 921 CB ILE A 80 2.052 -8.212 5.212 1.00 0.00 C ATOM 922 CG1 ILE A 80 3.283 -7.775 5.983 1.00 0.00 C ATOM 923 CG2 ILE A 80 1.051 -8.888 6.125 1.00 0.00 C ATOM 924 CD1 ILE A 80 3.107 -6.638 6.930 1.00 0.00 C ATOM 0 H ILE A 80 3.653 -7.531 3.539 1.00 0.00 H new ATOM 0 HA ILE A 80 3.018 -10.030 4.543 1.00 0.00 H new ATOM 0 HB ILE A 80 1.551 -7.345 4.781 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.656 -8.632 6.544 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.057 -7.504 5.265 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.740 -8.191 6.903 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.181 -9.197 5.546 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.511 -9.763 6.585 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.057 -6.421 7.419 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.771 -5.757 6.383 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.364 -6.903 7.682 1.00 0.00 H new ATOM 936 N LEU A 81 0.683 -8.849 2.532 1.00 0.00 N ATOM 937 CA LEU A 81 -0.477 -9.251 1.738 1.00 0.00 C ATOM 938 C LEU A 81 -0.092 -10.355 0.763 1.00 0.00 C ATOM 939 O LEU A 81 -0.732 -11.409 0.719 1.00 0.00 O ATOM 940 CB LEU A 81 -1.044 -8.067 0.965 1.00 0.00 C ATOM 941 CG LEU A 81 -1.482 -6.850 1.772 1.00 0.00 C ATOM 942 CD1 LEU A 81 -2.023 -5.792 0.839 1.00 0.00 C ATOM 943 CD2 LEU A 81 -2.523 -7.226 2.825 1.00 0.00 C ATOM 0 H LEU A 81 0.943 -7.868 2.433 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.240 -9.621 2.423 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.292 -7.742 0.246 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.902 -8.418 0.392 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.615 -6.453 2.300 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.336 -4.923 1.417 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.246 -5.498 0.133 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.878 -6.191 0.293 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.814 -6.336 3.383 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.399 -7.650 2.335 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.099 -7.961 3.510 1.00 0.00 H new ATOM 955 N GLU A 82 0.993 -10.124 0.032 1.00 0.00 N ATOM 956 CA GLU A 82 1.517 -11.079 -0.933 1.00 0.00 C ATOM 957 C GLU A 82 1.844 -12.404 -0.284 1.00 0.00 C ATOM 958 O GLU A 82 1.516 -13.440 -0.812 1.00 0.00 O ATOM 959 CB GLU A 82 2.761 -10.494 -1.611 1.00 0.00 C ATOM 960 CG GLU A 82 3.639 -11.458 -2.342 1.00 0.00 C ATOM 961 CD GLU A 82 4.900 -10.806 -2.858 1.00 0.00 C ATOM 962 OE1 GLU A 82 4.819 -9.779 -3.572 1.00 0.00 O ATOM 963 OE2 GLU A 82 6.005 -11.301 -2.540 1.00 0.00 O ATOM 0 H GLU A 82 1.536 -9.263 0.094 1.00 0.00 H new ATOM 0 HA GLU A 82 0.747 -11.265 -1.682 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.437 -9.727 -2.314 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.361 -9.995 -0.850 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.904 -12.281 -1.678 1.00 0.00 H new ATOM 0 HG3 GLU A 82 3.087 -11.888 -3.178 1.00 0.00 H new ATOM 970 N MET A 83 2.401 -12.351 0.897 1.00 0.00 N ATOM 971 CA MET A 83 2.888 -13.525 1.585 1.00 0.00 C ATOM 972 C MET A 83 1.737 -14.421 1.972 1.00 0.00 C ATOM 973 O MET A 83 1.861 -15.640 1.991 1.00 0.00 O ATOM 974 CB MET A 83 3.666 -13.112 2.829 1.00 0.00 C ATOM 975 CG MET A 83 4.363 -14.244 3.567 1.00 0.00 C ATOM 976 SD MET A 83 6.012 -14.685 2.947 1.00 0.00 S ATOM 977 CE MET A 83 5.712 -15.266 1.274 1.00 0.00 C ATOM 0 H MET A 83 2.532 -11.483 1.417 1.00 0.00 H new ATOM 0 HA MET A 83 3.550 -14.075 0.915 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.414 -12.374 2.541 1.00 0.00 H new ATOM 0 HB3 MET A 83 2.981 -12.619 3.518 1.00 0.00 H new ATOM 0 HG2 MET A 83 4.451 -13.969 4.618 1.00 0.00 H new ATOM 0 HG3 MET A 83 3.728 -15.129 3.521 1.00 0.00 H new ATOM 0 HE1 MET A 83 6.520 -15.931 0.970 1.00 0.00 H new ATOM 0 HE2 MET A 83 4.766 -15.806 1.240 1.00 0.00 H new ATOM 0 HE3 MET A 83 5.668 -14.414 0.595 1.00 0.00 H new ATOM 987 N THR A 84 0.626 -13.805 2.237 1.00 0.00 N ATOM 988 CA THR A 84 -0.574 -14.487 2.616 1.00 0.00 C ATOM 989 C THR A 84 -1.167 -15.203 1.384 1.00 0.00 C ATOM 990 O THR A 84 -1.619 -16.354 1.466 1.00 0.00 O ATOM 991 CB THR A 84 -1.547 -13.453 3.198 1.00 0.00 C ATOM 992 OG1 THR A 84 -0.802 -12.648 4.108 1.00 0.00 O ATOM 993 CG2 THR A 84 -2.642 -14.112 4.000 1.00 0.00 C ATOM 0 H THR A 84 0.526 -12.791 2.195 1.00 0.00 H new ATOM 0 HA THR A 84 -0.375 -15.246 3.372 1.00 0.00 H new ATOM 0 HB THR A 84 -1.993 -12.888 2.380 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.401 -11.895 3.626 1.00 0.00 H new ATOM 0 HG21 THR A 84 -3.312 -13.349 4.397 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.204 -14.791 3.359 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.202 -14.673 4.825 1.00 0.00 H new ATOM 1001 N VAL A 85 -1.086 -14.535 0.238 1.00 0.00 N ATOM 1002 CA VAL A 85 -1.537 -15.097 -1.036 1.00 0.00 C ATOM 1003 C VAL A 85 -0.620 -16.255 -1.413 1.00 0.00 C ATOM 1004 O VAL A 85 -1.070 -17.322 -1.811 1.00 0.00 O ATOM 1005 CB VAL A 85 -1.469 -14.041 -2.166 1.00 0.00 C ATOM 1006 CG1 VAL A 85 -1.981 -14.583 -3.497 1.00 0.00 C ATOM 1007 CG2 VAL A 85 -2.191 -12.783 -1.786 1.00 0.00 C ATOM 0 H VAL A 85 -0.707 -13.591 0.163 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.569 -15.429 -0.920 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.415 -13.798 -2.302 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -1.913 -13.805 -4.257 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -1.376 -15.439 -3.798 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.020 -14.893 -3.388 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.123 -12.064 -2.602 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -3.239 -13.010 -1.589 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.737 -12.359 -0.890 1.00 0.00 H new ATOM 1017 N LYS A 86 0.669 -16.029 -1.262 1.00 0.00 N ATOM 1018 CA LYS A 86 1.679 -17.018 -1.548 1.00 0.00 C ATOM 1019 C LYS A 86 1.521 -18.254 -0.652 1.00 0.00 C ATOM 1020 O LYS A 86 1.672 -19.385 -1.105 1.00 0.00 O ATOM 1021 CB LYS A 86 3.069 -16.412 -1.408 1.00 0.00 C ATOM 1022 CG LYS A 86 3.336 -15.245 -2.362 1.00 0.00 C ATOM 1023 CD LYS A 86 4.811 -14.945 -2.441 1.00 0.00 C ATOM 1024 CE LYS A 86 5.165 -14.240 -3.729 1.00 0.00 C ATOM 1025 NZ LYS A 86 6.578 -13.826 -3.759 1.00 0.00 N ATOM 0 H LYS A 86 1.046 -15.140 -0.933 1.00 0.00 H new ATOM 0 HA LYS A 86 1.550 -17.346 -2.579 1.00 0.00 H new ATOM 0 HB2 LYS A 86 3.203 -16.068 -0.382 1.00 0.00 H new ATOM 0 HB3 LYS A 86 3.813 -17.189 -1.583 1.00 0.00 H new ATOM 0 HG2 LYS A 86 2.956 -15.487 -3.355 1.00 0.00 H new ATOM 0 HG3 LYS A 86 2.798 -14.360 -2.021 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.103 -14.325 -1.594 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.377 -15.874 -2.366 1.00 0.00 H new ATOM 0 HE2 LYS A 86 4.963 -14.901 -4.572 1.00 0.00 H new ATOM 0 HE3 LYS A 86 4.528 -13.364 -3.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 6.914 -13.811 -4.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 6.670 -12.876 -3.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 7.149 -14.499 -3.208 1.00 0.00 H new ATOM 1039 N HIS A 87 1.169 -18.023 0.609 1.00 0.00 N ATOM 1040 CA HIS A 87 0.916 -19.098 1.572 1.00 0.00 C ATOM 1041 C HIS A 87 -0.264 -19.956 1.116 1.00 0.00 C ATOM 1042 O HIS A 87 -0.253 -21.185 1.283 1.00 0.00 O ATOM 1043 CB HIS A 87 0.660 -18.505 2.966 1.00 0.00 C ATOM 1044 CG HIS A 87 0.316 -19.501 4.045 1.00 0.00 C ATOM 1045 ND1 HIS A 87 -0.758 -19.362 4.885 1.00 0.00 N ATOM 1046 CD2 HIS A 87 0.960 -20.623 4.450 1.00 0.00 C ATOM 1047 CE1 HIS A 87 -0.738 -20.364 5.756 1.00 0.00 C ATOM 1048 NE2 HIS A 87 0.286 -21.164 5.537 1.00 0.00 N ATOM 0 H HIS A 87 1.050 -17.087 0.995 1.00 0.00 H new ATOM 0 HA HIS A 87 1.796 -19.739 1.627 1.00 0.00 H new ATOM 0 HB2 HIS A 87 1.548 -17.954 3.275 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -0.153 -17.783 2.890 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -1.453 -18.617 4.847 1.00 0.00 H new ATOM 0 HD2 HIS A 87 1.853 -21.030 4.000 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -1.466 -20.505 6.541 1.00 0.00 H new ATOM 1056 N LEU A 88 -1.248 -19.306 0.492 1.00 0.00 N ATOM 1057 CA LEU A 88 -2.401 -19.979 -0.049 1.00 0.00 C ATOM 1058 C LEU A 88 -1.940 -20.949 -1.095 1.00 0.00 C ATOM 1059 O LEU A 88 -2.335 -22.110 -1.103 1.00 0.00 O ATOM 1060 CB LEU A 88 -3.357 -18.937 -0.668 1.00 0.00 C ATOM 1061 CG LEU A 88 -4.386 -19.436 -1.697 1.00 0.00 C ATOM 1062 CD1 LEU A 88 -5.339 -20.432 -1.099 1.00 0.00 C ATOM 1063 CD2 LEU A 88 -5.131 -18.272 -2.317 1.00 0.00 C ATOM 0 H LEU A 88 -1.256 -18.295 0.354 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.932 -20.517 0.737 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.901 -18.456 0.145 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -2.751 -18.167 -1.145 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.838 -19.952 -2.485 