USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=24 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 67 LYS NZ :NH3+ 175:sc= 0.816 (180deg=-0.24) USER MOD Set 1.2: A 87 HIS : no HE2:sc= 0.434 K(o=0.95,f=-12!) USER MOD Set 1.3: A 90 ASN : amide:sc= -0.301 K(o=0.95,f=-1.5!) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= 0.904 K(o=0.9,f=-0.079) USER MOD Single : A 53 SER OG : rot 69:sc= 1.24 USER MOD Single : A 55 SER OG : rot -86:sc= 1.23 USER MOD Single : A 56 GLN : amide:sc= 0.307 K(o=0.31,f=-1.7!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 93:sc= 1.26 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 82:sc= 1.12 USER MOD Single : A 72 HIS : no HD1:sc= -1.82! C(o=-1.8!,f=-3.1!) USER MOD Single : A 73 SER OG : rot 18:sc= 0.581 USER MOD Single : A 74 LYS NZ :NH3+ -172:sc= 2.23 (180deg=1.89) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl 144:sc= -1.15 (180deg=-2.86) USER MOD Single : A 84 THR OG1 : rot 75:sc= -0.367! USER MOD Single : A 86 LYS NZ :NH3+ -176:sc= 0.649 (180deg=0.64) USER MOD Single : A 92 GLN : amide:sc= -4.38! C(o=-4.4!,f=-6.5!) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 ASN : amide:sc= 0.515 K(o=0.52,f=-0.061) USER MOD Single : B 53 SER OG : rot -75:sc= 0.964 USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 56 GLN : amide:sc= -2.02! K(o=-2!,f=-0.85) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 96:sc= 1.24 USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ -163:sc= -0.0301 (180deg=-0.283) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 SER OG : rot 180:sc= 0 USER MOD Single : B 72 HIS : no HE2:sc= -1.3 K(o=-1.3,f=-3.7!) USER MOD Single : B 73 SER OG : rot 71:sc= 1.14 USER MOD Single : B 74 LYS NZ :NH3+ -167:sc= 1.3 (180deg=0.816) USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 MET CE :methyl 137:sc= -0.136 (180deg=-0.662) USER MOD Single : B 84 THR OG1 : rot 78:sc= -0.67 USER MOD Single : B 86 LYS NZ :NH3+ -174:sc= 1.27 (180deg=1.16) USER MOD Single : B 87 HIS : no HD1:sc= -3.85 K(o=-3.9,f=-5.2!) USER MOD Single : B 90 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : B 92 GLN : amide:sc= -3.59! C(o=-3.6!,f=-6.3!) USER MOD Single : B 95 GLN : amide:sc= 0.214 K(o=0.21,f=-0.4) USER MOD ----------------------------------------------------------------- ATOM 268 N MET A 42 -18.859 4.509 10.424 1.00 0.00 N ATOM 269 CA MET A 42 -18.847 3.330 9.557 1.00 0.00 C ATOM 270 C MET A 42 -17.485 3.067 8.974 1.00 0.00 C ATOM 271 O MET A 42 -17.015 1.920 8.939 1.00 0.00 O ATOM 272 CB MET A 42 -19.865 3.467 8.448 1.00 0.00 C ATOM 273 CG MET A 42 -21.259 3.516 8.977 1.00 0.00 C ATOM 274 SD MET A 42 -21.704 2.002 9.836 1.00 0.00 S ATOM 275 CE MET A 42 -23.282 2.480 10.501 1.00 0.00 C ATOM 0 HA MET A 42 -19.111 2.477 10.182 1.00 0.00 H new ATOM 0 HB2 MET A 42 -19.661 4.373 7.877 1.00 0.00 H new ATOM 0 HB3 MET A 42 -19.767 2.628 7.759 1.00 0.00 H new ATOM 0 HG2 MET A 42 -21.360 4.362 9.657 1.00 0.00 H new ATOM 0 HG3 MET A 42 -21.954 3.684 8.154 1.00 0.00 H new ATOM 0 HE1 MET A 42 -23.704 1.651 11.069 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.155 3.341 11.157 1.00 0.00 H new ATOM 0 HE3 MET A 42 -23.956 2.742 9.686 1.00 0.00 H new ATOM 285 N GLU A 43 -16.820 4.117 8.564 1.00 0.00 N ATOM 286 CA GLU A 43 -15.533 3.966 7.945 1.00 0.00 C ATOM 287 C GLU A 43 -14.454 3.728 8.991 1.00 0.00 C ATOM 288 O GLU A 43 -13.453 3.082 8.718 1.00 0.00 O ATOM 289 CB GLU A 43 -15.210 5.147 7.019 1.00 0.00 C ATOM 290 CG GLU A 43 -15.180 6.504 7.693 1.00 0.00 C ATOM 291 CD GLU A 43 -15.021 7.623 6.697 1.00 0.00 C ATOM 292 OE1 GLU A 43 -13.877 7.927 6.308 1.00 0.00 O ATOM 293 OE2 GLU A 43 -16.031 8.215 6.274 1.00 0.00 O ATOM 0 H GLU A 43 -17.148 5.079 8.648 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.562 3.081 7.310 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.241 4.969 6.553 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -15.949 5.173 6.218 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -16.101 6.649 8.258 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.359 6.536 8.409 1.00 0.00 H new ATOM 300 N LYS A 44 -14.691 4.201 10.211 1.00 0.00 N ATOM 301 CA LYS A 44 -13.738 3.998 11.283 1.00 0.00 C ATOM 302 C LYS A 44 -13.822 2.560 11.775 1.00 0.00 C ATOM 303 O LYS A 44 -12.818 1.953 12.138 1.00 0.00 O ATOM 304 CB LYS A 44 -13.918 5.065 12.378 1.00 0.00 C ATOM 305 CG LYS A 44 -15.032 4.870 13.342 1.00 0.00 C ATOM 306 CD LYS A 44 -14.654 3.996 14.509 1.00 0.00 C ATOM 307 CE LYS A 44 -15.878 3.716 15.285 1.00 0.00 C ATOM 308 NZ LYS A 44 -15.630 2.903 16.485 1.00 0.00 N ATOM 0 H LYS A 44 -15.528 4.722 10.475 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.719 4.135 10.921 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -12.989 5.127 12.944 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -14.059 6.029 11.890 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -15.358 5.842 13.713 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -15.881 4.426 12.823 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.204 3.067 14.159 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -13.912 4.494 15.134 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.336 4.660 15.582 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.595 3.200 14.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.527 2.741 16.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.219 1.989 16.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.968 3.403 17.112 1.00 0.00 H new ATOM 322 N ARG A 45 -15.037 2.030 11.751 1.00 0.00 N ATOM 323 CA ARG A 45 -15.298 0.615 12.057 1.00 0.00 C ATOM 324 C ARG A 45 -14.541 -0.268 11.090 1.00 0.00 C ATOM 325 O ARG A 45 -13.811 -1.179 11.500 1.00 0.00 O ATOM 326 CB ARG A 45 -16.787 0.303 11.952 1.00 0.00 C ATOM 327 CG ARG A 45 -17.637 0.802 13.100 1.00 0.00 C ATOM 328 CD ARG A 45 -19.103 0.699 12.742 1.00 0.00 C ATOM 329 NE ARG A 45 -19.988 0.905 13.887 1.00 0.00 N ATOM 330 CZ ARG A 45 -21.315 0.690 13.874 1.00 0.00 C ATOM 331 NH1 ARG A 45 -21.928 0.354 12.739 1.00 0.00 N ATOM 332 NH2 ARG A 45 -22.025 0.835 14.989 1.00 0.00 N ATOM 0 H ARG A 45 -15.876 2.563 11.520 1.00 0.00 H new ATOM 0 HA ARG A 45 -14.966 0.422 13.077 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -17.167 0.735 11.026 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -16.910 -0.777 11.874 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -17.431 0.217 13.996 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -17.382 1.837 13.329 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -19.336 1.436 11.973 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -19.298 -0.283 12.312 1.00 0.00 H new ATOM 0 HE ARG A 45 -19.569 1.235 14.757 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -21.390 0.259 11.878 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -22.935 0.191 12.732 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -21.563 1.110 15.856 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -23.032 0.672 14.977 1.00 0.00 H new ATOM 346 N ARG A 46 -14.702 0.032 9.803 1.00 0.00 N ATOM 347 CA ARG A 46 -14.025 -0.689 8.746 1.00 0.00 C ATOM 348 C ARG A 46 -12.524 -0.584 8.937 1.00 0.00 C ATOM 349 O ARG A 46 -11.827 -1.585 8.906 1.00 0.00 O ATOM 350 CB ARG A 46 -14.405 -0.116 7.388 1.00 0.00 C ATOM 351 CG ARG A 46 -13.799 -0.861 6.206 1.00 0.00 C ATOM 352 CD ARG A 46 -14.129 -0.161 4.907 1.00 0.00 C ATOM 353 NE ARG A 46 -15.572 -0.103 4.678 1.00 0.00 N ATOM 354 CZ ARG A 46 -16.256 0.965 4.271 1.00 0.00 C ATOM 355 NH1 ARG A 46 -15.618 2.076 3.899 1.00 0.00 N ATOM 356 NH2 ARG A 46 -17.584 0.910 4.220 1.00 0.00 N ATOM 0 H ARG A 46 -15.307 0.783 9.471 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.327 -1.736 8.786 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -15.491 -0.127 7.292 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.092 0.927 7.345 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.717 -0.925 6.326 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -14.178 -1.883 6.181 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -13.722 0.850 4.924 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -13.649 -0.684 4.079 1.00 0.00 H new ATOM 0 HE ARG A 46 -16.103 -0.958 4.845 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -14.599 2.112 3.925 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -16.149 2.890 3.589 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -18.070 0.055 4.491 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -18.117 1.723 3.910 1.00 0.00 H new ATOM 370 N ARG A 47 -12.055 0.641 9.167 1.00 0.00 N ATOM 371 CA ARG A 47 -10.639 0.942 9.362 1.00 0.00 C ATOM 372 C ARG A 47 -10.043 0.072 10.462 1.00 0.00 C ATOM 373 O ARG A 47 -9.010 -0.572 10.266 1.00 0.00 O ATOM 374 CB ARG A 47 -10.468 2.413 9.723 1.00 0.00 C ATOM 375 CG ARG A 47 -9.033 2.882 9.766 1.00 0.00 C ATOM 376 CD ARG A 47 -8.951 4.313 10.237 1.00 0.00 C ATOM 377 NE ARG A 47 -7.588 4.847 10.166 1.00 0.00 N ATOM 378 CZ ARG A 47 -7.175 5.972 10.766 1.00 0.00 C ATOM 379 NH1 ARG A 47 -8.024 6.699 11.489 1.00 0.00 N ATOM 380 NH2 ARG A 47 -5.915 6.368 10.629 1.00 0.00 N ATOM 0 H ARG A 47 -12.656 1.463 9.224 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.113 0.730 8.431 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.014 3.018 8.999 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -10.925 2.591 10.696 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.456 2.241 10.433 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.587 2.794 8.775 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.613 4.931 9.630 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -9.310 4.376 11.264 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.903 4.324 9.620 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.994 6.401 11.589 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -7.704 7.554 11.943 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -5.265 5.817 10.069 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -5.597 7.224 11.084 1.00 0.00 H new ATOM 394 N ALA A 48 -10.715 0.033 11.600 1.00 0.00 N ATOM 395 CA ALA A 48 -10.281 -0.748 12.729 1.00 0.00 C ATOM 396 C ALA A 48 -10.196 -2.208 12.350 1.00 0.00 C ATOM 397 O ALA A 48 -9.171 -2.844 12.568 1.00 0.00 O ATOM 398 CB ALA A 48 -11.221 -0.552 13.911 1.00 0.00 C ATOM 0 H ALA A 48 -11.581 0.548 11.760 1.00 0.00 H new ATOM 0 HA ALA A 48 -9.289 -0.408 13.027 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.876 -1.151 14.754 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.234 0.500 14.195 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -12.227 -0.865 13.632 1.00 0.00 H new ATOM 404 N ARG A 49 -11.242 -2.705 11.697 1.00 0.00 N ATOM 405 CA ARG A 49 -11.321 -4.105 11.303 1.00 0.00 C ATOM 406 C ARG A 49 -10.203 -4.458 10.301 1.00 0.00 C ATOM 407 O ARG A 49 -9.675 -5.577 10.312 1.00 0.00 O ATOM 408 CB ARG A 49 -12.707 -4.433 10.715 1.00 0.00 C ATOM 409 CG ARG A 49 -12.968 -5.925 10.556 1.00 0.00 C ATOM 410 CD ARG A 49 -12.984 -6.601 11.913 1.00 0.00 C ATOM 411 NE ARG A 49 -13.060 -8.049 11.830 1.00 0.00 N ATOM 412 CZ ARG A 49 -12.516 -8.871 12.731 1.00 0.00 C ATOM 413 NH1 ARG A 49 -11.880 -8.377 13.803 1.00 0.00 N ATOM 414 NH2 ARG A 49 -12.587 -10.186 12.552 1.00 0.00 N ATOM 0 H ARG A 49 -12.055 -2.150 11.428 1.00 0.00 H new ATOM 0 HA ARG A 49 -11.180 -4.714 12.196 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.475 -4.006 11.359 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -12.802 -3.951 9.742 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -13.921 -6.083 10.052 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -12.197 -6.372 9.928 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -12.084 -6.322 12.461 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -13.834 -6.231 12.486 1.00 0.00 H new ATOM 0 HE ARG A 49 -13.556 -8.461 11.040 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -11.810 -7.368 13.934 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -11.467 -9.010 14.487 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -13.056 -10.564 11.729 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -12.173 -10.817 13.238 1.00 0.00 H new ATOM 428 N ILE A 50 -9.856 -3.497 9.448 1.00 0.00 N ATOM 429 CA ILE A 50 -8.757 -3.645 8.498 1.00 0.00 C ATOM 430 C ILE A 50 -7.454 -3.895 9.254 1.00 0.00 C ATOM 431 O ILE A 50 -6.779 -4.899 9.024 1.00 0.00 O ATOM 432 CB ILE A 50 -8.618 -2.374 7.603 1.00 0.00 C ATOM 433 CG1 ILE A 50 -9.848 -2.229 6.709 1.00 0.00 C ATOM 434 CG2 ILE A 50 -7.343 -2.427 6.748 1.00 0.00 C ATOM 435 CD1 ILE A 50 -9.957 -0.892 6.025 1.00 0.00 C ATOM 0 H ILE A 50 -10.329 -2.595 9.396 1.00 0.00 H new ATOM 0 HA ILE A 50 -8.972 -4.495 7.851 1.00 0.00 H new ATOM 0 HB ILE A 50 -8.544 -1.506 8.258 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -9.827 -3.012 5.951 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -10.742 -2.391 7.311 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -7.277 -1.527 6.137 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.471 -2.488 7.399 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.375 -3.303 6.101 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -10.856 -0.870 5.410 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.011 -0.103 6.775 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -9.082 -0.734 5.394 1.00 0.00 H new ATOM 447 N ASN A 51 -7.150 -3.009 10.196 1.00 0.00 N ATOM 448 CA ASN A 51 -5.927 -3.117 11.000 1.00 0.00 C ATOM 449 C ASN A 51 -5.901 -4.420 11.759 1.00 0.00 C ATOM 450 O ASN A 51 -4.873 -5.099 11.811 1.00 0.00 O ATOM 451 CB ASN A 51 -5.774 -1.953 11.992 1.00 0.00 C ATOM 452 CG ASN A 51 -5.467 -0.624 11.339 1.00 0.00 C ATOM 453 OD1 ASN A 51 -4.302 -0.273 11.135 1.00 0.00 O ATOM 454 ND2 ASN A 51 -6.492 0.120 11.008 1.00 0.00 N ATOM 0 H ASN A 51 -7.732 -2.204 10.426 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.092 -3.078 10.300 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -6.693 -1.858 12.570 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -4.978 -2.192 12.697 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -6.342 