USER MOD reduce.3.24.130724 H: found=0, std=0, add=755, rem=0, adj=18 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 171:sc= -0.434 (180deg=-0.546) 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+ -109:sc= -0.869 (180deg=-1.9) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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) USER MOD Single : A 52 GLN : amide:sc= -1.34 K(o=-1.3,f=-0.0042) 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 X(o=0,f=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -153:sc= 0.00225 (180deg=-0.111) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc=-0.00513 USER MOD Single : A 84 TYR OH : rot 30:sc= -0.0309 USER MOD Single : A 87 SER OG : rot -10:sc= 0.22 USER MOD Single : A 88 CYS SG : rot 84:sc= 0.577 USER MOD Single : A 106 THR OG1 : rot -28:sc= 0.00637 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.018) USER MOD Single : A 115 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0158) USER MOD Single : A 120 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0603) USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -7.450 26.223 -16.083 1.00 0.00 N ATOM 297 CA ARG A 22 -8.614 26.148 -16.969 1.00 0.00 C ATOM 298 C ARG A 22 -9.890 26.249 -16.108 1.00 0.00 C ATOM 299 O ARG A 22 -9.870 25.823 -14.947 1.00 0.00 O ATOM 300 CB ARG A 22 -8.618 24.831 -17.817 1.00 0.00 C ATOM 301 CG ARG A 22 -8.876 23.497 -17.043 1.00 0.00 C ATOM 302 CD ARG A 22 -7.671 22.996 -16.218 1.00 0.00 C ATOM 303 NE ARG A 22 -6.504 22.698 -17.077 1.00 0.00 N ATOM 304 CZ ARG A 22 -5.425 21.974 -16.723 1.00 0.00 C ATOM 305 NH1 ARG A 22 -5.345 21.382 -15.537 1.00 0.00 N ATOM 306 NH2 ARG A 22 -4.430 21.837 -17.584 1.00 0.00 N ATOM 0 HA ARG A 22 -8.574 26.974 -17.679 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.379 24.927 -18.591 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -7.656 24.750 -18.324 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -9.725 23.637 -16.375 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.158 22.724 -17.759 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -7.396 23.750 -15.480 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -7.955 22.100 -15.667 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.518 23.076 -18.024 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -6.112 21.470 -14.870 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -4.517 20.839 -15.293 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -4.486 22.277 -18.503 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -3.607 21.291 -17.329 1.00 0.00 H new ATOM 320 N PRO A 23 -11.000 26.851 -16.626 1.00 0.00 N ATOM 321 CA PRO A 23 -12.286 26.850 -15.906 1.00 0.00 C ATOM 322 C PRO A 23 -12.954 25.459 -15.969 1.00 0.00 C ATOM 323 O PRO A 23 -13.564 25.096 -16.987 1.00 0.00 O ATOM 324 CB PRO A 23 -13.110 27.948 -16.629 1.00 0.00 C ATOM 325 CG PRO A 23 -12.560 27.975 -18.027 1.00 0.00 C ATOM 326 CD PRO A 23 -11.090 27.596 -17.913 1.00 0.00 C ATOM 0 HA PRO A 23 -12.188 27.056 -14.840 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -14.174 27.712 -16.626 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -12.997 28.915 -16.140 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -13.094 27.274 -18.669 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -12.674 28.964 -18.471 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -10.772 26.978 -18.753 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -10.451 28.479 -17.907 1.00 0.00 H new ATOM 334 N MET A 24 -12.745 24.659 -14.897 1.00 0.00 N ATOM 335 CA MET A 24 -13.502 23.409 -14.653 1.00 0.00 C ATOM 336 C MET A 24 -14.997 23.762 -14.645 1.00 0.00 C ATOM 337 O MET A 24 -15.382 24.745 -14.006 1.00 0.00 O ATOM 338 CB MET A 24 -13.095 22.739 -13.298 1.00 0.00 C ATOM 339 CG MET A 24 -11.647 22.213 -13.216 1.00 0.00 C ATOM 340 SD MET A 24 -10.382 23.502 -13.303 1.00 0.00 S ATOM 341 CE MET A 24 -10.798 24.535 -11.895 1.00 0.00 C ATOM 0 H MET A 24 -12.049 24.861 -14.179 1.00 0.00 H new ATOM 0 HA MET A 24 -13.277 22.689 -15.440 1.00 0.00 H new ATOM 0 HB2 MET A 24 -13.244 23.463 -12.497 1.00 0.00 H new ATOM 0 HB3 MET A 24 -13.774 21.908 -13.107 1.00 0.00 H new ATOM 0 HG2 MET A 24 -11.525 21.663 -12.283 1.00 0.00 H new ATOM 0 HG3 MET A 24 -11.484 21.504 -14.028 1.00 0.00 H new ATOM 0 HE1 MET A 24 -10.009 25.270 -11.737 1.00 0.00 H new ATOM 0 HE2 MET A 24 -11.740 25.049 -12.086 1.00 0.00 H new ATOM 0 HE3 MET A 24 -10.898 23.914 -11.005 1.00 0.00 H new ATOM 351 N SER A 25 -15.807 22.968 -15.365 1.00 0.00 N ATOM 352 CA SER A 25 -17.190 23.335 -15.713 1.00 0.00 C ATOM 353 C SER A 25 -18.045 23.657 -14.464 1.00 0.00 C ATOM 354 O SER A 25 -18.129 22.846 -13.531 1.00 0.00 O ATOM 355 CB SER A 25 -17.814 22.192 -16.541 1.00 0.00 C ATOM 356 OG SER A 25 -17.026 21.925 -17.694 1.00 0.00 O ATOM 0 H SER A 25 -15.522 22.056 -15.721 1.00 0.00 H new ATOM 0 HA SER A 25 -17.169 24.249 -16.306 1.00 0.00 H new ATOM 0 HB2 SER A 25 -17.891 21.293 -15.930 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.827 22.462 -16.840 1.00 0.00 H new ATOM 0 HG SER A 25 -17.434 21.197 -18.208 1.00 0.00 H new ATOM 362 N TYR A 26 -18.710 24.837 -14.490 1.00 0.00 N ATOM 363 CA TYR A 26 -19.384 25.414 -13.307 1.00 0.00 C ATOM 364 C TYR A 26 -20.542 24.534 -12.826 1.00 0.00 C ATOM 365 O TYR A 26 -20.795 24.476 -11.637 1.00 0.00 O ATOM 366 CB TYR A 26 -19.867 26.880 -13.568 1.00 0.00 C ATOM 367 CG TYR A 26 -20.865 27.049 -14.735 1.00 0.00 C ATOM 368 CD1 TYR A 26 -20.423 27.364 -16.023 1.00 0.00 C ATOM 369 CD2 TYR A 26 -22.248 26.904 -14.550 1.00 0.00 C ATOM 370 CE1 TYR A 26 -21.307 27.509 -17.074 1.00 0.00 C ATOM 371 CE2 TYR A 26 -23.134 27.050 -15.601 1.00 0.00 C ATOM 372 CZ TYR A 26 -22.659 27.357 -16.860 1.00 0.00 C ATOM 373 OH TYR A 26 -23.543 27.502 -17.912 1.00 0.00 O ATOM 0 H TYR A 26 -18.793 25.412 -15.329 1.00 0.00 H new ATOM 0 HA TYR A 26 -18.641 25.448 -12.510 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -20.331 27.260 -12.657 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -18.994 27.503 -13.765 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -19.366 27.497 -16.200 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -22.628 26.673 -13.566 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -20.939 27.741 -18.062 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -24.194 26.924 -15.438 1.00 0.00 H new ATOM 0 HH TYR A 26 -24.459 27.362 -17.592 1.00 0.00 H new ATOM 383 N ASP A 27 -21.194 23.838 -13.772 1.00 0.00 N ATOM 384 CA ASP A 27 -22.345 22.947 -13.512 1.00 0.00 C ATOM 385 C ASP A 27 -21.949 21.756 -12.608 1.00 0.00 C ATOM 386 O ASP A 27 -22.702 21.366 -11.692 1.00 0.00 O ATOM 387 CB ASP A 27 -22.940 22.456 -14.859 1.00 0.00 C ATOM 388 CG ASP A 27 -21.921 21.710 -15.752 1.00 0.00 C ATOM 389 OD1 ASP A 27 -21.896 20.461 -15.741 1.00 0.00 O ATOM 390 OD2 ASP A 27 -21.126 22.378 -16.448 1.00 0.00 O ATOM 0 H ASP A 27 -20.934 23.877 -14.758 1.00 0.00 H new ATOM 0 HA ASP A 27 -23.106 23.513 -12.975 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -23.783 21.796 -14.655 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -23.332 23.313 -15.407 1.00 0.00 H new ATOM 395 N GLU A 28 -20.743 21.203 -12.857 1.00 0.00 N ATOM 396 CA GLU A 28 -20.164 20.133 -12.031 1.00 0.00 C ATOM 397 C GLU A 28 -19.802 20.698 -10.650 1.00 0.00 C ATOM 398 O GLU A 28 -19.979 20.019 -9.632 1.00 0.00 O ATOM 399 CB GLU A 28 -18.931 19.496 -12.755 1.00 0.00 C ATOM 400 CG GLU A 28 -18.330 18.210 -12.090 1.00 0.00 C ATOM 401 CD GLU A 28 -17.104 18.476 -11.192 1.00 0.00 C ATOM 402 OE1 GLU A 28 -15.959 18.461 -11.704 1.00 0.00 O ATOM 403 OE2 GLU A 28 -17.264 18.724 -9.979 1.00 0.00 O ATOM 0 H GLU A 28 -20.148 21.488 -13.635 1.00 0.00 H new ATOM 0 HA GLU A 28 -20.893 19.336 -11.887 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -19.222 19.250 -13.776 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -18.145 20.248 -12.820 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -19.105 17.727 -11.494 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -18.046 17.508 -12.874 1.00 0.00 H new ATOM 410 N LYS A 29 -19.321 21.965 -10.630 1.00 0.00 N ATOM 411 CA LYS A 29 -19.027 22.707 -9.385 1.00 0.00 C ATOM 412 C LYS A 29 -20.314 23.039 -8.602 1.00 0.00 C ATOM 413 O LYS A 29 -20.243 23.238 -7.394 1.00 0.00 O ATOM 414 CB LYS A 29 -18.201 24.012 -9.662 1.00 0.00 C ATOM 415 CG LYS A 29 -16.645 23.891 -9.609 1.00 0.00 C ATOM 416 CD LYS A 29 -15.981 23.424 -10.933 1.00 0.00 C ATOM 417 CE LYS A 29 -16.109 21.916 -11.205 1.00 0.00 C ATOM 418 NZ LYS A 29 -15.502 21.096 -10.137 1.00 0.00 N ATOM 0 H LYS A 29 -19.127 22.499 -11.477 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.415 22.049 -8.768 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -18.478 24.386 -10.648 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -18.507 24.767 -8.937 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -16.229 24.860 -9.333 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -16.376 23.191 -8.818 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -16.428 23.971 -11.763 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -14.924 23.689 -10.909 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -17.163 21.656 -11.304 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -15.632 21.680 -12.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -14.632 20.650 -10.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -15.273 21.701 -9.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -16.173 20.358 -9.842 1.00 0.00 H new ATOM 432 N ARG A 30 -21.472 23.115 -9.295 1.00 0.00 N ATOM 433 CA ARG A 30 -22.783 23.351 -8.650 1.00 0.00 C ATOM 434 C ARG A 30 -23.161 22.140 -7.794 1.00 0.00 C ATOM 435 O ARG A 30 -23.616 22.293 -6.663 1.00 0.00 O ATOM 436 CB ARG A 30 -23.902 23.628 -9.695 1.00 0.00 C ATOM 437 CG ARG A 30 -23.693 24.888 -10.561 1.00 0.00 C ATOM 438 CD ARG A 30 -23.640 26.186 -9.743 1.00 0.00 C ATOM 439 NE ARG A 30 -24.920 26.454 -9.083 1.00 0.00 N ATOM 440 CZ ARG A 30 -25.405 27.655 -8.774 1.00 0.00 C ATOM 441 NH1 ARG A 30 -24.701 28.763 -8.975 1.00 0.00 N ATOM 442 NH2 ARG A 30 -26.620 27.741 -8.268 1.00 0.00 N ATOM 0 H ARG A 30 -21.525 23.015 -10.309 1.00 0.00 H new ATOM 0 HA ARG A 30 -22.691 24.237 -8.022 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -23.984 22.763 -10.354 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -24.853 23.721 -9.170 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -22.765 24.784 -11.124 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -24.501 24.958 -11.289 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -22.851 26.114 -8.995 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -23.384 27.020 -10.397 1.00 0.00 H new ATOM 0 HE ARG A 30 -25.492 25.646 -8.838 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -23.765 28.707 -9.375 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -25.097 29.670 -8.729 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -27.172 26.896 -8.119 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -27.008 28.653 -8.025 1.00 0.00 H new ATOM 456 N GLN A 31 -22.944 20.933 -8.356 1.00 0.00 N ATOM 457 CA GLN A 31 -23.121 19.665 -7.618 1.00 0.00 C ATOM 458 C GLN A 31 -22.069 19.553 -6.478 1.00 0.00 C ATOM 459 O GLN A 31 -22.383 19.144 -5.355 1.00 0.00 O ATOM 460 CB GLN A 31 -23.005 18.466 -8.595 1.00 0.00 C ATOM 461 CG GLN A 31 -23.391 17.101 -7.983 1.00 0.00 C ATOM 462 CD GLN A 31 -23.188 15.913 -8.933 1.00 0.00 C ATOM 463 OE1 GLN A 31 -22.271 15.901 -9.752 1.00 0.00 O ATOM 464 NE2 GLN A 31 -24.062 14.922 -8.858 1.00 0.00 N ATOM 0 H GLN A 31 -22.644 20.810 -9.323 1.00 0.00 