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 -162:sc= -0.402 (180deg=-1.28) USER MOD Single : A 25 SER OG : rot -113:sc= 0.125 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 156:sc= 0.0256 (180deg=-0.0771) USER MOD Single : A 31 GLN : amide:sc= 0.0106 X(o=0.011,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0.555 K(o=0.56,f=-0.4) USER MOD Single : A 38 LYS NZ :NH3+ 172:sc= 0.673 (180deg=0.629) 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=-0.0019) USER MOD Single : A 52 GLN : amide:sc= -0.183 K(o=-0.18,f=-2.3!) 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=-0.00868 X(o=-0.0087,f=0) USER MOD Single : A 72 THR OG1 : rot -31:sc= 0.949 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0.00612 USER MOD Single : A 77 THR OG1 : rot 83:sc= -0.608 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 CYS SG : rot 70:sc= 0.369 USER MOD Single : A 106 THR OG1 : rot -10:sc= 0.857 USER MOD Single : A 107 LYS NZ :NH3+ 179:sc= 0.812 (180deg=0.811) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -169:sc= -0.0101 (180deg=-0.154) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 GLN : amide:sc=-0.00801 X(o=-0.008,f=-0.008) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -8.962 28.003 -16.834 1.00 0.00 N ATOM 297 CA ARG A 22 -10.340 28.065 -17.356 1.00 0.00 C ATOM 298 C ARG A 22 -11.346 27.782 -16.219 1.00 0.00 C ATOM 299 O ARG A 22 -11.039 26.987 -15.316 1.00 0.00 O ATOM 300 CB ARG A 22 -10.532 27.033 -18.507 1.00 0.00 C ATOM 301 CG ARG A 22 -9.789 27.373 -19.813 1.00 0.00 C ATOM 302 CD ARG A 22 -10.031 26.321 -20.906 1.00 0.00 C ATOM 303 NE ARG A 22 -9.571 26.778 -22.225 1.00 0.00 N ATOM 304 CZ ARG A 22 -9.973 26.264 -23.399 1.00 0.00 C ATOM 305 NH1 ARG A 22 -10.801 25.230 -23.449 1.00 0.00 N ATOM 306 NH2 ARG A 22 -9.543 26.795 -24.528 1.00 0.00 N ATOM 0 HA ARG A 22 -10.520 29.065 -17.752 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.197 26.056 -18.159 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.597 26.946 -18.724 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.115 28.349 -20.172 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -8.720 27.448 -19.613 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -9.514 25.399 -20.642 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.095 26.087 -20.954 1.00 0.00 H new ATOM 0 HE ARG A 22 -8.896 27.542 -22.251 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -11.145 24.810 -22.586 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.094 24.855 -24.351 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.908 27.593 -24.507 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.846 26.408 -25.422 1.00 0.00 H new ATOM 320 N PRO A 23 -12.547 28.464 -16.216 1.00 0.00 N ATOM 321 CA PRO A 23 -13.660 28.138 -15.296 1.00 0.00 C ATOM 322 C PRO A 23 -14.143 26.690 -15.526 1.00 0.00 C ATOM 323 O PRO A 23 -14.775 26.383 -16.548 1.00 0.00 O ATOM 324 CB PRO A 23 -14.765 29.187 -15.641 1.00 0.00 C ATOM 325 CG PRO A 23 -14.014 30.299 -16.315 1.00 0.00 C ATOM 326 CD PRO A 23 -12.900 29.622 -17.084 1.00 0.00 C ATOM 0 HA PRO A 23 -13.375 28.187 -14.245 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -15.526 28.764 -16.297 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -15.277 29.537 -14.744 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -14.665 30.865 -16.982 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -13.616 31.003 -15.585 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -13.230 29.300 -18.072 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -12.050 30.288 -17.233 1.00 0.00 H new ATOM 334 N MET A 24 -13.768 25.805 -14.585 1.00 0.00 N ATOM 335 CA MET A 24 -14.003 24.350 -14.679 1.00 0.00 C ATOM 336 C MET A 24 -15.505 24.000 -14.641 1.00 0.00 C ATOM 337 O MET A 24 -16.330 24.810 -14.187 1.00 0.00 O ATOM 338 CB MET A 24 -13.217 23.629 -13.548 1.00 0.00 C ATOM 339 CG MET A 24 -11.681 23.709 -13.703 1.00 0.00 C ATOM 340 SD MET A 24 -10.788 23.193 -12.219 1.00 0.00 S ATOM 341 CE MET A 24 -11.145 24.557 -11.112 1.00 0.00 C ATOM 0 H MET A 24 -13.288 26.081 -13.728 1.00 0.00 H new ATOM 0 HA MET A 24 -13.637 24.001 -15.645 1.00 0.00 H new ATOM 0 HB2 MET A 24 -13.499 24.064 -12.589 1.00 0.00 H new ATOM 0 HB3 MET A 24 -13.516 22.581 -13.523 1.00 0.00 H new ATOM 0 HG2 MET A 24 -11.374 23.083 -14.540 1.00 0.00 H new ATOM 0 HG3 MET A 24 -11.400 24.733 -13.951 1.00 0.00 H new ATOM 0 HE1 MET A 24 -10.428 24.556 -10.291 1.00 0.00 H new ATOM 0 HE2 MET A 24 -11.071 25.498 -11.658 1.00 0.00 H new ATOM 0 HE3 MET A 24 -12.154 24.448 -10.713 1.00 0.00 H new ATOM 351 N SER A 25 -15.826 22.762 -15.091 1.00 0.00 N ATOM 352 CA SER A 25 -17.199 22.316 -15.380 1.00 0.00 C ATOM 353 C SER A 25 -18.139 22.495 -14.161 1.00 0.00 C ATOM 354 O SER A 25 -17.846 22.033 -13.050 1.00 0.00 O ATOM 355 CB SER A 25 -17.166 20.844 -15.844 1.00 0.00 C ATOM 356 OG SER A 25 -18.458 20.348 -16.148 1.00 0.00 O ATOM 0 H SER A 25 -15.125 22.041 -15.263 1.00 0.00 H new ATOM 0 HA SER A 25 -17.604 22.940 -16.176 1.00 0.00 H new ATOM 0 HB2 SER A 25 -16.529 20.757 -16.724 1.00 0.00 H new ATOM 0 HB3 SER A 25 -16.717 20.229 -15.064 1.00 0.00 H new ATOM 0 HG SER A 25 -18.701 19.651 -15.503 1.00 0.00 H new ATOM 362 N TYR A 26 -19.289 23.136 -14.427 1.00 0.00 N ATOM 363 CA TYR A 26 -20.247 23.597 -13.406 1.00 0.00 C ATOM 364 C TYR A 26 -21.045 22.445 -12.790 1.00 0.00 C ATOM 365 O TYR A 26 -21.606 22.612 -11.711 1.00 0.00 O ATOM 366 CB TYR A 26 -21.197 24.662 -14.015 1.00 0.00 C ATOM 367 CG TYR A 26 -20.459 25.856 -14.636 1.00 0.00 C ATOM 368 CD1 TYR A 26 -20.401 26.029 -16.027 1.00 0.00 C ATOM 369 CD2 TYR A 26 -19.799 26.794 -13.840 1.00 0.00 C ATOM 370 CE1 TYR A 26 -19.726 27.090 -16.586 1.00 0.00 C ATOM 371 CE2 TYR A 26 -19.123 27.853 -14.401 1.00 0.00 C ATOM 372 CZ TYR A 26 -19.088 27.995 -15.771 1.00 0.00 C ATOM 373 OH TYR A 26 -18.423 29.056 -16.329 1.00 0.00 O ATOM 0 H TYR A 26 -19.586 23.353 -15.378 1.00 0.00 H new ATOM 0 HA TYR A 26 -19.673 24.047 -12.596 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -21.817 24.191 -14.778 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -21.869 25.025 -13.238 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.895 25.316 -16.671 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -19.819 26.687 -12.766 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -19.698 27.211 -17.659 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -18.621 28.571 -13.769 1.00 0.00 H new ATOM 0 HH TYR A 26 -18.027 29.603 -15.619 1.00 0.00 H new ATOM 383 N ASP A 27 -21.105 21.297 -13.498 1.00 0.00 N ATOM 384 CA ASP A 27 -21.781 20.062 -13.014 1.00 0.00 C ATOM 385 C ASP A 27 -21.207 19.637 -11.656 1.00 0.00 C ATOM 386 O ASP A 27 -21.945 19.409 -10.685 1.00 0.00 O ATOM 387 CB ASP A 27 -21.619 18.905 -14.043 1.00 0.00 C ATOM 388 CG ASP A 27 -22.143 19.268 -15.439 1.00 0.00 C ATOM 389 OD1 ASP A 27 -23.300 18.929 -15.773 1.00 0.00 O ATOM 390 OD2 ASP A 27 -21.415 19.932 -16.202 1.00 0.00 O ATOM 0 H ASP A 27 -20.687 21.195 -14.423 1.00 0.00 H new ATOM 0 HA ASP A 27 -22.843 20.279 -12.899 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -20.565 18.635 -14.115 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -22.150 18.025 -13.679 1.00 0.00 H new ATOM 395 N GLU A 28 -19.869 19.585 -11.614 1.00 0.00 N ATOM 396 CA GLU A 28 -19.086 19.224 -10.422 1.00 0.00 C ATOM 397 C GLU A 28 -19.211 20.298 -9.335 1.00 0.00 C ATOM 398 O GLU A 28 -19.189 19.973 -8.164 1.00 0.00 O ATOM 399 CB GLU A 28 -17.581 19.009 -10.803 1.00 0.00 C ATOM 400 CG GLU A 28 -17.276 17.717 -11.607 1.00 0.00 C ATOM 401 CD GLU A 28 -18.085 17.583 -12.910 1.00 0.00 C ATOM 402 OE1 GLU A 28 -18.003 18.492 -13.761 1.00 0.00 O ATOM 403 OE2 GLU A 28 -18.805 16.578 -13.094 1.00 0.00 O ATOM 0 H GLU A 28 -19.287 19.797 -12.425 1.00 0.00 H new ATOM 0 HA GLU A 28 -19.486 18.291 -10.025 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -17.245 19.867 -11.385 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -16.990 18.995 -9.887 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -16.213 17.694 -11.848 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -17.479 16.852 -10.975 1.00 0.00 H new ATOM 410 N LYS A 29 -19.358 21.570 -9.758 1.00 0.00 N ATOM 411 CA LYS A 29 -19.441 22.744 -8.852 1.00 0.00 C ATOM 412 C LYS A 29 -20.819 22.873 -8.177 1.00 0.00 C ATOM 413 O LYS A 29 -20.915 23.420 -7.075 1.00 0.00 O ATOM 414 CB LYS A 29 -19.034 24.050 -9.611 1.00 0.00 C ATOM 415 CG LYS A 29 -17.505 24.323 -9.644 1.00 0.00 C ATOM 416 CD LYS A 29 -16.681 23.149 -10.211 1.00 0.00 C ATOM 417 CE LYS A 29 -15.169 23.327 -10.037 1.00 0.00 C ATOM 418 NZ LYS A 29 -14.432 22.090 -10.402 1.00 0.00 N ATOM 0 H LYS A 29 -19.423 21.818 -10.745 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.728 22.586 -8.043 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -19.402 23.990 -10.635 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -19.532 24.899 -9.142 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -17.316 25.212 -10.245 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -17.162 24.542 -8.633 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -16.990 22.227 -9.719 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -16.906 23.035 -11.271 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -14.825 24.154 -10.658 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -14.949 23.592 -9.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -13.456 22.333 -10.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -14.418 21.442 -9.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.905 21.628 -11.205 1.00 0.00 H new ATOM 432 N ARG A 30 -21.869 22.350 -8.824 1.00 0.00 N ATOM 433 CA ARG A 30 -23.215 22.281 -8.225 1.00 0.00 C ATOM 434 C ARG A 30 -23.259 21.159 -7.171 1.00 0.00 C ATOM 435 O ARG A 30 -23.833 21.328 -6.092 1.00 0.00 O ATOM 436 CB ARG A 30 -24.288 22.071 -9.324 1.00 0.00 C ATOM 437 CG ARG A 30 -24.440 23.266 -10.294 1.00 0.00 C ATOM 438 CD ARG A 30 -25.558 23.071 -11.338 1.00 0.00 C ATOM 439 NE ARG A 30 -25.289 21.959 -12.279 1.00 0.00 N ATOM 440 CZ ARG A 30 -24.818 22.096 -13.534 1.00 0.00 C ATOM 441 NH1 ARG A 30 -24.418 23.273 -13.994 1.00 0.00 N ATOM 442 NH2 ARG A 30 -24.728 21.035 -14.314 1.00 0.00 N ATOM 0 H ARG A 30 -21.815 21.966 -9.767 1.00 0.00 H new ATOM 0 HA ARG A 30 -23.437 23.225 -7.727 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -24.035 21.180 -9.899 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -25.249 21.880 -8.847 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -24.645 24.168 -9.718 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -23.494 23.427 -10.811 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -26.499 22.882 -10.822 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -25.684 23.995 -11.903 1.00 0.00 H new ATOM 0 HE ARG A 30 -25.476 21.012 -11.950 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -24.463 24.097 -13.395 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -24.065 23.355 -14.947 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -25.014 20.120 -13.965 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -24.373 21.130 -15.265 1.00 0.00 H new ATOM 456 N GLN A 31 -22.614 20.026 -7.509 1.00 0.00 N ATOM 457 CA GLN A 31 -22.408 18.899 -6.574 1.00 0.00 C ATOM 458 C GLN A 31 -21.428 19.302 -5.443 1.00 0.00 C ATOM 459 O GLN A 31 -21.522 18.799 -4.316 1.00 0.00 O ATOM 460 CB GLN A 31 -21.860 17.672 -7.353 1.00 0.00 C ATOM 461 CG GLN A 31 -22.797 17.149 -8.470 1.00 0.00 C ATOM 462 CD GLN A 31 -22.182 16.001 -9.283 1.00 0.00 C ATOM 463 OE1 GLN A 31 -22.350 14.826 -8.955 1.00 0.00 O ATOM 464 NE2 GLN A 31 -21.455 16.336 -10.341 1.00 0.00 N ATOM 0 H GLN A 31 -22.221 19.865 -8.436 1.00 0.00 H new ATOM 0 HA GLN A 31 -23.363 18.637 -6.118 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -20.900 17.938 -7.796 