USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=22 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 117 ASN : amide:sc= -0.0357 K(o=-0.18,f=-1) USER MOD Set 1.2: A 134 GLN : amide:sc= -0.14 X(o=-0.18,f=0.32) USER MOD Set 2.1: A 128 SER OG : rot 180:sc= -2.98 USER MOD Set 2.2: A 131 GLN : amide:sc= -2.6 X(o=-5.6,f=-5.8!) USER MOD Set 3.1: A 47 HIS : no HD1:sc= -3.07! K(o=-4.1!,f=0.044) USER MOD Set 3.2: A 78 ASN : amide:sc= -1.02 K(o=-4.1,f=-3.4!) USER MOD Set 4.1: A 72 HIS : no HD1:sc= -6.87! C(o=-11!,f=-8.8!) USER MOD Set 4.2: A 73 ASN : amide:sc= -3.79! C(o=-11!,f=-13!) USER MOD Set 5.1: A 24 HIS : no HD1:sc= -6.66! C(o=-6.8!,f=-11!) USER MOD Set 5.2: A 71 SER OG : rot -160:sc= -0.139 USER MOD Set 6.1: A 48 LYS NZ :NH3+ -178:sc= -0.959 (180deg=-1.11) USER MOD Set 6.2: A 49 SER OG : rot 180:sc= 0.0105 USER MOD Single : A 22 HIS : no HD1:sc= -0.759 K(o=-0.76,f=0.15) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 139:sc= -1.82 (180deg=-3.34!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 166:sc= 1.14! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.129 USER MOD Single : A 68 SER OG : rot -102:sc= 1.08 USER MOD Single : A 76 MET CE :methyl -132:sc= -1.1 (180deg=-2.26!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -98:sc= 0.171 USER MOD Single : A 96 TYR OH : rot 39:sc= -3.14! USER MOD Single : A 106 SER OG : rot 68:sc= 1.1 USER MOD Single : A 108 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.214) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 115 ASN : amide:sc= -5.23! C(o=-5.2!,f=-16!) USER MOD Single : A 119 ASN : amide:sc= -2.65 K(o=-2.7,f=-5.4!) USER MOD Single : A 121 SER OG : rot 22:sc= 1.22 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 159:sc= 0.261 (180deg=0.144) USER MOD Single : A 124 TYR OH : rot -19:sc= -2! USER MOD Single : A 126 TYR OH : rot 23:sc= -0.371 USER MOD Single : A 136 MET CE :methyl -123:sc= -9.66! (180deg=-13.4!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc= -3.9! C(o=-3.9!,f=-8.9!) USER MOD Single : A 144 THR OG1 : rot 45:sc= 0.2 USER MOD ----------------------------------------------------------------- ATOM 308 N HIS A 22 -9.909 0.662 -11.124 1.00 0.00 N ATOM 309 CA HIS A 22 -10.202 -0.463 -10.234 1.00 0.00 C ATOM 310 C HIS A 22 -8.997 -1.392 -10.151 1.00 0.00 C ATOM 311 O HIS A 22 -8.609 -1.995 -11.150 1.00 0.00 O ATOM 312 CB HIS A 22 -11.421 -1.242 -10.737 1.00 0.00 C ATOM 313 CG HIS A 22 -11.553 -1.271 -12.231 1.00 0.00 C ATOM 314 ND1 HIS A 22 -12.741 -1.029 -12.887 1.00 0.00 N ATOM 315 CD2 HIS A 22 -10.635 -1.515 -13.199 1.00 0.00 C ATOM 316 CE1 HIS A 22 -12.550 -1.122 -14.191 1.00 0.00 C ATOM 317 NE2 HIS A 22 -11.281 -1.415 -14.406 1.00 0.00 N ATOM 0 HA HIS A 22 -10.421 -0.069 -9.242 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.363 -2.266 -10.368 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -12.322 -0.801 -10.311 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -9.591 -1.745 -13.048 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -13.304 -0.982 -14.952 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -10.850 -1.546 -15.321 1.00 0.00 H new ATOM 326 N ILE A 23 -8.387 -1.496 -8.970 1.00 0.00 N ATOM 327 CA ILE A 23 -7.208 -2.344 -8.811 1.00 0.00 C ATOM 328 C ILE A 23 -6.615 -2.241 -7.389 1.00 0.00 C ATOM 329 O ILE A 23 -6.974 -3.027 -6.491 1.00 0.00 O ATOM 330 CB ILE A 23 -6.158 -1.958 -9.891 1.00 0.00 C ATOM 331 CG1 ILE A 23 -4.805 -2.634 -9.653 1.00 0.00 C ATOM 332 CG2 ILE A 23 -5.999 -0.448 -9.973 1.00 0.00 C ATOM 333 CD1 ILE A 23 -3.727 -2.161 -10.611 1.00 0.00 C ATOM 0 H ILE A 23 -8.684 -1.012 -8.123 1.00 0.00 H new ATOM 0 HA ILE A 23 -7.501 -3.385 -8.948 1.00 0.00 H new ATOM 0 HB ILE A 23 -6.534 -2.322 -10.847 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.484 -2.440 -8.630 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -4.922 -3.713 -9.751 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -5.260 -0.201 -10.735 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -6.955 0.005 -10.235 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.668 -0.064 -9.008 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -2.793 -2.677 -10.391 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -4.029 -2.379 -11.635 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -3.584 -1.087 -10.496 1.00 0.00 H new ATOM 345 N HIS A 24 -5.722 -1.270 -7.182 1.00 0.00 N ATOM 346 CA HIS A 24 -5.096 -1.058 -5.886 1.00 0.00 C ATOM 347 C HIS A 24 -5.981 -0.188 -4.993 1.00 0.00 C ATOM 348 O HIS A 24 -5.481 0.557 -4.153 1.00 0.00 O ATOM 349 CB HIS A 24 -3.739 -0.373 -6.053 1.00 0.00 C ATOM 350 CG HIS A 24 -2.726 -1.169 -6.815 1.00 0.00 C ATOM 351 ND1 HIS A 24 -1.625 -0.596 -7.414 1.00 0.00 N ATOM 352 CD2 HIS A 24 -2.648 -2.494 -7.081 1.00 0.00 C ATOM 353 CE1 HIS A 24 -0.914 -1.532 -8.016 1.00 0.00 C ATOM 354 NE2 HIS A 24 -1.512 -2.693 -7.830 1.00 0.00 N ATOM 0 H HIS A 24 -5.418 -0.617 -7.904 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.960 -2.034 -5.420 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.888 0.580 -6.560 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -3.337 -0.149 -5.065 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -3.348 -3.253 -6.764 1.00 0.00 H new ATOM 0 HE1 HIS A 24 0.001 -1.374 -8.567 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -1.185 -3.592 -8.184 1.00 0.00 H new ATOM 363 N TRP A 25 -7.294 -0.273 -5.191 1.00 0.00 N ATOM 364 CA TRP A 25 -8.228 0.529 -4.408 1.00 0.00 C ATOM 365 C TRP A 25 -9.632 -0.048 -4.396 1.00 0.00 C ATOM 366 O TRP A 25 -10.513 0.507 -3.740 1.00 0.00 O ATOM 367 CB TRP A 25 -8.305 1.934 -4.977 1.00 0.00 C ATOM 368 CG TRP A 25 -7.810 2.011 -6.376 1.00 0.00 C ATOM 369 CD1 TRP A 25 -8.528 1.802 -7.511 1.00 0.00 C ATOM 370 CD2 TRP A 25 -6.479 2.312 -6.785 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.725 1.971 -8.605 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.458 2.287 -8.187 1.00 0.00 C ATOM 373 CE3 TRP A 25 -5.308 2.607 -6.097 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -5.302 2.549 -8.918 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -4.160 2.866 -6.815 1.00 0.00 C ATOM 376 CH2 TRP A 25 -4.163 2.839 -8.215 1.00 0.00 C ATOM 0 H TRP A 25 -7.732 -0.884 -5.881 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.849 0.534 -3.386 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.338 2.281 -4.941 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.721 2.608 -4.351 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.576 1.542 -7.544 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.021 1.877 -9.576 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.298 2.633 -5.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -5.304 2.524 -9.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -3.244 3.093 -6.290 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -3.250 3.051 -8.751 1.00 0.00 H new ATOM 387 N ARG A 26 -9.867 -1.138 -5.128 1.00 0.00 N ATOM 388 CA ARG A 26 -11.208 -1.712 -5.164 1.00 0.00 C ATOM 389 C ARG A 26 -11.854 -1.691 -3.777 1.00 0.00 C ATOM 390 O ARG A 26 -13.066 -1.508 -3.667 1.00 0.00 O ATOM 391 CB ARG A 26 -11.216 -3.137 -5.724 1.00 0.00 C ATOM 392 CG ARG A 26 -10.475 -3.281 -7.043 1.00 0.00 C ATOM 393 CD ARG A 26 -11.209 -4.218 -7.990 1.00 0.00 C ATOM 394 NE ARG A 26 -12.506 -3.677 -8.402 1.00 0.00 N ATOM 395 CZ ARG A 26 -13.672 -4.028 -7.859 1.00 0.00 C ATOM 396 NH1 ARG A 26 -13.721 -4.916 -6.875 1.00 0.00 N ATOM 397 NH2 ARG A 26 -14.795 -3.481 -8.304 1.00 0.00 N ATOM 0 H ARG A 26 -9.168 -1.627 -5.687 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.794 -1.088 -5.838 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.768 -3.808 -4.991 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -12.249 -3.458 -5.861 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.365 -2.302 -7.509 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.470 -3.661 -6.858 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -10.594 -4.397 -8.872 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -11.356 -5.182 -7.504 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.518 -2.987 -9.153 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -12.861 -5.338 -6.526 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -14.619 -5.177 -6.467 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -14.764 -2.795 -9.058 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -15.690 -3.746 -7.892 1.00 0.00 H new ATOM 411 N THR A 27 -11.043 -1.853 -2.711 1.00 0.00 N ATOM 412 CA THR A 27 -11.570 -1.824 -1.340 1.00 0.00 C ATOM 413 C THR A 27 -10.606 -2.471 -0.351 1.00 0.00 C ATOM 414 O THR A 27 -9.988 -3.497 -0.641 1.00 0.00 O ATOM 415 CB THR A 27 -12.936 -2.522 -1.249 1.00 0.00 C ATOM 416 OG1 THR A 27 -13.236 -2.866 0.091 1.00 0.00 O ATOM 417 CG2 THR A 27 -13.023 -3.786 -2.077 1.00 0.00 C ATOM 0 H THR A 27 -10.036 -2.003 -2.775 1.00 0.00 H new ATOM 0 HA THR A 27 -11.689 -0.773 -1.076 1.00 0.00 H new ATOM 0 HB THR A 27 -13.652 -1.801 -1.642 1.00 0.00 H new ATOM 0 HG1 THR A 27 -14.110 -3.308 0.128 1.00 0.00 H new ATOM 0 HG21 THR A 27 -14.014 -4.226 -1.966 1.00 0.00 H new ATOM 0 HG22 THR A 27 -12.848 -3.547 -3.126 1.00 0.00 H new ATOM 0 HG23 THR A 27 -12.270 -4.497 -1.736 1.00 0.00 H new ATOM 425 N LEU A 28 -10.496 -1.863 0.827 1.00 0.00 N ATOM 426 CA LEU A 28 -9.624 -2.372 1.876 1.00 0.00 C ATOM 427 C LEU A 28 -10.262 -3.572 2.569 1.00 0.00 C ATOM 428 O LEU A 28 -9.570 -4.505 2.978 1.00 0.00 O ATOM 429 CB LEU A 28 -9.332 -1.269 2.898 1.00 0.00 C ATOM 430 CG LEU A 28 -8.539 -1.715 4.128 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.749 -0.550 4.703 1.00 0.00 C ATOM 432 CD2 LEU A 28 -9.473 -2.298 5.178 1.00 0.00 C ATOM 0 H LEU A 28 -11.003 -1.014 1.078 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.687 -2.693 1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.781 -0.471 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.279 -0.844 3.230 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.835 -2.490 3.824 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -7.191 -0.885 5.577 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.055 -0.175 3.951 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.434 0.246 4.993 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.894 -2.611 6.047 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -10.199 -1.543 5.479 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.996 -3.159 4.762 1.00 0.00 H new ATOM 444 N GLU A 29 -11.586 -3.540 2.695 1.00 0.00 N ATOM 445 CA GLU A 29 -12.319 -4.627 3.334 1.00 0.00 C ATOM 446 C GLU A 29 -12.062 -5.945 2.613 1.00 0.00 C ATOM 447 O GLU A 29 -11.638 -6.927 3.223 1.00 0.00 O ATOM 448 CB GLU A 29 -13.820 -4.320 3.349 1.00 0.00 C ATOM 449 CG GLU A 29 -14.402 -4.202 4.748 1.00 0.00 C ATOM 450 CD GLU A 29 -15.917 -4.239 4.754 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.533 -3.463 3.992 1.00 0.00 O ATOM 452 OE2 GLU A 29 -16.488 -5.043 5.520 1.00 0.00 O ATOM 0 H GLU A 29 -12.172 -2.774 2.363 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.967 -4.719 4.362 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.997 -3.389 2.811 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.349 -5.106 2.809 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.020 -5.014 5.366 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -14.063 -3.270 5.201 1.00 0.00 H new ATOM 459 N ASP A 30 -12.311 -5.955 1.308 1.00 0.00 N ATOM 460 CA ASP A 30 -12.098 -7.150 0.499 1.00 0.00 C ATOM 461 C ASP A 30 -10.629 -7.554 0.531 1.00 0.00 C ATOM 462 O ASP A 30 -10.298 -8.736 0.455 1.00 0.00 O ATOM 463 CB ASP A 30 -12.543 -6.901 -0.942 1.00 0.00 C ATOM 464 CG ASP A 30 -14.052 -6.932 -1.091 1.00 0.00 C ATOM 465 OD1 ASP A 30 -14.749 -6.510 -0.146 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.534 -7.382 -2.150 1.00 0.00 O ATOM 0 H ASP A 30 -12.660 -5.150 0.788 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.695 -7.962 0.915 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -12.167 -5.933 -1.274 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.100 -7.655 -1.592 1.00 0.00 H new ATOM 471 N GLY A 31 -9.753 -6.561 0.645 1.00 0.00 N ATOM 472 CA GLY A 31 -8.330 -6.830 0.688 1.00 0.00 C ATOM 473 C GLY A 31 -7.933 -7.656 1.894 1.00 0.00 C ATOM 474 O GLY A 31 -6.992 -8.446 1.830 1.00 0.00 O ATOM 0 H GLY A 31 -10.005 -5.575 0.708 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.035 -7.354 -0.221 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.785 -5.886 0.703 1.00 0.00 H new ATOM 478 N LYS A 32 -8.649 -7.475 2.999 1.00 0.00 N ATOM 479 CA LYS A 32 -8.364 -8.213 4.223 1.00 0.00 C ATOM 480 C LYS A 32 -9.035 -9.581 4.199 1.00 0.00 C ATOM 481 O LYS A 32 -8.429 -10.590 4.561 1.00 0.00 O ATOM 482 CB LYS A 32 -8.833 -7.421 5.446 1.00 0.00 C ATOM 483 CG LYS A 32 -7.951 -6.226 5.773 1.00 0.00 C ATOM 484 CD LYS A 32 -8.607 -5.310 6.797 1.00 0.00 C ATOM 485 CE LYS A 32 -7.935 -5.421 8.156 1.00 0.00 C ATOM 486 NZ LYS A 32 -8.162 -6.753 8.783 1.00 0.00 N ATOM 0 H LYS A 32 -9.431 -6.824 3.071 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.286 -8.357 4.288 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.852 -7.074 5.275 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.864 -8.086 6.309 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.992 -6.575 6.157 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.744 -5.665 4.862 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.557 -4.278 6.449 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.663 -5.564 6.890 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -6.864 -5.250 8.046 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.317 -4.641 8.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.687 -6.787 9.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.182 -6.907 8.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.775 -7.497 8.168 1.00 0.00 H new ATOM 500 N LYS A 33 -10.292 -9.607 3.766 1.00 0.00 N ATOM 501 CA LYS A 33 -11.049 -10.851 3.690 1.00 0.00 C ATOM 502 C LYS A 33 -10.481 -11.769 2.612 1.00 0.00 C ATOM 503 O LYS A 33 -10.588 -12.992 2.705 1.00 0.00 O ATOM 504 CB LYS A 33 -12.523 -10.555 3.400 1.00 0.00 C ATOM 505 CG LYS A 33 -13.381 -11.804 3.259 1.00 0.00 C ATOM 506 CD LYS A 33 -13.942 -11.939 1.852 1.00 0.00 C ATOM 507 CE LYS A 33 -14.899 -13.115 1.745 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.846 -12.959 0.606 1.00 0.00 N ATOM 0 H LYS A 33 -10.807 -8.781 3.463 1.00 0.00 H new ATOM 0 HA LYS A 33 -10.968 -11.358 4.652 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.925 -9.937 4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.594 -9.971 2.482 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.786 -12.685 3.501 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.201 -11.767 3.977 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -14.460 -11.021 1.576 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -13.124 -12.069 1.144 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.330 -14.036 1.620 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -15.461 -13.211 2.