USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 949 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 115 ASN : amide:sc= 0.11 K(o=-7.7,f=-8.8) USER MOD Set 1.2: A 117 ASN : amide:sc= -3.16 X(o=-7.7,f=-7.2!) USER MOD Set 1.3: A 131 GLN : amide:sc= -2.42 K(o=-7.7,f=-14!) USER MOD Set 1.4: A 134 GLN : amide:sc= -2.25 K(o=-7.7,f=-9.4!) USER MOD Set 2.1: A 47 HIS : no HD1:sc= -12.5! C(o=-15!,f=-17!) USER MOD Set 2.2: A 78 ASN : amide:sc= -3.4 K(o=-15,f=-17!) USER MOD Set 2.3: A 126 TYR OH : rot -15:sc= 0.459 USER MOD Set 3.1: A 73 ASN :FLIP amide:sc= -4.1! C(o=-13!,f=-7.4!) USER MOD Set 3.2: A 140 GLN : amide:sc= -3.29 K(o=-7.4,f=-8) USER MOD Set 4.1: A 27 THR OG1 : rot -86:sc= -0.381! USER MOD Set 4.2: A 76 MET CE :methyl -107:sc= -1.58 (180deg=-7.09!) USER MOD Set 5.1: A 24 HIS :FLIP no HD1:sc= -8.35! C(o=-14!,f=-9.2!) USER MOD Set 5.2: A 136 MET CE :methyl -165:sc= -0.843 (180deg=-0.0285) USER MOD Single : A 22 HIS :FLIP no HD1:sc= -0.948 F(o=-2.2,f=-0.95) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 143:sc= -2.23 (180deg=-6.06!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -130:sc= -1.31! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -109:sc= -0.221 (180deg=-0.656) USER MOD Single : A 64 SER OG : rot 155:sc= 1.94 USER MOD Single : A 65 THR OG1 : rot 57:sc= 0.125 USER MOD Single : A 68 SER OG : rot 180:sc= -1.05 USER MOD Single : A 71 SER OG : rot -110:sc= -0.198 USER MOD Single : A 72 HIS : no HD1:sc= -6.78! C(o=-6.8!,f=-8.9!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -80:sc= 1.48 USER MOD Single : A 96 TYR OH : rot -41:sc= -0.134 USER MOD Single : A 106 SER OG : rot 70:sc= 0.723 USER MOD Single : A 108 LYS NZ :NH3+ 157:sc= -0.0646 (180deg=-0.336) USER MOD Single : A 110 HIS : no HE2:sc= -5.74 X(o=-5.7,f=-5.4!) USER MOD Single : A 119 ASN : amide:sc= -1.31 X(o=-1.3,f=-1.4) USER MOD Single : A 121 SER OG : rot 74:sc= 1.23 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 12:sc= -1.61 USER MOD Single : A 128 SER OG : rot -87:sc= 0.951 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 THR OG1 : rot 180:sc=5.91e-05 USER MOD ----------------------------------------------------------------- ATOM 308 N HIS A 22 -10.061 -0.292 -9.998 1.00 0.00 N ATOM 309 CA HIS A 22 -10.377 -1.320 -8.988 1.00 0.00 C ATOM 310 C HIS A 22 -9.252 -2.340 -8.810 1.00 0.00 C ATOM 311 O HIS A 22 -9.283 -3.423 -9.392 1.00 0.00 O ATOM 312 CB HIS A 22 -11.671 -2.045 -9.367 1.00 0.00 C ATOM 313 CG HIS A 22 -11.626 -2.691 -10.719 1.00 0.00 C ATOM 314 ND1 HIS A 22 -10.644 -2.733 -11.652 1.00 0.00 N flip ATOM 315 CD2 HIS A 22 -12.684 -3.401 -11.248 1.00 0.00 C flip ATOM 316 CE1 HIS A 22 -11.123 -3.459 -12.714 1.00 0.00 C flip ATOM 317 NE2 HIS A 22 -12.355 -3.850 -12.446 1.00 0.00 N flip ATOM 0 HA HIS A 22 -10.499 -0.802 -8.037 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.883 -2.807 -8.617 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -12.497 -1.334 -9.341 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -13.633 -3.564 -10.759 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -10.580 -3.675 -13.622 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -12.952 -4.405 -13.060 1.00 0.00 H new ATOM 326 N ILE A 23 -8.255 -1.979 -8.002 1.00 0.00 N ATOM 327 CA ILE A 23 -7.111 -2.853 -7.752 1.00 0.00 C ATOM 328 C ILE A 23 -6.598 -2.693 -6.307 1.00 0.00 C ATOM 329 O ILE A 23 -7.094 -3.349 -5.375 1.00 0.00 O ATOM 330 CB ILE A 23 -5.975 -2.550 -8.767 1.00 0.00 C ATOM 331 CG1 ILE A 23 -6.335 -3.062 -10.162 1.00 0.00 C ATOM 332 CG2 ILE A 23 -4.649 -3.144 -8.323 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.705 -2.248 -11.271 1.00 0.00 C ATOM 0 H ILE A 23 -8.217 -1.087 -7.510 1.00 0.00 H new ATOM 0 HA ILE A 23 -7.435 -3.886 -7.882 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.864 -1.466 -8.806 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.017 -4.100 -10.255 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.419 -3.049 -10.280 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.881 -2.910 -9.060 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -4.367 -2.723 -7.358 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -4.747 -4.226 -8.232 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.998 -2.661 -12.237 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.043 -1.214 -11.201 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.620 -2.282 -11.176 1.00 0.00 H new ATOM 345 N HIS A 24 -5.612 -1.814 -6.118 1.00 0.00 N ATOM 346 CA HIS A 24 -5.045 -1.571 -4.799 1.00 0.00 C ATOM 347 C HIS A 24 -5.836 -0.489 -4.073 1.00 0.00 C ATOM 348 O HIS A 24 -5.280 0.293 -3.303 1.00 0.00 O ATOM 349 CB HIS A 24 -3.576 -1.165 -4.909 1.00 0.00 C ATOM 350 CG HIS A 24 -2.805 -1.965 -5.912 1.00 0.00 C ATOM 351 ND1 HIS A 24 -2.696 -3.304 -6.084 1.00 0.00 N flip ATOM 352 CD2 HIS A 24 -2.022 -1.391 -6.892 1.00 0.00 C flip ATOM 353 CE1 HIS A 24 -1.859 -3.510 -7.154 1.00 0.00 C flip ATOM 354 NE2 HIS A 24 -1.469 -2.340 -7.623 1.00 0.00 N flip ATOM 0 H HIS A 24 -5.192 -1.260 -6.865 1.00 0.00 H new ATOM 0 HA HIS A 24 -5.106 -2.496 -4.225 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.519 -0.110 -5.177 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -3.104 -1.272 -3.932 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -1.883 -0.330 -7.038 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.568 -4.473 -7.547 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -0.845 -2.194 -8.417 1.00 0.00 H new ATOM 363 N TRP A 25 -7.140 -0.454 -4.335 1.00 0.00 N ATOM 364 CA TRP A 25 -8.028 0.529 -3.728 1.00 0.00 C ATOM 365 C TRP A 25 -9.473 0.043 -3.694 1.00 0.00 C ATOM 366 O TRP A 25 -10.338 0.719 -3.135 1.00 0.00 O ATOM 367 CB TRP A 25 -7.962 1.837 -4.507 1.00 0.00 C ATOM 368 CG TRP A 25 -7.441 1.659 -5.897 1.00 0.00 C ATOM 369 CD1 TRP A 25 -8.174 1.422 -7.018 1.00 0.00 C ATOM 370 CD2 TRP A 25 -6.073 1.687 -6.309 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.346 1.308 -8.101 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.052 1.471 -7.696 1.00 0.00 C ATOM 373 CE3 TRP A 25 -4.865 1.880 -5.643 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.870 1.441 -8.429 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.693 1.851 -6.367 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.702 1.634 -7.749 1.00 0.00 C ATOM 0 H TRP A 25 -7.607 -1.102 -4.970 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.694 0.682 -2.702 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.958 2.279 -4.551 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.324 2.541 -3.972 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.250 1.336 -7.049 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.647 1.130 -9.059 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.847 2.050 -4.577 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.876 1.271 -9.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.751 1.998 -5.859 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.767 1.619 -8.289 1.00 0.00 H new ATOM 387 N ARG A 26 -9.745 -1.114 -4.298 1.00 0.00 N ATOM 388 CA ARG A 26 -11.107 -1.648 -4.328 1.00 0.00 C ATOM 389 C ARG A 26 -11.822 -1.468 -2.984 1.00 0.00 C ATOM 390 O ARG A 26 -13.021 -1.187 -2.955 1.00 0.00 O ATOM 391 CB ARG A 26 -11.114 -3.127 -4.722 1.00 0.00 C ATOM 392 CG ARG A 26 -10.228 -3.451 -5.915 1.00 0.00 C ATOM 393 CD ARG A 26 -10.739 -4.662 -6.679 1.00 0.00 C ATOM 394 NE ARG A 26 -10.226 -5.913 -6.126 1.00 0.00 N ATOM 395 CZ ARG A 26 -10.737 -7.111 -6.404 1.00 0.00 C ATOM 396 NH1 ARG A 26 -11.779 -7.224 -7.219 1.00 0.00 N ATOM 397 NH2 ARG A 26 -10.207 -8.199 -5.863 1.00 0.00 N ATOM 0 H ARG A 26 -9.050 -1.694 -4.768 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.649 -1.078 -5.082 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.789 -3.722 -3.868 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -12.137 -3.428 -4.949 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.186 -2.590 -6.582 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.210 -3.639 -5.573 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -11.829 -4.674 -6.653 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.446 -4.581 -7.726 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.430 -5.866 -5.490 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -12.193 -6.390 -7.636 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -12.166 -8.144 -7.428 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -9.408 -8.118 -5.234 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -10.598 -9.117 -6.076 1.00 0.00 H new ATOM 411 N THR A 27 -11.092 -1.625 -1.873 1.00 0.00 N ATOM 412 CA THR A 27 -11.679 -1.472 -0.539 1.00 0.00 C ATOM 413 C THR A 27 -10.716 -1.953 0.543 1.00 0.00 C ATOM 414 O THR A 27 -10.169 -3.053 0.456 1.00 0.00 O ATOM 415 CB THR A 27 -13.001 -2.241 -0.427 1.00 0.00 C ATOM 416 OG1 THR A 27 -13.096 -3.235 -1.432 1.00 0.00 O ATOM 417 CG2 THR A 27 -14.223 -1.352 -0.540 1.00 0.00 C ATOM 0 H THR A 27 -10.099 -1.857 -1.872 1.00 0.00 H new ATOM 0 HA THR A 27 -11.874 -0.410 -0.391 1.00 0.00 H new ATOM 0 HB THR A 27 -12.988 -2.689 0.567 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.462 -2.839 -2.250 1.00 0.00 H new ATOM 0 HG21 THR A 27 -15.124 -1.959 -0.452 1.00 0.00 H new ATOM 0 HG22 THR A 27 -14.207 -0.609 0.257 1.00 0.00 H new ATOM 0 HG23 THR A 27 -14.218 -0.848 -1.506 1.00 0.00 H new ATOM 425 N LEU A 28 -10.521 -1.127 1.566 1.00 0.00 N ATOM 426 CA LEU A 28 -9.630 -1.473 2.669 1.00 0.00 C ATOM 427 C LEU A 28 -10.200 -2.629 3.485 1.00 0.00 C ATOM 428 O LEU A 28 -9.558 -3.667 3.640 1.00 0.00 O ATOM 429 CB LEU A 28 -9.406 -0.260 3.575 1.00 0.00 C ATOM 430 CG LEU A 28 -8.406 -0.481 4.713 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.835 0.847 5.187 1.00 0.00 C ATOM 432 CD2 LEU A 28 -9.067 -1.221 5.866 1.00 0.00 C ATOM 0 H LEU A 28 -10.967 -0.214 1.655 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.675 -1.783 2.246 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.060 0.573 2.963 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.363 0.036 4.004 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.586 -1.092 4.337 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -7.126 0.670 5.996 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.325 1.340 4.359 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.644 1.483 5.546 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.342 -1.370 6.666 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.906 -0.635 6.241 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.427 -2.189 5.518 1.00 0.00 H new ATOM 444 N GLU A 29 -11.413 -2.444 4.002 1.00 0.00 N ATOM 445 CA GLU A 29 -12.070 -3.474 4.801 1.00 0.00 C ATOM 446 C GLU A 29 -12.122 -4.796 4.042 1.00 0.00 C ATOM 447 O GLU A 29 -11.633 -5.819 4.519 1.00 0.00 O ATOM 448 CB GLU A 29 -13.485 -3.032 5.178 1.00 0.00 C ATOM 449 CG GLU A 29 -13.518 -1.818 6.093 1.00 0.00 C ATOM 450 CD GLU A 29 -14.405 -0.709 5.559 1.00 0.00 C ATOM 451 OE1 GLU A 29 -15.592 -0.979 5.280 1.00 0.00 O ATOM 452 OE2 GLU A 29 -13.912 0.431 5.420 1.00 0.00 O ATOM 0 H GLU A 29 -11.960 -1.591 3.882 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.489 -3.620 5.712 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -14.041 -2.806 4.268 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -13.997 -3.860 5.668 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -13.873 -2.120 7.078 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -12.505 -1.437 6.222 1.00 0.00 H new ATOM 459 N ASP A 30 -12.711 -4.765 2.851 1.00 0.00 N ATOM 460 CA ASP A 30 -12.816 -5.960 2.023 1.00 0.00 C ATOM 461 C ASP A 30 -11.437 -6.407 1.548 1.00 0.00 C ATOM 462 O ASP A 30 -11.230 -7.576 1.225 1.00 0.00 O ATOM 463 CB ASP A 30 -13.724 -5.694 0.821 1.00 0.00 C ATOM 464 CG ASP A 30 -15.171 -6.049 1.102 1.00 0.00 C ATOM 465 OD1 ASP A 30 -15.549 -7.218 0.881 1.00 0.00 O ATOM 466 OD2 ASP A 30 -15.927 -5.158 1.543 1.00 0.00 O ATOM 0 H ASP A 30 -13.122 -3.927 2.439 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.251 -6.757 2.625 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.658 -4.642 0.544 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -13.370 -6.271 -0.033 1.00 0.00 H new ATOM 471 N GLY A 31 -10.495 -5.467 1.510 1.00 0.00 N ATOM 472 CA GLY A 31 -9.148 -5.783 1.076 1.00 0.00 C ATOM 473 C GLY A 31 -8.466 -6.786 1.986 1.00 0.00 C ATOM 474 O GLY A 31 -7.828 -7.725 1.513 1.00 0.00 O ATOM 0 H GLY A 31 -10.643 -4.492 1.773 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -9.180 -6.181 0.062 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.557 -4.868 1.041 1.00 0.00 H new ATOM 478 N LYS A 32 -8.601 -6.588 3.293 1.00 0.00 N ATOM 479 CA LYS A 32 -7.991 -7.489 4.265 1.00 0.00 C ATOM 480 C LYS A 32 -8.669 -8.853 4.234 1.00 0.00 C ATOM 481 O LYS A 32 -8.007 -9.889 4.309 1.00 0.00 O ATOM 482 CB LYS A 32 -8.065 -6.894 5.673 1.00 0.00 C ATOM 483 CG LYS A 32 -9.448 -6.397 6.058 1.00 0.00 C ATOM 484 CD LYS A 32 -9.538 -6.100 7.547 1.00 0.00 C ATOM 485 CE LYS A 32 -10.835 -6.621 8.144 1.00 0.00 C ATOM 486 NZ LYS A 32 -10.616 -7.275 9.466 1.00 0.00 N ATOM 0 H LYS A 32 -9.125 -5.815 3.703 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.942 -7.617 3.996 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -7.747 -7.648 6.393 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.359 -6.067 5.745 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -9.683 -5.496 5.491 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.193 -7.146 5.789 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.691 -6.555 8.061 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.468 -5.024 7.709 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.539 -5.796 8.259 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.290 -7.335 7.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.525 -7.616 9.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.965 -8.078 9.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.206 -6.587 10.130 1.00 0.00 H new ATOM 500 N LYS A 33 -9.993 -8.848 4.116 1.00 0.00 N ATOM 501 CA LYS A 33 -10.757 -10.089 4.068 1.00 0.00 C ATOM 502 C LYS A 33 -10.442 -10.864 2.792 1.00 0.00 C ATOM 503 O LYS A 33 -10.521 -12.091 2.762 1.00 0.00 O ATOM 504 CB LYS A 33 -12.257 -9.793 4.143 1.00 0.00 C ATOM 505 CG LYS A 33 -13.094 -10.997 4.539 1.00 0.00 C ATOM 506 CD LYS A 33 -14.571 -10.759 4.269 1.00 0.00 C ATOM 507 CE LYS A 33 -14.992 -11.334 2.926 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.717 -12.626 3.078 1.00 0.00 N ATOM 0 H LYS A 33 -10.558 -8.001 4.052 1.00 0.00 H new ATOM 0 HA LYS A 33 -10.473 -10.699 4.926 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.425 -8.991 4.862 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.596 -9.428 3.173 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.758 -11.874 3.985 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.946 -11.213 5.597 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.165 -11.213 5.062 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.778 -9.689 4.289 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -15.631 -10.618 2.409 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.110 -11.483 2.