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -21.671 16.864 -6.646 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -23.731 16.810 -8.023 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -23.045 17.970 -9.142 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -21.335 17.319 -10.587 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -21.016 15.611 -10.909 1.00 0.00 H new ATOM 473 N LEU A 32 -20.507 20.232 -5.773 1.00 0.00 N ATOM 474 CA LEU A 32 -19.492 20.754 -4.840 1.00 0.00 C ATOM 475 C LEU A 32 -20.151 21.651 -3.798 1.00 0.00 C ATOM 476 O LEU A 32 -19.787 21.604 -2.637 1.00 0.00 O ATOM 477 CB LEU A 32 -18.409 21.569 -5.592 1.00 0.00 C ATOM 478 CG LEU A 32 -17.197 22.056 -4.737 1.00 0.00 C ATOM 479 CD1 LEU A 32 -16.293 20.871 -4.322 1.00 0.00 C ATOM 480 CD2 LEU A 32 -16.400 23.159 -5.475 1.00 0.00 C ATOM 0 H LEU A 32 -20.449 20.644 -6.704 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.019 19.902 -4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.028 20.959 -6.411 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -18.885 22.441 -6.039 1.00 0.00 H new ATOM 0 HG LEU A 32 -17.588 22.499 -3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.458 21.241 -3.728 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.872 20.161 -3.731 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.912 20.374 -5.214 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.562 23.479 -4.856 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.024 22.766 -6.419 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -17.052 24.010 -5.670 1.00 0.00 H new ATOM 492 N SER A 33 -21.127 22.470 -4.242 1.00 0.00 N ATOM 493 CA SER A 33 -21.896 23.367 -3.362 1.00 0.00 C ATOM 494 C SER A 33 -22.618 22.549 -2.266 1.00 0.00 C ATOM 495 O SER A 33 -22.594 22.921 -1.090 1.00 0.00 O ATOM 496 CB SER A 33 -22.897 24.208 -4.190 1.00 0.00 C ATOM 497 OG SER A 33 -23.573 25.153 -3.379 1.00 0.00 O ATOM 0 H SER A 33 -21.402 22.526 -5.222 1.00 0.00 H new ATOM 0 HA SER A 33 -21.210 24.056 -2.871 1.00 0.00 H new ATOM 0 HB2 SER A 33 -22.366 24.726 -4.989 1.00 0.00 H new ATOM 0 HB3 SER A 33 -23.623 23.548 -4.665 1.00 0.00 H new ATOM 0 HG SER A 33 -24.197 25.670 -3.930 1.00 0.00 H new ATOM 503 N LEU A 34 -23.194 21.396 -2.676 1.00 0.00 N ATOM 504 CA LEU A 34 -23.814 20.412 -1.759 1.00 0.00 C ATOM 505 C LEU A 34 -22.776 19.873 -0.744 1.00 0.00 C ATOM 506 O LEU A 34 -23.077 19.704 0.444 1.00 0.00 O ATOM 507 CB LEU A 34 -24.412 19.230 -2.576 1.00 0.00 C ATOM 508 CG LEU A 34 -25.478 19.604 -3.662 1.00 0.00 C ATOM 509 CD1 LEU A 34 -25.936 18.354 -4.457 1.00 0.00 C ATOM 510 CD2 LEU A 34 -26.685 20.351 -3.042 1.00 0.00 C ATOM 0 H LEU A 34 -23.242 21.121 -3.657 1.00 0.00 H new ATOM 0 HA LEU A 34 -24.610 20.912 -1.207 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -23.593 18.705 -3.068 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.867 18.528 -1.878 1.00 0.00 H new ATOM 0 HG LEU A 34 -25.000 20.286 -4.366 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -26.675 18.648 -5.202 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -25.077 17.905 -4.955 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -26.378 17.630 -3.773 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -27.403 20.594 -3.825 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -27.162 19.715 -2.296 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -26.340 21.270 -2.568 1.00 0.00 H new ATOM 522 N ASP A 35 -21.547 19.632 -1.247 1.00 0.00 N ATOM 523 CA ASP A 35 -20.423 19.083 -0.455 1.00 0.00 C ATOM 524 C ASP A 35 -19.867 20.147 0.524 1.00 0.00 C ATOM 525 O ASP A 35 -19.322 19.808 1.562 1.00 0.00 O ATOM 526 CB ASP A 35 -19.299 18.551 -1.407 1.00 0.00 C ATOM 527 CG ASP A 35 -18.369 17.505 -0.741 1.00 0.00 C ATOM 528 OD1 ASP A 35 -18.706 16.298 -0.778 1.00 0.00 O ATOM 529 OD2 ASP A 35 -17.327 17.875 -0.158 1.00 0.00 O ATOM 0 H ASP A 35 -21.304 19.814 -2.221 1.00 0.00 H new ATOM 0 HA ASP A 35 -20.792 18.247 0.139 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -19.761 18.106 -2.288 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -18.698 19.392 -1.752 1.00 0.00 H new ATOM 534 N ILE A 36 -20.011 21.439 0.176 1.00 0.00 N ATOM 535 CA ILE A 36 -19.614 22.559 1.064 1.00 0.00 C ATOM 536 C ILE A 36 -20.603 22.658 2.251 1.00 0.00 C ATOM 537 O ILE A 36 -20.207 22.959 3.379 1.00 0.00 O ATOM 538 CB ILE A 36 -19.537 23.935 0.278 1.00 0.00 C ATOM 539 CG1 ILE A 36 -18.433 23.869 -0.844 1.00 0.00 C ATOM 540 CG2 ILE A 36 -19.286 25.145 1.230 1.00 0.00 C ATOM 541 CD1 ILE A 36 -18.361 25.085 -1.768 1.00 0.00 C ATOM 0 H ILE A 36 -20.401 21.739 -0.717 1.00 0.00 H new ATOM 0 HA ILE A 36 -18.614 22.354 1.446 1.00 0.00 H new ATOM 0 HB ILE A 36 -20.508 24.094 -0.192 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.462 23.739 -0.367 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.610 22.982 -1.452 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.241 26.064 0.646 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -20.099 25.214 1.953 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -18.342 25.004 1.757 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -17.569 24.937 -2.503 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -19.314 25.209 -2.282 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -18.148 25.977 -1.179 1.00 0.00 H new ATOM 553 N ASN A 37 -21.894 22.348 1.985 1.00 0.00 N ATOM 554 CA ASN A 37 -22.955 22.329 3.030 1.00 0.00 C ATOM 555 C ASN A 37 -22.866 21.080 3.944 1.00 0.00 C ATOM 556 O ASN A 37 -23.651 20.958 4.885 1.00 0.00 O ATOM 557 CB ASN A 37 -24.374 22.428 2.396 1.00 0.00 C ATOM 558 CG ASN A 37 -24.688 23.817 1.825 1.00 0.00 C ATOM 559 OD1 ASN A 37 -25.096 24.717 2.553 1.00 0.00 O ATOM 560 ND2 ASN A 37 -24.559 23.985 0.521 1.00 0.00 N ATOM 0 H ASN A 37 -22.231 22.106 1.053 1.00 0.00 H new ATOM 0 HA ASN A 37 -22.785 23.206 3.654 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -24.462 21.688 1.601 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -25.120 22.176 3.150 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -24.801 24.880 0.096 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -24.217 23.220 -0.060 1.00 0.00 H new ATOM 567 N LYS A 38 -21.917 20.156 3.668 1.00 0.00 N ATOM 568 CA LYS A 38 -21.656 18.986 4.554 1.00 0.00 C ATOM 569 C LYS A 38 -20.901 19.469 5.820 1.00 0.00 C ATOM 570 O LYS A 38 -20.979 18.857 6.894 1.00 0.00 O ATOM 571 CB LYS A 38 -20.824 17.881 3.793 1.00 0.00 C ATOM 572 CG LYS A 38 -19.285 17.866 4.088 1.00 0.00 C ATOM 573 CD LYS A 38 -18.436 17.117 3.035 1.00 0.00 C ATOM 574 CE LYS A 38 -18.903 15.683 2.760 1.00 0.00 C ATOM 575 NZ LYS A 38 -18.013 15.019 1.774 1.00 0.00 N ATOM 0 H LYS A 38 -21.318 20.193 2.843 1.00 0.00 H new ATOM 0 HA LYS A 38 -22.605 18.538 4.848 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -21.234 16.904 4.048 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -20.969 18.017 2.721 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -18.931 18.895 4.156 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -19.119 17.407 5.063 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -18.455 17.679 2.101 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -17.399 17.092 3.371 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -18.912 15.114 3.690 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -19.926 15.695 2.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.263 14.012 1.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.128 15.470 0.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.024 15.109 2.083 1.00 0.00 H new ATOM 589 N LEU A 39 -20.187 20.590 5.652 1.00 0.00 N ATOM 590 CA LEU A 39 -19.356 21.220 6.685 1.00 0.00 C ATOM 591 C LEU A 39 -20.239 22.023 7.675 1.00 0.00 C ATOM 592 O LEU A 39 -21.351 22.416 7.301 1.00 0.00 O ATOM 593 CB LEU A 39 -18.326 22.135 5.969 1.00 0.00 C ATOM 594 CG LEU A 39 -17.389 21.415 4.938 1.00 0.00 C ATOM 595 CD1 LEU A 39 -16.596 22.431 4.073 1.00 0.00 C ATOM 596 CD2 LEU A 39 -16.438 20.417 5.658 1.00 0.00 C ATOM 0 H LEU A 39 -20.172 21.098 4.768 1.00 0.00 H new ATOM 0 HA LEU A 39 -18.831 20.466 7.271 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -18.867 22.927 5.451 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -17.705 22.615 6.725 1.00 0.00 H new ATOM 0 HG LEU A 39 -18.023 20.845 4.258 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -15.959 21.892 3.372 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -17.293 23.060 3.520 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -15.978 23.055 4.719 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -15.798 19.930 4.923 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.820 20.957 6.376 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -17.028 19.664 6.181 1.00 0.00 H new ATOM 608 N PRO A 40 -19.780 22.257 8.956 1.00 0.00 N ATOM 609 CA PRO A 40 -20.507 23.115 9.942 1.00 0.00 C ATOM 610 C PRO A 40 -20.778 24.542 9.407 1.00 0.00 C ATOM 611 O PRO A 40 -20.041 25.022 8.539 1.00 0.00 O ATOM 612 CB PRO A 40 -19.548 23.157 11.164 1.00 0.00 C ATOM 613 CG PRO A 40 -18.747 21.894 11.049 1.00 0.00 C ATOM 614 CD PRO A 40 -18.546 21.677 9.560 1.00 0.00 C ATOM 0 HA PRO A 40 -21.494 22.716 10.174 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -18.907 24.038 11.137 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -20.101 23.194 12.103 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -17.791 21.987 11.565 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -19.273 21.053 11.501 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -17.648 22.178 9.199 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -18.440 20.619 9.319 1.00 0.00 H new ATOM 622 N GLY A 41 -21.818 25.209 9.947 1.00 0.00 N ATOM 623 CA GLY A 41 -22.234 26.550 9.487 1.00 0.00 C ATOM 624 C GLY A 41 -21.124 27.597 9.561 1.00 0.00 C ATOM 625 O GLY A 41 -21.026 28.465 8.684 1.00 0.00 O ATOM 0 H GLY A 41 -22.388 24.838 10.707 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -22.586 26.478 8.458 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -23.078 26.885 10.090 1.00 0.00 H new ATOM 629 N GLU A 42 -20.281 27.484 10.611 1.00 0.00 N ATOM 630 CA GLU A 42 -19.110 28.359 10.818 1.00 0.00 C ATOM 631 C GLU A 42 -18.084 28.223 9.675 1.00 0.00 C ATOM 632 O GLU A 42 -17.433 29.199 9.305 1.00 0.00 O ATOM 633 CB GLU A 42 -18.422 28.040 12.175 1.00 0.00 C ATOM 634 CG GLU A 42 -17.900 26.587 12.315 1.00 0.00 C ATOM 635 CD GLU A 42 -17.029 26.378 13.563 1.00 0.00 C ATOM 636 OE1 GLU A 42 -15.793 26.540 13.471 1.00 0.00 O ATOM 637 OE2 GLU A 42 -17.573 26.070 14.645 1.00 0.00 O ATOM 0 H GLU A 42 -20.396 26.780 11.340 1.00 0.00 H new ATOM 0 HA GLU A 42 -19.475 29.386 10.828 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -17.586 28.726 12.312 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -19.130 28.236 12.980 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -18.749 25.904 12.353 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -17.322 26.328 11.428 1.00 0.00 H new ATOM 644 N LYS A 43 -18.013 27.016 9.084 1.00 0.00 N ATOM 645 CA LYS A 43 -16.994 26.652 8.085 1.00 0.00 C ATOM 646 C LYS A 43 -17.368 27.216 6.714 1.00 0.00 C ATOM 647 O LYS A 43 -16.482 27.616 5.962 1.00 0.00 O ATOM 648 CB LYS A 43 -16.870 25.103 7.986 1.00 0.00 C ATOM 649 CG LYS A 43 -15.768 24.591 7.011 1.00 0.00 C ATOM 650 CD LYS A 43 -14.339 24.725 7.579 1.00 0.00 C ATOM 651 CE LYS A 43 -14.092 23.761 8.754 1.00 0.00 C ATOM 652 NZ LYS A 43 -12.740 23.932 9.344 1.00 0.00 N ATOM 0 H LYS A 43 -18.667 26.261 9.289 1.00 0.00 H new ATOM 0 HA LYS A 43 -16.039 27.074 8.399 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -16.667 24.706 8.980 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -17.831 24.696 7.670 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -15.960 23.545 6.774 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -15.833 25.147 6.076 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.615 24.526 6.789 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -14.176 25.750 7.911 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.846 23.927 9.523 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -14.209 22.733 8.