USER MOD reduce.3.24.130724 H: found=0, std=0, add=645, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 644 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 THR OG1 : rot 180:sc=-0.00408 USER MOD Set 1.2: A 100 MET CE :methyl 139:sc= -0.153 (180deg=-1.13) USER MOD Set 2.1: A 52 ASN : amide:sc= -2 K(o=-1.9,f=-0.81) USER MOD Set 2.2: A 56 ASN : amide:sc= 0.0834 K(o=-1.9,f=-0.81) USER MOD Single : A 24 HIS : no HD1:sc= -1.38 K(o=-1.4,f=-1.9) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -56:sc= 1.02 USER MOD Single : A 34 GLN : amide:sc= -1.78 K(o=-1.8,f=-1.1) USER MOD Single : A 36 CYS SG : rot 95:sc= 0.248 USER MOD Single : A 37 SER OG : rot 180:sc= -0.0169 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.248 K(o=-0.25,f=-2.1!) USER MOD Single : A 77 SER OG : rot 63:sc= 0.231 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 164:sc=-0.00381 (180deg=-0.127) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot -169:sc= -0.191 USER MOD Single : A 90 GLN : amide:sc= -0.0151 X(o=-0.015,f=-0.16) USER MOD Single : A 94 GLN : amide:sc= -2.04! C(o=-2!,f=-1.6!) USER MOD Single : A 96 HIS : no HE2:sc= -1.33 X(o=-1.3,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 252 N GLU A 22 6.299 -18.880 -32.313 1.00 0.00 N ATOM 253 CA GLU A 22 7.241 -19.851 -31.767 1.00 0.00 C ATOM 254 C GLU A 22 7.790 -20.755 -32.867 1.00 0.00 C ATOM 255 O GLU A 22 7.518 -20.547 -34.050 1.00 0.00 O ATOM 256 CB GLU A 22 6.566 -20.697 -30.686 1.00 0.00 C ATOM 257 CG GLU A 22 5.587 -21.720 -31.236 1.00 0.00 C ATOM 258 CD GLU A 22 4.864 -22.483 -30.143 1.00 0.00 C ATOM 259 OE1 GLU A 22 5.281 -22.378 -28.970 1.00 0.00 O ATOM 260 OE2 GLU A 22 3.882 -23.185 -30.460 1.00 0.00 O ATOM 0 HA GLU A 22 8.072 -19.303 -31.323 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.333 -21.214 -30.110 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.040 -20.037 -29.996 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.855 -21.215 -31.866 1.00 0.00 H new ATOM 0 HG3 GLU A 22 6.123 -22.425 -31.872 1.00 0.00 H new ATOM 267 N LEU A 23 8.564 -21.758 -32.469 1.00 0.00 N ATOM 268 CA LEU A 23 9.152 -22.695 -33.420 1.00 0.00 C ATOM 269 C LEU A 23 8.973 -24.134 -32.947 1.00 0.00 C ATOM 270 O LEU A 23 8.563 -24.380 -31.812 1.00 0.00 O ATOM 271 CB LEU A 23 10.638 -22.390 -33.613 1.00 0.00 C ATOM 272 CG LEU A 23 10.975 -21.322 -34.654 1.00 0.00 C ATOM 273 CD1 LEU A 23 12.387 -20.799 -34.445 1.00 0.00 C ATOM 274 CD2 LEU A 23 10.812 -21.879 -36.061 1.00 0.00 C ATOM 0 H LEU A 23 8.799 -21.944 -31.494 1.00 0.00 H new ATOM 0 HA LEU A 23 8.637 -22.579 -34.374 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.052 -22.077 -32.654 1.00 0.00 H new ATOM 0 HB3 LEU A 23 11.145 -23.314 -33.893 1.00 0.00 H new ATOM 0 HG LEU A 23 10.281 -20.491 -34.532 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.609 -20.040 -35.195 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.469 -20.361 -33.450 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.097 -21.621 -34.539 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.056 -21.105 -36.789 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.482 -22.728 -36.196 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.781 -22.203 -36.207 1.00 0.00 H new ATOM 286 N HIS A 24 9.286 -25.083 -33.825 1.00 0.00 N ATOM 287 CA HIS A 24 9.162 -26.499 -33.497 1.00 0.00 C ATOM 288 C HIS A 24 10.175 -26.899 -32.428 1.00 0.00 C ATOM 289 O HIS A 24 11.312 -26.427 -32.407 1.00 0.00 O ATOM 290 CB HIS A 24 9.361 -27.353 -34.749 1.00 0.00 C ATOM 291 CG HIS A 24 8.289 -28.380 -34.949 1.00 0.00 C ATOM 292 ND1 HIS A 24 8.487 -29.727 -34.734 1.00 0.00 N ATOM 293 CD2 HIS A 24 7.001 -28.249 -35.346 1.00 0.00 C ATOM 294 CE1 HIS A 24 7.369 -30.381 -34.992 1.00 0.00 C ATOM 295 NE2 HIS A 24 6.451 -29.507 -35.365 1.00 0.00 N ATOM 0 H HIS A 24 9.627 -24.897 -34.768 1.00 0.00 H new ATOM 0 HA HIS A 24 8.159 -26.670 -33.105 1.00 0.00 H new ATOM 0 HB2 HIS A 24 9.396 -26.701 -35.622 1.00 0.00 H new ATOM 0 HB3 HIS A 24 10.327 -27.855 -34.687 1.00 0.00 H new ATOM 0 HD2 HIS A 24 6.500 -27.327 -35.600 1.00 0.00 H new ATOM 0 HE1 HIS A 24 7.229 -31.449 -34.912 1.00 0.00 H new ATOM 0 HE2 HIS A 24 5.490 -29.730 -35.625 1.00 0.00 H new ATOM 303 N PRO A 25 9.754 -27.789 -31.517 1.00 0.00 N ATOM 304 CA PRO A 25 10.609 -28.272 -30.428 1.00 0.00 C ATOM 305 C PRO A 25 11.735 -29.170 -30.930 1.00 0.00 C ATOM 306 O PRO A 25 12.799 -29.249 -30.315 1.00 0.00 O ATOM 307 CB PRO A 25 9.644 -29.067 -29.545 1.00 0.00 C ATOM 308 CG PRO A 25 8.553 -29.495 -30.466 1.00 0.00 C ATOM 309 CD PRO A 25 8.412 -28.393 -31.480 1.00 0.00 C ATOM 0 HA PRO A 25 11.108 -27.454 -29.908 1.00 0.00 H new ATOM 0 HB2 PRO A 25 10.139 -29.926 -29.091 1.00 0.00 H new ATOM 0 HB3 PRO A 25 9.257 -28.455 -28.730 1.00 0.00 H new ATOM 0 HG2 PRO A 25 8.798 -30.441 -30.949 1.00 0.00 H new ATOM 0 HG3 PRO A 25 7.620 -29.647 -29.923 1.00 0.00 H new ATOM 0 HD2 PRO A 25 8.119 -28.780 -32.456 1.00 0.00 H new ATOM 0 HD3 PRO A 25 7.653 -27.669 -31.183 1.00 0.00 H new ATOM 317 N ASP A 26 11.494 -29.843 -32.049 1.00 0.00 N ATOM 318 CA ASP A 26 12.489 -30.735 -32.634 1.00 0.00 C ATOM 319 C ASP A 26 13.284 -30.021 -33.723 1.00 0.00 C ATOM 320 O ASP A 26 13.010 -30.181 -34.912 1.00 0.00 O ATOM 321 CB ASP A 26 11.813 -31.979 -33.211 1.00 0.00 C ATOM 322 CG ASP A 26 11.697 -33.099 -32.196 1.00 0.00 C ATOM 323 OD1 ASP A 26 12.604 -33.225 -31.346 1.00 0.00 O ATOM 324 OD2 ASP A 26 10.700 -33.849 -32.250 1.00 0.00 O ATOM 0 H ASP A 26 10.619 -29.788 -32.570 1.00 0.00 H new ATOM 0 HA ASP A 26 13.178 -31.039 -31.846 1.00 0.00 H new ATOM 0 HB2 ASP A 26 10.819 -31.715 -33.571 1.00 0.00 H new ATOM 0 HB3 ASP A 26 12.381 -32.331 -34.072 1.00 0.00 H new ATOM 329 N TYR A 27 14.270 -29.233 -33.308 1.00 0.00 N ATOM 330 CA TYR A 27 15.103 -28.493 -34.248 1.00 0.00 C ATOM 331 C TYR A 27 15.752 -29.433 -35.259 1.00 0.00 C ATOM 332 O TYR A 27 16.139 -29.018 -36.352 1.00 0.00 O ATOM 333 CB TYR A 27 16.182 -27.709 -33.498 1.00 0.00 C ATOM 334 CG TYR A 27 17.356 -28.558 -33.064 1.00 0.00 C ATOM 335 CD1 TYR A 27 17.167 -29.693 -32.284 1.00 0.00 C ATOM 336 CD2 TYR A 27 18.653 -28.227 -33.436 1.00 0.00 C ATOM 337 CE1 TYR A 27 18.237 -30.470 -31.885 1.00 0.00 C ATOM 338 CE2 TYR A 27 19.728 -29.000 -33.043 1.00 0.00 C ATOM 339 CZ TYR A 27 19.515 -30.120 -32.267 1.00 0.00 C ATOM 340 OH TYR A 27 20.583 -30.894 -31.873 1.00 0.00 O ATOM 0 H TYR A 27 14.512 -29.091 -32.327 1.00 0.00 H new ATOM 0 HA TYR A 27 14.464 -27.794 -34.788 1.00 0.00 H new ATOM 0 HB2 TYR A 27 16.544 -26.903 -34.137 1.00 0.00 H new ATOM 0 HB3 TYR A 27 15.736 -27.244 -32.619 1.00 0.00 H new ATOM 0 HD1 TYR A 27 16.167 -29.972 -31.985 1.00 0.00 H new ATOM 0 HD2 TYR A 27 18.824 -27.350 -34.043 1.00 0.00 H new ATOM 0 HE1 TYR A 27 18.074 -31.347 -31.277 1.00 0.00 H new ATOM 0 HE2 TYR A 27 20.730 -28.729 -33.342 1.00 0.00 H new ATOM 0 HH TYR A 27 21.413 -30.511 -32.227 1.00 0.00 H new ATOM 350 N LYS A 28 15.867 -30.703 -34.887 1.00 0.00 N ATOM 351 CA LYS A 28 16.467 -31.705 -35.759 1.00 0.00 C ATOM 352 C LYS A 28 15.716 -31.792 -37.084 1.00 0.00 C ATOM 353 O LYS A 28 16.251 -32.275 -38.083 1.00 0.00 O ATOM 354 CB LYS A 28 16.470 -33.073 -35.073 1.00 0.00 C ATOM 355 CG LYS A 28 17.252 -33.098 -33.771 1.00 0.00 C ATOM 356 CD LYS A 28 17.289 -34.493 -33.169 1.00 0.00 C ATOM 357 CE LYS A 28 18.699 -35.063 -33.170 1.00 0.00 C ATOM 358 NZ LYS A 28 18.699 -36.544 -33.012 1.00 0.00 N ATOM 0 H LYS A 28 15.552 -31.063 -33.986 1.00 0.00 H new ATOM 0 HA LYS A 28 17.495 -31.405 -35.962 1.00 0.00 H new ATOM 0 HB2 LYS A 28 15.441 -33.373 -34.875 1.00 0.00 H new ATOM 0 HB3 LYS A 28 16.892 -33.811 -35.755 1.00 0.00 H new ATOM 0 HG2 LYS A 28 18.270 -32.751 -33.950 1.00 0.00 H new ATOM 0 HG3 LYS A 28 16.800 -32.406 -33.061 1.00 0.00 H new ATOM 0 HD2 LYS A 28 16.909 -34.460 -32.148 1.00 0.00 H new ATOM 0 HD3 LYS A 28 16.629 -35.152 -33.733 1.00 0.00 H new ATOM 0 HE2 LYS A 28 19.197 -34.797 -34.102 1.00 0.00 H new ATOM 0 HE3 LYS A 28 19.274 -34.612 -32.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 19.678 -36.894 -33.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 18.246 -36.797 -32.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 18.172 -36.977 -33.797 1.00 0.00 H new ATOM 372 N THR A 29 14.473 -31.320 -37.087 1.00 0.00 N ATOM 373 CA THR A 29 13.650 -31.344 -38.289 1.00 0.00 C ATOM 374 C THR A 29 13.202 -29.939 -38.678 1.00 0.00 C ATOM 375 O THR A 29 12.079 -29.741 -39.140 1.00 0.00 O ATOM 376 CB THR A 29 12.406 -32.233 -38.100 1.00 0.00 C ATOM 377 OG1 THR A 29 11.655 -32.291 -39.318 1.00 0.00 O ATOM 378 CG2 THR A 29 11.524 -31.699 -36.981 1.00 0.00 C ATOM 0 H THR A 29 14.015 -30.917 -36.270 1.00 0.00 H new ATOM 0 HA THR A 29 14.267 -31.759 -39.086 1.00 0.00 H new ATOM 0 HB THR A 29 12.741 -33.235 -37.832 1.00 0.00 H new ATOM 0 HG1 THR A 29 11.422 -31.383 -39.602 1.00 0.00 H new ATOM 0 HG21 THR A 29 10.652 -32.343 -36.866 1.00 0.00 H new ATOM 0 HG22 THR A 29 12.089 -31.683 -36.049 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.199 -30.688 -37.225 1.00 0.00 H new ATOM 386 N TRP A 30 14.088 -28.968 -38.488 1.00 0.00 N ATOM 387 CA TRP A 30 13.784 -27.581 -38.819 1.00 0.00 C ATOM 388 C TRP A 30 13.983 -27.321 -40.308 1.00 0.00 C ATOM 389 O TRP A 30 13.310 -26.475 -40.896 1.00 0.00 O ATOM 390 CB TRP A 30 14.664 -26.635 -38.001 1.00 0.00 C ATOM 391 CG TRP A 30 13.997 -26.131 -36.757 1.00 0.00 C ATOM 392 CD1 TRP A 30 12.803 -26.546 -36.241 1.00 0.00 C ATOM 393 CD2 TRP A 30 14.487 -25.115 -35.874 1.00 0.00 C ATOM 394 NE1 TRP A 30 12.521 -25.850 -35.090 1.00 0.00 N ATOM 395 CE2 TRP A 30 13.538 -24.967 -34.843 1.00 0.00 C ATOM 396 CE3 TRP A 30 15.634 -24.318 -35.853 1.00 0.00 C ATOM 397 CZ2 TRP A 30 13.704 -24.054 -33.806 1.00 0.00 C ATOM 398 CZ3 TRP A 30 15.797 -23.412 -34.822 1.00 0.00 C ATOM 399 CH2 TRP A 30 14.837 -23.286 -33.810 1.00 0.00 C ATOM 0 H TRP A 30 15.022 -29.116 -38.107 1.00 0.00 H new ATOM 0 HA TRP A 30 12.738 -27.396 -38.573 1.00 0.00 H new ATOM 0 HB2 TRP A 30 15.584 -27.151 -37.728 1.00 0.00 H new ATOM 0 HB3 TRP A 30 14.948 -25.786 -38.622 1.00 0.00 H new ATOM 0 HD1 TRP A 30 12.173 -27.309 -36.674 1.00 0.00 H new ATOM 0 HE1 TRP A 30 11.689 -25.972 -34.513 1.00 0.00 H new ATOM 0 HE3 TRP A 30 16.380 -24.408 -36.