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.049 -20.759 -1.859 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.781 -21.293 -0.730 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -5.879 -19.968 -0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.854 -18.647 -3.042 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.653 -17.718 -1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.423 -17.613 -2.819 1.00 0.00 H new ATOM 1075 N ARG A 89 -1.030 -20.482 -1.919 1.00 0.00 N ATOM 1076 CA ARG A 89 -0.535 -21.257 -3.025 1.00 0.00 C ATOM 1077 C ARG A 89 0.219 -22.457 -2.505 1.00 0.00 C ATOM 1078 O ARG A 89 0.017 -23.560 -2.964 1.00 0.00 O ATOM 1079 CB ARG A 89 0.373 -20.420 -3.948 1.00 0.00 C ATOM 1080 CG ARG A 89 -0.173 -19.038 -4.330 1.00 0.00 C ATOM 1081 CD ARG A 89 -1.656 -19.073 -4.661 1.00 0.00 C ATOM 1082 NE ARG A 89 -1.977 -20.034 -5.731 1.00 0.00 N ATOM 1083 CZ ARG A 89 -3.208 -20.424 -6.071 1.00 0.00 C ATOM 1084 NH1 ARG A 89 -4.263 -19.947 -5.422 1.00 0.00 N ATOM 1085 NH2 ARG A 89 -3.372 -21.303 -7.045 1.00 0.00 N ATOM 0 H ARG A 89 -0.615 -19.554 -1.838 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.390 -21.586 -3.616 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.338 -20.288 -3.458 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.554 -20.986 -4.862 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.003 -18.343 -3.508 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.379 -18.657 -5.189 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.218 -19.333 -3.764 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.980 -18.077 -4.963 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.197 -20.433 -6.253 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -4.135 -19.280 -4.661 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -5.202 -20.247 -5.685 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.560 -21.680 -7.533 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -4.311 -21.604 -7.308 1.00 0.00 H new ATOM 1099 N ASN A 90 1.019 -22.229 -1.482 1.00 0.00 N ATOM 1100 CA ASN A 90 1.862 -23.265 -0.877 1.00 0.00 C ATOM 1101 C ASN A 90 1.046 -24.385 -0.305 1.00 0.00 C ATOM 1102 O ASN A 90 1.392 -25.563 -0.454 1.00 0.00 O ATOM 1103 CB ASN A 90 2.764 -22.702 0.213 1.00 0.00 C ATOM 1104 CG ASN A 90 3.769 -21.682 -0.277 1.00 0.00 C ATOM 1105 OD1 ASN A 90 4.202 -21.717 -1.430 1.00 0.00 O ATOM 1106 ND2 ASN A 90 4.166 -20.789 0.592 1.00 0.00 N ATOM 0 H ASN A 90 1.110 -21.316 -1.037 1.00 0.00 H new ATOM 0 HA ASN A 90 2.483 -23.653 -1.684 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.142 -22.243 0.982 1.00 0.00 H new ATOM 0 HB3 ASN A 90 3.300 -23.525 0.686 1.00 0.00 H new ATOM 0 HD21 ASN A 90 4.858 -20.089 0.324 1.00 0.00 H new ATOM 0 HD22 ASN A 90 3.784 -20.793 1.538 1.00 0.00 H new ATOM 1113 N LEU A 91 -0.022 -24.035 0.351 1.00 0.00 N ATOM 1114 CA LEU A 91 -0.904 -25.018 0.911 1.00 0.00 C ATOM 1115 C LEU A 91 -1.645 -25.739 -0.192 1.00 0.00 C ATOM 1116 O LEU A 91 -1.667 -26.957 -0.233 1.00 0.00 O ATOM 1117 CB LEU A 91 -1.868 -24.362 1.885 1.00 0.00 C ATOM 1118 CG LEU A 91 -1.234 -23.814 3.164 1.00 0.00 C ATOM 1119 CD1 LEU A 91 -2.225 -22.967 3.928 1.00 0.00 C ATOM 1120 CD2 LEU A 91 -0.757 -24.963 4.039 1.00 0.00 C ATOM 0 H LEU A 91 -0.305 -23.068 0.512 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.318 -25.754 1.462 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -2.376 -23.545 1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -2.631 -25.090 2.161 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.383 -23.192 2.889 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.755 -22.586 4.835 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.544 -22.131 3.306 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.091 -23.572 4.195 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -0.306 -24.565 4.948 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.604 -25.597 4.301 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.018 -25.552 3.496 1.00 0.00 H new ATOM 1132 N GLN A 92 -2.130 -24.979 -1.148 1.00 0.00 N ATOM 1133 CA GLN A 92 -2.948 -25.503 -2.251 1.00 0.00 C ATOM 1134 C GLN A 92 -2.162 -26.463 -3.147 1.00 0.00 C ATOM 1135 O GLN A 92 -2.717 -27.417 -3.698 1.00 0.00 O ATOM 1136 CB GLN A 92 -3.503 -24.348 -3.094 1.00 0.00 C ATOM 1137 CG GLN A 92 -4.700 -23.632 -2.525 1.00 0.00 C ATOM 1138 CD GLN A 92 -5.957 -24.447 -2.647 1.00 0.00 C ATOM 1139 OE1 GLN A 92 -6.100 -25.269 -3.556 1.00 0.00 O ATOM 1140 NE2 GLN A 92 -6.885 -24.208 -1.797 1.00 0.00 N ATOM 0 H GLN A 92 -1.975 -23.972 -1.194 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.770 -26.063 -1.805 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -2.707 -23.619 -3.245 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -3.770 -24.737 -4.077 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -4.519 -23.401 -1.475 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -4.833 -22.682 -3.042 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -6.735 -23.522 -1.057 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -7.774 -24.704 -1.860 1.00 0.00 H new ATOM 1149 N ARG A 93 -0.879 -26.237 -3.246 1.00 0.00 N ATOM 1150 CA ARG A 93 -0.021 -26.995 -4.162 1.00 0.00 C ATOM 1151 C ARG A 93 0.652 -28.170 -3.461 1.00 0.00 C ATOM 1152 O ARG A 93 1.345 -28.961 -4.086 1.00 0.00 O ATOM 1153 CB ARG A 93 1.033 -26.056 -4.783 1.00 0.00 C ATOM 1154 CG ARG A 93 2.110 -25.565 -3.810 1.00 0.00 C ATOM 1155 CD ARG A 93 3.338 -26.462 -3.827 1.00 0.00 C ATOM 1156 NE ARG A 93 4.005 -26.438 -5.137 1.00 0.00 N ATOM 1157 CZ ARG A 93 4.376 -27.520 -5.845 1.00 0.00 C ATOM 1158 NH1 ARG A 93 4.103 -28.745 -5.410 1.00 0.00 N ATOM 1159 NH2 ARG A 93 5.010 -27.362 -6.988 1.00 0.00 N ATOM 0 H ARG A 93 -0.386 -25.528 -2.703 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.647 -27.407 -4.953 1.00 0.00 H new ATOM 0 HB2 ARG A 93 1.519 -26.575 -5.609 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.523 -25.190 -5.206 1.00 0.00 H new ATOM 0 HG2 ARG A 93 2.400 -24.547 -4.072 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.699 -25.530 -2.801 1.00 0.00 H new ATOM 0 HD2 ARG A 93 4.037 -26.138 -3.056 1.00 0.00 H new ATOM 0 HD3 ARG A 93 3.047 -27.484 -3.585 1.00 0.00 H new ATOM 0 HE ARG A 93 4.203 -25.524 -5.543 1.00 0.00 H new ATOM 0 HH11 ARG A 93 3.606 -28.874 -4.529 1.00 0.00 H new ATOM 0 HH12 ARG A 93 4.390 -29.556 -5.957 1.00 0.00 H new ATOM 0 HH21 ARG A 93 5.217 -26.424 -7.331 1.00 0.00 H new ATOM 0 HH22 ARG A 93 5.294 -28.178 -7.530 1.00 0.00 H new ATOM 1173 N ALA A 94 0.456 -28.277 -2.166 1.00 0.00 N ATOM 1174 CA ALA A 94 1.087 -29.339 -1.380 1.00 0.00 C ATOM 1175 C ALA A 94 0.369 -30.667 -1.582 1.00 0.00 C ATOM 1176 O ALA A 94 0.817 -31.723 -1.115 1.00 0.00 O ATOM 1177 CB ALA A 94 1.079 -28.965 0.092 1.00 0.00 C ATOM 0 H ALA A 94 -0.135 -27.646 -1.625 1.00 0.00 H new ATOM 0 HA ALA A 94 2.116 -29.452 -1.720 1.00 0.00 H new ATOM 0 HB1 ALA A 94 1.550 -29.759 0.672 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.631 -28.036 0.234 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.051 -28.831 0.428 1.00 0.00 H new ATOM 1485 N GLU B 43 6.887 5.385 -1.986 1.00 0.00 N ATOM 1486 CA GLU B 43 5.607 5.097 -1.386 1.00 0.00 C ATOM 1487 C GLU B 43 4.628 4.624 -2.443 1.00 0.00 C ATOM 1488 O GLU B 43 3.757 3.819 -2.156 1.00 0.00 O ATOM 1489 CB GLU B 43 5.045 6.295 -0.608 1.00 0.00 C ATOM 1490 CG GLU B 43 4.789 7.525 -1.448 1.00 0.00 C ATOM 1491 CD GLU B 43 4.213 8.651 -0.654 1.00 0.00 C ATOM 1492 OE1 GLU B 43 4.981 9.405 -0.020 1.00 0.00 O ATOM 1493 OE2 GLU B 43 2.965 8.806 -0.657 1.00 0.00 O ATOM 0 HA GLU B 43 5.756 4.297 -0.661 1.00 0.00 H new ATOM 0 HB2 GLU B 43 4.112 5.996 -0.131 1.00 0.00 H new ATOM 0 HB3 GLU B 43 5.742 6.554 0.189 1.00 0.00 H new ATOM 0 HG2 GLU B 43 5.723 7.849 -1.906 1.00 0.00 H new ATOM 0 HG3 GLU B 43 4.107 7.271 -2.260 1.00 0.00 H new ATOM 1500 N LYS B 44 4.816 5.093 -3.679 1.00 0.00 N ATOM 1501 CA LYS B 44 3.971 4.703 -4.786 1.00 0.00 C ATOM 1502 C LYS B 44 4.217 3.253 -5.132 1.00 0.00 C ATOM 1503 O LYS B 44 3.286 2.508 -5.395 1.00 0.00 O ATOM 1504 CB LYS B 44 4.236 5.578 -5.997 1.00 0.00 C ATOM 1505 CG LYS B 44 3.341 5.260 -7.176 1.00 0.00 C ATOM 1506 CD LYS B 44 3.512 6.253 -8.292 1.00 0.00 C ATOM 1507 CE LYS B 44 4.912 6.227 -8.899 1.00 0.00 C ATOM 1508 NZ LYS B 44 5.037 7.177 -10.022 1.00 0.00 N ATOM 0 H LYS B 44 5.556 5.749 -3.929 1.00 0.00 H new ATOM 0 HA LYS B 44 2.930 4.831 -4.490 1.00 0.00 H new ATOM 0 HB2 LYS B 44 4.099 6.623 -5.718 1.00 0.00 H new ATOM 0 HB3 LYS B 44 5.277 5.462 -6.299 1.00 0.00 H new ATOM 0 HG2 LYS B 44 3.566 4.259 -7.543 1.00 0.00 H new ATOM 0 HG3 LYS B 44 2.301 5.254 -6.851 1.00 0.00 H new ATOM 0 HD2 LYS B 44 2.779 6.046 -9.072 1.00 0.00 H new ATOM 0 HD3 LYS B 44 3.303 7.254 -7.916 1.00 0.00 H new ATOM 0 HE2 LYS B 44 5.646 6.472 -8.131 1.00 0.00 H new ATOM 0 HE3 LYS B 44 5.139 5.219 -9.