USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=30 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= -0.934 X(o=-7.4,f=-7) USER MOD Set 1.2: A 131 GLN : amide:sc= -6.42 K(o=-7.4,f=-16!) USER MOD Set 2.1: A 47 HIS : no HE2:sc= -6.84! C(o=-8.8!,f=-11!) USER MOD Set 2.2: A 78 ASN :FLIP amide:sc= -1.93! C(o=-9.5!,f=-8.8!) USER MOD Set 3.1: A 24 HIS :FLIP no HD1:sc= -5.69! C(o=-17!,f=-16!) USER MOD Set 3.2: A 71 SER OG : rot -90:sc= -1.27 USER MOD Set 3.3: A 136 MET CE :methyl 144:sc= -8.61! (180deg=-12.3!) USER MOD Single : A 22 HIS :FLIP no HE2:sc= -0.507 F(o=-1.5,f=-0.51) USER MOD Single : A 27 THR OG1 : rot -170:sc= -2.45 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0732) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 174:sc= -7.07! (180deg=-8.04!) USER MOD Single : A 48 LYS NZ :NH3+ 154:sc= -2.99 (180deg=-5.17!) USER MOD Single : A 49 SER OG : rot -41:sc= -2.62! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -160:sc= -0.0286 (180deg=-0.182) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 174:sc= -4.76! USER MOD Single : A 65 THR OG1 : rot 84:sc= 0.122 USER MOD Single : A 68 SER OG : rot -67:sc= 1.16 USER MOD Single : A 72 HIS : no HE2:sc= -1.01 K(o=-1,f=-3.5!) USER MOD Single : A 73 ASN :FLIP amide:sc= -10.3! C(o=-11!,f=-10!) USER MOD Single : A 76 MET CE :methyl -118:sc= -5.77! (180deg=-15.1!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -87:sc= 0.403 USER MOD Single : A 96 TYR OH : rot -12:sc= -1.68! USER MOD Single : A 106 SER OG : rot 57:sc= 1.11 USER MOD Single : A 108 LYS NZ :NH3+ 159:sc= -0.103 (180deg=-0.464) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= -1.46 K(o=-1.5,f=-7.5!) USER MOD Single : A 121 SER OG : rot 35:sc= 1.08 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -163:sc= -0.864 (180deg=-2.25) USER MOD Single : A 124 TYR OH : rot 0:sc= -1.46 USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot -97:sc= -0.947 USER MOD Single : A 134 GLN : amide:sc= -0.393 X(o=-0.39,f=-0.29) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc= -3.9 K(o=-3.9,f=-6.2!) USER MOD Single : A 144 THR OG1 : rot -124:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 308 N HIS A 22 -9.512 0.080 -11.421 1.00 0.00 N ATOM 309 CA HIS A 22 -9.756 -0.756 -10.246 1.00 0.00 C ATOM 310 C HIS A 22 -8.569 -1.683 -10.021 1.00 0.00 C ATOM 311 O HIS A 22 -8.423 -2.696 -10.706 1.00 0.00 O ATOM 312 CB HIS A 22 -11.038 -1.573 -10.427 1.00 0.00 C ATOM 313 CG HIS A 22 -11.142 -2.235 -11.766 1.00 0.00 C ATOM 314 ND1 HIS A 22 -10.599 -3.385 -12.230 1.00 0.00 N flip ATOM 315 CD2 HIS A 22 -11.877 -1.713 -12.811 1.00 0.00 C flip ATOM 316 CE1 HIS A 22 -11.012 -3.535 -13.531 1.00 0.00 C flip ATOM 317 NE2 HIS A 22 -11.782 -2.514 -13.857 1.00 0.00 N flip ATOM 0 HA HIS A 22 -9.879 -0.113 -9.374 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.086 -2.335 -9.649 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.899 -0.919 -10.286 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -9.995 -4.022 -11.710 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -12.442 -0.793 -12.779 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -10.749 -4.356 -14.182 1.00 0.00 H new ATOM 326 N ILE A 23 -7.703 -1.319 -9.080 1.00 0.00 N ATOM 327 CA ILE A 23 -6.510 -2.110 -8.806 1.00 0.00 C ATOM 328 C ILE A 23 -6.079 -2.017 -7.332 1.00 0.00 C ATOM 329 O ILE A 23 -6.498 -2.829 -6.487 1.00 0.00 O ATOM 330 CB ILE A 23 -5.357 -1.639 -9.730 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.598 -2.100 -11.168 1.00 0.00 C ATOM 332 CG2 ILE A 23 -4.009 -2.128 -9.236 1.00 0.00 C ATOM 333 CD1 ILE A 23 -4.583 -1.550 -12.148 1.00 0.00 C ATOM 0 H ILE A 23 -7.804 -0.487 -8.498 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.746 -3.155 -9.007 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.343 -0.549 -9.708 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.574 -3.189 -11.203 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.597 -1.793 -11.479 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.226 -1.778 -9.909 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.826 -1.740 -8.234 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -4.005 -3.218 -9.210 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -4.810 -1.914 -13.150 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -4.623 -0.461 -12.140 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -3.584 -1.878 -11.860 1.00 0.00 H new ATOM 345 N HIS A 24 -5.233 -1.034 -7.018 1.00 0.00 N ATOM 346 CA HIS A 24 -4.751 -0.864 -5.656 1.00 0.00 C ATOM 347 C HIS A 24 -5.678 0.038 -4.846 1.00 0.00 C ATOM 348 O HIS A 24 -5.238 0.738 -3.935 1.00 0.00 O ATOM 349 CB HIS A 24 -3.328 -0.302 -5.649 1.00 0.00 C ATOM 350 CG HIS A 24 -2.382 -1.060 -6.527 1.00 0.00 C ATOM 351 ND1 HIS A 24 -2.287 -2.385 -6.790 1.00 0.00 N flip ATOM 352 CD2 HIS A 24 -1.384 -0.453 -7.259 1.00 0.00 C flip ATOM 353 CE1 HIS A 24 -1.243 -2.551 -7.666 1.00 0.00 C flip ATOM 354 NE2 HIS A 24 -0.716 -1.371 -7.935 1.00 0.00 N flip ATOM 0 H HIS A 24 -4.873 -0.352 -7.685 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.741 -1.848 -5.187 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.355 0.739 -5.971 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.948 -0.309 -4.627 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -1.180 0.607 -7.277 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -0.907 -3.495 -8.070 1.00 0.00 H new ATOM 0 HE2 HIS A 24 0.072 -1.197 -8.558 1.00 0.00 H new ATOM 363 N TRP A 25 -6.964 0.016 -5.187 1.00 0.00 N ATOM 364 CA TRP A 25 -7.954 0.833 -4.498 1.00 0.00 C ATOM 365 C TRP A 25 -9.312 0.149 -4.419 1.00 0.00 C ATOM 366 O TRP A 25 -10.232 0.694 -3.807 1.00 0.00 O ATOM 367 CB TRP A 25 -8.119 2.151 -5.232 1.00 0.00 C ATOM 368 CG TRP A 25 -7.580 2.079 -6.611 1.00 0.00 C ATOM 369 CD1 TRP A 25 -8.270 1.795 -7.744 1.00 0.00 C ATOM 370 CD2 TRP A 25 -6.221 2.257 -6.994 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.421 1.793 -8.814 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.155 2.086 -8.383 1.00 0.00 C ATOM 373 CE3 TRP A 25 -5.058 2.555 -6.291 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.962 2.204 -9.092 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.873 2.671 -6.991 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.832 2.500 -8.379 1.00 0.00 C ATOM 0 H TRP A 25 -7.343 -0.561 -5.938 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.593 0.992 -3.482 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.175 2.419 -5.267 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.608 2.941 -4.682 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.331 1.600 -7.793 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.688 1.603 -9.780 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.081 2.693 -5.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.930 2.067 -10.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.962 2.898 -6.457 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.890 2.604 -8.898 1.00 0.00 H new ATOM 387 N ARG A 26 -9.466 -1.026 -5.045 1.00 0.00 N ATOM 388 CA ARG A 26 -10.765 -1.708 -5.012 1.00 0.00 C ATOM 389 C ARG A 26 -11.403 -1.587 -3.624 1.00 0.00 C ATOM 390 O ARG A 26 -12.606 -1.354 -3.511 1.00 0.00 O ATOM 391 CB ARG A 26 -10.646 -3.187 -5.407 1.00 0.00 C ATOM 392 CG ARG A 26 -11.895 -4.016 -5.170 1.00 0.00 C ATOM 393 CD ARG A 26 -12.983 -3.677 -6.156 1.00 0.00 C ATOM 394 NE ARG A 26 -13.083 -4.667 -7.226 1.00 0.00 N ATOM 395 CZ ARG A 26 -13.433 -5.936 -7.033 1.00 0.00 C ATOM 396 NH1 ARG A 26 -13.720 -6.375 -5.813 1.00 0.00 N ATOM 397 NH2 ARG A 26 -13.499 -6.769 -8.062 1.00 0.00 N ATOM 0 H ARG A 26 -8.733 -1.510 -5.564 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.405 -1.217 -5.745 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.384 -3.246 -6.463 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -9.822 -3.631 -4.849 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.649 -5.075 -5.249 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -12.257 -3.847 -4.156 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.937 -3.611 -5.634 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.787 -2.696 -6.588 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.872 -4.367 -8.178 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -13.673 -5.738 -5.018 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -13.988 -7.349 -5.671 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -13.281 -6.437 -9.002 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -13.767 -7.742 -7.914 1.00 0.00 H new ATOM 411 N THR A 27 -10.588 -1.728 -2.564 1.00 0.00 N ATOM 412 CA THR A 27 -11.093 -1.611 -1.190 1.00 0.00 C ATOM 413 C THR A 27 -10.067 -2.108 -0.178 1.00 0.00 C ATOM 414 O THR A 27 -9.426 -3.141 -0.381 1.00 0.00 O ATOM 415 CB THR A 27 -12.406 -2.384 -1.002 1.00 0.00 C ATOM 416 OG1 THR A 27 -12.571 -3.366 -2.014 1.00 0.00 O ATOM 417 CG2 THR A 27 -13.632 -1.490 -1.002 1.00 0.00 C ATOM 0 H THR A 27 -9.589 -1.921 -2.633 1.00 0.00 H new ATOM 0 HA THR A 27 -11.281 -0.552 -1.016 1.00 0.00 H new ATOM 0 HB THR A 27 -12.325 -2.854 -0.022 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.478 -3.734 -1.968 1.00 0.00 H new ATOM 0 HG21 THR A 27 -14.526 -2.098 -0.865 1.00 0.00 H new ATOM 0 HG22 THR A 27 -13.556 -0.768 -0.189 1.00 0.00 H new ATOM 0 HG23 THR A 27 -13.696 -0.960 -1.952 1.00 0.00 H new ATOM 425 N LEU A 28 -9.927 -1.372 0.920 1.00 0.00 N ATOM 426 CA LEU A 28 -8.991 -1.738 1.975 1.00 0.00 C ATOM 427 C LEU A 28 -9.571 -2.851 2.841 1.00 0.00 C ATOM 428 O LEU A 28 -8.908 -3.854 3.108 1.00 0.00 O ATOM 429 CB LEU A 28 -8.661 -0.519 2.840 1.00 0.00 C ATOM 430 CG LEU A 28 -7.722 -0.793 4.017 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.007 0.484 4.435 1.00 0.00 C ATOM 432 CD2 LEU A 28 -8.493 -1.385 5.192 1.00 0.00 C ATOM 0 H LEU A 28 -10.452 -0.516 1.102 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.074 -2.099 1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.211 0.245 2.207 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.592 -0.105 3.227 1.00 0.00 H new ATOM 0 HG LEU A 28 -6.974 -1.519 3.699 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.343 0.272 5.273 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.423 0.865 3.597 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.742 1.231 4.735 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.808 -1.573 6.019 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.264 -0.684 5.511 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.959 -2.322 4.887 1.00 0.00 H new ATOM 444 N GLU A 29 -10.813 -2.667 3.276 1.00 0.00 N ATOM 445 CA GLU A 29 -11.486 -3.656 4.111 1.00 0.00 C ATOM 446 C GLU A 29 -11.654 -4.971 3.360 1.00 0.00 C ATOM 447 O GLU A 29 -11.295 -6.035 3.865 1.00 0.00 O ATOM 448 CB GLU A 29 -12.850 -3.132 4.560 1.00 0.00 C ATOM 449 CG GLU A 29 -13.238 -3.575 5.962 1.00 0.00 C ATOM 450 CD GLU A 29 -14.736 -3.523 6.198 1.00 0.00 C ATOM 451 OE1 GLU A 29 -15.395 -2.627 5.630 1.00 0.00 O ATOM 452 OE2 GLU A 29 -15.247 -4.378 6.952 1.00 0.00 O ATOM 0 H GLU A 29 -11.374 -1.842 3.064 1.00 0.00 H new ATOM 0 HA GLU A 29 -10.869 -3.836 4.991 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -12.843 -2.043 4.521 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -13.610 -3.472 3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -12.883 -4.592 6.129 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -12.737 -2.939 6.692 1.00 0.00 H new ATOM 459 N ASP A 30 -12.197 -4.891 2.149 1.00 0.00 N ATOM 460 CA ASP A 30 -12.407 -6.078 1.327 1.00 0.00 C ATOM 461 C ASP A 30 -11.087 -6.797 1.077 1.00 0.00 C ATOM 462 O ASP A 30 -11.046 -8.022 0.969 1.00 0.00 O ATOM 463 CB ASP A 30 -13.054 -5.692 -0.007 1.00 0.00 C ATOM 464 CG ASP A 30 -14.331 -6.466 -0.273 1.00 0.00 C ATOM 465 OD1 ASP A 30 -15.408 -6.001 0.157 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.255 -7.536 -0.914 1.00 0.00 O ATOM 0 H ASP A 30 -12.499 -4.018 1.716 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.075 -6.753 1.863 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.272 -4.624 -0.007 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.347 -5.872 -0.817 1.00 0.00 H new ATOM 471 N GLY A 31 -10.009 -6.024 0.991 1.00 0.00 N ATOM 472 CA GLY A 31 -8.700 -6.601 0.759 1.00 0.00 C ATOM 473 C GLY A 31 -8.276 -7.541 1.869 1.00 0.00 C ATOM 474 O GLY A 31 -7.677 -8.586 1.612 1.00 0.00 O ATOM 0 H GLY A 31 -10.020 -5.008 1.078 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.707 -7.141 -0.188 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.965 -5.801 0.664 1.00 0.00 H new ATOM 478 N LYS A 32 -8.587 -7.171 3.107 1.00 0.00 N ATOM 479 CA LYS A 32 -8.234 -7.989 4.260 1.00 0.00 C ATOM 480 C LYS A 32 -9.010 -9.301 4.254 1.00 0.00 C ATOM 481 O LYS A 32 -8.465 -10.358 4.571 1.00 0.00 O ATOM 482 CB LYS A 32 -8.509 -7.228 5.557 1.00 0.00 C ATOM 483 CG LYS A 32 -7.708 -7.738 6.744 1.00 0.00 C ATOM 484 CD LYS A 32 -8.455 -7.530 8.050 1.00 0.00 C ATOM 485 CE LYS A 32 -7.725 -8.177 9.218 1.00 0.00 C ATOM 486 NZ LYS A 32 -8.669 -8.666 10.260 1.00 0.00 N ATOM 0 H LYS A 32 -9.083 -6.310 3.337 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.170 -8.216 4.199 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.284 -6.173 5.404 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.572 -7.296 5.790 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.494 -8.798 6.611 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.749 -7.222 6.786 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.571 -6.463 8.238 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.457 -7.950 7.968 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -7.123 -9.010 8.854 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.037 -7.456 9.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.133 -9.100 11.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.226 -7.868 10.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -9.309 -9.373 9.845 1.00 0.00 H new ATOM 500 N LYS A 33 -10.287 -9.226 3.891 1.00 0.00 N ATOM 501 CA LYS A 33 -11.139 -10.407 3.843 1.00 0.00 C ATOM 502 C LYS A 33 -10.604 -11.423 2.838 1.00 0.00 C ATOM 503 O LYS A 33 -10.404 -12.591 3.168 1.00 0.00 O ATOM 504 CB LYS A 33 -12.570 -10.013 3.475 1.00 0.00 C ATOM 505 CG LYS A 33 -13.583 -11.124 3.703 1.00 0.00 C ATOM 506 CD LYS A 33 -14.456 -11.344 2.477 1.00 0.00 C ATOM 507 CE LYS A 33 -13.988 -12.542 1.665 1.00 0.00 C ATOM 508 NZ LYS A 33 -13.358 -12.130 0.379 1.00 0.00 N ATOM 0 H LYS A 33 -10.754 -8.359 3.626 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.138 -10.866 4.832 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.861 -9.141 4.061 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.598 -9.716 2.427 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -13.061 -12.049 3.950 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.211 -10.875 4.558 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.490 -11.496 2.788 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.439 -10.451 1.852 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.273 -13.120 2.250 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.836 -13.196 1.