1.026 10.564 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -7.440 -0.206 11.194 1.00 0.00 H new ATOM 461 N GLU A 52 -7.041 -4.778 12.331 1.00 0.00 N ATOM 462 CA GLU A 52 -7.173 -6.029 13.091 1.00 0.00 C ATOM 463 C GLU A 52 -6.861 -7.252 12.224 1.00 0.00 C ATOM 464 O GLU A 52 -6.155 -8.172 12.657 1.00 0.00 O ATOM 465 CB GLU A 52 -8.576 -6.197 13.680 1.00 0.00 C ATOM 466 CG GLU A 52 -9.038 -5.073 14.582 1.00 0.00 C ATOM 467 CD GLU A 52 -10.362 -5.379 15.223 1.00 0.00 C ATOM 468 OE1 GLU A 52 -11.294 -5.814 14.524 1.00 0.00 O ATOM 469 OE2 GLU A 52 -10.494 -5.205 16.459 1.00 0.00 O ATOM 0 H GLU A 52 -7.896 -4.223 12.287 1.00 0.00 H new ATOM 0 HA GLU A 52 -6.449 -5.962 13.903 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.287 -6.298 12.860 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.606 -7.129 14.244 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.291 -4.898 15.356 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.118 -4.153 14.004 1.00 0.00 H new ATOM 476 N SER A 53 -7.354 -7.250 11.002 1.00 0.00 N ATOM 477 CA SER A 53 -7.189 -8.382 10.139 1.00 0.00 C ATOM 478 C SER A 53 -5.774 -8.444 9.561 1.00 0.00 C ATOM 479 O SER A 53 -5.187 -9.508 9.474 1.00 0.00 O ATOM 480 CB SER A 53 -8.242 -8.337 9.043 1.00 0.00 C ATOM 481 OG SER A 53 -9.545 -8.221 9.616 1.00 0.00 O ATOM 0 H SER A 53 -7.871 -6.472 10.592 1.00 0.00 H new ATOM 0 HA SER A 53 -7.326 -9.294 10.720 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.052 -7.493 8.380 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.183 -9.240 8.435 1.00 0.00 H new ATOM 0 HG SER A 53 -9.647 -7.334 10.019 1.00 0.00 H new ATOM 487 N LEU A 54 -5.211 -7.285 9.253 1.00 0.00 N ATOM 488 CA LEU A 54 -3.911 -7.188 8.619 1.00 0.00 C ATOM 489 C LEU A 54 -2.833 -7.632 9.608 1.00 0.00 C ATOM 490 O LEU A 54 -1.891 -8.358 9.261 1.00 0.00 O ATOM 491 CB LEU A 54 -3.693 -5.722 8.201 1.00 0.00 C ATOM 492 CG LEU A 54 -2.800 -5.447 6.986 1.00 0.00 C ATOM 493 CD1 LEU A 54 -2.868 -3.978 6.629 1.00 0.00 C ATOM 494 CD2 LEU A 54 -1.354 -5.856 7.217 1.00 0.00 C ATOM 0 H LEU A 54 -5.648 -6.382 9.438 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.857 -7.831 7.740 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.670 -5.282 8.004 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.270 -5.191 9.054 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.176 -6.054 6.162 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.233 -3.784 5.765 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.897 -3.709 6.391 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.523 -3.382 7.474 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.767 -5.639 6.324 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.949 -5.299 8.062 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.308 -6.924 7.431 1.00 0.00 H new ATOM 506 N SER A 55 -3.001 -7.227 10.837 1.00 0.00 N ATOM 507 CA SER A 55 -2.052 -7.520 11.863 1.00 0.00 C ATOM 508 C SER A 55 -2.041 -9.014 12.219 1.00 0.00 C ATOM 509 O SER A 55 -0.970 -9.634 12.325 1.00 0.00 O ATOM 510 CB SER A 55 -2.325 -6.633 13.062 1.00 0.00 C ATOM 511 OG SER A 55 -3.660 -6.784 13.516 1.00 0.00 O ATOM 0 H SER A 55 -3.805 -6.683 11.151 1.00 0.00 H new ATOM 0 HA SER A 55 -1.048 -7.301 11.499 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.634 -6.882 13.867 1.00 0.00 H new ATOM 0 HB3 SER A 55 -2.144 -5.592 12.796 1.00 0.00 H new ATOM 0 HG SER A 55 -4.247 -6.181 13.014 1.00 0.00 H new ATOM 517 N GLN A 56 -3.213 -9.612 12.354 1.00 0.00 N ATOM 518 CA GLN A 56 -3.270 -11.030 12.663 1.00 0.00 C ATOM 519 C GLN A 56 -2.836 -11.856 11.455 1.00 0.00 C ATOM 520 O GLN A 56 -2.290 -12.926 11.608 1.00 0.00 O ATOM 521 CB GLN A 56 -4.653 -11.455 13.161 1.00 0.00 C ATOM 522 CG GLN A 56 -5.758 -11.327 12.145 1.00 0.00 C ATOM 523 CD GLN A 56 -7.095 -11.677 12.722 1.00 0.00 C ATOM 524 OE1 GLN A 56 -7.528 -12.835 12.688 1.00 0.00 O ATOM 525 NE2 GLN A 56 -7.759 -10.693 13.260 1.00 0.00 N ATOM 0 H GLN A 56 -4.118 -9.151 12.257 1.00 0.00 H new ATOM 0 HA GLN A 56 -2.572 -11.219 13.479 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.601 -12.492 13.492 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -4.910 -10.854 14.034 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -5.784 -10.306 11.764 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -5.548 -11.978 11.297 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.363 -9.753 13.266 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -8.675 -10.863 13.676 1.00 0.00 H new ATOM 534 N LEU A 57 -3.041 -11.312 10.268 1.00 0.00 N ATOM 535 CA LEU A 57 -2.665 -11.957 9.018 1.00 0.00 C ATOM 536 C LEU A 57 -1.168 -12.249 9.005 1.00 0.00 C ATOM 537 O LEU A 57 -0.753 -13.411 8.892 1.00 0.00 O ATOM 538 CB LEU A 57 -3.102 -11.056 7.835 1.00 0.00 C ATOM 539 CG LEU A 57 -2.900 -11.566 6.405 1.00 0.00 C ATOM 540 CD1 LEU A 57 -3.866 -10.851 5.473 1.00 0.00 C ATOM 541 CD2 LEU A 57 -1.479 -11.302 5.936 1.00 0.00 C ATOM 0 H LEU A 57 -3.478 -10.399 10.142 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.173 -12.916 8.918 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.162 -10.838 7.961 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.569 -10.110 7.926 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.085 -12.640 6.392 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.724 -11.213 4.455 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.890 -11.049 5.789 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.677 -9.778 5.507 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.357 -11.672 4.918 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.282 -10.230 5.959 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.777 -11.814 6.595 1.00 0.00 H new ATOM 553 N LYS A 58 -0.368 -11.204 9.177 1.00 0.00 N ATOM 554 CA LYS A 58 1.084 -11.350 9.198 1.00 0.00 C ATOM 555 C LYS A 58 1.526 -12.251 10.359 1.00 0.00 C ATOM 556 O LYS A 58 2.494 -13.003 10.239 1.00 0.00 O ATOM 557 CB LYS A 58 1.795 -9.977 9.271 1.00 0.00 C ATOM 558 CG LYS A 58 1.443 -9.152 10.495 1.00 0.00 C ATOM 559 CD LYS A 58 2.232 -7.861 10.576 1.00 0.00 C ATOM 560 CE LYS A 58 1.903 -7.124 11.862 1.00 0.00 C ATOM 561 NZ LYS A 58 2.683 -5.886 12.021 1.00 0.00 N ATOM 0 H LYS A 58 -0.698 -10.247 9.304 1.00 0.00 H new ATOM 0 HA LYS A 58 1.378 -11.824 8.262 1.00 0.00 H new ATOM 0 HB2 LYS A 58 2.873 -10.139 9.255 1.00 0.00 H new ATOM 0 HB3 LYS A 58 1.545 -9.404 8.378 1.00 0.00 H new ATOM 0 HG2 LYS A 58 0.378 -8.922 10.479 1.00 0.00 H new ATOM 0 HG3 LYS A 58 1.628 -9.743 11.392 1.00 0.00 H new ATOM 0 HD2 LYS A 58 3.300 -8.076 10.535 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.000 -7.230 9.718 1.00 0.00 H new ATOM 0 HE2 LYS A 58 0.840 -6.884 11.877 1.00 0.00 H new ATOM 0 HE3 LYS A 58 2.093 -7.780 12.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 2.420 -5.422 12.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 3.698 -6.114 12.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.483 -5.245 11.226 1.00 0.00 H new ATOM 575 N THR A 59 0.793 -12.189 11.462 1.00 0.00 N ATOM 576 CA THR A 59 1.113 -12.973 12.634 1.00 0.00 C ATOM 577 C THR A 59 0.859 -14.486 12.392 1.00 0.00 C ATOM 578 O THR A 59 1.730 -15.315 12.658 1.00 0.00 O ATOM 579 CB THR A 59 0.307 -12.467 13.856 1.00 0.00 C ATOM 580 OG1 THR A 59 0.517 -11.045 13.999 1.00 0.00 O ATOM 581 CG2 THR A 59 0.762 -13.153 15.135 1.00 0.00 C ATOM 0 H THR A 59 -0.032 -11.598 11.564 1.00 0.00 H new ATOM 0 HA THR A 59 2.176 -12.849 12.842 1.00 0.00 H new ATOM 0 HB THR A 59 -0.747 -12.693 13.691 1.00 0.00 H new ATOM 0 HG1 THR A 59 -0.187 -10.560 13.519 1.00 0.00 H new ATOM 0 HG21 THR A 59 0.179 -12.778 15.976 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.615 -14.229 15.043 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.818 -12.944 15.304 1.00 0.00 H new ATOM 589 N LEU A 60 -0.304 -14.826 11.846 1.00 0.00 N ATOM 590 CA LEU A 60 -0.670 -16.222 11.604 1.00 0.00 C ATOM 591 C LEU A 60 0.121 -16.858 10.478 1.00 0.00 C ATOM 592 O LEU A 60 0.490 -18.020 10.576 1.00 0.00 O ATOM 593 CB LEU A 60 -2.191 -16.429 11.418 1.00 0.00 C ATOM 594 CG LEU A 60 -3.056 -16.547 12.700 1.00 0.00 C ATOM 595 CD1 LEU A 60 -2.628 -17.743 13.540 1.00 0.00 C ATOM 596 CD2 LEU A 60 -3.026 -15.278 13.540 1.00 0.00 C ATOM 0 H LEU A 60 -1.014 -14.152 11.561 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.393 -16.747 12.518 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.575 -15.597 10.828 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.338 -17.333 10.827 1.00 0.00 H new ATOM 0 HG LEU A 60 -4.084 -16.696 12.369 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.251 -17.802 14.433 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.742 -18.657 12.957 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.584 -17.627 13.833 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.647 -15.413 14.425 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.001 -15.067 13.845 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.409 -14.444 12.952 1.00 0.00 H new ATOM 608 N ILE A 61 0.412 -16.106 9.422 1.00 0.00 N ATOM 609 CA ILE A 61 1.244 -16.642 8.343 1.00 0.00 C ATOM 610 C ILE A 61 2.629 -16.976 8.895 1.00 0.00 C ATOM 611 O ILE A 61 3.203 -18.044 8.625 1.00 0.00 O ATOM 612 CB ILE A 61 1.396 -15.649 7.159 1.00 0.00 C ATOM 613 CG1 ILE A 61 0.052 -15.401 6.465 1.00 0.00 C ATOM 614 CG2 ILE A 61 2.428 -16.151 6.148 1.00 0.00 C ATOM 615 CD1 ILE A 61 -0.542 -16.626 5.785 1.00 0.00 C ATOM 0 H ILE A 61 0.095 -15.146 9.288 1.00 0.00 H new ATOM 0 HA ILE A 61 0.749 -17.535 7.962 1.00 0.00 H new ATOM 0 HB ILE A 61 1.748 -14.703 7.571 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.660 -15.029 7.202 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.181 -14.615 5.721 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.514 -15.436 5.330 1.00 0.00 H new ATOM 0 HG22 ILE A 61 3.395 -16.259 6.639 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.111 -17.117 5.754 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.491 -16.360 5.320 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.147 -16.988 5.022 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.707 -17.409 6.525 1.00 0.00 H new ATOM 627 N LEU A 62 3.135 -16.091 9.726 1.00 0.00 N ATOM 628 CA LEU A 62 4.426 -16.279 10.309 1.00 0.00 C ATOM 629 C LEU A 62 4.401 -17.355 11.379 1.00 0.00 C ATOM 630 O LEU A 62 5.417 -17.870 11.751 1.00 0.00 O ATOM 631 CB LEU A 62 4.942 -15.020 10.905 1.00 0.00 C ATOM 632 CG LEU A 62 6.445 -14.976 10.913 1.00 0.00 C ATOM 633 CD1 LEU A 62 6.995 -14.662 9.524 1.00 0.00 C ATOM 634 CD2 LEU A 62 6.932 -14.049 11.935 1.00 0.00 C ATOM 0 H LEU A 62 2.661 -15.233 10.008 1.00 0.00 H new ATOM 0 HA LEU A 62 5.088 -16.591 9.501 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.557 -14.169 10.344 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.571 -14.923 11.925 1.00 0.00 H new ATOM 0 HG LEU A 62 6.819 -15.965 11.178 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.084 -14.637 9.561 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.674 -15.432 8.823 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.621 -13.693 9.195 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.022 -14.033 11.923 1.00 0.00 H new ATOM 0 HD22 LEU A 62 6.552 -13.048 11.729 1.00 0.00 H new ATOM 0 HD23 LEU A 62 6.585 -14.374 12.916 1.00 0.00 H new ATOM 646 N ASP A 63 3.248 -17.641 11.902 1.00 0.00 N ATOM 647 CA ASP A 63 3.091 -18.688 12.922 1.00 0.00 C ATOM 648 C ASP A 63 2.951 -20.055 12.282 1.00 0.00 C ATOM 649 O ASP A 63 3.344 -21.071 12.838 1.00 0.00 O ATOM 650 CB ASP A 63 1.861 -18.424 13.714 1.00 0.00 C ATOM 651 CG ASP A 63 1.803 -19.205 15.004 1.00 0.00 C ATOM 652 OD1 ASP A 63 2.524 -18.845 15.954 1.00 0.00 O ATOM 653 OD2 ASP A 63 0.997 -20.148 15.113 1.00 0.00 O ATOM 0 H ASP A 63 2.379 -17.170 11.650 1.00 0.00 H new ATOM 0 HA ASP A 63 3.977 -18.675 13.557 1.00 0.00 H new ATOM 0 HB2 ASP A 63 1.804 -17.359 13.939 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.988 -18.669 13.109 1.00 0.00 H new ATOM 658 N ALA A 64 2.337 -20.076 11.133 1.00 0.00 N ATOM 659 CA ALA A 64 2.096 -21.295 10.412 1.00 0.00 C ATOM 660 C ALA A 64 3.320 -21.721 9.656 1.00 0.00 C ATOM 661 O ALA A 64 3.627 -22.907 9.572 1.00 0.00 O ATOM 662 CB ALA A 64 0.923 -21.126 9.474 1.00 0.00 C ATOM 0 H ALA A 64 1.986 -19.240 10.666 1.00 0.00 H new ATOM 0 HA ALA A 64 1.856 -22.077 11.132 1.00 0.00 H new ATOM 0 HB1 ALA A 64 0.752 -22.057 8.934 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.032 -20.870 10.048 1.00 0.00 H new ATOM 0 HB3 ALA A 64 1.138 -20.329 8.763 1.00 0.00 H new ATOM 668 N LEU A 65 4.031 -20.763 9.115 1.00 0.00 N ATOM 669 CA LEU A 65 5.211 -21.102 8.353 1.00 0.00 C ATOM 670 C LEU A 65 6.488 -20.826 9.102 1.00 0.00 C ATOM 671 O LEU A 65 7.487 -21.516 8.885 1.00 0.00 O ATOM 672 CB LEU A 65 5.197 -20.526 6.939 1.00 0.00 C ATOM 673 CG LEU A 65 4.054 -21.045 6.062 1.00 0.00 C ATOM 674 CD1 LEU A 65 2.927 -20.028 5.934 1.00 0.00 C ATOM 675 CD2 LEU A 65 4.569 -21.516 4.712 1.00 0.00 C ATOM 0 H LEU A 65 3.823 -19.767 9.183 1.00 0.00 H new ATOM 0 HA LEU A 65 5.181 -22.183 8.219 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.128 -19.440 7.002 1.00 0.00 H new ATOM 0 HB3 LEU A 65 6.146 -20.758 6.455 1.00 0.00 H new ATOM 0 HG LEU A 65 3.623 -21.913 6.560 1.00 0.00 H new ATOM 0 HD11 LEU A 65 2.137 -20.437 5.304 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.524 -19.805 6.922 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.312 -19.113 5.485 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.735 -21.879 4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.053 -20.686 4.197 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.289 -22.321 4.858 1.00 0.00 H new ATOM 687 N LYS A 66 6.457 -19.818 9.992 1.00 0.00 N ATOM 688 CA LYS A 66 7.572 -19.531 10.909 1.00 0.00 C ATOM 689 C LYS A 66 8.853 -19.233 10.166 1.00 0.00 C ATOM 690 O LYS A 66 9.872 -19.881 10.363 1.00 0.00 O ATOM 691 CB LYS A 66 7.719 -20.682 11.921 1.00 0.00 C ATOM 692 CG LYS A 66 6.523 -20.808 12.888 1.00 0.00 C ATOM 693 CD LYS A 66 6.333 -22.240 13.378 1.00 0.00 C ATOM 694 CE LYS A 66 5.811 -23.123 12.245 1.00 0.00 C ATOM 695 NZ LYS A 66 5.590 -24.527 12.657 1.00 0.00 N ATOM 0 H LYS A 66 5.664 -19.184 10.095 1.00 0.00 H new ATOM 0 HA LYS A 66 7.345 -18.622 11.467 1.00 0.00 H new ATOM 0 HB2 LYS A 66 7.837 -21.620 11.378 1.00 0.00 H new ATOM 0 HB3 LYS A 66 8.630 -20.532 12.500 1.00 0.00 H new ATOM 0 HG2 LYS A 66 6.677 -20.150 13.743 1.00 0.00 H new ATOM 0 HG3 LYS A 66 5.615 -20.473 12.387 1.00 0.00 H new ATOM 0 HD2 LYS A 66 7.280 -22.634 13.748 1.00 0.00 H new ATOM 0 HD3 LYS A 66 5.633 -22.256 14.213 1.00 0.00 H new ATOM 0 HE2 LYS A 66 4.875 -22.709 11.872 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.521 -23.101 11.