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.481 -13.781 0.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -16.408 -12.094 0.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.311 -12.893 -0.284 1.00 0.00 H new ATOM 522 N GLU A 34 -9.875 -11.173 1.589 1.00 0.00 N ATOM 523 CA GLU A 34 -9.291 -11.939 0.495 1.00 0.00 C ATOM 524 C GLU A 34 -7.845 -12.314 0.802 1.00 0.00 C ATOM 525 O GLU A 34 -7.433 -13.456 0.594 1.00 0.00 O ATOM 526 CB GLU A 34 -9.356 -11.139 -0.806 1.00 0.00 C ATOM 527 CG GLU A 34 -8.960 -11.944 -2.032 1.00 0.00 C ATOM 528 CD GLU A 34 -9.863 -11.682 -3.221 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.990 -12.218 -3.240 1.00 0.00 O ATOM 530 OE2 GLU A 34 -9.443 -10.938 -4.134 1.00 0.00 O ATOM 0 H GLU A 34 -9.776 -10.162 1.496 1.00 0.00 H new ATOM 0 HA GLU A 34 -9.868 -12.857 0.380 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.370 -10.761 -0.941 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -8.701 -10.272 -0.723 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -7.932 -11.704 -2.302 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -8.986 -13.006 -1.788 1.00 0.00 H new ATOM 537 N ALA A 35 -7.079 -11.348 1.298 1.00 0.00 N ATOM 538 CA ALA A 35 -5.678 -11.580 1.635 1.00 0.00 C ATOM 539 C ALA A 35 -5.529 -12.733 2.622 1.00 0.00 C ATOM 540 O ALA A 35 -4.471 -13.356 2.705 1.00 0.00 O ATOM 541 CB ALA A 35 -5.056 -10.316 2.205 1.00 0.00 C ATOM 0 H ALA A 35 -7.404 -10.398 1.476 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.154 -11.852 0.719 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.011 -10.504 2.452 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.116 -9.516 1.467 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.594 -10.020 3.106 1.00 0.00 H new ATOM 547 N ALA A 36 -6.592 -13.010 3.371 1.00 0.00 N ATOM 548 CA ALA A 36 -6.576 -14.086 4.353 1.00 0.00 C ATOM 549 C ALA A 36 -6.542 -15.453 3.676 1.00 0.00 C ATOM 550 O ALA A 36 -5.695 -16.289 3.985 1.00 0.00 O ATOM 551 CB ALA A 36 -7.785 -13.978 5.269 1.00 0.00 C ATOM 0 H ALA A 36 -7.475 -12.503 3.316 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.669 -13.986 4.949 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.762 -14.787 5.999 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.763 -13.020 5.789 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.697 -14.049 4.677 1.00 0.00 H new ATOM 557 N ALA A 37 -7.473 -15.674 2.753 1.00 0.00 N ATOM 558 CA ALA A 37 -7.551 -16.941 2.035 1.00 0.00 C ATOM 559 C ALA A 37 -6.377 -17.106 1.077 1.00 0.00 C ATOM 560 O ALA A 37 -5.519 -17.968 1.273 1.00 0.00 O ATOM 561 CB ALA A 37 -8.868 -17.039 1.280 1.00 0.00 C ATOM 0 H ALA A 37 -8.183 -14.993 2.485 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.502 -17.747 2.767 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.913 -17.990 0.749 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.697 -16.978 1.985 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.939 -16.220 0.565 1.00 0.00 H new ATOM 567 N SER A 38 -6.346 -16.278 0.039 1.00 0.00 N ATOM 568 CA SER A 38 -5.279 -16.333 -0.953 1.00 0.00 C ATOM 569 C SER A 38 -3.912 -16.133 -0.303 1.00 0.00 C ATOM 570 O SER A 38 -2.895 -16.585 -0.826 1.00 0.00 O ATOM 571 CB SER A 38 -5.503 -15.269 -2.030 1.00 0.00 C ATOM 572 OG SER A 38 -6.226 -15.800 -3.127 1.00 0.00 O ATOM 0 H SER A 38 -7.048 -15.560 -0.137 1.00 0.00 H new ATOM 0 HA SER A 38 -5.299 -17.321 -1.413 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.048 -14.426 -1.605 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.542 -14.887 -2.374 1.00 0.00 H new ATOM 0 HG SER A 38 -6.358 -15.101 -3.801 1.00 0.00 H new ATOM 578 N GLY A 39 -3.894 -15.450 0.839 1.00 0.00 N ATOM 579 CA GLY A 39 -2.643 -15.205 1.532 1.00 0.00 C ATOM 580 C GLY A 39 -1.757 -14.227 0.787 1.00 0.00 C ATOM 581 O GLY A 39 -0.564 -14.474 0.608 1.00 0.00 O ATOM 0 H GLY A 39 -4.721 -15.064 1.295 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -2.852 -14.816 2.529 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.111 -16.148 1.662 1.00 0.00 H new ATOM 585 N LEU A 40 -2.339 -13.115 0.351 1.00 0.00 N ATOM 586 CA LEU A 40 -1.590 -12.099 -0.379 1.00 0.00 C ATOM 587 C LEU A 40 -1.609 -10.764 0.363 1.00 0.00 C ATOM 588 O LEU A 40 -2.612 -10.400 0.977 1.00 0.00 O ATOM 589 CB LEU A 40 -2.162 -11.920 -1.787 1.00 0.00 C ATOM 590 CG LEU A 40 -3.678 -11.726 -1.855 1.00 0.00 C ATOM 591 CD1 LEU A 40 -4.058 -10.320 -1.417 1.00 0.00 C ATOM 592 CD2 LEU A 40 -4.184 -12.006 -3.262 1.00 0.00 C ATOM 0 H LEU A 40 -3.325 -12.895 0.490 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.556 -12.437 -0.455 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.681 -11.059 -2.251 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.896 -12.793 -2.383 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.149 -12.433 -1.172 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.140 -10.202 -1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.727 -10.156 -0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.580 -9.593 -2.073 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.264 -11.864 -3.295 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.706 -11.322 -3.963 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.945 -13.033 -3.537 1.00 0.00 H new ATOM 604 N PRO A 41 -0.494 -10.014 0.314 1.00 0.00 N ATOM 605 CA PRO A 41 -0.382 -8.714 0.985 1.00 0.00 C ATOM 606 C PRO A 41 -1.289 -7.657 0.364 1.00 0.00 C ATOM 607 O PRO A 41 -1.886 -7.868 -0.693 1.00 0.00 O ATOM 608 CB PRO A 41 1.087 -8.334 0.789 1.00 0.00 C ATOM 609 CG PRO A 41 1.514 -9.087 -0.422 1.00 0.00 C ATOM 610 CD PRO A 41 0.747 -10.376 -0.395 1.00 0.00 C ATOM 0 HA PRO A 41 -0.686 -8.772 2.030 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.203 -7.259 0.648 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.686 -8.608 1.657 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.298 -8.523 -1.329 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.588 -9.271 -0.409 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.544 -10.745 -1.400 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.295 -11.160 0.127 1.00 0.00 H new ATOM 618 N LEU A 42 -1.388 -6.511 1.026 1.00 0.00 N ATOM 619 CA LEU A 42 -2.221 -5.429 0.532 1.00 0.00 C ATOM 620 C LEU A 42 -1.369 -4.290 -0.014 1.00 0.00 C ATOM 621 O LEU A 42 -0.205 -4.120 0.366 1.00 0.00 O ATOM 622 CB LEU A 42 -3.162 -4.912 1.626 1.00 0.00 C ATOM 623 CG LEU A 42 -2.931 -5.478 3.028 1.00 0.00 C ATOM 624 CD1 LEU A 42 -3.586 -4.585 4.070 1.00 0.00 C ATOM 625 CD2 LEU A 42 -3.471 -6.896 3.123 1.00 0.00 C ATOM 0 H LEU A 42 -0.904 -6.310 1.901 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.828 -5.826 -0.282 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.071 -3.827 1.674 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -4.188 -5.133 1.330 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.859 -5.506 3.221 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.414 -4.999 5.064 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.156 -3.585 4.014 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.658 -4.530 3.880 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.299 -7.284 4.127 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.541 -6.893 2.914 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -2.961 -7.529 2.397 1.00 0.00 H new ATOM 637 N MET A 43 -1.966 -3.517 -0.911 1.00 0.00 N ATOM 638 CA MET A 43 -1.291 -2.392 -1.534 1.00 0.00 C ATOM 639 C MET A 43 -1.738 -1.079 -0.896 1.00 0.00 C ATOM 640 O MET A 43 -2.777 -0.525 -1.255 1.00 0.00 O ATOM 641 CB MET A 43 -1.579 -2.385 -3.040 1.00 0.00 C ATOM 642 CG MET A 43 -0.938 -1.219 -3.774 1.00 0.00 C ATOM 643 SD MET A 43 0.570 -1.688 -4.642 1.00 0.00 S ATOM 644 CE MET A 43 1.768 -1.550 -3.318 1.00 0.00 C ATOM 0 H MET A 43 -2.927 -3.653 -1.225 1.00 0.00 H new ATOM 0 HA MET A 43 -0.217 -2.494 -1.380 1.00 0.00 H new ATOM 0 HB2 MET A 43 -1.221 -3.318 -3.475 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.657 -2.353 -3.196 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.651 -0.809 -4.489 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.710 -0.427 -3.061 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.468 -2.384 -3.372 1.00 0.00 H new ATOM 0 HE2 MET A 43 2.313 -0.611 -3.417 1.00 0.00 H new ATOM 0 HE3 MET A 43 1.253 -1.571 -2.358 1.00 0.00 H new ATOM 654 N VAL A 44 -0.950 -0.594 0.061 1.00 0.00 N ATOM 655 CA VAL A 44 -1.271 0.648 0.757 1.00 0.00 C ATOM 656 C VAL A 44 -0.867 1.869 -0.055 1.00 0.00 C ATOM 657 O VAL A 44 0.184 2.466 0.181 1.00 0.00 O ATOM 658 CB VAL A 44 -0.593 0.716 2.140 1.00 0.00 C ATOM 659 CG1 VAL A 44 -0.915 2.030 2.840 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.023 -0.463 2.992 1.00 0.00 C ATOM 0 H VAL A 44 -0.087 -1.041 0.371 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.353 0.653 0.890 1.00 0.00 H new ATOM 0 HB VAL A 44 0.486 0.668 1.997 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.425 2.053 3.813 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.557 2.862 2.234 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -1.993 2.116 2.974 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.538 -0.404 3.966 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.105 -0.441 3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.736 -1.392 2.499 1.00 0.00 H new ATOM 670 N ILE A 45 -1.722 2.251 -0.991 1.00 0.00 N ATOM 671 CA ILE A 45 -1.471 3.418 -1.817 1.00 0.00 C ATOM 672 C ILE A 45 -2.246 4.606 -1.270 1.00 0.00 C ATOM 673 O ILE A 45 -3.473 4.622 -1.311 1.00 0.00 O ATOM 674 CB ILE A 45 -1.886 3.177 -3.283 1.00 0.00 C ATOM 675 CG1 ILE A 45 -1.331 1.833 -3.774 1.00 0.00 C ATOM 676 CG2 ILE A 45 -1.413 4.324 -4.164 1.00 0.00 C ATOM 677 CD1 ILE A 45 -1.369 1.657 -5.278 1.00 0.00 C ATOM 0 H ILE A 45 -2.597 1.768 -1.196 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.400 3.619 -1.793 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.974 3.137 -3.342 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -0.300 1.732 -3.434 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.900 1.027 -3.311 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.714 4.139 -5.195 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.859 5.256 -3.818 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.327 4.400 -4.111 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.959 0.682 -5.541 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.400 1.723 -5.626 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.775 2.439 -5.751 1.00 0.00 H new ATOM 689 N ILE A 46 -1.542 5.594 -0.739 1.00 0.00 N ATOM 690 CA ILE A 46 -2.208 6.758 -0.181 1.00 0.00 C ATOM 691 C ILE A 46 -1.865 8.001 -0.981 1.00 0.00 C ATOM 692 O ILE A 46 -0.723 8.190 -1.399 1.00 0.00 O ATOM 693 CB ILE A 46 -1.854 6.957 1.304 1.00 0.00 C ATOM 694 CG1 ILE A 46 -1.763 5.602 2.008 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.896 7.831 1.985 1.00 0.00 C ATOM 696 CD1 ILE A 46 -0.559 5.478 2.915 1.00 0.00 C ATOM 0 H ILE A 46 -0.524 5.613 -0.683 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.282 6.585 -0.244 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.887 7.455 1.368 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -2.668 5.443 2.594 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.727 4.812 1.258 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.631 7.962 3.034 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.931 8.804 1.495 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.873 7.354 1.914 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -0.556 4.493 3.382 1.00 0.00 H new ATOM 0 HD12 ILE A 46 0.352 5.605 2.330 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -0.604 6.246 3.687 1.00 0.00 H new ATOM 708 N HIS A 47 -2.871 8.827 -1.226 1.00 0.00 N ATOM 709 CA HIS A 47 -2.682 10.033 -2.019 1.00 0.00 C ATOM 710 C HIS A 47 -3.297 11.258 -1.357 1.00 0.00 C ATOM 711 O HIS A 47 -4.497 11.503 -1.486 1.00 0.00 O ATOM 712 CB HIS A 47 -3.308 9.835 -3.400 1.00 0.00 C ATOM 713 CG HIS A 47 -4.787 9.588 -3.354 1.00 0.00 C ATOM 714 ND1 HIS A 47 -5.691 10.318 -4.098 1.00 0.00 N ATOM 715 CD2 HIS A 47 -5.523 8.695 -2.644 1.00 0.00 C ATOM 716 CE1 HIS A 47 -6.914 9.886 -3.849 1.00 0.00 C ATOM 717 NE2 HIS A 47 -6.839 8.903 -2.972 1.00 0.00 N ATOM 0 H HIS A 47 -3.823 8.686 -0.889 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.610 10.207 -2.106 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.113 10.718 -4.009 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.822 8.994 -3.894 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.144 7.959 -1.951 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -7.822 10.272 -4.289 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -7.632 8.382 -2.598 1.00 0.00 H new ATOM 726 N LYS A 48 -2.478 12.043 -0.667 1.00 0.00 N ATOM 727 CA LYS A 48 -2.989 13.255 -0.023 1.00 0.00 C ATOM 728 C LYS A 48 -2.940 14.439 -0.985 1.00 0.00 C ATOM 729 O LYS A 48 -2.394 14.338 -2.083 1.00 0.00 O ATOM 730 CB LYS A 48 -2.206 13.582 1.247 1.00 0.00 C ATOM 731 CG LYS A 48 -3.089 13.792 2.469 1.00 0.00 C ATOM 732 CD LYS A 48 -3.253 15.270 2.797 1.00 0.00 C ATOM 733 CE LYS A 48 -4.694 15.609 3.145 1.00 0.00 C ATOM 734 NZ LYS A 48 -5.419 16.212 1.994 1.00 0.00 N ATOM 0 H LYS A 48 -1.481 11.872 -0.538 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.026 13.067 0.254 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.505 12.773 1.450 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.614 14.481 1.078 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.068 13.348 2.291 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.655 13.275 3.325 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.605 15.532 3.633 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -2.933 15.870 1.945 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.212 14.705 3.466 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.710 16.301 3.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.387 16.459 2.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.922 17.070 1.