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.618 23.263 10.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -12.019 23.748 8.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -12.636 24.905 9.697 1.00 0.00 H new ATOM 666 N LEU A 44 -18.693 27.273 6.420 1.00 0.00 N ATOM 667 CA LEU A 44 -19.217 27.794 5.140 1.00 0.00 C ATOM 668 C LEU A 44 -18.697 29.219 4.894 1.00 0.00 C ATOM 669 O LEU A 44 -18.100 29.474 3.868 1.00 0.00 O ATOM 670 CB LEU A 44 -20.783 27.752 5.089 1.00 0.00 C ATOM 671 CG LEU A 44 -21.439 26.400 4.638 1.00 0.00 C ATOM 672 CD1 LEU A 44 -21.059 25.228 5.562 1.00 0.00 C ATOM 673 CD2 LEU A 44 -22.979 26.544 4.522 1.00 0.00 C ATOM 0 H LEU A 44 -19.420 26.960 7.063 1.00 0.00 H new ATOM 0 HA LEU A 44 -18.854 27.145 4.343 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -21.162 28.000 6.080 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -21.122 28.537 4.413 1.00 0.00 H new ATOM 0 HG LEU A 44 -21.041 26.165 3.651 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -21.538 24.315 5.208 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -19.977 25.096 5.556 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -21.393 25.442 6.577 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -23.411 25.594 4.208 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -23.392 26.828 5.490 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -23.218 27.312 3.786 1.00 0.00 H new ATOM 685 N GLY A 45 -18.866 30.104 5.893 1.00 0.00 N ATOM 686 CA GLY A 45 -18.461 31.517 5.791 1.00 0.00 C ATOM 687 C GLY A 45 -16.954 31.731 5.646 1.00 0.00 C ATOM 688 O GLY A 45 -16.523 32.786 5.181 1.00 0.00 O ATOM 0 H GLY A 45 -19.286 29.861 6.790 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -18.964 31.966 4.934 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -18.808 32.047 6.678 1.00 0.00 H new ATOM 692 N ARG A 46 -16.165 30.709 6.029 1.00 0.00 N ATOM 693 CA ARG A 46 -14.687 30.741 5.967 1.00 0.00 C ATOM 694 C ARG A 46 -14.188 30.193 4.611 1.00 0.00 C ATOM 695 O ARG A 46 -13.159 30.641 4.097 1.00 0.00 O ATOM 696 CB ARG A 46 -14.105 29.943 7.173 1.00 0.00 C ATOM 697 CG ARG A 46 -14.590 30.473 8.545 1.00 0.00 C ATOM 698 CD ARG A 46 -14.160 29.599 9.742 1.00 0.00 C ATOM 699 NE ARG A 46 -14.889 29.985 10.967 1.00 0.00 N ATOM 700 CZ ARG A 46 -14.633 29.548 12.213 1.00 0.00 C ATOM 701 NH1 ARG A 46 -13.590 28.768 12.472 1.00 0.00 N ATOM 702 NH2 ARG A 46 -15.426 29.916 13.203 1.00 0.00 N ATOM 0 H ARG A 46 -16.536 29.831 6.393 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.336 31.771 6.039 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -14.386 28.894 7.076 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -13.016 29.986 7.138 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -14.206 31.483 8.689 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -15.678 30.544 8.532 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.349 28.549 9.517 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -13.087 29.702 9.905 1.00 0.00 H new ATOM 0 HE ARG A 46 -15.659 30.645 10.858 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -12.963 28.488 11.718 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -13.416 28.449 13.425 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -16.223 30.525 13.019 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -15.242 29.591 14.152 1.00 0.00 H new ATOM 716 N VAL A 47 -14.951 29.242 4.027 1.00 0.00 N ATOM 717 CA VAL A 47 -14.688 28.706 2.668 1.00 0.00 C ATOM 718 C VAL A 47 -15.150 29.727 1.605 1.00 0.00 C ATOM 719 O VAL A 47 -14.533 29.872 0.551 1.00 0.00 O ATOM 720 CB VAL A 47 -15.391 27.301 2.446 1.00 0.00 C ATOM 721 CG1 VAL A 47 -15.146 26.746 1.017 1.00 0.00 C ATOM 722 CG2 VAL A 47 -14.919 26.277 3.511 1.00 0.00 C ATOM 0 H VAL A 47 -15.764 28.824 4.480 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.615 28.547 2.566 1.00 0.00 H new ATOM 0 HB VAL A 47 -16.464 27.458 2.557 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -15.645 25.783 0.910 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -15.545 27.445 0.282 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.076 26.620 0.854 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.413 25.321 3.340 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -13.839 26.146 3.436 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -15.172 26.644 4.506 1.00 0.00 H new ATOM 732 N VAL A 48 -16.234 30.439 1.927 1.00 0.00 N ATOM 733 CA VAL A 48 -16.802 31.509 1.086 1.00 0.00 C ATOM 734 C VAL A 48 -15.971 32.805 1.215 1.00 0.00 C ATOM 735 O VAL A 48 -15.978 33.620 0.307 1.00 0.00 O ATOM 736 CB VAL A 48 -18.324 31.770 1.464 1.00 0.00 C ATOM 737 CG1 VAL A 48 -18.924 33.005 0.745 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.187 30.516 1.172 1.00 0.00 C ATOM 0 H VAL A 48 -16.753 30.289 2.792 1.00 0.00 H new ATOM 0 HA VAL A 48 -16.762 31.185 0.046 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.340 31.982 2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -19.965 33.130 1.044 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -18.358 33.896 1.018 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -18.872 32.859 -0.334 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.224 30.718 1.438 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.126 30.271 0.112 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -18.818 29.676 1.760 1.00 0.00 H new ATOM 748 N HIS A 49 -15.228 32.966 2.333 1.00 0.00 N ATOM 749 CA HIS A 49 -14.476 34.217 2.631 1.00 0.00 C ATOM 750 C HIS A 49 -13.411 34.542 1.550 1.00 0.00 C ATOM 751 O HIS A 49 -13.100 35.714 1.314 1.00 0.00 O ATOM 752 CB HIS A 49 -13.820 34.155 4.031 1.00 0.00 C ATOM 753 CG HIS A 49 -13.319 35.489 4.536 1.00 0.00 C ATOM 754 ND1 HIS A 49 -12.064 35.695 5.068 1.00 0.00 N ATOM 755 CD2 HIS A 49 -13.935 36.704 4.555 1.00 0.00 C ATOM 756 CE1 HIS A 49 -11.965 36.984 5.408 1.00 0.00 C ATOM 757 NE2 HIS A 49 -13.071 37.644 5.110 1.00 0.00 N ATOM 0 H HIS A 49 -15.130 32.246 3.049 1.00 0.00 H new ATOM 0 HA HIS A 49 -15.207 35.026 2.621 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -14.544 33.758 4.743 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -12.986 33.454 3.999 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -14.934 36.906 4.197 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -11.094 37.429 5.867 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -13.254 38.637 5.256 1.00 0.00 H new ATOM 765 N ILE A 50 -12.872 33.491 0.901 1.00 0.00 N ATOM 766 CA ILE A 50 -11.903 33.634 -0.213 1.00 0.00 C ATOM 767 C ILE A 50 -12.598 34.203 -1.479 1.00 0.00 C ATOM 768 O ILE A 50 -11.982 34.927 -2.272 1.00 0.00 O ATOM 769 CB ILE A 50 -11.185 32.261 -0.534 1.00 0.00 C ATOM 770 CG1 ILE A 50 -12.168 31.210 -1.162 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.510 31.694 0.747 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.533 29.889 -1.567 1.00 0.00 C ATOM 0 H ILE A 50 -13.092 32.522 1.130 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.137 34.342 0.104 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.416 32.459 -1.280 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.964 31.007 -0.445 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.636 31.654 -2.041 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -10.020 30.749 0.512 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -9.770 32.405 1.114 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.266 31.529 1.514 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.295 29.233 -1.989 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.758 30.071 -2.311 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -11.091 29.414 -0.691 1.00 0.00 H new ATOM 784 N ILE A 51 -13.890 33.863 -1.631 1.00 0.00 N ATOM 785 CA ILE A 51 -14.767 34.342 -2.719 1.00 0.00 C ATOM 786 C ILE A 51 -15.234 35.790 -2.436 1.00 0.00 C ATOM 787 O ILE A 51 -15.413 36.582 -3.366 1.00 0.00 O ATOM 788 CB ILE A 51 -16.010 33.374 -2.867 1.00 0.00 C ATOM 789 CG1 ILE A 51 -15.524 31.906 -3.149 1.00 0.00 C ATOM 790 CG2 ILE A 51 -17.011 33.856 -3.950 1.00 0.00 C ATOM 791 CD1 ILE A 51 -16.620 30.854 -3.157 1.00 0.00 C ATOM 0 H ILE A 51 -14.367 33.232 -0.986 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.208 34.342 -3.655 1.00 0.00 H new ATOM 0 HB ILE A 51 -16.552 33.388 -1.922 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -15.017 31.887 -4.114 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -14.786 31.633 -2.395 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.845 33.157 -4.011 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -17.385 34.845 -3.685 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -16.507 33.905 -4.915 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -16.184 29.876 -3.360 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -17.115 30.836 -2.186 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.349 31.094 -3.931 1.00 0.00 H new ATOM 803 N GLN A 52 -15.424 36.113 -1.136 1.00 0.00 N ATOM 804 CA GLN A 52 -15.761 37.480 -0.674 1.00 0.00 C ATOM 805 C GLN A 52 -14.591 38.433 -0.979 1.00 0.00 C ATOM 806 O GLN A 52 -14.782 39.562 -1.435 1.00 0.00 O ATOM 807 CB GLN A 52 -16.058 37.499 0.862 1.00 0.00 C ATOM 808 CG GLN A 52 -17.155 36.526 1.330 1.00 0.00 C ATOM 809 CD GLN A 52 -18.529 36.813 0.732 1.00 0.00 C ATOM 810 OE1 GLN A 52 -18.859 36.326 -0.344 1.00 0.00 O ATOM 811 NE2 GLN A 52 -19.338 37.597 1.428 1.00 0.00 N ATOM 0 H GLN A 52 -15.348 35.434 -0.378 1.00 0.00 H new ATOM 0 HA GLN A 52 -16.656 37.807 -1.203 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -15.137 37.267 1.397 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -16.346 38.511 1.148 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -16.861 35.509 1.070 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -17.226 36.569 2.417 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -19.030 37.985 2.320 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -20.269 37.813 1.072 1.00 0.00 H new ATOM 820 N ALA A 53 -13.369 37.918 -0.741 1.00 0.00 N ATOM 821 CA ALA A 53 -12.113 38.662 -0.960 1.00 0.00 C ATOM 822 C ALA A 53 -11.843 38.841 -2.458 1.00 0.00 C ATOM 823 O ALA A 53 -11.205 39.817 -2.869 1.00 0.00 O ATOM 824 CB ALA A 53 -10.942 37.937 -0.278 1.00 0.00 C ATOM 0 H ALA A 53 -13.225 36.971 -0.390 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.214 39.652 -0.516 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -10.021 38.495 -0.446 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -11.132 37.866 0.793 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -10.841 36.935 -0.696 1.00 0.00 H new ATOM 830 N ARG A 54 -12.337 37.873 -3.259 1.00 0.00 N ATOM 831 CA ARG A 54 -12.235 37.908 -4.719 1.00 0.00 C ATOM 832 C ARG A 54 -13.155 38.999 -5.289 1.00 0.00 C ATOM 833 O ARG A 54 -12.697 39.945 -5.919 1.00 0.00 O ATOM 834 CB ARG A 54 -12.616 36.523 -5.318 1.00 0.00 C ATOM 835 CG ARG A 54 -12.393 36.380 -6.852 1.00 0.00 C ATOM 836 CD ARG A 54 -10.929 36.101 -7.247 1.00 0.00 C ATOM 837 NE ARG A 54 -9.995 37.166 -6.824 1.00 0.00 N ATOM 838 CZ ARG A 54 -8.853 36.975 -6.146 1.00 0.00 C ATOM 839 NH1 ARG A 54 -8.498 35.764 -5.728 1.00 0.00 N ATOM 840 NH2 ARG A 54 -8.087 38.017 -5.855 1.00 0.00 N ATOM 0 H ARG A 54 -12.817 37.047 -2.903 1.00 0.00 H new ATOM 0 HA ARG A 54 -11.205 38.138 -4.991 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.036 35.753 -4.809 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -13.666 36.327 -5.100 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.021 35.571 -7.227 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.724 