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 12.965 -23.955 -33.025 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 16.680 -22.790 -34.796 1.00 0.00 H new ATOM 0 HH2 TRP A 30 14.994 -22.569 -33.018 1.00 0.00 H new ATOM 410 N GLY A 31 14.912 -28.054 -40.914 1.00 0.00 N ATOM 411 CA GLY A 31 15.183 -27.887 -42.330 1.00 0.00 C ATOM 412 C GLY A 31 15.723 -26.509 -42.658 1.00 0.00 C ATOM 413 O GLY A 31 15.950 -25.681 -41.776 1.00 0.00 O ATOM 0 H GLY A 31 15.482 -28.761 -40.449 1.00 0.00 H new ATOM 0 HA2 GLY A 31 15.902 -28.641 -42.651 1.00 0.00 H new ATOM 0 HA3 GLY A 31 14.267 -28.059 -42.895 1.00 0.00 H new ATOM 417 N PRO A 32 15.939 -26.248 -43.956 1.00 0.00 N ATOM 418 CA PRO A 32 16.460 -24.962 -44.428 1.00 0.00 C ATOM 419 C PRO A 32 15.448 -23.833 -44.269 1.00 0.00 C ATOM 420 O PRO A 32 15.767 -22.665 -44.492 1.00 0.00 O ATOM 421 CB PRO A 32 16.747 -25.218 -45.910 1.00 0.00 C ATOM 422 CG PRO A 32 15.827 -26.327 -46.288 1.00 0.00 C ATOM 423 CD PRO A 32 15.692 -27.188 -45.062 1.00 0.00 C ATOM 0 HA PRO A 32 17.333 -24.643 -43.859 1.00 0.00 H new ATOM 0 HB2 PRO A 32 16.560 -24.327 -46.509 1.00 0.00 H new ATOM 0 HB3 PRO A 32 17.789 -25.496 -46.069 1.00 0.00 H new ATOM 0 HG2 PRO A 32 14.858 -25.940 -46.602 1.00 0.00 H new ATOM 0 HG3 PRO A 32 16.228 -26.899 -47.125 1.00 0.00 H new ATOM 0 HD2 PRO A 32 14.701 -27.637 -44.994 1.00 0.00 H new ATOM 0 HD3 PRO A 32 16.413 -28.005 -45.063 1.00 0.00 H new ATOM 431 N GLU A 33 14.227 -24.189 -43.882 1.00 0.00 N ATOM 432 CA GLU A 33 13.168 -23.204 -43.693 1.00 0.00 C ATOM 433 C GLU A 33 13.277 -22.544 -42.321 1.00 0.00 C ATOM 434 O GLU A 33 13.595 -21.360 -42.215 1.00 0.00 O ATOM 435 CB GLU A 33 11.796 -23.862 -43.848 1.00 0.00 C ATOM 436 CG GLU A 33 11.693 -24.780 -45.054 1.00 0.00 C ATOM 437 CD GLU A 33 12.065 -24.085 -46.350 1.00 0.00 C ATOM 438 OE1 GLU A 33 11.186 -23.423 -46.940 1.00 0.00 O ATOM 439 OE2 GLU A 33 13.234 -24.203 -46.773 1.00 0.00 O ATOM 0 H GLU A 33 13.947 -25.151 -43.693 1.00 0.00 H new ATOM 0 HA GLU A 33 13.282 -22.435 -44.457 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.573 -24.434 -42.947 1.00 0.00 H new ATOM 0 HB3 GLU A 33 11.037 -23.084 -43.928 1.00 0.00 H new ATOM 0 HG2 GLU A 33 12.345 -25.641 -44.907 1.00 0.00 H new ATOM 0 HG3 GLU A 33 10.675 -25.161 -45.130 1.00 0.00 H new ATOM 446 N GLN A 34 13.010 -23.320 -41.276 1.00 0.00 N ATOM 447 CA GLN A 34 13.077 -22.811 -39.911 1.00 0.00 C ATOM 448 C GLN A 34 14.413 -22.123 -39.651 1.00 0.00 C ATOM 449 O GLN A 34 14.462 -21.043 -39.062 1.00 0.00 O ATOM 450 CB GLN A 34 12.872 -23.949 -38.909 1.00 0.00 C ATOM 451 CG GLN A 34 11.411 -24.231 -38.599 1.00 0.00 C ATOM 452 CD GLN A 34 10.849 -25.372 -39.424 1.00 0.00 C ATOM 453 OE1 GLN A 34 10.599 -26.462 -38.908 1.00 0.00 O ATOM 454 NE2 GLN A 34 10.647 -25.128 -40.713 1.00 0.00 N ATOM 0 H GLN A 34 12.746 -24.302 -41.348 1.00 0.00 H new ATOM 0 HA GLN A 34 12.281 -22.077 -39.784 1.00 0.00 H new ATOM 0 HB2 GLN A 34 13.333 -24.855 -39.302 1.00 0.00 H new ATOM 0 HB3 GLN A 34 13.391 -23.704 -37.982 1.00 0.00 H new ATOM 0 HG2 GLN A 34 11.307 -24.468 -37.540 1.00 0.00 H new ATOM 0 HG3 GLN A 34 10.824 -23.331 -38.783 1.00 0.00 H new ATOM 0 HE21 GLN A 34 10.868 -24.210 -41.099 1.00 0.00 H new ATOM 0 HE22 GLN A 34 10.271 -25.858 -41.317 1.00 0.00 H new ATOM 463 N VAL A 35 15.495 -22.755 -40.094 1.00 0.00 N ATOM 464 CA VAL A 35 16.832 -22.204 -39.910 1.00 0.00 C ATOM 465 C VAL A 35 16.920 -20.784 -40.458 1.00 0.00 C ATOM 466 O VAL A 35 17.542 -19.911 -39.851 1.00 0.00 O ATOM 467 CB VAL A 35 17.898 -23.076 -40.599 1.00 0.00 C ATOM 468 CG1 VAL A 35 19.273 -22.438 -40.472 1.00 0.00 C ATOM 469 CG2 VAL A 35 17.897 -24.480 -40.014 1.00 0.00 C ATOM 0 H VAL A 35 15.472 -23.650 -40.583 1.00 0.00 H new ATOM 0 HA VAL A 35 17.024 -22.189 -38.837 1.00 0.00 H new ATOM 0 HB VAL A 35 17.654 -23.148 -41.659 1.00 0.00 H new ATOM 0 HG11 VAL A 35 20.013 -23.068 -40.965 1.00 0.00 H new ATOM 0 HG12 VAL A 35 19.263 -21.455 -40.942 1.00 0.00 H new ATOM 0 HG13 VAL A 35 19.530 -22.333 -39.418 1.00 0.00 H new ATOM 0 HG21 VAL A 35 18.656 -25.082 -40.513 1.00 0.00 H new ATOM 0 HG22 VAL A 35 18.116 -24.430 -38.947 1.00 0.00 H new ATOM 0 HG23 VAL A 35 16.918 -24.935 -40.162 1.00 0.00 H new ATOM 479 N CYS A 36 16.295 -20.559 -41.608 1.00 0.00 N ATOM 480 CA CYS A 36 16.303 -19.244 -42.239 1.00 0.00 C ATOM 481 C CYS A 36 15.576 -18.221 -41.373 1.00 0.00 C ATOM 482 O CYS A 36 15.769 -17.015 -41.525 1.00 0.00 O ATOM 483 CB CYS A 36 15.653 -19.315 -43.622 1.00 0.00 C ATOM 484 SG CYS A 36 16.790 -19.778 -44.949 1.00 0.00 S ATOM 0 H CYS A 36 15.776 -21.270 -42.123 1.00 0.00 H new ATOM 0 HA CYS A 36 17.340 -18.927 -42.349 1.00 0.00 H new ATOM 0 HB2 CYS A 36 14.835 -20.035 -43.591 1.00 0.00 H new ATOM 0 HB3 CYS A 36 15.214 -18.345 -43.856 1.00 0.00 H new ATOM 0 HG CYS A 36 16.718 -21.060 -45.155 1.00 0.00 H new ATOM 490 N SER A 37 14.737 -18.711 -40.466 1.00 0.00 N ATOM 491 CA SER A 37 13.976 -17.839 -39.579 1.00 0.00 C ATOM 492 C SER A 37 14.686 -17.673 -38.239 1.00 0.00 C ATOM 493 O SER A 37 14.740 -16.575 -37.684 1.00 0.00 O ATOM 494 CB SER A 37 12.571 -18.403 -39.357 1.00 0.00 C ATOM 495 OG SER A 37 12.408 -18.856 -38.024 1.00 0.00 O ATOM 0 H SER A 37 14.567 -19.707 -40.326 1.00 0.00 H new ATOM 0 HA SER A 37 13.897 -16.860 -40.053 1.00 0.00 H new ATOM 0 HB2 SER A 37 11.829 -17.636 -39.577 1.00 0.00 H new ATOM 0 HB3 SER A 37 12.393 -19.226 -40.049 1.00 0.00 H new ATOM 0 HG SER A 37 11.502 -19.210 -37.907 1.00 0.00 H new ATOM 501 N PHE A 38 15.231 -18.770 -37.725 1.00 0.00 N ATOM 502 CA PHE A 38 15.939 -18.748 -36.450 1.00 0.00 C ATOM 503 C PHE A 38 16.991 -17.643 -36.431 1.00 0.00 C ATOM 504 O PHE A 38 17.016 -16.809 -35.525 1.00 0.00 O ATOM 505 CB PHE A 38 16.600 -20.102 -36.185 1.00 0.00 C ATOM 506 CG PHE A 38 17.526 -20.096 -35.003 1.00 0.00 C ATOM 507 CD1 PHE A 38 17.024 -20.028 -33.713 1.00 0.00 C ATOM 508 CD2 PHE A 38 18.899 -20.158 -35.181 1.00 0.00 C ATOM 509 CE1 PHE A 38 17.874 -20.023 -32.623 1.00 0.00 C ATOM 510 CE2 PHE A 38 19.753 -20.153 -34.095 1.00 0.00 C ATOM 511 CZ PHE A 38 19.240 -20.084 -32.815 1.00 0.00 C ATOM 0 H PHE A 38 15.196 -19.686 -38.172 1.00 0.00 H new ATOM 0 HA PHE A 38 15.212 -18.547 -35.663 1.00 0.00 H new ATOM 0 HB2 PHE A 38 15.824 -20.851 -36.025 1.00 0.00 H new ATOM 0 HB3 PHE A 38 17.157 -20.405 -37.071 1.00 0.00 H new ATOM 0 HD1 PHE A 38 15.956 -19.978 -33.558 1.00 0.00 H new ATOM 0 HD2 PHE A 38 19.306 -20.211 -36.180 1.00 0.00 H new ATOM 0 HE1 PHE A 38 17.470 -19.971 -31.623 1.00 0.00 H new ATOM 0 HE2 PHE A 38 20.821 -20.203 -34.247 1.00 0.00 H new ATOM 0 HZ PHE A 38 19.906 -20.078 -31.965 1.00 0.00 H new ATOM 521 N LEU A 39 17.859 -17.644 -37.437 1.00 0.00 N ATOM 522 CA LEU A 39 18.915 -16.642 -37.537 1.00 0.00 C ATOM 523 C LEU A 39 18.333 -15.233 -37.510 1.00 0.00 C ATOM 524 O LEU A 39 18.924 -14.317 -36.938 1.00 0.00 O ATOM 525 CB LEU A 39 19.721 -16.849 -38.820 1.00 0.00 C ATOM 526 CG LEU A 39 20.350 -18.231 -39.002 1.00 0.00 C ATOM 527 CD1 LEU A 39 20.461 -18.577 -40.479 1.00 0.00 C ATOM 528 CD2 LEU A 39 21.717 -18.286 -38.336 1.00 0.00 C ATOM 0 H LEU A 39 17.852 -18.327 -38.195 1.00 0.00 H new ATOM 0 HA LEU A 39 19.575 -16.759 -36.678 1.00 0.00 H new ATOM 0 HB2 LEU A 39 19.068 -16.654 -39.671 1.00 0.00 H new ATOM 0 HB3 LEU A 39 20.516 -16.103 -38.850 1.00 0.00 H new ATOM 0 HG LEU A 39 19.705 -18.968 -38.525 1.00 0.00 H new ATOM 0 HD11 LEU A 39 20.911 -19.564 -40.589 1.00 0.00 H new ATOM 0 HD12 LEU A 39 19.468 -18.579 -40.928 1.00 0.00 H new ATOM 0 HD13 LEU A 39 21.084 -17.836 -40.980 1.00 0.00 H new ATOM 0 HD21 LEU A 39 22.150 -19.277 -38.475 1.00 0.00 H new ATOM 0 HD22 LEU A 39 22.371 -17.538 -38.785 1.00 0.00 H new ATOM 0 HD23 LEU A 39 21.611 -18.083 -37.270 1.00 0.00 H new ATOM 540 N ARG A 40 17.169 -15.067 -38.131 1.00 0.00 N ATOM 541 CA ARG A 40 16.507 -13.769 -38.177 1.00 0.00 C ATOM 542 C ARG A 40 16.087 -13.323 -36.779 1.00 0.00 C ATOM 543 O ARG A 40 15.932 -12.130 -36.519 1.00 0.00 O ATOM 544 CB ARG A 40 15.283 -13.830 -39.094 1.00 0.00 C ATOM 545 CG ARG A 40 15.601 -14.304 -40.502 1.00 0.00 C ATOM 546 CD ARG A 40 16.005 -13.147 -41.402 1.00 0.00 C ATOM 547 NE ARG A 40 14.851 -12.524 -42.045 1.00 0.00 N ATOM 548 CZ ARG A 40 14.122 -13.120 -42.983 1.00 0.00 C ATOM 549 NH1 ARG A 40 14.426 -14.346 -43.384 1.00 0.00 N ATOM 550 NH2 ARG A 40 13.086 -12.488 -43.520 1.00 0.00 N ATOM 0 H ARG A 40 16.666 -15.815 -38.609 1.00 0.00 H new ATOM 0 HA ARG A 40 17.215 -13.041 -38.574 1.00 0.00 H new ATOM 0 HB2 ARG A 40 14.542 -14.497 -38.654 1.00 0.00 H new ATOM 0 HB3 ARG A 40 14.829 -12.840 -39.147 1.00 0.00 H new ATOM 0 HG2 ARG A 40 16.407 -15.037 -40.467 1.00 0.00 H new ATOM 0 HG3 ARG A 40 14.730 -14.807 -40.923 1.00 0.00 H new ATOM 0 HD2 ARG A 40 16.539 -12.400 -40.814 1.00 0.00 H new ATOM 0 HD3 ARG A 40 16.695 -13.506 -42.165 1.00 0.00 H new ATOM 0 HE ARG A 40 14.590 -11.580 -41.759 1.00 0.00 H new ATOM 0 HH11 ARG A 40 15.221 -14.835 -42.973 1.00 0.00 H new ATOM 0 HH12 ARG A 40 13.865 -14.801 -44.104 1.00 0.00 H new ATOM 0 HH21 ARG A 40 12.849 -11.545 -43.213 1.00 0.00 H new ATOM 0 HH22 ARG A 40 12.527 -12.946 -44.240 1.00 0.00 H new ATOM 564 N ARG A 41 15.904 -14.289 -35.885 1.00 0.00 N ATOM 565 CA ARG A 41 15.501 -13.996 -34.515 1.00 0.00 C ATOM 566 C ARG A 41 16.687 -13.501 -33.693 1.00 0.00 C ATOM 567 O ARG A 41 16.516 -12.794 -32.701 1.00 0.00 O ATOM 568 CB ARG A 41 14.897 -15.240 -33.862 1.00 0.00 C ATOM 569 CG ARG A 41 13.731 -15.830 -34.637 1.00 0.00 C ATOM 570 CD ARG A 41 12.898 -16.760 -33.769 1.00 0.00 C ATOM 571 NE ARG A 41 12.198 -16.039 -32.709 1.00 0.00 N ATOM 572 CZ ARG A 41 11.496 -16.637 -31.753 1.00 0.00 C ATOM 573 NH1 ARG A 41 11.401 -17.959 -31.724 1.00 0.00 N ATOM 574 NH2 ARG A 41 10.888 -15.912 -30.823 1.00 0.00 N ATOM 0 H ARG A 41 16.028 -15.281 -36.085 1.00 0.00 H new ATOM 0 HA ARG A 41 14.748 -13.208 -34.545 1.00 0.00 H new ATOM 0 HB2 ARG A 41 15.673 -15.998 -33.757 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.562 -14.986 -32.856 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.102 -15.026 -35.018 1.00 0.00 H new ATOM 0 HG3 ARG A 41 14.107 -16.377 -35.501 1.00 0.00 H new ATOM 0 HD2 ARG A 41 12.172 -17.284 -34.391 1.00 0.00 H new ATOM 0 HD3 ARG A 41 13.544 -17.518 -33.326 1.00 0.00 H new ATOM 0 HE ARG A 41 12.251 -15.020 -32.703 1.00 0.00 H new ATOM 0 HH11 ARG A 41 11.868 -18.520 -32.437 1.00 0.00 H new ATOM 0 HH12 ARG A 41 10.861 -18.416 -30.989 1.00 0.00 H new ATOM 0 HH21 ARG A 41 10.959 -14.895 -30.842 1.00 0.00 H new ATOM 0 HH22 ARG A 41 10.349 -16.372 -30.089 1.00 0.00 H new ATOM 588 N GLY A 42 17.891 -13.878 -34.114 1.00 0.00 N ATOM 589 CA GLY A 42 19.088 -13.465 -33.405 1.00 0.00 C ATOM 590 C GLY A 42 19.563 -12.087 -33.823 1.00 0.00 C ATOM 591 O GLY A 42 20.279 -11.418 -33.080 1.00 0.00 O ATOM 0 H GLY A 42 18.058 -14.462 -34.933 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.891 -13.468 -32.333 1.00 0.00 H new ATOM 0 HA3 GLY A 42 19.882 -14.190 -33.585 1.00 0.00 H new ATOM 595 N GLY A 43 19.164 -11.663 -35.019 1.00 0.00 N ATOM 596 CA GLY A 43 19.565 -10.360 -35.515 1.00 0.00 C ATOM 597 C GLY A 43 20.165 -10.428 -36.906 1.00 0.00 C ATOM 598 O GLY A 43 20.311 -9.407 -37.578 1.00 0.00 O ATOM 0 H GLY A 43 18.571 -12.199 -35.652 1.00 0.00 H new ATOM 0 HA2 GLY A 43 18.699 -9.698 -35.528 1.00 0.00 H new ATOM 0 HA3 GLY A 43 20.291 -9.922 -34.830 1.00 0.00 H new ATOM 602 N PHE A 44 20.514 -11.635 -37.339 1.00 0.00 N ATOM 603 CA PHE A 44 21.104 -11.832 -38.658 1.00 0.00 C ATOM 604 C PHE A 44 20.028 -11.843 -39.739 1.00 0.00 C ATOM 605 O PHE A 44 19.160 -12.715 -39.755 1.00 0.00 O ATOM 606 CB PHE A 44 21.895 -13.142 -38.695 1.00 0.00 C ATOM 607 CG PHE A 44 22.779 -13.343 -37.498 1.00 0.00 C ATOM 608 CD1 PHE A 44 23.976 -12.655 -37.382 1.00 0.00 C ATOM 609 CD2 PHE A 44 22.414 -14.220 -36.490 1.00 0.00 C ATOM 610 CE1 PHE A 44 24.792 -12.839 -36.281 1.00 0.00 C ATOM 611 CE2 PHE A 44 23.226 -14.407 -35.387 1.00 0.00 C ATOM 612 CZ PHE A 44 24.416 -13.715 -35.282 1.00 0.00 C ATOM 0 H PHE A 44 20.399 -12.491 -36.796 1.00 0.00 H new ATOM 0 HA PHE A 44 21.781 -11.001 -38.854 1.00 0.00 H new ATOM 0 HB2 PHE A 44 21.197 -13.976 -38.765 1.00 0.00 H new ATOM 0 HB3 PHE A 44 22.508 -13.162 -39.596 1.00 0.00 H new ATOM 0 HD1 PHE A 44 24.275 -11.968 -38.160 1.00 0.00 H new ATOM 0 HD2 PHE A 44 21.484 -14.764 -36.567 1.00 0.00 H new ATOM 0 HE1 PHE A 44 25.723 -12.298 -36.202 1.00 0.00 H new ATOM 0 HE2 PHE A 44 22.930 -15.094 -34.608 1.00 0.00 H new ATOM 0 HZ PHE A 44 25.051 -13.858 -34.421 1.00 0.00 H new ATOM 622 N GLU A 45 20.092 -10.868 -40.640 1.00 0.00 N ATOM 623 CA GLU A 45 19.122 -10.765 -41.724 1.00 0.00 C ATOM 624 C GLU A 45 19.823 -10.713 -43.078 1.00 0.00 C ATOM 625 O GLU A 45 19.280 -10.189 -44.050 1.00 0.00 O ATOM 626 CB GLU A 45 18.250 -9.522 -41.541 1.00 0.00 C ATOM 627 CG GLU A 45 17.586 -9.439 -40.177 1.00 0.00 C ATOM 628 CD GLU A 45 16.446 -8.439 -40.142 1.00 0.00 C ATOM 629 OE1 GLU A 45 15.324 -8.805 -40.549 1.00 0.00 O ATOM 630 OE2 GLU A 45 16.677 -7.291 -39.708 1.00 0.00 O ATOM 0 H GLU A 45 20.805 -10.139 -40.641 1.00 0.00 H new ATOM 0 HA GLU A 45 18.489 -11.652 -41.696 1.00 0.00 H new ATOM 0 HB2 GLU A 45 18.863 -8.633 -41.692 1.00 0.00 H new ATOM 0 HB3 GLU A 45 17.479 -9.513 -42.312 1.00 0.00 H new ATOM 0 HG2 GLU A 45 17.209 -10.424 -39.900 1.00 0.00 H new ATOM 0 HG3 GLU A 45 18.331 -9.161 -39.431 1.00 0.00 H new ATOM 637 N GLU A 46 21.034 -11.260 -43.133 1.00 0.00 N ATOM 638 CA GLU A 46 21.810 -11.274 -44.367 1.00 0.00 C ATOM 639 C GLU A 46 21.223 -12.266 -45.367 1.00 0.00 C ATOM 640 O GLU A 46 20.835 -13.381 -45.019 1.00 0.00 O ATOM 641 CB GLU A 46 23.269 -11.630 -44.075 1.00 0.00 C ATOM 642 CG GLU A 46 24.127 -11.754 -45.322 1.00 0.00 C ATOM 643 CD GLU A 46 25.490 -12.355 -45.036 1.00 0.00 C ATOM 644 OE1 GLU A 46 26.348 -11.639 -44.478 1.00 0.00 O ATOM 645 OE2 GLU A 46 25.698 -13.540 -45.369 1.00 0.00 O ATOM 0 H GLU A 46 21.498 -11.699 -42.338 1.00 0.00 H new ATOM 0 HA GLU A 46 21.768 -10.276 -44.804 1.00 0.00 H new ATOM 0 HB2 GLU A 46 23.697 -10.867 -43.424 1.00 0.00 H new ATOM 0 HB3 GLU A 46 23.302 -12.572 -43.527 1.00 0.00 H new ATOM 0 HG2 GLU A 46 23.608 -12.372 -46.055 1.00 0.00 H new ATOM 0 HG3 GLU A 46 24.255 -10.768 -45.769 1.00 0.00 H new ATOM 652 N PRO A 47 21.156 -11.852 -46.641 1.00 0.00 N ATOM 653 CA PRO A 47 20.618 -12.689 -47.718 1.00 0.00 C ATOM 654 C PRO A 47 21.529 -13.867 -48.047 1.00 0.00 C ATOM 655 O PRO A 47 21.067 -14.998 -48.197 1.00 0.00 O ATOM 656 CB PRO A 47 20.538 -11.728 -48.907 1.00 0.00 C ATOM 657 CG PRO A 47 21.567 -10.688 -48.624 1.00 0.00 C ATOM 658 CD PRO A 47 21.601 -10.536 -47.129 1.00 0.00 C ATOM 0 HA PRO A 47 19.661 -13.136 -47.448 1.00 0.00 H new ATOM 0 HB2 PRO A 47 20.743 -12.242 -49.846 1.00 0.00 H new ATOM 0 HB3 PRO A 47 19.544 -11.288 -48.994 1.00 0.00 H new ATOM 0 HG2 PRO A 47 22.542 -10.989 -49.008 1.00 0.00 H new ATOM 0 HG3 PRO A 47 21.312 -9.745 -49.107 1.00 0.00 H new ATOM 0 HD2 PRO A 47 22.602 -10.293 -46.773 1.00 0.00 H new ATOM 0 HD3 PRO A 47 20.940 -9.738 -46.791 1.00 0.00 H new ATOM 666 N VAL A 48 22.825 -13.595 -48.156 1.00 0.00 N ATOM 667 CA VAL A 48 23.801 -14.634 -48.465 1.00 0.00 C ATOM 668 C VAL A 48 23.821 -15.708 -47.384 1.00 0.00 C ATOM 669 O VAL A 48 23.971 -16.895 -47.676 1.00 0.00 O ATOM 670 CB VAL A 48 25.217 -14.047 -48.616 1.00 0.00 C ATOM 671 CG1 VAL A 48 26.202 -15.128 -49.035 1.00 0.00 C ATOM 672 CG2 VAL A 48 25.214 -12.900 -49.616 1.00 0.00 C ATOM 0 H VAL A 48 23.224 -12.664 -48.035 1.00 0.00 H new ATOM 0 HA VAL A 48 23.498 -15.081 -49.412 1.00 0.00 H new ATOM 0 HB VAL A 48 25.534 -13.656 -47.649 1.00 0.00 H new ATOM 0 HG11 VAL A 48 27.197 -14.694 -49.137 1.00 0.00 H new ATOM 0 HG12 VAL A 48 26.224 -15.913 -48.279 1.00 0.00 H new ATOM 0 HG13 VAL A 48 25.892 -15.552 -49.990 1.00 0.00 H new ATOM 0 HG21 VAL A 48 26.222 -12.497 -49.710 1.00 0.00 H new ATOM 0 HG22 VAL A 48 24.876 -13.264 -50.586 1.00 0.00 H new ATOM 0 HG23 VAL A 48 24.541 -12.116 -49.269 1.00 0.00 H new ATOM 682 N LEU A 49 23.668 -15.285 -46.134 1.00 0.00 N ATOM 683 CA LEU A 49 23.667 -16.211 -45.007 1.00 0.00 C ATOM 684 C LEU A 49 22.498 -17.186 -45.104 1.00 0.00 C ATOM 685 O LEU A 49 22.683 -18.402 -45.042 1.00 0.00 O ATOM 686 CB LEU A 49 23.595 -15.440 -43.688 1.00 0.00 C ATOM 687 CG LEU A 49 23.377 -16.281 -42.430 1.00 0.00 C ATOM 688 CD1 LEU A 49 24.390 -17.414 -42.362 1.00 0.00 C ATOM 689 CD2 LEU A 49 23.464 -15.411 -41.185 1.00 0.00 C ATOM 0 H LEU A 49 23.543 -14.306 -45.875 1.00 0.00 H new ATOM 0 HA LEU A 49 24.595 -16.782 -45.037 1.00 0.00 H new ATOM 0 HB2 LEU A 49 24.521 -14.877 -43.568 1.00 0.00 H new ATOM 0 HB3 LEU A 49 22.786 -14.713 -43.759 1.00 0.00 H new ATOM 0 HG LEU A 49 22.379 -16.716 -42.476 1.00 0.00 H new ATOM 0 HD11 LEU A 49 24.219 -18.001 -41.460 1.00 0.00 H new ATOM 0 HD12 LEU A 49 24.280 -18.054 -43.238 1.00 0.00 H new ATOM 0 HD13 LEU A 49 25.398 -17.000 -42.340 1.00 0.00 H new ATOM 0 HD21 LEU A 49 23.306 -16.026 -40.299 1.00 0.00 H new ATOM 0 HD22 LEU A 49 24.449 -14.947 -41.134 1.00 0.00 H new ATOM 0 HD23 LEU A 49 22.699 -14.636 -41.229 1.00 0.00 H new ATOM 701 N LEU A 50 21.295 -16.645 -45.258 1.00 0.00 N ATOM 702 CA LEU A 50 20.094 -17.466 -45.366 1.00 0.00 C ATOM 703 C LEU A 50 20.063 -18.212 -46.697 1.00 0.00 C ATOM 704 O LEU A 50 19.409 -19.247 -46.825 1.00 0.00 O ATOM 705 CB LEU A 50 18.843 -16.598 -45.225 1.00 0.00 C ATOM 706 CG LEU A 50 18.814 -15.653 -44.023 1.00 0.00 C ATOM 707 CD1 LEU A 50 17.949 -14.438 -44.320 1.00 0.00 C ATOM 708 CD2 LEU A 50 18.308 -16.381 -42.786 1.00 0.00 C ATOM 0 H LEU A 50 21.125 -15.641 -45.311 1.00 0.00 H new ATOM 0 HA LEU A 50 20.111 -18.199 -44.559 1.00 0.00 H new ATOM 0 HB2 LEU A 50 18.733 -16.003 -46.132 1.00 0.00 H new ATOM 0 HB3 LEU A 50 17.974 -17.254 -45.167 1.00 0.00 H new ATOM 0 HG LEU A 50 19.830 -15.310 -43.829 1.00 0.00 H new ATOM 0 HD11 LEU A 50 17.940 -13.777 -43.453 1.00 0.00 H new ATOM 0 HD12 LEU A 50 18.354 -13.904 -45.180 1.00 0.00 H new ATOM 0 HD13 LEU A 50 16.931 -14.761 -44.540 1.00 0.00 H new ATOM 0 HD21 LEU A 50 18.294 -15.694 -41.940 1.00 0.00 H new ATOM 0 HD22 LEU A 50 17.300 -16.752 -42.969 1.00 0.00 H new ATOM 0 HD23 LEU A 50 18.968 -17.219 -42.562 1.00 0.00 H new ATOM 720 N LYS A 51 20.775 -17.679 -47.684 1.00 0.00 N ATOM 721 CA LYS A 51 20.832 -18.295 -49.005 1.00 0.00 C ATOM 722 C LYS A 51 21.539 -19.645 -48.945 1.00 0.00 C ATOM 723 O LYS A 51 21.043 -20.640 -49.473 1.00 0.00 O ATOM 724 CB LYS A 51 21.554 -17.372 -49.989 1.00 0.00 C ATOM 725 CG LYS A 51 21.851 -18.024 -51.329 1.00 0.00 C ATOM 726 CD LYS A 51 22.629 -17.092 -52.242 1.00 0.00 C ATOM 727 CE LYS A 51 23.973 -17.688 -52.631 1.00 0.00 C ATOM 728 NZ LYS A 51 24.554 -17.014 -53.826 1.00 0.00 N ATOM 0 H LYS A 51 21.321 -16.822 -47.594 1.00 0.00 H new ATOM 0 HA LYS A 51 19.810 -18.455 -49.349 1.00 0.00 H new ATOM 0 HB2 LYS A 51 20.945 -16.483 -50.154 1.00 0.00 H new ATOM 0 HB3 LYS A 51 22.490 -17.038 -49.541 1.00 0.00 H new ATOM 0 HG2 LYS A 51 22.421 -18.939 -51.171 1.00 0.00 H new ATOM 0 HG3 LYS A 51 20.916 -18.310 -51.811 1.00 0.00 H new ATOM 0 HD2 LYS A 51 22.046 -16.890 -53.140 1.00 0.00 H new ATOM 0 HD3 LYS A 51 22.785 -16.136 -51.741 1.00 0.00 H new ATOM 0 HE2 LYS A 51 24.665 -17.602 -51.793 1.00 0.00 H new ATOM 0 HE3 LYS A 51 23.853 -18.752 -52.