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.903 -12.954 -0.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -14.087 -11.752 -0.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.643 -11.397 0.562 1.00 0.00 H new ATOM 522 N GLU A 34 -10.374 -10.968 1.611 1.00 0.00 N ATOM 523 CA GLU A 34 -9.863 -11.836 0.557 1.00 0.00 C ATOM 524 C GLU A 34 -8.425 -12.255 0.849 1.00 0.00 C ATOM 525 O GLU A 34 -8.029 -13.388 0.569 1.00 0.00 O ATOM 526 CB GLU A 34 -9.933 -11.128 -0.796 1.00 0.00 C ATOM 527 CG GLU A 34 -9.493 -11.999 -1.960 1.00 0.00 C ATOM 528 CD GLU A 34 -10.303 -11.745 -3.216 1.00 0.00 C ATOM 529 OE1 GLU A 34 -11.364 -12.384 -3.377 1.00 0.00 O ATOM 530 OE2 GLU A 34 -9.876 -10.907 -4.038 1.00 0.00 O ATOM 0 H GLU A 34 -10.533 -10.003 1.322 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.486 -12.730 0.524 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.956 -10.793 -0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.307 -10.236 -0.763 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.439 -11.815 -2.168 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.584 -13.048 -1.679 1.00 0.00 H new ATOM 537 N ALA A 35 -7.648 -11.335 1.411 1.00 0.00 N ATOM 538 CA ALA A 35 -6.254 -11.610 1.740 1.00 0.00 C ATOM 539 C ALA A 35 -6.140 -12.790 2.699 1.00 0.00 C ATOM 540 O ALA A 35 -5.134 -13.498 2.708 1.00 0.00 O ATOM 541 CB ALA A 35 -5.602 -10.375 2.341 1.00 0.00 C ATOM 0 H ALA A 35 -7.960 -10.393 1.648 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.733 -11.872 0.819 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.562 -10.594 2.582 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.644 -9.556 1.623 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.133 -10.089 3.249 1.00 0.00 H new ATOM 547 N ALA A 36 -7.176 -12.996 3.504 1.00 0.00 N ATOM 548 CA ALA A 36 -7.193 -14.091 4.466 1.00 0.00 C ATOM 549 C ALA A 36 -7.200 -15.443 3.760 1.00 0.00 C ATOM 550 O ALA A 36 -6.362 -16.303 4.035 1.00 0.00 O ATOM 551 CB ALA A 36 -8.398 -13.966 5.384 1.00 0.00 C ATOM 0 H ALA A 36 -8.016 -12.418 3.509 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.285 -14.030 5.066 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.399 -14.790 6.098 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.349 -13.020 5.923 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -9.312 -13.999 4.791 1.00 0.00 H new ATOM 557 N ALA A 37 -8.153 -15.625 2.852 1.00 0.00 N ATOM 558 CA ALA A 37 -8.273 -16.872 2.108 1.00 0.00 C ATOM 559 C ALA A 37 -7.047 -17.110 1.231 1.00 0.00 C ATOM 560 O ALA A 37 -6.283 -18.048 1.456 1.00 0.00 O ATOM 561 CB ALA A 37 -9.535 -16.861 1.260 1.00 0.00 C ATOM 0 H ALA A 37 -8.854 -14.923 2.614 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.337 -17.689 2.827 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.612 -17.799 0.710 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -10.406 -16.747 1.905 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.493 -16.030 0.556 1.00 0.00 H new ATOM 567 N SER A 38 -6.866 -16.254 0.231 1.00 0.00 N ATOM 568 CA SER A 38 -5.735 -16.372 -0.680 1.00 0.00 C ATOM 569 C SER A 38 -4.412 -16.283 0.075 1.00 0.00 C ATOM 570 O SER A 38 -3.413 -16.875 -0.333 1.00 0.00 O ATOM 571 CB SER A 38 -5.799 -15.280 -1.749 1.00 0.00 C ATOM 572 OG SER A 38 -6.486 -15.737 -2.903 1.00 0.00 O ATOM 0 H SER A 38 -7.488 -15.471 0.031 1.00 0.00 H new ATOM 0 HA SER A 38 -5.791 -17.348 -1.162 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.302 -14.401 -1.346 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.789 -14.973 -2.021 1.00 0.00 H new ATOM 0 HG SER A 38 -6.515 -15.021 -3.571 1.00 0.00 H new ATOM 578 N GLY A 39 -4.414 -15.541 1.178 1.00 0.00 N ATOM 579 CA GLY A 39 -3.206 -15.391 1.970 1.00 0.00 C ATOM 580 C GLY A 39 -2.172 -14.523 1.283 1.00 0.00 C ATOM 581 O GLY A 39 -1.018 -14.925 1.130 1.00 0.00 O ATOM 0 H GLY A 39 -5.228 -15.042 1.537 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.460 -14.954 2.936 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.779 -16.374 2.167 1.00 0.00 H new ATOM 585 N LEU A 40 -2.582 -13.329 0.867 1.00 0.00 N ATOM 586 CA LEU A 40 -1.679 -12.405 0.193 1.00 0.00 C ATOM 587 C LEU A 40 -1.633 -11.059 0.913 1.00 0.00 C ATOM 588 O LEU A 40 -2.575 -10.687 1.614 1.00 0.00 O ATOM 589 CB LEU A 40 -2.107 -12.204 -1.263 1.00 0.00 C ATOM 590 CG LEU A 40 -3.581 -11.856 -1.471 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.895 -10.488 -0.886 1.00 0.00 C ATOM 592 CD2 LEU A 40 -3.933 -11.898 -2.951 1.00 0.00 C ATOM 0 H LEU A 40 -3.533 -12.980 0.985 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.680 -12.840 0.213 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.499 -11.410 -1.696 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.884 -13.115 -1.818 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.187 -12.598 -0.951 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.949 -10.258 -1.044 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.680 -10.491 0.183 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.281 -9.733 -1.377 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.986 -11.648 -3.082 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.319 -11.178 -3.492 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.747 -12.899 -3.341 1.00 0.00 H new ATOM 604 N PRO A 41 -0.533 -10.307 0.746 1.00 0.00 N ATOM 605 CA PRO A 41 -0.365 -8.997 1.378 1.00 0.00 C ATOM 606 C PRO A 41 -1.202 -7.919 0.700 1.00 0.00 C ATOM 607 O PRO A 41 -1.742 -8.126 -0.386 1.00 0.00 O ATOM 608 CB PRO A 41 1.124 -8.709 1.194 1.00 0.00 C ATOM 609 CG PRO A 41 1.494 -9.439 -0.049 1.00 0.00 C ATOM 610 CD PRO A 41 0.637 -10.677 -0.076 1.00 0.00 C ATOM 0 HA PRO A 41 -0.689 -8.998 2.419 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.312 -7.640 1.097 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.704 -9.059 2.048 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.317 -8.823 -0.930 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.553 -9.698 -0.049 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.346 -10.941 -1.093 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.162 -11.537 0.338 1.00 0.00 H new ATOM 618 N LEU A 42 -1.310 -6.764 1.346 1.00 0.00 N ATOM 619 CA LEU A 42 -2.088 -5.664 0.796 1.00 0.00 C ATOM 620 C LEU A 42 -1.186 -4.524 0.333 1.00 0.00 C ATOM 621 O LEU A 42 -0.057 -4.368 0.807 1.00 0.00 O ATOM 622 CB LEU A 42 -3.107 -5.152 1.818 1.00 0.00 C ATOM 623 CG LEU A 42 -2.997 -5.740 3.228 1.00 0.00 C ATOM 624 CD1 LEU A 42 -3.679 -4.828 4.233 1.00 0.00 C ATOM 625 CD2 LEU A 42 -3.604 -7.134 3.270 1.00 0.00 C ATOM 0 H LEU A 42 -0.871 -6.567 2.245 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.627 -6.045 -0.072 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.008 -4.069 1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -4.108 -5.357 1.438 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.943 -5.818 3.493 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.593 -5.258 5.231 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.202 -3.848 4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.732 -4.723 3.973 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.518 -7.538 4.279 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.656 -7.081 2.989 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -3.074 -7.783 2.573 1.00 0.00 H new ATOM 637 N MET A 43 -1.704 -3.730 -0.598 1.00 0.00 N ATOM 638 CA MET A 43 -0.975 -2.592 -1.143 1.00 0.00 C ATOM 639 C MET A 43 -1.543 -1.290 -0.590 1.00 0.00 C ATOM 640 O MET A 43 -2.540 -0.774 -1.092 1.00 0.00 O ATOM 641 CB MET A 43 -1.061 -2.599 -2.672 1.00 0.00 C ATOM 642 CG MET A 43 -0.403 -1.396 -3.328 1.00 0.00 C ATOM 643 SD MET A 43 1.397 -1.507 -3.334 1.00 0.00 S ATOM 644 CE MET A 43 1.638 -2.972 -4.336 1.00 0.00 C ATOM 0 H MET A 43 -2.636 -3.856 -0.994 1.00 0.00 H new ATOM 0 HA MET A 43 0.072 -2.669 -0.848 1.00 0.00 H new ATOM 0 HB2 MET A 43 -0.593 -3.508 -3.049 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.110 -2.634 -2.968 1.00 0.00 H new ATOM 0 HG2 MET A 43 -0.761 -1.305 -4.353 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.706 -0.490 -2.803 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.702 -3.114 -4.523 1.00 0.00 H new ATOM 0 HE2 MET A 43 1.243 -3.841 -3.810 1.00 0.00 H new ATOM 0 HE3 MET A 43 1.116 -2.853 -5.285 1.00 0.00 H new ATOM 654 N VAL A 44 -0.910 -0.774 0.457 1.00 0.00 N ATOM 655 CA VAL A 44 -1.363 0.457 1.091 1.00 0.00 C ATOM 656 C VAL A 44 -0.769 1.694 0.431 1.00 0.00 C ATOM 657 O VAL A 44 0.198 2.270 0.930 1.00 0.00 O ATOM 658 CB VAL A 44 -1.011 0.479 2.589 1.00 0.00 C ATOM 659 CG1 VAL A 44 -1.718 1.630 3.287 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.362 -0.850 3.241 1.00 0.00 C ATOM 0 H VAL A 44 -0.082 -1.189 0.884 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.446 0.478 0.969 1.00 0.00 H new ATOM 0 HB VAL A 44 0.064 0.631 2.689 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.457 1.629 4.345 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.408 2.573 2.838 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.796 1.514 3.179 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.106 -0.815 4.300 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.430 -1.038 3.132 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.802 -1.651 2.759 1.00 0.00 H new ATOM 670 N ILE A 45 -1.363 2.115 -0.678 1.00 0.00 N ATOM 671 CA ILE A 45 -0.898 3.301 -1.377 1.00 0.00 C ATOM 672 C ILE A 45 -1.712 4.517 -0.931 1.00 0.00 C ATOM 673 O ILE A 45 -2.883 4.654 -1.274 1.00 0.00 O ATOM 674 CB ILE A 45 -0.971 3.128 -2.916 1.00 0.00 C ATOM 675 CG1 ILE A 45 -2.414 3.054 -3.411 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.204 1.883 -3.348 1.00 0.00 C ATOM 677 CD1 ILE A 45 -2.757 4.167 -4.377 1.00 0.00 C ATOM 0 H ILE A 45 -2.164 1.654 -1.110 1.00 0.00 H new ATOM 0 HA ILE A 45 0.150 3.456 -1.121 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.510 4.008 -3.366 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.578 2.093 -3.898 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.090 3.098 -2.557 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.265 1.776 -4.431 1.00 0.00 H new ATOM 0 HG22 ILE A 45 0.840 1.978 -3.051 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.639 1.004 -2.871 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -3.794 4.065 -4.696 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.622 5.130 -3.885 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -2.102 4.109 -5.247 1.00 0.00 H new ATOM 689 N ILE A 46 -1.107 5.386 -0.124 1.00 0.00 N ATOM 690 CA ILE A 46 -1.818 6.546 0.383 1.00 0.00 C ATOM 691 C ILE A 46 -1.310 7.839 -0.237 1.00 0.00 C ATOM 692 O ILE A 46 -0.117 8.130 -0.205 1.00 0.00 O ATOM 693 CB ILE A 46 -1.705 6.624 1.916 1.00 0.00 C ATOM 694 CG1 ILE A 46 -1.992 5.256 2.534 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.664 7.656 2.470 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.048 4.900 3.660 1.00 0.00 C ATOM 0 H ILE A 46 -0.139 5.307 0.187 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.865 6.427 0.104 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.689 6.924 2.172 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.016 5.242 2.909 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.926 4.493 1.758 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.569 7.696 3.555 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.429 8.634 2.049 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.685 7.383 2.205 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.306 3.917 4.054 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.025 4.883 3.285 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.131 5.643 4.453 1.00 0.00 H new ATOM 708 N HIS A 47 -2.233 8.609 -0.797 1.00 0.00 N ATOM 709 CA HIS A 47 -1.902 9.879 -1.425 1.00 0.00 C ATOM 710 C HIS A 47 -2.803 10.978 -0.882 1.00 0.00 C ATOM 711 O HIS A 47 -3.900 11.203 -1.391 1.00 0.00 O ATOM 712 CB HIS A 47 -2.059 9.775 -2.940 1.00 0.00 C ATOM 713 CG HIS A 47 -1.402 8.564 -3.523 1.00 0.00 C ATOM 714 ND1 HIS A 47 -0.384 8.634 -4.449 1.00 0.00 N ATOM 715 CD2 HIS A 47 -1.622 7.245 -3.306 1.00 0.00 C ATOM 716 CE1 HIS A 47 -0.007 7.414 -4.780 1.00 0.00 C ATOM 717 NE2 HIS A 47 -0.740 6.552 -4.101 1.00 0.00 N ATOM 0 H HIS A 47 -3.225 8.373 -0.829 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.865 10.125 -1.196 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.120 9.758 -3.188 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.637 10.667 -3.404 1.00 0.00 H new ATOM 0 HD1 HIS A 47 0.016 9.495 -4.821 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.353 6.818 -2.635 1.00 0.00 H new ATOM 0 HE1 HIS A 47 0.770 7.163 -5.487 1.00 0.00 H new ATOM 726 N LYS A 48 -2.342 11.646 0.167 1.00 0.00 N ATOM 727 CA LYS A 48 -3.129 12.710 0.791 1.00 0.00 C ATOM 728 C LYS A 48 -2.764 14.089 0.241 1.00 0.00 C ATOM 729 O LYS A 48 -1.711 14.268 -0.370 1.00 0.00 O ATOM 730 CB LYS A 48 -2.917 12.694 2.299 1.00 0.00 C ATOM 731 CG LYS A 48 -4.002 11.952 3.049 1.00 0.00 C ATOM 732 CD LYS A 48 -4.037 10.483 2.668 1.00 0.00 C ATOM 733 CE LYS A 48 -5.155 9.753 3.391 1.00 0.00 C ATOM 734 NZ LYS A 48 -4.707 9.223 4.709 1.00 0.00 N ATOM 0 H LYS A 48 -1.436 11.475 0.603 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.177 12.522 0.558 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.954 12.234 2.518 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -2.870 13.720 2.663 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.834 12.047 4.122 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.969 12.407 2.836 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.174 10.387 1.591 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.081 10.019 2.910 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.996 10.431 3.538 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.513 8.931 2.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.526 9.136 5.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.271 8.288 4.