USER MOD reduce.3.24.130724 H: found=0, std=0, add=1008, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1006 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: B 848 ASN : amide:sc= -2.03 K(o=-2.7,f=-7.7!) USER MOD Set 1.2: B 851 ASN : amide:sc= -0.0887 K(o=-2.7,f=-6.8) USER MOD Set 1.3: B 882 ASN : amide:sc= -0.614 K(o=-2.7,f=-6.8!) USER MOD Set 2.1: A 259 SER OG : rot 97:sc= 1.11 USER MOD Set 2.2: B 893 SER OG : rot 180:sc= -0.205 USER MOD Set 3.1: A 248 THR OG1 : rot 180:sc= 0.948 USER MOD Set 3.2: A 251 GLN :FLIP amide:sc= 0.92 F(o=1.2,f=1.9) USER MOD Set 4.1: A 240 THR OG1 : rot 6:sc= 1.22 USER MOD Set 4.2: A 250 SER OG : rot 70:sc= 1.43 USER MOD Single : A 233 SER OG : rot 180:sc= 0 USER MOD Single : A 236 THR OG1 : rot 78:sc= 1.14 USER MOD Single : A 238 CYS SG : rot 74:sc= 0.106 USER MOD Single : A 241 THR OG1 : rot -96:sc= 1.21 USER MOD Single : A 243 LYS NZ :NH3+ -148:sc= 0.43 (180deg=0.352) USER MOD Single : A 244 SER OG : rot -127:sc= -2.5! USER MOD Single : A 246 ASN : amide:sc= -0.408 K(o=-0.41,f=-1.9) USER MOD Single : A 247 LYS NZ :NH3+ 147:sc= 1.23 (180deg=0.868) USER MOD Single : A 252 THR OG1 : rot 73:sc= 0.997 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 THR OG1 : rot -93:sc= 0.544 USER MOD Single : A 262 GLN : amide:sc= -0.0188 K(o=-0.019,f=-0.59) USER MOD Single : A 267 SER OG : rot 180:sc= 0 USER MOD Single : A 274 CYS SG : rot -60:sc= -1.98 USER MOD Single : A 280 GLN : amide:sc= -1.62! X(o=-1.6!,f=-1.3) USER MOD Single : A 281 LYS NZ :NH3+ -169:sc= 2.1 (180deg=1.91) USER MOD Single : A 290 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 833 TYR OH : rot 15:sc= 0.985 USER MOD Single : B 834 ASN : amide:sc= -3.8! C(o=-3.8!,f=-5.3!) USER MOD Single : B 838 GLN : amide:sc= -2.75 K(o=-2.7,f=-4.9!) USER MOD Single : B 843 LYS NZ :NH3+ -179:sc= 1.26 (180deg=1.2) USER MOD Single : B 844 MET CE :methyl -118:sc= -0.376 (180deg=-3.21!) USER MOD Single : B 850 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 852 CYS SG : rot 58:sc= -2.42! USER MOD Single : B 854 SER OG : rot 70:sc= 0.463 USER MOD Single : B 856 MET CE :methyl 141:sc= -0.179 (180deg=-0.71) USER MOD Single : B 857 HIS : no HE2:sc= -0.128 X(o=-0.13,f=-0.11) USER MOD Single : B 858 HIS :FLIP no HE2:sc= 0.219 F(o=-0.79,f=0.22) USER MOD Single : B 860 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 861 ASN : amide:sc= -7.18! C(o=-7.2!,f=-7.4!) USER MOD Single : B 869 SER OG : rot 180:sc= 0 USER MOD Single : B 870 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 874 THR OG1 : rot 85:sc= 1.22 USER MOD Single : B 875 SER OG : rot 73:sc= 1.2 USER MOD Single : B 879 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 884 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.03) USER MOD Single : B 885 GLN : amide:sc= 0.334 X(o=0.33,f=-0.025) USER MOD Single : B 887 TYR OH : rot 180:sc= 0 USER MOD Single : B 891 HIS : no HE2:sc= 0.575 K(o=0.58,f=-2!) USER MOD Single : B 892 THR OG1 : rot 180:sc= 0.0904 USER MOD ----------------------------------------------------------------- ATOM 335 N ASP A 230 -12.766 2.241 -5.354 1.00 0.00 N ATOM 336 CA ASP A 230 -11.418 2.758 -5.600 1.00 0.00 C ATOM 337 C ASP A 230 -10.466 2.107 -4.620 1.00 0.00 C ATOM 338 O ASP A 230 -9.421 1.598 -5.013 1.00 0.00 O ATOM 339 CB ASP A 230 -11.349 4.293 -5.469 1.00 0.00 C ATOM 340 CG ASP A 230 -10.006 4.878 -5.932 1.00 0.00 C ATOM 341 OD1 ASP A 230 -9.063 5.009 -5.123 1.00 0.00 O ATOM 342 OD2 ASP A 230 -9.884 5.246 -7.130 1.00 0.00 O ATOM 0 HA ASP A 230 -11.137 2.516 -6.625 1.00 0.00 H new ATOM 0 HB2 ASP A 230 -12.153 4.738 -6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 230 -11.520 4.571 -4.429 1.00 0.00 H new ATOM 347 N LEU A 231 -10.897 2.042 -3.355 1.00 0.00 N ATOM 348 CA LEU A 231 -10.134 1.425 -2.271 1.00 0.00 C ATOM 349 C LEU A 231 -9.691 0.034 -2.604 1.00 0.00 C ATOM 350 O LEU A 231 -8.495 -0.256 -2.586 1.00 0.00 O ATOM 351 CB LEU A 231 -10.935 1.383 -0.964 1.00 0.00 C ATOM 352 CG LEU A 231 -11.052 2.697 -0.188 1.00 0.00 C ATOM 353 CD1 LEU A 231 -11.823 2.482 1.084 1.00 0.00 C ATOM 354 CD2 LEU A 231 -9.685 3.291 0.119 1.00 0.00 C ATOM 0 H LEU A 231 -11.795 2.421 -3.055 1.00 0.00 H new ATOM 0 HA LEU A 231 -9.253 2.054 -2.140 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -11.941 1.032 -1.193 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -10.479 0.640 -0.309 1.00 0.00 H new ATOM 0 HG LEU A 231 -11.589 3.407 -0.817 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -11.899 3.424 1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -12.823 2.118 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -11.307 1.748 1.702 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -9.809 4.223 0.671 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -9.109 2.587 0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -9.156 3.489 -0.814 1.00 0.00 H new ATOM 366 N VAL A 232 -10.635 -0.817 -2.934 1.00 0.00 N ATOM 367 CA VAL A 232 -10.330 -2.192 -3.221 1.00 0.00 C ATOM 368 C VAL A 232 -9.390 -2.316 -4.413 1.00 0.00 C ATOM 369 O VAL A 232 -8.440 -3.081 -4.358 1.00 0.00 O ATOM 370 CB VAL A 232 -11.605 -3.075 -3.385 1.00 0.00 C ATOM 371 CG1 VAL A 232 -12.476 -2.641 -4.548 1.00 0.00 C ATOM 372 CG2 VAL A 232 -11.251 -4.546 -3.498 1.00 0.00 C ATOM 0 H VAL A 232 -11.623 -0.576 -3.009 1.00 0.00 H new ATOM 0 HA VAL A 232 -9.807 -2.584 -2.349 1.00 0.00 H new ATOM 0 HB VAL A 232 -12.192 -2.931 -2.478 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -13.348 -3.292 -4.612 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -12.802 -1.612 -4.394 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -11.905 -2.706 -5.474 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -12.163 -5.132 -3.611 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -10.610 -4.700 -4.366 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -10.725 -4.864 -2.598 1.00 0.00 H new ATOM 382 N SER A 233 -9.596 -1.493 -5.430 1.00 0.00 N ATOM 383 CA SER A 233 -8.783 -1.536 -6.620 1.00 0.00 C ATOM 384 C SER A 233 -7.339 -1.149 -6.266 1.00 0.00 C ATOM 385 O SER A 233 -6.386 -1.829 -6.678 1.00 0.00 O ATOM 386 CB SER A 233 -9.363 -0.601 -7.683 1.00 0.00 C ATOM 387 OG SER A 233 -8.770 -0.813 -8.949 1.00 0.00 O ATOM 0 H SER A 233 -10.328 -0.783 -5.447 1.00 0.00 H new ATOM 0 HA SER A 233 -8.780 -2.547 -7.029 1.00 0.00 H new ATOM 0 HB2 SER A 233 -10.439 -0.756 -7.755 1.00 0.00 H new ATOM 0 HB3 SER A 233 -9.210 0.434 -7.379 1.00 0.00 H new ATOM 0 HG SER A 233 -9.166 -0.200 -9.603 1.00 0.00 H new ATOM 393 N ARG A 234 -7.196 -0.096 -5.440 1.00 0.00 N ATOM 394 CA ARG A 234 -5.888 0.358 -4.972 1.00 0.00 C ATOM 395 C ARG A 234 -5.194 -0.755 -4.244 1.00 0.00 C ATOM 396 O ARG A 234 -4.071 -1.113 -4.587 1.00 0.00 O ATOM 397 CB ARG A 234 -6.000 1.536 -4.005 1.00 0.00 C ATOM 398 CG ARG A 234 -6.660 2.767 -4.549 1.00 0.00 C ATOM 399 CD ARG A 234 -5.938 3.308 -5.748 1.00 0.00 C ATOM 400 NE ARG A 234 -6.574 4.531 -6.208 1.00 0.00 N ATOM 401 CZ ARG A 234 -6.049 5.409 -7.054 1.00 0.00 C ATOM 402 NH1 ARG A 234 -4.908 5.142 -7.704 1.00 0.00 N ATOM 403 NH2 ARG A 234 -6.689 6.537 -7.283 1.00 0.00 N ATOM 0 H ARG A 234 -7.979 0.454 -5.086 1.00 0.00 H new ATOM 0 HA ARG A 234 -5.329 0.670 -5.854 1.00 0.00 H new ATOM 0 HB2 ARG A 234 -6.554 1.208 -3.126 1.00 0.00 H new ATOM 0 HB3 ARG A 234 -4.998 1.802 -3.669 1.00 0.00 H new ATOM 0 HG2 ARG A 234 -7.690 2.537 -4.820 1.00 0.00 H new ATOM 0 HG3 ARG A 234 -6.698 3.531 -3.773 1.00 0.00 H new ATOM 0 HD2 ARG A 234 -4.896 3.504 -5.496 1.00 0.00 H new ATOM 0 HD3 ARG A 234 -5.939 2.567 -6.547 1.00 0.00 H new ATOM 0 HE ARG A 234 -7.507 4.733 -5.849 1.00 0.00 H new ATOM 0 HH11 ARG A 234 -4.430 4.254 -7.552 1.00 0.00 H new ATOM 0 HH12 ARG A 234 -4.517 5.827 -8.351 1.00 0.00 H new ATOM 0 HH21 ARG A 234 -7.574 6.725 -6.813 1.00 0.00 H new ATOM 0 HH22 ARG A 234 -6.299 7.222 -7.930 1.00 0.00 H new ATOM 417 N VAL A 235 -5.898 -1.336 -3.261 1.00 0.00 N ATOM 418 CA VAL A 235 -5.328 -2.387 -2.446 1.00 0.00 C ATOM 419 C VAL A 235 -4.923 -3.566 -3.327 1.00 0.00 C ATOM 420 O VAL A 235 -3.832 -4.081 -3.182 1.00 0.00 O ATOM 421 CB VAL A 235 -6.263 -2.876 -1.279 1.00 0.00 C ATOM 422 CG1 VAL A 235 -5.516 -3.839 -0.374 1.00 0.00 C ATOM 423 CG2 VAL A 235 -6.772 -1.717 -0.450 1.00 0.00 C ATOM 0 H VAL A 235 -6.858 -1.088 -3.022 1.00 0.00 H new ATOM 0 HA VAL A 235 -4.452 -1.955 -1.963 1.00 0.00 H new ATOM 0 HB VAL A 235 -7.115 -3.379 -1.736 1.00 0.00 H new ATOM 0 HG11 VAL A 235 -6.175 -4.169 0.429 1.00 0.00 H new ATOM 0 HG12 VAL A 235 -5.189 -4.703 -0.953 1.00 0.00 H new ATOM 0 HG13 VAL A 235 -4.647 -3.338 0.053 1.00 0.00 H new ATOM 0 HG21 VAL A 235 -7.414 -2.093 0.346 1.00 0.00 H new ATOM 0 HG22 VAL A 235 -5.928 -1.184 -0.013 1.00 0.00 H new ATOM 0 HG23 VAL A 235 -7.341 -1.038 -1.085 1.00 0.00 H new ATOM 433 N THR A 236 -5.780 -3.925 -4.299 1.00 0.00 N ATOM 434 CA THR A 236 -5.488 -5.041 -5.193 1.00 0.00 C ATOM 435 C THR A 236 -4.166 -4.781 -5.924 1.00 0.00 C ATOM 436 O THR A 236 -3.247 -5.588 -5.840 1.00 0.00 O ATOM 437 CB THR A 236 -6.599 -5.282 -6.261 1.00 0.00 C ATOM 438 OG1 THR A 236 -7.890 -5.207 -5.673 1.00 0.00 O ATOM 439 CG2 THR A 236 -6.462 -6.674 -6.826 1.00 0.00 C ATOM 0 H THR A 236 -6.670 -3.459 -4.478 1.00 0.00 H new ATOM 0 HA THR A 236 -5.431 -5.931 -4.566 1.00 0.00 H new ATOM 0 HB THR A 236 -6.486 -4.520 -7.032 1.00 0.00 H new ATOM 0 HG1 THR A 236 -8.135 -4.267 -5.540 1.00 0.00 H new ATOM 0 HG21 THR A 236 -7.239 -6.842 -7.572 1.00 0.00 H new ATOM 0 HG22 THR A 236 -5.482 -6.783 -7.291 1.00 0.00 H new ATOM 0 HG23 THR A 236 -6.566 -7.404 -6.024 1.00 0.00 H new ATOM 447 N GLU A 237 -4.064 -3.612 -6.576 1.00 0.00 N ATOM 448 CA GLU A 237 -2.858 -3.228 -7.299 1.00 0.00 C ATOM 449 C GLU A 237 -1.638 -3.223 -6.386 1.00 0.00 C ATOM 450 O GLU A 237 -0.578 -3.716 -6.770 1.00 0.00 O ATOM 451 CB GLU A 237 -3.022 -1.867 -7.951 1.00 0.00 C ATOM 452 CG GLU A 237 -3.955 -1.843 -9.148 1.00 0.00 C ATOM 453 CD GLU A 237 -3.349 -2.511 -10.365 1.00 0.00 C ATOM 454 OE1 GLU A 237 -2.489 -1.880 -11.027 1.00 0.00 O ATOM 455 OE2 GLU A 237 -3.718 -3.642 -10.700 1.00 0.00 O ATOM 0 H GLU A 237 -4.811 -2.918 -6.613 1.00 0.00 H new ATOM 0 HA GLU A 237 -2.700 -3.973 -8.079 1.00 0.00 H new ATOM 0 HB2 GLU A 237 -3.393 -1.165 -7.205 1.00 0.00 H new ATOM 0 HB3 GLU A 237 -2.041 -1.510 -8.265 1.00 0.00 H new ATOM 0 HG2 GLU A 237 -4.888 -2.344 -8.889 1.00 0.00 H new ATOM 0 HG3 GLU A 237 -4.205 -0.810 -9.390 1.00 0.00 H new ATOM 462 N CYS A 238 -1.797 -2.693 -5.171 1.00 0.00 N ATOM 463 CA CYS A 238 -0.720 -2.665 -4.212 1.00 0.00 C ATOM 464 C CYS A 238 -0.186 -4.063 -3.924 1.00 0.00 C ATOM 465 O CYS A 238 1.010 -4.271 -3.959 1.00 0.00 O ATOM 466 CB CYS A 238 -1.140 -1.967 -2.918 1.00 0.00 C ATOM 467 SG CYS A 238 -1.457 -0.194 -3.089 1.00 0.00 S ATOM 0 H CYS A 238 -2.668 -2.279 -4.839 1.00 0.00 H new ATOM 0 HA CYS A 238 0.089 -2.086 -4.658 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -2.040 -2.449 -2.536 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -0.359 -2.113 -2.172 1.00 0.00 H new ATOM 0 HG CYS A 238 -2.585 -0.013 -3.709 1.00 0.00 H new ATOM 473 N LEU A 239 -1.069 -5.033 -3.710 1.00 0.00 N ATOM 474 CA LEU A 239 -0.613 -6.397 -3.392 1.00 0.00 C ATOM 475 C LEU A 239 0.010 -7.005 -4.657 1.00 0.00 C ATOM 476 O LEU A 239 1.003 -7.710 -4.611 1.00 0.00 O ATOM 477 CB LEU A 239 -1.778 -7.302 -2.893 1.00 0.00 C ATOM 478 CG LEU A 239 -2.922 -6.630 -2.112 1.00 0.00 C ATOM 479 CD1 LEU A 239 -3.951 -7.642 -1.670 1.00 0.00 C ATOM 480 CD2 LEU A 239 -2.423 -5.841 -0.930 1.00 0.00 C ATOM 0 H LEU A 239 -2.081 -4.914 -3.748 1.00 0.00 H new ATOM 0 HA LEU A 239 0.118 -6.340 -2.586 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -2.211 -7.800 -3.761 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -1.351 -8.080 -2.260 1.00 0.00 H new ATOM 0 HG LEU A 239 -3.395 -5.928 -2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -4.746 -7.137 -1.121 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -4.372 -8.138 -2.544 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -3.479 -8.383 -1.025 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -3.268 -5.387 -0.413 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -1.893 -6.505 -0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -1.746 -5.059 -1.274 1.00 0.00 H new ATOM 492 N THR A 240 -0.560 -6.633 -5.771 1.00 0.00 N ATOM 493 CA THR A 240 -0.173 -7.082 -7.105 1.00 0.00 C ATOM 494 C THR A 240 1.253 -6.611 -7.512 1.00 0.00 C ATOM 495 O THR A 240 1.892 -7.208 -8.387 1.00 0.00 O ATOM 496 CB THR A 240 -1.253 -6.599 -8.130 1.00 0.00 C ATOM 497 OG1 THR A 240 -2.476 -7.325 -7.956 1.00 0.00 O ATOM 498 CG2 THR A 240 -0.809 -6.656 -9.586 1.00 0.00 C ATOM 0 H THR A 240 -1.343 -5.980 -5.787 1.00 0.00 H new ATOM 0 HA THR A 240 -0.127 -8.171 -7.102 1.00 0.00 H new ATOM 0 HB THR A 240 -1.411 -5.544 -7.908 1.00 0.00 H new ATOM 0 HG1 THR A 240 -2.404 -7.903 -7.168 1.00 0.00 H new ATOM 0 HG21 THR A 240 -1.617 -6.304 -10.227 1.00 0.00 H new ATOM 0 HG22 THR A 240 0.066 -6.022 -9.725 1.00 0.00 H new ATOM 0 HG23 THR A 240 -0.558 -7.683 -9.850 1.00 0.00 H new ATOM 506 N THR A 241 1.764 -5.593 -6.853 1.00 0.00 N ATOM 507 CA THR A 241 3.087 -5.075 -7.190 1.00 0.00 C ATOM 508 C THR A 241 4.217 -6.080 -6.859 1.00 0.00 C ATOM 509 O THR A 241 5.357 -5.928 -7.316 1.00 0.00 O ATOM 510 CB THR A 241 3.373 -3.768 -6.451 1.00 0.00 C ATOM 511 OG1 THR A 241 3.369 -3.988 -5.040 1.00 0.00 O ATOM 512 CG2 THR A 241 2.338 -2.734 -6.808 1.00 0.00 C ATOM 0 H THR A 241 1.295 -5.107 -6.088 1.00 0.00 H new ATOM 0 HA THR A 241 3.074 -4.902 -8.266 1.00 0.00 H new ATOM 0 HB THR A 241 4.357 -3.406 -6.751 1.00 0.00 H new ATOM 0 HG1 THR A 241 2.486 -3.766 -4.677 1.00 0.00 H new ATOM 0 HG21 THR A 241 2.551 -1.807 -6.276 1.00 0.00 H new ATOM 0 HG22 THR A 241 2.363 -2.550 -7.882 1.00 0.00 H new ATOM 0 HG23 THR A 241 1.350 -3.096 -6.525 1.00 0.00 H new ATOM 520 N VAL A 242 3.891 -7.106 -6.089 1.00 0.00 N ATOM 521 CA VAL A 242 4.858 -8.101 -5.676 1.00 0.00 C ATOM 522 C VAL A 242 5.199 -9.021 -6.835 1.00 0.00 C ATOM 523 O VAL A 242 4.316 -9.465 -7.555 1.00 0.00 O ATOM 524 CB VAL A 242 4.313 -8.971 -4.514 1.00 0.00 C ATOM 525 CG1 VAL A 242 5.339 -9.985 -4.040 1.00 0.00 C ATOM 526 CG2 VAL A 242 3.873 -8.121 -3.367 1.00 0.00 C ATOM 0 H VAL A 242 2.948 -7.269 -5.735 1.00 0.00 H new ATOM 0 HA VAL A 242 5.746 -7.565 -5.342 1.00 0.00 H new ATOM 0 HB VAL A 242 3.452 -9.514 -4.903 1.00 0.00 H new ATOM 0 HG11 VAL A 242 4.918 -10.575 -3.225 1.00 0.00 H new ATOM 0 HG12 VAL A 242 5.606 -10.645 -4.865 1.00 0.00 H new ATOM 0 HG13 VAL A 242 6.230 -9.464 -3.689 1.00 0.00 H new ATOM 0 HG21 VAL A 242 3.495 -8.757 -2.567 1.00 0.00 H new ATOM 0 HG22 VAL A 242 4.718 -7.539 -3.000 1.00 0.00 H new ATOM 0 HG23 VAL A 242 3.084 -7.446 -3.697 1.00 0.00 H new ATOM 536 N LYS A 243 6.490 -9.319 -6.972 1.00 0.00 N ATOM 537 CA LYS A 243 7.045 -10.229 -7.985 1.00 0.00 C ATOM 538 C LYS A 243 6.250 -11.554 -8.149 1.00 0.00 C ATOM 539 O LYS A 243 6.202 -12.128 -9.236 1.00 0.00 O ATOM 540 CB LYS A 243 8.537 -10.568 -7.665 1.00 0.00 C ATOM 541 CG LYS A 243 8.812 -11.165 -6.263 1.00 0.00 C ATOM 542 CD LYS A 243 9.183 -10.120 -5.179 1.00 0.00 C ATOM 543 CE LYS A 243 10.592 -9.534 -5.399 1.00 0.00 C ATOM 544 NZ LYS A 243 11.050 -8.672 -4.272 1.00 0.00 N ATOM 0 H LYS A 243 7.206 -8.923 -6.363 1.00 0.00 H new ATOM 0 HA LYS A 243 6.967 -9.689 -8.929 1.00 0.00 H new ATOM 0 HB2 LYS A 243 8.898 -11.272 -8.415 1.00 0.00 H new ATOM 0 HB3 LYS A 243 9.127 -9.658 -7.772 1.00 0.00 H new ATOM 0 HG2 LYS A 243 7.928 -11.711 -5.935 1.00 0.00 H new ATOM 0 HG3 LYS A 243 9.622 -11.889 -6.343 1.00 0.00 H new ATOM 0 HD2 LYS A 243 8.450 -9.314 -5.187 1.00 0.00 H new ATOM 0 HD3 LYS A 243 9.134 -10.586 -4.195 1.00 0.00 H new ATOM 0 HE2 LYS A 243 11.301 -10.350 -5.535 1.00 0.00 H new ATOM 0 HE3 LYS A 243 10.597 -8.951 -6.