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 25.469 -17.449 -54.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 23.906 -17.118 -54.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 24.693 -16.004 -53.622 1.00 0.00 H new ATOM 742 N ASN A 52 22.700 -19.672 -48.299 1.00 0.00 N ATOM 743 CA ASN A 52 23.474 -20.901 -48.170 1.00 0.00 C ATOM 744 C ASN A 52 22.669 -21.979 -47.452 1.00 0.00 C ATOM 745 O ASN A 52 22.831 -23.171 -47.717 1.00 0.00 O ATOM 746 CB ASN A 52 24.776 -20.631 -47.412 1.00 0.00 C ATOM 747 CG ASN A 52 25.964 -20.475 -48.341 1.00 0.00 C ATOM 748 OD1 ASN A 52 26.418 -21.442 -48.954 1.00 0.00 O ATOM 749 ND2 ASN A 52 26.474 -19.254 -48.449 1.00 0.00 N ATOM 0 H ASN A 52 23.125 -18.857 -47.857 1.00 0.00 H new ATOM 0 HA ASN A 52 23.712 -21.258 -49.172 1.00 0.00 H new ATOM 0 HB2 ASN A 52 24.664 -19.726 -46.814 1.00 0.00 H new ATOM 0 HB3 ASN A 52 24.966 -21.450 -46.718 1.00 0.00 H new ATOM 0 HD21 ASN A 52 27.274 -19.088 -49.059 1.00 0.00 H new ATOM 0 HD22 ASN A 52 26.065 -18.482 -47.922 1.00 0.00 H new ATOM 756 N ILE A 53 21.800 -21.553 -46.541 1.00 0.00 N ATOM 757 CA ILE A 53 20.968 -22.481 -45.786 1.00 0.00 C ATOM 758 C ILE A 53 20.161 -23.379 -46.718 1.00 0.00 C ATOM 759 O ILE A 53 19.952 -24.558 -46.433 1.00 0.00 O ATOM 760 CB ILE A 53 20.002 -21.735 -44.846 1.00 0.00 C ATOM 761 CG1 ILE A 53 20.786 -20.888 -43.842 1.00 0.00 C ATOM 762 CG2 ILE A 53 19.098 -22.722 -44.124 1.00 0.00 C ATOM 763 CD1 ILE A 53 21.652 -21.705 -42.909 1.00 0.00 C ATOM 0 H ILE A 53 21.654 -20.571 -46.308 1.00 0.00 H new ATOM 0 HA ILE A 53 21.642 -23.094 -45.188 1.00 0.00 H new ATOM 0 HB ILE A 53 19.377 -21.071 -45.443 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.416 -20.184 -44.386 1.00 0.00 H new ATOM 0 HG13 ILE A 53 20.085 -20.298 -43.251 1.00 0.00 H new ATOM 0 HG21 ILE A 53 18.421 -22.180 -43.464 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.518 -23.286 -44.855 1.00 0.00 H new ATOM 0 HG23 ILE A 53 19.706 -23.409 -43.536 1.00 0.00 H new ATOM 0 HD11 ILE A 53 22.179 -21.039 -42.225 1.00 0.00 H new ATOM 0 HD12 ILE A 53 21.026 -22.390 -42.338 1.00 0.00 H new ATOM 0 HD13 ILE A 53 22.377 -22.275 -43.491 1.00 0.00 H new ATOM 775 N ARG A 54 19.710 -22.813 -47.833 1.00 0.00 N ATOM 776 CA ARG A 54 18.927 -23.562 -48.807 1.00 0.00 C ATOM 777 C ARG A 54 19.834 -24.228 -49.838 1.00 0.00 C ATOM 778 O ARG A 54 19.438 -25.188 -50.497 1.00 0.00 O ATOM 779 CB ARG A 54 17.929 -22.639 -49.510 1.00 0.00 C ATOM 780 CG ARG A 54 16.925 -21.997 -48.567 1.00 0.00 C ATOM 781 CD ARG A 54 16.055 -20.979 -49.288 1.00 0.00 C ATOM 782 NE ARG A 54 14.910 -21.604 -49.943 1.00 0.00 N ATOM 783 CZ ARG A 54 13.890 -20.921 -50.450 1.00 0.00 C ATOM 784 NH1 ARG A 54 13.873 -19.597 -50.377 1.00 0.00 N ATOM 785 NH2 ARG A 54 12.883 -21.561 -51.031 1.00 0.00 N ATOM 0 H ARG A 54 19.874 -21.838 -48.084 1.00 0.00 H new ATOM 0 HA ARG A 54 18.379 -24.339 -48.274 1.00 0.00 H new ATOM 0 HB2 ARG A 54 18.478 -21.855 -50.032 1.00 0.00 H new ATOM 0 HB3 ARG A 54 17.391 -23.209 -50.267 1.00 0.00 H new ATOM 0 HG2 ARG A 54 16.294 -22.768 -48.125 1.00 0.00 H new ATOM 0 HG3 ARG A 54 17.454 -21.510 -47.748 1.00 0.00 H new ATOM 0 HD2 ARG A 54 15.702 -20.234 -48.575 1.00 0.00 H new ATOM 0 HD3 ARG A 54 16.654 -20.451 -50.030 1.00 0.00 H new ATOM 0 HE ARG A 54 14.892 -22.621 -50.015 1.00 0.00 H new ATOM 0 HH11 ARG A 54 14.644 -19.101 -49.931 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.089 -19.075 -50.767 1.00 0.00 H new ATOM 0 HH21 ARG A 54 12.891 -22.579 -51.089 1.00 0.00 H new ATOM 0 HH22 ARG A 54 12.101 -21.035 -51.420 1.00 0.00 H new ATOM 799 N GLU A 55 21.050 -23.709 -49.971 1.00 0.00 N ATOM 800 CA GLU A 55 22.012 -24.253 -50.922 1.00 0.00 C ATOM 801 C GLU A 55 22.706 -25.486 -50.351 1.00 0.00 C ATOM 802 O GLU A 55 23.198 -26.334 -51.093 1.00 0.00 O ATOM 803 CB GLU A 55 23.053 -23.194 -51.291 1.00 0.00 C ATOM 804 CG GLU A 55 22.480 -22.023 -52.072 1.00 0.00 C ATOM 805 CD GLU A 55 23.477 -21.429 -53.048 1.00 0.00 C ATOM 806 OE1 GLU A 55 24.689 -21.678 -52.882 1.00 0.00 O ATOM 807 OE2 GLU A 55 23.045 -20.715 -53.977 1.00 0.00 O ATOM 0 H GLU A 55 21.392 -22.913 -49.433 1.00 0.00 H new ATOM 0 HA GLU A 55 21.468 -24.547 -51.820 1.00 0.00 H new ATOM 0 HB2 GLU A 55 23.517 -22.819 -50.379 1.00 0.00 H new ATOM 0 HB3 GLU A 55 23.842 -23.662 -51.880 1.00 0.00 H new ATOM 0 HG2 GLU A 55 21.596 -22.353 -52.617 1.00 0.00 H new ATOM 0 HG3 GLU A 55 22.155 -21.250 -51.375 1.00 0.00 H new ATOM 814 N ASN A 56 22.740 -25.577 -49.025 1.00 0.00 N ATOM 815 CA ASN A 56 23.374 -26.705 -48.353 1.00 0.00 C ATOM 816 C ASN A 56 22.361 -27.478 -47.515 1.00 0.00 C ATOM 817 O ASN A 56 22.730 -28.326 -46.703 1.00 0.00 O ATOM 818 CB ASN A 56 24.521 -26.217 -47.465 1.00 0.00 C ATOM 819 CG ASN A 56 25.671 -25.643 -48.269 1.00 0.00 C ATOM 820 OD1 ASN A 56 26.517 -26.379 -48.776 1.00 0.00 O ATOM 821 ND2 ASN A 56 25.707 -24.321 -48.389 1.00 0.00 N ATOM 0 H ASN A 56 22.336 -24.883 -48.395 1.00 0.00 H new ATOM 0 HA ASN A 56 23.773 -27.373 -49.116 1.00 0.00 H new ATOM 0 HB2 ASN A 56 24.147 -25.458 -46.778 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.884 -27.046 -46.857 1.00 0.00 H new ATOM 0 HD21 ASN A 56 26.457 -23.877 -48.918 1.00 0.00 H new ATOM 0 HD22 ASN A 56 24.984 -23.749 -47.952 1.00 0.00 H new ATOM 828 N GLU A 57 21.082 -27.179 -47.718 1.00 0.00 N ATOM 829 CA GLU A 57 20.015 -27.846 -46.981 1.00 0.00 C ATOM 830 C GLU A 57 20.273 -27.787 -45.478 1.00 0.00 C ATOM 831 O GLU A 57 19.873 -28.682 -44.733 1.00 0.00 O ATOM 832 CB GLU A 57 19.888 -29.303 -47.431 1.00 0.00 C ATOM 833 CG GLU A 57 19.160 -29.471 -48.753 1.00 0.00 C ATOM 834 CD GLU A 57 19.036 -30.924 -49.171 1.00 0.00 C ATOM 835 OE1 GLU A 57 19.366 -31.806 -48.351 1.00 0.00 O ATOM 836 OE2 GLU A 57 18.610 -31.178 -50.317 1.00 0.00 O ATOM 0 H GLU A 57 20.759 -26.479 -48.387 1.00 0.00 H new ATOM 0 HA GLU A 57 19.081 -27.325 -47.193 1.00 0.00 H new ATOM 0 HB2 GLU A 57 20.885 -29.736 -47.517 1.00 0.00 H new ATOM 0 HB3 GLU A 57 19.361 -29.867 -46.662 1.00 0.00 H new ATOM 0 HG2 GLU A 57 18.165 -29.034 -48.673 1.00 0.00 H new ATOM 0 HG3 GLU A 57 19.690 -28.918 -49.528 1.00 0.00 H new ATOM 843 N ILE A 58 20.944 -26.727 -45.040 1.00 0.00 N ATOM 844 CA ILE A 58 21.255 -26.550 -43.627 1.00 0.00 C ATOM 845 C ILE A 58 20.005 -26.698 -42.767 1.00 0.00 C ATOM 846 O ILE A 58 19.000 -26.021 -42.988 1.00 0.00 O ATOM 847 CB ILE A 58 21.889 -25.173 -43.358 1.00 0.00 C ATOM 848 CG1 ILE A 58 23.227 -25.051 -44.092 1.00 0.00 C ATOM 849 CG2 ILE A 58 22.078 -24.959 -41.864 1.00 0.00 C ATOM 850 CD1 ILE A 58 24.238 -26.099 -43.683 1.00 0.00 C ATOM 0 H ILE A 58 21.283 -25.978 -45.644 1.00 0.00 H new ATOM 0 HA ILE A 58 21.971 -27.328 -43.362 1.00 0.00 H new ATOM 0 HB ILE A 58 21.217 -24.401 -43.734 1.00 0.00 H new ATOM 0 HG12 ILE A 58 23.052 -25.126 -45.165 1.00 0.00 H new ATOM 0 HG13 ILE A 58 23.645 -24.062 -43.906 1.00 0.00 H new ATOM 0 HG21 ILE A 58 22.527 -23.981 -41.690 1.00 0.00 H new ATOM 0 HG22 ILE A 58 21.111 -25.008 -41.364 1.00 0.00 H new ATOM 0 HG23 ILE A 58 22.732 -25.735 -41.465 1.00 0.00 H new ATOM 0 HD11 ILE A 58 25.162 -25.952 -44.243 1.00 0.00 H new ATOM 0 HD12 ILE A 58 24.443 -26.010 -42.616 1.00 0.00 H new ATOM 0 HD13 ILE A 58 23.840 -27.091 -43.895 1.00 0.00 H new ATOM 862 N THR A 59 20.073 -27.588 -41.781 1.00 0.00 N ATOM 863 CA THR A 59 18.948 -27.825 -40.886 1.00 0.00 C ATOM 864 C THR A 59 19.333 -27.557 -39.436 1.00 0.00 C ATOM 865 O THR A 59 20.510 -27.395 -39.115 1.00 0.00 O ATOM 866 CB THR A 59 18.427 -29.269 -41.008 1.00 0.00 C ATOM 867 OG1 THR A 59 19.320 -30.170 -40.344 1.00 0.00 O ATOM 868 CG2 THR A 59 18.286 -29.672 -42.468 1.00 0.00 C ATOM 0 H THR A 59 20.896 -28.156 -41.583 1.00 0.00 H new ATOM 0 HA THR A 59 18.158 -27.135 -41.183 1.00 0.00 H new ATOM 0 HB THR A 59 17.445 -29.318 -40.537 1.00 0.00 H new ATOM 0 HG1 THR A 59 18.981 -31.086 -40.425 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.917 -30.696 -42.529 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.583 -29.003 -42.964 1.00 0.00 H new ATOM 0 HG23 THR A 59 19.257 -29.607 -42.959 1.00 0.00 H new ATOM 876 N GLY A 60 18.332 -27.510 -38.561 1.00 0.00 N ATOM 877 CA GLY A 60 18.588 -27.262 -37.154 1.00 0.00 C ATOM 878 C GLY A 60 19.587 -28.237 -36.565 1.00 0.00 C ATOM 879 O GLY A 60 20.373 -27.878 -35.689 1.00 0.00 O ATOM 0 H GLY A 60 17.349 -27.639 -38.802 1.00 0.00 H new ATOM 0 HA2 GLY A 60 18.961 -26.245 -37.030 1.00 0.00 H new ATOM 0 HA3 GLY A 60 17.651 -27.328 -36.601 1.00 0.00 H new ATOM 883 N ALA A 61 19.558 -29.476 -37.047 1.00 0.00 N ATOM 884 CA ALA A 61 20.468 -30.506 -36.563 1.00 0.00 