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.012 9.874 5.127 1.00 0.00 H new ATOM 748 N SER A 49 -3.644 15.062 0.486 1.00 0.00 N ATOM 749 CA SER A 49 -3.432 16.444 0.045 1.00 0.00 C ATOM 750 C SER A 49 -2.862 16.514 -1.372 1.00 0.00 C ATOM 751 O SER A 49 -2.921 15.543 -2.127 1.00 0.00 O ATOM 752 CB SER A 49 -2.499 17.165 1.019 1.00 0.00 C ATOM 753 OG SER A 49 -1.142 16.987 0.653 1.00 0.00 O ATOM 0 H SER A 49 -4.518 14.917 0.992 1.00 0.00 H new ATOM 0 HA SER A 49 -4.404 16.937 0.032 1.00 0.00 H new ATOM 0 HB2 SER A 49 -2.738 18.228 1.036 1.00 0.00 H new ATOM 0 HB3 SER A 49 -2.659 16.786 2.028 1.00 0.00 H new ATOM 0 HG SER A 49 -0.997 16.059 0.375 1.00 0.00 H new ATOM 759 N TRP A 50 -2.306 17.676 -1.724 1.00 0.00 N ATOM 760 CA TRP A 50 -1.719 17.881 -3.047 1.00 0.00 C ATOM 761 C TRP A 50 -0.742 16.760 -3.374 1.00 0.00 C ATOM 762 O TRP A 50 0.322 16.653 -2.765 1.00 0.00 O ATOM 763 CB TRP A 50 -1.001 19.232 -3.122 1.00 0.00 C ATOM 764 CG TRP A 50 -1.710 20.332 -2.392 1.00 0.00 C ATOM 765 CD1 TRP A 50 -2.729 21.107 -2.865 1.00 0.00 C ATOM 766 CD2 TRP A 50 -1.452 20.779 -1.057 1.00 0.00 C ATOM 767 NE1 TRP A 50 -3.121 22.008 -1.904 1.00 0.00 N ATOM 768 CE2 TRP A 50 -2.352 21.826 -0.786 1.00 0.00 C ATOM 769 CE3 TRP A 50 -0.547 20.393 -0.063 1.00 0.00 C ATOM 770 CZ2 TRP A 50 -2.373 22.491 0.437 1.00 0.00 C ATOM 771 CZ3 TRP A 50 -0.569 21.054 1.149 1.00 0.00 C ATOM 772 CH2 TRP A 50 -1.477 22.093 1.392 1.00 0.00 C ATOM 0 H TRP A 50 -2.251 18.488 -1.110 1.00 0.00 H new ATOM 0 HA TRP A 50 -2.527 17.875 -3.778 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.003 19.123 -2.711 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -0.888 19.516 -4.168 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -3.164 21.024 -3.850 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.864 22.699 -2.007 1.00 0.00 H new ATOM 0 HE3 TRP A 50 0.156 19.593 -0.240 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -3.072 23.293 0.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.126 20.765 1.923 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.470 22.589 2.351 1.00 0.00 H new ATOM 783 N CYS A 51 -1.114 15.919 -4.330 1.00 0.00 N ATOM 784 CA CYS A 51 -0.275 14.797 -4.723 1.00 0.00 C ATOM 785 C CYS A 51 0.057 14.858 -6.217 1.00 0.00 C ATOM 786 O CYS A 51 -0.805 15.164 -7.041 1.00 0.00 O ATOM 787 CB CYS A 51 -0.992 13.483 -4.384 1.00 0.00 C ATOM 788 SG CYS A 51 -0.381 12.018 -5.277 1.00 0.00 S ATOM 0 H CYS A 51 -1.990 15.993 -4.847 1.00 0.00 H new ATOM 0 HA CYS A 51 0.664 14.848 -4.173 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -0.899 13.302 -3.313 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -2.055 13.602 -4.596 1.00 0.00 H new ATOM 793 N GLY A 52 1.309 14.556 -6.558 1.00 0.00 N ATOM 794 CA GLY A 52 1.726 14.572 -7.951 1.00 0.00 C ATOM 795 C GLY A 52 2.088 13.193 -8.456 1.00 0.00 C ATOM 796 O GLY A 52 1.709 12.812 -9.563 1.00 0.00 O ATOM 0 H GLY A 52 2.041 14.301 -5.895 1.00 0.00 H new ATOM 0 HA2 GLY A 52 0.923 14.982 -8.564 1.00 0.00 H new ATOM 0 HA3 GLY A 52 2.584 15.235 -8.064 1.00 0.00 H new ATOM 800 N ALA A 53 2.812 12.431 -7.637 1.00 0.00 N ATOM 801 CA ALA A 53 3.209 11.077 -8.007 1.00 0.00 C ATOM 802 C ALA A 53 2.016 10.287 -8.503 1.00 0.00 C ATOM 803 O ALA A 53 2.158 9.349 -9.287 1.00 0.00 O ATOM 804 CB ALA A 53 3.866 10.372 -6.829 1.00 0.00 C ATOM 0 H ALA A 53 3.134 12.729 -6.716 1.00 0.00 H new ATOM 0 HA ALA A 53 3.936 11.143 -8.817 1.00 0.00 H new ATOM 0 HB1 ALA A 53 4.155 9.363 -7.124 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.751 10.928 -6.520 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.162 10.319 -5.998 1.00 0.00 H new ATOM 810 N CYS A 54 0.836 10.685 -8.060 1.00 0.00 N ATOM 811 CA CYS A 54 -0.377 10.026 -8.477 1.00 0.00 C ATOM 812 C CYS A 54 -0.931 10.702 -9.725 1.00 0.00 C ATOM 813 O CYS A 54 -1.498 10.047 -10.602 1.00 0.00 O ATOM 814 CB CYS A 54 -1.415 10.047 -7.353 1.00 0.00 C ATOM 815 SG CYS A 54 -1.785 11.714 -6.716 1.00 0.00 S ATOM 0 H CYS A 54 0.698 11.461 -7.412 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.149 8.986 -8.710 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.338 9.595 -7.716 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.058 9.426 -6.531 1.00 0.00 H new ATOM 820 N LYS A 55 -0.744 12.017 -9.806 1.00 0.00 N ATOM 821 CA LYS A 55 -1.207 12.783 -10.956 1.00 0.00 C ATOM 822 C LYS A 55 -0.573 12.241 -12.229 1.00 0.00 C ATOM 823 O LYS A 55 -1.271 11.905 -13.186 1.00 0.00 O ATOM 824 CB LYS A 55 -0.866 14.266 -10.788 1.00 0.00 C ATOM 825 CG LYS A 55 -1.983 15.078 -10.154 1.00 0.00 C ATOM 826 CD LYS A 55 -1.868 16.552 -10.509 1.00 0.00 C ATOM 827 CE LYS A 55 -2.301 17.440 -9.353 1.00 0.00 C ATOM 828 NZ LYS A 55 -2.993 18.670 -9.825 1.00 0.00 N ATOM 0 H LYS A 55 -0.276 12.572 -9.090 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.290 12.685 -11.027 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.031 14.357 -10.175 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.630 14.689 -11.764 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -2.948 14.696 -10.488 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.951 14.960 -9.071 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.838 16.783 -10.780 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.483 16.766 -11.383 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -2.965 16.880 -8.695 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -1.428 17.719 -8.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.272 19.247 -9.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.351 19.218 -10.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.841 18.405 -10.366 1.00 0.00 H new ATOM 842 N ALA A 56 0.753 12.132 -12.224 1.00 0.00 N ATOM 843 CA ALA A 56 1.467 11.598 -13.375 1.00 0.00 C ATOM 844 C ALA A 56 1.089 10.144 -13.600 1.00 0.00 C ATOM 845 O ALA A 56 1.229 9.625 -14.705 1.00 0.00 O ATOM 846 CB ALA A 56 2.969 11.736 -13.180 1.00 0.00 C ATOM 0 H ALA A 56 1.349 12.404 -11.442 1.00 0.00 H new ATOM 0 HA ALA A 56 1.182 12.170 -14.258 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.487 11.332 -14.050 1.00 0.00 H new ATOM 0 HB2 ALA A 56 3.225 12.789 -13.062 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.272 11.186 -12.289 1.00 0.00 H new ATOM 852 N LEU A 57 0.604 9.495 -12.543 1.00 0.00 N ATOM 853 CA LEU A 57 0.202 8.099 -12.618 1.00 0.00 C ATOM 854 C LEU A 57 -1.136 7.934 -13.333 1.00 0.00 C ATOM 855 O LEU A 57 -1.477 6.843 -13.773 1.00 0.00 O ATOM 856 CB LEU A 57 0.135 7.495 -11.211 1.00 0.00 C ATOM 857 CG LEU A 57 1.381 6.710 -10.774 1.00 0.00 C ATOM 858 CD1 LEU A 57 2.643 7.296 -11.392 1.00 0.00 C ATOM 859 CD2 LEU A 57 1.496 6.690 -9.256 1.00 0.00 C ATOM 0 H LEU A 57 0.481 9.919 -11.623 1.00 0.00 H new ATOM 0 HA LEU A 57 0.953 7.566 -13.202 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.037 8.299 -10.496 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.729 6.832 -11.159 1.00 0.00 H new ATOM 0 HG LEU A 57 1.273 5.685 -11.130 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.509 6.721 -11.065 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.569 7.255 -12.479 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.756 8.333 -11.075 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.385 6.129 -8.966 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.574 7.711 -8.884 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.612 6.215 -8.830 1.00 0.00 H new ATOM 871 N LYS A 58 -1.900 9.007 -13.468 1.00 0.00 N ATOM 872 CA LYS A 58 -3.183 8.911 -14.157 1.00 0.00 C ATOM 873 C LYS A 58 -2.980 8.340 -15.566 1.00 0.00 C ATOM 874 O LYS A 58 -3.388 7.210 -15.857 1.00 0.00 O ATOM 875 CB LYS A 58 -3.870 10.277 -14.222 1.00 0.00 C ATOM 876 CG LYS A 58 -4.931 10.476 -13.151 1.00 0.00 C ATOM 877 CD LYS A 58 -4.670 11.728 -12.329 1.00 0.00 C ATOM 878 CE LYS A 58 -5.951 12.507 -12.078 1.00 0.00 C ATOM 879 NZ LYS A 58 -6.485 13.118 -13.327 1.00 0.00 N ATOM 0 H LYS A 58 -1.664 9.936 -13.119 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.830 8.237 -13.595 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.116 11.058 -14.125 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.329 10.397 -15.203 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.913 10.546 -13.619 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.953 9.607 -12.494 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.219 11.451 -11.376 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.953 12.363 -12.849 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.701 11.843 -11.650 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.762 13.290 -11.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.133 13.894 -13.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.698 13.490 -13.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.997 12.397 -13.874 1.00 0.00 H new ATOM 893 N PRO A 59 -2.307 9.097 -16.453 1.00 0.00 N ATOM 894 CA PRO A 59 -2.026 8.652 -17.818 1.00 0.00 C ATOM 895 C PRO A 59 -0.899 7.628 -17.858 1.00 0.00 C ATOM 896 O PRO A 59 -0.764 6.869 -18.819 1.00 0.00 O ATOM 897 CB PRO A 59 -1.602 9.938 -18.520 1.00 0.00 C ATOM 898 CG PRO A 59 -0.976 10.755 -17.444 1.00 0.00 C ATOM 899 CD PRO A 59 -1.731 10.429 -16.182 1.00 0.00 C ATOM 0 HA PRO A 59 -2.881 8.160 -18.281 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.898 9.737 -19.327 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -2.456 10.450 -18.962 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.082 10.516 -17.338 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -1.041 11.819 -17.674 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -1.072 10.411 -15.314 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.507 11.167 -15.978 1.00 0.00 H new ATOM 907 N LYS A 60 -0.097 7.609 -16.798 1.00 0.00 N ATOM 908 CA LYS A 60 1.016 6.678 -16.694 1.00 0.00 C ATOM 909 C LYS A 60 0.526 5.341 -16.171 1.00 0.00 C ATOM 910 O LYS A 60 0.521 4.340 -16.887 1.00 0.00 O ATOM 911 CB LYS A 60 2.080 7.233 -15.750 1.00 0.00 C ATOM 912 CG LYS A 60 2.968 6.165 -15.131 1.00 0.00 C ATOM 913 CD LYS A 60 3.915 5.572 -16.159 1.00 0.00 C ATOM 914 CE LYS A 60 4.864 6.630 -16.706 1.00 0.00 C ATOM 915 NZ LYS A 60 4.822 6.695 -18.193 1.00 0.00 N ATOM 0 H LYS A 60 -0.200 8.232 -15.997 1.00 0.00 H new ATOM 0 HA LYS A 60 1.451 6.542 -17.684 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.705 7.940 -16.297 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.590 7.791 -14.953 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.542 6.597 -14.311 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.349 5.375 -14.706 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.489 4.764 -15.706 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.342 5.136 -16.977 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.601 7.603 -16.292 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.881 6.410 -16.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.481 7.427 -18.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.098 5.774 -18.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.858 6.930 -18.503 1.00 0.00 H new ATOM 929 N PHE A 61 0.110 5.343 -14.907 1.00 0.00 N ATOM 930 CA PHE A 61 -0.392 4.143 -14.264 1.00 0.00 C ATOM 931 C PHE A 61 -1.430 3.473 -15.138 1.00 0.00 C ATOM 932 O PHE A 61 -1.666 2.281 -15.007 1.00 0.00 O ATOM 933 CB PHE A 61 -0.957 4.462 -12.889 1.00 0.00 C ATOM 934 CG PHE A 61 -1.110 3.251 -12.010 1.00 0.00 C ATOM 935 CD1 PHE A 61 -0.020 2.720 -11.341 1.00 0.00 C ATOM 936 CD2 PHE A 61 -2.346 2.642 -11.859 1.00 0.00 C ATOM 937 CE1 PHE A 61 -0.159 1.604 -10.535 1.00 0.00 C ATOM 938 CE2 PHE A 61 -2.491 1.526 -11.057 1.00 0.00 C ATOM 939 CZ PHE A 61 -1.396 1.008 -10.393 1.00 0.00 C ATOM 0 H PHE A 61 0.113 6.170 -14.309 1.00 0.00 H new ATOM 0 HA PHE A 61 0.438 3.450 -14.128 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.304 5.181 -12.394 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.929 4.942 -13.006 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.950 3.182 -11.450 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -3.206 3.044 -12.374 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.699 1.200 -10.018 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.459 1.059 -10.949 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.508 0.138 -9.763 1.00 0.00 H new ATOM 949 N ALA A 62 -2.018 4.222 -16.078 1.00 0.00 N ATOM 950 CA ALA A 62 -2.964 3.624 -17.003 1.00 0.00 C ATOM 951 C ALA A 62 -2.313 2.380 -17.628 1.00 0.00 C ATOM 952 O ALA A 62 -2.991 1.443 -18.050 1.00 0.00 O ATOM 953 CB ALA A 62 -3.367 4.631 -18.067 1.00 0.00 C ATOM 0 H ALA A 62 -1.855 5.220 -16.211 1.00 0.00 H new ATOM 0 HA ALA A 62 -3.871 3.327 -16.477 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.076 4.170 -18.754 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -3.831 5.496 -17.592 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.483 4.951 -18.619 1.00 0.00 H new ATOM 959 N GLU A 63 -0.972 2.386 -17.624 1.00 0.00 N ATOM 960 CA GLU A 63 -0.154 1.283 -18.123 1.00 0.00 C ATOM 961 C GLU A 63 -0.294 0.072 -17.214 1.00 0.00 C ATOM 962 O GLU A 63 0.090 -1.043 -17.572 1.00 0.00 O ATOM 963 CB GLU A 63 1.314 1.719 -18.199 1.00 0.00 C ATOM 964 CG GLU A 63 2.131 0.930 -19.207 1.00 0.00 C ATOM 965 CD GLU A 63 3.594 1.328 -19.213 1.00 0.00 C ATOM 966 OE1 GLU A 63 3.882 2.531 -19.387 1.00 0.00 O ATOM 967 OE2 GLU A 63 4.452 0.436 -19.044 1.00 0.00 O ATOM 0 H GLU A 63 -0.423 3.169 -17.269 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.497 1.010 -19.121 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.357 2.777 -18.457 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.767 1.613 -17.213 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.049 -0.133 -18.983 1.00 0.00 H new ATOM 0 HG3 GLU A 63 1.714 1.079 -20.203 1.00 0.00 H new ATOM 974 N SER A 64 -0.860 0.307 -16.037 1.00 0.00 N ATOM 975 CA SER A 64 -1.086 -0.734 -15.054 1.00 0.00 C ATOM 976 C SER A 64 -1.915 -1.879 -15.624 1.00 0.00 C ATOM 977 O SER A 64 -2.265 -2.807 -14.899 1.00 0.00 O ATOM 978 CB SER A 64 -1.796 -0.144 -13.843 1.00 0.00 C ATOM 979 OG SER A 64 -0.897 0.598 -13.037 1.00 0.00 O ATOM 0 H SER A 64 -1.175 1.231 -15.740 1.00 0.00 H new ATOM 0 HA SER A 64 -0.116 -1.136 -14.762 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.610 0.501 -14.173 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.242 -0.945 -13.253 1.00 0.00 H new ATOM 0 HG SER A 64 -1.394 1.049 -12.323 1.00 0.00 H new ATOM 985 N THR A 65 -2.219 -1.829 -16.920 1.00 0.00 N ATOM 986 CA THR A 65 -2.980 -2.897 -17.554 1.00 0.00 C ATOM 987 C THR A 65 -2.396 -4.234 -17.124 1.00 0.00 C ATOM 988 O THR A 65 -3.122 -5.189 -16.850 1.00 0.00 O ATOM 989 CB THR A 65 -2.938 -2.760 -19.076 1.00 0.00 C ATOM 990 OG1 THR A 65 -2.593 -1.440 -19.452 1.00 0.00 O ATOM 991 CG2 THR A 65 -4.256 -3.097 -19.738 1.00 0.00 C ATOM 0 H THR A 65 -1.952 -1.067 -17.544 1.00 0.00 H new ATOM 0 HA THR A 65 -4.023 -2.834 -17.244 1.00 0.00 H new ATOM 0 HB THR A 65 -2.185 -3.473 -19.412 1.00 0.00 H new ATOM 0 HG1 THR A 65 -1.618 -1.341 -19.441 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.161 -2.980 -20.818 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.526 -4.127 -19.507 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.031 -2.426 -19.367 1.00 0.00 H new ATOM 999 N GLU A 66 -1.070 -4.267 -17.013 1.00 0.00 N ATOM 1000 CA GLU A 66 -0.383 -5.461 -16.553 1.00 0.00 C ATOM 1001 C GLU A 66 -0.481 -5.521 -15.041 1.00 0.00 C ATOM 1002 O GLU A 66 -0.580 -6.599 -14.454 1.00 0.00 O ATOM 1003 CB GLU A 66 1.083 -5.471 -16.987 1.00 0.00 C ATOM 1004 CG GLU A 66 1.422 -6.606 -17.938 1.00 0.00 C ATOM 1005 CD GLU A 66 2.907 -6.907 -17.980 1.00 0.00 C ATOM 1006 OE1 GLU A 66 3.659 -6.109 -18.577 1.00 0.00 O ATOM 1007 OE2 GLU A 66 3.318 -7.943 -17.414 1.00 0.00 O ATOM 0 H GLU A 66 -0.457 -3.483 -17.235 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.857 -6.335 -17.000 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.319 -4.521 -17.468 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.716 -5.546 -16.103 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.882 -7.503 -17.635 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.078 -6.350 -18.940 1.00 0.00 H new ATOM 1014 N ILE A 67 -0.489 -4.346 -14.412 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.620 -4.279 -12.967 1.00 0.00 C ATOM 1016 C ILE A 67 -2.012 -4.754 -12.552 1.00 0.00 C ATOM 1017 O ILE A 67 -2.250 -5.060 -11.384 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.366 -2.855 -12.433 1.00 0.00 C ATOM 1019 CG1 ILE A 67 1.059 -2.407 -12.775 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.599 -2.794 -10.928 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.402 -1.025 -12.259 1.00 0.00 C ATOM 0 H ILE A 67 -0.407 -3.442 -14.877 1.00 0.00 H new ATOM 0 HA ILE A 67 0.136 -4.932 -12.532 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.070 -2.175 -12.913 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.766 -3.126 -12.361 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.186 -2.423 -13.857 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.414 -1.780 -10.572 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.629 -3.074 -10.708 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.080 -3.484 -10.427 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.426 -0.776 -12.539 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.719 -0.295 -12.693 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.308 -1.008 -11.173 1.00 0.00 H new ATOM 1033 N SER A 68 -2.926 -4.836 -13.526 1.00 0.00 N ATOM 1034 CA SER A 68 -4.281 -5.299 -13.259 1.00 0.00 C ATOM 1035 C SER A 68 -4.250 -6.771 -12.873 1.00 0.00 C ATOM 1036 O SER A 68 -5.027 -7.224 -12.033 1.00 0.00 O ATOM 1037 CB SER A 68 -5.169 -5.096 -14.488 1.00 0.00 C ATOM 1038 OG SER A 68 -4.959 -6.119 -15.445 1.00 0.00 O ATOM 0 H SER A 68 -2.748 -4.588 -14.499 1.00 0.00 H new ATOM 0 HA SER A 68 -4.697 -4.719 -12.435 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.216 -5.086 -14.186 1.00 0.00 H new ATOM 0 HB3 SER A 68 -4.958 -4.125 -14.937 1.00 0.00 H new ATOM 0 HG SER A 68 -4.053 -6.044 -15.811 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.322 -7.505 -13.479 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.156 -8.924 -13.188 1.00 0.00 C ATOM 1046 C GLU A 69 -2.043 -9.115 -12.167 1.00 0.00 C ATOM 1047 O GLU A 69 -2.049 -10.071 -11.392 1.00 0.00 O ATOM 1048 CB GLU A 69 -2.854 -9.728 -14.460 1.00 0.00 C ATOM 1049 CG GLU A 69 -2.102 -8.947 -15.525 1.00 0.00 C ATOM 1050 CD GLU A 69 -1.889 -9.749 -16.794 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -1.088 -10.707 -16.762 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -2.522 -9.419 -17.818 1.00 0.00 O ATOM 0 H GLU A 69 -2.673 -7.139 -14.176 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.094 -9.297 -12.776 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.270 -10.608 -14.190 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.793 -10.085 -14.882 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -2.655 -8.038 -15.762 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -1.135 -8.637 -15.129 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.097 -8.179 -12.159 1.00 0.00 N ATOM 1060 CA LEU A 70 0.013 -8.217 -11.220 1.00 0.00 C ATOM 1061 C LEU A 70 -0.482 -7.968 -9.801 1.00 0.00 C ATOM 1062 O LEU A 70 0.229 -8.205 -8.836 1.00 0.00 O ATOM 1063 CB LEU A 70 1.066 -7.177 -11.599 1.00 0.00 C ATOM 1064 CG LEU A 70 2.420 -7.754 -11.991 1.00 0.00 C ATOM 1065 CD1 LEU A 70 2.282 -8.552 -13.275 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.453 -6.649 -12.146 1.00 0.00 C ATOM 0 H LEU A 70 -1.080 -7.383 -12.797 1.00 0.00 H new ATOM 0 HA LEU A 70 0.467 -9.207 -11.263 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.686 -6.582 -12.429 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.206 -6.498 -10.758 1.00 0.00 H new ATOM 0 HG LEU A 70 2.765 -8.419 -11.199 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.252 -8.964 -13.553 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.572 -9.365 -13.123 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.922 -7.901 -14.071 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.412 -7.084 -12.426 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.129 -5.955 -12.921 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.559 -6.115 -11.202 1.00 0.00 H new ATOM 1078 N SER A 71 -1.706 -7.479 -9.685 1.00 0.00 N ATOM 1079 CA SER A 71 -2.299 -7.198 -8.384 1.00 0.00 C ATOM 1080 C SER A 71 -2.800 -8.473 -7.713 1.00 0.00 C ATOM 1081 O SER A 71 -3.113 -8.474 -6.527 1.00 0.00 O ATOM 1082 CB SER A 71 -3.460 -6.226 -8.519 1.00 0.00 C ATOM 1083 OG SER A 71 -3.093 -4.924 -8.098 1.00 0.00 O ATOM 0 H SER A 71 -2.312 -7.267 -10.478 1.00 0.00 H new ATOM 0 HA SER A 71 -1.518 -6.754 -7.766 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.792 -6.195 -9.557 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.303 -6.578 -7.925 1.00 0.00 H new ATOM 0 HG SER A 71 -3.285 -4.823 -7.142 1.00 0.00 H new ATOM 1089 N HIS A 72 -2.888 -9.550 -8.480 1.00 0.00 N ATOM 1090 CA HIS A 72 -3.361 -10.827 -7.965 1.00 0.00 C ATOM 1091 C HIS A 72 -2.503 -11.299 -6.800 1.00 0.00 C ATOM 1092 O HIS A 72 -2.870 -12.226 -6.080 1.00 0.00 O ATOM 1093 CB HIS A 72 -3.360 -11.878 -9.074 1.00 0.00 C ATOM 1094 CG HIS A 72 -4.464 -11.698 -10.069 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -4.241 -11.540 -11.420 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -5.807 -11.651 -9.902 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -5.398 -11.402 -12.043 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -6.364 -11.467 -11.143 1.00 0.00 N ATOM 0 H HIS A 72 -2.636 -9.564 -9.468 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.380 -10.688 -7.605 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -2.403 -11.844 -9.595 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -3.444 -12.868 -8.626 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -3.325 -11.531 -11.869 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -6.340 -11.741 -8.967 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.532 -11.260 -13.105 1.00 0.00 H new ATOM 1107 N ASN A 73 -1.347 -10.669 -6.632 1.00 0.00 N ATOM 1108 CA ASN A 73 -0.428 -11.044 -5.565 1.00 0.00 C ATOM 1109 C ASN A 73 -0.722 -10.293 -4.260 1.00 0.00 C ATOM 1110 O ASN A 73 -0.233 -10.672 -3.198 1.00 0.00 O ATOM 1111 CB ASN A 73 1.023 -10.824 -5.998 1.00 0.00 C ATOM 1112 CG ASN A 73 1.213 -9.613 -6.888 1.00 0.00 C ATOM 1113 OD1 ASN A 73 1.758 -9.829 -8.084 1.00 0.00 O flip ATOM 1114 ND2 ASN A 73 0.876 -8.494 -6.505 1.00 0.00 N flip ATOM 0 H ASN A 73 -1.025 -9.899 -7.218 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.578 -12.106 -5.369 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.646 -10.713 -5.110 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.375 -11.711 -6.525 1.00 0.00 H new ATOM 0 HD21 ASN A 73 0.462 -8.375 -5.580 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.010 -7.685 -7.112 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.535 -9.244 -4.346 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.919 -8.454 -3.179 1.00 0.00 C ATOM 1123 C PHE A 74 -3.283 -7.814 -3.426 1.00 0.00 C ATOM 1124 O PHE A 74 -3.971 -8.188 -4.373 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.860 -7.393 -2.872 1.00 0.00 C ATOM 1126 CG PHE A 74 -0.352 -6.665 -4.082 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -1.212 -5.942 -4.888 1.00 0.00 C ATOM 1128 CD2 PHE A 74 0.995 -6.702 -4.410 1.00 0.00 C ATOM 1129 CE1 PHE A 74 -0.742 -5.269 -6.000 1.00 0.00 C ATOM 1130 CE2 PHE A 74 1.471 -6.033 -5.520 1.00 0.00 C ATOM 1131 CZ PHE A 74 0.601 -5.314 -6.317 1.00 0.00 C ATOM 0 H PHE A 74 -1.945 -8.918 -5.222 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.989 -9.108 -2.310 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.279 -6.668 -2.175 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.019 -7.870 -2.369 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.264 -5.903 -4.646 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.680 -7.261 -3.790 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -1.425 -4.708 -6.621 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.522 -6.072 -5.765 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.970 -4.789 -7.185 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.698 -6.862 -2.590 1.00 0.00 N ATOM 1142 CA VAL A 75 -5.003 -6.239 -2.804 1.00 0.00 C ATOM 1143 C VAL A 75 -5.057 -4.753 -2.450 1.00 0.00 C ATOM 1144 O VAL A 75 -4.573 -4.302 -1.411 1.00 0.00 O ATOM 1145 CB VAL A 75 -6.134 -6.969 -2.045 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.948 -6.828 -0.541 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.505 -6.435 -2.483 1.00 0.00 C ATOM 0 H VAL A 75 -3.172 -6.516 -1.787 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.158 -6.330 -3.879 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.089 -8.030 -2.291 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.754 -7.349 -0.024 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.991 -7.262 -0.250 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.965 -5.772 -0.270 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.291 -6.960 -1.939 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.565 -5.368 -2.268 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.634 -6.598 -3.553 1.00 0.00 H new ATOM 1157 N MET A 76 -5.697 -4.032 -3.355 1.00 0.00 N ATOM 1158 CA MET A 76 -5.940 -2.603 -3.295 1.00 0.00 C ATOM 1159 C MET A 76 -6.262 -2.017 -1.927 1.00 0.00 C ATOM 1160 O MET A 76 -7.294 -2.341 -1.325 1.00 0.00 O ATOM 1161 CB MET A 76 -7.173 -2.386 -4.128 1.00 0.00 C ATOM 1162 CG MET A 76 -8.116 -3.579 -4.066 1.00 0.00 C ATOM 1163 SD MET A 76 -8.006 -4.672 -5.517 1.00 0.00 S ATOM 1164 CE MET A 76 -9.237 -5.914 -5.121 1.00 0.00 C ATOM 0 H MET A 76 -6.083 -4.454 -4.200 1.00 0.00 H new ATOM 0 HA MET A 76 -5.019 -2.117 -3.618 1.00 0.00 H new ATOM 0 HB2 MET A 76 -7.693 -1.493 -3.781 1.00 0.00 H new ATOM 0 HB3 MET A 76 -6.885 -2.204 -5.163 1.00 0.00 H new ATOM 0 HG2 MET A 76 -7.898 -4.158 -3.168 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.140 -3.217 -3.971 1.00 0.00 H new ATOM 0 HE1 MET A 76 -8.756 -6.888 -5.034 1.00 0.00 H new ATOM 0 HE2 MET A 76 -9.718 -5.661 -4.176 1.00 0.00 H new ATOM 0 HE3 MET A 76 -9.986 -5.949 -5.912 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.423 -1.065 -1.515 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.624 -0.326 -0.278 1.00 0.00 C ATOM 1176 C VAL A 77 -5.155 1.113 -0.436 1.00 0.00 C ATOM 1177 O VAL A 77 -4.215 1.551 0.228 1.00 0.00 O ATOM 1178 CB VAL A 77 -4.894 -0.975 0.911 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.115 -0.173 2.188 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -5.355 -2.405 1.088 1.00 0.00 C ATOM 0 H VAL A 77 -4.588 -0.789 -2.032 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.693 -0.344 -0.067 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.825 -0.978 0.700 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.589 -0.652 3.014 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.733 0.839 2.053 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.181 -0.132 2.412 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -4.832 -2.854 1.932 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.428 -2.421 1.277 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.137 -2.972 0.183 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.812 1.840 -1.329 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.458 3.224 -1.585 1.00 0.00 C ATOM 1192 C ASN A 78 -6.311 4.180 -0.765 1.00 0.00 C ATOM 1193 O ASN A 78 -7.482 4.410 -1.070 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.598 3.528 -3.071 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.603 5.013 -3.381 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -4.631 5.729 -2.837 1.00 0.00 O flip ATOM 1197 ND2 ASN A 78 -6.470 5.507 -4.101 1.00 0.00 N flip ATOM 0 H ASN A 78 -6.592 1.492 -1.887 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.421 3.369 -1.284 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -4.778 3.054 -3.611 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -6.522 3.084 -3.440 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -7.200 4.916 -4.499 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -6.458 6.507 -4.300 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.704 4.742 0.267 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.391 5.694 1.135 1.00 0.00 C ATOM 1206 C LEU A 79 -5.939 7.123 0.825 1.00 0.00 C ATOM 1207 O LEU A 79 -4.744 7.404 0.751 1.00 0.00 O ATOM 1208 CB LEU A 79 -6.144 5.329 2.610 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.844 6.493 3.562 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -7.092 7.331 3.803 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -5.291 5.969 4.877 1.00 0.00 C ATOM 0 H LEU A 79 -4.735 4.557 0.527 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.464 5.642 0.948 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -7.022 4.801 2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -5.309 4.629 2.653 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.093 7.131 3.097 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -6.855 8.151 4.481 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.447 7.736 2.855 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.869 6.708 4.245 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -5.082 6.806 5.543 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.023 5.309 5.342 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.370 5.416 4.690 1.00 0.00 H new ATOM 1223 N GLU A 80 -6.901 8.023 0.636 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.598 9.421 0.328 1.00 0.00 C ATOM 1225 C GLU A 80 -7.839 10.292 0.507 1.00 0.00 C ATOM 1226 O GLU A 80 -8.454 10.722 -0.469 1.00 0.00 O ATOM 1227 CB GLU A 80 -6.067 9.549 -1.101 1.00 0.00 C ATOM 1228 CG GLU A 80 -6.879 8.777 -2.128 1.00 0.00 C ATOM 1229 CD GLU A 80 -6.409 9.028 -3.546 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -6.673 10.129 -4.073 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -5.776 8.123 -4.132 1.00 0.00 O ATOM 0 H GLU A 80 -7.897 7.811 0.690 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.830 9.765 1.020 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.052 10.602 -1.380 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -5.036 9.198 -1.128 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.815 