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 174:sc= -0.057 (180deg=-0.165) 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+ 148:sc= 0.786 (180deg=0.159) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.43) 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= 0.586 (180deg=0.586) 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=-0.024) USER MOD Single : A 52 GLN : amide:sc= -1.39 X(o=-1.4,f=-1.5) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 68:sc= 0.995 USER MOD Single : A 62 ASN : amide:sc= 0.168 K(o=0.17,f=-0.71) USER MOD Single : A 72 THR OG1 : rot -79:sc= 0.264 USER MOD Single : A 74 LYS NZ :NH3+ -145:sc= -1.06 (180deg=-3.21!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.104 USER MOD Single : A 84 TYR OH : rot 180:sc= -1.32 USER MOD Single : A 87 SER OG : rot 70:sc= 1.1 USER MOD Single : A 88 CYS SG : rot 67:sc= 0.334 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0.00938 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0204) USER MOD Single : A 120 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0147) USER MOD Single : A 123 GLN : amide:sc= -0.782 K(o=-0.78,f=-0.0025) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -10.283 29.833 -18.237 1.00 0.00 N ATOM 297 CA ARG A 22 -11.756 29.807 -18.227 1.00 0.00 C ATOM 298 C ARG A 22 -12.255 29.231 -16.884 1.00 0.00 C ATOM 299 O ARG A 22 -11.518 28.464 -16.242 1.00 0.00 O ATOM 300 CB ARG A 22 -12.255 28.939 -19.423 1.00 0.00 C ATOM 301 CG ARG A 22 -11.690 27.493 -19.439 1.00 0.00 C ATOM 302 CD ARG A 22 -12.147 26.669 -20.654 1.00 0.00 C ATOM 303 NE ARG A 22 -11.493 25.345 -20.693 1.00 0.00 N ATOM 304 CZ ARG A 22 -11.869 24.311 -21.461 1.00 0.00 C ATOM 305 NH1 ARG A 22 -12.961 24.383 -22.214 1.00 0.00 N ATOM 306 NH2 ARG A 22 -11.151 23.193 -21.460 1.00 0.00 N ATOM 0 HA ARG A 22 -12.151 30.817 -18.334 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -13.344 28.891 -19.394 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.983 29.434 -20.355 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.601 27.537 -19.429 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -11.997 26.981 -18.527 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.229 26.540 -20.620 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.920 27.214 -21.570 1.00 0.00 H new ATOM 0 HE ARG A 22 -10.687 25.205 -20.084 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.526 25.232 -22.213 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -13.235 23.589 -22.793 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.317 23.123 -20.877 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.434 22.405 -22.042 1.00 0.00 H new ATOM 320 N PRO A 23 -13.492 29.609 -16.414 1.00 0.00 N ATOM 321 CA PRO A 23 -14.127 28.932 -15.266 1.00 0.00 C ATOM 322 C PRO A 23 -14.385 27.447 -15.614 1.00 0.00 C ATOM 323 O PRO A 23 -14.720 27.118 -16.761 1.00 0.00 O ATOM 324 CB PRO A 23 -15.446 29.727 -15.039 1.00 0.00 C ATOM 325 CG PRO A 23 -15.722 30.389 -16.355 1.00 0.00 C ATOM 326 CD PRO A 23 -14.358 30.708 -16.940 1.00 0.00 C ATOM 0 HA PRO A 23 -13.513 28.922 -14.365 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -16.262 29.065 -14.750 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -15.333 30.462 -14.242 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -16.288 29.731 -17.014 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -16.314 31.294 -16.223 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -14.380 30.716 -18.030 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -14.003 31.688 -16.621 1.00 0.00 H new ATOM 334 N MET A 24 -14.188 26.566 -14.629 1.00 0.00 N ATOM 335 CA MET A 24 -14.308 25.098 -14.811 1.00 0.00 C ATOM 336 C MET A 24 -15.785 24.658 -14.893 1.00 0.00 C ATOM 337 O MET A 24 -16.696 25.498 -14.804 1.00 0.00 O ATOM 338 CB MET A 24 -13.590 24.367 -13.650 1.00 0.00 C ATOM 339 CG MET A 24 -12.113 24.735 -13.458 1.00 0.00 C ATOM 340 SD MET A 24 -11.382 23.908 -12.027 1.00 0.00 S ATOM 341 CE MET A 24 -9.806 24.750 -11.887 1.00 0.00 C ATOM 0 H MET A 24 -13.940 26.840 -13.678 1.00 0.00 H new ATOM 0 HA MET A 24 -13.833 24.831 -15.755 1.00 0.00 H new ATOM 0 HB2 MET A 24 -14.124 24.579 -12.724 1.00 0.00 H new ATOM 0 HB3 MET A 24 -13.661 23.293 -13.820 1.00 0.00 H new ATOM 0 HG2 MET A 24 -11.554 24.467 -14.355 1.00 0.00 H new ATOM 0 HG3 MET A 24 -12.022 25.814 -13.337 1.00 0.00 H new ATOM 0 HE1 MET A 24 -9.295 24.417 -10.984 1.00 0.00 H new ATOM 0 HE2 MET A 24 -9.192 24.520 -12.758 1.00 0.00 H new ATOM 0 HE3 MET A 24 -9.972 25.826 -11.834 1.00 0.00 H new ATOM 351 N SER A 25 -16.013 23.336 -15.086 1.00 0.00 N ATOM 352 CA SER A 25 -17.364 22.755 -15.106 1.00 0.00 C ATOM 353 C SER A 25 -18.130 23.091 -13.811 1.00 0.00 C ATOM 354 O SER A 25 -17.628 22.889 -12.694 1.00 0.00 O ATOM 355 CB SER A 25 -17.287 21.227 -15.302 1.00 0.00 C ATOM 356 OG SER A 25 -18.557 20.604 -15.158 1.00 0.00 O ATOM 0 H SER A 25 -15.268 22.654 -15.230 1.00 0.00 H new ATOM 0 HA SER A 25 -17.908 23.191 -15.944 1.00 0.00 H new ATOM 0 HB2 SER A 25 -16.887 21.009 -16.292 1.00 0.00 H new ATOM 0 HB3 SER A 25 -16.592 20.804 -14.577 1.00 0.00 H new ATOM 0 HG SER A 25 -18.464 19.638 -15.291 1.00 0.00 H new ATOM 362 N TYR A 26 -19.356 23.582 -13.995 1.00 0.00 N ATOM 363 CA TYR A 26 -20.228 24.049 -12.916 1.00 0.00 C ATOM 364 C TYR A 26 -20.764 22.875 -12.093 1.00 0.00 C ATOM 365 O TYR A 26 -20.903 22.989 -10.880 1.00 0.00 O ATOM 366 CB TYR A 26 -21.394 24.881 -13.511 1.00 0.00 C ATOM 367 CG TYR A 26 -20.909 26.075 -14.364 1.00 0.00 C ATOM 368 CD1 TYR A 26 -20.756 25.972 -15.753 1.00 0.00 C ATOM 369 CD2 TYR A 26 -20.569 27.289 -13.774 1.00 0.00 C ATOM 370 CE1 TYR A 26 -20.297 27.039 -16.504 1.00 0.00 C ATOM 371 CE2 TYR A 26 -20.116 28.351 -14.524 1.00 0.00 C ATOM 372 CZ TYR A 26 -19.975 28.225 -15.882 1.00 0.00 C ATOM 373 OH TYR A 26 -19.513 29.293 -16.619 1.00 0.00 O ATOM 0 H TYR A 26 -19.780 23.668 -14.919 1.00 0.00 H new ATOM 0 HA TYR A 26 -19.646 24.681 -12.245 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -22.019 24.233 -14.125 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -22.020 25.252 -12.699 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -21.001 25.043 -16.246 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -20.663 27.400 -12.704 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -20.191 26.943 -17.574 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -19.871 29.286 -14.041 1.00 0.00 H new ATOM 0 HH TYR A 26 -19.335 30.050 -16.022 1.00 0.00 H new ATOM 383 N ASP A 27 -21.011 21.747 -12.786 1.00 0.00 N ATOM 384 CA ASP A 27 -21.654 20.542 -12.217 1.00 0.00 C ATOM 385 C ASP A 27 -20.776 19.880 -11.148 1.00 0.00 C ATOM 386 O ASP A 27 -21.289 19.409 -10.126 1.00 0.00 O ATOM 387 CB ASP A 27 -21.992 19.530 -13.347 1.00 0.00 C ATOM 388 CG ASP A 27 -22.954 20.119 -14.390 1.00 0.00 C ATOM 389 OD1 ASP A 27 -22.497 20.593 -15.457 1.00 0.00 O ATOM 390 OD2 ASP A 27 -24.178 20.134 -14.142 1.00 0.00 O ATOM 0 H ASP A 27 -20.767 21.643 -13.771 1.00 0.00 H new ATOM 0 HA ASP A 27 -22.578 20.856 -11.732 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -21.071 19.219 -13.840 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -22.437 18.636 -12.910 1.00 0.00 H new ATOM 395 N GLU A 28 -19.453 19.866 -11.387 1.00 0.00 N ATOM 396 CA GLU A 28 -18.482 19.290 -10.443 1.00 0.00 C ATOM 397 C GLU A 28 -18.471 20.093 -9.131 1.00 0.00 C ATOM 398 O GLU A 28 -18.604 19.543 -8.047 1.00 0.00 O ATOM 399 CB GLU A 28 -17.054 19.319 -11.047 1.00 0.00 C ATOM 400 CG GLU A 28 -16.893 18.675 -12.441 1.00 0.00 C ATOM 401 CD GLU A 28 -15.446 18.755 -12.960 1.00 0.00 C ATOM 402 OE1 GLU A 28 -14.991 19.870 -13.288 1.00 0.00 O ATOM 403 OE2 GLU A 28 -14.756 17.715 -13.041 1.00 0.00 O ATOM 0 H GLU A 28 -19.031 20.250 -12.232 1.00 0.00 H new ATOM 0 HA GLU A 28 -18.778 18.260 -10.246 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -16.729 20.358 -11.109 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -16.379 18.814 -10.356 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -17.202 17.631 -12.394 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -17.558 19.173 -13.147 1.00 0.00 H new ATOM 410 N LYS A 29 -18.312 21.413 -9.291 1.00 0.00 N ATOM 411 CA LYS A 29 -18.162 22.375 -8.184 1.00 0.00 C ATOM 412 C LYS A 29 -19.491 22.606 -7.442 1.00 0.00 C ATOM 413 O LYS A 29 -19.487 23.008 -6.280 1.00 0.00 O ATOM 414 CB LYS A 29 -17.570 23.719 -8.704 1.00 0.00 C ATOM 415 CG LYS A 29 -16.051 23.711 -9.019 1.00 0.00 C ATOM 416 CD LYS A 29 -15.654 22.705 -10.122 1.00 0.00 C ATOM 417 CE LYS A 29 -14.162 22.744 -10.458 1.00 0.00 C ATOM 418 NZ LYS A 29 -13.781 21.700 -11.437 1.00 0.00 N ATOM 0 H LYS A 29 -18.283 21.854 -10.210 1.00 0.00 H new ATOM 0 HA LYS A 29 -17.464 21.945 -7.465 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -18.108 24.005 -9.608 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -17.763 24.491 -7.960 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -15.747 24.712 -9.325 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -15.501 23.475 -8.108 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -15.922 21.698 -9.802 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -16.229 22.917 -11.023 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -13.907 23.725 -10.858 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -13.582 22.612 -9.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -13.000 22.048 -12.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -13.478 20.844 -10.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.598 21.475 -12.040 1.00 0.00 H new ATOM 432 N ARG A 30 -20.619 22.357 -8.130 1.00 0.00 N ATOM 433 CA ARG A 30 -21.967 22.457 -7.535 1.00 0.00 C ATOM 434 C ARG A 30 -22.236 21.224 -6.663 1.00 0.00 C ATOM 435 O ARG A 30 -22.928 21.311 -5.646 1.00 0.00 O ATOM 436 CB ARG A 30 -23.040 22.616 -8.641 1.00 0.00 C ATOM 437 CG ARG A 30 -24.445 23.021 -8.137 1.00 0.00 C ATOM 438 CD ARG A 30 -25.384 23.456 -9.281 1.00 0.00 C ATOM 439 NE ARG A 30 -24.799 24.565 -10.073 1.00 0.00 N ATOM 440 CZ ARG A 30 -24.853 25.877 -9.756 1.00 0.00 C ATOM 441 NH1 ARG A 30 -25.491 26.299 -8.670 1.00 0.00 N ATOM 442 NH2 ARG A 30 -24.267 26.767 -10.547 1.00 0.00 N ATOM 0 H ARG A 30 -20.624 22.081 -9.112 1.00 0.00 H new ATOM 0 HA ARG A 30 -22.019 23.343 -6.903 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -22.697 23.366 -9.354 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -23.123 21.674 -9.184 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -24.892 22.181 -7.605 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -24.349 23.837 -7.421 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -25.581 22.606 -9.934 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -26.342 23.769 -8.867 1.00 0.00 H new ATOM 0 HE ARG A 30 -24.312 24.315 -10.934 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -25.953 25.628 -8.056 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -25.519 27.295 -8.450 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -23.780 26.459 -11.388 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -24.304 27.759 -10.314 1.00 0.00 H new ATOM 456 N GLN A 31 -21.654 20.076 -7.073 1.00 0.00 N ATOM 457 CA GLN A 31 -21.601 18.861 -6.238 1.00 0.00 C ATOM 458 C GLN A 31 -20.723 19.129 -4.999 1.00 0.00 C ATOM 459 O GLN A 31 -21.070 18.717 -3.890 1.00 0.00 O ATOM 460 CB GLN A 31 -21.051 17.655 -7.047 1.00 0.00 C ATOM 461 CG GLN A 31 -20.950 16.324 -6.258 1.00 0.00 C ATOM 462 CD GLN A 31 -20.342 15.172 -7.067 1.00 0.00 C ATOM 463 OE1 GLN A 31 -19.503 15.376 -7.947 1.00 0.00 O ATOM 464 NE2 GLN A 31 -20.752 13.951 -6.768 1.00 0.00 N ATOM 0 H GLN A 31 -21.211 19.968 -7.986 1.00 0.00 H new ATOM 0 HA GLN A 31 -22.611 18.610 -5.915 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -21.692 17.497 -7.915 