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 11.665 -7.918 -4.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 10.225 -8.248 -3.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 11.580 -9.248 -3.588 1.00 0.00 H new ATOM 558 N SER A 244 5.639 -12.017 -7.093 1.00 0.00 N ATOM 559 CA SER A 244 4.964 -13.286 -7.123 1.00 0.00 C ATOM 560 C SER A 244 3.445 -13.160 -7.022 1.00 0.00 C ATOM 561 O SER A 244 2.718 -14.114 -7.284 1.00 0.00 O ATOM 562 CB SER A 244 5.494 -14.119 -5.994 1.00 0.00 C ATOM 563 OG SER A 244 6.909 -14.126 -6.044 1.00 0.00 O ATOM 0 H SER A 244 5.595 -11.532 -6.197 1.00 0.00 H new ATOM 0 HA SER A 244 5.161 -13.756 -8.087 1.00 0.00 H new ATOM 0 HB2 SER A 244 5.154 -13.717 -5.039 1.00 0.00 H new ATOM 0 HB3 SER A 244 5.111 -15.137 -6.066 1.00 0.00 H new ATOM 0 HG SER A 244 7.232 -15.051 -6.036 1.00 0.00 H new ATOM 569 N VAL A 245 2.964 -12.009 -6.667 1.00 0.00 N ATOM 570 CA VAL A 245 1.542 -11.851 -6.468 1.00 0.00 C ATOM 571 C VAL A 245 0.858 -11.515 -7.778 1.00 0.00 C ATOM 572 O VAL A 245 1.334 -10.702 -8.551 1.00 0.00 O ATOM 573 CB VAL A 245 1.208 -10.830 -5.350 1.00 0.00 C ATOM 574 CG1 VAL A 245 -0.291 -10.640 -5.202 1.00 0.00 C ATOM 575 CG2 VAL A 245 1.785 -11.312 -4.031 1.00 0.00 C ATOM 0 H VAL A 245 3.521 -11.169 -6.509 1.00 0.00 H new ATOM 0 HA VAL A 245 1.148 -12.806 -6.120 1.00 0.00 H new ATOM 0 HB VAL A 245 1.649 -9.872 -5.626 1.00 0.00 H new ATOM 0 HG11 VAL A 245 -0.490 -9.918 -4.410 1.00 0.00 H new ATOM 0 HG12 VAL A 245 -0.706 -10.272 -6.141 1.00 0.00 H new ATOM 0 HG13 VAL A 245 -0.755 -11.593 -4.949 1.00 0.00 H new ATOM 0 HG21 VAL A 245 1.549 -10.593 -3.246 1.00 0.00 H new ATOM 0 HG22 VAL A 245 1.354 -12.280 -3.777 1.00 0.00 H new ATOM 0 HG23 VAL A 245 2.867 -11.409 -4.121 1.00 0.00 H new ATOM 585 N ASN A 246 -0.217 -12.194 -8.027 1.00 0.00 N ATOM 586 CA ASN A 246 -0.982 -12.055 -9.247 1.00 0.00 C ATOM 587 C ASN A 246 -2.225 -11.221 -8.921 1.00 0.00 C ATOM 588 O ASN A 246 -2.491 -10.947 -7.745 1.00 0.00 O ATOM 589 CB ASN A 246 -1.364 -13.465 -9.729 1.00 0.00 C ATOM 590 CG ASN A 246 -1.986 -13.524 -11.103 1.00 0.00 C ATOM 591 OD1 ASN A 246 -1.712 -12.682 -11.962 1.00 0.00 O ATOM 592 ND2 ASN A 246 -2.793 -14.525 -11.333 1.00 0.00 N ATOM 0 H ASN A 246 -0.605 -12.879 -7.378 1.00 0.00 H new ATOM 0 HA ASN A 246 -0.418 -11.558 -10.036 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -0.470 -14.089 -9.725 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -2.060 -13.901 -9.013 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -3.223 -14.632 -12.251 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -2.993 -15.199 -10.594 1.00 0.00 H new ATOM 599 N LYS A 247 -3.008 -10.864 -9.910 1.00 0.00 N ATOM 600 CA LYS A 247 -4.140 -9.985 -9.676 1.00 0.00 C ATOM 601 C LYS A 247 -5.273 -10.717 -8.906 1.00 0.00 C ATOM 602 O LYS A 247 -5.812 -10.193 -7.922 1.00 0.00 O ATOM 603 CB LYS A 247 -4.619 -9.358 -10.999 1.00 0.00 C ATOM 604 CG LYS A 247 -5.606 -8.207 -10.855 1.00 0.00 C ATOM 605 CD LYS A 247 -4.999 -7.043 -10.082 1.00 0.00 C ATOM 606 CE LYS A 247 -5.922 -5.828 -10.060 1.00 0.00 C ATOM 607 NZ LYS A 247 -5.916 -5.087 -11.327 1.00 0.00 N ATOM 0 H LYS A 247 -2.889 -11.162 -10.878 1.00 0.00 H new ATOM 0 HA LYS A 247 -3.820 -9.165 -9.034 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -3.748 -9.001 -11.549 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -5.081 -10.137 -11.605 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -5.916 -7.867 -11.843 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -6.502 -8.557 -10.343 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -4.789 -7.357 -9.060 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -4.046 -6.766 -10.533 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -6.939 -6.154 -9.839 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -5.619 -5.161 -9.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -6.858 -4.678 -11.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -5.211 -4.324 -11.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -5.675 -5.733 -12.106 1.00 0.00 H new ATOM 621 N THR A 248 -5.584 -11.945 -9.310 1.00 0.00 N ATOM 622 CA THR A 248 -6.589 -12.743 -8.607 1.00 0.00 C ATOM 623 C THR A 248 -6.018 -13.218 -7.251 1.00 0.00 C ATOM 624 O THR A 248 -6.745 -13.504 -6.291 1.00 0.00 O ATOM 625 CB THR A 248 -7.095 -13.964 -9.460 1.00 0.00 C ATOM 626 OG1 THR A 248 -8.134 -14.668 -8.755 1.00 0.00 O ATOM 627 CG2 THR A 248 -5.965 -14.941 -9.776 1.00 0.00 C ATOM 0 H THR A 248 -5.160 -12.408 -10.114 1.00 0.00 H new ATOM 0 HA THR A 248 -7.457 -12.107 -8.435 1.00 0.00 H new ATOM 0 HB THR A 248 -7.481 -13.563 -10.397 1.00 0.00 H new ATOM 0 HG1 THR A 248 -8.442 -15.425 -9.296 1.00 0.00 H new ATOM 0 HG21 THR A 248 -6.355 -15.770 -10.366 1.00 0.00 H new ATOM 0 HG22 THR A 248 -5.187 -14.427 -10.341 1.00 0.00 H new ATOM 0 HG23 THR A 248 -5.545 -15.324 -8.846 1.00 0.00 H new ATOM 635 N ASP A 249 -4.711 -13.241 -7.174 1.00 0.00 N ATOM 636 CA ASP A 249 -3.997 -13.617 -5.966 1.00 0.00 C ATOM 637 C ASP A 249 -4.286 -12.539 -4.917 1.00 0.00 C ATOM 638 O ASP A 249 -4.700 -12.828 -3.793 1.00 0.00 O ATOM 639 CB ASP A 249 -2.510 -13.682 -6.311 1.00 0.00 C ATOM 640 CG ASP A 249 -1.599 -14.247 -5.265 1.00 0.00 C ATOM 641 OD1 ASP A 249 -1.209 -13.537 -4.380 1.00 0.00 O ATOM 642 OD2 ASP A 249 -1.200 -15.430 -5.415 1.00 0.00 O ATOM 0 H ASP A 249 -4.100 -12.997 -7.954 1.00 0.00 H new ATOM 0 HA ASP A 249 -4.306 -14.586 -5.574 1.00 0.00 H new ATOM 0 HB2 ASP A 249 -2.397 -14.277 -7.217 1.00 0.00 H new ATOM 0 HB3 ASP A 249 -2.172 -12.673 -6.548 1.00 0.00 H new ATOM 647 N SER A 250 -4.211 -11.290 -5.362 1.00 0.00 N ATOM 648 CA SER A 250 -4.483 -10.142 -4.524 1.00 0.00 C ATOM 649 C SER A 250 -5.941 -10.130 -4.025 1.00 0.00 C ATOM 650 O SER A 250 -6.193 -9.852 -2.852 1.00 0.00 O ATOM 651 CB SER A 250 -4.182 -8.870 -5.294 1.00 0.00 C ATOM 652 OG SER A 250 -2.857 -8.871 -5.774 1.00 0.00 O ATOM 0 H SER A 250 -3.958 -11.050 -6.321 1.00 0.00 H new ATOM 0 HA SER A 250 -3.839 -10.203 -3.647 1.00 0.00 H new ATOM 0 HB2 SER A 250 -4.875 -8.774 -6.130 1.00 0.00 H new ATOM 0 HB3 SER A 250 -4.338 -8.005 -4.649 1.00 0.00 H new ATOM 0 HG SER A 250 -2.767 -9.539 -6.485 1.00 0.00 H new ATOM 658 N GLN A 251 -6.907 -10.465 -4.901 1.00 0.00 N ATOM 659 CA GLN A 251 -8.319 -10.461 -4.475 1.00 0.00 C ATOM 660 C GLN A 251 -8.576 -11.522 -3.404 1.00 0.00 C ATOM 661 O GLN A 251 -9.441 -11.360 -2.542 1.00 0.00 O ATOM 662 CB GLN A 251 -9.311 -10.588 -5.639 1.00 0.00 C ATOM 663 CG GLN A 251 -9.349 -11.938 -6.328 1.00 0.00 C ATOM 664 CD GLN A 251 -10.333 -11.992 -7.492 1.00 0.00 C ATOM 665 OE1 GLN A 251 -11.408 -11.235 -7.407 1.00 0.00 O flip ATOM 666 NE2 GLN A 251 -10.117 -12.722 -8.466 1.00 0.00 N flip ATOM 0 H GLN A 251 -6.746 -10.732 -5.872 1.00 0.00 H new ATOM 0 HA GLN A 251 -8.499 -9.479 -4.038 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -10.310 -10.363 -5.266 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -9.069 -9.828 -6.382 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -8.351 -12.180 -6.693 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -9.616 -12.703 -5.599 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -9.273 -13.295 -8.497 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -10.782 -12.752 -9.239 1.00 0.00 H new ATOM 675 N THR A 252 -7.796 -12.585 -3.445 1.00 0.00 N ATOM 676 CA THR A 252 -7.870 -13.626 -2.441 1.00 0.00 C ATOM 677 C THR A 252 -7.457 -13.032 -1.064 1.00 0.00 C ATOM 678 O THR A 252 -8.140 -13.218 -0.041 1.00 0.00 O ATOM 679 CB THR A 252 -6.961 -14.813 -2.824 1.00 0.00 C ATOM 680 OG1 THR A 252 -7.212 -15.176 -4.207 1.00 0.00 O ATOM 681 CG2 THR A 252 -7.278 -16.009 -1.949 1.00 0.00 C ATOM 0 H THR A 252 -7.098 -12.750 -4.170 1.00 0.00 H new ATOM 0 HA THR A 252 -8.892 -14.000 -2.378 1.00 0.00 H new ATOM 0 HB THR A 252 -5.919 -14.523 -2.688 1.00 0.00 H new ATOM 0 HG1 THR A 252 -6.830 -14.494 -4.799 1.00 0.00 H new ATOM 0 HG21 THR A 252 -6.633 -16.843 -2.225 1.00 0.00 H new ATOM 0 HG22 THR A 252 -7.109 -15.750 -0.904 1.00 0.00 H new ATOM 0 HG23 THR A 252 -8.320 -16.295 -2.088 1.00 0.00 H new ATOM 689 N LEU A 253 -6.395 -12.232 -1.071 1.00 0.00 N ATOM 690 CA LEU A 253 -5.945 -11.538 0.140 1.00 0.00 C ATOM 691 C LEU A 253 -6.965 -10.490 0.582 1.00 0.00 C ATOM 692 O LEU A 253 -7.077 -10.154 1.764 1.00 0.00 O ATOM 693 CB LEU A 253 -4.567 -10.880 -0.039 1.00 0.00 C ATOM 694 CG LEU A 253 -3.333 -11.777 0.094 1.00 0.00 C ATOM 695 CD1 LEU A 253 -3.253 -12.806 -0.999 1.00 0.00 C ATOM 696 CD2 LEU A 253 -2.080 -10.947 0.127 1.00 0.00 C ATOM 0 H LEU A 253 -5.828 -12.046 -1.898 1.00 0.00 H new ATOM 0 HA LEU A 253 -5.852 -12.299 0.915 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -4.541 -10.416 -1.025 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -4.480 -10.077 0.693 1.00 0.00 H new ATOM 0 HG LEU A 253 -3.429 -12.316 1.036 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -2.361 -13.416 -0.860 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -4.137 -13.443 -0.965 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -3.203 -12.306 -1.966 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -1.213 -11.601 0.222 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -2.001 -10.371 -0.795 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -2.116 -10.267 0.978 1.00 0.00 H new ATOM 708 N LEU A 254 -7.720 -10.008 -0.354 1.00 0.00 N ATOM 709 CA LEU A 254 -8.721 -9.021 -0.092 1.00 0.00 C ATOM 710 C LEU A 254 -9.967 -9.599 0.536 1.00 0.00 C ATOM 711 O LEU A 254 -10.618 -8.945 1.344 1.00 0.00 O ATOM 712 CB LEU A 254 -9.040 -8.267 -1.337 1.00 0.00 C ATOM 713 CG LEU A 254 -7.995 -7.257 -1.724 1.00 0.00 C ATOM 714 CD1 LEU A 254 -8.281 -6.737 -3.076 1.00 0.00 C ATOM 715 CD2 LEU A 254 -7.992 -6.115 -0.740 1.00 0.00 C ATOM 0 H LEU A 254 -7.659 -10.291 -1.332 1.00 0.00 H new ATOM 0 HA LEU A 254 -8.308 -8.330 0.643 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -9.167 -8.975 -2.156 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -9.994 -7.756 -1.206 1.00 0.00 H new ATOM 0 HG LEU A 254 -7.018 -7.740 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -7.522 -6.006 -3.353 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -8.271 -7.559 -3.792 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -9.262 -6.262 -3.083 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -7.232 -5.388 -1.028 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -8.971 -5.635 -0.737 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -7.771 -6.495 0.258 1.00 0.00 H new ATOM 727 N THR A 255 -10.307 -10.814 0.195 1.00 0.00 N ATOM 728 CA THR A 255 -11.444 -11.411 0.824 1.00 0.00 C ATOM 729 C THR A 255 -11.073 -11.906 2.230 1.00 0.00 C ATOM 730 O THR A 255 -11.943 -12.062 3.081 1.00 0.00 O ATOM 731 CB THR A 255 -12.128 -12.525 -0.041 1.00 0.00 C ATOM 732 OG1 THR A 255 -13.352 -12.959 0.582 1.00 0.00 O ATOM 733 CG2 THR A 255 -11.216 -13.727 -0.243 1.00 0.00 C ATOM 0 H THR A 255 -9.826 -11.392 -0.495 1.00 0.00 H new ATOM 0 HA THR A 255 -12.202 -10.634 0.920 1.00 0.00 H new ATOM 0 HB THR A 255 -12.341 -12.089 -1.017 1.00 0.00 H new ATOM 0 HG1 THR A 255 -13.771 -13.654 0.032 1.00 0.00 H new ATOM 0 HG21 THR A 255 -11.729 -14.475 -0.848 1.00 0.00 H new ATOM 0 HG22 THR A 255 -10.305 -13.411 -0.752 1.00 0.00 H new ATOM 0 HG23 THR A 255 -10.960 -14.156 0.726 1.00 0.00 H new ATOM 741 N THR A 256 -9.782 -12.134 2.478 1.00 0.00 N ATOM 742 CA THR A 256 -9.368 -12.534 3.798 1.00 0.00 C ATOM 743 C THR A 256 -9.072 -11.314 4.721 1.00 0.00 C ATOM 744 O THR A 256 -9.595 -11.249 5.834 1.00 0.00 O ATOM 745 CB THR A 256 -8.194 -13.589 3.790 1.00 0.00 C ATOM 746 OG1 THR A 256 -7.926 -14.074 5.111 1.00 0.00 O ATOM 747 CG2 THR A 256 -6.929 -13.017 3.208 1.00 0.00 C ATOM 0 H THR A 256 -9.031 -12.048 1.793 1.00 0.00 H new ATOM 0 HA THR A 256 -10.222 -13.053 4.233 1.00 0.00 H new ATOM 0 HB THR A 256 -8.524 -14.415 3.161 1.00 0.00 H new ATOM 0 HG1 THR A 256 -7.218 -13.534 5.521 1.00 0.00 H new ATOM 0 HG21 THR A 256 -6.147 -13.776 3.221 1.00 0.00 H new ATOM 0 HG22 THR A 256 -7.111 -12.702 2.181 1.00 0.00 H new ATOM 0 HG23 THR A 256 -6.612 -12.158 3.800 1.00 0.00 H new ATOM 755 N PHE A 257 -8.253 -10.350 4.275 1.00 0.00 N ATOM 756 CA PHE A 257 -7.908 -9.227 5.163 1.00 0.00 C ATOM 757 C PHE A 257 -8.466 -7.885 4.654 1.00 0.00 C ATOM 758 O PHE A 257 -8.771 -6.997 5.448 1.00 0.00 O ATOM 759 CB PHE A 257 -6.375 -9.119 5.290 1.00 0.00 C ATOM 760 CG PHE A 257 -5.675 -10.426 5.575 1.00 0.00 C ATOM 761 CD1 PHE A 257 -6.145 -11.287 6.551 1.00 0.00 C ATOM 762 CD2 PHE A 257 -4.555 -10.796 4.850 1.00 0.00 C ATOM 763 CE1 PHE A 257 -5.521 -12.489 6.797 1.00 0.00 C ATOM 764 CE2 PHE A 257 -3.922 -11.997 5.095 1.00 0.00 C ATOM 765 CZ PHE A 257 -4.409 -12.845 6.070 1.00 0.00 C ATOM 0 H PHE A 257 -7.832 -10.321 3.346 1.00 0.00 H new ATOM 0 HA PHE A 257 -8.361 -9.431 6.133 1.00 0.00 H new ATOM 0 HB2 PHE A 257 -5.975 -8.702 4.366 1.00 0.00 H new ATOM 0 HB3 PHE A 257 -6.138 -8.414 6.087 1.00 0.00 H new ATOM 0 HD1 PHE A 257 -7.015 -11.012 7.129 1.00 0.00 H new ATOM 0 HD2 PHE A 257 -4.173 -10.137 4.084 1.00 0.00 H new ATOM 0 HE1 PHE A 257 -5.904 -13.151 7.559 1.00 0.00 H new ATOM 0 HE2 PHE A 257 -3.047 -12.274 4.525 1.00 0.00 H new ATOM 0 HZ PHE A 257 -3.917 -13.787 6.262 1.00 0.00 H new ATOM 775 N GLY A 258 -8.645 -7.781 3.343 1.00 0.00 N ATOM 776 CA GLY A 258 -9.234 -6.588 2.684 1.00 0.00 C ATOM 777 C GLY A 258 -8.644 -5.211 3.041 1.00 0.00 C ATOM 778 O GLY A 258 -9.306 -4.179 