7.711 -1.911 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.929 9.057 -2.042 1.00 0.00 H new ATOM 1238 N ASP A 81 -8.203 10.538 1.760 1.00 0.00 N ATOM 1239 CA ASP A 81 -9.379 11.351 2.069 1.00 0.00 C ATOM 1240 C ASP A 81 -9.109 12.345 3.208 1.00 0.00 C ATOM 1241 O ASP A 81 -8.532 13.409 2.987 1.00 0.00 O ATOM 1242 CB ASP A 81 -10.578 10.450 2.396 1.00 0.00 C ATOM 1243 CG ASP A 81 -10.179 9.179 3.127 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -9.739 8.222 2.457 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -10.306 9.144 4.369 1.00 0.00 O ATOM 0 H ASP A 81 -7.704 10.188 2.578 1.00 0.00 H new ATOM 0 HA ASP A 81 -9.616 11.941 1.184 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -11.289 11.007 3.007 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -11.091 10.186 1.471 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.545 11.998 4.426 1.00 0.00 N ATOM 1251 CA GLU A 82 -9.367 12.862 5.591 1.00 0.00 C ATOM 1252 C GLU A 82 -7.891 13.110 5.883 1.00 0.00 C ATOM 1253 O GLU A 82 -7.518 14.182 6.358 1.00 0.00 O ATOM 1254 CB GLU A 82 -10.036 12.239 6.818 1.00 0.00 C ATOM 1255 CG GLU A 82 -9.553 10.830 7.126 1.00 0.00 C ATOM 1256 CD GLU A 82 -10.305 10.194 8.279 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -10.418 10.838 9.343 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -10.780 9.050 8.118 1.00 0.00 O ATOM 0 H GLU A 82 -10.025 11.121 4.626 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.836 13.820 5.366 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.851 12.875 7.684 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.115 12.218 6.662 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -9.666 10.209 6.237 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.489 10.858 7.362 1.00 0.00 H new ATOM 1265 N GLU A 83 -7.058 12.109 5.596 1.00 0.00 N ATOM 1266 CA GLU A 83 -5.613 12.202 5.817 1.00 0.00 C ATOM 1267 C GLU A 83 -5.224 11.842 7.250 1.00 0.00 C ATOM 1268 O GLU A 83 -4.061 11.546 7.523 1.00 0.00 O ATOM 1269 CB GLU A 83 -5.086 13.604 5.481 1.00 0.00 C ATOM 1270 CG GLU A 83 -5.687 14.206 4.219 1.00 0.00 C ATOM 1271 CD GLU A 83 -6.234 15.603 4.439 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -5.437 16.511 4.754 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -7.461 15.789 4.295 1.00 0.00 O ATOM 0 H GLU A 83 -7.362 11.217 5.207 1.00 0.00 H new ATOM 0 HA GLU A 83 -5.154 11.476 5.146 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -5.290 14.268 6.321 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -4.003 13.556 5.368 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -4.927 14.237 3.439 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -6.487 13.560 3.859 1.00 0.00 H new ATOM 1280 N GLU A 84 -6.186 11.871 8.168 1.00 0.00 N ATOM 1281 CA GLU A 84 -5.907 11.549 9.563 1.00 0.00 C ATOM 1282 C GLU A 84 -6.573 10.236 9.971 1.00 0.00 C ATOM 1283 O GLU A 84 -7.663 10.234 10.544 1.00 0.00 O ATOM 1284 CB GLU A 84 -6.377 12.685 10.476 1.00 0.00 C ATOM 1285 CG GLU A 84 -5.235 13.478 11.090 1.00 0.00 C ATOM 1286 CD GLU A 84 -5.675 14.835 11.603 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -6.543 14.878 12.501 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -5.151 15.855 11.110 1.00 0.00 O ATOM 0 H GLU A 84 -7.158 12.112 7.973 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.829 11.430 9.670 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -7.013 13.361 9.904 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -6.991 12.269 11.275 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -4.802 12.907 11.911 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -4.450 13.612 10.346 1.00 0.00 H new ATOM 1295 N PRO A 85 -5.917 9.096 9.685 1.00 0.00 N ATOM 1296 CA PRO A 85 -6.440 7.775 10.029 1.00 0.00 C ATOM 1297 C PRO A 85 -6.148 7.387 11.478 1.00 0.00 C ATOM 1298 O PRO A 85 -6.413 6.259 11.892 1.00 0.00 O ATOM 1299 CB PRO A 85 -5.687 6.860 9.071 1.00 0.00 C ATOM 1300 CG PRO A 85 -4.362 7.520 8.894 1.00 0.00 C ATOM 1301 CD PRO A 85 -4.608 9.005 9.008 1.00 0.00 C ATOM 0 HA PRO A 85 -7.525 7.724 9.941 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -5.579 5.856 9.482 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.212 6.761 8.121 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -3.656 7.184 9.653 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -3.930 7.271 7.925 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -3.825 9.497 9.585 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -4.630 9.483 8.029 1.00 0.00 H new ATOM 1309 N LYS A 86 -5.598 8.329 12.246 1.00 0.00 N ATOM 1310 CA LYS A 86 -5.269 8.082 13.646 1.00 0.00 C ATOM 1311 C LYS A 86 -4.095 7.115 13.766 1.00 0.00 C ATOM 1312 O LYS A 86 -4.167 6.120 14.488 1.00 0.00 O ATOM 1313 CB LYS A 86 -6.487 7.530 14.394 1.00 0.00 C ATOM 1314 CG LYS A 86 -6.642 8.090 15.798 1.00 0.00 C ATOM 1315 CD LYS A 86 -6.928 9.582 15.776 1.00 0.00 C ATOM 1316 CE LYS A 86 -6.244 10.298 16.930 1.00 0.00 C ATOM 1317 NZ LYS A 86 -6.150 11.767 16.699 1.00 0.00 N ATOM 0 H LYS A 86 -5.372 9.269 11.920 1.00 0.00 H new ATOM 0 HA LYS A 86 -4.980 9.031 14.098 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.387 7.753 13.821 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.407 6.444 14.451 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -7.452 7.571 16.310 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.732 7.902 16.368 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.587 10.005 14.831 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -8.004 9.748 15.830 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -6.796 10.111 17.851 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.244 9.888 17.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.677 12.216 17.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.601 11.948 15.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -7.106 12.163 16.592 1.00 0.00 H new ATOM 1331 N ASP A 87 -3.011 7.414 13.053 1.00 0.00 N ATOM 1332 CA ASP A 87 -1.821 6.571 13.082 1.00 0.00 C ATOM 1333 C ASP A 87 -0.682 7.201 12.285 1.00 0.00 C ATOM 1334 O ASP A 87 -0.877 8.184 11.569 1.00 0.00 O ATOM 1335 CB ASP A 87 -2.141 5.181 12.528 1.00 0.00 C ATOM 1336 CG ASP A 87 -1.700 4.071 13.464 1.00 0.00 C ATOM 1337 OD1 ASP A 87 -2.033 4.142 14.666 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -1.024 3.132 12.994 1.00 0.00 O ATOM 0 H ASP A 87 -2.934 8.233 12.450 1.00 0.00 H new ATOM 0 HA ASP A 87 -1.501 6.477 14.120 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -3.214 5.100 12.353 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.650 5.055 11.563 1.00 0.00 H new ATOM 1343 N GLU A 88 0.508 6.622 12.415 1.00 0.00 N ATOM 1344 CA GLU A 88 1.688 7.115 11.712 1.00 0.00 C ATOM 1345 C GLU A 88 2.033 6.223 10.518 1.00 0.00 C ATOM 1346 O GLU A 88 2.827 6.604 9.661 1.00 0.00 O ATOM 1347 CB GLU A 88 2.881 7.192 12.666 1.00 0.00 C ATOM 1348 CG GLU A 88 3.148 8.594 13.182 1.00 0.00 C ATOM 1349 CD GLU A 88 2.150 9.028 14.238 1.00 0.00 C ATOM 1350 OE1 GLU A 88 2.350 8.684 15.421 1.00 0.00 O ATOM 1351 OE2 GLU A 88 1.166 9.708 13.878 1.00 0.00 O ATOM 0 H GLU A 88 0.681 5.807 13.004 1.00 0.00 H new ATOM 0 HA GLU A 88 1.462 8.114 11.339 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.704 6.529 13.512 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.771 6.825 12.154 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.154 8.638 13.599 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.117 9.296 12.348 1.00 0.00 H new ATOM 1358 N ASP A 89 1.438 5.032 10.477 1.00 0.00 N ATOM 1359 CA ASP A 89 1.688 4.081 9.395 1.00 0.00 C ATOM 1360 C ASP A 89 1.645 4.752 8.019 1.00 0.00 C ATOM 1361 O ASP A 89 2.282 4.287 7.075 1.00 0.00 O ATOM 1362 CB ASP A 89 0.670 2.939 9.450 1.00 0.00 C ATOM 1363 CG ASP A 89 1.105 1.749 8.617 1.00 0.00 C ATOM 1364 OD1 ASP A 89 1.894 1.953 7.673 1.00 0.00 O ATOM 1365 OD2 ASP A 89 0.659 0.613 8.906 1.00 0.00 O ATOM 0 H ASP A 89 0.778 4.702 11.182 1.00 0.00 H new ATOM 0 HA ASP A 89 2.693 3.683 9.537 1.00 0.00 H new ATOM 0 HB2 ASP A 89 0.532 2.626 10.485 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.296 3.297 9.094 1.00 0.00 H new ATOM 1370 N PHE A 90 0.892 5.842 7.907 1.00 0.00 N ATOM 1371 CA PHE A 90 0.778 6.560 6.637 1.00 0.00 C ATOM 1372 C PHE A 90 2.102 7.228 6.254 1.00 0.00 C ATOM 1373 O PHE A 90 2.347 7.516 5.079 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.338 7.607 6.719 1.00 0.00 C ATOM 1375 CG PHE A 90 0.026 8.818 7.531 1.00 0.00 C ATOM 1376 CD1 PHE A 90 0.812 9.820 6.986 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -0.416 8.953 8.837 1.00 0.00 C ATOM 1378 CE1 PHE A 90 1.150 10.934 7.727 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -0.081 10.066 9.584 1.00 0.00 C ATOM 1380 CZ PHE A 90 0.704 11.058 9.028 1.00 0.00 C ATOM 0 H PHE A 90 0.354 6.247 8.673 1.00 0.00 H new ATOM 0 HA PHE A 90 0.531 5.834 5.862 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.602 7.923 5.710 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.226 7.145 7.150 1.00 0.00 H new ATOM 0 HD1 PHE A 90 1.164 9.728 5.969 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.029 8.180 9.276 1.00 0.00 H new ATOM 0 HE1 PHE A 90 1.763 11.708 7.290 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.432 10.161 10.601 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.968 11.929 9.610 1.00 0.00 H new ATOM 1390 N SER A 91 2.949 7.471 7.254 1.00 0.00 N ATOM 1391 CA SER A 91 4.246 8.101 7.030 1.00 0.00 C ATOM 1392 C SER A 91 5.211 7.772 8.169 1.00 0.00 C ATOM 1393 O SER A 91 5.579 8.645 8.957 1.00 0.00 O ATOM 1394 CB SER A 91 4.087 9.619 6.905 1.00 0.00 C ATOM 1395 OG SER A 91 3.474 9.966 5.675 1.00 0.00 O ATOM 0 H SER A 91 2.758 7.240 8.229 1.00 0.00 H new ATOM 0 HA SER A 91 4.657 7.709 6.100 1.00 0.00 H new ATOM 0 HB2 SER A 91 3.486 9.995 7.733 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.064 10.098 6.976 1.00 0.00 H new ATOM 0 HG SER A 91 4.159 10.047 4.979 1.00 0.00 H new ATOM 1401 N PRO A 92 5.627 6.497 8.278 1.00 0.00 N ATOM 1402 CA PRO A 92 6.536 6.042 9.323 1.00 0.00 C ATOM 1403 C PRO A 92 8.006 6.106 8.912 1.00 0.00 C ATOM 1404 O PRO A 92 8.641 5.076 8.686 1.00 0.00 O ATOM 1405 CB PRO A 92 6.096 4.595 9.515 1.00 0.00 C ATOM 1406 CG PRO A 92 5.645 4.149 8.159 1.00 0.00 C ATOM 1407 CD PRO A 92 5.228 5.387 7.397 1.00 0.00 C ATOM 0 HA PRO A 92 6.484 6.662 10.218 1.00 0.00 H new ATOM 0 HB2 PRO A 92 6.916 3.978 9.882 1.00 0.00 H new ATOM 0 HB3 PRO A 92 5.290 4.520 10.244 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.449 3.629 7.638 1.00 0.00 H new ATOM 0 HG3 PRO A 92 4.813 3.449 8.241 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.726 5.447 6.429 1.00 0.00 H new ATOM 0 HD3 PRO A 92 4.155 5.395 7.205 1.00 0.00 H new ATOM 1415 N ASP A 93 8.546 7.320 8.828 1.00 0.00 N ATOM 1416 CA ASP A 93 9.947 7.516 8.458 1.00 0.00 C ATOM 1417 C ASP A 93 10.284 9.001 8.368 1.00 0.00 C ATOM 1418 O ASP A 93 11.277 9.457 8.937 1.00 0.00 O ATOM 1419 CB ASP A 93 10.257 6.835 7.122 1.00 0.00 C ATOM 1420 CG ASP A 93 9.335 7.290 6.012 1.00 0.00 C ATOM 1421 OD1 ASP A 93 8.105 7.134 6.161 1.00 0.00 O ATOM 1422 OD2 ASP A 93 9.842 7.801 4.991 1.00 0.00 O ATOM 0 H ASP A 93 8.035 8.183 9.011 1.00 0.00 H new ATOM 0 HA ASP A 93 10.561 7.063 9.237 1.00 0.00 H new ATOM 0 HB2 ASP A 93 11.289 7.045 6.842 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.172 5.755 7.240 1.00 0.00 H new ATOM 1427 N GLY A 94 9.453 9.751 7.651 1.00 0.00 N ATOM 1428 CA GLY A 94 9.681 11.175 7.500 1.00 0.00 C ATOM 1429 C GLY A 94 8.504 11.998 7.982 1.00 0.00 C ATOM 1430 O GLY A 94 8.044 11.831 9.111 1.00 0.00 O ATOM 0 H GLY A 94 8.625 9.397 7.172 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.573 11.459 8.058 1.00 0.00 H new ATOM 0 HA3 GLY A 94 9.875 11.401 6.451 1.00 0.00 H new ATOM 1434 N GLY A 95 8.013 12.887 7.127 1.00 0.00 N ATOM 1435 CA GLY A 95 6.886 13.720 7.497 1.00 0.00 C ATOM 1436 C GLY A 95 5.956 14.013 6.333 1.00 0.00 C ATOM 1437 O GLY A 95 5.095 14.887 6.432 1.00 0.00 O ATOM 0 H GLY A 95 8.374 13.045 6.186 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.323 13.228 8.290 1.00 0.00 H new ATOM 0 HA3 GLY A 95 7.255 14.661 7.905 1.00 0.00 H new ATOM 1441 N TYR A 96 6.122 13.285 5.230 1.00 0.00 N ATOM 1442 CA TYR A 96 5.274 13.486 4.058 1.00 0.00 C ATOM 1443 C TYR A 96 3.807 13.319 4.429 1.00 0.00 C ATOM 1444 O TYR A 96 3.487 12.948 5.559 1.00 0.00 O ATOM 1445 CB TYR A 96 5.661 12.523 2.931 1.00 0.00 C ATOM 1446 CG TYR A 96 5.759 11.073 3.353 1.00 0.00 C ATOM 1447 CD1 TYR A 96 6.919 10.577 3.938 1.00 0.00 C ATOM 1448 CD2 TYR A 96 4.698 10.197 3.157 1.00 0.00 C ATOM 1449 CE1 TYR A 96 7.014 9.253 4.319 1.00 0.00 C ATOM 1450 CE2 TYR A 96 4.787 8.870 3.537 1.00 0.00 C ATOM 1451 CZ TYR A 96 5.946 8.404 4.119 1.00 0.00 C ATOM 1452 OH TYR A 96 6.040 7.087 4.504 1.00 0.00 O ATOM 0 H TYR A 96 6.829 12.558 5.124 1.00 0.00 H new ATOM 0 HA TYR A 96 5.425 14.503 3.697 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.926 12.607 2.130 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.620 12.834 2.517 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.759 11.237 4.097 1.00 0.00 H new ATOM 0 HD2 TYR A 96 3.789 10.559 2.700 1.00 0.00 H new ATOM 0 HE1 TYR A 96 7.922 8.884 4.772 1.00 0.00 H new ATOM 0 HE2 TYR A 96 3.953 8.203 3.378 1.00 0.00 H new ATOM 0 HH TYR A 96 6.973 6.874 4.718 1.00 0.00 H new ATOM 1462 N ILE A 97 2.912 13.617 3.493 1.00 0.00 N ATOM 1463 CA ILE A 97 1.483 13.512 3.765 1.00 0.00 C ATOM 1464 C ILE A 97 0.672 13.071 2.508 1.00 0.00 C ATOM 1465 O ILE A 97 -0.160 13.919 2.186 1.00 0.00 O ATOM 1466 CB ILE A 97 0.930 14.863 4.234 1.00 0.00 C ATOM 1467 CG1 ILE A 97 1.352 15.947 3.246 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.420 15.187 5.638 1.00 0.00 C ATOM 1469 CD1 ILE A 97 0.282 16.980 2.969 1.00 0.00 C ATOM 0 H ILE A 97 3.146 13.929 2.551 1.00 0.00 H new ATOM 0 HA ILE A 97 1.371 12.755 4.541 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.158 14.815 4.269 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.238 16.451 3.633 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.639 15.475 2.306 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.016 16.150 5.951 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.087 14.412 6.328 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.509 15.232 5.642 1.00 0.00 H new ATOM 0 HD11 ILE A 97 0.661 17.714 2.258 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.597 16.490 2.551 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.011 17.481 3.898 1.00 0.00 H new ATOM 1481 N PRO A 98 0.208 11.796 2.581 1.00 0.00 N ATOM 1482 CA PRO A 98 0.682 10.407 2.889 1.00 0.00 C ATOM 1483 C PRO A 98 1.176 9.734 1.615 1.00 0.00 C ATOM 1484 O PRO A 98 0.896 10.221 0.517 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.549 9.687 3.405 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.013 10.688 4.321 1.00 0.00 C ATOM 1487 