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.456 15.529 1.211 1.00 0.00 H new ATOM 748 N SER A 49 -3.518 15.562 -0.566 1.00 0.00 N ATOM 749 CA SER A 49 -3.549 16.770 -1.389 1.00 0.00 C ATOM 750 C SER A 49 -2.172 17.091 -1.961 1.00 0.00 C ATOM 751 O SER A 49 -1.150 16.827 -1.327 1.00 0.00 O ATOM 752 CB SER A 49 -4.058 17.957 -0.566 1.00 0.00 C ATOM 753 OG SER A 49 -5.456 17.867 -0.352 1.00 0.00 O ATOM 0 H SER A 49 -3.973 15.661 0.342 1.00 0.00 H new ATOM 0 HA SER A 49 -4.228 16.587 -2.222 1.00 0.00 H new ATOM 0 HB2 SER A 49 -3.541 17.987 0.393 1.00 0.00 H new ATOM 0 HB3 SER A 49 -3.825 18.888 -1.082 1.00 0.00 H new ATOM 0 HG SER A 49 -5.756 18.635 0.177 1.00 0.00 H new ATOM 759 N TRP A 50 -2.157 17.662 -3.166 1.00 0.00 N ATOM 760 CA TRP A 50 -0.913 18.024 -3.844 1.00 0.00 C ATOM 761 C TRP A 50 0.140 16.931 -3.691 1.00 0.00 C ATOM 762 O TRP A 50 0.890 16.905 -2.715 1.00 0.00 O ATOM 763 CB TRP A 50 -0.378 19.358 -3.315 1.00 0.00 C ATOM 764 CG TRP A 50 -0.035 19.342 -1.854 1.00 0.00 C ATOM 765 CD1 TRP A 50 -0.896 19.504 -0.807 1.00 0.00 C ATOM 766 CD2 TRP A 50 1.265 19.165 -1.281 1.00 0.00 C ATOM 767 NE1 TRP A 50 -0.211 19.435 0.382 1.00 0.00 N ATOM 768 CE2 TRP A 50 1.116 19.228 0.117 1.00 0.00 C ATOM 769 CE3 TRP A 50 2.541 18.958 -1.814 1.00 0.00 C ATOM 770 CZ2 TRP A 50 2.195 19.090 0.988 1.00 0.00 C ATOM 771 CZ3 TRP A 50 3.610 18.822 -0.949 1.00 0.00 C ATOM 772 CH2 TRP A 50 3.432 18.888 0.438 1.00 0.00 C ATOM 0 H TRP A 50 -3.000 17.885 -3.696 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.134 18.133 -4.906 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.511 19.632 -3.883 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.123 20.133 -3.494 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -1.960 19.663 -0.900 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -0.624 19.524 1.311 1.00 0.00 H new ATOM 0 HE3 TRP A 50 2.688 18.905 -2.883 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 2.060 19.141 2.058 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 4.600 18.662 -1.350 1.00 0.00 H new ATOM 0 HH2 TRP A 50 4.288 18.777 1.087 1.00 0.00 H new ATOM 783 N CYS A 51 0.186 16.023 -4.659 1.00 0.00 N ATOM 784 CA CYS A 51 1.139 14.922 -4.627 1.00 0.00 C ATOM 785 C CYS A 51 1.579 14.529 -6.036 1.00 0.00 C ATOM 786 O CYS A 51 0.778 14.024 -6.823 1.00 0.00 O ATOM 787 CB CYS A 51 0.515 13.710 -3.931 1.00 0.00 C ATOM 788 SG CYS A 51 -1.132 13.258 -4.572 1.00 0.00 S ATOM 0 H CYS A 51 -0.426 16.028 -5.475 1.00 0.00 H new ATOM 0 HA CYS A 51 2.016 15.254 -4.072 1.00 0.00 H new ATOM 0 HB2 CYS A 51 1.184 12.856 -4.040 1.00 0.00 H new ATOM 0 HB3 CYS A 51 0.435 13.917 -2.864 1.00 0.00 H new ATOM 793 N GLY A 52 2.854 14.747 -6.349 1.00 0.00 N ATOM 794 CA GLY A 52 3.357 14.387 -7.664 1.00 0.00 C ATOM 795 C GLY A 52 3.256 12.899 -7.911 1.00 0.00 C ATOM 796 O GLY A 52 2.968 12.465 -9.025 1.00 0.00 O ATOM 0 H GLY A 52 3.543 15.163 -5.722 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.794 14.922 -8.429 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.397 14.702 -7.755 1.00 0.00 H new ATOM 800 N ALA A 53 3.480 12.115 -6.859 1.00 0.00 N ATOM 801 CA ALA A 53 3.395 10.663 -6.958 1.00 0.00 C ATOM 802 C ALA A 53 2.054 10.245 -7.527 1.00 0.00 C ATOM 803 O ALA A 53 1.912 9.150 -8.071 1.00 0.00 O ATOM 804 CB ALA A 53 3.623 10.021 -5.598 1.00 0.00 C ATOM 0 H ALA A 53 3.721 12.462 -5.930 1.00 0.00 H new ATOM 0 HA ALA A 53 4.176 10.319 -7.635 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.556 8.937 -5.691 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.612 10.293 -5.229 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.865 10.372 -4.898 1.00 0.00 H new ATOM 810 N CYS A 54 1.074 11.127 -7.410 1.00 0.00 N ATOM 811 CA CYS A 54 -0.246 10.847 -7.924 1.00 0.00 C ATOM 812 C CYS A 54 -0.389 11.408 -9.337 1.00 0.00 C ATOM 813 O CYS A 54 -1.031 10.803 -10.194 1.00 0.00 O ATOM 814 CB CYS A 54 -1.316 11.437 -7.001 1.00 0.00 C ATOM 815 SG CYS A 54 -0.898 11.349 -5.227 1.00 0.00 S ATOM 0 H CYS A 54 1.173 12.039 -6.964 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.385 9.767 -7.962 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -1.481 12.479 -7.273 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -2.256 10.911 -7.169 1.00 0.00 H new ATOM 820 N LYS A 55 0.230 12.563 -9.572 1.00 0.00 N ATOM 821 CA LYS A 55 0.185 13.204 -10.883 1.00 0.00 C ATOM 822 C LYS A 55 0.712 12.262 -11.960 1.00 0.00 C ATOM 823 O LYS A 55 -0.002 11.917 -12.901 1.00 0.00 O ATOM 824 CB LYS A 55 1.001 14.499 -10.869 1.00 0.00 C ATOM 825 CG LYS A 55 0.157 15.752 -11.034 1.00 0.00 C ATOM 826 CD LYS A 55 0.989 16.920 -11.538 1.00 0.00 C ATOM 827 CE LYS A 55 1.538 17.750 -10.388 1.00 0.00 C ATOM 828 NZ LYS A 55 2.921 18.229 -10.661 1.00 0.00 N ATOM 0 H LYS A 55 0.768 13.073 -8.872 1.00 0.00 H new ATOM 0 HA LYS A 55 -0.853 13.445 -11.112 1.00 0.00 H new ATOM 0 HB2 LYS A 55 1.550 14.562 -9.930 1.00 0.00 H new ATOM 0 HB3 LYS A 55 1.741 14.461 -11.669 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.656 15.555 -11.732 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.299 16.014 -10.079 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.814 16.546 -12.144 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.379 17.551 -12.185 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.885 18.605 -10.213 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.534 17.154 -9.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.260 18.791 -9.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.550 17.413 -10.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.921 18.819 -11.518 1.00 0.00 H new ATOM 842 N ALA A 56 1.963 11.837 -11.806 1.00 0.00 N ATOM 843 CA ALA A 56 2.580 10.918 -12.756 1.00 0.00 C ATOM 844 C ALA A 56 1.895 9.558 -12.725 1.00 0.00 C ATOM 845 O ALA A 56 2.105 8.734 -13.608 1.00 0.00 O ATOM 846 CB ALA A 56 4.066 10.771 -12.460 1.00 0.00 C ATOM 0 H ALA A 56 2.568 12.114 -11.033 1.00 0.00 H new ATOM 0 HA ALA A 56 2.461 11.333 -13.757 1.00 0.00 H new ATOM 0 HB1 ALA A 56 4.513 10.082 -13.177 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.551 11.744 -12.540 1.00 0.00 H new ATOM 0 HB3 ALA A 56 4.199 10.381 -11.451 1.00 0.00 H new ATOM 852 N LEU A 57 1.093 9.321 -11.695 1.00 0.00 N ATOM 853 CA LEU A 57 0.397 8.051 -11.544 1.00 0.00 C ATOM 854 C LEU A 57 -0.928 8.014 -12.312 1.00 0.00 C ATOM 855 O LEU A 57 -1.509 6.953 -12.479 1.00 0.00 O ATOM 856 CB LEU A 57 0.145 7.770 -10.060 1.00 0.00 C ATOM 857 CG LEU A 57 1.171 6.854 -9.381 1.00 0.00 C ATOM 858 CD1 LEU A 57 0.850 5.395 -9.661 1.00 0.00 C ATOM 859 CD2 LEU A 57 2.585 7.187 -9.838 1.00 0.00 C ATOM 0 H LEU A 57 0.909 9.994 -10.951 1.00 0.00 H new ATOM 0 HA LEU A 57 1.038 7.278 -11.967 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.122 8.720 -9.526 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.843 7.322 -9.955 1.00 0.00 H new ATOM 0 HG LEU A 57 1.115 7.021 -8.305 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.588 4.760 -9.172 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.143 5.161 -9.276 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.874 5.217 -10.736 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.293 6.523 -9.342 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.659 7.055 -10.917 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.816 8.221 -9.582 1.00 0.00 H new ATOM 871 N LYS A 58 -1.431 9.159 -12.755 1.00 0.00 N ATOM 872 CA LYS A 58 -2.712 9.175 -13.466 1.00 0.00 C ATOM 873 C LYS A 58 -2.607 8.622 -14.896 1.00 0.00 C ATOM 874 O LYS A 58 -3.219 7.597 -15.212 1.00 0.00 O ATOM 875 CB LYS A 58 -3.325 10.583 -13.476 1.00 0.00 C ATOM 876 CG LYS A 58 -3.024 11.392 -12.223 1.00 0.00 C ATOM 877 CD LYS A 58 -4.228 12.209 -11.783 1.00 0.00 C ATOM 878 CE LYS A 58 -4.217 13.597 -12.402 1.00 0.00 C ATOM 879 NZ LYS A 58 -5.481 14.339 -12.131 1.00 0.00 N ATOM 0 H LYS A 58 -0.988 10.071 -12.641 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.375 8.509 -12.915 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.953 11.125 -14.345 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.406 10.498 -13.592 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.725 10.720 -11.418 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.181 12.057 -12.412 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.144 11.690 -12.067 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.233 12.294 -10.696 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.373 14.163 -12.008 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.070 13.513 -13.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.432 15.280 -12.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.285 13.812 -12.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.609 14.443 -11.104 1.00 0.00 H new ATOM 893 N PRO A 59 -1.838 9.277 -15.786 1.00 0.00 N ATOM 894 CA PRO A 59 -1.695 8.832 -17.176 1.00 0.00 C ATOM 895 C PRO A 59 -0.737 7.661 -17.333 1.00 0.00 C ATOM 896 O PRO A 59 -0.710 7.006 -18.373 1.00 0.00 O ATOM 897 CB PRO A 59 -1.133 10.065 -17.871 1.00 0.00 C ATOM 898 CG PRO A 59 -0.331 10.743 -16.818 1.00 0.00 C ATOM 899 CD PRO A 59 -1.048 10.493 -15.516 1.00 0.00 C ATOM 0 HA PRO A 59 -2.640 8.472 -17.583 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.517 9.793 -18.728 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.929 10.710 -18.243 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.684 10.346 -16.786 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.249 11.811 -17.018 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.348 10.342 -14.695 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -1.686 11.333 -15.241 1.00 0.00 H new ATOM 907 N LYS A 60 0.050 7.403 -16.301 1.00 0.00 N ATOM 908 CA LYS A 60 1.010 6.315 -16.342 1.00 0.00 C ATOM 909 C LYS A 60 0.436 5.075 -15.674 1.00 0.00 C ATOM 910 O LYS A 60 0.406 3.999 -16.274 1.00 0.00 O ATOM 911 CB LYS A 60 2.317 6.747 -15.677 1.00 0.00 C ATOM 912 CG LYS A 60 3.000 5.661 -14.865 1.00 0.00 C ATOM 913 CD LYS A 60 3.699 4.660 -15.763 1.00 0.00 C ATOM 914 CE LYS A 60 4.805 5.327 -16.566 1.00 0.00 C ATOM 915 NZ LYS A 60 4.593 5.182 -18.032 1.00 0.00 N ATOM 0 H LYS A 60 0.042 7.931 -15.428 1.00 0.00 H new ATOM 0 HA LYS A 60 1.222 6.065 -17.382 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.005 7.093 -16.448 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.115 7.597 -15.025 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.724 6.112 -14.187 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.263 5.147 -14.248 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.118 3.855 -15.159 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.975 4.207 -16.441 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.852 6.385 -16.309 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.766 4.890 -16.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.368 5.650 -18.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.574 4.173 -18.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.689 5.622 -18.297 1.00 0.00 H new ATOM 929 N PHE A 61 -0.034 5.222 -14.436 1.00 0.00 N ATOM 930 CA PHE A 61 -0.616 4.093 -13.731 1.00 0.00 C ATOM 931 C PHE A 61 -1.769 3.541 -14.538 1.00 0.00 C ATOM 932 O PHE A 61 -2.109 2.369 -14.419 1.00 0.00 O ATOM 933 CB PHE A 61 -1.079 4.479 -12.337 1.00 0.00 C ATOM 934 CG PHE A 61 -1.464 3.296 -11.496 1.00 0.00 C ATOM 935 CD1 PHE A 61 -2.741 2.766 -11.579 1.00 0.00 C ATOM 936 CD2 PHE A 61 -0.551 2.708 -10.638 1.00 0.00 C ATOM 937 CE1 PHE A 61 -3.101 1.672 -10.818 1.00 0.00 C ATOM 938 CE2 PHE A 61 -0.905 1.613 -9.873 1.00 0.00 C ATOM 939 CZ PHE A 61 -2.183 1.094 -9.963 1.00 0.00 C ATOM 0 H PHE A 61 -0.022 6.097 -13.912 1.00 0.00 H new ATOM 0 HA PHE A 61 0.151 3.327 -13.615 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.283 5.030 -11.836 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.932 5.153 -12.417 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.463 3.213 -12.246 1.00 0.00 H new ATOM 0 HD2 PHE A 61 0.449 3.109 -10.566 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.100 1.268 -10.891 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.184 1.163 -9.206 1.00 0.00 H new ATOM 0 HZ PHE A 61 -2.463 0.239 -9.366 1.00 0.00 H new ATOM 949 N ALA A 62 -2.342 4.373 -15.406 1.00 0.00 N ATOM 950 CA ALA A 62 -3.411 3.912 -16.269 1.00 0.00 C ATOM 951 C ALA A 62 -2.910 2.704 -17.072 1.00 0.00 C ATOM 952 O ALA A 62 -3.691 1.878 -17.545 1.00 0.00 O ATOM 953 CB ALA A 62 -3.873 5.037 -17.186 1.00 0.00 C ATOM 0 H ALA A 62 -2.085 5.353 -15.525 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.270 3.608 -15.671 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.676 4.676 -17.828 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.236 5.871 -16.585 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.038 5.371 -17.802 1.00 0.00 H new ATOM 959 N GLU A 63 -1.578 2.606 -17.173 1.00 0.00 N ATOM 960 CA GLU A 63 -0.902 1.507 -17.857 1.00 0.00 C ATOM 961 C GLU A 63 -0.957 0.249 -17.006 1.00 0.00 C ATOM 962 O GLU A 63 -0.676 -0.853 -17.481 1.00 0.00 O ATOM 963 CB GLU A 63 0.553 1.885 -18.147 1.00 0.00 C ATOM 964 CG GLU A 63 1.127 1.198 -19.377 1.00 0.00 C ATOM 965 CD GLU A 63 0.658 1.833 -20.671 1.00 0.00 C ATOM 966 OE1 GLU A 63 1.107 2.958 -20.976 1.00 0.00 O ATOM 967 OE2 GLU A 63 -0.158 1.206 -21.378 1.00 0.00 O ATOM 0 H GLU A 63 -0.938 3.295 -16.778 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.410 1.314 -18.802 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.620 2.965 -18.280 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.165 1.632 -17.281 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.216 1.233 -19.333 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.841 0.146 -19.368 1.00 0.00 H new ATOM 974 N SER A 64 -1.328 0.427 -15.742 1.00 0.00 N ATOM 975 CA SER A 64 -1.444 -0.666 -14.794 1.00 0.00 C ATOM 976 C SER A 64 -2.357 -1.775 -15.306 1.00 0.00 C ATOM 977 O SER A 64 -2.589 -2.753 -14.601 1.00 0.00 O ATOM 978 CB SER A 64 -1.979 -0.136 -13.470 1.00 0.00 C ATOM 979 OG SER A 64 -1.005 0.642 -12.796 1.00 0.00 O ATOM 0 H SER A 64 -1.557 1.340 -15.349 1.00 0.00 H new ATOM 0 HA SER A 64 -0.450 -1.093 -14.657 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.869 0.467 -13.650 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.282 -0.970 -12.838 1.00 0.00 H new ATOM 0 HG SER A 64 -1.433 1.148 -12.074 1.00 0.00 H new ATOM 985 N THR A 65 -2.869 -1.642 -16.531 1.00 0.00 N ATOM 986 CA THR A 65 -3.728 -2.668 -17.106 1.00 0.00 C ATOM 987 C THR A 65 -3.103 -4.035 -16.857 1.00 0.00 C ATOM 988 O THR A 65 -3.788 -4.998 -16.517 1.00 0.00 O ATOM 989 CB THR A 65 -3.917 -2.436 -18.606 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.564 -1.110 -18.959 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.335 -2.673 -19.072 1.00 0.00 C ATOM 0 H THR A 65 -2.703 -0.839 -17.137 1.00 0.00 H new ATOM 0 HA THR A 65 -4.709 -2.622 -16.633 1.00 0.00 H new ATOM 0 HB THR A 65 -3.264 -3.160 -19.094 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.691 -0.983 -19.922 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.401 -2.491 -20.145 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.620 -3.704 -18.860 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.008 -1.995 -18.547 1.00 0.00 H new ATOM 999 N GLU A 66 -1.780 -4.084 -16.980 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.038 -5.305 -16.720 1.00 0.00 C ATOM 1001 C GLU A 66 -0.854 -5.455 -15.223 1.00 0.00 C ATOM 1002 O GLU A 66 -0.840 -6.569 -14.699 1.00 0.00 O ATOM 1003 CB GLU A 66 0.316 -5.289 -17.433 