37.295 -7.344 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -10.615 35.155 -6.805 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -10.868 35.983 -8.329 1.00 0.00 H new ATOM 0 HE ARG A 54 -10.239 38.126 -7.068 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -9.097 34.962 -5.921 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -7.626 35.637 -5.214 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -8.368 38.953 -6.146 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -7.217 37.882 -5.340 1.00 0.00 H new ATOM 854 N GLU A 55 -14.460 38.855 -5.028 1.00 0.00 N ATOM 855 CA GLU A 55 -15.502 39.714 -5.598 1.00 0.00 C ATOM 856 C GLU A 55 -16.127 40.606 -4.513 1.00 0.00 C ATOM 857 O GLU A 55 -16.896 40.112 -3.674 1.00 0.00 O ATOM 858 CB GLU A 55 -16.599 38.846 -6.279 1.00 0.00 C ATOM 859 CG GLU A 55 -16.084 37.938 -7.413 1.00 0.00 C ATOM 860 CD GLU A 55 -15.415 38.707 -8.569 1.00 0.00 C ATOM 861 OE1 GLU A 55 -14.177 38.614 -8.739 1.00 0.00 O ATOM 862 OE2 GLU A 55 -16.128 39.417 -9.310 1.00 0.00 O ATOM 0 H GLU A 55 -14.825 38.131 -4.409 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.044 40.358 -6.349 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -17.075 38.224 -5.521 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -17.369 39.505 -6.680 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -15.369 37.227 -7.000 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -16.918 37.358 -7.809 1.00 0.00 H new ATOM 869 N PRO A 56 -15.792 41.948 -4.496 1.00 0.00 N ATOM 870 CA PRO A 56 -16.499 42.958 -3.667 1.00 0.00 C ATOM 871 C PRO A 56 -18.022 42.988 -3.917 1.00 0.00 C ATOM 872 O PRO A 56 -18.785 43.424 -3.049 1.00 0.00 O ATOM 873 CB PRO A 56 -15.834 44.304 -4.077 1.00 0.00 C ATOM 874 CG PRO A 56 -14.469 43.912 -4.548 1.00 0.00 C ATOM 875 CD PRO A 56 -14.655 42.573 -5.234 1.00 0.00 C ATOM 0 HA PRO A 56 -16.409 42.737 -2.603 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.399 44.803 -4.864 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -15.782 44.995 -3.235 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -14.062 44.653 -5.235 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -13.772 43.834 -3.714 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -14.884 42.695 -6.293 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -13.754 41.963 -5.171 1.00 0.00 H new ATOM 883 N SER A 57 -18.429 42.508 -5.114 1.00 0.00 N ATOM 884 CA SER A 57 -19.836 42.384 -5.527 1.00 0.00 C ATOM 885 C SER A 57 -20.668 41.550 -4.526 1.00 0.00 C ATOM 886 O SER A 57 -21.842 41.862 -4.294 1.00 0.00 O ATOM 887 CB SER A 57 -19.914 41.748 -6.937 1.00 0.00 C ATOM 888 OG SER A 57 -21.251 41.696 -7.418 1.00 0.00 O ATOM 0 H SER A 57 -17.774 42.192 -5.829 1.00 0.00 H new ATOM 0 HA SER A 57 -20.262 43.387 -5.548 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.300 42.323 -7.630 1.00 0.00 H new ATOM 0 HB3 SER A 57 -19.499 40.740 -6.905 1.00 0.00 H new ATOM 0 HG SER A 57 -21.262 41.291 -8.310 1.00 0.00 H new ATOM 894 N LEU A 58 -20.055 40.497 -3.950 1.00 0.00 N ATOM 895 CA LEU A 58 -20.729 39.575 -2.992 1.00 0.00 C ATOM 896 C LEU A 58 -20.112 39.652 -1.585 1.00 0.00 C ATOM 897 O LEU A 58 -20.580 38.957 -0.682 1.00 0.00 O ATOM 898 CB LEU A 58 -20.660 38.113 -3.518 1.00 0.00 C ATOM 899 CG LEU A 58 -21.351 37.836 -4.897 1.00 0.00 C ATOM 900 CD1 LEU A 58 -21.275 36.331 -5.277 1.00 0.00 C ATOM 901 CD2 LEU A 58 -22.814 38.353 -4.902 1.00 0.00 C ATOM 0 H LEU A 58 -19.081 40.255 -4.130 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.770 39.890 -2.915 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -19.611 37.828 -3.598 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.112 37.460 -2.772 1.00 0.00 H new ATOM 0 HG LEU A 58 -20.804 38.390 -5.660 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -21.763 36.173 -6.239 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -20.231 36.025 -5.346 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -21.777 35.737 -4.513 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -23.269 38.148 -5.871 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -23.381 37.848 -4.120 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -22.821 39.427 -4.718 1.00 0.00 H new ATOM 913 N ARG A 59 -19.102 40.522 -1.407 1.00 0.00 N ATOM 914 CA ARG A 59 -18.291 40.594 -0.170 1.00 0.00 C ATOM 915 C ARG A 59 -19.139 40.977 1.058 1.00 0.00 C ATOM 916 O ARG A 59 -18.980 40.393 2.138 1.00 0.00 O ATOM 917 CB ARG A 59 -17.130 41.604 -0.359 1.00 0.00 C ATOM 918 CG ARG A 59 -16.115 41.691 0.809 1.00 0.00 C ATOM 919 CD ARG A 59 -14.977 42.688 0.520 1.00 0.00 C ATOM 920 NE ARG A 59 -14.007 42.765 1.630 1.00 0.00 N ATOM 921 CZ ARG A 59 -13.159 43.784 1.851 1.00 0.00 C ATOM 922 NH1 ARG A 59 -13.143 44.846 1.052 1.00 0.00 N ATOM 923 NH2 ARG A 59 -12.322 43.729 2.876 1.00 0.00 N ATOM 0 H ARG A 59 -18.821 41.199 -2.117 1.00 0.00 H new ATOM 0 HA ARG A 59 -17.884 39.600 0.017 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -16.588 41.340 -1.267 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -17.557 42.594 -0.519 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -16.636 41.991 1.719 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -15.692 40.704 0.994 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -14.460 42.391 -0.392 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -15.399 43.677 0.340 1.00 0.00 H new ATOM 0 HE ARG A 59 -13.978 41.981 2.282 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -13.781 44.896 0.257 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -12.493 45.611 1.234 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -12.323 42.916 3.492 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -11.676 44.499 3.049 1.00 0.00 H new ATOM 937 N ASP A 60 -20.045 41.948 0.872 1.00 0.00 N ATOM 938 CA ASP A 60 -20.921 42.447 1.953 1.00 0.00 C ATOM 939 C ASP A 60 -22.129 41.501 2.162 1.00 0.00 C ATOM 940 O ASP A 60 -22.712 41.468 3.252 1.00 0.00 O ATOM 941 CB ASP A 60 -21.397 43.890 1.632 1.00 0.00 C ATOM 942 CG ASP A 60 -22.202 44.539 2.773 1.00 0.00 C ATOM 943 OD1 ASP A 60 -21.588 45.015 3.750 1.00 0.00 O ATOM 944 OD2 ASP A 60 -23.448 44.552 2.720 1.00 0.00 O ATOM 0 H ASP A 60 -20.194 42.410 -0.025 1.00 0.00 H new ATOM 0 HA ASP A 60 -20.350 42.469 2.881 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -20.528 44.510 1.412 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.010 43.870 0.731 1.00 0.00 H new ATOM 949 N SER A 61 -22.494 40.740 1.101 1.00 0.00 N ATOM 950 CA SER A 61 -23.600 39.764 1.144 1.00 0.00 C ATOM 951 C SER A 61 -23.283 38.639 2.152 1.00 0.00 C ATOM 952 O SER A 61 -22.184 38.057 2.116 1.00 0.00 O ATOM 953 CB SER A 61 -23.853 39.188 -0.271 1.00 0.00 C ATOM 954 OG SER A 61 -24.105 40.230 -1.206 1.00 0.00 O ATOM 0 H SER A 61 -22.028 40.789 0.195 1.00 0.00 H new ATOM 0 HA SER A 61 -24.508 40.268 1.476 1.00 0.00 H new ATOM 0 HB2 SER A 61 -22.988 38.608 -0.592 1.00 0.00 H new ATOM 0 HB3 SER A 61 -24.702 38.505 -0.244 1.00 0.00 H new ATOM 0 HG SER A 61 -24.260 39.843 -2.093 1.00 0.00 H new ATOM 960 N ASN A 62 -24.245 38.372 3.058 1.00 0.00 N ATOM 961 CA ASN A 62 -24.079 37.414 4.163 1.00 0.00 C ATOM 962 C ASN A 62 -23.855 35.976 3.626 1.00 0.00 C ATOM 963 O ASN A 62 -24.671 35.486 2.829 1.00 0.00 O ATOM 964 CB ASN A 62 -25.307 37.456 5.113 1.00 0.00 C ATOM 965 CG ASN A 62 -25.559 38.856 5.695 1.00 0.00 C ATOM 966 OD1 ASN A 62 -24.979 39.231 6.714 1.00 0.00 O ATOM 967 ND2 ASN A 62 -26.429 39.628 5.062 1.00 0.00 N ATOM 0 H ASN A 62 -25.162 38.818 3.041 1.00 0.00 H new ATOM 0 HA ASN A 62 -23.194 37.704 4.729 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -26.193 37.128 4.569 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -25.154 36.750 5.929 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -26.635 40.562 5.417 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -26.894 39.289 4.220 1.00 0.00 H new ATOM 974 N PRO A 63 -22.753 35.272 4.069 1.00 0.00 N ATOM 975 CA PRO A 63 -22.386 33.924 3.556 1.00 0.00 C ATOM 976 C PRO A 63 -23.361 32.800 3.985 1.00 0.00 C ATOM 977 O PRO A 63 -23.157 31.633 3.631 1.00 0.00 O ATOM 978 CB PRO A 63 -20.964 33.700 4.124 1.00 0.00 C ATOM 979 CG PRO A 63 -20.937 34.508 5.383 1.00 0.00 C ATOM 980 CD PRO A 63 -21.763 35.744 5.087 1.00 0.00 C ATOM 0 HA PRO A 63 -22.433 33.885 2.468 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -20.777 32.645 4.324 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.199 34.031 3.422 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -21.355 33.947 6.219 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.916 34.774 5.657 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -22.258 36.119 5.983 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -21.146 36.555 4.700 1.00 0.00 H new ATOM 988 N GLU A 64 -24.403 33.166 4.760 1.00 0.00 N ATOM 989 CA GLU A 64 -25.515 32.264 5.093 1.00 0.00 C ATOM 990 C GLU A 64 -26.380 32.026 3.836 1.00 0.00 C ATOM 991 O GLU A 64 -26.690 30.887 3.474 1.00 0.00 O ATOM 992 CB GLU A 64 -26.400 32.870 6.229 1.00 0.00 C ATOM 993 CG GLU A 64 -25.641 33.389 7.469 1.00 0.00 C ATOM 994 CD GLU A 64 -24.727 32.335 8.113 1.00 0.00 C ATOM 995 OE1 GLU A 64 -23.490 32.432 7.968 1.00 0.00 O ATOM 996 OE2 GLU A 64 -25.241 31.405 8.773 1.00 0.00 O ATOM 0 H GLU A 64 -24.493 34.096 5.170 1.00 0.00 H new ATOM 0 HA GLU A 64 -25.102 31.318 5.443 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -26.981 33.693 5.811 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -27.111 32.110 6.554 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -25.041 34.253 7.183 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -26.363 33.734 8.209 1.00 0.00 H new ATOM 1003 N GLU A 65 -26.730 33.142 3.163 1.00 0.00 N ATOM 1004 CA GLU A 65 -27.712 33.165 2.058 1.00 0.00 C ATOM 1005 C GLU A 65 -27.055 33.541 0.718 1.00 0.00 C ATOM 1006 O GLU A 65 -27.767 33.877 -0.243 1.00 0.00 O ATOM 1007 CB GLU A 65 -28.851 34.168 2.410 1.00 0.00 C ATOM 1008 CG GLU A 65 -29.606 33.839 3.721 1.00 0.00 C ATOM 1009 CD GLU A 65 -30.731 34.836 4.031 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -31.895 34.592 3.642 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -30.445 35.888 4.634 1.00 0.00 O ATOM 0 H GLU A 65 -26.336 34.059 3.373 1.00 0.00 H new ATOM 0 HA GLU A 65 -28.125 32.163 1.940 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -28.426 35.169 2.490 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -29.567 34.190 1.588 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -30.026 32.836 3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -28.898 33.830 4.549 1.00 0.00 H new ATOM 1018 N ILE A 66 -25.711 33.470 0.638 1.00 0.00 N ATOM 1019 CA ILE A 66 -24.983 33.822 -0.596 1.00 0.00 C ATOM 1020 C ILE A 66 -25.229 32.767 -1.702 1.00 0.00 C ATOM 1021 O ILE A 66 -25.231 31.552 -1.450 1.00 0.00 O ATOM 1022 CB ILE A 66 -23.429 34.001 -0.361 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -22.738 34.544 -1.670 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -22.764 32.680 0.127 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -21.230 34.685 -1.601 1.00 0.00 C ATOM 0 H ILE A 66 -25.112 33.174 1.408 1.00 0.00 H new ATOM 0 HA ILE A 66 -25.377 34.786 -0.919 1.00 0.00 H new ATOM 0 HB ILE A 66 -23.289 34.736 0.432 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -22.986 33.876 -2.495 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -23.166 35.518 -1.909 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -21.697 32.844 0.277 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -23.219 32.369 1.067 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -22.910 31.901 -0.621 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -20.856 35.065 -2.552 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -20.966 35.379 -0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -20.782 