CD PRO A 98 0.022 11.740 4.105 1.00 0.00 C ATOM 0 HA PRO A 98 1.503 10.397 3.606 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.271 9.466 2.619 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.312 8.742 3.895 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.018 11.037 4.082 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.036 10.332 5.351 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.303 12.703 4.500 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.955 11.487 4.609 1.00 0.00 H new ATOM 1495 N ARG A 99 1.917 8.631 1.759 1.00 0.00 N ATOM 1496 CA ARG A 99 2.467 7.919 0.613 1.00 0.00 C ATOM 1497 C ARG A 99 2.109 6.434 0.637 1.00 0.00 C ATOM 1498 O ARG A 99 1.250 5.996 1.401 1.00 0.00 O ATOM 1499 CB ARG A 99 3.983 8.097 0.566 1.00 0.00 C ATOM 1500 CG ARG A 99 4.444 9.169 -0.402 1.00 0.00 C ATOM 1501 CD ARG A 99 3.729 10.492 -0.182 1.00 0.00 C ATOM 1502 NE ARG A 99 2.704 10.731 -1.196 1.00 0.00 N ATOM 1503 CZ ARG A 99 2.253 11.940 -1.527 1.00 0.00 C ATOM 1504 NH1 ARG A 99 2.727 13.022 -0.922 1.00 0.00 N ATOM 1505 NH2 ARG A 99 1.325 12.067 -2.464 1.00 0.00 N ATOM 0 H ARG A 99 2.147 8.215 2.662 1.00 0.00 H new ATOM 0 HA ARG A 99 2.023 8.346 -0.286 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.341 8.345 1.565 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.442 7.148 0.288 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.518 9.317 -0.292 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.272 8.831 -1.424 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.270 10.497 0.807 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.455 11.305 -0.201 1.00 0.00 H new ATOM 0 HE ARG A 99 2.310 9.924 -1.679 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.441 12.931 -0.199 1.00 0.00 H new ATOM 0 HH12 ARG A 99 2.378 13.945 -1.180 1.00 0.00 H new ATOM 0 HH21 ARG A 99 0.956 11.239 -2.932 1.00 0.00 H new ATOM 0 HH22 ARG A 99 0.980 12.993 -2.718 1.00 0.00 H new ATOM 1519 N ILE A 100 2.772 5.675 -0.232 1.00 0.00 N ATOM 1520 CA ILE A 100 2.535 4.240 -0.361 1.00 0.00 C ATOM 1521 C ILE A 100 3.435 3.415 0.556 1.00 0.00 C ATOM 1522 O ILE A 100 4.545 3.827 0.895 1.00 0.00 O ATOM 1523 CB ILE A 100 2.759 3.775 -1.813 1.00 0.00 C ATOM 1524 CG1 ILE A 100 1.918 4.611 -2.780 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.438 2.294 -1.960 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.718 5.665 -3.516 1.00 0.00 C ATOM 0 H ILE A 100 3.486 6.036 -0.864 1.00 0.00 H new ATOM 0 HA ILE A 100 1.498 4.077 -0.068 1.00 0.00 H new ATOM 0 HB ILE A 100 3.810 3.920 -2.061 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.448 3.949 -3.507 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.115 5.096 -2.225 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.603 1.987 -2.993 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.085 1.714 -1.301 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.396 2.119 -1.691 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.060 6.220 -4.184 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.166 6.350 -2.796 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.504 5.184 -4.098 1.00 0.00 H new ATOM 1538 N LEU A 101 2.943 2.238 0.946 1.00 0.00 N ATOM 1539 CA LEU A 101 3.691 1.339 1.819 1.00 0.00 C ATOM 1540 C LEU A 101 3.118 -0.076 1.776 1.00 0.00 C ATOM 1541 O LEU A 101 1.901 -0.265 1.805 1.00 0.00 O ATOM 1542 CB LEU A 101 3.681 1.847 3.266 1.00 0.00 C ATOM 1543 CG LEU A 101 2.620 2.905 3.598 1.00 0.00 C ATOM 1544 CD1 LEU A 101 1.973 2.591 4.931 1.00 0.00 C ATOM 1545 CD2 LEU A 101 3.229 4.300 3.635 1.00 0.00 C ATOM 0 H LEU A 101 2.027 1.886 0.669 1.00 0.00 H new ATOM 0 HA LEU A 101 4.718 1.315 1.455 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.536 0.994 3.929 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.663 2.262 3.492 1.00 0.00 H new ATOM 0 HG LEU A 101 1.863 2.883 2.814 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.222 3.347 5.158 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.498 1.611 4.883 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.733 2.588 5.713 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.454 5.029 3.872 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.008 4.337 4.397 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.662 4.534 2.662 1.00 0.00 H new ATOM 1557 N PHE A 102 4.003 -1.069 1.728 1.00 0.00 N ATOM 1558 CA PHE A 102 3.583 -2.465 1.706 1.00 0.00 C ATOM 1559 C PHE A 102 3.360 -2.964 3.130 1.00 0.00 C ATOM 1560 O PHE A 102 4.095 -2.589 4.049 1.00 0.00 O ATOM 1561 CB PHE A 102 4.632 -3.329 1.003 1.00 0.00 C ATOM 1562 CG PHE A 102 4.175 -3.874 -0.319 1.00 0.00 C ATOM 1563 CD1 PHE A 102 3.229 -4.884 -0.378 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.695 -3.375 -1.505 1.00 0.00 C ATOM 1565 CE1 PHE A 102 2.809 -5.389 -1.595 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.279 -3.876 -2.723 1.00 0.00 C ATOM 1567 CZ PHE A 102 3.335 -4.883 -2.767 1.00 0.00 C ATOM 0 H PHE A 102 5.013 -0.932 1.704 1.00 0.00 H new ATOM 0 HA PHE A 102 2.647 -2.539 1.153 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.534 -2.737 0.850 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.902 -4.160 1.655 1.00 0.00 H new ATOM 0 HD1 PHE A 102 2.815 -5.282 0.537 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.433 -2.587 -1.475 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.071 -6.177 -1.629 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.691 -3.481 -3.640 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.008 -5.275 -3.719 1.00 0.00 H new ATOM 1577 N LEU A 103 2.341 -3.797 3.325 1.00 0.00 N ATOM 1578 CA LEU A 103 2.050 -4.305 4.659 1.00 0.00 C ATOM 1579 C LEU A 103 1.652 -5.777 4.649 1.00 0.00 C ATOM 1580 O LEU A 103 1.174 -6.302 3.642 1.00 0.00 O ATOM 1581 CB LEU A 103 0.959 -3.458 5.312 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.471 -3.771 4.894 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.432 -2.784 5.536 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.597 -3.743 3.380 1.00 0.00 C ATOM 0 H LEU A 103 1.715 -4.128 2.591 1.00 0.00 H new ATOM 0 HA LEU A 103 2.967 -4.231 5.244 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.034 -3.576 6.393 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.160 -2.410 5.091 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.728 -4.773 5.237 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.452 -3.018 5.230 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.354 -2.853 6.621 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.181 -1.772 5.218 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.625 -3.969 3.096 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.327 -2.754 3.011 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.071 -4.487 2.945 1.00 0.00 H new ATOM 1596 N ASP A 104 1.860 -6.430 5.790 1.00 0.00 N ATOM 1597 CA ASP A 104 1.537 -7.842 5.944 1.00 0.00 C ATOM 1598 C ASP A 104 0.032 -8.077 5.852 1.00 0.00 C ATOM 1599 O ASP A 104 -0.766 -7.226 6.265 1.00 0.00 O ATOM 1600 CB ASP A 104 2.062 -8.362 7.283 1.00 0.00 C ATOM 1601 CG ASP A 104 3.547 -8.670 7.239 1.00 0.00 C ATOM 1602 OD1 ASP A 104 4.317 -7.808 6.762 1.00 0.00 O ATOM 1603 OD2 ASP A 104 3.939 -9.770 7.681 1.00 0.00 O ATOM 0 H ASP A 104 2.254 -5.998 6.626 1.00 0.00 H new ATOM 0 HA ASP A 104 2.019 -8.386 5.132 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.870 -7.621 8.059 1.00 0.00 H new ATOM 0 HB3 ASP A 104 1.514 -9.263 7.560 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.370 -9.247 5.309 1.00 0.00 N ATOM 1609 CA PRO A 105 -1.783 -9.616 5.154 1.00 0.00 C ATOM 1610 C PRO A 105 -2.549 -9.549 6.468 1.00 0.00 C ATOM 1611 O PRO A 105 -2.596 -10.522 7.220 1.00 0.00 O ATOM 1612 CB PRO A 105 -1.730 -11.062 4.651 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.381 -11.212 4.038 1.00 0.00 C ATOM 1614 CD PRO A 105 0.532 -10.303 4.812 1.00 0.00 C ATOM 0 HA PRO A 105 -2.302 -8.934 4.481 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -1.872 -11.769 5.468 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.517 -11.255 3.922 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.040 -12.246 4.094 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.400 -10.939 2.983 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.022 -10.830 5.631 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.320 -9.893 4.180 1.00 0.00 H new ATOM 1622 N SER A 106 -3.150 -8.395 6.730 1.00 0.00 N ATOM 1623 CA SER A 106 -3.925 -8.175 7.949 1.00 0.00 C ATOM 1624 C SER A 106 -4.096 -6.683 8.199 1.00 0.00 C ATOM 1625 O SER A 106 -5.086 -6.246 8.784 1.00 0.00 O ATOM 1626 CB SER A 106 -3.243 -8.823 9.160 1.00 0.00 C ATOM 1627 OG SER A 106 -3.747 -10.128 9.389 1.00 0.00 O ATOM 0 H SER A 106 -3.116 -7.587 6.108 1.00 0.00 H new ATOM 0 HA SER A 106 -4.903 -8.636 7.813 1.00 0.00 H new ATOM 0 HB2 SER A 106 -2.167 -8.869 8.994 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.403 -8.207 10.045 1.00 0.00 H new ATOM 0 HG SER A 106 -3.625 -10.672 8.583 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.115 -5.906 7.752 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.161 -4.473 7.934 1.00 0.00 C ATOM 1635 C GLY A 107 -2.043 -3.980 8.832 1.00 0.00 C ATOM 1636 O GLY A 107 -2.255 -3.100 9.665 1.00 0.00 O ATOM 0 H GLY A 107 -2.287 -6.248 7.265 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.090 -3.982 6.964 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.122 -4.193 8.364 1.00 0.00 H new ATOM 1640 N LYS A 108 -0.851 -4.557 8.677 1.00 0.00 N ATOM 1641 CA LYS A 108 0.286 -4.162 9.507 1.00 0.00 C ATOM 1642 C LYS A 108 1.518 -3.819 8.672 1.00 0.00 C ATOM 1643 O LYS A 108 2.378 -4.670 8.442 1.00 0.00 O ATOM 1644 CB LYS A 108 0.624 -5.280 10.499 1.00 0.00 C ATOM 1645 CG LYS A 108 0.575 -4.838 11.951 1.00 0.00 C ATOM 1646 CD LYS A 108 1.788 -5.330 12.726 1.00 0.00 C ATOM 1647 CE LYS A 108 1.539 -5.300 14.225 1.00 0.00 C ATOM 1648 NZ LYS A 108 0.488 -6.271 14.634 1.00 0.00 N ATOM 0 H LYS A 108 -0.649 -5.288 7.995 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.004 -3.262 10.049 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.073 -6.105 10.355 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.620 -5.662 10.277 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.528 -3.750 12.000 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.334 -5.218 12.417 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.031 -6.346 12.417 1.00 0.00 H new ATOM 0 HD3 LYS A 108 2.651 -4.709 12.487 1.00 0.00 H new ATOM 0 HE2 LYS A 108 2.466 -5.526 14.751 1.00 0.00 H new ATOM 0 HE3 LYS A 108 1.240 -4.295 14.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.588 -6.484 15.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.451 -5.861 14.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 0.592 -7.148 14.084 1.00 0.00 H new ATOM 1662 N VAL A 109 1.606 -2.566 8.226 1.00 0.00 N ATOM 1663 CA VAL A 109 2.728 -2.112 7.432 1.00 0.00 C ATOM 1664 C VAL A 109 4.035 -2.239 8.185 1.00 0.00 C ATOM 1665 O VAL A 109 4.095 -2.076 9.403 1.00 0.00 O ATOM 1666 CB VAL A 109 2.538 -0.646 7.021 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.699 -0.186 6.168 1.00 0.00 C ATOM 1668 CG2 VAL A 109 1.215 -0.455 6.291 1.00 0.00 C ATOM 0 H VAL A 109 0.904 -1.849 8.407 1.00 0.00 H new ATOM 0 HA VAL A 109 2.768 -2.747 6.547 1.00 0.00 H new ATOM 0 HB VAL A 109 2.511 -0.034 7.923 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.551 0.856 5.884 1.00 0.00 H new ATOM 0 HG12 VAL A 109 4.626 -0.280 6.734 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.758 -0.802 5.271 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.103 0.592 6.010 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.201 -1.075 5.395 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.393 -0.745 6.946 1.00 0.00 H new ATOM 1678 N HIS A 110 5.083 -2.511 7.430 1.00 0.00 N ATOM 1679 CA HIS A 110 6.412 -2.642 7.984 1.00 0.00 C ATOM 1680 C HIS A 110 7.397 -1.902 7.092 1.00 0.00 C ATOM 1681 O HIS A 110 7.349 -2.037 5.869 1.00 0.00 O ATOM 1682 CB HIS A 110 6.807 -4.118 8.101 1.00 0.00 C ATOM 1683 CG HIS A 110 6.901 -4.601 9.516 1.00 0.00 C ATOM 1684 ND1 HIS A 110 8.085 -4.639 10.221 1.00 0.00 N ATOM 1685 CD2 HIS A 110 5.949 -5.067 10.359 1.00 0.00 C ATOM 1686 CE1 HIS A 110 7.858 -5.110 11.435 1.00 0.00 C ATOM 1687 NE2 HIS A 110 6.569 -5.377 11.543 1.00 0.00 N ATOM 0 H HIS A 110 5.035 -2.646 6.420 1.00 0.00 H new ATOM 0 HA HIS A 110 6.428 -2.210 8.984 1.00 0.00 H new ATOM 0 HB2 HIS A 110 6.077 -4.725 7.566 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.768 -4.269 7.609 1.00 0.00 H new ATOM 0 HD2 HIS A 110 4.897 -5.175 10.140 1.00 0.00 H new ATOM 0 HE1 HIS A 110 8.600 -5.252 12.207 1.00 0.00 H new ATOM 0 HE2 HIS A 110 6.109 -5.753 12.372 1.00 0.00 H new ATOM 1696 N PRO A 111 8.299 -1.104 7.677 1.00 0.00 N ATOM 1697 CA PRO A 111 9.287 -0.347 6.907 1.00 0.00 C ATOM 1698 C PRO A 111 10.317 -1.260 6.252 1.00 0.00 C ATOM 1699 O PRO A 111 11.509 -0.952 6.225 1.00 0.00 O ATOM 1700 CB PRO A 111 9.950 0.548 7.957 1.00 0.00 C ATOM 1701 CG PRO A 111 9.744 -0.166 9.247 1.00 0.00 C ATOM 1702 CD PRO A 111 8.426 -0.874 9.125 1.00 0.00 C ATOM 0 HA PRO A 111 8.833 0.210 6.087 1.00 0.00 H new ATOM 0 HB2 PRO A 111 11.010 0.687 7.746 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.496 1.539 7.976 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.551 -0.874 9.434 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.735 0.534 10.083 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.419 -1.810 9.683 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.606 -0.267 9.510 1.00 0.00 H new ATOM 1710 N GLU A 112 9.845 -2.387 5.725 1.00 0.00 N ATOM 1711 CA GLU A 112 10.724 -3.348 5.069 1.00 0.00 C ATOM 1712 C GLU A 112 10.522 -3.326 3.559 1.00 0.00 C ATOM 1713 O GLU A 112 11.478 -3.453 2.793 1.00 0.00 O ATOM 1714 CB GLU A 112 10.467 -4.755 5.611 1.00 0.00 C ATOM 1715 CG GLU A 112 11.594 -5.733 5.322 1.00 0.00 C ATOM 1716 CD GLU A 112 11.328 -6.580 4.093 1.00 0.00 C ATOM 1717 OE1 GLU A 112 10.157 -6.952 3.871 1.00 0.00 O ATOM 1718 OE2 GLU A 112 12.292 -6.874 3.353 1.00 0.00 O ATOM 0 H GLU A 112 8.861 -2.656 5.740 1.00 0.00 H new ATOM 0 HA GLU A 112 11.755 -3.067 5.282 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.314 -4.698 6.689 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.544 -5.139 5.178 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.523 -5.181 5.184 1.00 0.00 H new ATOM 0 HG3 GLU A 112 11.735 -6.384 6.184 1.00 0.00 H new ATOM 1725 N ILE A 113 9.272 -3.166 3.139 1.00 0.00 N ATOM 1726 CA ILE A 113 8.944 -3.126 1.720 1.00 0.00 C ATOM 1727 C ILE A 113 8.575 -1.713 1.282 1.00 0.00 C ATOM 1728 O ILE A 113 7.398 -1.347 1.247 1.00 0.00 O ATOM 1729 CB ILE A 113 7.787 -4.084 1.386 1.00 0.00 C ATOM 1730 CG1 ILE A 113 8.104 -5.494 1.887 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.520 -4.097 -0.114 1.00 0.00 C ATOM 1732 CD1 ILE A 113 6.898 -6.231 2.424 1.00 0.00 C