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 6.001 7.132 -10.409 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 4.353 6.928 -10.765 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 4.845 8.142 -9.684 1.00 0.00 H new ATOM 1522 N ARG B 45 5.480 2.865 -5.096 1.00 0.00 N ATOM 1523 CA ARG B 45 5.898 1.491 -5.360 1.00 0.00 C ATOM 1524 C ARG B 45 5.270 0.545 -4.362 1.00 0.00 C ATOM 1525 O ARG B 45 4.678 -0.485 -4.744 1.00 0.00 O ATOM 1526 CB ARG B 45 7.409 1.383 -5.279 1.00 0.00 C ATOM 1527 CG ARG B 45 8.140 2.096 -6.391 1.00 0.00 C ATOM 1528 CD ARG B 45 9.620 2.174 -6.104 1.00 0.00 C ATOM 1529 NE ARG B 45 10.212 0.850 -5.834 1.00 0.00 N ATOM 1530 CZ ARG B 45 11.510 0.622 -5.596 1.00 0.00 C ATOM 1531 NH1 ARG B 45 12.396 1.614 -5.685 1.00 0.00 N ATOM 1532 NH2 ARG B 45 11.918 -0.601 -5.271 1.00 0.00 N ATOM 0 H ARG B 45 6.253 3.496 -4.882 1.00 0.00 H new ATOM 0 HA ARG B 45 5.568 1.218 -6.362 1.00 0.00 H new ATOM 0 HB2 ARG B 45 7.740 1.788 -4.323 1.00 0.00 H new ATOM 0 HB3 ARG B 45 7.688 0.329 -5.293 1.00 0.00 H new ATOM 0 HG2 ARG B 45 7.976 1.572 -7.333 1.00 0.00 H new ATOM 0 HG3 ARG B 45 7.736 3.101 -6.510 1.00 0.00 H new ATOM 0 HD2 ARG B 45 10.128 2.630 -6.954 1.00 0.00 H new ATOM 0 HD3 ARG B 45 9.787 2.825 -5.246 1.00 0.00 H new ATOM 0 HE ARG B 45 9.584 0.046 -5.828 1.00 0.00 H new ATOM 0 HH11 ARG B 45 12.087 2.553 -5.936 1.00 0.00 H new ATOM 0 HH12 ARG B 45 13.383 1.434 -5.502 1.00 0.00 H new ATOM 0 HH21 ARG B 45 11.243 -1.363 -5.204 1.00 0.00 H new ATOM 0 HH22 ARG B 45 12.906 -0.778 -5.089 1.00 0.00 H new ATOM 1546 N ARG B 46 5.374 0.913 -3.095 1.00 0.00 N ATOM 1547 CA ARG B 46 4.818 0.136 -2.012 1.00 0.00 C ATOM 1548 C ARG B 46 3.304 0.071 -2.172 1.00 0.00 C ATOM 1549 O ARG B 46 2.724 -1.000 -2.163 1.00 0.00 O ATOM 1550 CB ARG B 46 5.147 0.798 -0.681 1.00 0.00 C ATOM 1551 CG ARG B 46 4.935 -0.082 0.540 1.00 0.00 C ATOM 1552 CD ARG B 46 5.055 0.751 1.808 1.00 0.00 C ATOM 1553 NE ARG B 46 5.453 -0.047 2.968 1.00 0.00 N ATOM 1554 CZ ARG B 46 4.810 -0.144 4.134 1.00 0.00 C ATOM 1555 NH1 ARG B 46 3.618 0.427 4.305 1.00 0.00 N ATOM 1556 NH2 ARG B 46 5.385 -0.794 5.144 1.00 0.00 N ATOM 0 H ARG B 46 5.849 1.763 -2.793 1.00 0.00 H new ATOM 0 HA ARG B 46 5.242 -0.868 -2.033 1.00 0.00 H new ATOM 0 HB2 ARG B 46 6.187 1.123 -0.701 1.00 0.00 H new ATOM 0 HB3 ARG B 46 4.535 1.694 -0.576 1.00 0.00 H new ATOM 0 HG2 ARG B 46 3.952 -0.551 0.495 1.00 0.00 H new ATOM 0 HG3 ARG B 46 5.671 -0.886 0.552 1.00 0.00 H new ATOM 0 HD2 ARG B 46 5.785 1.545 1.650 1.00 0.00 H new ATOM 0 HD3 ARG B 46 4.099 1.233 2.014 1.00 0.00 H new ATOM 0 HE ARG B 46 6.314 -0.587 2.876 1.00 0.00 H new ATOM 0 HH11 ARG B 46 3.186 0.946 3.540 1.00 0.00 H new ATOM 0 HH12 ARG B 46 3.137 0.345 5.201 1.00 0.00 H new ATOM 0 HH21 ARG B 46 6.308 -1.212 5.022 1.00 0.00 H new ATOM 0 HH22 ARG B 46 4.903 -0.874 6.039 1.00 0.00 H new ATOM 1570 N ARG B 47 2.696 1.242 -2.355 1.00 0.00 N ATOM 1571 CA ARG B 47 1.249 1.406 -2.510 1.00 0.00 C ATOM 1572 C ARG B 47 0.717 0.544 -3.643 1.00 0.00 C ATOM 1573 O ARG B 47 -0.305 -0.127 -3.487 1.00 0.00 O ATOM 1574 CB ARG B 47 0.935 2.877 -2.762 1.00 0.00 C ATOM 1575 CG ARG B 47 -0.532 3.233 -2.858 1.00 0.00 C ATOM 1576 CD ARG B 47 -0.678 4.728 -3.067 1.00 0.00 C ATOM 1577 NE ARG B 47 -2.063 5.153 -3.233 1.00 0.00 N ATOM 1578 CZ ARG B 47 -2.506 6.399 -3.031 1.00 0.00 C ATOM 1579 NH1 ARG B 47 -1.707 7.316 -2.467 1.00 0.00 N ATOM 1580 NH2 ARG B 47 -3.753 6.720 -3.363 1.00 0.00 N ATOM 0 H ARG B 47 3.206 2.124 -2.401 1.00 0.00 H new ATOM 0 HA ARG B 47 0.757 1.081 -1.593 1.00 0.00 H new ATOM 0 HB2 ARG B 47 1.380 3.466 -1.960 1.00 0.00 H new ATOM 0 HB3 ARG B 47 1.424 3.179 -3.688 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -0.995 2.693 -3.684 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -1.051 2.930 -1.949 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -0.244 5.251 -2.215 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -0.106 5.023 -3.947 1.00 0.00 H new ATOM 0 HE ARG B 47 -2.742 4.450 -3.524 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -0.758 7.065 -2.190 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -2.048 8.265 -2.315 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -4.369 6.017 -3.771 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -4.093 7.669 -3.210 1.00 0.00 H new ATOM 1594 N ALA B 48 1.420 0.554 -4.759 1.00 0.00 N ATOM 1595 CA ALA B 48 1.082 -0.243 -5.907 1.00 0.00 C ATOM 1596 C ALA B 48 1.019 -1.690 -5.505 1.00 0.00 C ATOM 1597 O ALA B 48 -0.022 -2.315 -5.648 1.00 0.00 O ATOM 1598 CB ALA B 48 2.103 -0.042 -7.008 1.00 0.00 C ATOM 0 H ALA B 48 2.254 1.127 -4.889 1.00 0.00 H new ATOM 0 HA ALA B 48 0.109 0.066 -6.288 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.833 -0.652 -7.870 1.00 0.00 H new ATOM 0 HB2 ALA B 48 2.123 1.008 -7.299 1.00 0.00 H new ATOM 0 HB3 ALA B 48 3.089 -0.338 -6.649 1.00 0.00 H new ATOM 1604 N ARG B 49 2.100 -2.184 -4.890 1.00 0.00 N ATOM 1605 CA ARG B 49 2.160 -3.573 -4.465 1.00 0.00 C ATOM 1606 C ARG B 49 1.086 -3.894 -3.435 1.00 0.00 C ATOM 1607 O ARG B 49 0.588 -5.007 -3.404 1.00 0.00 O ATOM 1608 CB ARG B 49 3.519 -3.966 -3.908 1.00 0.00 C ATOM 1609 CG ARG B 49 4.662 -4.003 -4.895 1.00 0.00 C ATOM 1610 CD ARG B 49 5.915 -4.550 -4.221 1.00 0.00 C ATOM 1611 NE ARG B 49 5.718 -5.926 -3.706 1.00 0.00 N ATOM 1612 CZ ARG B 49 6.281 -6.434 -2.589 1.00 0.00 C ATOM 1613 NH1 ARG B 49 7.063 -5.678 -1.813 1.00 0.00 N ATOM 1614 NH2 ARG B 49 6.072 -7.698 -2.245 1.00 0.00 N ATOM 0 H ARG B 49 2.937 -1.640 -4.680 1.00 0.00 H new ATOM 0 HA ARG B 49 1.983 -4.158 -5.368 1.00 0.00 H new ATOM 0 HB2 ARG B 49 3.777 -3.268 -3.112 1.00 0.00 H new ATOM 0 HB3 ARG B 49 3.429 -4.952 -3.451 1.00 0.00 H new ATOM 0 HG2 ARG B 49 4.396 -4.627 -5.748 1.00 0.00 H new ATOM 0 HG3 ARG B 49 4.854 -3.001 -5.280 1.00 0.00 H new ATOM 0 HD2 ARG B 49 6.740 -4.545 -4.933 1.00 0.00 H new ATOM 0 HD3 ARG B 49 6.199 -3.893 -3.399 1.00 0.00 H new ATOM 0 HE ARG B 49 5.105 -6.541 -4.241 1.00 0.00 H new ATOM 0 HH11 ARG B 49 7.241 -4.705 -2.062 1.00 0.00 H new ATOM 0 HH12 ARG B 49 7.482 -6.074 -0.972 1.00 0.00 H new ATOM 0 HH21 ARG B 49 5.482 -8.294 -2.826 1.00 0.00 H new ATOM 0 HH22 ARG B 49 6.501 -8.074 -1.400 1.00 0.00 H new ATOM 1628 N ILE B 50 0.742 -2.930 -2.587 1.00 0.00 N ATOM 1629 CA ILE B 50 -0.314 -3.121 -1.611 1.00 0.00 C ATOM 1630 C ILE B 50 -1.639 -3.433 -2.329 1.00 0.00 C ATOM 1631 O ILE B 50 -2.253 -4.477 -2.088 1.00 0.00 O ATOM 1632 CB ILE B 50 -0.466 -1.879 -0.684 1.00 0.00 C ATOM 1633 CG1 ILE B 50 0.832 -1.679 0.111 1.00 0.00 C ATOM 1634 CG2 ILE B 50 -1.647 -2.062 0.274 1.00 0.00 C ATOM 1635 CD1 ILE B 50 0.894 -0.396 0.903 1.00 0.00 C ATOM 0 H ILE B 50 1.182 -2.010 -2.559 1.00 0.00 H new ATOM 0 HA ILE B 50 -0.046 -3.967 -0.978 1.00 0.00 H new ATOM 0 HB ILE B 50 -0.659 -0.999 -1.297 1.00 0.00 H new ATOM 0 HG12 ILE B 50 0.956 -2.519 0.795 1.00 0.00 H new ATOM 0 HG13 ILE B 50 1.674 -1.704 -0.581 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -1.736 -1.184 0.913 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -2.565 -2.188 -0.300 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -1.481 -2.945 0.892 1.00 0.00 H new ATOM 0 HD11 ILE B 50 1.845 -0.340 1.432 1.00 0.00 H new ATOM 0 HD12 ILE B 50 0.805 0.454 0.226 1.00 0.00 H new ATOM 0 HD13 ILE B 50 0.077 -0.373 1.624 1.00 0.00 H new ATOM 1647 N ASN B 51 -2.022 -2.572 -3.272 1.00 0.00 N ATOM 1648 CA ASN B 51 -3.272 -2.773 -4.029 1.00 0.00 C ATOM 1649 C ASN B 51 -3.185 -4.027 -4.866 1.00 0.00 C ATOM 1650 O ASN B 51 -4.139 -4.812 -4.914 1.00 0.00 O ATOM 1651 CB ASN B 51 -3.625 -1.585 -4.946 1.00 0.00 C ATOM 1652 CG ASN B 51 -3.897 -0.278 -4.223 1.00 0.00 C ATOM 1653 OD1 ASN B 51 -5.023 -0.003 -3.789 1.00 0.00 O ATOM 1654 ND2 ASN B 51 -2.889 0.543 -4.112 1.00 0.00 N ATOM 0 H ASN B 51 -1.497 -1.737 -3.533 1.00 0.00 H new ATOM 0 HA ASN B 51 -4.063 -2.863 -3.285 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -2.806 -1.431 -5.648 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -4.504 -1.848 -5.534 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -3.015 1.446 -3.655 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -1.975 0.282 -4.482 1.00 0.00 H new ATOM 1661 N GLU B 52 -2.038 -4.228 -5.506 1.00 0.00 N ATOM 1662 CA GLU B 52 -1.812 -5.392 -6.353 1.00 0.00 C ATOM 1663 C GLU B 52 -1.935 -6.696 -5.571 1.00 0.00 C ATOM 1664 O GLU B 52 -2.566 -7.648 -6.043 1.00 0.00 O ATOM 1665 CB GLU B 52 -0.449 -5.329 -7.053 1.00 0.00 C ATOM 1666 CG GLU B 52 -0.286 -4.169 -8.028 1.00 0.00 C ATOM 1667 CD GLU B 52 1.056 -4.186 -8.718 1.00 0.00 C ATOM 1668 OE1 GLU B 52 1.239 -4.969 -9.667 1.00 0.00 O ATOM 1669 OE2 GLU B 52 1.954 -3.418 -8.331 1.00 0.00 O ATOM 0 H GLU B 52 -1.243 -3.592 -5.452 1.00 0.00 H new ATOM 0 HA GLU B 52 -2.592 -5.374 -7.114 1.00 0.00 H new ATOM 0 HB2 GLU B 52 0.331 -5.260 -6.294 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -0.289 -6.263 -7.591 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -1.077 -4.212 -8.776 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -0.405 -3.227 -7.492 1.00 0.00 H new ATOM 1676 N SER B 53 -1.383 -6.736 -4.370 1.00 0.00 N ATOM 1677 CA SER B 53 -1.401 -7.942 -3.592 1.00 0.00 C ATOM 1678 C SER B 53 -2.788 -8.185 -3.021 1.00 0.00 C ATOM 1679 O SER B 53 -3.291 -9.283 -3.100 1.00 0.00 O ATOM 1680 CB SER B 53 -0.356 -7.883 -2.484 1.00 0.00 C ATOM 1681 OG SER B 53 0.930 -7.612 -3.021 1.00 0.00 O ATOM 0 H SER B 53 -0.921 -5.945 -3.922 1.00 0.00 H new ATOM 0 HA SER B 53 -1.151 -8.779 -4.244 1.00 0.00 H new ATOM 0 HB2 SER B 53 -0.625 -7.110 -1.764 1.00 0.00 H new ATOM 0 HB3 SER B 53 -0.338 -8.829 -1.944 1.00 0.00 H new ATOM 0 HG SER B 53 1.078 -6.643 -3.043 1.00 0.00 H new ATOM 1687 N LEU B 54 -3.421 -7.130 -2.511 1.00 0.00 N ATOM 1688 CA LEU B 54 -4.739 -7.221 -1.897 1.00 0.00 C ATOM 1689 C LEU B 54 -5.777 -7.659 -2.945 1.00 0.00 C ATOM 1690 O LEU B 54 -6.640 -8.511 -2.688 1.00 0.00 O ATOM 1691 CB LEU B 54 -5.095 -5.842 -1.319 1.00 0.00 C ATOM 1692 CG LEU B 54 -6.060 -5.806 -0.125 1.00 0.00 C ATOM 1693 CD1 LEU B 54 -6.054 -4.430 0.512 1.00 0.00 C ATOM 1694 CD2 LEU B 54 -7.479 -6.178 -0.521 1.00 0.00 C ATOM 0 H LEU B 54 -3.031 -6.187 -2.513 1.00 0.00 H new ATOM 0 HA LEU B 54 -4.737 -7.963 -1.098 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -4.168 -5.353 -1.019 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -5.527 -5.242 -2.120 1.00 0.00 H new ATOM 0 HG LEU B 54 -5.710 -6.548 0.593 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -6.742 -4.417 1.357 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -5.048 -4.194 0.859 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -6.367 -3.688 -0.222 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -8.124 -6.138 0.357 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -7.843 -5.476 -1.271 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -7.489 -7.187 -0.933 1.00 0.00 H new ATOM 1706 N SER B 55 -5.674 -7.092 -4.117 1.00 0.00 N ATOM 1707 CA SER B 55 -6.582 -7.396 -5.179 1.00 0.00 C ATOM 1708 C SER B 55 -6.408 -8.833 -5.712 1.00 0.00 C ATOM 1709 O SER B 55 -7.399 -9.535 -5.936 1.00 0.00 O ATOM 1710 CB SER B 55 -6.467 -6.344 -6.267 1.00 0.00 C ATOM 1711 OG SER B 55 -6.805 -5.069 -5.735 1.00 0.00 O ATOM 0 H SER B 55 -4.957 -6.407 -4.358 1.00 0.00 H new ATOM 0 HA SER B 55 -7.598 -7.364 -4.785 1.00 0.00 H new ATOM 0 HB2 SER B 55 -5.452 -6.326 -6.664 1.00 0.00 H new ATOM 0 HB3 SER B 55 -7.130 -6.590 -7.097 1.00 0.00 H new ATOM 0 HG SER B 55 -6.015 -4.670 -5.314 1.00 0.00 H new ATOM 1717 N GLN B 56 -5.170 -9.299 -5.875 1.00 0.00 N ATOM 1718 CA GLN B 56 -4.976 -10.676 -6.338 1.00 0.00 C ATOM 1719 C GLN B 56 -5.372 -11.646 -5.226 1.00 0.00 C ATOM 1720 O GLN B 56 -5.891 -12.722 -5.487 1.00 0.00 O ATOM 1721 CB GLN B 56 -3.540 -10.942 -6.822 1.00 0.00 C ATOM 1722 CG GLN B 56 -2.476 -10.842 -5.749 1.00 0.00 C ATOM 1723 CD GLN B 56 -1.090 -11.058 -6.290 1.00 0.00 C ATOM 1724 OE1 GLN B 56 -0.595 -12.175 -6.331 1.00 0.00 O ATOM 1725 NE2 GLN B 56 -0.460 -9.999 -6.712 1.00 0.00 N ATOM 0 H GLN B 56 -4.316 -8.769 -5.702 1.00 0.00 H new ATOM 0 HA GLN B 56 -5.619 -10.832 -7.204 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -3.499 -11.939 -7.262 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -3.303 -10.233 -7.616 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -2.530 -9.860 -5.279 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -2.678 -11.579 -4.972 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -0.909 -9.084 -6.660 1.00 0.00 H new ATOM 0 HE22 GLN B 56 0.482 -10.084 -7.094 1.00 0.00 H new ATOM 1734 N LEU B 57 -5.173 -11.203 -3.997 1.00 0.00 N ATOM 1735 CA LEU B 57 -5.512 -11.939 -2.797 1.00 0.00 C ATOM 1736 C LEU B 57 -6.990 -12.321 -2.808 1.00 0.00 C ATOM 1737 O LEU B 57 -7.325 -13.508 -2.785 1.00 0.00 O ATOM 1738 CB LEU B 57 -5.104 -11.069 -1.578 1.00 0.00 C ATOM 1739 CG LEU B 57 -5.376 -11.565 -0.166 1.00 0.00 C ATOM 1740 CD1 LEU B 57 -4.335 -10.986 0.786 1.00 0.00 C ATOM 1741 CD2 LEU B 57 -6.718 -11.076 0.273 1.00 0.00 C ATOM 0 H LEU B 57 -4.758 -10.292 -3.803 1.00 0.00 H new ATOM 0 HA LEU B 57 -4.969 -12.882 -2.739 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -4.033 -10.883 -1.656 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -5.603 -10.106 -1.685 1.00 0.00 H new ATOM 0 HG LEU B 57 -5.337 -12.654 -0.155 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -4.530 -11.341 1.798 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -3.340 -11.305 0.475 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -4.390 -9.898 0.767 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -6.920 -11.428 1.285 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -6.731 -9.986 0.258 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -7.483 -11.457 -0.403 1.00 0.00 H new ATOM 1753 N LYS B 58 -7.865 -11.325 -2.918 1.00 0.00 N ATOM 1754 CA LYS B 58 -9.308 -11.585 -2.973 1.00 0.00 C ATOM 1755 C LYS B 58 -9.669 -12.440 -4.195 1.00 0.00 C ATOM 1756 O LYS B 58 -10.559 -13.288 -4.130 1.00 0.00 O ATOM 1757 CB LYS B 58 -10.150 -10.280 -2.957 1.00 0.00 C ATOM 1758 CG LYS B 58 -10.020 -9.392 -4.193 1.00 0.00 C ATOM 1759 CD LYS B 58 -10.901 -8.150 -4.091 1.00 0.00 C ATOM 1760 CE LYS B 58 -10.851 -7.331 -5.374 1.00 0.00 C ATOM 1761 NZ LYS B 58 -11.668 -6.093 -5.288 1.00 0.00 N ATOM 0 H LYS B 58 -7.608 -10.339 -2.971 1.00 0.00 H new ATOM 0 HA LYS B 58 -9.557 -12.141 -2.069 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -11.199 -10.548 -2.834 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -9.865 -9.696 -2.082 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -8.980 -9.091 -4.317 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -10.295 -9.961 -5.081 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -11.930 -8.447 -3.886 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -10.573 -7.536 -3.252 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -9.817 -7.066 -5.592 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -11.206 -7.940 -6.205 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -11.602 -5.570 -6.185 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -12.661 -6.344 -5.106 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -11.314 -5.497 -4.513 1.00 0.00 H new ATOM 1775 N THR B 59 -8.936 -12.246 -5.285 1.00 0.00 N ATOM 1776 CA THR B 59 -9.198 -12.964 -6.508 1.00 0.00 C ATOM 1777 C THR B 59 -8.904 -14.468 -6.344 1.00 0.00 C ATOM 1778 O THR B 59 -9.760 -15.309 -6.645 1.00 0.00 O ATOM 1779 CB THR B 59 -8.379 -12.390 -7.687 1.00 0.00 C ATOM 1780 OG1 THR B 59 -8.611 -10.966 -7.780 1.00 0.00 O ATOM 1781 CG2 THR B 59 -8.829 -13.026 -8.988 1.00 0.00 C ATOM 0 H THR B 59 -8.154 -11.593 -5.338 1.00 0.00 H new ATOM 0 HA THR B 59 -10.257 -12.839 -6.733 1.00 0.00 H new ATOM 0 HB THR B 59 -7.323 -12.598 -7.516 1.00 0.00 H new ATOM 0 HG1 THR B 59 -7.908 -10.488 -7.293 1.00 0.00 H new ATOM 0 HG21 THR B 59 -8.247 -12.616 -9.814 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.678 -14.104 -8.937 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.886 -12.815 -9.149 1.00 0.00 H new ATOM 1789 N LEU B 60 -7.726 -14.798 -5.832 1.00 0.00 N ATOM 1790 CA LEU B 60 -7.333 -16.187 -5.657 1.00 0.00 C ATOM 1791 C LEU B 60 -8.123 -16.878 -4.556 1.00 0.00 C ATOM 1792 O LEU B 60 -8.348 -18.088 -4.626 1.00 0.00 O ATOM 1793 CB LEU B 60 -5.809 -16.372 -5.466 1.00 0.00 C ATOM 1794 CG LEU B 60 -4.912 -16.338 -6.736 1.00 0.00 C ATOM 1795 CD1 LEU B 60 -5.314 -17.423 -7.724 1.00 0.00 C ATOM 1796 CD2 LEU B 60 -4.909 -14.976 -7.414 1.00 0.00 C ATOM 0 H LEU B 60 -7.026 -14.120 -5.531 1.00 0.00 H new ATOM 0 HA LEU B 60 -7.586 -16.680 -6.596 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -5.459 -15.594 -4.787 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -5.647 -17.327 -4.966 1.00 0.00 H new ATOM 0 HG LEU B 60 -3.894 -16.532 -6.398 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -4.669 -17.374 -8.601 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -5.211 -18.400 -7.253 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -6.350 -17.273 -8.027 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -4.267 -15.009 -8.294 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -5.924 -14.717 -7.715 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -4.534 -14.225 -6.719 1.00 0.00 H new ATOM 1808 N ILE B 61 -8.557 -16.126 -3.558 1.00 0.00 N ATOM 1809 CA ILE B 61 -9.399 -16.687 -2.510 1.00 0.00 C ATOM 1810 C ILE B 61 -10.769 -17.063 -3.083 1.00 0.00 C ATOM 1811 O ILE B 61 -11.240 -18.196 -2.919 1.00 0.00 O ATOM 1812 CB ILE B 61 -9.542 -15.729 -1.296 1.00 0.00 C ATOM 1813 CG1 ILE B 61 -8.198 -15.578 -0.572 1.00 0.00 C ATOM 1814 CG2 ILE B 61 -10.603 -16.222 -0.326 1.00 0.00 C ATOM 1815 CD1 ILE B 61 -7.683 -16.866 0.057 1.00 0.00 C ATOM 0 H ILE B 61 -8.344 -15.134 -3.450 1.00 0.00 H new ATOM 0 HA ILE B 61 -8.912 -17.589 -2.138 1.00 0.00 H new ATOM 0 HB ILE B 61 -9.854 -14.756 -1.675 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.455 -15.210 -1.280 