H new ATOM 0 HA GLN A 31 -24.113 19.650 -7.167 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -23.641 18.655 -9.460 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -21.980 18.409 -8.960 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -22.800 16.938 -7.082 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -24.437 17.134 -7.677 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -24.814 14.956 -8.169 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -23.984 14.124 -9.489 1.00 0.00 H new ATOM 473 N LEU A 32 -20.834 19.972 -6.800 1.00 0.00 N ATOM 474 CA LEU A 32 -19.671 19.990 -5.881 1.00 0.00 C ATOM 475 C LEU A 32 -19.863 21.038 -4.754 1.00 0.00 C ATOM 476 O LEU A 32 -19.259 20.922 -3.685 1.00 0.00 O ATOM 477 CB LEU A 32 -18.385 20.224 -6.739 1.00 0.00 C ATOM 478 CG LEU A 32 -16.999 20.405 -6.003 1.00 0.00 C ATOM 479 CD1 LEU A 32 -15.843 19.731 -6.781 1.00 0.00 C ATOM 480 CD2 LEU A 32 -16.670 21.902 -5.771 1.00 0.00 C ATOM 0 H LEU A 32 -20.605 20.318 -7.732 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.570 19.036 -5.363 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.287 19.381 -7.423 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -18.553 21.112 -7.349 1.00 0.00 H new ATOM 0 HG LEU A 32 -17.096 19.914 -5.035 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.907 19.878 -6.242 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.043 18.664 -6.877 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.764 20.176 -7.773 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.710 21.989 -5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.620 22.417 -6.731 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -17.448 22.355 -5.156 1.00 0.00 H new ATOM 492 N SER A 33 -20.741 22.037 -4.990 1.00 0.00 N ATOM 493 CA SER A 33 -21.059 23.095 -4.008 1.00 0.00 C ATOM 494 C SER A 33 -21.865 22.537 -2.822 1.00 0.00 C ATOM 495 O SER A 33 -21.824 23.110 -1.730 1.00 0.00 O ATOM 496 CB SER A 33 -21.825 24.252 -4.682 1.00 0.00 C ATOM 497 OG SER A 33 -21.934 25.383 -3.823 1.00 0.00 O ATOM 0 H SER A 33 -21.250 22.132 -5.869 1.00 0.00 H new ATOM 0 HA SER A 33 -20.116 23.480 -3.621 1.00 0.00 H new ATOM 0 HB2 SER A 33 -21.314 24.541 -5.600 1.00 0.00 H new ATOM 0 HB3 SER A 33 -22.821 23.913 -4.965 1.00 0.00 H new ATOM 0 HG SER A 33 -22.423 26.097 -4.283 1.00 0.00 H new ATOM 503 N LEU A 34 -22.605 21.429 -3.057 1.00 0.00 N ATOM 504 CA LEU A 34 -23.310 20.679 -1.990 1.00 0.00 C ATOM 505 C LEU A 34 -22.289 20.077 -1.002 1.00 0.00 C ATOM 506 O LEU A 34 -22.573 19.942 0.193 1.00 0.00 O ATOM 507 CB LEU A 34 -24.219 19.557 -2.594 1.00 0.00 C ATOM 508 CG LEU A 34 -25.588 19.995 -3.245 1.00 0.00 C ATOM 509 CD1 LEU A 34 -25.406 20.993 -4.410 1.00 0.00 C ATOM 510 CD2 LEU A 34 -26.400 18.754 -3.705 1.00 0.00 C ATOM 0 H LEU A 34 -22.730 21.030 -3.987 1.00 0.00 H new ATOM 0 HA LEU A 34 -23.954 21.374 -1.452 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -23.641 19.028 -3.352 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.438 18.840 -1.803 1.00 0.00 H new ATOM 0 HG LEU A 34 -26.149 20.518 -2.471 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -26.381 21.258 -4.818 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -24.909 21.892 -4.045 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -24.799 20.534 -5.190 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -27.340 19.079 -4.151 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -25.823 18.195 -4.442 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -26.607 18.116 -2.846 1.00 0.00 H new ATOM 522 N ASP A 35 -21.095 19.729 -1.523 1.00 0.00 N ATOM 523 CA ASP A 35 -19.985 19.177 -0.710 1.00 0.00 C ATOM 524 C ASP A 35 -19.289 20.296 0.082 1.00 0.00 C ATOM 525 O ASP A 35 -18.847 20.086 1.220 1.00 0.00 O ATOM 526 CB ASP A 35 -18.966 18.440 -1.609 1.00 0.00 C ATOM 527 CG ASP A 35 -17.907 17.659 -0.809 1.00 0.00 C ATOM 528 OD1 ASP A 35 -16.803 18.193 -0.565 1.00 0.00 O ATOM 529 OD2 ASP A 35 -18.201 16.513 -0.389 1.00 0.00 O ATOM 0 H ASP A 35 -20.871 19.821 -2.514 1.00 0.00 H new ATOM 0 HA ASP A 35 -20.403 18.460 -0.003 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -19.500 17.750 -2.263 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -18.466 19.165 -2.251 1.00 0.00 H new ATOM 534 N ILE A 36 -19.190 21.483 -0.541 1.00 0.00 N ATOM 535 CA ILE A 36 -18.669 22.704 0.119 1.00 0.00 C ATOM 536 C ILE A 36 -19.621 23.133 1.265 1.00 0.00 C ATOM 537 O ILE A 36 -19.186 23.653 2.301 1.00 0.00 O ATOM 538 CB ILE A 36 -18.522 23.889 -0.913 1.00 0.00 C ATOM 539 CG1 ILE A 36 -17.644 23.464 -2.137 1.00 0.00 C ATOM 540 CG2 ILE A 36 -17.950 25.160 -0.239 1.00 0.00 C ATOM 541 CD1 ILE A 36 -17.464 24.530 -3.215 1.00 0.00 C ATOM 0 H ILE A 36 -19.466 21.628 -1.512 1.00 0.00 H new ATOM 0 HA ILE A 36 -17.684 22.474 0.525 1.00 0.00 H new ATOM 0 HB ILE A 36 -19.520 24.129 -1.279 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -16.660 23.171 -1.772 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.091 22.581 -2.594 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -17.862 25.956 -0.979 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -18.618 25.480 0.561 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -16.966 24.940 0.176 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -16.841 24.135 -4.017 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -18.438 24.809 -3.617 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -16.985 25.408 -2.782 1.00 0.00 H new ATOM 553 N ASN A 37 -20.928 22.881 1.049 1.00 0.00 N ATOM 554 CA ASN A 37 -22.008 23.242 1.991 1.00 0.00 C ATOM 555 C ASN A 37 -21.966 22.355 3.268 1.00 0.00 C ATOM 556 O ASN A 37 -22.592 22.695 4.276 1.00 0.00 O ATOM 557 CB ASN A 37 -23.375 23.114 1.258 1.00 0.00 C ATOM 558 CG ASN A 37 -24.570 23.661 2.051 1.00 0.00 C ATOM 559 OD1 ASN A 37 -24.924 24.836 1.936 1.00 0.00 O ATOM 560 ND2 ASN A 37 -25.208 22.814 2.844 1.00 0.00 N ATOM 0 H ASN A 37 -21.267 22.416 0.207 1.00 0.00 H new ATOM 0 HA ASN A 37 -21.870 24.272 2.321 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -23.314 23.641 0.306 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -23.555 22.063 1.030 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -26.016 23.128 3.381 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -24.891 21.847 2.918 1.00 0.00 H new ATOM 567 N LYS A 38 -21.194 21.243 3.217 1.00 0.00 N ATOM 568 CA LYS A 38 -21.075 20.284 4.336 1.00 0.00 C ATOM 569 C LYS A 38 -20.222 20.861 5.485 1.00 0.00 C ATOM 570 O LYS A 38 -20.332 20.400 6.628 1.00 0.00 O ATOM 571 CB LYS A 38 -20.465 18.935 3.856 1.00 0.00 C ATOM 572 CG LYS A 38 -21.250 18.210 2.736 1.00 0.00 C ATOM 573 CD LYS A 38 -22.725 17.931 3.095 1.00 0.00 C ATOM 574 CE LYS A 38 -22.888 17.060 4.353 1.00 0.00 C ATOM 575 NZ LYS A 38 -24.321 16.897 4.726 1.00 0.00 N ATOM 0 H LYS A 38 -20.639 20.988 2.400 1.00 0.00 H new ATOM 0 HA LYS A 38 -22.083 20.102 4.710 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -19.450 19.120 3.503 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -20.387 18.266 4.713 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -21.214 18.814 1.829 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -20.755 17.266 2.510 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -23.241 18.879 3.248 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -23.210 17.437 2.253 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -22.443 16.080 4.178 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -22.345 17.513 5.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -24.393 16.305 5.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -24.738 17.830 4.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -24.834 16.442 3.944 1.00 0.00 H new ATOM 589 N LEU A 39 -19.376 21.863 5.165 1.00 0.00 N ATOM 590 CA LEU A 39 -18.569 22.582 6.166 1.00 0.00 C ATOM 591 C LEU A 39 -19.507 23.322 7.143 1.00 0.00 C ATOM 592 O LEU A 39 -20.321 24.115 6.684 1.00 0.00 O ATOM 593 CB LEU A 39 -17.583 23.583 5.476 1.00 0.00 C ATOM 594 CG LEU A 39 -16.261 22.962 4.890 1.00 0.00 C ATOM 595 CD1 LEU A 39 -15.451 22.235 5.996 1.00 0.00 C ATOM 596 CD2 LEU A 39 -16.524 22.028 3.681 1.00 0.00 C ATOM 0 H LEU A 39 -19.236 22.193 4.210 1.00 0.00 H new ATOM 0 HA LEU A 39 -17.969 21.862 6.722 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -18.114 24.084 4.667 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -17.310 24.350 6.201 1.00 0.00 H new ATOM 0 HG LEU A 39 -15.662 23.792 4.515 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -14.542 21.815 5.565 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -15.186 22.945 6.779 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -16.055 21.434 6.422 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -15.577 21.628 3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -17.170 21.206 3.990 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -17.009 22.592 2.884 1.00 0.00 H new ATOM 608 N PRO A 40 -19.398 23.077 8.501 1.00 0.00 N ATOM 609 CA PRO A 40 -20.316 23.670 9.521 1.00 0.00 C ATOM 610 C PRO A 40 -20.247 25.212 9.516 1.00 0.00 C ATOM 611 O PRO A 40 -19.240 25.745 9.095 1.00 0.00 O ATOM 612 CB PRO A 40 -19.816 23.066 10.872 1.00 0.00 C ATOM 613 CG PRO A 40 -18.991 21.874 10.481 1.00 0.00 C ATOM 614 CD PRO A 40 -18.360 22.234 9.154 1.00 0.00 C ATOM 0 HA PRO A 40 -21.364 23.439 9.329 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -19.224 23.789 11.433 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -20.652 22.776 11.509 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -18.230 21.661 11.232 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -19.610 20.981 10.391 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -17.425 22.778 9.287 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -18.131 21.347 8.563 1.00 0.00 H new ATOM 622 N GLY A 41 -21.293 25.877 10.044 1.00 0.00 N ATOM 623 CA GLY A 41 -21.554 27.328 9.853 1.00 0.00 C ATOM 624 C GLY A 41 -20.351 28.293 9.914 1.00 0.00 C ATOM 625 O GLY A 41 -20.189 29.140 9.023 1.00 0.00 O ATOM 0 H GLY A 41 -21.995 25.419 10.625 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -22.036 27.456 8.884 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -22.272 27.641 10.611 1.00 0.00 H new ATOM 629 N GLU A 42 -19.504 28.163 10.952 1.00 0.00 N ATOM 630 CA GLU A 42 -18.313 29.050 11.143 1.00 0.00 C ATOM 631 C GLU A 42 -17.206 28.736 10.109 1.00 0.00 C ATOM 632 O GLU A 42 -16.418 29.620 9.742 1.00 0.00 O ATOM 633 CB GLU A 42 -17.751 28.974 12.603 1.00 0.00 C ATOM 634 CG GLU A 42 -17.116 27.626 13.024 1.00 0.00 C ATOM 635 CD GLU A 42 -18.114 26.457 13.035 1.00 0.00 C ATOM 636 OE1 GLU A 42 -18.994 26.433 13.921 1.00 0.00 O ATOM 637 OE2 GLU A 42 -18.055 25.601 12.132 1.00 0.00 O ATOM 0 H GLU A 42 -19.612 27.455 11.679 1.00 0.00 H new ATOM 0 HA GLU A 42 -18.651 30.073 10.978 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -17.002 29.757 12.723 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -18.563 29.201 13.294 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.299 27.390 12.343 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -16.682 27.732 14.018 1.00 0.00 H new ATOM 644 N LYS A 43 -17.162 27.471 9.646 1.00 0.00 N ATOM 645 CA LYS A 43 -16.244 27.028 8.576 1.00 0.00 C ATOM 646 C LYS A 43 -16.830 27.377 7.205 1.00 0.00 C ATOM 647 O LYS A 43 -16.084 27.693 6.284 1.00 0.00 O ATOM 648 CB LYS A 43 -15.983 25.493 8.662 1.00 0.00 C ATOM 649 CG LYS A 43 -15.460 25.005 10.028 1.00 0.00 C ATOM 650 CD LYS A 43 -14.189 25.755 10.479 1.00 0.00 C ATOM 651 CE LYS A 43 -13.735 25.349 11.885 1.00 0.00 C ATOM 652 NZ LYS A 43 -12.560 26.138 12.334 1.00 0.00 N ATOM 0 H LYS A 43 -17.762 26.727 10.003 1.00 0.00 H new ATOM 0 HA LYS A 43 -15.294 27.546 8.708 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -16.910 24.967 8.434 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -15.262 25.217 7.892 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -16.240 25.135 10.779 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -15.247 23.938 9.971 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.385 25.559 9.770 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -14.378 26.828 10.458 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.557 25.489 12.587 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -13.485 24.288 11.