ATOM 0 H ILE A 113 8.470 -3.062 3.761 1.00 0.00 H new ATOM 0 HA ILE A 113 9.833 -3.446 1.177 1.00 0.00 H new ATOM 0 HB ILE A 113 6.888 -3.731 1.891 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.538 -6.071 1.071 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.859 -5.431 2.670 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.699 -4.780 -0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.254 -3.093 -0.445 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.416 -4.427 -0.640 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.198 -7.223 2.761 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.475 -5.676 3.261 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.150 -6.326 1.637 1.00 0.00 H new ATOM 1744 N ILE A 114 9.592 -0.925 0.953 1.00 0.00 N ATOM 1745 CA ILE A 114 9.393 0.450 0.516 1.00 0.00 C ATOM 1746 C ILE A 114 9.903 0.649 -0.906 1.00 0.00 C ATOM 1747 O ILE A 114 10.286 -0.308 -1.581 1.00 0.00 O ATOM 1748 CB ILE A 114 10.119 1.441 1.447 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.634 1.175 1.428 1.00 0.00 C ATOM 1750 CG2 ILE A 114 9.562 1.356 2.861 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.105 0.183 2.473 1.00 0.00 C ATOM 0 H ILE A 114 10.569 -1.218 0.981 1.00 0.00 H new ATOM 0 HA ILE A 114 8.321 0.644 0.549 1.00 0.00 H new ATOM 0 HB ILE A 114 9.947 2.454 1.084 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.914 0.806 0.441 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.159 2.119 1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.088 2.063 3.502 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.499 1.598 2.849 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.699 0.346 3.246 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.184 0.053 2.391 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.859 0.557 3.467 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.611 -0.775 2.314 1.00 0.00 H new ATOM 1763 N ASN A 115 9.922 1.900 -1.350 1.00 0.00 N ATOM 1764 CA ASN A 115 10.402 2.232 -2.683 1.00 0.00 C ATOM 1765 C ASN A 115 11.926 2.240 -2.707 1.00 0.00 C ATOM 1766 O ASN A 115 12.550 3.301 -2.695 1.00 0.00 O ATOM 1767 CB ASN A 115 9.867 3.597 -3.113 1.00 0.00 C ATOM 1768 CG ASN A 115 10.338 3.998 -4.497 1.00 0.00 C ATOM 1769 OD1 ASN A 115 10.803 3.164 -5.274 1.00 0.00 O ATOM 1770 ND2 ASN A 115 10.218 5.284 -4.812 1.00 0.00 N ATOM 0 H ASN A 115 9.609 2.702 -0.803 1.00 0.00 H new ATOM 0 HA ASN A 115 10.041 1.476 -3.381 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.777 3.578 -3.095 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.184 4.351 -2.393 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.517 5.614 -5.729 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.827 5.940 -4.136 1.00 0.00 H new ATOM 1777 N GLU A 116 12.522 1.054 -2.737 1.00 0.00 N ATOM 1778 CA GLU A 116 13.976 0.932 -2.758 1.00 0.00 C ATOM 1779 C GLU A 116 14.577 1.745 -3.902 1.00 0.00 C ATOM 1780 O GLU A 116 15.740 2.147 -3.846 1.00 0.00 O ATOM 1781 CB GLU A 116 14.382 -0.536 -2.884 1.00 0.00 C ATOM 1782 CG GLU A 116 14.493 -1.245 -1.545 1.00 0.00 C ATOM 1783 CD GLU A 116 15.710 -0.809 -0.755 1.00 0.00 C ATOM 1784 OE1 GLU A 116 15.662 0.278 -0.142 1.00 0.00 O ATOM 1785 OE2 GLU A 116 16.713 -1.555 -0.748 1.00 0.00 O ATOM 0 H GLU A 116 12.023 0.164 -2.747 1.00 0.00 H new ATOM 0 HA GLU A 116 14.363 1.328 -1.819 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.651 -1.056 -3.503 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.340 -0.598 -3.401 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.595 -1.050 -0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.538 -2.321 -1.710 1.00 0.00 H new ATOM 1792 N ASN A 117 13.776 1.989 -4.935 1.00 0.00 N ATOM 1793 CA ASN A 117 14.228 2.762 -6.085 1.00 0.00 C ATOM 1794 C ASN A 117 14.056 4.263 -5.848 1.00 0.00 C ATOM 1795 O ASN A 117 14.446 5.077 -6.683 1.00 0.00 O ATOM 1796 CB ASN A 117 13.457 2.342 -7.338 1.00 0.00 C ATOM 1797 CG ASN A 117 14.322 2.367 -8.584 1.00 0.00 C ATOM 1798 OD1 ASN A 117 14.933 1.363 -8.949 1.00 0.00 O ATOM 1799 ND2 ASN A 117 14.376 3.518 -9.244 1.00 0.00 N ATOM 0 H ASN A 117 12.812 1.663 -4.998 1.00 0.00 H new ATOM 0 HA ASN A 117 15.289 2.560 -6.228 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.058 1.338 -7.196 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.605 3.007 -7.477 1.00 0.00 H new ATOM 0 HD21 ASN A 117 14.941 3.595 -10.090 1.00 0.00 H new ATOM 0 HD22 ASN A 117 13.853 4.325 -8.905 1.00 0.00 H new ATOM 1806 N GLY A 118 13.470 4.625 -4.707 1.00 0.00 N ATOM 1807 CA GLY A 118 13.265 6.028 -4.396 1.00 0.00 C ATOM 1808 C GLY A 118 14.529 6.699 -3.898 1.00 0.00 C ATOM 1809 O GLY A 118 15.633 6.206 -4.127 1.00 0.00 O ATOM 0 H GLY A 118 13.136 3.974 -3.997 1.00 0.00 H new ATOM 0 HA2 GLY A 118 12.908 6.546 -5.286 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.486 6.120 -3.639 1.00 0.00 H new ATOM 1813 N ASN A 119 14.369 7.828 -3.213 1.00 0.00 N ATOM 1814 CA ASN A 119 15.509 8.565 -2.680 1.00 0.00 C ATOM 1815 C ASN A 119 15.717 8.246 -1.201 1.00 0.00 C ATOM 1816 O ASN A 119 14.786 7.815 -0.517 1.00 0.00 O ATOM 1817 CB ASN A 119 15.307 10.071 -2.872 1.00 0.00 C ATOM 1818 CG ASN A 119 14.147 10.610 -2.056 1.00 0.00 C ATOM 1819 OD1 ASN A 119 14.223 10.698 -0.831 1.00 0.00 O ATOM 1820 ND2 ASN A 119 13.064 10.974 -2.733 1.00 0.00 N ATOM 0 H ASN A 119 13.462 8.251 -3.015 1.00 0.00 H new ATOM 0 HA ASN A 119 16.400 8.257 -3.227 1.00 0.00 H new ATOM 0 HB2 ASN A 119 16.220 10.596 -2.590 1.00 0.00 H new ATOM 0 HB3 ASN A 119 15.132 10.279 -3.928 1.00 0.00 H new ATOM 0 HD21 ASN A 119 12.253 11.343 -2.237 1.00 0.00 H new ATOM 0 HD22 ASN A 119 13.043 10.884 -3.749 1.00 0.00 H new ATOM 1827 N PRO A 120 16.945 8.447 -0.686 1.00 0.00 N ATOM 1828 CA PRO A 120 17.280 8.175 0.715 1.00 0.00 C ATOM 1829 C PRO A 120 16.744 9.246 1.664 1.00 0.00 C ATOM 1830 O PRO A 120 17.493 9.815 2.459 1.00 0.00 O ATOM 1831 CB PRO A 120 18.820 8.168 0.731 1.00 0.00 C ATOM 1832 CG PRO A 120 19.249 8.290 -0.697 1.00 0.00 C ATOM 1833 CD PRO A 120 18.111 8.943 -1.424 1.00 0.00 C ATOM 0 HA PRO A 120 16.835 7.241 1.058 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.208 8.995 1.327 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.201 7.249 1.176 1.00 0.00 H new ATOM 0 HG2 PRO A 120 20.157 8.887 -0.780 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.471 7.311 -1.121 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.179 10.030 -1.394 1.00 0.00 H new ATOM 0 HD3 PRO A 120 18.080 8.655 -2.475 1.00 0.00 H new ATOM 1841 N SER A 121 15.446 9.515 1.576 1.00 0.00 N ATOM 1842 CA SER A 121 14.807 10.514 2.425 1.00 0.00 C ATOM 1843 C SER A 121 13.331 10.622 2.077 1.00 0.00 C ATOM 1844 O SER A 121 12.768 11.716 2.036 1.00 0.00 O ATOM 1845 CB SER A 121 15.480 11.878 2.252 1.00 0.00 C ATOM 1846 OG SER A 121 16.599 12.009 3.112 1.00 0.00 O ATOM 0 H SER A 121 14.813 9.053 0.923 1.00 0.00 H new ATOM 0 HA SER A 121 14.912 10.202 3.464 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.797 12.001 1.217 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.762 12.670 2.462 1.00 0.00 H new ATOM 0 HG SER A 121 17.046 11.141 3.202 1.00 0.00 H new ATOM 1852 N TYR A 122 12.714 9.479 1.806 1.00 0.00 N ATOM 1853 CA TYR A 122 11.309 9.446 1.440 1.00 0.00 C ATOM 1854 C TYR A 122 10.814 8.012 1.293 1.00 0.00 C ATOM 1855 O TYR A 122 9.796 7.635 1.873 1.00 0.00 O ATOM 1856 CB TYR A 122 11.108 10.208 0.132 1.00 0.00 C ATOM 1857 CG TYR A 122 10.247 11.441 0.265 1.00 0.00 C ATOM 1858 CD1 TYR A 122 8.878 11.338 0.469 1.00 0.00 C ATOM 1859 CD2 TYR A 122 10.806 12.709 0.182 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.089 12.466 0.584 1.00 0.00 C ATOM 1861 CE2 TYR A 122 10.025 13.842 0.297 1.00 0.00 C ATOM 1862 CZ TYR A 122 8.666 13.716 0.499 1.00 0.00 C ATOM 1863 OH TYR A 122 7.884 14.840 0.615 1.00 0.00 O ATOM 0 H TYR A 122 13.166 8.565 1.833 1.00 0.00 H new ATOM 0 HA TYR A 122 10.731 9.920 2.233 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.082 10.499 -0.261 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.656 9.539 -0.600 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.423 10.361 0.539 1.00 0.00 H new ATOM 0 HD2 TYR A 122 11.870 12.811 0.025 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.025 12.370 0.740 1.00 0.00 H new ATOM 0 HE2 TYR A 122 10.475 14.821 0.229 1.00 0.00 H new ATOM 0 HH TYR A 122 8.446 15.639 0.533 1.00 0.00 H new ATOM 1873 N LYS A 123 11.543 7.220 0.512 1.00 0.00 N ATOM 1874 CA LYS A 123 11.189 5.818 0.277 1.00 0.00 C ATOM 1875 C LYS A 123 9.705 5.674 -0.075 1.00 0.00 C ATOM 1876 O LYS A 123 9.334 5.677 -1.245 1.00 0.00 O ATOM 1877 CB LYS A 123 11.529 4.974 1.511 1.00 0.00 C ATOM 1878 CG LYS A 123 12.992 4.560 1.594 1.00 0.00 C ATOM 1879 CD LYS A 123 13.437 3.793 0.356 1.00 0.00 C ATOM 1880 CE LYS A 123 14.679 4.411 -0.263 1.00 0.00 C ATOM 1881 NZ LYS A 123 14.341 5.391 -1.331 1.00 0.00 N ATOM 0 H LYS A 123 12.387 7.525 0.028 1.00 0.00 H new ATOM 0 HA LYS A 123 11.772 5.458 -0.571 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.270 5.538 2.407 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.908 4.078 1.508 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.614 5.447 1.714 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.144 3.941 2.478 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.639 2.756 0.622 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.630 3.783 -0.377 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.262 4.907 0.513 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.307 3.623 -0.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 15.182 5.572 -1.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 13.581 5.006 -1.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.023 6.281 -0.897 1.00 0.00 H new ATOM 1895 N TYR A 124 8.866 5.559 0.955 1.00 0.00 N ATOM 1896 CA TYR A 124 7.415 5.424 0.796 1.00 0.00 C ATOM 1897 C TYR A 124 6.888 6.217 -0.405 1.00 0.00 C ATOM 1898 O TYR A 124 5.928 5.804 -1.056 1.00 0.00 O ATOM 1899 CB TYR A 124 6.729 5.882 2.077 1.00 0.00 C ATOM 1900 CG TYR A 124 7.093 5.025 3.266 1.00 0.00 C ATOM 1901 CD1 TYR A 124 6.355 3.896 3.575 1.00 0.00 C ATOM 1902 CD2 TYR A 124 8.179 5.339 4.072 1.00 0.00 C ATOM 1903 CE1 TYR A 124 6.681 3.100 4.656 1.00 0.00 C ATOM 1904 CE2 TYR A 124 8.516 4.548 5.154 1.00 0.00 C ATOM 1905 CZ TYR A 124 7.763 3.431 5.443 1.00 0.00 C ATOM 1906 OH TYR A 124 8.094 2.640 6.519 1.00 0.00 O ATOM 0 H TYR A 124 9.174 5.557 1.928 1.00 0.00 H new ATOM 0 HA TYR A 124 7.189 4.375 0.605 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.003 6.917 2.282 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.649 5.860 1.935 1.00 0.00 H new ATOM 0 HD1 TYR A 124 5.508 3.632 2.959 1.00 0.00 H new ATOM 0 HD2 TYR A 124 8.770 6.215 3.850 1.00 0.00 H new ATOM 0 HE1 TYR A 124 6.092 2.224 4.883 1.00 0.00 H new ATOM 0 HE2 TYR A 124 9.365 4.804 5.770 1.00 0.00 H new ATOM 0 HH TYR A 124 7.465 1.891 6.580 1.00 0.00 H new ATOM 1916 N PHE A 125 7.526 7.350 -0.696 1.00 0.00 N ATOM 1917 CA PHE A 125 7.122 8.184 -1.823 1.00 0.00 C ATOM 1918 C PHE A 125 7.589 7.573 -3.141 1.00 0.00 C ATOM 1919 O PHE A 125 8.774 7.295 -3.325 1.00 0.00 O ATOM 1920 CB PHE A 125 7.686 9.602 -1.666 1.00 0.00 C ATOM 1921 CG PHE A 125 7.562 10.449 -2.904 1.00 0.00 C ATOM 1922 CD1 PHE A 125 6.331 10.943 -3.301 1.00 0.00 C ATOM 1923 CD2 PHE A 125 8.679 10.749 -3.667 1.00 0.00 C ATOM 1924 CE1 PHE A 125 6.215 11.722 -4.437 1.00 0.00 C ATOM 1925 CE2 PHE A 125 8.570 11.529 -4.803 1.00 0.00 C ATOM 1926 CZ PHE A 125 7.336 12.015 -5.189 1.00 0.00 C ATOM 0 H PHE A 125 8.322 7.709 -0.168 1.00 0.00 H new ATOM 0 HA PHE A 125 6.033 8.239 -1.836 1.00 0.00 H new ATOM 0 HB2 PHE A 125 7.170 10.099 -0.845 1.00 0.00 H new ATOM 0 HB3 PHE A 125 8.738 9.535 -1.387 1.00 0.00 H new ATOM 0 HD1 PHE A 125 5.451 10.717 -2.716 1.00 0.00 H new ATOM 0 HD2 PHE A 125 9.646 10.369 -3.371 1.00 0.00 H new ATOM 0 HE1 PHE A 125 5.249 12.101 -4.736 1.00 0.00 H new ATOM 0 HE2 PHE A 125 9.448 11.758 -5.388 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.248 12.623 -6.077 1.00 0.00 H new ATOM 1936 N TYR A 126 6.647 7.373 -4.057 1.00 0.00 N ATOM 1937 CA TYR A 126 6.956 6.801 -5.359 1.00 0.00 C ATOM 1938 C TYR A 126 6.880 7.864 -6.450 1.00 0.00 C ATOM 1939 O TYR A 126 6.600 9.030 -6.173 1.00 0.00 O ATOM 1940 CB TYR A 126 6.000 5.648 -5.671 1.00 0.00 C ATOM 1941 CG TYR A 126 6.260 4.410 -4.841 1.00 0.00 C ATOM 1942 CD1 TYR A 126 5.820 4.326 -3.527 1.00 0.00 C ATOM 1943 CD2 TYR A 126 6.947 3.325 -5.371 1.00 0.00 C ATOM 1944 CE1 TYR A 126 6.056 3.198 -2.764 1.00 0.00 C ATOM 1945 CE2 TYR A 126 7.187 2.192 -4.616 1.00 0.00 C ATOM 1946 CZ TYR A 126 6.740 2.134 -3.314 1.00 0.00 C ATOM 1947 OH TYR A 126 6.978 1.009 -2.557 1.00 0.00 O ATOM 0 H TYR A 126 5.662 7.600 -3.920 1.00 0.00 H new ATOM 0 HA TYR A 126 7.975 6.415 -5.331 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.975 5.980 -5.503 1.00 0.00 H new ATOM 0 HB3 TYR A 126 6.084 5.392 -6.727 1.00 0.00 H new ATOM 0 HD1 TYR A 126 5.284 5.157 -3.093 1.00 0.00 H new ATOM 0 HD2 TYR A 126 7.300 3.367 -6.391 1.00 0.00 H new ATOM 0 HE1 TYR A 126 5.707 3.150 -1.743 1.00 0.00 H new ATOM 0 HE2 TYR A 126 7.722 1.357 -5.044 1.00 0.00 H new ATOM 0 HH TYR A 126 7.470 0.352 -3.093 1.00 0.00 H new ATOM 1957 N VAL A 127 7.130 7.451 -7.688 1.00 0.00 N ATOM 1958 CA VAL A 127 7.098 8.354 -8.830 1.00 0.00 C ATOM 1959 C VAL A 127 7.085 7.565 -10.133 1.00 0.00 C ATOM 1960 O VAL A 127 8.121 7.077 -10.583 1.00 0.00 O ATOM 1961 CB VAL A 127 8.311 9.305 -8.837 1.00 0.00 C ATOM 1962 CG1 VAL A 127 8.093 10.457 -7.870 1.00 0.00 C ATOM 1963 CG2 VAL A 127 9.587 8.550 -8.500 1.00 0.00 C ATOM 0 H VAL A 127 7.359 6.486 -7.926 1.00 0.00 H new ATOM 0 HA VAL A 127 6.187 8.947 -8.744 1.00 0.00 H new ATOM 0 HB VAL A 127 8.417 9.718 -9.840 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.960 11.117 -7.889 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.205 11.016 -8.164 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.958 10.065 -6.862 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.431 9.239 -8.510 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.495 8.104 -7.510 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.751 7.765 -9.238 1.00 0.00 H new ATOM 1973 N SER A 128 5.900 7.444 -10.727 1.00 0.00 N ATOM 1974 CA SER A 128 5.720 6.711 -11.987 1.00 0.00 C ATOM 1975 C SER A 128 5.462 5.226 -11.740 1.00 0.00 C ATOM 1976 O SER A 128 6.024 4.628 -10.822 1.00 0.00 O ATOM 1977 CB SER A 128 6.937 6.881 -12.905 1.00 0.00 C ATOM 1978 OG SER A 128 6.570 6.746 -14.267 1.00 0.00 O ATOM 0 H SER A 128 5.040 7.847 -10.355 1.00 0.00 H new ATOM 0 HA SER A 128 4.845 7.135 -12.480 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.386 7.861 -12.741 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.693 6.138 -12.653 1.00 0.00 H new ATOM 0 HG SER A 128 6.755 5.831 -14.566 1.00 0.00 H new ATOM 1984 N ALA A 129 4.603 4.642 -12.574 1.00 0.00 