33.712 -1.398 1.00 0.00 H new ATOM 1037 N GLU A 67 -25.464 33.253 -2.923 1.00 0.00 N ATOM 1038 CA GLU A 67 -25.593 32.415 -4.112 1.00 0.00 C ATOM 1039 C GLU A 67 -24.303 32.553 -4.927 1.00 0.00 C ATOM 1040 O GLU A 67 -24.074 33.573 -5.588 1.00 0.00 O ATOM 1041 CB GLU A 67 -26.841 32.835 -4.921 1.00 0.00 C ATOM 1042 CG GLU A 67 -28.157 32.661 -4.133 1.00 0.00 C ATOM 1043 CD GLU A 67 -29.391 33.166 -4.889 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -29.926 32.418 -5.731 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -29.824 34.315 -4.656 1.00 0.00 O ATOM 0 H GLU A 67 -25.571 34.249 -3.113 1.00 0.00 H new ATOM 0 HA GLU A 67 -25.730 31.368 -3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -26.739 33.878 -5.221 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -26.890 32.244 -5.835 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -28.292 31.606 -3.895 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -28.077 33.194 -3.185 1.00 0.00 H new ATOM 1052 N ILE A 68 -23.438 31.534 -4.814 1.00 0.00 N ATOM 1053 CA ILE A 68 -22.099 31.543 -5.417 1.00 0.00 C ATOM 1054 C ILE A 68 -22.210 31.165 -6.898 1.00 0.00 C ATOM 1055 O ILE A 68 -22.220 29.974 -7.254 1.00 0.00 O ATOM 1056 CB ILE A 68 -21.128 30.540 -4.681 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -21.096 30.814 -3.142 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -19.699 30.606 -5.285 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -20.277 29.815 -2.337 1.00 0.00 C ATOM 0 H ILE A 68 -23.649 30.679 -4.300 1.00 0.00 H new ATOM 0 HA ILE A 68 -21.683 32.545 -5.316 1.00 0.00 H new ATOM 0 HB ILE A 68 -21.513 29.532 -4.833 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -20.695 31.813 -2.972 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -22.119 30.813 -2.765 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -19.049 29.905 -4.760 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -19.738 30.343 -6.342 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -19.305 31.617 -5.177 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -20.311 30.083 -1.281 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.689 28.815 -2.471 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -19.243 29.830 -2.682 1.00 0.00 H new ATOM 1071 N ASP A 69 -22.378 32.177 -7.752 1.00 0.00 N ATOM 1072 CA ASP A 69 -22.384 31.980 -9.200 1.00 0.00 C ATOM 1073 C ASP A 69 -20.932 31.826 -9.674 1.00 0.00 C ATOM 1074 O ASP A 69 -20.205 32.810 -9.824 1.00 0.00 O ATOM 1075 CB ASP A 69 -23.089 33.153 -9.913 1.00 0.00 C ATOM 1076 CG ASP A 69 -24.549 33.341 -9.466 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -24.806 34.162 -8.564 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -25.449 32.660 -10.010 1.00 0.00 O ATOM 0 H ASP A 69 -22.512 33.146 -7.462 1.00 0.00 H new ATOM 0 HA ASP A 69 -22.943 31.078 -9.450 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -22.535 34.072 -9.722 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -23.064 32.984 -10.990 1.00 0.00 H new ATOM 1083 N PHE A 70 -20.529 30.566 -9.875 1.00 0.00 N ATOM 1084 CA PHE A 70 -19.143 30.167 -10.207 1.00 0.00 C ATOM 1085 C PHE A 70 -18.662 30.797 -11.531 1.00 0.00 C ATOM 1086 O PHE A 70 -17.464 31.028 -11.721 1.00 0.00 O ATOM 1087 CB PHE A 70 -19.053 28.617 -10.273 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.530 27.926 -8.986 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -18.689 27.816 -7.879 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -20.817 27.387 -8.888 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -19.120 27.206 -6.716 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -21.247 26.777 -7.723 1.00 0.00 C ATOM 1093 CZ PHE A 70 -20.396 26.677 -6.640 1.00 0.00 C ATOM 0 H PHE A 70 -21.167 29.772 -9.811 1.00 0.00 H new ATOM 0 HA PHE A 70 -18.485 30.538 -9.422 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -19.651 28.260 -11.112 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -18.021 28.328 -10.472 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -17.686 28.213 -7.931 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.485 27.448 -9.734 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -18.459 27.142 -5.864 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -22.249 26.379 -7.661 1.00 0.00 H new ATOM 0 HZ PHE A 70 -20.726 26.187 -5.736 1.00 0.00 H new ATOM 1103 N GLU A 71 -19.622 31.083 -12.421 1.00 0.00 N ATOM 1104 CA GLU A 71 -19.355 31.688 -13.736 1.00 0.00 C ATOM 1105 C GLU A 71 -19.028 33.193 -13.620 1.00 0.00 C ATOM 1106 O GLU A 71 -18.199 33.708 -14.381 1.00 0.00 O ATOM 1107 CB GLU A 71 -20.570 31.433 -14.661 1.00 0.00 C ATOM 1108 CG GLU A 71 -20.377 31.884 -16.129 1.00 0.00 C ATOM 1109 CD GLU A 71 -21.471 31.347 -17.063 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -21.285 30.252 -17.628 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -22.524 32.000 -17.216 1.00 0.00 O ATOM 0 H GLU A 71 -20.611 30.901 -12.250 1.00 0.00 H new ATOM 0 HA GLU A 71 -18.471 31.221 -14.171 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -20.799 30.367 -14.651 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.437 31.949 -14.249 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -20.371 32.973 -16.172 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -19.404 31.545 -16.484 1.00 0.00 H new ATOM 1118 N THR A 72 -19.671 33.889 -12.652 1.00 0.00 N ATOM 1119 CA THR A 72 -19.416 35.330 -12.395 1.00 0.00 C ATOM 1120 C THR A 72 -18.074 35.539 -11.662 1.00 0.00 C ATOM 1121 O THR A 72 -17.598 36.672 -11.540 1.00 0.00 O ATOM 1122 CB THR A 72 -20.567 36.008 -11.570 1.00 0.00 C ATOM 1123 OG1 THR A 72 -20.648 35.460 -10.242 1.00 0.00 O ATOM 1124 CG2 THR A 72 -21.932 35.859 -12.258 1.00 0.00 C ATOM 0 H THR A 72 -20.371 33.477 -12.035 1.00 0.00 H new ATOM 0 HA THR A 72 -19.374 35.807 -13.374 1.00 0.00 H new ATOM 0 HB THR A 72 -20.320 37.068 -11.511 1.00 0.00 H new ATOM 0 HG1 THR A 72 -20.370 34.520 -10.258 1.00 0.00 H new ATOM 0 HG21 THR A 72 -22.699 36.342 -11.653 1.00 0.00 H new ATOM 0 HG22 THR A 72 -21.897 36.328 -13.242 1.00 0.00 H new ATOM 0 HG23 THR A 72 -22.170 34.801 -12.368 1.00 0.00 H new ATOM 1132 N LEU A 73 -17.500 34.433 -11.148 1.00 0.00 N ATOM 1133 CA LEU A 73 -16.185 34.429 -10.486 1.00 0.00 C ATOM 1134 C LEU A 73 -15.074 34.196 -11.527 1.00 0.00 C ATOM 1135 O LEU A 73 -15.336 33.644 -12.603 1.00 0.00 O ATOM 1136 CB LEU A 73 -16.130 33.308 -9.409 1.00 0.00 C ATOM 1137 CG LEU A 73 -17.307 33.259 -8.383 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -17.138 32.084 -7.394 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -17.485 34.602 -7.634 1.00 0.00 C ATOM 0 H LEU A 73 -17.940 33.513 -11.182 1.00 0.00 H new ATOM 0 HA LEU A 73 -16.033 35.395 -10.005 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.085 32.347 -9.921 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.199 33.416 -8.853 1.00 0.00 H new ATOM 0 HG LEU A 73 -18.220 33.090 -8.954 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -17.972 32.076 -6.692 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.119 31.144 -7.946 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -16.204 32.202 -6.845 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -18.315 34.520 -6.932 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -16.571 34.839 -7.090 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -17.695 35.394 -8.353 1.00 0.00 H new ATOM 1151 N LYS A 74 -13.840 34.624 -11.190 1.00 0.00 N ATOM 1152 CA LYS A 74 -12.630 34.329 -11.993 1.00 0.00 C ATOM 1153 C LYS A 74 -12.301 32.812 -11.957 1.00 0.00 C ATOM 1154 O LYS A 74 -12.672 32.129 -10.992 1.00 0.00 O ATOM 1155 CB LYS A 74 -11.422 35.148 -11.452 1.00 0.00 C ATOM 1156 CG LYS A 74 -11.563 36.675 -11.619 1.00 0.00 C ATOM 1157 CD LYS A 74 -10.300 37.449 -11.167 1.00 0.00 C ATOM 1158 CE LYS A 74 -10.437 38.961 -11.409 1.00 0.00 C ATOM 1159 NZ LYS A 74 -9.255 39.722 -10.935 1.00 0.00 N ATOM 0 H LYS A 74 -13.652 35.182 -10.357 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.824 34.614 -13.027 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.289 34.921 -10.394 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.518 34.820 -11.965 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.768 36.904 -12.665 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -12.421 37.021 -11.042 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -10.122 37.266 -10.107 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -9.431 37.072 -11.706 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.579 39.144 -12.474 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -11.329 39.328 -10.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -9.397 40.735 -11.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -9.132 39.572 -9.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -8.406 39.393 -11.438 1.00 0.00 H new ATOM 1173 N PRO A 75 -11.583 32.257 -12.994 1.00 0.00 N ATOM 1174 CA PRO A 75 -11.082 30.855 -12.955 1.00 0.00 C ATOM 1175 C PRO A 75 -10.102 30.629 -11.778 1.00 0.00 C ATOM 1176 O PRO A 75 -9.957 29.504 -11.286 1.00 0.00 O ATOM 1177 CB PRO A 75 -10.380 30.682 -14.334 1.00 0.00 C ATOM 1178 CG PRO A 75 -10.077 32.079 -14.793 1.00 0.00 C ATOM 1179 CD PRO A 75 -11.220 32.925 -14.282 1.00 0.00 C ATOM 0 HA PRO A 75 -11.877 30.127 -12.794 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.469 30.090 -14.242 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -11.026 30.165 -15.044 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -9.123 32.425 -14.395 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -10.006 32.129 -15.880 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.918 33.961 -14.128 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -12.057 32.937 -14.980 1.00 0.00 H new ATOM 1187 N SER A 76 -9.451 31.734 -11.355 1.00 0.00 N ATOM 1188 CA SER A 76 -8.580 31.801 -10.173 1.00 0.00 C ATOM 1189 C SER A 76 -9.340 31.398 -8.893 1.00 0.00 C ATOM 1190 O SER A 76 -8.812 30.657 -8.052 1.00 0.00 O ATOM 1191 CB SER A 76 -8.045 33.246 -10.041 1.00 0.00 C ATOM 1192 OG SER A 76 -7.520 33.708 -11.277 1.00 0.00 O ATOM 0 H SER A 76 -9.522 32.626 -11.844 1.00 0.00 H new ATOM 0 HA SER A 76 -7.754 31.100 -10.297 1.00 0.00 H new ATOM 0 HB2 SER A 76 -8.848 33.906 -9.713 1.00 0.00 H new ATOM 0 HB3 SER A 76 -7.270 33.282 -9.276 1.00 0.00 H new ATOM 0 HG SER A 76 -7.189 34.624 -11.170 1.00 0.00 H new ATOM 1198 N THR A 77 -10.592 31.901 -8.781 1.00 0.00 N ATOM 1199 CA THR A 77 -11.473 31.651 -7.625 1.00 0.00 C ATOM 1200 C THR A 77 -11.776 30.157 -7.504 1.00 0.00 C ATOM 1201 O THR A 77 -11.697 29.589 -6.426 1.00 0.00 O ATOM 1202 CB THR A 77 -12.841 32.415 -7.763 1.00 0.00 C ATOM 1203 OG1 THR A 77 -12.639 33.665 -8.429 1.00 0.00 O ATOM 1204 CG2 THR A 77 -13.518 32.662 -6.396 1.00 0.00 C ATOM 0 H THR A 77 -11.017 32.493 -9.495 1.00 0.00 H new ATOM 0 HA THR A 77 -10.948 32.010 -6.740 1.00 0.00 H new ATOM 0 HB THR A 77 -13.505 31.780 -8.350 1.00 0.00 H new ATOM 0 HG1 THR A 77 -12.626 33.521 -9.398 1.00 0.00 H new ATOM 0 HG21 THR A 77 -14.458 33.192 -6.546 1.00 0.00 H new ATOM 0 HG22 THR A 77 -13.714 31.707 -5.909 1.00 0.00 H new ATOM 0 HG23 THR A 77 -12.860 33.262 -5.767 1.00 0.00 H new ATOM 1212 N LEU A 78 -12.122 29.556 -8.660 1.00 0.00 N ATOM 1213 CA LEU A 78 -12.510 28.144 -8.772 1.00 0.00 C ATOM 1214 C LEU A 78 -11.334 27.220 -8.437 1.00 0.00 C ATOM 1215 O LEU A 78 -11.516 26.224 -7.751 1.00 0.00 O ATOM 1216 CB LEU A 78 -13.061 27.836 -10.206 1.00 0.00 C ATOM 1217 CG LEU A 78 -14.564 28.187 -10.460 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -15.475 27.370 -9.520 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -14.835 29.704 -10.324 1.00 0.00 C ATOM 0 H LEU A 78 -12.139 30.049 -9.553 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.303 27.955 -8.048 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.455 