1.00 0.00 C ATOM 1004 CG GLU A 66 1.236 -4.185 -16.947 1.00 0.00 C ATOM 1005 CD GLU A 66 1.520 -3.147 -18.014 1.00 0.00 C ATOM 1006 OE1 GLU A 66 1.536 -3.512 -19.208 1.00 0.00 O ATOM 1007 OE2 GLU A 66 1.726 -1.968 -17.656 1.00 0.00 O ATOM 0 H GLU A 66 -1.203 -3.290 -17.258 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.598 -6.156 -17.108 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.807 -6.252 -17.288 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.153 -5.172 -18.504 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.786 -3.697 -16.082 1.00 0.00 H new ATOM 0 HG3 GLU A 66 2.177 -4.623 -16.612 1.00 0.00 H new ATOM 1014 N ILE A 67 -0.765 -4.324 -14.526 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.646 -4.360 -13.083 1.00 0.00 C ATOM 1016 C ILE A 67 -1.946 -4.900 -12.494 1.00 0.00 C ATOM 1017 O ILE A 67 -1.980 -5.373 -11.358 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.329 -2.970 -12.493 1.00 0.00 C ATOM 1019 CG1 ILE A 67 1.043 -2.487 -12.979 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.379 -3.002 -10.970 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.480 -1.170 -12.368 1.00 0.00 C ATOM 0 H ILE A 67 -0.773 -3.390 -14.935 1.00 0.00 H new ATOM 0 HA ILE A 67 0.187 -5.013 -12.823 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.088 -2.268 -12.840 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.788 -3.248 -12.749 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.018 -2.383 -14.064 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.152 -2.011 -10.578 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.375 -3.302 -10.645 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.355 -3.717 -10.597 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.459 -0.894 -12.760 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.757 -0.394 -12.620 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.539 -1.273 -11.285 1.00 0.00 H new ATOM 1033 N SER A 68 -3.014 -4.863 -13.301 1.00 0.00 N ATOM 1034 CA SER A 68 -4.302 -5.387 -12.875 1.00 0.00 C ATOM 1035 C SER A 68 -4.153 -6.876 -12.620 1.00 0.00 C ATOM 1036 O SER A 68 -4.723 -7.425 -11.677 1.00 0.00 O ATOM 1037 CB SER A 68 -5.369 -5.131 -13.941 1.00 0.00 C ATOM 1038 OG SER A 68 -5.342 -6.129 -14.945 1.00 0.00 O ATOM 0 H SER A 68 -3.005 -4.477 -14.245 1.00 0.00 H new ATOM 0 HA SER A 68 -4.620 -4.883 -11.962 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.354 -5.108 -13.475 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.207 -4.153 -14.393 1.00 0.00 H new ATOM 0 HG SER A 68 -4.889 -5.780 -15.741 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.341 -7.515 -13.461 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.064 -8.931 -13.324 1.00 0.00 C ATOM 1046 C GLU A 69 -2.129 -9.133 -12.145 1.00 0.00 C ATOM 1047 O GLU A 69 -2.327 -10.024 -11.320 1.00 0.00 O ATOM 1048 CB GLU A 69 -2.433 -9.484 -14.604 1.00 0.00 C ATOM 1049 CG GLU A 69 -3.226 -9.164 -15.860 1.00 0.00 C ATOM 1050 CD GLU A 69 -4.575 -9.855 -15.891 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -5.432 -9.519 -15.044 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -4.775 -10.731 -16.757 1.00 0.00 O ATOM 0 H GLU A 69 -2.866 -7.067 -14.244 1.00 0.00 H new ATOM 0 HA GLU A 69 -3.996 -9.469 -13.152 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.426 -9.079 -14.707 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.334 -10.566 -14.512 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.373 -8.086 -15.928 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.649 -9.463 -16.735 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.122 -8.269 -12.057 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.163 -8.323 -10.957 1.00 0.00 C ATOM 1061 C LEU A 70 -0.861 -8.063 -9.623 1.00 0.00 C ATOM 1062 O LEU A 70 -0.301 -8.316 -8.557 1.00 0.00 O ATOM 1063 CB LEU A 70 0.946 -7.291 -11.158 1.00 0.00 C ATOM 1064 CG LEU A 70 2.080 -7.724 -12.087 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.693 -7.488 -13.537 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.360 -6.977 -11.745 1.00 0.00 C ATOM 0 H LEU A 70 -0.949 -7.524 -12.732 1.00 0.00 H new ATOM 0 HA LEU A 70 0.276 -9.321 -10.944 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.502 -6.378 -11.554 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.370 -7.043 -10.185 1.00 0.00 H new ATOM 0 HG LEU A 70 2.258 -8.790 -11.947 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.510 -7.801 -14.187 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.799 -8.065 -13.774 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.492 -6.428 -13.692 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.158 -7.297 -12.415 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.197 -5.905 -11.859 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.643 -7.193 -10.715 1.00 0.00 H new ATOM 1078 N SER A 71 -2.081 -7.543 -9.686 1.00 0.00 N ATOM 1079 CA SER A 71 -2.841 -7.240 -8.483 1.00 0.00 C ATOM 1080 C SER A 71 -3.221 -8.505 -7.722 1.00 0.00 C ATOM 1081 O SER A 71 -3.425 -8.469 -6.510 1.00 0.00 O ATOM 1082 CB SER A 71 -4.105 -6.475 -8.837 1.00 0.00 C ATOM 1083 OG SER A 71 -4.248 -5.319 -8.029 1.00 0.00 O ATOM 0 H SER A 71 -2.563 -7.323 -10.557 1.00 0.00 H new ATOM 0 HA SER A 71 -2.203 -6.630 -7.843 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.076 -6.186 -9.888 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.973 -7.122 -8.708 1.00 0.00 H new ATOM 0 HG SER A 71 -5.183 -5.026 -8.040 1.00 0.00 H new ATOM 1089 N HIS A 72 -3.311 -9.626 -8.431 1.00 0.00 N ATOM 1090 CA HIS A 72 -3.662 -10.890 -7.797 1.00 0.00 C ATOM 1091 C HIS A 72 -2.616 -11.264 -6.757 1.00 0.00 C ATOM 1092 O HIS A 72 -2.835 -12.140 -5.922 1.00 0.00 O ATOM 1093 CB HIS A 72 -3.799 -12.005 -8.840 1.00 0.00 C ATOM 1094 CG HIS A 72 -2.519 -12.348 -9.543 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -2.435 -12.505 -10.912 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -1.270 -12.570 -9.067 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -1.194 -12.808 -11.244 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -0.468 -12.852 -10.144 1.00 0.00 N ATOM 0 H HIS A 72 -3.147 -9.684 -9.436 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.625 -10.769 -7.301 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -4.183 -12.900 -8.351 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.539 -11.705 -9.582 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -0.963 -12.532 -8.032 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -0.834 -12.989 -12.246 1.00 0.00 H new ATOM 0 HE2 HIS A 72 0.529 -13.062 -10.101 1.00 0.00 H new ATOM 1107 N ASN A 73 -1.474 -10.591 -6.827 1.00 0.00 N ATOM 1108 CA ASN A 73 -0.379 -10.843 -5.906 1.00 0.00 C ATOM 1109 C ASN A 73 -0.602 -10.137 -4.565 1.00 0.00 C ATOM 1110 O ASN A 73 -0.057 -10.548 -3.541 1.00 0.00 O ATOM 1111 CB ASN A 73 0.922 -10.393 -6.554 1.00 0.00 C ATOM 1112 CG ASN A 73 1.128 -11.052 -7.903 1.00 0.00 C ATOM 1113 OD1 ASN A 73 1.258 -12.271 -7.997 1.00 0.00 O ATOM 1114 ND2 ASN A 73 1.161 -10.249 -8.959 1.00 0.00 N ATOM 0 H ASN A 73 -1.284 -9.864 -7.516 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.328 -11.911 -5.694 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.914 -9.310 -6.675 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.759 -10.634 -5.898 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.298 -10.638 -9.892 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.049 -9.242 -8.838 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.425 -9.093 -4.580 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.761 -8.336 -3.378 1.00 0.00 C ATOM 1123 C PHE A 74 -3.203 -7.841 -3.503 1.00 0.00 C ATOM 1124 O PHE A 74 -4.009 -8.502 -4.158 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.777 -7.181 -3.171 1.00 0.00 C ATOM 1126 CG PHE A 74 -0.414 -6.468 -4.435 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -1.395 -5.894 -5.221 1.00 0.00 C ATOM 1128 CD2 PHE A 74 0.910 -6.380 -4.844 1.00 0.00 C ATOM 1129 CE1 PHE A 74 -1.069 -5.243 -6.391 1.00 0.00 C ATOM 1130 CE2 PHE A 74 1.241 -5.730 -6.016 1.00 0.00 C ATOM 1131 CZ PHE A 74 0.250 -5.162 -6.792 1.00 0.00 C ATOM 0 H PHE A 74 -1.878 -8.748 -5.426 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.681 -8.975 -2.498 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.211 -6.466 -2.472 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.131 -7.567 -2.708 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.429 -5.956 -4.915 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.688 -6.824 -4.240 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -1.845 -4.796 -6.994 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.274 -5.666 -6.326 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.506 -4.655 -7.711 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.565 -6.709 -2.889 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.952 -6.258 -3.014 1.00 0.00 C ATOM 1143 C VAL A 75 -5.198 -4.774 -2.703 1.00 0.00 C ATOM 1144 O VAL A 75 -4.652 -4.206 -1.758 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.881 -7.110 -2.130 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.680 -6.779 -0.658 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.331 -6.914 -2.544 1.00 0.00 C ATOM 0 H VAL A 75 -2.953 -6.116 -2.329 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.178 -6.386 -4.073 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.626 -8.160 -2.271 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.347 -7.393 -0.053 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.646 -6.981 -0.378 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.903 -5.726 -0.488 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.976 -7.523 -1.910 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.602 -5.864 -2.435 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.456 -7.215 -3.584 1.00 0.00 H new ATOM 1157 N MET A 76 -6.066 -4.187 -3.534 1.00 0.00 N ATOM 1158 CA MET A 76 -6.498 -2.800 -3.462 1.00 0.00 C ATOM 1159 C MET A 76 -6.703 -2.225 -2.067 1.00 0.00 C ATOM 1160 O MET A 76 -7.755 -2.441 -1.449 1.00 0.00 O ATOM 1161 CB MET A 76 -7.853 -2.731 -4.136 1.00 0.00 C ATOM 1162 CG MET A 76 -8.753 -3.910 -3.781 1.00 0.00 C ATOM 1163 SD MET A 76 -8.722 -5.225 -5.020 1.00 0.00 S ATOM 1164 CE MET A 76 -10.158 -6.182 -4.541 1.00 0.00 C ATOM 0 H MET A 76 -6.501 -4.693 -4.305 1.00 0.00 H new ATOM 0 HA MET A 76 -5.698 -2.220 -3.923 1.00 0.00 H new ATOM 0 HB2 MET A 76 -8.349 -1.803 -3.850 1.00 0.00 H new ATOM 0 HB3 MET A 76 -7.714 -2.699 -5.217 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.444 -4.318 -2.819 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.777 -3.555 -3.662 1.00 0.00 H new ATOM 0 HE1 MET A 76 -9.894 -7.239 -4.499 1.00 0.00 H new ATOM 0 HE2 MET A 76 -10.503 -5.855 -3.560 1.00 0.00 H new ATOM 0 HE3 MET A 76 -10.953 -6.036 -5.272 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.745 -1.406 -1.634 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.848 -0.710 -0.358 1.00 0.00 C ATOM 1176 C VAL A 77 -5.333 0.718 -0.480 1.00 0.00 C ATOM 1177 O VAL A 77 -4.346 1.095 0.149 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.094 -1.438 0.771 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.123 -0.624 2.057 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -5.697 -2.805 1.002 1.00 0.00 C ATOM 0 H VAL A 77 -4.888 -1.210 -2.152 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.906 -0.695 -0.095 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.054 -1.556 0.468 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.584 -1.159 2.839 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.649 0.343 1.886 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.157 -0.472 2.368 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.156 -3.311 1.802 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.745 -2.698 1.283 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.625 -3.394 0.087 1.00 0.00 H new ATOM 1190 N ASN A 78 -6.012 1.506 -1.300 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.632 2.888 -1.512 1.00 0.00 C ATOM 1192 C ASN A 78 -6.540 3.828 -0.725 1.00 0.00 C ATOM 1193 O ASN A 78 -7.692 4.048 -1.091 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.683 3.202 -3.003 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.968 4.657 -3.316 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -7.048 5.003 -3.795 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -4.998 5.516 -3.046 1.00 0.00 N ATOM 0 H ASN A 78 -6.831 1.208 -1.830 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.614 3.038 -1.151 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -4.731 2.923 -3.456 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -6.451 2.584 -3.468 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.130 6.510 -3.235 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.119 5.184 -2.649 1.00 0.00 H new ATOM 1204 N LEU A 79 -6.004 4.374 0.356 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.761 5.288 1.205 1.00 0.00 C ATOM 1206 C LEU A 79 -6.173 6.700 1.171 1.00 0.00 C ATOM 1207 O LEU A 79 -5.275 6.995 0.379 1.00 0.00 O ATOM 1208 CB LEU A 79 -6.796 4.763 2.644 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.432 4.423 3.251 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -4.955 5.546 4.158 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -5.503 3.111 4.017 1.00 0.00 C ATOM 0 H LEU A 79 -5.048 4.202 0.668 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.778 5.341 0.818 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -7.279 5.510 3.274 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -7.420 3.870 2.672 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.713 4.310 2.440 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.984 5.286 4.580 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.865 6.466 3.581 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.673 5.692 4.965 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.525 2.884 4.442 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.236 3.197 4.819 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -5.799 2.310 3.340 1.00 0.00 H new ATOM 1223 N GLU A 80 -6.692 7.569 2.031 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.232 8.950 2.106 1.00 0.00 C ATOM 1225 C GLU A 80 -5.662 9.257 3.488 1.00 0.00 C ATOM 1226 O GLU A 80 -5.457 8.355 4.299 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.381 9.910 1.788 1.00 0.00 C ATOM 1228 CG GLU A 80 -6.976 11.064 0.883 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.119 11.548 0.011 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -9.090 12.106 0.564 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -8.042 11.369 -1.222 1.00 0.00 O ATOM 0 H GLU A 80 -7.436 7.339 2.690 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.441 9.086 1.368 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.188 