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -8.299 -14.821 0.206 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.679 -15.530 0.513 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.564 -16.280 -0.837 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.328 -17.210 0.043 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -6.729 -16.675 0.549 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.404 -17.226 0.791 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.547 -17.620 -0.718 1.00 0.00 H new ATOM 1827 N LEU B 62 -11.376 -16.151 -3.822 1.00 0.00 N ATOM 1828 CA LEU B 62 -12.658 -16.430 -4.469 1.00 0.00 C ATOM 1829 C LEU B 62 -12.546 -17.514 -5.511 1.00 0.00 C ATOM 1830 O LEU B 62 -13.515 -18.089 -5.889 1.00 0.00 O ATOM 1831 CB LEU B 62 -13.333 -15.184 -5.043 1.00 0.00 C ATOM 1832 CG LEU B 62 -14.282 -14.419 -4.110 1.00 0.00 C ATOM 1833 CD1 LEU B 62 -15.477 -15.276 -3.730 1.00 0.00 C ATOM 1834 CD2 LEU B 62 -13.572 -13.952 -2.873 1.00 0.00 C ATOM 0 H LEU B 62 -11.009 -15.214 -3.992 1.00 0.00 H new ATOM 0 HA LEU B 62 -13.307 -16.796 -3.673 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -12.554 -14.497 -5.373 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -13.894 -15.479 -5.930 1.00 0.00 H new ATOM 0 HG LEU B 62 -14.637 -13.543 -4.654 1.00 0.00 H new ATOM 0 HD11 LEU B 62 -16.134 -14.711 -3.069 1.00 0.00 H new ATOM 0 HD12 LEU B 62 -16.023 -15.558 -4.630 1.00 0.00 H new ATOM 0 HD13 LEU B 62 -15.132 -16.175 -3.218 1.00 0.00 H new ATOM 0 HD21 LEU B 62 -14.271 -13.414 -2.233 1.00 0.00 H new ATOM 0 HD22 LEU B 62 -13.176 -14.813 -2.334 1.00 0.00 H new ATOM 0 HD23 LEU B 62 -12.752 -13.290 -3.152 1.00 0.00 H new ATOM 1846 N ASP B 63 -11.365 -17.745 -5.973 1.00 0.00 N ATOM 1847 CA ASP B 63 -11.085 -18.799 -6.940 1.00 0.00 C ATOM 1848 C ASP B 63 -10.908 -20.147 -6.248 1.00 0.00 C ATOM 1849 O ASP B 63 -11.309 -21.168 -6.756 1.00 0.00 O ATOM 1850 CB ASP B 63 -9.816 -18.461 -7.629 1.00 0.00 C ATOM 1851 CG ASP B 63 -9.396 -19.429 -8.715 1.00 0.00 C ATOM 1852 OD1 ASP B 63 -9.868 -19.300 -9.880 1.00 0.00 O ATOM 1853 OD2 ASP B 63 -8.555 -20.297 -8.443 1.00 0.00 O ATOM 0 H ASP B 63 -10.542 -17.210 -5.698 1.00 0.00 H new ATOM 0 HA ASP B 63 -11.919 -18.871 -7.638 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -9.912 -17.468 -8.067 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -9.021 -18.406 -6.886 1.00 0.00 H new ATOM 1858 N ALA B 64 -10.286 -20.124 -5.090 1.00 0.00 N ATOM 1859 CA ALA B 64 -9.976 -21.338 -4.348 1.00 0.00 C ATOM 1860 C ALA B 64 -11.204 -21.878 -3.659 1.00 0.00 C ATOM 1861 O ALA B 64 -11.389 -23.099 -3.543 1.00 0.00 O ATOM 1862 CB ALA B 64 -8.872 -21.069 -3.336 1.00 0.00 C ATOM 0 H ALA B 64 -9.979 -19.266 -4.632 1.00 0.00 H new ATOM 0 HA ALA B 64 -9.628 -22.091 -5.055 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -8.650 -21.985 -2.788 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -7.976 -20.731 -3.856 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.198 -20.298 -2.638 1.00 0.00 H new ATOM 1868 N LEU B 65 -12.058 -20.990 -3.217 1.00 0.00 N ATOM 1869 CA LEU B 65 -13.256 -21.444 -2.534 1.00 0.00 C ATOM 1870 C LEU B 65 -14.471 -21.258 -3.397 1.00 0.00 C ATOM 1871 O LEU B 65 -15.353 -22.109 -3.406 1.00 0.00 O ATOM 1872 CB LEU B 65 -13.487 -20.794 -1.152 1.00 0.00 C ATOM 1873 CG LEU B 65 -12.365 -20.910 -0.126 1.00 0.00 C ATOM 1874 CD1 LEU B 65 -11.346 -19.821 -0.322 1.00 0.00 C ATOM 1875 CD2 LEU B 65 -12.918 -20.890 1.285 1.00 0.00 C ATOM 0 H LEU B 65 -11.959 -19.979 -3.310 1.00 0.00 H new ATOM 0 HA LEU B 65 -13.091 -22.505 -2.348 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -13.693 -19.735 -1.308 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -14.386 -21.233 -0.719 1.00 0.00 H new ATOM 0 HG LEU B 65 -11.867 -21.868 -0.276 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -10.555 -19.924 0.421 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -10.917 -19.899 -1.321 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -11.826 -18.849 -0.208 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -12.098 -20.974 1.998 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -13.451 -19.954 1.454 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -13.603 -21.727 1.419 1.00 0.00 H new ATOM 1887 N LYS B 66 -14.493 -20.161 -4.152 1.00 0.00 N ATOM 1888 CA LYS B 66 -15.625 -19.810 -5.015 1.00 0.00 C ATOM 1889 C LYS B 66 -16.899 -19.701 -4.207 1.00 0.00 C ATOM 1890 O LYS B 66 -17.747 -20.585 -4.211 1.00 0.00 O ATOM 1891 CB LYS B 66 -15.738 -20.782 -6.194 1.00 0.00 C ATOM 1892 CG LYS B 66 -14.574 -20.664 -7.186 1.00 0.00 C ATOM 1893 CD LYS B 66 -14.303 -21.968 -7.905 1.00 0.00 C ATOM 1894 CE LYS B 66 -13.682 -22.978 -6.956 1.00 0.00 C ATOM 1895 NZ LYS B 66 -13.184 -24.186 -7.653 1.00 0.00 N ATOM 0 H LYS B 66 -13.727 -19.488 -4.184 1.00 0.00 H new ATOM 0 HA LYS B 66 -15.448 -18.826 -5.449 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -15.781 -21.802 -5.813 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -16.675 -20.599 -6.720 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -14.799 -19.888 -7.917 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -13.676 -20.350 -6.654 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -15.233 -22.366 -8.312 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -13.635 -21.793 -8.748 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -12.858 -22.507 -6.420 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -14.421 -23.272 -6.211 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -12.771 -24.841 -6.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -13.973 -24.654 -8.144 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -12.458 -23.913 -8.346 1.00 0.00 H new ATOM 1909 N LYS B 67 -16.953 -18.653 -3.421 1.00 0.00 N ATOM 1910 CA LYS B 67 -18.087 -18.400 -2.557 1.00 0.00 C ATOM 1911 C LYS B 67 -19.225 -17.789 -3.349 1.00 0.00 C ATOM 1912 O LYS B 67 -20.296 -18.388 -3.465 1.00 0.00 O ATOM 1913 CB LYS B 67 -17.701 -17.484 -1.385 1.00 0.00 C ATOM 1914 CG LYS B 67 -16.618 -18.045 -0.476 1.00 0.00 C ATOM 1915 CD LYS B 67 -16.302 -17.084 0.659 1.00 0.00 C ATOM 1916 CE LYS B 67 -15.185 -17.609 1.559 1.00 0.00 C ATOM 1917 NZ LYS B 67 -15.549 -18.853 2.269 1.00 0.00 N ATOM 0 H LYS B 67 -16.215 -17.951 -3.360 1.00 0.00 H new ATOM 0 HA LYS B 67 -18.415 -19.354 -2.144 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -17.363 -16.528 -1.784 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -18.591 -17.284 -0.788 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -16.942 -19.002 -0.067 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -15.715 -18.236 -1.056 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -16.011 -16.118 0.246 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -17.200 -16.918 1.254 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -14.295 -17.789 0.956 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -14.925 -16.843 2.290 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -14.786 -19.113 2.926 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -16.429 -18.704 2.802 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -15.688 -19.619 1.579 1.00 0.00 H new ATOM 1931 N ASP B 68 -18.980 -16.608 -3.911 1.00 0.00 N ATOM 1932 CA ASP B 68 -19.981 -15.882 -4.697 1.00 0.00 C ATOM 1933 C ASP B 68 -19.304 -14.701 -5.285 1.00 0.00 C ATOM 1934 O ASP B 68 -18.398 -14.136 -4.663 1.00 0.00 O ATOM 1935 CB ASP B 68 -21.101 -15.356 -3.810 1.00 0.00 C ATOM 1936 CG ASP B 68 -22.380 -14.991 -4.548 1.00 0.00 C ATOM 1937 OD1 ASP B 68 -22.344 -14.148 -5.443 1.00 0.00 O ATOM 1938 OD2 ASP B 68 -23.461 -15.505 -4.183 1.00 0.00 O ATOM 0 H ASP B 68 -18.084 -16.126 -3.836 1.00 0.00 H new ATOM 0 HA ASP B 68 -20.400 -16.553 -5.447 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -21.334 -16.110 -3.058 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -20.741 -14.475 -3.278 1.00 0.00 H new ATOM 1943 N SER B 69 -19.747 -14.293 -6.411 1.00 0.00 N ATOM 1944 CA SER B 69 -19.173 -13.190 -7.072 1.00 0.00 C ATOM 1945 C SER B 69 -19.777 -11.856 -6.593 1.00 0.00 C ATOM 1946 O SER B 69 -19.136 -10.795 -6.684 1.00 0.00 O ATOM 1947 CB SER B 69 -19.280 -13.395 -8.565 1.00 0.00 C ATOM 1948 OG SER B 69 -20.567 -13.903 -8.897 1.00 0.00 O ATOM 0 H SER B 69 -20.529 -14.722 -6.906 1.00 0.00 H new ATOM 0 HA SER B 69 -18.115 -13.125 -6.819 1.00 0.00 H new ATOM 0 HB2 SER B 69 -19.108 -12.451 -9.083 1.00 0.00 H new ATOM 0 HB3 SER B 69 -18.509 -14.088 -8.901 1.00 0.00 H new ATOM 0 HG SER B 69 -20.628 -14.031 -9.867 1.00 0.00 H new ATOM 1954 N SER B 70 -20.968 -11.921 -6.032 1.00 0.00 N ATOM 1955 CA SER B 70 -21.634 -10.755 -5.514 1.00 0.00 C ATOM 1956 C SER B 70 -20.904 -10.285 -4.253 1.00 0.00 C ATOM 1957 O SER B 70 -20.538 -9.116 -4.127 1.00 0.00 O ATOM 1958 CB SER B 70 -23.105 -11.082 -5.219 1.00 0.00 C ATOM 1959 OG SER B 70 -23.827 -9.941 -4.796 1.00 0.00 O ATOM 0 H SER B 70 -21.497 -12.787 -5.925 1.00 0.00 H