N ATOM 1985 CA ALA A 129 4.252 3.231 -12.468 1.00 0.00 C ATOM 1986 C ALA A 129 5.459 2.335 -12.725 1.00 0.00 C ATOM 1987 O ALA A 129 5.573 1.251 -12.157 1.00 0.00 O ATOM 1988 CB ALA A 129 3.135 2.897 -13.444 1.00 0.00 C ATOM 0 H ALA A 129 4.135 5.132 -13.337 1.00 0.00 H new ATOM 0 HA ALA A 129 3.909 3.046 -11.450 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.880 1.841 -13.357 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.258 3.502 -13.214 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.465 3.108 -14.461 1.00 0.00 H new ATOM 1994 N GLU A 130 6.355 2.797 -13.594 1.00 0.00 N ATOM 1995 CA GLU A 130 7.556 2.040 -13.944 1.00 0.00 C ATOM 1996 C GLU A 130 8.250 1.474 -12.705 1.00 0.00 C ATOM 1997 O GLU A 130 8.495 0.270 -12.608 1.00 0.00 O ATOM 1998 CB GLU A 130 8.526 2.930 -14.721 1.00 0.00 C ATOM 1999 CG GLU A 130 9.300 2.189 -15.800 1.00 0.00 C ATOM 2000 CD GLU A 130 10.738 2.661 -15.909 1.00 0.00 C ATOM 2001 OE1 GLU A 130 11.466 2.587 -14.897 1.00 0.00 O ATOM 2002 OE2 GLU A 130 11.135 3.102 -17.008 1.00 0.00 O ATOM 0 H GLU A 130 6.272 3.695 -14.071 1.00 0.00 H new ATOM 0 HA GLU A 130 7.249 1.200 -14.567 1.00 0.00 H new ATOM 0 HB2 GLU A 130 7.969 3.746 -15.181 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.232 3.380 -14.023 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.287 1.121 -15.584 1.00 0.00 H new ATOM 0 HG3 GLU A 130 8.802 2.326 -16.760 1.00 0.00 H new ATOM 2009 N GLN A 131 8.582 2.340 -11.764 1.00 0.00 N ATOM 2010 CA GLN A 131 9.258 1.890 -10.557 1.00 0.00 C ATOM 2011 C GLN A 131 8.312 1.160 -9.613 1.00 0.00 C ATOM 2012 O GLN A 131 8.554 0.016 -9.247 1.00 0.00 O ATOM 2013 CB GLN A 131 9.909 3.039 -9.805 1.00 0.00 C ATOM 2014 CG GLN A 131 9.071 4.306 -9.732 1.00 0.00 C ATOM 2015 CD GLN A 131 8.341 4.447 -8.414 1.00 0.00 C ATOM 2016 OE1 GLN A 131 7.124 4.274 -8.347 1.00 0.00 O ATOM 2017 NE2 GLN A 131 9.078 4.764 -7.357 1.00 0.00 N ATOM 0 H GLN A 131 8.399 3.343 -11.808 1.00 0.00 H new ATOM 0 HA GLN A 131 10.032 1.200 -10.893 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.135 2.710 -8.791 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.860 3.275 -10.282 1.00 0.00 H new ATOM 0 HG2 GLN A 131 9.716 5.172 -9.880 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.346 4.305 -10.546 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.084 4.898 -7.458 1.00 0.00 H new ATOM 0 HE22 GLN A 131 8.638 4.874 -6.443 1.00 0.00 H new ATOM 2026 N VAL A 132 7.238 1.825 -9.204 1.00 0.00 N ATOM 2027 CA VAL A 132 6.286 1.208 -8.285 1.00 0.00 C ATOM 2028 C VAL A 132 5.843 -0.159 -8.796 1.00 0.00 C ATOM 2029 O VAL A 132 5.419 -1.010 -8.015 1.00 0.00 O ATOM 2030 CB VAL A 132 5.056 2.107 -8.018 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.644 2.861 -9.269 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.888 1.298 -7.464 1.00 0.00 C ATOM 0 H VAL A 132 7.005 2.777 -9.488 1.00 0.00 H new ATOM 0 HA VAL A 132 6.806 1.079 -7.336 1.00 0.00 H new ATOM 0 HB VAL A 132 5.344 2.839 -7.264 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.777 3.484 -9.049 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.469 3.491 -9.602 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.390 2.150 -10.055 1.00 0.00 H new ATOM 0 HG21 VAL A 132 3.039 1.959 -7.287 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.605 0.528 -8.182 1.00 0.00 H new ATOM 0 HG23 VAL A 132 4.183 0.828 -6.526 1.00 0.00 H new ATOM 2042 N VAL A 133 5.962 -0.379 -10.101 1.00 0.00 N ATOM 2043 CA VAL A 133 5.589 -1.660 -10.671 1.00 0.00 C ATOM 2044 C VAL A 133 6.702 -2.683 -10.462 1.00 0.00 C ATOM 2045 O VAL A 133 6.433 -3.876 -10.332 1.00 0.00 O ATOM 2046 CB VAL A 133 5.254 -1.569 -12.172 1.00 0.00 C ATOM 2047 CG1 VAL A 133 6.512 -1.358 -12.998 1.00 0.00 C ATOM 2048 CG2 VAL A 133 4.525 -2.824 -12.621 1.00 0.00 C ATOM 0 H VAL A 133 6.309 0.305 -10.773 1.00 0.00 H new ATOM 0 HA VAL A 133 4.687 -1.979 -10.149 1.00 0.00 H new ATOM 0 HB VAL A 133 4.603 -0.709 -12.328 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.248 -1.297 -14.054 1.00 0.00 H new ATOM 0 HG12 VAL A 133 6.997 -0.432 -12.691 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.194 -2.194 -12.842 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.293 -2.749 -13.683 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.158 -3.694 -12.448 1.00 0.00 H new ATOM 0 HG23 VAL A 133 3.600 -2.930 -12.054 1.00 0.00 H new ATOM 2058 N GLN A 134 7.958 -2.219 -10.417 1.00 0.00 N ATOM 2059 CA GLN A 134 9.066 -3.145 -10.207 1.00 0.00 C ATOM 2060 C GLN A 134 9.185 -3.460 -8.726 1.00 0.00 C ATOM 2061 O GLN A 134 9.358 -4.616 -8.333 1.00 0.00 O ATOM 2062 CB GLN A 134 10.385 -2.586 -10.750 1.00 0.00 C ATOM 2063 CG GLN A 134 10.580 -1.108 -10.486 1.00 0.00 C ATOM 2064 CD GLN A 134 11.938 -0.606 -10.936 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.937 -0.770 -10.237 1.00 0.00 O ATOM 2066 NE2 GLN A 134 11.979 0.011 -12.112 1.00 0.00 N ATOM 0 H GLN A 134 8.222 -1.239 -10.520 1.00 0.00 H new ATOM 0 HA GLN A 134 8.858 -4.062 -10.759 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.213 -3.137 -10.304 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.428 -2.762 -11.825 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.801 -0.546 -11.001 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.461 -0.915 -9.420 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.125 0.125 -12.658 1.00 0.00 H new ATOM 0 HE22 GLN A 134 12.864 0.371 -12.468 1.00 0.00 H new ATOM 2075 N GLY A 135 9.054 -2.426 -7.906 1.00 0.00 N ATOM 2076 CA GLY A 135 9.113 -2.606 -6.476 1.00 0.00 C ATOM 2077 C GLY A 135 7.931 -3.406 -5.970 1.00 0.00 C ATOM 2078 O GLY A 135 7.985 -3.977 -4.880 1.00 0.00 O ATOM 0 H GLY A 135 8.908 -1.464 -8.211 1.00 0.00 H new ATOM 0 HA2 GLY A 135 10.039 -3.115 -6.210 1.00 0.00 H new ATOM 0 HA3 GLY A 135 9.132 -1.633 -5.986 1.00 0.00 H new ATOM 2082 N MET A 136 6.860 -3.463 -6.766 1.00 0.00 N ATOM 2083 CA MET A 136 5.677 -4.218 -6.376 1.00 0.00 C ATOM 2084 C MET A 136 5.740 -5.628 -6.946 1.00 0.00 C ATOM 2085 O MET A 136 5.540 -6.601 -6.225 1.00 0.00 O ATOM 2086 CB MET A 136 4.395 -3.509 -6.831 1.00 0.00 C ATOM 2087 CG MET A 136 4.070 -3.701 -8.302 1.00 0.00 C ATOM 2088 SD MET A 136 2.568 -2.839 -8.803 1.00 0.00 S ATOM 2089 CE MET A 136 1.639 -4.186 -9.530 1.00 0.00 C ATOM 0 H MET A 136 6.792 -3.000 -7.672 1.00 0.00 H new ATOM 0 HA MET A 136 5.656 -4.281 -5.288 1.00 0.00 H new ATOM 0 HB2 MET A 136 3.559 -3.874 -6.234 1.00 0.00 H new ATOM 0 HB3 MET A 136 4.490 -2.443 -6.627 1.00 0.00 H new ATOM 0 HG2 MET A 136 4.906 -3.345 -8.904 1.00 0.00 H new ATOM 0 HG3 MET A 136 3.959 -4.765 -8.509 1.00 0.00 H new ATOM 0 HE1 MET A 136 0.579 -4.057 -9.311 1.00 0.00 H new ATOM 0 HE2 MET A 136 1.789 -4.190 -10.610 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.983 -5.132 -9.112 1.00 0.00 H new ATOM 2099 N LYS A 137 6.041 -5.723 -8.242 1.00 0.00 N ATOM 2100 CA LYS A 137 6.153 -7.011 -8.924 1.00 0.00 C ATOM 2101 C LYS A 137 7.200 -7.911 -8.259 1.00 0.00 C ATOM 2102 O LYS A 137 7.257 -9.111 -8.525 1.00 0.00 O ATOM 2103 CB LYS A 137 6.482 -6.807 -10.408 1.00 0.00 C ATOM 2104 CG LYS A 137 7.949 -6.526 -10.696 1.00 0.00 C ATOM 2105 CD LYS A 137 8.142 -5.918 -12.079 1.00 0.00 C ATOM 2106 CE LYS A 137 7.514 -6.776 -13.167 1.00 0.00 C ATOM 2107 NZ LYS A 137 8.309 -8.007 -13.428 1.00 0.00 N ATOM 0 H LYS A 137 6.212 -4.917 -8.843 1.00 0.00 H new ATOM 0 HA LYS A 137 5.188 -7.512 -8.845 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.181 -7.697 -10.960 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.885 -5.979 -10.789 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.345 -5.847 -9.941 1.00 0.00 H new ATOM 0 HG3 LYS A 137 8.519 -7.452 -10.622 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.701 -4.921 -12.102 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.207 -5.800 -12.279 1.00 0.00 H new ATOM 0 HE2 LYS A 137 6.502 -7.053 -12.873 1.00 0.00 H new ATOM 0 HE3 LYS A 137 7.431 -6.195 -14.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 7.849 -8.565 -14.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 9.268 -7.743 -13.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 8.367 -8.574 -12.558 1.00 0.00 H new ATOM 2121 N GLU A 138 8.019 -7.324 -7.390 1.00 0.00 N ATOM 2122 CA GLU A 138 9.053 -8.064 -6.681 1.00 0.00 C ATOM 2123 C GLU A 138 8.576 -8.407 -5.280 1.00 0.00 C ATOM 2124 O GLU A 138 8.527 -9.574 -4.893 1.00 0.00 O ATOM 2125 CB GLU A 138 10.339 -7.240 -6.610 1.00 0.00 C ATOM 2126 CG GLU A 138 11.432 -7.734 -7.540 1.00 0.00 C ATOM 2127 CD GLU A 138 11.133 -7.440 -8.998 1.00 0.00 C ATOM 2128 OE1 GLU A 138 11.508 -6.346 -9.472 1.00 0.00 O ATOM 2129 OE2 GLU A 138 10.526 -8.303 -9.666 1.00 0.00 O ATOM 0 H GLU A 138 7.984 -6.331 -7.161 1.00 0.00 H new ATOM 0 HA GLU A 138 9.259 -8.987 -7.222 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.109 -6.202 -6.853 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.712 -7.253 -5.586 1.00 0.00 H new ATOM 0 HG2 GLU A 138 12.377 -7.266 -7.265 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.558 -8.809 -7.408 1.00 0.00 H new ATOM 2136 N ALA A 139 8.209 -7.375 -4.533 1.00 0.00 N ATOM 2137 CA ALA A 139 7.711 -7.550 -3.176 1.00 0.00 C ATOM 2138 C ALA A 139 6.554 -8.542 -3.157 1.00 0.00 C ATOM 2139 O ALA A 139 6.277 -9.174 -2.137 1.00 0.00 O ATOM 2140 CB ALA A 139 7.265 -6.213 -2.604 1.00 0.00 C ATOM 0 H ALA A 139 8.247 -6.405 -4.845 1.00 0.00 H new ATOM 0 HA ALA A 139 8.518 -7.946 -2.559 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.895 -6.357 -1.589 1.00 0.00 H new ATOM 0 HB2 ALA A 139 8.110 -5.524 -2.588 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.471 -5.799 -3.225 1.00 0.00 H new ATOM 2146 N GLN A 140 5.876 -8.667 -4.296 1.00 0.00 N ATOM 2147 CA GLN A 140 4.742 -9.569 -4.412 1.00 0.00 C ATOM 2148 C GLN A 140 5.165 -11.037 -4.392 1.00 0.00 C ATOM 2149 O GLN A 140 4.345 -11.918 -4.144 1.00 0.00 O ATOM 2150 CB GLN A 140 3.941 -9.287 -5.687 1.00 0.00 C ATOM 2151 CG GLN A 140 4.783 -8.961 -6.909 1.00 0.00 C ATOM 2152 CD GLN A 140 4.678 -10.007 -8.007 1.00 0.00 C ATOM 2153 OE1 GLN A 140 4.657 -9.673 -9.192 1.00 0.00 O ATOM 2154 NE2 GLN A 140 4.613 -11.277 -7.623 1.00 0.00 N ATOM 0 H GLN A 140 6.095 -8.153 -5.149 1.00 0.00 H new ATOM 0 HA GLN A 140 4.113 -9.385 -3.541 1.00 0.00 H new ATOM 0 HB2 GLN A 140 3.323 -10.156 -5.911 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.264 -8.454 -5.497 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.475 -7.994 -7.307 1.00 0.00 H new ATOM 0 HG3 GLN A 140 5.826 -8.864 -6.608 1.00 0.00 H new ATOM 0 HE21 GLN A 140 4.633 -11.511 -6.631 1.00 0.00 H new ATOM 0 HE22 GLN A 140 4.543 -12.018 -8.321 1.00 0.00 H new ATOM 2163 N GLU A 141 6.437 -11.305 -4.675 1.00 0.00 N ATOM 2164 CA GLU A 141 6.931 -12.679 -4.702 1.00 0.00 C ATOM 2165 C GLU A 141 7.925 -12.953 -3.571 1.00 0.00 C ATOM 2166 O GLU A 141 8.244 -14.107 -3.286 1.00 0.00 O ATOM 2167 CB GLU A 141 7.558 -12.983 -6.073 1.00 0.00 C ATOM 2168 CG GLU A 141 9.062 -13.159 -6.043 1.00 0.00 C ATOM 2169 CD GLU A 141 9.703 -12.946 -7.399 1.00 0.00 C ATOM 2170 OE1 GLU A 141 9.347 -11.957 -8.076 1.00 0.00 O ATOM 2171 OE2 GLU A 141 10.562 -13.766 -7.787 1.00 0.00 O ATOM 0 H GLU A 141 7.139 -10.596 -4.887 1.00 0.00 H new ATOM 0 HA GLU A 141 6.083 -13.345 -4.544 1.00 0.00 H new ATOM 0 HB2 GLU A 141 7.105 -13.890 -6.474 1.00 0.00 H new ATOM 0 HB3 GLU A 141 7.312 -12.173 -6.760 1.00 0.00 H new ATOM 0 HG2 GLU A 141 9.492 -12.457 -5.328 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.299 -14.162 -5.687 1.00 0.00 H new ATOM 2178 N ARG A 142 8.420 -11.894 -2.941 1.00 0.00 N ATOM 2179 CA ARG A 142 9.386 -12.044 -1.855 1.00 0.00 C ATOM 2180 C ARG A 142 8.772 -11.718 -0.495 1.00 0.00 C ATOM 2181 O ARG A 142 9.348 -12.048 0.543 1.00 0.00 O ATOM 2182 CB ARG A 142 10.607 -11.155 -2.102 1.00 0.00 C ATOM 2183 CG ARG A 142 10.264 -9.723 -2.482 1.00 0.00 C ATOM 2184 CD ARG A 142 10.501 -8.764 -1.327 1.00 0.00 C ATOM 2185 NE ARG A 142 11.891 -8.786 -0.874 1.00 0.00 N ATOM 2186 CZ ARG A 142 12.276 -9.162 0.346 1.00 0.00 C ATOM 2187 NH1 ARG A 142 11.387 -9.560 1.247 1.00 0.00 N ATOM 2188 NH2 ARG A 142 13.564 -9.143 0.666 1.00 0.00 N ATOM 0 H ARG A 142 8.172 -10.929 -3.160 1.00 0.00 H new ATOM 0 HA ARG A 142 9.695 -13.089 -1.838 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.223 -11.144 -1.203 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.210 -11.596 -2.896 1.00 0.00 H new ATOM 0 HG2 ARG A 142 10.867 -9.419 -3.337 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.221 -9.669 -2.792 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.236 -7.753 -1.635 1.00 0.00 H new ATOM 0 HD3 ARG A 142 9.845 -9.027 -0.497 1.00 0.00 H new ATOM 0 HE ARG A 142 12.613 -8.495 -1.534 1.00 0.00 H new ATOM 0 HH11 ARG A 142 10.395 -9.581 1.010 1.00 0.00 H new ATOM 0 HH12 ARG A 142 11.695 -9.845 2.177 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.256 -8.841 -0.020 1.00 0.00 H new ATOM 0 HH22 ARG A 142 13.862 -9.430 1.598 1.00 0.00 H new ATOM 2202 N LEU A 143 7.613 -11.066 -0.492 1.00 0.00 N ATOM 2203 CA LEU A 143 6.955 -10.706 0.760 1.00 0.00 C ATOM 2204 C LEU A 143 5.705 -11.550 1.006 1.00 0.00 C ATOM 2205 O LEU A 143 5.329 -11.792 2.152 1.00 0.00 O ATOM 2206 CB LEU A 143 6.611 -9.209 0.768 1.00 0.00 C ATOM 2207 CG LEU A 143 5.181 -8.852 0.353 1.00 0.00 C ATOM 2208 CD1 LEU A 143 4.258 -8.886 1.559 1.00 0.00 C ATOM 2209 CD2 LEU A 143 5.145 -7.483 -0.311 1.00 0.00 C ATOM 0 H LEU A 143 7.114 -10.778 -1.334 1.00 0.00 H new ATOM 0 HA LEU A 143 7.650 -10.913 1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.786 -8.821 1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 143 7.302 -8.693 0.102 1.00 0.00 H new ATOM 0 HG LEU A 143 4.834 -9.591 -0.369 1.00 0.00 H new ATOM 0 HD11 LEU A 143 3.245 -8.630 1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 143 4.263 -9.886 1.993 1.00 0.00 H new ATOM 0 HD13 LEU A 143 4.603 -8.166 2.302 1.00 0.00 H new ATOM 0 HD21 LEU A 143 4.121 -7.245 -0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.509 -6.730 0.388 1.00 0.00 H new ATOM 0 HD23 LEU A 143 5.779 -7.492 -1.198 1.00 0.00 H new ATOM 2221 N THR A 144 5.062 -12.001 -0.070 1.00 0.00 N ATOM 2222 CA THR A 144 3.858 -12.817 0.046 1.00 0.00 C ATOM 2223 C THR A 144 4.078 -13.992 0.995 1.00 0.00 C ATOM 2224 O THR A 144 4.603 -15.033 0.601 1.00 0.00 O ATOM 2225 CB THR A 144 3.431 -13.329 -1.321 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.556 -13.661 -2.113 1.00 0.00 O ATOM 2227 CG2 THR A 144 2.593 -12.336 -2.097 1.00 0.00 C ATOM 0 H THR A 144 5.355 -11.815 -1.029 1.00 0.00 H new ATOM 0 HA THR A 144 3.067 -12.189 0.456 1.00 0.00 H new ATOM 0 HB THR A 144 2.824 -14.211 -1.119 1.00 0.00 H new ATOM 0 HG1 THR A 144 4.524 -13.158 -2.954 1.00 0.00 H new ATOM 0 HG21 THR A 144 2.322 -12.764 -3.062 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.688 -12.107 -1.535 1.00 0.00 H new ATOM 0 HG23 THR A 144 3.165 -11.421 -2.253 1.00 0.00 H new