USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 881 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 64 SER OG : rot 180:sc= -0.695 USER MOD Set 1.2: A 65 SER OG : rot 180:sc= 0.149! USER MOD Set 2.1: A 36 GLN :FLIP amide:sc= -0.139 F(o=-1,f=-0.14) USER MOD Set 2.2: A 39 GLN : amide:sc= 0 K(o=-0.14,f=-0.69) USER MOD Single : A 18 LYS NZ :NH3+ -121:sc= -1.05 (180deg=-2.96!) USER MOD Single : A 21 GLN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -1.02 X(o=-1,f=-0.77) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 34 SER OG : rot 180:sc= -0.15 USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 73:sc= 1.02 USER MOD Single : A 46 GLN : amide:sc= -0.263 X(o=-0.26,f=0) USER MOD Single : A 47 GLN : amide:sc= -0.0859 X(o=-0.086,f=-0.05) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN :FLIP amide:sc= 0 F(o=-0.55,f=0) USER MOD Single : A 60 GLN : amide:sc= -1.31 X(o=-1.3,f=-1.8) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot -170:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= -1.54 K(o=-1.5,f=-3!) USER MOD Single : A 72 HIS : no HD1:sc= -0.247 K(o=-0.25,f=-1.2) USER MOD Single : A 73 GLN : amide:sc= -1.32! C(o=-1.3!,f=-1.2!) USER MOD Single : A 74 GLN :FLIP amide:sc= -1.27 F(o=-1.8,f=-1.3) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot -73:sc= -0.803 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -2.25! X(o=-2.2!,f=-2.6) USER MOD Single : A 100 GLN : amide:sc= -5.25! C(o=-5.2!,f=-5.1!) USER MOD Single : A 102 ASN : amide:sc= -0.258 X(o=-0.26,f=-0.71) USER MOD Single : A 103 ASN : amide:sc= -10.1! C(o=-10!,f=-16!) USER MOD Single : A 105 GLN : amide:sc= -0.344 X(o=-0.34,f=-0.11) USER MOD Single : A 106 GLN : amide:sc= -0.532 X(o=-0.53,f=-0.22) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 TYR OH : rot -150:sc= 0.46 USER MOD Single : A 114 GLN : amide:sc= -3.35 K(o=-3.4,f=-8.7!) USER MOD Single : A 115 GLN : amide:sc= -0.64 K(o=-0.64,f=-3.3!) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 146:sc= -3.1 (180deg=-4.58!) USER MOD ----------------------------------------------------------------- ATOM 270 N LYS A 18 -0.583 16.225 -3.295 1.00 0.00 N ATOM 271 CA LYS A 18 -2.002 16.496 -3.661 1.00 0.00 C ATOM 272 C LYS A 18 -2.450 15.487 -4.718 1.00 0.00 C ATOM 273 O LYS A 18 -3.534 15.583 -5.262 1.00 0.00 O ATOM 274 CB LYS A 18 -2.153 17.924 -4.200 1.00 0.00 C ATOM 275 CG LYS A 18 -1.002 18.244 -5.153 1.00 0.00 C ATOM 276 CD LYS A 18 -1.236 19.608 -5.820 1.00 0.00 C ATOM 277 CE LYS A 18 -2.482 19.565 -6.725 1.00 0.00 C ATOM 278 NZ LYS A 18 -3.677 19.987 -5.941 1.00 0.00 N ATOM 0 HA LYS A 18 -2.626 16.397 -2.773 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -3.106 18.027 -4.719 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -2.161 18.635 -3.374 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -0.059 18.254 -4.607 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -0.922 17.467 -5.913 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -1.362 20.375 -5.056 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -0.362 19.885 -6.409 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -2.345 20.223 -7.583 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -2.627 18.558 -7.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -4.381 19.221 -5.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -3.394 20.196 -4.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -4.091 20.839 -6.371 1.00 0.00 H new ATOM 292 N ASP A 19 -1.642 14.487 -4.976 1.00 0.00 N ATOM 293 CA ASP A 19 -2.039 13.434 -5.959 1.00 0.00 C ATOM 294 C ASP A 19 -2.635 12.272 -5.167 1.00 0.00 C ATOM 295 O ASP A 19 -3.582 11.635 -5.595 1.00 0.00 O ATOM 296 CB ASP A 19 -0.827 12.969 -6.771 1.00 0.00 C ATOM 297 CG ASP A 19 -1.271 11.938 -7.809 1.00 0.00 C ATOM 298 OD1 ASP A 19 -1.367 10.774 -7.456 1.00 0.00 O ATOM 299 OD2 ASP A 19 -1.505 12.329 -8.941 1.00 0.00 O ATOM 0 H ASP A 19 -0.726 14.356 -4.548 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.769 13.828 -6.666 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -0.360 13.820 -7.266 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -0.078 12.534 -6.109 1.00 0.00 H new ATOM 304 N LEU A 20 -2.147 12.032 -3.976 1.00 0.00 N ATOM 305 CA LEU A 20 -2.758 10.958 -3.157 1.00 0.00 C ATOM 306 C LEU A 20 -4.133 11.469 -2.740 1.00 0.00 C ATOM 307 O LEU A 20 -5.088 10.728 -2.644 1.00 0.00 O ATOM 308 CB LEU A 20 -1.899 10.655 -1.925 1.00 0.00 C ATOM 309 CG LEU A 20 -0.422 10.681 -2.319 1.00 0.00 C ATOM 310 CD1 LEU A 20 0.435 10.265 -1.121 1.00 0.00 C ATOM 311 CD2 LEU A 20 -0.185 9.707 -3.476 1.00 0.00 C ATOM 0 H LEU A 20 -1.365 12.527 -3.547 1.00 0.00 H new ATOM 0 HA LEU A 20 -2.835 10.029 -3.723 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -2.092 11.390 -1.144 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -2.161 9.679 -1.516 1.00 0.00 H new ATOM 0 HG LEU A 20 -0.148 11.689 -2.629 1.00 0.00 H new ATOM 0 HD11 LEU A 20 1.488 10.284 -1.403 1.00 0.00 H new ATOM 0 HD12 LEU A 20 0.268 10.957 -0.296 1.00 0.00 H new ATOM 0 HD13 LEU A 20 0.161 9.257 -0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.868 9.725 -3.757 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -0.460 8.699 -3.165 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -0.794 10.002 -4.331 1.00 0.00 H new ATOM 323 N GLN A 21 -4.248 12.753 -2.525 1.00 0.00 N ATOM 324 CA GLN A 21 -5.572 13.320 -2.163 1.00 0.00 C ATOM 325 C GLN A 21 -6.481 13.176 -3.385 1.00 0.00 C ATOM 326 O GLN A 21 -7.647 12.862 -3.278 1.00 0.00 O ATOM 327 CB GLN A 21 -5.417 14.800 -1.801 1.00 0.00 C ATOM 328 CG GLN A 21 -6.760 15.355 -1.322 1.00 0.00 C ATOM 329 CD GLN A 21 -6.590 16.821 -0.917 1.00 0.00 C ATOM 330 OE1 GLN A 21 -5.712 17.560 -1.539 1.00 0.00 O flip ATOM 331 NE2 GLN A 21 -7.261 17.298 -0.024 1.00 0.00 N flip ATOM 0 H GLN A 21 -3.485 13.427 -2.585 1.00 0.00 H new ATOM 0 HA GLN A 21 -5.996 12.798 -1.305 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -4.665 14.917 -1.021 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -5.068 15.362 -2.667 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -7.504 15.269 -2.114 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -7.126 14.773 -0.476 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -7.947 16.721 0.462 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -7.138 18.276 0.240 1.00 0.00 H new ATOM 340 N ALA A 22 -5.943 13.386 -4.560 1.00 0.00 N ATOM 341 CA ALA A 22 -6.771 13.237 -5.791 1.00 0.00 C ATOM 342 C ALA A 22 -7.519 11.903 -5.712 1.00 0.00 C ATOM 343 O ALA A 22 -8.668 11.784 -6.117 1.00 0.00 O ATOM 344 CB ALA A 22 -5.868 13.251 -7.026 1.00 0.00 C ATOM 0 H ALA A 22 -4.971 13.653 -4.718 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.481 14.060 -5.867 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.477 13.142 -7.923 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.325 14.195 -7.069 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.158 12.426 -6.967 1.00 0.00 H new ATOM 350 N ILE A 23 -6.904 10.905 -5.134 1.00 0.00 N ATOM 351 CA ILE A 23 -7.622 9.614 -4.989 1.00 0.00 C ATOM 352 C ILE A 23 -8.792 9.867 -4.024 1.00 0.00 C ATOM 353 O ILE A 23 -9.930 9.610 -4.362 1.00 0.00 O ATOM 354 CB ILE A 23 -6.662 8.513 -4.477 1.00 0.00 C ATOM 355 CG1 ILE A 23 -5.860 7.936 -5.672 1.00 0.00 C ATOM 356 CG2 ILE A 23 -7.448 7.385 -3.772 1.00 0.00 C ATOM 357 CD1 ILE A 23 -4.908 9.003 -6.214 1.00 0.00 C ATOM 0 H ILE A 23 -5.954 10.929 -4.764 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.003 9.255 -5.945 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.975 8.952 -3.753 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.296 7.059 -5.355 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.542 7.610 -6.457 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.753 6.622 -3.420 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -7.994 7.797 -2.924 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -8.152 6.938 -4.474 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -4.345 8.596 -7.054 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -5.482 9.868 -6.547 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.217 9.307 -5.428 1.00 0.00 H new ATOM 369 N LYS A 24 -8.541 10.411 -2.846 1.00 0.00 N ATOM 370 CA LYS A 24 -9.660 10.728 -1.894 1.00 0.00 C ATOM 371 C LYS A 24 -10.835 11.344 -2.662 1.00 0.00 C ATOM 372 O LYS A 24 -11.961 10.938 -2.486 1.00 0.00 O ATOM 373 CB LYS A 24 -9.141 11.727 -0.823 1.00 0.00 C ATOM 374 CG LYS A 24 -8.863 11.009 0.517 1.00 0.00 C ATOM 375 CD LYS A 24 -10.146 10.958 1.370 1.00 0.00 C ATOM 376 CE LYS A 24 -10.290 12.246 2.192 1.00 0.00 C ATOM 377 NZ LYS A 24 -11.711 12.411 2.610 1.00 0.00 N ATOM 0 H LYS A 24 -7.609 10.648 -2.506 1.00 0.00 H new ATOM 0 HA LYS A 24 -10.002 9.815 -1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.229 12.206 -1.179 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.877 12.517 -0.671 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -8.503 9.998 0.328 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -8.076 11.531 1.061 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.015 10.831 0.725 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.114 10.095 2.035 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -9.644 12.205 3.069 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -9.971 13.105 1.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -11.810 13.284 3.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -12.317 12.468 1.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.000 11.596 3.189 1.00 0.00 H new ATOM 391 N GLN A 25 -10.609 12.323 -3.490 1.00 0.00 N ATOM 392 CA GLN A 25 -11.756 12.937 -4.228 1.00 0.00 C ATOM 393 C GLN A 25 -12.677 11.818 -4.746 1.00 0.00 C ATOM 394 O GLN A 25 -13.904 11.870 -4.710 1.00 0.00 O ATOM 395 CB GLN A 25 -11.208 13.702 -5.434 1.00 0.00 C ATOM 396 CG GLN A 25 -10.275 14.816 -4.954 1.00 0.00 C ATOM 397 CD GLN A 25 -9.888 15.702 -6.140 1.00 0.00 C ATOM 398 OE1 GLN A 25 -8.757 16.133 -6.247 1.00 0.00 O ATOM 399 NE2 GLN A 25 -10.785 15.992 -7.042 1.00 0.00 N ATOM 0 H GLN A 25 -9.693 12.724 -3.689 1.00 0.00 H new ATOM 0 HA GLN A 25 -12.308 13.605 -3.566 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -10.670 13.022 -6.095 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -12.029 14.125 -6.013 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -10.768 15.412 -4.186 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -9.382 14.387 -4.500 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -11.734 15.630 -6.952 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -10.537 16.581 -7.837 1.00 0.00 H new ATOM 408 N GLU A 26 -12.037 10.795 -5.255 1.00 0.00 N ATOM 409 CA GLU A 26 -12.773 9.640 -5.836 1.00 0.00 C ATOM 410 C GLU A 26 -13.066 8.531 -4.801 1.00 0.00 C ATOM 411 O GLU A 26 -13.969 7.727 -5.014 1.00 0.00 O ATOM 412 CB GLU A 26 -11.926 9.069 -6.980 1.00 0.00 C ATOM 413 CG GLU A 26 -12.119 9.911 -8.246 1.00 0.00 C ATOM 414 CD GLU A 26 -11.672 11.348 -7.974 1.00 0.00 C ATOM 415 OE1 GLU A 26 -10.475 11.577 -7.928 1.00 0.00 O ATOM 416 OE2 GLU A 26 -12.535 12.196 -7.814 1.00 0.00 O ATOM 0 H GLU A 26 -11.021 10.714 -5.291 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.741 9.994 -6.191 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.874 9.061 -6.696 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.212 8.035 -7.174 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.542 9.489 -9.068 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -13.166 9.896 -8.550 1.00 0.00 H new ATOM 423 N VAL A 27 -12.396 8.460 -3.665 1.00 0.00 N ATOM 424 CA VAL A 27 -12.794 7.369 -2.729 1.00 0.00 C ATOM 425 C VAL A 27 -14.215 7.708 -2.323 1.00 0.00 C ATOM 426 O VAL A 27 -15.054 6.870 -2.057 1.00 0.00 O ATOM 427 CB VAL A 27 -11.897 7.286 -1.478 1.00 0.00 C ATOM 428 CG1 VAL A 27 -10.417 7.291 -1.893 1.00 0.00 C ATOM 429 CG2 VAL A 27 -12.194 8.432 -0.491 1.00 0.00 C ATOM 0 H VAL A 27 -11.638 9.073 -3.365 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.699 6.398 -3.216 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.117 6.351 -0.963 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.790 7.232 -1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.217 6.434 -2.536 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.194 8.211 -2.434 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.543 8.341 0.379 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.014 9.389 -0.980 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -13.235 8.377 -0.172 1.00 0.00 H new ATOM 439 N SER A 28 -14.459 9.004 -2.336 1.00 0.00 N ATOM 440 CA SER A 28 -15.803 9.531 -2.016 1.00 0.00 C ATOM 441 C SER A 28 -16.707 8.894 -3.044 1.00 0.00 C ATOM 442 O SER A 28 -17.441 7.999 -2.726 1.00 0.00 O ATOM 443 CB SER A 28 -15.827 11.056 -2.146 1.00 0.00 C ATOM 444 OG SER A 28 -17.116 11.538 -1.789 1.00 0.00 O ATOM 0 H SER A 28 -13.764 9.717 -2.560 1.00 0.00 H new ATOM 0 HA SER A 28 -16.109 9.304 -0.995 1.00 0.00 H new ATOM 0 HB2 SER A 28 -15.069 11.499 -1.501 1.00 0.00 H new ATOM 0 HB3 SER A 28 -15.587 11.349 -3.168 1.00 0.00 H new ATOM 0 HG SER A 28 -17.134 12.515 -1.870 1.00 0.00 H new ATOM 450 N GLN A 29 -16.621 9.365 -4.280 1.00 0.00 N ATOM 451 CA GLN A 29 -17.437 8.790 -5.420 1.00 0.00 C ATOM 452 C GLN A 29 -18.159 7.491 -5.024 1.00 0.00 C ATOM 453 O GLN A 29 -19.353 7.343 -5.193 1.00 0.00 O ATOM 454 CB GLN A 29 -16.474 8.427 -6.556 1.00 0.00 C ATOM 455 CG GLN A 29 -17.273 8.095 -7.820 1.00 0.00 C ATOM 456 CD GLN A 29 -16.311 7.851 -8.983 1.00 0.00 C ATOM 457 OE1 GLN A 29 -15.336 7.140 -8.841 1.00 0.00 O ATOM 458 NE2 GLN A 29 -16.544 8.416 -10.137 1.00 0.00 N ATOM 0 H GLN A 29 -16.010 10.136 -4.551 1.00 0.00 H new ATOM 0 HA GLN A 29 -18.178 9.536 -5.706 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -15.795 9.257 -6.750 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -15.860 7.574 -6.267 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -17.889 7.211 -7.652 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -17.950 8.914 -8.060 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -17.362 9.013 -10.257 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -15.908 8.260 -10.919 1.00 0.00 H new ATOM 467 N ALA A 30 -17.407 6.545 -4.495 1.00 0.00 N ATOM 468 CA ALA A 30 -18.003 5.228 -4.074 1.00 0.00 C ATOM 469 C ALA A 30 -18.454 5.253 -2.609 1.00 0.00 C ATOM 470 O ALA A 30 -18.701 6.281 -2.019 1.00 0.00 O ATOM 471 CB ALA A 30 -16.948 4.127 -4.222 1.00 0.00 C ATOM 0 H ALA A 30 -16.403 6.630 -4.337 1.00 0.00 H new ATOM 0 HA ALA A 30 -18.869 5.039 -4.709 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -17.375 3.171 -3.918 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -16.628 4.067 -5.262 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.090 4.358 -3.591 1.00 0.00 H new ATOM 477 N ALA A 31 -18.556 4.094 -2.031 1.00 0.00 N ATOM 478 CA ALA A 31 -18.971 3.979 -0.603 1.00 0.00 C ATOM 479 C ALA A 31 -17.733 4.289 0.267 1.00 0.00 C ATOM 480 O ALA A 31 -16.664 4.481 -0.276 1.00 0.00 O ATOM 481 CB ALA A 31 -19.481 2.537 -0.377 1.00 0.00 C ATOM 0 H ALA A 31 -18.367 3.204 -2.492 1.00 0.00 H new ATOM 0 HA ALA A 31 -19.768 4.675 -0.340 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -19.793 2.420 0.661 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -20.328 2.343 -1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -18.682 1.830 -0.598 1.00 0.00 H new ATOM 487 N PRO A 32 -17.890 4.336 1.579 1.00 0.00 N ATOM 488 CA PRO A 32 -16.746 4.622 2.472 1.00 0.00 C ATOM 489 C PRO A 32 -15.724 3.476 2.363 1.00 0.00 C ATOM 490 O PRO A 32 -15.291 2.904 3.344 1.00 0.00 O ATOM 491 CB PRO A 32 -17.364 4.720 3.890 1.00 0.00 C ATOM 492 CG PRO A 32 -18.869 4.340 3.770 1.00 0.00 C ATOM 493 CD PRO A 32 -19.181 4.124 2.271 1.00 0.00 C ATOM 0 HA PRO A 32 -16.213 5.539 2.220 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -16.852 4.048 4.579 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -17.253 5.729 4.288 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -19.082 3.435 4.339 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -19.497 5.130 4.181 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -19.567 3.121 2.088 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -19.937 4.826 1.920 1.00 0.00 H new ATOM 501 N GLY A 33 -15.350 3.134 1.160 1.00 0.00 N ATOM 502 CA GLY A 33 -14.377 2.024 0.942 1.00 0.00 C ATOM 503 C GLY A 33 -14.798 1.261 -0.307 1.00 0.00 C ATOM 504 O GLY A 33 -14.672 1.738 -1.418 1.00 0.00 O ATOM 0 H GLY A 33 -15.682 3.583 0.306 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.369 2.420 0.824 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.359 1.359 1.806 1.00 0.00 H new ATOM 508 N SER A 34 -15.326 0.087 -0.127 1.00 0.00 N ATOM 509 CA SER A 34 -15.795 -0.716 -1.286 1.00 0.00 C ATOM 510 C SER A 34 -14.611 -0.997 -2.234 1.00 0.00 C ATOM 511 O SER A 34 -13.570 -0.386 -2.093 1.00 0.00 O ATOM 512 CB SER A 34 -16.884 0.103 -2.012 1.00 0.00 C ATOM 513 OG SER A 34 -16.465 0.405 -3.338 1.00 0.00 O ATOM 0 H SER A 34 -15.454 -0.356 0.783 1.00 0.00 H new ATOM 0 HA SER A 34 -16.202 -1.673 -0.958 1.00 0.00 H new ATOM 0 HB2 SER A 34 -17.817 -0.459 -2.036 1.00 0.00 H new ATOM 0 HB3 SER A 34 -17.082 1.025 -1.466 1.00 0.00 H new ATOM 0 HG SER A 34 -17.162 0.923 -3.791 1.00 0.00 H new ATOM 519 N PRO A 35 -14.798 -1.879 -3.195 1.00 0.00 N ATOM 520 CA PRO A 35 -13.736 -2.185 -4.178 1.00 0.00 C ATOM 521 C PRO A 35 -13.314 -0.903 -4.911 1.00 0.00 C ATOM 522 O PRO A 35 -12.144 -0.629 -5.063 1.00 0.00 O ATOM 523 CB PRO A 35 -14.383 -3.190 -5.164 1.00 0.00 C ATOM 524 CG PRO A 35 -15.818 -3.500 -4.644 1.00 0.00 C ATOM 525 CD PRO A 35 -16.057 -2.635 -3.385 1.00 0.00 C ATOM 0 HA PRO A 35 -12.840 -2.594 -3.711 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -14.422 -2.770 -6.169 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -13.791 -4.103 -5.223 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.560 -3.274 -5.410 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -15.918 -4.559 -4.406 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -16.904 -1.963 -3.523 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.280 -3.255 -2.517 1.00 0.00 H new ATOM 533 N GLN A 36 -14.264 -0.134 -5.368 1.00 0.00 N ATOM 534 CA GLN A 36 -13.952 1.128 -6.109 1.00 0.00 C ATOM 535 C GLN A 36 -12.720 1.832 -5.528 1.00 0.00 C ATOM 536 O GLN A 36 -11.928 2.421 -6.250 1.00 0.00 O ATOM 537 CB GLN A 36 -15.146 2.070 -5.991 1.00 0.00 C ATOM 538 CG GLN A 36 -16.322 1.523 -6.805 1.00 0.00 C ATOM 539 CD GLN A 36 -16.086 1.785 -8.295 1.00 0.00 C ATOM 540 OE1 GLN A 36 -15.582 2.929 -8.673 1.00 0.00 O flip ATOM 541 NE2 GLN A 36 -16.364 0.941 -9.124 1.00 0.00 N flip ATOM 0 H GLN A 36 -15.260 -0.327 -5.259 1.00 0.00 H new ATOM 0 HA GLN A 36 -13.747 0.873 -7.149 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -15.434 2.177 -4.945 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -14.874 3.063 -6.350 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -16.433 0.453 -6.627 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -17.250 1.997 -6.485 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -16.758 0.047 -8.830 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -16.204 1.126 -10.114 1.00 0.00 H new ATOM 550 N PHE A 37 -12.547 1.795 -4.234 1.00 0.00 N ATOM 551 CA PHE A 37 -11.381 2.484 -3.634 1.00 0.00 C ATOM 552 C PHE A 37 -10.123 2.047 -4.394 1.00 0.00 C ATOM 553 O PHE A 37 -9.296 2.826 -4.824 1.00 0.00 O ATOM 554 CB PHE A 37 -11.264 2.044 -2.171 1.00 0.00 C ATOM 555 CG PHE A 37 -10.444 3.064 -1.412 1.00 0.00 C ATOM 556 CD1 PHE A 37 -9.063 3.117 -1.597 1.00 0.00 C ATOM 557 CD2 PHE A 37 -11.066 3.959 -0.535 1.00 0.00 C ATOM 558 CE1 PHE A 37 -8.298 4.064 -0.904 1.00 0.00 C ATOM 559 CE2 PHE A 37 -10.303 4.906 0.158 1.00 0.00 C ATOM 560 CZ PHE A 37 -8.920 4.958 -0.027 1.00 0.00 C ATOM 0 H PHE A 37 -13.162 1.319 -3.574 1.00 0.00 H new ATOM 0 HA PHE A 37 -11.495 3.567 -3.690 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -12.255 1.951 -1.726 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -10.794 1.063 -2.110 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -8.583 2.427 -2.275 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -12.136 3.919 -0.393 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -7.228 4.104 -1.047 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -10.784 5.596 0.835 1.00 0.00 H new ATOM 0 HZ PHE A 37 -8.331 5.689 0.507 1.00 0.00 H new ATOM 570 N MET A 38 -10.029 0.740 -4.534 1.00 0.00 N ATOM 571 CA MET A 38 -8.897 0.072 -5.236 1.00 0.00 C ATOM 572 C MET A 38 -8.714 0.650 -6.625 1.00 0.00 C ATOM 573 O MET A 38 -7.615 0.920 -7.045 1.00 0.00 O ATOM 574 CB MET A 38 -9.189 -1.446 -5.326 1.00 0.00 C ATOM 575 CG MET A 38 -9.894 -1.840 -6.646 1.00 0.00 C ATOM 576 SD MET A 38 -10.433 -3.564 -6.551 1.00 0.00 S ATOM 577 CE MET A 38 -10.861 -3.775 -8.294 1.00 0.00 C ATOM 0 H MET A 38 -10.726 0.089 -4.171 1.00 0.00 H new ATOM 0 HA MET A 38 -7.977 0.240 -4.676 1.00 0.00 H new ATOM 0 HB2 MET A 38 -8.253 -1.998 -5.240 1.00 0.00 H new ATOM 0 HB3 MET A 38 -9.813 -1.743 -4.483 1.00 0.00 H new ATOM 0 HG2 MET A 38 -10.751 -1.189 -6.821 1.00 0.00 H new ATOM 0 HG3 MET A 38 -9.214 -1.706 -7.488 1.00 0.00 H new ATOM 0 HE1 MET A 38 -11.224 -4.789 -8.459 1.00 0.00 H new ATOM 0 HE2 MET A 38 -11.639 -3.062 -8.566 1.00 0.00 H new ATOM 0 HE3 MET A 38 -9.978 -3.601 -8.909 1.00 0.00 H new ATOM 587 N GLN A 39 -9.779 0.827 -7.339 1.00 0.00 N ATOM 588 CA GLN A 39 -9.677 1.379 -8.719 1.00 0.00 C ATOM 589 C GLN A 39 -8.683 2.537 -8.708 1.00 0.00 C ATOM 590 O GLN A 39 -7.849 2.689 -9.580 1.00 0.00 O ATOM 591 CB GLN A 39 -11.057 1.886 -9.144 1.00 0.00 C ATOM 592 CG GLN A 39 -11.053 2.167 -10.647 1.00 0.00 C ATOM 593 CD GLN A 39 -12.464 2.544 -11.101 1.00 0.00 C ATOM 594 OE1 GLN A 39 -13.188 3.208 -10.386 1.00 0.00 O ATOM 595 NE2 GLN A 39 -12.887 2.146 -12.269 1.00 0.00 N ATOM 0 H GLN A 39 -10.727 0.613 -7.029 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.338 0.613 -9.417 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.819 1.145 -8.903 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.309 2.793 -8.594 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.358 2.976 -10.874 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.708 1.288 -11.191 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -12.279 1.589 -12.869 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.826 2.392 -12.582 1.00 0.00 H new ATOM 604 N THR A 40 -8.787 3.345 -7.698 1.00 0.00 N ATOM 605 CA THR A 40 -7.889 4.511 -7.547 1.00 0.00 C ATOM 606 C THR A 40 -6.537 4.081 -6.934 1.00 0.00 C ATOM 607 O THR A 40 -5.508 4.556 -7.372 1.00 0.00 O ATOM 608 CB THR A 40 -8.621 5.532 -6.670 1.00 0.00 C ATOM 609 OG1 THR A 40 -9.673 4.863 -5.989 1.00 0.00 O ATOM 610 CG2 THR A 40 -9.232 6.662 -7.511 1.00 0.00 C ATOM 0 H THR A 40 -9.475 3.242 -6.952 1.00 0.00 H new ATOM 0 HA THR A 40 -7.655 4.957 -8.514 1.00 0.00 H new ATOM 0 HB THR A 40 -7.904 5.968 -5.974 1.00 0.00 H new ATOM 0 HG1 THR A 40 -9.297 4.296 -5.283 1.00 0.00 H new ATOM 0 HG21 THR A 40 -9.743 7.367 -6.856 1.00 0.00 H new ATOM 0 HG22 THR A 40 -8.441 7.179 -8.055 1.00 0.00 H new ATOM 0 HG23 THR A 40 -9.946 6.243 -8.220 1.00 0.00 H new ATOM 618 N ILE A 41 -6.479 3.185 -5.992 1.00 0.00 N ATOM 619 CA ILE A 41 -5.122 2.780 -5.489 1.00 0.00 C ATOM 620 C ILE A 41 -4.532 1.813 -6.509 1.00 0.00 C ATOM 621 O ILE A 41 -3.380 1.438 -6.450 1.00 0.00 O ATOM 622 CB ILE A 41 -5.217 2.090 -4.125 1.00 0.00 C ATOM 623 CG1 ILE A 41 -5.958 2.996 -3.130 1.00 0.00 C ATOM 624 CG2 ILE A 41 -3.815 1.773 -3.596 1.00 0.00 C ATOM 625 CD1 ILE A 41 -5.040 4.115 -2.589 1.00 0.00 C ATOM 0 H ILE A 41 -7.277 2.724 -5.555 1.00 0.00 H new ATOM 0 HA ILE A 41 -4.496 3.664 -5.366 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.771 1.158 -4.240 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -6.826 3.440 -3.618 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.331 2.397 -2.299 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.894 1.283 -2.626 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.303 1.112 -4.296 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.248 2.698 -3.490 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.598 4.736 -1.888 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.186 3.670 -2.079 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.688 4.729 -3.418 1.00 0.00 H new ATOM 637 N ARG A 42 -5.334 1.413 -7.447 1.00 0.00 N ATOM 638 CA ARG A 42 -4.872 0.472 -8.493 1.00 0.00 C ATOM 639 C ARG A 42 -4.071 1.224 -9.547 1.00 0.00 C ATOM 640 O ARG A 42 -3.064 0.749 -10.033 1.00 0.00 O ATOM 641 CB ARG A 42 -6.084 -0.145 -9.172 1.00 0.00 C ATOM 642 CG ARG A 42 -5.618 -1.096 -10.276 1.00 0.00 C ATOM 643 CD ARG A 42 -6.790 -1.958 -10.745 1.00 0.00 C ATOM 644 NE ARG A 42 -6.318 -2.899 -11.799 1.00 0.00 N ATOM 645 CZ ARG A 42 -7.054 -3.919 -12.141 1.00 0.00 C ATOM 646 NH1 ARG A 42 -8.208 -4.113 -11.564 1.00 0.00 N ATOM 647 NH2 ARG A 42 -6.636 -4.746 -13.061 1.00 0.00 N ATOM 0 H ARG A 42 -6.308 1.704 -7.534 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.252 -0.297 -8.033 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -6.688 -0.685 -8.443 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -6.716 0.637 -9.593 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -5.216 -0.526 -11.114 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -4.813 -1.731 -9.906 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.207 -2.514 -9.905 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.588 -1.326 -11.136 1.00 0.00 H new ATOM 0 HE ARG A 42 -5.418 -2.745 -12.254 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.534 -3.467 -10.846 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.784 -4.911 -11.831 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.734 -4.594 -13.512 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -7.212 -5.544 -13.329 1.00 0.00 H new ATOM 661 N LEU A 43 -4.511 2.400 -9.912 1.00 0.00 N ATOM 662 CA LEU A 43 -3.784 3.183 -10.951 1.00 0.00 C ATOM 663 C LEU A 43 -2.815 4.157 -10.287 1.00 0.00 C ATOM 664 O LEU A 43 -1.918 4.665 -10.919 1.00 0.00 O ATOM 665 CB LEU A 43 -4.795 3.969 -11.791 1.00 0.00 C ATOM 666 CG LEU A 43 -5.914 3.037 -12.269 1.00 0.00 C ATOM 667 CD1 LEU A 43 -6.977 3.857 -13.004 1.00 0.00 C ATOM 668 CD2 LEU A 43 -5.339 1.976 -13.217 1.00 0.00 C ATOM 0 H LEU A 43 -5.344 2.851 -9.534 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.224 2.499 -11.589 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.216 4.783 -11.201 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.295 4.421 -12.648 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.363 2.542 -11.408 