C ATOM 885 C ALA A 61 21.901 -30.221 -36.999 1.00 0.00 C ATOM 886 O ALA A 61 22.854 -30.738 -36.415 1.00 0.00 O ATOM 887 CB ALA A 61 20.027 -31.875 -37.056 1.00 0.00 C ATOM 0 H ALA A 61 18.914 -29.790 -37.773 1.00 0.00 H new ATOM 0 HA ALA A 61 20.439 -30.498 -35.473 1.00 0.00 H new ATOM 0 HB1 ALA A 61 20.716 -32.634 -36.686 1.00 0.00 H new ATOM 0 HB2 ALA A 61 19.023 -32.088 -36.690 1.00 0.00 H new ATOM 0 HB3 ALA A 61 20.025 -31.886 -38.146 1.00 0.00 H new ATOM 893 N LEU A 62 22.048 -29.396 -38.030 1.00 0.00 N ATOM 894 CA LEU A 62 23.366 -29.043 -38.547 1.00 0.00 C ATOM 895 C LEU A 62 23.811 -27.683 -38.017 1.00 0.00 C ATOM 896 O LEU A 62 24.993 -27.340 -38.072 1.00 0.00 O ATOM 897 CB LEU A 62 23.349 -29.027 -40.076 1.00 0.00 C ATOM 898 CG LEU A 62 23.027 -30.357 -40.758 1.00 0.00 C ATOM 899 CD1 LEU A 62 23.160 -30.230 -42.267 1.00 0.00 C ATOM 900 CD2 LEU A 62 23.935 -31.459 -40.232 1.00 0.00 C ATOM 0 H LEU A 62 21.270 -28.959 -38.525 1.00 0.00 H new ATOM 0 HA LEU A 62 24.077 -29.796 -38.207 1.00 0.00 H new ATOM 0 HB2 LEU A 62 22.618 -28.288 -40.403 1.00 0.00 H new ATOM 0 HB3 LEU A 62 24.324 -28.689 -40.427 1.00 0.00 H new ATOM 0 HG LEU A 62 21.995 -30.621 -40.526 1.00 0.00 H new ATOM 0 HD11 LEU A 62 22.927 -31.187 -42.735 1.00 0.00 H new ATOM 0 HD12 LEU A 62 22.468 -29.470 -42.631 1.00 0.00 H new ATOM 0 HD13 LEU A 62 24.181 -29.942 -42.519 1.00 0.00 H new ATOM 0 HD21 LEU A 62 23.692 -32.399 -40.728 1.00 0.00 H new ATOM 0 HD22 LEU A 62 24.975 -31.201 -40.433 1.00 0.00 H new ATOM 0 HD23 LEU A 62 23.790 -31.568 -39.157 1.00 0.00 H new ATOM 912 N LEU A 63 22.859 -26.913 -37.503 1.00 0.00 N ATOM 913 CA LEU A 63 23.153 -25.591 -36.962 1.00 0.00 C ATOM 914 C LEU A 63 24.322 -25.651 -35.984 1.00 0.00 C ATOM 915 O LEU A 63 25.347 -24.993 -36.164 1.00 0.00 O ATOM 916 CB LEU A 63 21.918 -25.019 -36.263 1.00 0.00 C ATOM 917 CG LEU A 63 21.171 -23.917 -37.016 1.00 0.00 C ATOM 918 CD1 LEU A 63 19.975 -23.436 -36.209 1.00 0.00 C ATOM 919 CD2 LEU A 63 22.106 -22.758 -37.330 1.00 0.00 C ATOM 0 H LEU A 63 21.876 -27.181 -37.449 1.00 0.00 H new ATOM 0 HA LEU A 63 23.429 -24.939 -37.791 1.00 0.00 H new ATOM 0 HB2 LEU A 63 21.223 -25.836 -36.071 1.00 0.00 H new ATOM 0 HB3 LEU A 63 22.223 -24.626 -35.293 1.00 0.00 H new ATOM 0 HG LEU A 63 20.806 -24.329 -37.957 1.00 0.00 H new ATOM 0 HD11 LEU A 63 19.456 -22.652 -36.760 1.00 0.00 H new ATOM 0 HD12 LEU A 63 19.294 -24.269 -36.035 1.00 0.00 H new ATOM 0 HD13 LEU A 63 20.317 -23.041 -35.252 1.00 0.00 H new ATOM 0 HD21 LEU A 63 21.558 -21.983 -37.866 1.00 0.00 H new ATOM 0 HD22 LEU A 63 22.500 -22.347 -36.401 1.00 0.00 H new ATOM 0 HD23 LEU A 63 22.930 -23.113 -37.949 1.00 0.00 H new ATOM 931 N PRO A 64 24.168 -26.460 -34.925 1.00 0.00 N ATOM 932 CA PRO A 64 25.203 -26.627 -33.900 1.00 0.00 C ATOM 933 C PRO A 64 26.420 -27.381 -34.423 1.00 0.00 C ATOM 934 O PRO A 64 27.441 -27.481 -33.741 1.00 0.00 O ATOM 935 CB PRO A 64 24.496 -27.440 -32.813 1.00 0.00 C ATOM 936 CG PRO A 64 23.418 -28.176 -33.531 1.00 0.00 C ATOM 937 CD PRO A 64 22.973 -27.273 -34.648 1.00 0.00 C ATOM 0 HA PRO A 64 25.591 -25.670 -33.552 1.00 0.00 H new ATOM 0 HB2 PRO A 64 25.185 -28.127 -32.322 1.00 0.00 H new ATOM 0 HB3 PRO A 64 24.085 -26.792 -32.039 1.00 0.00 H new ATOM 0 HG2 PRO A 64 23.786 -29.125 -33.920 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.589 -28.406 -32.861 1.00 0.00 H new ATOM 0 HD2 PRO A 64 22.662 -27.841 -35.524 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.126 -26.654 -34.352 1.00 0.00 H new ATOM 945 N CYS A 65 26.307 -27.910 -35.636 1.00 0.00 N ATOM 946 CA CYS A 65 27.399 -28.656 -36.251 1.00 0.00 C ATOM 947 C CYS A 65 28.359 -27.717 -36.975 1.00 0.00 C ATOM 948 O CYS A 65 29.572 -27.933 -36.978 1.00 0.00 O ATOM 949 CB CYS A 65 26.849 -29.695 -37.228 1.00 0.00 C ATOM 950 SG CYS A 65 27.386 -31.388 -36.886 1.00 0.00 S ATOM 0 H CYS A 65 25.470 -27.836 -36.214 1.00 0.00 H new ATOM 0 HA CYS A 65 27.947 -29.167 -35.460 1.00 0.00 H new ATOM 0 HB2 CYS A 65 25.760 -29.659 -37.205 1.00 0.00 H new ATOM 0 HB3 CYS A 65 27.155 -29.425 -38.239 1.00 0.00 H new ATOM 0 HG CYS A 65 26.867 -32.194 -37.764 1.00 0.00 H new ATOM 956 N LEU A 66 27.809 -26.676 -37.589 1.00 0.00 N ATOM 957 CA LEU A 66 28.615 -25.704 -38.319 1.00 0.00 C ATOM 958 C LEU A 66 29.550 -24.954 -37.376 1.00 0.00 C ATOM 959 O LEU A 66 29.165 -24.590 -36.264 1.00 0.00 O ATOM 960 CB LEU A 66 27.712 -24.713 -39.056 1.00 0.00 C ATOM 961 CG LEU A 66 26.686 -25.322 -40.012 1.00 0.00 C ATOM 962 CD1 LEU A 66 25.516 -24.372 -40.215 1.00 0.00 C ATOM 963 CD2 LEU A 66 27.336 -25.664 -41.345 1.00 0.00 C ATOM 0 H LEU A 66 26.807 -26.483 -37.596 1.00 0.00 H new ATOM 0 HA LEU A 66 29.220 -26.244 -39.047 1.00 0.00 H new ATOM 0 HB2 LEU A 66 27.179 -24.117 -38.315 1.00 0.00 H new ATOM 0 HB3 LEU A 66 28.344 -24.028 -39.621 1.00 0.00 H new ATOM 0 HG LEU A 66 26.307 -26.243 -39.569 1.00 0.00 H new ATOM 0 HD11 LEU A 66 24.796 -24.822 -40.898 1.00 0.00 H new ATOM 0 HD12 LEU A 66 25.034 -24.178 -39.257 1.00 0.00 H new ATOM 0 HD13 LEU A 66 25.878 -23.434 -40.636 1.00 0.00 H new ATOM 0 HD21 LEU A 66 26.591 -26.096 -42.013 1.00 0.00 H new ATOM 0 HD22 LEU A 66 27.744 -24.758 -41.794 1.00 0.00 H new ATOM 0 HD23 LEU A 66 28.140 -26.383 -41.184 1.00 0.00 H new ATOM 975 N ASP A 67 30.778 -24.725 -37.827 1.00 0.00 N ATOM 976 CA ASP A 67 31.767 -24.014 -37.024 1.00 0.00 C ATOM 977 C ASP A 67 32.082 -22.651 -37.632 1.00 0.00 C ATOM 978 O ASP A 67 31.464 -22.241 -38.613 1.00 0.00 O ATOM 979 CB ASP A 67 33.048 -24.842 -36.905 1.00 0.00 C ATOM 980 CG ASP A 67 32.767 -26.320 -36.724 1.00 0.00 C ATOM 981 OD1 ASP A 67 31.820 -26.658 -35.985 1.00 0.00 O ATOM 982 OD2 ASP A 67 33.496 -27.141 -37.321 1.00 0.00 O ATOM 0 H ASP A 67 31.113 -25.021 -38.744 1.00 0.00 H new ATOM 0 HA ASP A 67 31.349 -23.860 -36.029 1.00 0.00 H new ATOM 0 HB2 ASP A 67 33.655 -24.697 -37.799 1.00 0.00 H new ATOM 0 HB3 ASP A 67 33.634 -24.480 -36.060 1.00 0.00 H new ATOM 987 N GLU A 68 33.046 -21.953 -37.039 1.00 0.00 N ATOM 988 CA GLU A 68 33.441 -20.635 -37.522 1.00 0.00 C ATOM 989 C GLU A 68 33.738 -20.670 -39.018 1.00 0.00 C ATOM 990 O GLU A 68 33.136 -19.932 -39.799 1.00 0.00 O ATOM 991 CB GLU A 68 34.669 -20.135 -36.758 1.00 0.00 C ATOM 992 CG GLU A 68 34.593 -18.665 -36.380 1.00 0.00 C ATOM 993 CD GLU A 68 34.973 -18.414 -34.934 1.00 0.00 C ATOM 994 OE1 GLU A 68 35.834 -19.152 -34.411 1.00 0.00 O ATOM 995 OE2 GLU A 68 34.411 -17.480 -34.325 1.00 0.00 O ATOM 0 H GLU A 68 33.567 -22.278 -36.225 1.00 0.00 H new ATOM 0 HA GLU A 68 32.611 -19.949 -37.350 1.00 0.00 H new ATOM 0 HB2 GLU A 68 34.790 -20.729 -35.852 1.00 0.00 H new ATOM 0 HB3 GLU A 68 35.558 -20.299 -37.367 1.00 0.00 H new ATOM 0 HG2 GLU A 68 35.254 -18.092 -37.030 1.00 0.00 H new ATOM 0 HG3 GLU A 68 33.580 -18.301 -36.554 1.00 0.00 H new ATOM 1002 N SER A 69 34.672 -21.531 -39.410 1.00 0.00 N ATOM 1003 CA SER A 69 35.053 -21.660 -40.812 1.00 0.00 C ATOM 1004 C SER A 69 33.826 -21.885 -41.690 1.00 0.00 C ATOM 1005 O SER A 69 33.705 -21.303 -42.768 1.00 0.00 O ATOM 1006 CB SER A 69 36.041 -22.814 -40.989 1.00 0.00 C ATOM 1007 OG SER A 69 37.380 -22.356 -40.912 1.00 0.00 O ATOM 0 H SER A 69 35.179 -22.149 -38.777 1.00 0.00 H new ATOM 0 HA SER A 69 35.532 -20.731 -41.120 1.00 0.00 H new ATOM 0 HB2 SER A 69 35.866 -23.567 -40.221 1.00 0.00 H new ATOM 0 HB3 SER A 69 35.873 -23.296 -41.952 1.00 0.00 H new ATOM 0 HG SER A 69 37.992 -23.113 -41.026 1.00 0.00 H new ATOM 1013 N ARG A 70 32.918 -22.735 -41.220 1.00 0.00 N ATOM 1014 CA ARG A 70 31.701 -23.039 -41.963 1.00 0.00 C ATOM 1015 C ARG A 70 30.873 -21.777 -42.190 1.00 0.00 C ATOM 1016 O ARG A 70 30.551 -21.430 -43.327 1.00 0.00 O ATOM 1017 CB ARG A 70 30.868 -24.080 -41.213 1.00 0.00 C ATOM 1018 CG ARG A 70 31.467 -25.477 -41.244 1.00 0.00 C ATOM 1019 CD ARG A 70 31.115 -26.205 -42.532 1.00 0.00 C ATOM 1020 NE ARG A 70 30.775 -27.605 -42.294 1.00 0.00 N ATOM 1021 CZ ARG A 70 31.679 -28.560 -42.108 1.00 0.00 C ATOM 1022 NH1 ARG A 70 32.972 -28.266 -42.132 1.00 0.00 N ATOM 1023 NH2 ARG A 70 31.291 -29.811 -41.897 1.00 0.00 N ATOM 0 H ARG A 70 33.002 -23.225 -40.329 1.00 0.00 H new ATOM 0 HA ARG A 70 31.989 -23.444 -42.933 1.00 0.00 H new ATOM 0 HB2 ARG A 70 30.756 -23.765 -40.176 1.00 0.00 H new ATOM 0 HB3 ARG A 70 29.868 -24.113 -41.646 1.00 0.00 H new ATOM 0 HG2 ARG A 70 32.551 -25.412 -41.146 1.00 0.00 H new ATOM 0 HG3 ARG A 70 31.104 -26.049 -40.390 1.00 0.00 H new ATOM 0 HD2 ARG A 70 30.275 -25.705 -43.013 1.00 0.00 H new ATOM 0 HD3 ARG A 70 31.957 -26.149 -43.222 1.00 0.00 H new ATOM 0 HE ARG A 70 29.789 -27.864 -42.269 1.00 0.00 H new ATOM 0 HH11 ARG A 70 33.274 -27.305 -42.293 1.00 0.00 H new ATOM 0 HH12 ARG A 70 33.665 -29.001 -41.989 1.00 0.00 H new ATOM 0 HH21 ARG A 70 30.297 -30.040 -41.877 1.00 0.00 H new ATOM 0 HH22 ARG A 70 31.986 -30.543 -41.754 1.00 0.00 H new ATOM 1037 N PHE A 71 30.532 -21.096 -41.102 1.00 0.00 N ATOM 1038 CA PHE A 71 29.740 -19.874 -41.182 1.00 0.00 C ATOM 1039 C PHE A 71 30.377 -18.876 -42.145 1.00 0.00 C ATOM 1040 O PHE A 71 29.683 -18.204 -42.907 1.00 0.00 O ATOM 1041 CB PHE A 71 29.597 -19.242 -39.796 1.00 0.00 C ATOM 1042 CG PHE A 71 28.899 -20.127 -38.803 1.00 0.00 C ATOM 1043 CD1 PHE A 71 27.664 -20.681 -39.097 1.00 0.00 C ATOM 1044 CD2 PHE A 71 29.478 -20.403 -37.575 1.00 0.00 C ATOM 1045 CE1 PHE A 71 27.019 -21.496 -38.186 1.00 0.00 C ATOM 1046 CE2 PHE A 71 28.838 -21.218 -36.660 1.00 0.00 C ATOM 1047 CZ PHE A 71 27.607 -21.764 -36.965 1.00 0.00 C ATOM 0 H PHE A 71 30.791 -21.369 -40.154 1.00 0.00 H