9.353 1.313 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.777 10.312 2.721 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.614 11.891 1.494 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.147 10.750 0.249 1.00 0.00 H new ATOM 1238 N ASP A 81 -5.405 10.535 3.746 1.00 0.00 N ATOM 1239 CA ASP A 81 -4.854 10.969 5.029 1.00 0.00 C ATOM 1240 C ASP A 81 -5.588 10.320 6.200 1.00 0.00 C ATOM 1241 O ASP A 81 -4.979 9.985 7.216 1.00 0.00 O ATOM 1242 CB ASP A 81 -4.931 12.492 5.148 1.00 0.00 C ATOM 1243 CG ASP A 81 -3.980 13.039 6.196 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -4.028 12.561 7.349 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -3.188 13.945 5.862 1.00 0.00 O ATOM 0 H ASP A 81 -5.569 11.292 3.083 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.811 10.654 5.067 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -4.700 12.941 4.182 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.951 12.783 5.399 1.00 0.00 H new ATOM 1250 N GLU A 82 -6.899 10.144 6.056 1.00 0.00 N ATOM 1251 CA GLU A 82 -7.707 9.535 7.107 1.00 0.00 C ATOM 1252 C GLU A 82 -8.360 8.243 6.617 1.00 0.00 C ATOM 1253 O GLU A 82 -7.891 7.148 6.923 1.00 0.00 O ATOM 1254 CB GLU A 82 -8.775 10.518 7.599 1.00 0.00 C ATOM 1255 CG GLU A 82 -8.779 10.701 9.108 1.00 0.00 C ATOM 1256 CD GLU A 82 -10.168 10.942 9.663 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -11.138 10.400 9.093 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -10.287 11.673 10.669 1.00 0.00 O ATOM 0 H GLU A 82 -7.423 10.414 5.223 1.00 0.00 H new ATOM 0 HA GLU A 82 -7.048 9.288 7.939 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -8.614 11.486 7.124 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -9.756 10.166 7.281 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.353 9.815 9.579 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.136 11.542 9.370 1.00 0.00 H new ATOM 1265 N GLU A 83 -9.444 8.379 5.853 1.00 0.00 N ATOM 1266 CA GLU A 83 -10.165 7.226 5.317 1.00 0.00 C ATOM 1267 C GLU A 83 -10.437 6.182 6.403 1.00 0.00 C ATOM 1268 O GLU A 83 -11.473 6.221 7.065 1.00 0.00 O ATOM 1269 CB GLU A 83 -9.383 6.601 4.158 1.00 0.00 C ATOM 1270 CG GLU A 83 -9.864 7.049 2.788 1.00 0.00 C ATOM 1271 CD GLU A 83 -11.274 6.583 2.485 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -12.227 7.186 3.020 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -11.425 5.614 1.711 1.00 0.00 O ATOM 0 H GLU A 83 -9.843 9.280 5.591 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.128 7.577 4.945 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.328 6.854 4.264 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -9.458 5.516 4.223 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -9.825 8.137 2.731 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -9.186 6.665 2.025 1.00 0.00 H new ATOM 1280 N GLU A 84 -9.505 5.247 6.581 1.00 0.00 N ATOM 1281 CA GLU A 84 -9.655 4.198 7.584 1.00 0.00 C ATOM 1282 C GLU A 84 -8.581 4.300 8.669 1.00 0.00 C ATOM 1283 O GLU A 84 -8.901 4.368 9.856 1.00 0.00 O ATOM 1284 CB GLU A 84 -9.611 2.817 6.922 1.00 0.00 C ATOM 1285 CG GLU A 84 -10.963 2.123 6.874 1.00 0.00 C ATOM 1286 CD GLU A 84 -11.520 2.029 5.467 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -11.975 3.065 4.937 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -11.503 0.919 4.895 1.00 0.00 O ATOM 0 H GLU A 84 -8.640 5.196 6.044 1.00 0.00 H new ATOM 0 HA GLU A 84 -10.625 4.333 8.062 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -9.229 2.922 5.906 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -8.907 2.186 7.464 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -10.868 1.120 7.291 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.668 2.665 7.505 1.00 0.00 H new ATOM 1295 N PRO A 85 -7.288 4.308 8.288 1.00 0.00 N ATOM 1296 CA PRO A 85 -6.184 4.396 9.241 1.00 0.00 C ATOM 1297 C PRO A 85 -5.928 5.831 9.697 1.00 0.00 C ATOM 1298 O PRO A 85 -6.673 6.747 9.349 1.00 0.00 O ATOM 1299 CB PRO A 85 -4.973 3.861 8.456 1.00 0.00 C ATOM 1300 CG PRO A 85 -5.483 3.501 7.093 1.00 0.00 C ATOM 1301 CD PRO A 85 -6.785 4.230 6.915 1.00 0.00 C ATOM 0 HA PRO A 85 -6.394 3.835 10.152 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -4.188 4.614 8.391 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -4.541 2.992 8.952 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -4.768 3.791 6.323 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.627 2.424 7.005 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.642 5.218 6.478 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.469 3.688 6.261 1.00 0.00 H new ATOM 1309 N LYS A 86 -4.868 6.015 10.478 1.00 0.00 N ATOM 1310 CA LYS A 86 -4.506 7.334 10.984 1.00 0.00 C ATOM 1311 C LYS A 86 -3.238 7.260 11.829 1.00 0.00 C ATOM 1312 O LYS A 86 -3.280 7.429 13.048 1.00 0.00 O ATOM 1313 CB LYS A 86 -5.652 7.922 11.813 1.00 0.00 C ATOM 1314 CG LYS A 86 -5.719 9.441 11.765 1.00 0.00 C ATOM 1315 CD LYS A 86 -7.092 9.952 12.174 1.00 0.00 C ATOM 1316 CE LYS A 86 -6.990 11.060 13.210 1.00 0.00 C ATOM 1317 NZ LYS A 86 -8.325 11.625 13.552 1.00 0.00 N ATOM 0 H LYS A 86 -4.243 5.265 10.775 1.00 0.00 H new ATOM 0 HA LYS A 86 -4.317 7.984 10.130 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.596 7.513 11.454 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.540 7.604 12.850 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.961 9.861 12.427 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.487 9.785 10.757 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -7.620 10.322 11.295 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.682 9.129 12.577 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -6.518 10.671 14.112 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -6.346 11.854 12.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -8.212 12.377 14.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -8.765 12.019 12.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -8.932 10.873 13.938 1.00 0.00 H new ATOM 1331 N ASP A 87 -2.109 7.001 11.175 1.00 0.00 N ATOM 1332 CA ASP A 87 -0.832 6.901 11.870 1.00 0.00 C ATOM 1333 C ASP A 87 0.325 7.303 10.959 1.00 0.00 C ATOM 1334 O ASP A 87 0.120 7.886 9.895 1.00 0.00 O ATOM 1335 CB ASP A 87 -0.622 5.475 12.386 1.00 0.00 C ATOM 1336 CG ASP A 87 -0.033 5.448 13.782 1.00 0.00 C ATOM 1337 OD1 ASP A 87 1.019 6.086 13.995 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -0.624 4.789 14.663 1.00 0.00 O ATOM 0 H ASP A 87 -2.054 6.857 10.167 1.00 0.00 H new ATOM 0 HA ASP A 87 -0.854 7.589 12.715 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.576 4.947 12.386 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.039 4.938 11.705 1.00 0.00 H new ATOM 1343 N GLU A 88 1.543 6.985 11.389 1.00 0.00 N ATOM 1344 CA GLU A 88 2.740 7.310 10.621 1.00 0.00 C ATOM 1345 C GLU A 88 2.930 6.352 9.446 1.00 0.00 C ATOM 1346 O GLU A 88 3.725 6.617 8.547 1.00 0.00 O ATOM 1347 CB GLU A 88 3.973 7.272 11.527 1.00 0.00 C ATOM 1348 CG GLU A 88 4.184 8.552 12.321 1.00 0.00 C ATOM 1349 CD GLU A 88 4.603 9.718 11.448 1.00 0.00 C ATOM 1350 OE1 GLU A 88 3.713 10.395 10.893 1.00 0.00 O ATOM 1351 OE2 GLU A 88 5.823 9.954 11.320 1.00 0.00 O ATOM 0 H GLU A 88 1.727 6.501 12.268 1.00 0.00 H new ATOM 0 HA GLU A 88 2.614 8.315 10.219 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.879 6.436 12.220 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.856 7.083 10.917 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.262 8.807 12.843 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.945 8.381 13.082 1.00 0.00 H new ATOM 1358 N ASP A 89 2.205 5.233 9.463 1.00 0.00 N ATOM 1359 CA ASP A 89 2.305 4.234 8.400 1.00 0.00 C ATOM 1360 C ASP A 89 2.290 4.884 7.013 1.00 0.00 C ATOM 1361 O ASP A 89 2.927 4.394 6.085 1.00 0.00 O ATOM 1362 CB ASP A 89 1.159 3.220 8.515 1.00 0.00 C ATOM 1363 CG ASP A 89 1.581 1.943 9.225 1.00 0.00 C ATOM 1364 OD1 ASP A 89 2.655 1.947 9.861 1.00 0.00 O ATOM 1365 OD2 ASP A 89 0.836 0.939 9.144 1.00 0.00 O ATOM 0 H ASP A 89 1.542 4.996 10.201 1.00 0.00 H new ATOM 0 HA ASP A 89 3.258 3.718 8.520 1.00 0.00 H new ATOM 0 HB2 ASP A 89 0.329 3.675 9.055 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.794 2.974 7.518 1.00 0.00 H new ATOM 1370 N PHE A 90 1.558 5.987 6.880 1.00 0.00 N ATOM 1371 CA PHE A 90 1.461 6.698 5.602 1.00 0.00 C ATOM 1372 C PHE A 90 2.825 7.212 5.131 1.00 0.00 C ATOM 1373 O PHE A 90 2.992 7.552 3.948 1.00 0.00 O ATOM 1374 CB PHE A 90 0.483 7.868 5.724 1.00 0.00 C ATOM 1375 CG PHE A 90 -0.801 7.512 6.417 1.00 0.00 C ATOM 1376 CD1 PHE A 90 -1.474 6.342 6.105 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -1.337 8.351 7.383 1.00 0.00 C ATOM 1378 CE1 PHE A 90 -2.656 6.013 6.743 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -2.518 8.030 8.023 1.00 0.00 C ATOM 1380 CZ PHE A 90 -3.179 6.858 7.702 1.00 0.00 C ATOM 0 H PHE A 90 1.023 6.410 7.639 1.00 0.00 H new ATOM 0 HA PHE A 90 1.095 5.989 4.859 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.967 8.679 6.268 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.255 8.245 4.727 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.071 5.679 5.354 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.824 9.267 7.638 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -3.169 5.097 6.492 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.925 8.693 8.773 1.00 0.00 H new ATOM 0 HZ PHE A 90 -4.103 6.604 8.201 1.00 0.00 H new ATOM 1390 N SER A 91 3.785 7.275 6.063 1.00 0.00 N ATOM 1391 CA SER A 91 5.137 7.756 5.765 1.00 0.00 C ATOM 1392 C SER A 91 6.197 6.901 6.463 1.00 0.00 C ATOM 1393 O SER A 91 6.087 6.621 7.657 1.00 0.00 O ATOM 1394 CB SER A 91 5.289 9.212 6.212 1.00 0.00 C ATOM 1395 OG SER A 91 4.031 9.860 6.275 1.00 0.00 O ATOM 0 H SER A 91 3.647 6.997 7.035 1.00 0.00 H new ATOM 0 HA SER A 91 5.285 7.683 4.688 1.00 0.00 H new ATOM 0 HB2 SER A 91 5.769 9.247 7.190 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.941 9.743 5.518 1.00 0.00 H new ATOM 0 HG SER A 91 3.889 10.380 5.456 1.00 0.00 H new ATOM 1401 N PRO A 92 7.243 6.474 5.728 1.00 0.00 N ATOM 1402 CA PRO A 92 8.321 5.658 6.267 1.00 0.00 C ATOM 1403 C PRO A 92 9.553 6.481 6.619 1.00 0.00 C ATOM 1404 O PRO A 92 10.407 6.720 5.766 1.00 0.00 O ATOM 1405 CB PRO A 92 8.629 4.764 5.080 1.00 0.00 C ATOM 1406 CG PRO A 92 8.497 5.686 3.910 1.00 0.00 C ATOM 1407 CD PRO A 92 7.473 6.739 4.297 1.00 0.00 C ATOM 0 HA PRO A 92 8.049 5.145 7.190 1.00 0.00 H new ATOM 0 HB2 PRO A 92 9.631 4.339 5.146 1.00 0.00 H new ATOM 0 HB3 PRO A 92 7.932 3.929 5.014 1.00 0.00 H new ATOM 0 HG2 PRO A 92 9.455 6.147 3.671 1.00 0.00 H new ATOM 0 HG3 PRO A 92 8.175 5.141 3.022 1.00 0.00 H new ATOM 0 HD2 PRO A 92 7.850 7.748 4.130 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.556 6.641 3.717 1.00 0.00 H new ATOM 1415 N ASP A 93 9.652 6.914 7.869 1.00 0.00 N ATOM 1416 CA ASP A 93 10.798 7.707 8.297 1.00 0.00 C ATOM 1417 C ASP A 93 10.884 9.013 7.511 1.00 0.00 C ATOM 1418 O ASP A 93 11.945 9.632 7.431 1.00 0.00 O ATOM 1419 CB ASP A 93 12.088 6.901 8.107 1.00 0.00 C ATOM 1420 CG ASP A 93 13.310 7.629 8.633 1.00 0.00 C ATOM 1421 OD1 ASP A 93 13.289 8.053 9.806 1.00 0.00 O ATOM 1422 OD2 ASP A 93 14.287 7.776 7.868 1.00 0.00 O ATOM 0 H ASP A 93 8.961 6.733 8.597 1.00 0.00 H new ATOM 0 HA ASP A 93 10.672 7.950 9.352 1.00 0.00 H new ATOM 0 HB2 ASP A 93 11.992 5.943 8.617 1.00 0.00 H new ATOM 0 HB3 ASP A 93 12.225 6.686 7.047 1.00 0.00 H new ATOM 1427 N GLY A 94 9.764 9.430 6.925 1.00 0.00 N ATOM 1428 CA GLY A 94 9.747 10.659 6.150 1.00 0.00 C ATOM 1429 C GLY A 94 8.802 11.696 6.723 1.00 0.00 C ATOM 1430 O GLY A 94 8.282 11.531 7.827 1.00 0.00 O ATOM 0 H GLY A 94 8.871 8.940 6.973 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.754 11.073 6.110 1.00 0.00 H new ATOM 0 HA3 GLY A 94 9.455 10.434 5.124 1.00 0.00 H new ATOM 1434 N GLY A 95 8.582 12.770 5.971 1.00 0.00 N ATOM 1435 CA GLY A 95 7.693 13.824 6.425 1.00 0.00 C ATOM 1436 C GLY A 95 6.782 14.330 5.323 1.00 0.00 C ATOM 1437 O GLY A 95 6.327 15.473 5.361 1.00 0.00 O ATOM 0 H GLY A 95 9.003 12.929 5.056 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.087 13.453 7.251 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.285 14.653 6.812 1.00 0.00 H new ATOM 1441 N TYR A 96 6.514 13.477 4.339 1.00 0.00 N ATOM 1442 CA TYR A 96 5.651 13.842 3.222 1.00 0.00 C ATOM 1443 C TYR A 96 4.178 13.680 3.608 1.00 0.00 C ATOM 1444 O TYR A 96 3.841 13.745 4.789 1.00 0.00 O ATOM 1445 CB TYR A 96 6.004 12.994 1.990 1.00 0.00 C ATOM 1446 CG TYR A 96 5.744 11.502 2.140 1.00 0.00 C ATOM 1447 CD1 TYR A 96 5.004 10.990 3.202 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.231 10.605 1.197 1.00 0.00 C ATOM 1449 CE1 TYR A 96 4.761 9.642 3.315 1.00 0.00 C ATOM 1450 CE2 TYR A 96 5.993 9.250 1.309 1.00 0.00 C ATOM 1451 CZ TYR A 96 5.255 8.775 2.371 1.00 0.00 C ATOM 1452 OH TYR A 96 5.003 7.428 2.484 1.00 0.00 O ATOM 0 H TYR A 96 6.883 12.527 4.293 1.00 0.00 H new ATOM 0 HA TYR A 96 5.813 14.891 2.972 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.433 13.363 1.138 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.058 13.142 1.756 1.00 0.00 H new ATOM 0 HD1 TYR A 96 4.614 11.664 3.950 1.00 0.00 H new ATOM 0 HD2 TYR A 96 6.806 10.975 0.361 1.00 0.00 H new ATOM 0 HE1 TYR A 96 4.182 9.265 4.145 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.383 8.567 0.569 1.00 0.00 H new ATOM 0 HH TYR A 96 4.088 7.292 2.807 1.00 0.00 H new ATOM 1462 N ILE A 97 3.305 13.461 2.622 1.00 0.00 N ATOM 1463 CA ILE A 97 1.877 13.285 2.896 1.00 0.00 C ATOM 1464 C ILE A 97 1.074 13.048 1.578 1.00 0.00 C ATOM 1465 O ILE A 97 0.451 14.058 1.253 1.00 0.00 O ATOM 1466 CB ILE A 97 1.289 14.519 3.617 1.00 0.00 C ATOM 1467 CG1 ILE A 97 2.080 15.770 3.249 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.277 14.311 5.123 1.00 0.00 C ATOM 1469 CD1 ILE A 97 1.225 17.011 3.126 1.00 0.00 C ATOM 0 H ILE A 97 3.558 13.402 1.636 1.00 0.00 H new ATOM 0 HA ILE A 97 1.786 12.410 3.540 1.00 0.00 H new ATOM 0 HB ILE A 97 0.258 14.652 3.290 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.847 15.940 4.005 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.596 15.599 2.304 1.00 0.00 H new ATOM 0 HG21 ILE A 97 0.859 15.193 5.609 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.668 13.440 5.365 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.296 14.151 5.476 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.854 17.861 2.862 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.474 16.860 2.350 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.729 17.207 4.077 1.00 0.00 H new ATOM 1481 N PRO A 98 0.361 11.879 1.559 1.00 0.00 N ATOM 1482 CA PRO A 98 0.544 10.408 1.824 1.00 0.00 C ATOM 1483 C PRO A 98 0.993 9.724 0.541 1.00 0.00 C ATOM 1484 O PRO A 98 0.606 10.160 -0.550 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.835 9.904 2.217 