USER MOD reduce.3.24.130724 H: found=0, std=0, add=1008, rem=0, adj=33 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: A 259 SER OG : rot -87:sc= 0.897 USER MOD Set 1.2: B 893 SER OG : rot 180:sc= -0.292 USER MOD Set 2.1: B 848 ASN : amide:sc= -3.4 K(o=-3.5,f=-8.4!) USER MOD Set 2.2: B 851 ASN : amide:sc= 0.0231 K(o=-3.5,f=-6.2) USER MOD Set 2.3: B 882 ASN : amide:sc= -0.173 K(o=-3.5,f=-6.2!) USER MOD Set 3.1: A 240 THR OG1 : rot 14:sc= 1.16 USER MOD Set 3.2: A 250 SER OG : rot 76:sc= 1.71 USER MOD Set 4.1: A 247 LYS NZ :NH3+ 166:sc= -0.0295 (180deg=-0.24) USER MOD Set 4.2: A 251 GLN : amide:sc= 0.0102 X(o=-0.019,f=-0.3) USER MOD Single : A 233 SER OG : rot 180:sc= 0 USER MOD Single : A 236 THR OG1 : rot 87:sc= 0.625 USER MOD Single : A 238 CYS SG : rot -140:sc= 0.693 USER MOD Single : A 241 THR OG1 : rot -105:sc= 1.19 USER MOD Single : A 243 LYS NZ :NH3+ -166:sc= -0.0163 (180deg=-0.211) USER MOD Single : A 244 SER OG : rot -130:sc= -0.147 USER MOD Single : A 246 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 248 THR OG1 : rot 180:sc= 0 USER MOD Single : A 252 THR OG1 : rot 73:sc= 1.26 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 THR OG1 : rot -92:sc= 0.651 USER MOD Single : A 262 GLN :FLIP amide:sc= -0.209 F(o=-1.6!,f=-0.21) USER MOD Single : A 267 SER OG : rot -118:sc= 1.26 USER MOD Single : A 274 CYS SG : rot 98:sc= -3.01! USER MOD Single : A 280 GLN : amide:sc= -2.13 K(o=-2.1,f=-7!) USER MOD Single : A 281 LYS NZ :NH3+ -173:sc= 1.74 (180deg=1.36) USER MOD Single : A 290 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 833 TYR OH : rot -10:sc= 0.992 USER MOD Single : B 834 ASN : amide:sc=-0.00573 K(o=-0.0057,f=-1.7) USER MOD Single : B 838 GLN : amide:sc= -0.681 K(o=-0.68,f=-2.8!) USER MOD Single : B 843 LYS NZ :NH3+ -165:sc= 1.22 (180deg=1.04) USER MOD Single : B 844 MET CE :methyl -131:sc= -0.322 (180deg=-2.48!) USER MOD Single : B 850 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 852 CYS SG : rot 47:sc= -4.5! USER MOD Single : B 854 SER OG : rot 73:sc= 0.23 USER MOD Single : B 856 MET CE :methyl 166:sc= -0.354 (180deg=-0.66) USER MOD Single : B 857 HIS : no HE2:sc= 0.3 K(o=0.3,f=-5.1!) USER MOD Single : B 858 HIS :FLIP no HE2:sc=-0.00504 F(o=-0.93,f=-0.005) USER MOD Single : B 860 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 861 ASN : amide:sc= -3.66! C(o=-3.7!,f=-4.4!) USER MOD Single : B 869 SER OG : rot -114:sc= 1.22 USER MOD Single : B 870 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : B 874 THR OG1 : rot 80:sc= 1.24 USER MOD Single : B 875 SER OG : rot 82:sc= 0.101 USER MOD Single : B 879 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 884 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 885 GLN : amide:sc= 0.368 K(o=0.37,f=-0.26) USER MOD Single : B 887 TYR OH : rot 180:sc= 0 USER MOD Single : B 891 HIS : no HE2:sc= 1.24 K(o=1.2,f=-3.9!) USER MOD Single : B 892 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 335 N ASP A 230 -12.048 3.073 -5.494 1.00 0.00 N ATOM 336 CA ASP A 230 -10.621 3.308 -5.534 1.00 0.00 C ATOM 337 C ASP A 230 -9.917 2.461 -4.500 1.00 0.00 C ATOM 338 O ASP A 230 -8.869 1.910 -4.777 1.00 0.00 O ATOM 339 CB ASP A 230 -10.262 4.787 -5.371 1.00 0.00 C ATOM 340 CG ASP A 230 -8.782 5.038 -5.611 1.00 0.00 C ATOM 341 OD1 ASP A 230 -8.329 4.927 -6.770 1.00 0.00 O ATOM 342 OD2 ASP A 230 -8.054 5.372 -4.669 1.00 0.00 O ATOM 0 HA ASP A 230 -10.275 3.014 -6.525 1.00 0.00 H new ATOM 0 HB2 ASP A 230 -10.850 5.383 -6.069 1.00 0.00 H new ATOM 0 HB3 ASP A 230 -10.529 5.117 -4.367 1.00 0.00 H new ATOM 347 N LEU A 231 -10.553 2.296 -3.337 1.00 0.00 N ATOM 348 CA LEU A 231 -10.019 1.485 -2.238 1.00 0.00 C ATOM 349 C LEU A 231 -9.636 0.110 -2.686 1.00 0.00 C ATOM 350 O LEU A 231 -8.475 -0.286 -2.560 1.00 0.00 O ATOM 351 CB LEU A 231 -11.012 1.369 -1.073 1.00 0.00 C ATOM 352 CG LEU A 231 -11.181 2.611 -0.193 1.00 0.00 C ATOM 353 CD1 LEU A 231 -12.080 2.314 0.973 1.00 0.00 C ATOM 354 CD2 LEU A 231 -9.843 3.152 0.283 1.00 0.00 C ATOM 0 H LEU A 231 -11.456 2.722 -3.130 1.00 0.00 H new ATOM 0 HA LEU A 231 -9.126 2.007 -1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -11.988 1.105 -1.481 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -10.697 0.541 -0.438 1.00 0.00 H new ATOM 0 HG LEU A 231 -11.646 3.385 -0.804 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -12.188 3.209 1.586 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -13.059 2.004 0.608 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -11.646 1.513 1.572 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -10.007 4.033 0.904 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -9.328 2.388 0.865 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -9.233 3.424 -0.579 1.00 0.00 H new ATOM 366 N VAL A 232 -10.585 -0.606 -3.247 1.00 0.00 N ATOM 367 CA VAL A 232 -10.321 -1.949 -3.673 1.00 0.00 C ATOM 368 C VAL A 232 -9.280 -1.984 -4.783 1.00 0.00 C ATOM 369 O VAL A 232 -8.390 -2.826 -4.766 1.00 0.00 O ATOM 370 CB VAL A 232 -11.610 -2.728 -4.059 1.00 0.00 C ATOM 371 CG1 VAL A 232 -12.373 -2.062 -5.200 1.00 0.00 C ATOM 372 CG2 VAL A 232 -11.279 -4.164 -4.412 1.00 0.00 C ATOM 0 H VAL A 232 -11.536 -0.279 -3.415 1.00 0.00 H new ATOM 0 HA VAL A 232 -9.904 -2.472 -2.812 1.00 0.00 H new ATOM 0 HB VAL A 232 -12.262 -2.716 -3.186 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -13.264 -2.645 -5.431 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -12.665 -1.055 -4.903 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -11.735 -2.009 -6.082 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -12.194 -4.693 -4.679 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -10.590 -4.182 -5.256 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -10.815 -4.652 -3.555 1.00 0.00 H new ATOM 382 N SER A 233 -9.345 -1.024 -5.685 1.00 0.00 N ATOM 383 CA SER A 233 -8.404 -0.947 -6.774 1.00 0.00 C ATOM 384 C SER A 233 -6.968 -0.780 -6.244 1.00 0.00 C ATOM 385 O SER A 233 -6.064 -1.516 -6.646 1.00 0.00 O ATOM 386 CB SER A 233 -8.773 0.210 -7.678 1.00 0.00 C ATOM 387 OG SER A 233 -10.098 0.067 -8.199 1.00 0.00 O ATOM 0 H SER A 233 -10.047 -0.284 -5.680 1.00 0.00 H new ATOM 0 HA SER A 233 -8.445 -1.875 -7.344 1.00 0.00 H new ATOM 0 HB2 SER A 233 -8.698 1.145 -7.123 1.00 0.00 H new ATOM 0 HB3 SER A 233 -8.062 0.271 -8.502 1.00 0.00 H new ATOM 0 HG SER A 233 -10.306 0.830 -8.777 1.00 0.00 H new ATOM 393 N ARG A 234 -6.796 0.141 -5.295 1.00 0.00 N ATOM 394 CA ARG A 234 -5.495 0.428 -4.712 1.00 0.00 C ATOM 395 C ARG A 234 -4.957 -0.777 -3.988 1.00 0.00 C ATOM 396 O ARG A 234 -3.850 -1.211 -4.271 1.00 0.00 O ATOM 397 CB ARG A 234 -5.571 1.586 -3.727 1.00 0.00 C ATOM 398 CG ARG A 234 -6.035 2.894 -4.297 1.00 0.00 C ATOM 399 CD ARG A 234 -5.083 3.432 -5.321 1.00 0.00 C ATOM 400 NE ARG A 234 -5.576 4.672 -5.891 1.00 0.00 N ATOM 401 CZ ARG A 234 -4.884 5.478 -6.679 1.00 0.00 C ATOM 402 NH1 ARG A 234 -3.572 5.288 -6.850 1.00 0.00 N ATOM 403 NH2 ARG A 234 -5.494 6.500 -7.260 1.00 0.00 N ATOM 0 H ARG A 234 -7.555 0.705 -4.913 1.00 0.00 H new ATOM 0 HA ARG A 234 -4.831 0.696 -5.534 1.00 0.00 H new ATOM 0 HB2 ARG A 234 -6.242 1.305 -2.915 1.00 0.00 H new ATOM 0 HB3 ARG A 234 -4.584 1.731 -3.288 1.00 0.00 H new ATOM 0 HG2 ARG A 234 -7.018 2.763 -4.750 1.00 0.00 H new ATOM 0 HG3 ARG A 234 -6.149 3.620 -3.492 1.00 0.00 H new ATOM 0 HD2 ARG A 234 -4.108 3.601 -4.863 1.00 0.00 H new ATOM 0 HD3 ARG A 234 -4.940 2.696 -6.112 1.00 0.00 H new ATOM 0 HE ARG A 234 -6.533 4.944 -5.666 1.00 0.00 H new ATOM 0 HH11 ARG A 234 -3.101 4.520 -6.372 1.00 0.00 H new ATOM 0 HH12 ARG A 234 -3.041 5.911 -7.458 1.00 0.00 H new ATOM 0 HH21 ARG A 234 -6.488 6.660 -7.098 1.00 0.00 H new ATOM 0 HH22 ARG A 234 -4.969 7.128 -7.869 1.00 0.00 H new ATOM 417 N VAL A 235 -5.766 -1.344 -3.077 1.00 0.00 N ATOM 418 CA VAL A 235 -5.310 -2.467 -2.273 1.00 0.00 C ATOM 419 C VAL A 235 -4.901 -3.631 -3.167 1.00 0.00 C ATOM 420 O VAL A 235 -3.818 -4.166 -2.998 1.00 0.00 O ATOM 421 CB VAL A 235 -6.342 -2.956 -1.196 1.00 0.00 C ATOM 422 CG1 VAL A 235 -5.710 -4.012 -0.298 1.00 0.00 C ATOM 423 CG2 VAL A 235 -6.841 -1.812 -0.339 1.00 0.00 C ATOM 0 H VAL A 235 -6.722 -1.042 -2.888 1.00 0.00 H new ATOM 0 HA VAL A 235 -4.449 -2.095 -1.717 1.00 0.00 H new ATOM 0 HB VAL A 235 -7.190 -3.383 -1.732 1.00 0.00 H new ATOM 0 HG11 VAL A 235 -6.438 -4.342 0.444 1.00 0.00 H new ATOM 0 HG12 VAL A 235 -5.397 -4.863 -0.902 1.00 0.00 H new ATOM 0 HG13 VAL A 235 -4.843 -3.588 0.208 1.00 0.00 H new ATOM 0 HG21 VAL A 235 -7.553 -2.190 0.394 1.00 0.00 H new ATOM 0 HG22 VAL A 235 -5.999 -1.350 0.177 1.00 0.00 H new ATOM 0 HG23 VAL A 235 -7.330 -1.071 -0.971 1.00 0.00 H new ATOM 433 N THR A 236 -5.738 -3.962 -4.167 1.00 0.00 N ATOM 434 CA THR A 236 -5.435 -5.069 -5.072 1.00 0.00 C ATOM 435 C THR A 236 -4.076 -4.824 -5.759 1.00 0.00 C ATOM 436 O THR A 236 -3.179 -5.663 -5.675 1.00 0.00 O ATOM 437 CB THR A 236 -6.534 -5.264 -6.157 1.00 0.00 C ATOM 438 OG1 THR A 236 -7.833 -5.227 -5.551 1.00 0.00 O ATOM 439 CG2 THR A 236 -6.388 -6.624 -6.814 1.00 0.00 C ATOM 0 H THR A 236 -6.617 -3.482 -4.362 1.00 0.00 H new ATOM 0 HA THR A 236 -5.398 -5.978 -4.471 1.00 0.00 H new ATOM 0 HB THR A 236 -6.423 -4.467 -6.892 1.00 0.00 H new ATOM 0 HG1 THR A 236 -8.146 -4.299 -5.504 1.00 0.00 H new ATOM 0 HG21 THR A 236 -7.163 -6.748 -7.571 1.00 0.00 H new ATOM 0 HG22 THR A 236 -5.407 -6.698 -7.283 1.00 0.00 H new ATOM 0 HG23 THR A 236 -6.489 -7.405 -6.060 1.00 0.00 H new ATOM 447 N GLU A 237 -3.923 -3.634 -6.361 1.00 0.00 N ATOM 448 CA GLU A 237 -2.684 -3.237 -7.035 1.00 0.00 C ATOM 449 C GLU A 237 -1.483 -3.341 -6.116 1.00 0.00 C ATOM 450 O GLU A 237 -0.461 -3.923 -6.491 1.00 0.00 O ATOM 451 CB GLU A 237 -2.784 -1.814 -7.557 1.00 0.00 C ATOM 452 CG GLU A 237 -3.636 -1.648 -8.796 1.00 0.00 C ATOM 453 CD GLU A 237 -2.945 -2.178 -10.020 1.00 0.00 C ATOM 454 OE1 GLU A 237 -3.089 -3.377 -10.341 1.00 0.00 O ATOM 455 OE2 GLU A 237 -2.234 -1.393 -10.687 1.00 0.00 O ATOM 0 H GLU A 237 -4.655 -2.924 -6.392 1.00 0.00 H new ATOM 0 HA GLU A 237 -2.547 -3.926 -7.868 1.00 0.00 H new ATOM 0 HB2 GLU A 237 -3.189 -1.181 -6.768 1.00 0.00 H new ATOM 0 HB3 GLU A 237 -1.779 -1.450 -7.773 1.00 0.00 H new ATOM 0 HG2 GLU A 237 -4.584 -2.169 -8.659 1.00 0.00 H new ATOM 0 HG3 GLU A 237 -3.870 -0.593 -8.938 1.00 0.00 H new ATOM 462 N CYS A 238 -1.619 -2.814 -4.908 1.00 0.00 N ATOM 463 CA CYS A 238 -0.547 -2.818 -3.950 1.00 0.00 C ATOM 464 C CYS A 238 -0.050 -4.223 -3.656 1.00 0.00 C ATOM 465 O CYS A 238 1.137 -4.460 -3.677 1.00 0.00 O ATOM 466 CB CYS A 238 -0.947 -2.089 -2.674 1.00 0.00 C ATOM 467 SG CYS A 238 -1.183 -0.307 -2.887 1.00 0.00 S ATOM 0 H CYS A 238 -2.477 -2.375 -4.574 1.00 0.00 H new ATOM 0 HA CYS A 238 0.286 -2.275 -4.397 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -1.871 -2.524 -2.293 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -0.181 -2.256 -1.917 1.00 0.00 H new ATOM 0 HG CYS A 238 -0.694 0.321 -1.860 1.00 0.00 H new ATOM 473 N LEU A 239 -0.953 -5.164 -3.456 1.00 0.00 N ATOM 474 CA LEU A 239 -0.537 -6.544 -3.161 1.00 0.00 C ATOM 475 C LEU A 239 0.085 -7.155 -4.439 1.00 0.00 C ATOM 476 O LEU A 239 1.038 -7.926 -4.393 1.00 0.00 O ATOM 477 CB LEU A 239 -1.733 -7.423 -2.689 1.00 0.00 C ATOM 478 CG LEU A 239 -2.898 -6.722 -1.950 1.00 0.00 C ATOM 479 CD1 LEU A 239 -3.962 -7.711 -1.551 1.00 0.00 C ATOM 480 CD2 LEU A 239 -2.442 -5.947 -0.739 1.00 0.00 C ATOM 0 H LEU A 239 -1.962 -5.015 -3.489 1.00 0.00 H new ATOM 0 HA LEU A 239 0.190 -6.520 -2.350 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -2.146 -7.925 -3.564 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -1.339 -8.199 -2.033 1.00 0.00 H new ATOM 0 HG LEU A 239 -3.317 -6.007 -2.658 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -4.768 -7.190 -1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -4.358 -8.198 -2.442 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -3.531 -8.461 -0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -3.302 -5.478 -0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -1.961 -6.624 -0.033 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -1.733 -5.178 -1.045 1.00 0.00 H new ATOM 492 N THR A 240 -0.434 -6.702 -5.558 1.00 0.00 N ATOM 493 CA THR A 240 -0.084 -7.150 -6.915 1.00 0.00 C ATOM 494 C THR A 240 1.331 -6.688 -7.361 1.00 0.00 C ATOM 495 O THR A 240 1.920 -7.247 -8.303 1.00 0.00 O ATOM 496 CB THR A 240 -1.183 -6.627 -7.911 1.00 0.00 C ATOM 497 OG1 THR A 240 -2.412 -7.343 -7.752 1.00 0.00 O ATOM 498 CG2 THR A 240 -0.765 -6.609 -9.374 1.00 0.00 C ATOM 0 H THR A 240 -1.149 -5.974 -5.562 1.00 0.00 H new ATOM 0 HA THR A 240 -0.054 -8.240 -6.917 1.00 0.00 H new ATOM 0 HB THR A 240 -1.329 -5.583 -7.635 1.00 0.00 H new ATOM 0 HG1 THR A 240 -2.389 -7.851 -6.914 1.00 0.00 H new ATOM 0 HG21 THR A 240 -1.588 -6.234 -9.983 1.00 0.00 H new ATOM 0 HG22 THR A 240 0.103 -5.961 -9.497 1.00 0.00 H new ATOM 0 HG23 THR A 240 -0.510 -7.620 -9.692 1.00 0.00 H new ATOM 506 N THR A 241 1.889 -5.734 -6.656 1.00 0.00 N ATOM 507 CA THR A 241 3.181 -5.155 -7.033 1.00 0.00 C ATOM 508 C THR A 241 4.348 -6.160 -6.925 1.00 0.00 C ATOM 509 O THR A 241 5.458 -5.913 -7.423 1.00 0.00 O ATOM 510 CB THR A 241 3.482 -3.954 -6.158 1.00 0.00 C ATOM 511 OG1 THR A 241 3.514 -4.358 -4.783 1.00 0.00 O ATOM 512 CG2 THR A 241 2.420 -2.904 -6.360 1.00 0.00 C ATOM 0 H THR A 241 1.477 -5.333 -5.814 1.00 0.00 H new ATOM 0 HA THR A 241 3.097 -4.861 -8.079 1.00 0.00 H new ATOM 0 HB THR A 241 4.452 -3.539 -6.431 1.00 0.00 H new ATOM 0 HG1 THR A 241 2.700 -4.051 -4.333 1.00 0.00 H new ATOM 0 HG21 THR A 241 2.637 -2.041 -5.731 1.00 0.00 H new ATOM 0 HG22 THR A 241 2.407 -2.596 -7.406 1.00 0.00 H new ATOM 0 HG23 THR A 241 1.447 -3.314 -6.090 1.00 0.00 H new ATOM 520 N VAL A 242 4.093 -7.271 -6.283 1.00 0.00 N ATOM 521 CA VAL A 242 5.041 -8.337 -6.174 1.00 0.00 C ATOM 522 C VAL A 242 4.937 -9.185 -7.435 1.00 0.00 C ATOM 523 O VAL A 242 3.856 -9.633 -7.766 1.00 0.00 O ATOM 524 CB VAL A 242 4.707 -9.231 -4.964 1.00 0.00 C ATOM 525 CG1 VAL A 242 5.708 -10.353 -4.821 1.00 0.00 C ATOM 526 CG2 VAL A 242 4.638 -8.421 -3.694 1.00 0.00 C ATOM 0 H VAL A 242 3.206 -7.458 -5.816 1.00 0.00 H new ATOM 0 HA VAL A 242 6.042 -7.923 -6.048 1.00 0.00 H new ATOM 0 HB VAL A 242 3.726 -9.672 -5.143 1.00 0.00 H new ATOM 0 HG11 VAL A 242 5.446 -10.967 -3.959 1.00 0.00 H new ATOM 0 HG12 VAL A 242 5.696 -10.968 -5.721 1.00 0.00 H new ATOM 0 HG13 VAL A 242 6.705 -9.935 -4.680 1.00 0.00 H new ATOM 0 HG21 VAL A 242 4.401 -9.077 -2.856 1.00 0.00 H new ATOM 0 HG22 VAL A 242 5.600 -7.940 -3.517 1.00 0.00 H new ATOM 0 HG23 VAL A 242 3.863 -7.660 -3.789 1.00 0.00 H new ATOM 536 N LYS A 243 6.060 -9.407 -8.122 1.00 0.00 N ATOM 537 CA LYS A 243 6.086 -10.210 -9.374 1.00 0.00 C ATOM 538 C LYS A 243 5.362 -11.568 -9.250 1.00 0.00 C ATOM 539 O LYS A 243 4.697 -12.020 -10.186 1.00 0.00 O ATOM 540 CB LYS A 243 7.525 -10.422 -9.942 1.00 0.00 C ATOM 541 CG LYS A 243 8.555 -11.117 -9.019 1.00 0.00 C ATOM 542 CD LYS A 243 9.234 -10.164 -8.037 1.00 0.00 C ATOM 543 CE LYS A 243 10.177 -9.194 -8.762 1.00 0.00 C ATOM 544 NZ LYS A 243 11.335 -9.880 -9.390 1.00 0.00 N ATOM 0 H LYS A 243 6.972 -9.046 -7.842 1.00 0.00 H new ATOM 0 HA LYS A 243 5.530 -9.602 -10.088 1.00 0.00 H new ATOM 0 HB2 LYS A 243 7.444 -11.007 -10.858 1.00 0.00 H new ATOM 0 HB3 LYS A 243 7.925 -9.447 -10.221 1.00 0.00 H new ATOM 0 HG2 LYS A 243 8.054 -11.907 -8.459 1.00 0.00 H new ATOM 0 HG3 LYS A 243 9.317 -11.596 -9.634 1.00 0.00 H new ATOM 0 HD2 LYS A 243 8.477 -9.600 -7.492 1.00 0.00 H new ATOM 0 HD3 LYS A 243 9.796 -10.738 -7.300 1.00 0.00 H new ATOM 0 HE2 LYS A 243 9.619 -8.657 -9.529 1.00 0.00 H new ATOM 0 HE3 LYS A 243 10.541 -8.450 -8.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 12.053 -9.176 -9.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 11.746 -10.556 -8.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 11.018 -10.389 -10.240 1.00 0.00 H new ATOM 558 N SER A 244 5.467 -12.178 -8.090 1.00 0.00 N ATOM 559 CA SER A 244 4.870 -13.467 -7.834 1.00 0.00 C ATOM 560 C SER A 244 3.349 -13.357 -7.583 1.00 0.00 C ATOM 561 O SER A 244 2.595 -14.317 -7.796 1.00 0.00 O ATOM 562 CB SER A 244 5.550 -14.068 -6.614 1.00 0.00 C ATOM 563 OG SER A 244 6.964 -13.988 -6.740 1.00 0.00 O ATOM 0 H SER A 244 5.973 -11.790 -7.294 1.00 0.00 H new ATOM 0 HA SER A 244 5.007 -14.100 -8.710 1.00 0.00 H new ATOM 0 HB2 SER A 244 5.229 -13.541 -5.715 1.00 0.00 H new ATOM 0 HB3 SER A 244 5.248 -15.109 -6.498 1.00 0.00 H new ATOM 0 HG SER A 244 7.359 -14.865 -6.555 1.00 0.00 H new ATOM 569 N VAL A 245 2.907 -12.205 -7.163 1.00 0.00 N ATOM 570 CA VAL A 245 1.524 -12.010 -6.784 1.00 0.00 C ATOM 571 C VAL A 245 0.697 -11.488 -7.956 1.00 0.00 C ATOM 572 O VAL A 245 1.070 -10.524 -8.627 1.00 0.00 O ATOM 573 CB VAL A 245 1.404 -11.058 -5.555 1.00 0.00 C ATOM 574 CG1 VAL A 245 -0.048 -10.802 -5.181 1.00 0.00 C ATOM 575 CG2 VAL A 245 2.146 -11.642 -4.360 1.00 0.00 C ATOM 0 H VAL A 245 3.489 -11.372 -7.072 1.00 0.00 H new ATOM 0 HA VAL A 245 1.123 -12.982 -6.497 1.00 0.00 H new ATOM 0 HB VAL A 245 1.854 -10.106 -5.834 1.00 0.00 H new ATOM 0 HG11 VAL A 245 -0.090 -10.134 -4.320 1.00 0.00 H new ATOM 0 HG12 VAL A 245 -0.565 -10.341 -6.023 1.00 0.00 H new ATOM 0 HG13 VAL A 245 -0.531 -11.747 -4.931 1.00 0.00 H new ATOM 0 HG21 VAL A 245 2.054 -10.967 -3.509 1.00 0.00 H new ATOM 0 HG22 VAL A 245 1.717 -12.610 -4.103 1.00 0.00 H new ATOM 0 HG23 VAL A 245 3.199 -11.767 -4.611 1.00 0.00 H new ATOM 585 N ASN A 246 -0.380 -12.169 -8.227 1.00 0.00 N ATOM 586 CA ASN A 246 -1.313 -11.778 -9.251 1.00 0.00 C ATOM 587 C ASN A 246 -2.532 -11.138 -8.629 1.00 0.00 C ATOM 588 O ASN A 246 -2.639 -11.025 -7.396 1.00 0.00 O ATOM 589 CB ASN A 246 -1.761 -12.986 -10.084 1.00 0.00 C ATOM 590 CG ASN A 246 -0.733 -13.452 -11.081 1.00 0.00 C ATOM 591 OD1 ASN A 246 0.088 -14.335 -10.803 1.00 0.00 O ATOM 592 ND2 ASN A 246 -0.777 -12.884 -12.246 1.00 0.00 N ATOM 0 H ASN A 246 -0.640 -13.025 -7.737 1.00 0.00 H new ATOM 0 HA ASN A 246 -0.807 -11.065 -9.902 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -2.001 -13.810 -9.412 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -2.678 -12.730 -10.615 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -0.119 -13.162 -12.974 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -1.470 -12.160 -12.434 1.00 0.00 H new ATOM 599 N LYS A 247 -3.480 -10.760 -9.462 1.00 0.00 N ATOM 600 CA LYS A 247 -4.718 -10.176 -8.997 1.00 0.00 C ATOM 601 C LYS A 247 -5.543 -11.235 -8.273 1.00 0.00 C ATOM 602 O LYS A 247 -6.282 -10.925 -7.345 1.00 0.00 O ATOM 603 CB LYS A 247 -5.526 -9.595 -10.161 1.00 0.00 C ATOM 604 CG LYS A 247 -6.755 -8.807 -9.709 1.00 0.00 C ATOM 605 CD LYS A 247 -7.595 -8.307 -10.873 1.00 0.00 C ATOM 606 CE LYS A 247 -8.289 -9.444 -11.609 1.00 0.00 C ATOM 607 NZ LYS A 247 -9.253 -10.179 -10.743 1.00 0.00 N ATOM 0 H LYS A 247 -3.413 -10.849 -10.476 1.00 0.00 H new ATOM 0 HA LYS A 247 -4.478 -9.364 -8.311 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -4.882 -8.943 -10.752 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -5.844 -10.407 -10.815 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -7.370 -9.438 -9.068 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -6.435 -7.957 -9.107 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -8.343 -7.605 -10.504 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -6.959 -7.760 -11.569 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -8.816 -9.044 -12.475 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -7.539 -10.140 -11.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -9.865 -10.777 -11.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -8.730 -10.776 -10.