new ATOM 0 HA PHE A 71 28.751 -20.135 -41.558 1.00 0.00 H new ATOM 0 HB2 PHE A 71 30.587 -18.993 -39.415 1.00 0.00 H new ATOM 0 HB3 PHE A 71 29.046 -18.306 -39.887 1.00 0.00 H new ATOM 0 HD1 PHE A 71 27.199 -20.474 -40.050 1.00 0.00 H new ATOM 0 HD2 PHE A 71 30.440 -19.977 -37.330 1.00 0.00 H new ATOM 0 HE1 PHE A 71 26.057 -21.923 -38.428 1.00 0.00 H new ATOM 0 HE2 PHE A 71 29.301 -21.428 -35.707 1.00 0.00 H new ATOM 0 HZ PHE A 71 27.105 -22.399 -36.250 1.00 0.00 H new ATOM 1057 N GLU A 72 31.703 -18.785 -42.103 1.00 0.00 N ATOM 1058 CA GLU A 72 32.433 -17.868 -42.971 1.00 0.00 C ATOM 1059 C GLU A 72 32.199 -18.207 -44.440 1.00 0.00 C ATOM 1060 O GLU A 72 32.306 -17.345 -45.311 1.00 0.00 O ATOM 1061 CB GLU A 72 33.929 -17.917 -42.657 1.00 0.00 C ATOM 1062 CG GLU A 72 34.771 -17.041 -43.569 1.00 0.00 C ATOM 1063 CD GLU A 72 36.256 -17.163 -43.288 1.00 0.00 C ATOM 1064 OE1 GLU A 72 36.646 -18.097 -42.555 1.00 0.00 O ATOM 1065 OE2 GLU A 72 37.029 -16.326 -43.800 1.00 0.00 O ATOM 0 H GLU A 72 32.293 -19.334 -41.478 1.00 0.00 H new ATOM 0 HA GLU A 72 32.063 -16.860 -42.786 1.00 0.00 H new ATOM 0 HB2 GLU A 72 34.085 -17.607 -41.624 1.00 0.00 H new ATOM 0 HB3 GLU A 72 34.275 -18.948 -42.736 1.00 0.00 H new ATOM 0 HG2 GLU A 72 34.578 -17.313 -44.607 1.00 0.00 H new ATOM 0 HG3 GLU A 72 34.467 -16.001 -43.450 1.00 0.00 H new ATOM 1072 N ASN A 73 31.879 -19.469 -44.706 1.00 0.00 N ATOM 1073 CA ASN A 73 31.631 -19.923 -46.070 1.00 0.00 C ATOM 1074 C ASN A 73 30.155 -19.780 -46.431 1.00 0.00 C ATOM 1075 O ASN A 73 29.797 -19.703 -47.607 1.00 0.00 O ATOM 1076 CB ASN A 73 32.067 -21.381 -46.232 1.00 0.00 C ATOM 1077 CG ASN A 73 33.437 -21.506 -46.870 1.00 0.00 C ATOM 1078 OD1 ASN A 73 34.147 -20.515 -47.043 1.00 0.00 O ATOM 1079 ND2 ASN A 73 33.814 -22.729 -47.225 1.00 0.00 N ATOM 0 H ASN A 73 31.785 -20.195 -43.996 1.00 0.00 H new ATOM 0 HA ASN A 73 32.215 -19.298 -46.746 1.00 0.00 H new ATOM 0 HB2 ASN A 73 32.078 -21.865 -45.255 1.00 0.00 H new ATOM 0 HB3 ASN A 73 31.335 -21.911 -46.842 1.00 0.00 H new ATOM 0 HD21 ASN A 73 34.725 -22.876 -47.660 1.00 0.00 H new ATOM 0 HD22 ASN A 73 33.193 -23.522 -47.062 1.00 0.00 H new ATOM 1086 N LEU A 74 29.304 -19.743 -45.412 1.00 0.00 N ATOM 1087 CA LEU A 74 27.866 -19.608 -45.621 1.00 0.00 C ATOM 1088 C LEU A 74 27.488 -18.153 -45.882 1.00 0.00 C ATOM 1089 O LEU A 74 26.322 -17.835 -46.108 1.00 0.00 O ATOM 1090 CB LEU A 74 27.102 -20.135 -44.405 1.00 0.00 C ATOM 1091 CG LEU A 74 27.315 -21.611 -44.067 1.00 0.00 C ATOM 1092 CD1 LEU A 74 26.612 -21.967 -42.766 1.00 0.00 C ATOM 1093 CD2 LEU A 74 26.821 -22.495 -45.202 1.00 0.00 C ATOM 0 H LEU A 74 29.584 -19.805 -44.433 1.00 0.00 H new ATOM 0 HA LEU A 74 27.594 -20.198 -46.497 1.00 0.00 H new ATOM 0 HB2 LEU A 74 27.385 -19.540 -43.537 1.00 0.00 H new ATOM 0 HB3 LEU A 74 26.037 -19.971 -44.571 1.00 0.00 H new ATOM 0 HG LEU A 74 28.383 -21.784 -43.938 1.00 0.00 H new ATOM 0 HD11 LEU A 74 26.774 -23.021 -42.541 1.00 0.00 H new ATOM 0 HD12 LEU A 74 27.014 -21.357 -41.957 1.00 0.00 H new ATOM 0 HD13 LEU A 74 25.543 -21.778 -42.866 1.00 0.00 H new ATOM 0 HD21 LEU A 74 26.981 -23.542 -44.944 1.00 0.00 H new ATOM 0 HD22 LEU A 74 25.757 -22.319 -45.364 1.00 0.00 H new ATOM 0 HD23 LEU A 74 27.370 -22.258 -46.113 1.00 0.00 H new ATOM 1105 N GLY A 75 28.485 -17.274 -45.852 1.00 0.00 N ATOM 1106 CA GLY A 75 28.237 -15.863 -46.088 1.00 0.00 C ATOM 1107 C GLY A 75 28.608 -15.002 -44.898 1.00 0.00 C ATOM 1108 O GLY A 75 28.788 -13.791 -45.030 1.00 0.00 O ATOM 0 H GLY A 75 29.459 -17.513 -45.669 1.00 0.00 H new ATOM 0 HA2 GLY A 75 28.806 -15.538 -46.959 1.00 0.00 H new ATOM 0 HA3 GLY A 75 27.183 -15.717 -46.323 1.00 0.00 H new ATOM 1112 N VAL A 76 28.720 -15.626 -43.730 1.00 0.00 N ATOM 1113 CA VAL A 76 29.071 -14.908 -42.510 1.00 0.00 C ATOM 1114 C VAL A 76 30.574 -14.667 -42.427 1.00 0.00 C ATOM 1115 O VAL A 76 31.227 -15.077 -41.468 1.00 0.00 O ATOM 1116 CB VAL A 76 28.616 -15.678 -41.255 1.00 0.00 C ATOM 1117 CG1 VAL A 76 28.740 -14.803 -40.018 1.00 0.00 C ATOM 1118 CG2 VAL A 76 27.188 -16.175 -41.425 1.00 0.00 C ATOM 0 H VAL A 76 28.573 -16.627 -43.603 1.00 0.00 H new ATOM 0 HA VAL A 76 28.554 -13.949 -42.547 1.00 0.00 H new ATOM 0 HB VAL A 76 29.266 -16.544 -41.125 1.00 0.00 H new ATOM 0 HG11 VAL A 76 28.414 -15.363 -39.142 1.00 0.00 H new ATOM 0 HG12 VAL A 76 29.779 -14.500 -39.889 1.00 0.00 H new ATOM 0 HG13 VAL A 76 28.116 -13.917 -40.135 1.00 0.00 H new ATOM 0 HG21 VAL A 76 26.882 -16.717 -40.530 1.00 0.00 H new ATOM 0 HG22 VAL A 76 26.523 -15.325 -41.580 1.00 0.00 H new ATOM 0 HG23 VAL A 76 27.134 -16.840 -42.287 1.00 0.00 H new ATOM 1128 N SER A 77 31.117 -13.997 -43.439 1.00 0.00 N ATOM 1129 CA SER A 77 32.544 -13.703 -43.482 1.00 0.00 C ATOM 1130 C SER A 77 32.873 -12.480 -42.632 1.00 0.00 C ATOM 1131 O SER A 77 33.401 -11.486 -43.131 1.00 0.00 O ATOM 1132 CB SER A 77 32.995 -13.471 -44.926 1.00 0.00 C ATOM 1133 OG SER A 77 32.271 -12.407 -45.521 1.00 0.00 O ATOM 0 H SER A 77 30.590 -13.648 -44.240 1.00 0.00 H new ATOM 0 HA SER A 77 33.079 -14.561 -43.075 1.00 0.00 H new ATOM 0 HB2 SER A 77 34.061 -13.245 -44.946 1.00 0.00 H new ATOM 0 HB3 SER A 77 32.851 -14.382 -45.506 1.00 0.00 H new ATOM 0 HG SER A 77 32.454 -11.575 -45.036 1.00 0.00 H new ATOM 1139 N SER A 78 32.558 -12.561 -41.343 1.00 0.00 N ATOM 1140 CA SER A 78 32.816 -11.460 -40.422 1.00 0.00 C ATOM 1141 C SER A 78 33.247 -11.985 -39.056 1.00 0.00 C ATOM 1142 O SER A 78 32.609 -12.872 -38.488 1.00 0.00 O ATOM 1143 CB SER A 78 31.568 -10.587 -40.275 1.00 0.00 C ATOM 1144 OG SER A 78 31.645 -9.444 -41.109 1.00 0.00 O ATOM 0 H SER A 78 32.124 -13.378 -40.913 1.00 0.00 H new ATOM 0 HA SER A 78 33.626 -10.857 -40.833 1.00 0.00 H new ATOM 0 HB2 SER A 78 30.682 -11.168 -40.530 1.00 0.00 H new ATOM 0 HB3 SER A 78 31.458 -10.276 -39.236 1.00 0.00 H new ATOM 0 HG SER A 78 30.835 -8.903 -40.998 1.00 0.00 H new ATOM 1150 N LEU A 79 34.335 -11.430 -38.533 1.00 0.00 N ATOM 1151 CA LEU A 79 34.854 -11.841 -37.233 1.00 0.00 C ATOM 1152 C LEU A 79 33.822 -11.604 -36.135 1.00 0.00 C ATOM 1153 O LEU A 79 33.717 -12.383 -35.189 1.00 0.00 O ATOM 1154 CB LEU A 79 36.141 -11.079 -36.911 1.00 0.00 C ATOM 1155 CG LEU A 79 36.975 -11.629 -35.754 1.00 0.00 C ATOM 1156 CD1 LEU A 79 36.313 -11.314 -34.422 1.00 0.00 C ATOM 1157 CD2 LEU A 79 37.179 -13.129 -35.909 1.00 0.00 C ATOM 0 H LEU A 79 34.875 -10.694 -38.989 1.00 0.00 H new ATOM 0 HA LEU A 79 35.072 -12.908 -37.278 1.00 0.00 H new ATOM 0 HB2 LEU A 79 36.763 -11.063 -37.806 1.00 0.00 H new ATOM 0 HB3 LEU A 79 35.880 -10.045 -36.685 1.00 0.00 H new ATOM 0 HG LEU A 79 37.952 -11.146 -35.774 1.00 0.00 H new ATOM 0 HD11 LEU A 79 36.921 -11.713 -33.610 1.00 0.00 H new ATOM 0 HD12 LEU A 79 36.220 -10.234 -34.308 1.00 0.00 H new ATOM 0 HD13 LEU A 79 35.323 -11.769 -34.391 1.00 0.00 H new ATOM 0 HD21 LEU A 79 37.775 -13.503 -35.076 1.00 0.00 H new ATOM 0 HD22 LEU A 79 36.211 -13.629 -35.916 1.00 0.00 H new ATOM 0 HD23 LEU A 79 37.698 -13.331 -36.846 1.00 0.00 H new ATOM 1169 N GLY A 80 33.059 -10.523 -36.270 1.00 0.00 N ATOM 1170 CA GLY A 80 32.043 -10.204 -35.284 1.00 0.00 C ATOM 1171 C GLY A 80 30.786 -11.032 -35.458 1.00 0.00 C ATOM 1172 O GLY A 80 30.242 -11.557 -34.488 1.00 0.00 O ATOM 0 H GLY A 80 33.127 -9.863 -37.045 1.00 0.00 H new ATOM 0 HA2 GLY A 80 32.447 -10.368 -34.285 1.00 0.00 H new ATOM 0 HA3 GLY A 80 31.790 -9.146 -35.356 1.00 0.00 H new ATOM 1176 N GLU A 81 30.322 -11.147 -36.699 1.00 0.00 N ATOM 1177 CA GLU A 81 29.119 -11.915 -36.996 1.00 0.00 C ATOM 1178 C GLU A 81 29.244 -13.345 -36.478 1.00 0.00 C ATOM 1179 O GLU A 81 28.449 -13.789 -35.650 1.00 0.00 O ATOM 1180 CB GLU A 81 28.854 -11.928 -38.503 1.00 0.00 C ATOM 1181 CG GLU A 81 28.402 -10.585 -39.053 1.00 0.00 C ATOM 1182 CD GLU A 81 26.924 -10.561 -39.390 1.00 0.00 C ATOM 1183 OE1 GLU A 81 26.432 -11.550 -39.973 1.00 0.00 O ATOM 1184 OE2 GLU A 81 26.259 -9.553 -39.071 1.00 0.00 O ATOM 0 H GLU A 81 30.761 -10.718 -37.514 1.00 0.00 H new ATOM 0 HA GLU A 81 28.280 -11.436 -36.491 1.00 0.00 H new ATOM 0 HB2 GLU A 81 29.763 -12.236 -39.021 1.00 0.00 H new ATOM 0 HB3 GLU A 81 28.093 -12.676 -38.723 1.00 0.00 H new ATOM 0 HG2 GLU A 81 28.617 -9.806 -38.321 1.00 0.00 H new ATOM 0 HG3 GLU A 81 28.979 -10.350 -39.948 1.00 0.00 H new ATOM 1191 N ARG A 82 30.249 -14.060 -36.973 1.00 0.00 N ATOM 1192 CA ARG A 82 30.479 -15.440 -36.562 1.00 0.00 C ATOM 1193 C ARG A 82 30.537 -15.553 -35.041 1.00 0.00 C ATOM 1194 O ARG A 82 29.885 -16.411 -34.446 1.00 0.00 O ATOM 1195 CB ARG A 82 31.778 -15.967 -37.173 1.00 0.00 C ATOM 1196 CG ARG A 82 31.751 -16.042 -38.691 1.00 0.00 C ATOM 1197 CD ARG A 82 32.850 -16.947 -39.224 1.00 0.00 C ATOM 1198 NE ARG A 82 34.179 -16.386 -38.998 1.00 0.00 N ATOM 1199 CZ ARG A 82 34.737 -15.476 -39.790 1.00 0.00 C ATOM 1200 NH1 ARG A 82 34.085 -15.028 -40.853 1.00 0.00 N ATOM 1201 NH2 ARG A 82 35.951 -15.014 -39.518 1.00 0.00 N ATOM 0 H ARG A 82 30.917 -13.707 -37.659 1.00 0.00 H new ATOM 0 HA ARG A 82 29.645 -16.043 -36.922 1.00 0.00 H new ATOM 0 HB2 ARG A 82 32.602 -15.324 -36.864 1.00 0.00 H new ATOM 0 HB3 ARG A 82 31.981 -16.960 -36.772 1.00 0.00 H new ATOM 0 HG2 ARG A 82 30.781 -16.413 -39.021 1.00 0.00 H new ATOM 0 HG3 ARG A 82 31.868 -15.042 -39.108 1.00 0.00 H new ATOM 0 HD2 ARG A 82 32.782 -17.922 -38.742 1.00 0.00 H new ATOM 0 HD3 ARG A 82 32.701 -17.108 -40.292 1.00 0.00 H new ATOM 0 HE ARG A 82 34.708 -16.710 -38.188 1.00 0.00 H new ATOM 0 HH11 ARG A 82 33.152 -15.381 -41.065 1.00 0.00 H new ATOM 0 HH12 ARG A 82 34.516 -14.330 -41.459 1.00 0.00 H new ATOM 0 HH21 ARG A 82 36.456 -15.357 -38.701 1.00 0.00 H new ATOM 0 HH22 ARG A 82 36.379 -14.316 -40.126 1.00 0.00 H new ATOM 1215 N LYS A 83 31.323 -14.681 -34.419 1.00 0.00 N ATOM 1216 CA LYS A 83 31.467 -14.680 -32.968 1.00 0.00 C ATOM 1217 C LYS A 83 30.103 -14.634 -32.286 1.00 0.00 C ATOM 1218 O LYS A 83 29.934 -15.143 -31.177 1.00 0.00 O ATOM 1219 CB LYS A 83 32.314 -13.487 -32.519 1.00 0.00 C ATOM 1220 CG LYS A 83 33.810 -13.731 -32.619 1.00 0.00 C ATOM 1221 CD LYS A 83 34.411 -14.069 -31.266 1.00 0.00 C ATOM 1222 CE LYS A 83 35.909 -13.802 -31.239 1.00 0.00 C ATOM 1223 NZ LYS A 83 36.369 -13.360 -29.894 1.00 0.00 N ATOM 0 H LYS A 83 31.870 -13.965 -34.897 1.00 0.00 H new ATOM 0 HA LYS A 83 31.968 -15.603 -32.677 1.00 0.00 H new ATOM 0 HB2 LYS A 83 32.055 -12.619 -33.125 1.00 0.00 H new ATOM 0 HB3 LYS A 83 32.063 -13.241 -31.487 1.00 0.00 H new ATOM 0 HG2 LYS A 83 34.001 -14.546 -33.317 1.00 0.00 H new ATOM 0 HG3 LYS A 83 34.298 -12.844 -33.024 1.00 0.00 H new ATOM 0 HD2 LYS A 83 33.921 -13.479 -30.491 1.00 0.00 H new ATOM 0 HD3 LYS A 83 34.223 -15.117 -31.035 1.00 0.00 H new ATOM 0 HE2 LYS A 83 36.444 -14.707 -31.527 1.00 0.00 H new ATOM 0 HE3 LYS A 83 36.155 -13.038 -31.