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -15.987 -12.985 2.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.099 -13.317 3.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -16.572 -12.479 3.651 1.00 0.00 H new ATOM 522 N GLU A 34 -10.081 -10.135 1.739 1.00 0.00 N ATOM 523 CA GLU A 34 -9.749 -10.748 0.459 1.00 0.00 C ATOM 524 C GLU A 34 -8.298 -11.219 0.444 1.00 0.00 C ATOM 525 O GLU A 34 -7.982 -12.269 -0.117 1.00 0.00 O ATOM 526 CB GLU A 34 -9.986 -9.757 -0.681 1.00 0.00 C ATOM 527 CG GLU A 34 -9.670 -10.329 -2.051 1.00 0.00 C ATOM 528 CD GLU A 34 -10.623 -9.833 -3.123 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.675 -8.606 -3.348 1.00 0.00 O ATOM 530 OE2 GLU A 34 -11.315 -10.672 -3.734 1.00 0.00 O ATOM 0 H GLU A 34 -10.011 -9.117 1.749 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.396 -11.614 0.319 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.027 -9.434 -0.661 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.374 -8.870 -0.515 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.649 -10.063 -2.326 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.714 -11.417 -2.006 1.00 0.00 H new ATOM 537 N ALA A 35 -7.421 -10.438 1.064 1.00 0.00 N ATOM 538 CA ALA A 35 -6.004 -10.777 1.125 1.00 0.00 C ATOM 539 C ALA A 35 -5.795 -12.139 1.776 1.00 0.00 C ATOM 540 O ALA A 35 -4.843 -12.852 1.457 1.00 0.00 O ATOM 541 CB ALA A 35 -5.237 -9.704 1.884 1.00 0.00 C ATOM 0 H ALA A 35 -7.666 -9.565 1.532 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.623 -10.828 0.105 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.181 -9.970 1.922 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.352 -8.746 1.376 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.628 -9.626 2.898 1.00 0.00 H new ATOM 547 N ALA A 36 -6.694 -12.493 2.689 1.00 0.00 N ATOM 548 CA ALA A 36 -6.616 -13.769 3.389 1.00 0.00 C ATOM 549 C ALA A 36 -6.763 -14.936 2.418 1.00 0.00 C ATOM 550 O ALA A 36 -6.082 -15.954 2.548 1.00 0.00 O ATOM 551 CB ALA A 36 -7.682 -13.844 4.471 1.00 0.00 C ATOM 0 H ALA A 36 -7.487 -11.912 2.961 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.634 -13.839 3.857 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.612 -14.802 4.985 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.531 -13.036 5.187 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.668 -13.747 4.017 1.00 0.00 H new ATOM 557 N ALA A 37 -7.655 -14.783 1.443 1.00 0.00 N ATOM 558 CA ALA A 37 -7.889 -15.825 0.447 1.00 0.00 C ATOM 559 C ALA A 37 -6.584 -16.245 -0.219 1.00 0.00 C ATOM 560 O ALA A 37 -6.064 -17.331 0.041 1.00 0.00 O ATOM 561 CB ALA A 37 -8.888 -15.344 -0.595 1.00 0.00 C ATOM 0 H ALA A 37 -8.228 -13.948 1.321 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.304 -16.696 0.955 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.053 -16.131 -1.331 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.832 -15.099 -0.108 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.496 -14.457 -1.093 1.00 0.00 H new ATOM 567 N SER A 38 -6.053 -15.376 -1.071 1.00 0.00 N ATOM 568 CA SER A 38 -4.802 -15.656 -1.766 1.00 0.00 C ATOM 569 C SER A 38 -3.637 -15.663 -0.781 1.00 0.00 C ATOM 570 O SER A 38 -2.636 -16.347 -0.989 1.00 0.00 O ATOM 571 CB SER A 38 -4.556 -14.618 -2.860 1.00 0.00 C ATOM 572 OG SER A 38 -5.254 -14.954 -4.048 1.00 0.00 O ATOM 0 H SER A 38 -6.469 -14.472 -1.297 1.00 0.00 H new ATOM 0 HA SER A 38 -4.878 -16.641 -2.228 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.875 -13.636 -2.512 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.488 -14.551 -3.068 1.00 0.00 H new ATOM 0 HG SER A 38 -5.082 -14.274 -4.732 1.00 0.00 H new ATOM 578 N GLY A 39 -3.780 -14.898 0.298 1.00 0.00 N ATOM 579 CA GLY A 39 -2.741 -14.826 1.306 1.00 0.00 C ATOM 580 C GLY A 39 -1.639 -13.854 0.941 1.00 0.00 C ATOM 581 O GLY A 39 -0.497 -14.014 1.371 1.00 0.00 O ATOM 0 H GLY A 39 -4.601 -14.325 0.491 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.183 -14.528 2.257 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.312 -15.817 1.451 1.00 0.00 H new ATOM 585 N LEU A 40 -1.977 -12.837 0.154 1.00 0.00 N ATOM 586 CA LEU A 40 -0.998 -11.838 -0.252 1.00 0.00 C ATOM 587 C LEU A 40 -1.059 -10.625 0.675 1.00 0.00 C ATOM 588 O LEU A 40 -2.076 -10.387 1.327 1.00 0.00 O ATOM 589 CB LEU A 40 -1.216 -11.422 -1.712 1.00 0.00 C ATOM 590 CG LEU A 40 -2.538 -10.711 -2.015 1.00 0.00 C ATOM 591 CD1 LEU A 40 -2.449 -9.239 -1.655 1.00 0.00 C ATOM 592 CD2 LEU A 40 -2.913 -10.884 -3.481 1.00 0.00 C ATOM 0 H LEU A 40 -2.916 -12.684 -0.213 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.004 -12.279 -0.175 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.397 -10.767 -2.009 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.154 -12.313 -2.337 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.319 -11.164 -1.405 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.398 -8.752 -1.878 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.229 -9.137 -0.592 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.655 -8.770 -2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.855 -10.372 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.130 -10.459 -4.109 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.022 -11.945 -3.706 1.00 0.00 H new ATOM 604 N PRO A 41 0.035 -9.846 0.760 1.00 0.00 N ATOM 605 CA PRO A 41 0.102 -8.664 1.631 1.00 0.00 C ATOM 606 C PRO A 41 -0.895 -7.582 1.236 1.00 0.00 C ATOM 607 O PRO A 41 -1.393 -7.548 0.108 1.00 0.00 O ATOM 608 CB PRO A 41 1.536 -8.161 1.447 1.00 0.00 C ATOM 609 CG PRO A 41 1.945 -8.700 0.124 1.00 0.00 C ATOM 610 CD PRO A 41 1.299 -10.052 0.033 1.00 0.00 C ATOM 0 HA PRO A 41 -0.149 -8.913 2.662 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.581 -7.072 1.465 1.00 0.00 H new ATOM 0 HB3 PRO A 41 2.189 -8.520 2.242 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.613 -8.050 -0.686 1.00 0.00 H new ATOM 0 HG3 PRO A 41 3.030 -8.776 0.048 1.00 0.00 H new ATOM 0 HD2 PRO A 41 1.129 -10.353 -1.001 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.911 -10.827 0.494 1.00 0.00 H new ATOM 618 N LEU A 42 -1.175 -6.692 2.175 1.00 0.00 N ATOM 619 CA LEU A 42 -2.100 -5.608 1.937 1.00 0.00 C ATOM 620 C LEU A 42 -1.420 -4.487 1.161 1.00 0.00 C ATOM 621 O LEU A 42 -0.245 -4.177 1.389 1.00 0.00 O ATOM 622 CB LEU A 42 -2.646 -5.088 3.268 1.00 0.00 C ATOM 623 CG LEU A 42 -3.584 -6.037 4.023 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.410 -5.268 5.042 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.493 -6.791 3.064 1.00 0.00 C ATOM 0 H LEU A 42 -0.770 -6.704 3.111 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.932 -5.979 1.338 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.803 -4.850 3.916 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.178 -4.155 3.081 1.00 0.00 H new ATOM 0 HG LEU A 42 -2.970 -6.768 4.549 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.070 -5.956 5.569 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.746 -4.783 5.757 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -5.007 -4.512 4.531 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.146 -7.456 3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -5.098 -6.080 2.501 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -3.887 -7.378 2.374 1.00 0.00 H new ATOM 637 N MET A 43 -2.160 -3.900 0.230 1.00 0.00 N ATOM 638 CA MET A 43 -1.636 -2.824 -0.596 1.00 0.00 C ATOM 639 C MET A 43 -2.096 -1.468 -0.075 1.00 0.00 C ATOM 640 O MET A 43 -3.071 -0.898 -0.574 1.00 0.00 O ATOM 641 CB MET A 43 -2.078 -3.019 -2.049 1.00 0.00 C ATOM 642 CG MET A 43 -1.157 -2.354 -3.066 1.00 0.00 C ATOM 643 SD MET A 43 0.588 -2.743 -2.816 1.00 0.00 S ATOM 644 CE MET A 43 1.093 -1.375 -1.778 1.00 0.00 C ATOM 0 H MET A 43 -3.127 -4.153 0.029 1.00 0.00 H new ATOM 0 HA MET A 43 -0.547 -2.850 -0.551 1.00 0.00 H new ATOM 0 HB2 MET A 43 -2.130 -4.086 -2.263 1.00 0.00 H new ATOM 0 HB3 MET A 43 -3.085 -2.620 -2.169 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.451 -2.665 -4.069 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.292 -1.274 -3.015 1.00 0.00 H new ATOM 0 HE1 MET A 43 1.814 -1.726 -1.039 1.00 0.00 H new ATOM 0 HE2 MET A 43 1.552 -0.601 -2.394 1.00 0.00 H new ATOM 0 HE3 MET A 43 0.222 -0.964 -1.268 1.00 0.00 H new ATOM 654 N VAL A 44 -1.386 -0.964 0.935 1.00 0.00 N ATOM 655 CA VAL A 44 -1.713 0.321 1.539 1.00 0.00 C ATOM 656 C VAL A 44 -1.073 1.474 0.775 1.00 0.00 C ATOM 657 O VAL A 44 -0.102 2.076 1.231 1.00 0.00 O ATOM 658 CB VAL A 44 -1.279 0.378 3.020 1.00 0.00 C ATOM 659 CG1 VAL A 44 -1.417 1.787 3.581 1.00 0.00 C ATOM 660 CG2 VAL A 44 -2.099 -0.601 3.839 1.00 0.00 C ATOM 0 H VAL A 44 -0.579 -1.430 1.350 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.797 0.425 1.488 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.227 0.098 3.079 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.104 1.795 4.625 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.789 2.470 3.009 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.457 2.106 3.511 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.786 -0.554 4.882 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.155 -0.342 3.765 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.945 -1.611 3.459 1.00 0.00 H new ATOM 670 N ILE A 45 -1.641 1.785 -0.381 1.00 0.00 N ATOM 671 CA ILE A 45 -1.147 2.875 -1.204 1.00 0.00 C ATOM 672 C ILE A 45 -1.912 4.153 -0.878 1.00 0.00 C ATOM 673 O ILE A 45 -3.104 4.261 -1.152 1.00 0.00 O ATOM 674 CB ILE A 45 -1.291 2.543 -2.705 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.530 1.258 -3.032 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.794 3.693 -3.569 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.792 0.737 -4.427 1.00 0.00 C ATOM 0 H ILE A 45 -2.447 1.295 -0.770 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.089 3.019 -0.987 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.348 2.393 -2.924 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.539 1.439 -2.916 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.804 0.490 -2.309 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.907 3.433 -4.621 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.376 4.589 -3.352 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.257 3.882 -3.353 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.219 -0.176 -4.588 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.855 0.524 -4.542 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.492 1.488 -5.158 1.00 0.00 H new ATOM 689 N ILE A 46 -1.234 5.115 -0.267 1.00 0.00 N ATOM 690 CA ILE A 46 -1.886 6.361 0.108 1.00 0.00 C ATOM 691 C ILE A 46 -1.276 7.544 -0.623 1.00 0.00 C ATOM 692 O ILE A 46 -0.075 7.575 -0.892 1.00 0.00 O ATOM 693 CB ILE A 46 -1.819 6.596 1.626 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.069 5.283 2.373 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.837 7.649 2.038 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.549 5.283 3.791 1.00 0.00 C ATOM 0 H ILE A 46 -0.245 5.058 -0.023 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.933 6.272 -0.183 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.824 6.958 1.886 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.140 5.082 2.388 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.600 4.467 1.823 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.781 7.808 3.115 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.622 8.585 1.522 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.839 7.310 1.773 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.762 4.321 4.257 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.472 5.452 3.784 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.037 6.076 4.357 1.00 0.00 H new ATOM 708 N HIS A 47 -2.120 8.508 -0.961 1.00 0.00 N ATOM 709 CA HIS A 47 -1.673 9.690 -1.686 1.00 0.00 C ATOM 710 C HIS A 47 -2.430 10.929 -1.222 1.00 0.00 C ATOM 711 O HIS A 47 -3.632 11.054 -1.460 1.00 0.00 O ATOM 712 CB HIS A 47 -1.868 9.497 -3.195 1.00 0.00 C ATOM 713 CG HIS A 47 -2.008 8.063 -3.624 1.00 0.00 C ATOM 714 ND1 HIS A 47 -1.305 7.525 -4.682 1.00 0.00 N ATOM 715 CD2 HIS A 47 -2.782 7.055 -3.143 1.00 0.00 C ATOM 716 CE1 HIS A 47 -1.644 6.259 -4.837 1.00 0.00 C ATOM 717 NE2 HIS A 47 -2.537 5.949 -3.917 1.00 0.00 N ATOM 0 H HIS A 47 -3.117 8.496 -0.746 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.612 9.832 -1.479 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.757 10.046 -3.507 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.020 9.939 -3.718 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.463 7.114 -2.307 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -1.256 5.590 -5.590 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -2.975 5.035 -3.800 1.00 0.00 H new ATOM 726 N LYS A 48 -1.729 11.841 -0.556 1.00 0.00 N ATOM 727 CA LYS A 48 -2.365 13.065 -0.064 1.00 0.00 C ATOM 728 C LYS A 48 -1.587 14.317 -0.460 1.00 0.00 C ATOM 729 O LYS A 48 -0.442 14.240 -0.906 1.00 0.00 O ATOM 730 CB LYS A 48 -2.514 13.017 1.456 1.00 0.00 C ATOM 731 CG LYS A 48 -3.787 12.329 1.922 1.00 0.00 C ATOM 732 CD LYS A 48 -3.953 12.429 3.431 1.00 0.00 C ATOM 733 CE LYS A 48 -4.625 13.733 3.834 1.00 0.00 C ATOM 734 NZ LYS A 48 -3.760 14.550 4.731 1.00 0.00 N ATOM 0 H LYS A 48 -0.734 11.761 -0.345 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.350 13.120 -0.528 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.654 12.498 1.881 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -2.497 14.034 1.847 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.648 12.781 1.429 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.765 11.280 1.626 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.546 11.587 3.789 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -2.977 12.358 3.911 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.867 14.308 2.940 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.567 13.515 4.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.254 15.430 4.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -3.550 14.011 5.