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.192 10.949 3.130 1.00 0.00 C ATOM 1487 CD PRO A 98 0.044 11.789 3.060 1.00 0.00 C ATOM 0 HA PRO A 98 1.288 10.209 2.595 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.516 9.832 1.369 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.808 8.922 2.688 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.083 11.492 2.814 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.386 10.576 4.136 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.122 12.776 3.491 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.866 11.334 3.613 1.00 0.00 H new ATOM 1495 N ARG A 99 1.832 8.687 0.664 1.00 0.00 N ATOM 1496 CA ARG A 99 2.365 7.991 -0.512 1.00 0.00 C ATOM 1497 C ARG A 99 1.965 6.515 -0.565 1.00 0.00 C ATOM 1498 O ARG A 99 1.081 6.069 0.165 1.00 0.00 O ATOM 1499 CB ARG A 99 3.882 8.120 -0.537 1.00 0.00 C ATOM 1500 CG ARG A 99 4.390 9.233 -1.440 1.00 0.00 C ATOM 1501 CD ARG A 99 3.829 10.591 -1.044 1.00 0.00 C ATOM 1502 NE ARG A 99 3.619 11.456 -2.202 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.677 12.787 -2.155 1.00 0.00 C ATOM 1504 NH1 ARG A 99 3.907 13.410 -1.006 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.491 13.498 -3.257 1.00 0.00 N ATOM 0 H ARG A 99 2.153 8.315 1.558 1.00 0.00 H new ATOM 0 HA ARG A 99 1.930 8.466 -1.391 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.239 8.297 0.478 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.312 7.174 -0.865 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.479 9.265 -1.398 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.117 9.015 -2.472 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.884 10.453 -0.518 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.513 11.077 -0.348 1.00 0.00 H new ATOM 0 HE ARG A 99 3.416 11.016 -3.099 1.00 0.00 H new ATOM 0 HH11 ARG A 99 4.041 12.870 -0.151 1.00 0.00 H new ATOM 0 HH12 ARG A 99 3.950 14.429 -0.978 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.303 13.027 -4.142 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.535 14.516 -3.220 1.00 0.00 H new ATOM 1519 N ILE A 100 2.620 5.774 -1.467 1.00 0.00 N ATOM 1520 CA ILE A 100 2.344 4.348 -1.659 1.00 0.00 C ATOM 1521 C ILE A 100 3.310 3.474 -0.869 1.00 0.00 C ATOM 1522 O ILE A 100 4.475 3.825 -0.693 1.00 0.00 O ATOM 1523 CB ILE A 100 2.439 3.960 -3.146 1.00 0.00 C ATOM 1524 CG1 ILE A 100 1.638 4.938 -4.005 1.00 0.00 C ATOM 1525 CG2 ILE A 100 1.958 2.534 -3.357 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.417 6.168 -4.408 1.00 0.00 C ATOM 0 H ILE A 100 3.349 6.143 -2.078 1.00 0.00 H new ATOM 0 HA ILE A 100 1.330 4.179 -1.296 1.00 0.00 H new ATOM 0 HB ILE A 100 3.484 4.014 -3.453 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.297 4.424 -4.904 1.00 0.00 H new ATOM 0 HG13 ILE A 100 0.748 5.246 -3.456 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.032 2.278 -4.414 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.576 1.851 -2.774 1.00 0.00 H new ATOM 0 HG23 ILE A 100 0.920 2.449 -3.035 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.785 6.816 -5.015 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.736 6.706 -3.515 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.293 5.871 -4.985 1.00 0.00 H new ATOM 1538 N LEU A 101 2.820 2.330 -0.387 1.00 0.00 N ATOM 1539 CA LEU A 101 3.654 1.418 0.392 1.00 0.00 C ATOM 1540 C LEU A 101 3.019 0.041 0.538 1.00 0.00 C ATOM 1541 O LEU A 101 1.805 -0.117 0.406 1.00 0.00 O ATOM 1542 CB LEU A 101 3.925 2.010 1.774 1.00 0.00 C ATOM 1543 CG LEU A 101 2.829 2.930 2.320 1.00 0.00 C ATOM 1544 CD1 LEU A 101 2.769 2.842 3.831 1.00 0.00 C ATOM 1545 CD2 LEU A 101 3.069 4.369 1.890 1.00 0.00 C ATOM 0 H LEU A 101 1.859 2.017 -0.522 1.00 0.00 H new ATOM 0 HA LEU A 101 4.592 1.293 -0.149 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.073 1.192 2.479 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.859 2.570 1.734 1.00 0.00 H new ATOM 0 HG LEU A 101 1.874 2.601 1.910 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.985 3.502 4.203 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.551 1.816 4.127 1.00 0.00 H new ATOM 0 HD13 LEU A 101 3.728 3.145 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.279 5.005 2.289 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.033 4.707 2.271 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.068 4.429 0.802 1.00 0.00 H new ATOM 1557 N PHE A 102 3.859 -0.956 0.818 1.00 0.00 N ATOM 1558 CA PHE A 102 3.389 -2.327 0.990 1.00 0.00 C ATOM 1559 C PHE A 102 3.248 -2.677 2.472 1.00 0.00 C ATOM 1560 O PHE A 102 3.992 -2.169 3.321 1.00 0.00 O ATOM 1561 CB PHE A 102 4.357 -3.301 0.317 1.00 0.00 C ATOM 1562 CG PHE A 102 3.682 -4.393 -0.459 1.00 0.00 C ATOM 1563 CD1 PHE A 102 2.630 -4.110 -1.312 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.109 -5.705 -0.337 1.00 0.00 C ATOM 1565 CE1 PHE A 102 2.013 -5.117 -2.029 1.00 0.00 C ATOM 1566 CE2 PHE A 102 3.497 -6.715 -1.051 1.00 0.00 C ATOM 1567 CZ PHE A 102 2.449 -6.422 -1.898 1.00 0.00 C ATOM 0 H PHE A 102 4.866 -0.838 0.930 1.00 0.00 H new ATOM 0 HA PHE A 102 2.408 -2.411 0.522 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.010 -2.743 -0.354 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.993 -3.751 1.080 1.00 0.00 H new ATOM 0 HD1 PHE A 102 2.288 -3.091 -1.418 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.930 -5.940 0.324 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.192 -4.885 -2.691 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.839 -7.734 -0.946 1.00 0.00 H new ATOM 0 HZ PHE A 102 1.970 -7.211 -2.458 1.00 0.00 H new ATOM 1577 N LEU A 103 2.291 -3.548 2.784 1.00 0.00 N ATOM 1578 CA LEU A 103 2.073 -3.950 4.169 1.00 0.00 C ATOM 1579 C LEU A 103 1.695 -5.424 4.276 1.00 0.00 C ATOM 1580 O LEU A 103 1.113 -6.002 3.355 1.00 0.00 O ATOM 1581 CB LEU A 103 0.999 -3.075 4.812 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.436 -3.422 4.449 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.402 -2.479 5.145 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.619 -3.382 2.941 1.00 0.00 C ATOM 0 H LEU A 103 1.664 -3.983 2.107 1.00 0.00 H new ATOM 0 HA LEU A 103 3.012 -3.812 4.706 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.106 -3.137 5.895 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.185 -2.038 4.532 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.653 -4.434 4.790 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.425 -2.741 4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.279 -2.564 6.225 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.196 -1.454 4.836 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.650 -3.632 2.693 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.390 -2.382 2.573 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.052 -4.103 2.474 1.00 0.00 H new ATOM 1596 N ASP A 104 2.040 -6.024 5.412 1.00 0.00 N ATOM 1597 CA ASP A 104 1.754 -7.431 5.663 1.00 0.00 C ATOM 1598 C ASP A 104 0.253 -7.711 5.615 1.00 0.00 C ATOM 1599 O ASP A 104 -0.555 -6.890 6.066 1.00 0.00 O ATOM 1600 CB ASP A 104 2.319 -7.850 7.022 1.00 0.00 C ATOM 1601 CG ASP A 104 3.538 -8.742 6.889 1.00 0.00 C ATOM 1602 OD1 ASP A 104 4.647 -8.206 6.679 1.00 0.00 O ATOM 1603 OD2 ASP A 104 3.385 -9.977 6.996 1.00 0.00 O ATOM 0 H ASP A 104 2.521 -5.552 6.178 1.00 0.00 H new ATOM 0 HA ASP A 104 2.233 -8.015 4.877 1.00 0.00 H new ATOM 0 HB2 ASP A 104 2.584 -6.960 7.593 1.00 0.00 H new ATOM 0 HB3 ASP A 104 1.548 -8.374 7.587 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.134 -8.886 5.069 1.00 0.00 N ATOM 1609 CA PRO A 105 -1.541 -9.293 4.957 1.00 0.00 C ATOM 1610 C PRO A 105 -2.269 -9.235 6.292 1.00 0.00 C ATOM 1611 O PRO A 105 -2.279 -10.205 7.050 1.00 0.00 O ATOM 1612 CB PRO A 105 -1.463 -10.741 4.461 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.140 -10.849 3.789 1.00 0.00 C ATOM 1614 CD PRO A 105 0.778 -9.910 4.520 1.00 0.00 C ATOM 0 HA PRO A 105 -2.099 -8.631 4.295 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -1.544 -11.446 5.288 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.276 -10.966 3.770 1.00 0.00 H new ATOM 0 HG2 PRO A 105 0.235 -11.871 3.830 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.215 -10.579 2.736 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.328 -10.422 5.310 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.517 -9.470 3.850 1.00 0.00 H new ATOM 1622 N SER A 106 -2.881 -8.089 6.569 1.00 0.00 N ATOM 1623 CA SER A 106 -3.622 -7.877 7.811 1.00 0.00 C ATOM 1624 C SER A 106 -3.856 -6.389 8.038 1.00 0.00 C ATOM 1625 O SER A 106 -4.838 -5.991 8.665 1.00 0.00 O ATOM 1626 CB SER A 106 -2.866 -8.469 9.006 1.00 0.00 C ATOM 1627 OG SER A 106 -3.364 -9.754 9.337 1.00 0.00 O ATOM 0 H SER A 106 -2.879 -7.283 5.944 1.00 0.00 H new ATOM 0 HA SER A 106 -4.583 -8.383 7.721 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.804 -8.536 8.771 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.961 -7.806 9.866 1.00 0.00 H new ATOM 0 HG SER A 106 -3.148 -10.384 8.618 1.00 0.00 H new ATOM 1633 N GLY A 107 -2.940 -5.573 7.529 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.052 -4.139 7.686 1.00 0.00 C ATOM 1635 C GLY A 107 -1.914 -3.571 8.509 1.00 0.00 C ATOM 1636 O GLY A 107 -2.128 -2.693 9.346 1.00 0.00 O ATOM 0 H GLY A 107 -2.119 -5.883 7.009 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.062 -3.666 6.704 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.001 -3.899 8.165 1.00 0.00 H new ATOM 1640 N LYS A 108 -0.702 -4.084 8.292 1.00 0.00 N ATOM 1641 CA LYS A 108 0.458 -3.617 9.052 1.00 0.00 C ATOM 1642 C LYS A 108 1.567 -3.072 8.151 1.00 0.00 C ATOM 1643 O LYS A 108 2.554 -3.758 7.889 1.00 0.00 O ATOM 1644 CB LYS A 108 1.008 -4.755 9.915 1.00 0.00 C ATOM 1645 CG LYS A 108 0.292 -4.906 11.249 1.00 0.00 C ATOM 1646 CD LYS A 108 1.276 -5.075 12.396 1.00 0.00 C ATOM 1647 CE LYS A 108 0.670 -5.876 13.537 1.00 0.00 C ATOM 1648 NZ LYS A 108 -0.711 -5.422 13.862 1.00 0.00 N ATOM 0 H LYS A 108 -0.499 -4.812 7.607 1.00 0.00 H new ATOM 0 HA LYS A 108 0.119 -2.797 9.685 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.929 -5.691 9.362 1.00 0.00 H new ATOM 0 HB3 LYS A 108 2.068 -4.581 10.098 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.331 -4.030 11.429 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.374 -5.768 11.210 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.174 -5.576 12.035 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.583 -4.095 12.761 1.00 0.00 H new ATOM 0 HE2 LYS A 108 0.651 -6.932 13.269 1.00 0.00 H new ATOM 0 HE3 LYS A 108 1.300 -5.782 14.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.987 -5.789 14.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.740 -4.383 13.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -1.372 -5.777 13.141 1.00 0.00 H new ATOM 1662 N VAL A 109 1.408 -1.829 7.695 1.00 0.00 N ATOM 1663 CA VAL A 109 2.409 -1.190 6.844 1.00 0.00 C ATOM 1664 C VAL A 109 3.764 -1.183 7.527 1.00 0.00 C ATOM 1665 O VAL A 109 3.878 -0.863 8.710 1.00 0.00 O ATOM 1666 CB VAL A 109 1.995 0.257 6.479 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.170 1.223 6.583 1.00 0.00 C ATOM 1668 CG2 VAL A 109 1.389 0.301 5.087 1.00 0.00 C ATOM 0 H VAL A 109 0.596 -1.246 7.901 1.00 0.00 H new ATOM 0 HA VAL A 109 2.478 -1.769 5.923 1.00 0.00 H new ATOM 0 HB VAL A 109 1.243 0.577 7.200 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.840 2.228 6.319 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.552 1.223 7.604 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.960 0.910 5.900 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.104 1.325 4.847 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.121 -0.052 4.360 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.507 -0.339 5.054 1.00 0.00 H new ATOM 1678 N HIS A 110 4.789 -1.533 6.767 1.00 0.00 N ATOM 1679 CA HIS A 110 6.138 -1.561 7.297 1.00 0.00 C ATOM 1680 C HIS A 110 7.106 -0.930 6.309 1.00 0.00 C ATOM 1681 O HIS A 110 7.006 -1.159 5.104 1.00 0.00 O ATOM 1682 CB HIS A 110 6.561 -3.001 7.601 1.00 0.00 C ATOM 1683 CG HIS A 110 6.375 -3.386 9.036 1.00 0.00 C ATOM 1684 ND1 HIS A 110 7.212 -2.958 10.045 1.00 0.00 N ATOM 1685 CD2 HIS A 110 5.439 -4.164 9.631 1.00 0.00 C ATOM 1686 CE1 HIS A 110 6.800 -3.455 11.198 1.00 0.00 C ATOM 1687 NE2 HIS A 110 5.726 -4.189 10.974 1.00 0.00 N ATOM 0 H HIS A 110 4.711 -1.800 5.786 1.00 0.00 H new ATOM 0 HA HIS A 110 6.158 -0.987 8.223 1.00 0.00 H new ATOM 0 HB2 HIS A 110 5.986 -3.681 6.973 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.609 -3.128 7.332 1.00 0.00 H new ATOM 0 HD2 HIS A 110 4.620 -4.670 9.141 1.00 0.00 H new ATOM 0 HE1 HIS A 110 7.263 -3.289 12.160 1.00 0.00 H new ATOM 0 HE2 HIS A 110 5.195 -4.693 11.684 1.00 0.00 H new ATOM 1696 N PRO A 111 8.063 -0.129 6.798 1.00 0.00 N ATOM 1697 CA PRO A 111 9.053 0.522 5.937 1.00 0.00 C ATOM 1698 C PRO A 111 10.022 -0.481 5.319 1.00 0.00 C ATOM 1699 O PRO A 111 11.201 -0.180 5.129 1.00 0.00 O ATOM 1700 CB PRO A 111 9.791 1.466 6.890 1.00 0.00 C ATOM 1701 CG PRO A 111 9.614 0.860 8.239 1.00 0.00 C ATOM 1702 CD PRO A 111 8.265 0.198 8.221 1.00 0.00 C ATOM 0 HA PRO A 111 8.590 1.031 5.092 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.846 1.547 6.628 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.375 2.473 6.851 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.401 0.136 8.448 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.665 1.620 9.018 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.248 -0.696 8.845 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.486 0.863 8.595 1.00 0.00 H new ATOM 1710 N GLU A 112 9.519 -1.673 5.001 1.00 0.00 N ATOM 1711 CA GLU A 112 10.344 -2.712 4.400 1.00 0.00 C ATOM 1712 C GLU A 112 10.206 -2.677 2.885 1.00 0.00 C ATOM 1713 O GLU A 112 11.191 -2.774 2.154 1.00 0.00 O ATOM 1714 CB GLU A 112 9.944 -4.088 4.933 1.00 0.00 C ATOM 1715 CG GLU A 112 10.549 -4.415 6.289 1.00 0.00 C ATOM 1716 CD GLU A 112 11.336 -5.712 6.282 1.00 0.00 C ATOM 1717 OE1 GLU A 112 10.771 -6.746 5.872 1.00 0.00 O ATOM 1718 OE2 GLU A 112 12.518 -5.690 6.683 1.00 0.00 O ATOM 0 H GLU A 112 8.546 -1.940 5.150 1.00 0.00 H new ATOM 0 HA GLU A 112 11.385 -2.527 4.665 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.858 -4.138 5.008 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.249 -4.849 4.215 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.204 -3.599 6.596 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.753 -4.482 7.031 1.00 0.00 H new ATOM 1725 N ILE A 113 8.970 -2.527 2.425 1.00 0.00 N ATOM 1726 CA ILE A 113 8.689 -2.462 1.000 1.00 0.00 C ATOM 1727 C ILE A 113 8.497 -1.018 0.559 1.00 0.00 C ATOM 1728 O ILE A 113 7.365 -0.555 0.361 1.00 0.00 O ATOM 1729 CB ILE A 113 7.435 -3.272 0.636 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.491 -4.657 1.282 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.303 -3.389 -0.875 1.00 