2.828 1.00 0.00 O ATOM 0 H GLY A 258 -8.388 -8.520 2.689 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -9.145 -6.722 1.606 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -10.299 -6.568 2.916 1.00 0.00 H new ATOM 782 N SER A 259 -7.447 -5.180 3.557 1.00 0.00 N ATOM 783 CA SER A 259 -6.841 -3.940 3.994 1.00 0.00 C ATOM 784 C SER A 259 -5.336 -3.976 3.789 1.00 0.00 C ATOM 785 O SER A 259 -4.760 -5.049 3.571 1.00 0.00 O ATOM 786 CB SER A 259 -7.199 -3.679 5.470 1.00 0.00 C ATOM 787 OG SER A 259 -6.536 -2.534 5.998 1.00 0.00 O ATOM 0 H SER A 259 -6.862 -6.005 3.689 1.00 0.00 H new ATOM 0 HA SER A 259 -7.233 -3.120 3.393 1.00 0.00 H new ATOM 0 HB2 SER A 259 -8.277 -3.545 5.561 1.00 0.00 H new ATOM 0 HB3 SER A 259 -6.936 -4.554 6.065 1.00 0.00 H new ATOM 0 HG SER A 259 -7.136 -1.760 5.957 1.00 0.00 H new ATOM 793 N LEU A 260 -4.705 -2.812 3.876 1.00 0.00 N ATOM 794 CA LEU A 260 -3.273 -2.718 3.795 1.00 0.00 C ATOM 795 C LEU A 260 -2.651 -3.042 5.137 1.00 0.00 C ATOM 796 O LEU A 260 -1.766 -3.885 5.210 1.00 0.00 O ATOM 797 CB LEU A 260 -2.819 -1.337 3.357 1.00 0.00 C ATOM 798 CG LEU A 260 -1.303 -1.119 3.421 1.00 0.00 C ATOM 799 CD1 LEU A 260 -0.564 -2.062 2.488 1.00 0.00 C ATOM 800 CD2 LEU A 260 -0.959 0.304 3.134 1.00 0.00 C ATOM 0 H LEU A 260 -5.178 -1.917 4.004 1.00 0.00 H new ATOM 0 HA LEU A 260 -2.945 -3.439 3.046 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -3.156 -1.164 2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -3.308 -0.591 3.984 1.00 0.00 H new ATOM 0 HG LEU A 260 -0.978 -1.347 4.436 1.00 0.00 H new ATOM 0 HD11 LEU A 260 0.508 -1.879 2.560 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -0.776 -3.093 2.770 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -0.893 -1.892 1.463 1.00 0.00 H new ATOM 0 HD21 LEU A 260 0.122 0.434 3.185 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -1.310 0.569 2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -1.438 0.950 3.870 1.00 0.00 H new ATOM 812 N GLU A 261 -3.120 -2.364 6.197 1.00 0.00 N ATOM 813 CA GLU A 261 -2.625 -2.571 7.547 1.00 0.00 C ATOM 814 C GLU A 261 -2.730 -4.036 7.906 1.00 0.00 C ATOM 815 O GLU A 261 -1.775 -4.639 8.338 1.00 0.00 O ATOM 816 CB GLU A 261 -3.448 -1.721 8.510 1.00 0.00 C ATOM 817 CG GLU A 261 -3.269 -2.053 9.974 1.00 0.00 C ATOM 818 CD GLU A 261 -1.970 -1.558 10.586 1.00 0.00 C ATOM 819 OE1 GLU A 261 -0.883 -2.049 10.233 1.00 0.00 O ATOM 820 OE2 GLU A 261 -2.035 -0.690 11.479 1.00 0.00 O ATOM 0 H GLU A 261 -3.854 -1.659 6.131 1.00 0.00 H new ATOM 0 HA GLU A 261 -1.578 -2.274 7.614 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -3.189 -0.673 8.357 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -4.502 -1.829 8.255 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -4.103 -1.628 10.533 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -3.322 -3.135 10.096 1.00 0.00 H new ATOM 827 N GLN A 262 -3.881 -4.610 7.625 1.00 0.00 N ATOM 828 CA GLN A 262 -4.141 -6.018 7.912 1.00 0.00 C ATOM 829 C GLN A 262 -3.143 -6.939 7.173 1.00 0.00 C ATOM 830 O GLN A 262 -2.832 -8.019 7.650 1.00 0.00 O ATOM 831 CB GLN A 262 -5.573 -6.391 7.524 1.00 0.00 C ATOM 832 CG GLN A 262 -6.663 -5.607 8.250 1.00 0.00 C ATOM 833 CD GLN A 262 -6.713 -5.870 9.737 1.00 0.00 C ATOM 834 OE1 GLN A 262 -6.382 -6.958 10.205 1.00 0.00 O ATOM 835 NE2 GLN A 262 -7.147 -4.903 10.479 1.00 0.00 N ATOM 0 H GLN A 262 -4.665 -4.121 7.192 1.00 0.00 H new ATOM 0 HA GLN A 262 -4.011 -6.162 8.985 1.00 0.00 H new ATOM 0 HB2 GLN A 262 -5.693 -6.242 6.451 1.00 0.00 H new ATOM 0 HB3 GLN A 262 -5.721 -7.454 7.717 1.00 0.00 H new ATOM 0 HG2 GLN A 262 -6.504 -4.542 8.084 1.00 0.00 H new ATOM 0 HG3 GLN A 262 -7.630 -5.857 7.813 1.00 0.00 H new ATOM 0 HE21 GLN A 262 -7.412 -4.014 10.055 1.00 0.00 H new ATOM 0 HE22 GLN A 262 -7.224 -5.029 11.488 1.00 0.00 H new ATOM 844 N LEU A 263 -2.665 -6.488 6.012 1.00 0.00 N ATOM 845 CA LEU A 263 -1.722 -7.252 5.194 1.00 0.00 C ATOM 846 C LEU A 263 -0.296 -7.115 5.740 1.00 0.00 C ATOM 847 O LEU A 263 0.387 -8.092 5.969 1.00 0.00 O ATOM 848 CB LEU A 263 -1.710 -6.737 3.761 1.00 0.00 C ATOM 849 CG LEU A 263 -1.712 -7.788 2.664 1.00 0.00 C ATOM 850 CD1 LEU A 263 -3.101 -7.950 2.089 1.00 0.00 C ATOM 851 CD2 LEU A 263 -0.680 -7.460 1.603 1.00 0.00 C ATOM 0 H LEU A 263 -2.920 -5.585 5.613 1.00 0.00 H new ATOM 0 HA LEU A 263 -2.044 -8.293 5.222 1.00 0.00 H new ATOM 0 HB2 LEU A 263 -2.581 -6.096 3.621 1.00 0.00 H new ATOM 0 HB3 LEU A 263 -0.828 -6.110 3.631 1.00 0.00 H new ATOM 0 HG LEU A 263 -1.428 -8.749 3.093 1.00 0.00 H new ATOM 0 HD11 LEU A 263 -3.084 -8.707 1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 263 -3.787 -8.260 2.877 1.00 0.00 H new ATOM 0 HD13 LEU A 263 -3.434 -7.001 1.670 1.00 0.00 H new ATOM 0 HD21 LEU A 263 -0.699 -8.226 0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 263 -0.908 -6.490 1.161 1.00 0.00 H new ATOM 0 HD23 LEU A 263 0.311 -7.428 2.057 1.00 0.00 H new ATOM 863 N ILE A 264 0.133 -5.872 5.945 1.00 0.00 N ATOM 864 CA ILE A 264 1.500 -5.567 6.347 1.00 0.00 C ATOM 865 C ILE A 264 1.731 -5.956 7.821 1.00 0.00 C ATOM 866 O ILE A 264 2.840 -6.315 8.217 1.00 0.00 O ATOM 867 CB ILE A 264 1.851 -4.046 6.004 1.00 0.00 C ATOM 868 CG1 ILE A 264 3.346 -3.656 6.225 1.00 0.00 C ATOM 869 CG2 ILE A 264 0.926 -3.068 6.713 1.00 0.00 C ATOM 870 CD1 ILE A 264 3.769 -3.456 7.661 1.00 0.00 C ATOM 0 H ILE A 264 -0.459 -5.049 5.836 1.00 0.00 H new ATOM 0 HA ILE A 264 2.202 -6.172 5.773 1.00 0.00 H new ATOM 0 HB ILE A 264 1.681 -3.969 4.930 1.00 0.00 H new ATOM 0 HG12 ILE A 264 3.973 -4.432 5.786 1.00 0.00 H new ATOM 0 HG13 ILE A 264 3.547 -2.736 5.676 1.00 0.00 H new ATOM 0 HG21 ILE A 264 1.204 -2.048 6.449 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -0.104 -3.254 6.408 1.00 0.00 H new ATOM 0 HG23 ILE A 264 1.014 -3.200 7.791 1.00 0.00 H new ATOM 0 HD11 ILE A 264 4.825 -3.188 7.695 1.00 0.00 H new ATOM 0 HD12 ILE A 264 3.177 -2.656 8.107 1.00 0.00 H new ATOM 0 HD13 ILE A 264 3.610 -4.379 8.219 1.00 0.00 H new ATOM 882 N ALA A 265 0.676 -5.932 8.615 1.00 0.00 N ATOM 883 CA ALA A 265 0.767 -6.350 10.005 1.00 0.00 C ATOM 884 C ALA A 265 0.780 -7.867 10.094 1.00 0.00 C ATOM 885 O ALA A 265 1.129 -8.443 11.132 1.00 0.00 O ATOM 886 CB ALA A 265 -0.391 -5.797 10.818 1.00 0.00 C ATOM 0 H ALA A 265 -0.253 -5.628 8.323 1.00 0.00 H new ATOM 0 HA ALA A 265 1.696 -5.955 10.417 1.00 0.00 H new ATOM 0 HB1 ALA A 265 -0.298 -6.125 11.853 1.00 0.00 H new ATOM 0 HB2 ALA A 265 -0.375 -4.708 10.780 1.00 0.00 H new ATOM 0 HB3 ALA A 265 -1.332 -6.161 10.405 1.00 0.00 H new ATOM 892 N ALA A 266 0.397 -8.505 9.015 1.00 0.00 N ATOM 893 CA ALA A 266 0.356 -9.934 8.938 1.00 0.00 C ATOM 894 C ALA A 266 1.747 -10.443 8.602 1.00 0.00 C ATOM 895 O ALA A 266 2.473 -9.829 7.822 1.00 0.00 O ATOM 896 CB ALA A 266 -0.663 -10.368 7.886 1.00 0.00 C ATOM 0 H ALA A 266 0.103 -8.035 8.159 1.00 0.00 H new ATOM 0 HA ALA A 266 0.046 -10.357 9.894 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -0.689 -11.456 7.832 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -1.650 -9.994 8.159 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -0.378 -9.964 6.915 1.00 0.00 H new ATOM 902 N SER A 267 2.139 -11.517 9.209 1.00 0.00 N ATOM 903 CA SER A 267 3.443 -12.060 8.977 1.00 0.00 C ATOM 904 C SER A 267 3.361 -13.091 7.834 1.00 0.00 C ATOM 905 O SER A 267 2.267 -13.345 7.323 1.00 0.00 O ATOM 906 CB SER A 267 3.914 -12.687 10.272 1.00 0.00 C ATOM 907 OG SER A 267 3.736 -11.767 11.352 1.00 0.00 O ATOM 0 H SER A 267 1.571 -12.041 9.875 1.00 0.00 H new ATOM 0 HA SER A 267 4.156 -11.292 8.676 1.00 0.00 H new ATOM 0 HB2 SER A 267 3.355 -13.602 10.467 1.00 0.00 H new ATOM 0 HB3 SER A 267 4.965 -12.966 10.190 1.00 0.00 H new ATOM 0 HG SER A 267 4.041 -12.180 12.187 1.00 0.00 H new ATOM 913 N ARG A 268 4.491 -13.679 7.436 1.00 0.00 N ATOM 914 CA ARG A 268 4.519 -14.682 6.355 1.00 0.00 C ATOM 915 C ARG A 268 3.574 -15.848 6.647 1.00 0.00 C ATOM 916 O ARG A 268 2.935 -16.361 5.758 1.00 0.00 O ATOM 917 CB ARG A 268 5.943 -15.196 6.135 1.00 0.00 C ATOM 918 CG ARG A 268 6.910 -14.112 5.714 1.00 0.00 C ATOM 919 CD ARG A 268 8.330 -14.621 5.522 1.00 0.00 C ATOM 920 NE ARG A 268 8.848 -15.287 6.724 1.00 0.00 N ATOM 921 CZ ARG A 268 9.960 -14.934 7.394 1.00 0.00 C ATOM 922 NH1 ARG A 268 10.729 -13.932 6.960 1.00 0.00 N ATOM 923 NH2 ARG A 268 10.308 -15.596 8.488 1.00 0.00 N ATOM 0 H ARG A 268 5.405 -13.481 7.844 1.00 0.00 H new ATOM 0 HA ARG A 268 4.176 -14.193 5.443 1.00 0.00 H new ATOM 0 HB2 ARG A 268 6.302 -15.657 7.055 1.00 0.00 H new ATOM 0 HB3 ARG A 268 5.927 -15.976 5.373 1.00 0.00 H new ATOM 0 HG2 ARG A 268 6.562 -13.664 4.783 1.00 0.00 H new ATOM 0 HG3 ARG A 268 6.912 -13.323 6.466 1.00 0.00 H new ATOM 0 HD2 ARG A 268 8.354 -15.317 4.684 1.00 0.00 H new ATOM 0 HD3 ARG A 268 8.981 -13.786 5.262 1.00 0.00 H new ATOM 0 HE ARG A 268 8.321 -16.084 7.081 1.00 0.00 H new ATOM 0 HH11 ARG A 268 10.476 -13.425 6.112 1.00 0.00 H new ATOM 0 HH12 ARG A 268 11.570 -13.674 7.477 1.00 0.00 H new ATOM 0 HH21 ARG A 268 9.733 -16.371 8.820 1.00 0.00 H new ATOM 0 HH22 ARG A 268 11.150 -15.331 8.998 1.00 0.00 H new ATOM 937 N GLU A 269 3.482 -16.236 7.891 1.00 0.00 N ATOM 938 CA GLU A 269 2.571 -17.285 8.309 1.00 0.00 C ATOM 939 C GLU A 269 1.105 -16.848 8.213 1.00 0.00 C ATOM 940 O GLU A 269 0.251 -17.638 7.854 1.00 0.00 O ATOM 941 CB GLU A 269 2.913 -17.869 9.709 1.00 0.00 C ATOM 942 CG GLU A 269 3.339 -16.866 10.786 1.00 0.00 C ATOM 943 CD GLU A 269 4.773 -16.411 10.615 1.00 0.00 C ATOM 944 OE1 GLU A 269 5.015 -15.455 9.880 1.00 0.00 O ATOM 945 OE2 GLU A 269 5.683 -17.032 11.183 1.00 0.00 O ATOM 0 H GLU A 269 4.035 -15.837 8.650 1.00 0.00 H new ATOM 0 HA GLU A 269 2.711 -18.101 7.600 1.00 0.00 H new ATOM 0 HB2 GLU A 269 2.041 -18.411 10.074 1.00 0.00 H new ATOM 0 HB3 GLU A 269 3.714 -18.599 9.587 1.00 0.00 H new ATOM 0 HG2 GLU A 269 2.679 -15.999 10.753 1.00 0.00 H new ATOM 0 HG3 GLU A 269 3.219 -17.320 11.770 1.00 0.00 H new ATOM 952 N ASP A 270 0.839 -15.575 8.464 1.00 0.00 N ATOM 953 CA ASP A 270 -0.534 -15.032 8.378 1.00 0.00 C ATOM 954 C ASP A 270 -0.932 -14.895 6.929 1.00 0.00 C ATOM 955 O ASP A 270 -2.065 -15.172 6.540 1.00 0.00 O ATOM 956 CB ASP A 270 -0.652 -13.654 9.029 1.00 0.00 C ATOM 957 CG ASP A 270 -0.395 -13.622 10.499 1.00 0.00 C ATOM 958 OD1 ASP A 270 -1.267 -14.009 11.274 1.00 0.00 O ATOM 959 OD2 ASP A 270 0.697 -13.167 10.910 1.00 0.00 O ATOM 0 H ASP A 270 1.546 -14.889 8.730 1.00 0.00 H new ATOM 0 HA ASP A 270 -1.187 -15.726 8.907 1.00 0.00 H new ATOM 0 HB2 ASP A 270 0.048 -12.977 8.539 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -1.654 -13.266 8.843 1.00 0.00 H new ATOM 964 N LEU A 271 0.009 -14.476 6.126 1.00 0.00 N ATOM 965 CA LEU A 271 -0.215 -14.316 4.709 1.00 0.00 C ATOM 966 C LEU A 271 -0.336 -15.687 4.034 1.00 0.00 C ATOM 967 O LEU A 271 -1.072 -15.847 3.078 1.00 0.00 O ATOM 968 CB LEU A 271 0.909 -13.483 4.093 1.00 0.00 C ATOM 969 CG LEU A 271 1.050 -12.044 4.612 1.00 0.00 C ATOM 970 CD1 LEU A 271 2.314 -11.404 4.070 1.00 0.00 C ATOM 971 CD2 LEU A 271 -0.164 -11.212 4.227 1.00 0.00 C ATOM 0 H LEU A 271 0.952 -14.236 6.432 1.00 0.00 H new ATOM 0 HA LEU A 271 -1.153 -13.784 4.549 1.00 0.00 H new ATOM 0 HB2 LEU A 271 1.852 -14.002 4.262 1.00 0.00 H new ATOM 0 HB3 LEU A 271 0.755 -13.445 3.015 1.00 0.00 H new ATOM 0 HG LEU A 271 1.115 -12.081 5.699 1.00 0.00 H new ATOM 0 HD11 LEU A 271 2.397 -10.385 4.448 1.00 0.00 H new ATOM 0 HD12 LEU A 271 3.181 -11.982 4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 271 2.274 -11.384 2.981 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -0.044 -10.196 4.604 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.258 -11.187 3.141 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -1.061 -11.656 4.659 1.00 0.00 H new ATOM 983 N ALA A 272 0.368 -16.681 4.571 1.00 0.00 N ATOM 984 CA ALA A 272 0.284 -18.052 4.061 1.00 0.00 C ATOM 985 C ALA A 272 -0.959 -18.747 4.610 1.00 0.00 C ATOM 986 O ALA A 272 -1.359 -19.808 4.131 1.00 0.00 O ATOM 987 CB ALA A 272 1.532 -18.843 4.425 1.00 0.00 C ATOM 0 H ALA A 272 1.004 -16.565 5.360 1.00 0.00 H new ATOM 0 HA ALA A 272 0.212 -18.007 2.974 1.00 0.00 H new ATOM 0 HB1 ALA A 272 1.446 -19.857 4.036 1.00 0.00 H new ATOM 0 HB2 ALA A 272 2.408 -18.361 3.991 1.00 0.00 H new ATOM 0 HB3 ALA A 272 1.637 -18.878 5.509 1.00 0.00 H new ATOM 993 N LEU A 273 -1.541 -18.153 5.625 1.00 0.00 N ATOM 994 CA LEU A 273 -2.750 -18.628 6.246 1.00 0.00 C ATOM 995 C LEU A 273 -3.941 -18.383 5.329 1.00 0.00 C ATOM 996 O LEU A 273 -4.917 -19.150 5.351 1.00 0.00 O ATOM 997 CB LEU A 273 -2.932 -17.869 7.537 1.00 0.00 C ATOM 998 CG LEU A 273 -4.190 -18.104 8.310 1.00 0.00 C ATOM 999 CD1 LEU A 273 -4.236 -19.511 8.842 1.00 0.00 C ATOM 1000 CD2 LEU A 273 -4.288 -17.079 9.397 1.00 0.00 C ATOM 0 H LEU A 273 -1.174 -17.302 6.052 1.00 0.00 H new ATOM 0 HA LEU A 273 -2.682 -19.699 6.437 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -2.090 -18.106 8.187 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -2.871 -16.804 7.312 1.00 0.00 H new ATOM 0 HG LEU A 273 -5.056 -17.996 7.657 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -5.160 -19.659 9.401 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -4.198 -20.216 8.011 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -3.383 -19.679 9.500 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -5.202 -17.240 9.968 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -3.426 -17.167 10.059 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -4.307 -16.082 8.956 1.00 0.00 H new ATOM 1012 N CYS A 274 -3.842 -17.303 4.552 1.00 0.00 N ATOM 1013 CA CYS A 274 -4.830 -16.904 3.518 1.00 0.00 C ATOM 1014 C CYS A 274 -5.316 -18.148 2.740 1.00 0.00 C ATOM 1015 O CYS A 274 -4.493 -18.982 2.327 1.00 0.00 O ATOM 1016 CB CYS A 274 -4.177 -15.886 2.556 1.00 0.00 C ATOM 1017 SG CYS A 274 -5.235 -15.263 1.227 1.00 0.00 S ATOM 0 H CYS A 274 -3.056 -16.657 4.617 1.00 0.00 H new ATOM 0 HA CYS A 274 -5.693 -16.441 3.997 1.00 0.00 H new ATOM 0 HB2 CYS A 274 -3.824 -15.037 3.141 1.00 0.00 H new ATOM 0 HB3 CYS A 274 -3.299 -16.351 2.107 1.00 0.00 H new ATOM 0 HG CYS A 274 -5.631 -16.255 0.486 1.00 0.00 H new ATOM 1023 N PRO A 275 -6.651 -18.294 2.550 1.00 0.00 N ATOM 1024 CA PRO A 275 -7.241 -19.523 2.001 1.00 0.00 C ATOM 1025 C PRO A 275 -6.674 -19.948 0.641 1.00 0.00 C ATOM 1026 O PRO A 275 -6.863 -19.254 -0.372 1.00 0.00 O ATOM 1027 CB PRO A 275 -8.740 -19.197 1.883 1.00 0.00 C ATOM 1028 CG PRO A 275 -8.834 -17.710 1.985 1.00 0.00 C ATOM 1029 CD PRO A 275 -7.674 -17.271 2.825 1.00 0.00 C ATOM 0 HA PRO A 275 -7.018 -20.370 2.649 1.00 0.00 H new ATOM 0 