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -2.871 14.780 4.242 1.00 0.00 H new ATOM 748 N SER A 49 -2.224 15.474 -0.277 1.00 0.00 N ATOM 749 CA SER A 49 -1.611 16.758 -0.598 1.00 0.00 C ATOM 750 C SER A 49 -1.199 16.827 -2.064 1.00 0.00 C ATOM 751 O SER A 49 -1.598 15.984 -2.868 1.00 0.00 O ATOM 752 CB SER A 49 -0.394 16.995 0.298 1.00 0.00 C ATOM 753 OG SER A 49 -0.616 18.077 1.184 1.00 0.00 O ATOM 0 H SER A 49 -3.171 15.545 0.095 1.00 0.00 H new ATOM 0 HA SER A 49 -2.351 17.538 -0.419 1.00 0.00 H new ATOM 0 HB2 SER A 49 -0.178 16.092 0.869 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.481 17.200 -0.319 1.00 0.00 H new ATOM 0 HG SER A 49 0.142 18.697 1.140 1.00 0.00 H new ATOM 759 N TRP A 50 -0.397 17.835 -2.402 1.00 0.00 N ATOM 760 CA TRP A 50 0.079 18.014 -3.769 1.00 0.00 C ATOM 761 C TRP A 50 0.999 16.866 -4.162 1.00 0.00 C ATOM 762 O TRP A 50 2.205 17.049 -4.336 1.00 0.00 O ATOM 763 CB TRP A 50 0.811 19.351 -3.910 1.00 0.00 C ATOM 764 CG TRP A 50 2.012 19.471 -3.020 1.00 0.00 C ATOM 765 CD1 TRP A 50 2.018 19.732 -1.680 1.00 0.00 C ATOM 766 CD2 TRP A 50 3.383 19.337 -3.410 1.00 0.00 C ATOM 767 NE1 TRP A 50 3.310 19.767 -1.213 1.00 0.00 N ATOM 768 CE2 TRP A 50 4.166 19.526 -2.255 1.00 0.00 C ATOM 769 CE3 TRP A 50 4.027 19.071 -4.622 1.00 0.00 C ATOM 770 CZ2 TRP A 50 5.557 19.461 -2.278 1.00 0.00 C ATOM 771 CZ3 TRP A 50 5.408 19.007 -4.643 1.00 0.00 C ATOM 772 CH2 TRP A 50 6.159 19.201 -3.478 1.00 0.00 C ATOM 0 H TRP A 50 -0.064 18.541 -1.745 1.00 0.00 H new ATOM 0 HA TRP A 50 -0.782 18.018 -4.438 1.00 0.00 H new ATOM 0 HB2 TRP A 50 1.123 19.478 -4.947 1.00 0.00 H new ATOM 0 HB3 TRP A 50 0.118 20.161 -3.684 1.00 0.00 H new ATOM 0 HD1 TRP A 50 1.137 19.888 -1.076 1.00 0.00 H new ATOM 0 HE1 TRP A 50 3.587 19.944 -0.247 1.00 0.00 H new ATOM 0 HE3 TRP A 50 3.456 18.918 -5.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 6.139 19.611 -1.381 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 5.916 18.804 -5.574 1.00 0.00 H new ATOM 0 HH2 TRP A 50 7.236 19.144 -3.528 1.00 0.00 H new ATOM 783 N CYS A 51 0.421 15.680 -4.285 1.00 0.00 N ATOM 784 CA CYS A 51 1.174 14.488 -4.641 1.00 0.00 C ATOM 785 C CYS A 51 1.313 14.363 -6.160 1.00 0.00 C ATOM 786 O CYS A 51 0.317 14.344 -6.883 1.00 0.00 O ATOM 787 CB CYS A 51 0.475 13.250 -4.046 1.00 0.00 C ATOM 788 SG CYS A 51 0.590 11.724 -5.044 1.00 0.00 S ATOM 0 H CYS A 51 -0.576 15.518 -4.142 1.00 0.00 H new ATOM 0 HA CYS A 51 2.180 14.563 -4.228 1.00 0.00 H new ATOM 0 HB2 CYS A 51 0.900 13.052 -3.062 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -0.578 13.486 -3.896 1.00 0.00 H new ATOM 793 N GLY A 52 2.552 14.265 -6.636 1.00 0.00 N ATOM 794 CA GLY A 52 2.787 14.125 -8.063 1.00 0.00 C ATOM 795 C GLY A 52 2.951 12.676 -8.459 1.00 0.00 C ATOM 796 O GLY A 52 2.634 12.290 -9.584 1.00 0.00 O ATOM 0 H GLY A 52 3.394 14.280 -6.061 1.00 0.00 H new ATOM 0 HA2 GLY A 52 1.954 14.562 -8.614 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.681 14.683 -8.342 1.00 0.00 H new ATOM 800 N ALA A 53 3.433 11.865 -7.520 1.00 0.00 N ATOM 801 CA ALA A 53 3.619 10.442 -7.765 1.00 0.00 C ATOM 802 C ALA A 53 2.304 9.788 -8.152 1.00 0.00 C ATOM 803 O ALA A 53 2.288 8.678 -8.680 1.00 0.00 O ATOM 804 CB ALA A 53 4.218 9.763 -6.543 1.00 0.00 C ATOM 0 H ALA A 53 3.701 12.171 -6.585 1.00 0.00 H new ATOM 0 HA ALA A 53 4.314 10.326 -8.596 1.00 0.00 H new ATOM 0 HB1 ALA A 53 4.350 8.700 -6.745 1.00 0.00 H new ATOM 0 HB2 ALA A 53 5.185 10.211 -6.315 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.549 9.890 -5.692 1.00 0.00 H new ATOM 810 N CYS A 54 1.204 10.490 -7.901 1.00 0.00 N ATOM 811 CA CYS A 54 -0.114 9.987 -8.239 1.00 0.00 C ATOM 812 C CYS A 54 -0.629 10.681 -9.494 1.00 0.00 C ATOM 813 O CYS A 54 -1.323 10.079 -10.317 1.00 0.00 O ATOM 814 CB CYS A 54 -1.087 10.195 -7.074 1.00 0.00 C ATOM 815 SG CYS A 54 -1.001 11.846 -6.305 1.00 0.00 S ATOM 0 H CYS A 54 1.204 11.411 -7.463 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.040 8.917 -8.433 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.103 10.027 -7.431 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -0.888 9.442 -6.312 1.00 0.00 H new ATOM 820 N LYS A 55 -0.265 11.950 -9.646 1.00 0.00 N ATOM 821 CA LYS A 55 -0.672 12.720 -10.813 1.00 0.00 C ATOM 822 C LYS A 55 -0.206 12.019 -12.080 1.00 0.00 C ATOM 823 O LYS A 55 -0.983 11.811 -13.012 1.00 0.00 O ATOM 824 CB LYS A 55 -0.095 14.135 -10.751 1.00 0.00 C ATOM 825 CG LYS A 55 -0.549 15.028 -11.894 1.00 0.00 C ATOM 826 CD LYS A 55 0.628 15.712 -12.571 1.00 0.00 C ATOM 827 CE LYS A 55 0.214 17.023 -13.219 1.00 0.00 C ATOM 828 NZ LYS A 55 1.386 17.778 -13.744 1.00 0.00 N ATOM 0 H LYS A 55 0.309 12.464 -8.978 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.760 12.793 -10.823 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.383 14.595 -9.806 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.993 14.075 -10.758 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -1.095 14.433 -12.626 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.240 15.781 -11.516 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.412 15.899 -11.837 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.050 15.049 -13.326 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.482 16.822 -14.033 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.316 17.636 -12.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.061 18.666 -14.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.039 17.993 -12.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.878 17.203 -14.458 1.00 0.00 H new ATOM 842 N ALA A 56 1.069 11.643 -12.097 1.00 0.00 N ATOM 843 CA ALA A 56 1.640 10.946 -13.242 1.00 0.00 C ATOM 844 C ALA A 56 0.975 9.589 -13.443 1.00 0.00 C ATOM 845 O ALA A 56 0.855 9.110 -14.569 1.00 0.00 O ATOM 846 CB ALA A 56 3.142 10.782 -13.062 1.00 0.00 C ATOM 0 H ALA A 56 1.724 11.809 -11.333 1.00 0.00 H new ATOM 0 HA ALA A 56 1.456 11.546 -14.133 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.557 10.260 -13.924 1.00 0.00 H new ATOM 0 HB2 ALA A 56 3.607 11.764 -12.974 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.339 10.205 -12.159 1.00 0.00 H new ATOM 852 N LEU A 57 0.534 8.974 -12.348 1.00 0.00 N ATOM 853 CA LEU A 57 -0.125 7.673 -12.419 1.00 0.00 C ATOM 854 C LEU A 57 -1.375 7.747 -13.290 1.00 0.00 C ATOM 855 O LEU A 57 -1.775 6.763 -13.904 1.00 0.00 O ATOM 856 CB LEU A 57 -0.501 7.173 -11.017 1.00 0.00 C ATOM 857 CG LEU A 57 0.664 6.712 -10.125 1.00 0.00 C ATOM 858 CD1 LEU A 57 0.346 5.378 -9.464 1.00 0.00 C ATOM 859 CD2 LEU A 57 1.966 6.621 -10.914 1.00 0.00 C ATOM 0 H LEU A 57 0.621 9.354 -11.405 1.00 0.00 H new ATOM 0 HA LEU A 57 0.577 6.970 -12.867 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.033 7.971 -10.500 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.199 6.343 -11.125 1.00 0.00 H new ATOM 0 HG LEU A 57 0.797 7.461 -9.344 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.185 5.073 -8.838 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.547 5.481 -8.848 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.173 4.624 -10.232 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.769 6.293 -10.254 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.849 5.905 -11.728 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.212 7.600 -11.325 1.00 0.00 H new ATOM 871 N LYS A 58 -1.998 8.913 -13.336 1.00 0.00 N ATOM 872 CA LYS A 58 -3.208 9.086 -14.131 1.00 0.00 C ATOM 873 C LYS A 58 -3.030 8.544 -15.560 1.00 0.00 C ATOM 874 O LYS A 58 -3.634 7.532 -15.919 1.00 0.00 O ATOM 875 CB LYS A 58 -3.637 10.561 -14.137 1.00 0.00 C ATOM 876 CG LYS A 58 -4.606 10.927 -15.255 1.00 0.00 C ATOM 877 CD LYS A 58 -5.770 11.756 -14.735 1.00 0.00 C ATOM 878 CE LYS A 58 -6.234 12.772 -15.766 1.00 0.00 C ATOM 879 NZ LYS A 58 -5.542 14.080 -15.609 1.00 0.00 N ATOM 0 H LYS A 58 -1.691 9.749 -12.838 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.004 8.502 -13.668 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.100 10.797 -13.179 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.748 11.186 -14.223 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.077 11.485 -16.028 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.985 10.018 -15.721 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.598 11.098 -14.473 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -5.472 12.272 -13.822 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.050 12.382 -16.767 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -7.310 12.918 -15.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.887 14.744 -16.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.738 14.465 -14.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.517 13.946 -15.723 1.00 0.00 H new ATOM 893 N PRO A 59 -2.212 9.206 -16.401 1.00 0.00 N ATOM 894 CA PRO A 59 -1.993 8.779 -17.792 1.00 0.00 C ATOM 895 C PRO A 59 -1.120 7.532 -17.941 1.00 0.00 C ATOM 896 O PRO A 59 -1.213 6.830 -18.949 1.00 0.00 O ATOM 897 CB PRO A 59 -1.290 9.982 -18.416 1.00 0.00 C ATOM 898 CG PRO A 59 -0.565 10.611 -17.281 1.00 0.00 C ATOM 899 CD PRO A 59 -1.453 10.431 -16.081 1.00 0.00 C ATOM 0 HA PRO A 59 -2.936 8.498 -18.261 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.604 9.677 -19.206 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -2.005 10.673 -18.864 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.404 10.138 -17.125 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.377 11.667 -17.474 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.873 10.317 -15.165 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.113 11.287 -15.937 1.00 0.00 H new ATOM 907 N LYS A 60 -0.264 7.257 -16.961 1.00 0.00 N ATOM 908 CA LYS A 60 0.615 6.088 -17.046 1.00 0.00 C ATOM 909 C LYS A 60 0.060 4.911 -16.253 1.00 0.00 C ATOM 910 O LYS A 60 -0.064 3.811 -16.785 1.00 0.00 O ATOM 911 CB LYS A 60 2.025 6.424 -16.566 1.00 0.00 C ATOM 912 CG LYS A 60 2.154 6.433 -15.056 1.00 0.00 C ATOM 913 CD LYS A 60 3.459 7.068 -14.593 1.00 0.00 C ATOM 914 CE LYS A 60 3.711 8.413 -15.261 1.00 0.00 C ATOM 915 NZ LYS A 60 4.622 8.290 -16.433 1.00 0.00 N ATOM 0 H LYS A 60 -0.158 7.814 -16.113 1.00 0.00 H new ATOM 0 HA LYS A 60 0.663 5.799 -18.096 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.725 5.699 -16.980 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.311 7.401 -16.955 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.314 6.978 -14.625 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.097 5.411 -14.682 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.433 7.200 -13.511 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.287 6.394 -14.812 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.762 8.842 -15.583 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.143 9.103 -14.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.543 8.714 -16.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.752 7.285 -16.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.208 8.785 -17.248 1.00 0.00 H new ATOM 929 N PHE A 61 -0.286 5.134 -14.987 1.00 0.00 N ATOM 930 CA PHE A 61 -0.834 4.064 -14.180 1.00 0.00 C ATOM 931 C PHE A 61 -2.130 3.588 -14.804 1.00 0.00 C ATOM 932 O PHE A 61 -2.540 2.448 -14.611 1.00 0.00 O ATOM 933 CB PHE A 61 -1.039 4.493 -12.730 1.00 0.00 C ATOM 934 CG PHE A 61 -1.070 3.330 -11.781 1.00 0.00 C ATOM 935 CD1 PHE A 61 -2.245 2.632 -11.556 1.00 0.00 C ATOM 936 CD2 PHE A 61 0.080 2.928 -11.120 1.00 0.00 C ATOM 937 CE1 PHE A 61 -2.272 1.555 -10.691 1.00 0.00 C ATOM 938 CE2 PHE A 61 0.058 1.853 -10.251 1.00 0.00 C ATOM 939 CZ PHE A 61 -1.119 1.165 -10.038 1.00 0.00 C ATOM 0 H PHE A 61 -0.196 6.032 -14.511 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.121 3.240 -14.158 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.238 5.172 -12.440 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.973 5.048 -12.648 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.150 2.933 -12.062 1.00 0.00 H new ATOM 0 HD2 PHE A 61 1.005 3.461 -11.286 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.194 1.018 -10.525 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.961 1.552 -9.740 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.139 0.323 -9.362 1.00 0.00 H new ATOM 949 N ALA A 62 -2.740 4.447 -15.627 1.00 0.00 N ATOM 950 CA ALA A 62 -3.939 4.060 -16.346 1.00 0.00 C ATOM 951 C ALA A 62 -3.596 2.845 -17.212 1.00 0.00 C ATOM 952 O ALA A 62 -4.460 2.058 -17.598 1.00 0.00 O ATOM 953 CB ALA A 62 -4.445 5.216 -17.200 1.00 0.00 C ATOM 0 H ALA A 62 -2.422 5.400 -15.805 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.735 3.803 -15.647 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -5.345 4.908 -17.732 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.675 6.068 -16.560 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.677 5.500 -17.919 1.00 0.00 H new ATOM 959 N GLU A 63 -2.292 2.713 -17.471 1.00 0.00 N ATOM 960 CA GLU A 63 -1.719 1.624 -18.246 1.00 0.00 C ATOM 961 C GLU A 63 -1.649 0.354 -17.412 1.00 0.00 C ATOM 962 O GLU A 63 -1.429 -0.739 -17.938 1.00 0.00 O ATOM 963 CB GLU A 63 -0.317 2.026 -18.714 1.00 0.00 C ATOM 964 CG GLU A 63 0.198 1.204 -19.884 1.00 0.00 C ATOM 965 CD GLU A 63 0.819 2.061 -20.970 1.00 0.00 C ATOM 966 OE1 GLU A 63 2.003 2.431 -20.830 1.00 0.00 O ATOM 967 OE2 GLU A 63 0.119 2.362 -21.961 1.00 0.00 O ATOM 0 H GLU A 63 -1.595 3.379 -17.137 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.352 1.427 -19.111 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -0.327 3.078 -18.998 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.377 1.927 -17.879 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.937 0.489 -19.523 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.624 0.627 -20.307 1.00 0.00 H new ATOM 974 N SER A 64 -1.833 0.505 -16.107 1.00 0.00 N ATOM 975 CA SER A 64 -1.791 -0.618 -15.193 1.00 0.00 C ATOM 976 C SER A 64 -2.844 -1.675 -15.521 1.00 0.00 C ATOM 977 O SER A 64 -3.049 -2.601 -14.737 1.00 0.00 O ATOM 978 CB SER A 64 -1.968 -0.137 -13.757 1.00 0.00 C ATOM 979 OG SER A 64 -0.789 0.486 -13.275 1.00 0.00 O ATOM 0 H SER A 64 -2.014 1.404 -15.659 1.00 0.00 H new ATOM 0 HA SER A 64 -0.813 -1.086 -15.306 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.800 0.565 -13.706 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.224 -0.981 -13.117 1.00 0.00 H new ATOM 0 HG SER A 64 -1.020 1.115 -12.560 1.00 0.00 H new ATOM 985 N THR A 65 -3.494 -1.571 -16.684 1.00 0.00 N ATOM 986 CA THR A 65 -4.475 -2.574 -17.076 1.00 0.00 C ATOM 987 C THR A 65 -3.825 -3.943 -16.958 1.00 0.00 C ATOM 988 O THR A 65 -4.455 -4.915 -16.541 1.00 0.00 O ATOM 989 CB THR A 65 -4.965 -2.333 -18.505 1.00 0.00 C ATOM 990 OG1 THR A 65 -4.066 -1.495 -19.210 1.00 0.00 O ATOM 991 CG2 THR A 65 -6.334 -1.691 -18.568 1.00 0.00 C ATOM 0 H THR A 65 -3.359 -0.816 -17.356 1.00 0.00 H new ATOM 0 HA THR A 65 -5.345 -2.513 -16.422 1.00 0.00 H new ATOM 0 HB THR A 65 -5.023 -3.322 -18.960 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.173 -1.898 -19.208 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.621 -1.548 -19.610 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.062 -2.337 -18.076 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.307 -0.725 -18.063 1.00 0.00 H new ATOM 999 N GLU A 66 -2.533 -3.984 -17.274 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.758 -5.204 -17.145 1.00 0.00 C ATOM 1001 C GLU A 66 -1.427 -5.403 -15.684 1.00 0.00 C ATOM 1002 O GLU A 66 -1.335 -6.530 -15.198 1.00 0.00 O