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -20.061 17.912 -7.424 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -20.347 16.486 -5.365 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -21.946 16.034 -5.922 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -21.447 13.812 -6.035 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -20.373 13.148 -7.270 1.00 0.00 H new ATOM 473 N LEU A 32 -19.605 19.867 -5.206 1.00 0.00 N ATOM 474 CA LEU A 32 -18.690 20.261 -4.110 1.00 0.00 C ATOM 475 C LEU A 32 -19.363 21.282 -3.177 1.00 0.00 C ATOM 476 O LEU A 32 -19.016 21.357 -2.007 1.00 0.00 O ATOM 477 CB LEU A 32 -17.338 20.838 -4.632 1.00 0.00 C ATOM 478 CG LEU A 32 -16.558 19.991 -5.693 1.00 0.00 C ATOM 479 CD1 LEU A 32 -15.134 20.543 -5.937 1.00 0.00 C ATOM 480 CD2 LEU A 32 -16.536 18.485 -5.346 1.00 0.00 C ATOM 0 H LEU A 32 -19.316 20.201 -6.125 1.00 0.00 H new ATOM 0 HA LEU A 32 -18.466 19.350 -3.555 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.534 21.820 -5.062 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.683 20.991 -3.774 1.00 0.00 H new ATOM 0 HG LEU A 32 -17.107 20.087 -6.629 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.627 19.927 -6.680 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.199 21.569 -6.300 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.571 20.523 -5.004 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.983 17.943 -6.113 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.052 18.341 -4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -17.557 18.107 -5.300 1.00 0.00 H new ATOM 492 N SER A 33 -20.320 22.069 -3.721 1.00 0.00 N ATOM 493 CA SER A 33 -21.123 23.040 -2.945 1.00 0.00 C ATOM 494 C SER A 33 -22.107 22.306 -2.003 1.00 0.00 C ATOM 495 O SER A 33 -22.511 22.851 -0.968 1.00 0.00 O ATOM 496 CB SER A 33 -21.875 24.000 -3.900 1.00 0.00 C ATOM 497 OG SER A 33 -22.549 25.042 -3.200 1.00 0.00 O ATOM 0 H SER A 33 -20.557 22.048 -4.713 1.00 0.00 H new ATOM 0 HA SER A 33 -20.450 23.634 -2.326 1.00 0.00 H new ATOM 0 HB2 SER A 33 -21.167 24.437 -4.604 1.00 0.00 H new ATOM 0 HB3 SER A 33 -22.598 23.433 -4.486 1.00 0.00 H new ATOM 0 HG SER A 33 -23.008 25.624 -3.842 1.00 0.00 H new ATOM 503 N LEU A 34 -22.489 21.072 -2.391 1.00 0.00 N ATOM 504 CA LEU A 34 -23.286 20.158 -1.542 1.00 0.00 C ATOM 505 C LEU A 34 -22.406 19.574 -0.424 1.00 0.00 C ATOM 506 O LEU A 34 -22.888 19.291 0.678 1.00 0.00 O ATOM 507 CB LEU A 34 -23.892 19.015 -2.401 1.00 0.00 C ATOM 508 CG LEU A 34 -24.793 19.470 -3.596 1.00 0.00 C ATOM 509 CD1 LEU A 34 -25.210 18.271 -4.484 1.00 0.00 C ATOM 510 CD2 LEU A 34 -26.029 20.266 -3.096 1.00 0.00 C ATOM 0 H LEU A 34 -22.254 20.679 -3.303 1.00 0.00 H new ATOM 0 HA LEU A 34 -24.101 20.722 -1.089 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -23.076 18.410 -2.795 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.482 18.370 -1.750 1.00 0.00 H new ATOM 0 HG LEU A 34 -24.200 20.140 -4.218 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -25.835 18.625 -5.304 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -24.319 17.791 -4.888 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -25.770 17.552 -3.885 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -26.636 20.569 -3.949 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -26.623 19.637 -2.433 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -25.697 21.152 -2.555 1.00 0.00 H new ATOM 522 N ASP A 35 -21.112 19.380 -0.742 1.00 0.00 N ATOM 523 CA ASP A 35 -20.084 18.974 0.239 1.00 0.00 C ATOM 524 C ASP A 35 -19.767 20.119 1.216 1.00 0.00 C ATOM 525 O ASP A 35 -19.421 19.863 2.365 1.00 0.00 O ATOM 526 CB ASP A 35 -18.794 18.483 -0.469 1.00 0.00 C ATOM 527 CG ASP A 35 -19.002 17.169 -1.237 1.00 0.00 C ATOM 528 OD1 ASP A 35 -19.004 17.182 -2.487 1.00 0.00 O ATOM 529 OD2 ASP A 35 -19.163 16.108 -0.578 1.00 0.00 O ATOM 0 H ASP A 35 -20.748 19.500 -1.687 1.00 0.00 H new ATOM 0 HA ASP A 35 -20.489 18.141 0.814 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -18.449 19.252 -1.160 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -18.008 18.345 0.273 1.00 0.00 H new ATOM 534 N ILE A 36 -19.905 21.376 0.752 1.00 0.00 N ATOM 535 CA ILE A 36 -19.771 22.577 1.611 1.00 0.00 C ATOM 536 C ILE A 36 -20.989 22.677 2.551 1.00 0.00 C ATOM 537 O ILE A 36 -20.854 23.057 3.710 1.00 0.00 O ATOM 538 CB ILE A 36 -19.633 23.894 0.740 1.00 0.00 C ATOM 539 CG1 ILE A 36 -18.358 23.828 -0.168 1.00 0.00 C ATOM 540 CG2 ILE A 36 -19.611 25.180 1.614 1.00 0.00 C ATOM 541 CD1 ILE A 36 -18.261 24.904 -1.242 1.00 0.00 C ATOM 0 H ILE A 36 -20.112 21.591 -0.223 1.00 0.00 H new ATOM 0 HA ILE A 36 -18.863 22.479 2.205 1.00 0.00 H new ATOM 0 HB ILE A 36 -20.517 23.949 0.105 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.476 23.895 0.469 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.328 22.852 -0.652 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.515 26.055 0.971 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -20.537 25.248 2.184 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -18.765 25.139 2.300 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -17.343 24.767 -1.813 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -19.118 24.829 -1.911 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -18.253 25.887 -0.772 1.00 0.00 H new ATOM 553 N ASN A 37 -22.176 22.305 2.036 1.00 0.00 N ATOM 554 CA ASN A 37 -23.414 22.210 2.851 1.00 0.00 C ATOM 555 C ASN A 37 -23.290 21.072 3.900 1.00 0.00 C ATOM 556 O ASN A 37 -23.867 21.146 4.993 1.00 0.00 O ATOM 557 CB ASN A 37 -24.638 21.987 1.919 1.00 0.00 C ATOM 558 CG ASN A 37 -25.990 21.927 2.653 1.00 0.00 C ATOM 559 OD1 ASN A 37 -26.455 20.854 3.051 1.00 0.00 O ATOM 560 ND2 ASN A 37 -26.631 23.073 2.836 1.00 0.00 N ATOM 0 H ASN A 37 -22.310 22.063 1.054 1.00 0.00 H new ATOM 0 HA ASN A 37 -23.559 23.144 3.394 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -24.672 22.792 1.184 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -24.496 21.058 1.368 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -27.531 23.083 3.316 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -26.224 23.945 2.497 1.00 0.00 H new ATOM 567 N LYS A 38 -22.501 20.041 3.542 1.00 0.00 N ATOM 568 CA LYS A 38 -22.158 18.905 4.432 1.00 0.00 C ATOM 569 C LYS A 38 -21.134 19.350 5.505 1.00 0.00 C ATOM 570 O LYS A 38 -21.105 18.802 6.617 1.00 0.00 O ATOM 571 CB LYS A 38 -21.589 17.726 3.549 1.00 0.00 C ATOM 572 CG LYS A 38 -20.348 16.969 4.120 1.00 0.00 C ATOM 573 CD LYS A 38 -19.663 16.045 3.093 1.00 0.00 C ATOM 574 CE LYS A 38 -20.595 14.955 2.544 1.00 0.00 C ATOM 575 NZ LYS A 38 -19.897 14.114 1.547 1.00 0.00 N ATOM 0 H LYS A 38 -22.077 19.969 2.617 1.00 0.00 H new ATOM 0 HA LYS A 38 -23.048 18.560 4.957 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -22.388 17.002 3.390 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -21.324 18.128 2.571 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -19.623 17.698 4.481 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -20.659 16.376 4.980 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -19.291 16.647 2.264 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -18.798 15.573 3.559 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -20.954 14.332 3.363 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -21.470 15.416 2.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -20.548 13.385 1.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -19.576 14.708 0.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -19.076 13.657 1.992 1.00 0.00 H new ATOM 589 N LEU A 39 -20.312 20.357 5.170 1.00 0.00 N ATOM 590 CA LEU A 39 -19.345 20.947 6.104 1.00 0.00 C ATOM 591 C LEU A 39 -20.089 21.864 7.099 1.00 0.00 C ATOM 592 O LEU A 39 -21.021 22.560 6.694 1.00 0.00 O ATOM 593 CB LEU A 39 -18.251 21.744 5.338 1.00 0.00 C ATOM 594 CG LEU A 39 -17.293 20.905 4.427 1.00 0.00 C ATOM 595 CD1 LEU A 39 -16.327 21.815 3.631 1.00 0.00 C ATOM 596 CD2 LEU A 39 -16.520 19.839 5.251 1.00 0.00 C ATOM 0 H LEU A 39 -20.300 20.784 4.244 1.00 0.00 H new ATOM 0 HA LEU A 39 -18.849 20.147 6.654 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -18.744 22.493 4.718 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -17.646 22.282 6.067 1.00 0.00 H new ATOM 0 HG LEU A 39 -17.911 20.375 3.702 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -15.677 21.200 3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -16.902 22.490 2.997 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -15.721 22.397 4.325 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -15.864 19.273 4.590 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.924 20.334 6.018 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -17.229 19.161 5.725 1.00 0.00 H new ATOM 608 N PRO A 40 -19.727 21.843 8.424 1.00 0.00 N ATOM 609 CA PRO A 40 -20.332 22.755 9.436 1.00 0.00 C ATOM 610 C PRO A 40 -20.020 24.241 9.145 1.00 0.00 C ATOM 611 O PRO A 40 -19.089 24.548 8.389 1.00 0.00 O ATOM 612 CB PRO A 40 -19.702 22.282 10.776 1.00 0.00 C ATOM 613 CG PRO A 40 -18.438 21.583 10.384 1.00 0.00 C ATOM 614 CD PRO A 40 -18.739 20.916 9.058 1.00 0.00 C ATOM 0 HA PRO A 40 -21.421 22.707 9.441 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -19.498 23.125 11.436 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -20.373 21.612 11.313 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -17.612 22.288 10.290 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -18.146 20.849 11.135 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -17.841 20.807 8.449 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -19.154 19.918 9.195 1.00 0.00 H new ATOM 622 N GLY A 41 -20.807 25.144 9.775 1.00 0.00 N ATOM 623 CA GLY A 41 -20.747 26.600 9.541 1.00 0.00 C ATOM 624 C GLY A 41 -19.356 27.216 9.706 1.00 0.00 C ATOM 625 O GLY A 41 -19.016 28.173 9.006 1.00 0.00 O ATOM 0 H GLY A 41 -21.507 24.876 10.466 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -21.104 26.807 8.532 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -21.432 27.094 10.230 1.00 0.00 H new ATOM 629 N GLU A 42 -18.567 26.660 10.649 1.00 0.00 N ATOM 630 CA GLU A 42 -17.165 27.075 10.910 1.00 0.00 C ATOM 631 C GLU A 42 -16.275 26.971 9.643 1.00 0.00 C ATOM 632 O GLU A 42 -15.360 27.782 9.454 1.00 0.00 O ATOM 633 CB GLU A 42 -16.572 26.210 12.057 1.00 0.00 C ATOM 634 CG GLU A 42 -16.641 24.686 11.805 1.00 0.00 C ATOM 635 CD GLU A 42 -15.938 23.849 12.879 1.00 0.00 C ATOM 636 OE1 GLU A 42 -16.531 23.622 13.953 1.00 0.00 O ATOM 637 OE2 GLU A 42 -14.792 23.420 12.655 1.00 0.00 O ATOM 0 H GLU A 42 -18.883 25.905 11.257 1.00 0.00 H new ATOM 0 HA GLU A 42 -17.178 28.124 11.205 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -15.531 26.494 12.210 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -17.104 26.438 12.981 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -17.687 24.383 11.749 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -16.193 24.467 10.836 1.00 0.00 H new ATOM 644 N LYS A 43 -16.591 25.992 8.772 1.00 0.00 N ATOM 645 CA LYS A 43 -15.828 25.730 7.534 1.00 0.00 C ATOM 646 C LYS A 43 -16.265 26.730 6.465 1.00 0.00 C ATOM 647 O LYS A 43 -15.437 27.207 5.693 1.00 0.00 O ATOM 648 CB LYS A 43 -16.065 24.280 7.003 1.00 0.00 C ATOM 649 CG LYS A 43 -15.893 23.150 8.036 1.00 0.00 C ATOM 650 CD LYS A 43 -14.485 23.098 8.658 1.00 0.00 C ATOM 651 CE LYS A 43 -14.363 21.977 9.699 1.00 0.00 C ATOM 652 NZ LYS A 43 -13.038 21.964 10.369 1.00 0.00 N ATOM 0 H LYS A 43 -17.381 25.361 8.906 1.00 0.00 H new ATOM 0 HA LYS A 43 -14.767 25.837 7.759 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -17.074 24.223 6.596 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -15.377 24.099 6.177 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -16.628 23.279 8.830 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -16.106 22.194 7.557 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.746 22.946 7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -14.259 24.056 9.127 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -15.145 22.096 10.449 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -14.531 21.015 9.