USER MOD reduce.3.24.130724 H: found=0, std=0, add=755, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 756 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 Single : A 24 MET CE :methyl -167:sc= 0 (180deg=-0.0122) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -145:sc= 0.506 (180deg=0.00512) USER MOD Single : A 31 GLN : amide:sc= -0.807 K(o=-0.81,f=0) USER MOD Single : A 33 SER OG : rot -83:sc= 0.842 USER MOD Single : A 37 ASN : amide:sc= -0.0231 X(o=-0.023,f=-0.0064) USER MOD Single : A 38 LYS NZ :NH3+ -163:sc= 0.146 (180deg=-1.06) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 52 GLN : amide:sc= -2.38 K(o=-2.4,f=-4.7!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 0.296 K(o=0.3,f=-1.6!) USER MOD Single : A 72 THR OG1 : rot -13:sc= 0.274 USER MOD Single : A 74 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00634) USER MOD Single : A 76 SER OG : rot 180:sc= 0.00528 USER MOD Single : A 77 THR OG1 : rot 159:sc=0.000694 USER MOD Single : A 84 TYR OH : rot 110:sc= -0.0924 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 CYS SG : rot 69:sc= 1.19 USER MOD Single : A 106 THR OG1 : rot 31:sc= 0.317 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 134:sc= 0.352 (180deg=-0.16) USER MOD Single : A 123 GLN : amide:sc= 0.28 K(o=0.28,f=-0.48) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -8.664 27.472 -16.216 1.00 0.00 N ATOM 297 CA ARG A 22 -9.826 27.426 -17.110 1.00 0.00 C ATOM 298 C ARG A 22 -11.116 27.447 -16.256 1.00 0.00 C ATOM 299 O ARG A 22 -11.070 27.044 -15.079 1.00 0.00 O ATOM 300 CB ARG A 22 -9.769 26.153 -17.999 1.00 0.00 C ATOM 301 CG ARG A 22 -8.503 26.045 -18.879 1.00 0.00 C ATOM 302 CD ARG A 22 -8.555 24.840 -19.834 1.00 0.00 C ATOM 303 NE ARG A 22 -7.288 24.657 -20.558 1.00 0.00 N ATOM 304 CZ ARG A 22 -7.029 23.673 -21.431 1.00 0.00 C ATOM 305 NH1 ARG A 22 -7.920 22.720 -21.690 1.00 0.00 N ATOM 306 NH2 ARG A 22 -5.859 23.642 -22.035 1.00 0.00 N ATOM 0 HA ARG A 22 -9.821 28.293 -17.770 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.827 25.274 -17.357 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -10.648 26.135 -18.644 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -8.388 26.961 -19.459 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -7.625 25.961 -18.239 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -8.782 23.937 -19.267 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.365 24.979 -20.550 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.546 25.334 -20.382 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.825 22.727 -21.220 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -7.698 21.982 -22.359 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -5.163 24.361 -21.836 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -5.649 22.899 -22.701 1.00 0.00 H new ATOM 320 N PRO A 23 -12.275 27.952 -16.802 1.00 0.00 N ATOM 321 CA PRO A 23 -13.565 27.926 -16.082 1.00 0.00 C ATOM 322 C PRO A 23 -14.006 26.467 -15.840 1.00 0.00 C ATOM 323 O PRO A 23 -14.364 25.747 -16.787 1.00 0.00 O ATOM 324 CB PRO A 23 -14.539 28.689 -17.022 1.00 0.00 C ATOM 325 CG PRO A 23 -13.916 28.577 -18.382 1.00 0.00 C ATOM 326 CD PRO A 23 -12.420 28.586 -18.141 1.00 0.00 C ATOM 0 HA PRO A 23 -13.523 28.387 -15.095 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -15.535 28.247 -17.004 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -14.647 29.731 -16.720 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -14.228 27.660 -18.883 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -14.216 29.407 -19.021 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -11.887 28.026 -18.909 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -12.019 29.600 -18.150 1.00 0.00 H new ATOM 334 N MET A 24 -13.890 26.027 -14.568 1.00 0.00 N ATOM 335 CA MET A 24 -14.250 24.658 -14.140 1.00 0.00 C ATOM 336 C MET A 24 -15.740 24.416 -14.413 1.00 0.00 C ATOM 337 O MET A 24 -16.541 25.363 -14.300 1.00 0.00 O ATOM 338 CB MET A 24 -13.934 24.429 -12.627 1.00 0.00 C ATOM 339 CG MET A 24 -12.571 24.954 -12.150 1.00 0.00 C ATOM 340 SD MET A 24 -11.166 24.292 -13.069 1.00 0.00 S ATOM 341 CE MET A 24 -9.831 25.279 -12.382 1.00 0.00 C ATOM 0 H MET A 24 -13.543 26.612 -13.808 1.00 0.00 H new ATOM 0 HA MET A 24 -13.651 23.949 -14.711 1.00 0.00 H new ATOM 0 HB2 MET A 24 -14.715 24.905 -12.034 1.00 0.00 H new ATOM 0 HB3 MET A 24 -13.985 23.360 -12.421 1.00 0.00 H new ATOM 0 HG2 MET A 24 -12.564 26.041 -12.229 1.00 0.00 H new ATOM 0 HG3 MET A 24 -12.449 24.711 -11.095 1.00 0.00 H new ATOM 0 HE1 MET A 24 -8.939 25.162 -12.997 1.00 0.00 H new ATOM 0 HE2 MET A 24 -10.126 26.328 -12.365 1.00 0.00 H new ATOM 0 HE3 MET A 24 -9.618 24.946 -11.366 1.00 0.00 H new ATOM 351 N SER A 25 -16.114 23.166 -14.775 1.00 0.00 N ATOM 352 CA SER A 25 -17.490 22.845 -15.174 1.00 0.00 C ATOM 353 C SER A 25 -18.476 23.223 -14.053 1.00 0.00 C ATOM 354 O SER A 25 -18.342 22.775 -12.908 1.00 0.00 O ATOM 355 CB SER A 25 -17.608 21.353 -15.541 1.00 0.00 C ATOM 356 OG SER A 25 -18.954 20.975 -15.798 1.00 0.00 O ATOM 0 H SER A 25 -15.477 22.370 -14.796 1.00 0.00 H new ATOM 0 HA SER A 25 -17.746 23.430 -16.058 1.00 0.00 H new ATOM 0 HB2 SER A 25 -16.999 21.146 -16.421 1.00 0.00 H new ATOM 0 HB3 SER A 25 -17.210 20.746 -14.728 1.00 0.00 H new ATOM 0 HG SER A 25 -18.988 20.023 -16.029 1.00 0.00 H new ATOM 362 N TYR A 26 -19.489 24.009 -14.433 1.00 0.00 N ATOM 363 CA TYR A 26 -20.381 24.689 -13.489 1.00 0.00 C ATOM 364 C TYR A 26 -21.321 23.687 -12.829 1.00 0.00 C ATOM 365 O TYR A 26 -21.642 23.826 -11.655 1.00 0.00 O ATOM 366 CB TYR A 26 -21.171 25.806 -14.214 1.00 0.00 C ATOM 367 CG TYR A 26 -20.275 26.783 -15.002 1.00 0.00 C ATOM 368 CD1 TYR A 26 -20.130 26.674 -16.393 1.00 0.00 C ATOM 369 CD2 TYR A 26 -19.566 27.803 -14.361 1.00 0.00 C ATOM 370 CE1 TYR A 26 -19.326 27.540 -17.104 1.00 0.00 C ATOM 371 CE2 TYR A 26 -18.759 28.668 -15.073 1.00 0.00 C ATOM 372 CZ TYR A 26 -18.644 28.537 -16.443 1.00 0.00 C ATOM 373 OH TYR A 26 -17.856 29.413 -17.154 1.00 0.00 O ATOM 0 H TYR A 26 -19.714 24.192 -15.411 1.00 0.00 H new ATOM 0 HA TYR A 26 -19.782 25.151 -12.704 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -21.886 25.349 -14.898 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -21.748 26.367 -13.479 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.660 25.894 -16.919 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -19.651 27.916 -13.290 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -19.232 27.437 -18.175 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -18.217 29.448 -14.558 1.00 0.00 H new ATOM 0 HH TYR A 26 -17.445 30.056 -16.539 1.00 0.00 H new ATOM 383 N ASP A 27 -21.714 22.661 -13.606 1.00 0.00 N ATOM 384 CA ASP A 27 -22.580 21.567 -13.125 1.00 0.00 C ATOM 385 C ASP A 27 -21.910 20.812 -11.966 1.00 0.00 C ATOM 386 O ASP A 27 -22.560 20.534 -10.952 1.00 0.00 O ATOM 387 CB ASP A 27 -22.919 20.598 -14.282 1.00 0.00 C ATOM 388 CG ASP A 27 -23.874 19.457 -13.868 1.00 0.00 C ATOM 389 OD1 ASP A 27 -23.422 18.310 -13.701 1.00 0.00 O ATOM 390 OD2 ASP A 27 -25.081 19.719 -13.683 1.00 0.00 O ATOM 0 H ASP A 27 -21.441 22.566 -14.584 1.00 0.00 H new ATOM 0 HA ASP A 27 -23.509 22.002 -12.755 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -23.371 21.162 -15.098 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -21.995 20.167 -14.667 1.00 0.00 H new ATOM 395 N GLU A 28 -20.593 20.517 -12.119 1.00 0.00 N ATOM 396 CA GLU A 28 -19.780 19.883 -11.060 1.00 0.00 C ATOM 397 C GLU A 28 -19.822 20.733 -9.779 1.00 0.00 C ATOM 398 O GLU A 28 -20.055 20.223 -8.708 1.00 0.00 O ATOM 399 CB GLU A 28 -18.293 19.727 -11.479 1.00 0.00 C ATOM 400 CG GLU A 28 -18.015 18.908 -12.751 1.00 0.00 C ATOM 401 CD GLU A 28 -16.501 18.746 -13.036 1.00 0.00 C ATOM 402 OE1 GLU A 28 -16.023 17.599 -13.168 1.00 0.00 O ATOM 403 OE2 GLU A 28 -15.785 19.772 -13.115 1.00 0.00 O ATOM 0 H GLU A 28 -20.073 20.712 -12.974 1.00 0.00 H new ATOM 0 HA GLU A 28 -20.206 18.895 -10.888 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -17.872 20.723 -11.617 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -17.753 19.265 -10.652 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -18.470 17.922 -12.651 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -18.491 19.394 -13.603 1.00 0.00 H new ATOM 410 N LYS A 29 -19.602 22.054 -9.950 1.00 0.00 N ATOM 411 CA LYS A 29 -19.532 23.031 -8.839 1.00 0.00 C ATOM 412 C LYS A 29 -20.900 23.205 -8.131 1.00 0.00 C ATOM 413 O LYS A 29 -20.942 23.507 -6.932 1.00 0.00 O ATOM 414 CB LYS A 29 -18.969 24.395 -9.356 1.00 0.00 C ATOM 415 CG LYS A 29 -17.423 24.580 -9.325 1.00 0.00 C ATOM 416 CD LYS A 29 -16.624 23.730 -10.352 1.00 0.00 C ATOM 417 CE LYS A 29 -16.309 22.296 -9.885 1.00 0.00 C ATOM 418 NZ LYS A 29 -15.375 21.583 -10.803 1.00 0.00 N ATOM 0 H LYS A 29 -19.467 22.477 -10.868 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.846 22.640 -8.088 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -19.306 24.533 -10.383 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -19.417 25.193 -8.764 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -17.198 25.632 -9.498 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -17.066 24.338 -8.324 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -17.190 23.680 -11.282 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -15.687 24.240 -10.576 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -15.874 22.331 -8.886 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -17.238 21.731 -9.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -15.628 20.575 -10.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -15.444 21.994 -11.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.401 21.682 -10.453 1.00 0.00 H new ATOM 432 N ARG A 30 -22.003 22.983 -8.873 1.00 0.00 N ATOM 433 CA ARG A 30 -23.366 22.990 -8.299 1.00 0.00 C ATOM 434 C ARG A 30 -23.591 21.743 -7.426 1.00 0.00 C ATOM 435 O ARG A 30 -24.397 21.766 -6.502 1.00 0.00 O ATOM 436 CB ARG A 30 -24.461 23.075 -9.398 1.00 0.00 C ATOM 437 CG ARG A 30 -24.422 24.361 -10.256 1.00 0.00 C ATOM 438 CD ARG A 30 -25.636 24.488 -11.184 1.00 0.00 C ATOM 439 NE ARG A 30 -25.848 23.276 -11.999 1.00 0.00 N ATOM 440 CZ ARG A 30 -27.030 22.893 -12.514 1.00 0.00 C ATOM 441 NH1 ARG A 30 -28.123 23.623 -12.346 1.00 0.00 N ATOM 442 NH2 ARG A 30 -27.120 21.763 -13.181 1.00 0.00 N ATOM 0 H ARG A 30 -21.977 22.796 -9.875 1.00 0.00 H new ATOM 0 HA ARG A 30 -23.449 23.883 -7.679 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -24.362 22.213 -10.057 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -25.439 23.002 -8.923 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -24.379 25.230 -9.600 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -23.510 24.367 -10.854 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -26.527 24.682 -10.588 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -25.499 25.346 -11.842 1.00 0.00 H new ATOM 0 HE ARG A 30 -25.038 22.685 -12.186 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -28.078 24.494 -11.817 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -29.009 23.314 -12.745 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -26.294 21.178 -13.307 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -28.016 21.472 -13.572 1.00 0.00 H new ATOM 456 N GLN A 31 -22.880 20.656 -7.750 1.00 0.00 N ATOM 457 CA GLN A 31 -22.881 19.420 -6.942 1.00 0.00 C ATOM 458 C GLN A 31 -21.900 19.558 -5.760 1.00 0.00 C ATOM 459 O GLN A 31 -22.151 19.029 -4.676 1.00 0.00 O ATOM 460 CB GLN A 31 -22.502 18.220 -7.840 1.00 0.00 C ATOM 461 CG GLN A 31 -23.441 18.024 -9.050 1.00 0.00 C ATOM 462 CD GLN A 31 -22.965 16.938 -10.013 1.00 0.00 C ATOM 463 OE1 GLN A 31 -23.297 15.775 -9.855 1.00 0.00 O ATOM 464 NE2 GLN A 31 -22.215 17.316 -11.035 1.00 0.00 N ATOM 0 H GLN A 31 -22.287 20.604 -8.578 1.00 0.00 H new ATOM 0 HA GLN A 31 -23.877 19.250 -6.534 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -21.483 18.357 -8.202 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -22.507 17.312 -7.237 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -24.438 17.770 -8.690 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -23.528 18.967 -9.590 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -21.953 18.296 -11.141 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -21.898 16.627 -11.717 1.00 0.00 H new ATOM 473 N LEU A 32 -20.805 20.315 -5.982 1.00 0.00 N ATOM 474 CA LEU A 32 -19.740 20.537 -4.980 1.00 0.00 C ATOM 475 C LEU A 32 -20.214 21.416 -3.811 1.00 0.00 C ATOM 476 O LEU A 32 -19.594 21.389 -2.757 1.00 0.00 O ATOM 477 CB LEU A 32 -18.429 21.110 -5.629 1.00 0.00 C ATOM 478 CG LEU A 32 -17.306 20.060 -5.943 1.00 0.00 C ATOM 479 CD1 LEU A 32 -17.782 18.973 -6.933 1.00 0.00 C ATOM 480 CD2 LEU A 32 -16.011 20.750 -6.446 1.00 0.00 C ATOM 0 H LEU A 32 -20.633 20.793 -6.867 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.498 19.557 -4.568 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.697 21.616 -6.557 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -18.016 21.866 -4.961 1.00 0.00 H new ATOM 0 HG LEU A 32 -17.074 19.556 -5.005 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -16.970 18.270 -7.119 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -18.633 18.441 -6.508 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -18.079 19.441 -7.872 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.253 19.994 -6.654 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.227 21.308 -7.357 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.642 21.433 -5.681 1.00 0.00 H new ATOM 492 N SER A 33 -21.300 22.193 -4.010 1.00 0.00 N ATOM 493 CA SER A 33 -21.939 22.982 -2.925 1.00 0.00 C ATOM 494 C SER A 33 -22.414 22.057 -1.770 1.00 0.00 C ATOM 495 O SER A 33 -22.431 22.463 -0.605 1.00 0.00 O ATOM 496 CB SER A 33 -23.118 23.812 -3.490 1.00 0.00 C ATOM 497 OG SER A 33 -24.119 22.982 -4.059 1.00 0.00 O ATOM 0 H SER A 33 -21.758 22.294 -4.916 1.00 0.00 H new ATOM 0 HA SER A 33 -21.198 23.669 -2.516 1.00 0.00 H new ATOM 0 HB2 SER A 33 -23.554 24.414 -2.693 1.00 0.00 H new ATOM 0 HB3 SER A 33 -22.747 24.504 -4.245 1.00 0.00 H new ATOM 0 HG SER A 33 -23.870 22.753 -4.979 1.00 0.00 H new ATOM 503 N LEU A 34 -22.768 20.803 -2.125 1.00 0.00 N ATOM 504 CA LEU A 34 -23.171 19.749 -1.162 1.00 0.00 C ATOM 505 C LEU A 34 -21.926 19.245 -0.374 1.00 0.00 C ATOM 506 O LEU A 34 -22.018 18.900 0.806 1.00 0.00 O ATOM 507 CB LEU A 34 -23.883 18.585 -1.950 1.00 0.00 C ATOM 508 CG LEU A 34 -25.018 17.778 -1.212 1.00 0.00 C ATOM 509 CD1 LEU A 34 -25.758 16.823 -2.191 1.00 0.00 C ATOM 510 CD2 LEU A 34 -24.482 16.990 0.009 1.00 0.00 C ATOM 0 H LEU A 34 -22.783 20.489 -3.095 1.00 0.00 H new ATOM 0 HA LEU A 34 -23.874 20.149 -0.431 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -24.312 19.010 -2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -23.117 17.875 -2.261 1.00 0.00 H new ATOM 0 HG LEU A 34 -25.730 18.514 -0.839 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -26.535 16.280 -1.652 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -26.212 17.405 -2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -25.047 16.114 -2.614 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -25.302 16.451 0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -23.724 16.280 -0.321 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -24.042 17.684 0.725 1.00 0.00 H new ATOM 522 N ASP A 35 -20.763 19.222 -1.051 1.00 0.00 N ATOM 523 CA ASP A 35 -19.465 18.830 -0.445 1.00 0.00 C ATOM 524 C ASP A 35 -18.908 19.951 0.459 1.00 0.00 C ATOM 525 O ASP A 35 -18.199 19.682 1.429 1.00 0.00 O ATOM 526 CB ASP A 35 -18.444 18.469 -1.556 1.00 0.00 C ATOM 527 CG ASP A 35 -18.891 17.273 -2.424 1.00 0.00 C ATOM 528 OD1 ASP A 35 -18.911 16.140 -1.906 1.00 0.00 O ATOM 529 OD2 ASP A 35 -19.238 17.455 -3.616 1.00 0.00 O ATOM 0 H ASP A 35 -20.691 19.474 -2.037 1.00 0.00 H new ATOM 0 HA ASP A 35 -19.633 17.952 0.179 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -18.291 19.338 -2.196 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -17.483 18.238 -1.097 1.00 0.00 H new ATOM 534 N ILE A 36 -19.236 21.208 0.117 1.00 0.00 N ATOM 535 CA ILE A 36 -18.915 22.392 0.944 1.00 0.00 C ATOM 536 C ILE A 36 -19.867 22.439 2.164 1.00 0.00 C ATOM 537 O ILE A 36 -19.481 22.875 3.255 1.00 0.00 O ATOM 538 CB ILE A 36 -19.037 23.718 0.089 1.00 0.00 C ATOM 539 CG1 ILE A 36 -18.049 23.686 -1.135 1.00 0.00 C ATOM 540 CG2 ILE A 36 -18.799 24.993 0.943 1.00 0.00 C ATOM 541 CD1 ILE A 36 -18.182 24.854 -2.110 1.00 0.00 C ATOM 0 H ILE A 36 -19.733 21.437 -0.744 1.00 0.00 H new ATOM 0 HA ILE A 36 -17.886 22.315 1.296 1.00 0.00 H new ATOM 0 HB ILE A 36 -20.060 23.762 -0.283 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.027 23.665 -0.756 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.205 22.757 -1.683 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -18.893 25.877 0.312 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -19.538 25.038 1.743 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -17.799 24.960 1.374 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -17.458 24.739 -2.917 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -19.190 24.868 -2.526 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -17.993 25.790 -1.584 1.00 0.00 H new ATOM 553 N ASN A 37 -21.105 21.933 1.961 1.00 0.00 N ATOM 554 CA ASN A 37 -22.157 21.876 3.006 1.00 0.00 C ATOM 555 C ASN A 37 -21.813 20.836 4.112 1.00 0.00 C ATOM 556 O ASN A 37 -22.479 20.785 5.150 1.00 0.00 O ATOM 557 CB ASN A 37 -23.528 21.548 2.341 1.00 0.00 C ATOM 558 CG ASN A 37 -24.743 21.695 3.274 1.00 0.00 C ATOM 559 OD1 ASN A 37 -25.331 22.770 3.383 1.00 0.00 O ATOM 560 ND2 ASN A 37 -25.126 20.620 3.949 1.00 0.00 N ATOM 0 H ASN A 37 -21.405 21.551 1.064 1.00 0.00 H new ATOM 0 HA ASN A 37 -22.215 22.849 3.493 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -23.666 22.203 1.481 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -23.498 20.526 1.963 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -25.927 20.672 4.578 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -24.620 19.741 3.839 1.00 0.00 H new ATOM 567 N LYS A 38 -20.753 20.027 3.885 1.00 0.00 N ATOM 568 CA LYS A 38 -20.251 19.058 4.886 1.00 0.00 C ATOM 569 C LYS A 38 -19.517 19.790 6.030 1.00 0.00 C ATOM 570 O LYS A 38 -19.418 19.275 7.150 1.00 0.00 O ATOM 571 CB LYS A 38 -19.279 18.040 4.231 1.00 0.00 C ATOM 572 CG LYS A 38 -19.863 17.203 3.075 1.00 0.00 C ATOM 573 CD LYS A 38 -21.139 16.417 3.462 1.00 0.00 C ATOM 574 CE LYS A 38 -21.534 15.382 2.391 1.00 0.00 C ATOM 575 NZ LYS A 38 -21.556 15.959 1.022 1.00 0.00 N ATOM 0 H LYS A 38 -20.226 20.027 3.012 1.00 0.00 H new ATOM 0 HA LYS A 38 -21.112 18.524 5.289 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -18.411 18.583 3.858 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -18.922 17.359 5.003 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -20.093 17.864 2.239 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -19.105 16.501 2.727 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -20.976 15.909 4.413 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -21.963 17.115 3.611 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -20.832 14.549 2.419 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -22.518 14.977 2.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -22.092 15.331 0.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -22.010 16.894 1.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -20.582 16.056 0.670 1.00 0.00 H new ATOM 589 N LEU A 39 -19.009 20.989 5.724 1.00 0.00 N ATOM 590 CA LEU A 39 -18.307 21.845 6.691 1.00 0.00 C ATOM 591 C LEU A 39 -19.343 22.635 7.527 1.00 0.00 C ATOM 592 O LEU A 39 -20.280 23.181 6.941 1.00 0.00 O ATOM 593 CB LEU A 39 -17.348 22.803 5.931 1.00 0.00 C ATOM 594 CG LEU A 39 -16.299 22.099 4.997 1.00 0.00 C ATOM 595 CD1 LEU A 39 -15.448 23.126 4.205 1.00 0.00 C ATOM 596 CD2 LEU A 39 -15.390 21.124 5.799 1.00 0.00 C ATOM 0 H LEU A 39 -19.073 21.397 4.791 1.00 0.00 H new ATOM 0 HA LEU A 39 -17.713 21.235 7.371 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -17.946 23.486 5.328 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -16.811 23.408 6.661 1.00 0.00 H new ATOM 0 HG LEU A 39 -16.863 21.513 4.271 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -14.736 22.597 3.572 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -16.102 23.738 3.583 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -14.908 23.766 4.903 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -14.676 20.654 5.123 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -14.852 21.678 6.568 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -16.005 20.356 6.269 1.00 0.00 H new ATOM 608 N PRO A 40 -19.198 22.703 8.902 1.00 0.00 N ATOM 609 CA PRO A 40 -20.184 23.379 9.808 1.00 0.00 C ATOM 610 C PRO A 40 -20.427 24.863 9.458 1.00 0.00 C ATOM 611 O PRO A 40 -19.636 25.462 8.737 1.00 0.00 O ATOM 612 CB PRO A 40 -19.547 23.238 11.220 1.00 0.00 C ATOM 613 CG PRO A 40 -18.623 22.061 11.096 1.00 0.00 C ATOM 614 CD PRO A 40 -18.068 22.131 9.687 1.00 0.00 C ATOM 0 HA PRO A 40 -21.171 22.923 9.724 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -19.005 24.140 11.504 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -20.306 23.069 11.984 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -17.824 22.109 11.836 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -19.155 21.124 11.262 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -17.181 22.763 9.635 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -17.780 21.146 9.319 1.00 0.00 H new ATOM 622 N GLY A 41 -21.514 25.440 10.000 1.00 0.00 N ATOM 623 CA GLY A 41 -21.945 26.812 9.676 1.00 0.00 C ATOM 624 C GLY A 41 -20.927 27.899 10.046 1.00 0.00 C ATOM 625 O GLY A 41 -20.787 28.895 9.315 1.00 0.00 O ATOM 0 H GLY A 41 -22.118 24.969 10.674 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -22.151 26.873 8.607 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -22.882 27.017 10.193 1.00 0.00 H new ATOM 629 N GLU A 42 -20.218 27.701 11.176 1.00 0.00 N ATOM 630 CA GLU A 42 -19.157 28.632 11.637 1.00 0.00 C ATOM 631 C GLU A 42 -17.908 28.554 10.731 1.00 0.00 C ATOM 632 O GLU A 42 -17.134 29.517 10.633 1.00 0.00 O ATOM 633 CB GLU A 42 -18.829 28.378 13.147 1.00 0.00 C ATOM 634 CG GLU A 42 -18.530 26.909 13.565 1.00 0.00 C ATOM 635 CD GLU A 42 -17.166 26.363 13.096 1.00 0.00 C ATOM 636 OE1 GLU A 42 -16.122 26.875 13.560 1.00 0.00 O ATOM 637 OE2 GLU A 42 -17.130 25.410 12.287 1.00 0.00 O ATOM 0 H GLU A 42 -20.359 26.901 11.792 1.00 0.00 H new ATOM 0 HA GLU A 42 -19.526 29.654 11.555 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -17.967 28.989 13.414 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -19.670 28.736 13.742 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -18.578 26.839 14.652 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -19.317 26.267 13.169 1.00 0.00 H new ATOM 644 N LYS A 43 -17.737 27.394 10.069 1.00 0.00 N ATOM 645 CA LYS A 43 -16.666 27.175 9.081 1.00 0.00 C ATOM 646 C LYS A 43 -17.103 27.734 7.723 1.00 0.00 C ATOM 647 O LYS A 43 -16.299 28.331 7.010 1.00 0.00 O ATOM 648 CB LYS A 43 -16.370 25.652 8.961 1.00 0.00 C ATOM 649 CG LYS A 43 -15.224 25.271 7.993 1.00 0.00 C ATOM 650 CD LYS A 43 -13.846 25.799 8.452 1.00 0.00 C ATOM 651 CE LYS A 43 -12.690 25.273 7.582 1.00 0.00 C ATOM 652 NZ LYS A 43 -11.364 25.671 8.125 1.00 0.00 N ATOM 0 H LYS A 43 -18.339 26.582 10.205 1.00 0.00 H new ATOM 0 HA LYS A 43 -15.760 27.688 9.404 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -16.128 25.267 9.952 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -17.280 25.147 8.636 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -15.179 24.186 7.901 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -15.447 25.666 7.002 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.851 26.889 8.423 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.677 25.508 9.489 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -12.746 24.186 7.521 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -12.796 25.655 6.