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.283 25.835 13.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.768 25.985 11.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -12.806 27.148 12.350 1.00 0.00 H new ATOM 666 N LEU A 44 -18.176 27.353 7.105 1.00 0.00 N ATOM 667 CA LEU A 44 -18.912 27.637 5.865 1.00 0.00 C ATOM 668 C LEU A 44 -18.677 29.087 5.462 1.00 0.00 C ATOM 669 O LEU A 44 -18.279 29.370 4.336 1.00 0.00 O ATOM 670 CB LEU A 44 -20.433 27.386 6.050 1.00 0.00 C ATOM 671 CG LEU A 44 -21.306 27.571 4.766 1.00 0.00 C ATOM 672 CD1 LEU A 44 -21.032 26.456 3.731 1.00 0.00 C ATOM 673 CD2 LEU A 44 -22.812 27.672 5.105 1.00 0.00 C ATOM 0 H LEU A 44 -18.784 27.133 7.894 1.00 0.00 H new ATOM 0 HA LEU A 44 -18.549 26.969 5.084 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -20.574 26.371 6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -20.804 28.061 6.821 1.00 0.00 H new ATOM 0 HG LEU A 44 -21.015 28.518 4.312 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -21.655 26.615 2.851 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -19.982 26.479 3.441 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -21.266 25.486 4.170 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -23.384 27.800 4.186 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -23.134 26.760 5.609 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -22.981 28.527 5.760 1.00 0.00 H new ATOM 685 N GLY A 45 -18.884 29.983 6.444 1.00 0.00 N ATOM 686 CA GLY A 45 -18.695 31.413 6.264 1.00 0.00 C ATOM 687 C GLY A 45 -17.249 31.802 6.013 1.00 0.00 C ATOM 688 O GLY A 45 -16.997 32.851 5.442 1.00 0.00 O ATOM 0 H GLY A 45 -19.188 29.724 7.383 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -19.305 31.750 5.426 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -19.055 31.934 7.151 1.00 0.00 H new ATOM 692 N ARG A 46 -16.310 30.919 6.410 1.00 0.00 N ATOM 693 CA ARG A 46 -14.863 31.107 6.183 1.00 0.00 C ATOM 694 C ARG A 46 -14.490 30.721 4.733 1.00 0.00 C ATOM 695 O ARG A 46 -13.733 31.439 4.057 1.00 0.00 O ATOM 696 CB ARG A 46 -14.064 30.270 7.213 1.00 0.00 C ATOM 697 CG ARG A 46 -12.529 30.410 7.105 1.00 0.00 C ATOM 698 CD ARG A 46 -11.782 29.695 8.241 1.00 0.00 C ATOM 699 NE ARG A 46 -10.324 29.849 8.124 1.00 0.00 N ATOM 700 CZ ARG A 46 -9.575 30.770 8.760 1.00 0.00 C ATOM 701 NH1 ARG A 46 -10.127 31.650 9.581 1.00 0.00 N ATOM 702 NH2 ARG A 46 -8.262 30.780 8.589 1.00 0.00 N ATOM 0 H ARG A 46 -16.535 30.053 6.899 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.608 32.158 6.320 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -14.372 30.563 8.217 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.329 29.220 7.092 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.199 30.005 6.148 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -12.264 31.467 7.112 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -12.113 30.094 9.200 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -12.037 28.635 8.232 1.00 0.00 H new ATOM 0 HE ARG A 46 -9.837 29.200 7.506 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -11.134 31.637 9.740 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.545 32.341 10.055 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -7.822 30.092 7.978 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -7.691 31.476 9.069 1.00 0.00 H new ATOM 716 N VAL A 47 -15.071 29.600 4.259 1.00 0.00 N ATOM 717 CA VAL A 47 -14.904 29.122 2.869 1.00 0.00 C ATOM 718 C VAL A 47 -15.575 30.108 1.889 1.00 0.00 C ATOM 719 O VAL A 47 -15.099 30.319 0.778 1.00 0.00 O ATOM 720 CB VAL A 47 -15.488 27.661 2.676 1.00 0.00 C ATOM 721 CG1 VAL A 47 -15.359 27.184 1.212 1.00 0.00 C ATOM 722 CG2 VAL A 47 -14.806 26.648 3.631 1.00 0.00 C ATOM 0 H VAL A 47 -15.669 29.000 4.828 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.836 29.075 2.656 1.00 0.00 H new ATOM 0 HB VAL A 47 -16.548 27.709 2.925 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -15.770 26.179 1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -15.908 27.862 0.559 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.308 27.174 0.924 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.230 25.656 3.472 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -13.735 26.621 3.429 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -14.973 26.953 4.664 1.00 0.00 H new ATOM 732 N VAL A 48 -16.679 30.719 2.339 1.00 0.00 N ATOM 733 CA VAL A 48 -17.410 31.751 1.591 1.00 0.00 C ATOM 734 C VAL A 48 -16.669 33.104 1.666 1.00 0.00 C ATOM 735 O VAL A 48 -16.693 33.875 0.701 1.00 0.00 O ATOM 736 CB VAL A 48 -18.890 31.883 2.133 1.00 0.00 C ATOM 737 CG1 VAL A 48 -19.590 33.156 1.616 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.724 30.621 1.776 1.00 0.00 C ATOM 0 H VAL A 48 -17.095 30.507 3.246 1.00 0.00 H new ATOM 0 HA VAL A 48 -17.458 31.452 0.544 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.824 31.967 3.218 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.603 33.202 2.015 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -19.032 34.035 1.940 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -19.630 33.132 0.527 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.738 30.735 2.159 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.756 30.501 0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.263 29.741 2.225 1.00 0.00 H new ATOM 748 N HIS A 49 -15.988 33.367 2.804 1.00 0.00 N ATOM 749 CA HIS A 49 -15.318 34.659 3.060 1.00 0.00 C ATOM 750 C HIS A 49 -14.241 34.954 2.008 1.00 0.00 C ATOM 751 O HIS A 49 -14.180 36.059 1.496 1.00 0.00 O ATOM 752 CB HIS A 49 -14.690 34.699 4.475 1.00 0.00 C ATOM 753 CG HIS A 49 -14.117 36.043 4.850 1.00 0.00 C ATOM 754 ND1 HIS A 49 -12.795 36.269 5.168 1.00 0.00 N ATOM 755 CD2 HIS A 49 -14.736 37.247 4.952 1.00 0.00 C ATOM 756 CE1 HIS A 49 -12.656 37.569 5.446 1.00 0.00 C ATOM 757 NE2 HIS A 49 -13.803 38.209 5.329 1.00 0.00 N ATOM 0 H HIS A 49 -15.889 32.695 3.564 1.00 0.00 H new ATOM 0 HA HIS A 49 -16.086 35.430 2.996 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -15.449 34.421 5.207 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -13.901 33.949 4.533 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -15.785 37.429 4.770 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -11.724 38.035 5.730 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -13.972 39.203 5.483 1.00 0.00 H new ATOM 765 N ILE A 50 -13.417 33.935 1.694 1.00 0.00 N ATOM 766 CA ILE A 50 -12.326 34.045 0.700 1.00 0.00 C ATOM 767 C ILE A 50 -12.886 34.356 -0.708 1.00 0.00 C ATOM 768 O ILE A 50 -12.258 35.072 -1.485 1.00 0.00 O ATOM 769 CB ILE A 50 -11.446 32.732 0.646 1.00 0.00 C ATOM 770 CG1 ILE A 50 -12.293 31.508 0.151 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.806 32.445 2.035 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.526 30.227 -0.076 1.00 0.00 C ATOM 0 H ILE A 50 -13.487 33.011 2.121 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.689 34.870 1.020 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.641 32.890 -0.072 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.078 31.314 0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.786 31.784 -0.781 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -10.204 31.538 1.978 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -10.172 33.283 2.324 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.593 32.312 2.778 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.210 29.449 -0.416 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.758 30.392 -0.832 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -11.056 29.914 0.856 1.00 0.00 H new ATOM 784 N ILE A 51 -14.094 33.823 -0.994 1.00 0.00 N ATOM 785 CA ILE A 51 -14.785 33.996 -2.285 1.00 0.00 C ATOM 786 C ILE A 51 -15.210 35.471 -2.457 1.00 0.00 C ATOM 787 O ILE A 51 -14.883 36.104 -3.460 1.00 0.00 O ATOM 788 CB ILE A 51 -16.045 33.043 -2.376 1.00 0.00 C ATOM 789 CG1 ILE A 51 -15.629 31.550 -2.176 1.00 0.00 C ATOM 790 CG2 ILE A 51 -16.823 33.219 -3.706 1.00 0.00 C ATOM 791 CD1 ILE A 51 -16.794 30.575 -2.077 1.00 0.00 C ATOM 0 H ILE A 51 -14.619 33.256 -0.328 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.099 33.728 -3.089 1.00 0.00 H new ATOM 0 HB ILE A 51 -16.719 33.331 -1.569 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -14.991 31.250 -3.007 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -15.029 31.472 -1.269 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.678 32.543 -3.719 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -17.172 34.248 -3.790 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -16.166 32.990 -4.545 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -16.411 29.564 -1.939 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -17.422 30.844 -1.228 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.384 30.618 -2.993 1.00 0.00 H new ATOM 803 N GLN A 52 -15.897 36.008 -1.430 1.00 0.00 N ATOM 804 CA GLN A 52 -16.466 37.371 -1.460 1.00 0.00 C ATOM 805 C GLN A 52 -15.419 38.461 -1.119 1.00 0.00 C ATOM 806 O GLN A 52 -15.660 39.645 -1.361 1.00 0.00 O ATOM 807 CB GLN A 52 -17.692 37.467 -0.520 1.00 0.00 C ATOM 808 CG GLN A 52 -17.453 37.119 0.958 1.00 0.00 C ATOM 809 CD GLN A 52 -18.682 37.424 1.822 1.00 0.00 C ATOM 810 OE1 GLN A 52 -18.785 38.498 2.402 1.00 0.00 O ATOM 811 NE2 GLN A 52 -19.642 36.513 1.861 1.00 0.00 N ATOM 0 H GLN A 52 -16.073 35.511 -0.557 1.00 0.00 H new ATOM 0 HA GLN A 52 -16.791 37.561 -2.483 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -18.083 38.483 -0.572 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -18.469 36.806 -0.905 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -17.200 36.062 1.046 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -16.598 37.683 1.330 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -19.526 35.628 1.367 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -20.498 36.696 2.385 1.00 0.00 H new ATOM 820 N ALA A 53 -14.260 38.051 -0.558 1.00 0.00 N ATOM 821 CA ALA A 53 -13.138 38.971 -0.268 1.00 0.00 C ATOM 822 C ALA A 53 -12.360 39.294 -1.558 1.00 0.00 C ATOM 823 O ALA A 53 -11.733 40.351 -1.658 1.00 0.00 O ATOM 824 CB ALA A 53 -12.202 38.378 0.799 1.00 0.00 C ATOM 0 H ALA A 53 -14.077 37.083 -0.296 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.551 39.899 0.127 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -11.386 39.074 0.994 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.761 38.207 1.719 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.795 37.432 0.441 1.00 0.00 H new ATOM 830 N ARG A 54 -12.404 38.359 -2.523 1.00 0.00 N ATOM 831 CA ARG A 54 -11.813 38.543 -3.862 1.00 0.00 C ATOM 832 C ARG A 54 -12.833 39.211 -4.798 1.00 0.00 C ATOM 833 O ARG A 54 -12.556 40.253 -5.404 1.00 0.00 O ATOM 834 CB ARG A 54 -11.372 37.172 -4.444 1.00 0.00 C ATOM 835 CG ARG A 54 -10.331 36.425 -3.586 1.00 0.00 C ATOM 836 CD ARG A 54 -10.051 35.000 -4.090 1.00 