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -13.007 21.189 11.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -12.291 21.823 9.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -12.886 22.870 10.856 1.00 0.00 H new ATOM 666 N LEU A 44 -17.573 27.073 6.471 1.00 0.00 N ATOM 667 CA LEU A 44 -18.155 28.066 5.546 1.00 0.00 C ATOM 668 C LEU A 44 -17.543 29.442 5.810 1.00 0.00 C ATOM 669 O LEU A 44 -17.273 30.167 4.873 1.00 0.00 O ATOM 670 CB LEU A 44 -19.709 28.118 5.652 1.00 0.00 C ATOM 671 CG LEU A 44 -20.495 26.950 4.959 1.00 0.00 C ATOM 672 CD1 LEU A 44 -20.153 25.572 5.566 1.00 0.00 C ATOM 673 CD2 LEU A 44 -22.020 27.216 4.987 1.00 0.00 C ATOM 0 H LEU A 44 -18.252 26.669 7.117 1.00 0.00 H new ATOM 0 HA LEU A 44 -17.917 27.760 4.527 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -19.979 28.132 6.708 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -20.049 29.061 5.223 1.00 0.00 H new ATOM 0 HG LEU A 44 -20.174 26.921 3.918 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -20.722 24.797 5.053 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -19.087 25.377 5.449 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -20.408 25.568 6.626 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -22.542 26.392 4.501 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -22.356 27.299 6.021 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -22.237 28.145 4.460 1.00 0.00 H new ATOM 685 N GLY A 45 -17.271 29.759 7.097 1.00 0.00 N ATOM 686 CA GLY A 45 -16.620 31.027 7.488 1.00 0.00 C ATOM 687 C GLY A 45 -15.241 31.252 6.852 1.00 0.00 C ATOM 688 O GLY A 45 -14.697 32.359 6.905 1.00 0.00 O ATOM 0 H GLY A 45 -17.494 29.150 7.884 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.273 31.856 7.215 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.515 31.048 8.573 1.00 0.00 H new ATOM 692 N ARG A 46 -14.682 30.177 6.260 1.00 0.00 N ATOM 693 CA ARG A 46 -13.431 30.203 5.492 1.00 0.00 C ATOM 694 C ARG A 46 -13.715 30.056 3.981 1.00 0.00 C ATOM 695 O ARG A 46 -13.107 30.748 3.158 1.00 0.00 O ATOM 696 CB ARG A 46 -12.503 29.059 5.986 1.00 0.00 C ATOM 697 CG ARG A 46 -12.112 29.143 7.480 1.00 0.00 C ATOM 698 CD ARG A 46 -11.356 30.441 7.816 1.00 0.00 C ATOM 699 NE ARG A 46 -10.935 30.477 9.228 1.00 0.00 N ATOM 700 CZ ARG A 46 -9.954 31.243 9.732 1.00 0.00 C ATOM 701 NH1 ARG A 46 -9.241 32.053 8.957 1.00 0.00 N ATOM 702 NH2 ARG A 46 -9.690 31.187 11.028 1.00 0.00 N ATOM 0 H ARG A 46 -15.101 29.248 6.307 1.00 0.00 H new ATOM 0 HA ARG A 46 -12.936 31.162 5.647 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.999 28.105 5.807 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -11.593 29.063 5.386 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.012 29.081 8.092 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.490 28.286 7.739 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -10.480 30.529 7.173 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.994 31.299 7.605 1.00 0.00 H new ATOM 0 HE ARG A 46 -11.431 29.868 9.878 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.434 32.102 7.957 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -8.501 32.626 9.362 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -10.229 30.567 11.632 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -8.947 31.764 11.423 1.00 0.00 H new ATOM 716 N VAL A 47 -14.651 29.149 3.638 1.00 0.00 N ATOM 717 CA VAL A 47 -14.994 28.836 2.236 1.00 0.00 C ATOM 718 C VAL A 47 -15.663 30.042 1.552 1.00 0.00 C ATOM 719 O VAL A 47 -15.172 30.520 0.531 1.00 0.00 O ATOM 720 CB VAL A 47 -15.911 27.553 2.120 1.00 0.00 C ATOM 721 CG1 VAL A 47 -16.405 27.332 0.668 1.00 0.00 C ATOM 722 CG2 VAL A 47 -15.174 26.292 2.639 1.00 0.00 C ATOM 0 H VAL A 47 -15.188 28.615 4.321 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.059 28.616 1.720 1.00 0.00 H new ATOM 0 HB VAL A 47 -16.785 27.725 2.748 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -17.032 26.441 0.629 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.983 28.197 0.345 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -15.548 27.202 0.008 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.828 25.425 2.547 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.271 26.130 2.050 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -14.904 26.434 3.685 1.00 0.00 H new ATOM 732 N VAL A 48 -16.786 30.532 2.122 1.00 0.00 N ATOM 733 CA VAL A 48 -17.507 31.703 1.578 1.00 0.00 C ATOM 734 C VAL A 48 -16.633 32.967 1.660 1.00 0.00 C ATOM 735 O VAL A 48 -16.771 33.860 0.824 1.00 0.00 O ATOM 736 CB VAL A 48 -18.903 31.979 2.283 1.00 0.00 C ATOM 737 CG1 VAL A 48 -18.762 32.580 3.711 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.786 32.886 1.400 1.00 0.00 C ATOM 0 H VAL A 48 -17.212 30.134 2.959 1.00 0.00 H new ATOM 0 HA VAL A 48 -17.719 31.458 0.537 1.00 0.00 H new ATOM 0 HB VAL A 48 -19.385 31.009 2.402 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -19.752 32.744 4.136 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -18.206 31.888 4.344 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -18.229 33.529 3.655 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.738 33.064 1.899 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.280 33.837 1.234 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.964 32.398 0.442 1.00 0.00 H new ATOM 748 N HIS A 49 -15.719 33.003 2.662 1.00 0.00 N ATOM 749 CA HIS A 49 -14.855 34.162 2.917 1.00 0.00 C ATOM 750 C HIS A 49 -13.968 34.477 1.705 1.00 0.00 C ATOM 751 O HIS A 49 -13.932 35.621 1.268 1.00 0.00 O ATOM 752 CB HIS A 49 -13.993 33.959 4.185 1.00 0.00 C ATOM 753 CG HIS A 49 -13.157 35.169 4.531 1.00 0.00 C ATOM 754 ND1 HIS A 49 -11.845 35.342 4.133 1.00 0.00 N ATOM 755 CD2 HIS A 49 -13.487 36.298 5.216 1.00 0.00 C ATOM 756 CE1 HIS A 49 -11.439 36.542 4.567 1.00 0.00 C ATOM 757 NE2 HIS A 49 -12.395 37.160 5.233 1.00 0.00 N ATOM 0 H HIS A 49 -15.568 32.228 3.308 1.00 0.00 H new ATOM 0 HA HIS A 49 -15.509 35.017 3.089 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -14.644 33.722 5.026 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -13.337 33.101 4.038 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -14.445 36.494 5.674 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -10.455 36.951 4.394 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -12.344 38.080 5.670 1.00 0.00 H new ATOM 765 N ILE A 50 -13.272 33.451 1.164 1.00 0.00 N ATOM 766 CA ILE A 50 -12.392 33.618 -0.016 1.00 0.00 C ATOM 767 C ILE A 50 -13.219 33.980 -1.268 1.00 0.00 C ATOM 768 O ILE A 50 -12.792 34.795 -2.074 1.00 0.00 O ATOM 769 CB ILE A 50 -11.482 32.350 -0.288 1.00 0.00 C ATOM 770 CG1 ILE A 50 -12.329 31.077 -0.639 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.546 32.080 0.921 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.517 29.844 -1.000 1.00 0.00 C ATOM 0 H ILE A 50 -13.303 32.498 1.526 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.717 34.443 0.211 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.868 32.572 -1.161 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.966 30.837 0.212 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.988 31.316 -1.473 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -9.929 31.205 0.715 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -9.905 32.946 1.085 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.146 31.899 1.813 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.191 29.018 -1.226 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.899 30.058 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -10.877 29.571 -0.161 1.00 0.00 H new ATOM 784 N ILE A 51 -14.431 33.405 -1.383 1.00 0.00 N ATOM 785 CA ILE A 51 -15.353 33.673 -2.515 1.00 0.00 C ATOM 786 C ILE A 51 -15.732 35.168 -2.563 1.00 0.00 C ATOM 787 O ILE A 51 -15.611 35.813 -3.603 1.00 0.00 O ATOM 788 CB ILE A 51 -16.655 32.790 -2.397 1.00 0.00 C ATOM 789 CG1 ILE A 51 -16.280 31.276 -2.388 1.00 0.00 C ATOM 790 CG2 ILE A 51 -17.694 33.098 -3.520 1.00 0.00 C ATOM 791 CD1 ILE A 51 -17.416 30.345 -2.020 1.00 0.00 C ATOM 0 H ILE A 51 -14.802 32.744 -0.700 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.838 33.411 -3.439 1.00 0.00 H new ATOM 0 HB ILE A 51 -17.134 33.046 -1.452 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -15.909 31.002 -3.375 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -15.461 31.123 -1.686 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -18.570 32.462 -3.390 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -17.994 34.144 -3.461 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -17.245 32.903 -4.494 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -17.063 29.314 -2.040 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -17.775 30.586 -1.019 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -18.230 30.463 -2.735 1.00 0.00 H new ATOM 803 N GLN A 52 -16.142 35.705 -1.402 1.00 0.00 N ATOM 804 CA GLN A 52 -16.631 37.091 -1.276 1.00 0.00 C ATOM 805 C GLN A 52 -15.464 38.092 -1.091 1.00 0.00 C ATOM 806 O GLN A 52 -15.650 39.299 -1.233 1.00 0.00 O ATOM 807 CB GLN A 52 -17.652 37.188 -0.114 1.00 0.00 C ATOM 808 CG GLN A 52 -17.068 37.000 1.300 1.00 0.00 C ATOM 809 CD GLN A 52 -18.151 36.964 2.379 1.00 0.00 C ATOM 810 OE1 GLN A 52 -18.675 35.901 2.714 1.00 0.00 O ATOM 811 NE2 GLN A 52 -18.485 38.115 2.940 1.00 0.00 N ATOM 0 H GLN A 52 -16.144 35.190 -0.521 1.00 0.00 H new ATOM 0 HA GLN A 52 -17.135 37.364 -2.203 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -18.138 38.163 -0.161 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -18.427 36.438 -0.271 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -16.495 36.073 1.333 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -16.373 37.812 1.514 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -18.032 38.979 2.640 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -19.195 38.139 3.672 1.00 0.00 H new ATOM 820 N ALA A 53 -14.260 37.583 -0.768 1.00 0.00 N ATOM 821 CA ALA A 53 -13.036 38.411 -0.685 1.00 0.00 C ATOM 822 C ALA A 53 -12.552 38.775 -2.098 1.00 0.00 C ATOM 823 O ALA A 53 -12.090 39.895 -2.342 1.00 0.00 O ATOM 824 CB ALA A 53 -11.932 37.680 0.096 1.00 0.00 C ATOM 0 H ALA A 53 -14.106 36.597 -0.559 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.273 39.329 -0.148 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -11.043 38.309 0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.281 37.468 1.107 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.689 36.744 -0.408 1.00 0.00 H new ATOM 830 N ARG A 54 -12.663 37.794 -3.012 1.00 0.00 N ATOM 831 CA ARG A 54 -12.353 37.967 -4.442 1.00 0.00 C ATOM 832 C ARG A 54 -13.501 38.722 -5.138 1.00 0.00 C ATOM 833 O ARG A 54 -13.248 39.587 -5.981 1.00 0.00 O ATOM 834 CB ARG A 54 -12.087 36.581 -5.120 1.00 0.00 C ATOM 835 CG ARG A 54 -10.657 35.982 -4.902 1.00 0.00 C ATOM 836 CD ARG A 54 -10.256 35.818 -3.425 1.00 0.00 C ATOM 837 NE ARG A 54 -8.978 35.101 -3.256 1.00 0.00 N ATOM 838 CZ ARG A 54 -7.941 35.512 -2.513 1.00 0.00 C ATOM 839 NH1 ARG A 54 -7.939 36.708 -1.952 1.00 0.00 N ATOM 840 NH2 ARG A 54 -6.902 34.715 -2.341 1.00 0.00 N ATOM 0 H ARG A 54 -12.973 36.851 -2.776 1.00 0.00 H new ATOM 0 HA ARG A 54 -11.444 38.560 -4.541 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.821 35.867 -4.746 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.259 36.682 -6.192 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.605 35.009 -5.390 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -9.928 36.625 -5.395 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -10.179 36.802 -2.963 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -11.043 35.279 -2.897 1.00 0.00 H new ATOM 0 HE ARG A 54 -8.874 34.214 -3.748 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -8.734 37.333 -2.081 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -7.142 37.006 -1.389 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -6.891 33.791 -2.773 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -6.111 35.024 -1.776 1.00 0.00 H new ATOM 854 N GLU A 55 -14.753 38.399 -4.752 1.00 0.00 N ATOM 855 CA GLU A 55 -15.977 39.042 -5.283 1.00 0.00 C ATOM 856 C GLU A 55 -16.560 39.996 -4.213 1.00 0.00 C ATOM 857 O GLU A 55 -17.408 39.576 -3.414 1.00 0.00 O ATOM 858 CB GLU A 55 -17.029 37.967 -5.690 1.00 0.00 C ATOM 859 CG GLU A 55 -16.528 36.912 -6.693 1.00 0.00 C ATOM 860 CD GLU A 55 -16.009 37.511 -8.009 1.00 0.00 C ATOM 861 OE1 GLU A 55 -16.836 37.853 -8.882 1.00 0.00 O ATOM 862 OE2 GLU A 55 -14.778 37.643 -8.178 1.00 0.00 O ATOM 0 H GLU A 55 -14.946 37.678 -4.057 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.722 39.616 -6.174 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -17.371 37.457 -4.790 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -17.895 38.472 -6.119 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -15.731 36.331 -6.229 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.340 36.219 -6.914 1.00 0.00 H new ATOM 869 N PRO A 56 -16.116 41.298 -4.172 1.00 0.00 N ATOM 870 CA PRO A 56 -16.462 42.245 -3.076 1.00 0.00 C ATOM 871 C PRO A 56 -17.963 42.604 -3.034 1.00 0.00 C ATOM 872 O PRO A 56 -18.461 43.053 -2.003 1.00 0.00 O ATOM 873 CB PRO A 56 -15.578 43.499 -3.367 1.00 0.00 C ATOM 874 CG PRO A 56 -14.564 43.040 -4.373 1.00 0.00 C ATOM 875 CD PRO A 56 -15.256 41.970 -5.179 1.00 0.00 C ATOM 0 HA PRO A 56 -16.272 41.807 -2.096 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.177 44.321 -3.759 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -15.096 43.860 -2.459 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -14.241 43.864 -5.009 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -13.673 42.648 -3.882 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.844 42.394 -5.993 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -14.543 41.278 -5.628 1.00 0.00 H new ATOM 883 N SER A 57 -18.661 42.396 -4.163 1.00 0.00 N ATOM 884 CA SER A 57 -20.117 42.581 -4.263 1.00 0.00 C ATOM 885 C SER A 57 -20.850 41.587 -3.338 1.00 0.00 C ATOM 886 O SER A 57 -21.788 41.962 -2.624 1.00 0.00 O ATOM 887 CB SER A 57 -20.561 42.398 -5.731 1.00 0.00 C ATOM 888 OG SER A 57 -19.829 43.266 -6.583 1.00 0.00 O ATOM 0 H SER A 57 -18.228 42.093 -5.036 1.00 0.00 H new ATOM 0 HA SER A 57 -20.375 43.590 -3.942 1.00 0.00 H new ATOM 0 HB2 SER A 57 -20.407 41.363 -6.037 1.00 0.00 H new ATOM 0 HB3 SER A 57 -21.628 42.603 -5.823 1.00 0.00 H new ATOM 0 HG SER A 57 -20.120 43.137 -7.510 1.00 0.00 H new ATOM 894 N LEU A 58 -20.363 40.331 -3.342 1.00 0.00 N ATOM 895 CA LEU A 58 -20.900 39.232 -2.509 1.00 0.00 C ATOM 896 C LEU A 58 -20.563 39.452 -1.013 1.00 0.00 C ATOM 897 O LEU A 58 -21.265 38.950 -0.131 1.00 0.00 O ATOM 898 CB LEU A 58 -20.344 37.856 -3.002 1.00 0.00 C ATOM 899 CG LEU A 58 -20.964 37.261 -4.324 1.00 0.00 C ATOM 900 CD1 LEU A 58 -20.726 38.160 -5.566 1.00 0.00 C ATOM 901 CD2 LEU A 58 -20.443 35.822 -4.576 1.00 0.00 C ATOM 0 H LEU A 58 -19.579 40.046 -3.928 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.985 39.226 -2.610 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -19.269 37.959 -3.150 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -20.488 37.128 -2.204 1.00 0.00 H new ATOM 0 HG LEU A 58 -22.043 37.226 -4.172 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -21.177 37.695 -6.443 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -21.179 39.137 -5.400 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -19.655 38.280 -5.729 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -20.884 35.431 -5.493 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -19.358 35.840 -4.674 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -20.721 35.182 -3.738 1.00 0.00 H new ATOM 913 N ARG A 59 -19.473 40.204 -0.761 1.00 0.00 N ATOM 914 CA ARG A 59 -19.027 40.581 0.600 1.00 0.00 C ATOM 915 C ARG A 59 -19.963 41.629 1.212 1.00 0.00 C ATOM 916 O ARG A 59 -20.312 41.551 2.396 1.00 0.00 O ATOM 917 CB ARG A 59 -17.571 41.112 0.534 1.00 0.00 C ATOM 918 CG ARG A 59 -16.940 41.549 1.874 1.00 0.00 C ATOM 919 CD ARG A 59 -15.487 42.027 1.695 1.00 0.00 C ATOM 920 NE ARG A 59 -14.934 42.587 2.941 1.00 0.00 N ATOM 921 CZ ARG A 59 -14.187 43.705 3.031 1.00 0.00 C ATOM 922 NH1 ARG A 59 -13.919 44.439 1.957 1.00 0.00 N ATOM 923 NH2 ARG A 59 -13.731 44.095 4.208 1.00 0.00 N ATOM 0 H ARG A 59 -18.872 40.570 -1.499 1.00 0.00 H new ATOM 0 HA ARG A 59 -19.058 39.700 1.242 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -16.943 40.335 0.098 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -17.547 41.962 -0.148 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -17.535 42.351 2.311 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -16.964 40.715 2.576 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -14.868 41.192 1.367 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -15.447 42.781 0.909 1.00 0.00 H new ATOM 0 HE ARG A 59 -15.133 42.087 3.807 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -14.280 44.159 1.045 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -13.352 45.282 2.044 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -13.945 43.551 5.044 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -13.165 44.941 4.281 1.00 0.00 H new ATOM 937 N ASP A 60 -20.359 42.607 0.376 1.00 0.00 N ATOM 938 CA ASP A 60 -21.314 43.673 0.753 1.00 0.00 C ATOM 939 C ASP A 60 -22.751 43.131 0.830 1.00 0.00 C ATOM 940 O ASP A 60 -23.605 43.741 1.480 1.00 0.00 O ATOM 941 CB ASP A 60 -21.219 44.882 -0.228 1.00 0.00 C ATOM 942 CG ASP A 60 -19.978 45.759 0.015 1.00 0.00 C ATOM 943 OD1 ASP A 60 -20.126 46.956 0.361 1.00 0.00 O ATOM 944 OD2 ASP A 60 -18.841 45.246 -0.093 1.00 0.00 O ATOM 0 H ASP A 60 -20.026 42.683 -0.585 1.00 0.00 H new ATOM 0 HA ASP A 60 -21.042 44.028 1.747 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -21.199 44.510 -1.253 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.115 45.495 -0.128 1.00 0.00 H new ATOM 949 N SER A 61 -23.009 41.984 0.175 1.00 0.00 N ATOM 950 CA SER A 61 -24.291 41.264 0.290 1.00 0.00 C ATOM 951 C SER A 61 -24.373 40.528 1.644 1.00 0.00 C ATOM 952 O SER A 61 -23.338 40.188 2.237 1.00 0.00 O ATOM 953 CB SER A 61 -24.436 40.258 -0.870 1.00 0.00 C ATOM 954 OG SER A 61 -24.362 40.900 -2.132 1.00 0.00 O ATOM 0 H SER A 61 -22.338 41.532 -0.446 1.00 0.00 H new ATOM 0 HA SER A 61 -25.105 41.987 0.237 1.00 0.00 H new ATOM 0 HB2 SER A 61 -23.652 39.504 -0.798 1.00 0.00 H new ATOM 0 HB3 SER A 61 -25.389 39.736 -0.782 1.00 0.00 H new ATOM 0 HG SER A 61 -23.454 41.242 -2.272 1.00 0.00 H new ATOM 960 N ASN A 62 -25.612 40.312 2.129 1.00 0.00 N ATOM 961 CA ASN A 62 -25.868 39.510 3.338 1.00 0.00 C ATOM 962 C ASN A 62 -25.487 38.025 3.081 1.00 0.00 C ATOM 963 O ASN A 62 -25.953 37.442 2.094 1.00 0.00 O ATOM 964 CB ASN A 62 -27.364 39.622 3.775 1.00 0.00 C ATOM 965 CG ASN A 62 -27.747 40.962 4.417 1.00 0.00 C ATOM 966 OD1 ASN A 62 -27.164 42.001 4.133 1.00 0.00 O ATOM 967 ND2 ASN A 62 -28.759 40.952 5.272 1.00 0.00 N ATOM 0 H ASN A 62 -26.456 40.686 1.696 1.00 0.00 H new ATOM 0 HA ASN A 62 -25.251 39.899 4.148 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -27.996 39.459 2.902 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -27.583 38.821 4.481 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -29.067 41.821 5.708 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -29.230 40.075 5.494 1.00 0.00 H new ATOM 974 N PRO A 63 -24.625 37.396 3.958 1.00 0.00 N ATOM 975 CA PRO A 63 -24.230 35.959 3.824 1.00 0.00 C ATOM 976 C PRO A 63 -25.401 34.965 4.059 1.00 0.00 C ATOM 977 O PRO A 63 -25.217 33.751 3.927 1.00 0.00 O ATOM 978 CB PRO A 63 -23.111 35.790 4.892 1.00 0.00 C ATOM 979 CG PRO A 63 -23.400 36.852 5.911 1.00 0.00 C ATOM 980 CD PRO A 63 -23.932 38.035 5.125 1.00 0.00 C ATOM 0 HA PRO A 63 -23.904 35.727 2.810 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -23.135 34.796 5.338 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -22.121 35.919 4.454 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -24.131 36.506 6.642 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -22.500 37.121 6.463 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -24.619 38.636 5.720 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -23.128 38.696 4.802 1.00 0.00 H new ATOM 988 N GLU A 64 -26.587 35.488 4.431 1.00 0.00 N ATOM 989 CA GLU A 64 -27.834 34.696 4.519 1.00 0.00 C ATOM 990 C GLU A 64 -28.417 34.452 3.106 1.00 0.00 C ATOM 991 O GLU A 64 -29.122 33.470 2.879 1.00 0.00 O ATOM 992 CB GLU A 64 -28.873 35.436 5.401 1.00 0.00 C ATOM 993 CG GLU A 64 -29.383 36.768 4.811 1.00 0.00 C ATOM 994 CD GLU A 64 -30.342 37.516 5.744 1.00 0.00 C ATOM 995 OE1 GLU A 64 -29.873 38.307 6.590 1.00 0.00 O ATOM 996 OE2 GLU A 64 -31.570 37.300 5.646 1.00 0.00 O ATOM 0 H GLU A 64 -26.709 36.470 4.679 1.00 0.00 H new ATOM 0 HA GLU A 64 -27.604 33.733 4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -29.725 34.777 5.566 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -28.428 35.632 6.376 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -28.530 37.409 4.588 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -29.888 36.569 3.866 1.00 0.00 H new ATOM 1003 N GLU A 65 -28.105 35.378 2.176 1.00 0.00 N ATOM 1004 CA GLU A 65 -28.618 35.379 0.785 1.00 0.00 C ATOM 1005 C GLU A 65 -27.485 35.031 -0.220 1.00 0.00 C ATOM 1006 O GLU A 65 -27.662 35.138 -1.445 1.00 0.00 O ATOM 1007 CB GLU A 65 -29.228 36.778 0.469 1.00 0.00 C ATOM 1008 CG GLU A 65 -30.093 36.848 -0.817 1.00 0.00 C ATOM 1009 CD GLU A 65 -30.568 38.272 -1.155 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -30.017 38.902 -2.086 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -31.494 38.767 -0.482 1.00 0.00 O ATOM 0 H GLU A 65 -27.480 36.160 2.371 1.00 0.00 H new ATOM 0 HA GLU A 65 -29.392 34.618 0.685 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -29.839 37.089 1.316 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -28.415 37.499 0.380 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -29.517 36.456 -1.655 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -30.962 36.201 -0.697 1.00 0.00 H new ATOM 1018 N ILE A 66 -26.332 34.567 0.308 1.00 0.00 N ATOM 1019 CA ILE A 66 -25.131 34.295 -0.509 1.00 0.00 C ATOM 1020 C ILE A 66 -25.376 33.136 -1.515 1.00 0.00 C ATOM 1021 O ILE A 66 -26.067 32.158 -1.205 1.00 0.00 O ATOM 1022 CB ILE A 66 -23.874 33.964 0.392 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -22.551 33.983 -0.454 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -24.034 32.615 1.150 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -22.057 35.370 -0.827 1.00 0.00 C ATOM 0 H ILE A 66 -26.208 34.372 1.302 1.00 0.00 H new ATOM 0 HA ILE A 66 -24.924 35.206 -1.070 1.00 0.00 H new ATOM 0 HB ILE A 66 -23.807 34.748 1.146 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -21.769 33.472 0.108 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -22.712 33.411 -1.368 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -23.147 32.430 1.755 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -24.911 32.662 1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -24.157 31.806 0.430 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -21.140 35.285 -1.410 