new ATOM 0 HA SER B 70 -21.613 -9.951 -6.250 1.00 0.00 H new ATOM 0 HB2 SER B 70 -23.571 -11.495 -6.114 1.00 0.00 H new ATOM 0 HB3 SER B 70 -23.158 -11.851 -4.448 1.00 0.00 H new ATOM 0 HG SER B 70 -24.758 -10.190 -4.620 1.00 0.00 H new ATOM 1965 N ARG B 71 -20.603 -11.231 -3.362 1.00 0.00 N ATOM 1966 CA ARG B 71 -19.894 -10.917 -2.124 1.00 0.00 C ATOM 1967 C ARG B 71 -18.433 -10.617 -2.418 1.00 0.00 C ATOM 1968 O ARG B 71 -17.748 -10.051 -1.598 1.00 0.00 O ATOM 1969 CB ARG B 71 -20.109 -12.035 -1.053 1.00 0.00 C ATOM 1970 CG ARG B 71 -19.394 -13.365 -1.293 1.00 0.00 C ATOM 1971 CD ARG B 71 -17.995 -13.376 -0.686 1.00 0.00 C ATOM 1972 NE ARG B 71 -18.027 -13.327 0.792 1.00 0.00 N ATOM 1973 CZ ARG B 71 -17.724 -12.257 1.558 1.00 0.00 C ATOM 1974 NH1 ARG B 71 -17.595 -11.064 1.029 1.00 0.00 N ATOM 1975 NH2 ARG B 71 -17.619 -12.390 2.866 1.00 0.00 N ATOM 0 H ARG B 71 -20.839 -12.217 -3.475 1.00 0.00 H new ATOM 0 HA ARG B 71 -20.312 -10.011 -1.684 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -19.788 -11.646 -0.087 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -21.178 -12.233 -0.978 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -19.982 -14.176 -0.864 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -19.326 -13.553 -2.365 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -17.469 -14.275 -1.007 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -17.430 -12.524 -1.064 1.00 0.00 H new ATOM 0 HE ARG B 71 -18.304 -14.180 1.278 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -17.724 -10.934 0.026 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -17.366 -10.266 1.621 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -17.767 -13.301 3.299 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -17.390 -11.581 3.444 1.00 0.00 H new ATOM 1989 N HIS B 72 -17.993 -10.983 -3.615 1.00 0.00 N ATOM 1990 CA HIS B 72 -16.651 -10.688 -4.102 1.00 0.00 C ATOM 1991 C HIS B 72 -16.605 -9.224 -4.541 1.00 0.00 C ATOM 1992 O HIS B 72 -15.646 -8.520 -4.292 1.00 0.00 O ATOM 1993 CB HIS B 72 -16.325 -11.616 -5.306 1.00 0.00 C ATOM 1994 CG HIS B 72 -14.923 -11.524 -5.908 1.00 0.00 C ATOM 1995 ND1 HIS B 72 -14.477 -12.361 -6.911 1.00 0.00 N ATOM 1996 CD2 HIS B 72 -13.879 -10.686 -5.649 1.00 0.00 C ATOM 1997 CE1 HIS B 72 -13.226 -12.027 -7.217 1.00 0.00 C ATOM 1998 NE2 HIS B 72 -12.808 -11.011 -6.481 1.00 0.00 N ATOM 0 H HIS B 72 -18.565 -11.499 -4.283 1.00 0.00 H new ATOM 0 HA HIS B 72 -15.915 -10.859 -3.316 1.00 0.00 H new ATOM 0 HB2 HIS B 72 -16.489 -12.646 -4.991 1.00 0.00 H new ATOM 0 HB3 HIS B 72 -17.045 -11.407 -6.097 1.00 0.00 H new ATOM 0 HD2 HIS B 72 -13.881 -9.894 -4.914 1.00 0.00 H new ATOM 0 HE1 HIS B 72 -12.629 -12.522 -7.969 1.00 0.00 H new ATOM 0 HE2 HIS B 72 -11.894 -10.560 -6.515 1.00 0.00 H new ATOM 2006 N SER B 73 -17.674 -8.761 -5.134 1.00 0.00 N ATOM 2007 CA SER B 73 -17.703 -7.416 -5.681 1.00 0.00 C ATOM 2008 C SER B 73 -18.171 -6.380 -4.648 1.00 0.00 C ATOM 2009 O SER B 73 -18.225 -5.180 -4.918 1.00 0.00 O ATOM 2010 CB SER B 73 -18.554 -7.413 -6.937 1.00 0.00 C ATOM 2011 OG SER B 73 -18.091 -8.436 -7.834 1.00 0.00 O ATOM 0 H SER B 73 -18.538 -9.289 -5.254 1.00 0.00 H new ATOM 0 HA SER B 73 -16.689 -7.117 -5.946 1.00 0.00 H new ATOM 0 HB2 SER B 73 -19.599 -7.585 -6.681 1.00 0.00 H new ATOM 0 HB3 SER B 73 -18.501 -6.438 -7.422 1.00 0.00 H new ATOM 0 HG SER B 73 -18.389 -9.312 -7.512 1.00 0.00 H new ATOM 2017 N LYS B 74 -18.459 -6.858 -3.475 1.00 0.00 N ATOM 2018 CA LYS B 74 -18.884 -6.034 -2.370 1.00 0.00 C ATOM 2019 C LYS B 74 -17.778 -5.913 -1.330 1.00 0.00 C ATOM 2020 O LYS B 74 -17.773 -4.989 -0.506 1.00 0.00 O ATOM 2021 CB LYS B 74 -20.284 -6.526 -1.833 1.00 0.00 C ATOM 2022 CG LYS B 74 -20.621 -6.178 -0.389 1.00 0.00 C ATOM 2023 CD LYS B 74 -19.915 -7.157 0.508 1.00 0.00 C ATOM 2024 CE LYS B 74 -19.328 -6.508 1.738 1.00 0.00 C ATOM 2025 NZ LYS B 74 -20.327 -5.900 2.651 1.00 0.00 N ATOM 0 H LYS B 74 -18.406 -7.851 -3.249 1.00 0.00 H new ATOM 0 HA LYS B 74 -19.055 -5.009 -2.698 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -21.061 -6.109 -2.474 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -20.329 -7.610 -1.942 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -20.308 -5.159 -0.161 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -21.698 -6.224 -0.228 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -20.616 -7.934 0.813 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -19.119 -7.648 -0.053 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -18.758 -7.255 2.290 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -18.624 -5.737 1.425 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -19.836 -5.405 3.423 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -20.913 -5.223 2.123 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -20.933 -6.646 3.049 1.00 0.00 H new ATOM 2039 N LEU B 75 -16.831 -6.797 -1.462 1.00 0.00 N ATOM 2040 CA LEU B 75 -15.713 -6.999 -0.558 1.00 0.00 C ATOM 2041 C LEU B 75 -15.074 -5.744 0.015 1.00 0.00 C ATOM 2042 O LEU B 75 -14.412 -4.957 -0.688 1.00 0.00 O ATOM 2043 CB LEU B 75 -14.667 -7.887 -1.201 1.00 0.00 C ATOM 2044 CG LEU B 75 -14.907 -9.388 -1.117 1.00 0.00 C ATOM 2045 CD1 LEU B 75 -13.881 -10.153 -1.912 1.00 0.00 C ATOM 2046 CD2 LEU B 75 -14.894 -9.851 0.325 1.00 0.00 C ATOM 0 H LEU B 75 -16.809 -7.442 -2.252 1.00 0.00 H new ATOM 0 HA LEU B 75 -16.154 -7.489 0.310 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -14.586 -7.613 -2.253 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -13.704 -7.669 -0.740 1.00 0.00 H new ATOM 0 HG LEU B 75 -15.889 -9.588 -1.545 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -14.081 -11.221 -1.831 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -13.933 -9.852 -2.958 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -12.886 -9.939 -1.522 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -15.067 -10.926 0.363 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -13.926 -9.623 0.772 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -15.679 -9.337 0.879 1.00 0.00 H new ATOM 2058 N GLU B 76 -15.289 -5.584 1.295 1.00 0.00 N ATOM 2059 CA GLU B 76 -14.693 -4.543 2.082 1.00 0.00 C ATOM 2060 C GLU B 76 -13.297 -5.012 2.418 1.00 0.00 C ATOM 2061 O GLU B 76 -13.087 -6.213 2.525 1.00 0.00 O ATOM 2062 CB GLU B 76 -15.486 -4.390 3.376 1.00 0.00 C ATOM 2063 CG GLU B 76 -16.950 -4.054 3.169 1.00 0.00 C ATOM 2064 CD GLU B 76 -17.737 -4.111 4.452 1.00 0.00 C ATOM 2065 OE1 GLU B 76 -17.523 -3.245 5.335 1.00 0.00 O ATOM 2066 OE2 GLU B 76 -18.586 -5.014 4.595 1.00 0.00 O ATOM 0 H GLU B 76 -15.904 -6.195 1.833 1.00 0.00 H new ATOM 0 HA GLU B 76 -14.682 -3.591 1.551 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -15.414 -5.317 3.945 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -15.027 -3.608 3.981 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -17.034 -3.056 2.738 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -17.382 -4.750 2.449 1.00 0.00 H new ATOM 2073 N LYS B 77 -12.356 -4.099 2.595 1.00 0.00 N ATOM 2074 CA LYS B 77 -10.974 -4.461 2.922 1.00 0.00 C ATOM 2075 C LYS B 77 -10.894 -5.445 4.104 1.00 0.00 C ATOM 2076 O LYS B 77 -10.234 -6.470 4.029 1.00 0.00 O ATOM 2077 CB LYS B 77 -10.159 -3.196 3.187 1.00 0.00 C ATOM 2078 CG LYS B 77 -8.752 -3.468 3.645 1.00 0.00 C ATOM 2079 CD LYS B 77 -7.827 -2.228 3.648 1.00 0.00 C ATOM 2080 CE LYS B 77 -7.636 -1.550 2.274 1.00 0.00 C ATOM 2081 NZ LYS B 77 -8.747 -0.648 1.879 1.00 0.00 N ATOM 0 H LYS B 77 -12.519 -3.095 2.519 1.00 0.00 H new ATOM 0 HA LYS B 77 -10.547 -4.982 2.065 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -10.126 -2.598 2.276 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -10.668 -2.598 3.943 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -8.785 -3.883 4.652 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -8.315 -4.230 3.000 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -8.232 -1.494 4.345 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -6.850 -2.524 4.029 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -6.708 -0.979 2.289 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -7.522 -2.322 1.513 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -9.213 -1.023 1.