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.612 25.298 7.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.300 26.708 8.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.252 25.285 9.084 1.00 0.00 H new ATOM 666 N LEU A 44 -18.408 27.589 7.435 1.00 0.00 N ATOM 667 CA LEU A 44 -19.022 27.922 6.137 1.00 0.00 C ATOM 668 C LEU A 44 -18.948 29.429 5.871 1.00 0.00 C ATOM 669 O LEU A 44 -18.718 29.857 4.735 1.00 0.00 O ATOM 670 CB LEU A 44 -20.493 27.417 6.120 1.00 0.00 C ATOM 671 CG LEU A 44 -21.290 27.608 4.787 1.00 0.00 C ATOM 672 CD1 LEU A 44 -20.633 26.831 3.616 1.00 0.00 C ATOM 673 CD2 LEU A 44 -22.781 27.206 4.966 1.00 0.00 C ATOM 0 H LEU A 44 -19.080 27.229 8.113 1.00 0.00 H new ATOM 0 HA LEU A 44 -18.470 27.425 5.339 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -20.490 26.355 6.365 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -21.036 27.926 6.916 1.00 0.00 H new ATOM 0 HG LEU A 44 -21.258 28.667 4.532 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -21.213 26.986 2.706 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -19.616 27.193 3.465 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -20.608 25.767 3.854 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -23.312 27.348 4.025 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -22.842 26.159 5.262 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -23.236 27.828 5.737 1.00 0.00 H new ATOM 685 N GLY A 45 -19.120 30.221 6.952 1.00 0.00 N ATOM 686 CA GLY A 45 -19.031 31.680 6.887 1.00 0.00 C ATOM 687 C GLY A 45 -17.628 32.197 6.539 1.00 0.00 C ATOM 688 O GLY A 45 -17.485 33.328 6.054 1.00 0.00 O ATOM 0 H GLY A 45 -19.323 29.861 7.885 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -19.738 32.046 6.143 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -19.335 32.097 7.847 1.00 0.00 H new ATOM 692 N ARG A 46 -16.595 31.352 6.766 1.00 0.00 N ATOM 693 CA ARG A 46 -15.189 31.682 6.455 1.00 0.00 C ATOM 694 C ARG A 46 -14.747 31.005 5.130 1.00 0.00 C ATOM 695 O ARG A 46 -13.819 31.488 4.459 1.00 0.00 O ATOM 696 CB ARG A 46 -14.279 31.291 7.653 1.00 0.00 C ATOM 697 CG ARG A 46 -12.794 31.709 7.498 1.00 0.00 C ATOM 698 CD ARG A 46 -12.025 31.707 8.834 1.00 0.00 C ATOM 699 NE ARG A 46 -12.549 32.737 9.761 1.00 0.00 N ATOM 700 CZ ARG A 46 -12.197 32.896 11.050 1.00 0.00 C ATOM 701 NH1 ARG A 46 -11.326 32.076 11.632 1.00 0.00 N ATOM 702 NH2 ARG A 46 -12.734 33.886 11.755 1.00 0.00 N ATOM 0 H ARG A 46 -16.716 30.423 7.170 1.00 0.00 H new ATOM 0 HA ARG A 46 -15.093 32.757 6.304 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -14.678 31.746 8.559 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.326 30.211 7.791 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.302 31.030 6.801 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -12.747 32.706 7.059 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -12.102 30.724 9.299 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -10.967 31.889 8.647 1.00 0.00 H new ATOM 0 HE ARG A 46 -13.241 33.386 9.387 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -10.912 31.310 11.100 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -11.072 32.213 12.610 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -13.406 34.517 11.318 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -12.474 34.015 12.733 1.00 0.00 H new ATOM 716 N VAL A 47 -15.440 29.912 4.744 1.00 0.00 N ATOM 717 CA VAL A 47 -15.242 29.256 3.428 1.00 0.00 C ATOM 718 C VAL A 47 -15.695 30.207 2.306 1.00 0.00 C ATOM 719 O VAL A 47 -14.997 30.381 1.305 1.00 0.00 O ATOM 720 CB VAL A 47 -16.016 27.880 3.329 1.00 0.00 C ATOM 721 CG1 VAL A 47 -15.976 27.287 1.895 1.00 0.00 C ATOM 722 CG2 VAL A 47 -15.456 26.863 4.350 1.00 0.00 C ATOM 0 H VAL A 47 -16.146 29.462 5.327 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.180 29.036 3.318 1.00 0.00 H new ATOM 0 HB VAL A 47 -17.060 28.082 3.568 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.520 26.343 1.876 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.439 27.987 1.199 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.941 27.115 1.601 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -16.002 25.924 4.265 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.399 26.688 4.147 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -15.571 27.259 5.359 1.00 0.00 H new ATOM 732 N VAL A 48 -16.867 30.832 2.502 1.00 0.00 N ATOM 733 CA VAL A 48 -17.388 31.835 1.564 1.00 0.00 C ATOM 734 C VAL A 48 -16.573 33.144 1.665 1.00 0.00 C ATOM 735 O VAL A 48 -16.504 33.889 0.698 1.00 0.00 O ATOM 736 CB VAL A 48 -18.926 32.131 1.781 1.00 0.00 C ATOM 737 CG1 VAL A 48 -19.220 32.705 3.191 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.470 33.061 0.671 1.00 0.00 C ATOM 0 H VAL A 48 -17.472 30.658 3.305 1.00 0.00 H new ATOM 0 HA VAL A 48 -17.280 31.417 0.563 1.00 0.00 H new ATOM 0 HB VAL A 48 -19.450 31.178 1.715 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.289 32.892 3.292 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -18.904 31.988 3.949 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -18.674 33.639 3.325 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.530 33.250 0.842 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -18.926 34.005 0.688 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.339 32.584 -0.300 1.00 0.00 H new ATOM 748 N HIS A 49 -15.941 33.404 2.840 1.00 0.00 N ATOM 749 CA HIS A 49 -15.185 34.656 3.085 1.00 0.00 C ATOM 750 C HIS A 49 -14.017 34.839 2.089 1.00 0.00 C ATOM 751 O HIS A 49 -13.830 35.933 1.559 1.00 0.00 O ATOM 752 CB HIS A 49 -14.667 34.743 4.535 1.00 0.00 C ATOM 753 CG HIS A 49 -13.922 36.018 4.847 1.00 0.00 C ATOM 754 ND1 HIS A 49 -12.572 36.078 5.110 1.00 0.00 N ATOM 755 CD2 HIS A 49 -14.366 37.302 4.872 1.00 0.00 C ATOM 756 CE1 HIS A 49 -12.248 37.363 5.300 1.00 0.00 C ATOM 757 NE2 HIS A 49 -13.299 38.148 5.164 1.00 0.00 N ATOM 0 H HIS A 49 -15.942 32.761 3.632 1.00 0.00 H new ATOM 0 HA HIS A 49 -15.892 35.470 2.926 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -15.512 34.652 5.218 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -14.010 33.895 4.726 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -15.384 37.616 4.694 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -11.253 37.712 5.535 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -13.325 39.164 5.254 1.00 0.00 H new ATOM 765 N ILE A 50 -13.252 33.761 1.846 1.00 0.00 N ATOM 766 CA ILE A 50 -12.106 33.786 0.902 1.00 0.00 C ATOM 767 C ILE A 50 -12.598 33.966 -0.557 1.00 0.00 C ATOM 768 O ILE A 50 -11.920 34.603 -1.376 1.00 0.00 O ATOM 769 CB ILE A 50 -11.208 32.490 1.032 1.00 0.00 C ATOM 770 CG1 ILE A 50 -12.002 31.191 0.643 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.623 32.376 2.471 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.185 29.908 0.641 1.00 0.00 C ATOM 0 H ILE A 50 -13.402 32.855 2.289 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.486 34.642 1.168 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.382 32.586 0.328 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.834 31.072 1.337 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.432 31.331 -0.349 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -10.008 31.479 2.544 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -10.013 33.253 2.686 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.439 32.316 3.192 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -11.824 29.070 0.360 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.368 29.998 -0.075 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -10.777 29.735 1.637 1.00 0.00 H new ATOM 784 N ILE A 51 -13.796 33.425 -0.844 1.00 0.00 N ATOM 785 CA ILE A 51 -14.444 33.513 -2.167 1.00 0.00 C ATOM 786 C ILE A 51 -14.939 34.955 -2.436 1.00 0.00 C ATOM 787 O ILE A 51 -14.721 35.506 -3.516 1.00 0.00 O ATOM 788 CB ILE A 51 -15.652 32.496 -2.263 1.00 0.00 C ATOM 789 CG1 ILE A 51 -15.156 31.023 -2.032 1.00 0.00 C ATOM 790 CG2 ILE A 51 -16.420 32.617 -3.608 1.00 0.00 C ATOM 791 CD1 ILE A 51 -16.261 29.973 -1.977 1.00 0.00 C ATOM 0 H ILE A 51 -14.347 32.909 -0.158 1.00 0.00 H new ATOM 0 HA ILE A 51 -13.706 33.251 -2.925 1.00 0.00 H new ATOM 0 HB ILE A 51 -16.355 32.756 -1.472 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -14.464 30.759 -2.831 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -14.594 30.987 -1.099 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.239 31.898 -3.625 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -16.820 33.626 -3.709 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -15.740 32.412 -4.435 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -15.820 28.989 -1.815 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -16.943 30.205 -1.159 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -16.811 29.973 -2.918 1.00 0.00 H new ATOM 803 N GLN A 52 -15.573 35.554 -1.412 1.00 0.00 N ATOM 804 CA GLN A 52 -16.199 36.890 -1.502 1.00 0.00 C ATOM 805 C GLN A 52 -15.151 38.000 -1.284 1.00 0.00 C ATOM 806 O GLN A 52 -15.411 39.166 -1.582 1.00 0.00 O ATOM 807 CB GLN A 52 -17.379 37.007 -0.490 1.00 0.00 C ATOM 808 CG GLN A 52 -16.970 37.075 0.988 1.00 0.00 C ATOM 809 CD GLN A 52 -18.161 37.105 1.955 1.00 0.00 C ATOM 810 OE1 GLN A 52 -18.664 38.160 2.321 1.00 0.00 O ATOM 811 NE2 GLN A 52 -18.629 35.937 2.360 1.00 0.00 N ATOM 0 H GLN A 52 -15.667 35.124 -0.492 1.00 0.00 H new ATOM 0 HA GLN A 52 -16.607 37.018 -2.505 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -17.956 37.899 -0.732 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -18.041 36.152 -0.628 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -16.344 36.214 1.223 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -16.361 37.965 1.147 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -18.191 35.073 2.040 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -19.428 35.899 2.993 1.00 0.00 H new ATOM 820 N ALA A 53 -13.964 37.623 -0.760 1.00 0.00 N ATOM 821 CA ALA A 53 -12.811 38.528 -0.648 1.00 0.00 C ATOM 822 C ALA A 53 -12.252 38.812 -2.050 1.00 0.00 C ATOM 823 O ALA A 53 -11.971 39.961 -2.394 1.00 0.00 O ATOM 824 CB ALA A 53 -11.729 37.929 0.271 1.00 0.00 C ATOM 0 H ALA A 53 -13.784 36.684 -0.405 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.134 39.467 -0.198 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -10.886 38.617 0.338 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.145 37.767 1.265 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.389 36.978 -0.139 1.00 0.00 H new ATOM 830 N ARG A 54 -12.126 37.732 -2.843 1.00 0.00 N ATOM 831 CA ARG A 54 -11.685 37.789 -4.246 1.00 0.00 C ATOM 832 C ARG A 54 -12.775 38.425 -5.130 1.00 0.00 C ATOM 833 O ARG A 54 -12.476 39.253 -5.989 1.00 0.00 O ATOM 834 CB ARG A 54 -11.308 36.353 -4.739 1.00 0.00 C ATOM 835 CG ARG A 54 -9.828 35.921 -4.518 1.00 0.00 C ATOM 836 CD ARG A 54 -9.355 35.934 -3.045 1.00 0.00 C ATOM 837 NE ARG A 54 -9.059 37.293 -2.539 1.00 0.00 N ATOM 838 CZ ARG A 54 -8.374 37.576 -1.420 1.00 0.00 C ATOM 839 NH1 ARG A 54 -7.846 36.611 -0.674 1.00 0.00 N ATOM 840 NH2 ARG A 54 -8.201 38.838 -1.062 1.00 0.00 N ATOM 0 H ARG A 54 -12.330 36.785 -2.522 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.798 38.419 -4.321 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.954 35.636 -4.233 