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -22.817 35.880 -1.419 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -21.859 35.942 0.080 1.00 0.00 H new ATOM 1037 N GLU A 67 -24.826 33.282 -2.734 1.00 0.00 N ATOM 1038 CA GLU A 67 -24.807 32.222 -3.766 1.00 0.00 C ATOM 1039 C GLU A 67 -23.393 32.125 -4.336 1.00 0.00 C ATOM 1040 O GLU A 67 -22.776 33.152 -4.644 1.00 0.00 O ATOM 1041 CB GLU A 67 -25.817 32.528 -4.901 1.00 0.00 C ATOM 1042 CG GLU A 67 -27.294 32.481 -4.467 1.00 0.00 C ATOM 1043 CD GLU A 67 -28.246 32.968 -5.565 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -28.518 34.189 -5.628 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -28.698 32.145 -6.393 1.00 0.00 O ATOM 0 H GLU A 67 -24.377 34.147 -3.036 1.00 0.00 H new ATOM 0 HA GLU A 67 -25.098 31.275 -3.312 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -25.601 33.517 -5.306 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -25.665 31.812 -5.709 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -27.556 31.459 -4.191 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -27.427 33.096 -3.577 1.00 0.00 H new ATOM 1052 N ILE A 68 -22.881 30.888 -4.471 1.00 0.00 N ATOM 1053 CA ILE A 68 -21.559 30.635 -5.059 1.00 0.00 C ATOM 1054 C ILE A 68 -21.732 30.438 -6.579 1.00 0.00 C ATOM 1055 O ILE A 68 -21.979 29.317 -7.049 1.00 0.00 O ATOM 1056 CB ILE A 68 -20.866 29.365 -4.424 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -20.946 29.388 -2.856 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -19.393 29.262 -4.895 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -20.362 28.155 -2.173 1.00 0.00 C ATOM 0 H ILE A 68 -23.371 30.043 -4.177 1.00 0.00 H new ATOM 0 HA ILE A 68 -20.914 31.489 -4.853 1.00 0.00 H new ATOM 0 HB ILE A 68 -21.407 28.483 -4.767 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -20.422 30.272 -2.491 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -21.990 29.491 -2.560 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -18.929 28.382 -4.449 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -19.363 29.177 -5.981 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -18.849 30.155 -4.586 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -20.460 28.257 -1.092 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.900 27.267 -2.504 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -19.308 28.059 -2.434 1.00 0.00 H new ATOM 1071 N ASP A 69 -21.660 31.542 -7.331 1.00 0.00 N ATOM 1072 CA ASP A 69 -21.831 31.527 -8.788 1.00 0.00 C ATOM 1073 C ASP A 69 -20.461 31.347 -9.452 1.00 0.00 C ATOM 1074 O ASP A 69 -19.633 32.259 -9.438 1.00 0.00 O ATOM 1075 CB ASP A 69 -22.524 32.829 -9.256 1.00 0.00 C ATOM 1076 CG ASP A 69 -22.804 32.848 -10.769 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -22.036 33.468 -11.525 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -23.783 32.206 -11.207 1.00 0.00 O ATOM 0 H ASP A 69 -21.482 32.470 -6.947 1.00 0.00 H new ATOM 0 HA ASP A 69 -22.469 30.693 -9.080 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -23.463 32.949 -8.716 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -21.897 33.682 -8.997 1.00 0.00 H new ATOM 1083 N PHE A 70 -20.239 30.161 -10.035 1.00 0.00 N ATOM 1084 CA PHE A 70 -18.922 29.745 -10.579 1.00 0.00 C ATOM 1085 C PHE A 70 -18.603 30.432 -11.926 1.00 0.00 C ATOM 1086 O PHE A 70 -17.506 30.261 -12.468 1.00 0.00 O ATOM 1087 CB PHE A 70 -18.886 28.200 -10.728 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.361 27.451 -9.478 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -18.548 27.358 -8.348 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -20.635 26.868 -9.423 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -18.985 26.694 -7.214 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -21.066 26.206 -8.289 1.00 0.00 C ATOM 1093 CZ PHE A 70 -20.245 26.127 -7.181 1.00 0.00 C ATOM 0 H PHE A 70 -20.966 29.454 -10.147 1.00 0.00 H new ATOM 0 HA PHE A 70 -18.152 30.061 -9.875 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -19.510 27.910 -11.574 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -17.868 27.890 -10.962 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -17.567 27.809 -8.358 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.289 26.937 -10.280 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -18.339 26.619 -6.352 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -22.045 25.750 -8.269 1.00 0.00 H new ATOM 0 HZ PHE A 70 -20.587 25.623 -6.290 1.00 0.00 H new ATOM 1103 N GLU A 71 -19.577 31.196 -12.457 1.00 0.00 N ATOM 1104 CA GLU A 71 -19.430 31.942 -13.722 1.00 0.00 C ATOM 1105 C GLU A 71 -18.798 33.320 -13.458 1.00 0.00 C ATOM 1106 O GLU A 71 -17.940 33.771 -14.224 1.00 0.00 O ATOM 1107 CB GLU A 71 -20.818 32.087 -14.409 1.00 0.00 C ATOM 1108 CG GLU A 71 -20.787 32.702 -15.829 1.00 0.00 C ATOM 1109 CD GLU A 71 -22.184 32.793 -16.469 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -22.650 31.786 -17.048 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -22.833 33.860 -16.379 1.00 0.00 O ATOM 0 H GLU A 71 -20.491 31.314 -12.019 1.00 0.00 H new ATOM 0 HA GLU A 71 -18.768 31.392 -14.391 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -21.282 31.102 -14.466 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.456 32.704 -13.777 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -20.349 33.699 -15.779 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -20.139 32.101 -16.466 1.00 0.00 H new ATOM 1118 N THR A 72 -19.231 33.980 -12.357 1.00 0.00 N ATOM 1119 CA THR A 72 -18.672 35.276 -11.925 1.00 0.00 C ATOM 1120 C THR A 72 -17.294 35.059 -11.270 1.00 0.00 C ATOM 1121 O THR A 72 -16.464 35.967 -11.259 1.00 0.00 O ATOM 1122 CB THR A 72 -19.637 36.066 -10.958 1.00 0.00 C ATOM 1123 OG1 THR A 72 -19.201 37.430 -10.830 1.00 0.00 O ATOM 1124 CG2 THR A 72 -19.739 35.451 -9.542 1.00 0.00 C ATOM 0 H THR A 72 -19.972 33.629 -11.750 1.00 0.00 H new ATOM 0 HA THR A 72 -18.557 35.895 -12.815 1.00 0.00 H new ATOM 0 HB THR A 72 -20.625 36.007 -11.414 1.00 0.00 H new ATOM 0 HG1 THR A 72 -18.454 37.477 -10.197 1.00 0.00 H new ATOM 0 HG21 THR A 72 -20.419 36.048 -8.934 1.00 0.00 H new ATOM 0 HG22 THR A 72 -20.117 34.431 -9.615 1.00 0.00 H new ATOM 0 HG23 THR A 72 -18.753 35.440 -9.078 1.00 0.00 H new ATOM 1132 N LEU A 73 -17.072 33.839 -10.734 1.00 0.00 N ATOM 1133 CA LEU A 73 -15.762 33.415 -10.213 1.00 0.00 C ATOM 1134 C LEU A 73 -14.787 33.167 -11.382 1.00 0.00 C ATOM 1135 O LEU A 73 -15.059 32.330 -12.258 1.00 0.00 O ATOM 1136 CB LEU A 73 -15.897 32.133 -9.342 1.00 0.00 C ATOM 1137 CG LEU A 73 -16.756 32.262 -8.042 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -16.885 30.902 -7.317 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -16.192 33.346 -7.093 1.00 0.00 C ATOM 0 H LEU A 73 -17.796 33.125 -10.652 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.368 34.212 -9.582 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.328 31.345 -9.959 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.897 31.805 -9.059 1.00 0.00 H new ATOM 0 HG LEU A 73 -17.755 32.576 -8.344 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -17.488 31.025 -6.417 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.364 30.181 -7.979 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -15.894 30.540 -7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -16.814 33.408 -6.200 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -15.173 33.085 -6.808 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -16.191 34.310 -7.602 1.00 0.00 H new ATOM 1151 N LYS A 74 -13.667 33.913 -11.390 1.00 0.00 N ATOM 1152 CA LYS A 74 -12.594 33.766 -12.394 1.00 0.00 C ATOM 1153 C LYS A 74 -11.868 32.403 -12.225 1.00 0.00 C ATOM 1154 O LYS A 74 -11.949 31.814 -11.146 1.00 0.00 O ATOM 1155 CB LYS A 74 -11.587 34.950 -12.256 1.00 0.00 C ATOM 1156 CG LYS A 74 -10.833 35.010 -10.906 1.00 0.00 C ATOM 1157 CD LYS A 74 -9.874 36.225 -10.752 1.00 0.00 C ATOM 1158 CE LYS A 74 -10.591 37.580 -10.549 1.00 0.00 C ATOM 1159 NZ LYS A 74 -11.346 38.041 -11.745 1.00 0.00 N ATOM 0 H LYS A 74 -13.479 34.638 -10.698 1.00 0.00 H new ATOM 0 HA LYS A 74 -13.033 33.788 -13.391 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -10.856 34.882 -13.061 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.128 35.886 -12.395 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.564 35.036 -10.098 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.257 34.092 -10.785 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -9.213 36.046 -9.904 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -9.244 36.290 -11.639 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -11.278 37.495 -9.707 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.852 38.336 -10.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.293 39.078 -11.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -10.933 37.618 -12.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.341 37.750 -11.661 1.00 0.00 H new ATOM 1173 N PRO A 75 -11.135 31.886 -13.279 1.00 0.00 N ATOM 1174 CA PRO A 75 -10.354 30.609 -13.206 1.00 0.00 C ATOM 1175 C PRO A 75 -9.394 30.533 -11.995 1.00 0.00 C ATOM 1176 O PRO A 75 -9.147 29.443 -11.468 1.00 0.00 O ATOM 1177 CB PRO A 75 -9.557 30.596 -14.549 1.00 0.00 C ATOM 1178 CG PRO A 75 -9.650 32.010 -15.053 1.00 0.00 C ATOM 1179 CD PRO A 75 -11.012 32.478 -14.640 1.00 0.00 C ATOM 0 HA PRO A 75 -11.012 29.751 -13.070 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -8.520 30.297 -14.393 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -9.988 29.891 -15.260 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -8.869 32.636 -14.620 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -9.529 32.052 -16.135 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -11.083 33.566 -14.621 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -11.790 32.119 -15.314 1.00 0.00 H new ATOM 1187 N SER A 76 -8.863 31.696 -11.585 1.00 0.00 N ATOM 1188 CA SER A 76 -7.928 31.817 -10.453 1.00 0.00 C ATOM 1189 C SER A 76 -8.635 31.522 -9.109 1.00 0.00 C ATOM 1190 O SER A 76 -8.146 30.727 -8.293 1.00 0.00 O ATOM 1191 CB SER A 76 -7.317 33.235 -10.450 1.00 0.00 C ATOM 1192 OG SER A 76 -6.810 33.567 -11.731 1.00 0.00 O ATOM 0 H SER A 76 -9.072 32.588 -12.034 1.00 0.00 H new ATOM 0 HA SER A 76 -7.133 31.080 -10.570 1.00 0.00 H new ATOM 0 HB2 SER A 76 -8.074 33.961 -10.154 1.00 0.00 H new ATOM 0 HB3 SER A 76 -6.517 33.290 -9.712 1.00 0.00 H new ATOM 0 HG SER A 76 -6.429 34.470 -11.708 1.00 0.00 H new ATOM 1198 N THR A 77 -9.806 32.162 -8.908 1.00 0.00 N ATOM 1199 CA THR A 77 -10.643 31.963 -7.709 1.00 0.00 C ATOM 1200 C THR A 77 -11.290 30.563 -7.722 1.00 0.00 C ATOM 1201 O THR A 77 -11.524 29.973 -6.667 1.00 0.00 O ATOM 1202 CB THR A 77 -11.765 33.051 -7.616 1.00 0.00 C ATOM 1203 OG1 THR A 77 -11.179 34.353 -7.754 1.00 0.00 O ATOM 1204 CG2 THR A 77 -12.546 32.987 -6.279 1.00 0.00 C ATOM 0 H THR A 77 -10.196 32.830 -9.572 1.00 0.00 H new ATOM 0 HA THR A 77 -9.993 32.052 -6.839 1.00 0.00 H new ATOM 0 HB THR A 77 -12.473 32.856 -8.422 1.00 0.00 H new ATOM 0 HG1 THR A 77 -11.880 35.035 -7.698 1.00 0.00 H new ATOM 0 HG21 THR A 77 -13.312 33.763 -6.267 1.00 0.00 H new ATOM 0 HG22 THR A 77 -13.018 32.010 -6.180 1.00 0.00 H new ATOM 0 HG23 THR A 77 -11.858 33.143 -5.448 1.00 0.00 H new ATOM 1212 N LEU A 78 -11.550 30.054 -8.947 1.00 0.00 N ATOM 1213 CA LEU A 78 -12.199 28.759 -9.185 1.00 0.00 C ATOM 1214 C LEU A 78 -11.249 27.646 -8.710 1.00 0.00 C ATOM 1215 O LEU A 78 -11.641 26.808 -7.904 1.00 0.00 O ATOM 1216 CB LEU A 78 -12.576 28.605 -10.706 1.00 0.00 C ATOM 1217 CG LEU A 78 -13.913 27.859 -11.039 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -13.928 26.422 -10.491 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -15.125 28.669 -10.540 1.00 0.00 C ATOM 0 H LEU