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 37.394 -13.188 -29.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 35.877 -12.483 -29.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 36.157 -14.100 -29.194 1.00 0.00 H new ATOM 1237 N LYS A 84 29.132 -14.022 -32.955 1.00 0.00 N ATOM 1238 CA LYS A 84 27.782 -13.911 -32.415 1.00 0.00 C ATOM 1239 C LYS A 84 26.950 -15.137 -32.777 1.00 0.00 C ATOM 1240 O LYS A 84 26.260 -15.704 -31.928 1.00 0.00 O ATOM 1241 CB LYS A 84 27.102 -12.646 -32.942 1.00 0.00 C ATOM 1242 CG LYS A 84 27.879 -11.373 -32.654 1.00 0.00 C ATOM 1243 CD LYS A 84 27.709 -10.352 -33.766 1.00 0.00 C ATOM 1244 CE LYS A 84 26.495 -9.467 -33.531 1.00 0.00 C ATOM 1245 NZ LYS A 84 26.725 -8.489 -32.432 1.00 0.00 N ATOM 0 H LYS A 84 29.255 -13.595 -33.873 1.00 0.00 H new ATOM 0 HA LYS A 84 27.855 -13.851 -31.329 1.00 0.00 H new ATOM 0 HB2 LYS A 84 26.962 -12.741 -34.019 1.00 0.00 H new ATOM 0 HB3 LYS A 84 26.110 -12.565 -32.498 1.00 0.00 H new ATOM 0 HG2 LYS A 84 27.540 -10.945 -31.711 1.00 0.00 H new ATOM 0 HG3 LYS A 84 28.936 -11.610 -32.535 1.00 0.00 H new ATOM 0 HD2 LYS A 84 28.604 -9.733 -33.833 1.00 0.00 H new ATOM 0 HD3 LYS A 84 27.605 -10.867 -34.721 1.00 0.00 H new ATOM 0 HE2 LYS A 84 26.253 -8.931 -34.449 1.00 0.00 H new ATOM 0 HE3 LYS A 84 25.634 -10.089 -33.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 26.005 -7.740 -32.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 26.661 -8.976 -31.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 27.670 -8.067 -32.535 1.00 0.00 H new ATOM 1259 N LEU A 85 27.019 -15.542 -34.040 1.00 0.00 N ATOM 1260 CA LEU A 85 26.273 -16.702 -34.514 1.00 0.00 C ATOM 1261 C LEU A 85 26.664 -17.955 -33.737 1.00 0.00 C ATOM 1262 O LEU A 85 25.804 -18.688 -33.246 1.00 0.00 O ATOM 1263 CB LEU A 85 26.520 -16.916 -36.008 1.00 0.00 C ATOM 1264 CG LEU A 85 25.273 -16.983 -36.892 1.00 0.00 C ATOM 1265 CD1 LEU A 85 25.220 -15.789 -37.831 1.00 0.00 C ATOM 1266 CD2 LEU A 85 25.247 -18.285 -37.679 1.00 0.00 C ATOM 0 H LEU A 85 27.584 -15.084 -34.755 1.00 0.00 H new ATOM 0 HA LEU A 85 25.212 -16.513 -34.351 1.00 0.00 H new ATOM 0 HB2 LEU A 85 27.155 -16.107 -36.370 1.00 0.00 H new ATOM 0 HB3 LEU A 85 27.081 -17.842 -36.134 1.00 0.00 H new ATOM 0 HG LEU A 85 24.393 -16.953 -36.249 1.00 0.00 H new ATOM 0 HD11 LEU A 85 24.326 -15.854 -38.452 1.00 0.00 H new ATOM 0 HD12 LEU A 85 25.191 -14.869 -37.248 1.00 0.00 H new ATOM 0 HD13 LEU A 85 26.105 -15.787 -38.468 1.00 0.00 H new ATOM 0 HD21 LEU A 85 24.353 -18.316 -38.302 1.00 0.00 H new ATOM 0 HD22 LEU A 85 26.133 -18.346 -38.311 1.00 0.00 H new ATOM 0 HD23 LEU A 85 25.236 -19.128 -36.988 1.00 0.00 H new ATOM 1278 N LEU A 86 27.966 -18.195 -33.628 1.00 0.00 N ATOM 1279 CA LEU A 86 28.471 -19.359 -32.908 1.00 0.00 C ATOM 1280 C LEU A 86 27.861 -19.444 -31.513 1.00 0.00 C ATOM 1281 O LEU A 86 27.480 -20.521 -31.056 1.00 0.00 O ATOM 1282 CB LEU A 86 29.997 -19.298 -32.808 1.00 0.00 C ATOM 1283 CG LEU A 86 30.771 -19.981 -33.935 1.00 0.00 C ATOM 1284 CD1 LEU A 86 32.132 -19.327 -34.120 1.00 0.00 C ATOM 1285 CD2 LEU A 86 30.926 -21.468 -33.651 1.00 0.00 C ATOM 0 H LEU A 86 28.691 -17.600 -34.029 1.00 0.00 H new ATOM 0 HA LEU A 86 28.185 -20.252 -33.464 1.00 0.00 H new ATOM 0 HB2 LEU A 86 30.297 -18.251 -32.771 1.00 0.00 H new ATOM 0 HB3 LEU A 86 30.297 -19.749 -31.862 1.00 0.00 H new ATOM 0 HG LEU A 86 30.206 -19.865 -34.860 1.00 0.00 H new ATOM 0 HD11 LEU A 86 32.669 -19.826 -34.926 1.00 0.00 H new ATOM 0 HD12 LEU A 86 31.999 -18.274 -34.370 1.00 0.00 H new ATOM 0 HD13 LEU A 86 32.705 -19.411 -33.196 1.00 0.00 H new ATOM 0 HD21 LEU A 86 31.479 -21.938 -34.464 1.00 0.00 H new ATOM 0 HD22 LEU A 86 31.469 -21.605 -32.716 1.00 0.00 H new ATOM 0 HD23 LEU A 86 29.941 -21.927 -33.570 1.00 0.00 H new ATOM 1297 N SER A 87 27.770 -18.300 -30.842 1.00 0.00 N ATOM 1298 CA SER A 87 27.207 -18.245 -29.498 1.00 0.00 C ATOM 1299 C SER A 87 25.683 -18.297 -29.544 1.00 0.00 C ATOM 1300 O SER A 87 25.036 -18.728 -28.589 1.00 0.00 O ATOM 1301 CB SER A 87 27.664 -16.972 -28.782 1.00 0.00 C ATOM 1302 OG SER A 87 27.756 -17.178 -27.383 1.00 0.00 O ATOM 0 H SER A 87 28.079 -17.399 -31.207 1.00 0.00 H new ATOM 0 HA SER A 87 27.566 -19.113 -28.945 1.00 0.00 H new ATOM 0 HB2 SER A 87 28.633 -16.660 -29.171 1.00 0.00 H new ATOM 0 HB3 SER A 87 26.963 -16.163 -28.988 1.00 0.00 H new ATOM 0 HG SER A 87 28.051 -16.350 -26.949 1.00 0.00 H new ATOM 1308 N TYR A 88 25.117 -17.855 -30.661 1.00 0.00 N ATOM 1309 CA TYR A 88 23.669 -17.849 -30.832 1.00 0.00 C ATOM 1310 C TYR A 88 23.120 -19.271 -30.886 1.00 0.00 C ATOM 1311 O TYR A 88 22.300 -19.664 -30.055 1.00 0.00 O ATOM 1312 CB TYR A 88 23.289 -17.095 -32.108 1.00 0.00 C ATOM 1313 CG TYR A 88 21.798 -16.916 -32.284 1.00 0.00 C ATOM 1314 CD1 TYR A 88 20.990 -16.557 -31.212 1.00 0.00 C ATOM 1315 CD2 TYR A 88 21.197 -17.105 -33.523 1.00 0.00 C ATOM 1316 CE1 TYR A 88 19.627 -16.393 -31.369 1.00 0.00 C ATOM 1317 CE2 TYR A 88 19.835 -16.942 -33.689 1.00 0.00 C ATOM 1318 CZ TYR A 88 19.054 -16.586 -32.609 1.00 0.00 C ATOM 1319 OH TYR A 88 17.698 -16.423 -32.769 1.00 0.00 O ATOM 0 H TYR A 88 25.638 -17.496 -31.461 1.00 0.00 H new ATOM 0 HA TYR A 88 23.229 -17.342 -29.973 1.00 0.00 H new ATOM 0 HB2 TYR A 88 23.765 -16.115 -32.096 1.00 0.00 H new ATOM 0 HB3 TYR A 88 23.686 -17.632 -32.969 1.00 0.00 H new ATOM 0 HD1 TYR A 88 21.435 -16.404 -30.240 1.00 0.00 H new ATOM 0 HD2 TYR A 88 21.805 -17.384 -34.371 1.00 0.00 H new ATOM 0 HE1 TYR A 88 19.013 -16.115 -30.525 1.00 0.00 H new ATOM 0 HE2 TYR A 88 19.384 -17.092 -34.659 1.00 0.00 H new ATOM 0 HH TYR A 88 17.429 -16.762 -33.648 1.00 0.00 H new ATOM 1329 N ILE A 89 23.578 -20.038 -31.870 1.00 0.00 N ATOM 1330 CA ILE A 89 23.135 -21.417 -32.032 1.00 0.00 C ATOM 1331 C ILE A 89 23.313 -22.207 -30.740 1.00 0.00 C ATOM 1332 O ILE A 89 22.538 -23.117 -30.446 1.00 0.00 O ATOM 1333 CB ILE A 89 23.904 -22.126 -33.163 1.00 0.00 C ATOM 1334 CG1 ILE A 89 23.635 -21.436 -34.502 1.00 0.00 C ATOM 1335 CG2 ILE A 89 23.512 -23.595 -33.230 1.00 0.00 C ATOM 1336 CD1 ILE A 89 24.797 -21.517 -35.467 1.00 0.00 C ATOM 0 H ILE A 89 24.255 -19.728 -32.567 1.00 0.00 H new ATOM 0 HA ILE A 89 22.077 -21.380 -32.290 1.00 0.00 H new ATOM 0 HB ILE A 89 24.971 -22.064 -32.951 1.00 0.00 H new ATOM 0 HG12 ILE A 89 22.757 -21.887 -34.964 1.00 0.00 H new ATOM 0 HG13 ILE A 89 23.396 -20.388 -34.320 1.00 0.00 H new ATOM 0 HG21 ILE A 89 24.064 -24.082 -34.034 1.00 0.00 H new ATOM 0 HG22 ILE A 89 23.749 -24.078 -32.282 1.00 0.00 H new ATOM 0 HG23 ILE A 89 22.442 -23.678 -33.422 1.00 0.00 H new ATOM 0 HD11 ILE A 89 24.536 -21.007 -36.394 1.00 0.00 H new ATOM 0 HD12 ILE A 89 25.671 -21.040 -35.024 1.00 0.00 H new ATOM 0 HD13 ILE A 89 25.022 -22.562 -35.679 1.00 0.00 H new ATOM 1348 N GLN A 90 24.337 -21.851 -29.971 1.00 0.00 N ATOM 1349 CA GLN A 90 24.615 -22.527 -28.709 1.00 0.00 C ATOM 1350 C GLN A 90 23.453 -22.361 -27.735 1.00 0.00 C ATOM 1351 O GLN A 90 23.204 -23.228 -26.898 1.00 0.00 O ATOM 1352 CB GLN A 90 25.900 -21.979 -28.086 1.00 0.00 C ATOM 1353 CG GLN A 90 27.158 -22.366 -28.847 1.00 0.00 C ATOM 1354 CD GLN A 90 27.751 -23.677 -28.368 1.00 0.00 C ATOM 1355 OE1 GLN A 90 27.989 -23.864 -27.174 1.00 0.00 O ATOM 1356 NE2 GLN A 90 27.991 -24.593 -29.298 1.00 0.00 N ATOM 0 H GLN A 90 24.987 -21.099 -30.199 1.00 0.00 H new ATOM 0 HA GLN A 90 24.743 -23.590 -28.915 1.00 0.00 H new ATOM 0 HB2 GLN A 90 25.835 -20.892 -28.037 1.00 0.00 H new ATOM 0 HB3 GLN A 90 25.980 -22.341 -27.061 1.00 0.00 H new ATOM 0 HG2 GLN A 90 26.926 -22.443 -29.909 1.00 0.00 H new ATOM 0 HG3 GLN A 90 27.900 -21.575 -28.740 1.00 0.00 H new ATOM 0 HE21 GLN A 90 27.778 -24.395 -30.276 1.00 0.00 H new ATOM 0 HE22 GLN A 90 28.388 -25.495 -29.035 1.00 0.00 H new ATOM 1365 N ARG A 91 22.746 -21.242 -27.851 1.00 0.00 N ATOM 1366 CA ARG A 91 21.611 -20.962 -26.979 1.00 0.00 C ATOM 1367 C ARG A 91 20.399 -21.799 -27.379 1.00 0.00 C ATOM 1368 O ARG A 91 19.383 -21.813 -26.682 1.00 0.00 O ATOM 1369 CB ARG A 91 21.256 -19.475 -27.031 1.00 0.00 C ATOM 1370 CG ARG A 91 22.319 -18.574 -26.424 1.00 0.00 C ATOM 1371 CD ARG A 91 21.951 -17.105 -26.565 1.00 0.00 C ATOM 1372 NE ARG A 91 22.381 -16.320 -25.411 1.00 0.00 N ATOM 1373 CZ ARG A 91 22.041 -15.050 -25.219 1.00 0.00 C ATOM 1374 NH1 