0.00 C ATOM 837 NE ARG A 54 -9.222 34.249 -3.125 1.00 0.00 N ATOM 838 CZ ARG A 54 -9.336 32.942 -2.853 1.00 0.00 C ATOM 839 NH1 ARG A 54 -10.202 32.174 -3.517 1.00 0.00 N ATOM 840 NH2 ARG A 54 -8.573 32.398 -1.921 1.00 0.00 N ATOM 0 H ARG A 54 -12.852 37.451 -2.397 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.937 39.186 -3.777 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.252 36.539 -4.560 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -10.959 37.329 -5.441 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -9.400 36.992 -3.579 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.684 36.378 -2.556 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -10.993 34.476 -4.250 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -9.543 35.045 -5.053 1.00 0.00 H new ATOM 0 HE ARG A 54 -8.502 34.769 -2.624 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -10.790 32.580 -4.245 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -10.276 31.181 -3.297 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -7.901 32.973 -1.412 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -8.656 31.403 -1.710 1.00 0.00 H new ATOM 854 N GLU A 55 -14.014 38.589 -4.890 1.00 0.00 N ATOM 855 CA GLU A 55 -15.100 39.017 -5.785 1.00 0.00 C ATOM 856 C GLU A 55 -16.046 39.970 -5.015 1.00 0.00 C ATOM 857 O GLU A 55 -16.824 39.506 -4.167 1.00 0.00 O ATOM 858 CB GLU A 55 -15.867 37.770 -6.324 1.00 0.00 C ATOM 859 CG GLU A 55 -14.957 36.619 -6.828 1.00 0.00 C ATOM 860 CD GLU A 55 -14.023 36.998 -7.993 1.00 0.00 C ATOM 861 OE1 GLU A 55 -12.870 37.421 -7.747 1.00 0.00 O ATOM 862 OE2 GLU A 55 -14.427 36.873 -9.168 1.00 0.00 O ATOM 0 H GLU A 55 -14.247 37.763 -4.339 1.00 0.00 H new ATOM 0 HA GLU A 55 -14.689 39.552 -6.642 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -16.511 37.386 -5.533 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -16.518 38.085 -7.140 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.350 36.263 -5.995 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -15.587 35.787 -7.142 1.00 0.00 H new ATOM 869 N PRO A 56 -16.007 41.319 -5.301 1.00 0.00 N ATOM 870 CA PRO A 56 -16.708 42.349 -4.478 1.00 0.00 C ATOM 871 C PRO A 56 -18.245 42.324 -4.634 1.00 0.00 C ATOM 872 O PRO A 56 -18.959 42.936 -3.832 1.00 0.00 O ATOM 873 CB PRO A 56 -16.103 43.676 -5.000 1.00 0.00 C ATOM 874 CG PRO A 56 -15.741 43.391 -6.428 1.00 0.00 C ATOM 875 CD PRO A 56 -15.299 41.942 -6.461 1.00 0.00 C ATOM 0 HA PRO A 56 -16.563 42.186 -3.410 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.820 44.494 -4.928 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -15.228 43.968 -4.420 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -16.593 43.555 -7.088 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.943 44.051 -6.768 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.574 41.462 -7.400 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -14.217 41.853 -6.363 1.00 0.00 H new ATOM 883 N SER A 57 -18.725 41.609 -5.665 1.00 0.00 N ATOM 884 CA SER A 57 -20.158 41.439 -5.951 1.00 0.00 C ATOM 885 C SER A 57 -20.857 40.650 -4.834 1.00 0.00 C ATOM 886 O SER A 57 -22.017 40.902 -4.510 1.00 0.00 O ATOM 887 CB SER A 57 -20.315 40.702 -7.299 1.00 0.00 C ATOM 888 OG SER A 57 -19.573 39.487 -7.304 1.00 0.00 O ATOM 0 H SER A 57 -18.121 41.127 -6.331 1.00 0.00 H new ATOM 0 HA SER A 57 -20.626 42.422 -6.006 1.00 0.00 H new ATOM 0 HB2 SER A 57 -21.369 40.490 -7.481 1.00 0.00 H new ATOM 0 HB3 SER A 57 -19.974 41.344 -8.111 1.00 0.00 H new ATOM 0 HG SER A 57 -19.689 39.037 -8.167 1.00 0.00 H new ATOM 894 N LEU A 58 -20.120 39.693 -4.251 1.00 0.00 N ATOM 895 CA LEU A 58 -20.627 38.796 -3.196 1.00 0.00 C ATOM 896 C LEU A 58 -20.328 39.337 -1.784 1.00 0.00 C ATOM 897 O LEU A 58 -20.804 38.766 -0.799 1.00 0.00 O ATOM 898 CB LEU A 58 -20.004 37.385 -3.391 1.00 0.00 C ATOM 899 CG LEU A 58 -20.388 36.640 -4.713 1.00 0.00 C ATOM 900 CD1 LEU A 58 -19.642 35.294 -4.854 1.00 0.00 C ATOM 901 CD2 LEU A 58 -21.919 36.437 -4.808 1.00 0.00 C ATOM 0 H LEU A 58 -19.147 39.516 -4.499 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.712 38.736 -3.283 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -18.919 37.481 -3.354 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -20.298 36.761 -2.547 1.00 0.00 H new ATOM 0 HG LEU A 58 -20.074 37.272 -5.544 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -19.938 34.810 -5.785 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -18.567 35.473 -4.864 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -19.895 34.648 -4.013 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -22.160 35.917 -5.735 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -22.261 35.844 -3.960 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -22.416 37.407 -4.796 1.00 0.00 H new ATOM 913 N ARG A 59 -19.546 40.440 -1.698 1.00 0.00 N ATOM 914 CA ARG A 59 -19.029 40.988 -0.416 1.00 0.00 C ATOM 915 C ARG A 59 -20.167 41.459 0.514 1.00 0.00 C ATOM 916 O ARG A 59 -20.135 41.232 1.730 1.00 0.00 O ATOM 917 CB ARG A 59 -18.048 42.161 -0.692 1.00 0.00 C ATOM 918 CG ARG A 59 -17.328 42.708 0.567 1.00 0.00 C ATOM 919 CD ARG A 59 -16.603 44.038 0.322 1.00 0.00 C ATOM 920 NE ARG A 59 -15.529 43.930 -0.690 1.00 0.00 N ATOM 921 CZ ARG A 59 -15.242 44.869 -1.604 1.00 0.00 C ATOM 922 NH1 ARG A 59 -16.040 45.913 -1.784 1.00 0.00 N ATOM 923 NH2 ARG A 59 -14.178 44.744 -2.369 1.00 0.00 N ATOM 0 H ARG A 59 -19.254 40.977 -2.515 1.00 0.00 H new ATOM 0 HA ARG A 59 -18.500 40.182 0.093 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -17.297 41.829 -1.409 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -18.599 42.975 -1.162 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -18.058 42.842 1.365 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -16.607 41.968 0.915 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -17.327 44.786 -0.002 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -16.177 44.392 1.261 1.00 0.00 H new ATOM 0 HE ARG A 59 -14.966 43.080 -0.693 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -16.886 46.011 -1.223 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -15.807 46.618 -2.483 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -13.570 43.932 -2.268 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -13.962 45.459 -3.063 1.00 0.00 H new ATOM 937 N ASP A 60 -21.169 42.113 -0.094 1.00 0.00 N ATOM 938 CA ASP A 60 -22.354 42.655 0.612 1.00 0.00 C ATOM 939 C ASP A 60 -23.340 41.535 1.029 1.00 0.00 C ATOM 940 O ASP A 60 -24.195 41.749 1.895 1.00 0.00 O ATOM 941 CB ASP A 60 -23.079 43.694 -0.281 1.00 0.00 C ATOM 942 CG ASP A 60 -23.514 43.117 -1.642 1.00 0.00 C ATOM 943 OD1 ASP A 60 -24.677 42.677 -1.781 1.00 0.00 O ATOM 944 OD2 ASP A 60 -22.679 43.082 -2.576 1.00 0.00 O ATOM 0 H ASP A 60 -21.185 42.285 -1.099 1.00 0.00 H new ATOM 0 HA ASP A 60 -22.000 43.141 1.522 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -23.956 44.069 0.246 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.419 44.546 -0.447 1.00 0.00 H new ATOM 949 N SER A 61 -23.208 40.351 0.398 1.00 0.00 N ATOM 950 CA SER A 61 -24.069 39.187 0.646 1.00 0.00 C ATOM 951 C SER A 61 -23.503 38.358 1.817 1.00 0.00 C ATOM 952 O SER A 61 -22.388 37.818 1.725 1.00 0.00 O ATOM 953 CB SER A 61 -24.167 38.345 -0.648 1.00 0.00 C ATOM 954 OG SER A 61 -24.632 39.134 -1.732 1.00 0.00 O ATOM 0 H SER A 61 -22.490 40.179 -0.306 1.00 0.00 H new ATOM 0 HA SER A 61 -25.071 39.513 0.923 1.00 0.00 H new ATOM 0 HB2 SER A 61 -23.190 37.928 -0.890 1.00 0.00 H new ATOM 0 HB3 SER A 61 -24.842 37.504 -0.489 1.00 0.00 H new ATOM 0 HG SER A 61 -24.684 38.582 -2.540 1.00 0.00 H new ATOM 960 N ASN A 62 -24.279 38.296 2.920 1.00 0.00 N ATOM 961 CA ASN A 62 -23.925 37.510 4.120 1.00 0.00 C ATOM 962 C ASN A 62 -23.882 35.997 3.796 1.00 0.00 C ATOM 963 O ASN A 62 -24.721 35.525 3.028 1.00 0.00 O ATOM 964 CB ASN A 62 -24.945 37.778 5.265 1.00 0.00 C ATOM 965 CG ASN A 62 -24.823 39.193 5.845 1.00 0.00 C ATOM 966 OD1 ASN A 62 -25.436 40.137 5.351 1.00 0.00 O ATOM 967 ND2 ASN A 62 -24.039 39.349 6.899 1.00 0.00 N ATOM 0 H ASN A 62 -25.168 38.789 3.003 1.00 0.00 H new ATOM 0 HA ASN A 62 -22.933 37.823 4.447 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -25.957 37.630 4.887 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -24.792 37.049 6.061 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -23.931 40.271 7.323 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -23.542 38.548 7.288 1.00 0.00 H new ATOM 974 N PRO A 63 -22.922 35.207 4.400 1.00 0.00 N ATOM 975 CA PRO A 63 -22.777 33.743 4.141 1.00 0.00 C ATOM 976 C PRO A 63 -24.017 32.897 4.533 1.00 0.00 C ATOM 977 O PRO A 63 -24.109 31.719 4.167 1.00 0.00 O ATOM 978 CB PRO A 63 -21.528 33.345 4.978 1.00 0.00 C ATOM 979 CG PRO A 63 -21.412 34.413 6.023 1.00 0.00 C ATOM 980 CD PRO A 63 -21.886 35.684 5.353 1.00 0.00 C ATOM 0 HA PRO A 63 -22.674 33.545 3.074 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.652 32.361 5.430 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.633 33.300 4.357 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -22.022 34.177 6.895 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -20.384 34.512 6.371 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -22.299 36.389 6.075 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -21.072 36.195 4.839 1.00 0.00 H new ATOM 988 N GLU A 64 -24.955 33.516 5.266 1.00 0.00 N ATOM 989 CA GLU A 64 -26.203 32.871 5.720 1.00 0.00 C ATOM 990 C GLU A 64 -27.242 32.813 4.582 1.00 0.00 C ATOM 991 O GLU A 64 -28.099 31.929 4.556 1.00 0.00 O ATOM 992 CB GLU A 64 -26.780 33.662 6.935 1.00 0.00 C ATOM 993 CG GLU A 64 -25.739 34.048 8.011 1.00 0.00 C ATOM 994 CD GLU A 64 -24.932 32.854 8.558 1.00 0.00 C ATOM 995 OE1 GLU A 64 -23.734 32.714 8.217 1.00 0.00 O ATOM 996 OE2 GLU A 64 -25.498 32.048 9.329 1.00 0.00 O ATOM 0 H GLU A 64 -24.871 34.488 5.565 1.00 0.00 H new ATOM 0 HA GLU A 64 -25.979 31.848 6.021 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -27.255 34.571 6.566 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -27.561 33.062 7.403 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -25.048 34.778 7.588 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -26.252 34.537 8.839 1.00 0.00 H new ATOM 1003 N GLU A 65 -27.154 33.773 3.652 1.00 0.00 N ATOM 1004 CA GLU A 65 -28.138 33.950 2.555 1.00 0.00 C ATOM 1005 C GLU A 65 -27.487 33.810 1.166 1.00 0.00 C ATOM 1006 O GLU A 65 -28.197 33.738 0.152 1.00 0.00 O ATOM 1007 CB GLU A 65 -28.794 35.346 2.687 1.00 0.00 C ATOM 1008 CG GLU A 65 -27.796 36.523 2.561 1.00 0.00 C ATOM 1009 CD GLU A 65 -28.455 37.890 2.733 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -29.149 38.334 1.796 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -28.286 38.526 3.791 1.00 0.00 O ATOM 0 H GLU A 65 -26.397 34.457 3.632 1.00 0.00 H new ATOM 0 HA GLU A 65 -28.889 33.165 2.643 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -29.562 35.450 1.920 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -29.297 35.411 3.652 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -27.012 36.408 3.309 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -27.314 36.479 1.584 1.00 0.00 H new ATOM 1018 N ILE A 66 -26.141 33.775 1.132 1.00 0.00 N ATOM 1019 CA ILE A 66 -25.357 33.784 -0.120 1.00 0.00 C ATOM 1020 C ILE A 66 -25.450 32.420 -0.848 1.00 0.00 C ATOM 1021 O ILE A 66 -25.845 31.405 -0.259 1.00 0.00 O ATOM 1022 CB ILE A 66 -23.835 34.131 0.169 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -23.105 34.697 -1.097 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -23.079 32.892 0.727 