A 78 -11.308 30.545 -9.808 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.130 28.690 -8.623 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.627 29.602 -11.144 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -11.762 28.079 -11.204 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.982 27.777 -12.124 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.874 25.945 -10.746 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -13.106 25.856 -10.930 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.814 26.445 -9.407 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.044 28.134 -10.781 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.054 28.802 -9.460 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -15.135 29.645 -11.025 1.00 0.00 H new ATOM 1231 N ARG A 79 -9.992 27.707 -9.204 1.00 0.00 N ATOM 1232 CA ARG A 79 -8.895 26.789 -8.821 1.00 0.00 C ATOM 1233 C ARG A 79 -8.712 26.757 -7.302 1.00 0.00 C ATOM 1234 O ARG A 79 -8.643 25.687 -6.709 1.00 0.00 O ATOM 1235 CB ARG A 79 -7.564 27.241 -9.487 1.00 0.00 C ATOM 1236 CG ARG A 79 -6.273 26.444 -9.091 1.00 0.00 C ATOM 1237 CD ARG A 79 -6.009 25.178 -9.935 1.00 0.00 C ATOM 1238 NE ARG A 79 -6.945 24.056 -9.692 1.00 0.00 N ATOM 1239 CZ ARG A 79 -6.979 22.920 -10.432 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -6.221 22.786 -11.509 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -7.791 21.935 -10.102 1.00 0.00 N ATOM 0 H ARG A 79 -9.707 28.406 -9.890 1.00 0.00 H new ATOM 0 HA ARG A 79 -9.159 25.789 -9.165 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -7.685 27.177 -10.568 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.403 28.292 -9.246 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.413 27.107 -9.178 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -6.348 26.155 -8.043 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -6.055 25.447 -10.990 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -4.994 24.833 -9.738 1.00 0.00 H new ATOM 0 HE ARG A 79 -7.605 24.143 -8.920 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -5.600 23.544 -11.793 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -6.258 21.925 -12.055 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -8.397 22.025 -9.287 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -7.813 21.083 -10.662 1.00 0.00 H new ATOM 1255 N GLU A 80 -8.629 27.957 -6.698 1.00 0.00 N ATOM 1256 CA GLU A 80 -8.435 28.116 -5.250 1.00 0.00 C ATOM 1257 C GLU A 80 -9.575 27.446 -4.464 1.00 0.00 C ATOM 1258 O GLU A 80 -9.313 26.656 -3.561 1.00 0.00 O ATOM 1259 CB GLU A 80 -8.327 29.621 -4.883 1.00 0.00 C ATOM 1260 CG GLU A 80 -8.097 29.908 -3.374 1.00 0.00 C ATOM 1261 CD GLU A 80 -7.905 31.399 -3.066 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -6.740 31.856 -2.981 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -8.912 32.128 -2.930 1.00 0.00 O ATOM 0 H GLU A 80 -8.695 28.841 -7.202 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.503 27.623 -4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.508 30.061 -5.451 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.241 30.124 -5.199 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -8.948 29.533 -2.805 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.219 29.357 -3.035 1.00 0.00 H new ATOM 1270 N LEU A 81 -10.829 27.737 -4.871 1.00 0.00 N ATOM 1271 CA LEU A 81 -12.047 27.295 -4.164 1.00 0.00 C ATOM 1272 C LEU A 81 -12.215 25.760 -4.196 1.00 0.00 C ATOM 1273 O LEU A 81 -12.433 25.133 -3.150 1.00 0.00 O ATOM 1274 CB LEU A 81 -13.304 27.970 -4.774 1.00 0.00 C ATOM 1275 CG LEU A 81 -14.683 27.505 -4.194 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -14.794 27.789 -2.675 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -15.854 28.137 -4.978 1.00 0.00 C ATOM 0 H LEU A 81 -11.024 28.289 -5.706 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.938 27.598 -3.123 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -13.218 29.047 -4.633 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.304 27.788 -5.849 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.744 26.424 -4.319 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -15.765 27.452 -2.312 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -14.004 27.256 -2.146 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -14.692 28.859 -2.497 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -16.800 27.798 -4.555 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -15.794 29.223 -4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -15.796 27.836 -6.024 1.00 0.00 H new ATOM 1289 N GLU A 82 -12.126 25.163 -5.400 1.00 0.00 N ATOM 1290 CA GLU A 82 -12.389 23.723 -5.587 1.00 0.00 C ATOM 1291 C GLU A 82 -11.292 22.878 -4.920 1.00 0.00 C ATOM 1292 O GLU A 82 -11.587 21.848 -4.322 1.00 0.00 O ATOM 1293 CB GLU A 82 -12.615 23.382 -7.093 1.00 0.00 C ATOM 1294 CG GLU A 82 -11.475 23.746 -8.078 1.00 0.00 C ATOM 1295 CD GLU A 82 -10.339 22.719 -8.137 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -10.605 21.568 -8.532 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -9.182 23.054 -7.817 1.00 0.00 O ATOM 0 H GLU A 82 -11.874 25.655 -6.257 1.00 0.00 H new ATOM 0 HA GLU A 82 -13.320 23.464 -5.083 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -12.802 22.311 -7.173 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.522 23.890 -7.422 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.897 23.861 -9.076 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -11.060 24.713 -7.794 1.00 0.00 H new ATOM 1304 N ARG A 83 -10.039 23.364 -4.978 1.00 0.00 N ATOM 1305 CA ARG A 83 -8.886 22.717 -4.315 1.00 0.00 C ATOM 1306 C ARG A 83 -9.049 22.822 -2.773 1.00 0.00 C ATOM 1307 O ARG A 83 -8.708 21.891 -2.036 1.00 0.00 O ATOM 1308 CB ARG A 83 -7.549 23.392 -4.807 1.00 0.00 C ATOM 1309 CG ARG A 83 -6.352 22.441 -5.072 1.00 0.00 C ATOM 1310 CD ARG A 83 -5.834 21.730 -3.808 1.00 0.00 C ATOM 1311 NE ARG A 83 -5.431 22.677 -2.755 1.00 0.00 N ATOM 1312 CZ ARG A 83 -4.504 22.448 -1.815 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -3.806 21.323 -1.789 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -4.265 23.376 -0.908 1.00 0.00 N ATOM 0 H ARG A 83 -9.795 24.215 -5.484 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.845 21.660 -4.578 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.761 23.939 -5.726 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -7.243 24.127 -4.062 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -6.651 21.690 -5.804 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.537 23.012 -5.516 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -6.611 21.071 -3.421 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.984 21.101 -4.071 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.897 23.584 -2.740 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.968 20.606 -2.496 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -3.106 21.174 -1.062 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.783 24.254 -0.928 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -3.562 23.215 -0.187 1.00 0.00 H new ATOM 1328 N TYR A 84 -9.614 23.960 -2.330 1.00 0.00 N ATOM 1329 CA TYR A 84 -9.805 24.299 -0.904 1.00 0.00 C ATOM 1330 C TYR A 84 -10.796 23.331 -0.223 1.00 0.00 C ATOM 1331 O TYR A 84 -10.478 22.741 0.818 1.00 0.00 O ATOM 1332 CB TYR A 84 -10.303 25.769 -0.799 1.00 0.00 C ATOM 1333 CG TYR A 84 -10.203 26.420 0.588 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -11.302 26.485 1.460 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -9.000 26.995 1.021 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -11.193 27.096 2.699 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -8.896 27.600 2.256 1.00 0.00 C ATOM 1338 CZ TYR A 84 -9.990 27.649 3.089 1.00 0.00 C ATOM 1339 OH TYR A 84 -9.877 28.258 4.314 1.00 0.00 O ATOM 0 H TYR A 84 -9.957 24.683 -2.962 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.853 24.198 -0.383 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.734 26.375 -1.504 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -11.345 25.802 -1.119 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -12.245 26.053 1.161 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.136 26.964 0.374 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -12.048 27.139 3.358 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -7.958 28.034 2.569 1.00 0.00 H new ATOM 0 HH TYR A 84 -8.963 28.592 4.430 1.00 0.00 H new ATOM 1349 N VAL A 85 -11.984 23.164 -0.837 1.00 0.00 N ATOM 1350 CA VAL A 85 -13.047 22.282 -0.307 1.00 0.00 C ATOM 1351 C VAL A 85 -12.609 20.800 -0.346 1.00 0.00 C ATOM 1352 O VAL A 85 -12.896 20.047 0.585 1.00 0.00 O ATOM 1353 CB VAL A 85 -14.429 22.481 -1.058 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -14.305 22.259 -2.584 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -15.539 21.576 -0.454 1.00 0.00 C ATOM 0 H VAL A 85 -12.234 23.632 -1.708 1.00 0.00 H new ATOM 0 HA VAL A 85 -13.205 22.569 0.733 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.719 23.521 -0.906 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -15.278 22.407 -3.053 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -13.590 22.970 -2.998 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -13.959 21.243 -2.777 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -16.473 21.738 -0.992 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.245 20.530 -0.544 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -15.679 21.825 0.598 1.00 0.00 H new ATOM 1365 N LEU A 86 -11.872 20.405 -1.407 1.00 0.00 N ATOM 1366 CA LEU A 86 -11.340 19.031 -1.542 1.00 0.00 C ATOM 1367 C LEU A 86 -10.254 18.729 -0.484 1.00 0.00 C ATOM 1368 O LEU A 86 -10.063 17.568 -0.108 1.00 0.00 O ATOM 1369 CB LEU A 86 -10.809 18.796 -2.981 1.00 0.00 C ATOM 1370 CG LEU A 86 -11.896 18.801 -4.113 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -11.261 18.651 -5.519 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -12.984 17.722 -3.865 1.00 0.00 C ATOM 0 H LEU A 86 -11.631 21.020 -2.184 1.00 0.00 H new ATOM 0 HA LEU A 86 -12.159 18.335 -1.361 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.071 19.566 -3.207 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -10.289 17.838 -3.005 1.00 0.00 H new ATOM 0 HG LEU A 86 -12.387 19.774 -4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -12.046 18.659 -6.275 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -10.575 19.479 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -10.715 17.709 -5.573 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -13.719 17.755 -4.669 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -12.520 16.736 -3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -13.478 17.916 -2.913 1.00 0.00 H new ATOM 1384 N SER A 87 -9.557 19.784 -0.012 1.00 0.00 N ATOM 1385 CA SER A 87 -8.615 19.687 1.123 1.00 0.00 C ATOM 1386 C SER A 87 -9.381 19.449 2.447 1.00 0.00 C ATOM 1387 O SER A 87 -8.925 18.690 3.303 1.00 0.00 O ATOM 1388 CB SER A 87 -7.746 20.960 1.221 1.00 0.00 C ATOM 1389 OG SER A 87 -6.984 21.158 0.038 1.00 0.00 O ATOM 0 H SER A 87 -9.631 20.723 -0.405 1.00 0.00 H new ATOM 0 HA SER A 87 -7.957 18.836 0.949 1.00 0.00 H new ATOM 0 HB2 SER A 87 -8.385 21.826 1.394 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.077 20.881 2.078 1.00 0.00 H new ATOM 0 HG SER A 87 -7.580 21.414 -0.696 1.00 0.00 H new ATOM 1395 N CYS A 88 -10.563 20.094 2.587 1.00 0.00 N ATOM 1396 CA CYS A 88 -11.450 19.934 3.768 1.00 0.00 C ATOM 1397 C CYS A 88 -12.107 18.531 3.797 1.00 0.00 C ATOM 1398 O CYS A 88 -12.406 17.998 4.874 1.00 0.00 O ATOM 1399 CB CYS A 88 -12.524 21.047 3.786 1.00 0.00 C ATOM 1400 SG CYS A 88 -11.842 22.719 3.859 1.00 0.00 S ATOM 0 H CYS A 88 -10.930 20.739 1.887 1.00 0.00 H new ATOM 