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -9.838 -9.498 -10.218 1.00 0.00 H new ATOM 621 N THR A 248 -5.331 -12.498 -8.642 1.00 0.00 N ATOM 622 CA THR A 248 -6.100 -13.584 -8.060 1.00 0.00 C ATOM 623 C THR A 248 -5.587 -13.816 -6.645 1.00 0.00 C ATOM 624 O THR A 248 -6.343 -14.095 -5.702 1.00 0.00 O ATOM 625 CB THR A 248 -6.039 -14.895 -8.931 1.00 0.00 C ATOM 626 OG1 THR A 248 -6.874 -15.920 -8.376 1.00 0.00 O ATOM 627 CG2 THR A 248 -4.615 -15.431 -9.077 1.00 0.00 C ATOM 0 H THR A 248 -4.640 -12.787 -9.334 1.00 0.00 H new ATOM 0 HA THR A 248 -7.154 -13.308 -8.031 1.00 0.00 H new ATOM 0 HB THR A 248 -6.403 -14.622 -9.921 1.00 0.00 H new ATOM 0 HG1 THR A 248 -6.821 -16.723 -8.935 1.00 0.00 H new ATOM 0 HG21 THR A 248 -4.627 -16.335 -9.686 1.00 0.00 H new ATOM 0 HG22 THR A 248 -3.990 -14.678 -9.558 1.00 0.00 H new ATOM 0 HG23 THR A 248 -4.211 -15.663 -8.092 1.00 0.00 H new ATOM 635 N ASP A 249 -4.311 -13.589 -6.498 1.00 0.00 N ATOM 636 CA ASP A 249 -3.655 -13.685 -5.239 1.00 0.00 C ATOM 637 C ASP A 249 -4.135 -12.560 -4.354 1.00 0.00 C ATOM 638 O ASP A 249 -4.592 -12.777 -3.234 1.00 0.00 O ATOM 639 CB ASP A 249 -2.160 -13.556 -5.430 1.00 0.00 C ATOM 640 CG ASP A 249 -1.500 -14.704 -6.122 1.00 0.00 C ATOM 641 OD1 ASP A 249 -1.161 -15.705 -5.481 1.00 0.00 O ATOM 642 OD2 ASP A 249 -1.252 -14.600 -7.326 1.00 0.00 O ATOM 0 H ASP A 249 -3.694 -13.328 -7.267 1.00 0.00 H new ATOM 0 HA ASP A 249 -3.880 -14.649 -4.783 1.00 0.00 H new ATOM 0 HB2 ASP A 249 -1.961 -12.648 -5.999 1.00 0.00 H new ATOM 0 HB3 ASP A 249 -1.696 -13.428 -4.452 1.00 0.00 H new ATOM 647 N SER A 250 -4.090 -11.368 -4.905 1.00 0.00 N ATOM 648 CA SER A 250 -4.478 -10.163 -4.221 1.00 0.00 C ATOM 649 C SER A 250 -5.933 -10.213 -3.744 1.00 0.00 C ATOM 650 O SER A 250 -6.222 -9.851 -2.606 1.00 0.00 O ATOM 651 CB SER A 250 -4.247 -8.974 -5.139 1.00 0.00 C ATOM 652 OG SER A 250 -2.894 -8.931 -5.571 1.00 0.00 O ATOM 0 H SER A 250 -3.775 -11.210 -5.862 1.00 0.00 H new ATOM 0 HA SER A 250 -3.863 -10.061 -3.327 1.00 0.00 H new ATOM 0 HB2 SER A 250 -4.908 -9.041 -6.003 1.00 0.00 H new ATOM 0 HB3 SER A 250 -4.497 -8.051 -4.617 1.00 0.00 H new ATOM 0 HG SER A 250 -2.747 -9.618 -6.254 1.00 0.00 H new ATOM 658 N GLN A 251 -6.843 -10.701 -4.586 1.00 0.00 N ATOM 659 CA GLN A 251 -8.241 -10.758 -4.192 1.00 0.00 C ATOM 660 C GLN A 251 -8.456 -11.755 -3.061 1.00 0.00 C ATOM 661 O GLN A 251 -9.323 -11.561 -2.215 1.00 0.00 O ATOM 662 CB GLN A 251 -9.165 -11.045 -5.361 1.00 0.00 C ATOM 663 CG GLN A 251 -8.961 -12.379 -6.019 1.00 0.00 C ATOM 664 CD GLN A 251 -9.846 -12.535 -7.216 1.00 0.00 C ATOM 665 OE1 GLN A 251 -9.466 -12.159 -8.325 1.00 0.00 O ATOM 666 NE2 GLN A 251 -11.016 -13.084 -7.018 1.00 0.00 N ATOM 0 H GLN A 251 -6.641 -11.053 -5.522 1.00 0.00 H new ATOM 0 HA GLN A 251 -8.502 -9.766 -3.824 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -10.196 -10.982 -5.013 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -9.033 -10.264 -6.109 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -7.918 -12.484 -6.319 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -9.169 -13.175 -5.304 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -11.288 -13.380 -6.081 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -11.656 -13.216 -7.801 1.00 0.00 H new ATOM 675 N THR A 252 -7.642 -12.801 -3.024 1.00 0.00 N ATOM 676 CA THR A 252 -7.718 -13.755 -1.945 1.00 0.00 C ATOM 677 C THR A 252 -7.314 -13.066 -0.603 1.00 0.00 C ATOM 678 O THR A 252 -7.929 -13.287 0.456 1.00 0.00 O ATOM 679 CB THR A 252 -6.836 -14.990 -2.219 1.00 0.00 C ATOM 680 OG1 THR A 252 -7.132 -15.513 -3.530 1.00 0.00 O ATOM 681 CG2 THR A 252 -7.144 -16.070 -1.210 1.00 0.00 C ATOM 0 H THR A 252 -6.930 -13.003 -3.726 1.00 0.00 H new ATOM 0 HA THR A 252 -8.747 -14.107 -1.868 1.00 0.00 H new ATOM 0 HB THR A 252 -5.789 -14.694 -2.152 1.00 0.00 H new ATOM 0 HG1 THR A 252 -6.763 -14.914 -4.212 1.00 0.00 H new ATOM 0 HG21 THR A 252 -6.519 -16.941 -1.407 1.00 0.00 H new ATOM 0 HG22 THR A 252 -6.942 -15.698 -0.206 1.00 0.00 H new ATOM 0 HG23 THR A 252 -8.194 -16.352 -1.288 1.00 0.00 H new ATOM 689 N LEU A 253 -6.335 -12.177 -0.668 1.00 0.00 N ATOM 690 CA LEU A 253 -5.935 -11.411 0.505 1.00 0.00 C ATOM 691 C LEU A 253 -6.993 -10.368 0.856 1.00 0.00 C ATOM 692 O LEU A 253 -7.162 -9.982 2.021 1.00 0.00 O ATOM 693 CB LEU A 253 -4.554 -10.765 0.337 1.00 0.00 C ATOM 694 CG LEU A 253 -3.334 -11.660 0.614 1.00 0.00 C ATOM 695 CD1 LEU A 253 -3.239 -12.814 -0.344 1.00 0.00 C ATOM 696 CD2 LEU A 253 -2.065 -10.855 0.591 1.00 0.00 C ATOM 0 H LEU A 253 -5.805 -11.968 -1.514 1.00 0.00 H new ATOM 0 HA LEU A 253 -5.853 -12.113 1.335 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -4.476 -10.390 -0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -4.500 -9.901 0.999 1.00 0.00 H new ATOM 0 HG LEU A 253 -3.471 -12.078 1.611 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -2.361 -13.414 -0.105 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -4.134 -13.431 -0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -3.153 -12.435 -1.362 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -1.216 -11.509 0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -1.946 -10.392 -0.389 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -2.112 -10.079 1.356 1.00 0.00 H new ATOM 708 N LEU A 254 -7.729 -9.951 -0.135 1.00 0.00 N ATOM 709 CA LEU A 254 -8.804 -9.018 0.052 1.00 0.00 C ATOM 710 C LEU A 254 -10.019 -9.671 0.684 1.00 0.00 C ATOM 711 O LEU A 254 -10.692 -9.068 1.504 1.00 0.00 O ATOM 712 CB LEU A 254 -9.179 -8.372 -1.246 1.00 0.00 C ATOM 713 CG LEU A 254 -8.227 -7.310 -1.719 1.00 0.00 C ATOM 714 CD1 LEU A 254 -8.541 -6.951 -3.119 1.00 0.00 C ATOM 715 CD2 LEU A 254 -8.350 -6.083 -0.854 1.00 0.00 C ATOM 0 H LEU A 254 -7.599 -10.251 -1.101 1.00 0.00 H new ATOM 0 HA LEU A 254 -8.446 -8.251 0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -9.251 -9.144 -2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -10.171 -7.932 -1.143 1.00 0.00 H new ATOM 0 HG LEU A 254 -7.209 -7.695 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -7.850 -6.181 -3.461 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -8.443 -7.833 -3.752 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -9.562 -6.574 -3.178 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -7.656 -5.319 -1.205 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -9.369 -5.700 -0.909 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -8.114 -6.341 0.179 1.00 0.00 H new ATOM 727 N THR A 255 -10.295 -10.898 0.318 1.00 0.00 N ATOM 728 CA THR A 255 -11.415 -11.585 0.896 1.00 0.00 C ATOM 729 C THR A 255 -11.094 -12.008 2.352 1.00 0.00 C ATOM 730 O THR A 255 -12.000 -12.223 3.153 1.00 0.00 O ATOM 731 CB THR A 255 -11.903 -12.792 0.016 1.00 0.00 C ATOM 732 OG1 THR A 255 -13.156 -13.304 0.510 1.00 0.00 O ATOM 733 CG2 THR A 255 -10.891 -13.920 0.002 1.00 0.00 C ATOM 0 H THR A 255 -9.765 -11.434 -0.369 1.00 0.00 H new ATOM 0 HA THR A 255 -12.253 -10.889 0.925 1.00 0.00 H new ATOM 0 HB THR A 255 -12.027 -12.415 -0.999 1.00 0.00 H new ATOM 0 HG1 THR A 255 -13.446 -14.054 -0.050 1.00 0.00 H new ATOM 0 HG21 THR A 255 -11.264 -14.736 -0.617 1.00 0.00 H new ATOM 0 HG22 THR A 255 -9.948 -13.557 -0.406 1.00 0.00 H new ATOM 0 HG23 THR A 255 -10.732 -14.279 1.019 1.00 0.00 H new ATOM 741 N THR A 256 -9.810 -12.108 2.695 1.00 0.00 N ATOM 742 CA THR A 256 -9.456 -12.417 4.058 1.00 0.00 C ATOM 743 C THR A 256 -9.296 -11.140 4.923 1.00 0.00 C ATOM 744 O THR A 256 -9.944 -11.022 5.965 1.00 0.00 O ATOM 745 CB THR A 256 -8.229 -13.388 4.181 1.00 0.00 C ATOM 746 OG1 THR A 256 -7.992 -13.746 5.549 1.00 0.00 O ATOM 747 CG2 THR A 256 -6.984 -12.783 3.601 1.00 0.00 C ATOM 0 H THR A 256 -9.024 -11.981 2.058 1.00 0.00 H new ATOM 0 HA THR A 256 -10.301 -12.971 4.467 1.00 0.00 H new ATOM 0 HB THR A 256 -8.476 -14.285 3.613 1.00 0.00 H new ATOM 0 HG1 THR A 256 -7.344 -13.125 5.942 1.00 0.00 H new ATOM 0 HG21 THR A 256 -6.156 -13.485 3.705 1.00 0.00 H new ATOM 0 HG22 THR A 256 -7.144 -12.564 2.545 1.00 0.00 H new ATOM 0 HG23 THR A 256 -6.747 -11.861 4.131 1.00 0.00 H new ATOM 755 N PHE A 257 -8.473 -10.168 4.497 1.00 0.00 N ATOM 756 CA PHE A 257 -8.269 -8.996 5.356 1.00 0.00 C ATOM 757 C PHE A 257 -8.837 -7.721 4.728 1.00 0.00 C ATOM 758 O PHE A 257 -9.286 -6.834 5.445 1.00 0.00 O ATOM 759 CB PHE A 257 -6.762 -8.786 5.612 1.00 0.00 C ATOM 760 CG PHE A 257 -6.007 -10.034 6.004 1.00 0.00 C ATOM 761 CD1 PHE A 257 -6.487 -10.878 6.991 1.00 0.00 C ATOM 762 CD2 PHE A 257 -4.830 -10.374 5.353 1.00 0.00 C ATOM 763 CE1 PHE A 257 -5.813 -12.032 7.323 1.00 0.00 C ATOM 764 CE2 PHE A 257 -4.150 -11.532 5.680 1.00 0.00 C ATOM 765 CZ PHE A 257 -4.645 -12.361 6.668 1.00 0.00 C ATOM 0 H PHE A 257 -7.964 -10.166 3.613 1.00 0.00 H new ATOM 0 HA PHE A 257 -8.795 -9.188 6.291 1.00 0.00 H new ATOM 0 HB2 PHE A 257 -6.309 -8.372 4.711 1.00 0.00 H new ATOM 0 HB3 PHE A 257 -6.642 -8.043 6.400 1.00 0.00 H new ATOM 0 HD1 PHE A 257 -7.402 -10.628 7.507 1.00 0.00 H new ATOM 0 HD2 PHE A 257 -4.441 -9.726 4.582 1.00 0.00 H new ATOM 0 HE1 PHE A 257 -6.199 -12.679 8.096 1.00 0.00 H new ATOM 0 HE2 PHE A 257 -3.236 -11.788 5.165 1.00 0.00 H new ATOM 0 HZ PHE A 257 -4.117 -13.267 6.927 1.00 0.00 H new ATOM 775 N GLY A 258 -8.887 -7.681 3.394 1.00 0.00 N ATOM 776 CA GLY A 258 -9.452 -6.533 2.637 1.00 0.00 C ATOM 777 C GLY A 258 -8.936 -5.148 3.027 1.00 0.00 C ATOM 778 O GLY A 258 -9.607 -4.139 2.757 1.00 0.00 O ATOM 0 H GLY A 258 -8.542 -8.434 2.799 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -9.249 -6.688 1.577 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -10.535 -6.542 2.759 1.00 0.00 H new ATOM 782 N SER A 259 -7.769 -5.093 3.624 1.00 0.00 N ATOM 783 CA SER A 259 -7.258 -3.867 4.180 1.00 0.00 C ATOM 784 C SER A 259 -5.730 -3.888 4.038 1.00 0.00 C ATOM 785 O SER A 259 -5.151 -4.984 3.907 1.00 0.00 O ATOM 786 CB SER A 259 -7.692 -3.826 5.645 1.00 0.00 C ATOM 787 OG SER A 259 -7.700 -2.518 6.167 1.00 0.00 O ATOM 0 H SER A 259 -7.150 -5.896 3.737 1.00 0.00 H new ATOM 0 HA SER A 259 -7.636 -2.980 3.672 1.00 0.00 H new ATOM 0 HB2 SER A 259 -8.689 -4.257 5.738 1.00 0.00 H new ATOM 0 HB3 SER A 259 -7.020 -4.447 6.238 1.00 0.00 H new ATOM 0 HG SER A 259 -6.808 -2.295 6.505 1.00 0.00 H new ATOM 793 N LEU A 260 -5.066 -2.725 4.051 1.00 0.00 N ATOM 794 CA LEU A 260 -3.617 -2.726 3.877 1.00 0.00 C ATOM 795 C LEU A 260 -2.845 -2.921 5.183 1.00 0.00 C ATOM 796 O LEU A 260 -1.869 -3.685 5.203 