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.530 36.286 -5.804 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -9.696 34.915 -4.917 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -9.182 36.581 -5.097 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -10.124 35.480 -2.419 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -8.462 35.316 -2.952 1.00 0.00 H new ATOM 0 HE ARG A 54 -9.405 38.081 -3.087 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -7.958 35.635 -0.949 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -7.329 36.846 0.173 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -8.587 39.588 -1.635 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -7.682 39.061 -0.213 1.00 0.00 H new ATOM 854 N GLU A 55 -14.032 38.029 -4.900 1.00 0.00 N ATOM 855 CA GLU A 55 -15.213 38.519 -5.643 1.00 0.00 C ATOM 856 C GLU A 55 -16.082 39.404 -4.716 1.00 0.00 C ATOM 857 O GLU A 55 -16.986 38.891 -4.049 1.00 0.00 O ATOM 858 CB GLU A 55 -16.016 37.300 -6.226 1.00 0.00 C ATOM 859 CG GLU A 55 -15.646 36.896 -7.680 1.00 0.00 C ATOM 860 CD GLU A 55 -14.128 36.894 -7.988 1.00 0.00 C ATOM 861 OE1 GLU A 55 -13.633 37.855 -8.616 1.00 0.00 O ATOM 862 OE2 GLU A 55 -13.417 35.940 -7.602 1.00 0.00 O ATOM 0 H GLU A 55 -14.268 37.346 -4.180 1.00 0.00 H new ATOM 0 HA GLU A 55 -14.898 39.136 -6.485 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.860 36.439 -5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -17.079 37.537 -6.192 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -16.044 35.901 -7.878 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -16.141 37.580 -8.369 1.00 0.00 H new ATOM 869 N PRO A 56 -15.810 40.765 -4.656 1.00 0.00 N ATOM 870 CA PRO A 56 -16.457 41.700 -3.690 1.00 0.00 C ATOM 871 C PRO A 56 -17.970 41.882 -3.911 1.00 0.00 C ATOM 872 O PRO A 56 -18.675 42.364 -3.014 1.00 0.00 O ATOM 873 CB PRO A 56 -15.682 43.044 -3.892 1.00 0.00 C ATOM 874 CG PRO A 56 -14.443 42.665 -4.652 1.00 0.00 C ATOM 875 CD PRO A 56 -14.854 41.502 -5.523 1.00 0.00 C ATOM 0 HA PRO A 56 -16.398 41.313 -2.673 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.281 43.766 -4.447 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -15.434 43.504 -2.936 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -14.079 43.498 -5.253 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -13.636 42.384 -3.975 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.322 41.836 -6.449 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -14.001 40.884 -5.802 1.00 0.00 H new ATOM 883 N SER A 57 -18.454 41.491 -5.103 1.00 0.00 N ATOM 884 CA SER A 57 -19.892 41.484 -5.435 1.00 0.00 C ATOM 885 C SER A 57 -20.666 40.526 -4.502 1.00 0.00 C ATOM 886 O SER A 57 -21.812 40.805 -4.117 1.00 0.00 O ATOM 887 CB SER A 57 -20.077 41.073 -6.915 1.00 0.00 C ATOM 888 OG SER A 57 -21.446 41.088 -7.316 1.00 0.00 O ATOM 0 H SER A 57 -17.858 41.170 -5.866 1.00 0.00 H new ATOM 0 HA SER A 57 -20.295 42.486 -5.290 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.507 41.750 -7.551 1.00 0.00 H new ATOM 0 HB3 SER A 57 -19.668 40.074 -7.066 1.00 0.00 H new ATOM 0 HG SER A 57 -21.514 40.824 -8.257 1.00 0.00 H new ATOM 894 N LEU A 58 -20.013 39.404 -4.146 1.00 0.00 N ATOM 895 CA LEU A 58 -20.568 38.401 -3.218 1.00 0.00 C ATOM 896 C LEU A 58 -20.462 38.889 -1.756 1.00 0.00 C ATOM 897 O LEU A 58 -21.271 38.504 -0.905 1.00 0.00 O ATOM 898 CB LEU A 58 -19.827 37.043 -3.404 1.00 0.00 C ATOM 899 CG LEU A 58 -19.904 36.397 -4.834 1.00 0.00 C ATOM 900 CD1 LEU A 58 -19.130 35.051 -4.894 1.00 0.00 C ATOM 901 CD2 LEU A 58 -21.375 36.218 -5.297 1.00 0.00 C ATOM 0 H LEU A 58 -19.084 39.167 -4.494 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.625 38.258 -3.445 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -18.777 37.189 -3.151 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -20.232 36.331 -2.685 1.00 0.00 H new ATOM 0 HG LEU A 58 -19.420 37.086 -5.527 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -19.205 34.633 -5.898 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -18.082 35.223 -4.650 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -19.560 34.352 -4.177 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.392 35.769 -6.290 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -21.901 35.569 -4.596 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -21.867 37.190 -5.330 1.00 0.00 H new ATOM 913 N ARG A 59 -19.459 39.762 -1.496 1.00 0.00 N ATOM 914 CA ARG A 59 -19.177 40.301 -0.142 1.00 0.00 C ATOM 915 C ARG A 59 -20.208 41.368 0.266 1.00 0.00 C ATOM 916 O ARG A 59 -20.348 41.687 1.454 1.00 0.00 O ATOM 917 CB ARG A 59 -17.735 40.901 -0.070 1.00 0.00 C ATOM 918 CG ARG A 59 -17.108 40.956 1.373 1.00 0.00 C ATOM 919 CD ARG A 59 -16.612 42.353 1.795 1.00 0.00 C ATOM 920 NE ARG A 59 -17.724 43.296 2.026 1.00 0.00 N ATOM 921 CZ ARG A 59 -17.626 44.443 2.715 1.00 0.00 C ATOM 922 NH1 ARG A 59 -16.470 44.827 3.248 1.00 0.00 N ATOM 923 NH2 ARG A 59 -18.689 45.205 2.876 1.00 0.00 N ATOM 0 H ARG A 59 -18.825 40.111 -2.215 1.00 0.00 H new ATOM 0 HA ARG A 59 -19.250 39.469 0.558 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -17.080 40.312 -0.712 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -17.757 41.911 -0.479 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -17.852 40.614 2.093 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -16.273 40.257 1.421 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -16.018 42.266 2.705 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -15.955 42.752 1.022 1.00 0.00 H new ATOM 0 HE ARG A 59 -18.634 43.058 1.633 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -15.639 44.246 3.136 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -16.414 45.702 3.769 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -19.584 44.922 2.477 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -18.617 46.077 3.400 1.00 0.00 H new ATOM 937 N ASP A 60 -20.892 41.940 -0.738 1.00 0.00 N ATOM 938 CA ASP A 60 -21.957 42.932 -0.519 1.00 0.00 C ATOM 939 C ASP A 60 -23.235 42.254 0.022 1.00 0.00 C ATOM 940 O ASP A 60 -24.015 42.878 0.745 1.00 0.00 O ATOM 941 CB ASP A 60 -22.260 43.697 -1.836 1.00 0.00 C ATOM 942 CG ASP A 60 -23.305 44.820 -1.658 1.00 0.00 C ATOM 943 OD1 ASP A 60 -24.433 44.708 -2.185 1.00 0.00 O ATOM 944 OD2 ASP A 60 -23.010 45.806 -0.956 1.00 0.00 O ATOM 0 H ASP A 60 -20.723 41.729 -1.721 1.00 0.00 H new ATOM 0 HA ASP A 60 -21.612 43.648 0.227 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -21.335 44.127 -2.220 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.618 42.991 -2.585 1.00 0.00 H new ATOM 949 N SER A 61 -23.430 40.970 -0.329 1.00 0.00 N ATOM 950 CA SER A 61 -24.571 40.163 0.146 1.00 0.00 C ATOM 951 C SER A 61 -24.247 39.506 1.505 1.00 0.00 C ATOM 952 O SER A 61 -23.077 39.323 1.850 1.00 0.00 O ATOM 953 CB SER A 61 -24.903 39.077 -0.903 1.00 0.00 C ATOM 954 OG SER A 61 -25.203 39.654 -2.168 1.00 0.00 O ATOM 0 H SER A 61 -22.801 40.461 -0.950 1.00 0.00 H new ATOM 0 HA SER A 61 -25.433 40.816 0.281 1.00 0.00 H new ATOM 0 HB2 SER A 61 -24.059 38.395 -1.003 1.00 0.00 H new ATOM 0 HB3 SER A 61 -25.752 38.485 -0.561 1.00 0.00 H new ATOM 0 HG SER A 61 -25.407 38.944 -2.811 1.00 0.00 H new ATOM 960 N ASN A 62 -25.305 39.174 2.270 1.00 0.00 N ATOM 961 CA ASN A 62 -25.198 38.413 3.525 1.00 0.00 C ATOM 962 C ASN A 62 -24.647 36.993 3.239 1.00 0.00 C ATOM 963 O ASN A 62 -25.078 36.355 2.262 1.00 0.00 O ATOM 964 CB ASN A 62 -26.586 38.298 4.237 1.00 0.00 C ATOM 965 CG ASN A 62 -27.184 39.633 4.724 1.00 0.00 C ATOM 966 OD1 ASN A 62 -26.955 40.694 4.142 1.00 0.00 O ATOM 967 ND2 ASN A 62 -27.968 39.588 5.798 1.00 0.00 N ATOM 0 H ASN A 62 -26.263 39.429 2.031 1.00 0.00 H new ATOM 0 HA ASN A 62 -24.514 38.948 4.184 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -27.292 37.831 3.550 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -26.484 37.630 5.092 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -28.393 40.444 6.155 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -28.144 38.698 6.264 1.00 0.00 H new ATOM 974 N PRO A 63 -23.714 36.458 4.099 1.00 0.00 N ATOM 975 CA PRO A 63 -23.151 35.088 3.931 1.00 0.00 C ATOM 976 C PRO A 63 -24.156 33.972 4.348 1.00 0.00 C ATOM 977 O PRO A 63 -23.820 32.785 4.328 1.00 0.00 O ATOM 978 CB PRO A 63 -21.898 35.121 4.847 1.00 0.00 C ATOM 979 CG PRO A 63 -22.278 36.056 5.956 1.00 0.00 C ATOM 980 CD PRO A 63 -23.135 37.135 5.311 1.00 0.00 C ATOM 0 HA PRO A 63 -22.921 34.848 2.893 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.657 34.129 5.228 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -21.020 35.478 4.308 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -22.830 35.533 6.737 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -21.393 36.487 6.425 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -23.917 37.482 5.987 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -22.541 38.007 5.037 1.00 0.00 H new ATOM 988 N GLU A 64 -25.380 34.395 4.727 1.00 0.00 N ATOM 989 CA GLU A 64 -26.500 33.505 5.077 1.00 0.00 C ATOM 990 C GLU A 64 -27.213 33.022 3.802 1.00 0.00 C ATOM 991 O GLU A 64 -27.411 31.820 3.592 1.00 0.00 O ATOM 992 CB GLU A 64 -27.498 34.293 5.969 1.00 0.00 C ATOM 993 CG GLU A 64 -26.861 34.958 7.212 1.00 0.00 C ATOM 994 CD GLU A 64 -27.820 35.921 7.925 1.00 0.00 C ATOM 995 OE1 GLU A 64 -28.622 35.470 8.766 1.00 0.00 O ATOM 996 OE2 GLU A 64 -27.801 37.131 7.610 1.00 0.00 O ATOM 0 H GLU A 64 -25.619 35.384 4.799 1.00 0.00 H new ATOM 0 HA GLU A 64 -26.123 32.635 5.614 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -27.975 35.064 5.364 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -28.285 33.614 6.299 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -26.544 34.184 7.911 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -25.965 35.501 6.910 1.00 0.00 H new ATOM 1003 N GLU A 65 -27.579 33.999 2.943 1.00 0.00 N ATOM 1004 CA GLU A 65 -28.362 33.768 1.710 1.00 0.00 C ATOM 1005 C GLU A 65 -27.447 33.779 0.469 1.00 0.00 C ATOM 1006 O GLU A 65 -27.935 33.899 -0.664 1.00 0.00 O ATOM 1007 CB GLU A 65 -29.473 34.863 1.571 1.00 0.00 C ATOM 1008 CG GLU A 65 -30.342 35.103 2.831 1.00 0.00 C ATOM 1009 CD GLU A 65 -30.992 33.824 3.395 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -30.603 33.377 4.499 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -31.887 33.251 2.734 1.00 0.00 O ATOM 0 H GLU A 65 -27.337 34.979 3.088 1.00 0.00 H new ATOM 0 HA GLU A 65 -28.832 32.787 1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -28.997 35.804 1.296 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -30.130 34.585 0.747 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -29.724 35.556 3.606 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -31.126 35.820 2.588 1.00 0.00 H new ATOM 1018 N ILE A 66 -26.130 33.616 0.699 1.00 0.00 N ATOM 1019 CA ILE A 66 -25.102 33.755 -0.340 1.00 0.00 C ATOM 1020 C ILE A 66 -25.262 32.716 -1.477 1.00 0.00 C ATOM 1021 O ILE A 66 -25.338 31.505 -1.242 1.00 0.00 O ATOM 1022 CB ILE A 66 -23.646 33.664 0.262 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -22.562 33.916 -0.845 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -23.397 32.319 1.005 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -22.511 35.331 -1.388 1.00 0.00 C ATOM 0 H ILE A 66 -25.752 33.383 1.617 1.00 0.00 H new ATOM 0 HA ILE A 66 -25.246 34.747 -0.768 1.00 0.00 H new ATOM 0 HB ILE A 66 -23.558 34.454 1.008 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -21.583 33.665 -0.436 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -22.746 33.232 -1.674 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -22.382 32.305 1.401 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -24.108 32.219 1.825 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -23.527 31.490 0.310 