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.774 3.197 -13.345 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.390 4.606 -12.328 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.524 4.353 -13.863 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.139 1.317 -13.553 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.886 2.466 -14.079 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.583 1.391 -12.693 1.00 0.00 H new ATOM 680 N ALA A 44 -2.958 4.405 -9.015 1.00 0.00 N ATOM 681 CA ALA A 44 -1.998 5.339 -8.342 1.00 0.00 C ATOM 682 C ALA A 44 -0.788 4.548 -7.838 1.00 0.00 C ATOM 683 O ALA A 44 0.339 4.982 -7.994 1.00 0.00 O ATOM 684 CB ALA A 44 -2.683 6.067 -7.184 1.00 0.00 C ATOM 0 H ALA A 44 -3.684 4.011 -8.416 1.00 0.00 H new ATOM 0 HA ALA A 44 -1.662 6.087 -9.060 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.972 6.741 -6.706 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.528 6.641 -7.564 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.038 5.338 -6.455 1.00 0.00 H new ATOM 690 N VAL A 45 -0.978 3.397 -7.261 1.00 0.00 N ATOM 691 CA VAL A 45 0.201 2.619 -6.790 1.00 0.00 C ATOM 692 C VAL A 45 0.807 1.855 -7.972 1.00 0.00 C ATOM 693 O VAL A 45 1.985 1.572 -7.993 1.00 0.00 O ATOM 694 CB VAL A 45 -0.225 1.636 -5.692 1.00 0.00 C ATOM 695 CG1 VAL A 45 0.905 0.638 -5.412 1.00 0.00 C ATOM 696 CG2 VAL A 45 -0.529 2.417 -4.412 1.00 0.00 C ATOM 0 H VAL A 45 -1.887 2.964 -7.096 1.00 0.00 H new ATOM 0 HA VAL A 45 0.946 3.301 -6.379 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.111 1.093 -6.021 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.593 -0.055 -4.631 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.133 0.082 -6.321 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.794 1.177 -5.084 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.833 1.725 -3.627 1.00 0.00 H new ATOM 0 HG22 VAL A 45 0.363 2.957 -4.095 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -1.334 3.127 -4.601 1.00 0.00 H new ATOM 706 N GLN A 46 0.029 1.529 -8.971 1.00 0.00 N ATOM 707 CA GLN A 46 0.605 0.790 -10.129 1.00 0.00 C ATOM 708 C GLN A 46 1.286 1.764 -11.094 1.00 0.00 C ATOM 709 O GLN A 46 2.117 1.374 -11.890 1.00 0.00 O ATOM 710 CB GLN A 46 -0.509 0.055 -10.873 1.00 0.00 C ATOM 711 CG GLN A 46 0.109 -0.877 -11.916 1.00 0.00 C ATOM 712 CD GLN A 46 -0.989 -1.728 -12.557 1.00 0.00 C ATOM 713 OE1 GLN A 46 -0.817 -2.915 -12.753 1.00 0.00 O ATOM 714 NE2 GLN A 46 -2.119 -1.169 -12.894 1.00 0.00 N ATOM 0 H GLN A 46 -0.967 1.740 -9.034 1.00 0.00 H new ATOM 0 HA GLN A 46 1.340 0.076 -9.757 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -1.115 -0.517 -10.171 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -1.173 0.771 -11.357 1.00 0.00 H new ATOM 0 HG2 GLN A 46 0.624 -0.294 -12.680 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.855 -1.520 -11.448 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -2.264 -0.173 -12.730 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -2.857 -1.728 -13.322 1.00 0.00 H new ATOM 723 N GLN A 47 0.928 3.025 -11.059 1.00 0.00 N ATOM 724 CA GLN A 47 1.550 3.995 -12.012 1.00 0.00 C ATOM 725 C GLN A 47 2.839 4.587 -11.448 1.00 0.00 C ATOM 726 O GLN A 47 3.913 4.397 -11.983 1.00 0.00 O ATOM 727 CB GLN A 47 0.569 5.142 -12.280 1.00 0.00 C ATOM 728 CG GLN A 47 -0.586 4.639 -13.155 1.00 0.00 C ATOM 729 CD GLN A 47 -0.112 4.505 -14.604 1.00 0.00 C ATOM 730 OE1 GLN A 47 -0.037 5.481 -15.324 1.00 0.00 O ATOM 731 NE2 GLN A 47 0.213 3.328 -15.065 1.00 0.00 N ATOM 0 H GLN A 47 0.239 3.421 -10.419 1.00 0.00 H new ATOM 0 HA GLN A 47 1.784 3.457 -12.931 1.00 0.00 H new ATOM 0 HB2 GLN A 47 0.182 5.530 -11.338 1.00 0.00 H new ATOM 0 HB3 GLN A 47 1.083 5.965 -12.777 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -0.941 3.676 -12.788 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -1.426 5.331 -13.099 1.00 0.00 H new ATOM 0 HE21 GLN A 47 0.150 2.509 -14.461 1.00 0.00 H new ATOM 0 HE22 GLN A 47 0.530 3.228 -16.029 1.00 0.00 H new ATOM 740 N PHE A 48 2.728 5.339 -10.386 1.00 0.00 N ATOM 741 CA PHE A 48 3.932 5.990 -9.799 1.00 0.00 C ATOM 742 C PHE A 48 4.626 5.057 -8.809 1.00 0.00 C ATOM 743 O PHE A 48 5.638 5.421 -8.247 1.00 0.00 O ATOM 744 CB PHE A 48 3.506 7.265 -9.065 1.00 0.00 C ATOM 745 CG PHE A 48 2.797 8.193 -10.025 1.00 0.00 C ATOM 746 CD1 PHE A 48 1.424 8.048 -10.254 1.00 0.00 C ATOM 747 CD2 PHE A 48 3.514 9.201 -10.680 1.00 0.00 C ATOM 748 CE1 PHE A 48 0.767 8.910 -11.141 1.00 0.00 C ATOM 749 CE2 PHE A 48 2.857 10.064 -11.566 1.00 0.00 C ATOM 750 CZ PHE A 48 1.484 9.919 -11.796 1.00 0.00 C ATOM 0 H PHE A 48 1.852 5.530 -9.899 1.00 0.00 H new ATOM 0 HA PHE A 48 4.627 6.227 -10.605 1.00 0.00 H new ATOM 0 HB2 PHE A 48 2.848 7.015 -8.233 1.00 0.00 H new ATOM 0 HB3 PHE A 48 4.379 7.762 -8.642 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.871 7.271 -9.747 1.00 0.00 H new ATOM 0 HD2 PHE A 48 4.573 9.313 -10.502 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.292 8.797 -11.320 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.410 10.842 -12.072 1.00 0.00 H new ATOM 0 HZ PHE A 48 0.978 10.585 -12.479 1.00 0.00 H new ATOM 760 N ASP A 49 4.103 3.860 -8.607 1.00 0.00 N ATOM 761 CA ASP A 49 4.740 2.880 -7.649 1.00 0.00 C ATOM 762 C ASP A 49 5.624 3.588 -6.610 1.00 0.00 C ATOM 763 O ASP A 49 6.827 3.429 -6.634 1.00 0.00 O ATOM 764 CB ASP A 49 5.628 1.917 -8.429 1.00 0.00 C ATOM 765 CG ASP A 49 4.790 1.156 -9.458 1.00 0.00 C ATOM 766 OD1 ASP A 49 4.158 1.806 -10.275 1.00 0.00 O ATOM 767 OD2 ASP A 49 4.795 -0.063 -9.414 1.00 0.00 O ATOM 0 H ASP A 49 3.259 3.518 -9.066 1.00 0.00 H new ATOM 0 HA ASP A 49 3.934 2.357 -7.135 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.424 2.467 -8.930 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.107 1.215 -7.746 1.00 0.00 H new ATOM 772 N PRO A 50 5.026 4.359 -5.741 1.00 0.00 N ATOM 773 CA PRO A 50 5.796 5.090 -4.723 1.00 0.00 C ATOM 774 C PRO A 50 6.627 4.104 -3.889 1.00 0.00 C ATOM 775 O PRO A 50 6.430 2.906 -3.947 1.00 0.00 O ATOM 776 CB PRO A 50 4.733 5.814 -3.869 1.00 0.00 C ATOM 777 CG PRO A 50 3.347 5.562 -4.534 1.00 0.00 C ATOM 778 CD PRO A 50 3.564 4.560 -5.689 1.00 0.00 C ATOM 0 HA PRO A 50 6.505 5.799 -5.150 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.742 5.438 -2.846 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.945 6.882 -3.817 1.00 0.00 H new ATOM 0 HG2 PRO A 50 2.640 5.163 -3.807 1.00 0.00 H new ATOM 0 HG3 PRO A 50 2.926 6.495 -4.909 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.042 3.622 -5.503 1.00 0.00 H new ATOM 0 HD3 PRO A 50 3.185 4.954 -6.632 1.00 0.00 H new ATOM 786 N THR A 51 7.551 4.601 -3.114 1.00 0.00 N ATOM 787 CA THR A 51 8.389 3.696 -2.277 1.00 0.00 C ATOM 788 C THR A 51 7.593 3.279 -1.039 1.00 0.00 C ATOM 789 O THR A 51 6.448 3.651 -0.876 1.00 0.00 O ATOM 790 CB THR A 51 9.664 4.429 -1.845 1.00 0.00 C ATOM 791 OG1 THR A 51 9.316 5.574 -1.080 1.00 0.00 O ATOM 792 CG2 THR A 51 10.453 4.859 -3.084 1.00 0.00 C ATOM 0 H THR A 51 7.762 5.595 -3.024 1.00 0.00 H new ATOM 0 HA THR A 51 8.662 2.812 -2.853 1.00 0.00 H new ATOM 0 HB THR A 51 10.278 3.762 -1.240 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.131 6.042 -0.802 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.359 5.380 -2.775 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.722 3.979 -3.668 1.00 0.00 H new ATOM 0 HG23 THR A 51 9.841 5.525 -3.692 1.00 0.00 H new ATOM 800 N ALA A 52 8.182 2.511 -0.164 1.00 0.00 N ATOM 801 CA ALA A 52 7.440 2.083 1.054 1.00 0.00 C ATOM 802 C ALA A 52 7.220 3.298 1.961 1.00 0.00 C ATOM 803 O ALA A 52 6.356 3.315 2.820 1.00 0.00 O ATOM 804 CB ALA A 52 8.250 1.024 1.800 1.00 0.00 C ATOM 0 H ALA A 52 9.138 2.164 -0.239 1.00 0.00 H new ATOM 0 HA ALA A 52 6.476 1.661 0.768 1.00 0.00 H new ATOM 0 HB1 ALA A 52 7.706 0.711 2.691 1.00 0.00 H new ATOM 0 HB2 ALA A 52 8.408 0.163 1.151 1.00 0.00 H new ATOM 0 HB3 ALA A 52 9.214 1.441 2.091 1.00 0.00 H new ATOM 810 N LYS A 53 7.988 4.328 1.762 1.00 0.00 N ATOM 811 CA LYS A 53 7.818 5.544 2.596 1.00 0.00 C ATOM 812 C LYS A 53 6.392 6.064 2.416 1.00 0.00 C ATOM 813 O LYS A 53 5.724 6.430 3.367 1.00 0.00 O ATOM 814 CB LYS A 53 8.822 6.608 2.154 1.00 0.00 C ATOM 815 CG LYS A 53 10.243 6.083 2.367 1.00 0.00 C ATOM 816 CD LYS A 53 11.250 7.204 2.106 1.00 0.00 C ATOM 817 CE LYS A 53 12.631 6.771 2.602 1.00 0.00 C ATOM 818 NZ LYS A 53 13.647 7.778 2.182 1.00 0.00 N ATOM 0 H LYS A 53 8.725 4.380 1.059 1.00 0.00 H new ATOM 0 HA LYS A 53 7.993 5.309 3.646 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.667 6.856 1.104 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.672 7.525 2.724 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.355 5.710 3.385 1.00 0.00 H new ATOM 0 HG3 LYS A 53 10.436 5.245 1.698 1.00 0.00 H new ATOM 0 HD2 LYS A 53 11.289 7.432 1.041 1.00 0.00 H new ATOM 0 HD3 LYS A 53 10.937 8.115 2.616 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.626 6.675 3.688 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.885 5.792 2.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 14.586 7.485 2.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 13.658 7.849 1.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 13.407 8.704 2.590 1.00 0.00 H new ATOM 832 N ASP A 54 5.897 6.057 1.209 1.00 0.00 N ATOM 833 CA ASP A 54 4.504 6.513 0.978 1.00 0.00 C ATOM 834 C ASP A 54 3.549 5.419 1.463 1.00 0.00 C ATOM 835 O ASP A 54 2.354 5.618 1.518 1.00 0.00 O ATOM 836 CB ASP A 54 4.281 6.784 -0.530 1.00 0.00 C ATOM 837 CG ASP A 54 3.578 8.134 -0.743 1.00 0.00 C ATOM 838 OD1 ASP A 54 2.808 8.523 0.119 1.00 0.00 O ATOM 839 OD2 ASP A 54 3.822 8.751 -1.767 1.00 0.00 O ATOM 0 H ASP A 54 6.400 5.755 0.375 1.00 0.00 H new ATOM 0 HA ASP A 54 4.317 7.437 1.525 1.00 0.00 H new ATOM 0 HB2 ASP A 54 5.239 6.781 -1.050 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.681 5.984 -0.963 1.00 0.00 H new ATOM 844 N LEU A 55 4.056 4.286 1.875 1.00 0.00 N ATOM 845 CA LEU A 55 3.140 3.240 2.408 1.00 0.00 C ATOM 846 C LEU A 55 2.793 3.674 3.823 1.00 0.00 C ATOM 847 O LEU A 55 1.768 3.323 4.373 1.00 0.00 O ATOM 848 CB LEU A 55 3.836 1.866 2.417 1.00 0.00 C ATOM 849 CG LEU A 55 2.817 0.725 2.699 1.00 0.00 C ATOM 850 CD1 LEU A 55 3.195 -0.525 1.893 1.00 0.00 C ATOM 851 CD2 LEU A 55 2.821 0.363 4.193 1.00 0.00 C ATOM 0 H LEU A 55 5.047 4.044 1.866 1.00 0.00 H new ATOM 0 HA LEU A 55 2.247 3.138 1.792 1.00 0.00 H new ATOM 0 HB2 LEU A 55 4.322 1.695 1.457 1.00 0.00 H new ATOM 0 HB3 LEU A 55 4.618 1.856 3.176 1.00 0.00 H new ATOM 0 HG LEU A 55 1.826 1.072 2.408 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.477 -1.320 2.096 1.00 0.00 H new ATOM 0 HD12 LEU A 55 3.184 -0.289 0.829 1.00 0.00 H new ATOM 0 HD13 LEU A 55 4.193 -0.856 2.181 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.103 -0.437 4.376 1.00 0.00 H new ATOM 0 HD22 LEU A 55 3.817 0.030 4.484 1.00 0.00 H new ATOM 0 HD23 LEU A 55 2.545 1.239 4.780 1.00 0.00 H new ATOM 863 N GLN A 56 3.641 4.490 4.394 1.00 0.00 N ATOM 864 CA GLN A 56 3.377 5.018 5.755 1.00 0.00 C ATOM 865 C GLN A 56 2.400 6.188 5.627 1.00 0.00 C ATOM 866 O GLN A 56 1.570 6.411 6.480 1.00 0.00 O ATOM 867 CB GLN A 56 4.685 5.507 6.381 1.00 0.00 C ATOM 868 CG GLN A 56 5.657 4.334 6.520 1.00 0.00 C ATOM 869 CD GLN A 56 6.941 4.812 7.199 1.00 0.00 C ATOM 870 OE1 GLN A 56 7.424 5.987 6.899 1.00 0.00 O flip ATOM 871 NE2 GLN A 56 7.510 4.111 8.012 1.00 0.00 N flip ATOM 0 H GLN A 56 4.510 4.812 3.968 1.00 0.00 H new ATOM 0 HA GLN A 56 2.955 4.238 6.389 1.00 0.00 H new ATOM 0 HB2 GLN A 56 5.127 6.287 5.761 1.00 0.00 H new ATOM 0 HB3 GLN A 56 4.490 5.948 7.358 1.00 0.00 H new ATOM 0 HG2 GLN A 56 5.199 3.536 7.105 1.00 0.00 H new ATOM 0 HG3 GLN A 56 5.885 3.919 5.538 1.00 0.00 H new ATOM 0 HE21 GLN A 56 7.133 3.193 8.247 1.00 0.00 H new ATOM 0 HE22 GLN A 56 8.365 4.441 8.460 1.00 0.00 H new ATOM 880 N ASP A 57 2.491 6.930 4.551 1.00 0.00 N ATOM 881 CA ASP A 57 1.560 8.085 4.350 1.00 0.00 C ATOM 882 C ASP A 57 0.250 7.603 3.724 1.00 0.00 C ATOM 883 O ASP A 57 -0.763 8.264 3.825 1.00 0.00 O ATOM 884 CB ASP A 57 2.204 9.122 3.431 1.00 0.00 C ATOM 885 CG ASP A 57 1.433 10.441 3.522 1.00 0.00 C ATOM 886 OD1 ASP A 57 1.406 11.015 4.598 1.00 0.00 O ATOM 887 OD2 ASP A 57 0.883 10.854 2.515 1.00 0.00 O ATOM 0 H ASP A 57 3.169 6.786 3.803 1.00 0.00 H new ATOM 0 HA ASP A 57 1.353 8.537 5.320 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.245 9.278 3.715 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.205 8.760 2.403 1.00 0.00 H new ATOM 892 N LEU A 58 0.236 6.453 3.109 1.00 0.00 N ATOM 893 CA LEU A 58 -1.042 5.944 2.524 1.00 0.00 C ATOM 894 C LEU A 58 -1.740 5.101 3.590 1.00 0.00 C ATOM 895 O LEU A 58 -2.940 4.926 3.568 1.00 0.00 O ATOM 896 CB LEU A 58 -0.762 5.095 1.275 1.00 0.00 C ATOM 897 CG LEU A 58 -0.163 5.973 0.156 1.00 0.00 C ATOM 898 CD1 LEU A 58 0.611 5.096 -0.834 1.00 0.00 C ATOM 899 CD2 LEU A 58 -1.281 6.699 -0.603 1.00 0.00 C ATOM 0 H LEU A 58 1.046 5.846 2.985 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.676 6.778 2.223 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.072 4.288 1.522 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -1.685 4.630 0.928 1.00 0.00 H new ATOM 0 HG LEU A 58 0.506 6.703 0.611 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.032 5.721 -1.622 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.416 4.580 -0.311 