1.00 0.00 O ATOM 797 CB LEU A 260 -3.113 -1.501 3.085 1.00 0.00 C ATOM 798 CG LEU A 260 -1.609 -1.516 2.669 1.00 0.00 C ATOM 799 CD1 LEU A 260 -1.411 -0.634 1.483 1.00 0.00 C ATOM 800 CD2 LEU A 260 -0.692 -1.017 3.789 1.00 0.00 C ATOM 0 H LEU A 260 -5.493 -1.807 4.175 1.00 0.00 H new ATOM 0 HA LEU A 260 -3.404 -3.606 3.270 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -3.716 -1.406 2.182 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -3.293 -0.609 3.684 1.00 0.00 H new ATOM 0 HG LEU A 260 -1.350 -2.550 2.443 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -0.360 -0.645 1.193 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -2.020 -0.996 0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -1.708 0.384 1.733 1.00 0.00 H new ATOM 0 HD21 LEU A 260 0.344 -1.046 3.451 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -0.960 0.007 4.050 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -0.806 -1.656 4.665 1.00 0.00 H new ATOM 812 N GLU A 261 -3.254 -2.247 6.265 1.00 0.00 N ATOM 813 CA GLU A 261 -2.519 -2.343 7.547 1.00 0.00 C ATOM 814 C GLU A 261 -2.436 -3.795 8.005 1.00 0.00 C ATOM 815 O GLU A 261 -1.413 -4.247 8.499 1.00 0.00 O ATOM 816 CB GLU A 261 -3.099 -1.435 8.677 1.00 0.00 C ATOM 817 CG GLU A 261 -4.361 -1.923 9.399 1.00 0.00 C ATOM 818 CD GLU A 261 -5.574 -2.014 8.530 1.00 0.00 C ATOM 819 OE1 GLU A 261 -5.603 -2.860 7.640 1.00 0.00 O ATOM 820 OE2 GLU A 261 -6.526 -1.262 8.747 1.00 0.00 O ATOM 0 H GLU A 261 -4.073 -1.639 6.287 1.00 0.00 H new ATOM 0 HA GLU A 261 -1.515 -1.966 7.352 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -2.319 -1.288 9.424 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -3.315 -0.458 8.246 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -4.162 -2.905 9.828 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -4.573 -1.249 10.229 1.00 0.00 H new ATOM 827 N GLN A 262 -3.510 -4.514 7.773 1.00 0.00 N ATOM 828 CA GLN A 262 -3.617 -5.926 8.077 1.00 0.00 C ATOM 829 C GLN A 262 -2.562 -6.751 7.359 1.00 0.00 C ATOM 830 O GLN A 262 -2.091 -7.741 7.894 1.00 0.00 O ATOM 831 CB GLN A 262 -5.003 -6.447 7.711 1.00 0.00 C ATOM 832 CG GLN A 262 -6.136 -5.864 8.535 1.00 0.00 C ATOM 833 CD GLN A 262 -5.956 -6.136 10.003 1.00 0.00 C ATOM 834 OE1 GLN A 262 -5.382 -5.207 10.698 1.00 0.00 O flip ATOM 835 NE2 GLN A 262 -6.367 -7.182 10.516 1.00 0.00 N flip ATOM 0 H GLN A 262 -4.356 -4.125 7.357 1.00 0.00 H new ATOM 0 HA GLN A 262 -3.454 -6.031 9.150 1.00 0.00 H new ATOM 0 HB2 GLN A 262 -5.190 -6.234 6.658 1.00 0.00 H new ATOM 0 HB3 GLN A 262 -5.010 -7.531 7.823 1.00 0.00 H new ATOM 0 HG2 GLN A 262 -6.190 -4.788 8.369 1.00 0.00 H new ATOM 0 HG3 GLN A 262 -7.084 -6.286 8.201 1.00 0.00 H new ATOM 0 HE21 GLN A 262 -6.815 -7.892 9.937 1.00 0.00 H new ATOM 0 HE22 GLN A 262 -6.259 -7.335 11.519 1.00 0.00 H new ATOM 844 N LEU A 263 -2.185 -6.319 6.171 1.00 0.00 N ATOM 845 CA LEU A 263 -1.219 -7.032 5.355 1.00 0.00 C ATOM 846 C LEU A 263 0.190 -6.758 5.850 1.00 0.00 C ATOM 847 O LEU A 263 0.982 -7.665 6.042 1.00 0.00 O ATOM 848 CB LEU A 263 -1.305 -6.572 3.910 1.00 0.00 C ATOM 849 CG LEU A 263 -1.446 -7.654 2.864 1.00 0.00 C ATOM 850 CD1 LEU A 263 -2.901 -7.809 2.450 1.00 0.00 C ATOM 851 CD2 LEU A 263 -0.518 -7.386 1.691 1.00 0.00 C ATOM 0 H LEU A 263 -2.540 -5.463 5.743 1.00 0.00 H new ATOM 0 HA LEU A 263 -1.444 -8.096 5.424 1.00 0.00 H new ATOM 0 HB2 LEU A 263 -2.155 -5.896 3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 263 -0.410 -5.993 3.683 1.00 0.00 H new ATOM 0 HG LEU A 263 -1.140 -8.610 3.290 1.00 0.00 H new ATOM 0 HD11 LEU A 263 -2.983 -8.592 1.696 1.00 0.00 H new ATOM 0 HD12 LEU A 263 -3.500 -8.078 3.320 1.00 0.00 H new ATOM 0 HD13 LEU A 263 -3.264 -6.868 2.036 1.00 0.00 H new ATOM 0 HD21 LEU A 263 -0.633 -8.175 0.948 1.00 0.00 H new ATOM 0 HD22 LEU A 263 -0.768 -6.425 1.241 1.00 0.00 H new ATOM 0 HD23 LEU A 263 0.514 -7.365 2.041 1.00 0.00 H new ATOM 863 N ILE A 264 0.492 -5.487 6.068 1.00 0.00 N ATOM 864 CA ILE A 264 1.824 -5.077 6.495 1.00 0.00 C ATOM 865 C ILE A 264 2.099 -5.546 7.935 1.00 0.00 C ATOM 866 O ILE A 264 3.235 -5.899 8.291 1.00 0.00 O ATOM 867 CB ILE A 264 2.038 -3.520 6.265 1.00 0.00 C ATOM 868 CG1 ILE A 264 3.435 -2.977 6.704 1.00 0.00 C ATOM 869 CG2 ILE A 264 0.925 -2.707 6.884 1.00 0.00 C ATOM 870 CD1 ILE A 264 3.618 -2.729 8.200 1.00 0.00 C ATOM 0 H ILE A 264 -0.169 -4.718 5.956 1.00 0.00 H new ATOM 0 HA ILE A 264 2.573 -5.569 5.874 1.00 0.00 H new ATOM 0 HB ILE A 264 2.008 -3.398 5.182 1.00 0.00 H new ATOM 0 HG12 ILE A 264 4.197 -3.685 6.378 1.00 0.00 H new ATOM 0 HG13 ILE A 264 3.622 -2.042 6.176 1.00 0.00 H new ATOM 0 HG21 ILE A 264 1.106 -1.647 6.706 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -0.027 -2.993 6.436 1.00 0.00 H new ATOM 0 HG23 ILE A 264 0.891 -2.894 7.957 1.00 0.00 H new ATOM 0 HD11 ILE A 264 4.624 -2.354 8.386 1.00 0.00 H new ATOM 0 HD12 ILE A 264 2.888 -1.994 8.539 1.00 0.00 H new ATOM 0 HD13 ILE A 264 3.472 -3.662 8.744 1.00 0.00 H new ATOM 882 N ALA A 265 1.050 -5.613 8.731 1.00 0.00 N ATOM 883 CA ALA A 265 1.150 -6.078 10.100 1.00 0.00 C ATOM 884 C ALA A 265 1.002 -7.604 10.170 1.00 0.00 C ATOM 885 O ALA A 265 0.944 -8.187 11.262 1.00 0.00 O ATOM 886 CB ALA A 265 0.100 -5.396 10.969 1.00 0.00 C ATOM 0 H ALA A 265 0.107 -5.347 8.448 1.00 0.00 H new ATOM 0 HA ALA A 265 2.138 -5.817 10.480 1.00 0.00 H new ATOM 0 HB1 ALA A 265 0.187 -5.755 11.994 1.00 0.00 H new ATOM 0 HB2 ALA A 265 0.255 -4.317 10.948 1.00 0.00 H new ATOM 0 HB3 ALA A 265 -0.894 -5.627 10.587 1.00 0.00 H new ATOM 892 N ALA A 266 0.952 -8.247 9.017 1.00 0.00 N ATOM 893 CA ALA A 266 0.839 -9.685 8.940 1.00 0.00 C ATOM 894 C ALA A 266 2.210 -10.289 8.776 1.00 0.00 C ATOM 895 O ALA A 266 3.107 -9.667 8.200 1.00 0.00 O ATOM 896 CB ALA A 266 -0.049 -10.095 7.771 1.00 0.00 C ATOM 0 H ALA A 266 0.989 -7.783 8.109 1.00 0.00 H new ATOM 0 HA ALA A 266 0.385 -10.050 9.861 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -0.120 -11.182 7.732 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -1.044 -9.671 7.904 1.00 0.00 H new ATOM 0 HB3 ALA A 266 0.381 -9.726 6.840 1.00 0.00 H new ATOM 902 N SER A 267 2.399 -11.454 9.306 1.00 0.00 N ATOM 903 CA SER A 267 3.640 -12.138 9.139 1.00 0.00 C ATOM 904 C SER A 267 3.487 -13.048 7.918 1.00 0.00 C ATOM 905 O SER A 267 2.374 -13.198 7.413 1.00 0.00 O ATOM 906 CB SER A 267 3.948 -12.957 10.398 1.00 0.00 C ATOM 907 OG SER A 267 5.303 -13.351 10.431 1.00 0.00 O ATOM 0 H SER A 267 1.705 -11.954 9.862 1.00 0.00 H new ATOM 0 HA SER A 267 4.465 -11.441 8.988 1.00 0.00 H new ATOM 0 HB2 SER A 267 3.716 -12.367 11.285 1.00 0.00 H new ATOM 0 HB3 SER A 267 3.309 -13.840 10.426 1.00 0.00 H new ATOM 0 HG SER A 267 5.360 -14.329 10.416 1.00 0.00 H new ATOM 913 N ARG A 268 4.572 -13.646 7.446 1.00 0.00 N ATOM 914 CA ARG A 268 4.529 -14.571 6.299 1.00 0.00 C ATOM 915 C ARG A 268 3.496 -15.684 6.522 1.00 0.00 C ATOM 916 O ARG A 268 2.756 -16.034 5.634 1.00 0.00 O ATOM 917 CB ARG A 268 5.914 -15.156 6.062 1.00 0.00 C ATOM 918 CG ARG A 268 6.938 -14.111 5.683 1.00 0.00 C ATOM 919 CD ARG A 268 8.318 -14.694 5.502 1.00 0.00 C ATOM 920 NE ARG A 268 8.767 -15.408 6.702 1.00 0.00 N ATOM 921 CZ ARG A 268 9.827 -16.221 6.775 1.00 0.00 C ATOM 922 NH1 ARG A 268 10.643 -16.362 5.723 1.00 0.00 N ATOM 923 NH2 ARG A 268 10.072 -16.886 7.902 1.00 0.00 N ATOM 0 H ARG A 268 5.505 -13.512 7.837 1.00 0.00 H new ATOM 0 HA ARG A 268 4.222 -14.015 5.413 1.00 0.00 H new ATOM 0 HB2 ARG A 268 6.245 -15.671 6.964 1.00 0.00 H new ATOM 0 HB3 ARG A 268 5.856 -15.904 5.271 1.00 0.00 H new ATOM 0 HG2 ARG A 268 6.629 -13.623 4.759 1.00 0.00 H new ATOM 0 HG3 ARG A 268 6.970 -13.342 6.455 1.00 0.00 H new ATOM 0 HD2 ARG A 268 8.316 -15.376 4.652 1.00 0.00 H new ATOM 0 HD3 ARG A 268 9.023 -13.896 5.269 1.00 0.00 H new ATOM 0 HE ARG A 268 8.224 -15.273 7.555 1.00 0.00 H new ATOM 0 HH11 ARG A 268 10.458 -15.848 4.861 1.00 0.00 H new ATOM 0 HH12 ARG A 268 11.450 -16.983 5.783 1.00 0.00 H new ATOM 0 HH21 ARG A 268 9.453 -16.774 8.705 1.00 0.00 H new ATOM 0 HH22 ARG A 268 10.879 -17.507 7.963 1.00 0.00 H new ATOM 937 N GLU A 269 3.410 -16.176 7.720 1.00 0.00 N ATOM 938 CA GLU A 269 2.435 -17.196 8.051 1.00 0.00 C ATOM 939 C GLU A 269 1.006 -16.645 8.103 1.00 0.00 C ATOM 940 O GLU A 269 0.047 -17.357 7.795 1.00 0.00 O ATOM 941 CB GLU A 269 2.792 -18.009 9.325 1.00 0.00 C ATOM 942 CG GLU A 269 3.455 -17.242 10.472 1.00 0.00 C ATOM 943 CD GLU A 269 4.891 -16.882 10.173 1.00 0.00 C ATOM 944 OE1 GLU A 269 5.792 -17.717 10.364 1.00 0.00 O ATOM 945 OE2 GLU A 269 5.132 -15.784 9.692 1.00 0.00 O ATOM 0 H GLU A 269 4.005 -15.891 8.498 1.00 0.00 H new ATOM 0 HA GLU A 269 2.474 -17.907 7.226 1.00 0.00 H new ATOM 0 HB2 GLU A 269 1.877 -18.464 9.705 1.00 0.00 H new ATOM 0 HB3 GLU A 269 3.455 -18.823 9.033 1.00 0.00 H new ATOM 0 HG2 GLU A 269 2.889 -16.332 10.671 1.00 0.00 H new ATOM 0 HG3 GLU A 269 3.416 -17.846 11.379 1.00 0.00 H new ATOM 952 N ASP A 270 0.867 -15.379 8.435 1.00 0.00 N ATOM 953 CA ASP A 270 -0.461 -14.749 8.525 1.00 0.00 C ATOM 954 C ASP A 270 -0.926 -14.393 7.118 1.00 0.00 C ATOM 955 O ASP A 270 -2.102 -14.417 6.810 1.00 0.00 O ATOM 956 CB ASP A 270 -0.405 -13.509 9.433 1.00 0.00 C ATOM 957 CG ASP A 270 -1.778 -12.983 9.860 1.00 0.00 C ATOM 958 OD1 ASP A 270 -2.390 -13.576 10.782 1.00 0.00 O ATOM 959 OD2 ASP A 270 -2.223 -11.945 9.363 1.00 0.00 O ATOM 0 H ASP A 270 1.646 -14.756 8.649 1.00 0.00 H new ATOM 0 HA ASP A 270 -1.176 -15.441 8.970 1.00 0.00 H new ATOM 0 HB2 ASP A 270 0.173 -13.751 10.325 1.00 0.00 H new ATOM 0 HB3 ASP A 270 0.130 -12.715 8.912 1.00 0.00 H new ATOM 964 N LEU A 271 0.034 -14.125 6.256 1.00 0.00 N ATOM 965 CA LEU A 271 -0.227 -13.892 4.843 1.00 0.00 C ATOM 966 C LEU A 271 -0.504 -15.222 4.125 1.00 0.00 C ATOM 967 O LEU A 271 -1.267 -15.273 3.173 1.00 0.00 O ATOM 968 CB LEU A 271 0.952 -13.163 4.188 1.00 0.00 C ATOM 969 CG LEU A 271 1.212 -11.727 4.655 1.00 0.00 C ATOM 970 CD1 LEU A 271 2.513 -11.208 4.068 1.00 0.00 C ATOM 971 CD2 LEU A 271 0.060 -10.819 4.244 1.00 0.00 C ATOM 0 H LEU A 271 1.019 -14.062 6.512 1.00 0.00 H new ATOM 0 HA LEU A 271 -1.110 -13.259 4.755 1.00 0.00 H new ATOM 0 HB2 LEU A 271 1.855 -13.748 4.364 1.00 0.00 H new ATOM 0 HB3 LEU A 271 0.787 -13.147 3.111 1.00 0.00 H new ATOM 0 HG LEU A 271 1.290 -11.728 5.742 1.00 0.00 H new ATOM 0 HD11 LEU A 271 2.684 -10.187 4.409 1.00 0.00 H new ATOM 0 HD12 LEU A 271 3.338 -11.842 4.394 1.00 0.00 H new ATOM 0 HD13 LEU A 271 2.452 -11.222 2.980 1.00 0.00 H new ATOM 0 HD21 LEU A 271 0.259 -9.802 4.583 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.040 -10.827 3.159 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -0.865 -11.177 4.696 1.00 0.00 H new ATOM 983 N ALA A 272 0.115 -16.297 4.603 1.00 0.00 N ATOM 984 CA ALA A 272 -0.099 -17.637 4.032 1.00 0.00 C ATOM 985 C ALA A 272 -1.344 -18.290 4.634 1.00 0.00 C ATOM 986 O ALA A 272 -1.787 -19.354 4.193 1.00 0.00 O ATOM 987 CB ALA A 272 1.124 -18.521 4.256 1.00 0.00 C ATOM 0 H ALA A 272 0.770 -16.274 5.384 1.00 0.00 H new ATOM 0 HA ALA A 272 -0.253 -17.526 2.959 1.00 0.00 H new ATOM 0 HB1 ALA A 272 0.944 -19.506 3.826 1.00 0.00 H new ATOM 0 HB2 ALA A 272 1.992 -18.069 3.777 1.00 0.00 H new ATOM 0 HB3 ALA A 272 1.310 -18.620 5.325 1.00 0.00 H new ATOM 993 N LEU A 273 -1.881 -17.644 5.649 1.00 0.00 N ATOM 994 CA LEU A 273 -3.085 -18.063 6.333 1.00 0.00 C ATOM 995 C LEU A 273 -4.306 -17.892 5.432 1.00 0.00 C ATOM 996 O LEU A 273 -5.310 -18.605 5.586 1.00 0.00 O ATOM 997 CB LEU A 273 -3.239 -17.186 7.542 1.00 0.00 C ATOM 998 CG LEU A 273 -4.523 -17.302 8.307 1.00 0.00 C ATOM 999 CD1 LEU A 273 -4.563 -18.576 9.119 1.00 0.00 C ATOM 1000 CD2 LEU A 273 -4.710 -16.073 9.137 1.00 0.00 C ATOM 0 H LEU A 273 -1.479 -16.788 6.031 1.00 0.00 H new ATOM 0 HA LEU A 273 -3.010 -19.115 6.608 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -2.417 -17.402 8.225 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -3.126 -16.149 7.225 1.00 0.00 H new ATOM 0 HG LEU A 273 -5.362 -17.369 7.614 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -5.506 -18.632 9.663 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -4.477 -19.435 8.453 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -3.735 -18.582 9.828 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -5.642 -16.150 9.696 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -3.877 -15.973 9.832 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -4.748 -15.198 8.488 1.00 0.00 H new ATOM 1012 N CYS A 274 -4.219 -16.911 4.538 1.00 0.00 N ATOM 1013 CA CYS A 274 -5.235 -16.659 3.515 1.00 0.00 C ATOM 1014 C CYS A 274 -5.623 -17.989 2.860 1.00 0.00 C ATOM 1015 O CYS A 274 -4.734 -18.755 2.455 1.00 0.00 O ATOM 1016 CB CYS A 274 -4.664 -15.720 2.465 1.00 0.00 C ATOM 1017 SG CYS A 274 -3.991 -14.189 3.139 1.00 0.00 S ATOM 0 H CYS A 274 -3.434 -16.261 4.501 1.00 0.00 H new ATOM 0 HA CYS A 274 -6.116 -16.203 3.967 1.00 0.00 H new ATOM 0 HB2 CYS A 274 -3.879 -16.240 1.916 1.00 0.00 H new ATOM 0 HB3 CYS A 274 -5.447 -15.476 1.747 1.00 0.00 H new ATOM 0 HG CYS A 274 -2.701 -14.298 3.261 1.00 0.00 H new ATOM 1023 N PRO A 275 -6.935 -18.287 2.762 1.00 0.00 N ATOM 1024 CA PRO A 275 -7.417 -19.610 2.338 1.00 0.00 C ATOM 1025 C PRO A 275 -6.891 -20.033 0.968 1.00 0.00 C ATOM 1026 O PRO A 275 -7.199 -19.400 -0.047 1.00 0.00 O ATOM 1027 CB PRO A 275 -8.950 -19.443 2.298 1.00 0.00 C ATOM 1028 CG PRO A 275 -9.178 -17.965 2.257 1.00 0.00 C ATOM 1029 CD PRO A 275 -8.047 -17.355 3.022 1.00 0.00 C ATOM 0 HA PRO A 275 -7.073 -20.391 3.016 1.00 0.00 H new ATOM 0 HB2 PRO A 275 -9.378 -19.933 1.423 1.00 0.00 H new ATOM 0 HB3 PRO A 275 -9.419 -19.890 3.175 1.00 0.00 H new ATOM 0 HG2 PRO A 275 -9.196 -17.601 1.230 1.00 0.00 H new ATOM 0 HG3 PRO A 275 -10.137 -17.705 2.704 1.00 0.00 H new ATOM 0 HD2 PRO A 275 -7.820 -16.348 2.673 1.00 0.00 H new ATOM 0 HD3 PRO A 275 -8.272 -17.281 4.086 1.00 0.00 H new ATOM 1037 N GLY A 276 -6.096 -21.113 0.979 1.00 0.00 N ATOM 1038 CA GLY A 276 -5.523 -21.710 -0.222 1.00 0.00 C ATOM 1039 C GLY A 276 -4.895 -20.700 -1.155 1.00 0.00 C ATOM 1040 O GLY A 276 -5.235 -20.653 -2.345 1.00 0.00 O ATOM 0 H GLY A 276 -5.833 -21.598 1.837 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -4.769 -22.442 0.069 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -6.303 -22.252 -0.757 1.00 0.00 H new ATOM 1044 N LEU A 277 -4.005 -19.875 -0.648 1.00 0.00 N ATOM 1045 CA LEU A 277 -3.480 -18.845 -1.486 1.00 0.00 C ATOM 1046 C LEU A 277 -2.035 -19.086 -1.892 1.00 0.00 C ATOM 1047 O LEU A 277 -1.734 -19.093 -3.086 1.00 0.00 O ATOM 1048 CB LEU A 277 -3.645 -17.492 -0.721 1.00 0.00 C ATOM 1049 CG LEU A 277 -3.032 -16.185 -1.299 1.00 0.00 C ATOM 1050 CD1 LEU A 277 -1.529 -16.058 -1.010 1.00 0.00 C ATOM 1051 CD2 LEU A 277 -3.302 -16.073 -2.784 1.00 0.00 C ATOM 0 H LEU A 277 -3.646 -19.901 0.306 1.00 0.00 H new ATOM 0 HA LEU A 277 -4.034 -18.828 -2.425 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -4.714 -17.320 -0.597 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -3.227 -17.632 0.276 1.00 0.00 H new ATOM 0 HG LEU A 277 -3.524 -15.357 -0.789 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -1.154 -15.128 -1.436 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -1.365 -16.056 0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -1.000 -16.900 -1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -2.863 -15.151 -3.165 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -2.859 -16.925 -3.300 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -4.378 -16.062 -2.958 1.00 0.00 H new ATOM 1063 N GLY A 278 -1.161 -19.318 -0.959 1.00 0.00 N ATOM 1064 CA GLY A 278 0.205 -19.503 -1.341 1.00 0.00 C ATOM 1065 C GLY A 278 1.156 -19.288 -0.203 1.00 0.00 C ATOM 1066 O GLY A 278 1.040 -18.279 0.493 1.00 0.00 O ATOM 0 H GLY A 278 -1.359 -19.382 0.040 1.00 0.00 H new ATOM 0 HA2 GLY A 278 0.335 -20.512 -1.733 1.00 0.00 H new ATOM 0 HA3 GLY A 278 0.449 -18.813 -2.149 1.00 0.00 H new ATOM 1070 N PRO A 279 2.106 -20.166 0.034 1.00 0.00 N ATOM 1071 CA PRO A 279 3.115 -19.907 1.038 1.00 0.00 C ATOM 1072 C PRO A 279 4.228 -18.969 0.503 1.00 0.00 C ATOM 1073 O PRO A 279 4.708 -18.065 1.218 1.00 0.00 O ATOM 1074 CB PRO A 279 3.661 -21.293 1.358 1.00 0.00 C ATOM 1075 CG PRO A 279 3.473 -22.072 0.093 1.00 0.00 C ATOM 1076 CD PRO A 279 2.242 -21.509 -0.578 1.00 0.00 C ATOM 0 HA PRO A 279 2.715 -19.396 1.914 1.00 0.00 H new ATOM 0 HB2 PRO A 279 4.712 -21.249 1.645 1.00 0.00 H new ATOM 0 HB3 PRO A 279 3.123 -21.749 2.189 1.00 0.00 H new ATOM 0 HG2 PRO A 279 4.345 -21.978 -0.554 1.00 0.00 H new ATOM 0 HG3 PRO A 279 3.348 -23.134 0.306 1.00 0.00 H new ATOM 0 HD2 PRO A 279 2.365 -21.448 -1.659 1.00 0.00 H new ATOM 0 HD3 PRO A 279 1.364 -22.127 -0.392 1.00 0.00 H new ATOM 1084 N GLN A 280 4.586 -19.133 -0.775 1.00 0.00 N ATOM 1085 CA GLN A 280 5.671 -18.365 -1.345 1.00 0.00 C ATOM 1086 C GLN A 280 5.244 -16.933 -1.543 1.00 0.00 C ATOM 1087 O GLN A 280 6.051 -16.020 -1.422 1.00 0.00 O ATOM 1088 CB GLN A 280 6.171 -18.938 -2.678 1.00 0.00 C ATOM 1089 CG GLN A 280 7.444 -18.256 -3.174 1.00 0.00 C ATOM 1090 CD GLN A 280 8.692 -18.598 -2.363 1.00 0.00 C ATOM 1091 OE1 GLN A 280 8.632 -18.932 -1.175 1.00 0.00 O ATOM 1092 NE2 GLN A 280 9.823 -18.448 -2.976 1.00 0.00 N ATOM 0 H GLN A 280 4.139 -19.786 -1.419 1.00 0.00 H new ATOM 0 HA GLN A 280 6.498 -18.418 -0.637 1.00 0.00 H new ATOM 0 HB2 GLN A 280 6.358 -20.006 -2.562 1.00 0.00 H new ATOM 0 HB3 GLN A 280 5.390 -18.831 -3.430 1.00 0.00 H new ATOM 0 HG2 GLN A 280 7.612 -18.536 -4.214 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.296 -17.176 -3.155 1.00 0.00 H new ATOM 0 HE21 GLN A 280 9.838 -18.171 -3.958 1.00 0.00 H new ATOM 0 HE22 GLN A 280 10.698 -18.607 -2.477 1.00 0.00 H new ATOM 1101 N LYS A 281 3.967 -16.735 -1.816 1.00 0.00 N ATOM 1102 CA LYS A 281 3.437 -15.390 -2.024 1.00 0.00 C ATOM 1103 C LYS A 281 3.638 -14.550 -0.785 1.00 0.00 C ATOM 1104 O LYS A 281 4.054 -13.404 -0.870 1.00 0.00 O ATOM 1105 CB LYS A 281 1.958 -15.404 -2.417 1.00 0.00 C ATOM 1106 CG LYS A 281 1.642 -16.239 -3.656 1.00 0.00 C ATOM 1107 CD LYS A 281 2.602 -15.942 -4.807 1.00 0.00 C ATOM 1108 CE LYS A 281 2.334 -16.831 -6.015 1.00 0.00 C ATOM 1109 NZ LYS A 281 1.075 -16.495 -6.697 1.00 0.00 N ATOM 0 H LYS A 281 3.277 -17.481 -1.900 1.00 0.00 H new ATOM 0 HA LYS A 281 3.990 -14.950 -2.854 1.00 0.00 H new ATOM 0 HB2 LYS A 281 1.375 -15.786 -1.578 1.00 0.00 H new ATOM 0 HB3 LYS A 281 1.631 -14.379 -2.592 1.00 0.00 H new ATOM 0 HG2 LYS A 281 1.696 -17.298 -3.403 1.00 0.00 H new ATOM 0 HG3 LYS A 281 0.619 -16.040 -3.976 1.00 0.00 H new ATOM 0 HD2 LYS A 281 2.507 -14.896 -5.098 1.00 0.00 H new ATOM 0 HD3 LYS A 281 3.628 -16.087 -4.470 1.00 0.00 H new ATOM 0 HE2 LYS A 281 3.160 -16.739 -6.720 1.00 0.00 H new ATOM 0 HE3 LYS A 281 2.303 -17.873 -5.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 0.881 -17.201 -7.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 0.296 -16.493 -6.