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -21.731 35.402 -2.146 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -23.473 35.585 -1.833 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -22.292 36.025 -0.576 1.00 0.00 H new ATOM 1037 N GLU A 67 -25.354 33.228 -2.711 1.00 0.00 N ATOM 1038 CA GLU A 67 -25.272 32.415 -3.934 1.00 0.00 C ATOM 1039 C GLU A 67 -23.925 32.653 -4.614 1.00 0.00 C ATOM 1040 O GLU A 67 -23.579 33.785 -4.959 1.00 0.00 O ATOM 1041 CB GLU A 67 -26.448 32.719 -4.897 1.00 0.00 C ATOM 1042 CG GLU A 67 -27.775 32.067 -4.473 1.00 0.00 C ATOM 1043 CD GLU A 67 -27.717 30.527 -4.490 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -27.474 29.904 -3.433 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -27.893 29.930 -5.571 1.00 0.00 O ATOM 0 H GLU A 67 -25.488 34.223 -2.891 1.00 0.00 H new ATOM 0 HA GLU A 67 -25.350 31.363 -3.661 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -26.587 33.798 -4.959 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -26.186 32.374 -5.897 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -28.036 32.405 -3.470 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -28.569 32.403 -5.140 1.00 0.00 H new ATOM 1052 N ILE A 68 -23.184 31.556 -4.795 1.00 0.00 N ATOM 1053 CA ILE A 68 -21.834 31.589 -5.372 1.00 0.00 C ATOM 1054 C ILE A 68 -21.941 31.356 -6.892 1.00 0.00 C ATOM 1055 O ILE A 68 -22.095 30.215 -7.347 1.00 0.00 O ATOM 1056 CB ILE A 68 -20.902 30.500 -4.703 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -20.869 30.656 -3.140 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -19.470 30.578 -5.289 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -19.996 29.631 -2.418 1.00 0.00 C ATOM 0 H ILE A 68 -23.502 30.619 -4.546 1.00 0.00 H new ATOM 0 HA ILE A 68 -21.383 32.562 -5.180 1.00 0.00 H new ATOM 0 HB ILE A 68 -21.319 29.519 -4.930 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -20.511 31.656 -2.895 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -21.887 30.580 -2.759 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -18.842 29.822 -4.818 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -19.507 30.401 -6.364 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -19.052 31.567 -5.099 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -20.033 29.814 -1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.365 28.627 -2.628 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -18.967 29.720 -2.766 1.00 0.00 H new ATOM 1071 N ASP A 69 -21.939 32.455 -7.654 1.00 0.00 N ATOM 1072 CA ASP A 69 -22.025 32.414 -9.120 1.00 0.00 C ATOM 1073 C ASP A 69 -20.626 32.174 -9.717 1.00 0.00 C ATOM 1074 O ASP A 69 -19.828 33.107 -9.856 1.00 0.00 O ATOM 1075 CB ASP A 69 -22.664 33.719 -9.650 1.00 0.00 C ATOM 1076 CG ASP A 69 -24.100 33.933 -9.133 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -24.296 34.691 -8.160 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -25.037 33.321 -9.686 1.00 0.00 O ATOM 0 H ASP A 69 -21.878 33.399 -7.273 1.00 0.00 H new ATOM 0 HA ASP A 69 -22.665 31.587 -9.429 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -22.046 34.567 -9.354 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -22.674 33.697 -10.740 1.00 0.00 H new ATOM 1083 N PHE A 70 -20.358 30.897 -10.056 1.00 0.00 N ATOM 1084 CA PHE A 70 -19.034 30.402 -10.507 1.00 0.00 C ATOM 1085 C PHE A 70 -18.604 30.972 -11.876 1.00 0.00 C ATOM 1086 O PHE A 70 -17.414 30.952 -12.210 1.00 0.00 O ATOM 1087 CB PHE A 70 -19.027 28.846 -10.537 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.238 28.213 -9.155 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -18.177 28.083 -8.264 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -20.490 27.738 -8.755 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -18.363 27.521 -7.017 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -20.675 27.175 -7.504 1.00 0.00 C ATOM 1093 CZ PHE A 70 -19.607 27.056 -6.640 1.00 0.00 C ATOM 0 H PHE A 70 -21.067 30.164 -10.025 1.00 0.00 H new ATOM 0 HA PHE A 70 -18.301 30.759 -9.783 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -19.809 28.499 -11.212 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -18.077 28.501 -10.946 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -17.194 28.427 -8.552 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.327 27.811 -9.433 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -17.531 27.445 -6.333 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -21.654 26.830 -7.205 1.00 0.00 H new ATOM 0 HZ PHE A 70 -19.743 26.600 -5.671 1.00 0.00 H new ATOM 1103 N GLU A 71 -19.576 31.485 -12.646 1.00 0.00 N ATOM 1104 CA GLU A 71 -19.319 32.121 -13.949 1.00 0.00 C ATOM 1105 C GLU A 71 -18.746 33.542 -13.766 1.00 0.00 C ATOM 1106 O GLU A 71 -17.839 33.959 -14.493 1.00 0.00 O ATOM 1107 CB GLU A 71 -20.629 32.154 -14.769 1.00 0.00 C ATOM 1108 CG GLU A 71 -20.503 32.780 -16.172 1.00 0.00 C ATOM 1109 CD GLU A 71 -21.832 32.812 -16.936 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -22.700 33.646 -16.608 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -22.019 32.001 -17.866 1.00 0.00 O ATOM 0 H GLU A 71 -20.562 31.471 -12.384 1.00 0.00 H new ATOM 0 HA GLU A 71 -18.575 31.537 -14.490 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -21.000 31.134 -14.874 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.379 32.709 -14.206 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -20.120 33.796 -16.077 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -19.771 32.216 -16.751 1.00 0.00 H new ATOM 1118 N THR A 72 -19.286 34.270 -12.774 1.00 0.00 N ATOM 1119 CA THR A 72 -18.841 35.637 -12.429 1.00 0.00 C ATOM 1120 C THR A 72 -17.639 35.583 -11.461 1.00 0.00 C ATOM 1121 O THR A 72 -16.988 36.595 -11.201 1.00 0.00 O ATOM 1122 CB THR A 72 -20.008 36.471 -11.805 1.00 0.00 C ATOM 1123 OG1 THR A 72 -20.458 35.877 -10.572 1.00 0.00 O ATOM 1124 CG2 THR A 72 -21.206 36.576 -12.767 1.00 0.00 C ATOM 0 H THR A 72 -20.046 33.929 -12.185 1.00 0.00 H new ATOM 0 HA THR A 72 -18.529 36.132 -13.349 1.00 0.00 H new ATOM 0 HB THR A 72 -19.616 37.470 -11.614 1.00 0.00 H new ATOM 0 HG1 THR A 72 -20.093 34.971 -10.493 1.00 0.00 H new ATOM 0 HG21 THR A 72 -21.997 37.162 -12.300 1.00 0.00 H new ATOM 0 HG22 THR A 72 -20.890 37.063 -13.690 1.00 0.00 H new ATOM 0 HG23 THR A 72 -21.580 35.577 -12.993 1.00 0.00 H new ATOM 1132 N LEU A 73 -17.393 34.372 -10.934 1.00 0.00 N ATOM 1133 CA LEU A 73 -16.270 34.052 -10.044 1.00 0.00 C ATOM 1134 C LEU A 73 -15.029 33.773 -10.933 1.00 0.00 C ATOM 1135 O LEU A 73 -15.128 32.990 -11.884 1.00 0.00 O ATOM 1136 CB LEU A 73 -16.665 32.788 -9.199 1.00 0.00 C ATOM 1137 CG LEU A 73 -16.207 32.704 -7.714 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -16.547 31.326 -7.111 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -14.723 33.010 -7.560 1.00 0.00 C ATOM 0 H LEU A 73 -17.989 33.566 -11.123 1.00 0.00 H new ATOM 0 HA LEU A 73 -16.039 34.869 -9.361 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -17.752 32.708 -9.214 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.274 31.911 -9.715 1.00 0.00 H new ATOM 0 HG LEU A 73 -16.756 33.467 -7.162 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -16.217 31.292 -6.073 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.624 31.165 -7.155 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -16.040 30.545 -7.679 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.444 32.941 -6.509 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.141 32.292 -8.138 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -14.520 34.017 -7.923 1.00 0.00 H new ATOM 1151 N LYS A 74 -13.872 34.404 -10.618 1.00 0.00 N ATOM 1152 CA LYS A 74 -12.642 34.258 -11.437 1.00 0.00 C ATOM 1153 C LYS A 74 -12.062 32.826 -11.323 1.00 0.00 C ATOM 1154 O LYS A 74 -11.920 32.320 -10.208 1.00 0.00 O ATOM 1155 CB LYS A 74 -11.585 35.325 -11.042 1.00 0.00 C ATOM 1156 CG LYS A 74 -12.001 36.779 -11.375 1.00 0.00 C ATOM 1157 CD LYS A 74 -10.887 37.819 -11.072 1.00 0.00 C ATOM 1158 CE LYS A 74 -11.335 39.270 -11.328 1.00 0.00 C ATOM 1159 NZ LYS A 74 -11.648 39.514 -12.757 1.00 0.00 N ATOM 0 H LYS A 74 -13.764 35.015 -9.809 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.911 34.423 -12.480 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.391 35.250 -9.972 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.649 35.100 -11.553 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -12.270 36.841 -12.430 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -12.893 37.035 -10.803 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -10.576 37.718 -10.032 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -10.015 37.599 -11.688 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.214 39.490 -10.722 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -10.549 39.953 -11.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.912 40.511 -12.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -10.813 39.297 -13.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.439 38.905 -13.048 1.00 0.00 H new ATOM 1173 N PRO A 75 -11.747 32.148 -12.491 1.00 0.00 N ATOM 1174 CA PRO A 75 -11.214 30.751 -12.533 1.00 0.00 C ATOM 1175 C PRO A 75 -9.926 30.504 -11.701 1.00 0.00 C ATOM 1176 O PRO A 75 -9.579 29.350 -11.429 1.00 0.00 O ATOM 1177 CB PRO A 75 -10.949 30.513 -14.047 1.00 0.00 C ATOM 1178 CG PRO A 75 -11.899 31.432 -14.744 1.00 0.00 C ATOM 1179 CD PRO A 75 -11.936 32.676 -13.881 1.00 0.00 C ATOM 0 HA PRO A 75 -11.927 30.062 -12.079 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.915 30.738 -14.309 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -11.128 29.474 -14.322 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -11.559 31.661 -15.754 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -12.888 30.984 -14.835 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -11.147 33.377 -14.154 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -12.883 33.206 -13.983 1.00 0.00 H new ATOM 1187 N SER A 76 -9.225 31.593 -11.343 1.00 0.00 N ATOM 1188 CA SER A 76 -8.062 31.563 -10.432 1.00 0.00 C ATOM 1189 C SER A 76 -8.501 31.220 -8.989 1.00 0.00 C ATOM 1190 O SER A 76 -7.824 30.458 -8.277 1.00 0.00 O ATOM 1191 CB SER A 76 -7.347 32.934 -10.475 1.00 0.00 C ATOM 1192 OG SER A 76 -8.267 33.996 -10.283 1.00 0.00 O ATOM 0 H SER A 76 -9.450 32.529 -11.680 1.00 0.00 H new ATOM 0 HA SER A 76 -7.371 30.786 -10.759 1.00 0.00 H new ATOM 0 HB2 SER A 76 -6.578 32.971 -9.703 1.00 0.00 H new ATOM 0 HB3 SER A 76 -6.843 33.055 -11.434 1.00 0.00 H new ATOM 0 HG SER A 76 -7.790 34.852 -10.313 1.00 0.00 H new ATOM 1198 N THR A 77 -9.645 31.794 -8.576 1.00 0.00 N ATOM 1199 CA THR A 77 -10.259 31.510 -7.274 1.00 0.00 C ATOM 1200 C THR A 77 -10.926 30.114 -7.287 1.00 0.00 C ATOM 1201 O THR A 77 -10.939 29.433 -6.267 1.00 0.00 O ATOM 1202 CB THR A 77 -11.310 32.601 -6.899 1.00 0.00 C ATOM 1203 OG1 THR A 77 -10.781 33.911 -7.158 1.00 0.00 O ATOM 1204 CG2 THR A 77 -11.754 32.520 -5.419 1.00 0.00 C ATOM 0 H THR A 77 -10.167 32.467 -9.138 1.00 0.00 H new ATOM 0 HA THR A 77 -9.471 31.521 -6.521 1.00 0.00 H new ATOM 0 HB THR A 77 -12.186 32.415 -7.521 1.00 0.00 H new ATOM 0 HG1 THR A 77 -11.519 34.550 -7.249 1.00 0.00 H new ATOM 0 HG21 THR A 77 -12.485 33.302 -5.215 1.00 0.00 H new ATOM 0 HG22 THR A 77 -12.202 31.545 -5.226 1.00 0.00 H new ATOM 0 HG23 THR A 77 -10.888 32.655 -4.771 1.00 0.00 H new ATOM 1212 N LEU A 78 -11.476 29.710 -8.466 1.00 0.00 N ATOM 1213 CA LEU A 78 -11.995 28.333 -8.688 1.00 0.00 C ATOM 1214 C LEU A 78 -10.868 27.301 -8.504 1.00 0.00 C ATOM 1215 O LEU A 78 -11.078 26.274 -7.882 1.00 0.00 O ATOM 1216 CB LEU A 78 -12.637 28.152 -10.103 1.00 0.00 C ATOM 1217 CG LEU A 78 -14.128 28.597 -10.278 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -14.313 30.098 -10.018 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -14.665 