0.00 C ATOM 1732 CD1 ILE A 113 8.716 -5.457 0.890 1.00 0.00 C ATOM 0 H ILE A 113 8.146 -2.448 3.021 1.00 0.00 H new ATOM 0 HA ILE A 113 9.545 -2.893 0.481 1.00 0.00 H new ATOM 0 HB ILE A 113 6.558 -2.750 1.019 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.472 -4.545 2.366 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.597 -5.216 1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.410 -3.965 -1.119 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.223 -2.393 -1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.181 -3.892 -1.279 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.690 -6.428 1.385 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.726 -5.600 -0.190 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.614 -4.919 1.193 1.00 0.00 H new ATOM 1744 N ILE A 114 9.618 -0.313 0.420 1.00 0.00 N ATOM 1745 CA ILE A 114 9.619 1.083 0.012 1.00 0.00 C ATOM 1746 C ILE A 114 10.000 1.218 -1.461 1.00 0.00 C ATOM 1747 O ILE A 114 10.019 0.234 -2.200 1.00 0.00 O ATOM 1748 CB ILE A 114 10.610 1.903 0.867 1.00 0.00 C ATOM 1749 CG1 ILE A 114 12.047 1.390 0.659 1.00 0.00 C ATOM 1750 CG2 ILE A 114 10.212 1.857 2.338 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.467 0.288 1.613 1.00 0.00 C ATOM 0 H ILE A 114 10.548 -0.696 0.588 1.00 0.00 H new ATOM 0 HA ILE A 114 8.610 1.469 0.160 1.00 0.00 H new ATOM 0 HB ILE A 114 10.575 2.944 0.545 1.00 0.00 H new ATOM 0 HG12 ILE A 114 12.144 1.024 -0.363 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.737 2.227 0.765 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.921 2.440 2.925 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.212 2.274 2.458 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.217 0.823 2.684 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.492 -0.012 1.394 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.407 0.652 2.639 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.805 -0.569 1.493 1.00 0.00 H new ATOM 1763 N ASN A 115 10.316 2.439 -1.877 1.00 0.00 N ATOM 1764 CA ASN A 115 10.710 2.703 -3.252 1.00 0.00 C ATOM 1765 C ASN A 115 12.228 2.799 -3.362 1.00 0.00 C ATOM 1766 O ASN A 115 12.799 3.886 -3.281 1.00 0.00 O ATOM 1767 CB ASN A 115 10.069 4.002 -3.740 1.00 0.00 C ATOM 1768 CG ASN A 115 10.437 4.337 -5.175 1.00 0.00 C ATOM 1769 OD1 ASN A 115 11.526 4.009 -5.645 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.524 4.996 -5.879 1.00 0.00 N ATOM 0 H ASN A 115 10.306 3.264 -1.277 1.00 0.00 H new ATOM 0 HA ASN A 115 10.366 1.879 -3.877 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.985 3.920 -3.657 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.378 4.821 -3.090 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.713 5.250 -6.849 1.00 0.00 H new ATOM 0 HD22 ASN A 115 8.634 5.248 -5.450 1.00 0.00 H new ATOM 1777 N GLU A 116 12.877 1.653 -3.548 1.00 0.00 N ATOM 1778 CA GLU A 116 14.331 1.607 -3.669 1.00 0.00 C ATOM 1779 C GLU A 116 14.825 2.558 -4.757 1.00 0.00 C ATOM 1780 O GLU A 116 15.974 2.997 -4.733 1.00 0.00 O ATOM 1781 CB GLU A 116 14.790 0.181 -3.972 1.00 0.00 C ATOM 1782 CG GLU A 116 14.912 -0.692 -2.733 1.00 0.00 C ATOM 1783 CD GLU A 116 16.082 -0.298 -1.855 1.00 0.00 C ATOM 1784 OE1 GLU A 116 15.974 0.722 -1.144 1.00 0.00 O ATOM 1785 OE2 GLU A 116 17.109 -1.010 -1.880 1.00 0.00 O ATOM 0 H GLU A 116 12.419 0.744 -3.618 1.00 0.00 H new ATOM 0 HA GLU A 116 14.758 1.927 -2.719 1.00 0.00 H new ATOM 0 HB2 GLU A 116 14.085 -0.280 -4.664 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.755 0.218 -4.478 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.990 -0.626 -2.155 1.00 0.00 H new ATOM 0 HG3 GLU A 116 15.025 -1.733 -3.036 1.00 0.00 H new ATOM 1792 N ASN A 117 13.952 2.871 -5.710 1.00 0.00 N ATOM 1793 CA ASN A 117 14.303 3.767 -6.804 1.00 0.00 C ATOM 1794 C ASN A 117 14.201 5.234 -6.380 1.00 0.00 C ATOM 1795 O ASN A 117 14.627 6.127 -7.114 1.00 0.00 O ATOM 1796 CB ASN A 117 13.395 3.511 -8.009 1.00 0.00 C ATOM 1797 CG ASN A 117 14.073 2.669 -9.073 1.00 0.00 C ATOM 1798 OD1 ASN A 117 14.409 1.507 -8.841 1.00 0.00 O ATOM 1799 ND2 ASN A 117 14.278 3.254 -10.248 1.00 0.00 N ATOM 0 H ASN A 117 12.996 2.517 -5.746 1.00 0.00 H new ATOM 0 HA ASN A 117 15.338 3.564 -7.080 1.00 0.00 H new ATOM 0 HB2 ASN A 117 12.486 3.009 -7.676 1.00 0.00 H new ATOM 0 HB3 ASN A 117 13.092 4.464 -8.442 1.00 0.00 H new ATOM 0 HD21 ASN A 117 14.730 2.738 -11.003 1.00 0.00 H new ATOM 0 HD22 ASN A 117 13.983 4.219 -10.396 1.00 0.00 H new ATOM 1806 N GLY A 118 13.638 5.481 -5.199 1.00 0.00 N ATOM 1807 CA GLY A 118 13.500 6.841 -4.719 1.00 0.00 C ATOM 1808 C GLY A 118 14.679 7.280 -3.877 1.00 0.00 C ATOM 1809 O GLY A 118 15.563 6.482 -3.566 1.00 0.00 O ATOM 0 H GLY A 118 13.277 4.764 -4.570 1.00 0.00 H new ATOM 0 HA2 GLY A 118 13.394 7.514 -5.570 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.586 6.924 -4.131 1.00 0.00 H new ATOM 1813 N ASN A 119 14.690 8.553 -3.506 1.00 0.00 N ATOM 1814 CA ASN A 119 15.765 9.108 -2.693 1.00 0.00 C ATOM 1815 C ASN A 119 15.671 8.599 -1.256 1.00 0.00 C ATOM 1816 O ASN A 119 14.603 8.189 -0.806 1.00 0.00 O ATOM 1817 CB ASN A 119 15.719 10.637 -2.713 1.00 0.00 C ATOM 1818 CG ASN A 119 14.371 11.182 -2.281 1.00 0.00 C ATOM 1819 OD1 ASN A 119 14.154 11.468 -1.105 1.00 0.00 O ATOM 1820 ND2 ASN A 119 13.461 11.330 -3.236 1.00 0.00 N ATOM 0 H ASN A 119 13.963 9.224 -3.756 1.00 0.00 H new ATOM 0 HA ASN A 119 16.715 8.781 -3.117 1.00 0.00 H new ATOM 0 HB2 ASN A 119 16.494 11.029 -2.055 1.00 0.00 H new ATOM 0 HB3 ASN A 119 15.945 10.991 -3.719 1.00 0.00 H new ATOM 0 HD21 ASN A 119 12.536 11.695 -3.007 1.00 0.00 H new ATOM 0 HD22 ASN A 119 13.686 11.079 -4.199 1.00 0.00 H new ATOM 1827 N PRO A 120 16.797 8.608 -0.520 1.00 0.00 N ATOM 1828 CA PRO A 120 16.838 8.133 0.867 1.00 0.00 C ATOM 1829 C PRO A 120 16.197 9.109 1.853 1.00 0.00 C ATOM 1830 O PRO A 120 16.852 9.586 2.780 1.00 0.00 O ATOM 1831 CB PRO A 120 18.336 8.002 1.143 1.00 0.00 C ATOM 1832 CG PRO A 120 18.968 9.016 0.256 1.00 0.00 C ATOM 1833 CD PRO A 120 18.119 9.069 -0.986 1.00 0.00 C ATOM 0 HA PRO A 120 16.276 7.208 0.994 1.00 0.00 H new ATOM 0 HB2 PRO A 120 18.565 8.194 2.191 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.695 6.998 0.917 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.007 9.990 0.743 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.994 8.738 0.015 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.071 10.078 -1.396 1.00 0.00 H new ATOM 0 HD3 PRO A 120 18.515 8.424 -1.771 1.00 0.00 H new ATOM 1841 N SER A 121 14.915 9.400 1.654 1.00 0.00 N ATOM 1842 CA SER A 121 14.193 10.310 2.533 1.00 0.00 C ATOM 1843 C SER A 121 12.710 10.243 2.227 1.00 0.00 C ATOM 1844 O SER A 121 11.865 10.292 3.120 1.00 0.00 O ATOM 1845 CB SER A 121 14.696 11.742 2.351 1.00 0.00 C ATOM 1846 OG SER A 121 15.883 11.967 3.092 1.00 0.00 O ATOM 0 H SER A 121 14.356 9.018 0.891 1.00 0.00 H new ATOM 0 HA SER A 121 14.365 10.010 3.567 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.882 11.933 1.294 1.00 0.00 H new ATOM 0 HB3 SER A 121 13.926 12.444 2.671 1.00 0.00 H new ATOM 0 HG SER A 121 16.319 11.110 3.279 1.00 0.00 H new ATOM 1852 N TYR A 122 12.419 10.130 0.944 1.00 0.00 N ATOM 1853 CA TYR A 122 11.062 10.050 0.457 1.00 0.00 C ATOM 1854 C TYR A 122 10.567 8.604 0.474 1.00 0.00 C ATOM 1855 O TYR A 122 9.412 8.327 0.803 1.00 0.00 O ATOM 1856 CB TYR A 122 11.030 10.611 -0.957 1.00 0.00 C ATOM 1857 CG TYR A 122 10.255 11.902 -1.084 1.00 0.00 C ATOM 1858 CD1 TYR A 122 8.900 11.956 -0.790 1.00 0.00 C ATOM 1859 CD2 TYR A 122 10.885 13.070 -1.491 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.192 13.138 -0.899 1.00 0.00 C ATOM 1861 CE2 TYR A 122 10.186 14.257 -1.602 1.00 0.00 C ATOM 1862 CZ TYR A 122 8.840 14.286 -1.306 1.00 0.00 C ATOM 1863 OH TYR A 122 8.140 15.464 -1.416 1.00 0.00 O ATOM 0 H TYR A 122 13.125 10.091 0.209 1.00 0.00 H new ATOM 0 HA TYR A 122 10.401 10.630 1.102 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.053 10.777 -1.295 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.591 9.868 -1.623 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.390 11.059 -0.471 1.00 0.00 H new ATOM 0 HD2 TYR A 122 11.939 13.051 -1.725 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.138 13.163 -0.667 1.00 0.00 H new ATOM 0 HE2 TYR A 122 10.692 15.157 -1.919 1.00 0.00 H new ATOM 0 HH TYR A 122 8.744 16.177 -1.713 1.00 0.00 H new ATOM 1873 N LYS A 123 11.460 7.686 0.122 1.00 0.00 N ATOM 1874 CA LYS A 123 11.150 6.259 0.096 1.00 0.00 C ATOM 1875 C LYS A 123 9.824 5.972 -0.626 1.00 0.00 C ATOM 1876 O LYS A 123 9.787 5.878 -1.846 1.00 0.00 O ATOM 1877 CB LYS A 123 11.121 5.697 1.530 1.00 0.00 C ATOM 1878 CG LYS A 123 12.473 5.232 2.061 1.00 0.00 C ATOM 1879 CD LYS A 123 13.302 4.524 0.999 1.00 0.00 C ATOM 1880 CE LYS A 123 14.270 5.478 0.320 1.00 0.00 C ATOM 1881 NZ LYS A 123 14.749 4.947 -0.986 1.00 0.00 N ATOM 0 H LYS A 123 12.417 7.908 -0.153 1.00 0.00 H new ATOM 0 HA LYS A 123 11.937 5.758 -0.467 1.00 0.00 H new ATOM 0 HB2 LYS A 123 10.728 6.463 2.198 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.425 4.858 1.563 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.027 6.092 2.437 1.00 0.00 H new ATOM 0 HG3 LYS A 123 12.317 4.559 2.904 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.857 3.705 1.456 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.640 4.084 0.253 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.782 6.440 0.164 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.123 5.656 0.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 15.102 5.731 -1.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.516 4.264 -0.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 13.964 4.474 -1.478 1.00 0.00 H new ATOM 1895 N TYR A 124 8.744 5.821 0.139 1.00 0.00 N ATOM 1896 CA TYR A 124 7.416 5.520 -0.405 1.00 0.00 C ATOM 1897 C TYR A 124 6.982 6.444 -1.552 1.00 0.00 C ATOM 1898 O TYR A 124 5.891 6.273 -2.103 1.00 0.00 O ATOM 1899 CB TYR A 124 6.380 5.570 0.720 1.00 0.00 C ATOM 1900 CG TYR A 124 6.455 4.395 1.677 1.00 0.00 C ATOM 1901 CD1 TYR A 124 7.158 3.239 1.351 1.00 0.00 C ATOM 1902 CD2 TYR A 124 5.821 4.445 2.914 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.222 2.173 2.225 1.00 0.00 C ATOM 1904 CE2 TYR A 124 5.883 3.381 3.792 1.00 0.00 C ATOM 1905 CZ TYR A 124 6.584 2.248 3.443 1.00 0.00 C ATOM 1906 OH TYR A 124 6.639 1.185 4.314 1.00 0.00 O ATOM 0 H TYR A 124 8.763 5.904 1.155 1.00 0.00 H new ATOM 0 HA TYR A 124 7.480 4.520 -0.833 1.00 0.00 H new ATOM 0 HB2 TYR A 124 6.514 6.494 1.283 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.383 5.606 0.281 1.00 0.00 H new ATOM 0 HD1 TYR A 124 7.662 3.175 0.398 1.00 0.00 H new ATOM 0 HD2 TYR A 124 5.271 5.331 3.193 1.00 0.00 H new ATOM 0 HE1 TYR A 124 7.771 1.283 1.955 1.00 0.00 H new ATOM 0 HE2 TYR A 124 5.384 3.437 4.748 1.00 0.00 H new ATOM 0 HH TYR A 124 6.889 0.374 3.825 1.00 0.00 H new ATOM 1916 N PHE A 125 7.818 7.410 -1.919 1.00 0.00 N ATOM 1917 CA PHE A 125 7.487 8.317 -3.010 1.00 0.00 C ATOM 1918 C PHE A 125 7.586 7.603 -4.354 1.00 0.00 C ATOM 1919 O PHE A 125 8.670 7.189 -4.769 1.00 0.00 O ATOM 1920 CB PHE A 125 8.421 9.526 -2.999 1.00 0.00 C ATOM 1921 CG PHE A 125 7.929 10.666 -3.841 1.00 0.00 C ATOM 1922 CD1 PHE A 125 6.600 11.054 -3.798 1.00 0.00 C ATOM 1923 CD2 PHE A 125 8.796 11.349 -4.680 1.00 0.00 C ATOM 1924 CE1 PHE A 125 6.144 12.099 -4.575 1.00 0.00 C ATOM 1925 CE2 PHE A 125 8.344 12.396 -5.458 1.00 0.00 C ATOM 1926 CZ PHE A 125 7.016 12.771 -5.406 1.00 0.00 C ATOM 0 H PHE A 125 8.722 7.584 -1.480 1.00 0.00 H new ATOM 0 HA PHE A 125 6.461 8.657 -2.868 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.546 9.870 -1.972 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.405 9.219 -3.355 1.00 0.00 H new ATOM 0 HD1 PHE A 125 5.913 10.532 -3.149 1.00 0.00 H new ATOM 0 HD2 PHE A 125 9.835 11.059 -4.725 1.00 0.00 H new ATOM 0 HE1 PHE A 125 5.105 12.391 -4.533 1.00 0.00 H new ATOM 0 HE2 PHE A 125 9.029 12.922 -6.107 1.00 0.00 H new ATOM 0 HZ PHE A 125 6.661 13.589 -6.015 1.00 0.00 H new ATOM 1936 N TYR A 126 6.452 7.461 -5.033 1.00 0.00 N ATOM 1937 CA TYR A 126 6.418 6.798 -6.331 1.00 0.00 C ATOM 1938 C TYR A 126 5.901 7.746 -7.407 1.00 0.00 C ATOM 1939 O TYR A 126 4.693 7.883 -7.597 1.00 0.00 O ATOM 1940 CB TYR A 126 5.532 5.552 -6.276 1.00 0.00 C ATOM 1941 CG TYR A 126 6.104 4.428 -5.437 1.00 0.00 C ATOM 1942 CD1 TYR A 126 6.965 3.489 -5.990 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.772 4.303 -4.097 1.00 0.00 C ATOM 1944 CE1 TYR A 126 7.479 2.457 -5.228 1.00 0.00 C ATOM 1945 CE2 TYR A 126 6.280 3.273 -3.327 1.00 0.00 C ATOM 1946 CZ TYR A 126 7.134 2.353 -3.897 1.00 0.00 C ATOM 1947 OH TYR A 126 7.642 1.325 -3.136 1.00 0.00 O ATOM 0 H TYR A 126 5.546 7.796 -4.706 1.00 0.00 H new ATOM 0 HA TYR A 126 7.436 6.500 -6.582 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.556 5.829 -5.877 1.00 0.00 H new ATOM 0 HB3 TYR A 126 5.370 5.188 -7.291 1.00 0.00 H new ATOM 0 HD1 TYR A 126 7.237 3.567 -7.032 1.00 0.00 H new ATOM 0 HD2 TYR A 126 5.105 5.023 -3.646 1.00 0.00 H new ATOM 0 HE1 TYR A 126 8.148 1.735 -5.673 1.00 0.00 H new ATOM 0 HE2 TYR A 126 6.009 3.190 -2.285 1.00 0.00 H new ATOM 0 HH TYR A 126 8.470 0.995 -3.543 1.00 0.00 H new ATOM 1957 N VAL A 127 6.821 8.395 -8.109 1.00 0.00 N ATOM 1958 CA VAL A 127 6.453 9.326 -9.169 1.00 0.00 C ATOM 1959 C VAL A 127 6.432 8.623 -10.519 1.00 0.00 C ATOM 1960 O VAL A 127 6.924 9.153 -11.517 1.00 0.00 O ATOM 1961 CB VAL A 127 7.422 10.522 -9.237 1.00 0.00 C ATOM 1962 CG1 VAL A 127 7.157 11.490 -8.095 1.00 0.00 C ATOM 1963 CG2 VAL A 127 8.866 10.044 -9.217 1.00 0.00 C ATOM 0 H VAL A 127 7.826 8.295 -7.964 1.00 0.00 H new ATOM 0 HA VAL A 127 5.456 9.699 -8.935 1.00 0.00 H new ATOM 0 HB VAL A 127 7.252 11.049 -10.176 1.00 0.00 H new ATOM 0 HG11 VAL A 127 7.851 12.328 -8.160 1.00 0.00 H new ATOM 0 HG12 VAL A 127 6.134 11.860 -8.162 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.296 10.977 -7.143 1.00 0.00 H new ATOM 0 HG21 VAL A 127 9.535 10.904 -9.266 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.053 9.490 -8.297 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.046 9.395 -10.074 1.00 0.00 H new ATOM 1973 N SER A 128 5.856 7.422 -10.546 1.00 0.00 N ATOM 1974 CA SER A 128 5.767 6.636 -11.773 1.00 0.00 C ATOM 1975 C SER A 128 5.367 5.192 -11.484 1.00 0.00 C ATOM 1976 O SER A 128 6.062 4.467 -10.763 1.00 0.00 O ATOM 1977 CB SER A 128 7.101 6.656 -12.527 1.00 0.00 C ATOM 1978 OG SER A 128 8.188 6.833 -11.635 1.00 0.00 O ATOM 0 H SER A 128 5.443 6.972 -9.729 1.00 0.00 H new ATOM 0 HA SER A 128 4.995 7.091 -12.393 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.226 5.723 -13.077 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.095 7.461 -13.262 1.00 0.00 H new ATOM 0 HG SER A 128 9.028 6.841 -12.140 1.00 0.00 H new ATOM 1984 N ALA A 129 4.250 4.772 -12.070 1.00 0.00 N ATOM 1985 CA ALA A 