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 1.156 -15.553 -7.131 1.00 0.00 H new ATOM 1123 N ALA A 282 3.402 -15.161 0.362 1.00 0.00 N ATOM 1124 CA ALA A 282 3.570 -14.534 1.638 1.00 0.00 C ATOM 1125 C ALA A 282 5.025 -14.148 1.852 1.00 0.00 C ATOM 1126 O ALA A 282 5.320 -13.077 2.381 1.00 0.00 O ATOM 1127 CB ALA A 282 3.125 -15.493 2.698 1.00 0.00 C ATOM 0 H ALA A 282 3.082 -16.128 0.422 1.00 0.00 H new ATOM 0 HA ALA A 282 2.972 -13.624 1.685 1.00 0.00 H new ATOM 0 HB1 ALA A 282 3.246 -15.033 3.679 1.00 0.00 H new ATOM 0 HB2 ALA A 282 2.076 -15.746 2.542 1.00 0.00 H new ATOM 0 HB3 ALA A 282 3.729 -16.399 2.646 1.00 0.00 H new ATOM 1133 N ARG A 283 5.932 -15.026 1.421 1.00 0.00 N ATOM 1134 CA ARG A 283 7.373 -14.769 1.520 1.00 0.00 C ATOM 1135 C ARG A 283 7.716 -13.515 0.725 1.00 0.00 C ATOM 1136 O ARG A 283 8.350 -12.597 1.225 1.00 0.00 O ATOM 1137 CB ARG A 283 8.185 -15.922 0.912 1.00 0.00 C ATOM 1138 CG ARG A 283 7.797 -17.311 1.362 1.00 0.00 C ATOM 1139 CD ARG A 283 7.996 -17.555 2.836 1.00 0.00 C ATOM 1140 NE ARG A 283 7.580 -18.918 3.189 1.00 0.00 N ATOM 1141 CZ ARG A 283 7.646 -19.454 4.407 1.00 0.00 C ATOM 1142 NH1 ARG A 283 8.229 -18.798 5.395 1.00 0.00 N ATOM 1143 NH2 ARG A 283 7.158 -20.664 4.624 1.00 0.00 N ATOM 0 H ARG A 283 5.695 -15.924 0.999 1.00 0.00 H new ATOM 0 HA ARG A 283 7.618 -14.658 2.576 1.00 0.00 H new ATOM 0 HB2 ARG A 283 8.092 -15.873 -0.173 1.00 0.00 H new ATOM 0 HB3 ARG A 283 9.237 -15.765 1.150 1.00 0.00 H new ATOM 0 HG2 ARG A 283 6.750 -17.483 1.114 1.00 0.00 H new ATOM 0 HG3 ARG A 283 8.382 -18.040 0.801 1.00 0.00 H new ATOM 0 HD2 ARG A 283 9.044 -17.409 3.097 1.00 0.00 H new ATOM 0 HD3 ARG A 283 7.420 -16.831 3.412 1.00 0.00 H new ATOM 0 HE ARG A 283 7.210 -19.503 2.440 1.00 0.00 H new ATOM 0 HH11 ARG A 283 8.632 -17.876 5.227 1.00 0.00 H new ATOM 0 HH12 ARG A 283 8.276 -19.214 6.325 1.00 0.00 H new ATOM 0 HH21 ARG A 283 6.731 -21.187 3.859 1.00 0.00 H new ATOM 0 HH22 ARG A 283 7.208 -21.075 5.556 1.00 0.00 H new ATOM 1157 N ARG A 284 7.232 -13.485 -0.507 1.00 0.00 N ATOM 1158 CA ARG A 284 7.542 -12.421 -1.452 1.00 0.00 C ATOM 1159 C ARG A 284 6.892 -11.095 -1.033 1.00 0.00 C ATOM 1160 O ARG A 284 7.466 -10.020 -1.232 1.00 0.00 O ATOM 1161 CB ARG A 284 7.114 -12.828 -2.872 1.00 0.00 C ATOM 1162 CG ARG A 284 7.621 -14.208 -3.316 1.00 0.00 C ATOM 1163 CD ARG A 284 9.135 -14.348 -3.175 1.00 0.00 C ATOM 1164 NE ARG A 284 9.869 -13.422 -4.038 1.00 0.00 N ATOM 1165 CZ ARG A 284 10.915 -12.672 -3.660 1.00 0.00 C ATOM 1166 NH1 ARG A 284 11.304 -12.635 -2.384 1.00 0.00 N ATOM 1167 NH2 ARG A 284 11.564 -11.963 -4.564 1.00 0.00 N ATOM 0 H ARG A 284 6.610 -14.201 -0.882 1.00 0.00 H new ATOM 0 HA ARG A 284 8.621 -12.266 -1.450 1.00 0.00 H new ATOM 0 HB2 ARG A 284 6.025 -12.819 -2.927 1.00 0.00 H new ATOM 0 HB3 ARG A 284 7.475 -12.078 -3.576 1.00 0.00 H new ATOM 0 HG2 ARG A 284 7.131 -14.980 -2.722 1.00 0.00 H new ATOM 0 HG3 ARG A 284 7.339 -14.378 -4.355 1.00 0.00 H new ATOM 0 HD2 ARG A 284 9.417 -14.172 -2.137 1.00 0.00 H new ATOM 0 HD3 ARG A 284 9.425 -15.371 -3.416 1.00 0.00 H new ATOM 0 HE ARG A 284 9.560 -13.340 -5.007 1.00 0.00 H new ATOM 0 HH11 ARG A 284 10.804 -13.181 -1.682 1.00 0.00 H new ATOM 0 HH12 ARG A 284 12.101 -12.060 -2.110 1.00 0.00 H new ATOM 0 HH21 ARG A 284 11.269 -11.988 -5.540 1.00 0.00 H new ATOM 0 HH22 ARG A 284 12.361 -11.390 -4.287 1.00 0.00 H new ATOM 1181 N LEU A 285 5.703 -11.183 -0.459 1.00 0.00 N ATOM 1182 CA LEU A 285 5.008 -10.023 0.095 1.00 0.00 C ATOM 1183 C LEU A 285 5.791 -9.420 1.238 1.00 0.00 C ATOM 1184 O LEU A 285 6.085 -8.234 1.234 1.00 0.00 O ATOM 1185 CB LEU A 285 3.616 -10.420 0.572 1.00 0.00 C ATOM 1186 CG LEU A 285 2.554 -10.605 -0.504 1.00 0.00 C ATOM 1187 CD1 LEU A 285 1.360 -11.323 0.078 1.00 0.00 C ATOM 1188 CD2 LEU A 285 2.117 -9.248 -1.044 1.00 0.00 C ATOM 0 H LEU A 285 5.189 -12.059 -0.362 1.00 0.00 H new ATOM 0 HA LEU A 285 4.916 -9.275 -0.693 1.00 0.00 H new ATOM 0 HB2 LEU A 285 3.700 -11.352 1.131 1.00 0.00 H new ATOM 0 HB3 LEU A 285 3.265 -9.660 1.270 1.00 0.00 H new ATOM 0 HG LEU A 285 2.973 -11.196 -1.318 1.00 0.00 H new ATOM 0 HD11 LEU A 285 0.602 -11.454 -0.694 1.00 0.00 H new ATOM 0 HD12 LEU A 285 1.669 -12.299 0.452 1.00 0.00 H new ATOM 0 HD13 LEU A 285 0.946 -10.735 0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 285 1.358 -9.390 -1.813 1.00 0.00 H new ATOM 0 HD22 LEU A 285 1.704 -8.649 -0.232 1.00 0.00 H new ATOM 0 HD23 LEU A 285 2.977 -8.733 -1.474 1.00 0.00 H new ATOM 1200 N PHE A 286 6.170 -10.255 2.192 1.00 0.00 N ATOM 1201 CA PHE A 286 6.921 -9.815 3.368 1.00 0.00 C ATOM 1202 C PHE A 286 8.255 -9.189 2.920 1.00 0.00 C ATOM 1203 O PHE A 286 8.779 -8.235 3.533 1.00 0.00 O ATOM 1204 CB PHE A 286 7.185 -11.029 4.266 1.00 0.00 C ATOM 1205 CG PHE A 286 7.617 -10.696 5.654 1.00 0.00 C ATOM 1206 CD1 PHE A 286 6.670 -10.412 6.615 1.00 0.00 C ATOM 1207 CD2 PHE A 286 8.952 -10.684 6.005 1.00 0.00 C ATOM 1208 CE1 PHE A 286 7.039 -10.119 7.900 1.00 0.00 C ATOM 1209 CE2 PHE A 286 9.333 -10.390 7.295 1.00 0.00 C ATOM 1210 CZ PHE A 286 8.375 -10.106 8.246 1.00 0.00 C ATOM 0 H PHE A 286 5.969 -11.255 2.178 1.00 0.00 H new ATOM 0 HA PHE A 286 6.350 -9.069 3.921 1.00 0.00 H new ATOM 0 HB2 PHE A 286 6.277 -11.630 4.317 1.00 0.00 H new ATOM 0 HB3 PHE A 286 7.952 -11.648 3.800 1.00 0.00 H new ATOM 0 HD1 PHE A 286 5.623 -10.421 6.350 1.00 0.00 H new ATOM 0 HD2 PHE A 286 9.703 -10.907 5.262 1.00 0.00 H new ATOM 0 HE1 PHE A 286 6.286 -9.898 8.642 1.00 0.00 H new ATOM 0 HE2 PHE A 286 10.380 -10.382 7.562 1.00 0.00 H new ATOM 0 HZ PHE A 286 8.670 -9.874 9.259 1.00 0.00 H new ATOM 1220 N ASP A 287 8.771 -9.715 1.823 1.00 0.00 N ATOM 1221 CA ASP A 287 10.021 -9.268 1.245 1.00 0.00 C ATOM 1222 C ASP A 287 9.897 -7.830 0.792 1.00 0.00 C ATOM 1223 O ASP A 287 10.640 -6.986 1.243 1.00 0.00 O ATOM 1224 CB ASP A 287 10.399 -10.155 0.063 1.00 0.00 C ATOM 1225 CG ASP A 287 11.851 -10.043 -0.343 1.00 0.00 C ATOM 1226 OD1 ASP A 287 12.724 -10.513 0.424 1.00 0.00 O ATOM 1227 OD2 ASP A 287 12.143 -9.563 -1.451 1.00 0.00 O ATOM 0 H ASP A 287 8.327 -10.473 1.305 1.00 0.00 H new ATOM 0 HA ASP A 287 10.803 -9.336 2.002 1.00 0.00 H new ATOM 0 HB2 ASP A 287 10.181 -11.193 0.315 1.00 0.00 H new ATOM 0 HB3 ASP A 287 9.772 -9.895 -0.790 1.00 0.00 H new ATOM 1232 N VAL A 288 8.880 -7.537 -0.025 1.00 0.00 N ATOM 1233 CA VAL A 288 8.693 -6.176 -0.543 1.00 0.00 C ATOM 1234 C VAL A 288 8.301 -5.202 0.558 1.00 0.00 C ATOM 1235 O VAL A 288 8.643 -4.037 0.507 1.00 0.00 O ATOM 1236 CB VAL A 288 7.685 -6.087 -1.726 1.00 0.00 C ATOM 1237 CG1 VAL A 288 8.123 -6.974 -2.874 1.00 0.00 C ATOM 1238 CG2 VAL A 288 6.266 -6.415 -1.298 1.00 0.00 C ATOM 0 H VAL A 288 8.183 -8.212 -0.339 1.00 0.00 H new ATOM 0 HA VAL A 288 9.667 -5.889 -0.939 1.00 0.00 H new ATOM 0 HB VAL A 288 7.683 -5.052 -2.069 1.00 0.00 H new ATOM 0 HG11 VAL A 288 7.404 -6.896 -3.689 1.00 0.00 H new ATOM 0 HG12 VAL A 288 9.105 -6.657 -3.225 1.00 0.00 H new ATOM 0 HG13 VAL A 288 8.176 -8.009 -2.535 1.00 0.00 H new ATOM 0 HG21 VAL A 288 5.600 -6.339 -2.158 1.00 0.00 H new ATOM 0 HG22 VAL A 288 6.231 -7.429 -0.900 1.00 0.00 H new ATOM 0 HG23 VAL A 288 5.946 -5.712 -0.528 1.00 0.00 H new ATOM 1248 N LEU A 289 7.617 -5.702 1.568 1.00 0.00 N ATOM 1249 CA LEU A 289 7.197 -4.882 2.688 1.00 0.00 C ATOM 1250 C LEU A 289 8.401 -4.385 3.493 1.00 0.00 C ATOM 1251 O LEU A 289 8.371 -3.278 4.042 1.00 0.00 O ATOM 1252 CB LEU A 289 6.220 -5.658 3.588 1.00 0.00 C ATOM 1253 CG LEU A 289 4.890 -6.084 2.937 1.00 0.00 C ATOM 1254 CD1 LEU A 289 4.078 -6.951 3.881 1.00 0.00 C ATOM 1255 CD2 LEU A 289 4.080 -4.872 2.505 1.00 0.00 C ATOM 0 H LEU A 289 7.338 -6.681 1.636 1.00 0.00 H new ATOM 0 HA LEU A 289 6.680 -4.008 2.291 1.00 0.00 H new ATOM 0 HB2 LEU A 289 6.726 -6.552 3.952 1.00 0.00 H new ATOM 0 HB3 LEU A 289 5.994 -5.043 4.459 1.00 0.00 H new ATOM 0 HG LEU A 289 5.129 -6.670 2.050 1.00 0.00 H new ATOM 0 HD11 LEU A 289 3.144 -7.239 3.398 1.00 0.00 H new ATOM 0 HD12 LEU A 289 4.647 -7.846 4.133 1.00 0.00 H new ATOM 0 HD13 LEU A 289 3.859 -6.392 4.791 1.00 0.00 H new ATOM 0 HD21 LEU A 289 3.147 -5.202 2.049 1.00 0.00 H new ATOM 0 HD22 LEU A 289 3.860 -4.253 3.375 1.00 0.00 H new ATOM 0 HD23 LEU A 289 4.652 -4.291 1.781 1.00 0.00 H new ATOM 1267 N HIS A 290 9.468 -5.184 3.519 1.00 0.00 N ATOM 1268 CA HIS A 290 10.664 -4.852 4.296 1.00 0.00 C ATOM 1269 C HIS A 290 11.873 -4.555 3.398 1.00 0.00 C ATOM 1270 O HIS A 290 13.025 -4.577 3.857 1.00 0.00 O ATOM 1271 CB HIS A 290 10.999 -5.972 5.303 1.00 0.00 C ATOM 1272 CG HIS A 290 10.005 -6.135 6.426 1.00 0.00 C ATOM 1273 ND1 HIS A 290 10.280 -5.853 7.752 1.00 0.00 N ATOM 1274 CD2 HIS A 290 8.726 -6.590 6.404 1.00 0.00 C ATOM 1275 CE1 HIS A 290 9.192 -6.141 8.470 1.00 0.00 C ATOM 1276 NE2 HIS A 290 8.216 -6.592 7.699 1.00 0.00 N ATOM 0 H HIS A 290 9.529 -6.066 3.011 1.00 0.00 H new ATOM 0 HA HIS A 290 10.439 -3.942 4.851 1.00 0.00 H new ATOM 0 HB2 HIS A 290 11.073 -6.916 4.763 1.00 0.00 H new ATOM 0 HB3 HIS A 290 11.981 -5.773 5.732 1.00 0.00 H new ATOM 0 HD2 HIS A 290 8.189 -6.901 5.520 1.00 0.00 H new ATOM 0 HE1 HIS A 290 9.118 -6.021 9.541 1.00 0.00 H new ATOM 0 HE2 HIS A 290 7.283 -6.881 7.993 1.00 0.00 H new ATOM 1284 N GLU A 291 11.619 -4.274 2.151 1.00 0.00 N ATOM 1285 CA GLU A 291 12.652 -3.926 1.204 1.00 0.00 C ATOM 1286 C GLU A 291 12.544 -2.459 0.839 1.00 0.00 C ATOM 1287 O GLU A 291 11.445 -1.961 0.612 1.00 0.00 O ATOM 1288 CB GLU A 291 12.561 -4.805 -0.044 1.00 0.00 C ATOM 1289 CG GLU A 291 13.352 -6.096 0.043 1.00 0.00 C ATOM 1290 CD GLU A 291 14.844 -5.866 0.051 1.00 0.00 C ATOM 1291 OE1 GLU A 291 15.432 -5.718 -1.039 1.00 0.00 O ATOM 1292 OE2 GLU A 291 15.463 -5.862 1.135 1.00 0.00 O ATOM 0 H GLU A 291 10.679 -4.279 1.754 1.00 0.00 H new ATOM 0 HA GLU A 291 13.624 -4.101 1.665 1.00 0.00 H new ATOM 0 HB2 GLU A 291 11.514 -5.046 -0.229 1.00 0.00 H new ATOM 0 HB3 GLU A 291 12.913 -4.234 -0.903 1.00 0.00 H new ATOM 0 HG2 GLU A 291 13.066 -6.632 0.948 1.00 0.00 H new ATOM 0 HG3 GLU A 291 13.091 -6.734 -0.801 1.00 0.00 H new ATOM 1299 N PRO A 292 13.671 -1.741 0.794 1.00 0.00 N ATOM 1300 CA PRO A 292 13.670 -0.335 0.477 1.00 0.00 C ATOM 1301 C PRO A 292 13.323 -0.088 -0.977 1.00 0.00 C ATOM 1302 O PRO A 292 13.643 -0.909 -1.854 1.00 0.00 O ATOM 1303 CB PRO A 292 15.091 0.133 0.775 1.00 0.00 C ATOM 1304 CG PRO A 292 15.924 -1.093 0.798 1.00 0.00 C ATOM 1305 CD PRO A 292 15.019 -2.263 1.025 1.00 0.00 C ATOM 0 HA PRO A 292 12.921 0.204 1.057 1.00 0.00 H new ATOM 0 HB2 PRO A 292 15.441 0.829 0.013 1.00 0.00 H new ATOM 0 HB3 PRO A 292 15.138 0.656 1.730 1.00 0.00 H new ATOM 0 HG2 PRO A 292 16.463 -1.205 -0.143 1.00 0.00 H new ATOM 0 HG3 PRO A 292 16.672 -1.031 1.588 1.00 0.00 H new ATOM 0 HD2 PRO A 292 15.250 -3.080 0.342 1.00 0.00 H new ATOM 0 HD3 PRO A 292 15.124 -2.654 2.037 1.00 0.00 H new ATOM 1313 N PHE A 293 12.695 1.046 -1.239 1.00 0.00 N ATOM 1314 CA PHE A 293 12.267 1.391 -2.593 1.00 0.00 C ATOM 1315 C PHE A 293 13.467 1.509 -3.515 1.00 0.00 C ATOM 1316 O PHE A 293 13.418 1.094 -4.655 1.00 0.00 O ATOM 1317 CB PHE A 293 11.488 2.704 -2.622 1.00 0.00 C ATOM 1318 CG PHE A 293 10.437 2.829 -1.557 1.00 0.00 C ATOM 1319 CD1 PHE A 293 9.373 1.959 -1.509 1.00 0.00 C ATOM 1320 