HB2 PRO A 275 -9.145 -19.552 0.935 1.00 0.00 H new ATOM 0 HB3 PRO A 275 -9.311 -19.682 2.675 1.00 0.00 H new ATOM 0 HG2 PRO A 275 -8.795 -17.250 0.998 1.00 0.00 H new ATOM 0 HG3 PRO A 275 -9.778 -17.411 2.440 1.00 0.00 H new ATOM 0 HD2 PRO A 275 -7.331 -16.274 2.548 1.00 0.00 H new ATOM 0 HD3 PRO A 275 -7.934 -17.236 3.883 1.00 0.00 H new ATOM 1037 N GLY A 276 -6.010 -21.130 0.657 1.00 0.00 N ATOM 1038 CA GLY A 276 -5.401 -21.769 -0.518 1.00 0.00 C ATOM 1039 C GLY A 276 -4.802 -20.798 -1.510 1.00 0.00 C ATOM 1040 O GLY A 276 -5.153 -20.831 -2.692 1.00 0.00 O ATOM 0 H GLY A 276 -5.885 -21.672 1.512 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -4.623 -22.455 -0.182 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -6.157 -22.368 -1.025 1.00 0.00 H new ATOM 1044 N LEU A 277 -3.906 -19.951 -1.068 1.00 0.00 N ATOM 1045 CA LEU A 277 -3.433 -18.920 -1.948 1.00 0.00 C ATOM 1046 C LEU A 277 -1.964 -19.104 -2.347 1.00 0.00 C ATOM 1047 O LEU A 277 -1.639 -19.104 -3.550 1.00 0.00 O ATOM 1048 CB LEU A 277 -3.682 -17.559 -1.207 1.00 0.00 C ATOM 1049 CG LEU A 277 -3.160 -16.240 -1.804 1.00 0.00 C ATOM 1050 CD1 LEU A 277 -1.643 -16.055 -1.616 1.00 0.00 C ATOM 1051 CD2 LEU A 277 -3.554 -16.140 -3.258 1.00 0.00 C ATOM 0 H LEU A 277 -3.501 -19.954 -0.132 1.00 0.00 H new ATOM 0 HA LEU A 277 -3.972 -18.953 -2.895 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -4.760 -17.452 -1.083 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -3.254 -17.653 -0.209 1.00 0.00 H new ATOM 0 HG LEU A 277 -3.628 -15.424 -1.253 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -1.335 -15.107 -2.057 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -1.406 -16.054 -0.552 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -1.113 -16.873 -2.105 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -3.181 -15.204 -3.673 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -3.126 -16.977 -3.809 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -4.640 -16.167 -3.343 1.00 0.00 H new ATOM 1063 N GLY A 278 -1.094 -19.275 -1.386 1.00 0.00 N ATOM 1064 CA GLY A 278 0.291 -19.447 -1.711 1.00 0.00 C ATOM 1065 C GLY A 278 1.188 -19.165 -0.532 1.00 0.00 C ATOM 1066 O GLY A 278 1.182 -18.039 -0.029 1.00 0.00 O ATOM 0 H GLY A 278 -1.317 -19.298 -0.391 1.00 0.00 H new ATOM 0 HA2 GLY A 278 0.458 -20.467 -2.058 1.00 0.00 H new ATOM 0 HA3 GLY A 278 0.555 -18.783 -2.534 1.00 0.00 H new ATOM 1070 N PRO A 279 1.968 -20.114 -0.049 1.00 0.00 N ATOM 1071 CA PRO A 279 2.888 -19.842 1.045 1.00 0.00 C ATOM 1072 C PRO A 279 4.098 -19.000 0.579 1.00 0.00 C ATOM 1073 O PRO A 279 4.604 -18.128 1.315 1.00 0.00 O ATOM 1074 CB PRO A 279 3.328 -21.230 1.502 1.00 0.00 C ATOM 1075 CG PRO A 279 3.164 -22.091 0.290 1.00 0.00 C ATOM 1076 CD PRO A 279 1.989 -21.532 -0.460 1.00 0.00 C ATOM 0 HA PRO A 279 2.425 -19.259 1.841 1.00 0.00 H new ATOM 0 HB2 PRO A 279 4.361 -21.225 1.849 1.00 0.00 H new ATOM 0 HB3 PRO A 279 2.716 -21.588 2.330 1.00 0.00 H new ATOM 0 HG2 PRO A 279 4.064 -22.074 -0.325 1.00 0.00 H new ATOM 0 HG3 PRO A 279 2.989 -23.130 0.570 1.00 0.00 H new ATOM 0 HD2 PRO A 279 2.113 -21.637 -1.538 1.00 0.00 H new ATOM 0 HD3 PRO A 279 1.063 -22.042 -0.195 1.00 0.00 H new ATOM 1084 N GLN A 280 4.521 -19.207 -0.662 1.00 0.00 N ATOM 1085 CA GLN A 280 5.659 -18.497 -1.178 1.00 0.00 C ATOM 1086 C GLN A 280 5.261 -17.069 -1.462 1.00 0.00 C ATOM 1087 O GLN A 280 6.083 -16.170 -1.373 1.00 0.00 O ATOM 1088 CB GLN A 280 6.227 -19.159 -2.429 1.00 0.00 C ATOM 1089 CG GLN A 280 7.600 -18.639 -2.858 1.00 0.00 C ATOM 1090 CD GLN A 280 8.672 -18.790 -1.789 1.00 0.00 C ATOM 1091 OE1 GLN A 280 8.619 -19.680 -0.940 1.00 0.00 O ATOM 1092 NE2 GLN A 280 9.678 -17.971 -1.858 1.00 0.00 N ATOM 0 H GLN A 280 4.089 -19.858 -1.317 1.00 0.00 H new ATOM 0 HA GLN A 280 6.449 -18.518 -0.427 1.00 0.00 H new ATOM 0 HB2 GLN A 280 6.298 -20.233 -2.255 1.00 0.00 H new ATOM 0 HB3 GLN A 280 5.526 -19.015 -3.251 1.00 0.00 H new ATOM 0 HG2 GLN A 280 7.916 -19.171 -3.755 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.512 -17.586 -3.126 1.00 0.00 H new ATOM 0 HE21 GLN A 280 9.695 -17.243 -2.572 1.00 0.00 H new ATOM 0 HE22 GLN A 280 10.451 -18.056 -1.198 1.00 0.00 H new ATOM 1101 N LYS A 281 3.973 -16.853 -1.752 1.00 0.00 N ATOM 1102 CA LYS A 281 3.472 -15.502 -1.985 1.00 0.00 C ATOM 1103 C LYS A 281 3.686 -14.675 -0.743 1.00 0.00 C ATOM 1104 O LYS A 281 4.156 -13.555 -0.820 1.00 0.00 O ATOM 1105 CB LYS A 281 1.985 -15.473 -2.369 1.00 0.00 C ATOM 1106 CG LYS A 281 1.614 -16.317 -3.580 1.00 0.00 C ATOM 1107 CD LYS A 281 2.559 -16.093 -4.741 1.00 0.00 C ATOM 1108 CE LYS A 281 2.108 -16.848 -5.972 1.00 0.00 C ATOM 1109 NZ LYS A 281 0.976 -16.189 -6.640 1.00 0.00 N ATOM 0 H LYS A 281 3.270 -17.588 -1.829 1.00 0.00 H new ATOM 0 HA LYS A 281 4.027 -15.090 -2.828 1.00 0.00 H new ATOM 0 HB2 LYS A 281 1.399 -15.813 -1.515 1.00 0.00 H new ATOM 0 HB3 LYS A 281 1.696 -14.440 -2.563 1.00 0.00 H new ATOM 0 HG2 LYS A 281 1.624 -17.371 -3.303 1.00 0.00 H new ATOM 0 HG3 LYS A 281 0.597 -16.078 -3.890 1.00 0.00 H new ATOM 0 HD2 LYS A 281 2.616 -15.028 -4.966 1.00 0.00 H new ATOM 0 HD3 LYS A 281 3.563 -16.414 -4.463 1.00 0.00 H new ATOM 0 HE2 LYS A 281 2.941 -16.933 -6.670 1.00 0.00 H new ATOM 0 HE3 LYS A 281 1.823 -17.862 -5.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 0.580 -16.825 -7.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 0.243 -15.962 -5.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 1.303 -15.313 -7.094 1.00 0.00 H new ATOM 1123 N ALA A 282 3.407 -15.283 0.403 1.00 0.00 N ATOM 1124 CA ALA A 282 3.596 -14.677 1.702 1.00 0.00 C ATOM 1125 C ALA A 282 5.047 -14.274 1.900 1.00 0.00 C ATOM 1126 O ALA A 282 5.342 -13.191 2.418 1.00 0.00 O ATOM 1127 CB ALA A 282 3.204 -15.672 2.756 1.00 0.00 C ATOM 0 H ALA A 282 3.035 -16.232 0.449 1.00 0.00 H new ATOM 0 HA ALA A 282 2.978 -13.782 1.775 1.00 0.00 H new ATOM 0 HB1 ALA A 282 3.341 -15.230 3.743 1.00 0.00 H new ATOM 0 HB2 ALA A 282 2.158 -15.948 2.624 1.00 0.00 H new ATOM 0 HB3 ALA A 282 3.828 -16.561 2.667 1.00 0.00 H new ATOM 1133 N ARG A 283 5.947 -15.144 1.464 1.00 0.00 N ATOM 1134 CA ARG A 283 7.385 -14.895 1.565 1.00 0.00 C ATOM 1135 C ARG A 283 7.764 -13.644 0.757 1.00 0.00 C ATOM 1136 O ARG A 283 8.537 -12.797 1.208 1.00 0.00 O ATOM 1137 CB ARG A 283 8.174 -16.085 0.996 1.00 0.00 C ATOM 1138 CG ARG A 283 7.777 -17.453 1.530 1.00 0.00 C ATOM 1139 CD ARG A 283 7.965 -17.593 3.029 1.00 0.00 C ATOM 1140 NE ARG A 283 9.351 -17.369 3.455 1.00 0.00 N ATOM 1141 CZ ARG A 283 10.014 -18.135 4.329 1.00 0.00 C ATOM 1142 NH1 ARG A 283 9.482 -19.275 4.764 1.00 0.00 N ATOM 1143 NH2 ARG A 283 11.213 -17.776 4.742 1.00 0.00 N ATOM 0 H ARG A 283 5.708 -16.037 1.033 1.00 0.00 H new ATOM 0 HA ARG A 283 7.628 -14.753 2.618 1.00 0.00 H new ATOM 0 HB2 ARG A 283 8.058 -16.090 -0.088 1.00 0.00 H new ATOM 0 HB3 ARG A 283 9.233 -15.928 1.202 1.00 0.00 H new ATOM 0 HG2 ARG A 283 6.732 -17.642 1.283 1.00 0.00 H new ATOM 0 HG3 ARG A 283 8.367 -18.217 1.024 1.00 0.00 H new ATOM 0 HD2 ARG A 283 7.314 -16.883 3.539 1.00 0.00 H new ATOM 0 HD3 ARG A 283 7.652 -18.591 3.338 1.00 0.00 H new ATOM 0 HE ARG A 283 9.845 -16.571 3.056 1.00 0.00 H new ATOM 0 HH11 ARG A 283 8.564 -19.569 4.431 1.00 0.00 H new ATOM 0 HH12 ARG A 283 9.993 -19.854 5.430 1.00 0.00 H new ATOM 0 HH21 ARG A 283 11.635 -16.915 4.395 1.00 0.00 H new ATOM 0 HH22 ARG A 283 11.719 -18.360 5.408 1.00 0.00 H new ATOM 1157 N ARG A 284 7.176 -13.528 -0.418 1.00 0.00 N ATOM 1158 CA ARG A 284 7.509 -12.468 -1.358 1.00 0.00 C ATOM 1159 C ARG A 284 6.802 -11.155 -0.986 1.00 0.00 C ATOM 1160 O ARG A 284 7.305 -10.071 -1.264 1.00 0.00 O ATOM 1161 CB ARG A 284 7.162 -12.914 -2.780 1.00 0.00 C ATOM 1162 CG ARG A 284 7.656 -14.332 -3.119 1.00 0.00 C ATOM 1163 CD ARG A 284 9.170 -14.496 -3.003 1.00 0.00 C ATOM 1164 NE ARG A 284 9.894 -13.865 -4.104 1.00 0.00 N ATOM 1165 CZ ARG A 284 11.066 -13.220 -3.999 1.00 0.00 C ATOM 1166 NH1 ARG A 284 11.621 -13.001 -2.808 1.00 0.00 N ATOM 1167 NH2 ARG A 284 11.681 -12.800 -5.095 1.00 0.00 N ATOM 0 H ARG A 284 6.453 -14.165 -0.751 1.00 0.00 H new ATOM 0 HA ARG A 284 8.581 -12.274 -1.310 1.00 0.00 H new ATOM 0 HB2 ARG A 284 6.081 -12.874 -2.911 1.00 0.00 H new ATOM 0 HB3 ARG A 284 7.595 -12.208 -3.489 1.00 0.00 H new ATOM 0 HG2 ARG A 284 7.170 -15.046 -2.454 1.00 0.00 H new ATOM 0 HG3 ARG A 284 7.349 -14.582 -4.135 1.00 0.00 H new ATOM 0 HD2 ARG A 284 9.506 -14.066 -2.059 1.00 0.00 H new ATOM 0 HD3 ARG A 284 9.415 -15.558 -2.975 1.00 0.00 H new ATOM 0 HE ARG A 284 9.473 -13.919 -5.031 1.00 0.00 H new ATOM 0 HH11 ARG A 284 11.155 -13.325 -1.961 1.00 0.00 H new ATOM 0 HH12 ARG A 284 12.512 -12.509 -2.743 1.00 0.00 H new ATOM 0 HH21 ARG A 284 11.263 -12.968 -6.010 1.00 0.00 H new ATOM 0 HH22 ARG A 284 12.572 -12.309 -5.023 1.00 0.00 H new ATOM 1181 N LEU A 285 5.632 -11.270 -0.392 1.00 0.00 N ATOM 1182 CA LEU A 285 4.910 -10.128 0.151 1.00 0.00 C ATOM 1183 C LEU A 285 5.711 -9.485 1.253 1.00 0.00 C ATOM 1184 O LEU A 285 6.032 -8.313 1.183 1.00 0.00 O ATOM 1185 CB LEU A 285 3.553 -10.568 0.688 1.00 0.00 C ATOM 1186 CG LEU A 285 2.453 -10.765 -0.346 1.00 0.00 C ATOM 1187 CD1 LEU A 285 1.392 -11.694 0.200 1.00 0.00 C ATOM 1188 CD2 LEU A 285 1.817 -9.417 -0.665 1.00 0.00 C ATOM 0 H LEU A 285 5.149 -12.160 -0.270 1.00 0.00 H new ATOM 0 HA LEU A 285 4.756 -9.402 -0.648 1.00 0.00 H new ATOM 0 HB2 LEU A 285 3.686 -11.505 1.229 1.00 0.00 H new ATOM 0 HB3 LEU A 285 3.214 -9.827 1.412 1.00 0.00 H new ATOM 0 HG LEU A 285 2.884 -11.199 -1.249 1.00 0.00 H new ATOM 0 HD11 LEU A 285 0.609 -11.830 -0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 285 1.840 -12.659 0.436 1.00 0.00 H new ATOM 0 HD13 LEU A 285 0.962 -11.263 1.104 1.00 0.00 H new ATOM 0 HD21 LEU A 285 1.028 -9.553 -1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 285 1.392 -8.991 0.244 1.00 0.00 H new ATOM 0 HD23 LEU A 285 2.575 -8.742 -1.062 1.00 0.00 H new ATOM 1200 N PHE A 286 6.094 -10.294 2.235 1.00 0.00 N ATOM 1201 CA PHE A 286 6.874 -9.835 3.386 1.00 0.00 C ATOM 1202 C PHE A 286 8.197 -9.225 2.894 1.00 0.00 C ATOM 1203 O PHE A 286 8.726 -8.254 3.468 1.00 0.00 O ATOM 1204 CB PHE A 286 7.154 -11.034 4.293 1.00 0.00 C ATOM 1205 CG PHE A 286 7.613 -10.683 5.669 1.00 0.00 C ATOM 1206 CD1 PHE A 286 6.691 -10.471 6.667 1.00 0.00 C ATOM 1207 CD2 PHE A 286 8.956 -10.585 5.971 1.00 0.00 C ATOM 1208 CE1 PHE A 286 7.092 -10.169 7.938 1.00 0.00 C ATOM 1209 CE2 PHE A 286 9.370 -10.279 7.244 1.00 0.00 C ATOM 1210 CZ PHE A 286 8.435 -10.070 8.233 1.00 0.00 C ATOM 0 H PHE A 286 5.873 -11.290 2.258 1.00 0.00 H new ATOM 0 HA PHE A 286 6.321 -9.077 3.941 1.00 0.00 H new ATOM 0 HB2 PHE A 286 6.247 -11.634 4.369 1.00 0.00 H new ATOM 0 HB3 PHE A 286 7.911 -11.660 3.821 1.00 0.00 H new ATOM 0 HD1 PHE A 286 5.637 -10.544 6.444 1.00 0.00 H new ATOM 0 HD2 PHE A 286 9.690 -10.751 5.197 1.00 0.00 H new ATOM 0 HE1 PHE A 286 6.356 -10.008 8.712 1.00 0.00 H new ATOM 0 HE2 PHE A 286 10.424 -10.203 7.468 1.00 0.00 H new ATOM 0 HZ PHE A 286 8.753 -9.829 9.237 1.00 0.00 H new ATOM 1220 N ASP A 287 8.692 -9.794 1.807 1.00 0.00 N ATOM 1221 CA ASP A 287 9.916 -9.357 1.164 1.00 0.00 C ATOM 1222 C ASP A 287 9.778 -7.918 0.720 1.00 0.00 C ATOM 1223 O ASP A 287 10.512 -7.077 1.183 1.00 0.00 O ATOM 1224 CB ASP A 287 10.160 -10.220 -0.060 1.00 0.00 C ATOM 1225 CG ASP A 287 11.489 -10.013 -0.724 1.00 0.00 C ATOM 1226 OD1 ASP A 287 12.533 -10.222 -0.073 1.00 0.00 O ATOM 1227 OD2 ASP A 287 11.511 -9.738 -1.928 1.00 0.00 O ATOM 0 H ASP A 287 8.246 -10.584 1.341 1.00 0.00 H new ATOM 0 HA ASP A 287 10.745 -9.444 1.867 1.00 0.00 H new ATOM 0 HB2 ASP A 287 10.074 -11.267 0.229 1.00 0.00 H new ATOM 0 HB3 ASP A 287 9.372 -10.024 -0.788 1.00 0.00 H new ATOM 1232 N VAL A 288 8.734 -7.619 -0.070 1.00 0.00 N ATOM 1233 CA VAL A 288 8.553 -6.260 -0.594 1.00 0.00 C ATOM 1234 C VAL A 288 8.122 -5.294 0.491 1.00 0.00 C ATOM 1235 O VAL A 288 8.425 -4.121 0.434 1.00 0.00 O ATOM 1236 CB VAL A 288 7.568 -6.164 -1.791 1.00 0.00 C ATOM 1237 CG1 VAL A 288 7.993 -7.072 -2.931 1.00 0.00 C ATOM 1238 CG2 VAL A 288 6.144 -6.439 -1.375 1.00 0.00 C ATOM 0 H VAL A 288 8.017 -8.286 -0.354 1.00 0.00 H new ATOM 0 HA VAL A 288 9.538 -5.979 -0.968 1.00 0.00 H new ATOM 0 HB VAL A 288 7.604 -5.136 -2.152 1.00 0.00 H new ATOM 0 HG11 VAL A 288 7.283 -6.981 -3.753 1.00 0.00 H new ATOM 0 HG12 VAL A 288 8.986 -6.783 -3.276 1.00 0.00 H new ATOM 0 HG13 VAL A 288 8.016 -8.105 -2.584 1.00 0.00 H new ATOM 0 HG21 VAL A 288 5.490 -6.361 -2.243 1.00 0.00 H new ATOM 0 HG22 VAL A 288 6.074 -7.443 -0.957 1.00 0.00 H new ATOM 0 HG23 VAL A 288 5.838 -5.711 -0.623 1.00 0.00 H new ATOM 1248 N LEU A 289 7.432 -5.806 1.494 1.00 0.00 N ATOM 1249 CA LEU A 289 6.965 -4.986 2.594 1.00 0.00 C ATOM 1250 C LEU A 289 8.132 -4.479 3.425 1.00 0.00 C ATOM 1251 O LEU A 289 8.027 -3.437 4.063 1.00 0.00 O ATOM 1252 CB LEU A 289 5.958 -5.760 3.467 1.00 0.00 C ATOM 1253 CG LEU A 289 4.652 -6.176 2.774 1.00 0.00 C ATOM 1254 CD1 LEU A 289 3.819 -7.048 3.686 1.00 0.00 C ATOM 1255 CD2 LEU A 289 3.852 -4.958 2.339 1.00 0.00 C ATOM 0 H LEU A 289 7.182 -6.792 1.568 1.00 0.00 H new ATOM 0 HA LEU A 289 6.450 -4.121 2.177 1.00 0.00 H new ATOM 0 HB2 LEU A 289 6.448 -6.657 3.845 1.00 0.00 H new ATOM 0 HB3 LEU A 289 5.708 -5.145 4.332 1.00 0.00 H new ATOM 0 HG LEU A 289 4.914 -6.749 1.885 1.00 0.00 H new ATOM 0 HD11 LEU A 289 2.898 -7.332 3.177 1.00 0.00 H new ATOM 0 HD12 LEU A 289 4.382 -7.945 3.946 1.00 0.00 H new ATOM 0 HD13 LEU A 289 3.576 -6.497 4.594 1.00 0.00 H new ATOM 0 HD21 LEU A 289 2.933 -5.282 1.851 1.00 0.00 H new ATOM 0 HD22 LEU A 289 3.606 -4.353 3.212 1.00 0.00 H new ATOM 0 HD23 LEU A 289 4.443 -4.365 1.641 1.00 0.00 H new ATOM 1267 N HIS A 290 9.252 -5.210 3.386 1.00 0.00 N ATOM 1268 CA HIS A 290 10.436 -4.828 4.144 1.00 0.00 C ATOM 1269 C HIS A 290 11.583 -4.370 3.244 1.00 0.00 C ATOM 1270 O HIS A 290 12.608 -3.871 3.736 1.00 0.00 O ATOM 1271 CB HIS A 290 10.900 -5.948 5.088 1.00 0.00 C ATOM 1272 CG HIS A 290 10.028 -6.159 6.301 1.00 0.00 C ATOM 1273 ND1 HIS A 290 10.503 -6.146 7.597 1.00 0.00 N ATOM 1274 CD2 HIS A 290 8.698 -6.415 6.402 1.00 0.00 C ATOM 1275 CE1 HIS A 290 9.482 -6.385 8.417 1.00 0.00 C ATOM 1276 NE2 HIS A 290 8.359 -6.554 7.746 1.00 0.00 N ATOM 0 H HIS A 290 9.358 -6.064 2.839 1.00 0.00 H new ATOM 0 HA HIS A 290 10.140 -3.975 4.755 1.00 0.00 H new ATOM 0 HB2 HIS A 290 10.947 -6.881 4.526 1.00 0.00 H new ATOM 0 HB3 HIS A 290 11.914 -5.725 5.422 1.00 0.00 H new ATOM 0 HD2 HIS A 290 8.012 -6.498 5.572 1.00 0.00 H new ATOM 0 HE1 HIS A 290 9.563 -6.434 9.493 1.00 0.00 H new ATOM 0 HE2 HIS A 290 7.434 -6.746 8.131 1.00 0.00 H new ATOM 1284 N