ATOM 1003 CB GLU A 66 -0.471 -5.138 -17.964 1.00 0.00 C ATOM 1004 CG GLU A 66 0.284 -3.835 -17.785 1.00 0.00 C ATOM 1005 CD GLU A 66 0.117 -2.895 -18.961 1.00 0.00 C ATOM 1006 OE1 GLU A 66 -1.032 -2.715 -19.419 1.00 0.00 O ATOM 1007 OE2 GLU A 66 1.133 -2.339 -19.427 1.00 0.00 O ATOM 0 H GLU A 66 -2.005 -3.183 -17.621 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.345 -6.040 -17.525 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.176 -5.968 -17.679 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -0.712 -5.269 -19.019 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.063 -3.340 -16.878 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.343 -4.050 -17.645 1.00 0.00 H new ATOM 1014 N ILE A 67 -1.267 -4.286 -14.973 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.970 -4.346 -13.558 1.00 0.00 C ATOM 1016 C ILE A 67 -2.143 -4.938 -12.788 1.00 0.00 C ATOM 1017 O ILE A 67 -1.994 -5.368 -11.644 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.518 -2.980 -12.996 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.997 -3.015 -12.786 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -1.231 -2.621 -11.696 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.604 -1.657 -12.507 1.00 0.00 C ATOM 0 H ILE A 67 -1.339 -3.343 -15.356 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.120 -5.015 -13.423 1.00 0.00 H new ATOM 0 HB ILE A 67 -0.783 -2.206 -13.716 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.224 -3.682 -11.955 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.468 -3.438 -13.673 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.878 -1.652 -11.343 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -2.306 -2.573 -11.872 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -1.020 -3.381 -10.943 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.680 -1.761 -12.369 1.00 0.00 H new ATOM 0 HD12 ILE A 67 1.409 -0.991 -13.348 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.161 -1.239 -11.603 1.00 0.00 H new ATOM 1033 N SER A 68 -3.299 -5.013 -13.438 1.00 0.00 N ATOM 1034 CA SER A 68 -4.463 -5.615 -12.819 1.00 0.00 C ATOM 1035 C SER A 68 -4.227 -7.120 -12.648 1.00 0.00 C ATOM 1036 O SER A 68 -4.955 -7.794 -11.921 1.00 0.00 O ATOM 1037 CB SER A 68 -5.714 -5.365 -13.666 1.00 0.00 C ATOM 1038 OG SER A 68 -6.694 -4.655 -12.930 1.00 0.00 O ATOM 0 H SER A 68 -3.450 -4.666 -14.385 1.00 0.00 H new ATOM 0 HA SER A 68 -4.621 -5.161 -11.841 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.446 -4.801 -14.559 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.126 -6.317 -14.002 1.00 0.00 H new ATOM 0 HG SER A 68 -7.482 -4.506 -13.493 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.201 -7.638 -13.336 1.00 0.00 N ATOM 1045 CA GLU A 69 -2.865 -9.058 -13.275 1.00 0.00 C ATOM 1046 C GLU A 69 -1.513 -9.297 -12.592 1.00 0.00 C ATOM 1047 O GLU A 69 -1.455 -9.854 -11.498 1.00 0.00 O ATOM 1048 CB GLU A 69 -2.847 -9.657 -14.683 1.00 0.00 C ATOM 1049 CG GLU A 69 -4.029 -9.233 -15.541 1.00 0.00 C ATOM 1050 CD GLU A 69 -5.362 -9.591 -14.915 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -5.761 -10.772 -15.001 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -6.008 -8.692 -14.338 1.00 0.00 O ATOM 0 H GLU A 69 -2.591 -7.089 -13.942 1.00 0.00 H new ATOM 0 HA GLU A 69 -3.633 -9.550 -12.677 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.923 -9.364 -15.182 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.836 -10.744 -14.606 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.986 -8.156 -15.705 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.952 -9.708 -16.519 1.00 0.00 H new ATOM 1059 N LEU A 70 -0.423 -8.885 -13.245 1.00 0.00 N ATOM 1060 CA LEU A 70 0.920 -9.079 -12.692 1.00 0.00 C ATOM 1061 C LEU A 70 1.107 -8.337 -11.365 1.00 0.00 C ATOM 1062 O LEU A 70 2.092 -8.563 -10.662 1.00 0.00 O ATOM 1063 CB LEU A 70 2.010 -8.686 -13.712 1.00 0.00 C ATOM 1064 CG LEU A 70 2.556 -7.262 -13.651 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.426 -6.271 -13.589 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.496 -7.089 -12.464 1.00 0.00 C ATOM 0 H LEU A 70 -0.443 -8.418 -14.152 1.00 0.00 H new ATOM 0 HA LEU A 70 1.028 -10.143 -12.482 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.848 -9.372 -13.589 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.608 -8.849 -14.712 1.00 0.00 H new ATOM 0 HG LEU A 70 3.129 -7.075 -14.559 1.00 0.00 H new ATOM 0 HD11 LEU A 70 1.831 -5.260 -13.546 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.802 -6.375 -14.477 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.825 -6.460 -12.699 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.871 -6.066 -12.443 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.957 -7.297 -11.540 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.333 -7.781 -12.559 1.00 0.00 H new ATOM 1078 N SER A 71 0.183 -7.437 -11.038 1.00 0.00 N ATOM 1079 CA SER A 71 0.275 -6.658 -9.805 1.00 0.00 C ATOM 1080 C SER A 71 -0.838 -7.003 -8.811 1.00 0.00 C ATOM 1081 O SER A 71 -0.768 -6.614 -7.645 1.00 0.00 O ATOM 1082 CB SER A 71 0.242 -5.167 -10.110 1.00 0.00 C ATOM 1083 OG SER A 71 1.451 -4.537 -9.722 1.00 0.00 O ATOM 0 H SER A 71 -0.637 -7.229 -11.608 1.00 0.00 H new ATOM 0 HA SER A 71 1.227 -6.917 -9.341 1.00 0.00 H new ATOM 0 HB2 SER A 71 0.076 -5.015 -11.176 1.00 0.00 H new ATOM 0 HB3 SER A 71 -0.596 -4.705 -9.588 1.00 0.00 H new ATOM 0 HG SER A 71 1.286 -3.962 -8.946 1.00 0.00 H new ATOM 1089 N HIS A 72 -1.867 -7.727 -9.262 1.00 0.00 N ATOM 1090 CA HIS A 72 -2.979 -8.101 -8.378 1.00 0.00 C ATOM 1091 C HIS A 72 -2.462 -8.764 -7.109 1.00 0.00 C ATOM 1092 O HIS A 72 -3.186 -8.915 -6.124 1.00 0.00 O ATOM 1093 CB HIS A 72 -3.989 -9.018 -9.089 1.00 0.00 C ATOM 1094 CG HIS A 72 -3.412 -10.270 -9.689 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -2.315 -10.938 -9.179 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -3.812 -10.988 -10.767 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -2.067 -12.003 -9.918 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -2.959 -12.057 -10.886 1.00 0.00 N ATOM 0 H HIS A 72 -1.955 -8.063 -10.221 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.499 -7.183 -8.106 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -4.763 -9.301 -8.375 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.478 -8.448 -9.879 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -4.647 -10.761 -11.413 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -1.268 -12.711 -9.756 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -3.008 -12.777 -11.607 1.00 0.00 H new ATOM 1107 N ASN A 73 -1.195 -9.148 -7.150 1.00 0.00 N ATOM 1108 CA ASN A 73 -0.524 -9.787 -6.033 1.00 0.00 C ATOM 1109 C ASN A 73 -0.736 -9.010 -4.730 1.00 0.00 C ATOM 1110 O ASN A 73 -0.581 -9.554 -3.641 1.00 0.00 O ATOM 1111 CB ASN A 73 0.961 -9.901 -6.357 1.00 0.00 C ATOM 1112 CG ASN A 73 1.211 -10.531 -7.718 1.00 0.00 C ATOM 1113 OD1 ASN A 73 1.265 -9.704 -8.758 1.00 0.00 O flip ATOM 1114 ND2 ASN A 73 1.352 -11.748 -7.832 1.00 0.00 N flip ATOM 0 H ASN A 73 -0.600 -9.023 -7.969 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.949 -10.780 -5.883 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.413 -8.910 -6.330 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.453 -10.497 -5.588 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.303 -12.346 -7.007 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.518 -12.158 -8.751 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.104 -7.741 -4.856 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.362 -6.884 -3.717 1.00 0.00 C ATOM 1123 C PHE A 74 -2.862 -6.605 -3.647 1.00 0.00 C ATOM 1124 O PHE A 74 -3.545 -6.679 -4.669 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.574 -5.590 -3.872 1.00 0.00 C ATOM 1126 CG PHE A 74 0.909 -5.775 -3.714 1.00 0.00 C ATOM 1127 CD1 PHE A 74 1.478 -5.879 -2.454 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.732 -5.848 -4.826 1.00 0.00 C ATOM 1129 CE1 PHE A 74 2.841 -6.053 -2.309 1.00 0.00 C ATOM 1130 CE2 PHE A 74 3.096 -6.022 -4.687 1.00 0.00 C ATOM 1131 CZ PHE A 74 3.652 -6.124 -3.427 1.00 0.00 C ATOM 0 H PHE A 74 -1.231 -7.280 -5.757 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.047 -7.368 -2.792 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.777 -5.164 -4.855 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.924 -4.869 -3.133 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.850 -5.823 -1.577 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.302 -5.768 -5.814 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.273 -6.134 -1.322 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.726 -6.078 -5.562 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.718 -6.259 -3.315 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.398 -6.342 -2.455 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.841 -6.130 -2.340 1.00 0.00 C ATOM 1143 C VAL A 75 -5.273 -4.680 -2.088 1.00 0.00 C ATOM 1144 O VAL A 75 -4.625 -3.912 -1.379 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.466 -7.032 -1.261 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.008 -6.623 0.130 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -6.984 -7.001 -1.369 1.00 0.00 C ATOM 0 H VAL A 75 -2.875 -6.272 -1.582 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.216 -6.399 -3.328 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.127 -8.055 -1.428 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.466 -7.278 0.871 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.923 -6.705 0.194 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.306 -5.593 0.323 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.417 -7.642 -0.601 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.338 -5.979 -1.230 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.286 -7.359 -2.353 1.00 0.00 H new ATOM 1157 N MET A 76 -6.406 -4.360 -2.708 1.00 0.00 N ATOM 1158 CA MET A 76 -7.073 -3.065 -2.663 1.00 0.00 C ATOM 1159 C MET A 76 -7.053 -2.344 -1.313 1.00 0.00 C ATOM 1160 O MET A 76 -8.004 -2.462 -0.537 1.00 0.00 O ATOM 1161 CB MET A 76 -8.530 -3.306 -3.029 1.00 0.00 C ATOM 1162 CG MET A 76 -9.238 -4.271 -2.085 1.00 0.00 C ATOM 1163 SD MET A 76 -9.666 -5.839 -2.868 1.00 0.00 S ATOM 1164 CE MET A 76 -11.104 -6.313 -1.912 1.00 0.00 C ATOM 0 H MET A 76 -6.909 -5.034 -3.285 1.00 0.00 H new ATOM 0 HA MET A 76 -6.526 -2.418 -3.349 1.00 0.00 H new ATOM 0 HB2 MET A 76 -9.060 -2.353 -3.028 1.00 0.00 H new ATOM 0 HB3 MET A 76 -8.582 -3.699 -4.045 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.597 -4.464 -1.225 1.00 0.00 H new ATOM 0 HG3 MET A 76 -10.146 -3.800 -1.707 1.00 0.00 H new ATOM 0 HE1 MET A 76 -10.843 -7.135 -1.246 1.00 0.00 H new ATOM 0 HE2 MET A 76 -11.445 -5.462 -1.322 1.00 0.00 H new ATOM 0 HE3 MET A 76 -11.900 -6.630 -2.585 1.00 0.00 H new ATOM 1174 N VAL A 77 -6.021 -1.534 -1.059 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.973 -0.760 0.178 1.00 0.00 C ATOM 1176 C VAL A 77 -5.297 0.591 -0.020 1.00 0.00 C ATOM 1177 O VAL A 77 -4.291 0.894 0.612 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.280 -1.521 1.325 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.226 -0.669 2.586 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -6.008 -2.816 1.598 1.00 0.00 C ATOM 0 H VAL A 77 -5.224 -1.400 -1.681 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.013 -0.594 0.460 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.257 -1.745 1.023 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.733 -1.227 3.382 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.668 0.245 2.384 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.239 -0.414 2.896 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.512 -3.348 2.410 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.039 -2.601 1.881 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.999 -3.434 0.700 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.869 1.414 -0.883 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.324 2.736 -1.129 1.00 0.00 C ATOM 1192 C ASN A 78 -6.144 3.786 -0.394 1.00 0.00 C ATOM 1193 O ASN A 78 -7.281 4.078 -0.763 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.277 3.026 -2.629 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.698 4.439 -2.987 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -6.634 4.644 -3.757 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -5.002 5.419 -2.427 1.00 0.00 N ATOM 0 H ASN A 78 -6.706 1.191 -1.422 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.303 2.772 -0.749 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -4.264 2.854 -2.992 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -5.925 2.320 -3.148 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.236 6.391 -2.630 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.233 5.201 -1.794 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.557 4.345 0.651 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.233 5.362 1.450 1.00 0.00 C ATOM 1206 C LEU A 79 -6.005 6.763 0.885 1.00 0.00 C ATOM 1207 O LEU A 79 -4.957 7.054 0.301 1.00 0.00 O ATOM 1208 CB LEU A 79 -5.767 5.304 2.906 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.720 3.902 3.518 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -4.883 3.904 4.788 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -7.127 3.396 3.803 1.00 0.00 C ATOM 0 H LEU A 79 -4.615 4.115 0.968 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.301 5.150 1.410 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.772 5.745 2.971 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.431 5.924 3.508 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.253 3.227 2.800 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.860 2.899 5.210 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.867 4.222 4.554 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.321 4.592 5.511 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.074 2.398 4.238 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -7.622 4.070 4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -7.695 3.357 2.873 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.000 7.626 1.068 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.929 9.001 0.586 1.00 0.00 C ATOM 1225 C GLU A 80 -7.153 9.982 1.735 1.00 0.00 C ATOM 1226 O GLU A 80 -7.296 9.576 2.887 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.973 9.232 -0.508 1.00 0.00 C ATOM 1228 CG GLU A 80 -7.556 10.264 -1.544 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.480 11.466 -1.574 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -9.680 11.285 -1.865 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -8.001 12.589 -1.307 1.00 0.00 O ATOM 0 H GLU A 80 -7.869 7.395 1.549 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.936 9.170 0.170 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.174 8.286 -1.011 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.907 9.552 -0.045 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.540 10.597 -1.332 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.540 9.798 -2.529 1.00 0.00 H new ATOM 1238 N ASP A 81 -7.183 11.272 1.414 1.00 0.00 N ATOM 1239 CA ASP A 81 -7.394 12.306 2.423 1.00 0.00 C ATOM 1240 C ASP A 81 -8.643 12.019 3.252 1.00 0.00 C ATOM 1241 O ASP A 81 -8.739 12.426 4.410 1.00 0.00 O ATOM 1242 CB ASP A 81 -7.513 13.678 1.759 1.00 0.00 C ATOM 1243 CG ASP A 81 -7.531 14.810 2.768 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -8.401 14.790 3.665 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -6.677 15.714 2.663 1.00 0.00 O ATOM 0 H ASP A 81 -7.064 11.626 0.465 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.532 12.305 3.091 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.678 13.820 1.073 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.425 13.712 1.163 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.599 11.315 2.651 1.00 0.00 N ATOM 1251 CA GLU A 82 -10.840 10.974 3.336 1.00 0.00 C ATOM 1252 C GLU A 82 -10.569 10.076 4.539 1.00 0.00 C ATOM 1253 O GLU A 82 -10.725 10.495 5.686 1.00 0.00 O ATOM 1254 CB GLU A 82 -11.804 10.280 2.372 1.00 0.00 C ATOM 1255 CG GLU A 82 -13.253 10.706 2.548 1.00 0.00 C ATOM 1256 CD GLU A 82 -14.208 9.529 2.583 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -14.291 8.801 1.573 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -14.874 9.336 3.622 1.00 0.00 O ATOM 0 H GLU A 82 -9.537 10.971 1.693 1.00 0.00 H new ATOM 0 HA GLU A 82 -11.296 11.898 3.692 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -11.494 10.490 1.348 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.731 9.202 2.513 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -13.350 11.275 3.472 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.533 11.372 1.732 1.00 0.00 H new ATOM 1265 N GLU A 83 -10.158 8.841 4.270 1.00 0.00 N ATOM 1266 CA GLU A 83 -9.861 7.886 5.332 1.00 0.00 C ATOM 1267 C GLU A 83 -8.580 8.273 6.063 1.00 0.00 C ATOM 1268 O GLU A 83 -7.519 8.399 5.451 1.00 0.00 O ATOM 1269 CB GLU A 83 -9.725 6.475 4.756 1.00 0.00 C ATOM 1270 CG GLU A 83 -10.893 6.061 3.877 1.00 0.00 C ATOM 1271 CD GLU A 83 -12.162 5.814 4.673 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -12.877 6.795 4.967 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -12.439 4.641 4.997 1.00 0.00 O ATOM 0 H GLU A 83 -10.023 8.478 3.326 1.00 0.00 H new ATOM 0 HA GLU A 83 -10.687 7.902 6.043 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.805 6.416 4.174 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -9.629 5.764 5.577 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -11.079 6.838 3.136 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.629 5.156 3.330 1.00 0.00 H new ATOM 1280 N GLU A 84 -8.685 8.464 7.373 1.00 0.00 N ATOM 1281 CA GLU A 84 -7.533 8.843 8.182 1.00 0.00 C ATOM 1282 C GLU A 84 -7.419 7.962 9.425 1.00 0.00 C ATOM 1283 O GLU A 84 -7.963 8.291 10.480 1.00 0.00 O ATOM 1284 CB GLU A 84 -7.633 10.313 8.595 1.00 0.00 C ATOM 1285 CG GLU A 84 -9.014 10.717 9.082 1.00 0.00 C ATOM 1286 CD GLU A 84 -9.114 12.199 9.388 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -9.059 13.007 8.437 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -9.248 12.550 10.579 1.00 0.00 O ATOM 0 H GLU A 84 -9.554 8.363 7.897 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.638 8.701 7.576 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -6.907 10.510 9.384 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -7.359 10.939 7.746 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -9.753 10.455 8.325 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -9.260 10.147 9.978 1.00 0.00 H new ATOM 1295 N PRO A 85 -6.703 6.829 9.319 1.00 0.00 N ATOM 1296 CA PRO A 85 -6.516 5.905 10.442 1.00 0.00 C ATOM 1297 C PRO A 85 -5.528 6.435 11.480 1.00 0.00 C ATOM 1298 O PRO A 85 -5.296 5.796 12.507 1.00 0.00 O ATOM 1299 CB PRO A 85 -5.961 4.650 9.767 1.00 0.00 C ATOM 1300 CG PRO A 85 -5.244 5.158 8.566 1.00 0.00 C ATOM 1301 CD PRO A 85 -6.018 6.361 8.097 1.00 0.00 C ATOM 0 HA PRO A 85 -7.441 5.741 10.995 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -5.288 4.107 10.431 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.760 3.962 9.491 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -4.216 5.427 8.810 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.198 4.396 7.788 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -5.360 7.127 7.688 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -6.729 6.100 7.313 1.00 0.00 H new ATOM 1309 N LYS A 86 -4.947 7.605 11.207 1.00 0.00 N ATOM 1310 CA LYS A 86 -3.980 8.229 12.112 1.00 0.00 C ATOM 1311 C LYS A 86 -2.971 7.213 12.643 1.00 0.00 C ATOM 1312 O LYS A 86 -3.176 6.608 13.694 1.00 0.00 O ATOM 1313 CB LYS A 86 -4.697 8.916 13.279 1.00 0.00 C ATOM 1314 CG LYS A 86 -5.732 8.046 13.970 1.00 0.00 C ATOM 1315 CD LYS A 86 -6.330 8.755 15.174 1.00 0.00 C ATOM 1316 CE LYS A 86 -7.829 8.522 15.271 1.00 0.00 C ATOM 1317 NZ LYS A 86 -8.363 8.882 16.614 1.00 0.00 N ATOM 0 H LYS A 86 -5.131 8.143 10.360 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.435 8.979 11.539 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.955 9.231 14.013 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.184 9.819 12.911 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.523 7.789 13.266 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.271 7.110 14.287 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -5.846 8.400 16.084 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -6.131 9.824 15.104 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.338 9.112 14.508 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.048 7.475 15.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -9.388 8.708 16.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -7.896 8.302 17.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -8.178 9.888 16.803 1.00 0.00 H new ATOM 1331 N ASP A 87 -1.877 7.039 11.907 1.00 0.00 N ATOM 1332 CA ASP A 87 -0.830 6.101 12.300 1.00 0.00 C ATOM 1333 C ASP A 87 0.300 6.088 11.276 1.00 0.00 C ATOM 1334 O ASP A 87 0.263 6.817 10.284 1.00 0.00 O ATOM 1335 CB ASP A 87 -1.405 4.693 12.460 1.00 0.00 C ATOM 1336 CG ASP A 87 -0.781 3.945 13.622 1.00 0.00 C ATOM 1337 OD1 ASP A 87 0.380 3.505 13.491 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -1.456 3.799 14.664 1.00 0.00 O ATOM 0 H ASP A 87 -1.692 7.535 11.035 1.00 0.00 H new ATOM 0 HA ASP A 87 -0.426 6.429 13.258 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.483 4.758 12.609 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.244 4.131 11.540 1.00 0.00 H new ATOM 1343 N GLU A 88 1.302 5.251 11.520 1.00 0.00 N ATOM 1344 CA GLU A 88 2.445 5.137 10.620 1.00 0.00 C ATOM 1345 C GLU A 88 2.019 4.612 9.249 1.00 0.00 C ATOM 1346 O GLU A 88 2.760 4.732 8.274 1.00 0.00 O ATOM 1347 CB GLU A 88 3.505 4.220 11.226 1.00 0.00 C ATOM 1348 CG GLU A 88 4.641 4.973 11.892 1.00 0.00 C ATOM 1349 CD GLU A 88 4.241 5.575 13.224 1.00 0.00 C ATOM 1350 OE1 GLU A 88 4.275 4.846 14.239 1.00 0.00 O ATOM 1351 OE2 GLU A 88 3.892 6.774 13.255 1.00 0.00 O ATOM 0 H GLU A 88 1.346 4.640 12.335 1.00 0.00 H new ATOM 0 HA GLU A 88 2.868 6.133 10.486 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.033 3.566 11.959 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.912 3.580 10.443 1.00 0.00 H new ATOM 0 HG2 GLU A 88 5.482 4.296 12.042 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.985 5.766 11.228 1.00 0.00 H new ATOM 1358 N ASP A 89 0.821 4.037 9.177 1.00 0.00 N ATOM 1359 CA ASP A 89 0.303 3.499 7.921 1.00 0.00 C ATOM 1360 C ASP A 89 0.259 4.572 6.828 1.00 0.00 C ATOM 1361 O ASP A 89 0.107 4.255 5.649 1.00 0.00 O ATOM 1362 CB ASP A 89 -1.089 2.895 8.133 1.00 0.00 C ATOM 1363 CG ASP A 89 -1.078 1.744 9.126 1.00 0.00 C ATOM 1364 OD1 ASP A 89 -1.118 2.015 10.344 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -1.029 0.571 8.686 1.00 0.00 O ATOM 0 H ASP A 89 0.191 3.932 9.972 1.00 0.00 H new ATOM 0 HA ASP A 89 0.982 2.713 7.589 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -1.768 3.670 8.488 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -1.478 2.543 7.178 1.00 0.00 H new ATOM 1370 N PHE A 90 0.388 5.840 7.220 1.00 0.00 N ATOM 1371 CA PHE A 90 0.365 6.945 6.262 1.00 0.00 C ATOM 1372 C PHE A 90 1.770 7.236 5.732 1.00 0.00 C ATOM 1373 O PHE A 90 1.978 7.382 4.521 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.205 8.205 6.920 1.00 0.00 C ATOM 1375 CG PHE A 90 -1.673 8.420 6.673 1.00 0.00 C ATOM 1376 CD1 PHE A 90 -2.225 8.179 5.426 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -2.499 8.874 7.689 1.00 0.00 C ATOM 1378 CE1 PHE A 90 -3.573 8.382 5.198 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -3.846 9.080 7.467 1.00 0.00 C ATOM 1380 CZ PHE A 90 -4.384 8.834 6.219 1.00 0.00 C ATOM 0 H PHE A 90 0.509 6.127 8.191 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.271 6.654 5.426 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.033 8.149 7.995 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.344 9.072 6.554 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.595 7.828 4.622 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.084 9.069 8.667 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -3.991 8.187 4.222 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.478 9.433 8.268 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.437 8.995 6.042 1.00 0.00 H new ATOM 1390 N SER A 91 2.728 7.329 6.652 1.00 0.00 N ATOM 1391 CA SER A 91 4.116 7.609 6.300 1.00 0.00 C ATOM 1392 C SER A 91 5.036 7.393 7.502 1.00 0.00 C ATOM 1393 O SER A 91 5.273 8.313 8.286 1.00 0.00 O ATOM 1394 CB SER A 91 4.259 9.043 5.792 1.00 0.00 C ATOM 1395 OG SER A 91 4.107 9.103 4.384 1.00 0.00 O ATOM 0 H SER A 91 2.565 7.214 7.652 1.00 0.00 H new ATOM 0 HA SER A 91 4.408 6.919 5.508 1.00 0.00 H new ATOM 0 HB2 SER A 91 3.512 9.677 6.269 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.236 9.436 6.072 1.00 0.00 H new ATOM 0 HG SER A 91 4.946 8.836 3.953 1.00 0.00 H new ATOM 1401 N PRO A 92 5.567 6.170 7.665 1.00 0.00 N ATOM 1402 CA PRO A 92 6.454 5.826 8.769 1.00 0.00 C ATOM 1403 C PRO A 92 7.916 6.158 8.476 1.00 0.00 C ATOM 1404 O PRO A 92 8.572 6.851 9.254 1.00 0.00 O ATOM 1405 CB PRO A 92 6.276 4.307 8.919 1.00 0.00 C ATOM 1406 CG PRO A 92 5.503 3.843 7.718 1.00 0.00 C ATOM 1407 CD PRO A 92 5.340 5.021 6.791 1.00 0.00 C ATOM 0 HA PRO A 92 6.208 6.391 9.668 1.00 0.00 H new ATOM 0 HB2 PRO A 92 7.243 3.807 8.973 1.00 0.00 H new ATOM 0 HB3 PRO A 92 5.742 4.069 9.839 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.029 3.031 7.215 1.00 0.00 H new ATOM 0 HG3 PRO A 92 4.529 3.455 8.017 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.058 4.991 5.972 1.00 0.00 H new ATOM 0 HD3 PRO A 92 4.347 5.046 6.343 1.00 0.00 H new ATOM 1415 N ASP A 93 8.421 5.651 7.353 1.00 0.00 N ATOM 1416 CA ASP A 93 9.810 5.881 6.953 1.00 0.00 C ATOM 1417 C ASP A 93 10.216 7.340 7.143 1.00 0.00 C ATOM 1418 O ASP A 93 10.941 7.675 8.082 1.00 0.00 O ATOM 1419 CB ASP A 93 10.011 5.466 5.494 1.00 0.00 C ATOM 1420 CG ASP A 93 10.884 4.233 5.360 1.00 0.00 C ATOM 1421 OD1 ASP A 93 10.343 3.110 5.444 1.00 0.00 O ATOM 1422 OD2 ASP A 93 12.109 4.390 5.173 1.00 0.00 O ATOM 0 H ASP A 93 7.888 5.076 6.701 1.00 0.00 H new ATOM 0 HA ASP A 93 10.447 5.272 7.595 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.041 5.272 5.037 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.464 6.290 4.943 1.00 0.00 H new ATOM 1427 N GLY A 94 9.753 8.205 6.247 1.00 0.00 N ATOM 1428 CA GLY A 94 10.086 9.614 6.336 1.00 0.00 C ATOM 1429 C GLY A 94 8.953 10.442 6.907 1.00 0.00 C ATOM 1430 O GLY A 94 8.261 10.011 7.829 1.00 0.00 O ATOM 0 H GLY A 94 9.153 7.955 5.461 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.971 9.736 6.960 1.00 0.00 H new ATOM 0 HA3 GLY A 94 10.341 9.987 5.344 1.00 0.00 H new ATOM 1434 N GLY A 95 8.762 11.639 6.358 1.00 0.00 N ATOM 1435 CA GLY A 95 7.706 12.511 6.834 1.00 0.00 C ATOM 1436 C GLY A 95 6.952 13.179 5.701 1.00 0.00 C ATOM 1437 O GLY A 95 6.909 14.407 5.614 1.00 0.00 O ATOM 0 H GLY A 95 9.320 12.019 5.593 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.008 11.934 7.441 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.135 13.276 7.482 1.00 0.00 H new ATOM 1441 N TYR A 96 6.349 12.371 4.836 1.00 0.00 N ATOM 1442 CA TYR A 96 5.584 12.897 3.708 1.00 0.00 C ATOM 1443 C TYR A 96 4.090 12.828 4.003 1.00 0.00 C ATOM 1444 O TYR A 96 3.687 12.536 5.128 1.00 0.00 O ATOM 1445 CB TYR A 96 5.908 12.137 2.413 1.00 0.00 C ATOM 1446 CG TYR A 96 6.584 10.800 2.627 1.00 0.00 C ATOM 1447 CD1 TYR A 96 7.896 10.723 3.075 1.00 0.00 C ATOM 1448 CD2 TYR A 96 5.906 9.615 2.375 1.00 0.00 C ATOM 1449 CE1 TYR A 96 8.514 9.502 3.268 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.515 8.390 2.565 1.00 0.00 C ATOM 1451 CZ TYR A 96 7.819 8.338 3.012 1.00 0.00 C ATOM 1452 OH TYR A 96 8.430 7.121 3.206 1.00 0.00 O ATOM 0 H TYR A 96 6.374 11.353 4.892 1.00 0.00 H new ATOM 0 HA TYR A 96 5.868 13.940 3.566 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.984 11.979 1.858 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.551 12.760 1.791 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.443 11.632 3.276 1.00 0.00 H new ATOM 0 HD2 TYR A 96 4.885 9.652 2.024 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.535 9.459 3.617 1.00 0.00 H new ATOM 0 HE2 TYR A 96 5.973 7.478 2.365 1.00 0.00 H new ATOM 0 HH TYR A 96 9.357 7.166 2.891 1.00 0.00 H new ATOM 1462 N ILE A 97 3.267 13.110 2.996 1.00 0.00 N ATOM 1463 CA ILE A 97 1.819 13.086 3.175 1.00 0.00 C ATOM 1464 C ILE A 97 1.080 12.795 1.832 1.00 0.00 C ATOM 1465 O ILE A 97 0.396 13.754 1.470 1.00 0.00 O ATOM 1466 CB ILE A 97 1.321 14.432 3.731 1.00 0.00 C ATOM 1467 CG1 ILE A 97 2.062 15.579 3.047 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.511 14.493 5.238 1.00 0.00 C ATOM 1469 CD1 ILE A 97 1.206 16.799 2.805 1.00 0.00 C ATOM 0 H ILE A 97 3.575 13.356 2.055 1.00 0.00 H new ATOM 0 HA ILE A 97 1.597 12.286 3.881 1.00 0.00 H new ATOM 0 HB ILE A 97 0.255 14.527 3.523 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.918 15.863 3.660 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.455 15.228 2.093 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.153 15.452 5.611 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.948 13.687 5.709 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.569 14.383 5.476 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.802 17.570 2.316 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.364 16.532 2.167 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.834 17.177 3.757 1.00 0.00 H new ATOM 1481 N PRO A 98 0.454 11.585 1.804 1.00 0.00 N ATOM 1482 CA PRO A 98 0.769 10.144 2.105 1.00 0.00 C ATOM 1483 C PRO A 98 1.376 