CD2 PHE A 293 10.511 3.836 -0.619 1.00 0.00 C ATOM 1321 CE1 PHE A 293 8.399 2.089 -0.548 1.00 0.00 C ATOM 1322 CE2 PHE A 293 9.544 3.973 0.351 1.00 0.00 C ATOM 1323 CZ PHE A 293 8.482 3.097 0.383 1.00 0.00 C ATOM 0 H PHE A 293 12.468 1.747 -0.534 1.00 0.00 H new ATOM 0 HA PHE A 293 11.612 0.590 -2.936 1.00 0.00 H new ATOM 0 HB2 PHE A 293 12.191 3.531 -2.520 1.00 0.00 H new ATOM 0 HB3 PHE A 293 11.013 2.808 -3.597 1.00 0.00 H new ATOM 0 HD1 PHE A 293 9.302 1.163 -2.236 1.00 0.00 H new ATOM 0 HD2 PHE A 293 11.340 4.528 -0.645 1.00 0.00 H new ATOM 0 HE1 PHE A 293 7.568 1.399 -0.524 1.00 0.00 H new ATOM 0 HE2 PHE A 293 9.618 4.763 1.083 1.00 0.00 H new ATOM 0 HZ PHE A 293 7.716 3.202 1.137 1.00 0.00 H new ATOM 1333 N LEU A 294 14.560 2.036 -2.980 1.00 0.00 N ATOM 1334 CA LEU A 294 15.782 2.234 -3.745 1.00 0.00 C ATOM 1335 C LEU A 294 16.634 0.970 -3.758 1.00 0.00 C ATOM 1336 O LEU A 294 17.788 1.015 -4.175 1.00 0.00 O ATOM 1337 CB LEU A 294 16.647 3.383 -3.168 1.00 0.00 C ATOM 1338 CG LEU A 294 16.046 4.807 -3.098 1.00 0.00 C ATOM 1339 CD1 LEU A 294 15.011 4.946 -1.995 1.00 0.00 C ATOM 1340 CD2 LEU A 294 17.144 5.832 -2.918 1.00 0.00 C ATOM 0 H LEU A 294 14.624 2.337 -2.008 1.00 0.00 H new ATOM 0 HA LEU A 294 15.466 2.489 -4.757 1.00 0.00 H new ATOM 0 HB2 LEU A 294 16.941 3.099 -2.158 1.00 0.00 H new ATOM 0 HB3 LEU A 294 17.559 3.439 -3.762 1.00 0.00 H new ATOM 0 HG LEU A 294 15.534 4.986 -4.044 1.00 0.00 H new ATOM 0 HD11 LEU A 294 14.620 5.964 -1.989 1.00 0.00 H new ATOM 0 HD12 LEU A 294 14.195 4.245 -2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 294 15.474 4.729 -1.032 1.00 0.00 H new ATOM 0 HD21 LEU A 294 16.707 6.829 -2.870 1.00 0.00 H new ATOM 0 HD22 LEU A 294 17.684 5.628 -1.993 1.00 0.00 H new ATOM 0 HD23 LEU A 294 17.834 5.778 -3.760 1.00 0.00 H new ATOM 1352 N LYS A 295 16.085 -0.144 -3.239 1.00 0.00 N ATOM 1353 CA LYS A 295 16.778 -1.460 -3.137 1.00 0.00 C ATOM 1354 C LYS A 295 17.877 -1.420 -2.043 1.00 0.00 C ATOM 1355 O LYS A 295 18.048 -2.359 -1.271 1.00 0.00 O ATOM 1356 CB LYS A 295 17.392 -1.877 -4.492 1.00 0.00 C ATOM 1357 CG LYS A 295 18.007 -3.259 -4.489 1.00 0.00 C ATOM 1358 CD LYS A 295 18.840 -3.528 -5.733 1.00 0.00 C ATOM 1359 CE LYS A 295 20.079 -2.632 -5.786 1.00 0.00 C ATOM 1360 NZ LYS A 295 20.948 -2.952 -6.938 1.00 0.00 N ATOM 0 H LYS A 295 15.134 -0.165 -2.871 1.00 0.00 H new ATOM 0 HA LYS A 295 16.032 -2.204 -2.857 1.00 0.00 H new ATOM 0 HB2 LYS A 295 16.618 -1.837 -5.258 1.00 0.00 H new ATOM 0 HB3 LYS A 295 18.155 -1.151 -4.772 1.00 0.00 H new ATOM 0 HG2 LYS A 295 18.634 -3.372 -3.604 1.00 0.00 H new ATOM 0 HG3 LYS A 295 17.216 -4.005 -4.417 1.00 0.00 H new ATOM 0 HD2 LYS A 295 19.146 -4.574 -5.747 1.00 0.00 H new ATOM 0 HD3 LYS A 295 18.232 -3.361 -6.622 1.00 0.00 H new ATOM 0 HE2 LYS A 295 19.769 -1.589 -5.845 1.00 0.00 H new ATOM 0 HE3 LYS A 295 20.647 -2.744 -4.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 21.775 -2.321 -6.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 21.266 -3.940 -6.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 20.416 -2.820 -7.822 1.00 0.00 H new ATOM 1720 N TYR B 833 16.672 0.574 -7.794 1.00 0.00 N ATOM 1721 CA TYR B 833 15.315 0.600 -7.299 1.00 0.00 C ATOM 1722 C TYR B 833 14.777 -0.789 -7.249 1.00 0.00 C ATOM 1723 O TYR B 833 15.142 -1.631 -8.072 1.00 0.00 O ATOM 1724 CB TYR B 833 14.385 1.522 -8.108 1.00 0.00 C ATOM 1725 CG TYR B 833 14.507 2.984 -7.746 1.00 0.00 C ATOM 1726 CD1 TYR B 833 13.743 3.523 -6.713 1.00 0.00 C ATOM 1727 CD2 TYR B 833 15.382 3.822 -8.414 1.00 0.00 C ATOM 1728 CE1 TYR B 833 13.858 4.846 -6.362 1.00 0.00 C ATOM 1729 CE2 TYR B 833 15.492 5.151 -8.060 1.00 0.00 C ATOM 1730 CZ TYR B 833 14.730 5.656 -7.041 1.00 0.00 C ATOM 1731 OH TYR B 833 14.863 6.976 -6.677 1.00 0.00 O ATOM 0 HA TYR B 833 15.346 1.022 -6.295 1.00 0.00 H new ATOM 0 HB2 TYR B 833 14.603 1.401 -9.169 1.00 0.00 H new ATOM 0 HB3 TYR B 833 13.353 1.205 -7.956 1.00 0.00 H new ATOM 0 HD1 TYR B 833 13.049 2.890 -6.180 1.00 0.00 H new ATOM 0 HD2 TYR B 833 15.985 3.432 -9.221 1.00 0.00 H new ATOM 0 HE1 TYR B 833 13.263 5.246 -5.554 1.00 0.00 H new ATOM 0 HE2 TYR B 833 16.181 5.794 -8.588 1.00 0.00 H new ATOM 0 HH TYR B 833 14.157 7.213 -6.040 1.00 0.00 H new ATOM 1741 N ASN B 834 13.946 -1.044 -6.295 1.00 0.00 N ATOM 1742 CA ASN B 834 13.371 -2.347 -6.130 1.00 0.00 C ATOM 1743 C ASN B 834 11.922 -2.255 -6.573 1.00 0.00 C ATOM 1744 O ASN B 834 11.113 -1.558 -5.935 1.00 0.00 O ATOM 1745 CB ASN B 834 13.476 -2.763 -4.670 1.00 0.00 C ATOM 1746 CG ASN B 834 13.278 -4.247 -4.415 1.00 0.00 C ATOM 1747 OD1 ASN B 834 12.533 -4.943 -5.116 1.00 0.00 O ATOM 1748 ND2 ASN B 834 13.948 -4.735 -3.399 1.00 0.00 N ATOM 0 H ASN B 834 13.643 -0.358 -5.604 1.00 0.00 H new ATOM 0 HA ASN B 834 13.893 -3.097 -6.725 1.00 0.00 H new ATOM 0 HB2 ASN B 834 14.456 -2.472 -4.293 1.00 0.00 H new ATOM 0 HB3 ASN B 834 12.735 -2.208 -4.094 1.00 0.00 H new ATOM 0 HD21 ASN B 834 13.866 -5.723 -3.161 1.00 0.00 H new ATOM 0 HD22 ASN B 834 14.552 -4.126 -2.847 1.00 0.00 H new ATOM 1755 N PRO B 835 11.574 -2.967 -7.659 1.00 0.00 N ATOM 1756 CA PRO B 835 10.261 -2.866 -8.325 1.00 0.00 C ATOM 1757 C PRO B 835 9.079 -3.177 -7.425 1.00 0.00 C ATOM 1758 O PRO B 835 8.048 -2.533 -7.527 1.00 0.00 O ATOM 1759 CB PRO B 835 10.358 -3.900 -9.456 1.00 0.00 C ATOM 1760 CG PRO B 835 11.444 -4.819 -9.009 1.00 0.00 C ATOM 1761 CD PRO B 835 12.438 -3.947 -8.345 1.00 0.00 C ATOM 0 HA PRO B 835 10.073 -1.845 -8.657 1.00 0.00 H new ATOM 0 HB2 PRO B 835 9.416 -4.431 -9.593 1.00 0.00 H new ATOM 0 HB3 PRO B 835 10.600 -3.429 -10.409 1.00 0.00 H new ATOM 0 HG2 PRO B 835 11.063 -5.576 -8.323 1.00 0.00 H new ATOM 0 HG3 PRO B 835 11.885 -5.348 -9.854 1.00 0.00 H new ATOM 0 HD2 PRO B 835 13.064 -4.501 -7.645 1.00 0.00 H new ATOM 0 HD3 PRO B 835 13.107 -3.471 -9.062 1.00 0.00 H new ATOM 1769 N GLY B 836 9.242 -4.142 -6.549 1.00 0.00 N ATOM 1770 CA GLY B 836 8.164 -4.546 -5.672 1.00 0.00 C ATOM 1771 C GLY B 836 7.719 -3.442 -4.719 1.00 0.00 C ATOM 1772 O GLY B 836 6.623 -2.900 -4.864 1.00 0.00 O ATOM 0 H GLY B 836 10.110 -4.663 -6.424 1.00 0.00 H new ATOM 0 HA2 GLY B 836 7.313 -4.862 -6.275 1.00 0.00 H new ATOM 0 HA3 GLY B 836 8.482 -5.412 -5.091 1.00 0.00 H new ATOM 1776 N PRO B 837 8.568 -3.045 -3.754 1.00 0.00 N ATOM 1777 CA PRO B 837 8.187 -2.064 -2.755 1.00 0.00 C ATOM 1778 C PRO B 837 7.960 -0.674 -3.310 1.00 0.00 C ATOM 1779 O PRO B 837 7.098 0.057 -2.794 1.00 0.00 O ATOM 1780 CB PRO B 837 9.337 -2.063 -1.765 1.00 0.00 C ATOM 1781 CG PRO B 837 10.499 -2.567 -2.532 1.00 0.00 C ATOM 1782 CD PRO B 837 9.946 -3.524 -3.546 1.00 0.00 C ATOM 0 HA PRO B 837 7.228 -2.331 -2.311 1.00 0.00 H new ATOM 0 HB2 PRO B 837 9.524 -1.062 -1.377 1.00 0.00 H new ATOM 0 HB3 PRO B 837 9.122 -2.702 -0.908 1.00 0.00 H new ATOM 0 HG2 PRO B 837 11.030 -1.748 -3.018 1.00 0.00 H new ATOM 0 HG3 PRO B 837 11.213 -3.065 -1.876 1.00 0.00 H new ATOM 0 HD2 PRO B 837 10.522 -3.505 -4.471 1.00 0.00 H new ATOM 0 HD3 PRO B 837 9.963 -4.551 -3.180 1.00 0.00 H new ATOM 1790 N GLN B 838 8.702 -0.294 -4.361 1.00 0.00 N ATOM 1791 CA GLN B 838 8.519 1.027 -4.919 1.00 0.00 C ATOM 1792 C GLN B 838 7.151 1.092 -5.502 1.00 0.00 C ATOM 1793 O GLN B 838 6.429 2.013 -5.232 1.00 0.00 O ATOM 1794 CB GLN B 838 9.615 1.404 -5.962 1.00 0.00 C ATOM 1795 CG GLN B 838 9.301 1.061 -7.417 1.00 0.00 C ATOM 1796 CD GLN B 838 10.451 1.345 -8.350 1.00 0.00 C ATOM 1797 OE1 GLN B 838 11.280 0.483 -8.620 1.00 0.00 O ATOM 1798 NE2 GLN B 838 10.532 2.562 -8.828 1.00 0.00 N ATOM 0 H GLN B 838 9.408 -0.870 -4.819 1.00 0.00 H new ATOM 0 HA GLN B 838 8.624 1.766 -4.125 1.00 0.00 H new ATOM 0 HB2 GLN B 838 9.800 2.476 -5.894 1.00 0.00 H new ATOM 0 HB3 GLN B 838 10.542 0.902 -5.683 1.00 0.00 H new ATOM 0 HG2 GLN B 838 9.036 0.006 -7.487 1.00 0.00 H new ATOM 0 HG3 GLN B 838 8.430 1.631 -7.739 1.00 0.00 H new ATOM 0 HE21 GLN B 838 9.824 3.254 -8.583 1.00 0.00 H new ATOM 0 HE22 GLN B 838 11.303 2.817 -9.446 1.00 0.00 H new ATOM 1807 N ASP B 839 6.747 0.025 -6.176 1.00 0.00 N ATOM 1808 CA ASP B 839 5.485 0.016 -6.853 1.00 0.00 C ATOM 1809 C ASP B 839 4.371 -0.019 -5.841 1.00 0.00 C ATOM 1810 O ASP B 839 3.386 0.662 -6.000 1.00 0.00 O ATOM 1811 CB ASP B 839 5.380 -1.163 -7.786 1.00 0.00 C ATOM 1812 CG ASP B 839 4.339 -0.983 -8.860 1.00 0.00 C ATOM 1813 OD1 ASP B 839 4.399 0.033 -9.590 1.00 0.00 O ATOM 1814 OD2 ASP B 839 3.483 -1.843 -9.028 1.00 0.00 O ATOM 0 H ASP B 839 7.283 -0.838 -6.261 1.00 0.00 H new ATOM 0 HA ASP B 839 5.404 0.924 -7.450 1.00 0.00 H new ATOM 0 HB2 ASP B 839 6.349 -1.334 -8.254 1.00 0.00 H new ATOM 0 HB3 ASP B 839 5.144 -2.056 -7.207 1.00 0.00 H new ATOM 1819 N PHE B 840 4.581 -0.789 -4.761 1.00 0.00 N ATOM 1820 CA PHE B 840 3.627 -0.912 -3.644 1.00 0.00 C ATOM 1821 C PHE B 840 3.248 0.489 -3.148 1.00 0.00 C ATOM 1822 O PHE B 840 2.076 0.806 -2.959 1.00 0.00 O ATOM 1823 CB PHE B 840 4.286 -1.701 -2.499 1.00 0.00 C ATOM 1824 CG PHE B 840 3.351 -2.592 -1.720 1.00 0.00 C ATOM 1825 CD1 PHE B 840 2.269 -2.075 -1.027 1.00 0.00 C ATOM 1826 CD2 PHE B 840 3.558 -3.962 -1.699 1.00 0.00 C ATOM 1827 CE1 PHE B 840 1.409 -2.913 -0.336 1.00 0.00 C ATOM 1828 CE2 PHE B 840 2.700 -4.801 -1.009 1.00 0.00 C ATOM 1829 CZ PHE B 840 1.624 -4.274 -0.330 1.00 0.00 C ATOM 0 H PHE B 840 5.424 -1.349 -4.636 1.00 0.00 H new ATOM 0 HA PHE B 840 2.731 -1.435 -3.979 1.00 0.00 H new ATOM 0 HB2 PHE B 840 5.087 -2.314 -2.913 1.00 0.00 H new ATOM 0 HB3 PHE B 840 4.749 -0.994 -1.810 1.00 0.00 H new ATOM 0 HD1 PHE B 840 2.094 -1.009 -1.025 1.00 0.00 H new ATOM 0 HD2 PHE B 840 4.401 -4.381 -2.229 1.00 0.00 H new ATOM 0 HE1 PHE B 840 0.568 -2.498 0.199 1.00 0.00 H new ATOM 0 HE2 PHE B 840 2.874 -5.867 -1.003 1.00 0.00 H new ATOM 0 HZ PHE B 840 0.950 -4.926 0.206 1.00 0.00 H new ATOM 1839 N LEU B 841 4.265 1.319 -2.993 1.00 0.00 N ATOM 1840 CA LEU B 841 4.115 2.707 -2.585 1.00 0.00 C ATOM 1841 C LEU B 841 3.540 3.567 -3.725 1.00 0.00 C ATOM 1842 O LEU B 841 2.712 4.438 -3.504 1.00 0.00 O ATOM 1843 CB LEU B 841 5.481 3.256 -2.136 1.00 0.00 C ATOM 1844 CG LEU B 841 5.630 