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 5.237 -25.075 11.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.487 -24.937 12.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 4.891 -24.557 13.427 1.00 0.00 H new ATOM 709 N LYS A 67 8.763 -18.254 9.279 1.00 0.00 N ATOM 710 CA LYS A 67 9.901 -17.826 8.487 1.00 0.00 C ATOM 711 C LYS A 67 10.984 -17.200 9.380 1.00 0.00 C ATOM 712 O LYS A 67 12.030 -17.816 9.640 1.00 0.00 O ATOM 713 CB LYS A 67 9.472 -16.817 7.410 1.00 0.00 C ATOM 714 CG LYS A 67 8.398 -17.300 6.443 1.00 0.00 C ATOM 715 CD LYS A 67 8.181 -16.275 5.351 1.00 0.00 C ATOM 716 CE LYS A 67 7.157 -16.747 4.350 1.00 0.00 C ATOM 717 NZ LYS A 67 7.584 -17.975 3.641 1.00 0.00 N ATOM 0 H LYS A 67 7.904 -17.738 9.090 1.00 0.00 H new ATOM 0 HA LYS A 67 10.313 -18.709 7.998 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.110 -15.916 7.906 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.352 -16.532 6.834 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.695 -18.253 6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.466 -17.473 6.980 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.853 -15.334 5.793 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.125 -16.077 4.843 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.213 -16.936 4.862 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.973 -15.956 3.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 6.813 -18.307 3.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.423 -17.768 3.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.816 -18.714 4.335 1.00 0.00 H new ATOM 731 N ASP A 68 10.711 -15.997 9.871 1.00 0.00 N ATOM 732 CA ASP A 68 11.659 -15.260 10.703 1.00 0.00 C ATOM 733 C ASP A 68 10.951 -14.075 11.230 1.00 0.00 C ATOM 734 O ASP A 68 10.100 -13.498 10.534 1.00 0.00 O ATOM 735 CB ASP A 68 12.825 -14.748 9.870 1.00 0.00 C ATOM 736 CG ASP A 68 14.080 -14.425 10.664 1.00 0.00 C ATOM 737 OD1 ASP A 68 14.004 -13.731 11.696 1.00 0.00 O ATOM 738 OD2 ASP A 68 15.170 -14.819 10.235 1.00 0.00 O ATOM 0 H ASP A 68 9.832 -15.506 9.706 1.00 0.00 H new ATOM 0 HA ASP A 68 12.033 -15.916 11.489 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.071 -15.496 9.116 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.507 -13.851 9.338 1.00 0.00 H new ATOM 743 N SER A 69 11.282 -13.692 12.399 1.00 0.00 N ATOM 744 CA SER A 69 10.692 -12.554 12.981 1.00 0.00 C ATOM 745 C SER A 69 11.406 -11.271 12.518 1.00 0.00 C ATOM 746 O SER A 69 10.826 -10.182 12.547 1.00 0.00 O ATOM 747 CB SER A 69 10.680 -12.697 14.488 1.00 0.00 C ATOM 748 OG SER A 69 9.983 -13.872 14.864 1.00 0.00 O ATOM 0 H SER A 69 11.974 -14.161 12.984 1.00 0.00 H new ATOM 0 HA SER A 69 9.657 -12.472 12.648 1.00 0.00 H new ATOM 0 HB2 SER A 69 11.702 -12.736 14.865 1.00 0.00 H new ATOM 0 HB3 SER A 69 10.207 -11.825 14.939 1.00 0.00 H new ATOM 0 HG SER A 69 9.984 -13.954 15.841 1.00 0.00 H new ATOM 754 N SER A 70 12.629 -11.420 12.030 1.00 0.00 N ATOM 755 CA SER A 70 13.418 -10.297 11.557 1.00 0.00 C ATOM 756 C SER A 70 12.833 -9.784 10.228 1.00 0.00 C ATOM 757 O SER A 70 12.689 -8.578 10.012 1.00 0.00 O ATOM 758 CB SER A 70 14.866 -10.750 11.376 1.00 0.00 C ATOM 759 OG SER A 70 15.302 -11.490 12.524 1.00 0.00 O ATOM 0 H SER A 70 13.100 -12.322 11.952 1.00 0.00 H new ATOM 0 HA SER A 70 13.391 -9.483 12.281 1.00 0.00 H new ATOM 0 HB2 SER A 70 14.952 -11.368 10.482 1.00 0.00 H new ATOM 0 HB3 SER A 70 15.510 -9.883 11.227 1.00 0.00 H new ATOM 0 HG SER A 70 14.989 -12.416 12.455 1.00 0.00 H new ATOM 765 N ARG A 71 12.431 -10.715 9.363 1.00 0.00 N ATOM 766 CA ARG A 71 11.810 -10.346 8.101 1.00 0.00 C ATOM 767 C ARG A 71 10.401 -9.833 8.353 1.00 0.00 C ATOM 768 O ARG A 71 9.870 -9.086 7.573 1.00 0.00 O ATOM 769 CB ARG A 71 11.820 -11.516 7.101 1.00 0.00 C ATOM 770 CG ARG A 71 11.018 -12.722 7.536 1.00 0.00 C ATOM 771 CD ARG A 71 9.901 -13.014 6.565 1.00 0.00 C ATOM 772 NE ARG A 71 10.404 -13.478 5.253 1.00 0.00 N ATOM 773 CZ ARG A 71 10.036 -12.994 4.039 1.00 0.00 C ATOM 774 NH1 ARG A 71 9.222 -11.947 3.950 1.00 0.00 N ATOM 775 NH2 ARG A 71 10.500 -13.558 2.930 1.00 0.00 N ATOM 0 H ARG A 71 12.525 -11.719 9.515 1.00 0.00 H new ATOM 0 HA ARG A 71 12.394 -9.545 7.647 1.00 0.00 H new ATOM 0 HB2 ARG A 71 11.432 -11.163 6.145 1.00 0.00 H new ATOM 0 HB3 ARG A 71 12.852 -11.824 6.932 1.00 0.00 H new ATOM 0 HG2 ARG A 71 11.673 -13.590 7.612 1.00 0.00 H new ATOM 0 HG3 ARG A 71 10.604 -12.548 8.529 1.00 0.00 H new ATOM 0 HD2 ARG A 71 9.244 -13.773 6.989 1.00 0.00 H new ATOM 0 HD3 ARG A 71 9.301 -12.115 6.424 1.00 0.00 H new ATOM 0 HE ARG A 71 11.091 -14.232 5.261 1.00 0.00 H new ATOM 0 HH11 ARG A 71 8.869 -11.502 4.797 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.950 -11.589 3.034 1.00 0.00 H new ATOM 0 HH21 ARG A 71 11.133 -14.355 2.990 1.00 0.00 H new ATOM 0 HH22 ARG A 71 10.223 -13.194 2.018 1.00 0.00 H new ATOM 789 N HIS A 72 9.825 -10.239 9.477 1.00 0.00 N ATOM 790 CA HIS A 72 8.500 -9.783 9.902 1.00 0.00 C ATOM 791 C HIS A 72 8.532 -8.283 10.283 1.00 0.00 C ATOM 792 O HIS A 72 7.534 -7.580 10.147 1.00 0.00 O ATOM 793 CB HIS A 72 7.993 -10.650 11.078 1.00 0.00 C ATOM 794 CG HIS A 72 6.581 -10.357 11.558 1.00 0.00 C ATOM 795 ND1 HIS A 72 5.474 -11.105 11.205 1.00 0.00 N ATOM 796 CD2 HIS A 72 6.122 -9.413 12.422 1.00 0.00 C ATOM 797 CE1 HIS A 72 4.419 -10.611 11.850 1.00 0.00 C ATOM 798 NE2 HIS A 72 4.753 -9.584 12.602 1.00 0.00 N ATOM 0 H HIS A 72 10.261 -10.896 10.124 1.00 0.00 H new ATOM 0 HA HIS A 72 7.805 -9.896 9.070 1.00 0.00 H new ATOM 0 HB2 HIS A 72 8.045 -11.697 10.781 1.00 0.00 H new ATOM 0 HB3 HIS A 72 8.675 -10.523 11.918 1.00 0.00 H new ATOM 0 HD2 HIS A 72 6.725 -8.651 12.894 1.00 0.00 H new ATOM 0 HE1 HIS A 72 3.416 -11.003 11.767 1.00 0.00 H new ATOM 0 HE2 HIS A 72 4.136 -9.028 13.194 1.00 0.00 H new ATOM 806 N SER A 73 9.670 -7.798 10.746 1.00 0.00 N ATOM 807 CA SER A 73 9.788 -6.390 11.089 1.00 0.00 C ATOM 808 C SER A 73 10.159 -5.533 9.879 1.00 0.00 C ATOM 809 O SER A 73 10.079 -4.298 9.904 1.00 0.00 O ATOM 810 CB SER A 73 10.729 -6.206 12.274 1.00 0.00 C ATOM 811 OG SER A 73 11.879 -7.034 12.149 1.00 0.00 O ATOM 0 H SER A 73 10.516 -8.349 10.892 1.00 0.00 H new ATOM 0 HA SER A 73 8.809 -6.029 11.404 1.00 0.00 H new ATOM 0 HB2 SER A 73 11.035 -5.162 12.341 1.00 0.00 H new ATOM 0 HB3 SER A 73 10.204 -6.444 13.199 1.00 0.00 H new ATOM 0 HG SER A 73 11.972 -7.327 11.218 1.00 0.00 H new ATOM 817 N LYS A 74 10.518 -6.201 8.832 1.00 0.00 N ATOM 818 CA LYS A 74 10.851 -5.588 7.582 1.00 0.00 C ATOM 819 C LYS A 74 9.593 -5.533 6.764 1.00 0.00 C ATOM 820 O LYS A 74 9.277 -4.532 6.143 1.00 0.00 O ATOM 821 CB LYS A 74 12.000 -6.398 6.918 1.00 0.00 C ATOM 822 CG LYS A 74 12.580 -5.836 5.614 1.00 0.00 C ATOM 823 CD LYS A 74 11.690 -6.106 4.435 1.00 0.00 C ATOM 824 CE LYS A 74 11.169 -4.820 3.862 1.00 0.00 C ATOM 825 NZ LYS A 74 10.357 -5.030 2.647 1.00 0.00 N ATOM 0 H LYS A 74 10.591 -7.218 8.819 1.00 0.00 H new ATOM 0 HA LYS A 74 11.221 -4.569 7.692 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.812 -6.489 7.639 1.00 0.00 H new ATOM 0 HB3 LYS A 74 11.635 -7.406 6.721 1.00 0.00 H new ATOM 0 HG2 LYS A 74 12.727 -4.761 5.717 1.00 0.00 H new ATOM 0 HG3 LYS A 74 13.561 -6.276 5.435 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.244 -6.653 3.672 1.00 0.00 H new ATOM 0 HD3 LYS A 74 10.857 -6.739 4.739 1.00 0.00 H new ATOM 0 HE2 LYS A 74 10.567 -4.309 4.613 1.00 0.00 H new ATOM 0 HE3 LYS A 74 12.008 -4.165 3.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 10.135 -4.111 2.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 10.890 -5.612 1.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 9.473 -5.516 2.900 1.00 0.00 H new ATOM 839 N LEU A 75 8.889 -6.604 6.878 1.00 0.00 N ATOM 840 CA LEU A 75 7.616 -6.936 6.227 1.00 0.00 C ATOM 841 C LEU A 75 6.700 -5.733 6.130 1.00 0.00 C ATOM 842 O LEU A 75 6.045 -5.336 7.097 1.00 0.00 O ATOM 843 CB LEU A 75 6.960 -8.067 7.034 1.00 0.00 C ATOM 844 CG LEU A 75 6.207 -9.164 6.279 1.00 0.00 C ATOM 845 CD1 LEU A 75 7.085 -9.767 5.212 1.00 0.00 C ATOM 846 CD2 LEU A 75 5.744 -10.254 7.250 1.00 0.00 C ATOM 0 H LEU A 75 9.199 -7.363 7.485 1.00 0.00 H new ATOM 0 HA LEU A 75 7.802 -7.258 5.202 1.00 0.00 H new ATOM 0 HB2 LEU A 75 7.740 -8.547 7.625 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.263 -7.611 7.737 1.00 0.00 H new ATOM 0 HG LEU A 75 5.333 -8.718 5.804 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.534 -10.546 4.685 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.384 -8.992 4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.973 -10.200 5.673 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.210 -11.028 6.700 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.611 -10.693 7.745 1.00 0.00 H new ATOM 0 HD23 LEU A 75 5.082 -9.818 7.998 1.00 0.00 H new ATOM 858 N GLU A 76 6.726 -5.134 4.970 1.00 0.00 N ATOM 859 CA GLU A 76 5.946 -3.978 4.646 1.00 0.00 C ATOM 860 C GLU A 76 4.563 -4.454 4.285 1.00 0.00 C ATOM 861 O GLU A 76 4.377 -5.644 4.047 1.00 0.00 O ATOM 862 CB GLU A 76 6.593 -3.254 3.465 1.00 0.00 C ATOM 863 CG GLU A 76 8.029 -2.804 3.741 1.00 0.00 C ATOM 864 CD GLU A 76 8.684 -2.130 2.562 1.00 0.00 C ATOM 865 OE1 GLU A 76 9.167 -2.849 1.664 1.00 0.00 O ATOM 866 OE2 GLU A 76 8.758 -0.887 2.520 1.00 0.00 O ATOM 0 H GLU A 76 7.313 -5.452 4.199 1.00 0.00 H new ATOM 0 HA GLU A 76 5.893 -3.284 5.485 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.587 -3.913 2.597 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.990 -2.383 3.208 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.030 -2.118 4.588 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.624 -3.670 4.031 1.00 0.00 H new ATOM 873 N LYS A 77 3.612 -3.555 4.193 1.00 0.00 N ATOM 874 CA LYS A 77 2.229 -3.932 3.937 1.00 0.00 C ATOM 875 C LYS A 77 2.084 -4.687 2.631 1.00 0.00 C ATOM 876 O LYS A 77 1.390 -5.690 2.550 1.00 0.00 O ATOM 877 CB LYS A 77 1.342 -2.714 3.984 1.00 0.00 C ATOM 878 CG LYS A 77 -0.106 -2.992 3.637 1.00 0.00 C ATOM 879 CD LYS A 77 -1.018 -1.990 4.302 1.00 0.00 C ATOM 880 CE LYS A 77 -0.633 -0.597 3.923 1.00 0.00 C ATOM 881 NZ LYS A 77 -1.316 0.408 4.739 1.00 0.00 N ATOM 0 H LYS A 77 3.765 -2.551 4.291 1.00 0.00 H new ATOM 0 HA LYS A 77 1.910 -4.615 4.724 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.389 -2.282 4.983 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.733 -1.966 3.294 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.240 -2.951 2.556 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.373 -4.000 3.953 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.051 -2.180 4.010 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -0.967 -2.106 5.385 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.445 -0.478 4.031 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.869 -0.430 2.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.018 1.359 4.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.345 0.313 4.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.071 0.267 5.740 1.00 0.00 H new ATOM 895 N ALA A 78 2.807 -4.230 1.651 1.00 0.00 N ATOM 896 CA ALA A 78 2.847 -4.846 0.333 1.00 0.00 C ATOM 897 C ALA A 78 3.419 -6.270 0.402 1.00 0.00 C ATOM 898 O ALA A 78 3.026 -7.155 -0.369 1.00 0.00 O ATOM 899 CB ALA A 78 3.704 -3.995 -0.576 1.00 0.00 C ATOM 0 H ALA A 78 3.400 -3.405 1.734 1.00 0.00 H new ATOM 0 HA ALA A 78 1.831 -4.912 -0.056 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.742 -4.446 -1.568 1.00 0.00 H new ATOM 0 HB2 ALA A 78 3.276 -2.995 -0.648 1.00 0.00 H new ATOM 0 HB3 ALA A 78 4.713 -3.929 -0.168 1.00 0.00 H new ATOM 905 N ASP A 79 4.308 -6.489 1.357 1.00 0.00 N ATOM 906 CA ASP A 79 4.982 -7.775 1.509 1.00 0.00 C ATOM 907 C ASP A 79 4.028 -8.721 2.155 1.00 0.00 C ATOM 908 O ASP A 79 3.780 -9.802 1.664 1.00 0.00 O ATOM 909 CB ASP A 79 6.233 -7.668 2.396 1.00 0.00 C ATOM 910 CG ASP A 79 7.289 -6.714 1.915 1.00 0.00 C ATOM 911 OD1 ASP A 79 7.436 -6.504 0.690 1.00 0.00 O ATOM 912 OD2 ASP A 79 7.994 -6.140 2.765 1.00 0.00 O ATOM 0 H ASP A 79 4.584 -5.789 2.045 1.00 0.00 H new ATOM 0 HA ASP A 79 5.295 -8.119 0.523 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.923 -7.365 3.396 1.00 0.00 H new ATOM 0 HB3 ASP A 79 6.678 -8.659 2.487 1.00 0.00 H new ATOM 917 N ILE A 80 3.507 -8.269 3.268 1.00 0.00 N ATOM 918 CA ILE A 80 2.508 -8.956 4.067 1.00 0.00 C ATOM 919 C ILE A 80 1.329 -9.456 3.219 1.00 0.00 C ATOM 920 O ILE A 80 1.005 -10.646 3.257 1.00 0.00 O ATOM 921 CB ILE A 80 2.012 -7.999 5.181 1.00 0.00 C ATOM 922 CG1 ILE A 80 3.194 -7.639 6.075 1.00 0.00 C ATOM 923 CG2 ILE A 80 0.887 -8.625 5.987 1.00 0.00 C ATOM 924 CD1 ILE A 80 2.975 -6.483 6.999 1.00 0.00 C ATOM 0 H ILE A 80 3.777 -7.369 3.666 1.00 0.00 H new ATOM 0 HA ILE A 80 2.969 -9.839 4.510 1.00 0.00 H new ATOM 0 HB ILE A 80 1.608 -7.094 4.727 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.456 -8.513 6.671 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.052 -7.417 5.441 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.562 -7.928 6.760 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.049 -8.852 5.327 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.241 -9.544 6.453 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.876 -6.312 7.588 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.747 -5.590 6.417 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.142 -6.703 7.666 1.00 0.00 H new ATOM 936 N LEU A 81 