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.064 4.362 -1.275 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.846 7.315 -1.390 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.955 5.966 -1.047 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.838 7.332 0.088 1.00 0.00 H new ATOM 911 N LEU A 59 -1.005 4.614 4.550 1.00 0.00 N ATOM 912 CA LEU A 59 -1.629 3.816 5.645 1.00 0.00 C ATOM 913 C LEU A 59 -1.983 4.760 6.799 1.00 0.00 C ATOM 914 O LEU A 59 -2.823 4.466 7.621 1.00 0.00 O ATOM 915 CB LEU A 59 -0.638 2.754 6.132 1.00 0.00 C ATOM 916 CG LEU A 59 -1.358 1.720 7.014 1.00 0.00 C ATOM 917 CD1 LEU A 59 -2.241 0.789 6.158 1.00 0.00 C ATOM 918 CD2 LEU A 59 -0.308 0.890 7.762 1.00 0.00 C ATOM 0 H LEU A 59 0.005 4.734 4.625 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.530 3.322 5.281 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.178 2.257 5.278 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.165 3.227 6.696 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.000 2.243 7.723 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.740 0.066 6.803 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.989 1.381 5.630 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -1.619 0.261 5.435 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.807 0.153 8.391 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.332 0.379 7.043 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.299 1.547 8.385 1.00 0.00 H new ATOM 930 N GLN A 60 -1.329 5.885 6.886 1.00 0.00 N ATOM 931 CA GLN A 60 -1.618 6.836 8.002 1.00 0.00 C ATOM 932 C GLN A 60 -2.581 7.935 7.543 1.00 0.00 C ATOM 933 O GLN A 60 -3.183 8.614 8.352 1.00 0.00 O ATOM 934 CB GLN A 60 -0.313 7.496 8.432 1.00 0.00 C ATOM 935 CG GLN A 60 0.594 6.448 9.082 1.00 0.00 C ATOM 936 CD GLN A 60 2.005 7.016 9.240 1.00 0.00 C ATOM 937 OE1 GLN A 60 2.977 6.298 9.125 1.00 0.00 O ATOM 938 NE2 GLN A 60 2.159 8.285 9.501 1.00 0.00 N ATOM 0 H GLN A 60 -0.606 6.189 6.234 1.00 0.00 H new ATOM 0 HA GLN A 60 -2.071 6.283 8.825 1.00 0.00 H new ATOM 0 HB2 GLN A 60 0.185 7.940 7.570 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -0.515 8.305 9.134 1.00 0.00 H new ATOM 0 HG2 GLN A 60 0.196 6.161 10.055 1.00 0.00 H new ATOM 0 HG3 GLN A 60 0.621 5.546 8.470 1.00 0.00 H new ATOM 0 HE21 GLN A 60 1.342 8.889 9.598 1.00 0.00 H new ATOM 0 HE22 GLN A 60 3.096 8.674 9.608 1.00 0.00 H new ATOM 947 N TYR A 61 -2.710 8.136 6.252 1.00 0.00 N ATOM 948 CA TYR A 61 -3.610 9.219 5.732 1.00 0.00 C ATOM 949 C TYR A 61 -4.871 8.629 5.098 1.00 0.00 C ATOM 950 O TYR A 61 -5.970 9.066 5.374 1.00 0.00 O ATOM 951 CB TYR A 61 -2.857 10.029 4.673 1.00 0.00 C ATOM 952 CG TYR A 61 -3.603 11.313 4.390 1.00 0.00 C ATOM 953 CD1 TYR A 61 -3.581 12.354 5.326 1.00 0.00 C ATOM 954 CD2 TYR A 61 -4.318 11.463 3.194 1.00 0.00 C ATOM 955 CE1 TYR A 61 -4.273 13.544 5.067 1.00 0.00 C ATOM 956 CE2 TYR A 61 -5.009 12.652 2.936 1.00 0.00 C ATOM 957 CZ TYR A 61 -4.987 13.692 3.872 1.00 0.00 C ATOM 958 OH TYR A 61 -5.669 14.864 3.617 1.00 0.00 O ATOM 0 H TYR A 61 -2.229 7.595 5.533 1.00 0.00 H new ATOM 0 HA TYR A 61 -3.904 9.855 6.567 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -1.848 10.252 5.021 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -2.757 9.446 3.758 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -3.030 12.239 6.248 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -4.336 10.661 2.471 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -4.256 14.347 5.789 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -5.560 12.767 2.014 1.00 0.00 H new ATOM 0 HH TYR A 61 -6.110 14.802 2.744 1.00 0.00 H new ATOM 968 N LEU A 62 -4.734 7.656 4.234 1.00 0.00 N ATOM 969 CA LEU A 62 -5.952 7.082 3.581 1.00 0.00 C ATOM 970 C LEU A 62 -6.622 6.083 4.518 1.00 0.00 C ATOM 971 O LEU A 62 -7.820 5.885 4.459 1.00 0.00 O ATOM 972 CB LEU A 62 -5.578 6.384 2.271 1.00 0.00 C ATOM 973 CG LEU A 62 -4.994 7.393 1.275 1.00 0.00 C ATOM 974 CD1 LEU A 62 -4.569 6.645 0.009 1.00 0.00 C ATOM 975 CD2 LEU A 62 -6.046 8.461 0.916 1.00 0.00 C ATOM 0 H LEU A 62 -3.846 7.238 3.955 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.644 7.896 3.363 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.852 5.595 2.467 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.459 5.907 1.841 1.00 0.00 H new ATOM 0 HG LEU A 62 -4.134 7.890 1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -4.152 7.352 -0.708 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.816 5.898 0.263 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.436 6.152 -0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.617 9.170 0.208 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.914 7.980 0.466 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.351 8.989 1.819 1.00 0.00 H new ATOM 987 N CYS A 63 -5.874 5.466 5.395 1.00 0.00 N ATOM 988 CA CYS A 63 -6.482 4.494 6.354 1.00 0.00 C ATOM 989 C CYS A 63 -6.543 5.157 7.733 1.00 0.00 C ATOM 990 O CYS A 63 -6.774 6.345 7.844 1.00 0.00 O ATOM 991 CB CYS A 63 -5.622 3.229 6.411 1.00 0.00 C ATOM 992 SG CYS A 63 -5.668 2.400 4.803 1.00 0.00 S ATOM 0 H CYS A 63 -4.866 5.593 5.489 1.00 0.00 H new ATOM 0 HA CYS A 63 -7.486 4.216 6.034 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -4.595 3.485 6.671 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -5.991 2.560 7.188 1.00 0.00 H new ATOM 0 HG CYS A 63 -5.117 1.227 4.904 1.00 0.00 H new ATOM 998 N SER A 64 -6.350 4.413 8.782 1.00 0.00 N ATOM 999 CA SER A 64 -6.412 5.015 10.141 1.00 0.00 C ATOM 1000 C SER A 64 -5.929 3.994 11.169 1.00 0.00 C ATOM 1001 O SER A 64 -5.647 2.859 10.837 1.00 0.00 O ATOM 1002 CB SER A 64 -7.857 5.403 10.454 1.00 0.00 C ATOM 1003 OG SER A 64 -8.005 5.570 11.857 1.00 0.00 O ATOM 0 H SER A 64 -6.152 3.413 8.758 1.00 0.00 H new ATOM 0 HA SER A 64 -5.777 5.900 10.180 1.00 0.00 H new ATOM 0 HB2 SER A 64 -8.118 6.326 9.937 1.00 0.00 H new ATOM 0 HB3 SER A 64 -8.539 4.632 10.094 1.00 0.00 H new ATOM 0 HG SER A 64 -8.930 5.821 12.061 1.00 0.00 H new ATOM 1009 N SER A 65 -5.821 4.395 12.411 1.00 0.00 N ATOM 1010 CA SER A 65 -5.347 3.462 13.481 1.00 0.00 C ATOM 1011 C SER A 65 -5.929 2.062 13.264 1.00 0.00 C ATOM 1012 O SER A 65 -5.245 1.157 12.823 1.00 0.00 O ATOM 1013 CB SER A 65 -5.794 3.989 14.844 1.00 0.00 C ATOM 1014 OG SER A 65 -7.214 4.011 14.896 1.00 0.00 O ATOM 0 H SER A 65 -6.043 5.337 12.733 1.00 0.00 H new ATOM 0 HA SER A 65 -4.259 3.402 13.442 1.00 0.00 H new ATOM 0 HB2 SER A 65 -5.399 3.356 15.639 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.397 4.991 15.007 1.00 0.00 H new ATOM 0 HG SER A 65 -7.504 4.347 15.770 1.00 0.00 H new ATOM 1020 N LEU A 66 -7.181 1.865 13.572 1.00 0.00 N ATOM 1021 CA LEU A 66 -7.788 0.520 13.384 1.00 0.00 C ATOM 1022 C LEU A 66 -7.525 0.019 11.962 1.00 0.00 C ATOM 1023 O LEU A 66 -6.788 -0.923 11.761 1.00 0.00 O ATOM 1024 CB LEU A 66 -9.301 0.621 13.627 1.00 0.00 C ATOM 1025 CG LEU A 66 -9.996 -0.706 13.285 1.00 0.00 C ATOM 1026 CD1 LEU A 66 -9.332 -1.861 14.046 1.00 0.00 C ATOM 1027 CD2 LEU A 66 -11.471 -0.613 13.687 1.00 0.00 C ATOM 0 H LEU A 66 -7.809 2.577 13.945 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.345 -0.183 14.089 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.491 0.878 14.669 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.719 1.423 13.019 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.911 -0.893 12.215 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -9.832 -2.797 13.796 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -8.281 -1.925 13.765 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -9.410 -1.683 15.118 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.973 -1.551 13.448 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.545 -0.424 14.758 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.946 0.202 13.141 1.00 0.00 H new ATOM 1039 N VAL A 67 -8.176 0.605 10.984 1.00 0.00 N ATOM 1040 CA VAL A 67 -8.025 0.133 9.568 1.00 0.00 C ATOM 1041 C VAL A 67 -6.584 -0.336 9.294 1.00 0.00 C ATOM 1042 O VAL A 67 -6.364 -1.395 8.744 1.00 0.00 O ATOM 1043 CB VAL A 67 -8.405 1.257 8.604 1.00 0.00 C ATOM 1044 CG1 VAL A 67 -8.267 0.766 7.161 1.00 0.00 C ATOM 1045 CG2 VAL A 67 -9.856 1.674 8.860 1.00 0.00 C ATOM 0 H VAL A 67 -8.810 1.395 11.106 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.692 -0.715 9.414 1.00 0.00 H new ATOM 0 HB VAL A 67 -7.743 2.109 8.762 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -8.538 1.569 6.476 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.236 0.464 6.976 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.928 -0.086 7.002 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -10.131 2.476 8.174 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -10.514 0.819 8.701 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.958 2.024 9.887 1.00 0.00 H new ATOM 1055 N ALA A 68 -5.594 0.431 9.695 1.00 0.00 N ATOM 1056 CA ALA A 68 -4.177 -0.003 9.475 1.00 0.00 C ATOM 1057 C ALA A 68 -4.040 -1.447 9.957 1.00 0.00 C ATOM 1058 O ALA A 68 -3.461 -2.291 9.294 1.00 0.00 O ATOM 1059 CB ALA A 68 -3.234 0.897 10.279 1.00 0.00 C ATOM 0 H ALA A 68 -5.706 1.331 10.161 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.920 0.069 8.418 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -2.204 0.580 10.118 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.351 1.930 9.953 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.475 0.822 11.339 1.00 0.00 H new ATOM 1065 N SER A 69 -4.634 -1.744 11.080 1.00 0.00 N ATOM 1066 CA SER A 69 -4.626 -3.133 11.603 1.00 0.00 C ATOM 1067 C SER A 69 -5.159 -4.059 10.508 1.00 0.00 C ATOM 1068 O SER A 69 -4.458 -4.868 9.935 1.00 0.00 O ATOM 1069 CB SER A 69 -5.587 -3.188 12.802 1.00 0.00 C ATOM 1070 OG SER A 69 -5.374 -4.401 13.513 1.00 0.00 O ATOM 0 H SER A 69 -5.131 -1.071 11.663 1.00 0.00 H new ATOM 0 HA SER A 69 -3.622 -3.436 11.899 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.420 -2.333 13.458 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.620 -3.129 12.459 1.00 0.00 H new ATOM 0 HG SER A 69 -5.983 -4.442 14.280 1.00 0.00 H new ATOM 1076 N LEU A 70 -6.431 -3.916 10.247 1.00 0.00 N ATOM 1077 CA LEU A 70 -7.164 -4.719 9.230 1.00 0.00 C ATOM 1078 C LEU A 70 -6.366 -4.963 7.936 1.00 0.00 C ATOM 1079 O LEU A 70 -6.148 -6.085 7.517 1.00 0.00 O ATOM 1080 CB LEU A 70 -8.426 -3.897 8.838 1.00 0.00 C ATOM 1081 CG LEU A 70 -9.558 -4.061 9.881 1.00 0.00 C ATOM 1082 CD1 LEU A 70 -10.123 -5.497 9.865 1.00 0.00 C ATOM 1083 CD2 LEU A 70 -9.038 -3.722 11.282 1.00 0.00 C ATOM 0 H LEU A 70 -7.021 -3.236 10.727 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.378 -5.694 9.669 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -8.162 -2.843 8.749 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.782 -4.220 7.860 1.00 0.00 H new ATOM 0 HG LEU A 70 -10.362 -3.373 9.619 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.917 -5.584 10.607 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -10.525 -5.719 8.876 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.327 -6.204 10.100 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.843 -3.841 12.007 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.217 -4.392 11.538 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.683 -2.691 11.299 1.00 0.00 H new ATOM 1095 N HIS A 71 -6.087 -3.898 7.219 1.00 0.00 N ATOM 1096 CA HIS A 71 -5.486 -4.051 5.860 1.00 0.00 C ATOM 1097 C HIS A 71 -4.212 -4.914 5.883 1.00 0.00 C ATOM 1098 O HIS A 71 -4.106 -5.945 5.218 1.00 0.00 O ATOM 1099 CB HIS A 71 -5.194 -2.653 5.267 1.00 0.00 C ATOM 1100 CG HIS A 71 -4.114 -2.723 4.216 1.00 0.00 C ATOM 1101 ND1 HIS A 71 -2.769 -2.664 4.542 1.00 0.00 N ATOM 1102 CD2 HIS A 71 -4.164 -2.848 2.851 1.00 0.00 C ATOM 1103 CE1 HIS A 71 -2.070 -2.754 3.399 1.00 0.00 C ATOM 1104 NE2 HIS A 71 -2.872 -2.868 2.336 1.00 0.00 N ATOM 0 H HIS A 71 -6.250 -2.936 7.517 1.00 0.00 H new ATOM 0 HA HIS A 71 -6.204 -4.572 5.227 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -6.104 -2.243 4.830 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -4.888 -1.974 6.063 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.069 -2.920 2.265 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -0.991 -2.736 3.345 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -2.596 -2.952 1.358 1.00 0.00 H new ATOM 1112 N HIS A 72 -3.213 -4.469 6.607 1.00 0.00 N ATOM 1113 CA HIS A 72 -1.950 -5.241 6.609 1.00 0.00 C ATOM 1114 C HIS A 72 -2.215 -6.576 7.278 1.00 0.00 C ATOM 1115 O HIS A 72 -1.466 -7.506 7.117 1.00 0.00 O ATOM 1116 CB HIS A 72 -0.826 -4.477 7.309 1.00 0.00 C ATOM 1117 CG HIS A 72 0.471 -5.213 7.119 1.00 0.00 C ATOM 1118 ND1 HIS A 72 1.221 -5.102 5.959 1.00 0.00 N ATOM 1119 CD2 HIS A 72 1.162 -6.078 7.931 1.00 0.00 C ATOM 1120 CE1 HIS A 72 2.309 -5.881 6.104 1.00 0.00 C ATOM 1121 NE2 HIS A 72 2.322 -6.499 7.288 1.00 0.00 N ATOM 0 H HIS A 72 -3.223 -3.625 7.180 1.00 0.00 H new ATOM 0 HA HIS A 72 -1.616 -5.402 5.584 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -0.748 -3.469 6.902 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -1.047 -4.375 8.371 1.00 0.00 H new ATOM 0 HD2 HIS A 72 0.852 -6.385 8.919 1.00 0.00 H new ATOM 0 HE1 HIS A 72 3.078 -5.993 5.354 1.00 0.00 H new ATOM 0 HE2 HIS A 72 3.030 -7.141 7.644 1.00 0.00 H new ATOM 1129 N GLN A 73 -3.317 -6.702 7.978 1.00 0.00 N ATOM 1130 CA GLN A 73 -3.641 -8.024 8.585 1.00 0.00 C ATOM 1131 C GLN A 73 -3.536 -9.035 7.446 1.00 0.00 C ATOM 1132 O GLN A 73 -2.753 -9.959 7.483 1.00 0.00 O ATOM 1133 CB GLN A 73 -5.065 -8.017 9.170 1.00 0.00 C ATOM 1134 CG GLN A 73 -5.191 -9.106 10.241 1.00 0.00 C ATOM 1135 CD GLN A 73 -4.998 -10.479 9.596 1.00 0.00 C ATOM 1136 OE1 GLN A 73 -5.857 -10.954 8.880 1.00 0.00 O ATOM 1137 NE2 GLN A 73 -3.896 -11.143 9.820 1.00 0.00 N ATOM 0 H GLN A 73 -3.993 -5.959 8.151 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.964 -8.267 9.404 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.286 -7.041 9.603 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.794 -8.187 8.378 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -4.446 -8.951 11.022 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.169 -9.051 10.718 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -3.174 -10.745 10.421 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -3.757 -12.059 9.394 1.00 0.00 H new ATOM 1146 N GLN A 74 -4.320 -8.851 6.417 1.00 0.00 N ATOM 1147 CA GLN A 74 -4.243 -9.788 5.263 1.00 0.00 C ATOM 1148 C GLN A 74 -2.759 -9.928 4.890 1.00 0.00 C ATOM 1149 O GLN A 74 -2.115 -10.910 5.202 1.00 0.00 O ATOM 1150 CB GLN A 74 -5.020 -9.192 4.085 1.00 0.00 C ATOM 1151 CG GLN A 74 -6.523 -9.273 4.376 1.00 0.00 C ATOM 1152 CD GLN A 74 -7.310 -8.717 3.189 1.00 0.00 C ATOM 1153 OE1 GLN A 74 -7.877 -9.544 2.353 1.00 0.00 O flip ATOM 1154 NE2 GLN A 74 -7.413 -7.518 3.021 1.00 0.00 N flip ATOM 0 H GLN A 74 -5.004 -8.099 6.327 1.00 0.00 H new ATOM 0 HA GLN A 74 -4.669 -10.760 5.511 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -4.724 -8.155 3.927 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -4.786 -9.734 3.169 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -6.811 -10.307 4.563 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.759 -8.708 5.278 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.970 -6.872 3.674 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -7.942 -7.158 2.227 1.00 0.00 H new ATOM 1163 N LEU A 75 -2.208 -8.894 4.266 1.00 0.00 N ATOM 1164 CA LEU A 75 -0.745 -8.872 3.900 1.00 0.00 C ATOM 1165 C LEU A 75 0.100 -9.557 4.982 1.00 0.00 C ATOM 1166 O LEU A 75 0.753 -10.540 4.698 1.00 0.00 O ATOM 1167 CB LEU A 75 -0.311 -7.392 3.732 1.00 0.00 C ATOM 1168 CG LEU A 75 0.779 -7.241 2.637 1.00 0.00 C ATOM 1169 CD1 LEU A 75 2.001 -8.088 3.009 1.00 0.00 C ATOM 1170 CD2 LEU A 75 0.238 -7.673 1.254 1.00 0.00 C ATOM 0 H LEU A 75 -2.721 -8.056 3.994 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.590 -9.418 2.970 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.178 -6.785 3.471 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.069 -7.013 4.681 1.00 0.00 H new ATOM 0 HG LEU A 75 1.067 -6.191 2.576 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.766 -7.981 2.240 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.400 -7.751 3.966 1.00 0.00 H new ATOM 0 HD13 LEU A 75 1.708 -9.135 3.087 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.021 -7.558 0.505 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.074 -8.717 1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.615 -7.050 0.986 1.00 0.00 H new ATOM 1182 N ASP A 76 0.091 -9.060 6.199 1.00 0.00 N ATOM 1183 CA ASP A 76 0.886 -9.688 7.318 1.00 0.00 C ATOM 1184 C ASP A 76 1.146 -11.172 7.046 1.00 0.00 C ATOM 1185 O ASP A 76 2.246 -11.607 6.740 1.00 0.00 O ATOM 1186 CB ASP A 76 0.048 -9.606 8.609 1.00 0.00 C ATOM 1187 CG ASP A 76 0.911 -10.034 9.799 1.00 0.00 C ATOM 1188 OD1 ASP A 76 1.313 -11.185 9.830 1.00 0.00 O ATOM 1189 OD2 ASP A 76 1.155 -9.202 10.658 1.00 0.00 O ATOM 0 H ASP A 76 -0.440 -8.233 6.472 1.00 0.00 H new ATOM 0 HA ASP A 76 1.836 -9.160 7.404 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -0.316 -8.589 8.756 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.828 -10.250 8.530 1.00 0.00 H new ATOM 1194 N SER A 77 0.101 -11.944 7.155 1.00 0.00 N ATOM 1195 CA SER A 77 0.193 -13.399 6.923 1.00 0.00 C ATOM 1196 C SER A 77 0.252 -13.691 5.432 1.00 0.00 C ATOM 1197 O SER A 77 0.839 -14.671 5.018 1.00 0.00 O ATOM 1198 CB SER A 77 -1.055 -14.059 7.489 1.00 0.00 C ATOM 1199 OG SER A 77 -1.026 -13.986 8.909 1.00 0.00 O ATOM 0 H SER A 77 -0.832 -11.612 7.401 1.00 0.00 H new ATOM 0 HA SER A 77 1.093 -13.782 7.404 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.947 -13.563 7.107 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.107 -15.100 7.168 1.00 0.00 H new ATOM 0 HG SER A 77 -1.831 -14.409 9.275 1.00 0.00 H new ATOM 1205 N LEU A 78 -0.364 -12.874 4.606 1.00 0.00 N ATOM 1206 CA LEU A 78 -0.327 -13.170 3.155 1.00 0.00 C ATOM 1207 C LEU A 78 1.122 -13.404 2.768 1.00 0.00 C ATOM 1208 O LEU A 78 1.459 -14.413 2.192 1.00 0.00 O ATOM 1209 CB LEU A 78 -0.935 -12.002 2.354 1.00 0.00 C ATOM 1210 CG LEU A 78 -1.788 -12.543 1.209 1.00 0.00 C ATOM 1211 CD1 LEU A 78 -2.625 -11.409 0.603 1.00 0.00 C ATOM 1212 CD2 LEU A 78 -0.877 -13.138 0.135 1.00 0.00 C ATOM 0 H LEU A 78 -0.878 -12.035 4.876 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.918 -14.057 2.929 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.544 -11.379 3.009 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.141 -11.369 1.959 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.456 -13.315 1.590 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.232 -11.801 -0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.276 -10.988 1.369 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.963 -10.631 0.222 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.484 -13.525 -0.683 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.208 -12.365 -0.243 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.289 -13.949 0.565 1.00 0.00 H new ATOM 1224 N ILE A 79 2.001 -12.508 3.136 1.00 0.00 N ATOM 1225 CA ILE A 79 3.434 -12.722 2.850 1.00 0.00 C ATOM 1226 C ILE A 79 3.801 -14.094 3.418 1.00 0.00 C ATOM 1227 O ILE A 79 4.307 -14.948 2.718 1.00 0.00 O ATOM 1228 CB ILE A 79 4.240 -11.550 3.517 1.00 0.00 C ATOM 1229 CG1 ILE A 79 5.316 -11.020 2.548 1.00 0.00 C ATOM 1230 CG2 ILE A 79 4.938 -11.965 4.828 1.00 0.00 C ATOM 1231 CD1 ILE A 79 4.674 -10.419 1.285 1.00 0.00 C ATOM 0 H ILE A 79 1.779 -11.639 3.622 1.00 0.00 H new ATOM 0 HA ILE A 79 3.668 -12.715 1.785 1.00 0.00 H new ATOM 0 HB ILE A 79 3.507 -10.778 3.750 1.00 0.00 H new ATOM 0 HG12 ILE A 79 5.920 -10.263 3.048 1.00 0.00 H new ATOM 0 HG13 ILE A 79 5.989 -11.830 2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 79 5.477 -11.112 5.239 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.191 -12.303 5.547 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.639 -12.775 4.626 1.00 0.00 H new ATOM 0 HD11 ILE A 79 5.455 -10.053 0.619 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.091 -11.185 0.774 1.00 0.00 H new ATOM 0 HD13 ILE A 79 4.021 -9.593 1.567 1.00 0.00 H new ATOM 1243 N SER A 80 3.559 -14.310 4.685 1.00 0.00 N ATOM 1244 CA SER A 80 3.910 -15.626 5.278 1.00 0.00 C ATOM 1245 C SER A 80 3.392 -16.750 4.380 1.00 0.00 C ATOM 1246 O SER A 80 4.126 -17.650 4.003 1.00 0.00 O ATOM 1247 CB SER A 80 3.274 -15.757 6.662 1.00 0.00 C ATOM 1248 OG SER A 80 3.609 -14.619 7.445 1.00 0.00 O ATOM 0 H SER A 80 3.138 -13.637 5.326 1.00 0.00 H new ATOM 0 HA SER A 80 4.994 -15.697 5.367 1.00 0.00 H new ATOM 0 HB2 SER A 80 2.191 -15.843 6.570 1.00 0.00 H new ATOM 0 HB3 SER A 80 3.626 -16.665 7.151 1.00 0.00 H new ATOM 0 HG SER A 80 3.201 -14.701 8.332 1.00 0.00 H new ATOM 1254 N GLU A 81 2.131 -16.726 4.041 1.00 0.00 N ATOM 1255 CA GLU A 81 1.586 -17.815 3.199 1.00 0.00 C ATOM 1256 C GLU A 81 2.019 -17.658 1.742 1.00 0.00 C ATOM 1257 O GLU A 81 2.089 -18.631 1.012 1.00 0.00 O ATOM 1258 CB GLU A 81 0.057 -17.789 3.271 1.00 0.00 C ATOM 1259 CG GLU A 81 -0.513 -18.981 2.499 1.00 0.00 C ATOM 1260 CD GLU A 81 -2.035 -19.009 2.651 1.00 0.00 C ATOM 1261 OE1 GLU A 81 -2.513 -18.628 3.707 1.00 0.00 O ATOM 1262 OE2 GLU A 81 -2.697 -19.411 1.708 1.00 0.00 O ATOM 0 H GLU A 81 1.464 -16.003 4.311 1.00 0.00 H new ATOM 0 HA GLU A 81 1.971 -18.763 3.574 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -0.269 -17.826 4.310 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -0.321 -16.857 2.852 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -0.244 -18.907 1.445 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -0.083 -19.910 2.874 1.00 0.00 H new ATOM 1269 N ALA A 82 2.265 -16.458 1.268 1.00 0.00 N ATOM 1270 CA ALA A 82 2.621 -16.338 -0.176 1.00 0.00 C ATOM 1271 C ALA A 82 4.061 -16.783 -0.374 1.00 0.00 C ATOM 1272 O ALA A 82 4.398 -17.454 -1.320 1.00 0.00 O ATOM 1273 CB ALA A 82 2.464 -14.891 -0.648 1.00 0.00 C ATOM 0 H ALA A 82 2.236 -15.588 1.799 1.00 0.00 H new ATOM 0 HA ALA A 82 1.952 -16.970 -0.760 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.728 -14.822 -1.703 1.00 0.00 H new ATOM 0 HB2 ALA A 82 1.430 -14.574 -0.511 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.122 -14.245 -0.067 1.00 0.00 H new ATOM 1279 N GLU A 83 4.933 -16.373 0.515 1.00 0.00 N ATOM 1280 CA GLU A 83 6.355 -16.747 0.351 1.00 0.00 C ATOM 1281 C GLU A 83 6.425 -18.265 0.279 1.00 0.00 C ATOM 1282 O GLU A 83 7.203 -18.837 -0.459 1.00 0.00 O ATOM 1283 CB GLU A 83 7.187 -16.218 1.530 1.00 0.00 C ATOM 1284 CG GLU A 83 7.597 -14.760 1.276 1.00 0.00 C ATOM 1285 CD GLU A 83 8.811 -14.720 0.343 1.00 0.00 C ATOM 1286 OE1 GLU A 83 9.837 -15.264 0.715 1.00 0.00 O ATOM 1287 OE2 GLU A 83 8.692 -14.148 -0.727 1.00 0.00 O ATOM 0 H GLU A 83 4.717 -15.804 1.333 1.00 0.00 H new ATOM 0 HA GLU A 83 6.764 -16.308 -0.559 1.00 0.00 H new ATOM 0 HB2 GLU A 83 6.609 -16.286 2.452 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.075 -16.835 1.664 1.00 0.00 H new ATOM 0 HG2 GLU A 83 6.767 -14.211 0.832 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.835 -14.269 2.220 1.00 0.00 H new ATOM 1294 N THR A 84 5.588 -18.916 1.034 1.00 0.00 N ATOM 1295 CA THR A 84 5.561 -20.396 1.016 1.00 0.00 C ATOM 1296 C THR A 84 5.302 -20.869 -0.428 1.00 0.00 C ATOM 1297 O THR A 84 5.950 -21.772 -0.918 1.00 0.00 O ATOM 1298 CB THR A 84 4.426 -20.865 1.960 1.00 0.00 C ATOM 1299 OG1 THR A 84 3.824 -19.723 2.552 1.00 0.00 O ATOM 1300 CG2 THR A 84 4.976 -21.768 3.074 1.00 0.00 C ATOM 0 H THR A 84 4.917 -18.479 1.667 1.00 0.00 H new ATOM 0 HA THR A 84 6.509 -20.815 1.354 1.00 0.00 H new ATOM 0 HB THR A 84 3.698 -21.431 1.379 1.00 0.00 H new ATOM 0 HG1 THR A 84 4.430 -19.344 3.223 1.00 0.00 H new ATOM 0 HG21 THR A 84 4.159 -22.084 3.723 1.00 0.00 H new ATOM 0 HG22 THR A 84 5.448 -22.645 2.632 1.00 0.00 H new ATOM 0 HG23 THR A 84 5.712 -21.217 3.659 1.00 0.00 H new ATOM 1308 N ARG A 85 4.334 -20.279 -1.094 1.00 0.00 N ATOM 1309 CA ARG A 85 3.998 -20.704 -2.492 1.00 0.00 C ATOM 1310 C ARG A 85 5.263 -20.996 -3.300 1.00 0.00 C ATOM 1311 O ARG A 85 5.278 -21.900 -4.112 1.00 0.00 O ATOM 1312 CB ARG A 85 3.186 -19.605 -3.200 1.00 0.00 C ATOM 1313 CG ARG A 85 3.036 -19.929 -4.707 1.00 0.00 C ATOM 1314 CD ARG A 85 4.281 -19.469 -5.519 1.00 0.00 C ATOM 1315 NE ARG A 85 3.844 -18.731 -6.749 1.00 0.00 N ATOM 1316 CZ ARG A 85 2.910 -19.207 -7.532 1.00 0.00 C ATOM 1317 NH1 ARG A 85 2.401 -20.387 -7.310 1.00 0.00 N ATOM 1318 NH2 ARG A 85 2.506 -18.511 -8.559 1.00 0.00 N ATOM 0 H ARG A 85 3.761 -19.519 -0.727 1.00 0.00 H new ATOM 0 HA ARG A 85 3.405 -21.617 -2.429 1.00 0.00 H new ATOM 0 HB2 ARG A 85 2.201 -19.519 -2.741 1.00 0.00 H new ATOM 0 HB3 ARG A 85 3.681 -18.642 -3.076 1.00 0.00 H new ATOM 0 HG2 ARG A 85 2.893 -21.002 -4.836 1.00 0.00 H new ATOM 0 HG3 ARG A 85 2.144 -19.439 -5.098 1.00 0.00 H new ATOM 0 HD2 ARG A 85 4.910 -18.827 -4.903 1.00 0.00 H new ATOM 0 HD3 ARG A 85 4.884 -20.333 -5.798 1.00 0.00 H new ATOM 0 HE ARG A 85 4.284 -17.840 -6.980 1.00 0.00 H new ATOM 0 HH11 ARG A 85 2.731 -20.945 -6.522 1.00 0.00 H new ATOM 0 HH12 ARG A 85 1.673 -20.752 -7.924 1.00 0.00 H new ATOM 0 HH21 ARG A 85 2.918 -17.598 -8.750 1.00 0.00 H new ATOM 0 HH22 ARG A 85 1.778 -18.880 -9.171 1.00 0.00 H new ATOM 1332 N GLY A 86 6.331 -20.258 -3.088 1.00 0.00 N ATOM 1333 CA GLY A 86 7.599 -20.515 -3.856 1.00 0.00 C ATOM 1334 C GLY A 86 7.886 -19.351 -4.819 1.00 0.00 C ATOM 1335 O GLY A 86 7.977 -19.537 -6.016 1.00 0.00 O ATOM 0 H GLY A 86 6.381 -19.490 -2.418 1.00 0.00 H new ATOM 0 HA2 GLY A 86 8.432 -20.637 -3.164 1.00 0.00 H new ATOM 0 HA3 GLY A 86 7.510 -21.446 -4.416 1.00 0.00 H new ATOM 1339 N ILE A 87 8.040 -18.155 -4.308 1.00 0.00 N ATOM 1340 CA ILE A 87 8.333 -16.985 -5.200 1.00 0.00 C ATOM 1341 C ILE A 87 9.647 -17.225 -5.958 1.00 0.00 C ATOM 1342 O ILE A 87 10.059 -18.344 -6.194 1.00 0.00 O ATOM 1343 CB ILE A 87 8.497 -15.705 -4.350 1.00 0.00 C ATOM 1344 CG1 ILE A 87 7.517 -15.734 -3.175 1.00 0.00 C ATOM 1345 CG2 ILE A 87 8.249 -14.437 -5.208 1.00 0.00 C ATOM 1346 CD1 ILE A 87 6.094 -16.000 -3.678 1.00 0.00 C ATOM 0 H ILE A 87 7.976 -17.936 -3.314 1.00 0.00 H new ATOM 0 HA ILE A 87 7.507 -16.869 -5.902 1.00 0.00 H new ATOM 0 HB ILE A 87 9.519 -15.671 -3.972 1.00 0.00 H new ATOM 0 HG12 ILE A 87 7.811 -16.508 -2.466 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.550 -14.784 -2.641 1.00 0.00 H new ATOM 0 HG21 ILE A 87 8.370 -13.549 -4.588 1.00 0.00 H new ATOM 0 HG22 ILE A 87 8.966 -14.407 -6.029 1.00 0.00 H new ATOM 0 HG23 ILE A 87 7.237 -14.463 -5.611 1.00 0.00 H new ATOM 0 HD11 ILE A 87 5.407 -16.018 -2.832 1.00 0.00 H new ATOM 0 HD12 ILE A 87 5.799 -15.210 -4.369 