28.381 -10.930 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.919 26.774 -10.407 1.00 0.00 H new ATOM 0 HG LEU A 78 -14.798 27.915 -11.489 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.517 27.626 -9.710 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -15.324 26.306 -9.702 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -15.228 27.600 -8.484 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -15.891 29.903 -10.508 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -14.574 30.031 -9.318 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -14.231 30.248 -11.050 1.00 0.00 H new ATOM 1231 N ARG A 79 -10.135 27.572 -8.927 1.00 0.00 N ATOM 1232 CA ARG A 79 -8.918 26.756 -8.737 1.00 0.00 C ATOM 1233 C ARG A 79 -8.503 26.726 -7.257 1.00 0.00 C ATOM 1234 O ARG A 79 -8.119 25.677 -6.719 1.00 0.00 O ATOM 1235 CB ARG A 79 -7.765 27.310 -9.614 1.00 0.00 C ATOM 1236 CG ARG A 79 -6.566 26.347 -9.782 1.00 0.00 C ATOM 1237 CD ARG A 79 -6.977 25.035 -10.474 1.00 0.00 C ATOM 1238 NE ARG A 79 -5.825 24.161 -10.752 1.00 0.00 N ATOM 1239 CZ ARG A 79 -5.841 23.109 -11.585 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -6.953 22.734 -12.211 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -4.730 22.417 -11.784 1.00 0.00 N ATOM 0 H ARG A 79 -9.979 28.425 -9.464 1.00 0.00 H new ATOM 0 HA ARG A 79 -9.136 25.734 -9.046 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -8.160 27.553 -10.600 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.408 28.242 -9.176 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.786 26.836 -10.365 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -6.140 26.124 -8.804 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -7.689 24.503 -9.844 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.488 25.265 -11.409 1.00 0.00 H new ATOM 0 HE ARG A 79 -4.948 24.371 -10.275 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -7.820 23.250 -12.063 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -6.938 21.931 -12.839 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -3.870 22.685 -11.306 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -4.734 21.616 -12.416 1.00 0.00 H new ATOM 1255 N GLU A 80 -8.612 27.903 -6.617 1.00 0.00 N ATOM 1256 CA GLU A 80 -8.333 28.077 -5.188 1.00 0.00 C ATOM 1257 C GLU A 80 -9.408 27.370 -4.347 1.00 0.00 C ATOM 1258 O GLU A 80 -9.087 26.758 -3.330 1.00 0.00 O ATOM 1259 CB GLU A 80 -8.278 29.583 -4.833 1.00 0.00 C ATOM 1260 CG GLU A 80 -7.970 29.886 -3.346 1.00 0.00 C ATOM 1261 CD GLU A 80 -7.900 31.390 -3.037 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -8.953 32.051 -3.039 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -6.790 31.920 -2.790 1.00 0.00 O ATOM 0 H GLU A 80 -8.898 28.764 -7.083 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.365 27.630 -4.963 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.519 30.061 -5.452 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.234 30.039 -5.092 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -8.738 29.429 -2.722 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.022 29.422 -3.076 1.00 0.00 H new ATOM 1270 N LEU A 81 -10.681 27.457 -4.806 1.00 0.00 N ATOM 1271 CA LEU A 81 -11.847 26.863 -4.121 1.00 0.00 C ATOM 1272 C LEU A 81 -11.713 25.335 -4.062 1.00 0.00 C ATOM 1273 O LEU A 81 -12.009 24.741 -3.036 1.00 0.00 O ATOM 1274 CB LEU A 81 -13.174 27.263 -4.829 1.00 0.00 C ATOM 1275 CG LEU A 81 -14.501 26.767 -4.160 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -14.665 27.323 -2.720 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -15.729 27.121 -5.042 1.00 0.00 C ATOM 0 H LEU A 81 -10.925 27.945 -5.668 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.875 27.252 -3.103 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -13.211 28.350 -4.895 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.144 26.883 -5.850 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.442 25.682 -4.079 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -15.598 26.955 -2.292 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.828 26.992 -2.105 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -14.685 28.412 -2.751 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -16.639 26.767 -4.558 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -15.784 28.202 -5.172 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -15.627 26.643 -6.016 1.00 0.00 H new ATOM 1289 N GLU A 82 -11.244 24.728 -5.180 1.00 0.00 N ATOM 1290 CA GLU A 82 -10.968 23.273 -5.274 1.00 0.00 C ATOM 1291 C GLU A 82 -9.951 22.846 -4.212 1.00 0.00 C ATOM 1292 O GLU A 82 -10.165 21.874 -3.497 1.00 0.00 O ATOM 1293 CB GLU A 82 -10.427 22.895 -6.684 1.00 0.00 C ATOM 1294 CG GLU A 82 -11.431 23.065 -7.834 1.00 0.00 C ATOM 1295 CD GLU A 82 -12.602 22.069 -7.780 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -13.605 22.337 -7.091 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -12.536 21.019 -8.464 1.00 0.00 O ATOM 0 H GLU A 82 -11.046 25.234 -6.043 1.00 0.00 H new ATOM 0 HA GLU A 82 -11.909 22.750 -5.104 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.549 23.506 -6.895 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.095 21.857 -6.663 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.827 24.080 -7.813 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -10.908 22.947 -8.783 1.00 0.00 H new ATOM 1304 N ARG A 83 -8.856 23.609 -4.123 1.00 0.00 N ATOM 1305 CA ARG A 83 -7.738 23.323 -3.207 1.00 0.00 C ATOM 1306 C ARG A 83 -8.131 23.577 -1.730 1.00 0.00 C ATOM 1307 O ARG A 83 -7.657 22.879 -0.821 1.00 0.00 O ATOM 1308 CB ARG A 83 -6.520 24.190 -3.615 1.00 0.00 C ATOM 1309 CG ARG A 83 -5.220 23.894 -2.837 1.00 0.00 C ATOM 1310 CD ARG A 83 -4.039 24.735 -3.338 1.00 0.00 C ATOM 1311 NE ARG A 83 -2.809 24.459 -2.582 1.00 0.00 N ATOM 1312 CZ ARG A 83 -1.638 25.099 -2.748 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -1.506 26.086 -3.621 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -0.588 24.741 -2.028 1.00 0.00 N ATOM 0 H ARG A 83 -8.716 24.448 -4.686 1.00 0.00 H new ATOM 0 HA ARG A 83 -7.477 22.268 -3.286 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -6.330 24.046 -4.679 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -6.778 25.240 -3.477 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.380 24.091 -1.777 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.976 22.836 -2.931 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.869 24.529 -4.395 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.286 25.793 -3.255 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.847 23.724 -1.876 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -2.304 26.377 -4.186 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -0.607 26.555 -3.728 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.669 23.983 -1.351 1.00 0.00 H new ATOM 0 HH22 ARG A 83 0.302 25.223 -2.150 1.00 0.00 H new ATOM 1328 N TYR A 84 -9.024 24.560 -1.515 1.00 0.00 N ATOM 1329 CA TYR A 84 -9.446 24.995 -0.172 1.00 0.00 C ATOM 1330 C TYR A 84 -10.465 23.998 0.419 1.00 0.00 C ATOM 1331 O TYR A 84 -10.384 23.639 1.597 1.00 0.00 O ATOM 1332 CB TYR A 84 -10.043 26.434 -0.233 1.00 0.00 C ATOM 1333 CG TYR A 84 -10.128 27.130 1.140 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -11.235 26.967 1.980 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -9.081 27.933 1.598 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -11.287 27.572 3.219 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -9.135 28.541 2.836 1.00 0.00 C ATOM 1338 CZ TYR A 84 -10.242 28.361 3.644 1.00 0.00 C ATOM 1339 OH TYR A 84 -10.299 28.966 4.882 1.00 0.00 O ATOM 0 H TYR A 84 -9.474 25.076 -2.271 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.574 25.016 0.482 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.434 27.042 -0.901 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -11.041 26.385 -0.668 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -12.064 26.357 1.653 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.213 28.081 0.972 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -12.147 27.427 3.855 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -8.314 29.156 3.173 1.00 0.00 H new ATOM 0 HH TYR A 84 -9.482 29.487 5.030 1.00 0.00 H new ATOM 1349 N VAL A 85 -11.414 23.554 -0.421 1.00 0.00 N ATOM 1350 CA VAL A 85 -12.437 22.565 -0.026 1.00 0.00 C ATOM 1351 C VAL A 85 -11.801 21.159 0.071 1.00 0.00 C ATOM 1352 O VAL A 85 -12.284 20.320 0.818 1.00 0.00 O ATOM 1353 CB VAL A 85 -13.681 22.552 -1.005 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -13.325 21.959 -2.390 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -14.898 21.813 -0.374 1.00 0.00 C ATOM 0 H VAL A 85 -11.496 23.867 -1.388 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.815 22.860 0.953 1.00 0.00 H new ATOM 0 HB VAL A 85 -13.968 23.592 -1.163 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -14.208 21.970 -3.028 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -12.537 22.556 -2.850 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -12.978 20.933 -2.268 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.733 21.824 -1.074 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -14.623 20.782 -0.153 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -15.191 22.316 0.548 1.00 0.00 H new ATOM 1365 N LEU A 86 -10.700 20.934 -0.689 1.00 0.00 N ATOM 1366 CA LEU A 86 -9.878 19.704 -0.604 1.00 0.00 C ATOM 1367 C LEU A 86 -9.029 19.712 0.684 1.00 0.00 C ATOM 1368 O LEU A 86 -8.622 18.663 1.168 1.00 0.00 O ATOM 1369 CB LEU A 86 -8.959 19.565 -1.853 1.00 0.00 C ATOM 1370 CG LEU A 86 -8.119 18.243 -1.965 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -9.026 16.985 -2.066 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -7.119 18.313 -3.145 1.00 0.00 C ATOM 0 H LEU A 86 -10.358 21.603 -1.379 1.00 0.00 H new ATOM 0 HA LEU A 86 -10.551 18.847 -0.576 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -9.581 19.650 -2.744 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.269 20.409 -1.864 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.543 18.148 -1.044 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -8.404 16.093 -2.142 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.653 16.916 -1.177 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -9.658 17.062 -2.950 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -6.552 17.384 -3.197 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -7.666 18.457 -4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.435 19.148 -2.993 1.00 0.00 H new ATOM 1384 N SER A 87 -8.743 20.912 1.223 1.00 0.00 N ATOM 1385 CA SER A 87 -8.088 21.055 2.540 1.00 0.00 C ATOM 1386 C SER A 87 -9.073 20.688 3.675 1.00 0.00 C ATOM 1387 O SER A 87 -8.654 20.282 4.765 1.00 0.00 O ATOM 1388 CB SER A 87 -7.539 22.489 2.719 1.00 0.00 C ATOM 1389 OG SER A 87 -6.704 22.588 3.866 1.00 0.00 O ATOM 0 H SER A 87 -8.955 21.799 0.767 1.00 0.00 H new ATOM 0 HA SER A 87 -7.246 20.365 2.588 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.976 22.777 1.832 1.00 0.00 H new ATOM 0 HB3 SER A 87 -8.370 23.189 2.811 1.00 0.00 H new ATOM 0 HG SER A 87 -6.372 23.506 3.950 1.00 0.00 H new ATOM 1395 N CYS A 88 -10.388 20.852 3.399 1.00 0.00 N ATOM 1396 CA CYS A 88 -11.480 20.487 4.328 1.00 0.00 C ATOM 1397 C CYS A 88 -11.906 19.009 4.145 1.00 0.00 C ATOM 1398 O CYS A 88 -12.275 18.336 5.117 1.00 0.00 O ATOM 1399 CB CYS A 88 -12.687 21.424 4.099 1.00 0.00 C ATOM 1400 SG CYS A 88 -12.299 23.178 4.292 1.00 0.00 S ATOM 0 H CYS A 88 -10.722 21.244 2.519 1.00 0.00 H new ATOM 0 HA CYS A 88 -11.117 20.602 5.349 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -13.079 21.257 3.096 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -13.479 21.158 4.799 1.00 0.00 H new ATOM 0 HG CYS A 88 -11.536 23.564 3.313 1.00 0.00 