ARG A 91 21.271 -14.425 -26.100 1.00 0.00 N ATOM 1375 NH2 ARG A 91 22.472 -14.402 -24.144 1.00 0.00 N ATOM 0 H ARG A 91 22.939 -20.515 -28.540 1.00 0.00 H new ATOM 0 HA ARG A 91 21.894 -21.226 -25.960 1.00 0.00 H new ATOM 0 HB2 ARG A 91 21.095 -19.185 -28.069 1.00 0.00 H new ATOM 0 HB3 ARG A 91 20.314 -19.316 -26.506 1.00 0.00 H new ATOM 0 HG2 ARG A 91 22.446 -18.819 -25.369 1.00 0.00 H new ATOM 0 HG3 ARG A 91 23.276 -18.759 -26.912 1.00 0.00 H new ATOM 0 HD2 ARG A 91 22.408 -16.702 -27.468 1.00 0.00 H new ATOM 0 HD3 ARG A 91 20.872 -17.012 -26.685 1.00 0.00 H new ATOM 0 HE ARG A 91 22.974 -16.771 -24.715 1.00 0.00 H new ATOM 0 HH11 ARG A 91 20.938 -14.919 -26.928 1.00 0.00 H new ATOM 0 HH12 ARG A 91 21.012 -13.450 -25.950 1.00 0.00 H new ATOM 0 HH21 ARG A 91 23.065 -14.879 -23.465 1.00 0.00 H new ATOM 0 HH22 ARG A 91 22.211 -13.427 -23.997 1.00 0.00 H new ATOM 1389 N LEU A 92 20.513 -22.496 -28.504 1.00 0.00 N ATOM 1390 CA LEU A 92 19.427 -23.336 -28.997 1.00 0.00 C ATOM 1391 C LEU A 92 19.547 -24.756 -28.454 1.00 0.00 C ATOM 1392 O LEU A 92 18.701 -25.211 -27.684 1.00 0.00 O ATOM 1393 CB LEU A 92 19.429 -23.361 -30.527 1.00 0.00 C ATOM 1394 CG LEU A 92 18.315 -24.175 -31.186 1.00 0.00 C ATOM 1395 CD1 LEU A 92 18.004 -23.629 -32.571 1.00 0.00 C ATOM 1396 CD2 LEU A 92 18.704 -25.644 -31.265 1.00 0.00 C ATOM 0 H LEU A 92 21.346 -22.496 -29.092 1.00 0.00 H new ATOM 0 HA LEU A 92 18.486 -22.912 -28.648 1.00 0.00 H new ATOM 0 HB2 LEU A 92 19.363 -22.334 -30.887 1.00 0.00 H new ATOM 0 HB3 LEU A 92 20.388 -23.756 -30.863 1.00 0.00 H new ATOM 0 HG LEU A 92 17.417 -24.090 -30.574 1.00 0.00 H new ATOM 0 HD11 LEU A 92 17.209 -24.220 -33.025 1.00 0.00 H new ATOM 0 HD12 LEU A 92 17.682 -22.591 -32.489 1.00 0.00 H new ATOM 0 HD13 LEU A 92 18.898 -23.684 -33.193 1.00 0.00 H new ATOM 0 HD21 LEU A 92 17.900 -26.209 -31.737 1.00 0.00 H new ATOM 0 HD22 LEU A 92 19.615 -25.748 -31.855 1.00 0.00 H new ATOM 0 HD23 LEU A 92 18.877 -26.029 -30.260 1.00 0.00 H new ATOM 1408 N VAL A 93 20.606 -25.451 -28.858 1.00 0.00 N ATOM 1409 CA VAL A 93 20.839 -26.818 -28.409 1.00 0.00 C ATOM 1410 C VAL A 93 20.835 -26.906 -26.887 1.00 0.00 C ATOM 1411 O VAL A 93 20.350 -27.881 -26.314 1.00 0.00 O ATOM 1412 CB VAL A 93 22.179 -27.362 -28.939 1.00 0.00 C ATOM 1413 CG1 VAL A 93 22.037 -27.817 -30.384 1.00 0.00 C ATOM 1414 CG2 VAL A 93 23.270 -26.310 -28.809 1.00 0.00 C ATOM 0 H VAL A 93 21.316 -25.090 -29.495 1.00 0.00 H new ATOM 0 HA VAL A 93 20.025 -27.424 -28.807 1.00 0.00 H new ATOM 0 HB VAL A 93 22.464 -28.225 -28.337 1.00 0.00 H new ATOM 0 HG11 VAL A 93 22.994 -28.198 -30.741 1.00 0.00 H new ATOM 0 HG12 VAL A 93 21.287 -28.605 -30.445 1.00 0.00 H new ATOM 0 HG13 VAL A 93 21.729 -26.974 -31.002 1.00 0.00 H new ATOM 0 HG21 VAL A 93 24.210 -26.712 -29.188 1.00 0.00 H new ATOM 0 HG22 VAL A 93 22.994 -25.427 -29.385 1.00 0.00 H new ATOM 0 HG23 VAL A 93 23.389 -26.037 -27.761 1.00 0.00 H new ATOM 1424 N GLN A 94 21.377 -25.880 -26.239 1.00 0.00 N ATOM 1425 CA GLN A 94 21.435 -25.841 -24.783 1.00 0.00 C ATOM 1426 C GLN A 94 20.035 -25.883 -24.181 1.00 0.00 C ATOM 1427 O GLN A 94 19.862 -26.220 -23.009 1.00 0.00 O ATOM 1428 CB GLN A 94 22.168 -24.583 -24.314 1.00 0.00 C ATOM 1429 CG GLN A 94 21.308 -23.330 -24.349 1.00 0.00 C ATOM 1430 CD GLN A 94 21.983 -22.141 -23.693 1.00 0.00 C ATOM 1431 OE1 GLN A 94 21.372 -21.427 -22.898 1.00 0.00 O ATOM 1432 NE2 GLN A 94 23.250 -21.923 -24.024 1.00 0.00 N ATOM 0 H GLN A 94 21.782 -25.065 -26.699 1.00 0.00 H new ATOM 0 HA GLN A 94 21.983 -26.720 -24.443 1.00 0.00 H new ATOM 0 HB2 GLN A 94 22.527 -24.739 -23.297 1.00 0.00 H new ATOM 0 HB3 GLN A 94 23.046 -24.429 -24.941 1.00 0.00 H new ATOM 0 HG2 GLN A 94 21.073 -23.084 -25.385 1.00 0.00 H new ATOM 0 HG3 GLN A 94 20.362 -23.529 -23.846 1.00 0.00 H new ATOM 0 HE21 GLN A 94 23.717 -22.541 -24.688 1.00 0.00 H new ATOM 0 HE22 GLN A 94 23.756 -21.138 -23.615 1.00 0.00 H new ATOM 1441 N ILE A 95 19.038 -25.537 -24.989 1.00 0.00 N ATOM 1442 CA ILE A 95 17.653 -25.536 -24.536 1.00 0.00 C ATOM 1443 C ILE A 95 16.881 -26.712 -25.123 1.00 0.00 C ATOM 1444 O ILE A 95 16.328 -27.534 -24.391 1.00 0.00 O ATOM 1445 CB ILE A 95 16.938 -24.226 -24.916 1.00 0.00 C ATOM 1446 CG1 ILE A 95 17.752 -23.019 -24.444 1.00 0.00 C ATOM 1447 CG2 ILE A 95 15.539 -24.193 -24.318 1.00 0.00 C ATOM 1448 CD1 ILE A 95 17.148 -21.690 -24.841 1.00 0.00 C ATOM 0 H ILE A 95 19.164 -25.254 -25.961 1.00 0.00 H new ATOM 0 HA ILE A 95 17.676 -25.626 -23.450 1.00 0.00 H new ATOM 0 HB ILE A 95 16.850 -24.180 -26.001 1.00 0.00 H new ATOM 0 HG12 ILE A 95 17.846 -23.056 -23.359 1.00 0.00 H new ATOM 0 HG13 ILE A 95 18.760 -23.088 -24.854 1.00 0.00 H new ATOM 0 HG21 ILE A 95 15.047 -23.261 -24.595 1.00 0.00 H new ATOM 0 HG22 ILE A 95 14.961 -25.036 -24.698 1.00 0.00 H new ATOM 0 HG23 ILE A 95 15.606 -24.259 -23.232 1.00 0.00 H new ATOM 0 HD11 ILE A 95 17.778 -20.880 -24.473 1.00 0.00 H new ATOM 0 HD12 ILE A 95 17.079 -21.632 -25.927 1.00 0.00 H new ATOM 0 HD13 ILE A 95 16.151 -21.600 -24.409 1.00 0.00 H new ATOM 1460 N HIS A 96 16.849 -26.788 -26.450 1.00 0.00 N ATOM 1461 CA HIS A 96 16.146 -27.867 -27.137 1.00 0.00 C ATOM 1462 C HIS A 96 16.769 -29.219 -26.805 1.00 0.00 C ATOM 1463 O HIS A 96 17.990 -29.344 -26.702 1.00 0.00 O ATOM 1464 CB HIS A 96 16.171 -27.638 -28.649 1.00 0.00 C ATOM 1465 CG HIS A 96 15.002 -26.850 -29.155 1.00 0.00 C ATOM 1466 ND1 HIS A 96 15.118 -25.860 -30.107 1.00 0.00 N ATOM 1467 CD2 HIS A 96 13.688 -26.913 -28.836 1.00 0.00 C ATOM 1468 CE1 HIS A 96 13.925 -25.346 -30.352 1.00 0.00 C ATOM 1469 NE2 HIS A 96 13.040 -25.968 -29.593 1.00 0.00 N ATOM 0 H HIS A 96 17.301 -26.116 -27.071 1.00 0.00 H new ATOM 0 HA HIS A 96 15.111 -27.870 -26.794 1.00 0.00 H new ATOM 0 HB2 HIS A 96 17.091 -27.118 -28.914 1.00 0.00 H new ATOM 0 HB3 HIS A 96 16.194 -28.604 -29.154 1.00 0.00 H new ATOM 0 HD1 HIS A 96 15.988 -25.569 -30.553 1.00 0.00 H new ATOM 0 HD2 HIS A 96 13.234 -27.582 -28.120 1.00 0.00 H new ATOM 0 HE1 HIS A 96 13.710 -24.553 -31.053 1.00 0.00 H new ATOM 1477 N VAL A 97 15.923 -30.230 -26.637 1.00 0.00 N ATOM 1478 CA VAL A 97 16.390 -31.573 -26.316 1.00 0.00 C ATOM 1479 C VAL A 97 17.189 -31.582 -25.018 1.00 0.00 C ATOM 1480 O VAL A 97 18.104 -32.388 -24.845 1.00 0.00 O ATOM 1481 CB VAL A 97 17.263 -32.149 -27.447 1.00 0.00 C ATOM 1482 CG1 VAL A 97 17.302 -33.667 -27.371 1.00 0.00 C ATOM 1483 CG2 VAL A 97 16.750 -31.687 -28.803 1.00 0.00 C ATOM 0 H VAL A 97 14.910 -30.144 -26.718 1.00 0.00 H new ATOM 0 HA VAL A 97 15.503 -32.196 -26.198 1.00 0.00 H new ATOM 0 HB VAL A 97 18.280 -31.777 -27.323 1.00 0.00 H new ATOM 0 HG11 VAL A 97 17.923 -34.056 -28.178 1.00 0.00 H new ATOM 0 HG12 VAL A 97 17.720 -33.973 -26.412 1.00 0.00 H new ATOM 0 HG13 VAL A 97 16.291 -34.062 -27.469 1.00 0.00 H new ATOM 0 HG21 VAL A 97 17.378 -32.103 -29.591 1.00 0.00 H new ATOM 0 HG22 VAL A 97 15.724 -32.028 -28.939 1.00 0.00 H new ATOM 0 HG23 VAL A 97 16.780 -30.599 -28.852 1.00 0.00 H new ATOM 1493 N ASP A 98 16.838 -30.681 -24.107 1.00 0.00 N ATOM 1494 CA ASP A 98 17.521 -30.585 -22.822 1.00 0.00 C ATOM 1495 C ASP A 98 16.672 -31.191 -21.709 1.00 0.00 C ATOM 1496 O ASP A 98 15.448 -31.056 -21.702 1.00 0.00 O ATOM 1497 CB ASP A 98 17.842 -29.125 -22.499 1.00 0.00 C ATOM 1498 CG ASP A 98 18.595 -28.974 -21.192 1.00 0.00 C ATOM 1499 OD1 ASP A 98 19.517 -29.779 -20.942 1.00 0.00 O ATOM 1500 OD2 ASP A 98 18.263 -28.051 -20.418 1.00 0.00 O ATOM 0 H ASP A 98 16.084 -30.006 -24.235 1.00 0.00 H new ATOM 0 HA ASP A 98 18.453 -31.147 -22.890 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.435 -28.699 -23.308 1.00 0.00 H new ATOM 0 HB3 ASP A 98 16.915 -28.555 -22.449 1.00 0.00 H new ATOM 1505 N THR A 99 17.330 -31.862 -20.768 1.00 0.00 N ATOM 1506 CA THR A 99 16.637 -32.490 -19.651 1.00 0.00 C ATOM 1507 C THR A 99 15.696 -31.507 -18.965 1.00 0.00 C ATOM 1508 O THR A 99 14.645 -31.893 -18.454 1.00 0.00 O ATOM 1509 CB THR A 99 17.631 -33.043 -18.612 1.00 0.00 C ATOM 1510 OG1 THR A 99 16.932 -33.429 -17.423 1.00 0.00 O ATOM 1511 CG2 THR A 99 18.689 -32.005 -18.271 1.00 0.00 C ATOM 0 H THR A 99 18.343 -31.984 -20.758 1.00 0.00 H new ATOM 0 HA THR A 99 16.057 -33.316 -20.063 1.00 0.00 H new ATOM 0 HB THR A 99 18.125 -33.915 -19.041 1.00 0.00 H new ATOM 0 HG1 THR A 99 17.570 -33.781 -16.768 1.00 0.00 H new ATOM 0 HG21 THR A 99 19.380 -32.418 -17.536 1.00 0.00 H new ATOM 0 HG22 THR A 99 19.238 -31.735 -19.173 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.209 -31.117 -17.859 1.00 0.00 H new ATOM 1519 N MET A 100 16.080 -30.235 -18.957 1.00 0.00 N ATOM 1520 CA MET A 100 15.268 -29.196 -18.334 1.00 0.00 C ATOM 1521 C MET A 100 14.402 -28.487 -19.371 1.00 0.00 C ATOM 1522 O MET A 100 14.913 -27.906 -20.328 1.00 0.00 O ATOM 1523 CB MET A 100 16.161 -28.180 -17.619 1.00 0.00 C ATOM 1524 CG MET A 100 16.971 -28.779 -16.480 1.00 0.00 C ATOM 1525 SD MET A 100 15.948 -29.239 -15.068 1.00 0.00 S ATOM 1526 CE MET A 100 15.760 -30.998 -15.344 1.00 0.00 C ATOM 0 H MET A 100 16.948 -29.899 -19.375 1.00 0.00 H new ATOM 0 HA MET A 100 14.614 -29.672 -17.603 1.00 0.00 H new ATOM 0 HB2 MET A 100 16.842 -27.734 -18.343 1.00 0.00 H new ATOM 0 HB3 MET A 100 15.540 -27.374 -17.228 1.00 0.00 H new ATOM 0 HG2 MET A 100 17.502 -29.660 -16.841 1.00 0.00 H new ATOM 0 HG3 MET A 100 17.725 -28.061 -16.159 1.00 0.00 H new ATOM 0 HE1 MET A 100 15.845 -31.526 -14.394 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.782 -31.195 -15.783 1.00 0.00 H new ATOM 0 HE3 MET A 100 16.539 -31.345 -16.023 1.00 0.00 H new