1.00 0.00 H new ATOM 0 HD13 ILE A 87 6.063 -16.961 -4.191 1.00 0.00 H new ATOM 1358 N THR A 88 10.306 -16.153 -6.306 1.00 0.00 N ATOM 1359 CA THR A 88 11.610 -16.260 -7.012 1.00 0.00 C ATOM 1360 C THR A 88 12.613 -16.834 -6.017 1.00 0.00 C ATOM 1361 O THR A 88 13.613 -16.222 -5.697 1.00 0.00 O ATOM 1362 CB THR A 88 12.070 -14.874 -7.472 1.00 0.00 C ATOM 1363 OG1 THR A 88 11.006 -14.226 -8.156 1.00 0.00 O ATOM 1364 CG2 THR A 88 13.270 -15.016 -8.409 1.00 0.00 C ATOM 0 H THR A 88 9.991 -15.199 -6.128 1.00 0.00 H new ATOM 0 HA THR A 88 11.524 -16.899 -7.891 1.00 0.00 H new ATOM 0 HB THR A 88 12.359 -14.281 -6.604 1.00 0.00 H new ATOM 0 HG1 THR A 88 11.299 -13.338 -8.450 1.00 0.00 H new ATOM 0 HG21 THR A 88 13.596 -14.028 -8.735 1.00 0.00 H new ATOM 0 HG22 THR A 88 14.086 -15.512 -7.883 1.00 0.00 H new ATOM 0 HG23 THR A 88 12.985 -15.609 -9.278 1.00 0.00 H new ATOM 1372 N SER A 89 12.332 -18.003 -5.505 1.00 0.00 N ATOM 1373 CA SER A 89 13.240 -18.631 -4.501 1.00 0.00 C ATOM 1374 C SER A 89 13.634 -17.581 -3.456 1.00 0.00 C ATOM 1375 O SER A 89 14.573 -17.760 -2.713 1.00 0.00 O ATOM 1376 CB SER A 89 14.488 -19.181 -5.191 1.00 0.00 C ATOM 1377 OG SER A 89 14.097 -20.005 -6.281 1.00 0.00 O ATOM 0 H SER A 89 11.506 -18.554 -5.741 1.00 0.00 H new ATOM 0 HA SER A 89 12.725 -19.457 -4.011 1.00 0.00 H new ATOM 0 HB2 SER A 89 15.113 -18.361 -5.546 1.00 0.00 H new ATOM 0 HB3 SER A 89 15.086 -19.754 -4.483 1.00 0.00 H new ATOM 0 HG SER A 89 14.895 -20.358 -6.727 1.00 0.00 H new ATOM 1383 N TYR A 90 12.878 -16.507 -3.392 1.00 0.00 N ATOM 1384 CA TYR A 90 13.115 -15.401 -2.402 1.00 0.00 C ATOM 1385 C TYR A 90 14.596 -14.991 -2.299 1.00 0.00 C ATOM 1386 O TYR A 90 15.482 -15.805 -2.152 1.00 0.00 O ATOM 1387 CB TYR A 90 12.583 -15.813 -1.023 1.00 0.00 C ATOM 1388 CG TYR A 90 12.983 -17.234 -0.707 1.00 0.00 C ATOM 1389 CD1 TYR A 90 12.156 -18.295 -1.095 1.00 0.00 C ATOM 1390 CD2 TYR A 90 14.178 -17.491 -0.025 1.00 0.00 C ATOM 1391 CE1 TYR A 90 12.524 -19.613 -0.802 1.00 0.00 C ATOM 1392 CE2 TYR A 90 14.546 -18.809 0.269 1.00 0.00 C ATOM 1393 CZ TYR A 90 13.720 -19.870 -0.120 1.00 0.00 C ATOM 1394 OH TYR A 90 14.083 -21.170 0.169 1.00 0.00 O ATOM 0 H TYR A 90 12.080 -16.346 -4.006 1.00 0.00 H new ATOM 0 HA TYR A 90 12.574 -14.527 -2.765 1.00 0.00 H new ATOM 0 HB2 TYR A 90 12.974 -15.140 -0.260 1.00 0.00 H new ATOM 0 HB3 TYR A 90 11.497 -15.721 -1.003 1.00 0.00 H new ATOM 0 HD1 TYR A 90 11.234 -18.096 -1.621 1.00 0.00 H new ATOM 0 HD2 TYR A 90 14.816 -16.673 0.274 1.00 0.00 H new ATOM 0 HE1 TYR A 90 11.886 -20.431 -1.102 1.00 0.00 H new ATOM 0 HE2 TYR A 90 15.468 -19.007 0.796 1.00 0.00 H new ATOM 0 HH TYR A 90 14.940 -21.172 0.644 1.00 0.00 H new ATOM 1404 N ASN A 91 14.862 -13.705 -2.370 1.00 0.00 N ATOM 1405 CA ASN A 91 16.273 -13.210 -2.281 1.00 0.00 C ATOM 1406 C ASN A 91 16.379 -11.965 -1.361 1.00 0.00 C ATOM 1407 O ASN A 91 17.240 -11.932 -0.505 1.00 0.00 O ATOM 1408 CB ASN A 91 16.813 -12.865 -3.710 1.00 0.00 C ATOM 1409 CG ASN A 91 15.850 -13.391 -4.781 1.00 0.00 C ATOM 1410 OD1 ASN A 91 15.293 -12.626 -5.543 1.00 0.00 O ATOM 1411 ND2 ASN A 91 15.633 -14.675 -4.872 1.00 0.00 N ATOM 0 H ASN A 91 14.158 -12.976 -2.486 1.00 0.00 H new ATOM 0 HA ASN A 91 16.880 -14.004 -1.846 1.00 0.00 H new ATOM 0 HB2 ASN A 91 16.928 -11.786 -3.812 1.00 0.00 H new ATOM 0 HB3 ASN A 91 17.800 -13.306 -3.850 1.00 0.00 H new ATOM 0 HD21 ASN A 91 14.996 -15.035 -5.583 1.00 0.00 H new ATOM 0 HD22 ASN A 91 16.100 -15.318 -4.233 1.00 0.00 H new ATOM 1418 N PRO A 92 15.558 -10.941 -1.591 1.00 0.00 N ATOM 1419 CA PRO A 92 15.633 -9.681 -0.817 1.00 0.00 C ATOM 1420 C PRO A 92 14.650 -9.637 0.358 1.00 0.00 C ATOM 1421 O PRO A 92 14.885 -8.934 1.321 1.00 0.00 O ATOM 1422 CB PRO A 92 15.223 -8.626 -1.861 1.00 0.00 C ATOM 1423 CG PRO A 92 14.395 -9.383 -2.947 1.00 0.00 C ATOM 1424 CD PRO A 92 14.503 -10.895 -2.625 1.00 0.00 C ATOM 0 HA PRO A 92 16.618 -9.540 -0.371 1.00 0.00 H new ATOM 0 HB2 PRO A 92 14.631 -7.835 -1.402 1.00 0.00 H new ATOM 0 HB3 PRO A 92 16.101 -8.153 -2.301 1.00 0.00 H new ATOM 0 HG2 PRO A 92 13.354 -9.059 -2.934 1.00 0.00 H new ATOM 0 HG3 PRO A 92 14.782 -9.172 -3.944 1.00 0.00 H new ATOM 0 HD2 PRO A 92 13.559 -11.297 -2.257 1.00 0.00 H new ATOM 0 HD3 PRO A 92 14.776 -11.477 -3.506 1.00 0.00 H new ATOM 1432 N LEU A 93 13.553 -10.338 0.307 1.00 0.00 N ATOM 1433 CA LEU A 93 12.611 -10.250 1.460 1.00 0.00 C ATOM 1434 C LEU A 93 13.403 -10.557 2.718 1.00 0.00 C ATOM 1435 O LEU A 93 13.410 -9.780 3.632 1.00 0.00 O ATOM 1436 CB LEU A 93 11.438 -11.228 1.293 1.00 0.00 C ATOM 1437 CG LEU A 93 11.107 -11.390 -0.209 1.00 0.00 C ATOM 1438 CD1 LEU A 93 11.805 -12.637 -0.752 1.00 0.00 C ATOM 1439 CD2 LEU A 93 9.588 -11.525 -0.407 1.00 0.00 C ATOM 0 H LEU A 93 13.271 -10.951 -0.458 1.00 0.00 H new ATOM 0 HA LEU A 93 12.178 -9.252 1.519 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.693 -12.195 1.726 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.564 -10.859 1.830 1.00 0.00 H new ATOM 0 HG LEU A 93 11.457 -10.509 -0.747 1.00 0.00 H new ATOM 0 HD11 LEU A 93 11.572 -12.752 -1.811 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.883 -12.534 -0.626 1.00 0.00 H new ATOM 0 HD13 LEU A 93 11.458 -13.515 -0.207 1.00 0.00 H new ATOM 0 HD21 LEU A 93 9.368 -11.638 -1.469 1.00 0.00 H new ATOM 0 HD22 LEU A 93 9.227 -12.400 0.134 1.00 0.00 H new ATOM 0 HD23 LEU A 93 9.091 -10.633 -0.027 1.00 0.00 H new ATOM 1451 N ALA A 94 14.052 -11.701 2.716 1.00 0.00 N ATOM 1452 CA ALA A 94 14.902 -12.179 3.868 1.00 0.00 C ATOM 1453 C ALA A 94 15.046 -11.079 4.927 1.00 0.00 C ATOM 1454 O ALA A 94 14.693 -11.246 6.078 1.00 0.00 O ATOM 1455 CB ALA A 94 16.280 -12.546 3.316 1.00 0.00 C ATOM 0 H ALA A 94 14.028 -12.352 1.931 1.00 0.00 H new ATOM 0 HA ALA A 94 14.432 -13.042 4.340 1.00 0.00 H new ATOM 0 HB1 ALA A 94 16.916 -12.895 4.129 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.175 -13.336 2.572 1.00 0.00 H new ATOM 0 HB3 ALA A 94 16.732 -11.669 2.853 1.00 0.00 H new ATOM 1461 N GLY A 95 15.522 -9.939 4.512 1.00 0.00 N ATOM 1462 CA GLY A 95 15.654 -8.781 5.448 1.00 0.00 C ATOM 1463 C GLY A 95 14.239 -8.328 5.861 1.00 0.00 C ATOM 1464 O GLY A 95 13.304 -9.090 5.744 1.00 0.00 O ATOM 0 H GLY A 95 15.829 -9.755 3.557 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.233 -9.067 6.326 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.189 -7.963 4.966 1.00 0.00 H new ATOM 1468 N PRO A 96 14.092 -7.113 6.337 1.00 0.00 N ATOM 1469 CA PRO A 96 12.755 -6.623 6.729 1.00 0.00 C ATOM 1470 C PRO A 96 11.924 -6.422 5.443 1.00 0.00 C ATOM 1471 O PRO A 96 12.461 -6.531 4.359 1.00 0.00 O ATOM 1472 CB PRO A 96 13.029 -5.296 7.468 1.00 0.00 C ATOM 1473 CG PRO A 96 14.557 -4.995 7.329 1.00 0.00 C ATOM 1474 CD PRO A 96 15.202 -6.175 6.561 1.00 0.00 C ATOM 0 HA PRO A 96 12.192 -7.303 7.369 1.00 0.00 H new ATOM 0 HB2 PRO A 96 12.437 -4.488 7.039 1.00 0.00 H new ATOM 0 HB3 PRO A 96 12.747 -5.375 8.518 1.00 0.00 H new ATOM 0 HG2 PRO A 96 14.715 -4.059 6.794 1.00 0.00 H new ATOM 0 HG3 PRO A 96 15.015 -4.882 8.311 1.00 0.00 H new ATOM 0 HD2 PRO A 96 15.640 -5.845 5.619 1.00 0.00 H new ATOM 0 HD3 PRO A 96 16.002 -6.636 7.140 1.00 0.00 H new ATOM 1482 N LEU A 97 10.641 -6.129 5.505 1.00 0.00 N ATOM 1483 CA LEU A 97 9.887 -5.940 4.221 1.00 0.00 C ATOM 1484 C LEU A 97 10.260 -4.577 3.628 1.00 0.00 C ATOM 1485 O LEU A 97 10.711 -4.496 2.506 1.00 0.00 O ATOM 1486 CB LEU A 97 8.378 -6.019 4.473 1.00 0.00 C ATOM 1487 CG LEU A 97 7.957 -7.483 4.636 1.00 0.00 C ATOM 1488 CD1 LEU A 97 8.822 -8.154 5.708 1.00 0.00 C ATOM 1489 CD2 LEU A 97 6.486 -7.543 5.056 1.00 0.00 C ATOM 0 H LEU A 97 10.099 -6.016 6.361 1.00 0.00 H new ATOM 0 HA LEU A 97 10.153 -6.730 3.519 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.119 -5.454 5.369 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.837 -5.565 3.643 1.00 0.00 H new ATOM 0 HG LEU A 97 8.090 -8.005 3.689 1.00 0.00 H new ATOM 0 HD11 LEU A 97 8.519 -9.195 5.821 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.870 -8.111 5.410 1.00 0.00 H new ATOM 0 HD13 LEU A 97 8.693 -7.634 6.657 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.183 -8.584 5.173 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.356 -7.019 6.003 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.870 -7.069 4.292 1.00 0.00 H new ATOM 1501 N ARG A 98 10.041 -3.506 4.358 1.00 0.00 N ATOM 1502 CA ARG A 98 10.375 -2.128 3.844 1.00 0.00 C ATOM 1503 C ARG A 98 11.692 -2.180 3.035 1.00 0.00 C ATOM 1504 O ARG A 98 11.968 -1.352 2.195 1.00 0.00 O ATOM 1505 CB ARG A 98 10.550 -1.193 5.072 1.00 0.00 C ATOM 1506 CG ARG A 98 9.626 0.026 4.960 1.00 0.00 C ATOM 1507 CD ARG A 98 9.941 1.014 6.085 1.00 0.00 C ATOM 1508 NE ARG A 98 11.378 1.403 6.017 1.00 0.00 N ATOM 1509 CZ ARG A 98 11.803 2.448 6.672 1.00 0.00 C ATOM 1510 NH1 ARG A 98 10.970 3.153 7.388 1.00 0.00 N ATOM 1511 NH2 ARG A 98 13.061 2.788 6.612 1.00 0.00 N ATOM 0 H ARG A 98 9.642 -3.524 5.296 1.00 0.00 H new ATOM 0 HA ARG A 98 9.581 -1.759 3.194 1.00 0.00 H new ATOM 0 HB2 ARG A 98 10.328 -1.741 5.988 1.00 0.00 H new ATOM 0 HB3 ARG A 98 11.587 -0.865 5.141 1.00 0.00 H new ATOM 0 HG2 ARG A 98 9.759 0.508 3.991 1.00 0.00 H new ATOM 0 HG3 ARG A 98 8.584 -0.288 5.019 1.00 0.00 H new ATOM 0 HD2 ARG A 98 9.309 1.898 5.995 1.00 0.00 H new ATOM 0 HD3 ARG A 98 9.721 0.562 7.052 1.00 0.00 H new ATOM 0 HE ARG A 98 12.029 0.852 5.458 1.00 0.00 H new ATOM 0 HH11 ARG A 98 9.986 2.887 7.435 1.00 0.00 H new ATOM 0 HH12 ARG A 98 11.303 3.970 7.900 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.712 2.237 6.053 1.00 0.00 H new ATOM 0 HH22 ARG A 98 13.393 3.605 7.124 1.00 0.00 H new ATOM 1525 N VAL A 99 12.467 -3.188 3.301 1.00 0.00 N ATOM 1526 CA VAL A 99 13.757 -3.393 2.586 1.00 0.00 C ATOM 1527 C VAL A 99 13.485 -4.164 1.285 1.00 0.00 C ATOM 1528 O VAL A 99 14.064 -3.881 0.255 1.00 0.00 O ATOM 1529 CB VAL A 99 14.719 -4.175 3.515 1.00 0.00 C ATOM 1530 CG1 VAL A 99 15.712 -5.017 2.697 1.00 0.00 C ATOM 1531 CG2 VAL A 99 15.509 -3.176 4.376 1.00 0.00 C ATOM 0 H VAL A 99 12.257 -3.898 4.002 1.00 0.00 H new ATOM 0 HA VAL A 99 14.220 -2.440 2.330 1.00 0.00 H new ATOM 0 HB VAL A 99 14.127 -4.841 4.143 1.00 0.00 H new ATOM 0 HG11 VAL A 99 16.376 -5.556 3.373 1.00 0.00 H new ATOM 0 HG12 VAL A 99 15.164 -5.730 2.082 1.00 0.00 H new ATOM 0 HG13 VAL A 99 16.302 -4.362 2.055 1.00 0.00 H new ATOM 0 HG21 VAL A 99 16.188 -3.719 5.033 1.00 0.00 H new ATOM 0 HG22 VAL A 99 16.083 -2.512 3.729 1.00 0.00 H new ATOM 0 HG23 VAL A 99 14.817 -2.587 4.978 1.00 0.00 H new ATOM 1541 N GLN A 100 12.621 -5.138 1.326 1.00 0.00 N ATOM 1542 CA GLN A 100 12.328 -5.924 0.097 1.00 0.00 C ATOM 1543 C GLN A 100 12.025 -4.990 -1.078 1.00 0.00 C ATOM 1544 O GLN A 100 12.586 -5.135 -2.143 1.00 0.00 O ATOM 1545 CB GLN A 100 11.144 -6.893 0.349 1.00 0.00 C ATOM 1546 CG GLN A 100 9.783 -6.236 0.060 1.00 0.00 C ATOM 1547 CD GLN A 100 8.664 -7.171 0.521 1.00 0.00 C ATOM 1548 OE1 GLN A 100 7.528 -6.759 0.654 1.00 0.00 O ATOM 1549 NE2 GLN A 100 8.938 -8.422 0.773 1.00 0.00 N ATOM 0 H GLN A 100 12.105 -5.424 2.158 1.00 0.00 H new ATOM 0 HA GLN A 100 13.208 -6.515 -0.158 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.260 -7.776 -0.279 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.169 -7.233 1.384 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.710 -5.280 0.578 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.685 -6.030 -1.006 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.891 -8.768 0.661 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.199 -9.054 1.081 1.00 0.00 H new ATOM 1558 N ALA A 101 11.108 -4.065 -0.923 1.00 0.00 N ATOM 1559 CA ALA A 101 10.748 -3.173 -2.077 1.00 0.00 C ATOM 1560 C ALA A 101 11.624 -1.916 -2.104 1.00 0.00 C ATOM 1561 O ALA A 101 11.978 -1.441 -3.165 1.00 0.00 O ATOM 1562 CB ALA A 101 9.272 -2.787 -1.979 1.00 0.00 C ATOM 0 H ALA A 101 10.597 -3.888 -0.058 1.00 0.00 H new ATOM 0 HA ALA A 101 10.924 -3.718 -3.004 1.00 0.00 H new ATOM 0 HB1 ALA A 101 9.009 -2.140 -2.816 1.00 0.00 H new ATOM 0 HB2 ALA A 101 8.658 -3.687 -2.009 1.00 0.00 H new ATOM 0 HB3 ALA A 101 9.096 -2.259 -1.042 1.00 0.00 H new ATOM 1568 N ASN A 102 11.991 -1.370 -0.983 1.00 0.00 N ATOM 1569 CA ASN A 102 12.857 -0.156 -1.020 1.00 0.00 C ATOM 1570 C ASN A 102 14.242 -0.570 -1.525 1.00 0.00 C ATOM 1571 O ASN A 102 15.257 -0.152 -1.004 1.00 0.00 O ATOM 1572 CB ASN A 102 12.983 0.447 0.380 1.00 0.00 C ATOM 1573 CG ASN A 102 13.628 1.831 0.281 1.00 0.00 C ATOM 1574 OD1 ASN A 102 13.215 2.651 -0.515 1.00 0.00 O ATOM 1575 ND2 ASN A 102 14.631 2.127 1.062 1.00 0.00 N ATOM 0 H ASN A 102 11.735 -1.703 -0.053 1.00 0.00 H new ATOM 0 HA ASN A 102 12.417 0.591 -1.681 1.00 0.00 H new ATOM 0 HB2 ASN A 102 12.000 0.524 0.845 1.00 0.00 H new ATOM 0 HB3 ASN A 102 13.586 -0.203 1.015 1.00 0.00 H new ATOM 0 HD21 ASN A 102 15.068 3.047 1.004 1.00 0.00 H new ATOM 0 HD22 ASN A 102 14.978 1.439 1.730 1.00 0.00 H new ATOM 1582 N ASN A 103 14.281 -1.406 -2.536 1.00 0.00 N ATOM 1583 CA ASN A 103 15.578 -1.889 -3.100 1.00 0.00 C ATOM 1584 C ASN A 103 15.628 -1.563 -4.609 1.00 0.00 C ATOM 1585 O ASN A 103 15.267 -2.393 -5.418 1.00 0.00 O ATOM 1586 CB ASN A 103 15.643 -3.408 -2.909 1.00 0.00 C ATOM 1587 CG ASN A 103 14.459 -4.068 -3.619 1.00 0.00 C ATOM 1588 OD1 ASN A 103 13.572 -3.393 -4.103 1.00 0.00 O ATOM 1589 ND2 ASN A 103 14.405 -5.369 -3.700 1.00 0.00 