0.728 -8.560 2.432 1.00 0.00 N ATOM 937 CA LEU A 81 -0.424 -8.925 1.601 1.00 0.00 C ATOM 938 C LEU A 81 -0.054 -10.007 0.600 1.00 0.00 C ATOM 939 O LEU A 81 -0.734 -11.047 0.516 1.00 0.00 O ATOM 940 CB LEU A 81 -0.989 -7.722 0.841 1.00 0.00 C ATOM 941 CG LEU A 81 -1.463 -6.524 1.664 1.00 0.00 C ATOM 942 CD1 LEU A 81 -2.044 -5.469 0.743 1.00 0.00 C ATOM 943 CD2 LEU A 81 -2.491 -6.944 2.710 1.00 0.00 C ATOM 0 H LEU A 81 1.016 -7.585 2.352 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.188 -9.299 2.282 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.223 -7.372 0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.829 -8.069 0.239 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.605 -6.107 2.192 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.381 -4.617 1.333 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.281 -5.143 0.037 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.889 -5.888 0.196 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.809 -6.070 3.279 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.354 -7.388 2.214 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.045 -7.674 3.385 1.00 0.00 H new ATOM 955 N GLU A 82 1.046 -9.789 -0.128 1.00 0.00 N ATOM 956 CA GLU A 82 1.498 -10.727 -1.128 1.00 0.00 C ATOM 957 C GLU A 82 1.864 -12.060 -0.493 1.00 0.00 C ATOM 958 O GLU A 82 1.630 -13.109 -1.082 1.00 0.00 O ATOM 959 CB GLU A 82 2.677 -10.140 -1.911 1.00 0.00 C ATOM 960 CG GLU A 82 3.293 -11.045 -2.920 1.00 0.00 C ATOM 961 CD GLU A 82 4.527 -10.455 -3.547 1.00 0.00 C ATOM 962 OE1 GLU A 82 4.410 -9.528 -4.366 1.00 0.00 O ATOM 963 OE2 GLU A 82 5.657 -10.929 -3.237 1.00 0.00 O ATOM 0 H GLU A 82 1.635 -8.961 -0.033 1.00 0.00 H new ATOM 0 HA GLU A 82 0.683 -10.910 -1.828 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.339 -9.236 -2.418 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.447 -9.838 -1.201 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.548 -11.993 -2.445 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.563 -11.265 -3.699 1.00 0.00 H new ATOM 970 N MET A 83 2.378 -12.006 0.728 1.00 0.00 N ATOM 971 CA MET A 83 2.802 -13.180 1.464 1.00 0.00 C ATOM 972 C MET A 83 1.629 -14.138 1.580 1.00 0.00 C ATOM 973 O MET A 83 1.730 -15.265 1.138 1.00 0.00 O ATOM 974 CB MET A 83 3.354 -12.781 2.848 1.00 0.00 C ATOM 975 CG MET A 83 4.084 -13.883 3.632 1.00 0.00 C ATOM 976 SD MET A 83 4.732 -13.291 5.219 1.00 0.00 S ATOM 977 CE MET A 83 3.240 -12.619 5.975 1.00 0.00 C ATOM 0 H MET A 83 2.512 -11.133 1.238 1.00 0.00 H new ATOM 0 HA MET A 83 3.610 -13.681 0.932 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.040 -11.944 2.715 1.00 0.00 H new ATOM 0 HB3 MET A 83 2.525 -12.420 3.456 1.00 0.00 H new ATOM 0 HG2 MET A 83 3.400 -14.713 3.809 1.00 0.00 H new ATOM 0 HG3 MET A 83 4.905 -14.270 3.029 1.00 0.00 H new ATOM 0 HE1 MET A 83 3.260 -12.806 7.049 1.00 0.00 H new ATOM 0 HE2 MET A 83 3.193 -11.545 5.794 1.00 0.00 H new ATOM 0 HE3 MET A 83 2.364 -13.099 5.540 1.00 0.00 H new ATOM 987 N THR A 84 0.500 -13.662 2.087 1.00 0.00 N ATOM 988 CA THR A 84 -0.712 -14.475 2.185 1.00 0.00 C ATOM 989 C THR A 84 -1.115 -15.056 0.818 1.00 0.00 C ATOM 990 O THR A 84 -1.402 -16.242 0.705 1.00 0.00 O ATOM 991 CB THR A 84 -1.859 -13.626 2.718 1.00 0.00 C ATOM 992 OG1 THR A 84 -1.382 -12.284 2.894 1.00 0.00 O ATOM 993 CG2 THR A 84 -2.367 -14.171 4.047 1.00 0.00 C ATOM 0 H THR A 84 0.395 -12.711 2.440 1.00 0.00 H new ATOM 0 HA THR A 84 -0.503 -15.301 2.865 1.00 0.00 H new ATOM 0 HB THR A 84 -2.686 -13.648 2.008 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.303 -11.848 2.020 1.00 0.00 H new ATOM 0 HG21 THR A 84 -3.186 -13.548 4.407 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.722 -15.192 3.910 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.557 -14.163 4.777 1.00 0.00 H new ATOM 1001 N VAL A 85 -1.060 -14.219 -0.222 1.00 0.00 N ATOM 1002 CA VAL A 85 -1.438 -14.629 -1.582 1.00 0.00 C ATOM 1003 C VAL A 85 -0.563 -15.805 -2.061 1.00 0.00 C ATOM 1004 O VAL A 85 -1.065 -16.853 -2.491 1.00 0.00 O ATOM 1005 CB VAL A 85 -1.268 -13.468 -2.597 1.00 0.00 C ATOM 1006 CG1 VAL A 85 -1.749 -13.861 -3.988 1.00 0.00 C ATOM 1007 CG2 VAL A 85 -1.967 -12.224 -2.124 1.00 0.00 C ATOM 0 H VAL A 85 -0.756 -13.248 -0.149 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.486 -14.926 -1.538 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.201 -13.254 -2.664 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -1.614 -13.022 -4.670 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -1.173 -14.715 -4.344 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.805 -14.128 -3.946 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.830 -11.429 -2.856 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -3.031 -12.428 -2.005 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.548 -11.913 -1.167 1.00 0.00 H new ATOM 1017 N LYS A 86 0.741 -15.631 -1.943 1.00 0.00 N ATOM 1018 CA LYS A 86 1.705 -16.617 -2.403 1.00 0.00 C ATOM 1019 C LYS A 86 1.598 -17.907 -1.584 1.00 0.00 C ATOM 1020 O LYS A 86 1.826 -19.007 -2.086 1.00 0.00 O ATOM 1021 CB LYS A 86 3.111 -16.046 -2.323 1.00 0.00 C ATOM 1022 CG LYS A 86 3.258 -14.692 -3.017 1.00 0.00 C ATOM 1023 CD LYS A 86 4.684 -14.252 -3.085 1.00 0.00 C ATOM 1024 CE LYS A 86 5.222 -13.919 -1.709 1.00 0.00 C ATOM 1025 NZ LYS A 86 6.555 -13.323 -1.784 1.00 0.00 N ATOM 0 H LYS A 86 1.163 -14.802 -1.525 1.00 0.00 H new ATOM 0 HA LYS A 86 1.484 -16.861 -3.442 1.00 0.00 H new ATOM 0 HB2 LYS A 86 3.393 -15.941 -1.275 1.00 0.00 H new ATOM 0 HB3 LYS A 86 3.808 -16.753 -2.772 1.00 0.00 H new ATOM 0 HG2 LYS A 86 2.849 -14.755 -4.025 1.00 0.00 H new ATOM 0 HG3 LYS A 86 2.673 -13.944 -2.482 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.289 -15.040 -3.534 1.00 0.00 H new ATOM 0 HD3 LYS A 86 4.767 -13.379 -3.732 1.00 0.00 H new ATOM 0 HE2 LYS A 86 4.542 -13.230 -1.208 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.261 -14.825 -1.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 6.921 -13.170 -0.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.193 -13.962 -2.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 6.500 -12.412 -2.283 1.00 0.00 H new ATOM 1039 N HIS A 87 1.215 -17.761 -0.335 1.00 0.00 N ATOM 1040 CA HIS A 87 1.030 -18.890 0.557 1.00 0.00 C ATOM 1041 C HIS A 87 -0.263 -19.619 0.310 1.00 0.00 C ATOM 1042 O HIS A 87 -0.371 -20.817 0.609 1.00 0.00 O ATOM 1043 CB HIS A 87 1.270 -18.526 2.011 1.00 0.00 C ATOM 1044 CG HIS A 87 2.725 -18.283 2.242 1.00 0.00 C ATOM 1045 ND1 HIS A 87 3.350 -17.107 1.970 1.00 0.00 N ATOM 1046 CD2 HIS A 87 3.684 -19.117 2.634 1.00 0.00 C ATOM 1047 CE1 HIS A 87 4.633 -17.249 2.180 1.00 0.00 C ATOM 1048 NE2 HIS A 87 4.904 -18.463 2.595 1.00 0.00 N ATOM 0 H HIS A 87 1.022 -16.856 0.094 1.00 0.00 H new ATOM 0 HA HIS A 87 1.808 -19.614 0.314 1.00 0.00 H new ATOM 0 HB2 HIS A 87 0.698 -17.635 2.271 1.00 0.00 H new ATOM 0 HB3 HIS A 87 0.920 -19.330 2.659 1.00 0.00 H new ATOM 0 HD1 HIS A 87 2.892 -16.252 1.653 1.00 0.00 H new ATOM 0 HD2 HIS A 87 3.535 -20.143 2.935 1.00 0.00 H new ATOM 0 HE1 HIS A 87 5.369 -16.472 2.032 1.00 0.00 H new ATOM 1056 N LEU A 88 -1.245 -18.903 -0.244 1.00 0.00 N ATOM 1057 CA LEU A 88 -2.501 -19.491 -0.650 1.00 0.00 C ATOM 1058 C LEU A 88 -2.178 -20.512 -1.701 1.00 0.00 C ATOM 1059 O LEU A 88 -2.655 -21.629 -1.651 1.00 0.00 O ATOM 1060 CB LEU A 88 -3.465 -18.367 -1.177 1.00 0.00 C ATOM 1061 CG LEU A 88 -4.866 -18.737 -1.766 1.00 0.00 C ATOM 1062 CD1 LEU A 88 -4.776 -19.343 -3.164 1.00 0.00 C ATOM 1063 CD2 LEU A 88 -5.630 -19.664 -0.835 1.00 0.00 C ATOM 0 H LEU A 88 -1.181 -17.900 -0.419 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.018 -19.976 0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.635 -17.676 -0.352 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -2.927 -17.816 -1.948 1.00 0.00 H new ATOM 0 HG LEU A 88 -5.416 -17.800 -1.855 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.778 -19.580 -3.523 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.308 -18.628 -3.841 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.178 -20.254 -3.128 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.599 -19.902 -1.273 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.062 -20.583 -0.690 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.778 -19.173 0.127 1.00 0.00 H new ATOM 1075 N ARG A 89 -1.282 -20.123 -2.602 1.00 0.00 N ATOM 1076 CA ARG A 89 -0.836 -20.983 -3.691 1.00 0.00 C ATOM 1077 C ARG A 89 -0.193 -22.228 -3.098 1.00 0.00 C ATOM 1078 O ARG A 89 -0.556 -23.340 -3.433 1.00 0.00 O ATOM 1079 CB ARG A 89 0.221 -20.274 -4.566 1.00 0.00 C ATOM 1080 CG ARG A 89 -0.012 -18.787 -4.803 1.00 0.00 C ATOM 1081 CD ARG A 89 -1.378 -18.479 -5.362 1.00 0.00 C ATOM 1082 NE ARG A 89 -1.579 -19.061 -6.700 1.00 0.00 N ATOM 1083 CZ ARG A 89 -1.826 -18.350 -7.808 1.00 0.00 C ATOM 1084 NH1 ARG A 89 -1.764 -17.030 -7.780 1.00 0.00 N ATOM 1085 NH2 ARG A 89 -2.091 -18.958 -8.951 1.00 0.00 N ATOM 0 H ARG A 89 -0.845 -19.202 -2.597 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.700 -21.232 -4.307 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.198 -20.401 -4.099 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.262 -20.776 -5.533 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.117 -18.252 -3.862 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.747 -18.412 -5.490 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.140 -18.862 -4.684 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.511 -17.398 -5.414 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.526 -20.076 -6.789 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -1.527 -16.549 -6.912 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.953 -16.493 -8.626 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.109 -19.977 -8.995 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -2.278 -18.408 -9.790 1.00 0.00 H new ATOM 1099 N ASN A 90 0.710 -21.999 -2.143 1.00 0.00 N ATOM 1100 CA ASN A 90 1.498 -23.055 -1.501 1.00 0.00 C ATOM 1101 C ASN A 90 0.614 -24.076 -0.847 1.00 0.00 C ATOM 1102 O ASN A 90 0.703 -25.264 -1.144 1.00 0.00 O ATOM 1103 CB ASN A 90 2.488 -22.509 -0.450 1.00 0.00 C ATOM 1104 CG ASN A 90 3.560 -21.598 -1.011 1.00 0.00 C ATOM 1105 OD1 ASN A 90 3.887 -21.661 -2.188 1.00 0.00 O ATOM 1106 ND2 ASN A 90 4.165 -20.798 -0.164 1.00 0.00 N ATOM 0 H ASN A 90 0.918 -21.065 -1.789 1.00 0.00 H new ATOM 0 HA ASN A 90 2.071 -23.520 -2.303 1.00 0.00 H new ATOM 0 HB2 ASN A 90 1.928 -21.965 0.310 1.00 0.00 H new ATOM 0 HB3 ASN A 90 2.969 -23.350 0.049 1.00 0.00 H new ATOM 0 HD21 ASN A 90 4.932 -20.205 -0.481 1.00 0.00 H new ATOM 0 HD22 ASN A 90 3.868 -20.769 0.811 1.00 0.00 H new ATOM 1113 N LEU A 91 -0.267 -23.613 0.015 1.00 0.00 N ATOM 1114 CA LEU A 91 -1.168 -24.490 0.728 1.00 0.00 C ATOM 1115 C LEU A 91 -2.146 -25.173 -0.207 1.00 0.00 C ATOM 1116 O LEU A 91 -2.537 -26.297 0.030 1.00 0.00 O ATOM 1117 CB LEU A 91 -1.896 -23.737 1.833 1.00 0.00 C ATOM 1118 CG LEU A 91 -1.061 -23.359 3.057 1.00 0.00 C ATOM 1119 CD1 LEU A 91 -1.843 -22.419 3.948 1.00 0.00 C ATOM 1120 CD2 LEU A 91 -0.683 -24.617 3.834 1.00 0.00 C ATOM 0 H LEU A 91 -0.378 -22.624 0.239 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.566 -25.273 1.190 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -2.313 -22.824 1.408 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -2.736 -24.346 2.166 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.152 -22.857 2.725 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.240 -22.156 4.817 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.093 -21.515 3.393 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.760 -22.908 4.277 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -0.088 -24.342 4.705 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.588 -25.129 4.160 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.102 -25.280 3.193 1.00 0.00 H new ATOM 1132 N GLN A 92 -2.498 -24.516 -1.285 1.00 0.00 N ATOM 1133 CA GLN A 92 -3.415 -25.080 -2.253 1.00 0.00 C ATOM 1134 C GLN A 92 -2.784 -26.142 -3.140 1.00 0.00 C ATOM 1135 O GLN A 92 -3.493 -26.968 -3.736 1.00 0.00 O ATOM 1136 CB GLN A 92 -4.111 -23.990 -3.059 1.00 0.00 C ATOM 1137 CG GLN A 92 -5.239 -23.318 -2.290 1.00 0.00 C ATOM 1138 CD GLN A 92 -6.403 -24.255 -2.019 1.00 0.00 C ATOM 1139 OE1 GLN A 92 -6.251 -25.471 -1.915 1.00 0.00 O ATOM 1140 NE2 GLN A 92 -7.553 -23.710 -1.860 1.00 0.00 N ATOM 0 H GLN A 92 -2.161 -23.582 -1.518 1.00 0.00 H new ATOM 0 HA GLN A 92 -4.179 -25.605 -1.680 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -3.379 -23.238 -3.352 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -4.510 -24.422 -3.977 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -4.853 -22.941 -1.343 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -5.595 -22.456 -2.855 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -7.655 -22.699 -1.951 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -8.365 -24.287 -1.643 1.00 0.00 H new ATOM 1149 N ARG A 93 -1.480 -26.154 -3.221 1.00 0.00 N ATOM 1150 CA ARG A 93 -0.791 -27.171 -3.997 1.00 0.00 C ATOM 1151 C ARG A 93 -0.033 -28.133 -3.113 1.00 0.00 C ATOM 1152 O ARG A 93 0.702 -28.981 -3.594 1.00 0.00 O ATOM 1153 CB ARG A 93 0.082 -26.561 -5.110 1.00 0.00 C ATOM 1154 CG ARG A 93 1.085 -25.500 -4.681 1.00 0.00 C ATOM 1155 CD ARG A 93 2.313 -26.048 -3.975 1.00 0.00 C ATOM 1156 NE ARG A 93 3.271 -24.976 -3.678 1.00 0.00 N ATOM 1157 CZ ARG A 93 4.394 -25.105 -2.968 1.00 0.00 C ATOM 1158 NH1 ARG A 93 4.744 -26.282 -2.459 1.00 0.00 N ATOM 1159 NH2 ARG A 93 5.159 -24.050 -2.769 1.00 0.00 N ATOM 0 H ARG A 93 -0.869 -25.477 -2.764 1.00 0.00 H new ATOM 0 HA ARG A 93 -1.554 -27.760 -4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 93 0.628 -27.369 -5.597 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.577 -26.124 -5.860 1.00 0.00 H new ATOM 0 HG2 ARG A 93 1.405 -24.943 -5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 93 0.586 -24.792 -4.019 1.00 0.00 H new ATOM 0 HD2 ARG A 93 2.015 -26.541 -3.050 1.00 0.00 H new ATOM 0 HD3 ARG A 93 2.789 -26.804 -4.600 1.00 0.00 H new ATOM 0 HE ARG A 93 3.059 -24.049 -4.047 1.00 0.00 H new ATOM 0 HH11 ARG A 93 4.152 -27.099 -2.609 1.00 0.00 H new ATOM 0 HH12 ARG A 93 5.605 -26.368 -1.918 1.00 0.00 H new ATOM 0 HH21 ARG A 93 4.891 -23.145 -3.156 1.00 0.00 H new ATOM 0 HH22 ARG A 93 6.019 -24.138 -2.228 1.00 0.00 H new ATOM 1173 N ALA A 94 -0.272 -28.040 -1.822 1.00 0.00 N ATOM 1174 CA ALA A 94 0.369 -28.905 -0.827 1.00 0.00 C ATOM 1175 C ALA A 94 -0.412 -30.213 -0.687 1.00 0.00 C ATOM 1176 O ALA A 94 -0.445 -30.833 0.377 1.00 0.00 O ATOM 1177 CB ALA A 94 0.407 -28.182 0.505 1.00 0.00 C ATOM 0 H ALA A 94 -0.919 -27.361 -1.421 1.00 0.00 H new ATOM 0 HA ALA A 94 1.384 -29.138 -1.148 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.882 -28.819 1.251 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.976 -27.258 0.401 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.610 -27.949 0.822 1.00 0.00 H new ATOM 1485 N GLU B 43 7.319 5.318 -2.412 1.00 0.00 N ATOM 1486 CA GLU B 43 6.129 4.926 -1.696 1.00 0.00 C ATOM 1487 C GLU B 43 4.939 4.767 -2.620 1.00 0.00 C ATOM 1488 O GLU B 43 4.016 4.051 -2.301 1.00 0.00 O ATOM 1489 CB GLU B 43 5.821 5.807 -0.496 1.00 0.00 C ATOM 1490 CG GLU B 43 5.603 7.262 -0.793 1.00 0.00 C ATOM 1491 CD GLU B 43 5.328 8.010 0.466 1.00 0.00 C ATOM 1492 OE1 GLU B 43 6.258 8.190 1.264 1.00 0.00 O ATOM 1493 OE2 GLU B 43 4.158 8.383 0.716 1.00 0.00 O ATOM 0 HA GLU B 43 6.344 3.942 -1.279 1.00 0.00 H new ATOM 0 HB2 GLU B 43 4.930 5.419 -0.003 1.00 0.00 H new ATOM 0 HB3 GLU B 43 6.642 5.720 0.215 1.00 0.00 H new ATOM 0 HG2 GLU B 43 6.483 7.676 -1.285 1.00 0.00 H new ATOM 0 HG3 GLU B 43 4.767 7.378 -1.483 1.00 0.00 H new ATOM 1500 N LYS B 44 4.985 5.408 -3.781 1.00 0.00 N ATOM 1501 CA LYS B 44 3.946 5.228 -4.796 1.00 0.00 C ATOM 1502 C LYS B 44 4.070 3.808 -5.348 1.00 0.00 C ATOM 1503 O LYS B 44 3.073 3.138 -5.623 1.00 0.00 O ATOM 1504 CB LYS B 44 4.091 6.315 -5.897 1.00 0.00 C ATOM 1505 CG LYS B 44 3.019 6.353 -7.003 1.00 0.00 C ATOM 1506 CD LYS B 44 3.264 5.357 -8.140 1.00 0.00 C ATOM 1507 CE LYS B 44 4.535 5.692 -8.924 1.00 0.00 C ATOM 1508 NZ LYS B 44 4.710 4.817 -10.097 1.00 0.00 N ATOM 0 H LYS B 44 5.727 6.056 -4.046 1.00 0.00 H new ATOM 0 HA LYS B 44 2.949 5.348 -4.372 1.00 0.00 H new ATOM 0 HB2 LYS B 44 4.105 7.289 -5.408 1.00 0.00 H new ATOM 0 HB3 LYS B 44 5.062 6.184 -6.374 1.00 0.00 H new ATOM 0 HG2 LYS B 44 2.045 6.149 -6.558 1.00 0.00 H new ATOM 0 HG3 LYS B 44 2.975 7.360 -7.418 1.00 0.00 H new ATOM 0 HD2 LYS B 44 3.344 4.350 -7.730 1.00 0.00 H new ATOM 0 HD3 LYS B 44 2.409 5.359 -8.816 1.00 0.00 H new ATOM 0 HE2 LYS B 44 4.496 6.731 -9.250 1.00 0.00 H new ATOM 0 HE3 LYS B 44 5.401 5.596 -8.268 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 5.583 5.079 -10.598 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 4.774 3.827 -9.785 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 3.897 4.927 -10.736 1.00 0.00 H new ATOM 1522 N ARG B 45 5.312 3.351 -5.464 1.00 0.00 N ATOM 1523 CA ARG B 45 5.613 1.994 -5.890 1.00 0.00 C ATOM 1524 C ARG B 45 5.081 0.998 -4.868 1.00 0.00 C ATOM 1525 O ARG B 45 4.400 0.021 -5.234 1.00 0.00 O ATOM 1526 CB ARG B 45 7.119 1.825 -6.082 1.00 0.00 C ATOM 1527 CG ARG B 45 7.670 2.579 -7.276 1.00 0.00 C ATOM 1528 CD ARG B 45 9.183 2.662 -7.223 1.00 0.00 C ATOM 1529 NE ARG B 45 9.751 3.208 -8.452 1.00 0.00 N ATOM 1530 CZ ARG B 45 11.013 3.014 -8.866 1.00 0.00 C ATOM 1531 NH1 ARG B 45 11.857 2.251 -8.141 1.00 0.00 N ATOM 1532 NH2 ARG B 45 11.425 3.577 -10.004 1.00 0.00 N ATOM 0 H ARG B 45 6.139 3.914 -5.264 1.00 0.00 H new ATOM 0 HA ARG B 45 5.124 1.802 -6.845 1.00 0.00 H new ATOM 0 HB2 ARG B 45 7.631 2.164 -5.182 1.00 0.00 H new ATOM 0 HB3 ARG B 45 7.345 0.765 -6.197 1.00 0.00 H new ATOM 0 HG2 ARG B 45 7.363 2.082 -8.196 1.00 0.00 H new ATOM 0 HG3 ARG B 45 7.249 3.584 -7.300 1.00 0.00 H new ATOM 0 HD2 ARG B 45 9.481 3.285 -6.380 1.00 0.00 H new ATOM 0 HD3 ARG B 45 9.593 1.668 -7.046 1.00 0.00 H new ATOM 0 HE ARG B 45 9.144 3.779 -9.040 1.00 0.00 H new ATOM 0 HH11 ARG B 45 11.537 1.819 -7.274 1.00 0.00 H new ATOM 0 HH12 ARG B 45 12.815 2.106 -8.460 1.00 0.00 H new ATOM 0 HH21 ARG B 45 10.782 4.149 -10.552 1.00 0.00 H new ATOM 0 HH22 ARG B 45 12.382 3.435 -10.326 1.00 0.00 H new ATOM 1546 N ARG B 46 5.368 1.265 -3.594 1.00 0.00 N ATOM 1547 CA ARG B 46 4.869 0.452 -2.489 1.00 0.00 C ATOM 1548 C ARG B 46 3.346 0.423 -2.500 1.00 0.00 C ATOM 1549 O ARG B 46 2.752 -0.639 -2.505 1.00 0.00 O ATOM 1550 CB ARG B 46 5.346 1.005 -1.145 1.00 0.00 C ATOM 1551 CG ARG B 46 4.837 0.214 0.062 1.00 0.00 C ATOM 1552 CD ARG B 46 5.168 0.912 1.358 1.00 0.00 C ATOM 1553 NE ARG B 46 6.598 0.896 1.646 1.00 0.00 N ATOM 1554 CZ ARG B 46 7.371 1.960 1.862 1.00 0.00 C ATOM 1555 NH1 ARG B 46 6.885 3.200 1.804 1.00 0.00 N ATOM 1556 NH2 ARG B 46 8.621 1.763 2.163 1.00 0.00 N ATOM 0 H ARG B 46 5.951 2.049 -3.301 1.00 0.00 H new ATOM 0 HA ARG B 46 5.258 -0.558 -2.618 1.00 0.00 H new ATOM 0 HB2 ARG B 46 6.436 1.011 -1.131 1.00 0.00 H new ATOM 0 HB3 ARG B 46 5.021 2.041 -1.053 1.00 0.00 H new ATOM 0 HG2 ARG B 46 3.758 0.082 -0.017 1.00 0.00 H new ATOM 0 HG3 ARG B 46 5.281 -0.782 0.060 1.00 0.00 H new ATOM 0 HD2 ARG B 46 4.821 1.944 1.311 1.00 0.00 H new ATOM 0 HD3 ARG B 46 4.630 0.431 2.175 1.00 0.00 H new ATOM 0 HE ARG B 46 7.050 -0.018 1.686 1.00 0.00 H new ATOM 0 HH11 ARG B 46 5.899 3.352 1.590 1.00 0.00 H new ATOM 0 HH12 ARG B 46 7.499 3.997 1.974 1.00 0.00 H new ATOM 0 HH21 ARG B 46 8.986 0.813 2.228 1.00 0.00 H new ATOM 0 HH22 ARG B 46 9.236 2.559 2.334 1.00 0.00 H new ATOM 1570 N ARG B 47 2.742 1.612 -2.521 1.00 0.00 N ATOM 1571 CA ARG B 47 1.290 1.809 -2.495 1.00 0.00 C ATOM 1572 C ARG B 47 0.626 1.014 -3.598 1.00 0.00 C ATOM 1573 O ARG B 47 -0.349 0.303 -3.357 1.00 0.00 O ATOM 1574 CB ARG B 47 0.977 3.295 -2.651 1.00 0.00 C ATOM 1575 CG ARG B 47 -0.470 3.694 -2.395 1.00 0.00 C ATOM 1576 CD ARG B 47 -0.628 5.185 -2.606 1.00 0.00 C ATOM 1577 NE ARG B 47 -1.955 5.697 -2.250 1.00 0.00 N ATOM 1578 CZ ARG B 47 -2.242 7.001 -2.089 1.00 0.00 C ATOM 1579 NH1 ARG B 47 -1.334 7.929 -2.372 1.00 0.00 N ATOM 1580 NH2 ARG B 47 -3.443 7.374 -1.678 1.00 0.00 N ATOM 0 H ARG B 47 3.262 2.489 -2.558 1.00 0.00 H new ATOM 0 HA ARG B 47 0.900 1.456 -1.540 1.00 0.00 H new ATOM 0 HB2 ARG B 47 1.616 3.856 -1.969 1.00 0.00 H new ATOM 0 HB3 ARG B 47 1.246 3.600 -3.662 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -1.133 3.149 -3.067 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -0.757 3.427 -1.378 1.00 0.00 H new ATOM 0 HD2 ARG B 47 0.123 5.708 -2.014 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -0.428 5.417 -3.652 1.00 0.00 H new ATOM 0 HE ARG B 47 -2.708 5.022 -2.116 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -0.413 7.654 -2.714 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -1.558 8.916 -2.248 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -4.156 6.671 -1.482 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -3.656 8.364 -1.557 1.00 0.00 H new ATOM 1594 N ALA B 48 1.174 1.116 -4.796 1.00 0.00 N ATOM 1595 CA ALA B 48 0.685 0.364 -5.927 1.00 0.00 C ATOM 1596 C ALA B 48 0.728 -1.126 -5.628 1.00 0.00 C ATOM 1597 O ALA B 48 -0.292 -1.788 -5.702 1.00 0.00 O ATOM 1598 CB ALA B 48 1.480 0.687 -7.175 1.00 0.00 C ATOM 0 H ALA B 48 1.967 1.721 -5.007 1.00 0.00 H new ATOM 0 HA ALA B 48 -0.351 0.650 -6.108 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.093 0.108 -8.013 1.00 0.00 H new ATOM 0 HB2 ALA B 48 1.392 1.750 -7.397 1.00 0.00 H new ATOM 0 HB3 ALA B 48 2.528 0.435 -7.014 1.00 0.00 H new ATOM 1604 N ARG B 49 1.896 -1.625 -5.193 1.00 0.00 N ATOM 1605 CA ARG B 49 2.066 -3.047 -4.874 1.00 0.00 C ATOM 1606 C ARG B 49 1.111 -3.479 -3.757 1.00 0.00 C ATOM 1607 O ARG B 49 0.679 -4.604 -3.735 1.00 0.00 O ATOM 1608 CB ARG B 49 3.537 -3.380 -4.520 1.00 0.00 C ATOM 1609 CG ARG B 49 3.798 -4.829 -4.045 1.00 0.00 C ATOM 1610 CD ARG B 49 3.485 -5.898 -5.091 1.00 0.00 C ATOM 1611 NE ARG B 49 4.325 -5.805 -6.287 1.00 0.00 N ATOM 1612 CZ ARG B 49 4.659 -6.853 -7.072 1.00 0.00 C ATOM 1613 NH1 ARG B 49 4.441 -8.107 -6.667 1.00 0.00 N ATOM 1614 NH2 ARG B 49 5.281 -6.644 -8.219 1.00 0.00 N ATOM 0 H ARG B 49 2.736 -1.062 -5.055 1.00 0.00 H new ATOM 0 HA ARG B 49 1.812 -3.617 -5.768 1.00 0.00 H new ATOM 0 HB2 ARG B 49 4.156 -3.187 -5.396 1.00 0.00 H new ATOM 0 HB3 ARG B 49 3.868 -2.695 -3.739 1.00 0.00 H new ATOM 0 HG2 ARG B 49 4.844 -4.920 -3.751 1.00 0.00 H new ATOM 0 HG3 ARG B 49 3.199 -5.021 -3.155 1.00 0.00 H new ATOM 0 HD2 ARG B 49 3.612 -6.883 -4.642 1.00 0.00 H new ATOM 0 HD3 ARG B 49 2.438 -5.814 -5.384 1.00 0.00 H new ATOM 0 HE ARG B 49 4.683 -4.885 -6.545 1.00 0.00 H new ATOM 0 HH11 ARG B 49 4.018 -8.282 -5.756 1.00 0.00 H new ATOM 0 HH12 ARG B 49 4.698 -8.889 -7.269 1.00 0.00 H new ATOM 0 HH21 ARG B 49 5.508 -5.693 -8.510 1.00 0.00 H new ATOM 0 HH22 ARG B 49 5.534 -7.434 -8.813 1.00 0.00 H new ATOM 1628 N ILE B 50 0.791 -2.575 -2.843 1.00 0.00 N ATOM 1629 CA ILE B 50 -0.181 -2.845 -1.790 1.00 0.00 C ATOM 1630 C ILE B 50 -1.563 -3.114 -2.400 1.00 0.00 C ATOM 1631 O ILE B 50 -2.131 -4.184 -2.218 1.00 0.00 O ATOM 1632 CB ILE B 50 -0.266 -1.662 -0.786 1.00 0.00 C ATOM 1633 CG1 ILE B 50 1.070 -1.508 -0.058 1.00 0.00 C ATOM 1634 CG2 ILE B 50 -1.405 -1.880 0.212 1.00 0.00 C ATOM 1635 CD1 ILE B 50 1.192 -0.261 0.774 1.00 0.00 C ATOM 0 H ILE B 50 1.194 -1.639 -2.809 1.00 0.00 H new ATOM 0 HA ILE B 50 0.150 -3.730 -1.247 1.00 0.00 H new ATOM 0 HB ILE B 50 -0.476 -0.745 -1.337 1.00 0.00 H new ATOM 0 HG12 ILE B 50 1.219 -2.374 0.586 1.00 0.00 H new ATOM 0 HG13 ILE B 50 1.873 -1.517 -0.795 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -1.447 -1.040 0.906 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -2.350 -1.954 -0.325 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -1.230 -2.801 0.768 1.00 0.00 H new ATOM 0 HD11 ILE B 50 2.171 -0.237 1.252 1.00 0.00 H new ATOM 0 HD12 ILE B 50 1.079 0.615 0.135 1.00 0.00 H new ATOM 0 HD13 ILE B 50 0.415 -0.256 1.538 1.00 0.00 H new ATOM 1647 N ASN B 51 -2.061 -2.164 -3.171 1.00 0.00 N ATOM 1648 CA ASN B 51 -3.390 -2.302 -3.786 1.00 0.00 C ATOM 1649 C ASN B 51 -3.425 -3.478 -4.741 1.00 0.00 C ATOM 1650 O ASN B 51 -4.409 -4.217 -4.800 1.00 0.00 O ATOM 1651 CB ASN B 51 -3.828 -1.032 -4.527 1.00 0.00 C ATOM 1652 CG ASN B 51 -4.003 0.171 -3.627 1.00 0.00 C ATOM 1653 OD1 ASN B 51 -5.068 0.382 -3.043 1.00 0.00 O ATOM 1654 ND2 ASN B 51 -2.982 0.975 -3.521 1.00 0.00 N ATOM 0 H ASN B 51 -1.579 -1.293 -3.391 1.00 0.00 H new ATOM 0 HA ASN B 51 -4.090 -2.473 -2.968 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -3.089 -0.796 -5.293 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -4.769 -1.229 -5.041 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -3.049 1.811 -2.940 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -2.116 0.768 -4.019 1.00 0.00 H new ATOM 1661 N GLU B 52 -2.340 -3.662 -5.458 1.00 0.00 N ATOM 1662 CA GLU B 52 -2.211 -4.749 -6.410 1.00 0.00 C ATOM 1663 C GLU B 52 -2.121 -6.115 -5.722 1.00 0.00 C ATOM 1664 O GLU B 52 -2.712 -7.086 -6.211 1.00 0.00 O ATOM 1665 CB GLU B 52 -1.018 -4.522 -7.338 1.00 0.00 C ATOM 1666 CG GLU B 52 -1.141 -3.282 -8.216 1.00 0.00 C ATOM 1667 CD GLU B 52 -2.188 -3.400 -9.299 1.00 0.00 C ATOM 1668 OE1 GLU B 52 -3.407 -3.479 -8.995 1.00 0.00 O ATOM 1669 OE2 GLU B 52 -1.809 -3.371 -10.496 1.00 0.00 O ATOM 0 H GLU B 52 -1.518 -3.062 -5.399 1.00 0.00 H new ATOM 0 HA GLU B 52 -3.119 -4.757 -7.013 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -0.113 -4.440 -6.736 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -0.897 -5.396 -7.977 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -1.379 -2.425 -7.586 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -0.175 -3.079 -8.679 1.00 0.00 H new ATOM 1676 N SER B 53 -1.432 -6.206 -4.571 1.00 0.00 N ATOM 1677 CA SER B 53 -1.330 -7.476 -3.898 1.00 0.00 C ATOM 1678 C SER B 53 -2.658 -7.831 -3.282 1.00 0.00 C ATOM 1679 O SER B 53 -3.068 -8.974 -3.307 1.00 0.00 O ATOM 1680 CB SER B 53 -0.178 -7.503 -2.883 1.00 0.00 C ATOM 1681 OG SER B 53 -0.223 -6.389 -2.025 1.00 0.00 O ATOM 0 H SER B 53 -0.956 -5.429 -4.112 1.00 0.00 H new ATOM 0 HA SER B 53 -1.083 -8.242 -4.633 1.00 0.00 H new ATOM 0 HB2 SER B 53 -0.231 -8.419 -2.295 1.00 0.00 H new ATOM 0 HB3 SER B 53 0.775 -7.518 -3.412 1.00 0.00 H new ATOM 0 HG SER B 53 0.091 -5.594 -2.504 1.00 0.00 H new ATOM 1687 N LEU B 54 -3.352 -6.816 -2.795 1.00 0.00 N ATOM 1688 CA LEU B 54 -4.676 -6.963 -2.252 1.00 0.00 C ATOM 1689 C LEU B 54 -5.645 -7.390 -3.384 1.00 0.00 C ATOM 1690 O LEU B 54 -6.537 -8.225 -3.183 1.00 0.00 O ATOM 1691 CB LEU B 54 -5.081 -5.608 -1.654 1.00 0.00 C ATOM 1692 CG LEU B 54 -6.130 -5.602 -0.544 1.00 0.00 C ATOM 1693 CD1 LEU B 54 -6.200 -4.226 0.068 1.00 0.00 C ATOM 1694 CD2 LEU B 54 -7.507 -6.004 -1.040 1.00 0.00 C ATOM 0 H LEU B 54 -3.000 -5.859 -2.769 1.00 0.00 H new ATOM 0 HA LEU B 54 -4.710 -7.728 -1.477 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -4.181 -5.131 -1.266 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -5.449 -4.981 -2.466 1.00 0.00 H new ATOM 0 HG LEU B 54 -5.824 -6.340 0.198 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -6.948 -4.218 0.861 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -5.227 -3.963 0.484 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -6.475 -3.501 -0.698 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -8.213 -5.983 -0.210 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -7.833 -5.307 -1.812 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -7.465 -7.011 -1.455 1.00 0.00 H new ATOM 1706 N SER B 55 -5.436 -6.833 -4.569 1.00 0.00 N ATOM 1707 CA SER B 55 -6.258 -7.120 -5.725 1.00 0.00 C ATOM 1708 C SER B 55 -6.125 -8.600 -6.128 1.00 0.00 C ATOM 1709 O SER B 55 -7.130 -9.300 -6.284 1.00 0.00 O ATOM 1710 CB SER B 55 -5.888 -6.182 -6.890 1.00 0.00 C ATOM 1711 OG SER B 55 -6.765 -6.330 -8.001 1.00 0.00 O ATOM 0 H SER B 55 -4.686 -6.166 -4.751 1.00 0.00 H new ATOM 0 HA SER B 55 -7.302 -6.940 -5.469 1.00 0.00 H new ATOM 0 HB2 SER B 55 -5.914 -5.149 -6.544 1.00 0.00 H new ATOM 0 HB3 SER B 55 -4.865 -6.386 -7.207 1.00 0.00 