28.208 -11.684 1.00 0.00 C ATOM 0 H LEU A 78 -11.571 30.321 -9.277 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.777 28.171 -7.946 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.033 28.707 -10.821 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.566 27.099 -10.373 1.00 0.00 H new ATOM 0 HG LEU A 78 -14.713 28.063 -9.529 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -15.362 30.364 -10.150 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.005 30.331 -8.999 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.703 30.667 -10.720 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -15.702 28.529 -11.779 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -14.063 28.695 -12.451 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -14.607 27.127 -11.809 1.00 0.00 H new ATOM 1231 N ARG A 79 -9.683 27.612 -9.062 1.00 0.00 N ATOM 1232 CA ARG A 79 -8.458 26.790 -8.938 1.00 0.00 C ATOM 1233 C ARG A 79 -8.139 26.508 -7.460 1.00 0.00 C ATOM 1234 O ARG A 79 -7.900 25.361 -7.061 1.00 0.00 O ATOM 1235 CB ARG A 79 -7.265 27.547 -9.581 1.00 0.00 C ATOM 1236 CG ARG A 79 -5.896 26.806 -9.519 1.00 0.00 C ATOM 1237 CD ARG A 79 -4.698 27.761 -9.377 1.00 0.00 C ATOM 1238 NE ARG A 79 -4.730 28.877 -10.341 1.00 0.00 N ATOM 1239 CZ ARG A 79 -4.092 30.053 -10.182 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -3.286 30.261 -9.147 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -4.234 31.001 -11.091 1.00 0.00 N ATOM 0 H ARG A 79 -9.545 28.454 -9.621 1.00 0.00 H new ATOM 0 HA ARG A 79 -8.622 25.841 -9.449 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -7.504 27.748 -10.625 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.160 28.513 -9.087 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.902 26.113 -8.677 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -5.772 26.209 -10.422 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -4.680 28.164 -8.364 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -3.774 27.198 -9.512 1.00 0.00 H new ATOM 0 HE ARG A 79 -5.277 28.749 -11.193 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -3.142 29.524 -8.457 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -2.811 31.158 -9.043 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -4.824 30.840 -11.907 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -3.754 31.894 -10.976 1.00 0.00 H new ATOM 1255 N GLU A 80 -8.164 27.597 -6.670 1.00 0.00 N ATOM 1256 CA GLU A 80 -7.896 27.555 -5.229 1.00 0.00 C ATOM 1257 C GLU A 80 -9.023 26.812 -4.484 1.00 0.00 C ATOM 1258 O GLU A 80 -8.744 26.092 -3.535 1.00 0.00 O ATOM 1259 CB GLU A 80 -7.744 29.001 -4.684 1.00 0.00 C ATOM 1260 CG GLU A 80 -7.319 29.105 -3.194 1.00 0.00 C ATOM 1261 CD GLU A 80 -7.160 30.560 -2.709 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -6.108 31.181 -2.976 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -8.093 31.108 -2.089 1.00 0.00 O ATOM 0 H GLU A 80 -8.372 28.533 -7.019 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.967 27.011 -5.060 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.008 29.526 -5.293 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.693 29.522 -4.812 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -8.061 28.601 -2.575 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.376 28.577 -3.054 1.00 0.00 H new ATOM 1270 N LEU A 81 -10.286 26.982 -4.952 1.00 0.00 N ATOM 1271 CA LEU A 81 -11.491 26.419 -4.295 1.00 0.00 C ATOM 1272 C LEU A 81 -11.531 24.881 -4.424 1.00 0.00 C ATOM 1273 O LEU A 81 -11.875 24.195 -3.459 1.00 0.00 O ATOM 1274 CB LEU A 81 -12.789 27.048 -4.878 1.00 0.00 C ATOM 1275 CG LEU A 81 -14.143 26.534 -4.281 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -14.233 26.778 -2.748 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -15.345 27.176 -5.017 1.00 0.00 C ATOM 0 H LEU A 81 -10.496 27.514 -5.796 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.435 26.669 -3.235 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -12.740 28.127 -4.733 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -12.801 26.871 -5.953 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.179 25.456 -4.436 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -15.188 26.406 -2.376 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.419 26.253 -2.248 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -14.155 27.846 -2.544 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -16.275 26.805 -4.587 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -15.301 28.260 -4.908 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -15.305 26.915 -6.075 1.00 0.00 H new ATOM 1289 N GLU A 82 -11.175 24.362 -5.620 1.00 0.00 N ATOM 1290 CA GLU A 82 -11.089 22.903 -5.889 1.00 0.00 C ATOM 1291 C GLU A 82 -10.099 22.247 -4.916 1.00 0.00 C ATOM 1292 O GLU A 82 -10.396 21.229 -4.276 1.00 0.00 O ATOM 1293 CB GLU A 82 -10.630 22.623 -7.355 1.00 0.00 C ATOM 1294 CG GLU A 82 -11.532 23.212 -8.454 1.00 0.00 C ATOM 1295 CD GLU A 82 -12.981 22.704 -8.393 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -13.233 21.560 -8.842 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -13.874 23.443 -7.916 1.00 0.00 O ATOM 0 H GLU A 82 -10.939 24.939 -6.427 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.084 22.479 -5.749 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.623 23.020 -7.484 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.569 21.544 -7.499 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.532 24.299 -8.370 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -11.110 22.968 -9.429 1.00 0.00 H new ATOM 1304 N ARG A 83 -8.930 22.890 -4.809 1.00 0.00 N ATOM 1305 CA ARG A 83 -7.834 22.447 -3.944 1.00 0.00 C ATOM 1306 C ARG A 83 -8.210 22.602 -2.451 1.00 0.00 C ATOM 1307 O ARG A 83 -7.845 21.759 -1.636 1.00 0.00 O ATOM 1308 CB ARG A 83 -6.564 23.265 -4.285 1.00 0.00 C ATOM 1309 CG ARG A 83 -5.294 22.849 -3.510 1.00 0.00 C ATOM 1310 CD ARG A 83 -4.055 23.654 -3.926 1.00 0.00 C ATOM 1311 NE ARG A 83 -2.849 23.218 -3.201 1.00 0.00 N ATOM 1312 CZ ARG A 83 -1.732 23.947 -3.041 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -1.647 25.191 -3.508 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -0.703 23.431 -2.391 1.00 0.00 N ATOM 0 H ARG A 83 -8.718 23.742 -5.327 1.00 0.00 H new ATOM 0 HA ARG A 83 -7.639 21.389 -4.119 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -6.366 23.173 -5.353 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -6.764 24.318 -4.087 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.466 22.981 -2.442 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.105 21.788 -3.674 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.894 23.544 -4.998 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.230 24.713 -3.737 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.863 22.286 -2.786 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -2.439 25.607 -3.998 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -0.790 25.728 -3.376 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.760 22.485 -2.015 1.00 0.00 H new ATOM 0 HH22 ARG A 83 0.148 23.979 -2.266 1.00 0.00 H new ATOM 1328 N TYR A 84 -8.973 23.669 -2.133 1.00 0.00 N ATOM 1329 CA TYR A 84 -9.374 24.022 -0.753 1.00 0.00 C ATOM 1330 C TYR A 84 -10.321 22.958 -0.165 1.00 0.00 C ATOM 1331 O TYR A 84 -10.037 22.396 0.896 1.00 0.00 O ATOM 1332 CB TYR A 84 -10.042 25.433 -0.736 1.00 0.00 C ATOM 1333 CG TYR A 84 -10.568 25.903 0.638 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -9.698 26.406 1.610 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -11.929 25.830 0.958 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -10.163 26.822 2.840 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -12.393 26.247 2.184 1.00 0.00 C ATOM 1338 CZ TYR A 84 -11.512 26.738 3.125 1.00 0.00 C ATOM 1339 OH TYR A 84 -11.981 27.149 4.355 1.00 0.00 O ATOM 0 H TYR A 84 -9.332 24.317 -2.834 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.481 24.051 -0.128 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.318 26.163 -1.097 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -10.872 25.431 -1.442 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -8.642 26.470 1.394 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -12.626 25.440 0.231 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -9.476 27.211 3.577 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -13.448 26.190 2.410 1.00 0.00 H new ATOM 0 HH TYR A 84 -12.501 27.973 4.248 1.00 0.00 H new ATOM 1349 N VAL A 85 -11.425 22.685 -0.883 1.00 0.00 N ATOM 1350 CA VAL A 85 -12.468 21.736 -0.439 1.00 0.00 C ATOM 1351 C VAL A 85 -11.915 20.291 -0.391 1.00 0.00 C ATOM 1352 O VAL A 85 -12.277 19.509 0.499 1.00 0.00 O ATOM 1353 CB VAL A 85 -13.767 21.831 -1.346 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -13.496 21.400 -2.814 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -14.955 21.034 -0.733 1.00 0.00 C ATOM 0 H VAL A 85 -11.621 23.114 -1.787 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.762 22.015 0.573 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.051 22.883 -1.371 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -14.416 21.483 -3.393 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -12.734 22.047 -3.248 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -13.148 20.367 -2.832 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.826 21.123 -1.382 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -14.678 19.984 -0.638 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -15.194 21.436 0.252 1.00 0.00 H new ATOM 1365 N LEU A 86 -10.998 19.974 -1.328 1.00 0.00 N ATOM 1366 CA LEU A 86 -10.321 18.665 -1.393 1.00 0.00 C ATOM 1367 C LEU A 86 -9.304 18.510 -0.237 1.00 0.00 C ATOM 1368 O LEU A 86 -9.107 17.405 0.274 1.00 0.00 O ATOM 1369 CB LEU A 86 -9.618 18.509 -2.768 1.00 0.00 C ATOM 1370 CG LEU A 86 -8.941 17.127 -3.061 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -9.958 15.958 -2.956 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -8.237 17.138 -4.444 1.00 0.00 C ATOM 0 H LEU A 86 -10.707 20.620 -2.061 1.00 0.00 H new ATOM 0 HA LEU A 86 -11.067 17.878 -1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.354 18.700 -3.549 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.857 19.285 -2.851 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.181 16.963 -2.297 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.452 15.016 -3.166 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -10.377 15.929 -1.950 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -10.760 16.108 -3.679 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.775 16.168 -4.625 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -8.971 17.341 -5.224 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -7.471 17.913 -4.456 1.00 0.00 H new ATOM 1384 N SER A 87 -8.672 19.631 0.159 1.00 0.00 N ATOM 1385 CA SER A 87 -7.697 19.664 1.276 1.00 0.00 C ATOM 1386 C SER A 87 -8.417 19.503 2.627 1.00 0.00 C ATOM 1387 O SER A 87 -7.857 18.929 3.570 1.00 0.00 O ATOM 1388 CB SER A 87 -6.892 20.986 1.252 1.00 0.00 C ATOM 1389 OG SER A 87 -5.888 21.029 2.261 1.00 0.00 O ATOM 0 H SER A 87 -8.819 20.539 -0.282 1.00 0.00 H new ATOM 0 HA SER A 87 -7.004 18.832 1.151 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.426 21.107 0.274 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.574 21.826 1.386 1.00 0.00 H new ATOM 0 HG SER A 87 -5.405 21.880 2.206 1.00 0.00 H new ATOM 1395 N CYS A 88 -9.651 20.040 2.704 1.00 0.00 N ATOM 1396 CA CYS A 88 -10.521 19.902 3.888 1.00 0.00 C ATOM 1397 C CYS A 88 -11.042 18.454 4.006 1.00 0.00 C ATOM 1398 O CYS A 88 -11.150 17.909 5.110 1.00 0.00 O ATOM 1399 CB CYS A 88 -11.707 20.899 3.802 1.00 0.00 C ATOM 1400 SG CYS A 88 -11.209 22.632 3.675 1.00 0.00 S ATOM 0 