9.467 0.886 1.00 0.00 C ATOM 1484 O PRO A 98 1.178 9.928 -0.243 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.576 9.516 2.429 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.080 10.534 3.308 1.00 0.00 C ATOM 1487 CD PRO A 98 0.073 11.486 3.287 1.00 0.00 C ATOM 0 HA PRO A 98 1.487 10.042 2.919 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.199 9.372 1.547 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.483 8.545 2.915 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.001 10.986 2.939 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.290 10.155 4.308 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.206 12.459 3.692 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.904 11.118 3.888 1.00 0.00 H new ATOM 1495 N ARG A 99 2.129 8.390 1.120 1.00 0.00 N ATOM 1496 CA ARG A 99 2.793 7.658 0.043 1.00 0.00 C ATOM 1497 C ARG A 99 2.345 6.200 0.007 1.00 0.00 C ATOM 1498 O ARG A 99 1.394 5.816 0.689 1.00 0.00 O ATOM 1499 CB ARG A 99 4.305 7.724 0.240 1.00 0.00 C ATOM 1500 CG ARG A 99 4.998 8.758 -0.629 1.00 0.00 C ATOM 1501 CD ARG A 99 4.474 10.162 -0.373 1.00 0.00 C ATOM 1502 NE ARG A 99 4.212 10.882 -1.617 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.838 12.158 -1.672 1.00 0.00 C ATOM 1504 NH1 ARG A 99 3.670 12.856 -0.556 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.630 12.737 -2.846 1.00 0.00 N ATOM 0 H ARG A 99 2.294 8.005 2.050 1.00 0.00 H new ATOM 0 HA ARG A 99 2.520 8.121 -0.905 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.515 7.945 1.287 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.731 6.743 0.029 1.00 0.00 H new ATOM 0 HG2 ARG A 99 6.071 8.731 -0.438 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.855 8.504 -1.679 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.557 10.106 0.214 1.00 0.00 H new ATOM 0 HD3 ARG A 99 5.199 10.717 0.222 1.00 0.00 H new ATOM 0 HE ARG A 99 4.322 10.376 -2.496 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.828 12.415 0.350 1.00 0.00 H new ATOM 0 HH12 ARG A 99 3.383 13.834 -0.604 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.757 12.205 -3.707 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.343 13.715 -2.889 1.00 0.00 H new ATOM 1519 N ILE A 100 3.047 5.385 -0.782 1.00 0.00 N ATOM 1520 CA ILE A 100 2.722 3.967 -0.883 1.00 0.00 C ATOM 1521 C ILE A 100 3.317 3.214 0.298 1.00 0.00 C ATOM 1522 O ILE A 100 4.444 3.483 0.704 1.00 0.00 O ATOM 1523 CB ILE A 100 3.233 3.345 -2.198 1.00 0.00 C ATOM 1524 CG1 ILE A 100 4.735 3.579 -2.358 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.474 3.917 -3.386 1.00 0.00 C ATOM 1526 CD1 ILE A 100 5.446 2.463 -3.093 1.00 0.00 C ATOM 0 H ILE A 100 3.837 5.682 -1.355 1.00 0.00 H new ATOM 0 HA ILE A 100 1.635 3.882 -0.874 1.00 0.00 H new ATOM 0 HB ILE A 100 3.057 2.270 -2.160 1.00 0.00 H new ATOM 0 HG12 ILE A 100 4.894 4.515 -2.894 1.00 0.00 H new ATOM 0 HG13 ILE A 100 5.183 3.697 -1.371 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.847 3.468 -4.306 1.00 0.00 H new ATOM 0 HG22 ILE A 100 1.412 3.697 -3.279 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.619 4.997 -3.425 1.00 0.00 H new ATOM 0 HD11 ILE A 100 6.508 2.696 -3.170 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.318 1.528 -2.547 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.024 2.359 -4.093 1.00 0.00 H new ATOM 1538 N LEU A 101 2.547 2.294 0.867 1.00 0.00 N ATOM 1539 CA LEU A 101 3.004 1.536 2.024 1.00 0.00 C ATOM 1540 C LEU A 101 2.613 0.065 1.931 1.00 0.00 C ATOM 1541 O LEU A 101 1.451 -0.261 1.686 1.00 0.00 O ATOM 1542 CB LEU A 101 2.398 2.142 3.291 1.00 0.00 C ATOM 1543 CG LEU A 101 3.264 3.180 4.000 1.00 0.00 C ATOM 1544 CD1 LEU A 101 3.429 4.423 3.140 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.650 3.534 5.343 1.00 0.00 C ATOM 0 H LEU A 101 1.608 2.056 0.548 1.00 0.00 H new ATOM 0 HA LEU A 101 4.092 1.590 2.054 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.445 2.604 3.032 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.181 1.335 3.991 1.00 0.00 H new ATOM 0 HG LEU A 101 4.254 2.755 4.167 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.050 5.149 3.665 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.905 4.153 2.198 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.450 4.860 2.940 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.273 4.275 5.844 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.651 3.943 5.190 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.584 2.638 5.961 1.00 0.00 H new ATOM 1557 N PHE A 102 3.580 -0.823 2.150 1.00 0.00 N ATOM 1558 CA PHE A 102 3.310 -2.254 2.113 1.00 0.00 C ATOM 1559 C PHE A 102 3.208 -2.803 3.534 1.00 0.00 C ATOM 1560 O PHE A 102 3.883 -2.317 4.453 1.00 0.00 O ATOM 1561 CB PHE A 102 4.404 -2.981 1.337 1.00 0.00 C ATOM 1562 CG PHE A 102 4.586 -2.475 -0.066 1.00 0.00 C ATOM 1563 CD1 PHE A 102 5.075 -1.200 -0.297 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.269 -3.276 -1.150 1.00 0.00 C ATOM 1565 CE1 PHE A 102 5.243 -0.731 -1.587 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.435 -2.813 -2.441 1.00 0.00 C ATOM 1567 CZ PHE A 102 4.923 -1.538 -2.661 1.00 0.00 C ATOM 0 H PHE A 102 4.549 -0.578 2.353 1.00 0.00 H new ATOM 0 HA PHE A 102 2.360 -2.420 1.604 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.347 -2.881 1.875 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.168 -4.044 1.303 1.00 0.00 H new ATOM 0 HD1 PHE A 102 5.328 -0.565 0.539 1.00 0.00 H new ATOM 0 HD2 PHE A 102 3.888 -4.273 -0.985 1.00 0.00 H new ATOM 0 HE1 PHE A 102 5.624 0.266 -1.754 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.184 -3.447 -3.278 1.00 0.00 H new ATOM 0 HZ PHE A 102 5.053 -1.174 -3.670 1.00 0.00 H new ATOM 1577 N LEU A 103 2.348 -3.798 3.732 1.00 0.00 N ATOM 1578 CA LEU A 103 2.175 -4.363 5.065 1.00 0.00 C ATOM 1579 C LEU A 103 1.729 -5.819 5.034 1.00 0.00 C ATOM 1580 O LEU A 103 1.555 -6.410 3.970 1.00 0.00 O ATOM 1581 CB LEU A 103 1.180 -3.523 5.856 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.267 -3.603 5.396 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.150 -2.731 6.265 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.379 -3.193 3.940 1.00 0.00 C ATOM 0 H LEU A 103 1.772 -4.221 3.004 1.00 0.00 H new ATOM 0 HA LEU A 103 3.149 -4.343 5.554 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.226 -3.828 6.901 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.498 -2.481 5.813 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.606 -4.635 5.492 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.182 -2.801 5.921 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.089 -3.068 7.300 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.815 -1.696 6.200 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.420 -3.255 3.624 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.024 -2.169 3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.227 -3.860 3.327 1.00 0.00 H new ATOM 1596 N ASP A 104 1.560 -6.390 6.226 1.00 0.00 N ATOM 1597 CA ASP A 104 1.147 -7.784 6.362 1.00 0.00 C ATOM 1598 C ASP A 104 -0.366 -7.939 6.201 1.00 0.00 C ATOM 1599 O ASP A 104 -1.135 -7.068 6.626 1.00 0.00 O ATOM 1600 CB ASP A 104 1.586 -8.332 7.721 1.00 0.00 C ATOM 1601 CG ASP A 104 2.831 -9.192 7.622 1.00 0.00 C ATOM 1602 OD1 ASP A 104 3.701 -8.881 6.783 1.00 0.00 O ATOM 1603 OD2 ASP A 104 2.935 -10.176 8.385 1.00 0.00 O ATOM 0 H ASP A 104 1.703 -5.906 7.113 1.00 0.00 H new ATOM 0 HA ASP A 104 1.630 -8.354 5.568 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.775 -7.501 8.401 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.775 -8.919 8.152 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.805 -9.062 5.588 1.00 0.00 N ATOM 1609 CA PRO A 105 -2.229 -9.350 5.366 1.00 0.00 C ATOM 1610 C PRO A 105 -3.044 -9.290 6.652 1.00 0.00 C ATOM 1611 O PRO A 105 -3.181 -10.286 7.360 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.231 -10.776 4.803 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.873 -10.962 4.222 1.00 0.00 C ATOM 1614 CD PRO A 105 0.058 -10.141 5.069 1.00 0.00 C ATOM 0 HA PRO A 105 -2.686 -8.616 4.703 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.430 -11.509 5.585 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -3.005 -10.900 4.046 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.585 -12.013 4.233 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.845 -10.635 3.183 1.00 0.00 H new ATOM 0 HD2 PRO A 105 0.491 -10.731 5.876 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.888 -9.744 4.484 1.00 0.00 H new ATOM 1622 N SER A 106 -3.582 -8.109 6.940 1.00 0.00 N ATOM 1623 CA SER A 106 -4.391 -7.884 8.137 1.00 0.00 C ATOM 1624 C SER A 106 -4.500 -6.391 8.422 1.00 0.00 C ATOM 1625 O SER A 106 -5.483 -5.925 8.996 1.00 0.00 O ATOM 1626 CB SER A 106 -3.787 -8.598 9.352 1.00 0.00 C ATOM 1627 OG SER A 106 -4.471 -9.808 9.623 1.00 0.00 O ATOM 0 H SER A 106 -3.471 -7.282 6.353 1.00 0.00 H new ATOM 0 HA SER A 106 -5.385 -8.293 7.954 1.00 0.00 H new ATOM 0 HB2 SER A 106 -2.733 -8.806 9.169 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.837 -7.945 10.223 1.00 0.00 H new ATOM 0 HG SER A 106 -4.279 -10.458 8.915 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.473 -5.650 8.015 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.456 -4.218 8.233 1.00 0.00 C ATOM 1635 C GLY A 107 -2.350 -3.804 9.180 1.00 0.00 C ATOM 1636 O GLY A 107 -2.562 -2.973 10.064 1.00 0.00 O ATOM 0 H GLY A 107 -2.651 -6.019 7.537 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.327 -3.707 7.279 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.417 -3.901 8.637 1.00 0.00 H new ATOM 1640 N LYS A 108 -1.168 -4.392 9.006 1.00 0.00 N ATOM 1641 CA LYS A 108 -0.035 -4.074 9.873 1.00 0.00 C ATOM 1642 C LYS A 108 1.133 -3.459 9.097 1.00 0.00 C ATOM 1643 O LYS A 108 2.143 -4.124 8.859 1.00 0.00 O ATOM 1644 CB LYS A 108 0.432 -5.334 10.606 1.00 0.00 C ATOM 1645 CG LYS A 108 -0.071 -5.424 12.038 1.00 0.00 C ATOM 1646 CD LYS A 108 1.060 -5.249 13.039 1.00 0.00 C ATOM 1647 CE LYS A 108 0.901 -6.184 14.228 1.00 0.00 C ATOM 1648 NZ LYS A 108 1.068 -7.611 13.835 1.00 0.00 N ATOM 0 H LYS A 108 -0.971 -5.083 8.282 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.375 -3.331 10.595 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.094 -6.212 10.055 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.522 -5.360 10.610 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.829 -4.659 12.207 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.552 -6.390 12.196 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.014 -5.441 12.549 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.083 -4.216 13.387 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.636 -5.929 14.992 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.084 -6.042 14.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 1.341 -8.171 14.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.171 -7.973 13.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 1.809 -7.687 13.109 1.00 0.00 H new ATOM 1662 N VAL A 109 1.001 -2.183 8.719 1.00 0.00 N ATOM 1663 CA VAL A 109 2.056 -1.480 7.997 1.00 0.00 C ATOM 1664 C VAL A 109 3.373 -1.563 8.741 1.00 0.00 C ATOM 1665 O VAL A 109 3.430 -1.397 9.960 1.00 0.00 O ATOM 1666 CB VAL A 109 1.678 0.002 7.773 1.00 0.00 C ATOM 1667 CG1 VAL A 109 2.910 0.888 7.751 1.00 0.00 C ATOM 1668 CG2 VAL A 109 0.875 0.164 6.492 1.00 0.00 C ATOM 0 H VAL A 109 0.171 -1.619 8.903 1.00 0.00 H new ATOM 0 HA VAL A 109 2.169 -1.966 7.028 1.00 0.00 H new ATOM 0 HB VAL A 109 1.056 0.318 8.611 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.610 1.924 7.592 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.435 0.804 8.702 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.570 0.573 6.943 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.619 1.214 6.353 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.468 -0.180 5.645 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.039 -0.426 6.558 1.00 0.00 H new ATOM 1678 N HIS A 110 4.433 -1.814 7.992 1.00 0.00 N ATOM 1679 CA HIS A 110 5.757 -1.911 8.574 1.00 0.00 C ATOM 1680 C HIS A 110 6.786 -1.266 7.657 1.00 0.00 C ATOM 1681 O HIS A 110 6.736 -1.440 6.440 1.00 0.00 O ATOM 1682 CB HIS A 110 6.124 -3.374 8.844 1.00 0.00 C ATOM 1683 CG HIS A 110 6.292 -4.204 7.607 1.00 0.00 C ATOM 1684 ND1 HIS A 110 6.974 -5.403 7.596 1.00 0.00 N ATOM 1685 CD2 HIS A 110 5.861 -4.010 6.337 1.00 0.00 C ATOM 1686 CE1 HIS A 110 6.957 -5.908 6.375 1.00 0.00 C ATOM 1687 NE2 HIS A 110 6.287 -5.082 5.594 1.00 0.00 N ATOM 0 H HIS A 110 4.401 -1.954 6.982 1.00 0.00 H new ATOM 0 HA HIS A 110 5.754 -1.378 9.525 1.00 0.00 H new ATOM 0 HB2 HIS A 110 7.051 -3.405 9.417 1.00 0.00 H new ATOM 0 HB3 HIS A 110 5.349 -3.822 9.466 1.00 0.00 H new ATOM 0 HD1 HIS A 110 7.422 -5.833 8.405 1.00 0.00 H new ATOM 0 HD2 HIS A 110 5.289 -3.168 5.977 1.00 0.00 H new ATOM 0 HE1 HIS A 110 7.413 -6.838 6.069 1.00 0.00 H new ATOM 1696 N PRO A 111 7.742 -0.514 8.224 1.00 0.00 N ATOM 1697 CA PRO A 111 8.783 0.142 7.438 1.00 0.00 C ATOM 1698 C PRO A 111 9.774 -0.865 6.868 1.00 0.00 C ATOM 1699 O PRO A 111 10.980 -0.618 6.839 1.00 0.00 O ATOM 1700 CB PRO A 111 9.471 1.060 8.451 1.00 0.00 C ATOM 1701 CG PRO A 111 9.228 0.413 9.770 1.00 0.00 C ATOM 1702 CD PRO A 111 7.884 -0.255 9.668 1.00 0.00 C ATOM 0 HA PRO A 111 8.379 0.674 6.577 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.537 1.150 8.244 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.054 2.067 8.421 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.008 -0.314 9.997 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.236 1.150 10.573 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.848 -1.178 10.247 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.086 0.387 10.042 1.00 0.00 H new ATOM 1710 N GLU A 112 9.256 -2.007 6.419 1.00 0.00 N ATOM 1711 CA GLU A 112 10.097 -3.055 5.856 1.00 0.00 C ATOM 1712 C GLU A 112 9.956 -3.107 4.341 1.00 0.00 C ATOM 1713 O GLU A 112 10.947 -3.051 3.613 1.00 0.00 O ATOM 1714 CB GLU A 112 9.732 -4.411 6.465 1.00 0.00 C ATOM 1715 CG GLU A 112 10.936 -5.203 6.951 1.00 0.00 C ATOM 1716 CD GLU A 112 10.894 -6.654 6.515 1.00 0.00 C ATOM 1717 OE1 GLU A 112 10.332 -7.482 7.263 1.00 0.00 O ATOM 1718 OE2 GLU A 112 11.422 -6.964 5.427 1.00 0.00 O ATOM 0 H GLU A 112 8.260 -2.227 6.435 1.00 0.00 H new ATOM 0 HA GLU A 112 11.135 -2.826 6.097 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.050 -4.253 7.300 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.195 -5.001 5.722 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.847 -4.740 6.573 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.982 -5.156 8.039 1.00 0.00 H new ATOM 1725 N ILE A 113 8.718 -3.212 3.872 1.00 0.00 N ATOM 1726 CA ILE A 113 8.449 -3.270 2.442 1.00 0.00 C ATOM 1727 C ILE A 113 8.059 -1.893 1.905 1.00 0.00 C ATOM 1728 O ILE A 113 6.920 -1.438 2.068 1.00 0.00 O ATOM 1729 CB ILE A 113 