H new ATOM 1406 N LEU A 89 -11.845 18.520 2.894 1.00 0.00 N ATOM 1407 CA LEU A 89 -12.291 17.160 2.519 1.00 0.00 C ATOM 1408 C LEU A 89 -11.151 16.164 2.759 1.00 0.00 C ATOM 1409 O LEU A 89 -11.313 15.220 3.530 1.00 0.00 O ATOM 1410 CB LEU A 89 -12.752 17.138 1.029 1.00 0.00 C ATOM 1411 CG LEU A 89 -13.308 15.780 0.486 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -14.574 15.321 1.255 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -13.570 15.858 -1.042 1.00 0.00 C ATOM 0 H LEU A 89 -11.483 19.058 2.107 1.00 0.00 H new ATOM 0 HA LEU A 89 -13.141 16.871 3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.523 17.897 0.900 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.907 17.433 0.407 1.00 0.00 H new ATOM 0 HG LEU A 89 -12.542 15.024 0.658 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.926 14.374 0.845 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -14.332 15.192 2.310 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -15.355 16.074 1.152 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -13.956 14.901 -1.394 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -14.300 16.641 -1.246 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -12.638 16.086 -1.560 1.00 0.00 H new ATOM 1425 N ARG A 90 -10.014 16.419 2.069 1.00 0.00 N ATOM 1426 CA ARG A 90 -8.731 15.670 2.166 1.00 0.00 C ATOM 1427 C ARG A 90 -8.813 14.313 1.446 1.00 0.00 C ATOM 1428 O ARG A 90 -8.062 14.054 0.496 1.00 0.00 O ATOM 1429 CB ARG A 90 -8.261 15.508 3.641 1.00 0.00 C ATOM 1430 CG ARG A 90 -6.848 14.916 3.808 1.00 0.00 C ATOM 1431 CD ARG A 90 -6.408 14.833 5.282 1.00 0.00 C ATOM 1432 NE ARG A 90 -6.598 16.107 6.009 1.00 0.00 N ATOM 1433 CZ ARG A 90 -5.863 17.225 5.848 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -4.886 17.291 4.954 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -6.134 18.293 6.580 1.00 0.00 N ATOM 0 H ARG A 90 -9.960 17.186 1.399 1.00 0.00 H new ATOM 0 HA ARG A 90 -7.975 16.266 1.655 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.290 16.484 4.126 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.972 14.869 4.166 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.822 13.919 3.369 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -6.135 15.527 3.254 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -6.974 14.047 5.782 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.357 14.547 5.327 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.353 16.143 6.694 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -4.676 16.483 4.368 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -4.345 18.150 4.852 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.894 18.266 7.260 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.583 19.143 6.465 1.00 0.00 H new ATOM 1724 N THR A 106 -28.085 -3.301 -15.712 1.00 0.00 N ATOM 1725 CA THR A 106 -28.133 -4.703 -16.166 1.00 0.00 C ATOM 1726 C THR A 106 -28.725 -5.603 -15.053 1.00 0.00 C ATOM 1727 O THR A 106 -28.972 -5.137 -13.932 1.00 0.00 O ATOM 1728 CB THR A 106 -26.714 -5.227 -16.604 1.00 0.00 C ATOM 1729 OG1 THR A 106 -25.748 -5.045 -15.559 1.00 0.00 O ATOM 1730 CG2 THR A 106 -26.210 -4.534 -17.882 1.00 0.00 C ATOM 0 HA THR A 106 -28.779 -4.746 -17.043 1.00 0.00 H new ATOM 0 HB THR A 106 -26.831 -6.291 -16.810 1.00 0.00 H new ATOM 0 HG1 THR A 106 -26.131 -4.482 -14.854 1.00 0.00 H new ATOM 0 HG21 THR A 106 -25.228 -4.927 -18.146 1.00 0.00 H new ATOM 0 HG22 THR A 106 -26.908 -4.723 -18.698 1.00 0.00 H new ATOM 0 HG23 THR A 106 -26.136 -3.460 -17.709 1.00 0.00 H new ATOM 1738 N LYS A 107 -28.926 -6.904 -15.383 1.00 0.00 N ATOM 1739 CA LYS A 107 -29.538 -7.915 -14.480 1.00 0.00 C ATOM 1740 C LYS A 107 -28.735 -8.135 -13.180 1.00 0.00 C ATOM 1741 O LYS A 107 -29.282 -8.629 -12.186 1.00 0.00 O ATOM 1742 CB LYS A 107 -29.720 -9.261 -15.239 1.00 0.00 C ATOM 1743 CG LYS A 107 -28.403 -9.928 -15.705 1.00 0.00 C ATOM 1744 CD LYS A 107 -28.638 -11.185 -16.580 1.00 0.00 C ATOM 1745 CE LYS A 107 -27.333 -11.773 -17.147 1.00 0.00 C ATOM 1746 NZ LYS A 107 -26.414 -12.252 -16.085 1.00 0.00 N ATOM 0 H LYS A 107 -28.665 -7.286 -16.292 1.00 0.00 H new ATOM 0 HA LYS A 107 -30.510 -7.524 -14.178 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -30.254 -9.957 -14.592 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -30.351 -9.088 -16.111 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -27.815 -9.204 -16.269 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -27.814 -10.205 -14.831 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -29.145 -11.945 -15.986 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -29.303 -10.928 -17.404 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -27.572 -12.600 -17.816 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -26.827 -11.015 -17.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -25.559 -12.653 -16.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -26.148 -11.456 -15.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -26.889 -12.983 -15.518 1.00 0.00 H new ATOM 1760 N GLU A 108 -27.442 -7.750 -13.211 1.00 0.00 N ATOM 1761 CA GLU A 108 -26.540 -7.830 -12.051 1.00 0.00 C ATOM 1762 C GLU A 108 -27.063 -6.969 -10.892 1.00 0.00 C ATOM 1763 O GLU A 108 -27.198 -7.453 -9.769 1.00 0.00 O ATOM 1764 CB GLU A 108 -25.106 -7.382 -12.460 1.00 0.00 C ATOM 1765 CG GLU A 108 -24.508 -8.127 -13.676 1.00 0.00 C ATOM 1766 CD GLU A 108 -24.540 -9.657 -13.521 1.00 0.00 C ATOM 1767 OE1 GLU A 108 -25.393 -10.314 -14.153 1.00 0.00 O ATOM 1768 OE2 GLU A 108 -23.731 -10.211 -12.745 1.00 0.00 O ATOM 0 H GLU A 108 -26.996 -7.374 -14.047 1.00 0.00 H new ATOM 0 HA GLU A 108 -26.503 -8.865 -11.711 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -25.125 -6.315 -12.681 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -24.442 -7.520 -11.607 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -25.060 -7.847 -14.573 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -23.477 -7.804 -13.822 1.00 0.00 H new ATOM 1775 N GLU A 109 -27.401 -5.701 -11.206 1.00 0.00 N ATOM 1776 CA GLU A 109 -27.858 -4.713 -10.206 1.00 0.00 C ATOM 1777 C GLU A 109 -29.352 -4.878 -9.914 1.00 0.00 C ATOM 1778 O GLU A 109 -29.812 -4.443 -8.865 1.00 0.00 O ATOM 1779 CB GLU A 109 -27.565 -3.257 -10.634 1.00 0.00 C ATOM 1780 CG GLU A 109 -26.079 -2.917 -10.892 1.00 0.00 C ATOM 1781 CD GLU A 109 -25.505 -3.529 -12.175 1.00 0.00 C ATOM 1782 OE1 GLU A 109 -26.236 -3.595 -13.184 1.00 0.00 O ATOM 1783 OE2 GLU A 109 -24.323 -3.919 -12.197 1.00 0.00 O ATOM 0 H GLU A 109 -27.365 -5.334 -12.157 1.00 0.00 H new ATOM 0 HA GLU A 109 -27.290 -4.911 -9.297 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -28.130 -3.045 -11.542 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -27.942 -2.588 -9.860 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -25.969 -1.834 -10.940 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -25.487 -3.260 -10.043 1.00 0.00 H new ATOM 1790 N LEU A 110 -30.108 -5.478 -10.856 1.00 0.00 N ATOM 1791 CA LEU A 110 -31.527 -5.840 -10.627 1.00 0.00 C ATOM 1792 C LEU A 110 -31.643 -6.947 -9.549 1.00 0.00 C ATOM 1793 O LEU A 110 -32.676 -7.084 -8.884 1.00 0.00 O ATOM 1794 CB LEU A 110 -32.204 -6.289 -11.952 1.00 0.00 C ATOM 1795 CG LEU A 110 -32.245 -5.228 -13.106 1.00 0.00 C ATOM 1796 CD1 LEU A 110 -32.902 -5.812 -14.385 1.00 0.00 C ATOM 1797 CD2 LEU A 110 -32.957 -3.928 -12.652 1.00 0.00 C ATOM 0 H LEU A 110 -29.762 -5.723 -11.784 1.00 0.00 H new ATOM 0 HA LEU A 110 -32.048 -4.954 -10.264 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -31.684 -7.174 -12.319 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -33.227 -6.591 -11.728 1.00 0.00 H new ATOM 0 HG LEU A 110 -31.215 -4.970 -13.352 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -32.915 -5.052 -15.166 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -32.329 -6.674 -14.727 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -33.923 -6.120 -14.161 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -32.969 -3.213 -13.475 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -33.981 -4.158 -12.357 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -32.423 -3.498 -11.805 1.00 0.00 H new ATOM 1809 N ALA A 111 -30.577 -7.757 -9.424 1.00 0.00 N ATOM 1810 CA ALA A 111 -30.413 -8.736 -8.333 1.00 0.00 C ATOM 1811 C ALA A 111 -29.757 -8.090 -7.092 1.00 0.00 C ATOM 1812 O ALA A 111 -30.148 -8.369 -5.959 1.00 0.00 O ATOM 1813 CB ALA A 111 -29.587 -9.930 -8.826 1.00 0.00 C ATOM 0 H ALA A 111 -29.798 -7.751 -10.083 1.00 0.00 H new ATOM 0 HA ALA A 111 -31.401 -9.087 -8.034 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -29.469 -10.650 -8.016 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -30.099 -10.406 -9.663 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -28.605 -9.584 -9.150 1.00 0.00 H new ATOM 1819 N LEU A 112 -28.753 -7.222 -7.332 1.00 0.00 N ATOM 1820 CA LEU A 112 -27.910 -6.610 -6.269 1.00 0.00 C ATOM 1821 C LEU A 112 -28.712 -5.583 -5.431 1.00 0.00 C ATOM 1822 O LEU A 112 -28.391 -5.344 -4.264 1.00 0.00 O ATOM 1823 CB LEU A 112 -26.634 -5.983 -6.933 1.00 0.00 C ATOM 1824 CG LEU A 112 -25.439 -5.494 -6.017 1.00 0.00 C ATOM 1825 CD1 LEU A 112 -25.671 -4.084 -5.412 1.00 0.00 C ATOM 1826 CD2 LEU A 112 -25.103 -6.538 -4.920 1.00 0.00 C ATOM 0 H LEU A 112 -28.498 -6.920 -8.272 1.00 0.00 H new ATOM 0 HA LEU A 112 -27.590 -7.378 -5.565 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -26.232 -6.720 -7.628 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -26.961 -5.129 -7.527 1.00 0.00 H new ATOM 0 HG LEU A 112 -24.572 -5.402 -6.671 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -24.816 -3.808 -4.795 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -25.788 -3.358 -6.216 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -26.572 -4.095 -4.799 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -24.278 -6.171 -4.309 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -25.978 -6.698 -4.290 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -24.816 -7.479 -5.389 1.00 0.00 H new ATOM 1838 N GLU A 113 -29.771 -4.997 -6.035 1.00 0.00 N ATOM 1839 CA GLU A 113 -30.670 -4.036 -5.353 1.00 0.00 C ATOM 1840 C GLU A 113 -31.395 -4.696 -4.166 1.00 0.00 C ATOM 1841 O GLU A 113 -31.859 -4.002 -3.273 1.00 0.00 O ATOM 1842 CB GLU A 113 -31.664 -3.369 -6.362 1.00 0.00 C ATOM 1843 CG GLU A 113 -32.639 -4.319 -7.112 1.00 0.00 C ATOM 1844 CD GLU A 113 -33.830 -4.818 -6.265 1.00 0.00 C ATOM 1845 OE1 GLU A 113 -34.666 -3.986 -5.866 1.00 0.00 O ATOM 1846 OE2 GLU A 113 -33.934 -6.034 -5.995 1.00 0.00 O ATOM 0 H GLU A 113 -30.026 -5.176 -7.006 1.00 0.00 H new ATOM 0 HA GLU A 113 -30.056 -3.235 -4.942 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -32.257 -2.632 -5.819 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -31.081 -2.824 -7.105 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -33.026 -3.802 -7.990 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -32.079 -5.182 -7.472 1.00 0.00 H new ATOM 1853 N LYS A 114 -31.520 -6.046 -4.212 1.00 0.00 N ATOM 1854 CA LYS A 114 -32.123 -6.850 -3.131 1.00 0.00 C ATOM 1855 C LYS A 114 -31.290 -6.738 -1.840 1.00 0.00 C ATOM 1856 O LYS A 114 -31.829 -6.835 -0.738 1.00 0.00 O ATOM 1857 CB LYS A 114 -32.255 -8.338 -3.568 1.00 0.00 C ATOM 1858 CG LYS A 114 -33.241 -9.175 -2.717 1.00 0.00 C ATOM 1859 CD LYS A 114 -34.705 -8.698 -2.891 1.00 0.00 C ATOM 1860 CE LYS A 114 -35.717 -9.560 -2.121 1.00 0.00 C ATOM 1861 NZ LYS A 114 -37.117 -9.188 -2.451 1.00 0.00 N ATOM 0 H LYS A 114 -31.203 -6.605 -5.004 1.00 0.00 H new ATOM 0 HA LYS A 114 -33.120 -6.459 -2.929 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -32.576 -8.370 -4.609 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -31.271 -8.805 -3.524 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -33.165 -10.225 -3.001 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -32.960 -9.108 -1.666 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -34.786 -7.665 -2.554 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -34.960 -8.708 -3.951 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -35.554 -10.611 -2.358 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -35.553 -9.445 -1.