H new ATOM 0 HG SER B 55 -6.495 -5.716 -8.715 1.00 0.00 H new ATOM 1717 N GLN B 56 -4.900 -9.088 -6.255 1.00 0.00 N ATOM 1718 CA GLN B 56 -4.693 -10.494 -6.603 1.00 0.00 C ATOM 1719 C GLN B 56 -5.111 -11.397 -5.452 1.00 0.00 C ATOM 1720 O GLN B 56 -5.548 -12.523 -5.665 1.00 0.00 O ATOM 1721 CB GLN B 56 -3.244 -10.775 -7.010 1.00 0.00 C ATOM 1722 CG GLN B 56 -2.231 -10.399 -6.003 1.00 0.00 C ATOM 1723 CD GLN B 56 -0.867 -10.759 -6.470 1.00 0.00 C ATOM 1724 OE1 GLN B 56 -0.670 -11.765 -7.139 1.00 0.00 O ATOM 1725 NE2 GLN B 56 0.040 -9.904 -6.268 1.00 0.00 N ATOM 0 H GLN B 56 -4.045 -8.546 -6.126 1.00 0.00 H new ATOM 0 HA GLN B 56 -5.321 -10.712 -7.467 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -3.143 -11.838 -7.227 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -3.031 -10.240 -7.935 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -2.284 -9.328 -5.810 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -2.443 -10.904 -5.061 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -0.156 -9.076 -5.706 1.00 0.00 H new ATOM 0 HE22 GLN B 56 0.969 -10.042 -6.667 1.00 0.00 H new ATOM 1734 N LEU B 57 -5.017 -10.868 -4.245 1.00 0.00 N ATOM 1735 CA LEU B 57 -5.358 -11.589 -3.044 1.00 0.00 C ATOM 1736 C LEU B 57 -6.822 -11.996 -3.078 1.00 0.00 C ATOM 1737 O LEU B 57 -7.127 -13.180 -3.067 1.00 0.00 O ATOM 1738 CB LEU B 57 -5.016 -10.709 -1.819 1.00 0.00 C ATOM 1739 CG LEU B 57 -5.133 -11.309 -0.420 1.00 0.00 C ATOM 1740 CD1 LEU B 57 -4.292 -10.493 0.548 1.00 0.00 C ATOM 1741 CD2 LEU B 57 -6.568 -11.296 0.048 1.00 0.00 C ATOM 0 H LEU B 57 -4.697 -9.914 -4.075 1.00 0.00 H new ATOM 0 HA LEU B 57 -4.778 -12.509 -2.971 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -3.991 -10.358 -1.942 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -5.660 -9.830 -1.855 1.00 0.00 H new ATOM 0 HG LEU B 57 -4.781 -12.340 -0.454 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -4.373 -10.918 1.548 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -3.250 -10.511 0.229 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -4.649 -9.463 0.562 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -6.629 -11.728 1.047 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -6.933 -10.269 0.074 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -7.180 -11.881 -0.638 1.00 0.00 H new ATOM 1753 N LYS B 58 -7.714 -11.014 -3.183 1.00 0.00 N ATOM 1754 CA LYS B 58 -9.158 -11.286 -3.254 1.00 0.00 C ATOM 1755 C LYS B 58 -9.477 -12.201 -4.442 1.00 0.00 C ATOM 1756 O LYS B 58 -10.280 -13.130 -4.322 1.00 0.00 O ATOM 1757 CB LYS B 58 -9.992 -9.987 -3.351 1.00 0.00 C ATOM 1758 CG LYS B 58 -9.645 -9.127 -4.550 1.00 0.00 C ATOM 1759 CD LYS B 58 -10.659 -8.041 -4.816 1.00 0.00 C ATOM 1760 CE LYS B 58 -10.252 -7.247 -6.044 1.00 0.00 C ATOM 1761 NZ LYS B 58 -11.284 -6.285 -6.472 1.00 0.00 N ATOM 0 H LYS B 58 -7.469 -10.024 -3.221 1.00 0.00 H new ATOM 0 HA LYS B 58 -9.433 -11.789 -2.327 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -11.049 -10.247 -3.396 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -9.846 -9.403 -2.442 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -8.667 -8.672 -4.392 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -9.562 -9.762 -5.432 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -11.645 -8.480 -4.966 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -10.733 -7.380 -3.952 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -9.327 -6.710 -5.834 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -10.042 -7.935 -6.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -10.952 -5.772 -7.314 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -12.161 -6.795 -6.701 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -11.468 -5.608 -5.704 1.00 0.00 H new ATOM 1775 N THR B 59 -8.780 -11.964 -5.556 1.00 0.00 N ATOM 1776 CA THR B 59 -8.965 -12.713 -6.776 1.00 0.00 C ATOM 1777 C THR B 59 -8.706 -14.212 -6.543 1.00 0.00 C ATOM 1778 O THR B 59 -9.559 -15.050 -6.851 1.00 0.00 O ATOM 1779 CB THR B 59 -8.033 -12.170 -7.895 1.00 0.00 C ATOM 1780 OG1 THR B 59 -8.306 -10.768 -8.129 1.00 0.00 O ATOM 1781 CG2 THR B 59 -8.218 -12.943 -9.194 1.00 0.00 C ATOM 0 H THR B 59 -8.067 -11.237 -5.625 1.00 0.00 H new ATOM 0 HA THR B 59 -10.000 -12.591 -7.095 1.00 0.00 H new ATOM 0 HB THR B 59 -7.003 -12.296 -7.561 1.00 0.00 H new ATOM 0 HG1 THR B 59 -7.678 -10.222 -7.612 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.552 -12.538 -9.956 1.00 0.00 H new ATOM 0 HG22 THR B 59 -7.984 -13.994 -9.028 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.251 -12.850 -9.529 1.00 0.00 H new ATOM 1789 N LEU B 60 -7.552 -14.538 -5.975 1.00 0.00 N ATOM 1790 CA LEU B 60 -7.199 -15.922 -5.719 1.00 0.00 C ATOM 1791 C LEU B 60 -7.924 -16.510 -4.522 1.00 0.00 C ATOM 1792 O LEU B 60 -8.180 -17.698 -4.491 1.00 0.00 O ATOM 1793 CB LEU B 60 -5.677 -16.161 -5.650 1.00 0.00 C ATOM 1794 CG LEU B 60 -4.910 -16.225 -6.999 1.00 0.00 C ATOM 1795 CD1 LEU B 60 -5.472 -17.323 -7.897 1.00 0.00 C ATOM 1796 CD2 LEU B 60 -4.907 -14.890 -7.729 1.00 0.00 C ATOM 0 H LEU B 60 -6.847 -13.861 -5.684 1.00 0.00 H new ATOM 0 HA LEU B 60 -7.553 -16.469 -6.593 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -5.237 -15.366 -5.048 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -5.505 -17.097 -5.118 1.00 0.00 H new ATOM 0 HG LEU B 60 -3.874 -16.465 -6.758 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -4.917 -17.346 -8.835 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -5.378 -18.286 -7.396 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -6.523 -17.122 -8.103 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -4.358 -14.989 -8.666 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -5.933 -14.588 -7.940 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -4.428 -14.135 -7.105 1.00 0.00 H new ATOM 1808 N ILE B 61 -8.268 -15.691 -3.549 1.00 0.00 N ATOM 1809 CA ILE B 61 -9.028 -16.173 -2.401 1.00 0.00 C ATOM 1810 C ILE B 61 -10.410 -16.634 -2.840 1.00 0.00 C ATOM 1811 O ILE B 61 -10.844 -17.740 -2.508 1.00 0.00 O ATOM 1812 CB ILE B 61 -9.144 -15.115 -1.258 1.00 0.00 C ATOM 1813 CG1 ILE B 61 -7.785 -14.887 -0.593 1.00 0.00 C ATOM 1814 CG2 ILE B 61 -10.180 -15.520 -0.213 1.00 0.00 C ATOM 1815 CD1 ILE B 61 -7.195 -16.127 0.051 1.00 0.00 C ATOM 0 H ILE B 61 -8.039 -14.697 -3.524 1.00 0.00 H new ATOM 0 HA ILE B 61 -8.475 -17.017 -1.989 1.00 0.00 H new ATOM 0 HB ILE B 61 -9.477 -14.182 -1.713 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.086 -14.511 -1.340 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -7.889 -14.111 0.166 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.230 -14.758 0.564 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.156 -15.619 -0.688 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -9.895 -16.473 0.232 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -6.232 -15.881 0.500 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -7.872 -16.493 0.823 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.056 -16.899 -0.706 1.00 0.00 H new ATOM 1827 N LEU B 62 -11.077 -15.827 -3.628 1.00 0.00 N ATOM 1828 CA LEU B 62 -12.402 -16.176 -4.071 1.00 0.00 C ATOM 1829 C LEU B 62 -12.290 -17.320 -5.090 1.00 0.00 C ATOM 1830 O LEU B 62 -13.155 -18.153 -5.184 1.00 0.00 O ATOM 1831 CB LEU B 62 -13.100 -14.937 -4.672 1.00 0.00 C ATOM 1832 CG LEU B 62 -14.653 -14.880 -4.628 1.00 0.00 C ATOM 1833 CD1 LEU B 62 -15.321 -15.972 -5.447 1.00 0.00 C ATOM 1834 CD2 LEU B 62 -15.158 -14.895 -3.183 1.00 0.00 C ATOM 0 H LEU B 62 -10.728 -14.933 -3.972 1.00 0.00 H new ATOM 0 HA LEU B 62 -13.011 -16.514 -3.232 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -12.719 -14.056 -4.156 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -12.792 -14.853 -5.714 1.00 0.00 H new ATOM 0 HG LEU B 62 -14.936 -13.936 -5.093 1.00 0.00 H new ATOM 0 HD11 LEU B 62 -16.404 -15.873 -5.372 1.00 0.00 H new ATOM 0 HD12 LEU B 62 -15.020 -15.880 -6.491 1.00 0.00 H new ATOM 0 HD13 LEU B 62 -15.019 -16.948 -5.067 1.00 0.00 H new ATOM 0 HD21 LEU B 62 -16.247 -14.854 -3.178 1.00 0.00 H new ATOM 0 HD22 LEU B 62 -14.827 -15.810 -2.691 1.00 0.00 H new ATOM 0 HD23 LEU B 62 -14.760 -14.032 -2.650 1.00 0.00 H new ATOM 1846 N ASP B 63 -11.174 -17.378 -5.777 1.00 0.00 N ATOM 1847 CA ASP B 63 -10.928 -18.398 -6.804 1.00 0.00 C ATOM 1848 C ASP B 63 -10.670 -19.745 -6.179 1.00 0.00 C ATOM 1849 O ASP B 63 -11.043 -20.761 -6.711 1.00 0.00 O ATOM 1850 CB ASP B 63 -9.693 -18.054 -7.560 1.00 0.00 C ATOM 1851 CG ASP B 63 -9.624 -18.697 -8.913 1.00 0.00 C ATOM 1852 OD1 ASP B 63 -9.125 -19.845 -9.046 1.00 0.00 O ATOM 1853 OD2 ASP B 63 -10.056 -18.051 -9.894 1.00 0.00 O ATOM 0 H ASP B 63 -10.401 -16.724 -5.650 1.00 0.00 H new ATOM 0 HA ASP B 63 -11.809 -18.432 -7.445 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -9.637 -16.972 -7.677 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -8.823 -18.357 -6.977 1.00 0.00 H new ATOM 1858 N ALA B 64 -9.980 -19.741 -5.078 1.00 0.00 N ATOM 1859 CA ALA B 64 -9.623 -20.957 -4.411 1.00 0.00 C ATOM 1860 C ALA B 64 -10.737 -21.450 -3.550 1.00 0.00 C ATOM 1861 O ALA B 64 -11.048 -22.629 -3.545 1.00 0.00 O ATOM 1862 CB ALA B 64 -8.370 -20.776 -3.585 1.00 0.00 C ATOM 0 H ALA B 64 -9.648 -18.894 -4.617 1.00 0.00 H new ATOM 0 HA ALA B 64 -9.427 -21.704 -5.181 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -8.122 -21.715 -3.090 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -7.546 -20.479 -4.234 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -8.537 -20.003 -2.835 1.00 0.00 H new ATOM 1868 N LEU B 65 -11.359 -20.552 -2.840 1.00 0.00 N ATOM 1869 CA LEU B 65 -12.401 -20.942 -1.919 1.00 0.00 C ATOM 1870 C LEU B 65 -13.724 -21.098 -2.632 1.00 0.00 C ATOM 1871 O LEU B 65 -14.544 -21.927 -2.244 1.00 0.00 O ATOM 1872 CB LEU B 65 -12.507 -19.985 -0.713 1.00 0.00 C ATOM 1873 CG LEU B 65 -11.380 -20.080 0.360 1.00 0.00 C ATOM 1874 CD1 LEU B 65 -10.023 -19.613 -0.146 1.00 0.00 C ATOM 1875 CD2 LEU B 65 -11.771 -19.346 1.634 1.00 0.00 C ATOM 0 H LEU B 65 -11.168 -19.551 -2.877 1.00 0.00 H new ATOM 0 HA LEU B 65 -12.125 -21.915 -1.513 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -12.531 -18.963 -1.091 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -13.462 -20.165 -0.220 1.00 0.00 H new ATOM 0 HG LEU B 65 -11.270 -21.140 0.589 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -9.286 -19.706 0.651 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -9.720 -20.227 -0.994 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -10.090 -18.571 -0.458 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -10.966 -19.430 2.364 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -11.948 -18.294 1.408 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -12.679 -19.787 2.044 1.00 0.00 H new ATOM 1887 N LYS B 66 -13.892 -20.319 -3.696 1.00 0.00 N ATOM 1888 CA LYS B 66 -15.077 -20.327 -4.542 1.00 0.00 C ATOM 1889 C LYS B 66 -16.352 -20.229 -3.767 1.00 0.00 C ATOM 1890 O LYS B 66 -17.102 -21.200 -3.608 1.00 0.00 O ATOM 1891 CB LYS B 66 -15.049 -21.469 -5.536 1.00 0.00 C ATOM 1892 CG LYS B 66 -14.045 -21.234 -6.655 1.00 0.00 C ATOM 1893 CD LYS B 66 -13.632 -22.523 -7.328 1.00 0.00 C ATOM 1894 CE LYS B 66 -12.734 -23.336 -6.403 1.00 0.00 C ATOM 1895 NZ LYS B 66 -12.200 -24.547 -7.061 1.00 0.00 N ATOM 0 H LYS B 66 -13.188 -19.647 -4.000 1.00 0.00 H new ATOM 0 HA LYS B 66 -15.050 -19.413 -5.135 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -14.801 -22.394 -5.016 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -16.043 -21.600 -5.964 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -14.479 -20.562 -7.395 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -13.163 -20.737 -6.251 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -14.516 -23.104 -7.591 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -13.106 -22.304 -8.257 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -11.905 -22.713 -6.065 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -13.297 -23.626 -5.516 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -11.596 -25.067 -6.393 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -12.988 -25.156 -7.361 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -11.640 -24.272 -7.893 1.00 0.00 H new ATOM 1909 N LYS B 67 -16.516 -19.084 -3.174 1.00 0.00 N ATOM 1910 CA LYS B 67 -17.707 -18.785 -2.423 1.00 0.00 C ATOM 1911 C LYS B 67 -18.805 -18.296 -3.355 1.00 0.00 C ATOM 1912 O LYS B 67 -19.758 -19.031 -3.633 1.00 0.00 O ATOM 1913 CB LYS B 67 -17.422 -17.775 -1.308 1.00 0.00 C ATOM 1914 CG LYS B 67 -16.417 -18.276 -0.287 1.00 0.00 C ATOM 1915 CD LYS B 67 -16.235 -17.301 0.860 1.00 0.00 C ATOM 1916 CE LYS B 67 -15.277 -17.864 1.901 1.00 0.00 C ATOM 1917 NZ LYS B 67 -15.799 -19.097 2.536 1.00 0.00 N ATOM 0 H LYS B 67 -15.831 -18.329 -3.195 1.00 0.00 H new ATOM 0 HA LYS B 67 -18.052 -19.700 -1.942 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -17.050 -16.851 -1.751 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -18.355 -17.532 -0.800 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -16.748 -19.238 0.105 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -15.457 -18.443 -0.776 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -15.851 -16.354 0.481 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -17.200 -17.092 1.322 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -14.317 -18.078 1.430 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -15.095 -17.112 2.668 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -15.276 -19.283 3.415 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -16.809 -18.975 2.753 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -15.679 -19.900 1.886 1.00 0.00 H new ATOM 1931 N ASP B 68 -18.666 -17.070 -3.857 1.00 0.00 N ATOM 1932 CA ASP B 68 -19.632 -16.504 -4.797 1.00 0.00 C ATOM 1933 C ASP B 68 -19.144 -15.191 -5.251 1.00 0.00 C ATOM 1934 O ASP B 68 -18.395 -14.521 -4.524 1.00 0.00 O ATOM 1935 CB ASP B 68 -20.984 -16.293 -4.167 1.00 0.00 C ATOM 1936 CG ASP B 68 -22.062 -16.063 -5.173 1.00 0.00 C ATOM 1937 OD1 ASP B 68 -22.474 -17.018 -5.860 1.00 0.00 O ATOM 1938 OD2 ASP B 68 -22.527 -14.933 -5.286 1.00 0.00 O ATOM 0 H ASP B 68 -17.891 -16.448 -3.627 1.00 0.00 H new ATOM 0 HA ASP B 68 -19.736 -17.210 -5.621 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -21.238 -17.164 -3.562 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -20.936 -15.439 -3.492 1.00 0.00 H new ATOM 1943 N SER B 69 -19.580 -14.788 -6.392 1.00 0.00 N ATOM 1944 CA SER B 69 -19.150 -13.573 -6.952 1.00 0.00 C ATOM 1945 C SER B 69 -19.906 -12.371 -6.355 1.00 0.00 C ATOM 1946 O SER B 69 -19.344 -11.272 -6.241 1.00 0.00 O ATOM 1947 CB SER B 69 -19.254 -13.627 -8.485 1.00 0.00 C ATOM 1948 OG SER B 69 -18.786 -12.436 -9.102 1.00 0.00 O ATOM 0 H SER B 69 -20.251 -15.303 -6.962 1.00 0.00 H new ATOM 0 HA SER B 69 -18.101 -13.428 -6.696 1.00 0.00 H new ATOM 0 HB2 SER B 69 -18.679 -14.475 -8.856 1.00 0.00 H new ATOM 0 HB3 SER B 69 -20.292 -13.797 -8.770 1.00 0.00 H new ATOM 0 HG SER B 69 -18.870 -12.517 -10.075 1.00 0.00 H new ATOM 1954 N SER B 70 -21.139 -12.587 -5.932 1.00 0.00 N ATOM 1955 CA SER B 70 -21.969 -11.517 -5.430 1.00 0.00 C ATOM 1956 C SER B 70 -21.367 -10.927 -4.150 1.00 0.00 C ATOM 1957 O SER B 70 -21.201 -9.702 -4.033 1.00 0.00 O ATOM 1958 CB SER B 70 -23.401 -12.021 -5.201 1.00 0.00 C ATOM 1959 OG SER B 70 -24.287 -10.956 -4.885 1.00 0.00 O ATOM 0 H SER B 70 -21.587 -13.504 -5.928 1.00 0.00 H new ATOM 0 HA SER B 70 -22.010 -10.720 -6.172 1.00 0.00 H new ATOM 0 HB2 SER B 70 -23.754 -12.535 -6.095 1.00 0.00 H new ATOM 0 HB3 SER B 70 -23.405 -12.751 -4.391 1.00 0.00 H new ATOM 0 HG SER B 70 -25.190 -11.311 -4.747 1.00 0.00 H new ATOM 1965 N ARG B 71 -20.968 -11.796 -3.223 1.00 0.00 N ATOM 1966 CA ARG B 71 -20.368 -11.338 -1.978 1.00 0.00 C ATOM 1967 C ARG B 71 -18.998 -10.727 -2.246 1.00 0.00 C ATOM 1968 O ARG B 71 -18.626 -9.744 -1.633 1.00 0.00 O ATOM 1969 CB ARG B 71 -20.247 -12.464 -0.973 1.00 0.00 C ATOM 1970 CG ARG B 71 -19.376 -13.597 -1.439 1.00 0.00 C ATOM 1971 CD ARG B 71 -19.064 -14.512 -0.325 1.00 0.00 C ATOM 1972 NE ARG B 71 -20.252 -15.223 0.168 1.00 0.00 N ATOM 1973 CZ ARG B 71 -20.732 -15.205 1.429 1.00 0.00 C ATOM 1974 NH1 ARG B 71 -20.219 -14.392 2.341 1.00 0.00 N ATOM 1975 NH2 ARG B 71 -21.763 -15.978 1.747 1.00 0.00 N ATOM 0 H ARG B 71 -21.049 -12.809 -3.311 1.00 0.00 H new ATOM 0 HA ARG B 71 -21.024 -10.578 -1.553 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -19.844 -12.066 -0.042 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -21.242 -12.850 -0.751 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -19.880 -14.145 -2.235 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -18.452 -13.201 -1.860 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -18.320 -15.238 -0.653 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -18.618 -13.945 0.493 1.00 0.00 H new ATOM 0 HE ARG B 71 -20.765 -15.786 -0.511 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -19.451 -13.768 2.094 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -20.593 -14.390 3.290 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -22.186 -16.580 1.040 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -22.132 -15.970 2.698 1.00 0.00 H new ATOM 1989 N HIS B 72 -18.252 -11.337 -3.163 1.00 0.00 N ATOM 1990 CA HIS B 72 -16.949 -10.817 -3.597 1.00 0.00 C ATOM 1991 C HIS B 72 -17.076 -9.372 -4.128 1.00 0.00 C ATOM 1992 O HIS B 72 -16.199 -8.540 -3.908 1.00 0.00 O ATOM 1993 CB HIS B 72 -16.346 -11.739 -4.663 1.00 0.00 C ATOM 1994 CG HIS B 72 -14.938 -11.388 -5.082 1.00 0.00 C ATOM 1995 ND1 HIS B 72 -14.493 -11.421 -6.380 1.00 0.00 N ATOM 1996 CD2 HIS B 72 -13.864 -11.035 -4.332 1.00 0.00 C ATOM 1997 CE1 HIS B 72 -13.201 -11.101 -6.387 1.00 0.00 C ATOM 1998 NE2 HIS B 72 -12.767 -10.855 -5.164 1.00 0.00 N ATOM 0 H HIS B 72 -18.528 -12.202 -3.627 1.00 0.00 H new ATOM 0 HA HIS B 72 -16.282 -10.794 -2.736 1.00 0.00 H new ATOM 0 HB2 HIS B 72 -16.353 -12.761 -4.285 1.00 0.00 H new ATOM 0 HB3 HIS B 72 -16.987 -11.720 -5.544 1.00 0.00 H new ATOM 0 HD1 HIS B 72 -15.056 -11.651 -7.199 1.00 0.00 H new ATOM 0 HD2 HIS B 72 -13.863 -10.913 -3.259 1.00 0.00 H new ATOM 0 HE1 HIS B 72 -12.589 -11.049 -7.275 1.00 0.00 H new ATOM 2006 N SER B 73 -18.203 -9.071 -4.756 1.00 0.00 N ATOM 2007 CA SER B 73 -18.467 -7.735 -5.294 1.00 0.00 C ATOM 2008 C SER B 73 -18.873 -6.749 -4.185 1.00 0.00 C ATOM 2009 O SER B 73 -19.124 -5.564 -4.421 1.00 0.00 O ATOM 2010 CB SER B 73 -19.531 -7.819 -6.377 1.00 0.00 C ATOM 2011 OG SER B 73 -19.137 -8.742 -7.384 1.00 0.00 O ATOM 0 H SER B 73 -18.959 -9.738 -4.909 1.00 0.00 H new ATOM 0 HA SER B 73 -17.547 -7.351 -5.736 1.00 0.00 H new ATOM 0 HB2 SER B 73 -20.480 -8.130 -5.941 1.00 0.00 H new ATOM 0 HB3 SER B 73 -19.690 -6.835 -6.818 1.00 0.00 H new ATOM 0 HG SER B 73 -19.190 -9.654 -7.030 1.00 0.00 H new ATOM 2017 N LYS B 74 -18.937 -7.254 -2.999 1.00 0.00 N ATOM 2018 CA LYS B 74 -19.219 -6.481 -1.834 1.00 0.00 C ATOM 2019 C LYS B 74 -17.984 -6.372 -0.976 1.00 0.00 C ATOM 2020 O LYS B 74 -17.771 -5.366 -0.304 1.00 0.00 O ATOM 2021 CB LYS B 74 -20.490 -7.044 -1.091 1.00 0.00 C ATOM 2022 CG LYS B 74 -20.678 -6.611 0.368 1.00 0.00 C ATOM 2023 CD LYS B 74 -19.769 -7.440 1.245 1.00 0.00 C ATOM 2024 CE LYS B 74 -18.993 -6.602 2.244 1.00 0.00 C ATOM 2025 NZ LYS B 74 -19.812 -5.992 3.296 1.00 0.00 N ATOM 0 H LYS B 74 -18.790 -8.245 -2.807 1.00 0.00 H new ATOM 0 HA LYS B 74 -19.479 -5.459 -2.110 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -21.374 -6.743 -1.653 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -20.448 -8.133 -1.121 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -20.446 -5.552 0.480 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -21.717 -6.744 0.670 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -20.364 -8.179 1.782 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -19.068 -7.990 0.617 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -18.233 -7.228 2.711 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -18.469 -5.812 1.706 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -19.254 -5.271 3.796 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -20.650 -5.547 2.870 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -20.114 -6.725 3.969 1.00 0.00 H new ATOM 2039 N LEU B 75 -17.178 -7.388 -1.082 1.00 0.00 N ATOM 2040 CA LEU B 75 -16.006 -7.638 -0.248 1.00 0.00 C ATOM 2041 C LEU B 75 -15.157 -6.408 -0.039 1.00 0.00 C ATOM 2042 O LEU B 75 -14.549 -5.870 -0.982 1.00 0.00 O ATOM 2043 CB LEU B 75 -15.192 -8.808 -0.813 1.00 0.00 C ATOM 2044 CG LEU B 75 -14.725 -9.854 0.209 1.00 0.00 C ATOM 2045 CD1 LEU B 75 -15.912 -10.485 0.914 1.00 0.00 C ATOM 2046 CD2 LEU B 75 -13.882 -10.930 -0.450 1.00 0.00 C ATOM 0 H LEU B 75 -17.316 -8.112 -1.787 1.00 0.00 H new ATOM 0 HA LEU B 75 -16.366 -7.914 0.743 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -15.793 -9.311 -1.571 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -14.314 -8.405 -1.318 1.00 0.00 H new ATOM 0 HG LEU B 75 -14.109 -9.339 0.947 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -15.558 -11.223 1.634 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -16.478 -9.713 1.435 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -16.554 -10.973 0.180 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -13.567 -11.655 0.300 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -14.470 -11.434 -1.218 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -13.003 -10.475 -0.906 1.00 0.00 H new ATOM 2058 N GLU B 76 -15.181 -5.948 1.188 1.00 0.00 N ATOM 2059 CA GLU B 76 -14.452 -4.806 1.628 1.00 0.00 C ATOM 2060 C GLU B 76 -13.071 -5.235 1.997 1.00 0.00 C ATOM 2061 O GLU B 76 -12.831 -6.424 2.183 1.00 0.00 O ATOM 2062 CB GLU B 76 -15.147 -4.212 2.841 1.00 0.00 C ATOM 2063 CG GLU B 76 -16.492 -3.592 2.517 1.00 0.00 C ATOM 2064 CD GLU B 76 -17.303 -3.237 3.734 1.00 0.00 C ATOM 2065 OE1 GLU B 76 -16.860 -2.406 4.542 1.00 0.00 O ATOM 2066 OE2 GLU B 76 -18.453 -3.745 3.856 1.00 0.00 O ATOM 0 H GLU B 76 -15.733 -6.382 1.928 1.00 0.00 H new ATOM 0 HA GLU B 76 -14.405 -4.057 0.837 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -15.285 -4.992 3.590 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -14.503 -3.453 3.285 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -16.334 -2.693 1.922 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -17.063 -4.286 1.900 1.00 0.00 H new ATOM 2073 N LYS B 77 -12.173 -4.283 2.129 1.00 0.00 N ATOM 2074 CA LYS B 77 -10.797 -4.563 2.494 1.00 0.00 C ATOM 2075 C LYS B 77 -10.708 -5.370 3.789 1.00 0.00 C ATOM 2076 O LYS B 77 -9.941 -6.311 3.890 1.00 0.00 O ATOM 2077 CB LYS B 77 -10.012 -3.263 2.578 1.00 0.00 C ATOM 2078 CG LYS B 77 -8.604 -3.404 3.147 1.00 0.00 C ATOM 2079 CD LYS B 77 -7.663 -2.316 2.633 1.00 0.00 C ATOM 2080 CE LYS B 77 -8.252 -0.960 2.829 1.00 0.00 C ATOM 2081 NZ LYS B 77 -7.435 0.119 2.231 1.00 0.00 N ATOM 0 H LYS B 77 -12.374 -3.293 1.987 1.00 0.00 H new ATOM 0 HA LYS B 77 -10.350 -5.183 1.717 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -9.944 -2.830 1.580 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -10.569 -2.557 3.194 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -8.648 -3.360 4.235 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -8.204 -4.383 2.883 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -6.708 -2.380 3.155 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -7.459 -2.478 1.575 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -9.250 -0.937 2.391 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -8.368 -0.771 3.896 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -7.895 1.037 2.399 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -6.490 0.120 2.665 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -7.345 -0.040 1.207 1.00 0.00 H new ATOM 2095 N ALA B 78 -11.546 -5.029 4.734 1.00 0.00 N ATOM 2096 CA ALA B 78 -11.602 -5.731 6.006 1.00 0.00 C ATOM 2097 C ALA B 78 -12.102 -7.170 5.832 1.00 0.00 C ATOM 2098 O ALA B 78 -11.701 -8.068 6.575 1.00 0.00 O ATOM 2099 CB ALA B 78 -12.485 -4.979 6.983 1.00 0.00 C ATOM 0 H ALA B 78 -12.211 -4.260 4.651 1.00 0.00 H new ATOM 0 HA ALA B 78 -10.589 -5.778 6.407 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.518 -5.516 7.931 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.080 -3.980 7.145 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -13.493 -4.900 6.576 1.00 0.00 H new ATOM 2105 N ASP B 79 -12.928 -7.390 4.813 1.00 0.00 N ATOM 2106 CA ASP B 79 -13.502 -8.720 4.570 1.00 0.00 C ATOM 2107 C ASP B 79 -12.453 -9.570 3.925 1.00 0.00 C ATOM 2108 O ASP B 79 -12.148 -10.671 4.372 1.00 0.00 O ATOM 2109 CB ASP B 79 -14.713 -8.680 3.622 1.00 0.00 C ATOM 2110 CG ASP B 79 -15.939 -7.976 4.120 1.00 0.00 C ATOM 2111 OD1 ASP B 79 -16.587 -8.455 5.078 1.00 0.00 O ATOM 2112 OD2 ASP B 79 -16.310 -6.975 3.519 1.00 0.00 O ATOM 0 H ASP B 79 -13.216 -6.675 4.145 1.00 0.00 H new ATOM 0 HA ASP B 79 -13.834 -9.116 5.530 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -14.401 -8.203 2.693 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -14.987 -9.706 3.377 1.00 0.00 H new ATOM 2117 N ILE B 80 -11.918 -9.026 2.853 1.00 0.00 N ATOM 2118 CA ILE B 80 -10.844 -9.600 2.065 1.00 0.00 C ATOM 2119 C ILE B 80 -9.664 -10.033 2.950 1.00 0.00 C ATOM 2120 O ILE B 80 -9.212 -11.183 2.860 1.00 0.00 O ATOM 2121 CB ILE B 80 -10.390 -8.554 1.010 1.00 0.00 C ATOM 2122 CG1 ILE B 80 -11.559 -8.257 0.075 1.00 0.00 C ATOM 2123 CG2 ILE B 80 -9.192 -9.046 0.225 1.00 0.00 C ATOM 2124 CD1 ILE B 80 -11.412 -7.030 -0.778 1.00 0.00 C ATOM 0 H ILE B 80 -12.234 -8.128 2.488 1.00 0.00 H new ATOM 0 HA ILE B 80 -11.208 -10.497 1.564 1.00 0.00 H new ATOM 0 HB ILE B 80 -10.087 -7.641 1.523 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -11.705 -9.117 -0.579 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -12.464 -8.155 0.675 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -8.900 -8.291 -0.504 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -8.362 -9.232 0.907 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -9.451 -9.970 -0.293 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -12.297 -6.913 -1.403 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -11.301 -6.154 -0.139 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -10.531 -7.131 -1.412 1.00 0.00 H new ATOM 2136 N LEU B 81 -9.213 -9.130 3.816 1.00 0.00 N ATOM 2137 CA LEU B 81 -8.106 -9.399 4.745 1.00 0.00 C ATOM 2138 C LEU B 81 -8.415 -10.550 5.689 1.00 0.00 C ATOM 2139 O LEU B 81 -7.589 -11.444 5.870 1.00 0.00 O ATOM 2140 CB LEU B 81 -7.740 -8.151 5.549 1.00 0.00 C ATOM 2141 CG LEU B 81 -6.627 -7.238 5.005 1.00 0.00 C ATOM 2142 CD1 LEU B 81 -6.869 -6.829 3.554 1.00 0.00 C ATOM 2143 CD2 LEU B 81 -6.522 -6.007 5.888 1.00 0.00 C ATOM 0 H LEU B 81 -9.601 -8.190 3.898 1.00 0.00 H new ATOM 0 HA LEU B 81 -7.252 -9.687 4.132 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.642 -7.548 5.658 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -7.449 -8.472 6.549 1.00 0.00 H new ATOM 0 HG LEU B 81 -5.691 -7.797 5.023 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -6.056 -6.186 3.217 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -6.911 -7.720 2.927 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -7.813 -6.289 3.481 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -5.735 -5.354 5.510 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -7.472 -5.472 5.881 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.283 -6.310 6.908 1.00 0.00 H new ATOM 2155 N GLU B 82 -9.604 -10.548 6.285 1.00 0.00 N ATOM 2156 CA GLU B 82 -9.973 -11.620 7.172 1.00 0.00 C ATOM 2157 C GLU B 82 -10.067 -12.916 6.397 1.00 0.00 C ATOM 2158 O GLU B 82 -9.631 -13.947 6.863 1.00 0.00 O ATOM 2159 CB GLU B 82 -11.296 -11.328 7.887 1.00 0.00 C ATOM 2160 CG GLU B 82 -11.807 -12.456 8.726 1.00 0.00 C ATOM 2161 CD GLU B 82 -13.173 -12.208 9.303 1.00 0.00 C ATOM 2162 OE1 GLU B 82 -13.299 -11.513 10.336 1.00 0.00 O ATOM 2163 OE2 GLU B 82 -14.164 -12.705 8.726 1.00 0.00 O ATOM 0 H GLU B 82 -10.311 -9.823 6.166 1.00 0.00 H new ATOM 0 HA GLU B 82 -9.201 -11.711 7.936 