0 HA CYS A 88 -10.838 20.026 4.665 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -13.143 20.956 2.893 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -13.178 20.894 4.644 1.00 0.00 H new ATOM 0 HG CYS A 88 -11.210 22.979 2.753 1.00 0.00 H new ATOM 1406 N LEU A 89 -12.326 17.951 2.603 1.00 0.00 N ATOM 1407 CA LEU A 89 -12.805 16.558 2.448 1.00 0.00 C ATOM 1408 C LEU A 89 -11.650 15.553 2.614 1.00 0.00 C ATOM 1409 O LEU A 89 -11.912 14.355 2.788 1.00 0.00 O ATOM 1410 CB LEU A 89 -13.490 16.354 1.055 1.00 0.00 C ATOM 1411 CG LEU A 89 -15.021 16.673 0.967 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -15.350 18.130 1.377 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -15.562 16.346 -0.448 1.00 0.00 C ATOM 0 H LEU A 89 -12.177 18.432 1.716 1.00 0.00 H new ATOM 0 HA LEU A 89 -13.541 16.376 3.231 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -12.971 16.977 0.327 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -13.341 15.318 0.752 1.00 0.00 H new ATOM 0 HG LEU A 89 -15.528 16.032 1.688 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.424 18.297 1.298 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -15.032 18.299 2.406 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -14.826 18.821 0.717 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -16.627 16.573 -0.492 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.032 16.946 -1.188 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -15.408 15.288 -0.661 1.00 0.00 H new ATOM 1425 N ARG A 90 -10.385 16.051 2.500 1.00 0.00 N ATOM 1426 CA ARG A 90 -9.151 15.226 2.539 1.00 0.00 C ATOM 1427 C ARG A 90 -9.092 14.289 1.292 1.00 0.00 C ATOM 1428 O ARG A 90 -8.329 13.320 1.258 1.00 0.00 O ATOM 1429 CB ARG A 90 -9.064 14.453 3.912 1.00 0.00 C ATOM 1430 CG ARG A 90 -7.737 13.661 4.192 1.00 0.00 C ATOM 1431 CD ARG A 90 -7.964 12.152 4.430 1.00 0.00 C ATOM 1432 NE ARG A 90 -8.609 11.487 3.269 1.00 0.00 N ATOM 1433 CZ ARG A 90 -8.346 10.247 2.824 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -7.457 9.473 3.427 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -8.990 9.788 1.762 1.00 0.00 N ATOM 0 H ARG A 90 -10.197 17.046 2.378 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.269 15.865 2.485 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.207 15.173 4.718 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -9.896 13.751 3.961 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.060 13.791 3.348 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.244 14.089 5.065 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -7.008 11.671 4.635 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.586 12.016 5.315 1.00 0.00 H new ATOM 0 HE ARG A 90 -9.316 12.021 2.763 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.956 9.815 4.247 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -7.273 8.535 3.072 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -9.678 10.374 1.290 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.798 8.848 1.416 1.00 0.00 H new ATOM 1724 N THR A 106 -38.248 1.705 -3.466 1.00 0.00 N ATOM 1725 CA THR A 106 -39.472 2.340 -2.953 1.00 0.00 C ATOM 1726 C THR A 106 -39.147 3.745 -2.401 1.00 0.00 C ATOM 1727 O THR A 106 -37.978 4.156 -2.357 1.00 0.00 O ATOM 1728 CB THR A 106 -40.130 1.461 -1.832 1.00 0.00 C ATOM 1729 OG1 THR A 106 -39.187 1.230 -0.766 1.00 0.00 O ATOM 1730 CG2 THR A 106 -40.630 0.108 -2.375 1.00 0.00 C ATOM 0 HA THR A 106 -40.181 2.433 -3.776 1.00 0.00 H new ATOM 0 HB THR A 106 -40.992 2.011 -1.455 1.00 0.00 H new ATOM 0 HG1 THR A 106 -39.607 0.682 -0.071 1.00 0.00 H new ATOM 0 HG21 THR A 106 -41.078 -0.466 -1.564 1.00 0.00 H new ATOM 0 HG22 THR A 106 -41.375 0.281 -3.152 1.00 0.00 H new ATOM 0 HG23 THR A 106 -39.791 -0.448 -2.794 1.00 0.00 H new ATOM 1738 N LYS A 107 -40.189 4.478 -1.979 1.00 0.00 N ATOM 1739 CA LYS A 107 -40.023 5.776 -1.294 1.00 0.00 C ATOM 1740 C LYS A 107 -39.490 5.564 0.131 1.00 0.00 C ATOM 1741 O LYS A 107 -38.814 6.434 0.687 1.00 0.00 O ATOM 1742 CB LYS A 107 -41.342 6.576 -1.296 1.00 0.00 C ATOM 1743 CG LYS A 107 -42.513 5.948 -0.502 1.00 0.00 C ATOM 1744 CD LYS A 107 -43.865 6.626 -0.815 1.00 0.00 C ATOM 1745 CE LYS A 107 -43.862 8.148 -0.570 1.00 0.00 C ATOM 1746 NZ LYS A 107 -45.103 8.788 -1.076 1.00 0.00 N ATOM 0 H LYS A 107 -41.161 4.195 -2.100 1.00 0.00 H new ATOM 0 HA LYS A 107 -39.288 6.366 -1.842 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -41.144 7.568 -0.890 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -41.661 6.712 -2.329 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -42.579 4.886 -0.736 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -42.308 6.027 0.566 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -44.126 6.434 -1.856 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -44.642 6.169 -0.202 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -43.760 8.345 0.497 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -42.997 8.594 -1.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -45.065 9.811 -0.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -45.187 8.621 -2.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -45.927 8.380 -0.590 1.00 0.00 H new ATOM 1760 N GLU A 108 -39.795 4.386 0.709 1.00 0.00 N ATOM 1761 CA GLU A 108 -39.237 3.956 2.000 1.00 0.00 C ATOM 1762 C GLU A 108 -37.743 3.639 1.865 1.00 0.00 C ATOM 1763 O GLU A 108 -36.988 3.805 2.821 1.00 0.00 O ATOM 1764 CB GLU A 108 -39.996 2.714 2.533 1.00 0.00 C ATOM 1765 CG GLU A 108 -41.474 2.967 2.871 1.00 0.00 C ATOM 1766 CD GLU A 108 -41.671 4.021 3.975 1.00 0.00 C ATOM 1767 OE1 GLU A 108 -42.207 5.116 3.696 1.00 0.00 O ATOM 1768 OE2 GLU A 108 -41.282 3.757 5.137 1.00 0.00 O ATOM 0 H GLU A 108 -40.434 3.709 0.293 1.00 0.00 H new ATOM 0 HA GLU A 108 -39.357 4.774 2.711 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -39.937 1.921 1.788 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -39.489 2.350 3.427 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -41.996 3.291 1.971 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -41.934 2.030 3.186 1.00 0.00 H new ATOM 1775 N GLU A 109 -37.341 3.190 0.657 1.00 0.00 N ATOM 1776 CA GLU A 109 -35.949 2.828 0.350 1.00 0.00 C ATOM 1777 C GLU A 109 -35.066 4.088 0.331 1.00 0.00 C ATOM 1778 O GLU A 109 -34.025 4.124 0.991 1.00 0.00 O ATOM 1779 CB GLU A 109 -35.875 2.078 -1.011 1.00 0.00 C ATOM 1780 CG GLU A 109 -34.558 1.330 -1.273 1.00 0.00 C ATOM 1781 CD GLU A 109 -34.302 0.219 -0.236 1.00 0.00 C ATOM 1782 OE1 GLU A 109 -33.550 0.445 0.735 1.00 0.00 O ATOM 1783 OE2 GLU A 109 -34.885 -0.875 -0.373 1.00 0.00 O ATOM 0 H GLU A 109 -37.977 3.070 -0.131 1.00 0.00 H new ATOM 0 HA GLU A 109 -35.577 2.160 1.127 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -36.696 1.363 -1.059 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -36.032 2.798 -1.814 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -34.583 0.894 -2.272 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -33.730 2.039 -1.255 1.00 0.00 H new ATOM 1790 N LEU A 110 -35.528 5.135 -0.403 1.00 0.00 N ATOM 1791 CA LEU A 110 -34.800 6.423 -0.508 1.00 0.00 C ATOM 1792 C LEU A 110 -34.811 7.195 0.831 1.00 0.00 C ATOM 1793 O LEU A 110 -33.935 8.029 1.085 1.00 0.00 O ATOM 1794 CB LEU A 110 -35.307 7.279 -1.719 1.00 0.00 C ATOM 1795 CG LEU A 110 -36.829 7.671 -1.771 1.00 0.00 C ATOM 1796 CD1 LEU A 110 -37.177 8.888 -0.873 1.00 0.00 C ATOM 1797 CD2 LEU A 110 -37.295 7.913 -3.227 1.00 0.00 C ATOM 0 H LEU A 110 -36.401 5.110 -0.930 1.00 0.00 H new ATOM 0 HA LEU A 110 -33.754 6.197 -0.717 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -34.726 8.201 -1.741 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -35.073 6.733 -2.633 1.00 0.00 H new ATOM 0 HG LEU A 110 -37.375 6.819 -1.365 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -38.242 9.107 -0.954 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -36.932 8.657 0.164 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -36.602 9.756 -1.197 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -38.351 8.182 -3.231 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -36.712 8.723 -3.666 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -37.150 7.004 -3.811 1.00 0.00 H new ATOM 1809 N ALA A 111 -35.809 6.886 1.680 1.00 0.00 N ATOM 1810 CA ALA A 111 -35.936 7.453 3.035 1.00 0.00 C ATOM 1811 C ALA A 111 -34.986 6.759 4.032 1.00 0.00 C ATOM 1812 O ALA A 111 -34.438 7.406 4.937 1.00 0.00 O ATOM 1813 CB ALA A 111 -37.393 7.340 3.507 1.00 0.00 C ATOM 0 H ALA A 111 -36.555 6.232 1.443 1.00 0.00 H new ATOM 0 HA ALA A 111 -35.651 8.504 2.995 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -37.485 7.760 4.509 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -38.041 7.889 2.823 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -37.689 6.291 3.525 1.00 0.00 H new ATOM 1819 N LEU A 112 -34.806 5.435 3.856 1.00 0.00 N ATOM 1820 CA LEU A 112 -33.997 4.601 4.774 1.00 0.00 C ATOM 1821 C LEU A 112 -32.487 4.792 4.507 1.00 0.00 C ATOM 1822 O LEU A 112 -31.681 4.825 5.443 1.00 0.00 O ATOM 1823 CB LEU A 112 -34.404 3.108 4.640 1.00 0.00 C ATOM 1824 CG LEU A 112 -33.803 2.130 5.701 1.00 0.00 C ATOM 1825 CD1 LEU A 112 -34.152 2.558 7.153 1.00 0.00 C ATOM 1826 CD2 LEU A 112 -34.252 0.678 5.424 1.00 0.00 C ATOM 0 H LEU A 112 -35.213 4.914 3.079 1.00 0.00 H new ATOM 0 HA LEU A 112 -34.194 4.920 5.797 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -35.491 3.043 4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -34.111 2.761 3.649 1.00 0.00 H new ATOM 0 HG LEU A 112 -32.718 2.177 5.609 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -33.714 1.850 7.856 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -33.753 3.554 7.345 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -35.235 2.571 7.278 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -33.822 0.015 6.174 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -35.340 0.619 5.468 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -33.912 0.375 4.434 1.00 0.00 H new ATOM 1838 N GLU A 113 -32.116 4.918 3.214 1.00 0.00 N ATOM 1839 CA GLU A 113 -30.721 5.202 2.797 1.00 0.00 C ATOM 1840 C GLU A 113 -30.322 6.642 3.189 1.00 0.00 C ATOM 1841 O GLU A 113 -29.141 6.923 3.370 1.00 0.00 O ATOM 1842 CB GLU A 113 -30.539 4.985 1.271 1.00 0.00 C ATOM 1843 CG GLU A 113 -31.318 5.988 0.407 1.00 0.00 C ATOM 1844 CD GLU A 113 -31.304 5.689 -1.096 1.00 0.00 C ATOM 1845 OE1 GLU A 113 -31.817 4.626 -1.503 1.00 0.00 O ATOM 1846 OE2 GLU A 113 -30.830 6.535 -1.888 1.00 0.00 O ATOM 0 H GLU A 113 -32.767 4.827 2.434 1.00 0.00 H new ATOM 0 HA GLU A 113 -30.065 4.504 3.318 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -29.479 5.055 1.027 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -30.858 3.975 1.016 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -32.353 6.013 0.748 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -30.905 6.983 0.569 1.00 0.00 H new ATOM 1853 N LYS A 114 -31.330 7.541 3.302 1.00 0.00 N ATOM 1854 CA LYS A 114 -31.136 8.925 3.792 1.00 0.00 C ATOM 1855 C LYS A 114 -30.712 8.914 5.274 1.00 0.00 C ATOM 1856 O LYS A 114 -29.858 9.709 5.690 1.00 0.00 O ATOM 1857 CB LYS A 114 -32.435 9.763 3.609 1.00 0.00 C ATOM 1858 CG LYS A 114 -32.351 11.193 4.203 1.00 0.00 C ATOM 1859 CD LYS A 114 -33.644 12.019 4.032 1.00 0.00 C ATOM 1860 CE LYS A 114 -33.538 13.409 4.692 1.00 0.00 C ATOM 1861 NZ LYS A 114 -34.750 14.231 4.461 1.00 0.00 N ATOM 0 H LYS A 114 -32.297 7.327 3.057 1.00 0.00 H new ATOM 0 HA LYS A 114 -30.344 9.388 3.203 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -32.662 9.835 2.545 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -33.265 9.234 4.077 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -32.115 11.121 5.265 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -31.526 11.725 3.729 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -33.859 12.138 2.970 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -34.482 11.474 4.468 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -33.381 13.290 5.764 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -32.666 13.931 4.