GLU A 291 11.417 -4.538 1.947 1.00 0.00 N ATOM 1285 CA GLU A 291 12.384 -4.107 0.982 1.00 0.00 C ATOM 1286 C GLU A 291 12.308 -2.607 0.815 1.00 0.00 C ATOM 1287 O GLU A 291 11.219 -2.041 0.669 1.00 0.00 O ATOM 1288 CB GLU A 291 12.173 -4.783 -0.387 1.00 0.00 C ATOM 1289 CG GLU A 291 12.762 -6.166 -0.564 1.00 0.00 C ATOM 1290 CD GLU A 291 12.679 -6.633 -2.007 1.00 0.00 C ATOM 1291 OE1 GLU A 291 11.604 -6.524 -2.642 1.00 0.00 O ATOM 1292 OE2 GLU A 291 13.717 -7.072 -2.559 1.00 0.00 O ATOM 0 H GLU A 291 10.595 -4.983 1.539 1.00 0.00 H new ATOM 0 HA GLU A 291 13.367 -4.396 1.353 1.00 0.00 H new ATOM 0 HB2 GLU A 291 11.101 -4.844 -0.574 1.00 0.00 H new ATOM 0 HB3 GLU A 291 12.594 -4.134 -1.155 1.00 0.00 H new ATOM 0 HG2 GLU A 291 13.804 -6.162 -0.243 1.00 0.00 H new ATOM 0 HG3 GLU A 291 12.233 -6.871 0.077 1.00 0.00 H new ATOM 1299 N PRO A 292 13.445 -1.933 0.877 1.00 0.00 N ATOM 1300 CA PRO A 292 13.492 -0.526 0.646 1.00 0.00 C ATOM 1301 C PRO A 292 13.181 -0.228 -0.801 1.00 0.00 C ATOM 1302 O PRO A 292 13.487 -1.046 -1.693 1.00 0.00 O ATOM 1303 CB PRO A 292 14.928 -0.108 0.942 1.00 0.00 C ATOM 1304 CG PRO A 292 15.673 -1.336 1.320 1.00 0.00 C ATOM 1305 CD PRO A 292 14.753 -2.508 1.189 1.00 0.00 C ATOM 0 HA PRO A 292 12.769 0.004 1.266 1.00 0.00 H new ATOM 0 HB2 PRO A 292 15.380 0.363 0.069 1.00 0.00 H new ATOM 0 HB3 PRO A 292 14.957 0.624 1.749 1.00 0.00 H new ATOM 0 HG2 PRO A 292 16.544 -1.464 0.677 1.00 0.00 H new ATOM 0 HG3 PRO A 292 16.041 -1.256 2.343 1.00 0.00 H new ATOM 0 HD2 PRO A 292 15.085 -3.183 0.400 1.00 0.00 H new ATOM 0 HD3 PRO A 292 14.719 -3.087 2.112 1.00 0.00 H new ATOM 1313 N PHE A 293 12.606 0.931 -1.055 1.00 0.00 N ATOM 1314 CA PHE A 293 12.274 1.311 -2.420 1.00 0.00 C ATOM 1315 C PHE A 293 13.569 1.503 -3.208 1.00 0.00 C ATOM 1316 O PHE A 293 13.647 1.202 -4.388 1.00 0.00 O ATOM 1317 CB PHE A 293 11.454 2.611 -2.465 1.00 0.00 C ATOM 1318 CG PHE A 293 10.366 2.696 -1.429 1.00 0.00 C ATOM 1319 CD1 PHE A 293 9.311 1.816 -1.442 1.00 0.00 C ATOM 1320 CD2 PHE A 293 10.401 3.677 -0.453 1.00 0.00 C ATOM 1321 CE1 PHE A 293 8.310 1.905 -0.506 1.00 0.00 C ATOM 1322 CE2 PHE A 293 9.402 3.772 0.492 1.00 0.00 C ATOM 1323 CZ PHE A 293 8.352 2.885 0.463 1.00 0.00 C ATOM 0 H PHE A 293 12.360 1.621 -0.345 1.00 0.00 H new ATOM 0 HA PHE A 293 11.668 0.518 -2.859 1.00 0.00 H new ATOM 0 HB2 PHE A 293 12.129 3.457 -2.335 1.00 0.00 H new ATOM 0 HB3 PHE A 293 11.006 2.710 -3.454 1.00 0.00 H new ATOM 0 HD1 PHE A 293 9.268 1.045 -2.197 1.00 0.00 H new ATOM 0 HD2 PHE A 293 11.223 4.378 -0.432 1.00 0.00 H new ATOM 0 HE1 PHE A 293 7.488 1.205 -0.529 1.00 0.00 H new ATOM 0 HE2 PHE A 293 9.444 4.539 1.251 1.00 0.00 H new ATOM 0 HZ PHE A 293 7.563 2.956 1.197 1.00 0.00 H new ATOM 1333 N LEU A 294 14.598 1.922 -2.486 1.00 0.00 N ATOM 1334 CA LEU A 294 15.915 2.226 -3.041 1.00 0.00 C ATOM 1335 C LEU A 294 16.757 0.954 -3.176 1.00 0.00 C ATOM 1336 O LEU A 294 17.917 1.022 -3.573 1.00 0.00 O ATOM 1337 CB LEU A 294 16.654 3.159 -2.080 1.00 0.00 C ATOM 1338 CG LEU A 294 15.896 4.392 -1.578 1.00 0.00 C ATOM 1339 CD1 LEU A 294 16.730 5.128 -0.542 1.00 0.00 C ATOM 1340 CD2 LEU A 294 15.543 5.319 -2.727 1.00 0.00 C ATOM 0 H LEU A 294 14.543 2.064 -1.477 1.00 0.00 H new ATOM 0 HA LEU A 294 15.775 2.683 -4.021 1.00 0.00 H new ATOM 0 HB2 LEU A 294 16.961 2.575 -1.212 1.00 0.00 H new ATOM 0 HB3 LEU A 294 17.564 3.500 -2.573 1.00 0.00 H new ATOM 0 HG LEU A 294 14.966 4.060 -1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 294 16.184 6.003 -0.190 1.00 0.00 H new ATOM 0 HD12 LEU A 294 16.933 4.465 0.299 1.00 0.00 H new ATOM 0 HD13 LEU A 294 17.672 5.444 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 294 15.006 6.186 -2.343 1.00 0.00 H new ATOM 0 HD22 LEU A 294 16.456 5.648 -3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 294 14.913 4.789 -3.442 1.00 0.00 H new ATOM 1352 N LYS A 295 16.186 -0.191 -2.760 1.00 0.00 N ATOM 1353 CA LYS A 295 16.843 -1.523 -2.765 1.00 0.00 C ATOM 1354 C LYS A 295 17.890 -1.630 -1.654 1.00 0.00 C ATOM 1355 O LYS A 295 17.906 -2.590 -0.891 1.00 0.00 O ATOM 1356 CB LYS A 295 17.482 -1.878 -4.129 1.00 0.00 C ATOM 1357 CG LYS A 295 18.011 -3.316 -4.206 1.00 0.00 C ATOM 1358 CD LYS A 295 18.817 -3.570 -5.472 1.00 0.00 C ATOM 1359 CE LYS A 295 20.143 -2.830 -5.434 1.00 0.00 C ATOM 1360 NZ LYS A 295 20.943 -3.033 -6.656 1.00 0.00 N ATOM 0 H LYS A 295 15.232 -0.223 -2.401 1.00 0.00 H new ATOM 0 HA LYS A 295 16.049 -2.247 -2.581 1.00 0.00 H new ATOM 0 HB2 LYS A 295 16.743 -1.729 -4.916 1.00 0.00 H new ATOM 0 HB3 LYS A 295 18.302 -1.187 -4.327 1.00 0.00 H new ATOM 0 HG2 LYS A 295 18.634 -3.518 -3.335 1.00 0.00 H new ATOM 0 HG3 LYS A 295 17.173 -4.011 -4.166 1.00 0.00 H new ATOM 0 HD2 LYS A 295 18.997 -4.639 -5.584 1.00 0.00 H new ATOM 0 HD3 LYS A 295 18.244 -3.250 -6.342 1.00 0.00 H new ATOM 0 HE2 LYS A 295 19.956 -1.765 -5.300 1.00 0.00 H new ATOM 0 HE3 LYS A 295 20.716 -3.164 -4.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 21.837 -2.507 -6.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 21.147 -4.046 -6.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 20.410 -2.690 -7.481 1.00 0.00 H new ATOM 1720 N TYR B 833 16.548 0.366 -7.679 1.00 0.00 N ATOM 1721 CA TYR B 833 15.233 0.559 -7.130 1.00 0.00 C ATOM 1722 C TYR B 833 14.493 -0.741 -7.188 1.00 0.00 C ATOM 1723 O TYR B 833 14.481 -1.401 -8.233 1.00 0.00 O ATOM 1724 CB TYR B 833 14.446 1.670 -7.857 1.00 0.00 C ATOM 1725 CG TYR B 833 14.809 3.075 -7.458 1.00 0.00 C ATOM 1726 CD1 TYR B 833 15.812 3.761 -8.107 1.00 0.00 C ATOM 1727 CD2 TYR B 833 14.136 3.722 -6.429 1.00 0.00 C ATOM 1728 CE1 TYR B 833 16.139 5.044 -7.746 1.00 0.00 C ATOM 1729 CE2 TYR B 833 14.467 5.009 -6.069 1.00 0.00 C ATOM 1730 CZ TYR B 833 15.473 5.660 -6.738 1.00 0.00 C ATOM 1731 OH TYR B 833 15.815 6.945 -6.396 1.00 0.00 O ATOM 0 HA TYR B 833 15.337 0.887 -6.096 1.00 0.00 H new ATOM 0 HB2 TYR B 833 14.602 1.562 -8.930 1.00 0.00 H new ATOM 0 HB3 TYR B 833 13.382 1.520 -7.673 1.00 0.00 H new ATOM 0 HD1 TYR B 833 16.349 3.282 -8.912 1.00 0.00 H new ATOM 0 HD2 TYR B 833 13.343 3.209 -5.905 1.00 0.00 H new ATOM 0 HE1 TYR B 833 16.929 5.565 -8.266 1.00 0.00 H new ATOM 0 HE2 TYR B 833 13.939 5.502 -5.266 1.00 0.00 H new ATOM 0 HH TYR B 833 16.364 7.337 -7.106 1.00 0.00 H new ATOM 1741 N ASN B 834 13.913 -1.121 -6.083 1.00 0.00 N ATOM 1742 CA ASN B 834 13.160 -2.360 -5.998 1.00 0.00 C ATOM 1743 C ASN B 834 11.787 -2.166 -6.565 1.00 0.00 C ATOM 1744 O ASN B 834 10.992 -1.391 -6.012 1.00 0.00 O ATOM 1745 CB ASN B 834 13.069 -2.883 -4.568 1.00 0.00 C ATOM 1746 CG ASN B 834 14.270 -3.674 -4.129 1.00 0.00 C ATOM 1747 OD1 ASN B 834 14.938 -4.320 -4.932 1.00 0.00 O ATOM 1748 ND2 ASN B 834 14.546 -3.650 -2.857 1.00 0.00 N ATOM 0 H ASN B 834 13.944 -0.588 -5.214 1.00 0.00 H new ATOM 0 HA ASN B 834 13.695 -3.108 -6.583 1.00 0.00 H new ATOM 0 HB2 ASN B 834 12.935 -2.039 -3.891 1.00 0.00 H new ATOM 0 HB3 ASN B 834 12.181 -3.509 -4.477 1.00 0.00 H new ATOM 0 HD21 ASN B 834 15.340 -4.180 -2.497 1.00 0.00 H new ATOM 0 HD22 ASN B 834 13.968 -3.102 -2.220 1.00 0.00 H new ATOM 1755 N PRO B 835 11.472 -2.872 -7.666 1.00 0.00 N ATOM 1756 CA PRO B 835 10.215 -2.698 -8.390 1.00 0.00 C ATOM 1757 C PRO B 835 8.982 -2.986 -7.548 1.00 0.00 C ATOM 1758 O PRO B 835 7.990 -2.263 -7.642 1.00 0.00 O ATOM 1759 CB PRO B 835 10.314 -3.676 -9.572 1.00 0.00 C ATOM 1760 CG PRO B 835 11.380 -4.647 -9.188 1.00 0.00 C ATOM 1761 CD PRO B 835 12.332 -3.901 -8.301 1.00 0.00 C ATOM 0 HA PRO B 835 10.090 -1.660 -8.698 1.00 0.00 H new ATOM 0 HB2 PRO B 835 9.364 -4.182 -9.745 1.00 0.00 H new ATOM 0 HB3 PRO B 835 10.570 -3.154 -10.494 1.00 0.00 H new ATOM 0 HG2 PRO B 835 10.955 -5.505 -8.667 1.00 0.00 H new ATOM 0 HG3 PRO B 835 11.891 -5.031 -10.070 1.00 0.00 H new ATOM 0 HD2 PRO B 835 12.789 -4.557 -7.560 1.00 0.00 H new ATOM 0 HD3 PRO B 835 13.144 -3.450 -8.871 1.00 0.00 H new ATOM 1769 N GLY B 836 9.054 -4.012 -6.723 1.00 0.00 N ATOM 1770 CA GLY B 836 7.930 -4.401 -5.901 1.00 0.00 C ATOM 1771 C GLY B 836 7.509 -3.329 -4.909 1.00 0.00 C ATOM 1772 O GLY B 836 6.464 -2.710 -5.081 1.00 0.00 O ATOM 0 H GLY B 836 9.884 -4.593 -6.605 1.00 0.00 H new ATOM 0 HA2 GLY B 836 7.084 -4.642 -6.545 1.00 0.00 H new ATOM 0 HA3 GLY B 836 8.185 -5.310 -5.356 1.00 0.00 H new ATOM 1776 N PRO B 837 8.325 -3.046 -3.886 1.00 0.00 N ATOM 1777 CA PRO B 837 7.961 -2.108 -2.836 1.00 0.00 C ATOM 1778 C PRO B 837 7.791 -0.682 -3.313 1.00 0.00 C ATOM 1779 O PRO B 837 6.961 0.050 -2.754 1.00 0.00 O ATOM 1780 CB PRO B 837 9.089 -2.197 -1.831 1.00 0.00 C ATOM 1781 CG PRO B 837 10.234 -2.705 -2.612 1.00 0.00 C ATOM 1782 CD PRO B 837 9.652 -3.620 -3.642 1.00 0.00 C ATOM 0 HA PRO B 837 6.987 -2.371 -2.424 1.00 0.00 H new ATOM 0 HB2 PRO B 837 9.308 -1.224 -1.391 1.00 0.00 H new ATOM 0 HB3 PRO B 837 8.838 -2.869 -1.010 1.00 0.00 H new ATOM 0 HG2 PRO B 837 10.781 -1.887 -3.080 1.00 0.00 H new ATOM 0 HG3 PRO B 837 10.939 -3.235 -1.972 1.00 0.00 H new ATOM 0 HD2 PRO B 837 10.255 -3.641 -4.550 1.00 0.00 H new ATOM 0 HD3 PRO B 837 9.587 -4.646 -3.279 1.00 0.00 H new ATOM 1790 N GLN B 838 8.561 -0.265 -4.340 1.00 0.00 N ATOM 1791 CA GLN B 838 8.409 1.088 -4.838 1.00 0.00 C ATOM 1792 C GLN B 838 7.048 1.197 -5.390 1.00 0.00 C ATOM 1793 O GLN B 838 6.342 2.103 -5.048 1.00 0.00 O ATOM 1794 CB GLN B 838 9.478 1.481 -5.896 1.00 0.00 C ATOM 1795 CG GLN B 838 9.215 0.971 -7.311 1.00 0.00 C ATOM 1796 CD GLN B 838 10.371 1.176 -8.260 1.00 0.00 C ATOM 1797 OE1 GLN B 838 10.577 0.388 -9.166 1.00 0.00 O ATOM 1798 NE2 GLN B 838 11.106 2.237 -8.089 1.00 0.00 N ATOM 0 H GLN B 838 9.264 -0.832 -4.815 1.00 0.00 H new ATOM 0 HA GLN B 838 8.561 1.788 -4.016 1.00 0.00 H new ATOM 0 HB2 GLN B 838 9.552 2.568 -5.927 1.00 0.00 H new ATOM 0 HB3 GLN B 838 10.447 1.105 -5.566 1.00 0.00 H new ATOM 0 HG2 GLN B 838 8.979 -0.092 -7.265 1.00 0.00 H new ATOM 0 HG3 GLN B 838 8.336 1.476 -7.711 1.00 0.00 H new ATOM 0 HE21 GLN B 838 10.907 2.877 -7.320 1.00 0.00 H new ATOM 0 HE22 GLN B 838 11.881 2.428 -8.724 1.00 0.00 H new ATOM 1807 N ASP B 839 6.626 0.169 -6.111 1.00 0.00 N ATOM 1808 CA ASP B 839 5.395 0.231 -6.790 1.00 0.00 C ATOM 1809 C ASP B 839 4.259 0.105 -5.806 1.00 0.00 C ATOM 1810 O ASP B 839 3.244 0.727 -5.973 1.00 0.00 O ATOM 1811 CB ASP B 839 5.305 -0.812 -7.865 1.00 0.00 C ATOM 1812 CG ASP B 839 4.347 -0.413 -8.976 1.00 0.00 C ATOM 1813 OD1 ASP B 839 4.473 0.708 -9.515 1.00 0.00 O ATOM 1814 OD2 ASP B 839 3.479 -1.206 -9.354 1.00 0.00 O ATOM 0 H ASP B 839 7.137 -0.707 -6.225 1.00 0.00 H new ATOM 0 HA ASP B 839 5.322 1.200 -7.283 1.00 0.00 H new ATOM 0 HB2 ASP B 839 6.296 -0.983 -8.286 1.00 0.00 H new ATOM 0 HB3 ASP B 839 4.978 -1.755 -7.427 1.00 0.00 H new ATOM 1819 N PHE B 840 4.478 -0.682 -4.738 1.00 0.00 N ATOM 1820 CA PHE B 840 3.508 -0.853 -3.648 1.00 0.00 C ATOM 1821 C PHE B 840 3.138 0.542 -3.097 1.00 0.00 C ATOM 1822 O PHE B 840 1.970 0.861 -2.892 1.00 0.00 O ATOM 1823 CB PHE B 840 4.142 -1.707 -2.524 1.00 0.00 C ATOM 1824 CG PHE B 840 3.193 -2.660 -1.834 1.00 0.00 C ATOM 1825 CD1 PHE B 840 2.064 -2.206 -1.175 1.00 0.00 C ATOM 1826 CD2 PHE B 840 3.440 -4.029 -1.860 1.00 0.00 C ATOM 1827 CE1 PHE B 840 1.197 -3.095 -0.560 1.00 0.00 C ATOM 1828 CE2 PHE B 840 2.574 -4.918 -1.245 1.00 0.00 C ATOM 1829 CZ PHE B 840 1.453 -4.449 -0.598 1.00 0.00 C ATOM 0 H PHE B 840 5.336 -1.218 -4.608 1.00 0.00 H new ATOM 0 HA PHE B 840 2.614 -1.356 -4.015 1.00 0.00 H new ATOM 0 HB2 PHE B 840 4.967 -2.281 -2.946 1.00 0.00 H new ATOM 0 HB3 PHE B 840 4.569 -1.038 -1.777 1.00 0.00 H new ATOM 0 HD1 PHE B 840 1.856 -1.147 -1.140 1.00 0.00 H new ATOM 0 HD2 PHE B 840 4.318 -4.403 -2.366 1.00 0.00 H new ATOM 0 HE1 PHE B 840 0.319 -2.726 -0.050 1.00 0.00 H new ATOM 0 HE2 PHE B 840 2.778 -5.978 -1.273 1.00 0.00 H new ATOM 0 HZ PHE B 840 0.775 -5.141 -0.121 1.00 0.00 H new ATOM 1839 N LEU B 841 4.165 1.368 -2.918 1.00 0.00 N ATOM 1840 CA LEU B 841 4.021 2.754 -2.479 1.00 0.00 C ATOM 1841 C LEU B 841 3.479 3.648 -3.616 1.00 0.00 C ATOM 1842 O LEU B 841 2.697 4.563 -3.392 1.00 0.00 O ATOM 1843 CB LEU B 841 5.385 3.285 -1.980 1.00 0.00 C ATOM 1844 CG LEU B 841 5.550 4.810 -1.978 1.00 0.00 C ATOM 1845 CD1 LEU B 841 4.669 5.479 -0.932 1.00 0.00 C ATOM 1846 CD2 LEU B 841 7.005 5.215 -1.830 1.00 0.00 C ATOM 0 H LEU B 841 5.134 1.090 -3.076 1.00 0.00 H new ATOM 0 HA LEU B 841 3.300 2.784 -1.662 1.00 0.00 H new ATOM 0 HB2 LEU B 841 5.546 2.920 -0.966 1.00 0.00 H new ATOM 0 HB3 LEU B 841 6.170 2.855 -2.602 1.00 0.00 H new ATOM 0 HG LEU B 841 5.212 5.167 -2.951 1.00 0.00 H new ATOM 0 HD11 LEU B 841 4.819 6.558 -0.967 1.00 0.00 H new ATOM 0 HD12 LEU B 841 3.623 5.251 -1.137 1.00 0.00 H new ATOM 0 HD13 LEU B 841 4.934 5.108 0.058 1.00 0.00 H new ATOM 0 HD21 LEU B 841 7.082 6.302 -1.833 1.00 0.00 H new ATOM 0 HD22 LEU B 841 7.397 4.826 -0.890 1.00 0.00 H new ATOM 0 HD23 LEU B 841 7.582 4.808 -2.660 1.00 0.00 H new ATOM 1858 N LEU B 842 3.881 3.361 -4.811 1.00 0.00 N ATOM 1859 CA LEU B 842 3.493 4.139 -5.974 1.00 0.00 C ATOM 1860 C LEU B 842 1.999 4.035 -6.276 1.00 0.00 C ATOM 1861 O LEU B 842 1.398 4.942 -6.882 1.00 0.00 O ATOM 1862 CB LEU B 842 4.286 3.677 -7.178 1.00 0.00 C ATOM 1863 CG LEU B 842 5.812 3.905 -7.154 1.00 0.00 C ATOM 1864 CD1 LEU B 842 6.394 3.944 -8.517 1.00 0.00 C ATOM 1865 CD2 LEU B 842 6.250 5.109 -6.335 1.00 0.00 C ATOM 0 H LEU B 842 4.495 2.575 -5.024 1.00 0.00 H new ATOM 0 HA LEU B 842 3.708 5.185 -5.753 1.00 0.00 H new ATOM 0 HB2 LEU B 842 4.107 2.610 -7.310 1.00 0.00 H new ATOM 0 HB3 LEU B 842 3.884 4.179 -8.058 1.00 0.00 H new ATOM 0 HG LEU B 842 6.213 3.033 -6.638 1.00 0.00 H new ATOM 0 HD11 LEU B 842 7.470 4.107 -8.449 1.00 0.00 H new ATOM 0 HD12 LEU B 842 6.201 2.998 -9.022 1.00 0.00 H new ATOM 0 HD13 LEU B 842 5.939 4.757 -9.084 1.00 0.00 H new ATOM 0 HD21 LEU B 842 7.336 5.198 -6.370 1.00 0.00 H new ATOM 0 HD22 LEU B 842 5.799 6.012 -6.746 1.00 0.00 H new ATOM 0 HD23 LEU B 842 5.930 4.982 -5.301 1.00 0.00 H new ATOM 1877 N LYS B 843 1.415 2.948 -5.849 1.00 0.00 N ATOM 1878 CA LYS B 843 0.017 2.647 -6.079 1.00 0.00 C ATOM 1879 C LYS B 843 -0.865 3.212 -4.965 1.00 0.00 C ATOM 1880 O LYS B 843 -2.094 3.098 -5.026 1.00 0.00 O ATOM 1881 CB LYS B 843 -0.150 1.137 -6.129 1.00 0.00 C ATOM 1882 CG LYS B 843 0.616 0.445 -7.242 1.00 0.00 C ATOM 1883 CD LYS B 843 -0.114 0.444 -8.557 1.00 0.00 C ATOM 1884 CE LYS B 843 0.544 -0.545 -9.507 1.00 0.00 C ATOM 1885 NZ LYS B 843 -0.143 -0.629 -10.810 1.00 0.00 N ATOM 0 H LYS B 843 1.904 2.227 -5.319 1.00 0.00 H new ATOM 0 HA LYS B 843 -0.290 3.105 -7.019 1.00 0.00 H new ATOM 0 HB2 LYS B 843 0.169 0.719 -5.174 1.00 0.00 H new ATOM 0 HB3 LYS B 843 -1.210 0.907 -6.240 1.00 0.00 H new