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -21.652 35.091 -0.876 1.00 0.00 C ATOM 0 H ILE A 66 -25.565 33.740 1.973 1.00 0.00 H new ATOM 0 HA ILE A 66 -25.781 34.554 -0.765 1.00 0.00 H new ATOM 0 HB ILE A 66 -23.827 34.915 0.926 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -23.147 33.948 -1.888 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -23.652 35.569 -1.455 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -22.039 33.156 0.917 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -23.547 32.569 1.657 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -23.121 32.082 -0.001 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -21.232 35.471 -1.807 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -21.597 35.865 -0.111 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -21.084 34.219 -0.551 1.00 0.00 H new ATOM 1037 N GLU A 67 -25.095 32.428 -2.129 1.00 0.00 N ATOM 1038 CA GLU A 67 -24.845 31.225 -2.919 1.00 0.00 C ATOM 1039 C GLU A 67 -23.505 31.419 -3.641 1.00 0.00 C ATOM 1040 O GLU A 67 -23.144 32.559 -3.975 1.00 0.00 O ATOM 1041 CB GLU A 67 -26.004 30.997 -3.914 1.00 0.00 C ATOM 1042 CG GLU A 67 -25.894 29.712 -4.754 1.00 0.00 C ATOM 1043 CD GLU A 67 -27.098 29.517 -5.683 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -28.014 28.734 -5.346 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -27.140 30.160 -6.751 1.00 0.00 O ATOM 0 H GLU A 67 -24.970 33.290 -2.660 1.00 0.00 H new ATOM 0 HA GLU A 67 -24.792 30.340 -2.286 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -26.941 30.971 -3.358 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -26.057 31.851 -4.589 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -24.981 29.747 -5.349 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -25.808 28.853 -4.089 1.00 0.00 H new ATOM 1052 N ILE A 68 -22.759 30.324 -3.849 1.00 0.00 N ATOM 1053 CA ILE A 68 -21.458 30.374 -4.534 1.00 0.00 C ATOM 1054 C ILE A 68 -21.701 30.397 -6.055 1.00 0.00 C ATOM 1055 O ILE A 68 -21.957 29.354 -6.678 1.00 0.00 O ATOM 1056 CB ILE A 68 -20.529 29.166 -4.140 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -20.480 28.990 -2.581 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -19.105 29.357 -4.731 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -19.664 27.803 -2.098 1.00 0.00 C ATOM 0 H ILE A 68 -23.036 29.389 -3.551 1.00 0.00 H new ATOM 0 HA ILE A 68 -20.938 31.279 -4.222 1.00 0.00 H new ATOM 0 HB ILE A 68 -20.948 28.254 -4.565 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -20.070 29.898 -2.140 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -21.499 28.887 -2.209 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -18.477 28.512 -4.448 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -19.167 29.415 -5.818 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -18.670 30.278 -4.343 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -19.689 27.763 -1.009 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.084 26.883 -2.504 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -18.633 27.910 -2.434 1.00 0.00 H new ATOM 1071 N ASP A 69 -21.690 31.610 -6.616 1.00 0.00 N ATOM 1072 CA ASP A 69 -21.939 31.848 -8.038 1.00 0.00 C ATOM 1073 C ASP A 69 -20.665 31.580 -8.869 1.00 0.00 C ATOM 1074 O ASP A 69 -19.913 32.509 -9.181 1.00 0.00 O ATOM 1075 CB ASP A 69 -22.431 33.308 -8.245 1.00 0.00 C ATOM 1076 CG ASP A 69 -23.801 33.600 -7.602 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -23.846 34.029 -6.434 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -24.841 33.409 -8.271 1.00 0.00 O ATOM 0 H ASP A 69 -21.506 32.463 -6.088 1.00 0.00 H new ATOM 0 HA ASP A 69 -22.712 31.161 -8.381 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -21.692 33.993 -7.830 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -22.491 33.513 -9.314 1.00 0.00 H new ATOM 1083 N PHE A 70 -20.436 30.298 -9.228 1.00 0.00 N ATOM 1084 CA PHE A 70 -19.236 29.855 -10.006 1.00 0.00 C ATOM 1085 C PHE A 70 -19.182 30.479 -11.416 1.00 0.00 C ATOM 1086 O PHE A 70 -18.123 30.519 -12.053 1.00 0.00 O ATOM 1087 CB PHE A 70 -19.211 28.314 -10.133 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.112 27.579 -8.804 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -17.875 27.386 -8.182 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -20.246 27.074 -8.182 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -17.785 26.702 -6.990 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -20.154 26.396 -6.993 1.00 0.00 C ATOM 1093 CZ PHE A 70 -18.925 26.209 -6.392 1.00 0.00 C ATOM 0 H PHE A 70 -21.071 29.535 -8.992 1.00 0.00 H new ATOM 0 HA PHE A 70 -18.363 30.200 -9.452 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -20.115 27.989 -10.649 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -18.366 28.026 -10.758 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -16.980 27.778 -8.642 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.213 27.217 -8.640 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -16.822 26.552 -6.524 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -21.046 26.007 -6.525 1.00 0.00 H new ATOM 0 HZ PHE A 70 -18.857 25.677 -5.455 1.00 0.00 H new ATOM 1103 N GLU A 71 -20.344 30.970 -11.861 1.00 0.00 N ATOM 1104 CA GLU A 71 -20.557 31.544 -13.197 1.00 0.00 C ATOM 1105 C GLU A 71 -19.862 32.916 -13.317 1.00 0.00 C ATOM 1106 O GLU A 71 -19.499 33.337 -14.421 1.00 0.00 O ATOM 1107 CB GLU A 71 -22.085 31.687 -13.500 1.00 0.00 C ATOM 1108 CG GLU A 71 -22.936 30.391 -13.365 1.00 0.00 C ATOM 1109 CD GLU A 71 -23.097 29.881 -11.909 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -23.674 30.612 -11.082 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -22.614 28.775 -11.586 1.00 0.00 O ATOM 0 H GLU A 71 -21.187 30.980 -11.286 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.119 30.866 -13.929 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -22.498 32.440 -12.829 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -22.199 32.068 -14.515 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -23.925 30.575 -13.785 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -22.477 29.605 -13.964 1.00 0.00 H new ATOM 1118 N THR A 72 -19.690 33.606 -12.173 1.00 0.00 N ATOM 1119 CA THR A 72 -18.989 34.903 -12.116 1.00 0.00 C ATOM 1120 C THR A 72 -17.553 34.733 -11.573 1.00 0.00 C ATOM 1121 O THR A 72 -16.700 35.593 -11.825 1.00 0.00 O ATOM 1122 CB THR A 72 -19.776 35.957 -11.261 1.00 0.00 C ATOM 1123 OG1 THR A 72 -19.204 37.263 -11.441 1.00 0.00 O ATOM 1124 CG2 THR A 72 -19.805 35.633 -9.750 1.00 0.00 C ATOM 0 H THR A 72 -20.031 33.282 -11.268 1.00 0.00 H new ATOM 0 HA THR A 72 -18.933 35.281 -13.137 1.00 0.00 H new ATOM 0 HB THR A 72 -20.805 35.925 -11.620 1.00 0.00 H new ATOM 0 HG1 THR A 72 -19.702 37.915 -10.905 1.00 0.00 H new ATOM 0 HG21 THR A 72 -20.366 36.405 -9.223 1.00 0.00 H new ATOM 0 HG22 THR A 72 -20.284 34.666 -9.594 1.00 0.00 H new ATOM 0 HG23 THR A 72 -18.786 35.599 -9.366 1.00 0.00 H new ATOM 1132 N LEU A 73 -17.287 33.620 -10.845 1.00 0.00 N ATOM 1133 CA LEU A 73 -15.952 33.355 -10.263 1.00 0.00 C ATOM 1134 C LEU A 73 -14.928 33.037 -11.369 1.00 0.00 C ATOM 1135 O LEU A 73 -15.291 32.550 -12.451 1.00 0.00 O ATOM 1136 CB LEU A 73 -15.987 32.181 -9.250 1.00 0.00 C ATOM 1137 CG LEU A 73 -16.973 32.285 -8.045 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -16.789 31.106 -7.056 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -16.871 33.647 -7.332 1.00 0.00 C ATOM 0 H LEU A 73 -17.978 32.896 -10.649 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.652 34.260 -9.735 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.227 31.271 -9.801 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.981 32.055 -8.849 1.00 0.00 H new ATOM 0 HG LEU A 73 -17.982 32.215 -8.451 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -17.492 31.211 -6.230 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -16.975 30.165 -7.573 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -15.770 31.112 -6.669 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -17.575 33.676 -6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -15.858 33.785 -6.955 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -17.109 34.445 -8.036 1.00 0.00 H new ATOM 1151 N LYS A 74 -13.647 33.302 -11.066 1.00 0.00 N ATOM 1152 CA LYS A 74 -12.535 33.144 -12.023 1.00 0.00 C ATOM 1153 C LYS A 74 -12.054 31.669 -12.055 1.00 0.00 C ATOM 1154 O LYS A 74 -12.244 30.961 -11.065 1.00 0.00 O ATOM 1155 CB LYS A 74 -11.374 34.099 -11.615 1.00 0.00 C ATOM 1156 CG LYS A 74 -11.840 35.532 -11.266 1.00 0.00 C ATOM 1157 CD LYS A 74 -10.684 36.553 -11.165 1.00 0.00 C ATOM 1158 CE LYS A 74 -11.160 37.921 -10.640 1.00 0.00 C ATOM 1159 NZ LYS A 74 -12.399 38.390 -11.317 1.00 0.00 N ATOM 0 H LYS A 74 -13.350 33.633 -10.148 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.875 33.404 -13.026 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -10.853 33.677 -10.756 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.653 34.150 -12.431 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -12.546 35.870 -12.024 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -12.377 35.509 -10.318 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -9.912 36.161 -10.503 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -10.228 36.681 -12.147 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -11.339 37.853 -9.567 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -10.370 38.657 -10.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -12.433 39.429 -11.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -12.401 38.062 -12.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -13.230 38.007 -10.823 1.00 0.00 H new ATOM 1173 N PRO A 75 -11.426 31.174 -13.186 1.00 0.00 N ATOM 1174 CA PRO A 75 -10.851 29.795 -13.264 1.00 0.00 C ATOM 1175 C PRO A 75 -9.844 29.504 -12.123 1.00 0.00 C ATOM 1176 O PRO A 75 -9.771 28.376 -11.619 1.00 0.00 O ATOM 1177 CB PRO A 75 -10.160 29.760 -14.658 1.00 0.00 C ATOM 1178 CG PRO A 75 -10.042 31.201 -15.074 1.00 0.00 C ATOM 1179 CD PRO A 75 -11.250 31.887 -14.480 1.00 0.00 C ATOM 0 HA PRO A 75 -11.616 29.028 -13.148 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.181 29.285 -14.601 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.749 29.190 -15.376 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -9.117 31.643 -14.704 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -10.029 31.297 -16.160 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -11.080 32.954 -14.335 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -12.127 31.788 -15.119 1.00 0.00 H new ATOM 1187 N SER A 76 -9.095 30.555 -11.727 1.00 0.00 N ATOM 1188 CA SER A 76 -8.156 30.521 -10.593 1.00 0.00 C ATOM 1189 C SER A 76 -8.907 30.358 -9.256 1.00 0.00 C ATOM 1190 O SER A 76 -8.454 29.627 -8.373 1.00 0.00 O ATOM 1191 CB SER A 76 -7.316 31.819 -10.583 1.00 0.00 C ATOM 1192 OG SER A 76 -8.157 32.968 -10.545 1.00 0.00 O ATOM 0 H SER A 76 -9.128 31.461 -12.194 1.00 0.00 H new ATOM 0 HA SER A 76 -7.496 29.662 -10.710 1.00 0.00 H new ATOM 0 HB2 SER A 76 -6.652 31.821 -9.719 1.00 0.00 H new ATOM 0 HB3 SER A 76 -6.684 31.855 -11.470 1.00 0.00 H new ATOM 0 HG SER A 76 -7.605 33.778 -10.538 1.00 0.00 H new ATOM 1198 N THR A 77 -10.067 31.045 -9.134 1.00 0.00 N ATOM 1199 CA THR A 77 -10.902 31.022 -7.921 1.00 0.00 C ATOM 1200 C THR A 77 -11.528 29.627 -7.713 1.00 0.00 C ATOM 1201 O THR A 77 -11.581 29.150 -6.585 1.00 0.00 O ATOM 1202 CB THR A 77 -12.018 32.124 -7.984 1.00 0.00 C ATOM 1203 OG1 THR A 77 -11.420 33.398 -8.290 1.00 0.00 O ATOM 1204 CG2 THR A 77 -12.817 32.254 -6.665 1.00 0.00 C ATOM 0 H THR A 77 -10.446 31.630 -9.878 1.00 0.00 H new ATOM 0 HA THR A 77 -10.259 31.240 -7.068 1.00 0.00 H new ATOM 0 HB THR A 77 -12.717 31.819 -8.763 1.00 0.00 H new ATOM 0 HG1 THR A 77 -12.117 34.085 -8.331 1.00 0.00 H new ATOM 0 HG21 THR A 77 -13.573 33.032 -6.773 1.00 0.00 H new ATOM 0 HG22 THR A 77 -13.303 31.305 -6.439 1.00 0.00 H new ATOM 0 HG23 THR A 77 -12.139 32.517 -5.853 1.00 0.00 H new ATOM 1212 N LEU A 78 -11.980 28.979 -8.813 1.00 0.00 N ATOM 1213 CA LEU A 78 -12.513 27.595 -8.773 1.00 0.00 C ATOM 1214 C LEU A 78 -11.406 26.608 -8.363 1.00 0.00 C ATOM 1215 O LEU A 78 -11.606 25.779 -7.480 1.00 0.00 O ATOM 1216 CB LEU A 78 -13.133 27.168 -10.148 1.00 0.00 C ATOM 1217 CG LEU A 78 -14.609 27.620 -10.438 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -14.769 29.144 -10.435 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -15.134 27.016 -11.765 1.00 0.00 C ATOM 0 H LEU A 78 -11.986 29.395 -9.744 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.310 27.573 -8.029 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.497 27.559 -10.942 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.093 26.081 -10.214 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.216 27.233 -9.620 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -15.808 29.401 -10.641 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.484 29.538 -9.459 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.129 29.579 -11.203 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.158 27.348 -11.936 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -14.503 27.346 -12.590 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -15.111 25.928 -11.704 1.00 0.00 H new ATOM 1231 N ARG A 79 -10.233 26.745 -9.008 1.00 0.00 N ATOM 1232 CA ARG A 79 -9.074 25.847 -8.803 1.00 0.00 C ATOM 1233 C ARG A 79 -8.576 25.895 -7.345 1.00 0.00 C ATOM 1234 O ARG A 79 -8.227 24.858 -6.755 1.00 0.00 O ATOM 1235 CB ARG A 79 -7.931 26.232 -9.789 1.00 0.00 C ATOM 1236 CG ARG A 79 -6.741 25.240 -9.822 1.00 0.00 C ATOM 1237 CD ARG A 79 -7.170 23.826 -10.255 1.00 0.00 C ATOM 1238 NE ARG A 79 -6.046 22.878 -10.230 1.00 0.00 N ATOM 1239 CZ ARG A 79 -6.156 21.539 -10.324 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -7.344 20.955 -10.411 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -5.067 20.787 -10.324 1.00 0.00 N ATOM 0 H ARG A 79 -10.058 27.484 -9.689 1.00 0.00 H new ATOM 0 HA ARG A 79 -9.391 24.824 -9.005 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -8.348 26.312 -10.793 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.556 27.219 -9.520 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.980 25.612 -10.508 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -6.284 25.192 -8.834 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -7.960 23.469 -9.595 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.588 23.866 -11.261 1.00 0.00 H new ATOM 0 HE ARG A 79 -5.108 23.266 -10.134 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -8.192 21.521 -10.407 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -7.409 19.940 -10.482 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -4.147 21.222 -10.253 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -5.148 19.773 -10.395 1.00 0.00 H new ATOM 1255 N GLU A 80 -8.563 27.116 -6.785 1.00 0.00 N ATOM 1256 CA GLU A 80 -8.168 27.369 -5.393 1.00 0.00 C ATOM 1257 C GLU A 80 -9.225 26.775 -4.449 1.00 0.00 C ATOM 1258 O GLU A 80 -8.885 26.026 -3.535 1.00 0.00 O ATOM 1259 CB GLU A 80 -7.998 28.912 -5.166 1.00 0.00 C ATOM 1260 CG GLU A 80 -7.326 29.358 -3.830 1.00 0.00 C ATOM 1261 CD GLU A 80 -8.193 29.158 -2.558 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -9.364 29.578 -2.560 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -7.695 28.616 -1.552 1.00 0.00 O ATOM 0 H GLU A 80 -8.829 27.961 -7.291 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.212 26.890 -5.180 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.411 29.314 -5.992 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.984 29.374 -5.221 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.395 28.804 -3.707 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.062 30.413 -3.909 1.00 0.00 H new ATOM 1270 N LEU A 81 -10.507 27.103 -4.717 1.00 0.00 N ATOM 1271 CA LEU A 81 -11.647 26.774 -3.840 1.00 0.00 C ATOM 1272 C LEU A 81 -11.809 25.260 -3.658 1.00 0.00 C ATOM 1273 O LEU A 81 -12.010 24.791 -2.545 1.00 0.00 O ATOM 1274 CB LEU A 81 -12.956 27.396 -4.402 1.00 0.00 C ATOM 1275 CG LEU A 81 -14.238 27.229 -3.521 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -14.065 27.875 -2.121 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -15.494 27.780 -4.238 1.00 0.00 C ATOM 0 H LEU A 81 -10.781 27.610 -5.559 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.442 27.201 -2.858 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -12.787 28.461 -4.562 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.153 26.954 -5.379 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.383 26.159 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -14.978 27.737 -1.541 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.231 27.402 -1.603 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -13.865 28.941 -2.234 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -16.366 27.648 -3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -15.356 28.840 -4.449 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -15.645 27.240 -5.173 1.00 0.00 H new ATOM 1289 N GLU A 82 -11.688 24.515 -4.764 1.00 0.00 N ATOM 1290 CA GLU A 82 -11.832 23.047 -4.764 1.00 0.00 C ATOM 1291 C GLU A 82 -10.744 22.376 -3.911 1.00 0.00 C ATOM 1292 O GLU A 82 -11.023 21.398 -3.214 1.00 0.00 O ATOM 1293 CB GLU A 82 -11.813 22.486 -6.212 1.00 0.00 C ATOM 1294 CG GLU A 82 -13.031 22.915 -7.069 1.00 0.00 C ATOM 1295 CD GLU A 82 -13.006 22.354 -8.498 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -12.875 23.126 -9.469 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -13.117 21.122 -8.660 1.00 0.00 O ATOM 0 H GLU A 82 -11.488 24.908 -5.684 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.799 22.814 -4.318 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.899 22.816 -6.707 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.777 21.397 -6.169 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -13.946 22.587 -6.575 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.066 24.003 -7.116 1.00 0.00 H new ATOM 1304 N ARG A 83 -9.506 22.919 -3.967 1.00 0.00 N ATOM 1305 CA ARG A 83 -8.365 22.417 -3.161 1.00 0.00 C ATOM 1306 C ARG A 83 -8.528 22.848 -1.683 1.00 0.00 C ATOM 1307 O ARG A 83 -8.144 22.111 -0.762 1.00 0.00 O ATOM 1308 CB ARG A 83 -7.012 22.919 -3.780 1.00 0.00 C ATOM 1309 CG ARG A 83 -5.703 22.326 -3.159 1.00 0.00 C ATOM 1310 CD ARG A 83 -5.212 23.086 -1.914 1.00 0.00 C ATOM 1311 NE ARG A 83 -4.077 22.421 -1.256 1.00 0.00 N ATOM 1312 CZ ARG A 83 -3.799 22.483 0.063 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -4.573 23.181 0.886 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -2.727 21.877 0.548 1.00 0.00 N ATOM 0 H ARG A 83 -9.269 23.710 -4.566 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.351 21.327 -3.181 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.018 22.692 -4.846 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -6.974 24.004 -3.686 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.877 21.283 -2.893 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.916 22.335 -3.914 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.920 24.096 -2.201 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -6.033 23.182 -1.204 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.451 21.870 -1.843 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.387 23.677 0.523 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.354 23.221 1.881 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -2.107 21.360 -0.076 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.521 21.927 1.546 1.00 0.00 H new ATOM 1328 N TYR A 84 -9.117 24.040 -1.476 1.00 0.00 N ATOM 1329 CA TYR A 84 -9.345 24.626 -0.137 1.00 0.00 C ATOM 1330 C TYR A 84 -10.382 23.796 0.636 1.00 0.00 C ATOM 1331 O TYR A 84 -10.251 23.576 1.846 1.00 0.00 O ATOM 1332 CB TYR A 84 -9.811 26.104 -0.281 1.00 0.00 C ATOM 1333 CG TYR A 84 -9.999 26.858 1.047 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -8.904 27.359 1.765 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -11.271 27.064 1.595 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -9.076 28.047 2.953 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -11.436 27.750 2.780 1.00 0.00 C ATOM 1338 CZ TYR A 84 -10.342 28.231 3.457 1.00 0.00 C ATOM 1339 OH TYR A 84 -10.520 28.916 4.637 1.00 0.00 O ATOM 0 H TYR A 84 -9.452 24.630 -2.238 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.412 24.611 0.426 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.082 26.642 -0.887 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -10.754 26.120 -0.828 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -7.906 27.205 1.383 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -12.139 26.679 1.080 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -8.220 28.438 3.482 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -12.428 27.909 3.177 1.00 0.00 H new ATOM 0 HH TYR A 84 -9.807 29.580 4.740 1.00 0.00 H new ATOM 1349 N VAL A 85 -11.405 23.336 -0.092 1.00 0.00 N ATOM 1350 CA VAL A 85 -12.451 22.464 0.453 1.00 0.00 C ATOM 1351 C VAL A 85 -11.907 21.042 0.622 1.00 0.00 C ATOM 1352 O VAL A 85 -12.186 20.414 1.627 1.00 0.00 O ATOM 1353 CB VAL A 85 -13.735 22.473 -0.461 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -14.816 21.465 0.023 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -14.314 23.907 -0.545 1.00 0.00 C ATOM 0 H VAL A 85 -11.531 23.559 -1.079 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.746 22.845 1.431 1.00 0.00 H new ATOM 0 HB VAL A 85 -13.432 22.149 -1.457 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -15.679 21.511 -0.641 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -14.403 20.456 0.013 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -15.124 21.721 1.037 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.201 23.905 -1.178 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -14.582 24.250 0.454 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -13.566 24.577 -0.970 1.00 0.00 H new ATOM 1365 N LEU A 86 -11.089 20.574 -0.355 1.00 0.00 N ATOM 1366 CA LEU A 86 -10.491 19.212 -0.355 1.00 0.00 C ATOM 1367 C LEU A 86 -9.586 18.979 0.876 1.00 0.00 C ATOM 1368 O LEU A 86 -9.566 17.882 1.442 1.00 0.00 O ATOM 1369 CB LEU A 86 -9.685 18.970 -1.663 1.00 0.00 C ATOM 1370 CG LEU A 86 -9.014 17.564 -1.828 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -10.065 16.418 -1.854 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -8.108 17.524 -3.083 1.00 0.00 C ATOM 0 H LEU A 86 -10.824 21.131 -1.167 1.00 0.00 H new ATOM 0 HA LEU A 86 -11.313 18.498 -0.303 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.354 19.129 -2.509 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.905 19.729 -1.727 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.385 17.401 -0.953 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.557 15.461 -1.970 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -10.628 16.419 -0.921 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -10.748 16.570 -2.690 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.655 16.537 -3.173 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -8.706 