N ATOM 0 H ASN A 103 13.453 -1.779 -3.000 1.00 0.00 H new ATOM 0 HA ASN A 103 16.416 -1.406 -2.598 1.00 0.00 H new ATOM 0 HB2 ASN A 103 16.581 -3.795 -3.308 1.00 0.00 H new ATOM 0 HB3 ASN A 103 15.624 -3.652 -1.847 1.00 0.00 H new ATOM 0 HD21 ASN A 103 13.619 -5.819 -4.169 1.00 0.00 H new ATOM 0 HD22 ASN A 103 15.149 -5.937 -3.294 1.00 0.00 H new ATOM 1596 N PRO A 104 16.053 -0.365 -4.964 1.00 0.00 N ATOM 1597 CA PRO A 104 16.110 0.033 -6.385 1.00 0.00 C ATOM 1598 C PRO A 104 16.930 -0.979 -7.200 1.00 0.00 C ATOM 1599 O PRO A 104 16.688 -1.176 -8.374 1.00 0.00 O ATOM 1600 CB PRO A 104 16.760 1.436 -6.377 1.00 0.00 C ATOM 1601 CG PRO A 104 16.827 1.902 -4.895 1.00 0.00 C ATOM 1602 CD PRO A 104 16.509 0.674 -4.013 1.00 0.00 C ATOM 0 HA PRO A 104 15.127 0.055 -6.854 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.758 1.401 -6.815 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.174 2.135 -6.974 1.00 0.00 H new ATOM 0 HG2 PRO A 104 17.815 2.298 -4.661 1.00 0.00 H new ATOM 0 HG3 PRO A 104 16.111 2.703 -4.711 1.00 0.00 H new ATOM 0 HD2 PRO A 104 17.389 0.345 -3.460 1.00 0.00 H new ATOM 0 HD3 PRO A 104 15.738 0.904 -3.278 1.00 0.00 H new ATOM 1610 N GLN A 105 17.889 -1.625 -6.596 1.00 0.00 N ATOM 1611 CA GLN A 105 18.700 -2.619 -7.358 1.00 0.00 C ATOM 1612 C GLN A 105 17.835 -3.843 -7.677 1.00 0.00 C ATOM 1613 O GLN A 105 18.126 -4.606 -8.576 1.00 0.00 O ATOM 1614 CB GLN A 105 19.908 -3.045 -6.521 1.00 0.00 C ATOM 1615 CG GLN A 105 20.717 -1.808 -6.126 1.00 0.00 C ATOM 1616 CD GLN A 105 21.311 -1.164 -7.380 1.00 0.00 C ATOM 1617 OE1 GLN A 105 21.193 0.029 -7.578 1.00 0.00 O ATOM 1618 NE2 GLN A 105 21.948 -1.908 -8.242 1.00 0.00 N ATOM 0 H GLN A 105 18.146 -1.510 -5.616 1.00 0.00 H new ATOM 0 HA GLN A 105 19.049 -2.169 -8.288 1.00 0.00 H new ATOM 0 HB2 GLN A 105 19.576 -3.576 -5.629 1.00 0.00 H new ATOM 0 HB3 GLN A 105 20.532 -3.735 -7.089 1.00 0.00 H new ATOM 0 HG2 GLN A 105 20.079 -1.094 -5.605 1.00 0.00 H new ATOM 0 HG3 GLN A 105 21.513 -2.086 -5.436 1.00 0.00 H new ATOM 0 HE21 GLN A 105 22.047 -2.910 -8.076 1.00 0.00 H new ATOM 0 HE22 GLN A 105 22.347 -1.488 -9.082 1.00 0.00 H new ATOM 1627 N GLN A 106 16.766 -4.029 -6.945 1.00 0.00 N ATOM 1628 CA GLN A 106 15.861 -5.196 -7.192 1.00 0.00 C ATOM 1629 C GLN A 106 14.413 -4.731 -7.050 1.00 0.00 C ATOM 1630 O GLN A 106 13.762 -4.975 -6.053 1.00 0.00 O ATOM 1631 CB GLN A 106 16.157 -6.293 -6.166 1.00 0.00 C ATOM 1632 CG GLN A 106 17.485 -6.970 -6.510 1.00 0.00 C ATOM 1633 CD GLN A 106 17.322 -7.802 -7.783 1.00 0.00 C ATOM 1634 OE1 GLN A 106 18.118 -7.699 -8.695 1.00 0.00 O ATOM 1635 NE2 GLN A 106 16.317 -8.627 -7.884 1.00 0.00 N ATOM 0 H GLN A 106 16.478 -3.418 -6.180 1.00 0.00 H new ATOM 0 HA GLN A 106 16.023 -5.593 -8.194 1.00 0.00 H new ATOM 0 HB2 GLN A 106 16.203 -5.866 -5.164 1.00 0.00 H new ATOM 0 HB3 GLN A 106 15.352 -7.028 -6.162 1.00 0.00 H new ATOM 0 HG2 GLN A 106 18.262 -6.219 -6.652 1.00 0.00 H new ATOM 0 HG3 GLN A 106 17.804 -7.607 -5.685 1.00 0.00 H new ATOM 0 HE21 GLN A 106 15.649 -8.713 -7.118 1.00 0.00 H new ATOM 0 HE22 GLN A 106 16.199 -9.186 -8.729 1.00 0.00 H new ATOM 1644 N GLN A 107 13.909 -4.048 -8.042 1.00 0.00 N ATOM 1645 CA GLN A 107 12.508 -3.545 -7.976 1.00 0.00 C ATOM 1646 C GLN A 107 11.529 -4.652 -8.385 1.00 0.00 C ATOM 1647 O GLN A 107 10.332 -4.468 -8.346 1.00 0.00 O ATOM 1648 CB GLN A 107 12.351 -2.356 -8.925 1.00 0.00 C ATOM 1649 CG GLN A 107 13.191 -1.183 -8.418 1.00 0.00 C ATOM 1650 CD GLN A 107 12.974 0.030 -9.324 1.00 0.00 C ATOM 1651 OE1 GLN A 107 12.250 0.942 -8.976 1.00 0.00 O ATOM 1652 NE2 GLN A 107 13.575 0.081 -10.481 1.00 0.00 N ATOM 0 H GLN A 107 14.411 -3.816 -8.899 1.00 0.00 H new ATOM 0 HA GLN A 107 12.290 -3.236 -6.954 1.00 0.00 H new ATOM 0 HB2 GLN A 107 12.667 -2.635 -9.930 1.00 0.00 H new ATOM 0 HB3 GLN A 107 11.303 -2.065 -8.990 1.00 0.00 H new ATOM 0 HG2 GLN A 107 12.912 -0.939 -7.393 1.00 0.00 H new ATOM 0 HG3 GLN A 107 14.246 -1.456 -8.405 1.00 0.00 H new ATOM 0 HE21 GLN A 107 14.183 -0.684 -10.774 1.00 0.00 H new ATOM 0 HE22 GLN A 107 13.437 0.886 -11.092 1.00 0.00 H new ATOM 1661 N GLY A 108 12.020 -5.800 -8.781 1.00 0.00 N ATOM 1662 CA GLY A 108 11.097 -6.910 -9.187 1.00 0.00 C ATOM 1663 C GLY A 108 9.961 -7.019 -8.168 1.00 0.00 C ATOM 1664 O GLY A 108 8.839 -6.618 -8.406 1.00 0.00 O ATOM 0 H GLY A 108 13.015 -6.018 -8.841 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.693 -6.717 -10.181 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.644 -7.851 -9.242 1.00 0.00 H new ATOM 1668 N LEU A 109 10.277 -7.529 -7.022 1.00 0.00 N ATOM 1669 CA LEU A 109 9.256 -7.641 -5.943 1.00 0.00 C ATOM 1670 C LEU A 109 8.512 -6.306 -5.820 1.00 0.00 C ATOM 1671 O LEU A 109 7.303 -6.285 -5.804 1.00 0.00 O ATOM 1672 CB LEU A 109 9.931 -8.013 -4.613 1.00 0.00 C ATOM 1673 CG LEU A 109 10.205 -9.529 -4.583 1.00 0.00 C ATOM 1674 CD1 LEU A 109 11.436 -9.854 -5.433 1.00 0.00 C ATOM 1675 CD2 LEU A 109 10.442 -9.972 -3.140 1.00 0.00 C ATOM 0 H LEU A 109 11.204 -7.878 -6.778 1.00 0.00 H new ATOM 0 HA LEU A 109 8.542 -8.427 -6.190 1.00 0.00 H new ATOM 0 HB2 LEU A 109 10.864 -7.462 -4.500 1.00 0.00 H new ATOM 0 HB3 LEU A 109 9.291 -7.732 -3.777 1.00 0.00 H new ATOM 0 HG LEU A 109 9.344 -10.060 -4.990 1.00 0.00 H new ATOM 0 HD11 LEU A 109 11.623 -10.927 -5.407 1.00 0.00 H new ATOM 0 HD12 LEU A 109 11.260 -9.541 -6.462 1.00 0.00 H new ATOM 0 HD13 LEU A 109 12.302 -9.325 -5.036 1.00 0.00 H new ATOM 0 HD21 LEU A 109 10.636 -11.044 -3.116 1.00 0.00 H new ATOM 0 HD22 LEU A 109 11.300 -9.439 -2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 109 9.559 -9.750 -2.541 1.00 0.00 H new ATOM 1687 N ARG A 110 9.202 -5.202 -5.714 1.00 0.00 N ATOM 1688 CA ARG A 110 8.487 -3.882 -5.574 1.00 0.00 C ATOM 1689 C ARG A 110 7.250 -3.831 -6.492 1.00 0.00 C ATOM 1690 O ARG A 110 6.226 -3.282 -6.124 1.00 0.00 O ATOM 1691 CB ARG A 110 9.450 -2.730 -5.902 1.00 0.00 C ATOM 1692 CG ARG A 110 8.795 -1.364 -5.590 1.00 0.00 C ATOM 1693 CD ARG A 110 7.893 -0.879 -6.758 1.00 0.00 C ATOM 1694 NE ARG A 110 8.369 0.455 -7.258 1.00 0.00 N ATOM 1695 CZ ARG A 110 8.580 1.455 -6.442 1.00 0.00 C ATOM 1696 NH1 ARG A 110 8.294 1.340 -5.174 1.00 0.00 N ATOM 1697 NH2 ARG A 110 9.062 2.577 -6.902 1.00 0.00 N ATOM 0 H ARG A 110 10.221 -5.148 -5.717 1.00 0.00 H new ATOM 0 HA ARG A 110 8.146 -3.776 -4.544 1.00 0.00 H new ATOM 0 HB2 ARG A 110 10.367 -2.840 -5.323 1.00 0.00 H new ATOM 0 HB3 ARG A 110 9.731 -2.772 -6.954 1.00 0.00 H new ATOM 0 HG2 ARG A 110 8.200 -1.445 -4.680 1.00 0.00 H new ATOM 0 HG3 ARG A 110 9.571 -0.623 -5.398 1.00 0.00 H new ATOM 0 HD2 ARG A 110 7.911 -1.608 -7.569 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.859 -0.802 -6.422 1.00 0.00 H new ATOM 0 HE ARG A 110 8.531 0.584 -8.257 1.00 0.00 H new ATOM 0 HH11 ARG A 110 7.904 0.468 -4.816 1.00 0.00 H new ATOM 0 HH12 ARG A 110 8.460 2.122 -4.541 1.00 0.00 H new ATOM 0 HH21 ARG A 110 9.273 2.672 -7.895 1.00 0.00 H new ATOM 0 HH22 ARG A 110 9.228 3.359 -6.268 1.00 0.00 H new ATOM 1711 N ARG A 111 7.304 -4.427 -7.658 1.00 0.00 N ATOM 1712 CA ARG A 111 6.096 -4.421 -8.547 1.00 0.00 C ATOM 1713 C ARG A 111 5.221 -5.633 -8.211 1.00 0.00 C ATOM 1714 O ARG A 111 4.007 -5.547 -8.219 1.00 0.00 O ATOM 1715 CB ARG A 111 6.497 -4.471 -10.032 1.00 0.00 C ATOM 1716 CG ARG A 111 7.676 -3.498 -10.328 1.00 0.00 C ATOM 1717 CD ARG A 111 8.898 -4.277 -10.831 1.00 0.00 C ATOM 1718 NE ARG A 111 8.647 -4.746 -12.223 1.00 0.00 N ATOM 1719 CZ ARG A 111 9.639 -5.171 -12.958 1.00 0.00 C ATOM 1720 NH1 ARG A 111 10.851 -5.181 -12.475 1.00 0.00 N ATOM 1721 NH2 ARG A 111 9.417 -5.585 -14.175 1.00 0.00 N ATOM 0 H ARG A 111 8.120 -4.912 -8.031 1.00 0.00 H new ATOM 0 HA ARG A 111 5.543 -3.497 -8.376 1.00 0.00 H new ATOM 0 HB2 ARG A 111 6.785 -5.488 -10.300 1.00 0.00 H new ATOM 0 HB3 ARG A 111 5.640 -4.208 -10.652 1.00 0.00 H new ATOM 0 HG2 ARG A 111 7.372 -2.764 -11.075 1.00 0.00 H new ATOM 0 HG3 ARG A 111 7.935 -2.945 -9.425 1.00 0.00 H new ATOM 0 HD2 ARG A 111 9.784 -3.643 -10.803 1.00 0.00 H new ATOM 0 HD3 ARG A 111 9.095 -5.128 -10.179 1.00 0.00 H new ATOM 0 HE ARG A 111 7.700 -4.735 -12.602 1.00 0.00 H new ATOM 0 HH11 ARG A 111 11.023 -4.857 -11.523 1.00 0.00 H new ATOM 0 HH12 ARG A 111 11.626 -5.513 -13.049 1.00 0.00 H new ATOM 0 HH21 ARG A 111 8.469 -5.577 -14.552 1.00 0.00 H new ATOM 0 HH22 ARG A 111 10.191 -5.917 -14.750 1.00 0.00 H new ATOM 1735 N GLU A 112 5.805 -6.751 -7.869 1.00 0.00 N ATOM 1736 CA GLU A 112 4.957 -7.916 -7.499 1.00 0.00 C ATOM 1737 C GLU A 112 4.326 -7.600 -6.149 1.00 0.00 C ATOM 1738 O GLU A 112 3.148 -7.793 -5.936 1.00 0.00 O ATOM 1739 CB GLU A 112 5.803 -9.190 -7.395 1.00 0.00 C ATOM 1740 CG GLU A 112 4.883 -10.413 -7.410 1.00 0.00 C ATOM 1741 CD GLU A 112 5.723 -11.686 -7.293 1.00 0.00 C ATOM 1742 OE1 GLU A 112 6.638 -11.844 -8.085 1.00 0.00 O ATOM 1743 OE2 GLU A 112 5.438 -12.481 -6.413 1.00 0.00 O ATOM 0 H GLU A 112 6.813 -6.905 -7.831 1.00 0.00 H new ATOM 0 HA GLU A 112 4.195 -8.088 -8.259 1.00 0.00 H new ATOM 0 HB2 GLU A 112 6.508 -9.241 -8.225 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.392 -9.175 -6.478 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.172 -10.357 -6.585 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.301 -10.432 -8.332 1.00 0.00 H new ATOM 1750 N TYR A 113 5.114 -7.085 -5.243 1.00 0.00 N ATOM 1751 CA TYR A 113 4.584 -6.711 -3.903 1.00 0.00 C ATOM 1752 C TYR A 113 3.268 -5.960 -4.103 1.00 0.00 C ATOM 1753 O TYR A 113 2.219 -6.422 -3.700 1.00 0.00 O ATOM 1754 CB TYR A 113 5.591 -5.808 -3.187 1.00 0.00 C ATOM 1755 CG TYR A 113 5.066 -5.452 -1.817 1.00 0.00 C ATOM 1756 CD1 TYR A 113 5.274 -6.322 -0.740 1.00 0.00 C ATOM 1757 CD2 TYR A 113 4.371 -4.253 -1.624 1.00 0.00 C ATOM 1758 CE1 TYR A 113 4.787 -5.993 0.530 1.00 0.00 C ATOM 1759 CE2 TYR A 113 3.884 -3.923 -0.354 1.00 0.00 C ATOM 1760 CZ TYR A 113 4.092 -4.793 0.723 1.00 0.00 C ATOM 1761 OH TYR A 113 3.612 -4.468 1.976 1.00 0.00 O ATOM 0 H TYR A 113 6.109 -6.907 -5.377 1.00 0.00 H new ATOM 0 HA TYR A 113 4.420 -7.603 -3.298 1.00 0.00 H new ATOM 0 HB2 TYR A 113 6.552 -6.315 -3.099 1.00 0.00 H new ATOM 0 HB3 TYR A 113 5.761 -4.902 -3.769 1.00 0.00 H new ATOM 0 HD1 TYR A 113 5.810 -7.247 -0.889 1.00 0.00 H new ATOM 0 HD2 TYR A 113 4.210 -3.582 -2.455 1.00 0.00 H new ATOM 0 HE1 TYR A 113 4.947 -6.664 1.361 1.00 0.00 H new ATOM 0 HE2 TYR A 113 3.348 -2.997 -0.205 1.00 0.00 H new ATOM 0 HH TYR A 113 2.803 -3.922 1.885 1.00 0.00 H new ATOM 1771 N GLN A 114 3.317 -4.803 -4.722 1.00 0.00 N ATOM 1772 CA GLN A 114 2.070 -4.013 -4.957 1.00 0.00 C ATOM 1773 C GLN A 114 0.910 -4.937 -5.352 1.00 0.00 C ATOM 1774 O GLN A 114 -0.199 -4.787 -4.878 1.00 0.00 O ATOM 1775 CB GLN A 114 2.316 -3.009 -6.084 1.00 0.00 C ATOM 1776 CG GLN A 114 3.276 -1.922 -5.598 1.00 0.00 C ATOM 1777 CD GLN A 114 3.607 -0.979 -6.756 1.00 0.00 C ATOM 1778 OE1 GLN A 114 4.577 -0.252 -6.702 1.00 0.00 O ATOM 1779 NE2 GLN A 114 2.835 -0.961 -7.808 1.00 0.00 N ATOM 0 H GLN A 114 4.172 -4.372 -5.075 1.00 0.00 H new ATOM 0 HA GLN A 114 1.807 -3.492 -4.037 1.00 0.00 H new ATOM 0 HB2 GLN A 114 2.735 -3.517 -6.953 1.00 0.00 H new ATOM 0 HB3 GLN A 114 1.373 -2.562 -6.400 1.00 0.00 H new ATOM 0 HG2 GLN A 114 2.825 -1.364 -4.778 1.00 0.00 H new ATOM 0 HG3 GLN A 114 4.189 -2.375 -5.211 1.00 0.00 H new ATOM 0 HE21 GLN A 114 2.020 -1.572 -7.853 1.00 0.00 H new ATOM 0 HE22 GLN A 114 3.047 -0.336 -8.585 1.00 0.00 H new ATOM 1788 N GLN A 115 1.150 -5.889 -6.216 1.00 0.00 N ATOM 1789 CA GLN A 115 0.045 -6.808 -6.627 1.00 0.00 C ATOM 1790 C GLN A 115 -0.485 -7.547 -5.395 1.00 0.00 C ATOM 1791 O GLN A 115 -1.669 -7.794 -5.271 1.00 0.00 O ATOM 1792 CB GLN A 115 0.553 -7.824 -7.655 1.00 0.00 C ATOM 1793 CG GLN A 115 1.132 -7.085 -8.862 1.00 0.00 C ATOM 1794 CD GLN A 115 1.881 -8.075 -9.756 1.00 0.00 C ATOM 1795 OE1 GLN A 115 2.352 -9.095 -9.291 1.00 0.00 O ATOM 1796 NE2 GLN A 115 2.011 -7.818 -11.028 1.00 0.00 N ATOM 0 H GLN A 115 2.054 -6.070 -6.652 1.00 0.00 H new ATOM 0 HA GLN A 115 -0.755 -6.222 -7.078 1.00 0.00 H new ATOM 0 HB2 GLN A 115 1.315 -8.461 -7.206 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -0.262 -8.476 -7.971 1.00 0.00 H new ATOM 0 HG2 GLN A 115 0.332 -6.604 -9.425 1.00 0.00 H new ATOM 0 HG3 GLN A 115 1.807 -6.296 -8.529 1.00 0.00 H new ATOM 0 HE21 GLN A 115 1.616 -6.962 -11.418 1.00 0.00 H new ATOM 0 HE22 GLN A 115 2.508 -8.473 -11.632 1.00 0.00 H new ATOM 1805 N LEU A 116 0.375 -7.875 -4.468 1.00 0.00 N ATOM 1806 CA LEU A 116 -0.090 -8.567 -3.233 1.00 0.00 C ATOM 1807 C LEU A 116 -0.614 -7.501 -2.271 1.00 0.00 C ATOM 1808 O LEU A 116 -1.409 -7.769 -1.390 1.00 0.00 O ATOM 1809 CB LEU A 116 1.080 -9.320 -2.584 1.00 0.00 C ATOM 1810 CG LEU A 116 1.359 -10.626 -3.343 1.00 0.00 C ATOM 1811 CD1 LEU A 116 2.041 -10.325 -4.680 1.00 0.00 C ATOM 1812 CD2 LEU A 116 2.277 -11.514 -2.500 1.00 0.00 C ATOM 0 H LEU A 116 1.378 -7.694 -4.513 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.873 -9.286 -3.472 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.971 -8.693 -2.586 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.847 -9.539 -1.542 1.00 0.00 H new ATOM 0 HG LEU A 116 0.414 -11.136 -3.531 1.00 0.00 H new ATOM 0 HD11 LEU A 116 2.234 -11.259 -5.209 1.00 0.00 H new ATOM 0 HD12 LEU A 116 1.392 -9.693 -5.285 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.984 -9.809 -4.499 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.477 -12.442 -3.035 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.216 -10.993 -2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.792 -11.740 -1.550 1.00 0.00 H new ATOM 1824 N TRP A 117 -0.183 -6.285 -2.460 1.00 0.00 N ATOM 1825 CA TRP A 117 -0.648 -5.172 -1.597 1.00 0.00 C ATOM 1826 C TRP A 117 -2.053 -4.749 -2.038 1.00 0.00 C ATOM 1827 O TRP A 117 -2.915 -4.494 -1.221 1.00 0.00 O ATOM 1828 CB TRP A 117 0.322 -3.988 -1.750 1.00 0.00 C ATOM 1829 CG TRP A 117 0.284 -3.125 -0.528 1.00 0.00 C ATOM 1830 CD1 TRP A 117 0.783 -3.468 0.681 1.00 0.00 C ATOM 1831 CD2 TRP A 117 -0.269 -1.786 -0.379 1.00 0.00 C ATOM 1832 NE1 TRP A 117 0.570 -2.426 1.563 1.00 0.00 N ATOM 1833 CE2 TRP A 117 -0.077 -1.366 0.958 1.00 0.00 C ATOM 1834 CE3 TRP A 117 -0.914 -0.905 -1.264 1.00 0.00 C ATOM 1835 CZ2 TRP A 117 -0.510 -0.116 1.401 1.00 0.00 C ATOM 1836 CZ3 TRP A 117 -1.350 0.354 -0.822 1.00 0.00 C ATOM 1837 CH2 TRP A 117 -1.149 0.748 0.508 1.00 0.00 C ATOM 0 H TRP A 117 0.480 -6.015 -3.186 1.00 0.00 H new ATOM 0 HA TRP A 117 -0.677 -5.490 -0.555 1.00 0.00 H new ATOM 0 HB2 TRP A 117 1.335 -4.357 -1.912 1.00 0.00 H new ATOM 0 HB3 TRP A 117 0.053 -3.400 -2.628 1.00 0.00 H new ATOM 0 HD1 TRP A 117 1.268 -4.403 0.918 1.00 0.00 H new ATOM 0 HE1 TRP A 117 0.856 -2.438 2.542 1.00 0.00 H new ATOM 0 HE3 TRP A 117 -1.075 -1.199 -2.291 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -0.352 0.182 2.427 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 -1.843 1.023 -1.511 1.00 0.00 H new ATOM 0 HH2 TRP A 117 -1.487 1.718 0.842 1.00 0.00 H new ATOM 1848 N LEU A 118 -2.311 -4.713 -3.322 1.00 0.00 N ATOM 1849 CA LEU A 118 -3.671 -4.337 -3.792 1.00 0.00 C ATOM 1850 C LEU A 118 -4.649 -5.432 -3.381 1.00 0.00 C ATOM 1851 O LEU A 118 -5.771 -5.145 -3.019 1.00 0.00 O ATOM 1852 CB LEU A 118 -3.662 -4.141 -5.311 1.00 0.00 C ATOM 1853 CG LEU A 118 -2.755 -2.947 -5.668 1.00 0.00 C ATOM 1854 CD1 LEU A 118 -2.526 -2.915 -7.183 1.00 0.00 C ATOM 1855 CD2 LEU A 118 -3.402 -1.619 -5.212 1.00 0.00 C ATOM 0 H LEU A 118 -1.639 -4.927 -4.059 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.982 -3.396 -3.339 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.303 -5.045 -5.803 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.675 -3.963 -5.672 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.801 -3.064 -5.154 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.885 -2.071 -7.436 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.047 -3.842 -7.498 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.483 -2.809 -7.694 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.747 -0.787 -5.472 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.364 -1.493 -5.709 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.551 -1.639 -4.132 1.00 0.00 H new ATOM 1867 N ALA A 119 -4.238 -6.676 -3.337 1.00 0.00 N ATOM 1868 CA ALA A 119 -5.181 -7.713 -2.833 1.00 0.00 C ATOM 1869 C ALA A 119 -5.566 -7.255 -1.431 1.00 0.00 C ATOM 1870 O ALA A 119 -6.673 -6.801 -1.223 1.00 0.00 O ATOM 1871 CB ALA A 119 -4.514 -9.090 -2.793 1.00 0.00 C ATOM 0 H ALA A 119 -3.316 -7.009 -3.620 1.00 0.00 H new ATOM 0 HA ALA A 119 -6.051 -7.816 -3.481 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -5.225 -9.828 -2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -4.194 -9.368 -3.797 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.648 -9.056 -2.132 1.00 0.00 H new ATOM 1877 N ALA A 120 -4.698 -7.357 -0.464 1.00 0.00 N ATOM 1878 CA ALA A 120 -5.071 -6.894 0.902 1.00 0.00 C ATOM 1879 C ALA A 120 -5.720 -5.500 0.852 1.00 0.00 C ATOM 1880 O ALA A 120 -6.165 -5.015 1.864 1.00 0.00 O ATOM 1881 CB ALA A 120 -3.824 -6.815 1.781 1.00 0.00 C ATOM 0 H ALA A 120 -3.756 -7.737 -0.558 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.783 -7.608 1.315 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -4.103 -6.476 2.779 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.363 -7.801 1.848 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -3.115 -6.112 1.344 1.00 0.00 H new ATOM 1887 N PHE A 121 -5.789 -4.852 -0.303 1.00 0.00 N ATOM 1888 CA PHE A 121 -6.444 -3.496 -0.386 1.00 0.00 C ATOM 1889 C PHE A 121 -7.768 -3.595 -1.184 1.00 0.00 C ATOM 1890 O PHE A 121 -8.663 -2.796 -1.004 1.00 0.00 O ATOM 1891 CB PHE A 121 -5.487 -2.486 -1.066 1.00 0.00 C ATOM 1892 CG PHE A 121 -5.594 -1.123 -0.401 1.00 0.00 C ATOM 1893 CD1 PHE A 121 -6.754 -0.355 -0.557 1.00 0.00 C ATOM 1894 CD2 PHE A 121 -4.532 -0.633 0.374 1.00 0.00 C ATOM 1895 CE1 PHE A 121 -6.853 0.898 0.060 1.00 0.00 C ATOM 1896 CE2 PHE A 121 -4.632 0.620 0.989 1.00 0.00 C ATOM 1897 CZ PHE A 121 -5.792 1.386 0.832 1.00 0.00 C ATOM 0 H PHE A 121 -5.420 -5.205 -1.186 1.00 0.00 H new ATOM 0 HA PHE A 121 -6.666 -3.147 0.623 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -4.461 -2.849 -1.003 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -5.731 -2.401 -2.125 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -7.573 -0.729 -1.154 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -3.636 -1.224 0.496 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -7.749 1.489 -0.060 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -3.813 0.996 1.585 1.00 0.00 H new ATOM 0 HZ PHE A 121 -5.869 2.353 1.306 1.00 0.00 H new ATOM 1907 N ALA A 122 -7.903 -4.566 -2.057 1.00 0.00 N ATOM 1908 CA ALA A 122 -9.174 -4.706 -2.854 1.00 0.00 C ATOM 1909 C ALA A 122 -10.070 -5.775 -2.232 1.00 0.00 C ATOM 1910 O ALA A 122 -11.278 -5.686 -2.321 1.00 0.00 O ATOM 1911 CB ALA A 122 -8.864 -5.068 -4.305 1.00 0.00 C ATOM 0 H ALA A 122 -7.191 -5.269 -2.255 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.695 -3.749 -2.838 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -9.795 -5.164 -4.863 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -8.252 -4.285 -4.753 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.323 -6.014 -4.336 1.00 0.00 H new ATOM 1917 N ALA A 123 -9.534 -6.737 -1.554 1.00 0.00 N ATOM 1918 CA ALA A 123 -10.422 -7.730 -0.888 1.00 0.00 C ATOM 1919 C ALA A 123 -10.715 -7.169 0.499 1.00 0.00 C ATOM 1920 O ALA A 123 -11.032 -7.884 1.426 1.00 0.00 O ATOM 1921 CB ALA A 123 -9.704 -9.076 -0.763 1.00 0.00 C ATOM 0 H ALA A 123 -8.533 -6.884 -1.429 1.00 0.00 H new ATOM 0 HA ALA A 123 -11.337 -7.893 -1.458 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -10.362 -9.795 -0.275 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -9.440 -9.441 -1.756 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -8.798 -8.951 -0.170 1.00 0.00 H new ATOM 1927 N LEU A 124 -10.518 -5.884 0.657 1.00 0.00 N ATOM 1928 CA LEU A 124 -10.682 -5.264 1.998 1.00 0.00 C ATOM 1929 C LEU A 124 -12.127 -5.392 2.532 1.00 0.00 C ATOM 1930 O LEU A 124 -12.343 -6.003 3.559 1.00 0.00 O ATOM 1931 CB LEU A 124 -10.298 -3.766 1.934 1.00 0.00 C ATOM 1932 CG LEU A 124 -8.907 -3.505 2.536 1.00 0.00 C ATOM 1933 CD1 LEU A 124 -8.456 -2.080 2.198 1.00 0.00 C ATOM 1934 CD2 LEU A 124 -8.948 -3.655 4.058 1.00 0.00 C ATOM 0 H LEU A 124 -10.251 -5.241 -0.088 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.023 -5.799 2.682 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -10.313 -3.431 0.897 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -11.042 -3.177 2.470 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.210 -4.230 2.117 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.470 -1.899 2.626 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -8.409 -1.960 1.116 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.168 -1.365 2.611 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -7.956 -3.467 4.469 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -9.655 -2.938 4.475 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -9.262 -4.667 4.316 1.00 0.00 H new ATOM 1946 N PRO A 125 -13.080 -4.747 1.840 1.00 0.00 N ATOM 1947 CA PRO A 125 -14.483 -4.719 2.287 1.00 0.00 C ATOM 1948 C PRO A 125 -14.972 -6.113 2.610 1.00 0.00 C ATOM 1949 O PRO A 125 -15.322 -6.409 3.735 1.00 0.00 O ATOM 1950 CB PRO A 125 -15.269 -4.075 1.122 1.00 0.00 C ATOM 1951 CG PRO A 125 -14.273 -3.901 -0.048 1.00 0.00 C ATOM 1952 CD PRO A 125 -12.865 -4.035 0.551 1.00 0.00 C ATOM 0 HA PRO A 125 -14.615 -4.148 3.206 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -16.107 -4.706 0.826 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -15.685 -3.113 1.422 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -14.441 -4.656 -0.816 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.401 -2.929 -0.524 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -12.204 -4.597 -0.109 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.405 -3.059 0.707 1.00 0.00 H new ATOM 1960 N GLY A 126 -15.012 -6.972 1.642 1.00 0.00 N ATOM 1961 CA GLY A 126 -15.497 -8.348 1.919 1.00 0.00 C ATOM 1962 C GLY A 126 -14.342 -9.215 2.416 1.00 0.00 C ATOM 1963 O GLY A 126 -14.044 -10.254 1.860 1.00 0.00 O ATOM 0 H GLY A 126 -14.734 -6.787 0.678 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -16.290 -8.320 2.666 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -15.926 -8.781 1.015 1.00 0.00 H new ATOM 1967 N SER A 127 -13.785 -8.832 3.546 1.00 0.00 N ATOM 1968 CA SER A 127 -12.722 -9.658 4.214 1.00 0.00 C ATOM 1969 C SER A 127 -12.193 -8.916 5.447 1.00 0.00 C ATOM 1970 O SER A 127 -12.345 -9.358 6.568 1.00 0.00 O ATOM 1971 CB SER A 127 -11.557 -9.999 3.258 1.00 0.00 C ATOM 1972 OG SER A 127 -11.144 -11.338 3.490 1.00 0.00 O ATOM 0 H SER A 127 -14.025 -7.972 4.039 1.00 0.00 H new ATOM 0 HA SER A 127 -13.177 -10.602 4.515 1.00 0.00 H new ATOM 0 HB2 SER A 127 -11.872 -9.877 2.222 1.00 0.00 H new ATOM 0 HB3 SER A 127 -10.724 -9.315 3.421 1.00 0.00 H new ATOM 0 HG SER A 127 -10.406 -11.562 2.886 1.00 0.00 H new ATOM 1978 N ALA A 128 -11.558 -7.805 5.233 1.00 0.00 N ATOM 1979 CA ALA A 128 -10.979 -7.007 6.358 1.00 0.00 C ATOM 1980 C ALA A 128 -11.489 -5.567 6.263 1.00 0.00 C ATOM 1981 O ALA A 128 -10.939 -4.783 5.534 1.00 0.00 O ATOM 1982 CB ALA A 128 -9.457 -7.012 6.187 1.00 0.00 C ATOM 0 H ALA A 128 -11.409 -7.402 4.308 1.00 0.00 H new ATOM 0 HA ALA A 128 -11.264 -7.428 7.322 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -8.999 -6.438 6.992 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -9.091 -8.038 6.219 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -9.197 -6.564 5.228 1.00 0.00 H new ATOM 1988 N LYS A 129 -12.519 -5.195 6.987 1.00 0.00 N ATOM 1989 CA LYS A 129 -13.012 -3.792 6.884 1.00 0.00 C ATOM 1990 C LYS A 129 -14.230 -3.565 7.794 1.00 0.00 C ATOM 1991 O LYS A 129 -14.438 -4.206 8.805 1.00 0.00 O ATOM 1992 CB LYS A 129 -13.471 -3.514 5.421 1.00 0.00 C ATOM 1993 CG LYS A 129 -13.337 -2.005 5.060 1.00 0.00 C ATOM 1994 CD LYS A 129 -14.546 -1.501 4.251 1.00 0.00 C ATOM 1995 CE LYS A 129 -14.593 0.031 4.323 1.00 0.00 C ATOM 1996 NZ LYS A 129 -14.898 0.450 5.721 1.00 0.00 N ATOM 0 H LYS A 129 -13.030 -5.795 7.634 1.00 0.00 H new ATOM 0 HA LYS A 129 -12.199 -3.130 7.183 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -12.873 -4.109 4.731 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -14.507 -3.829 5.297 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -13.242 -1.420 5.975 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -12.424 -1.848 4.485 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -14.467 -1.827 3.214 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -15.468 -1.925 4.649 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -13.639 0.451 4.005 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -15.353 0.415 3.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -14.401 1.338 5.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.923 0.593 5.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -14.583 -0.289 6.381 1.00 0.00 H new ATOM 2010 N ASP A 130 -15.020 -2.635 7.362 1.00 0.00 N ATOM 2011 CA ASP A 130 -16.274 -2.240 8.050 1.00 0.00 C ATOM 2012 C ASP A 130 -16.917 -1.143 7.188 1.00 0.00 C ATOM 2013 O ASP A 130 -16.838 0.022 7.524 1.00 0.00 O ATOM 2014 CB ASP A 130 -15.951 -1.686 9.441 1.00 0.00 C ATOM 2015 CG ASP A 130 -17.228 -1.139 10.081 1.00 0.00 C ATOM 2016 OD1 ASP A 130 -18.264 -1.763 9.919 1.00 0.00 O ATOM 2017 OD2 ASP A 130 -17.149 -0.105 10.724 1.00 0.00 O ATOM 0 H ASP A 130 -14.837 -2.102 6.512 1.00 0.00 H new ATOM 0 HA ASP A 130 -16.944 -3.091 8.173 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -15.525 -2.470 10.067 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -15.203 -0.897 9.365 1.00 0.00 H new ATOM 2022 N PRO A 131 -17.476 -1.537 6.059 1.00 0.00 N ATOM 2023 CA PRO A 131 -18.061 -0.589 5.093 1.00 0.00 C ATOM 2024 C PRO A 131 -19.538 -0.344 5.418 1.00 0.00 C ATOM 2025 O PRO A 131 -20.023 0.769 5.426 1.00 0.00 O ATOM 2026 CB PRO A 131 -17.955 -1.354 3.755 1.00 0.00 C ATOM 2027 CG PRO A 131 -17.857 -2.867 4.114 1.00 0.00 C ATOM 2028 CD PRO A 131 -17.587 -2.952 5.635 1.00 0.00 C ATOM 0 HA PRO A 131 -17.566 0.382 5.092 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -18.825 -1.160 3.128 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -17.079 -1.032 3.193 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -18.780 -3.386 3.856 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -17.055 -3.346 3.552 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -18.397 -3.462 6.156 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -16.672 -3.505 5.848 1.00 0.00 H new