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -34.635 15.156 4.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -34.887 14.368 3.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -35.579 13.746 4.860 1.00 0.00 H new ATOM 1875 N LYS A 115 -31.322 8.004 6.059 1.00 0.00 N ATOM 1876 CA LYS A 115 -30.967 7.807 7.480 1.00 0.00 C ATOM 1877 C LYS A 115 -29.521 7.266 7.564 1.00 0.00 C ATOM 1878 O LYS A 115 -28.760 7.676 8.435 1.00 0.00 O ATOM 1879 CB LYS A 115 -31.991 6.841 8.176 1.00 0.00 C ATOM 1880 CG LYS A 115 -32.217 7.062 9.705 1.00 0.00 C ATOM 1881 CD LYS A 115 -30.954 6.857 10.577 1.00 0.00 C ATOM 1882 CE LYS A 115 -31.205 7.066 12.078 1.00 0.00 C ATOM 1883 NZ LYS A 115 -32.114 6.042 12.640 1.00 0.00 N ATOM 0 H LYS A 115 -32.068 7.390 5.731 1.00 0.00 H new ATOM 0 HA LYS A 115 -31.016 8.758 8.010 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -32.952 6.938 7.670 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -31.653 5.816 8.024 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -32.591 8.074 9.862 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -32.994 6.379 10.047 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -30.572 5.849 10.418 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -30.178 7.548 10.247 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -30.255 7.038 12.611 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -31.632 8.056 12.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -32.201 6.181 13.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -33.051 6.129 12.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -31.729 5.095 12.451 1.00 0.00 H new ATOM 1897 N ARG A 116 -29.159 6.355 6.633 1.00 0.00 N ATOM 1898 CA ARG A 116 -27.776 5.851 6.493 1.00 0.00 C ATOM 1899 C ARG A 116 -26.798 7.019 6.250 1.00 0.00 C ATOM 1900 O ARG A 116 -25.746 7.076 6.878 1.00 0.00 O ATOM 1901 CB ARG A 116 -27.661 4.830 5.326 1.00 0.00 C ATOM 1902 CG ARG A 116 -26.208 4.374 5.030 1.00 0.00 C ATOM 1903 CD ARG A 116 -26.067 3.608 3.714 1.00 0.00 C ATOM 1904 NE ARG A 116 -26.834 2.352 3.730 1.00 0.00 N ATOM 1905 CZ ARG A 116 -27.648 1.926 2.759 1.00 0.00 C ATOM 1906 NH1 ARG A 116 -27.898 2.677 1.694 1.00 0.00 N ATOM 1907 NH2 ARG A 116 -28.229 0.748 2.872 1.00 0.00 N ATOM 0 H ARG A 116 -29.813 5.951 5.962 1.00 0.00 H new ATOM 0 HA ARG A 116 -27.516 5.346 7.423 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -28.265 3.954 5.562 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -28.083 5.275 4.424 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -25.559 5.249 5.003 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -25.859 3.743 5.848 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -26.411 4.234 2.890 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -25.015 3.390 3.531 1.00 0.00 H new ATOM 0 HE ARG A 116 -26.736 1.756 4.552 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -27.466 3.597 1.606 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -28.522 2.334 0.963 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -28.056 0.171 3.695 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -28.852 0.414 2.137 1.00 0.00 H new ATOM 1921 N GLU A 117 -27.172 7.941 5.335 1.00 0.00 N ATOM 1922 CA GLU A 117 -26.365 9.135 4.992 1.00 0.00 C ATOM 1923 C GLU A 117 -26.171 10.046 6.215 1.00 0.00 C ATOM 1924 O GLU A 117 -25.107 10.646 6.377 1.00 0.00 O ATOM 1925 CB GLU A 117 -27.032 9.927 3.829 1.00 0.00 C ATOM 1926 CG GLU A 117 -27.048 9.186 2.478 1.00 0.00 C ATOM 1927 CD GLU A 117 -25.637 8.852 1.964 1.00 0.00 C ATOM 1928 OE1 GLU A 117 -24.884 9.797 1.639 1.00 0.00 O ATOM 1929 OE2 GLU A 117 -25.263 7.659 1.892 1.00 0.00 O ATOM 0 H GLU A 117 -28.045 7.878 4.811 1.00 0.00 H new ATOM 0 HA GLU A 117 -25.383 8.793 4.667 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -28.058 10.166 4.110 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -26.507 10.874 3.703 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -27.620 8.264 2.582 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -27.563 9.799 1.739 1.00 0.00 H new ATOM 1936 N LEU A 118 -27.222 10.136 7.055 1.00 0.00 N ATOM 1937 CA LEU A 118 -27.208 10.906 8.314 1.00 0.00 C ATOM 1938 C LEU A 118 -26.172 10.316 9.295 1.00 0.00 C ATOM 1939 O LEU A 118 -25.307 11.034 9.809 1.00 0.00 O ATOM 1940 CB LEU A 118 -28.628 10.900 8.946 1.00 0.00 C ATOM 1941 CG LEU A 118 -28.779 11.589 10.341 1.00 0.00 C ATOM 1942 CD1 LEU A 118 -28.423 13.096 10.279 1.00 0.00 C ATOM 1943 CD2 LEU A 118 -30.202 11.363 10.903 1.00 0.00 C ATOM 0 H LEU A 118 -28.112 9.672 6.876 1.00 0.00 H new ATOM 0 HA LEU A 118 -26.922 11.936 8.100 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -29.312 11.386 8.251 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -28.954 9.864 9.041 1.00 0.00 H new ATOM 0 HG LEU A 118 -28.066 11.126 11.024 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -28.541 13.539 11.268 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -27.391 13.213 9.950 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -29.087 13.598 9.576 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -30.291 11.849 11.875 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -30.936 11.787 10.217 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -30.384 10.294 11.014 1.00 0.00 H new ATOM 1955 N GLU A 119 -26.277 8.997 9.511 1.00 0.00 N ATOM 1956 CA GLU A 119 -25.393 8.234 10.409 1.00 0.00 C ATOM 1957 C GLU A 119 -23.943 8.260 9.913 1.00 0.00 C ATOM 1958 O GLU A 119 -23.004 8.357 10.710 1.00 0.00 O ATOM 1959 CB GLU A 119 -25.889 6.763 10.506 1.00 0.00 C ATOM 1960 CG GLU A 119 -27.315 6.593 11.055 1.00 0.00 C ATOM 1961 CD GLU A 119 -27.483 7.110 12.495 1.00 0.00 C ATOM 1962 OE1 GLU A 119 -27.126 6.373 13.445 1.00 0.00 O ATOM 1963 OE2 GLU A 119 -27.976 8.244 12.685 1.00 0.00 O ATOM 0 H GLU A 119 -26.988 8.420 9.061 1.00 0.00 H new ATOM 0 HA GLU A 119 -25.424 8.699 11.394 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -25.842 6.313 9.514 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -25.202 6.205 11.142 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -28.012 7.121 10.404 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -27.585 5.538 11.022 1.00 0.00 H new ATOM 1970 N LYS A 120 -23.788 8.197 8.575 1.00 0.00 N ATOM 1971 CA LYS A 120 -22.482 8.106 7.923 1.00 0.00 C ATOM 1972 C LYS A 120 -21.732 9.427 8.074 1.00 0.00 C ATOM 1973 O LYS A 120 -20.627 9.431 8.586 1.00 0.00 O ATOM 1974 CB LYS A 120 -22.626 7.723 6.424 1.00 0.00 C ATOM 1975 CG LYS A 120 -21.283 7.487 5.686 1.00 0.00 C ATOM 1976 CD LYS A 120 -21.464 6.957 4.236 1.00 0.00 C ATOM 1977 CE LYS A 120 -22.182 7.948 3.303 1.00 0.00 C ATOM 1978 NZ LYS A 120 -21.427 9.216 3.119 1.00 0.00 N ATOM 0 H LYS A 120 -24.571 8.208 7.922 1.00 0.00 H new ATOM 0 HA LYS A 120 -21.909 7.317 8.410 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -23.230 6.819 6.350 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -23.173 8.514 5.911 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -20.723 8.422 5.657 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -20.684 6.775 6.254 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -20.485 6.723 3.819 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -22.029 6.025 4.266 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -22.337 7.478 2.332 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -23.168 8.173 3.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -21.931 9.825 2.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -21.345 9.707 4.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -20.477 9.004 2.753 1.00 0.00 H new ATOM 1992 N ARG A 121 -22.369 10.548 7.667 1.00 0.00 N ATOM 1993 CA ARG A 121 -21.743 11.895 7.703 1.00 0.00 C ATOM 1994 C ARG A 121 -21.418 12.325 9.147 1.00 0.00 C ATOM 1995 O ARG A 121 -20.450 13.058 9.374 1.00 0.00 O ATOM 1996 CB ARG A 121 -22.640 12.973 7.021 1.00 0.00 C ATOM 1997 CG ARG A 121 -23.967 13.300 7.763 1.00 0.00 C ATOM 1998 CD ARG A 121 -24.703 14.527 7.190 1.00 0.00 C ATOM 1999 NE ARG A 121 -23.856 15.736 7.266 1.00 0.00 N ATOM 2000 CZ ARG A 121 -23.803 16.591 8.305 1.00 0.00 C ATOM 2001 NH1 ARG A 121 -24.538 16.405 9.387 1.00 0.00 N ATOM 2002 NH2 ARG A 121 -22.978 17.618 8.265 1.00 0.00 N ATOM 0 H ARG A 121 -23.323 10.549 7.307 1.00 0.00 H new ATOM 0 HA ARG A 121 -20.813 11.820 7.140 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -22.063 13.892 6.921 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -22.880 12.637 6.012 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -24.626 12.434 7.712 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -23.752 13.474 8.817 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -24.980 14.338 6.153 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -25.628 14.691 7.743 1.00 0.00 H new ATOM 0 HE ARG A 121 -23.261 15.940 6.463 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -25.162 15.600 9.448 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -24.481 17.066 10.162 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -22.383 17.763 7.449 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -22.935 18.268 9.050 1.00 0.00 H new ATOM 2016 N LEU A 122 -22.237 11.847 10.111 1.00 0.00 N ATOM 2017 CA LEU A 122 -22.076 12.157 11.542 1.00 0.00 C ATOM 2018 C LEU A 122 -20.735 11.614 12.080 1.00 0.00 C ATOM 2019 O LEU A 122 -20.024 12.305 12.810 1.00 0.00 O ATOM 2020 CB LEU A 122 -23.261 11.560 12.351 1.00 0.00 C ATOM 2021 CG LEU A 122 -23.282 11.891 13.883 1.00 0.00 C ATOM 2022 CD1 LEU A 122 -23.432 13.413 14.133 1.00 0.00 C ATOM 2023 CD2 LEU A 122 -24.380 11.088 14.624 1.00 0.00 C ATOM 0 H LEU A 122 -23.028 11.235 9.914 1.00 0.00 H new ATOM 0 HA LEU A 122 -22.073 13.241 11.659 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -24.192 11.916 11.910 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -23.246 10.476 12.234 1.00 0.00 H new ATOM 0 HG LEU A 122 -22.320 11.584 14.293 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -23.443 13.606 15.206 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -22.594 13.941 13.678 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -24.365 13.764 13.692 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -24.365 11.343 15.684 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -25.356 11.334 14.205 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -24.193 10.021 14.505 1.00 0.00 H new ATOM 2035 N GLN A 123 -20.406 10.372 11.700 1.00 0.00 N ATOM 2036 CA GLN A 123 -19.153 9.704 12.118 1.00 0.00 C ATOM 2037 C GLN A 123 -18.003 10.003 11.133 1.00 0.00 C ATOM 2038 O GLN A 123 -16.834 9.909 11.502 1.00 0.00 O ATOM 2039 CB GLN A 123 -19.390 8.173 12.266 1.00 0.00 C ATOM 2040 CG GLN A 123 -19.865 7.454 10.986 1.00 0.00 C ATOM 2041 CD GLN A 123 -20.305 5.996 11.188 1.00 0.00 C ATOM 2042 OE1 GLN A 123 -20.169 5.169 10.287 1.00 0.00 O ATOM 2043 NE2 GLN A 123 -20.871 5.671 12.345 1.00 0.00 N ATOM 0 H GLN A 123 -20.995 9.798 11.096 1.00 0.00 H new ATOM 0 HA GLN A 123 -18.855 10.102 13.088 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -18.462 7.709 12.601 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -20.129 8.010 13.050 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -20.698 8.014 10.560 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -19.058 7.476 10.254 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -20.973 6.373 13.078 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -21.203 4.719 12.501 1.00 0.00 H new