17.731 -3.970 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -7.324 18.276 -2.990 1.00 0.00 H new ATOM 1384 N SER A 87 -8.851 20.026 1.287 1.00 0.00 N ATOM 1385 CA SER A 87 -7.976 19.979 2.476 1.00 0.00 C ATOM 1386 C SER A 87 -8.813 19.906 3.775 1.00 0.00 C ATOM 1387 O SER A 87 -8.404 19.269 4.751 1.00 0.00 O ATOM 1388 CB SER A 87 -7.029 21.202 2.483 1.00 0.00 C ATOM 1389 OG SER A 87 -7.750 22.419 2.459 1.00 0.00 O ATOM 0 H SER A 87 -8.845 20.927 0.808 1.00 0.00 H new ATOM 0 HA SER A 87 -7.368 19.075 2.430 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.398 21.170 3.371 1.00 0.00 H new ATOM 0 HB3 SER A 87 -6.366 21.154 1.619 1.00 0.00 H new ATOM 0 HG SER A 87 -8.697 22.235 2.289 1.00 0.00 H new ATOM 1395 N CYS A 88 -9.998 20.556 3.762 1.00 0.00 N ATOM 1396 CA CYS A 88 -10.977 20.505 4.876 1.00 0.00 C ATOM 1397 C CYS A 88 -11.826 19.207 4.827 1.00 0.00 C ATOM 1398 O CYS A 88 -12.375 18.772 5.847 1.00 0.00 O ATOM 1399 CB CYS A 88 -11.894 21.746 4.811 1.00 0.00 C ATOM 1400 SG CYS A 88 -11.027 23.328 4.964 1.00 0.00 S ATOM 0 H CYS A 88 -10.305 21.132 2.978 1.00 0.00 H new ATOM 0 HA CYS A 88 -10.428 20.503 5.817 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -12.436 21.733 3.865 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -12.637 21.675 5.605 1.00 0.00 H new ATOM 0 HG CYS A 88 -10.562 23.682 3.803 1.00 0.00 H new ATOM 1406 N LEU A 89 -11.909 18.604 3.633 1.00 0.00 N ATOM 1407 CA LEU A 89 -12.747 17.421 3.346 1.00 0.00 C ATOM 1408 C LEU A 89 -12.003 16.126 3.705 1.00 0.00 C ATOM 1409 O LEU A 89 -12.617 15.191 4.225 1.00 0.00 O ATOM 1410 CB LEU A 89 -13.132 17.435 1.838 1.00 0.00 C ATOM 1411 CG LEU A 89 -13.924 16.210 1.272 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -15.305 16.038 1.955 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -14.061 16.313 -0.269 1.00 0.00 C ATOM 0 H LEU A 89 -11.386 18.928 2.819 1.00 0.00 H new ATOM 0 HA LEU A 89 -13.651 17.459 3.954 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.725 18.331 1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -12.214 17.535 1.260 1.00 0.00 H new ATOM 0 HG LEU A 89 -13.350 15.313 1.505 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -15.817 15.175 1.529 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -15.165 15.885 3.025 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -15.905 16.933 1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.615 15.452 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -14.595 17.228 -0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -13.070 16.332 -0.722 1.00 0.00 H new ATOM 1425 N ARG A 90 -10.670 16.118 3.440 1.00 0.00 N ATOM 1426 CA ARG A 90 -9.790 14.920 3.510 1.00 0.00 C ATOM 1427 C ARG A 90 -10.184 13.875 2.440 1.00 0.00 C ATOM 1428 O ARG A 90 -11.154 14.085 1.697 1.00 0.00 O ATOM 1429 CB ARG A 90 -9.776 14.283 4.935 1.00 0.00 C ATOM 1430 CG ARG A 90 -9.211 15.195 6.043 1.00 0.00 C ATOM 1431 CD ARG A 90 -9.267 14.543 7.436 1.00 0.00 C ATOM 1432 NE ARG A 90 -8.567 15.353 8.444 1.00 0.00 N ATOM 1433 CZ ARG A 90 -8.536 15.100 9.761 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -9.255 14.116 10.293 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -7.807 15.875 10.555 1.00 0.00 N ATOM 0 H ARG A 90 -10.166 16.962 3.166 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.775 15.258 3.299 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -10.794 13.999 5.201 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -9.187 13.366 4.903 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -8.178 15.449 5.807 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.773 16.129 6.061 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -10.307 14.410 7.734 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.819 13.550 7.392 1.00 0.00 H new ATOM 0 HE ARG A 90 -8.063 16.176 8.114 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -9.845 13.536 9.697 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -9.216 13.941 11.297 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.278 16.653 10.162 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.776 15.692 11.558 1.00 0.00 H new ATOM 1724 N THR A 106 4.274 3.470 -31.495 1.00 0.00 N ATOM 1725 CA THR A 106 4.360 1.992 -31.539 1.00 0.00 C ATOM 1726 C THR A 106 5.753 1.519 -31.106 1.00 0.00 C ATOM 1727 O THR A 106 6.739 2.214 -31.350 1.00 0.00 O ATOM 1728 CB THR A 106 4.031 1.445 -32.973 1.00 0.00 C ATOM 1729 OG1 THR A 106 4.863 2.082 -33.954 1.00 0.00 O ATOM 1730 CG2 THR A 106 2.557 1.664 -33.349 1.00 0.00 C ATOM 0 HA THR A 106 3.619 1.598 -30.843 1.00 0.00 H new ATOM 0 HB THR A 106 4.226 0.373 -32.956 1.00 0.00 H new ATOM 0 HG1 THR A 106 5.108 2.978 -33.643 1.00 0.00 H new ATOM 0 HG21 THR A 106 2.374 1.270 -34.349 1.00 0.00 H new ATOM 0 HG22 THR A 106 1.918 1.147 -32.633 1.00 0.00 H new ATOM 0 HG23 THR A 106 2.332 2.730 -33.332 1.00 0.00 H new ATOM 1738 N LYS A 107 5.805 0.315 -30.498 1.00 0.00 N ATOM 1739 CA LYS A 107 7.044 -0.308 -29.978 1.00 0.00 C ATOM 1740 C LYS A 107 8.073 -0.519 -31.094 1.00 0.00 C ATOM 1741 O LYS A 107 9.265 -0.288 -30.912 1.00 0.00 O ATOM 1742 CB LYS A 107 6.712 -1.687 -29.347 1.00 0.00 C ATOM 1743 CG LYS A 107 5.672 -1.659 -28.203 1.00 0.00 C ATOM 1744 CD LYS A 107 5.309 -3.079 -27.711 1.00 0.00 C ATOM 1745 CE LYS A 107 4.310 -3.075 -26.548 1.00 0.00 C ATOM 1746 NZ LYS A 107 3.921 -4.454 -26.166 1.00 0.00 N ATOM 0 H LYS A 107 4.976 -0.261 -30.352 1.00 0.00 H new ATOM 0 HA LYS A 107 7.465 0.364 -29.231 1.00 0.00 H new ATOM 0 HB2 LYS A 107 6.346 -2.348 -30.132 1.00 0.00 H new ATOM 0 HB3 LYS A 107 7.635 -2.125 -28.966 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.066 -1.077 -27.370 1.00 0.00 H new ATOM 0 HG3 LYS A 107 4.770 -1.153 -28.547 1.00 0.00 H new ATOM 0 HD2 LYS A 107 4.890 -3.648 -28.540 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.218 -3.593 -27.399 1.00 0.00 H new ATOM 0 HE2 LYS A 107 4.751 -2.568 -25.689 1.00 0.00 H new ATOM 0 HE3 LYS A 107 3.422 -2.510 -26.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 3.245 -4.418 -25.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 3.479 -4.928 -26.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 4.766 -4.985 -25.873 1.00 0.00 H new ATOM 1760 N GLU A 108 7.559 -0.973 -32.245 1.00 0.00 N ATOM 1761 CA GLU A 108 8.351 -1.333 -33.430 1.00 0.00 C ATOM 1762 C GLU A 108 9.020 -0.088 -34.031 1.00 0.00 C ATOM 1763 O GLU A 108 10.145 -0.161 -34.523 1.00 0.00 O ATOM 1764 CB GLU A 108 7.449 -2.032 -34.489 1.00 0.00 C ATOM 1765 CG GLU A 108 6.879 -3.416 -34.078 1.00 0.00 C ATOM 1766 CD GLU A 108 5.943 -3.389 -32.852 1.00 0.00 C ATOM 1767 OE1 GLU A 108 4.945 -2.641 -32.868 1.00 0.00 O ATOM 1768 OE2 GLU A 108 6.205 -4.104 -31.865 1.00 0.00 O ATOM 0 H GLU A 108 6.557 -1.103 -32.382 1.00 0.00 H new ATOM 0 HA GLU A 108 9.133 -2.028 -33.126 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.615 -1.371 -34.722 1.00 0.00 H new ATOM 0 HB3 GLU A 108 8.025 -2.154 -35.406 1.00 0.00 H new ATOM 0 HG2 GLU A 108 6.335 -3.836 -34.924 1.00 0.00 H new ATOM 0 HG3 GLU A 108 7.711 -4.089 -33.868 1.00 0.00 H new ATOM 1775 N GLU A 109 8.307 1.048 -33.960 1.00 0.00 N ATOM 1776 CA GLU A 109 8.806 2.349 -34.431 1.00 0.00 C ATOM 1777 C GLU A 109 9.940 2.852 -33.524 1.00 0.00 C ATOM 1778 O GLU A 109 10.997 3.246 -34.014 1.00 0.00 O ATOM 1779 CB GLU A 109 7.646 3.365 -34.461 1.00 0.00 C ATOM 1780 CG GLU A 109 8.028 4.780 -34.937 1.00 0.00 C ATOM 1781 CD GLU A 109 6.866 5.786 -34.928 1.00 0.00 C ATOM 1782 OE1 GLU A 109 7.126 6.982 -35.164 1.00 0.00 O ATOM 1783 OE2 GLU A 109 5.690 5.392 -34.704 1.00 0.00 O ATOM 0 H GLU A 109 7.364 1.089 -33.573 1.00 0.00 H new ATOM 0 HA GLU A 109 9.206 2.234 -35.439 1.00 0.00 H new ATOM 0 HB2 GLU A 109 6.862 2.979 -35.112 1.00 0.00 H new ATOM 0 HB3 GLU A 109 7.221 3.438 -33.460 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.828 5.161 -34.302 1.00 0.00 H new ATOM 0 HG3 GLU A 109 8.429 4.714 -35.949 1.00 0.00 H new ATOM 1790 N LEU A 110 9.712 2.783 -32.199 1.00 0.00 N ATOM 1791 CA LEU A 110 10.677 3.248 -31.185 1.00 0.00 C ATOM 1792 C LEU A 110 11.969 2.404 -31.226 1.00 0.00 C ATOM 1793 O LEU A 110 13.073 2.936 -31.093 1.00 0.00 O ATOM 1794 CB LEU A 110 10.035 3.205 -29.768 1.00 0.00 C ATOM 1795 CG LEU A 110 8.709 4.023 -29.585 1.00 0.00 C ATOM 1796 CD1 LEU A 110 8.151 3.882 -28.147 1.00 0.00 C ATOM 1797 CD2 LEU A 110 8.894 5.515 -29.975 1.00 0.00 C ATOM 0 H LEU A 110 8.853 2.403 -31.801 1.00 0.00 H new ATOM 0 HA LEU A 110 10.944 4.280 -31.413 1.00 0.00 H new ATOM 0 HB2 LEU A 110 9.834 2.164 -29.514 1.00 0.00 H new ATOM 0 HB3 LEU A 110 10.767 3.573 -29.049 1.00 0.00 H new ATOM 0 HG LEU A 110 7.973 3.599 -30.268 1.00 0.00 H new ATOM 0 HD11 LEU A 110 7.232 4.461 -28.055 1.00 0.00 H new ATOM 0 HD12 LEU A 110 7.941 2.833 -27.939 1.00 0.00 H new ATOM 0 HD13 LEU A 110 8.887 4.253 -27.433 1.00 0.00 H new ATOM 0 HD21 LEU A 110 7.953 6.047 -29.834 1.00 0.00 H new ATOM 0 HD22 LEU A 110 9.662 5.963 -29.345 1.00 0.00 H new ATOM 0 HD23 LEU A 110 9.197 5.583 -31.020 1.00 0.00 H new ATOM 1809 N ALA A 111 11.794 1.085 -31.437 1.00 0.00 N ATOM 1810 CA ALA A 111 12.899 0.117 -31.574 1.00 0.00 C ATOM 1811 C ALA A 111 13.628 0.287 -32.918 1.00 0.00 C ATOM 1812 O ALA A 111 14.814 -0.019 -33.012 1.00 0.00 O ATOM 1813 CB ALA A 111 12.376 -1.322 -31.415 1.00 0.00 C ATOM 0 H ALA A 111 10.871 0.657 -31.518 1.00 0.00 H new ATOM 0 HA ALA A 111 13.619 0.314 -30.780 1.00 0.00 H new ATOM 0 HB1 ALA A 111 13.204 -2.024 -31.519 1.00 0.00 H new ATOM 0 HB2 ALA A 111 11.923 -1.438 -30.430 1.00 0.00 H new ATOM 0 HB3 ALA A 111 11.630 -1.525 -32.183 1.00 0.00 H new ATOM 1819 N LEU A 112 12.893 0.771 -33.946 1.00 0.00 N ATOM 1820 CA LEU A 112 13.454 1.099 -35.280 1.00 0.00 C ATOM 1821 C LEU A 112 14.325 2.365 -35.205 1.00 0.00 C ATOM 1822 O LEU A 112 15.305 2.502 -35.943 1.00 0.00 O ATOM 1823 CB LEU A 112 12.307 1.291 -36.308 1.00 0.00 C ATOM 1824 CG LEU A 112 12.718 1.700 -37.764 1.00 0.00 C ATOM 1825 CD1 LEU A 112 13.607 0.627 -38.441 1.00 0.00 C ATOM 1826 CD2 LEU A 112 11.468 2.014 -38.618 1.00 0.00 C ATOM 0 H LEU A 112 11.891 0.946 -33.875 1.00 0.00 H new ATOM 0 HA LEU A 112 14.083 0.271 -35.606 1.00 0.00 H new ATOM 0 HB2 LEU A 112 11.743 0.360 -36.364 1.00 0.00 H new ATOM 0 HB3 LEU A 112 11.629 2.052 -35.921 1.00 0.00 H new ATOM 0 HG LEU A 112 13.318 2.607 -37.691 1.00 0.00 H new ATOM 0 HD11 LEU A 112 13.867 0.953 -39.448 1.00 0.00 H new ATOM 0 HD12 LEU A 112 14.517 0.488 -37.858 1.00 0.00 H new ATOM 0 HD13 LEU A 112 13.063 -0.316 -38.494 1.00 0.00 H new ATOM 0 HD21 LEU A 112 11.777 2.296 -39.625 1.00 0.00 H new ATOM 0 HD22 LEU A 112 10.830 1.132 -38.667 1.00 0.00 H new ATOM 0 HD23 LEU A 112 10.915 2.837 -38.165 1.00 0.00 H new ATOM 1838 N GLU A 113 13.951 3.281 -34.304 1.00 0.00 N ATOM 1839 CA GLU A 113 14.708 4.516 -34.059 1.00 0.00 C ATOM 1840 C GLU A 113 16.017 4.213 -33.302 1.00 0.00 C ATOM 1841 O GLU A 113 17.053 4.831 -33.579 1.00 0.00 O ATOM 1842 CB GLU A 113 13.830 5.534 -33.294 1.00 0.00 C ATOM 1843 CG GLU A 113 12.585 5.991 -34.083 1.00 0.00 C ATOM 1844 CD GLU A 113 11.723 7.011 -33.334 1.00 0.00 C ATOM 1845 OE1 GLU A 113 10.873 6.604 -32.520 1.00 0.00 O ATOM 1846 OE2 GLU A 113 11.903 8.232 -33.553 1.00 0.00 O ATOM 0 H GLU A 113 13.117 3.188 -33.725 1.00 0.00 H new ATOM 0 HA GLU A 113 14.982 4.959 -35.016 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.510 5.089 -32.352 1.00 0.00 H new ATOM 0 HB3 GLU A 113 14.433 6.407 -33.046 1.00 0.00 H new ATOM 0 HG2 GLU A 113 12.905 6.425 -35.030 1.00 0.00 H new ATOM 0 HG3 GLU A 113 11.976 5.119 -34.321 1.00 0.00 H new ATOM 1853 N LYS A 114 15.951 3.250 -32.358 1.00 0.00 N ATOM 1854 CA LYS A 114 17.141 2.720 -31.647 1.00 0.00 C ATOM 1855 C LYS A 114 18.038 1.931 -32.614 1.00 0.00 C ATOM 1856 O LYS A 114 19.270 1.973 -32.515 1.00 0.00 O ATOM 1857 CB LYS A 114 16.710 1.803 -30.460 1.00 0.00 C ATOM 1858 CG LYS A 114 15.913 2.522 -29.343 1.00 0.00 C ATOM 1859 CD LYS A 114 16.719 3.657 -28.649 1.00 0.00 C ATOM 1860 CE LYS A 114 18.003 3.155 -27.951 1.00 0.00 C ATOM 1861 NZ LYS A 114 17.717 2.151 -26.892 1.00 0.00 N ATOM 0 H LYS A 114 15.075 2.817 -32.066 1.00 0.00 H new ATOM 0 HA LYS A 114 17.703 3.566 -31.252 1.00 0.00 H new ATOM 0 HB2 LYS A 114 16.104 0.986 -30.851 1.00 0.00 H new ATOM 0 HB3 LYS A 114 17.602 1.356 -30.021 1.00 0.00 H new ATOM 0 HG2 LYS A 114 15.001 2.941 -29.768 1.00 0.00 H new ATOM 0 HG3 LYS A 114 15.609 1.791 -28.594 1.00 0.00 H new ATOM 0 HD2 LYS A 114 16.987 4.409 -29.391 1.00 0.00 H new ATOM 0 HD3 LYS A 114 16.082 4.148 -27.913 1.00 0.00 H new ATOM 0 HE2 LYS A 114 18.669 2.716 -28.694 1.00 0.00 H new ATOM 0 HE3 LYS A 114 18.530 4.002 -27.