129 3.755 3.412 -11.904 1.00 0.00 C ATOM 1986 C ALA A 129 4.845 2.390 -12.227 1.00 0.00 C ATOM 1987 O ALA A 129 4.779 1.238 -11.797 1.00 0.00 O ATOM 1988 CB ALA A 129 2.541 3.181 -12.792 1.00 0.00 C ATOM 0 H ALA A 129 3.668 5.359 -12.668 1.00 0.00 H new ATOM 0 HA ALA A 129 3.463 3.282 -10.862 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.181 2.161 -12.658 1.00 0.00 H new ATOM 0 HB2 ALA A 129 1.752 3.883 -12.520 1.00 0.00 H new ATOM 0 HB3 ALA A 129 2.819 3.334 -13.835 1.00 0.00 H new ATOM 1994 N GLU A 130 5.846 2.822 -12.991 1.00 0.00 N ATOM 1995 CA GLU A 130 6.950 1.954 -13.377 1.00 0.00 C ATOM 1996 C GLU A 130 7.660 1.366 -12.161 1.00 0.00 C ATOM 1997 O GLU A 130 7.651 0.155 -11.953 1.00 0.00 O ATOM 1998 CB GLU A 130 7.950 2.727 -14.238 1.00 0.00 C ATOM 1999 CG GLU A 130 8.786 1.839 -15.145 1.00 0.00 C ATOM 2000 CD GLU A 130 10.086 2.495 -15.565 1.00 0.00 C ATOM 2001 OE1 GLU A 130 10.911 2.800 -14.679 1.00 0.00 O ATOM 2002 OE2 GLU A 130 10.278 2.705 -16.782 1.00 0.00 O ATOM 0 H GLU A 130 5.913 3.773 -13.355 1.00 0.00 H new ATOM 0 HA GLU A 130 6.533 1.128 -13.953 1.00 0.00 H new ATOM 0 HB2 GLU A 130 7.409 3.449 -14.849 1.00 0.00 H new ATOM 0 HB3 GLU A 130 8.614 3.295 -13.587 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.005 0.904 -14.630 1.00 0.00 H new ATOM 0 HG3 GLU A 130 8.207 1.586 -16.033 1.00 0.00 H new ATOM 2009 N GLN A 131 8.294 2.215 -11.362 1.00 0.00 N ATOM 2010 CA GLN A 131 9.011 1.725 -10.192 1.00 0.00 C ATOM 2011 C GLN A 131 8.090 0.989 -9.228 1.00 0.00 C ATOM 2012 O GLN A 131 8.415 -0.099 -8.762 1.00 0.00 O ATOM 2013 CB GLN A 131 9.715 2.846 -9.448 1.00 0.00 C ATOM 2014 CG GLN A 131 8.850 4.072 -9.206 1.00 0.00 C ATOM 2015 CD GLN A 131 9.493 5.351 -9.706 1.00 0.00 C ATOM 2016 OE1 GLN A 131 10.398 5.320 -10.541 1.00 0.00 O ATOM 2017 NE2 GLN A 131 9.027 6.486 -9.196 1.00 0.00 N ATOM 0 H GLN A 131 8.327 3.225 -11.498 1.00 0.00 H new ATOM 0 HA GLN A 131 9.758 1.027 -10.570 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.064 2.466 -8.488 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.598 3.144 -10.013 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.888 3.936 -9.701 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.649 4.165 -8.139 1.00 0.00 H new ATOM 0 HE21 GLN A 131 8.276 6.465 -8.506 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.420 7.379 -9.494 1.00 0.00 H new ATOM 2026 N VAL A 132 6.941 1.572 -8.921 1.00 0.00 N ATOM 2027 CA VAL A 132 6.015 0.919 -7.999 1.00 0.00 C ATOM 2028 C VAL A 132 5.656 -0.475 -8.502 1.00 0.00 C ATOM 2029 O VAL A 132 5.215 -1.324 -7.729 1.00 0.00 O ATOM 2030 CB VAL A 132 4.734 1.743 -7.750 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.120 2.203 -9.054 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.727 0.951 -6.927 1.00 0.00 C ATOM 0 H VAL A 132 6.630 2.473 -9.284 1.00 0.00 H new ATOM 0 HA VAL A 132 6.531 0.839 -7.042 1.00 0.00 H new ATOM 0 HB VAL A 132 5.014 2.629 -7.180 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.219 2.781 -8.848 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.835 2.825 -9.593 1.00 0.00 H new ATOM 0 HG13 VAL A 132 3.863 1.335 -9.661 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.834 1.555 -6.766 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.458 0.039 -7.461 1.00 0.00 H new ATOM 0 HG23 VAL A 132 4.168 0.691 -5.965 1.00 0.00 H new ATOM 2042 N VAL A 133 5.872 -0.720 -9.794 1.00 0.00 N ATOM 2043 CA VAL A 133 5.590 -2.026 -10.362 1.00 0.00 C ATOM 2044 C VAL A 133 6.708 -3.003 -10.027 1.00 0.00 C ATOM 2045 O VAL A 133 6.470 -4.199 -9.871 1.00 0.00 O ATOM 2046 CB VAL A 133 5.400 -1.978 -11.894 1.00 0.00 C ATOM 2047 CG1 VAL A 133 6.728 -2.102 -12.628 1.00 0.00 C ATOM 2048 CG2 VAL A 133 4.460 -3.085 -12.329 1.00 0.00 C ATOM 0 H VAL A 133 6.237 -0.036 -10.456 1.00 0.00 H new ATOM 0 HA VAL A 133 4.652 -2.362 -9.919 1.00 0.00 H new ATOM 0 HB VAL A 133 4.969 -1.010 -12.150 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.554 -2.064 -13.703 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.383 -1.280 -12.337 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.199 -3.050 -12.370 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.329 -3.047 -13.410 1.00 0.00 H new ATOM 0 HG22 VAL A 133 4.880 -4.051 -12.048 1.00 0.00 H new ATOM 0 HG23 VAL A 133 3.494 -2.954 -11.842 1.00 0.00 H new ATOM 2058 N GLN A 134 7.933 -2.489 -9.917 1.00 0.00 N ATOM 2059 CA GLN A 134 9.068 -3.347 -9.597 1.00 0.00 C ATOM 2060 C GLN A 134 9.109 -3.599 -8.101 1.00 0.00 C ATOM 2061 O GLN A 134 9.340 -4.723 -7.649 1.00 0.00 O ATOM 2062 CB GLN A 134 10.384 -2.735 -10.085 1.00 0.00 C ATOM 2063 CG GLN A 134 10.460 -1.232 -9.902 1.00 0.00 C ATOM 2064 CD GLN A 134 11.832 -0.670 -10.219 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.692 -0.569 -9.343 1.00 0.00 O ATOM 2066 NE2 GLN A 134 12.044 -0.300 -11.477 1.00 0.00 N ATOM 0 H GLN A 134 8.160 -1.503 -10.042 1.00 0.00 H new ATOM 0 HA GLN A 134 8.943 -4.298 -10.115 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.212 -3.200 -9.549 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.515 -2.971 -11.141 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.720 -0.755 -10.544 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.199 -0.982 -8.874 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.303 -0.402 -12.170 1.00 0.00 H new ATOM 0 HE22 GLN A 134 12.948 0.086 -11.750 1.00 0.00 H new ATOM 2075 N GLY A 135 8.849 -2.548 -7.332 1.00 0.00 N ATOM 2076 CA GLY A 135 8.826 -2.678 -5.894 1.00 0.00 C ATOM 2077 C GLY A 135 7.646 -3.508 -5.431 1.00 0.00 C ATOM 2078 O GLY A 135 7.652 -4.045 -4.322 1.00 0.00 O ATOM 0 H GLY A 135 8.654 -1.610 -7.682 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.753 -3.140 -5.554 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.778 -1.689 -5.439 1.00 0.00 H new ATOM 2082 N MET A 136 6.628 -3.627 -6.288 1.00 0.00 N ATOM 2083 CA MET A 136 5.442 -4.409 -5.954 1.00 0.00 C ATOM 2084 C MET A 136 5.567 -5.831 -6.492 1.00 0.00 C ATOM 2085 O MET A 136 5.279 -6.797 -5.790 1.00 0.00 O ATOM 2086 CB MET A 136 4.183 -3.738 -6.510 1.00 0.00 C ATOM 2087 CG MET A 136 3.989 -3.953 -8.001 1.00 0.00 C ATOM 2088 SD MET A 136 2.490 -3.181 -8.634 1.00 0.00 S ATOM 2089 CE MET A 136 2.007 -4.384 -9.870 1.00 0.00 C ATOM 0 H MET A 136 6.604 -3.194 -7.211 1.00 0.00 H new ATOM 0 HA MET A 136 5.359 -4.457 -4.868 1.00 0.00 H new ATOM 0 HB2 MET A 136 3.312 -4.122 -5.979 1.00 0.00 H new ATOM 0 HB3 MET A 136 4.232 -2.668 -6.309 1.00 0.00 H new ATOM 0 HG2 MET A 136 4.851 -3.553 -8.535 1.00 0.00 H new ATOM 0 HG3 MET A 136 3.955 -5.023 -8.207 1.00 0.00 H new ATOM 0 HE1 MET A 136 1.929 -3.896 -10.842 1.00 0.00 H new ATOM 0 HE2 MET A 136 2.756 -5.175 -9.920 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.042 -4.814 -9.601 1.00 0.00 H new ATOM 2099 N LYS A 137 6.006 -5.947 -7.742 1.00 0.00 N ATOM 2100 CA LYS A 137 6.183 -7.246 -8.383 1.00 0.00 C ATOM 2101 C LYS A 137 7.233 -8.086 -7.652 1.00 0.00 C ATOM 2102 O LYS A 137 7.345 -9.291 -7.877 1.00 0.00 O ATOM 2103 CB LYS A 137 6.557 -7.077 -9.860 1.00 0.00 C ATOM 2104 CG LYS A 137 8.017 -6.726 -10.105 1.00 0.00 C ATOM 2105 CD LYS A 137 8.218 -6.101 -11.481 1.00 0.00 C ATOM 2106 CE LYS A 137 7.628 -6.961 -12.588 1.00 0.00 C ATOM 2107 NZ LYS A 137 8.445 -8.179 -12.843 1.00 0.00 N ATOM 0 H LYS A 137 6.247 -5.152 -8.334 1.00 0.00 H new ATOM 0 HA LYS A 137 5.233 -7.777 -8.328 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.325 -8.002 -10.389 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.931 -6.297 -10.293 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.360 -6.034 -9.336 1.00 0.00 H new ATOM 0 HG3 LYS A 137 8.628 -7.625 -10.020 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.755 -5.114 -11.502 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.283 -5.957 -11.662 1.00 0.00 H new ATOM 0 HE2 LYS A 137 6.614 -7.255 -12.317 1.00 0.00 H new ATOM 0 HE3 LYS A 137 7.556 -6.374 -13.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 8.008 -8.737 -13.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 9.406 -7.899 -13.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 8.493 -8.753 -11.977 1.00 0.00 H new ATOM 2121 N GLU A 138 7.996 -7.439 -6.772 1.00 0.00 N ATOM 2122 CA GLU A 138 9.030 -8.119 -6.004 1.00 0.00 C ATOM 2123 C GLU A 138 8.518 -8.438 -4.609 1.00 0.00 C ATOM 2124 O GLU A 138 8.479 -9.597 -4.197 1.00 0.00 O ATOM 2125 CB GLU A 138 10.286 -7.251 -5.916 1.00 0.00 C ATOM 2126 CG GLU A 138 11.548 -8.041 -5.611 1.00 0.00 C ATOM 2127 CD GLU A 138 12.603 -7.204 -4.916 1.00 0.00 C ATOM 2128 OE1 GLU A 138 12.813 -6.046 -5.333 1.00 0.00 O ATOM 2129 OE2 GLU A 138 13.222 -7.708 -3.954 1.00 0.00 O ATOM 0 H GLU A 138 7.915 -6.442 -6.575 1.00 0.00 H new ATOM 0 HA GLU A 138 9.285 -9.050 -6.510 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.418 -6.720 -6.859 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.143 -6.496 -5.142 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.295 -8.895 -4.983 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.958 -8.438 -6.540 1.00 0.00 H new ATOM 2136 N ALA A 139 8.105 -7.399 -3.895 1.00 0.00 N ATOM 2137 CA ALA A 139 7.567 -7.565 -2.552 1.00 0.00 C ATOM 2138 C ALA A 139 6.414 -8.553 -2.572 1.00 0.00 C ATOM 2139 O ALA A 139 6.203 -9.308 -1.624 1.00 0.00 O ATOM 2140 CB ALA A 139 7.091 -6.229 -2.002 1.00 0.00 C ATOM 0 H ALA A 139 8.132 -6.434 -4.223 1.00 0.00 H new ATOM 0 HA ALA A 139 8.357 -7.949 -1.907 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.692 -6.370 -0.998 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.928 -5.532 -1.965 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.312 -5.826 -2.649 1.00 0.00 H new ATOM 2146 N GLN A 140 5.669 -8.530 -3.668 1.00 0.00 N ATOM 2147 CA GLN A 140 4.528 -9.406 -3.839 1.00 0.00 C ATOM 2148 C GLN A 140 4.945 -10.875 -3.895 1.00 0.00 C ATOM 2149 O GLN A 140 4.108 -11.769 -3.769 1.00 0.00 O ATOM 2150 CB GLN A 140 3.768 -9.015 -5.105 1.00 0.00 C ATOM 2151 CG GLN A 140 4.521 -9.304 -6.394 1.00 0.00 C ATOM 2152 CD GLN A 140 4.447 -10.761 -6.810 1.00 0.00 C ATOM 2153 OE1 GLN A 140 3.722 -11.555 -6.213 1.00 0.00 O ATOM 2154 NE2 GLN A 140 5.201 -11.119 -7.843 1.00 0.00 N ATOM 0 H GLN A 140 5.840 -7.906 -4.457 1.00 0.00 H new ATOM 0 HA GLN A 140 3.876 -9.289 -2.973 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.817 -9.548 -5.125 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.536 -7.951 -5.063 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.115 -8.683 -7.192 1.00 0.00 H new ATOM 0 HG3 GLN A 140 5.566 -9.020 -6.269 1.00 0.00 H new ATOM 0 HE21 GLN A 140 5.788 -10.428 -8.310 1.00 0.00 H new ATOM 0 HE22 GLN A 140 5.193 -12.085 -8.170 1.00 0.00 H new ATOM 2163 N GLU A 141 6.236 -11.121 -4.096 1.00 0.00 N ATOM 2164 CA GLU A 141 6.752 -12.484 -4.180 1.00 0.00 C ATOM 2165 C GLU A 141 7.308 -12.960 -2.837 1.00 0.00 C ATOM 2166 O GLU A 141 7.504 -14.159 -2.631 1.00 0.00 O ATOM 2167 CB GLU A 141 7.833 -12.565 -5.265 1.00 0.00 C ATOM 2168 CG GLU A 141 8.920 -13.591 -4.986 1.00 0.00 C ATOM 2169 CD GLU A 141 9.929 -13.694 -6.113 1.00 0.00 C ATOM 2170 OE1 GLU A 141 10.462 -12.646 -6.530 1.00 0.00 O ATOM 2171 OE2 GLU A 141 10.187 -14.825 -6.578 1.00 0.00 O ATOM 0 H GLU A 141 6.944 -10.395 -4.204 1.00 0.00 H new ATOM 0 HA GLU A 141 5.925 -13.143 -4.444 1.00 0.00 H new ATOM 0 HB2 GLU A 141 7.359 -12.804 -6.217 1.00 0.00 H new ATOM 0 HB3 GLU A 141 8.295 -11.584 -5.376 1.00 0.00 H new ATOM 0 HG2 GLU A 141 9.437 -13.325 -4.064 1.00 0.00 H new ATOM 0 HG3 GLU A 141 8.461 -14.566 -4.824 1.00 0.00 H new ATOM 2178 N ARG A 142 7.578 -12.026 -1.933 1.00 0.00 N ATOM 2179 CA ARG A 142 8.128 -12.374 -0.623 1.00 0.00 C ATOM 2180 C ARG A 142 7.119 -12.121 0.497 1.00 0.00 C ATOM 2181 O ARG A 142 6.840 -13.011 1.301 1.00 0.00 O ATOM 2182 CB ARG A 142 9.416 -11.585 -0.356 1.00 0.00 C ATOM 2183 CG ARG A 142 9.543 -10.310 -1.175 1.00 0.00 C ATOM 2184 CD ARG A 142 10.607 -9.387 -0.604 1.00 0.00 C ATOM 2185 NE ARG A 142 11.910 -9.604 -1.229 1.00 0.00 N ATOM 2186 CZ ARG A 142 12.914 -8.732 -1.171 1.00 0.00 C ATOM 2187 NH1 ARG A 142 12.768 -7.584 -0.521 1.00 0.00 N ATOM 2188 NH2 ARG A 142 14.067 -9.009 -1.765 1.00 0.00 N ATOM 0 H ARG A 142 7.427 -11.028 -2.079 1.00 0.00 H new ATOM 0 HA ARG A 142 8.356 -13.440 -0.636 1.00 0.00 H new ATOM 0 HB2 ARG A 142 9.461 -11.330 0.703 1.00 0.00 H new ATOM 0 HB3 ARG A 142 10.272 -12.226 -0.566 1.00 0.00 H new ATOM 0 HG2 ARG A 142 9.793 -10.561 -2.206 1.00 0.00 H new ATOM 0 HG3 ARG A 142 8.584 -9.793 -1.196 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.303 -8.350 -0.748 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.689 -9.548 0.471 1.00 0.00 H new ATOM 0 HE ARG A 142 12.059 -10.474 -1.739 1.00 0.00 H new ATOM 0 HH11 ARG A 142 11.883 -7.366 -0.063 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.541 -6.919 -0.480 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.184 -9.890 -2.266 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.837 -8.341 -1.721 1.00 0.00 H new ATOM 2202 N LEU A 143 6.585 -10.905 0.552 1.00 0.00 N ATOM 2203 CA LEU A 143 5.617 -10.538 1.583 1.00 0.00 C ATOM 2204 C LEU A 143 4.485 -11.560 1.684 1.00 0.00 C ATOM 2205 O LEU A 143 3.856 -11.695 2.733 1.00 0.00 O ATOM 2206 CB LEU A 143 5.043 -9.147 1.303 1.00 0.00 C ATOM 2207 CG LEU A 143 5.537 -8.047 2.243 1.00 0.00 C ATOM 2208 CD1 LEU A 143 5.062 -8.311 3.661 1.00 0.00 C ATOM 2209 CD2 LEU A 143 7.054 -7.948 2.195 1.00 0.00 C ATOM 0 H LEU A 143 6.805 -10.156 -0.105 1.00 0.00 H new ATOM 0 HA LEU A 143 6.143 -10.525 2.538 1.00 0.00 H new ATOM 0 HB2 LEU A 143 5.289 -8.867 0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 143 3.956 -9.199 1.367 1.00 0.00 H new ATOM 0 HG LEU A 143 5.121 -7.095 1.913 1.00 0.00 H new ATOM 0 HD11 LEU A 143 5.422 -7.519 4.318 1.00 0.00 H new ATOM 0 HD12 LEU A 143 3.972 -8.333 3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 143 5.451 -9.271 4.002 1.00 0.00 H new ATOM 0 HD21 LEU A 143 7.389 -7.160 2.870 1.00 0.00 H new ATOM 0 HD22 LEU A 143 7.491 -8.898 2.502 1.00 0.00 H new ATOM 0 HD23 LEU A 143 7.371 -7.714 1.179 1.00 0.00 H new ATOM 2221 N THR A 144 4.228 -12.274 0.592 1.00 0.00 N ATOM 2222 CA THR A 144 3.172 -13.275 0.567 1.00 0.00 C ATOM 2223 C THR A 144 3.349 -14.292 1.692 1.00 0.00 C ATOM 2224 O THR A 144 4.298 -15.077 1.691 1.00 0.00 O ATOM 2225 CB THR A 144 3.161 -13.986 -0.781 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.465 -14.417 -1.132 1.00 0.00 O ATOM 2227 CG2 THR A 144 2.642 -13.122 -1.908 1.00 0.00 C ATOM 0 H THR A 144 4.738 -12.176 -0.286 1.00 0.00 H new ATOM 0 HA THR A 144 2.219 -12.767 0.716 1.00 0.00 H new ATOM 0 HB THR A 144 2.487 -14.833 -0.656 1.00 0.00 H new ATOM 0 HG1 THR A 144 4.890 -14.839 -0.356 1.00 0.00 H new ATOM 0 HG21 THR A 144 2.661 -13.688 -2.839 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.619 -12.816 -1.690 1.00 0.00 H new ATOM 0 HG23 THR A 144 3.272 -12.238 -2.008 1.00 0.00 H new