ATOM 0 HG2 LYS B 843 1.580 0.937 -7.370 1.00 0.00 H new ATOM 0 HG3 LYS B 843 0.820 -0.584 -6.947 1.00 0.00 H new ATOM 0 HD2 LYS B 843 -1.159 0.176 -8.404 1.00 0.00 H new ATOM 0 HD3 LYS B 843 -0.102 1.444 -8.991 1.00 0.00 H new ATOM 0 HE2 LYS B 843 1.582 -0.253 -9.667 1.00 0.00 H new ATOM 0 HE3 LYS B 843 0.558 -1.532 -9.044 1.00 0.00 H new ATOM 0 HZ1 LYS B 843 0.337 -1.329 -11.411 1.00 0.00 H new ATOM 0 HZ2 LYS B 843 -1.131 -0.918 -10.663 1.00 0.00 H new ATOM 0 HZ3 LYS B 843 -0.120 0.301 -11.275 1.00 0.00 H new ATOM 1899 N MET B 844 -0.244 3.813 -3.972 1.00 0.00 N ATOM 1900 CA MET B 844 -0.962 4.355 -2.821 1.00 0.00 C ATOM 1901 C MET B 844 -1.745 5.608 -3.241 1.00 0.00 C ATOM 1902 O MET B 844 -1.230 6.440 -4.008 1.00 0.00 O ATOM 1903 CB MET B 844 0.028 4.673 -1.694 1.00 0.00 C ATOM 1904 CG MET B 844 0.841 3.459 -1.253 1.00 0.00 C ATOM 1905 SD MET B 844 -0.081 2.251 -0.304 1.00 0.00 S ATOM 1906 CE MET B 844 0.000 3.029 1.288 1.00 0.00 C ATOM 0 H MET B 844 0.767 3.943 -3.933 1.00 0.00 H new ATOM 0 HA MET B 844 -1.673 3.616 -2.451 1.00 0.00 H new ATOM 0 HB2 MET B 844 0.708 5.457 -2.026 1.00 0.00 H new ATOM 0 HB3 MET B 844 -0.519 5.067 -0.838 1.00 0.00 H new ATOM 0 HG2 MET B 844 1.251 2.971 -2.138 1.00 0.00 H new ATOM 0 HG3 MET B 844 1.687 3.801 -0.657 1.00 0.00 H new ATOM 0 HE1 MET B 844 0.531 2.379 1.984 1.00 0.00 H new ATOM 0 HE2 MET B 844 0.528 3.978 1.203 1.00 0.00 H new ATOM 0 HE3 MET B 844 -1.010 3.208 1.657 1.00 0.00 H new ATOM 1916 N PRO B 845 -2.998 5.751 -2.780 1.00 0.00 N ATOM 1917 CA PRO B 845 -3.864 6.864 -3.179 1.00 0.00 C ATOM 1918 C PRO B 845 -3.446 8.196 -2.560 1.00 0.00 C ATOM 1919 O PRO B 845 -3.124 8.276 -1.369 1.00 0.00 O ATOM 1920 CB PRO B 845 -5.243 6.445 -2.680 1.00 0.00 C ATOM 1921 CG PRO B 845 -4.967 5.561 -1.522 1.00 0.00 C ATOM 1922 CD PRO B 845 -3.669 4.852 -1.821 1.00 0.00 C ATOM 0 HA PRO B 845 -3.822 7.037 -4.254 1.00 0.00 H new ATOM 0 HB2 PRO B 845 -5.838 7.310 -2.386 1.00 0.00 H new ATOM 0 HB3 PRO B 845 -5.803 5.921 -3.455 1.00 0.00 H new ATOM 0 HG2 PRO B 845 -4.889 6.140 -0.602 1.00 0.00 H new ATOM 0 HG3 PRO B 845 -5.776 4.845 -1.380 1.00 0.00 H new ATOM 0 HD2 PRO B 845 -3.073 4.710 -0.920 1.00 0.00 H new ATOM 0 HD3 PRO B 845 -3.841 3.864 -2.249 1.00 0.00 H new ATOM 1930 N GLY B 846 -3.428 9.221 -3.383 1.00 0.00 N ATOM 1931 CA GLY B 846 -3.054 10.545 -2.941 1.00 0.00 C ATOM 1932 C GLY B 846 -1.569 10.774 -3.051 1.00 0.00 C ATOM 1933 O GLY B 846 -1.079 11.894 -2.893 1.00 0.00 O ATOM 0 H GLY B 846 -3.671 9.161 -4.372 1.00 0.00 H new ATOM 0 HA2 GLY B 846 -3.582 11.290 -3.537 1.00 0.00 H new ATOM 0 HA3 GLY B 846 -3.367 10.685 -1.906 1.00 0.00 H new ATOM 1937 N VAL B 847 -0.851 9.725 -3.345 1.00 0.00 N ATOM 1938 CA VAL B 847 0.566 9.793 -3.411 1.00 0.00 C ATOM 1939 C VAL B 847 1.030 9.994 -4.847 1.00 0.00 C ATOM 1940 O VAL B 847 1.073 9.063 -5.653 1.00 0.00 O ATOM 1941 CB VAL B 847 1.236 8.543 -2.782 1.00 0.00 C ATOM 1942 CG1 VAL B 847 2.741 8.692 -2.757 1.00 0.00 C ATOM 1943 CG2 VAL B 847 0.719 8.318 -1.376 1.00 0.00 C ATOM 0 H VAL B 847 -1.240 8.803 -3.544 1.00 0.00 H new ATOM 0 HA VAL B 847 0.878 10.656 -2.823 1.00 0.00 H new ATOM 0 HB VAL B 847 0.983 7.680 -3.398 1.00 0.00 H new ATOM 0 HG11 VAL B 847 3.187 7.803 -2.311 1.00 0.00 H new ATOM 0 HG12 VAL B 847 3.112 8.813 -3.775 1.00 0.00 H new ATOM 0 HG13 VAL B 847 3.010 9.568 -2.167 1.00 0.00 H new ATOM 0 HG21 VAL B 847 1.199 7.437 -0.949 1.00 0.00 H new ATOM 0 HG22 VAL B 847 0.946 9.189 -0.761 1.00 0.00 H new ATOM 0 HG23 VAL B 847 -0.360 8.165 -1.405 1.00 0.00 H new ATOM 1953 N ASN B 848 1.317 11.227 -5.168 1.00 0.00 N ATOM 1954 CA ASN B 848 1.860 11.602 -6.478 1.00 0.00 C ATOM 1955 C ASN B 848 3.355 11.304 -6.508 1.00 0.00 C ATOM 1956 O ASN B 848 3.911 10.874 -5.499 1.00 0.00 O ATOM 1957 CB ASN B 848 1.613 13.087 -6.785 1.00 0.00 C ATOM 1958 CG ASN B 848 2.059 13.978 -5.671 1.00 0.00 C ATOM 1959 OD1 ASN B 848 3.215 14.312 -5.569 1.00 0.00 O ATOM 1960 ND2 ASN B 848 1.149 14.381 -4.843 1.00 0.00 N ATOM 0 H ASN B 848 1.186 12.016 -4.535 1.00 0.00 H new ATOM 0 HA ASN B 848 1.350 11.017 -7.243 1.00 0.00 H new ATOM 0 HB2 ASN B 848 2.141 13.360 -7.699 1.00 0.00 H new ATOM 0 HB3 ASN B 848 0.551 13.246 -6.971 1.00 0.00 H new ATOM 0 HD21 ASN B 848 1.399 15.002 -4.073 1.00 0.00 H new ATOM 0 HD22 ASN B 848 0.182 14.078 -4.961 1.00 0.00 H new ATOM 1967 N ALA B 849 4.013 11.588 -7.621 1.00 0.00 N ATOM 1968 CA ALA B 849 5.430 11.228 -7.807 1.00 0.00 C ATOM 1969 C ALA B 849 6.325 11.973 -6.843 1.00 0.00 C ATOM 1970 O ALA B 849 7.263 11.412 -6.289 1.00 0.00 O ATOM 1971 CB ALA B 849 5.864 11.484 -9.240 1.00 0.00 C ATOM 0 H ALA B 849 3.596 12.068 -8.418 1.00 0.00 H new ATOM 0 HA ALA B 849 5.528 10.163 -7.596 1.00 0.00 H new ATOM 0 HB1 ALA B 849 6.913 11.212 -9.357 1.00 0.00 H new ATOM 0 HB2 ALA B 849 5.256 10.884 -9.917 1.00 0.00 H new ATOM 0 HB3 ALA B 849 5.735 12.540 -9.476 1.00 0.00 H new ATOM 1977 N LYS B 850 5.968 13.203 -6.592 1.00 0.00 N ATOM 1978 CA LYS B 850 6.714 14.098 -5.714 1.00 0.00 C ATOM 1979 C LYS B 850 6.644 13.525 -4.301 1.00 0.00 C ATOM 1980 O LYS B 850 7.644 13.411 -3.588 1.00 0.00 O ATOM 1981 CB LYS B 850 6.021 15.440 -5.734 1.00 0.00 C ATOM 1982 CG LYS B 850 5.622 15.886 -7.128 1.00 0.00 C ATOM 1983 CD LYS B 850 4.495 16.865 -7.048 1.00 0.00 C ATOM 1984 CE LYS B 850 3.863 17.099 -8.387 1.00 0.00 C ATOM 1985 NZ LYS B 850 2.808 18.134 -8.310 1.00 0.00 N ATOM 0 H LYS B 850 5.135 13.631 -6.995 1.00 0.00 H new ATOM 0 HA LYS B 850 7.752 14.201 -6.031 1.00 0.00 H new ATOM 0 HB2 LYS B 850 5.131 15.391 -5.106 1.00 0.00 H new ATOM 0 HB3 LYS B 850 6.680 16.189 -5.295 1.00 0.00 H new ATOM 0 HG2 LYS B 850 6.475 16.341 -7.631 1.00 0.00 H new ATOM 0 HG3 LYS B 850 5.324 15.023 -7.723 1.00 0.00 H new ATOM 0 HD2 LYS B 850 3.743 16.497 -6.351 1.00 0.00 H new ATOM 0 HD3 LYS B 850 4.863 17.811 -6.650 1.00 0.00 H new ATOM 0 HE2 LYS B 850 4.625 17.406 -9.103 1.00 0.00 H new ATOM 0 HE3 LYS B 850 3.435 16.167 -8.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 850 2.389 18.274 -9.252 1.00 0.00 H new ATOM 0 HZ2 LYS B 850 2.069 17.828 -7.645 1.00 0.00 H new ATOM 0 HZ3 LYS B 850 3.223 19.029 -7.979 1.00 0.00 H new ATOM 1999 N ASN B 851 5.434 13.128 -3.934 1.00 0.00 N ATOM 2000 CA ASN B 851 5.159 12.494 -2.650 1.00 0.00 C ATOM 2001 C ASN B 851 5.884 11.166 -2.536 1.00 0.00 C ATOM 2002 O ASN B 851 6.485 10.881 -1.505 1.00 0.00 O ATOM 2003 CB ASN B 851 3.653 12.300 -2.450 1.00 0.00 C ATOM 2004 CG ASN B 851 2.898 13.559 -2.032 1.00 0.00 C ATOM 2005 OD1 ASN B 851 1.843 13.472 -1.446 1.00 0.00 O ATOM 2006 ND2 ASN B 851 3.435 14.723 -2.284 1.00 0.00 N ATOM 0 H ASN B 851 4.608 13.237 -4.523 1.00 0.00 H new ATOM 0 HA ASN B 851 5.528 13.154 -1.865 1.00 0.00 H new ATOM 0 HB2 ASN B 851 3.222 11.926 -3.379 1.00 0.00 H new ATOM 0 HB3 ASN B 851 3.497 11.531 -1.693 1.00 0.00 H new ATOM 0 HD21 ASN B 851 2.964 15.577 -1.986 1.00 0.00 H new ATOM 0 HD22 ASN B 851 4.325 14.778 -2.779 1.00 0.00 H new ATOM 2013 N CYS B 852 5.860 10.368 -3.617 1.00 0.00 N ATOM 2014 CA CYS B 852 6.569 9.082 -3.653 1.00 0.00 C ATOM 2015 C CYS B 852 8.051 9.320 -3.408 1.00 0.00 C ATOM 2016 O CYS B 852 8.700 8.579 -2.674 1.00 0.00 O ATOM 2017 CB CYS B 852 6.375 8.360 -5.008 1.00 0.00 C ATOM 2018 SG CYS B 852 4.657 8.045 -5.477 1.00 0.00 S ATOM 0 H CYS B 852 5.357 10.593 -4.476 1.00 0.00 H new ATOM 0 HA CYS B 852 6.155 8.443 -2.873 1.00 0.00 H new ATOM 0 HB2 CYS B 852 6.844 8.958 -5.790 1.00 0.00 H new ATOM 0 HB3 CYS B 852 6.905 7.408 -4.973 1.00 0.00 H new ATOM 0 HG CYS B 852 4.009 9.170 -5.531 1.00 0.00 H new ATOM 2024 N ARG B 853 8.563 10.387 -4.007 1.00 0.00 N ATOM 2025 CA ARG B 853 9.929 10.800 -3.824 1.00 0.00 C ATOM 2026 C ARG B 853 10.218 11.157 -2.387 1.00 0.00 C ATOM 2027 O ARG B 853 11.133 10.624 -1.814 1.00 0.00 O ATOM 2028 CB ARG B 853 10.313 11.929 -4.785 1.00 0.00 C ATOM 2029 CG ARG B 853 10.606 11.445 -6.188 1.00 0.00 C ATOM 2030 CD ARG B 853 11.873 10.611 -6.196 1.00 0.00 C ATOM 2031 NE ARG B 853 12.093 9.936 -7.462 1.00 0.00 N ATOM 2032 CZ ARG B 853 13.087 9.080 -7.684 1.00 0.00 C ATOM 2033 NH1 ARG B 853 14.024 8.900 -6.757 1.00 0.00 N ATOM 2034 NH2 ARG B 853 13.154 8.424 -8.836 1.00 0.00 N ATOM 0 H ARG B 853 8.030 10.988 -4.636 1.00 0.00 H new ATOM 0 HA ARG B 853 10.560 9.946 -4.070 1.00 0.00 H new ATOM 0 HB2 ARG B 853 9.503 12.658 -4.821 1.00 0.00 H new ATOM 0 HB3 ARG B 853 11.190 12.446 -4.396 1.00 0.00 H new ATOM 0 HG2 ARG B 853 9.769 10.853 -6.559 1.00 0.00 H new ATOM 0 HG3 ARG B 853 10.717 12.297 -6.859 1.00 0.00 H new ATOM 0 HD2 ARG B 853 12.727 11.253 -5.978 1.00 0.00 H new ATOM 0 HD3 ARG B 853 11.820 9.870 -5.398 1.00 0.00 H new ATOM 0 HE ARG B 853 11.447 10.129 -8.227 1.00 0.00 H new ATOM 0 HH11 ARG B 853 13.979 9.417 -5.879 1.00 0.00 H new ATOM 0 HH12 ARG B 853 14.787 8.244 -6.924 1.00 0.00 H new ATOM 0 HH21 ARG B 853 12.443 8.576 -9.552 1.00 0.00 H new ATOM 0 HH22 ARG B 853 13.916 7.768 -9.006 1.00 0.00 H new ATOM 2048 N SER B 854 9.383 11.989 -1.789 1.00 0.00 N ATOM 2049 CA SER B 854 9.579 12.408 -0.413 1.00 0.00 C ATOM 2050 C SER B 854 9.551 11.179 0.511 1.00 0.00 C ATOM 2051 O SER B 854 10.359 11.043 1.429 1.00 0.00 O ATOM 2052 CB SER B 854 8.467 13.390 -0.017 1.00 0.00 C ATOM 2053 OG SER B 854 8.406 14.504 -0.916 1.00 0.00 O ATOM 0 H SER B 854 8.559 12.389 -2.238 1.00 0.00 H new ATOM 0 HA SER B 854 10.546 12.902 -0.315 1.00 0.00 H new ATOM 0 HB2 SER B 854 7.508 12.872 -0.012 1.00 0.00 H new ATOM 0 HB3 SER B 854 8.641 13.749 0.997 1.00 0.00 H new ATOM 0 HG SER B 854 8.067 14.205 -1.785 1.00 0.00 H new ATOM 2059 N LEU B 855 8.668 10.264 0.190 1.00 0.00 N ATOM 2060 CA LEU B 855 8.463 9.073 0.956 1.00 0.00 C ATOM 2061 C LEU B 855 9.696 8.174 0.876 1.00 0.00 C ATOM 2062 O LEU B 855 10.164 7.730 1.874 1.00 0.00 O ATOM 2063 CB LEU B 855 7.197 8.373 0.440 1.00 0.00 C ATOM 2064 CG LEU B 855 6.321 7.609 1.445 1.00 0.00 C ATOM 2065 CD1 LEU B 855 6.990 6.353 1.942 1.00 0.00 C ATOM 2066 CD2 LEU B 855 5.944 8.519 2.601 1.00 0.00 C ATOM 0 H LEU B 855 8.063 10.334 -0.628 1.00 0.00 H new ATOM 0 HA LEU B 855 8.319 9.314 2.009 1.00 0.00 H new ATOM 0 HB2 LEU B 855 6.572 9.128 -0.038 1.00 0.00 H new ATOM 0 HB3 LEU B 855 7.500 7.671 -0.337 1.00 0.00 H new ATOM 0 HG LEU B 855 5.414 7.297 0.927 1.00 0.00 H new ATOM 0 HD11 LEU B 855 6.334 5.847 2.650 1.00 0.00 H new ATOM 0 HD12 LEU B 855 7.194 5.692 1.100 1.00 0.00 H new ATOM 0 HD13 LEU B 855 7.927 6.611 2.436 1.00 0.00 H new ATOM 0 HD21 LEU B 855 5.323 7.970 3.309 1.00 0.00 H new ATOM 0 HD22 LEU B 855 6.848 8.864 3.103 1.00 0.00 H new ATOM 0 HD23 LEU B 855 5.390 9.378 2.222 1.00 0.00 H new ATOM 2078 N MET B 856 10.251 7.990 -0.311 1.00 0.00 N ATOM 2079 CA MET B 856 11.433 7.114 -0.477 1.00 0.00 C ATOM 2080 C MET B 856 12.733 7.824 -0.084 1.00 0.00 C ATOM 2081 O MET B 856 13.808 7.223 -0.061 1.00 0.00 O ATOM 2082 CB MET B 856 11.536 6.545 -1.905 1.00 0.00 C ATOM 2083 CG MET B 856 11.764 7.576 -2.994 1.00 0.00 C ATOM 2084 SD MET B 856 11.829 6.854 -4.651 1.00 0.00 S ATOM 2085 CE MET B 856 10.192 6.132 -4.785 1.00 0.00 C ATOM 0 H MET B 856 9.918 8.423 -1.173 1.00 0.00 H new ATOM 0 HA MET B 856 11.290 6.276 0.205 1.00 0.00 H new ATOM 0 HB2 MET B 856 12.352 5.823 -1.934 1.00 0.00 H new ATOM 0 HB3 MET B 856 10.619 5.999 -2.129 1.00 0.00 H new ATOM 0 HG2 MET B 856 10.965 8.317 -2.958 1.00 0.00 H new ATOM 0 HG3 MET B 856 12.697 8.104 -2.797 1.00 0.00 H new ATOM 0 HE1 MET B 856 9.812 6.278 -5.796 1.00 0.00 H new ATOM 0 HE2 MET B 856 10.246 5.065 -4.568 1.00 0.00 H new ATOM 0 HE3 MET B 856 9.522 6.614 -4.073 1.00 0.00 H new ATOM 2095 N HIS B 857 12.636 9.103 0.163 1.00 0.00 N ATOM 2096 CA HIS B 857 13.778 9.872 0.598 1.00 0.00 C ATOM 2097 C HIS B 857 13.894 9.840 2.116 1.00 0.00 C ATOM 2098 O HIS B 857 14.994 9.734 2.662 1.00 0.00 O ATOM 2099 CB HIS B 857 13.718 11.321 0.068 1.00 0.00 C ATOM 2100 CG HIS B 857 14.010 11.472 -1.413 1.00 0.00 C ATOM 2101 ND1 HIS B 857 14.119 12.686 -2.050 1.00 0.00 N ATOM 2102 CD2 HIS B 857 14.181 10.533 -2.385 1.00 0.00 C ATOM 2103 CE1 HIS B 857 14.336 12.463 -3.348 1.00 0.00 C ATOM 2104 NE2 HIS B 857 14.384 11.166 -3.609 1.00 0.00 N ATOM 0 H HIS B 857 11.774 9.640 0.071 1.00 0.00 H new ATOM 0 HA HIS B 857 14.674 9.414 0.179 1.00 0.00 H new ATOM 0 HB2 HIS B 857 12.727 11.726 0.271 1.00 0.00 H new ATOM 0 HB3 HIS B 857 14.431 11.927 0.628 1.00 0.00 H new ATOM 0 HD1 HIS B 857 14.046 13.601 -1.606 1.00 0.00 H new ATOM 0 HD2 HIS B 857 14.162 9.464 -2.231 1.00 0.00 H new ATOM 0 HE1 HIS B 857 14.457 13.240 -4.089 1.00 0.00 H new ATOM 2112 N HIS B 858 12.762 9.909 2.796 1.00 0.00 N ATOM 2113 CA HIS B 858 12.752 9.871 4.262 1.00 0.00 C ATOM 2114 C HIS B 858 12.546 8.446 4.769 1.00 0.00 C ATOM 2115 O HIS B 858 13.215 7.995 5.711 1.00 0.00 O ATOM 2116 CB HIS B 858 11.641 10.782 4.843 1.00 0.00 C ATOM 2117 CG HIS B 858 11.811 12.255 4.579 1.00 0.00 C ATOM 2118 ND1 HIS B 858 11.641 12.965 3.435 1.00 0.00 N flip ATOM 2119 CD2 HIS B 858 12.155 13.178 5.543 1.00 0.00 C flip ATOM 2120 CE1 HIS B 858 11.879 14.309 3.685 1.00 0.00 C flip ATOM 2121 NE2 HIS B 858 12.185 14.382 4.971 1.00 0.00 N flip ATOM 0 H HIS B 858 11.840 9.991 2.367 1.00 0.00 H new ATOM 0 HA HIS B 858 13.722 10.238 4.598 1.00 0.00 H new ATOM 0 HB2 HIS B 858 10.682 10.465 4.432 1.00 0.00 H new ATOM 0 HB3 HIS B 858 11.593 10.626 5.921 1.00 0.00 H new ATOM 0 HD1 HIS B 858 11.379 12.572 2.531 1.00 0.00 H new ATOM 0 HD2 HIS B 858 12.364 12.963 6.581 1.00 0.00 H new ATOM 0 HE1 HIS B 858 11.826 15.124 2.979 1.00 0.00 H new ATOM 2129 N VAL B 859 11.657 7.743 4.120 1.00 0.00 N ATOM 2130 CA VAL B 859 11.248 6.419 4.510 1.00 0.00 C ATOM 2131 C VAL B 859 11.920 5.349 3.643 1.00 0.00 C ATOM 2132 O VAL B 859 12.149 5.543 2.454 1.00 0.00 O ATOM 2133 CB VAL B 859 9.684 6.312 4.469 1.00 0.00 C ATOM 2134 CG1 VAL B 859 9.201 4.882 4.527 1.00 0.00 C ATOM 2135 CG2 VAL B 859 9.095 7.063 5.633 1.00 0.00 C ATOM 0 H VAL B 859 11.184 8.084 3.283 1.00 0.00 H new ATOM 0 HA VAL B 859 11.574 6.237 5.534 1.00 0.00 H new ATOM 0 HB VAL B 859 9.360 6.741 3.521 1.00 0.00 H new ATOM 0 HG11 VAL B 859 8.112 4.864 4.496 1.00 0.00 H new ATOM 0 HG12 VAL B 859 9.598 4.329 3.675 1.00 0.00 H new ATOM 0 HG13 VAL B 859 9.545 4.419 5.452 1.00 0.00 H new ATOM 0 HG21 VAL B 859 8.008 6.987 5.602 1.00 0.00 H new ATOM 0 HG22 VAL B 859 9.462 6.635 6.566 1.00 0.00 H new ATOM 0 HG23 VAL B 859 9.387 8.111 5.575 1.00 0.00 H new ATOM 2145 N LYS B 860 12.240 4.244 4.269 1.00 0.00 N ATOM 2146 CA LYS B 860 12.896 3.142 3.639 1.00 0.00 C ATOM 2147 C LYS B 860 11.882 2.265 2.927 1.00 0.00 C ATOM 2148 O LYS B 860 12.061 1.908 1.755 1.00 0.00 O ATOM 2149 CB LYS B 860 13.588 2.294 4.712 1.00 0.00 C ATOM 2150 CG LYS B 860 14.430 1.163 4.156 1.00 0.00 