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -11.167 -10.450 8.520 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -12.050 -11.075 7.141 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -11.836 -13.363 8.122 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -11.106 -12.638 9.540 1.00 0.00 H new ATOM 2170 N MET B 83 -10.566 -12.829 5.178 1.00 0.00 N ATOM 2171 CA MET B 83 -10.798 -13.988 4.339 1.00 0.00 C ATOM 2172 C MET B 83 -9.477 -14.712 4.043 1.00 0.00 C ATOM 2173 O MET B 83 -9.449 -15.935 3.912 1.00 0.00 O ATOM 2174 CB MET B 83 -11.492 -13.569 3.038 1.00 0.00 C ATOM 2175 CG MET B 83 -12.323 -14.669 2.395 1.00 0.00 C ATOM 2176 SD MET B 83 -13.760 -15.133 3.398 1.00 0.00 S ATOM 2177 CE MET B 83 -14.708 -13.602 3.375 1.00 0.00 C ATOM 0 H MET B 83 -10.823 -11.945 4.740 1.00 0.00 H new ATOM 0 HA MET B 83 -11.451 -14.680 4.871 1.00 0.00 H new ATOM 0 HB2 MET B 83 -12.136 -12.714 3.242 1.00 0.00 H new ATOM 0 HB3 MET B 83 -10.736 -13.236 2.326 1.00 0.00 H new ATOM 0 HG2 MET B 83 -12.661 -14.337 1.414 1.00 0.00 H new ATOM 0 HG3 MET B 83 -11.697 -15.547 2.236 1.00 0.00 H new ATOM 0 HE1 MET B 83 -15.762 -13.829 3.218 1.00 0.00 H new ATOM 0 HE2 MET B 83 -14.586 -13.084 4.326 1.00 0.00 H new ATOM 0 HE3 MET B 83 -14.350 -12.965 2.566 1.00 0.00 H new ATOM 2187 N THR B 84 -8.383 -13.957 3.986 1.00 0.00 N ATOM 2188 CA THR B 84 -7.075 -14.532 3.769 1.00 0.00 C ATOM 2189 C THR B 84 -6.596 -15.221 5.060 1.00 0.00 C ATOM 2190 O THR B 84 -6.123 -16.344 5.045 1.00 0.00 O ATOM 2191 CB THR B 84 -6.058 -13.450 3.360 1.00 0.00 C ATOM 2192 OG1 THR B 84 -6.732 -12.196 3.201 1.00 0.00 O ATOM 2193 CG2 THR B 84 -5.373 -13.813 2.051 1.00 0.00 C ATOM 0 H THR B 84 -8.385 -12.942 4.089 1.00 0.00 H new ATOM 0 HA THR B 84 -7.149 -15.261 2.962 1.00 0.00 H new ATOM 0 HB THR B 84 -5.303 -13.377 4.143 1.00 0.00 H new ATOM 0 HG1 THR B 84 -6.910 -11.806 4.082 1.00 0.00 H new ATOM 0 HG21 THR B 84 -4.660 -13.033 1.785 1.00 0.00 H new ATOM 0 HG22 THR B 84 -4.847 -14.761 2.166 1.00 0.00 H new ATOM 0 HG23 THR B 84 -6.120 -13.906 1.263 1.00 0.00 H new ATOM 2201 N VAL B 85 -6.781 -14.561 6.173 1.00 0.00 N ATOM 2202 CA VAL B 85 -6.385 -15.112 7.466 1.00 0.00 C ATOM 2203 C VAL B 85 -7.177 -16.420 7.742 1.00 0.00 C ATOM 2204 O VAL B 85 -6.635 -17.441 8.231 1.00 0.00 O ATOM 2205 CB VAL B 85 -6.665 -14.098 8.594 1.00 0.00 C ATOM 2206 CG1 VAL B 85 -6.161 -14.592 9.928 1.00 0.00 C ATOM 2207 CG2 VAL B 85 -6.075 -12.751 8.280 1.00 0.00 C ATOM 0 H VAL B 85 -7.205 -13.635 6.222 1.00 0.00 H new ATOM 0 HA VAL B 85 -5.317 -15.326 7.440 1.00 0.00 H new ATOM 0 HB VAL B 85 -7.748 -13.992 8.661 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -6.377 -13.850 10.696 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -6.657 -15.530 10.180 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -5.085 -14.754 9.873 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -6.291 -12.060 9.095 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -4.996 -12.845 8.160 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -6.510 -12.369 7.356 1.00 0.00 H new ATOM 2217 N LYS B 86 -8.445 -16.397 7.398 1.00 0.00 N ATOM 2218 CA LYS B 86 -9.287 -17.545 7.563 1.00 0.00 C ATOM 2219 C LYS B 86 -8.894 -18.658 6.591 1.00 0.00 C ATOM 2220 O LYS B 86 -9.008 -19.830 6.932 1.00 0.00 O ATOM 2221 CB LYS B 86 -10.755 -17.173 7.414 1.00 0.00 C ATOM 2222 CG LYS B 86 -11.163 -16.000 8.298 1.00 0.00 C ATOM 2223 CD LYS B 86 -12.643 -15.804 8.362 1.00 0.00 C ATOM 2224 CE LYS B 86 -13.211 -15.350 7.037 1.00 0.00 C ATOM 2225 NZ LYS B 86 -14.604 -14.919 7.182 1.00 0.00 N ATOM 0 H LYS B 86 -8.913 -15.584 6.999 1.00 0.00 H new ATOM 0 HA LYS B 86 -9.144 -17.924 8.575 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -10.957 -16.924 6.372 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -11.371 -18.038 7.660 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -10.780 -16.161 9.306 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -10.697 -15.089 7.921 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -13.120 -16.738 8.660 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -12.878 -15.066 9.129 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -12.612 -14.529 6.643 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -13.152 -16.164 6.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -15.002 -14.709 6.244 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -15.157 -15.677 7.631 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -14.643 -14.065 7.774 1.00 0.00 H new ATOM 2239 N HIS B 87 -8.367 -18.292 5.392 1.00 0.00 N ATOM 2240 CA HIS B 87 -7.928 -19.310 4.418 1.00 0.00 C ATOM 2241 C HIS B 87 -6.791 -20.099 5.027 1.00 0.00 C ATOM 2242 O HIS B 87 -6.655 -21.307 4.780 1.00 0.00 O ATOM 2243 CB HIS B 87 -7.496 -18.716 3.002 1.00 0.00 C ATOM 2244 CG HIS B 87 -5.973 -18.544 2.737 1.00 0.00 C ATOM 2245 ND1 HIS B 87 -5.073 -19.592 2.664 1.00 0.00 N ATOM 2246 CD2 HIS B 87 -5.230 -17.435 2.557 1.00 0.00 C ATOM 2247 CE1 HIS B 87 -3.858 -19.086 2.462 1.00 0.00 C ATOM 2248 NE2 HIS B 87 -3.899 -17.780 2.386 1.00 0.00 N ATOM 0 H HIS B 87 -8.241 -17.326 5.089 1.00 0.00 H new ATOM 0 HA HIS B 87 -8.786 -19.949 4.211 1.00 0.00 H new ATOM 0 HB2 HIS B 87 -7.903 -19.364 2.226 1.00 0.00 H new ATOM 0 HB3 HIS B 87 -7.971 -17.742 2.885 1.00 0.00 H new ATOM 0 HD2 HIS B 87 -5.615 -16.426 2.547 1.00 0.00 H new ATOM 0 HE1 HIS B 87 -2.957 -19.675 2.373 1.00 0.00 H new ATOM 0 HE2 HIS B 87 -3.114 -17.147 2.233 1.00 0.00 H new ATOM 2256 N LEU B 88 -5.964 -19.388 5.806 1.00 0.00 N ATOM 2257 CA LEU B 88 -4.837 -19.971 6.478 1.00 0.00 C ATOM 2258 C LEU B 88 -5.348 -21.078 7.364 1.00 0.00 C ATOM 2259 O LEU B 88 -4.928 -22.209 7.225 1.00 0.00 O ATOM 2260 CB LEU B 88 -4.045 -18.873 7.261 1.00 0.00 C ATOM 2261 CG LEU B 88 -2.712 -19.254 7.977 1.00 0.00 C ATOM 2262 CD1 LEU B 88 -2.935 -20.078 9.242 1.00 0.00 C ATOM 2263 CD2 LEU B 88 -1.777 -19.987 7.021 1.00 0.00 C ATOM 0 H LEU B 88 -6.075 -18.388 5.977 1.00 0.00 H new ATOM 0 HA LEU B 88 -4.130 -20.399 5.767 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.822 -18.069 6.560 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -4.715 -18.461 8.015 1.00 0.00 H new ATOM 0 HG LEU B 88 -2.245 -18.319 8.286 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.973 -20.314 9.697 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -3.540 -19.507 9.946 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -3.452 -21.003 8.987 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.854 -20.243 7.540 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -2.259 -20.898 6.667 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -1.549 -19.344 6.171 1.00 0.00 H new ATOM 2275 N ARG B 89 -6.327 -20.761 8.207 1.00 0.00 N ATOM 2276 CA ARG B 89 -6.922 -21.787 9.084 1.00 0.00 C ATOM 2277 C ARG B 89 -7.513 -22.939 8.283 1.00 0.00 C ATOM 2278 O ARG B 89 -7.225 -24.091 8.555 1.00 0.00 O ATOM 2279 CB ARG B 89 -8.007 -21.229 10.018 1.00 0.00 C ATOM 2280 CG ARG B 89 -7.511 -20.480 11.244 1.00 0.00 C ATOM 2281 CD ARG B 89 -6.815 -19.183 10.910 1.00 0.00 C ATOM 2282 NE ARG B 89 -6.387 -18.499 12.129 1.00 0.00 N ATOM 2283 CZ ARG B 89 -6.787 -17.281 12.516 1.00 0.00 C ATOM 2284 NH1 ARG B 89 -7.706 -16.630 11.823 1.00 0.00 N ATOM 2285 NH2 ARG B 89 -6.321 -16.753 13.634 1.00 0.00 N ATOM 0 H ARG B 89 -6.724 -19.827 8.307 1.00 0.00 H new ATOM 0 HA ARG B 89 -6.096 -22.148 9.697 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -8.645 -20.559 9.441 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -8.632 -22.057 10.351 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -8.356 -20.272 11.901 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -6.825 -21.120 11.799 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -5.951 -19.381 10.275 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -7.487 -18.539 10.342 1.00 0.00 H new ATOM 0 HE ARG B 89 -5.729 -18.990 12.735 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -8.113 -17.055 10.990 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -8.008 -15.702 12.121 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -5.655 -17.273 14.205 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -6.627 -15.825 13.926 1.00 0.00 H new ATOM 2299 N ASN B 90 -8.272 -22.598 7.257 1.00 0.00 N ATOM 2300 CA ASN B 90 -9.015 -23.569 6.435 1.00 0.00 C ATOM 2301 C ASN B 90 -8.119 -24.569 5.777 1.00 0.00 C ATOM 2302 O ASN B 90 -8.378 -25.778 5.806 1.00 0.00 O ATOM 2303 CB ASN B 90 -9.853 -22.898 5.349 1.00 0.00 C ATOM 2304 CG ASN B 90 -10.980 -22.027 5.849 1.00 0.00 C ATOM 2305 OD1 ASN B 90 -11.521 -22.234 6.924 1.00 0.00 O ATOM 2306 ND2 ASN B 90 -11.360 -21.062 5.051 1.00 0.00 N ATOM 0 H ASN B 90 -8.399 -21.631 6.958 1.00 0.00 H new ATOM 0 HA ASN B 90 -9.673 -24.079 7.139 1.00 0.00 H new ATOM 0 HB2 ASN B 90 -9.194 -22.290 4.728 1.00 0.00 H new ATOM 0 HB3 ASN B 90 -10.272 -23.672 4.706 1.00 0.00 H new ATOM 0 HD21 ASN B 90 -12.132 -20.452 5.320 1.00 0.00 H new ATOM 0 HD22 ASN B 90 -10.884 -20.919 4.160 1.00 0.00 H new ATOM 2313 N LEU B 91 -7.080 -24.097 5.170 1.00 0.00 N ATOM 2314 CA LEU B 91 -6.178 -24.982 4.522 1.00 0.00 C ATOM 2315 C LEU B 91 -5.342 -25.721 5.526 1.00 0.00 C ATOM 2316 O LEU B 91 -5.137 -26.909 5.394 1.00 0.00 O ATOM 2317 CB LEU B 91 -5.341 -24.243 3.502 1.00 0.00 C ATOM 2318 CG LEU B 91 -6.132 -23.683 2.322 1.00 0.00 C ATOM 2319 CD1 LEU B 91 -5.253 -22.830 1.451 1.00 0.00 C ATOM 2320 CD2 LEU B 91 -6.729 -24.819 1.508 1.00 0.00 C ATOM 0 H LEU B 91 -6.838 -23.108 5.111 1.00 0.00 H new ATOM 0 HA LEU B 91 -6.753 -25.731 3.977 1.00 0.00 H new ATOM 0 HB2 LEU B 91 -4.825 -23.422 4.000 1.00 0.00 H new ATOM 0 HB3 LEU B 91 -4.574 -24.918 3.122 1.00 0.00 H new ATOM 0 HG LEU B 91 -6.939 -23.062 2.711 1.00 0.00 H new ATOM 0 HD11 LEU B 91 -5.836 -22.441 0.616 1.00 0.00 H new ATOM 0 HD12 LEU B 91 -4.857 -22.000 2.036 1.00 0.00 H new ATOM 0 HD13 LEU B 91 -4.427 -23.430 1.069 1.00 0.00 H new ATOM 0 HD21 LEU B 91 -7.291 -24.409 0.669 1.00 0.00 H new ATOM 0 HD22 LEU B 91 -5.929 -25.457 1.132 1.00 0.00 H new ATOM 0 HD23 LEU B 91 -7.396 -25.407 2.139 1.00 0.00 H new ATOM 2332 N GLN B 92 -4.967 -25.053 6.588 1.00 0.00 N ATOM 2333 CA GLN B 92 -4.097 -25.653 7.594 1.00 0.00 C ATOM 2334 C GLN B 92 -4.799 -26.736 8.392 1.00 0.00 C ATOM 2335 O GLN B 92 -4.169 -27.660 8.886 1.00 0.00 O ATOM 2336 CB GLN B 92 -3.490 -24.593 8.507 1.00 0.00 C ATOM 2337 CG GLN B 92 -2.365 -23.786 7.865 1.00 0.00 C ATOM 2338 CD GLN B 92 -1.129 -24.601 7.577 1.00 0.00 C ATOM 2339 OE1 GLN B 92 -1.184 -25.800 7.318 1.00 0.00 O ATOM 2340 NE2 GLN B 92 -0.015 -23.964 7.603 1.00 0.00 N ATOM 0 H GLN B 92 -5.246 -24.092 6.787 1.00 0.00 H new ATOM 0 HA GLN B 92 -3.281 -26.137 7.057 1.00 0.00 H new ATOM 0 HB2 GLN B 92 -4.277 -23.909 8.825 1.00 0.00 H new ATOM 0 HB3 GLN B 92 -3.107 -25.078 9.405 1.00 0.00 H new ATOM 0 HG2 GLN B 92 -2.727 -23.349 6.935 1.00 0.00 H new ATOM 0 HG3 GLN B 92 -2.100 -22.959 8.524 1.00 0.00 H new ATOM 0 HE21 GLN B 92 -0.002 -22.968 7.822 1.00 0.00 H new ATOM 0 HE22 GLN B 92 0.857 -24.454 7.405 1.00 0.00 H new ATOM 2349 N ARG B 93 -6.103 -26.660 8.449 1.00 0.00 N ATOM 2350 CA ARG B 93 -6.892 -27.630 9.192 1.00 0.00 C ATOM 2351 C ARG B 93 -7.201 -28.829 8.302 1.00 0.00 C ATOM 2352 O ARG B 93 -7.712 -29.855 8.751 1.00 0.00 O ATOM 2353 CB ARG B 93 -8.181 -26.970 9.748 1.00 0.00 C ATOM 2354 CG ARG B 93 -9.189 -26.513 8.691 1.00 0.00 C ATOM 2355 CD ARG B 93 -10.187 -27.607 8.323 1.00 0.00 C ATOM 2356 NE ARG B 93 -11.068 -27.934 9.451 1.00 0.00 N ATOM 2357 CZ ARG B 93 -11.116 -29.102 10.110 1.00 0.00 C ATOM 2358 NH1 ARG B 93 -10.261 -30.085 9.824 1.00 0.00 N ATOM 2359 NH2 ARG B 93 -11.995 -29.265 11.079 1.00 0.00 N ATOM 0 H ARG B 93 -6.652 -25.934 7.989 1.00 0.00 H new ATOM 0 HA ARG B 93 -6.320 -27.986 10.049 1.00 0.00 H new ATOM 0 HB2 ARG B 93 -8.674 -27.678 10.414 1.00 0.00 H new ATOM 0 HB3 ARG B 93 -7.897 -26.108 10.352 1.00 0.00 H new ATOM 0 HG2 ARG B 93 -9.730 -25.642 9.062 1.00 0.00 H new ATOM 0 HG3 ARG B 93 -8.654 -26.198 7.795 1.00 0.00 H new ATOM 0 HD2 ARG B 93 -10.788 -27.282 7.473 1.00 0.00 H new ATOM 0 HD3 ARG B 93 -9.649 -28.501 8.009 1.00 0.00 H new ATOM 0 HE ARG B 93 -11.706 -27.202 9.764 1.00 0.00 H new ATOM 0 HH11 ARG B 93 -9.559 -29.954 9.096 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -10.309 -30.967 10.333 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -12.632 -28.506 11.323 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -12.038 -30.150 11.585 1.00 0.00 H new ATOM 2373 N ALA B 94 -6.872 -28.688 7.034 1.00 0.00 N ATOM 2374 CA ALA B 94 -7.113 -29.718 6.041 1.00 0.00 C ATOM 2375 C ALA B 94 -5.997 -30.739 6.073 1.00 0.00 C ATOM 2376 O ALA B 94 -6.030 -31.738 5.375 1.00 0.00 O ATOM 2377 CB ALA B 94 -7.181 -29.089 4.658 1.00 0.00 C ATOM 0 H ALA B 94 -6.427 -27.850 6.660 1.00 0.00 H new ATOM 0 HA ALA B 94 -8.058 -30.212 6.265 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -7.362 -29.865 3.914 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -7.992 -28.362 4.629 1.00 0.00 H new ATOM 0 HB3 ALA B 94 -6.237 -28.589 4.439 1.00 0.00 H new ATOM 2383 N GLN B 95 -5.009 -30.472 6.868 1.00 0.00 N ATOM 2384 CA GLN B 95 -3.851 -31.305 6.952 1.00 0.00 C ATOM 2385 C GLN B 95 -3.720 -31.801 8.366 1.00 0.00 C ATOM 2386 O GLN B 95 -4.420 -32.759 8.734 1.00 0.00 O ATOM 2387 CB GLN B 95 -2.639 -30.476 6.535 1.00 0.00 C ATOM 2388 CG GLN B 95 -2.716 -30.006 5.093 1.00 0.00 C ATOM 2389 CD GLN B 95 -1.974 -28.722 4.855 1.00 0.00 C ATOM 2390 OE1 GLN B 95 -0.791 -28.711 4.536 1.00 0.00 O ATOM 2391 NE2 GLN B 95 -2.669 -27.631 5.010 1.00 0.00 N ATOM 0 H GLN B 95 -4.984 -29.660 7.484 1.00 0.00 H new ATOM 0 HA GLN B 95 -3.928 -32.169 6.292 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -2.554 -29.610 7.191 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -1.735 -31.069 6.671 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -2.310 -30.780 4.442 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -3.762 -29.872 4.815 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -3.652 -27.686 5.276 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -2.230 -26.722 4.865 1.00 0.00 H new