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 18.604 1.883 -26.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 17.062 2.559 -26.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 17.285 1.308 -27.321 1.00 0.00 H new ATOM 1875 N LYS A 115 17.379 1.220 -33.546 1.00 0.00 N ATOM 1876 CA LYS A 115 18.030 0.439 -34.612 1.00 0.00 C ATOM 1877 C LYS A 115 18.786 1.363 -35.568 1.00 0.00 C ATOM 1878 O LYS A 115 19.862 1.011 -36.039 1.00 0.00 O ATOM 1879 CB LYS A 115 16.957 -0.360 -35.384 1.00 0.00 C ATOM 1880 CG LYS A 115 17.475 -1.240 -36.547 1.00 0.00 C ATOM 1881 CD LYS A 115 16.315 -1.900 -37.331 1.00 0.00 C ATOM 1882 CE LYS A 115 15.405 -2.767 -36.442 1.00 0.00 C ATOM 1883 NZ LYS A 115 16.152 -3.865 -35.779 1.00 0.00 N ATOM 0 H LYS A 115 16.361 1.171 -33.580 1.00 0.00 H new ATOM 0 HA LYS A 115 18.747 -0.249 -34.164 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.430 -1.000 -34.677 1.00 0.00 H new ATOM 0 HB3 LYS A 115 16.226 0.343 -35.784 1.00 0.00 H new ATOM 0 HG2 LYS A 115 18.072 -0.631 -37.226 1.00 0.00 H new ATOM 0 HG3 LYS A 115 18.133 -2.014 -36.152 1.00 0.00 H new ATOM 0 HD2 LYS A 115 15.716 -1.123 -37.806 1.00 0.00 H new ATOM 0 HD3 LYS A 115 16.728 -2.517 -38.129 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.936 -2.140 -35.684 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.603 -3.189 -37.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.492 -4.453 -35.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.621 -4.450 -36.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.867 -3.462 -35.141 1.00 0.00 H new ATOM 1897 N ARG A 116 18.200 2.550 -35.828 1.00 0.00 N ATOM 1898 CA ARG A 116 18.795 3.578 -36.701 1.00 0.00 C ATOM 1899 C ARG A 116 20.102 4.097 -36.091 1.00 0.00 C ATOM 1900 O ARG A 116 21.097 4.259 -36.789 1.00 0.00 O ATOM 1901 CB ARG A 116 17.806 4.756 -36.926 1.00 0.00 C ATOM 1902 CG ARG A 116 18.283 5.798 -37.974 1.00 0.00 C ATOM 1903 CD ARG A 116 17.371 7.043 -38.060 1.00 0.00 C ATOM 1904 NE ARG A 116 15.946 6.709 -38.237 1.00 0.00 N ATOM 1905 CZ ARG A 116 15.363 6.347 -39.394 1.00 0.00 C ATOM 1906 NH1 ARG A 116 16.074 6.197 -40.506 1.00 0.00 N ATOM 1907 NH2 ARG A 116 14.055 6.138 -39.426 1.00 0.00 N ATOM 0 H ARG A 116 17.298 2.821 -35.436 1.00 0.00 H new ATOM 0 HA ARG A 116 19.009 3.122 -37.668 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.844 4.352 -37.243 1.00 0.00 H new ATOM 0 HB3 ARG A 116 17.641 5.263 -35.975 1.00 0.00 H new ATOM 0 HG2 ARG A 116 19.296 6.115 -37.725 1.00 0.00 H new ATOM 0 HG3 ARG A 116 18.329 5.322 -38.954 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.489 7.635 -37.152 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.697 7.667 -38.892 1.00 0.00 H new ATOM 0 HE ARG A 116 15.350 6.757 -37.410 1.00 0.00 H new ATOM 0 HH11 ARG A 116 17.081 6.357 -40.493 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.613 5.922 -41.373 1.00 0.00 H new ATOM 0 HH21 ARG A 116 13.499 6.252 -38.578 1.00 0.00 H new ATOM 0 HH22 ARG A 116 13.604 5.863 -40.298 1.00 0.00 H new ATOM 1921 N GLU A 117 20.073 4.325 -34.768 1.00 0.00 N ATOM 1922 CA GLU A 117 21.240 4.784 -34.000 1.00 0.00 C ATOM 1923 C GLU A 117 22.315 3.677 -33.912 1.00 0.00 C ATOM 1924 O GLU A 117 23.520 3.972 -33.909 1.00 0.00 O ATOM 1925 CB GLU A 117 20.790 5.229 -32.585 1.00 0.00 C ATOM 1926 CG GLU A 117 19.774 6.399 -32.581 1.00 0.00 C ATOM 1927 CD GLU A 117 19.295 6.786 -31.170 1.00 0.00 C ATOM 1928 OE1 GLU A 117 18.531 6.011 -30.560 1.00 0.00 O ATOM 1929 OE2 GLU A 117 19.672 7.867 -30.661 1.00 0.00 O ATOM 0 H GLU A 117 19.236 4.195 -34.200 1.00 0.00 H new ATOM 0 HA GLU A 117 21.686 5.635 -34.514 1.00 0.00 H new ATOM 0 HB2 GLU A 117 20.347 4.376 -32.072 1.00 0.00 H new ATOM 0 HB3 GLU A 117 21.669 5.524 -32.012 1.00 0.00 H new ATOM 0 HG2 GLU A 117 20.231 7.269 -33.053 1.00 0.00 H new ATOM 0 HG3 GLU A 117 18.911 6.123 -33.187 1.00 0.00 H new ATOM 1936 N LEU A 118 21.857 2.405 -33.852 1.00 0.00 N ATOM 1937 CA LEU A 118 22.745 1.228 -33.800 1.00 0.00 C ATOM 1938 C LEU A 118 23.523 1.088 -35.119 1.00 0.00 C ATOM 1939 O LEU A 118 24.744 1.099 -35.118 1.00 0.00 O ATOM 1940 CB LEU A 118 21.946 -0.077 -33.513 1.00 0.00 C ATOM 1941 CG LEU A 118 22.780 -1.412 -33.531 1.00 0.00 C ATOM 1942 CD1 LEU A 118 23.860 -1.436 -32.419 1.00 0.00 C ATOM 1943 CD2 LEU A 118 21.856 -2.651 -33.450 1.00 0.00 C ATOM 0 H LEU A 118 20.865 2.170 -33.838 1.00 0.00 H new ATOM 0 HA LEU A 118 23.449 1.380 -32.981 1.00 0.00 H new ATOM 0 HB2 LEU A 118 21.470 0.018 -32.537 1.00 0.00 H new ATOM 0 HB3 LEU A 118 21.147 -0.160 -34.250 1.00 0.00 H new ATOM 0 HG LEU A 118 23.306 -1.451 -34.485 1.00 0.00 H new ATOM 0 HD11 LEU A 118 24.412 -2.375 -32.468 1.00 0.00 H new ATOM 0 HD12 LEU A 118 24.548 -0.603 -32.562 1.00 0.00 H new ATOM 0 HD13 LEU A 118 23.381 -1.347 -31.444 1.00 0.00 H new ATOM 0 HD21 LEU A 118 22.461 -3.558 -33.464 1.00 0.00 H new ATOM 0 HD22 LEU A 118 21.279 -2.615 -32.526 1.00 0.00 H new ATOM 0 HD23 LEU A 118 21.177 -2.655 -34.302 1.00 0.00 H new ATOM 1955 N GLU A 119 22.790 0.989 -36.243 1.00 0.00 N ATOM 1956 CA GLU A 119 23.380 0.808 -37.583 1.00 0.00 C ATOM 1957 C GLU A 119 24.236 2.025 -37.978 1.00 0.00 C ATOM 1958 O GLU A 119 25.232 1.871 -38.684 1.00 0.00 O ATOM 1959 CB GLU A 119 22.276 0.538 -38.634 1.00 0.00 C ATOM 1960 CG GLU A 119 21.302 1.710 -38.857 1.00 0.00 C ATOM 1961 CD GLU A 119 20.226 1.415 -39.906 1.00 0.00 C ATOM 1962 OE1 GLU A 119 20.502 1.597 -41.115 1.00 0.00 O ATOM 1963 OE2 GLU A 119 19.104 1.004 -39.540 1.00 0.00 O ATOM 0 H GLU A 119 21.771 1.032 -36.248 1.00 0.00 H new ATOM 0 HA GLU A 119 24.036 -0.062 -37.551 1.00 0.00 H new ATOM 0 HB2 GLU A 119 22.750 0.291 -39.584 1.00 0.00 H new ATOM 0 HB3 GLU A 119 21.705 -0.338 -38.325 1.00 0.00 H new ATOM 0 HG2 GLU A 119 20.819 1.956 -37.911 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.868 2.589 -39.165 1.00 0.00 H new ATOM 1970 N LYS A 120 23.846 3.221 -37.480 1.00 0.00 N ATOM 1971 CA LYS A 120 24.594 4.470 -37.704 1.00 0.00 C ATOM 1972 C LYS A 120 25.986 4.383 -37.064 1.00 0.00 C ATOM 1973 O LYS A 120 26.988 4.670 -37.722 1.00 0.00 O ATOM 1974 CB LYS A 120 23.821 5.691 -37.128 1.00 0.00 C ATOM 1975 CG LYS A 120 24.490 7.065 -37.383 1.00 0.00 C ATOM 1976 CD LYS A 120 24.617 7.391 -38.889 1.00 0.00 C ATOM 1977 CE LYS A 120 25.302 8.737 -39.158 1.00 0.00 C ATOM 1978 NZ LYS A 120 26.699 8.767 -38.672 1.00 0.00 N ATOM 0 H LYS A 120 23.006 3.342 -36.914 1.00 0.00 H new ATOM 0 HA LYS A 120 24.706 4.607 -38.780 1.00 0.00 H new ATOM 0 HB2 LYS A 120 22.820 5.705 -37.559 1.00 0.00 H new ATOM 0 HB3 LYS A 120 23.704 5.554 -36.053 1.00 0.00 H new ATOM 0 HG2 LYS A 120 23.908 7.846 -36.893 1.00 0.00 H new ATOM 0 HG3 LYS A 120 25.480 7.073 -36.928 1.00 0.00 H new ATOM 0 HD2 LYS A 120 25.182 6.598 -39.380 1.00 0.00 H new ATOM 0 HD3 LYS A 120 23.624 7.400 -39.338 1.00 0.00 H new ATOM 0 HE2 LYS A 120 25.288 8.941 -40.229 1.00 0.00 H new ATOM 0 HE3 LYS A 120 24.735 9.533 -38.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 27.150 9.657 -38.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 26.707 8.701 -37.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 27.224 7.964 -39.074 1.00 0.00 H new ATOM 1992 N ARG A 121 26.033 3.958 -35.781 1.00 0.00 N ATOM 1993 CA ARG A 121 27.299 3.842 -35.027 1.00 0.00 C ATOM 1994 C ARG A 121 28.107 2.617 -35.508 1.00 0.00 C ATOM 1995 O ARG A 121 29.315 2.582 -35.333 1.00 0.00 O ATOM 1996 CB ARG A 121 27.059 3.819 -33.475 1.00 0.00 C ATOM 1997 CG ARG A 121 26.407 2.518 -32.888 1.00 0.00 C ATOM 1998 CD ARG A 121 27.369 1.664 -32.023 1.00 0.00 C ATOM 1999 NE ARG A 121 28.609 1.312 -32.746 1.00 0.00 N ATOM 2000 CZ ARG A 121 29.160 0.100 -32.815 1.00 0.00 C ATOM 2001 NH1 ARG A 121 28.674 -0.918 -32.121 1.00 0.00 N ATOM 2002 NH2 ARG A 121 30.206 -0.090 -33.599 1.00 0.00 N ATOM 0 H ARG A 121 25.207 3.690 -35.247 1.00 0.00 H new ATOM 0 HA ARG A 121 27.893 4.733 -35.230 1.00 0.00 H new ATOM 0 HB2 ARG A 121 28.017 3.974 -32.979 1.00 0.00 H new ATOM 0 HB3 ARG A 121 26.424 4.666 -33.215 1.00 0.00 H new ATOM 0 HG2 ARG A 121 25.544 2.798 -32.284 1.00 0.00 H new ATOM 0 HG3 ARG A 121 26.036 1.907 -33.711 1.00 0.00 H new ATOM 0 HD2 ARG A 121 27.623 2.213 -31.116 1.00 0.00 H new ATOM 0 HD3 ARG A 121 26.861 0.751 -31.712 1.00 0.00 H new ATOM 0 HE ARG A 121 29.088 2.066 -33.238 1.00 0.00 H new ATOM 0 HH11 ARG A 121 27.862 -0.783 -31.518 1.00 0.00 H new ATOM 0 HH12 ARG A 121 29.112 -1.837 -32.189 1.00 0.00 H new ATOM 0 HH21 ARG A 121 30.583 0.686 -34.143 1.00 0.00 H new ATOM 0 HH22 ARG A 121 30.636 -1.013 -33.660 1.00 0.00 H new ATOM 2016 N LEU A 122 27.437 1.614 -36.112 1.00 0.00 N ATOM 2017 CA LEU A 122 28.130 0.449 -36.723 1.00 0.00 C ATOM 2018 C LEU A 122 29.000 0.896 -37.918 1.00 0.00 C ATOM 2019 O LEU A 122 30.036 0.292 -38.200 1.00 0.00 O ATOM 2020 CB LEU A 122 27.124 -0.653 -37.171 1.00 0.00 C ATOM 2021 CG LEU A 122 26.392 -1.443 -36.029 1.00 0.00 C ATOM 2022 CD1 LEU A 122 25.328 -2.413 -36.601 1.00 0.00 C ATOM 2023 CD2 LEU A 122 27.396 -2.193 -35.121 1.00 0.00 C ATOM 0 H LEU A 122 26.421 1.582 -36.192 1.00 0.00 H new ATOM 0 HA LEU A 122 28.776 0.019 -35.957 1.00 0.00 H new ATOM 0 HB2 LEU A 122 26.367 -0.187 -37.802 1.00 0.00 H new ATOM 0 HB3 LEU A 122 27.659 -1.371 -37.793 1.00 0.00 H new ATOM 0 HG LEU A 122 25.874 -0.708 -35.412 1.00 0.00 H new ATOM 0 HD11 LEU A 122 24.841 -2.943 -35.782 1.00 0.00 H new ATOM 0 HD12 LEU A 122 24.583 -1.847 -37.161 1.00 0.00 H new ATOM 0 HD13 LEU A 122 25.810 -3.132 -37.263 1.00 0.00 H new ATOM 0 HD21 LEU A 122 26.853 -2.728 -34.342 1.00 0.00 H new ATOM 0 HD22 LEU A 122 27.967 -2.903 -35.719 1.00 0.00 H new ATOM 0 HD23 LEU A 122 28.077 -1.476 -34.661 1.00 0.00 H new ATOM 2035 N GLN A 123 28.546 1.960 -38.609 1.00 0.00 N ATOM 2036 CA GLN A 123 29.280 2.567 -39.738 1.00 0.00 C ATOM 2037 C GLN A 123 30.296 3.605 -39.222 1.00 0.00 C ATOM 2038 O GLN A 123 31.444 3.643 -39.678 1.00 0.00 O ATOM 2039 CB GLN A 123 28.289 3.245 -40.733 1.00 0.00 C ATOM 2040 CG GLN A 123 27.128 2.347 -41.224 1.00 0.00 C ATOM 2041 CD GLN A 123 27.572 1.046 -41.897 1.00 0.00 C ATOM 2042 OE1 GLN A 123 28.628 0.976 -42.523 1.00 0.00 O ATOM 2043 NE2 GLN A 123 26.750 0.015 -41.799 1.00 0.00 N ATOM 0 H GLN A 123 27.661 2.423 -38.401 1.00 0.00 H new ATOM 0 HA GLN A 123 29.817 1.776 -40.261 1.00 0.00 H new ATOM 0 HB2 GLN A 123 27.866 4.128 -40.254 1.00 0.00 H new ATOM 0 HB3 GLN A 123 28.851 3.591 -41.601 1.00 0.00 H new ATOM 0 HG2 GLN A 123 26.490 2.102 -40.374 1.00 0.00 H new ATOM 0 HG3 GLN A 123 26.518 2.915 -41.927 1.00 0.00 H new ATOM 0 HE21 GLN A 123 25.881 0.104 -41.273 1.00 0.00 H new ATOM 0 HE22 GLN A 123 26.985 -0.869 -42.250 1.00 0.00 H new