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -9.438 -0.588 2.654 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -8.370 0.300 1.677 1.00 0.00 H new ATOM 2095 N ALA B 78 -11.624 -5.142 5.136 1.00 0.00 N ATOM 2096 CA ALA B 78 -11.711 -5.967 6.345 1.00 0.00 C ATOM 2097 C ALA B 78 -12.271 -7.366 6.057 1.00 0.00 C ATOM 2098 O ALA B 78 -11.885 -8.350 6.693 1.00 0.00 O ATOM 2099 CB ALA B 78 -12.608 -5.275 7.340 1.00 0.00 C ATOM 0 H ALA B 78 -12.196 -4.299 5.180 1.00 0.00 H new ATOM 0 HA ALA B 78 -10.702 -6.090 6.740 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.682 -5.878 8.245 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.191 -4.299 7.588 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -13.600 -5.147 6.908 1.00 0.00 H new ATOM 2105 N ASP B 79 -13.116 -7.442 5.052 1.00 0.00 N ATOM 2106 CA ASP B 79 -13.843 -8.675 4.714 1.00 0.00 C ATOM 2107 C ASP B 79 -12.896 -9.575 3.971 1.00 0.00 C ATOM 2108 O ASP B 79 -12.789 -10.774 4.241 1.00 0.00 O ATOM 2109 CB ASP B 79 -15.054 -8.308 3.836 1.00 0.00 C ATOM 2110 CG ASP B 79 -16.100 -9.413 3.648 1.00 0.00 C ATOM 2111 OD1 ASP B 79 -16.059 -10.476 4.326 1.00 0.00 O ATOM 2112 OD2 ASP B 79 -17.030 -9.206 2.829 1.00 0.00 O ATOM 0 H ASP B 79 -13.328 -6.656 4.437 1.00 0.00 H new ATOM 0 HA ASP B 79 -14.205 -9.186 5.606 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.546 -7.439 4.273 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -14.689 -8.008 2.854 1.00 0.00 H new ATOM 2117 N ILE B 80 -12.150 -8.948 3.095 1.00 0.00 N ATOM 2118 CA ILE B 80 -11.155 -9.588 2.261 1.00 0.00 C ATOM 2119 C ILE B 80 -10.030 -10.159 3.112 1.00 0.00 C ATOM 2120 O ILE B 80 -9.688 -11.343 2.997 1.00 0.00 O ATOM 2121 CB ILE B 80 -10.564 -8.551 1.285 1.00 0.00 C ATOM 2122 CG1 ILE B 80 -11.666 -7.953 0.444 1.00 0.00 C ATOM 2123 CG2 ILE B 80 -9.522 -9.190 0.397 1.00 0.00 C ATOM 2124 CD1 ILE B 80 -11.267 -6.723 -0.320 1.00 0.00 C ATOM 0 H ILE B 80 -12.219 -7.943 2.935 1.00 0.00 H new ATOM 0 HA ILE B 80 -11.632 -10.399 1.710 1.00 0.00 H new ATOM 0 HB ILE B 80 -10.085 -7.761 1.863 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -12.017 -8.706 -0.262 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -12.507 -7.706 1.092 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -9.117 -8.442 -0.285 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -8.718 -9.594 1.012 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -9.979 -9.996 -0.178 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -12.118 -6.360 -0.896 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -10.945 -5.950 0.378 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -10.447 -6.965 -0.997 1.00 0.00 H new ATOM 2136 N LEU B 81 -9.479 -9.319 3.970 1.00 0.00 N ATOM 2137 CA LEU B 81 -8.373 -9.699 4.839 1.00 0.00 C ATOM 2138 C LEU B 81 -8.706 -10.921 5.664 1.00 0.00 C ATOM 2139 O LEU B 81 -8.000 -11.928 5.594 1.00 0.00 O ATOM 2140 CB LEU B 81 -7.981 -8.537 5.755 1.00 0.00 C ATOM 2141 CG LEU B 81 -6.889 -7.562 5.268 1.00 0.00 C ATOM 2142 CD1 LEU B 81 -7.164 -7.028 3.868 1.00 0.00 C ATOM 2143 CD2 LEU B 81 -6.780 -6.412 6.248 1.00 0.00 C ATOM 0 H LEU B 81 -9.784 -8.353 4.086 1.00 0.00 H new ATOM 0 HA LEU B 81 -7.527 -9.946 4.198 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.880 -7.955 5.959 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -7.652 -8.958 6.705 1.00 0.00 H new ATOM 0 HG LEU B 81 -5.949 -8.112 5.218 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -6.365 -6.347 3.575 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -7.209 -7.859 3.164 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -8.115 -6.495 3.862 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -6.010 -5.718 5.911 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -7.736 -5.892 6.307 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.515 -6.797 7.233 1.00 0.00 H new ATOM 2155 N GLU B 82 -9.826 -10.869 6.368 1.00 0.00 N ATOM 2156 CA GLU B 82 -10.233 -11.945 7.229 1.00 0.00 C ATOM 2157 C GLU B 82 -10.524 -13.212 6.434 1.00 0.00 C ATOM 2158 O GLU B 82 -10.174 -14.285 6.860 1.00 0.00 O ATOM 2159 CB GLU B 82 -11.448 -11.526 8.050 1.00 0.00 C ATOM 2160 CG GLU B 82 -12.014 -12.589 8.927 1.00 0.00 C ATOM 2161 CD GLU B 82 -13.311 -12.183 9.567 1.00 0.00 C ATOM 2162 OE1 GLU B 82 -13.310 -11.308 10.468 1.00 0.00 O ATOM 2163 OE2 GLU B 82 -14.361 -12.743 9.207 1.00 0.00 O ATOM 0 H GLU B 82 -10.470 -10.078 6.352 1.00 0.00 H new ATOM 0 HA GLU B 82 -9.411 -12.169 7.909 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -11.172 -10.673 8.670 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -12.228 -11.185 7.369 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -12.171 -13.494 8.339 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -11.291 -12.836 9.705 1.00 0.00 H new ATOM 2170 N MET B 83 -11.073 -13.059 5.245 1.00 0.00 N ATOM 2171 CA MET B 83 -11.510 -14.186 4.423 1.00 0.00 C ATOM 2172 C MET B 83 -10.333 -15.089 4.096 1.00 0.00 C ATOM 2173 O MET B 83 -10.402 -16.320 4.214 1.00 0.00 O ATOM 2174 CB MET B 83 -12.138 -13.647 3.150 1.00 0.00 C ATOM 2175 CG MET B 83 -12.699 -14.688 2.215 1.00 0.00 C ATOM 2176 SD MET B 83 -13.479 -13.937 0.771 1.00 0.00 S ATOM 2177 CE MET B 83 -12.128 -12.924 0.144 1.00 0.00 C ATOM 0 H MET B 83 -11.232 -12.148 4.814 1.00 0.00 H new ATOM 0 HA MET B 83 -12.245 -14.777 4.970 1.00 0.00 H new ATOM 0 HB2 MET B 83 -12.938 -12.959 3.423 1.00 0.00 H new ATOM 0 HB3 MET B 83 -11.388 -13.067 2.613 1.00 0.00 H new ATOM 0 HG2 MET B 83 -11.900 -15.355 1.891 1.00 0.00 H new ATOM 0 HG3 MET B 83 -13.429 -15.299 2.746 1.00 0.00 H new ATOM 0 HE1 MET B 83 -12.360 -11.871 0.300 1.00 0.00 H new ATOM 0 HE2 MET B 83 -11.209 -13.175 0.673 1.00 0.00 H new ATOM 0 HE3 MET B 83 -11.996 -13.112 -0.922 1.00 0.00 H new ATOM 2187 N THR B 84 -9.263 -14.447 3.750 1.00 0.00 N ATOM 2188 CA THR B 84 -8.017 -15.051 3.401 1.00 0.00 C ATOM 2189 C THR B 84 -7.384 -15.731 4.632 1.00 0.00 C ATOM 2190 O THR B 84 -6.887 -16.860 4.549 1.00 0.00 O ATOM 2191 CB THR B 84 -7.134 -13.922 2.877 1.00 0.00 C ATOM 2192 OG1 THR B 84 -7.956 -13.157 1.996 1.00 0.00 O ATOM 2193 CG2 THR B 84 -5.947 -14.440 2.083 1.00 0.00 C ATOM 0 H THR B 84 -9.234 -13.429 3.701 1.00 0.00 H new ATOM 0 HA THR B 84 -8.143 -15.829 2.648 1.00 0.00 H new ATOM 0 HB THR B 84 -6.741 -13.348 3.716 1.00 0.00 H new ATOM 0 HG1 THR B 84 -8.403 -12.446 2.501 1.00 0.00 H new ATOM 0 HG21 THR B 84 -5.349 -13.599 1.732 1.00 0.00 H new ATOM 0 HG22 THR B 84 -5.335 -15.079 2.719 1.00 0.00 H new ATOM 0 HG23 THR B 84 -6.304 -15.014 1.228 1.00 0.00 H new ATOM 2201 N VAL B 85 -7.457 -15.060 5.779 1.00 0.00 N ATOM 2202 CA VAL B 85 -6.927 -15.606 7.025 1.00 0.00 C ATOM 2203 C VAL B 85 -7.710 -16.860 7.420 1.00 0.00 C ATOM 2204 O VAL B 85 -7.135 -17.896 7.737 1.00 0.00 O ATOM 2205 CB VAL B 85 -7.014 -14.585 8.187 1.00 0.00 C ATOM 2206 CG1 VAL B 85 -6.393 -15.135 9.458 1.00 0.00 C ATOM 2207 CG2 VAL B 85 -6.362 -13.292 7.815 1.00 0.00 C ATOM 0 H VAL B 85 -7.879 -14.136 5.871 1.00 0.00 H new ATOM 0 HA VAL B 85 -5.878 -15.847 6.851 1.00 0.00 H new ATOM 0 HB VAL B 85 -8.072 -14.401 8.376 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -6.472 -14.393 10.252 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -6.918 -16.042 9.756 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -5.343 -15.366 9.280 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -6.437 -12.593 8.648 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -5.312 -13.468 7.583 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -6.861 -12.871 6.942 1.00 0.00 H new ATOM 2217 N LYS B 86 -9.023 -16.764 7.358 1.00 0.00 N ATOM 2218 CA LYS B 86 -9.896 -17.865 7.718 1.00 0.00 C ATOM 2219 C LYS B 86 -9.658 -19.066 6.805 1.00 0.00 C ATOM 2220 O LYS B 86 -9.654 -20.215 7.251 1.00 0.00 O ATOM 2221 CB LYS B 86 -11.355 -17.426 7.675 1.00 0.00 C ATOM 2222 CG LYS B 86 -11.630 -16.201 8.539 1.00 0.00 C ATOM 2223 CD LYS B 86 -13.095 -15.876 8.633 1.00 0.00 C ATOM 2224 CE LYS B 86 -13.640 -15.364 7.306 1.00 0.00 C ATOM 2225 NZ LYS B 86 -14.957 -14.727 7.462 1.00 0.00 N ATOM 0 H LYS B 86 -9.515 -15.923 7.057 1.00 0.00 H new ATOM 0 HA LYS B 86 -9.663 -18.169 8.738 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.633 -17.207 6.644 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -11.987 -18.249 8.008 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -11.235 -16.371 9.540 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.097 -15.344 8.127 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -13.647 -16.766 8.935 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -13.253 -15.125 9.407 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -12.939 -14.648 6.878 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -13.719 -16.193 6.602 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -15.171 -14.161 6.