7.346 -4.298 2.120 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.737 -5.674 2.662 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.094 -4.371 0.619 1.00 0.00 C ATOM 1732 CD1 ILE A 113 9.051 -6.186 2.113 1.00 0.00 C ATOM 0 H ILE A 113 7.886 -3.259 4.461 1.00 0.00 H new ATOM 0 HA ILE A 113 9.367 -3.590 1.949 1.00 0.00 H new ATOM 0 HB ILE A 113 6.423 -3.977 2.603 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.801 -5.623 3.749 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.949 -6.388 2.422 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.312 -5.103 0.417 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.779 -3.393 0.255 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.011 -4.669 0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.266 -7.166 2.539 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.984 -6.269 1.028 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.850 -5.492 2.375 1.00 0.00 H new ATOM 1744 N ILE A 114 9.026 -1.240 1.266 1.00 0.00 N ATOM 1745 CA ILE A 114 8.825 0.086 0.696 1.00 0.00 C ATOM 1746 C ILE A 114 8.983 0.056 -0.821 1.00 0.00 C ATOM 1747 O ILE A 114 9.213 -0.999 -1.410 1.00 0.00 O ATOM 1748 CB ILE A 114 9.823 1.104 1.279 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.265 0.642 1.030 1.00 0.00 C ATOM 1750 CG2 ILE A 114 9.564 1.313 2.767 1.00 0.00 C ATOM 1751 CD1 ILE A 114 11.776 -0.370 2.036 1.00 0.00 C ATOM 0 H ILE A 114 9.965 -1.614 1.130 1.00 0.00 H new ATOM 0 HA ILE A 114 7.811 0.392 0.952 1.00 0.00 H new ATOM 0 HB ILE A 114 9.682 2.060 0.775 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.329 0.209 0.032 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.921 1.513 1.042 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.278 2.035 3.163 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.551 1.688 2.911 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.678 0.365 3.293 1.00 0.00 H new ATOM 0 HD11 ILE A 114 12.802 -0.644 1.788 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.748 0.064 3.035 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.147 -1.259 2.009 1.00 0.00 H new ATOM 1763 N ASN A 115 8.862 1.223 -1.444 1.00 0.00 N ATOM 1764 CA ASN A 115 8.997 1.335 -2.892 1.00 0.00 C ATOM 1765 C ASN A 115 10.353 0.810 -3.353 1.00 0.00 C ATOM 1766 O ASN A 115 10.472 0.232 -4.434 1.00 0.00 O ATOM 1767 CB ASN A 115 8.825 2.792 -3.321 1.00 0.00 C ATOM 1768 CG ASN A 115 8.997 2.986 -4.814 1.00 0.00 C ATOM 1769 OD1 ASN A 115 8.691 2.095 -5.608 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.491 4.155 -5.206 1.00 0.00 N ATOM 0 H ASN A 115 8.671 2.105 -0.969 1.00 0.00 H new ATOM 0 HA ASN A 115 8.219 0.730 -3.358 1.00 0.00 H new ATOM 0 HB2 ASN A 115 7.835 3.139 -3.025 1.00 0.00 H new ATOM 0 HB3 ASN A 115 9.551 3.410 -2.792 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.630 4.343 -6.199 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.731 4.865 -4.514 1.00 0.00 H new ATOM 1777 N GLU A 116 11.374 1.013 -2.525 1.00 0.00 N ATOM 1778 CA GLU A 116 12.728 0.561 -2.841 1.00 0.00 C ATOM 1779 C GLU A 116 13.344 1.400 -3.958 1.00 0.00 C ATOM 1780 O GLU A 116 14.351 2.079 -3.754 1.00 0.00 O ATOM 1781 CB GLU A 116 12.717 -0.919 -3.240 1.00 0.00 C ATOM 1782 CG GLU A 116 13.603 -1.790 -2.363 1.00 0.00 C ATOM 1783 CD GLU A 116 15.052 -1.344 -2.373 1.00 0.00 C ATOM 1784 OE1 GLU A 116 15.361 -0.315 -1.736 1.00 0.00 O ATOM 1785 OE2 GLU A 116 15.877 -2.024 -3.018 1.00 0.00 O ATOM 0 H GLU A 116 11.290 1.489 -1.627 1.00 0.00 H new ATOM 0 HA GLU A 116 13.339 0.684 -1.947 1.00 0.00 H new ATOM 0 HB2 GLU A 116 11.694 -1.292 -3.193 1.00 0.00 H new ATOM 0 HB3 GLU A 116 13.043 -1.010 -4.276 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.228 -1.770 -1.340 1.00 0.00 H new ATOM 0 HG3 GLU A 116 13.542 -2.823 -2.704 1.00 0.00 H new ATOM 1792 N ASN A 117 12.735 1.348 -5.139 1.00 0.00 N ATOM 1793 CA ASN A 117 13.224 2.099 -6.292 1.00 0.00 C ATOM 1794 C ASN A 117 13.444 3.571 -5.951 1.00 0.00 C ATOM 1795 O ASN A 117 14.255 4.249 -6.582 1.00 0.00 O ATOM 1796 CB ASN A 117 12.238 1.980 -7.457 1.00 0.00 C ATOM 1797 CG ASN A 117 12.889 2.264 -8.795 1.00 0.00 C ATOM 1798 OD1 ASN A 117 13.471 1.375 -9.417 1.00 0.00 O ATOM 1799 ND2 ASN A 117 12.794 3.509 -9.248 1.00 0.00 N ATOM 0 H ASN A 117 11.900 0.792 -5.323 1.00 0.00 H new ATOM 0 HA ASN A 117 14.184 1.671 -6.582 1.00 0.00 H new ATOM 0 HB2 ASN A 117 11.813 0.976 -7.469 1.00 0.00 H new ATOM 0 HB3 ASN A 117 11.412 2.674 -7.303 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.213 3.759 -10.144 1.00 0.00 H new ATOM 0 HD22 ASN A 117 12.302 4.215 -8.700 1.00 0.00 H new ATOM 1806 N GLY A 118 12.718 4.063 -4.953 1.00 0.00 N ATOM 1807 CA GLY A 118 12.849 5.452 -4.555 1.00 0.00 C ATOM 1808 C GLY A 118 14.269 5.815 -4.164 1.00 0.00 C ATOM 1809 O GLY A 118 15.196 5.025 -4.346 1.00 0.00 O ATOM 0 H GLY A 118 12.041 3.524 -4.413 1.00 0.00 H new ATOM 0 HA2 GLY A 118 12.527 6.093 -5.375 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.183 5.650 -3.715 1.00 0.00 H new ATOM 1813 N ASN A 119 14.436 7.017 -3.626 1.00 0.00 N ATOM 1814 CA ASN A 119 15.746 7.499 -3.202 1.00 0.00 C ATOM 1815 C ASN A 119 16.040 7.069 -1.767 1.00 0.00 C ATOM 1816 O ASN A 119 15.128 6.698 -1.030 1.00 0.00 O ATOM 1817 CB ASN A 119 15.803 9.025 -3.315 1.00 0.00 C ATOM 1818 CG ASN A 119 14.796 9.709 -2.408 1.00 0.00 C ATOM 1819 OD1 ASN A 119 13.660 9.967 -2.806 1.00 0.00 O ATOM 1820 ND2 ASN A 119 15.210 10.003 -1.181 1.00 0.00 N ATOM 0 H ASN A 119 13.676 7.680 -3.472 1.00 0.00 H new ATOM 0 HA ASN A 119 16.503 7.063 -3.854 1.00 0.00 H new ATOM 0 HB2 ASN A 119 16.807 9.368 -3.064 1.00 0.00 H new ATOM 0 HB3 ASN A 119 15.615 9.318 -4.348 1.00 0.00 H new ATOM 0 HD21 ASN A 119 14.577 10.461 -0.525 1.00 0.00 H new ATOM 0 HD22 ASN A 119 16.161 9.770 -0.894 1.00 0.00 H new ATOM 1827 N PRO A 120 17.319 7.106 -1.347 1.00 0.00 N ATOM 1828 CA PRO A 120 17.714 6.715 0.009 1.00 0.00 C ATOM 1829 C PRO A 120 17.374 7.781 1.050 1.00 0.00 C ATOM 1830 O PRO A 120 18.243 8.243 1.789 1.00 0.00 O ATOM 1831 CB PRO A 120 19.227 6.541 -0.107 1.00 0.00 C ATOM 1832 CG PRO A 120 19.630 7.481 -1.188 1.00 0.00 C ATOM 1833 CD PRO A 120 18.479 7.528 -2.159 1.00 0.00 C ATOM 0 HA PRO A 120 17.190 5.821 0.346 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.727 6.779 0.832 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.490 5.513 -0.357 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.838 8.472 -0.784 1.00 0.00 H new ATOM 0 HG3 PRO A 120 20.540 7.140 -1.681 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.340 8.529 -2.567 1.00 0.00 H new ATOM 0 HD3 PRO A 120 18.641 6.859 -3.004 1.00 0.00 H new ATOM 1841 N SER A 121 16.102 8.165 1.098 1.00 0.00 N ATOM 1842 CA SER A 121 15.629 9.173 2.038 1.00 0.00 C ATOM 1843 C SER A 121 14.164 9.473 1.769 1.00 0.00 C ATOM 1844 O SER A 121 13.734 10.628 1.799 1.00 0.00 O ATOM 1845 CB SER A 121 16.455 10.455 1.917 1.00 0.00 C ATOM 1846 OG SER A 121 17.550 10.444 2.818 1.00 0.00 O ATOM 0 H SER A 121 15.375 7.788 0.490 1.00 0.00 H new ATOM 0 HA SER A 121 15.741 8.787 3.051 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.821 10.560 0.896 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.822 11.319 2.119 1.00 0.00 H new ATOM 0 HG SER A 121 18.236 9.825 2.491 1.00 0.00 H new ATOM 1852 N TYR A 122 13.403 8.423 1.486 1.00 0.00 N ATOM 1853 CA TYR A 122 11.988 8.565 1.187 1.00 0.00 C ATOM 1854 C TYR A 122 11.323 7.196 1.058 1.00 0.00 C ATOM 1855 O TYR A 122 10.212 6.985 1.542 1.00 0.00 O ATOM 1856 CB TYR A 122 11.824 9.361 -0.104 1.00 0.00 C ATOM 1857 CG TYR A 122 11.176 10.713 0.093 1.00 0.00 C ATOM 1858 CD1 TYR A 122 9.844 10.821 0.469 1.00 0.00 C ATOM 1859 CD2 TYR A 122 11.901 11.882 -0.100 1.00 0.00 C ATOM 1860 CE1 TYR A 122 9.253 12.057 0.649 1.00 0.00 C ATOM 1861 CE2 TYR A 122 11.317 13.122 0.079 1.00 0.00 C ATOM 1862 CZ TYR A 122 9.993 13.204 0.452 1.00 0.00 C ATOM 1863 OH TYR A 122 9.408 14.436 0.631 1.00 0.00 O ATOM 0 H TYR A 122 13.745 7.463 1.458 1.00 0.00 H new ATOM 0 HA TYR A 122 11.502 9.098 2.005 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.804 9.501 -0.561 1.00 0.00 H new ATOM 0 HB3 TYR A 122 11.225 8.780 -0.805 1.00 0.00 H new ATOM 0 HD1 TYR A 122 9.261 9.925 0.623 1.00 0.00 H new ATOM 0 HD2 TYR A 122 12.938 11.821 -0.395 1.00 0.00 H new ATOM 0 HE1 TYR A 122 8.216 12.125 0.943 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.895 14.022 -0.073 1.00 0.00 H new ATOM 0 HH TYR A 122 10.067 15.140 0.453 1.00 0.00 H new ATOM 1873 N LYS A 123 12.019 6.270 0.410 1.00 0.00 N ATOM 1874 CA LYS A 123 11.514 4.910 0.224 1.00 0.00 C ATOM 1875 C LYS A 123 10.092 4.899 -0.346 1.00 0.00 C ATOM 1876 O LYS A 123 9.907 4.901 -1.561 1.00 0.00 O ATOM 1877 CB LYS A 123 11.565 4.152 1.555 1.00 0.00 C ATOM 1878 CG LYS A 123 12.977 3.849 2.034 1.00 0.00 C ATOM 1879 CD LYS A 123 13.787 3.117 0.973 1.00 0.00 C ATOM 1880 CE LYS A 123 14.882 4.001 0.399 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.859 3.222 -0.410 1.00 0.00 N ATOM 0 H LYS A 123 12.939 6.435 0.002 1.00 0.00 H new ATOM 0 HA LYS A 123 12.155 4.411 -0.503 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.051 4.738 2.317 1.00 0.00 H new ATOM 0 HB3 LYS A 123 11.018 3.215 1.450 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.479 4.780 2.297 1.00 0.00 H new ATOM 0 HG3 LYS A 123 12.932 3.244 2.939 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.231 2.221 1.407 1.00 0.00 H new ATOM 0 HD3 LYS A 123 13.126 2.789 0.171 1.00 0.00 H new ATOM 0 HE2 LYS A 123 14.434 4.777 -0.222 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.404 4.505 1.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.589 3.862 -0.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.306 2.498 0.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.365 2.761 -1.201 1.00 0.00 H new ATOM 1895 N TYR A 124 9.095 4.872 0.535 1.00 0.00 N ATOM 1896 CA TYR A 124 7.686 4.835 0.135 1.00 0.00 C ATOM 1897 C TYR A 124 7.356 5.805 -1.003 1.00 0.00 C ATOM 1898 O TYR A 124 6.340 5.640 -1.683 1.00 0.00 O ATOM 1899 CB TYR A 124 6.798 5.114 1.346 1.00 0.00 C ATOM 1900 CG TYR A 124 6.805 3.986 2.355 1.00 0.00 C ATOM 1901 CD1 TYR A 124 6.596 2.673 1.954 1.00 0.00 C ATOM 1902 CD2 TYR A 124 7.019 4.231 3.705 1.00 0.00 C ATOM 1903 CE1 TYR A 124 6.596 1.639 2.867 1.00 0.00 C ATOM 1904 CE2 TYR A 124 7.024 3.200 4.626 1.00 0.00 C ATOM 1905 CZ TYR A 124 6.811 1.906 4.200 1.00 0.00 C ATOM 1906 OH TYR A 124 6.811 0.877 5.113 1.00 0.00 O ATOM 0 H TYR A 124 9.238 4.875 1.545 1.00 0.00 H new ATOM 0 HA TYR A 124 7.490 3.834 -0.249 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.132 6.031 1.832 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.776 5.286 1.009 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.431 2.458 0.909 1.00 0.00 H new ATOM 0 HD2 TYR A 124 7.184 5.244 4.041 1.00 0.00 H new ATOM 0 HE1 TYR A 124 6.428 0.624 2.537 1.00 0.00 H new ATOM 0 HE2 TYR A 124 7.194 3.407 5.672 1.00 0.00 H new ATOM 0 HH TYR A 124 6.829 0.019 4.639 1.00 0.00 H new ATOM 1916 N PHE A 125 8.205 6.806 -1.223 1.00 0.00 N ATOM 1917 CA PHE A 125 7.974 7.763 -2.300 1.00 0.00 C ATOM 1918 C PHE A 125 8.270 7.110 -3.649 1.00 0.00 C ATOM 1919 O PHE A 125 9.354 6.565 -3.858 1.00 0.00 O ATOM 1920 CB PHE A 125 8.851 9.001 -2.116 1.00 0.00 C ATOM 1921 CG PHE A 125 8.720 10.004 -3.229 1.00 0.00 C ATOM 1922 CD1 PHE A 125 7.733 10.976 -3.192 1.00 0.00 C ATOM 1923 CD2 PHE A 125 9.585 9.973 -4.310 1.00 0.00 C ATOM 1924 CE1 PHE A 125 7.612 11.898 -4.215 1.00 0.00 C ATOM 1925 CE2 PHE A 125 9.468 10.891 -5.336 1.00 0.00 C ATOM 1926 CZ PHE A 125 8.481 11.856 -5.288 1.00 0.00 C ATOM 0 H PHE A 125 9.050 6.974 -0.676 1.00 0.00 H new ATOM 0 HA PHE A 125 6.929 8.071 -2.272 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.592 9.482 -1.173 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.893 8.690 -2.040 1.00 0.00 H new ATOM 0 HD1 PHE A 125 7.051 11.014 -2.355 1.00 0.00 H new ATOM 0 HD2 PHE A 125 10.360 9.222 -4.352 1.00 0.00 H new ATOM 0 HE1 PHE A 125 6.839 12.651 -4.175 1.00 0.00 H new ATOM 0 HE2 PHE A 125 10.148 10.854 -6.175 1.00 0.00 H new ATOM 0 HZ PHE A 125 8.389 12.576 -6.088 1.00 0.00 H new ATOM 1936 N TYR A 126 7.302 7.159 -4.560 1.00 0.00 N ATOM 1937 CA TYR A 126 7.470 6.560 -5.880 1.00 0.00 C ATOM 1938 C TYR A 126 7.293 7.594 -6.987 1.00 0.00 C ATOM 1939 O TYR A 126 6.928 8.741 -6.727 1.00 0.00 O ATOM 1940 CB TYR A 126 6.477 5.412 -6.072 1.00 0.00 C ATOM 1941 CG TYR A 126 5.035 5.862 -6.144 1.00 0.00 C ATOM 1942 CD1 TYR A 126 4.392 6.376 -5.025 1.00 0.00 C ATOM 1943 CD2 TYR A 126 4.318 5.772 -7.331 1.00 0.00 C ATOM 1944 CE1 TYR A 126 3.074 6.788 -5.086 1.00 0.00 C ATOM 1945 CE2 TYR A 126 3.000 6.182 -7.400 1.00 0.00 C ATOM 1946 CZ TYR A 126 2.383 6.689 -6.275 1.00 0.00 C ATOM 1947 OH TYR A 126 1.071 7.100 -6.341 1.00 0.00 O ATOM 0 H TYR A 126 6.397 7.605 -4.409 1.00 0.00 H new ATOM 0 HA TYR A 126 8.486 6.170 -5.941 1.00 0.00 H new ATOM 0 HB2 TYR A 126 6.727 4.876 -6.987 1.00 0.00 H new ATOM 0 HB3 TYR A 126 6.588 4.706 -5.249 1.00 0.00 H new ATOM 0 HD1 TYR A 126 4.931 6.455 -4.092 1.00 0.00 H new ATOM 0 HD2 TYR A 126 4.798 5.375 -8.213 1.00 0.00 H new ATOM 0 HE1 TYR A 126 2.588 7.185 -4.207 1.00 0.00 H new ATOM 0 HE2 TYR A 126 2.456 6.106 -8.330 1.00 0.00 H new ATOM 0 HH TYR A 126 0.715 7.204 -5.434 1.00 0.00 H new ATOM 1957 N VAL A 127 7.556 7.174 -8.222 1.00 0.00 N ATOM 1958 CA VAL A 127 7.431 8.048 -9.379 1.00 0.00 C ATOM 1959 C VAL A 127 7.433 7.243 -10.675 1.00 0.00 C ATOM 1960 O VAL A 127 8.493 6.874 -11.180 1.00 0.00 O ATOM 1961 CB VAL A 127 8.572 9.082 -9.437 1.00 0.00 C ATOM 1962 CG1 VAL A 127 8.305 10.230 -8.478 1.00 0.00 C ATOM 1963 CG2 VAL A 127 9.910 8.424 -9.132 1.00 0.00 C ATOM 0 H VAL A 127 7.859 6.226 -8.445 1.00 0.00 H new ATOM 0 HA VAL A 127 6.481 8.573 -9.273 1.00 0.00 H new ATOM 0 HB VAL A 127 8.615 9.487 -10.448 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.122 10.949 -8.534 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.371 10.721 -8.750 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.230 9.845 -7.461 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.702 9.171 -9.178 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.881 7.987 -8.134 1.00 0.00 H new ATOM 0 HG23 VAL A 127 10.106 7.642 -9.865 1.00 0.00 H new ATOM 1973 N SER A 128 6.232 6.983 -11.202 1.00 0.00 N ATOM 1974 CA SER A 128 6.046 6.228 -12.451 1.00 0.00 C ATOM 1975 C SER A 128 5.665 4.774 -12.182 1.00 0.00 C ATOM 1976 O SER A 128 6.218 4.127 -11.292 1.00 0.00 O ATOM 1977 CB SER A 128 7.292 6.286 -13.345 1.00 0.00 C ATOM 1978 OG SER A 128 8.213 5.261 -13.005 1.00 0.00 O ATOM 0 H SER A 128 5.358 7.290 -10.775 1.00 0.00 H new ATOM 0 HA SER A 128 5.223 6.708 -12.980 1.00 0.00 H new ATOM 0 HB2 SER A 128 6.999 6.184 -14.390 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.772 7.259 -13.242 1.00 0.00 H new ATOM 0 HG SER A 128 8.803 5.576 -12.288 1.00 0.00 H new ATOM 1984 N ALA A 129 4.714 4.270 -12.967 1.00 0.00 N ATOM 1985 CA ALA A 129 4.243 2.893 -12.838 1.00 0.00 C ATOM 1986 C ALA A 129 5.345 1.887 -13.167 1.00 0.00 C ATOM 1987 O ALA A 129 5.227 0.701 -12.862 1.00 0.00 O ATOM 1988 CB ALA A 129 3.041 2.666 -13.743 1.00 0.00 C ATOM 0 H ALA A 129 4.251 4.801 -13.705 1.00 0.00 H new ATOM 0 HA ALA A 129 3.950 2.737 -11.800 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.697 1.637 -13.640 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.238 3.347 -13.460 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.325 2.851 -14.779 1.00 0.00 H new ATOM 1994 N GLU A 130 6.415 2.360 -13.796 1.00 0.00 N ATOM 1995 CA GLU A 130 7.525 1.490 -14.161 1.00 0.00 C ATOM 1996 C GLU A 130 8.206 0.923 -12.918 1.00 0.00 C ATOM 1997 O GLU A 130 8.323 -0.293 -12.753 1.00 0.00 O ATOM 1998 CB GLU A 130 8.539 2.255 -15.015 1.00 0.00 C ATOM 1999 CG GLU A 130 8.526 1.849 -16.480 1.00 0.00 C ATOM 2000 CD GLU A 130 9.916 1.800 -17.083 1.00 0.00 C ATOM 2001 OE1 GLU A 130 10.618 0.786 -16.877 1.00 0.00 O ATOM 2002 OE2 GLU A 130 10.304 2.773 -17.763 1.00 0.00 O ATOM 0 H GLU A 130 6.537 3.337 -14.063 1.00 0.00 H new ATOM 0 HA GLU A 130 7.128 0.658 -14.742 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.333 3.323 -14.940 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.538 2.094 -14.610 1.00 0.00 H new ATOM 0 HG2 GLU A 130 8.057 0.870 -16.578 1.00 0.00 H new ATOM 0 HG3 GLU A 130 7.914 2.554 -17.043 1.00 0.00 H new ATOM 2009 N GLN A 131 8.662 1.800 -12.039 1.00 0.00 N ATOM 2010 CA GLN A 131 9.330 1.344 -10.835 1.00 0.00 C ATOM 2011 C GLN A 131 8.358 0.656 -9.884 1.00 0.00 C ATOM 2012 O GLN A 131 8.708 -0.328 -9.235 1.00 0.00 O ATOM 2013 CB GLN A 131 10.019 2.484 -10.109 1.00 0.00 C ATOM 2014 CG GLN A 131 9.164 3.729 -9.961 1.00 0.00 C ATOM 2015 CD GLN A 131 9.306 4.366 -8.596 1.00 0.00 C ATOM 2016 OE1 GLN A 131 8.637 3.971 -7.641 1.00 0.00 O ATOM 2017 NE2 GLN A 131 10.180 5.361 -8.494 1.00 0.00 N ATOM 0 H GLN A 131 8.584 2.813 -12.134 1.00 0.00 H new ATOM 0 HA GLN A 131 10.084 0.625 -11.154 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.319 2.142 -9.118 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.931 2.744 -10.646 1.00 0.00 H new ATOM 0 HG2 GLN A 131 9.444 4.452 -10.727 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.119 3.471 -10.132 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.714 5.657 -9.311 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.317 5.829 -7.598 1.00 0.00 H new ATOM 2026 N VAL A 132 7.137 1.174 -9.792 1.00 0.00 N ATOM 2027 CA VAL A 132 6.145 0.588 -8.905 1.00 0.00 C ATOM 2028 C VAL A 132 5.945 -0.889 -9.225 1.00 0.00 C ATOM 2029 O VAL A 132 5.578 -1.674 -8.352 1.00 0.00 O ATOM 2030 CB VAL A 132 4.788 1.333 -8.964 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.993 2.836 -9.089 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.913 0.809 -10.094 1.00 0.00 C ATOM 0 H VAL A 132 6.816 1.989 -10.315 1.00 0.00 H new ATOM 0 HA VAL A 132 6.529 0.689 -7.890 1.00 0.00 H new ATOM 0 HB VAL A 132 4.268 1.139 -8.026 1.00 0.00 H new ATOM 0 HG11 VAL A 132 4.024 3.333 -9.128 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.553 3.200 -8.227 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.549 3.053 -10.001 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.969 1.354 -10.106 1.00 0.00 H new ATOM 0 HG22 VAL A 132 4.425 0.949 -11.046 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.717 -0.252 -9.940 1.00 0.00 H new ATOM 2042 N VAL A 133 6.203 -1.266 -10.478 1.00 0.00 N ATOM 2043 CA VAL A 133 6.059 -2.656 -10.882 1.00 0.00 C ATOM 2044 C VAL A 133 7.258 -3.479 -10.429 1.00 0.00 C ATOM 2045 O VAL A 133 7.110 -4.650 -10.086 1.00 0.00 O ATOM 2046 CB VAL A 133 5.866 -2.821 -12.406 1.00 0.00 C ATOM 2047 CG1 VAL A 133 7.167 -2.586 -13.158 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.317 -4.204 -12.716 1.00 0.00 C ATOM 0 H VAL A 133 6.508 -0.634 -11.218 1.00 0.00 H new ATOM 0 HA VAL A 133 5.156 -3.022 -10.394 1.00 0.00 H new ATOM 0 HB VAL A 133 5.149 -2.070 -12.739 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.997 -2.710 -14.227 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.523 -1.575 -12.962 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.915 -3.305 -12.824 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.185 -4.310 -13.793 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.016 -4.961 -12.360 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.356 -4.334 -12.218 1.00 0.00 H new ATOM 2058 N GLN A 134 8.448 -2.869 -10.407 1.00 0.00 N ATOM 2059 CA GLN A 134 9.629 -3.605 -9.958 1.00 0.00 C ATOM 2060 C GLN A 134 9.593 -3.732 -8.447 1.00 0.00 C ATOM 2061 O GLN A 134 10.041 -4.729 -7.883 1.00 0.00 O ATOM 2062 CB GLN A 134 10.936 -2.951 -10.418 1.00 0.00 C ATOM 2063 CG GLN A 134 10.892 -1.441 -10.450 1.00 0.00 C ATOM 2064 CD GLN A 134 12.201 -0.828 -10.910 1.00 0.00 C ATOM 2065 OE1 GLN A 134 13.227 -0.958 -10.242 1.00 0.00 O ATOM 2066 NE2 GLN A 134 12.170 -0.156 -12.054 1.00 0.00 N ATOM 0 H GLN A 134 8.615 -1.902 -10.685 1.00 0.00 H new ATOM 0 HA GLN A 134 9.604 -4.595 -10.413 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.741 -3.266 -9.754 1.00 0.00 H new ATOM 0 HB3 GLN A 134 11.182 -3.318 -11.414 1.00 0.00 H new ATOM 0 HG2 GLN A 134 10.091 -1.119 -11.115 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.650 -1.067 -9.455 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.296 -0.074 -12.574 1.00 0.00 H new ATOM 0 HE22 GLN A 134 13.020 0.279 -12.413 1.00 0.00 H new ATOM 2075 N GLY A 135 9.011 -2.729 -7.800 1.00 0.00 N ATOM 2076 CA GLY A 135 8.875 -2.759 -6.362 1.00 0.00 C ATOM 2077 C GLY A 135 7.760 -3.696 -5.951 1.00 0.00 C ATOM 2078 O GLY A 135 7.763 -4.237 -4.844 1.00 0.00 O ATOM 0 H GLY A 135 8.631 -1.896 -8.249 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.813 -3.081 -5.909 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.669 -1.755 -5.990 1.00 0.00 H new ATOM 2082 N MET A 136 6.807 -3.907 -6.863 1.00 0.00 N ATOM 2083 CA MET A 136 5.689 -4.802 -6.606 1.00 0.00 C ATOM 2084 C MET A 136 6.124 -6.242 -6.828 1.00 0.00 C ATOM 2085 O MET A 136 5.860 -7.118 -6.006 1.00 0.00 O ATOM 2086 CB MET A 136 4.507 -4.460 -7.518 1.00 0.00 C ATOM 2087 CG MET A 136 3.318 -3.868 -6.775 1.00 0.00 C ATOM 2088 SD MET A 136 2.788 -2.284 -7.455 1.00 0.00 S ATOM 2089 CE MET A 136 1.330 -1.963 -6.464 1.00 0.00 C ATOM 0 H MET A 136 6.792 -3.468 -7.784 1.00 0.00 H new ATOM 0 HA MET A 136 5.370 -4.680 -5.571 1.00 0.00 H new ATOM 0 HB2 MET A 136 4.838 -3.753 -8.279 1.00 0.00 H new ATOM 0 HB3 MET A 136 4.187 -5.363 -8.039 1.00 0.00 H new ATOM 0 HG2 MET A 136 2.486 -4.571 -6.812 1.00 0.00 H new ATOM 0 HG3 MET A 136 3.579 -3.738 -5.725 1.00 0.00 H new ATOM 0 HE1 MET A 136 0.742 -1.171 -6.928 1.00 0.00 H new ATOM 0 HE2 MET A 136 0.729 -2.870 -6.397 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.631 -1.652 -5.464 1.00 0.00 H new ATOM 2099 N LYS A 137 6.810 -6.471 -7.942 1.00 0.00 N ATOM 2100 CA LYS A 137 7.306 -7.796 -8.276 1.00 0.00 C ATOM 2101 C LYS A 137 8.402 -8.224 -7.299 1.00 0.00 C ATOM 2102 O LYS A 137 8.757 -9.400 -7.226 1.00 0.00 O ATOM 2103 CB LYS A 137 7.812 -7.828 -9.723 1.00 0.00 C ATOM 2104 CG LYS A 137 9.104 -7.067 -9.959 1.00 0.00 C ATOM 2105 CD LYS A 137 9.215 -6.591 -11.404 1.00 0.00 C ATOM 2106 CE LYS A 137 8.874 -7.690 -12.400 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.869 -8.798 -12.372 1.00 0.00 N ATOM 0 H LYS A 137 7.035 -5.752 -8.630 1.00 0.00 H new ATOM 0 HA LYS A 137 6.485 -8.507 -8.188 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.958 -8.867 -10.020 1.00 0.00 H new ATOM 0 HB3 LYS A 137 7.040 -7.417 -10.373 1.00 0.00 H new ATOM 0 HG2 LYS A 137 9.151 -6.210 -9.288 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.953 -7.706 -9.719 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.547 -5.744 -11.558 1.00 0.00 H new ATOM 0 HD3 LYS A 137 10.228 -6.236 -11.591 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.884 -8.087 -12.177 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.830 -7.268 -13.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.599 -9.525 -13.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.810 -8.425 -12.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.894 -9.219 -11.421 1.00 0.00 H new ATOM 2121 N GLU A 138 8.921 -7.260 -6.534 1.00 0.00 N ATOM 2122 CA GLU A 138 9.957 -7.536 -5.545 1.00 0.00 C ATOM 2123 C GLU A 138 9.335 -8.193 -4.327 1.00 0.00 C ATOM 2124 O GLU A 138 9.602 -9.357 -4.027 1.00 0.00 O ATOM 2125 CB GLU A 138 10.669 -6.245 -5.136 1.00 0.00 C ATOM 2126 CG GLU A 138 12.139 -6.439 -4.805 1.00 0.00 C ATOM 2127 CD GLU A 138 12.714 -5.283 -4.010 1.00 0.00 C ATOM 2128 OE1 GLU A 138 12.436 -5.204 -2.793 1.00 0.00 O ATOM 2129 OE2 GLU A 138 13.440 -4.458 -4.601 1.00 0.00 O ATOM 0 H GLU A 138 8.638 -6.281 -6.583 1.00 0.00 H new ATOM 0 HA GLU A 138 10.692 -8.210 -5.985 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.580 -5.519 -5.944 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.163 -5.820 -4.269 1.00 0.00 H new ATOM 0 HG2 GLU A 138 12.261 -7.362 -4.238 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.704 -6.556 -5.730 1.00 0.00 H new ATOM 2136 N ALA A 139 8.482 -7.443 -3.642 1.00 0.00 N ATOM 2137 CA ALA A 139 7.788 -7.958 -2.470 1.00 0.00 C ATOM 2138 C ALA A 139 6.941 -9.166 -2.855 1.00 0.00 C ATOM 2139 O ALA A 139 6.582 -9.985 -2.011 1.00 0.00 O ATOM 2140 CB ALA A 139 6.919 -6.871 -1.847 1.00 0.00 C ATOM 0 H ALA A 139 8.254 -6.477 -3.878 1.00 0.00 H new ATOM 0 HA ALA A 139 8.526 -8.270 -1.732 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.407 -7.272 -0.972 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.546 -6.031 -1.548 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.182 -6.532 -2.575 1.00 0.00 H new ATOM 2146 N GLN A 140 6.628 -9.263 -4.144 1.00 0.00 N ATOM 2147 CA GLN A 140 5.830 -10.361 -4.664 1.00 0.00 C ATOM 2148 C GLN A 140 6.584 -11.687 -4.584 1.00 0.00 C ATOM 2149 O GLN A 140 5.995 -12.755 -4.742 1.00 0.00 O ATOM 2150 CB GLN A 140 5.434 -10.078 -6.112 1.00 0.00 C ATOM 2151 CG GLN A 140 4.116 -9.334 -6.248 1.00 0.00 C ATOM 2152 CD GLN A 140 3.791 -8.983 -7.685 1.00 0.00 C ATOM 2153 OE1 GLN A 140 3.993 -9.788 -8.594 1.00 0.00 O ATOM 2154 NE2 GLN A 140 3.287 -7.773 -7.900 1.00 0.00 N ATOM 0 H GLN A 140 6.919 -8.587 -4.850 1.00 0.00 H new ATOM 0 HA GLN A 140 4.934 -10.444 -4.049 1.00 0.00 H new ATOM 0 HB2 GLN A 140 6.222 -9.494 -6.588 1.00 0.00 H new ATOM 0 HB3 GLN A 140 5.366 -11.022 -6.652 1.00 0.00 H new ATOM 0 HG2 GLN A 140 3.313 -9.946 -5.837 1.00 0.00 H new ATOM 0 HG3 GLN A 140 4.156 -8.420 -5.655 1.00 0.00 H new ATOM 0 HE21 GLN A 140 3.136 -7.137 -7.117 1.00 0.00 H new ATOM 0 HE22 GLN A 140 3.051 -7.480 -8.848 1.00 0.00 H new ATOM 2163 N GLU A 141 7.892 -11.613 -4.363 1.00 0.00 N ATOM 2164 CA GLU A 141 8.722 -12.809 -4.287 1.00 0.00 C ATOM 2165 C GLU A 141 9.028 -13.200 -2.841 1.00 0.00 C ATOM 2166 O GLU A 141 9.445 -14.329 -2.575 1.00 0.00 O ATOM 2167 CB GLU A 141 10.027 -12.583 -5.059 1.00 0.00 C ATOM 2168 CG GLU A 141 11.158 -13.507 -4.636 1.00 0.00 C ATOM 2169 CD GLU A 141 12.316 -13.502 -5.614 1.00 0.00 C ATOM 2170 OE1 GLU A 141 13.117 -12.545 -5.580 1.00 0.00 O ATOM 2171 OE2 GLU A 141 12.421 -14.456 -6.415 1.00 0.00 O ATOM 0 H GLU A 141 8.400 -10.738 -4.233 1.00 0.00 H new ATOM 0 HA GLU A 141 8.166 -13.631 -4.737 1.00 0.00 H new ATOM 0 HB2 GLU A 141 9.837 -12.720 -6.123 1.00 0.00 H new ATOM 0 HB3 GLU A 141 10.345 -11.549 -4.923 1.00 0.00 H new ATOM 0 HG2 GLU A 141 11.518 -13.207 -3.652 1.00 0.00 H new ATOM 0 HG3 GLU A 141 10.775 -14.523 -4.539 1.00 0.00 H new ATOM 2178 N ARG A 142 8.845 -12.271 -1.910 1.00 0.00 N ATOM 2179 CA ARG A 142 9.133 -12.547 -0.504 1.00 0.00 C ATOM 2180 C ARG A 142 7.972 -12.159 0.413 1.00 0.00 C ATOM 2181 O ARG A 142 7.609 -12.911 1.317 1.00 0.00 O ATOM 2182 CB ARG A 142 10.399 -11.803 -0.080 1.00 0.00 C ATOM 2183 CG ARG A 142 10.427 -10.347 -0.524 1.00 0.00 C ATOM 2184 CD ARG A 142 11.596 -9.598 0.094 1.00 0.00 C ATOM 2185 NE ARG A 142 12.881 -10.193 -0.269 1.00 0.00 N ATOM 2186 CZ ARG A 142 14.044 -9.554 -0.175 1.00 0.00 C ATOM 2187 NH1 ARG A 142 14.090 -8.304 0.271 1.00 0.00 N ATOM 2188 NH2 ARG A 142 15.167 -10.167 -0.526 1.00 0.00 N ATOM 0 H ARG A 142 8.502 -11.329 -2.098 1.00 0.00 H new ATOM 0 HA ARG A 142 9.281 -13.622 -0.406 1.00 0.00 H new ATOM 0 HB2 ARG A 142 10.489 -11.845 1.005 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.268 -12.317 -0.492 1.00 0.00 H new ATOM 0 HG2 ARG A 142 10.496 -10.298 -1.611 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.493 -9.862 -0.242 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.573 -8.558 -0.232 1.00 0.00 H new ATOM 0 HD3 ARG A 142 11.492 -9.595 1.179 1.00 0.00 H new ATOM 0 HE ARG A 142 12.886 -11.153 -0.614 1.00 0.00 H new ATOM 0 HH11 ARG A 142 13.230 -7.828 0.544 1.00 0.00 H new ATOM 0 HH12 ARG A 142 14.985 -7.820 0.341 1.00 0.00 H new ATOM 0 HH21 ARG A 142 15.138 -11.128 -0.868 1.00 0.00 H new ATOM 0 HH22 ARG A 142 16.059 -9.678 -0.454 1.00 0.00 H new ATOM 2202 N LEU A 143 7.404 -10.980 0.189 1.00 0.00 N ATOM 2203 CA LEU A 143 6.302 -10.493 1.013 1.00 0.00 C ATOM 2204 C LEU A 143 5.037 -11.330 0.830 1.00 0.00 C ATOM 2205 O LEU A 143 4.106 -11.236 1.632 1.00 0.00 O ATOM 2206 CB LEU A 143 6.012 -9.029 0.689 1.00 0.00 C ATOM 2207 CG LEU A 143 5.081 -8.326 1.673 1.00 0.00 C ATOM 2208 CD1 LEU A 143 5.650 -8.382 3.082 1.00 0.00 C ATOM 2209 CD2 LEU A 143 4.848 -6.885 1.245 1.00 0.00 C ATOM 0 H LEU A 143 7.687 -10.343 -0.556 1.00 0.00 H new ATOM 0 HA LEU A 143 6.608 -10.583 2.055 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.956 -8.486 0.653 1.00 0.00 H new ATOM 0 HB3 LEU A 143 5.574 -8.972 -0.307 1.00 0.00 H new ATOM 0 HG LEU A 143 4.122 -8.845 1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 143 4.972 -7.875 3.769 1.00 0.00 H new ATOM 0 HD12 LEU A 143 5.765 -9.422 3.387 1.00 0.00 H new ATOM 0 HD13 LEU A 143 6.622 -7.889 3.102 1.00 0.00 H new ATOM 0 HD21 LEU A 143 4.182 -6.397 1.957 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.800 -6.355 1.217 1.00 0.00 H new ATOM 0 HD23 LEU A 143 4.395 -6.869 0.254 1.00 0.00 H new ATOM 2221 N THR A 144 4.997 -12.143 -0.222 1.00 0.00 N ATOM 2222 CA THR A 144 3.838 -12.985 -0.494 1.00 0.00 C ATOM 2223 C THR A 144 3.401 -13.756 0.749 1.00 0.00 C ATOM 2224 O THR A 144 2.227 -14.093 0.899 1.00 0.00 O ATOM 2225 CB THR A 144 4.149 -13.957 -1.623 1.00 0.00 C ATOM 2226 OG1 THR A 144 5.459 -14.482 -1.493 1.00 0.00 O ATOM 2227 CG2 THR A 144 4.034 -13.334 -2.997 1.00 0.00 C ATOM 0 H THR A 144 5.754 -12.236 -0.899 1.00 0.00 H new ATOM 0 HA THR A 144 3.017 -12.333 -0.792 1.00 0.00 H new ATOM 0 HB THR A 144 3.402 -14.746 -1.537 1.00 0.00 H new ATOM 0 HG1 THR A 144 5.636 -15.105 -2.228 1.00 0.00 H new ATOM 0 HG21 THR A 144 4.269 -14.081 -3.756 1.00 0.00 H new ATOM 0 HG22 THR A 144 3.018 -12.970 -3.148 1.00 0.00 H new ATOM 0 HG23 THR A 144 4.733 -12.502 -3.079 1.00 0.00 H new