H CYS A 88 -10.072 20.581 1.948 1.00 0.00 H new ATOM 0 HA CYS A 88 -9.937 20.133 4.779 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -12.320 20.644 2.937 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -12.335 20.777 4.685 1.00 0.00 H new ATOM 0 HG CYS A 88 -10.662 22.842 2.514 1.00 0.00 H new ATOM 1406 N LEU A 89 -11.345 17.849 2.838 1.00 0.00 N ATOM 1407 CA LEU A 89 -11.907 16.487 2.737 1.00 0.00 C ATOM 1408 C LEU A 89 -10.846 15.413 3.064 1.00 0.00 C ATOM 1409 O LEU A 89 -11.137 14.429 3.761 1.00 0.00 O ATOM 1410 CB LEU A 89 -12.490 16.259 1.313 1.00 0.00 C ATOM 1411 CG LEU A 89 -13.193 14.880 1.065 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -14.403 14.674 2.018 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -13.608 14.727 -0.419 1.00 0.00 C ATOM 0 H LEU A 89 -11.205 18.296 1.932 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.707 16.394 3.471 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.209 17.052 1.106 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.681 16.366 0.590 1.00 0.00 H new ATOM 0 HG LEU A 89 -12.470 14.096 1.291 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.865 13.707 1.816 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -14.061 14.704 3.052 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -15.134 15.466 1.855 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.093 13.762 -0.563 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -14.300 15.525 -0.687 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -12.723 14.786 -1.052 1.00 0.00 H new ATOM 1425 N ARG A 90 -9.618 15.620 2.565 1.00 0.00 N ATOM 1426 CA ARG A 90 -8.509 14.668 2.748 1.00 0.00 C ATOM 1427 C ARG A 90 -7.892 14.909 4.137 1.00 0.00 C ATOM 1428 O ARG A 90 -7.150 15.886 4.324 1.00 0.00 O ATOM 1429 CB ARG A 90 -7.438 14.829 1.621 1.00 0.00 C ATOM 1430 CG ARG A 90 -6.534 13.566 1.376 1.00 0.00 C ATOM 1431 CD ARG A 90 -5.016 13.826 1.492 1.00 0.00 C ATOM 1432 NE ARG A 90 -4.572 13.976 2.903 1.00 0.00 N ATOM 1433 CZ ARG A 90 -3.465 13.406 3.427 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -2.664 12.657 2.681 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -3.154 13.610 4.695 1.00 0.00 N ATOM 0 H ARG A 90 -9.365 16.448 2.025 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.885 13.647 2.683 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -7.947 15.078 0.690 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -6.796 15.674 1.869 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.812 12.793 2.092 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -6.746 13.171 0.382 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.473 13.002 1.029 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.761 14.728 0.936 1.00 0.00 H new ATOM 0 HE ARG A 90 -5.145 14.551 3.520 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -2.880 12.504 1.696 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -1.832 12.234 3.092 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -3.750 14.198 5.278 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -2.318 13.180 5.091 1.00 0.00 H new ATOM 1724 N THR A 106 -1.099 33.962 22.122 1.00 0.00 N ATOM 1725 CA THR A 106 0.175 33.568 22.772 1.00 0.00 C ATOM 1726 C THR A 106 -0.045 33.450 24.301 1.00 0.00 C ATOM 1727 O THR A 106 -1.056 33.937 24.830 1.00 0.00 O ATOM 1728 CB THR A 106 1.303 34.626 22.459 1.00 0.00 C ATOM 1729 OG1 THR A 106 1.231 34.998 21.074 1.00 0.00 O ATOM 1730 CG2 THR A 106 2.724 34.113 22.752 1.00 0.00 C ATOM 0 HA THR A 106 0.496 32.603 22.379 1.00 0.00 H new ATOM 0 HB THR A 106 1.122 35.476 23.116 1.00 0.00 H new ATOM 0 HG1 THR A 106 0.301 34.946 20.769 1.00 0.00 H new ATOM 0 HG21 THR A 106 3.448 34.892 22.514 1.00 0.00 H new ATOM 0 HG22 THR A 106 2.806 33.851 23.807 1.00 0.00 H new ATOM 0 HG23 THR A 106 2.925 33.232 22.143 1.00 0.00 H new ATOM 1738 N LYS A 107 0.914 32.805 24.999 1.00 0.00 N ATOM 1739 CA LYS A 107 0.930 32.680 26.475 1.00 0.00 C ATOM 1740 C LYS A 107 0.920 34.082 27.144 1.00 0.00 C ATOM 1741 O LYS A 107 0.376 34.254 28.236 1.00 0.00 O ATOM 1742 CB LYS A 107 2.179 31.833 26.891 1.00 0.00 C ATOM 1743 CG LYS A 107 2.202 31.263 28.345 1.00 0.00 C ATOM 1744 CD LYS A 107 2.600 32.301 29.415 1.00 0.00 C ATOM 1745 CE LYS A 107 2.558 31.740 30.843 1.00 0.00 C ATOM 1746 NZ LYS A 107 2.860 32.790 31.854 1.00 0.00 N ATOM 0 H LYS A 107 1.709 32.351 24.549 1.00 0.00 H new ATOM 0 HA LYS A 107 0.032 32.167 26.820 1.00 0.00 H new ATOM 0 HB2 LYS A 107 2.265 30.996 26.198 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.067 32.451 26.756 1.00 0.00 H new ATOM 0 HG2 LYS A 107 1.215 30.867 28.586 1.00 0.00 H new ATOM 0 HG3 LYS A 107 2.900 30.427 28.386 1.00 0.00 H new ATOM 0 HD2 LYS A 107 3.605 32.665 29.203 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.930 33.158 29.348 1.00 0.00 H new ATOM 0 HE2 LYS A 107 1.573 31.318 31.040 1.00 0.00 H new ATOM 0 HE3 LYS A 107 3.278 30.927 30.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.823 32.375 32.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 3.810 33.175 31.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.158 33.554 31.781 1.00 0.00 H new ATOM 1760 N GLU A 108 1.505 35.072 26.447 1.00 0.00 N ATOM 1761 CA GLU A 108 1.558 36.473 26.904 1.00 0.00 C ATOM 1762 C GLU A 108 0.151 37.104 26.972 1.00 0.00 C ATOM 1763 O GLU A 108 -0.125 37.939 27.846 1.00 0.00 O ATOM 1764 CB GLU A 108 2.472 37.282 25.956 1.00 0.00 C ATOM 1765 CG GLU A 108 3.895 36.702 25.819 1.00 0.00 C ATOM 1766 CD GLU A 108 4.775 37.503 24.857 1.00 0.00 C ATOM 1767 OE1 GLU A 108 4.768 37.206 23.650 1.00 0.00 O ATOM 1768 OE2 GLU A 108 5.464 38.448 25.302 1.00 0.00 O ATOM 0 H GLU A 108 1.957 34.922 25.545 1.00 0.00 H new ATOM 0 HA GLU A 108 1.967 36.493 27.914 1.00 0.00 H new ATOM 0 HB2 GLU A 108 2.010 37.324 24.970 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.541 38.307 26.320 1.00 0.00 H new ATOM 0 HG2 GLU A 108 4.368 36.677 26.801 1.00 0.00 H new ATOM 0 HG3 GLU A 108 3.830 35.671 25.471 1.00 0.00 H new ATOM 1775 N GLU A 109 -0.731 36.695 26.041 1.00 0.00 N ATOM 1776 CA GLU A 109 -2.153 37.108 26.040 1.00 0.00 C ATOM 1777 C GLU A 109 -2.900 36.463 27.214 1.00 0.00 C ATOM 1778 O GLU A 109 -3.782 37.086 27.785 1.00 0.00 O ATOM 1779 CB GLU A 109 -2.847 36.773 24.680 1.00 0.00 C ATOM 1780 CG GLU A 109 -2.544 37.760 23.529 1.00 0.00 C ATOM 1781 CD GLU A 109 -1.055 37.818 23.127 1.00 0.00 C ATOM 1782 OE1 GLU A 109 -0.280 38.599 23.730 1.00 0.00 O ATOM 1783 OE2 GLU A 109 -0.660 37.089 22.213 1.00 0.00 O ATOM 0 H GLU A 109 -0.483 36.073 25.272 1.00 0.00 H new ATOM 0 HA GLU A 109 -2.188 38.190 26.163 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -2.542 35.773 24.371 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -3.925 36.743 24.838 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -3.134 37.478 22.657 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -2.869 38.758 23.825 1.00 0.00 H new ATOM 1790 N LEU A 110 -2.506 35.232 27.581 1.00 0.00 N ATOM 1791 CA LEU A 110 -3.079 34.520 28.744 1.00 0.00 C ATOM 1792 C LEU A 110 -2.672 35.218 30.059 1.00 0.00 C ATOM 1793 O LEU A 110 -3.453 35.270 31.007 1.00 0.00 O ATOM 1794 CB LEU A 110 -2.620 33.039 28.742 1.00 0.00 C ATOM 1795 CG LEU A 110 -2.981 32.213 27.459 1.00 0.00 C ATOM 1796 CD1 LEU A 110 -2.407 30.775 27.538 1.00 0.00 C ATOM 1797 CD2 LEU A 110 -4.512 32.199 27.204 1.00 0.00 C ATOM 0 H LEU A 110 -1.787 34.703 27.087 1.00 0.00 H new ATOM 0 HA LEU A 110 -4.166 34.545 28.670 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -1.538 33.014 28.875 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -3.059 32.541 29.607 1.00 0.00 H new ATOM 0 HG LEU A 110 -2.515 32.708 26.607 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -2.674 30.227 26.634 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -1.322 30.821 27.628 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.822 30.265 28.408 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -4.726 31.618 26.307 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -5.019 31.749 28.058 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -4.868 33.220 27.068 1.00 0.00 H new ATOM 1809 N ALA A 111 -1.436 35.770 30.076 1.00 0.00 N ATOM 1810 CA ALA A 111 -0.894 36.555 31.211 1.00 0.00 C ATOM 1811 C ALA A 111 -1.614 37.913 31.344 1.00 0.00 C ATOM 1812 O ALA A 111 -1.759 38.448 32.452 1.00 0.00 O ATOM 1813 CB ALA A 111 0.624 36.757 31.041 1.00 0.00 C ATOM 0 H ALA A 111 -0.782 35.683 29.298 1.00 0.00 H new ATOM 0 HA ALA A 111 -1.072 35.995 32.129 1.00 0.00 H new ATOM 0 HB1 ALA A 111 1.010 37.335 31.881 1.00 0.00 H new ATOM 0 HB2 ALA A 111 1.119 35.786 31.010 1.00 0.00 H new ATOM 0 HB3 ALA A 111 0.818 37.293 30.112 1.00 0.00 H new ATOM 1819 N LEU A 112 -2.045 38.452 30.192 1.00 0.00 N ATOM 1820 CA LEU A 112 -2.835 39.696 30.114 1.00 0.00 C ATOM 1821 C LEU A 112 -4.279 39.456 30.612 1.00 0.00 C ATOM 1822 O LEU A 112 -4.860 40.301 31.301 1.00 0.00 O ATOM 1823 CB LEU A 112 -2.834 40.222 28.656 1.00 0.00 C ATOM 1824 CG LEU A 112 -3.598 41.560 28.403 1.00 0.00 C ATOM 1825 CD1 LEU A 112 -2.992 42.733 29.222 1.00 0.00 C ATOM 1826 CD2 LEU A 112 -3.629 41.888 26.895 1.00 0.00 C ATOM 0 H LEU A 112 -1.855 38.035 29.281 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.381 40.448 30.760 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -1.799 40.354 28.341 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -3.267 39.454 28.015 1.00 0.00 H new ATOM 0 HG LEU A 112 -4.624 41.428 28.747 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -3.551 43.646 29.018 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -3.049 42.502 30.286 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -1.949 42.875 28.937 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -4.165 42.824 26.737 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -2.609 41.987 26.523 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -4.134 41.085 26.358 1.00 0.00 H new ATOM 1838 N GLU A 113 -4.841 38.286 30.256 1.00 0.00 N ATOM 1839 CA GLU A 113 -6.177 37.866 30.713 1.00 0.00 C ATOM 1840 C GLU A 113 -6.153 37.498 32.202 1.00 0.00 C ATOM 1841 O GLU A 113 -7.164 37.624 32.875 1.00 0.00 O ATOM 1842 CB GLU A 113 -6.713 36.686 29.856 1.00 0.00 C ATOM 1843 CG GLU A 113 -6.927 37.022 28.366 1.00 0.00 C ATOM 1844 CD GLU A 113 -7.887 38.206 28.140 1.00 0.00 C ATOM 1845 OE1 GLU A 113 -9.121 37.996 28.178 1.00 0.00 O ATOM 1846 OE2 GLU A 113 -7.417 39.348 27.933 1.00 0.00 O ATOM 0 H GLU A 113 -4.383 37.608 29.646 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.858 38.708 30.585 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -6.014 35.853 29.931 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -7.659 36.347 30.278 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -5.964 37.252 27.911 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -7.319 36.143 27.855 1.00 0.00 H new ATOM 1853 N LYS A 114 -4.978 37.054 32.695 1.00 0.00 N ATOM 1854 CA LYS A 114 -4.739 36.777 34.128 1.00 0.00 C ATOM 1855 C LYS A 114 -4.732 38.095 34.927 1.00 0.00 C ATOM 1856 O LYS A 114 -5.245 38.162 36.059 1.00 0.00 O ATOM 1857 CB LYS A 114 -3.387 36.031 34.312 1.00 0.00 C ATOM 1858 CG LYS A 114 -3.035 35.661 35.778 1.00 0.00 C ATOM 1859 CD LYS A 114 -4.028 34.648 36.394 1.00 0.00 C ATOM 1860 CE LYS A 114 -3.683 34.292 37.853 1.00 0.00 C ATOM 1861 NZ LYS A 114 -4.601 33.260 38.401 1.00 0.00 N ATOM 0 H LYS A 114 -4.164 36.876 32.107 1.00 0.00 H new ATOM 0 HA LYS A 114 -5.542 36.143 34.503 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.410 35.117 33.718 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -2.588 36.653 33.909 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.029 35.243 35.811 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.024 36.567 36.384 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.036 35.062 36.353 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.033 33.738 35.793 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.656 33.930 37.906 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.736 35.190 38.