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -15.685 -15.460 7.582 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -14.947 -14.109 8.298 1.00 0.00 H new ATOM 2239 N HIS B 87 -9.391 -18.794 5.539 1.00 0.00 N ATOM 2240 CA HIS B 87 -9.123 -19.853 4.587 1.00 0.00 C ATOM 2241 C HIS B 87 -7.770 -20.511 4.859 1.00 0.00 C ATOM 2242 O HIS B 87 -7.629 -21.730 4.684 1.00 0.00 O ATOM 2243 CB HIS B 87 -9.234 -19.352 3.136 1.00 0.00 C ATOM 2244 CG HIS B 87 -8.937 -20.394 2.075 1.00 0.00 C ATOM 2245 ND1 HIS B 87 -9.532 -21.644 2.001 1.00 0.00 N ATOM 2246 CD2 HIS B 87 -8.090 -20.335 1.027 1.00 0.00 C ATOM 2247 CE1 HIS B 87 -9.040 -22.275 0.935 1.00 0.00 C ATOM 2248 NE2 HIS B 87 -8.160 -21.529 0.305 1.00 0.00 N ATOM 0 H HIS B 87 -9.355 -17.852 5.150 1.00 0.00 H new ATOM 0 HA HIS B 87 -9.889 -20.617 4.719 1.00 0.00 H new ATOM 0 HB2 HIS B 87 -10.242 -18.969 2.976 1.00 0.00 H new ATOM 0 HB3 HIS B 87 -8.549 -18.514 3.003 1.00 0.00 H new ATOM 0 HD2 HIS B 87 -7.456 -19.495 0.784 1.00 0.00 H new ATOM 0 HE1 HIS B 87 -9.327 -23.270 0.629 1.00 0.00 H new ATOM 0 HE2 HIS B 87 -7.637 -21.772 -0.536 1.00 0.00 H new ATOM 2256 N LEU B 88 -6.788 -19.733 5.340 1.00 0.00 N ATOM 2257 CA LEU B 88 -5.493 -20.318 5.632 1.00 0.00 C ATOM 2258 C LEU B 88 -5.640 -21.283 6.791 1.00 0.00 C ATOM 2259 O LEU B 88 -4.984 -22.299 6.823 1.00 0.00 O ATOM 2260 CB LEU B 88 -4.350 -19.258 5.840 1.00 0.00 C ATOM 2261 CG LEU B 88 -4.291 -18.428 7.149 1.00 0.00 C ATOM 2262 CD1 LEU B 88 -3.698 -19.227 8.316 1.00 0.00 C ATOM 2263 CD2 LEU B 88 -3.508 -17.148 6.934 1.00 0.00 C ATOM 0 H LEU B 88 -6.870 -18.733 5.526 1.00 0.00 H new ATOM 0 HA LEU B 88 -5.162 -20.873 4.755 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.400 -19.783 5.746 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -4.407 -18.553 5.011 1.00 0.00 H new ATOM 0 HG LEU B 88 -5.318 -18.177 7.416 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -3.677 -18.604 9.210 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -4.311 -20.109 8.502 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -2.683 -19.537 8.066 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -3.478 -16.579 7.863 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -2.492 -17.391 6.624 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -3.991 -16.552 6.160 1.00 0.00 H new ATOM 2275 N ARG B 89 -6.558 -20.959 7.726 1.00 0.00 N ATOM 2276 CA ARG B 89 -6.887 -21.868 8.816 1.00 0.00 C ATOM 2277 C ARG B 89 -7.360 -23.182 8.263 1.00 0.00 C ATOM 2278 O ARG B 89 -6.832 -24.218 8.614 1.00 0.00 O ATOM 2279 CB ARG B 89 -7.980 -21.327 9.754 1.00 0.00 C ATOM 2280 CG ARG B 89 -7.506 -20.498 10.930 1.00 0.00 C ATOM 2281 CD ARG B 89 -6.971 -19.143 10.551 1.00 0.00 C ATOM 2282 NE ARG B 89 -6.509 -18.425 11.743 1.00 0.00 N ATOM 2283 CZ ARG B 89 -7.042 -17.292 12.232 1.00 0.00 C ATOM 2284 NH1 ARG B 89 -8.154 -16.779 11.705 1.00 0.00 N ATOM 2285 NH2 ARG B 89 -6.506 -16.731 13.300 1.00 0.00 N ATOM 0 H ARG B 89 -7.074 -20.079 7.738 1.00 0.00 H new ATOM 0 HA ARG B 89 -5.971 -21.983 9.396 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -8.668 -20.722 9.164 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -8.550 -22.173 10.139 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -8.334 -20.368 11.626 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -6.728 -21.049 11.459 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -6.149 -19.254 9.844 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -7.747 -18.566 10.049 1.00 0.00 H new ATOM 0 HE ARG B 89 -5.714 -18.820 12.245 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -8.610 -17.247 10.922 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -8.549 -15.919 12.085 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -5.694 -17.157 13.747 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -6.904 -15.871 13.678 1.00 0.00 H new ATOM 2299 N ASN B 90 -8.321 -23.113 7.348 1.00 0.00 N ATOM 2300 CA ASN B 90 -8.937 -24.300 6.751 1.00 0.00 C ATOM 2301 C ASN B 90 -7.899 -25.177 6.093 1.00 0.00 C ATOM 2302 O ASN B 90 -7.865 -26.383 6.325 1.00 0.00 O ATOM 2303 CB ASN B 90 -10.006 -23.949 5.714 1.00 0.00 C ATOM 2304 CG ASN B 90 -11.189 -23.156 6.247 1.00 0.00 C ATOM 2305 OD1 ASN B 90 -11.502 -23.199 7.441 1.00 0.00 O ATOM 2306 ND2 ASN B 90 -11.914 -22.503 5.358 1.00 0.00 N ATOM 0 H ASN B 90 -8.698 -22.233 6.997 1.00 0.00 H new ATOM 0 HA ASN B 90 -9.414 -24.834 7.573 1.00 0.00 H new ATOM 0 HB2 ASN B 90 -9.538 -23.378 4.912 1.00 0.00 H new ATOM 0 HB3 ASN B 90 -10.378 -24.873 5.272 1.00 0.00 H new ATOM 0 HD21 ASN B 90 -12.760 -22.014 5.650 1.00 0.00 H new ATOM 0 HD22 ASN B 90 -11.628 -22.487 4.379 1.00 0.00 H new ATOM 2313 N LEU B 91 -7.038 -24.563 5.304 1.00 0.00 N ATOM 2314 CA LEU B 91 -5.968 -25.274 4.603 1.00 0.00 C ATOM 2315 C LEU B 91 -4.899 -25.762 5.546 1.00 0.00 C ATOM 2316 O LEU B 91 -4.173 -26.658 5.217 1.00 0.00 O ATOM 2317 CB LEU B 91 -5.340 -24.394 3.544 1.00 0.00 C ATOM 2318 CG LEU B 91 -6.171 -24.040 2.328 1.00 0.00 C ATOM 2319 CD1 LEU B 91 -5.447 -22.978 1.537 1.00 0.00 C ATOM 2320 CD2 LEU B 91 -6.387 -25.267 1.453 1.00 0.00 C ATOM 0 H LEU B 91 -7.054 -23.559 5.126 1.00 0.00 H new ATOM 0 HA LEU B 91 -6.427 -26.142 4.130 1.00 0.00 H new ATOM 0 HB2 LEU B 91 -5.034 -23.463 4.022 1.00 0.00 H new ATOM 0 HB3 LEU B 91 -4.432 -24.887 3.196 1.00 0.00 H new ATOM 0 HG LEU B 91 -7.144 -23.671 2.653 1.00 0.00 H new ATOM 0 HD11 LEU B 91 -6.035 -22.714 0.658 1.00 0.00 H new ATOM 0 HD12 LEU B 91 -5.307 -22.094 2.159 1.00 0.00 H new ATOM 0 HD13 LEU B 91 -4.475 -23.358 1.222 1.00 0.00 H new ATOM 0 HD21 LEU B 91 -6.986 -24.994 0.584 1.00 0.00 H new ATOM 0 HD22 LEU B 91 -5.423 -25.652 1.122 1.00 0.00 H new ATOM 0 HD23 LEU B 91 -6.907 -26.035 2.025 1.00 0.00 H new ATOM 2332 N GLN B 92 -4.788 -25.157 6.695 1.00 0.00 N ATOM 2333 CA GLN B 92 -3.835 -25.593 7.696 1.00 0.00 C ATOM 2334 C GLN B 92 -4.349 -26.796 8.481 1.00 0.00 C ATOM 2335 O GLN B 92 -3.597 -27.728 8.776 1.00 0.00 O ATOM 2336 CB GLN B 92 -3.478 -24.444 8.643 1.00 0.00 C ATOM 2337 CG GLN B 92 -2.454 -23.480 8.101 1.00 0.00 C ATOM 2338 CD GLN B 92 -1.098 -24.117 8.018 1.00 0.00 C ATOM 2339 OE1 GLN B 92 -0.769 -25.017 8.787 1.00 0.00 O ATOM 2340 NE2 GLN B 92 -0.296 -23.655 7.139 1.00 0.00 N ATOM 0 H GLN B 92 -5.349 -24.351 6.970 1.00 0.00 H new ATOM 0 HA GLN B 92 -2.932 -25.905 7.171 1.00 0.00 H new ATOM 0 HB2 GLN B 92 -4.387 -23.892 8.882 1.00 0.00 H new ATOM 0 HB3 GLN B 92 -3.105 -24.863 9.577 1.00 0.00 H new ATOM 0 HG2 GLN B 92 -2.760 -23.139 7.112 1.00 0.00 H new ATOM 0 HG3 GLN B 92 -2.406 -22.599 8.741 1.00 0.00 H new ATOM 0 HE21 GLN B 92 -0.599 -22.907 6.515 1.00 0.00 H new ATOM 0 HE22 GLN B 92 0.648 -24.034 7.061 1.00 0.00 H new ATOM 2349 N ARG B 93 -5.623 -26.804 8.773 1.00 0.00 N ATOM 2350 CA ARG B 93 -6.213 -27.855 9.615 1.00 0.00 C ATOM 2351 C ARG B 93 -6.972 -28.899 8.818 1.00 0.00 C ATOM 2352 O ARG B 93 -7.698 -29.706 9.381 1.00 0.00 O ATOM 2353 CB ARG B 93 -7.087 -27.230 10.734 1.00 0.00 C ATOM 2354 CG ARG B 93 -8.167 -26.271 10.247 1.00 0.00 C ATOM 2355 CD ARG B 93 -9.389 -26.962 9.663 1.00 0.00 C ATOM 2356 NE ARG B 93 -10.129 -27.720 10.670 1.00 0.00 N ATOM 2357 CZ ARG B 93 -10.941 -28.744 10.415 1.00 0.00 C ATOM 2358 NH1 ARG B 93 -11.094 -29.189 9.174 1.00 0.00 N ATOM 2359 NH2 ARG B 93 -11.614 -29.311 11.401 1.00 0.00 N ATOM 0 H ARG B 93 -6.287 -26.101 8.448 1.00 0.00 H new ATOM 0 HA ARG B 93 -5.388 -28.390 10.084 1.00 0.00 H new ATOM 0 HB2 ARG B 93 -7.563 -28.035 11.295 1.00 0.00 H new ATOM 0 HB3 ARG B 93 -6.436 -26.698 11.428 1.00 0.00 H new ATOM 0 HG2 ARG B 93 -8.481 -25.641 11.079 1.00 0.00 H new ATOM 0 HG3 ARG B 93 -7.739 -25.612 9.492 1.00 0.00 H new ATOM 0 HD2 ARG B 93 -10.047 -26.217 9.216 1.00 0.00 H new ATOM 0 HD3 ARG B 93 -9.077 -27.633 8.863 1.00 0.00 H new ATOM 0 HE ARG B 93 -10.014 -27.443 11.645 1.00 0.00 H new ATOM 0 HH11 ARG B 93 -10.588 -28.746 8.407 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -11.718 -29.974 8.987 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -11.511 -28.964 12.355 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -12.237 -30.096 11.208 1.00 0.00 H new ATOM 2373 N ALA B 94 -6.788 -28.905 7.517 1.00 0.00 N ATOM 2374 CA ALA B 94 -7.482 -29.866 6.673 1.00 0.00 C ATOM 2375 C ALA B 94 -6.816 -31.220 6.784 1.00 0.00 C ATOM 2376 O ALA B 94 -7.432 -32.259 6.573 1.00 0.00 O ATOM 2377 CB ALA B 94 -7.497 -29.404 5.228 1.00 0.00 C ATOM 0 H ALA B 94 -6.171 -28.264 7.019 1.00 0.00 H new ATOM 0 HA ALA B 94 -8.514 -29.946 7.013 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -8.021 -30.139 4.617 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -8.007 -28.443 5.158 1.00 0.00 H new ATOM 0 HB3 ALA B 94 -6.473 -29.298 4.869 1.00 0.00 H new ATOM 2383 N GLN B 95 -5.581 -31.182 7.180 1.00 0.00 N ATOM 2384 CA GLN B 95 -4.761 -32.330 7.296 1.00 0.00 C ATOM 2385 C GLN B 95 -3.936 -32.233 8.561 1.00 0.00 C ATOM 2386 O GLN B 95 -4.217 -32.966 9.512 1.00 0.00 O ATOM 2387 CB GLN B 95 -3.876 -32.541 6.042 1.00 0.00 C ATOM 2388 CG GLN B 95 -2.940 -31.386 5.645 1.00 0.00 C ATOM 2389 CD GLN B 95 -3.624 -30.173 5.039 1.00 0.00 C ATOM 2390 OE1 GLN B 95 -3.842 -30.118 3.830 1.00 0.00 O ATOM 2391 NE2 GLN B 95 -3.922 -29.167 5.839 1.00 0.00 N ATOM 0 H GLN B 95 -5.108 -30.316 7.438 1.00 0.00 H new ATOM 0 HA GLN B 95 -5.401 -33.210 7.362 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -3.267 -33.430 6.203 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -4.531 -32.752 5.197 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -2.389 -31.067 6.530 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -2.207 -31.763 4.932 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -3.732 -29.237 6.839 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -4.343 -28.320 5.458 1.00 0.00 H new