C ATOM 2151 CD LYS B 860 14.978 0.253 5.243 1.00 0.00 C ATOM 2152 CE LYS B 860 15.853 1.009 6.234 1.00 0.00 C ATOM 2153 NZ LYS B 860 16.484 0.110 7.223 1.00 0.00 N ATOM 0 H LYS B 860 12.043 4.089 5.258 1.00 0.00 H new ATOM 0 HA LYS B 860 13.619 3.527 2.920 1.00 0.00 H new ATOM 0 HB2 LYS B 860 14.222 2.941 5.319 1.00 0.00 H new ATOM 0 HB3 LYS B 860 12.830 1.877 5.375 1.00 0.00 H new ATOM 0 HG2 LYS B 860 13.829 0.574 3.463 1.00 0.00 H new ATOM 0 HG3 LYS B 860 15.259 1.580 3.584 1.00 0.00 H new ATOM 0 HD2 LYS B 860 14.150 -0.216 5.775 1.00 0.00 H new ATOM 0 HD3 LYS B 860 15.558 -0.549 4.786 1.00 0.00 H new ATOM 0 HE2 LYS B 860 16.628 1.551 5.692 1.00 0.00 H new ATOM 0 HE3 LYS B 860 15.250 1.753 6.755 1.00 0.00 H new ATOM 0 HZ1 LYS B 860 17.070 0.669 7.876 1.00 0.00 H new ATOM 0 HZ2 LYS B 860 15.746 -0.388 7.760 1.00 0.00 H new ATOM 0 HZ3 LYS B 860 17.081 -0.584 6.730 1.00 0.00 H new ATOM 2167 N ASN B 861 10.799 1.933 3.631 1.00 0.00 N ATOM 2168 CA ASN B 861 9.847 0.952 3.120 1.00 0.00 C ATOM 2169 C ASN B 861 8.459 1.230 3.631 1.00 0.00 C ATOM 2170 O ASN B 861 8.299 1.882 4.671 1.00 0.00 O ATOM 2171 CB ASN B 861 10.289 -0.507 3.470 1.00 0.00 C ATOM 2172 CG ASN B 861 10.375 -0.856 4.979 1.00 0.00 C ATOM 2173 OD1 ASN B 861 10.137 -1.972 5.367 1.00 0.00 O ATOM 2174 ND2 ASN B 861 10.771 0.067 5.825 1.00 0.00 N ATOM 0 H ASN B 861 10.563 2.324 4.543 1.00 0.00 H new ATOM 0 HA ASN B 861 9.832 1.042 2.034 1.00 0.00 H new ATOM 0 HB2 ASN B 861 9.591 -1.198 2.998 1.00 0.00 H new ATOM 0 HB3 ASN B 861 11.266 -0.685 3.021 1.00 0.00 H new ATOM 0 HD21 ASN B 861 10.878 -0.160 6.814 1.00 0.00 H new ATOM 0 HD22 ASN B 861 10.972 1.010 5.493 1.00 0.00 H new ATOM 2181 N ILE B 862 7.456 0.730 2.898 1.00 0.00 N ATOM 2182 CA ILE B 862 6.032 0.910 3.231 1.00 0.00 C ATOM 2183 C ILE B 862 5.708 0.487 4.671 1.00 0.00 C ATOM 2184 O ILE B 862 4.758 0.974 5.261 1.00 0.00 O ATOM 2185 CB ILE B 862 5.050 0.165 2.266 1.00 0.00 C ATOM 2186 CG1 ILE B 862 5.498 -1.290 1.964 1.00 0.00 C ATOM 2187 CG2 ILE B 862 4.804 0.967 0.987 1.00 0.00 C ATOM 2188 CD1 ILE B 862 6.381 -1.446 0.744 1.00 0.00 C ATOM 0 H ILE B 862 7.608 0.184 2.050 1.00 0.00 H new ATOM 0 HA ILE B 862 5.875 1.982 3.114 1.00 0.00 H new ATOM 0 HB ILE B 862 4.097 0.086 2.789 1.00 0.00 H new ATOM 0 HG12 ILE B 862 6.031 -1.678 2.832 1.00 0.00 H new ATOM 0 HG13 ILE B 862 4.610 -1.908 1.833 1.00 0.00 H new ATOM 0 HG21 ILE B 862 4.118 0.420 0.341 1.00 0.00 H new ATOM 0 HG22 ILE B 862 4.370 1.934 1.242 1.00 0.00 H new ATOM 0 HG23 ILE B 862 5.749 1.120 0.466 1.00 0.00 H new ATOM 0 HD11 ILE B 862 6.642 -2.497 0.615 1.00 0.00 H new ATOM 0 HD12 ILE B 862 5.847 -1.094 -0.139 1.00 0.00 H new ATOM 0 HD13 ILE B 862 7.291 -0.860 0.876 1.00 0.00 H new ATOM 2200 N ALA B 863 6.488 -0.441 5.216 1.00 0.00 N ATOM 2201 CA ALA B 863 6.325 -0.878 6.594 1.00 0.00 C ATOM 2202 C ALA B 863 6.459 0.302 7.577 1.00 0.00 C ATOM 2203 O ALA B 863 5.581 0.491 8.442 1.00 0.00 O ATOM 2204 CB ALA B 863 7.320 -1.969 6.917 1.00 0.00 C ATOM 0 H ALA B 863 7.246 -0.907 4.717 1.00 0.00 H new ATOM 0 HA ALA B 863 5.319 -1.282 6.707 1.00 0.00 H new ATOM 0 HB1 ALA B 863 7.188 -2.287 7.951 1.00 0.00 H new ATOM 0 HB2 ALA B 863 7.158 -2.818 6.252 1.00 0.00 H new ATOM 0 HB3 ALA B 863 8.333 -1.590 6.781 1.00 0.00 H new ATOM 2210 N GLU B 864 7.529 1.123 7.416 1.00 0.00 N ATOM 2211 CA GLU B 864 7.726 2.304 8.272 1.00 0.00 C ATOM 2212 C GLU B 864 6.556 3.233 8.101 1.00 0.00 C ATOM 2213 O GLU B 864 6.003 3.738 9.054 1.00 0.00 O ATOM 2214 CB GLU B 864 8.991 3.079 7.925 1.00 0.00 C ATOM 2215 CG GLU B 864 10.290 2.343 8.119 1.00 0.00 C ATOM 2216 CD GLU B 864 11.457 3.242 7.889 1.00 0.00 C ATOM 2217 OE1 GLU B 864 11.663 3.659 6.751 1.00 0.00 O ATOM 2218 OE2 GLU B 864 12.180 3.560 8.848 1.00 0.00 O ATOM 0 H GLU B 864 8.253 0.986 6.711 1.00 0.00 H new ATOM 0 HA GLU B 864 7.817 1.944 9.297 1.00 0.00 H new ATOM 0 HB2 GLU B 864 8.926 3.393 6.883 1.00 0.00 H new ATOM 0 HB3 GLU B 864 9.016 3.985 8.530 1.00 0.00 H new ATOM 0 HG2 GLU B 864 10.334 1.937 9.130 1.00 0.00 H new ATOM 0 HG3 GLU B 864 10.338 1.497 7.433 1.00 0.00 H new ATOM 2225 N LEU B 865 6.194 3.415 6.852 1.00 0.00 N ATOM 2226 CA LEU B 865 5.065 4.221 6.425 1.00 0.00 C ATOM 2227 C LEU B 865 3.775 3.829 7.142 1.00 0.00 C ATOM 2228 O LEU B 865 3.045 4.677 7.623 1.00 0.00 O ATOM 2229 CB LEU B 865 4.892 4.063 4.910 1.00 0.00 C ATOM 2230 CG LEU B 865 3.563 4.525 4.317 1.00 0.00 C ATOM 2231 CD1 LEU B 865 3.331 5.982 4.566 1.00 0.00 C ATOM 2232 CD2 LEU B 865 3.483 4.195 2.845 1.00 0.00 C ATOM 0 H LEU B 865 6.696 2.990 6.072 1.00 0.00 H new ATOM 0 HA LEU B 865 5.269 5.261 6.680 1.00 0.00 H new ATOM 0 HB2 LEU B 865 5.693 4.613 4.417 1.00 0.00 H new ATOM 0 HB3 LEU B 865 5.028 3.011 4.660 1.00 0.00 H new ATOM 0 HG LEU B 865 2.766 3.980 4.822 1.00 0.00 H new ATOM 0 HD11 LEU B 865 2.376 6.278 4.131 1.00 0.00 H new ATOM 0 HD12 LEU B 865 3.314 6.169 5.640 1.00 0.00 H new ATOM 0 HD13 LEU B 865 4.133 6.561 4.109 1.00 0.00 H new ATOM 0 HD21 LEU B 865 2.527 4.535 2.447 1.00 0.00 H new ATOM 0 HD22 LEU B 865 4.294 4.695 2.315 1.00 0.00 H new ATOM 0 HD23 LEU B 865 3.570 3.117 2.708 1.00 0.00 H new ATOM 2244 N ALA B 866 3.508 2.556 7.218 1.00 0.00 N ATOM 2245 CA ALA B 866 2.287 2.110 7.830 1.00 0.00 C ATOM 2246 C ALA B 866 2.409 2.035 9.363 1.00 0.00 C ATOM 2247 O ALA B 866 1.434 1.729 10.064 1.00 0.00 O ATOM 2248 CB ALA B 866 1.836 0.782 7.240 1.00 0.00 C ATOM 0 H ALA B 866 4.113 1.813 6.867 1.00 0.00 H new ATOM 0 HA ALA B 866 1.519 2.852 7.609 1.00 0.00 H new ATOM 0 HB1 ALA B 866 0.910 0.466 7.720 1.00 0.00 H new ATOM 0 HB2 ALA B 866 1.668 0.898 6.169 1.00 0.00 H new ATOM 0 HB3 ALA B 866 2.606 0.029 7.407 1.00 0.00 H new ATOM 2254 N ALA B 867 3.614 2.247 9.870 1.00 0.00 N ATOM 2255 CA ALA B 867 3.850 2.281 11.310 1.00 0.00 C ATOM 2256 C ALA B 867 3.848 3.719 11.833 1.00 0.00 C ATOM 2257 O ALA B 867 3.573 3.963 13.020 1.00 0.00 O ATOM 2258 CB ALA B 867 5.177 1.617 11.653 1.00 0.00 C ATOM 0 H ALA B 867 4.449 2.399 9.304 1.00 0.00 H new ATOM 0 HA ALA B 867 3.040 1.732 11.790 1.00 0.00 H new ATOM 0 HB1 ALA B 867 5.334 1.653 12.731 1.00 0.00 H new ATOM 0 HB2 ALA B 867 5.160 0.578 11.323 1.00 0.00 H new ATOM 0 HB3 ALA B 867 5.988 2.144 11.151 1.00 0.00 H new ATOM 2264 N LEU B 868 4.154 4.660 10.964 1.00 0.00 N ATOM 2265 CA LEU B 868 4.237 6.057 11.343 1.00 0.00 C ATOM 2266 C LEU B 868 2.862 6.723 11.425 1.00 0.00 C ATOM 2267 O LEU B 868 1.879 6.234 10.863 1.00 0.00 O ATOM 2268 CB LEU B 868 5.282 6.835 10.475 1.00 0.00 C ATOM 2269 CG LEU B 868 5.117 6.862 8.939 1.00 0.00 C ATOM 2270 CD1 LEU B 868 3.920 7.672 8.498 1.00 0.00 C ATOM 2271 CD2 LEU B 868 6.380 7.395 8.284 1.00 0.00 C ATOM 0 H LEU B 868 4.351 4.480 9.980 1.00 0.00 H new ATOM 0 HA LEU B 868 4.622 6.099 12.362 1.00 0.00 H new ATOM 0 HB2 LEU B 868 5.292 7.868 10.822 1.00 0.00 H new ATOM 0 HB3 LEU B 868 6.265 6.417 10.692 1.00 0.00 H new ATOM 0 HG LEU B 868 4.945 5.835 8.619 1.00 0.00 H new ATOM 0 HD11 LEU B 868 3.852 7.657 7.410 1.00 0.00 H new ATOM 0 HD12 LEU B 868 3.013 7.243 8.924 1.00 0.00 H new ATOM 0 HD13 LEU B 868 4.031 8.701 8.841 1.00 0.00 H new ATOM 0 HD21 LEU B 868 6.251 7.409 7.202 1.00 0.00 H new ATOM 0 HD22 LEU B 868 6.575 8.407 8.639 1.00 0.00 H new ATOM 0 HD23 LEU B 868 7.222 6.752 8.540 1.00 0.00 H new ATOM 2283 N SER B 869 2.805 7.804 12.146 1.00 0.00 N ATOM 2284 CA SER B 869 1.576 8.504 12.400 1.00 0.00 C ATOM 2285 C SER B 869 1.283 9.516 11.284 1.00 0.00 C ATOM 2286 O SER B 869 2.159 9.814 10.454 1.00 0.00 O ATOM 2287 CB SER B 869 1.718 9.203 13.738 1.00 0.00 C ATOM 2288 OG SER B 869 2.148 8.287 14.742 1.00 0.00 O ATOM 0 H SER B 869 3.622 8.232 12.581 1.00 0.00 H new ATOM 0 HA SER B 869 0.740 7.805 12.424 1.00 0.00 H new ATOM 0 HB2 SER B 869 2.435 10.020 13.653 1.00 0.00 H new ATOM 0 HB3 SER B 869 0.764 9.645 14.026 1.00 0.00 H new ATOM 0 HG SER B 869 2.236 8.757 15.598 1.00 0.00 H new ATOM 2294 N GLN B 870 0.069 10.062 11.283 1.00 0.00 N ATOM 2295 CA GLN B 870 -0.355 11.003 10.269 1.00 0.00 C ATOM 2296 C GLN B 870 0.521 12.240 10.195 1.00 0.00 C ATOM 2297 O GLN B 870 0.888 12.659 9.108 1.00 0.00 O ATOM 2298 CB GLN B 870 -1.830 11.373 10.408 1.00 0.00 C ATOM 2299 CG GLN B 870 -2.264 12.463 9.449 1.00 0.00 C ATOM 2300 CD GLN B 870 -3.747 12.560 9.276 1.00 0.00 C ATOM 2301 OE1 GLN B 870 -4.528 12.228 10.171 1.00 0.00 O ATOM 2302 NE2 GLN B 870 -4.140 13.039 8.134 1.00 0.00 N ATOM 0 H GLN B 870 -0.641 9.860 11.987 1.00 0.00 H new ATOM 0 HA GLN B 870 -0.233 10.483 9.319 1.00 0.00 H new ATOM 0 HB2 GLN B 870 -2.438 10.485 10.238 1.00 0.00 H new ATOM 0 HB3 GLN B 870 -2.021 11.700 11.430 1.00 0.00 H new ATOM 0 HG2 GLN B 870 -1.886 13.421 9.807 1.00 0.00 H new ATOM 0 HG3 GLN B 870 -1.805 12.283 8.477 1.00 0.00 H new ATOM 0 HE21 GLN B 870 -3.453 13.299 7.426 1.00 0.00 H new ATOM 0 HE22 GLN B 870 -5.136 13.155 7.945 1.00 0.00 H new ATOM 2311 N ASP B 871 0.877 12.807 11.324 1.00 0.00 N ATOM 2312 CA ASP B 871 1.726 14.003 11.328 1.00 0.00 C ATOM 2313 C ASP B 871 3.074 13.730 10.665 1.00 0.00 C ATOM 2314 O ASP B 871 3.613 14.587 9.977 1.00 0.00 O ATOM 2315 CB ASP B 871 1.916 14.580 12.731 1.00 0.00 C ATOM 2316 CG ASP B 871 2.866 15.766 12.736 1.00 0.00 C ATOM 2317 OD1 ASP B 871 2.470 16.888 12.317 1.00 0.00 O ATOM 2318 OD2 ASP B 871 4.036 15.593 13.126 1.00 0.00 O ATOM 0 H ASP B 871 0.602 12.474 12.248 1.00 0.00 H new ATOM 0 HA ASP B 871 1.202 14.757 10.740 1.00 0.00 H new ATOM 0 HB2 ASP B 871 0.950 14.888 13.130 1.00 0.00 H new ATOM 0 HB3 ASP B 871 2.301 13.804 13.393 1.00 0.00 H new ATOM 2323 N GLU B 872 3.575 12.513 10.823 1.00 0.00 N ATOM 2324 CA GLU B 872 4.827 12.109 10.198 1.00 0.00 C ATOM 2325 C GLU B 872 4.694 12.163 8.680 1.00 0.00 C ATOM 2326 O GLU B 872 5.398 12.915 8.015 1.00 0.00 O ATOM 2327 CB GLU B 872 5.219 10.701 10.641 1.00 0.00 C ATOM 2328 CG GLU B 872 5.527 10.581 12.117 1.00 0.00 C ATOM 2329 CD GLU B 872 6.751 11.360 12.508 1.00 0.00 C ATOM 2330 OE1 GLU B 872 6.637 12.557 12.836 1.00 0.00 O ATOM 2331 OE2 GLU B 872 7.858 10.784 12.503 1.00 0.00 O ATOM 0 H GLU B 872 3.131 11.784 11.382 1.00 0.00 H new ATOM 0 HA GLU B 872 5.610 12.800 10.511 1.00 0.00 H new ATOM 0 HB2 GLU B 872 4.409 10.015 10.393 1.00 0.00 H new ATOM 0 HB3 GLU B 872 6.092 10.382 10.072 1.00 0.00 H new ATOM 0 HG2 GLU B 872 4.673 10.936 12.694 1.00 0.00 H new ATOM 0 HG3 GLU B 872 5.670 9.531 12.372 1.00 0.00 H new ATOM 2338 N LEU B 873 3.727 11.430 8.147 1.00 0.00 N ATOM 2339 CA LEU B 873 3.506 11.388 6.704 1.00 0.00 C ATOM 2340 C LEU B 873 3.079 12.751 6.139 1.00 0.00 C ATOM 2341 O LEU B 873 3.426 13.100 5.020 1.00 0.00 O ATOM 2342 CB LEU B 873 2.556 10.223 6.311 1.00 0.00 C ATOM 2343 CG LEU B 873 1.212 10.107 7.055 1.00 0.00 C ATOM 2344 CD1 LEU B 873 0.176 11.043 6.493 1.00 0.00 C ATOM 2345 CD2 LEU B 873 0.705 8.676 7.065 1.00 0.00 C ATOM 0 H LEU B 873 3.082 10.856 8.690 1.00 0.00 H new ATOM 0 HA LEU B 873 4.463 11.172 6.228 1.00 0.00 H new ATOM 0 HB2 LEU B 873 2.342 10.311 5.246 1.00 0.00 H new ATOM 0 HB3 LEU B 873 3.098 9.288 6.451 1.00 0.00 H new ATOM 0 HG LEU B 873 1.394 10.405 8.087 1.00 0.00 H new ATOM 0 HD11 LEU B 873 -0.756 10.929 7.046 1.00 0.00 H new ATOM 0 HD12 LEU B 873 0.527 12.071 6.583 1.00 0.00 H new ATOM 0 HD13 LEU B 873 0.005 10.808 5.442 1.00 0.00 H new ATOM 0 HD21 LEU B 873 -0.245 8.630 7.598 1.00 0.00 H new ATOM 0 HD22 LEU B 873 0.563 8.333 6.040 1.00 0.00 H new ATOM 0 HD23 LEU B 873 1.432 8.036 7.564 1.00 0.00 H new ATOM 2357 N THR B 874 2.395 13.533 6.942 1.00 0.00 N ATOM 2358 CA THR B 874 1.969 14.844 6.551 1.00 0.00 C ATOM 2359 C THR B 874 3.185 15.784 6.391 1.00 0.00 C ATOM 2360 O THR B 874 3.246 16.568 5.442 1.00 0.00 O ATOM 2361 CB THR B 874 0.931 15.400 7.565 1.00 0.00 C ATOM 2362 OG1 THR B 874 -0.224 14.548 7.582 1.00 0.00 O ATOM 2363 CG2 THR B 874 0.518 16.816 7.241 1.00 0.00 C ATOM 0 H THR B 874 2.120 13.270 7.888 1.00 0.00 H new ATOM 0 HA THR B 874 1.477 14.784 5.580 1.00 0.00 H new ATOM 0 HB THR B 874 1.402 15.416 8.548 1.00 0.00 H new ATOM 0 HG1 THR B 874 -0.073 13.804 8.202 1.00 0.00 H new ATOM 0 HG21 THR B 874 -0.208 17.161 7.977 1.00 0.00 H new ATOM 0 HG22 THR B 874 1.394 17.465 7.264 1.00 0.00 H new ATOM 0 HG23 THR B 874 0.070 16.846 6.248 1.00 0.00 H new ATOM 2371 N SER B 875 4.166 15.643 7.271 1.00 0.00 N ATOM 2372 CA SER B 875 5.375 16.446 7.202 1.00 0.00 C ATOM 2373 C SER B 875 6.248 16.017 6.009 1.00 0.00 C ATOM 2374 O SER B 875 6.932 16.847 5.391 1.00 0.00 O ATOM 2375 CB SER B 875 6.149 16.315 8.507 1.00 0.00 C ATOM 2376 OG SER B 875 5.318 16.651 9.608 1.00 0.00 O ATOM 0 H SER B 875 4.146 14.977 8.043 1.00 0.00 H new ATOM 0 HA SER B 875 5.098 17.490 7.055 1.00 0.00 H new ATOM 0 HB2 SER B 875 6.517 15.295 8.619 1.00 0.00 H new ATOM 0 HB3 SER B 875 7.021 16.969 8.488 1.00 0.00 H new ATOM 0 HG SER B 875 4.672 15.931 9.762 1.00 0.00 H new ATOM 2382 N ILE B 876 6.209 14.726 5.697 1.00 0.00 N ATOM 2383 CA ILE B 876 6.962 14.167 4.586 1.00 0.00 C ATOM 2384 C ILE B 876 6.340 14.596 3.243 1.00 0.00 C ATOM 2385 O ILE B 876 7.021 15.155 2.384 1.00 0.00 O ATOM 2386 CB ILE B 876 7.015 12.608 4.673 1.00 0.00 C ATOM 2387 CG1 ILE B 876 7.691 12.163 5.984 1.00 0.00 C ATOM 2388 CG2 ILE B 876 7.751 12.020 3.472 1.00 0.00 C ATOM 2389 CD1 ILE B 876 7.730 10.658 6.187 1.00 0.00 C ATOM 0 H ILE B 876 5.654 14.040 6.209 1.00 0.00 H new ATOM 0 HA ILE B 876 7.980 14.551 4.645 1.00 0.00 H new ATOM 0 HB ILE B 876 5.991 12.234 4.663 1.00 0.00 H new ATOM 0 HG12 ILE B 876 8.711 12.547 6.002 1.00 0.00 H new ATOM 0 HG13 ILE B 876 7.165 12.618 6.823 1.00 0.00 H new ATOM 0 HG21 ILE B 876 7.774 10.933 3.556 1.00 0.00 H new ATOM 0 HG22 ILE B 876 7.234 12.302 2.555 1.00 0.00 H new ATOM 0 HG23 ILE B 876 8.771 12.404 3.447 1.00 0.00 H new ATOM 0 HD11 ILE B 876 8.222 10.431 7.133 1.00 0.00 H new ATOM 0 HD12 ILE B 876 6.713 10.267 6.204 1.00 0.00 H new ATOM 0 HD13 ILE B 876 8.283 10.195 5.370 1.00 0.00 H new ATOM 2401 N LEU B 877 5.047 14.347 3.084 1.00 0.00 N ATOM 2402 CA LEU B 877 4.333 14.666 1.843 1.00 0.00 C ATOM 2403 C LEU B 877 4.190 16.168 1.640 1.00 0.00 C ATOM 2404 O LEU B 877 4.269 16.664 0.514 1.00 0.00 O ATOM 2405 CB LEU B 877 2.945 13.998 1.790 1.00 0.00 C ATOM 2406 CG LEU B 877 2.869 12.498 1.402 1.00 0.00 C ATOM 2407 CD1 LEU B 877 3.737 11.612 2.272 1.00 0.00 C ATOM 2408 CD2 LEU B 877 1.432 12.024 1.447 1.00 0.00 C ATOM 0 H LEU B 877 4.462 13.921 3.803 1.00 0.00 H new ATOM 0 HA LEU B 877 4.940 14.264 1.032 1.00 0.00 H new ATOM 0 HB2 LEU B 877 2.483 14.112 2.770 1.00 0.00 H new ATOM 0 HB3 LEU B 877 2.333 14.557 1.082 1.00 0.00 H new ATOM 0 HG LEU B 877 3.258 12.416 0.387 1.00 0.00 H new ATOM 0 HD11 LEU B 877 3.638 10.576 1.949 1.00 0.00 H new ATOM 0 HD12 LEU B 877 4.778 11.922 