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.337 33.047 39.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -5.578 33.615 38.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -4.531 32.394 37.829 1.00 0.00 H new ATOM 1875 N LYS A 115 -4.154 39.141 34.301 1.00 0.00 N ATOM 1876 CA LYS A 115 -4.110 40.497 34.865 1.00 0.00 C ATOM 1877 C LYS A 115 -5.542 41.027 35.072 1.00 0.00 C ATOM 1878 O LYS A 115 -5.880 41.563 36.135 1.00 0.00 O ATOM 1879 CB LYS A 115 -3.317 41.450 33.916 1.00 0.00 C ATOM 1880 CG LYS A 115 -2.969 42.836 34.524 1.00 0.00 C ATOM 1881 CD LYS A 115 -1.989 42.717 35.721 1.00 0.00 C ATOM 1882 CE LYS A 115 -0.614 42.138 35.309 1.00 0.00 C ATOM 1883 NZ LYS A 115 0.179 41.689 36.485 1.00 0.00 N ATOM 0 H LYS A 115 -3.705 39.064 33.388 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.602 40.462 35.829 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.391 40.957 33.620 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -3.901 41.604 33.008 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.526 43.468 33.755 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.885 43.328 34.853 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -1.846 43.701 36.168 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -2.432 42.081 36.487 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.763 41.298 34.631 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.052 42.894 34.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 1.092 41.309 36.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 0.345 42.495 37.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.344 40.949 36.994 1.00 0.00 H new ATOM 1897 N ARG A 116 -6.372 40.835 34.032 1.00 0.00 N ATOM 1898 CA ARG A 116 -7.784 41.237 34.036 1.00 0.00 C ATOM 1899 C ARG A 116 -8.635 40.277 34.903 1.00 0.00 C ATOM 1900 O ARG A 116 -9.670 40.678 35.421 1.00 0.00 O ATOM 1901 CB ARG A 116 -8.320 41.315 32.576 1.00 0.00 C ATOM 1902 CG ARG A 116 -9.756 41.884 32.455 1.00 0.00 C ATOM 1903 CD ARG A 116 -10.227 42.040 31.002 1.00 0.00 C ATOM 1904 NE ARG A 116 -11.642 42.449 30.945 1.00 0.00 N ATOM 1905 CZ ARG A 116 -12.345 42.689 29.829 1.00 0.00 C ATOM 1906 NH1 ARG A 116 -11.782 42.600 28.635 1.00 0.00 N ATOM 1907 NH2 ARG A 116 -13.615 43.026 29.918 1.00 0.00 N ATOM 0 H ARG A 116 -6.077 40.394 33.161 1.00 0.00 H new ATOM 0 HA ARG A 116 -7.864 42.228 34.483 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -7.645 41.935 31.986 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -8.299 40.316 32.140 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -10.446 41.227 32.985 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -9.798 42.855 32.949 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -9.610 42.781 30.494 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -10.096 41.097 30.470 1.00 0.00 H new ATOM 0 HE ARG A 116 -12.130 42.559 31.834 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -10.798 42.345 28.553 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -12.332 42.786 27.797 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -14.059 43.103 30.833 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -14.154 43.210 29.072 1.00 0.00 H new ATOM 1921 N GLU A 117 -8.173 39.012 35.063 1.00 0.00 N ATOM 1922 CA GLU A 117 -8.865 37.988 35.880 1.00 0.00 C ATOM 1923 C GLU A 117 -8.880 38.396 37.366 1.00 0.00 C ATOM 1924 O GLU A 117 -9.829 38.085 38.081 1.00 0.00 O ATOM 1925 CB GLU A 117 -8.216 36.582 35.697 1.00 0.00 C ATOM 1926 CG GLU A 117 -8.951 35.408 36.392 1.00 0.00 C ATOM 1927 CD GLU A 117 -10.432 35.281 35.987 1.00 0.00 C ATOM 1928 OE1 GLU A 117 -10.717 34.860 34.841 1.00 0.00 O ATOM 1929 OE2 GLU A 117 -11.319 35.608 36.806 1.00 0.00 O ATOM 0 H GLU A 117 -7.313 38.675 34.630 1.00 0.00 H new ATOM 0 HA GLU A 117 -9.896 37.924 35.531 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.153 36.367 34.630 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -7.194 36.622 36.075 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -8.437 34.477 36.154 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -8.888 35.540 37.472 1.00 0.00 H new ATOM 1936 N LEU A 118 -7.822 39.117 37.796 1.00 0.00 N ATOM 1937 CA LEU A 118 -7.722 39.710 39.153 1.00 0.00 C ATOM 1938 C LEU A 118 -8.979 40.555 39.501 1.00 0.00 C ATOM 1939 O LEU A 118 -9.619 40.346 40.544 1.00 0.00 O ATOM 1940 CB LEU A 118 -6.437 40.586 39.243 1.00 0.00 C ATOM 1941 CG LEU A 118 -6.186 41.347 40.598 1.00 0.00 C ATOM 1942 CD1 LEU A 118 -5.996 40.365 41.782 1.00 0.00 C ATOM 1943 CD2 LEU A 118 -4.981 42.314 40.480 1.00 0.00 C ATOM 0 H LEU A 118 -7.008 39.307 37.211 1.00 0.00 H new ATOM 0 HA LEU A 118 -7.663 38.899 39.879 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -5.576 39.946 39.049 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -6.473 41.324 38.441 1.00 0.00 H new ATOM 0 HG LEU A 118 -7.077 41.940 40.806 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -5.825 40.929 42.699 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -6.891 39.753 41.894 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -5.138 39.722 41.587 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -4.831 42.826 41.430 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.084 41.749 40.227 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -5.179 43.049 39.700 1.00 0.00 H new ATOM 1955 N GLU A 119 -9.328 41.497 38.597 1.00 0.00 N ATOM 1956 CA GLU A 119 -10.479 42.414 38.781 1.00 0.00 C ATOM 1957 C GLU A 119 -11.810 41.740 38.377 1.00 0.00 C ATOM 1958 O GLU A 119 -12.875 42.159 38.831 1.00 0.00 O ATOM 1959 CB GLU A 119 -10.269 43.732 37.980 1.00 0.00 C ATOM 1960 CG GLU A 119 -10.235 43.570 36.442 1.00 0.00 C ATOM 1961 CD GLU A 119 -10.067 44.900 35.690 1.00 0.00 C ATOM 1962 OE1 GLU A 119 -11.072 45.616 35.499 1.00 0.00 O ATOM 1963 OE2 GLU A 119 -8.932 45.241 35.294 1.00 0.00 O ATOM 0 H GLU A 119 -8.824 41.644 37.723 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.538 42.659 39.842 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -11.068 44.427 38.239 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.333 44.189 38.302 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.416 42.903 36.173 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -11.157 43.090 36.114 1.00 0.00 H new ATOM 1970 N LYS A 120 -11.727 40.719 37.507 1.00 0.00 N ATOM 1971 CA LYS A 120 -12.892 39.958 36.995 1.00 0.00 C ATOM 1972 C LYS A 120 -13.554 39.168 38.151 1.00 0.00 C ATOM 1973 O LYS A 120 -14.748 39.305 38.402 1.00 0.00 O ATOM 1974 CB LYS A 120 -12.410 39.011 35.842 1.00 0.00 C ATOM 1975 CG LYS A 120 -13.481 38.253 34.990 1.00 0.00 C ATOM 1976 CD LYS A 120 -14.198 37.079 35.731 1.00 0.00 C ATOM 1977 CE LYS A 120 -14.664 35.951 34.792 1.00 0.00 C ATOM 1978 NZ LYS A 120 -13.506 35.268 34.168 1.00 0.00 N ATOM 0 H LYS A 120 -10.838 40.390 37.131 1.00 0.00 H new ATOM 0 HA LYS A 120 -13.644 40.637 36.592 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -11.805 39.606 35.158 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -11.750 38.264 36.283 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -14.234 38.968 34.659 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -13.000 37.859 34.095 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -13.520 36.663 36.477 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -15.061 37.473 36.269 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -15.258 35.229 35.352 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -15.310 36.362 34.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -13.639 34.238 34.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -13.431 35.553 33.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -12.635 35.533 34.670 1.00 0.00 H new ATOM 1992 N ARG A 121 -12.733 38.369 38.855 1.00 0.00 N ATOM 1993 CA ARG A 121 -13.198 37.424 39.897 1.00 0.00 C ATOM 1994 C ARG A 121 -13.526 38.122 41.231 1.00 0.00 C ATOM 1995 O ARG A 121 -14.024 37.482 42.162 1.00 0.00 O ATOM 1996 CB ARG A 121 -12.125 36.332 40.108 1.00 0.00 C ATOM 1997 CG ARG A 121 -10.831 36.817 40.796 1.00 0.00 C ATOM 1998 CD ARG A 121 -9.699 35.788 40.692 1.00 0.00 C ATOM 1999 NE ARG A 121 -10.105 34.454 41.189 1.00 0.00 N ATOM 2000 CZ ARG A 121 -10.120 33.326 40.461 1.00 0.00 C ATOM 2001 NH1 ARG A 121 -9.762 33.344 39.184 1.00 0.00 N ATOM 2002 NH2 ARG A 121 -10.500 32.184 41.014 1.00 0.00 N ATOM 0 H ARG A 121 -11.722 38.357 38.720 1.00 0.00 H new ATOM 0 HA ARG A 121 -14.128 36.975 39.548 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -12.557 35.529 40.705 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -11.866 35.905 39.139 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -10.510 37.755 40.343 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -11.036 37.024 41.846 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -9.381 35.705 39.653 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -8.838 36.139 41.262 1.00 0.00 H new ATOM 0 HE ARG A 121 -10.397 34.386 42.164 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -9.472 34.219 38.748 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -9.776 32.482 38.638 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -10.782 32.161 41.994 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -10.511 31.328 40.460 1.00 0.00 H new ATOM 2016 N LEU A 122 -13.226 39.428 41.320 1.00 0.00 N ATOM 2017 CA LEU A 122 -13.484 40.236 42.524 1.00 0.00 C ATOM 2018 C LEU A 122 -14.993 40.223 42.892 1.00 0.00 C ATOM 2019 O LEU A 122 -15.349 40.254 44.066 1.00 0.00 O ATOM 2020 CB LEU A 122 -12.971 41.684 42.302 1.00 0.00 C ATOM 2021 CG LEU A 122 -13.090 42.667 43.513 1.00 0.00 C ATOM 2022 CD1 LEU A 122 -12.242 42.192 44.719 1.00 0.00 C ATOM 2023 CD2 LEU A 122 -12.718 44.110 43.094 1.00 0.00 C ATOM 0 H LEU A 122 -12.797 39.954 40.559 1.00 0.00 H new ATOM 0 HA LEU A 122 -12.943 39.800 43.364 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -11.923 41.632 42.008 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -13.517 42.113 41.461 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.132 42.670 43.834 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.350 42.900 45.541 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.585 41.208 45.040 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.194 42.133 44.426 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.809 44.773 43.954 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -11.692 44.129 42.728 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -13.391 44.445 42.305 1.00 0.00 H new ATOM 2035 N GLN A 123 -15.870 40.167 41.866 1.00 0.00 N ATOM 2036 CA GLN A 123 -17.342 40.082 42.067 1.00 0.00 C ATOM 2037 C GLN A 123 -17.794 38.645 42.402 1.00 0.00 C ATOM 2038 O GLN A 123 -18.844 38.455 43.041 1.00 0.00 O ATOM 2039 CB GLN A 123 -18.112 40.655 40.821 1.00 0.00 C ATOM 2040 CG GLN A 123 -17.698 40.101 39.431 1.00 0.00 C ATOM 2041 CD GLN A 123 -18.195 38.690 39.087 1.00 0.00 C ATOM 2042 OE1 GLN A 123 -19.259 38.264 39.535 1.00 0.00 O ATOM 2043 NE2 GLN A 123 -17.415 37.940 38.324 1.00 0.00 N ATOM 0 H GLN A 123 -15.588 40.179 40.886 1.00 0.00 H new ATOM 0 HA GLN A 123 -17.593 40.701 42.929 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -19.176 40.463 40.961 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -17.982 41.737 40.809 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -18.061 40.788 38.667 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -16.610 40.105 39.371 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -16.538 38.317 37.965 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -17.691 36.985 38.095 1.00 0.00 H new