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -37.772 -9.790 -1.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -37.279 -8.191 -2.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -37.281 -9.322 -3.469 1.00 0.00 H new ATOM 1875 N LYS A 115 -29.966 -6.544 -1.999 1.00 0.00 N ATOM 1876 CA LYS A 115 -29.068 -6.254 -0.873 1.00 0.00 C ATOM 1877 C LYS A 115 -29.377 -4.861 -0.298 1.00 0.00 C ATOM 1878 O LYS A 115 -29.391 -4.693 0.906 1.00 0.00 O ATOM 1879 CB LYS A 115 -27.579 -6.354 -1.300 1.00 0.00 C ATOM 1880 CG LYS A 115 -26.553 -6.001 -0.191 1.00 0.00 C ATOM 1881 CD LYS A 115 -26.689 -6.887 1.069 1.00 0.00 C ATOM 1882 CE LYS A 115 -25.670 -6.524 2.156 1.00 0.00 C ATOM 1883 NZ LYS A 115 -24.272 -6.634 1.669 1.00 0.00 N ATOM 0 H LYS A 115 -29.496 -6.584 -2.904 1.00 0.00 H new ATOM 0 HA LYS A 115 -29.239 -7.001 -0.098 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -27.383 -7.369 -1.645 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -27.415 -5.691 -2.150 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -25.545 -6.103 -0.592 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -26.679 -4.956 0.092 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -27.697 -6.787 1.472 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -26.560 -7.933 0.789 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -25.855 -5.506 2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -25.807 -7.181 3.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -23.617 -6.564 2.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -24.141 -7.550 1.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -24.077 -5.865 0.996 1.00 0.00 H new ATOM 1897 N ARG A 116 -29.649 -3.882 -1.184 1.00 0.00 N ATOM 1898 CA ARG A 116 -29.994 -2.493 -0.784 1.00 0.00 C ATOM 1899 C ARG A 116 -31.389 -2.486 -0.089 1.00 0.00 C ATOM 1900 O ARG A 116 -31.639 -1.688 0.823 1.00 0.00 O ATOM 1901 CB ARG A 116 -29.938 -1.555 -2.044 1.00 0.00 C ATOM 1902 CG ARG A 116 -29.589 -0.062 -1.772 1.00 0.00 C ATOM 1903 CD ARG A 116 -30.717 0.728 -1.093 1.00 0.00 C ATOM 1904 NE ARG A 116 -30.328 2.126 -0.823 1.00 0.00 N ATOM 1905 CZ ARG A 116 -31.177 3.153 -0.646 1.00 0.00 C ATOM 1906 NH1 ARG A 116 -32.496 2.976 -0.706 1.00 0.00 N ATOM 1907 NH2 ARG A 116 -30.693 4.361 -0.394 1.00 0.00 N ATOM 0 H ARG A 116 -29.637 -4.026 -2.194 1.00 0.00 H new ATOM 0 HA ARG A 116 -29.271 -2.109 -0.064 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -29.202 -1.958 -2.739 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -30.905 -1.595 -2.545 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -28.698 -0.016 -1.145 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -29.339 0.420 -2.717 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -31.603 0.714 -1.728 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -30.989 0.240 -0.157 1.00 0.00 H new ATOM 0 HE ARG A 116 -29.330 2.330 -0.766 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -32.878 2.048 -0.889 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -33.124 3.768 -0.569 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -29.685 4.505 -0.336 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -31.329 5.147 -0.258 1.00 0.00 H new ATOM 1921 N GLU A 117 -32.261 -3.420 -0.521 1.00 0.00 N ATOM 1922 CA GLU A 117 -33.577 -3.675 0.093 1.00 0.00 C ATOM 1923 C GLU A 117 -33.356 -4.236 1.509 1.00 0.00 C ATOM 1924 O GLU A 117 -34.036 -3.835 2.459 1.00 0.00 O ATOM 1925 CB GLU A 117 -34.390 -4.671 -0.810 1.00 0.00 C ATOM 1926 CG GLU A 117 -35.912 -4.824 -0.511 1.00 0.00 C ATOM 1927 CD GLU A 117 -36.262 -5.634 0.756 1.00 0.00 C ATOM 1928 OE1 GLU A 117 -35.995 -6.853 0.783 1.00 0.00 O ATOM 1929 OE2 GLU A 117 -36.834 -5.072 1.716 1.00 0.00 O ATOM 0 H GLU A 117 -32.066 -4.026 -1.318 1.00 0.00 H new ATOM 0 HA GLU A 117 -34.155 -2.755 0.172 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -34.280 -4.354 -1.847 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -33.929 -5.655 -0.727 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -36.348 -3.829 -0.417 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -36.387 -5.301 -1.369 1.00 0.00 H new ATOM 1936 N LEU A 118 -32.359 -5.143 1.623 1.00 0.00 N ATOM 1937 CA LEU A 118 -31.941 -5.741 2.900 1.00 0.00 C ATOM 1938 C LEU A 118 -31.390 -4.663 3.851 1.00 0.00 C ATOM 1939 O LEU A 118 -31.665 -4.706 5.035 1.00 0.00 O ATOM 1940 CB LEU A 118 -30.886 -6.860 2.678 1.00 0.00 C ATOM 1941 CG LEU A 118 -30.385 -7.606 3.962 1.00 0.00 C ATOM 1942 CD1 LEU A 118 -31.543 -8.338 4.687 1.00 0.00 C ATOM 1943 CD2 LEU A 118 -29.224 -8.580 3.629 1.00 0.00 C ATOM 0 H LEU A 118 -31.822 -5.479 0.823 1.00 0.00 H new ATOM 0 HA LEU A 118 -32.820 -6.193 3.360 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -31.308 -7.598 1.996 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -30.022 -6.422 2.178 1.00 0.00 H new ATOM 0 HG LEU A 118 -30.000 -6.851 4.647 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -31.156 -8.843 5.572 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -32.301 -7.614 4.985 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -31.987 -9.072 4.015 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -28.898 -9.082 4.540 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -29.567 -9.322 2.908 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -28.390 -8.021 3.205 1.00 0.00 H new ATOM 1955 N GLU A 119 -30.640 -3.691 3.296 1.00 0.00 N ATOM 1956 CA GLU A 119 -30.030 -2.585 4.064 1.00 0.00 C ATOM 1957 C GLU A 119 -31.106 -1.661 4.666 1.00 0.00 C ATOM 1958 O GLU A 119 -30.984 -1.216 5.818 1.00 0.00 O ATOM 1959 CB GLU A 119 -29.062 -1.764 3.163 1.00 0.00 C ATOM 1960 CG GLU A 119 -27.859 -2.542 2.596 1.00 0.00 C ATOM 1961 CD GLU A 119 -26.918 -3.100 3.675 1.00 0.00 C ATOM 1962 OE1 GLU A 119 -27.178 -4.199 4.198 1.00 0.00 O ATOM 1963 OE2 GLU A 119 -25.904 -2.432 4.004 1.00 0.00 O ATOM 0 H GLU A 119 -30.439 -3.650 2.297 1.00 0.00 H new ATOM 0 HA GLU A 119 -29.463 -3.024 4.885 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -29.631 -1.353 2.329 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -28.686 -0.919 3.740 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -28.227 -3.367 1.986 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -27.292 -1.885 1.936 1.00 0.00 H new ATOM 1970 N LYS A 120 -32.157 -1.387 3.869 1.00 0.00 N ATOM 1971 CA LYS A 120 -33.252 -0.474 4.260 1.00 0.00 C ATOM 1972 C LYS A 120 -34.106 -1.130 5.372 1.00 0.00 C ATOM 1973 O LYS A 120 -34.411 -0.484 6.375 1.00 0.00 O ATOM 1974 CB LYS A 120 -34.102 -0.091 3.002 1.00 0.00 C ATOM 1975 CG LYS A 120 -35.013 1.177 3.137 1.00 0.00 C ATOM 1976 CD LYS A 120 -36.378 0.947 3.884 1.00 0.00 C ATOM 1977 CE LYS A 120 -36.507 1.726 5.213 1.00 0.00 C ATOM 1978 NZ LYS A 120 -37.822 1.503 5.874 1.00 0.00 N ATOM 0 H LYS A 120 -32.272 -1.790 2.939 1.00 0.00 H new ATOM 0 HA LYS A 120 -32.841 0.451 4.666 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -33.422 0.064 2.164 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -34.735 -0.941 2.745 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -34.455 1.951 3.664 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -35.224 1.561 2.139 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -37.195 1.238 3.224 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -36.495 -0.118 4.086 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -35.707 1.422 5.889 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -36.375 2.791 5.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -37.861 2.045 6.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -38.586 1.817 5.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -37.939 0.491 6.082 1.00 0.00 H new ATOM 1992 N ARG A 121 -34.473 -2.420 5.185 1.00 0.00 N ATOM 1993 CA ARG A 121 -35.291 -3.181 6.165 1.00 0.00 C ATOM 1994 C ARG A 121 -34.477 -3.494 7.442 1.00 0.00 C ATOM 1995 O ARG A 121 -35.046 -3.617 8.522 1.00 0.00 O ATOM 1996 CB ARG A 121 -35.853 -4.487 5.529 1.00 0.00 C ATOM 1997 CG ARG A 121 -34.806 -5.584 5.241 1.00 0.00 C ATOM 1998 CD ARG A 121 -35.355 -6.745 4.397 1.00 0.00 C ATOM 1999 NE ARG A 121 -36.502 -7.407 5.042 1.00 0.00 N ATOM 2000 CZ ARG A 121 -37.591 -7.859 4.400 1.00 0.00 C ATOM 2001 NH1 ARG A 121 -37.762 -7.640 3.103 1.00 0.00 N ATOM 2002 NH2 ARG A 121 -38.532 -8.495 5.077 1.00 0.00 N ATOM 0 H ARG A 121 -34.214 -2.960 4.359 1.00 0.00 H new ATOM 0 HA ARG A 121 -36.137 -2.556 6.451 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -36.612 -4.898 6.194 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -36.353 -4.231 4.595 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -33.957 -5.138 4.723 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -34.433 -5.977 6.187 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -35.657 -6.370 3.419 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -34.564 -7.475 4.228 1.00 0.00 H new ATOM 0 HE ARG A 121 -36.466 -7.532 6.054 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -37.060 -7.120 2.577 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -38.596 -7.991 2.632 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -38.428 -8.640 6.081 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -39.362 -8.841 4.595 1.00 0.00 H new ATOM 2016 N LEU A 122 -33.142 -3.600 7.293 1.00 0.00 N ATOM 2017 CA LEU A 122 -32.208 -3.829 8.418 1.00 0.00 C ATOM 2018 C LEU A 122 -32.182 -2.586 9.322 1.00 0.00 C ATOM 2019 O LEU A 122 -32.139 -2.691 10.556 1.00 0.00 O ATOM 2020 CB LEU A 122 -30.780 -4.128 7.874 1.00 0.00 C ATOM 2021 CG LEU A 122 -29.711 -4.602 8.909 1.00 0.00 C ATOM 2022 CD1 LEU A 122 -30.111 -5.956 9.548 1.00 0.00 C ATOM 2023 CD2 LEU A 122 -28.307 -4.679 8.256 1.00 0.00 C ATOM 0 H LEU A 122 -32.678 -3.529 6.388 1.00 0.00 H new ATOM 0 HA LEU A 122 -32.545 -4.688 8.998 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -30.865 -4.892 7.101 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -30.406 -3.226 7.390 1.00 0.00 H new ATOM 0 HG LEU A 122 -29.667 -3.863 9.709 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -29.348 -6.260 10.264 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -31.067 -5.848 10.061 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -30.200 -6.714 8.769 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -27.579 -5.011 8.996 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -28.330 -5.386 7.427 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -28.024 -3.694 7.885 1.00 0.00 H new ATOM 2035 N GLN A 123 -32.216 -1.414 8.665 1.00 0.00 N ATOM 2036 CA GLN A 123 -32.247 -0.104 9.333 1.00 0.00 C ATOM 2037 C GLN A 123 -33.631 0.097 10.001 1.00 0.00 C ATOM 2038 O GLN A 123 -33.725 0.567 11.142 1.00 0.00 O ATOM 2039 CB GLN A 123 -31.935 1.028 8.283 1.00 0.00 C ATOM 2040 CG GLN A 123 -31.194 2.277 8.828 1.00 0.00 C ATOM 2041 CD GLN A 123 -31.953 3.025 9.934 1.00 0.00 C ATOM 2042 OE1 GLN A 123 -31.762 2.761 11.122 1.00 0.00 O ATOM 2043 NE2 GLN A 123 -32.817 3.948 9.554 1.00 0.00 N ATOM 0 H GLN A 123 -32.223 -1.350 7.647 1.00 0.00 H new ATOM 0 HA GLN A 123 -31.486 -0.056 10.112 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -31.336 0.597 7.481 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -32.876 1.353 7.839 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -30.222 1.970 9.214 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -31.007 2.964 8.003 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -32.952 4.143 8.562 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -33.350 4.466 10.253 1.00 0.00 H new