2.183 1.00 0.00 H new ATOM 0 HD13 LEU B 877 3.420 11.699 3.311 1.00 0.00 H new ATOM 0 HD21 LEU B 877 1.388 10.970 1.173 1.00 0.00 H new ATOM 0 HD22 LEU B 877 1.037 12.154 2.455 1.00 0.00 H new ATOM 0 HD23 LEU B 877 0.835 12.606 0.745 1.00 0.00 H new ATOM 2420 N GLY B 878 3.930 16.880 2.714 1.00 0.00 N ATOM 2421 CA GLY B 878 3.804 18.319 2.644 1.00 0.00 C ATOM 2422 C GLY B 878 2.377 18.768 2.413 1.00 0.00 C ATOM 2423 O GLY B 878 1.971 19.854 2.850 1.00 0.00 O ATOM 0 H GLY B 878 3.802 16.486 3.646 1.00 0.00 H new ATOM 0 HA2 GLY B 878 4.173 18.758 3.571 1.00 0.00 H new ATOM 0 HA3 GLY B 878 4.435 18.696 1.839 1.00 0.00 H new ATOM 2427 N ASN B 879 1.621 17.946 1.735 1.00 0.00 N ATOM 2428 CA ASN B 879 0.243 18.239 1.421 1.00 0.00 C ATOM 2429 C ASN B 879 -0.658 17.517 2.381 1.00 0.00 C ATOM 2430 O ASN B 879 -0.522 16.307 2.575 1.00 0.00 O ATOM 2431 CB ASN B 879 -0.079 17.805 0.009 1.00 0.00 C ATOM 2432 CG ASN B 879 -0.424 18.946 -0.914 1.00 0.00 C ATOM 2433 OD1 ASN B 879 0.447 19.518 -1.561 1.00 0.00 O ATOM 2434 ND2 ASN B 879 -1.683 19.287 -0.989 1.00 0.00 N ATOM 0 H ASN B 879 1.945 17.046 1.381 1.00 0.00 H new ATOM 0 HA ASN B 879 0.086 19.314 1.506 1.00 0.00 H new ATOM 0 HB2 ASN B 879 0.776 17.265 -0.399 1.00 0.00 H new ATOM 0 HB3 ASN B 879 -0.915 17.106 0.035 1.00 0.00 H new ATOM 0 HD21 ASN B 879 -1.969 20.052 -1.601 1.00 0.00 H new ATOM 0 HD22 ASN B 879 -2.380 18.789 -0.436 1.00 0.00 H new ATOM 2441 N ALA B 880 -1.587 18.241 2.952 1.00 0.00 N ATOM 2442 CA ALA B 880 -2.487 17.712 3.964 1.00 0.00 C ATOM 2443 C ALA B 880 -3.481 16.713 3.389 1.00 0.00 C ATOM 2444 O ALA B 880 -3.689 15.644 3.954 1.00 0.00 O ATOM 2445 CB ALA B 880 -3.217 18.847 4.628 1.00 0.00 C ATOM 0 H ALA B 880 -1.747 19.224 2.731 1.00 0.00 H new ATOM 0 HA ALA B 880 -1.885 17.176 4.697 1.00 0.00 H new ATOM 0 HB1 ALA B 880 -3.892 18.451 5.387 1.00 0.00 H new ATOM 0 HB2 ALA B 880 -2.497 19.518 5.097 1.00 0.00 H new ATOM 0 HB3 ALA B 880 -3.792 19.396 3.882 1.00 0.00 H new ATOM 2451 N ALA B 881 -4.073 17.061 2.259 1.00 0.00 N ATOM 2452 CA ALA B 881 -5.068 16.218 1.605 1.00 0.00 C ATOM 2453 C ALA B 881 -4.465 14.894 1.224 1.00 0.00 C ATOM 2454 O ALA B 881 -5.012 13.843 1.548 1.00 0.00 O ATOM 2455 CB ALA B 881 -5.606 16.901 0.374 1.00 0.00 C ATOM 0 H ALA B 881 -3.880 17.934 1.767 1.00 0.00 H new ATOM 0 HA ALA B 881 -5.886 16.048 2.305 1.00 0.00 H new ATOM 0 HB1 ALA B 881 -6.347 16.260 -0.103 1.00 0.00 H new ATOM 0 HB2 ALA B 881 -6.071 17.846 0.656 1.00 0.00 H new ATOM 0 HB3 ALA B 881 -4.789 17.092 -0.322 1.00 0.00 H new ATOM 2461 N ASN B 882 -3.321 14.965 0.559 1.00 0.00 N ATOM 2462 CA ASN B 882 -2.555 13.790 0.126 1.00 0.00 C ATOM 2463 C ASN B 882 -2.290 12.889 1.301 1.00 0.00 C ATOM 2464 O ASN B 882 -2.528 11.684 1.252 1.00 0.00 O ATOM 2465 CB ASN B 882 -1.197 14.208 -0.402 1.00 0.00 C ATOM 2466 CG ASN B 882 -1.201 15.138 -1.582 1.00 0.00 C ATOM 2467 OD1 ASN B 882 -2.105 15.959 -1.779 1.00 0.00 O ATOM 2468 ND2 ASN B 882 -0.168 15.058 -2.340 1.00 0.00 N ATOM 0 H ASN B 882 -2.887 15.850 0.298 1.00 0.00 H new ATOM 0 HA ASN B 882 -3.138 13.285 -0.644 1.00 0.00 H new ATOM 0 HB2 ASN B 882 -0.647 14.686 0.409 1.00 0.00 H new ATOM 0 HB3 ASN B 882 -0.645 13.309 -0.676 1.00 0.00 H new ATOM 0 HD21 ASN B 882 -0.071 15.686 -3.138 1.00 0.00 H new ATOM 0 HD22 ASN B 882 0.556 14.367 -2.144 1.00 0.00 H new ATOM 2475 N ALA B 883 -1.811 13.504 2.370 1.00 0.00 N ATOM 2476 CA ALA B 883 -1.481 12.818 3.587 1.00 0.00 C ATOM 2477 C ALA B 883 -2.686 12.148 4.173 1.00 0.00 C ATOM 2478 O ALA B 883 -2.598 11.025 4.649 1.00 0.00 O ATOM 2479 CB ALA B 883 -0.863 13.777 4.562 1.00 0.00 C ATOM 0 H ALA B 883 -1.642 14.509 2.407 1.00 0.00 H new ATOM 0 HA ALA B 883 -0.755 12.037 3.362 1.00 0.00 H new ATOM 0 HB1 ALA B 883 -0.615 13.250 5.483 1.00 0.00 H new ATOM 0 HB2 ALA B 883 0.044 14.200 4.131 1.00 0.00 H new ATOM 0 HB3 ALA B 883 -1.569 14.578 4.781 1.00 0.00 H new ATOM 2485 N LYS B 884 -3.814 12.816 4.119 1.00 0.00 N ATOM 2486 CA LYS B 884 -5.039 12.241 4.586 1.00 0.00 C ATOM 2487 C LYS B 884 -5.435 11.025 3.746 1.00 0.00 C ATOM 2488 O LYS B 884 -5.814 10.001 4.303 1.00 0.00 O ATOM 2489 CB LYS B 884 -6.172 13.268 4.603 1.00 0.00 C ATOM 2490 CG LYS B 884 -7.527 12.637 4.866 1.00 0.00 C ATOM 2491 CD LYS B 884 -7.590 11.998 6.250 1.00 0.00 C ATOM 2492 CE LYS B 884 -8.816 11.126 6.391 1.00 0.00 C ATOM 2493 NZ LYS B 884 -10.080 11.884 6.237 1.00 0.00 N ATOM 0 H LYS B 884 -3.902 13.764 3.753 1.00 0.00 H new ATOM 0 HA LYS B 884 -4.868 11.911 5.611 1.00 0.00 H new ATOM 0 HB2 LYS B 884 -5.968 14.016 5.370 1.00 0.00 H new ATOM 0 HB3 LYS B 884 -6.198 13.791 3.647 1.00 0.00 H new ATOM 0 HG2 LYS B 884 -8.305 13.395 4.779 1.00 0.00 H new ATOM 0 HG3 LYS B 884 -7.731 11.882 4.107 1.00 0.00 H new ATOM 0 HD2 LYS B 884 -6.694 11.401 6.420 1.00 0.00 H new ATOM 0 HD3 LYS B 884 -7.604 12.776 7.013 1.00 0.00 H new ATOM 0 HE2 LYS B 884 -8.780 10.333 5.644 1.00 0.00 H new ATOM 0 HE3 LYS B 884 -8.803 10.644 7.369 1.00 0.00 H new ATOM 0 HZ1 LYS B 884 -10.886 11.260 6.443 1.00 0.00 H new ATOM 0 HZ2 LYS B 884 -10.086 12.687 6.898 1.00 0.00 H new ATOM 0 HZ3 LYS B 884 -10.156 12.237 5.262 1.00 0.00 H new ATOM 2507 N GLN B 885 -5.313 11.142 2.424 1.00 0.00 N ATOM 2508 CA GLN B 885 -5.714 10.072 1.513 1.00 0.00 C ATOM 2509 C GLN B 885 -4.891 8.831 1.800 1.00 0.00 C ATOM 2510 O GLN B 885 -5.416 7.720 1.880 1.00 0.00 O ATOM 2511 CB GLN B 885 -5.486 10.467 0.049 1.00 0.00 C ATOM 2512 CG GLN B 885 -6.110 11.777 -0.426 1.00 0.00 C ATOM 2513 CD GLN B 885 -7.543 11.973 0.001 1.00 0.00 C ATOM 2514 OE1 GLN B 885 -8.480 11.541 -0.673 1.00 0.00 O ATOM 2515 NE2 GLN B 885 -7.724 12.695 1.073 1.00 0.00 N ATOM 0 H GLN B 885 -4.939 11.970 1.960 1.00 0.00 H new ATOM 0 HA GLN B 885 -6.776 9.883 1.669 1.00 0.00 H new ATOM 0 HB2 GLN B 885 -4.411 10.523 -0.122 1.00 0.00 H new ATOM 0 HB3 GLN B 885 -5.867 9.663 -0.581 1.00 0.00 H new ATOM 0 HG2 GLN B 885 -5.514 12.608 -0.048 1.00 0.00 H new ATOM 0 HG3 GLN B 885 -6.059 11.817 -1.514 1.00 0.00 H new ATOM 0 HE21 GLN B 885 -6.920 13.033 1.602 1.00 0.00 H new ATOM 0 HE22 GLN B 885 -8.669 12.922 1.382 1.00 0.00 H new ATOM 2524 N LEU B 886 -3.607 9.055 1.992 1.00 0.00 N ATOM 2525 CA LEU B 886 -2.664 8.037 2.271 1.00 0.00 C ATOM 2526 C LEU B 886 -2.945 7.411 3.636 1.00 0.00 C ATOM 2527 O LEU B 886 -3.144 6.202 3.744 1.00 0.00 O ATOM 2528 CB LEU B 886 -1.272 8.670 2.231 1.00 0.00 C ATOM 2529 CG LEU B 886 -0.126 7.804 2.697 1.00 0.00 C ATOM 2530 CD1 LEU B 886 0.020 6.571 1.824 1.00 0.00 C ATOM 2531 CD2 LEU B 886 1.166 8.593 2.754 1.00 0.00 C ATOM 0 H LEU B 886 -3.196 9.988 1.953 1.00 0.00 H new ATOM 0 HA LEU B 886 -2.730 7.239 1.532 1.00 0.00 H new ATOM 0 HB2 LEU B 886 -1.069 8.983 1.207 1.00 0.00 H new ATOM 0 HB3 LEU B 886 -1.289 9.572 2.843 1.00 0.00 H new ATOM 0 HG LEU B 886 -0.353 7.467 3.708 1.00 0.00 H new ATOM 0 HD11 LEU B 886 0.853 5.967 2.184 1.00 0.00 H new ATOM 0 HD12 LEU B 886 -0.898 5.985 1.866 1.00 0.00 H new ATOM 0 HD13 LEU B 886 0.210 6.875 0.795 1.00 0.00 H new ATOM 0 HD21 LEU B 886 1.974 7.944 3.093 1.00 0.00 H new ATOM 0 HD22 LEU B 886 1.401 8.978 1.762 1.00 0.00 H new ATOM 0 HD23 LEU B 886 1.054 9.425 3.449 1.00 0.00 H new ATOM 2543 N TYR B 887 -2.995 8.255 4.654 1.00 0.00 N ATOM 2544 CA TYR B 887 -3.223 7.842 6.030 1.00 0.00 C ATOM 2545 C TYR B 887 -4.502 7.031 6.180 1.00 0.00 C ATOM 2546 O TYR B 887 -4.465 5.915 6.735 1.00 0.00 O ATOM 2547 CB TYR B 887 -3.239 9.073 6.953 1.00 0.00 C ATOM 2548 CG TYR B 887 -3.721 8.813 8.358 1.00 0.00 C ATOM 2549 CD1 TYR B 887 -2.900 8.231 9.321 1.00 0.00 C ATOM 2550 CD2 TYR B 887 -5.017 9.151 8.718 1.00 0.00 C ATOM 2551 CE1 TYR B 887 -3.369 8.002 10.598 1.00 0.00 C ATOM 2552 CE2 TYR B 887 -5.486 8.926 9.984 1.00 0.00 C ATOM 2553 CZ TYR B 887 -4.662 8.348 10.921 1.00 0.00 C ATOM 2554 OH TYR B 887 -5.135 8.132 12.197 1.00 0.00 O ATOM 0 H TYR B 887 -2.876 9.262 4.546 1.00 0.00 H new ATOM 0 HA TYR B 887 -2.401 7.189 6.323 1.00 0.00 H new ATOM 0 HB2 TYR B 887 -2.231 9.484 7.002 1.00 0.00 H new ATOM 0 HB3 TYR B 887 -3.874 9.837 6.503 1.00 0.00 H new ATOM 0 HD1 TYR B 887 -1.887 7.957 9.066 1.00 0.00 H new ATOM 0 HD2 TYR B 887 -5.669 9.601 7.984 1.00 0.00 H new ATOM 0 HE1 TYR B 887 -2.725 7.554 11.340 1.00 0.00 H new ATOM 0 HE2 TYR B 887 -6.497 9.201 10.246 1.00 0.00 H new ATOM 0 HH TYR B 887 -6.066 8.434 12.256 1.00 0.00 H new ATOM 2564 N ASP B 888 -5.621 7.583 5.694 1.00 0.00 N ATOM 2565 CA ASP B 888 -6.916 6.929 5.783 1.00 0.00 C ATOM 2566 C ASP B 888 -6.880 5.569 5.148 1.00 0.00 C ATOM 2567 O ASP B 888 -7.307 4.619 5.748 1.00 0.00 O ATOM 2568 CB ASP B 888 -7.982 7.785 5.129 1.00 0.00 C ATOM 2569 CG ASP B 888 -9.377 7.217 5.250 1.00 0.00 C ATOM 2570 OD1 ASP B 888 -9.977 7.319 6.345 1.00 0.00 O ATOM 2571 OD2 ASP B 888 -9.927 6.739 4.248 1.00 0.00 O ATOM 0 H ASP B 888 -5.646 8.492 5.231 1.00 0.00 H new ATOM 0 HA ASP B 888 -7.160 6.804 6.838 1.00 0.00 H new ATOM 0 HB2 ASP B 888 -7.964 8.778 5.578 1.00 0.00 H new ATOM 0 HB3 ASP B 888 -7.740 7.908 4.073 1.00 0.00 H new ATOM 2576 N PHE B 889 -6.281 5.486 3.964 1.00 0.00 N ATOM 2577 CA PHE B 889 -6.164 4.243 3.212 1.00 0.00 C ATOM 2578 C PHE B 889 -5.471 3.156 4.016 1.00 0.00 C ATOM 2579 O PHE B 889 -5.949 2.025 4.099 1.00 0.00 O ATOM 2580 CB PHE B 889 -5.402 4.490 1.919 1.00 0.00 C ATOM 2581 CG PHE B 889 -5.124 3.252 1.115 1.00 0.00 C ATOM 2582 CD1 PHE B 889 -6.086 2.728 0.282 1.00 0.00 C ATOM 2583 CD2 PHE B 889 -3.888 2.627 1.186 1.00 0.00 C ATOM 2584 CE1 PHE B 889 -5.833 1.604 -0.464 1.00 0.00 C ATOM 2585 CE2 PHE B 889 -3.621 1.504 0.438 1.00 0.00 C ATOM 2586 CZ PHE B 889 -4.594 0.989 -0.390 1.00 0.00 C ATOM 0 H PHE B 889 -5.859 6.288 3.496 1.00 0.00 H new ATOM 0 HA PHE B 889 -7.173 3.898 2.987 1.00 0.00 H new ATOM 0 HB2 PHE B 889 -5.971 5.187 1.304 1.00 0.00 H new ATOM 0 HB3 PHE B 889 -4.455 4.974 2.157 1.00 0.00 H new ATOM 0 HD1 PHE B 889 -7.052 3.207 0.214 1.00 0.00 H new ATOM 0 HD2 PHE B 889 -3.125 3.027 1.837 1.00 0.00 H new ATOM 0 HE1 PHE B 889 -6.599 1.199 -1.108 1.00 0.00 H new ATOM 0 HE2 PHE B 889 -2.653 1.028 0.500 1.00 0.00 H new ATOM 0 HZ PHE B 889 -4.391 0.108 -0.980 1.00 0.00 H new ATOM 2596 N ILE B 890 -4.355 3.511 4.612 1.00 0.00 N ATOM 2597 CA ILE B 890 -3.561 2.577 5.395 1.00 0.00 C ATOM 2598 C ILE B 890 -4.365 2.083 6.594 1.00 0.00 C ATOM 2599 O ILE B 890 -4.266 0.933 7.003 1.00 0.00 O ATOM 2600 CB ILE B 890 -2.263 3.257 5.905 1.00 0.00 C ATOM 2601 CG1 ILE B 890 -1.467 3.839 4.729 1.00 0.00 C ATOM 2602 CG2 ILE B 890 -1.407 2.270 6.700 1.00 0.00 C ATOM 2603 CD1 ILE B 890 -0.212 4.583 5.141 1.00 0.00 C ATOM 0 H ILE B 890 -3.968 4.454 4.571 1.00 0.00 H new ATOM 0 HA ILE B 890 -3.298 1.735 4.754 1.00 0.00 H new ATOM 0 HB ILE B 890 -2.543 4.073 6.571 1.00 0.00 H new ATOM 0 HG12 ILE B 890 -1.191 3.029 4.054 1.00 0.00 H new ATOM 0 HG13 ILE B 890 -2.111 4.516 4.168 1.00 0.00 H new ATOM 0 HG21 ILE B 890 -0.503 2.770 7.047 1.00 0.00 H new ATOM 0 HG22 ILE B 890 -1.973 1.907 7.558 1.00 0.00 H new ATOM 0 HG23 ILE B 890 -1.135 1.429 6.062 1.00 0.00 H new ATOM 0 HD11 ILE B 890 0.293 4.963 4.253 1.00 0.00 H new ATOM 0 HD12 ILE B 890 -0.480 5.416 5.791 1.00 0.00 H new ATOM 0 HD13 ILE B 890 0.454 3.905 5.675 1.00 0.00 H new ATOM 2615 N HIS B 891 -5.204 2.943 7.090 1.00 0.00 N ATOM 2616 CA HIS B 891 -5.961 2.664 8.295 1.00 0.00 C ATOM 2617 C HIS B 891 -7.379 2.209 8.004 1.00 0.00 C ATOM 2618 O HIS B 891 -8.170 2.015 8.926 1.00 0.00 O ATOM 2619 CB HIS B 891 -5.966 3.884 9.229 1.00 0.00 C ATOM 2620 CG HIS B 891 -4.637 4.135 9.859 1.00 0.00 C ATOM 2621 ND1 HIS B 891 -3.562 4.652 9.186 1.00 0.00 N ATOM 2622 CD2 HIS B 891 -4.199 3.858 11.108 1.00 0.00 C ATOM 2623 CE1 HIS B 891 -2.519 4.662 10.013 1.00 0.00 C ATOM 2624 NE2 HIS B 891 -2.851 4.191 11.205 1.00 0.00 N ATOM 0 H HIS B 891 -5.390 3.858 6.679 1.00 0.00 H new ATOM 0 HA HIS B 891 -5.459 1.836 8.795 1.00 0.00 H new ATOM 0 HB2 HIS B 891 -6.268 4.766 8.665 1.00 0.00 H new ATOM 0 HB3 HIS B 891 -6.711 3.735 10.010 1.00 0.00 H new ATOM 0 HD1 HIS B 891 -3.561 4.974 8.218 1.00 0.00 H new ATOM 0 HD2 HIS B 891 -4.800 3.444 11.904 1.00 0.00 H new ATOM 0 HE1 HIS B 891 -1.532 5.009 9.747 1.00 0.00 H new ATOM 2632 N THR B 892 -7.698 2.013 6.754 1.00 0.00 N ATOM 2633 CA THR B 892 -9.024 1.629 6.398 1.00 0.00 C ATOM 2634 C THR B 892 -8.990 0.299 5.637 1.00 0.00 C ATOM 2635 O THR B 892 -7.923 -0.303 5.442 1.00 0.00 O ATOM 2636 CB THR B 892 -9.753 2.760 5.566 1.00 0.00 C ATOM 2637 OG1 THR B 892 -11.180 2.566 5.574 1.00 0.00 O ATOM 2638 CG2 THR B 892 -9.283 2.777 4.117 1.00 0.00 C ATOM 0 H THR B 892 -7.054 2.114 5.970 1.00 0.00 H new ATOM 0 HA THR B 892 -9.604 1.491 7.310 1.00 0.00 H new ATOM 0 HB THR B 892 -9.502 3.709 6.041 1.00 0.00 H new ATOM 0 HG1 THR B 892 -11.610 3.278 5.055 1.00 0.00 H new ATOM 0 HG21 THR B 892 -9.804 3.566 3.575 1.00 0.00 H new ATOM 0 HG22 THR B 892 -8.209 2.963 4.085 1.00 0.00 H new ATOM 0 HG23 THR B 892 -9.499 1.814 3.653 1.00 0.00 H new ATOM 2646 N SER B 893 -10.137 -0.150 5.251 1.00 0.00 N ATOM 2647 CA SER B 893 -10.327 -1.357 4.530 1.00 0.00 C ATOM 2648 C SER B 893 -11.414 -1.031 3.528 1.00 0.00 C ATOM 2649 O SER B 893 -12.170 -0.088 3.747 1.00 0.00 O ATOM 2650 CB SER B 893 -10.834 -2.446 5.489 1.00 0.00 C ATOM 2651 OG SER B 893 -10.105 -2.455 6.718 1.00 0.00 O ATOM 0 H SER B 893 -11.010 0.343 5.441 1.00 0.00 H new ATOM 0 HA SER B 893 -9.412 -1.715 4.059 1.00 0.00 H new ATOM 0 HB2 SER B 893 -11.892 -2.284 5.696 1.00 0.00 H new ATOM 0 HB3 SER B 893 -10.749 -3.421 5.009 1.00 0.00 H new ATOM 0 HG SER B 893 -10.457 -3.159 7.302 1.00 0.00 H new ATOM 2657 N PHE B 894 -11.529 -1.761 2.460 1.00 0.00 N ATOM 2658 CA PHE B 894 -12.598 -1.444 1.520 1.00 0.00 C ATOM 2659 C PHE B 894 -13.928 -1.949 2.073 1.00 0.00 C ATOM 2660 O PHE B 894 -14.961 -1.309 1.940 1.00 0.00 O ATOM 2661 CB PHE B 894 -12.334 -2.005 0.107 1.00 0.00 C ATOM 2662 CG PHE B 894 -12.433 -3.506 -0.027 1.00 0.00 C ATOM 2663 CD1 PHE B 894 -11.382 -4.324 0.323 1.00 0.00 C ATOM 2664 CD2 PHE B 894 -13.593 -4.089 -0.509 1.00 0.00 C ATOM 2665 CE1 PHE B 894 -11.486 -5.697 0.193 1.00 0.00 C ATOM 2666 CE2 PHE B 894 -13.697 -5.455 -0.639 1.00 0.00 C ATOM 2667 CZ PHE B 894 -12.644 -6.260 -0.286 1.00 0.00 C ATOM 0 H PHE B 894 -10.932 -2.550 2.211 1.00 0.00 H new ATOM 0 HA PHE B 894 -12.637 -0.360 1.412 1.00 0.00 H new ATOM 0 HB2 PHE B 894 -13.043 -1.549 -0.584 1.00 0.00 H new ATOM 0 HB3 PHE B 894 -11.338 -1.695 -0.207 1.00 0.00 H new ATOM 0 HD1 PHE B 894 -10.469 -3.890 0.702 1.00 0.00 H new ATOM 0 HD2 PHE B 894 -14.428 -3.463 -0.787 1.00 0.00 H new ATOM 0 HE1 PHE B 894 -10.654 -6.328 0.469 1.00 0.00 H new ATOM 0 HE2 PHE B 894 -14.608 -5.893 -1.019 1.00 0.00 H new ATOM 0 HZ PHE B 894 -12.725 -7.332 -0.384 1.00 0.00 H new