4.777 -2.151 1.00 0.00 C ATOM 1845 CD1 LEU B 841 4.767 5.442 -1.096 1.00 0.00 C ATOM 1846 CD2 LEU B 841 7.080 5.197 -2.035 1.00 0.00 C ATOM 0 H LEU B 841 5.235 1.044 -3.149 1.00 0.00 H new ATOM 0 HA LEU B 841 3.412 2.751 -1.754 1.00 0.00 H new ATOM 0 HB2 LEU B 841 5.678 2.902 -1.124 1.00 0.00 H new ATOM 0 HB3 LEU B 841 6.251 2.829 -2.779 1.00 0.00 H new ATOM 0 HG LEU B 841 5.269 5.123 -3.120 1.00 0.00 H new ATOM 0 HD11 LEU B 841 4.904 6.522 -1.142 1.00 0.00 H new ATOM 0 HD12 LEU B 841 3.720 5.201 -1.278 1.00 0.00 H new ATOM 0 HD13 LEU B 841 5.056 5.081 -0.109 1.00 0.00 H new ATOM 0 HD21 LEU B 841 7.146 6.285 -2.049 1.00 0.00 H new ATOM 0 HD22 LEU B 841 7.494 4.821 -1.100 1.00 0.00 H new ATOM 0 HD23 LEU B 841 7.645 4.788 -2.873 1.00 0.00 H new ATOM 1858 N LEU B 842 3.966 3.301 -4.916 1.00 0.00 N ATOM 1859 CA LEU B 842 3.565 4.075 -6.079 1.00 0.00 C ATOM 1860 C LEU B 842 2.082 3.935 -6.402 1.00 0.00 C ATOM 1861 O LEU B 842 1.485 4.802 -7.054 1.00 0.00 O ATOM 1862 CB LEU B 842 4.378 3.647 -7.284 1.00 0.00 C ATOM 1863 CG LEU B 842 5.892 3.916 -7.260 1.00 0.00 C ATOM 1864 CD1 LEU B 842 6.446 4.057 -8.628 1.00 0.00 C ATOM 1865 CD2 LEU B 842 6.303 5.081 -6.374 1.00 0.00 C ATOM 0 H LEU B 842 4.608 2.537 -5.127 1.00 0.00 H new ATOM 0 HA LEU B 842 3.750 5.122 -5.840 1.00 0.00 H new ATOM 0 HB2 LEU B 842 4.230 2.576 -7.424 1.00 0.00 H new ATOM 0 HB3 LEU B 842 3.963 4.144 -8.161 1.00 0.00 H new ATOM 0 HG LEU B 842 6.331 3.030 -6.801 1.00 0.00 H new ATOM 0 HD11 LEU B 842 7.518 4.246 -8.569 1.00 0.00 H new ATOM 0 HD12 LEU B 842 6.270 3.139 -9.188 1.00 0.00 H new ATOM 0 HD13 LEU B 842 5.958 4.890 -9.134 1.00 0.00 H new ATOM 0 HD21 LEU B 842 7.385 5.204 -6.413 1.00 0.00 H new ATOM 0 HD22 LEU B 842 5.822 5.993 -6.726 1.00 0.00 H new ATOM 0 HD23 LEU B 842 5.997 4.883 -5.347 1.00 0.00 H new ATOM 1877 N LYS B 843 1.507 2.849 -5.979 1.00 0.00 N ATOM 1878 CA LYS B 843 0.116 2.550 -6.239 1.00 0.00 C ATOM 1879 C LYS B 843 -0.788 3.150 -5.156 1.00 0.00 C ATOM 1880 O LYS B 843 -2.007 3.222 -5.329 1.00 0.00 O ATOM 1881 CB LYS B 843 -0.047 1.039 -6.288 1.00 0.00 C ATOM 1882 CG LYS B 843 0.784 0.365 -7.379 1.00 0.00 C ATOM 1883 CD LYS B 843 0.128 0.411 -8.737 1.00 0.00 C ATOM 1884 CE LYS B 843 0.906 -0.446 -9.722 1.00 0.00 C ATOM 1885 NZ LYS B 843 0.257 -0.500 -11.044 1.00 0.00 N ATOM 0 H LYS B 843 1.990 2.133 -5.437 1.00 0.00 H new ATOM 0 HA LYS B 843 -0.179 2.991 -7.191 1.00 0.00 H new ATOM 0 HB2 LYS B 843 0.232 0.621 -5.321 1.00 0.00 H new ATOM 0 HB3 LYS B 843 -1.099 0.801 -6.446 1.00 0.00 H new ATOM 0 HG2 LYS B 843 1.759 0.850 -7.436 1.00 0.00 H new ATOM 0 HG3 LYS B 843 0.961 -0.674 -7.103 1.00 0.00 H new ATOM 0 HD2 LYS B 843 -0.900 0.055 -8.665 1.00 0.00 H new ATOM 0 HD3 LYS B 843 0.084 1.440 -9.094 1.00 0.00 H new ATOM 0 HE2 LYS B 843 1.915 -0.048 -9.830 1.00 0.00 H new ATOM 0 HE3 LYS B 843 1.003 -1.456 -9.325 1.00 0.00 H new ATOM 0 HZ1 LYS B 843 0.665 -1.279 -11.599 1.00 0.00 H new ATOM 0 HZ2 LYS B 843 -0.764 -0.658 -10.923 1.00 0.00 H new ATOM 0 HZ3 LYS B 843 0.411 0.399 -11.544 1.00 0.00 H new ATOM 1899 N MET B 844 -0.173 3.616 -4.071 1.00 0.00 N ATOM 1900 CA MET B 844 -0.891 4.157 -2.908 1.00 0.00 C ATOM 1901 C MET B 844 -1.644 5.438 -3.292 1.00 0.00 C ATOM 1902 O MET B 844 -1.117 6.269 -4.033 1.00 0.00 O ATOM 1903 CB MET B 844 0.096 4.454 -1.768 1.00 0.00 C ATOM 1904 CG MET B 844 0.897 3.240 -1.318 1.00 0.00 C ATOM 1905 SD MET B 844 -0.042 2.035 -0.382 1.00 0.00 S ATOM 1906 CE MET B 844 0.005 2.794 1.226 1.00 0.00 C ATOM 0 H MET B 844 0.842 3.631 -3.969 1.00 0.00 H new ATOM 0 HA MET B 844 -1.613 3.413 -2.570 1.00 0.00 H new ATOM 0 HB2 MET B 844 0.786 5.234 -2.091 1.00 0.00 H new ATOM 0 HB3 MET B 844 -0.456 4.850 -0.916 1.00 0.00 H new ATOM 0 HG2 MET B 844 1.317 2.751 -2.197 1.00 0.00 H new ATOM 0 HG3 MET B 844 1.736 3.579 -0.711 1.00 0.00 H new ATOM 0 HE1 MET B 844 0.307 2.055 1.968 1.00 0.00 H new ATOM 0 HE2 MET B 844 0.721 3.616 1.220 1.00 0.00 H new ATOM 0 HE3 MET B 844 -0.984 3.177 1.477 1.00 0.00 H new ATOM 1916 N PRO B 845 -2.887 5.619 -2.811 1.00 0.00 N ATOM 1917 CA PRO B 845 -3.693 6.796 -3.146 1.00 0.00 C ATOM 1918 C PRO B 845 -3.176 8.052 -2.449 1.00 0.00 C ATOM 1919 O PRO B 845 -2.722 8.000 -1.302 1.00 0.00 O ATOM 1920 CB PRO B 845 -5.088 6.435 -2.648 1.00 0.00 C ATOM 1921 CG PRO B 845 -4.852 5.475 -1.543 1.00 0.00 C ATOM 1922 CD PRO B 845 -3.595 4.713 -1.894 1.00 0.00 C ATOM 0 HA PRO B 845 -3.665 7.025 -4.211 1.00 0.00 H new ATOM 0 HB2 PRO B 845 -5.625 7.317 -2.299 1.00 0.00 H new ATOM 0 HB3 PRO B 845 -5.689 5.988 -3.440 1.00 0.00 H new ATOM 0 HG2 PRO B 845 -4.736 5.998 -0.594 1.00 0.00 H new ATOM 0 HG3 PRO B 845 -5.698 4.797 -1.432 1.00 0.00 H new ATOM 0 HD2 PRO B 845 -2.999 4.493 -1.008 1.00 0.00 H new ATOM 0 HD3 PRO B 845 -3.824 3.759 -2.370 1.00 0.00 H new ATOM 1930 N GLY B 846 -3.213 9.160 -3.156 1.00 0.00 N ATOM 1931 CA GLY B 846 -2.704 10.403 -2.634 1.00 0.00 C ATOM 1932 C GLY B 846 -1.233 10.577 -2.958 1.00 0.00 C ATOM 1933 O GLY B 846 -0.713 11.700 -2.985 1.00 0.00 O ATOM 0 H GLY B 846 -3.594 9.222 -4.100 1.00 0.00 H new ATOM 0 HA2 GLY B 846 -3.271 11.235 -3.052 1.00 0.00 H new ATOM 0 HA3 GLY B 846 -2.846 10.431 -1.554 1.00 0.00 H new ATOM 1937 N VAL B 847 -0.573 9.471 -3.245 1.00 0.00 N ATOM 1938 CA VAL B 847 0.839 9.472 -3.500 1.00 0.00 C ATOM 1939 C VAL B 847 1.151 9.703 -4.975 1.00 0.00 C ATOM 1940 O VAL B 847 1.107 8.791 -5.813 1.00 0.00 O ATOM 1941 CB VAL B 847 1.534 8.185 -2.980 1.00 0.00 C ATOM 1942 CG1 VAL B 847 3.034 8.255 -3.205 1.00 0.00 C ATOM 1943 CG2 VAL B 847 1.242 7.993 -1.505 1.00 0.00 C ATOM 0 H VAL B 847 -1.009 8.551 -3.306 1.00 0.00 H new ATOM 0 HA VAL B 847 1.249 10.311 -2.938 1.00 0.00 H new ATOM 0 HB VAL B 847 1.139 7.335 -3.536 1.00 0.00 H new ATOM 0 HG11 VAL B 847 3.501 7.343 -2.833 1.00 0.00 H new ATOM 0 HG12 VAL B 847 3.238 8.358 -4.271 1.00 0.00 H new ATOM 0 HG13 VAL B 847 3.442 9.114 -2.673 1.00 0.00 H new ATOM 0 HG21 VAL B 847 1.735 7.087 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL B 847 1.615 8.851 -0.946 1.00 0.00 H new ATOM 0 HG23 VAL B 847 0.166 7.903 -1.356 1.00 0.00 H new ATOM 1953 N ASN B 848 1.398 10.936 -5.271 1.00 0.00 N ATOM 1954 CA ASN B 848 1.825 11.390 -6.590 1.00 0.00 C ATOM 1955 C ASN B 848 3.345 11.277 -6.646 1.00 0.00 C ATOM 1956 O ASN B 848 3.952 11.001 -5.635 1.00 0.00 O ATOM 1957 CB ASN B 848 1.398 12.846 -6.801 1.00 0.00 C ATOM 1958 CG ASN B 848 1.815 13.714 -5.645 1.00 0.00 C ATOM 1959 OD1 ASN B 848 2.922 14.184 -5.593 1.00 0.00 O ATOM 1960 ND2 ASN B 848 0.932 13.933 -4.712 1.00 0.00 N ATOM 0 H ASN B 848 1.311 11.693 -4.593 1.00 0.00 H new ATOM 0 HA ASN B 848 1.369 10.784 -7.373 1.00 0.00 H new ATOM 0 HB2 ASN B 848 1.840 13.227 -7.722 1.00 0.00 H new ATOM 0 HB3 ASN B 848 0.316 12.895 -6.923 1.00 0.00 H new ATOM 0 HD21 ASN B 848 1.171 14.516 -3.910 1.00 0.00 H new ATOM 0 HD22 ASN B 848 0.002 13.521 -4.784 1.00 0.00 H new ATOM 1967 N ALA B 849 3.962 11.581 -7.783 1.00 0.00 N ATOM 1968 CA ALA B 849 5.423 11.363 -7.970 1.00 0.00 C ATOM 1969 C ALA B 849 6.260 12.218 -7.045 1.00 0.00 C ATOM 1970 O ALA B 849 7.338 11.812 -6.621 1.00 0.00 O ATOM 1971 CB ALA B 849 5.831 11.572 -9.422 1.00 0.00 C ATOM 0 H ALA B 849 3.490 11.978 -8.596 1.00 0.00 H new ATOM 0 HA ALA B 849 5.619 10.324 -7.705 1.00 0.00 H new ATOM 0 HB1 ALA B 849 6.903 11.406 -9.526 1.00 0.00 H new ATOM 0 HB2 ALA B 849 5.291 10.869 -10.056 1.00 0.00 H new ATOM 0 HB3 ALA B 849 5.591 12.591 -9.724 1.00 0.00 H new ATOM 1977 N LYS B 850 5.735 13.365 -6.702 1.00 0.00 N ATOM 1978 CA LYS B 850 6.398 14.295 -5.799 1.00 0.00 C ATOM 1979 C LYS B 850 6.431 13.628 -4.423 1.00 0.00 C ATOM 1980 O LYS B 850 7.462 13.550 -3.769 1.00 0.00 O ATOM 1981 CB LYS B 850 5.565 15.573 -5.734 1.00 0.00 C ATOM 1982 CG LYS B 850 5.117 16.050 -7.108 1.00 0.00 C ATOM 1983 CD LYS B 850 3.813 16.810 -7.023 1.00 0.00 C ATOM 1984 CE LYS B 850 3.194 16.959 -8.389 1.00 0.00 C ATOM 1985 NZ LYS B 850 1.884 17.640 -8.335 1.00 0.00 N ATOM 0 H LYS B 850 4.829 13.691 -7.039 1.00 0.00 H new ATOM 0 HA LYS B 850 7.407 14.540 -6.131 1.00 0.00 H new ATOM 0 HB2 LYS B 850 4.688 15.400 -5.110 1.00 0.00 H new ATOM 0 HB3 LYS B 850 6.148 16.358 -5.253 1.00 0.00 H new ATOM 0 HG2 LYS B 850 5.886 16.689 -7.543 1.00 0.00 H new ATOM 0 HG3 LYS B 850 5.000 15.194 -7.773 1.00 0.00 H new ATOM 0 HD2 LYS B 850 3.123 16.286 -6.361 1.00 0.00 H new ATOM 0 HD3 LYS B 850 3.987 17.794 -6.588 1.00 0.00 H new ATOM 0 HE2 LYS B 850 3.869 17.523 -9.033 1.00 0.00 H new ATOM 0 HE3 LYS B 850 3.072 15.974 -8.840 1.00 0.00 H new ATOM 0 HZ1 LYS B 850 1.495 17.721 -9.296 1.00 0.00 H new ATOM 0 HZ2 LYS B 850 1.231 17.089 -7.742 1.00 0.00 H new ATOM 0 HZ3 LYS B 850 2.003 18.590 -7.929 1.00 0.00 H new ATOM 1999 N ASN B 851 5.285 13.077 -4.052 1.00 0.00 N ATOM 2000 CA ASN B 851 5.104 12.362 -2.787 1.00 0.00 C ATOM 2001 C ASN B 851 5.861 11.041 -2.777 1.00 0.00 C ATOM 2002 O ASN B 851 6.422 10.669 -1.752 1.00 0.00 O ATOM 2003 CB ASN B 851 3.611 12.145 -2.491 1.00 0.00 C ATOM 2004 CG ASN B 851 2.884 13.388 -1.969 1.00 0.00 C ATOM 2005 OD1 ASN B 851 1.847 13.286 -1.348 1.00 0.00 O ATOM 2006 ND2 ASN B 851 3.438 14.552 -2.156 1.00 0.00 N ATOM 0 H ASN B 851 4.441 13.111 -4.624 1.00 0.00 H new ATOM 0 HA ASN B 851 5.522 12.983 -1.994 1.00 0.00 H new ATOM 0 HB2 ASN B 851 3.118 11.806 -3.402 1.00 0.00 H new ATOM 0 HB3 ASN B 851 3.511 11.345 -1.757 1.00 0.00 H new ATOM 0 HD21 ASN B 851 3.000 15.392 -1.778 1.00 0.00 H new ATOM 0 HD22 ASN B 851 4.310 14.623 -2.680 1.00 0.00 H new ATOM 2013 N CYS B 852 5.888 10.335 -3.926 1.00 0.00 N ATOM 2014 CA CYS B 852 6.661 9.088 -4.064 1.00 0.00 C ATOM 2015 C CYS B 852 8.106 9.366 -3.696 1.00 0.00 C ATOM 2016 O CYS B 852 8.750 8.590 -2.976 1.00 0.00 O ATOM 2017 CB CYS B 852 6.602 8.536 -5.506 1.00 0.00 C ATOM 2018 SG CYS B 852 4.947 8.188 -6.143 1.00 0.00 S ATOM 0 H CYS B 852 5.384 10.608 -4.769 1.00 0.00 H new ATOM 0 HA CYS B 852 6.227 8.340 -3.400 1.00 0.00 H new ATOM 0 HB2 CYS B 852 7.084 9.253 -6.170 1.00 0.00 H new ATOM 0 HB3 CYS B 852 7.188 7.618 -5.549 1.00 0.00 H new ATOM 0 HG CYS B 852 4.164 9.194 -5.888 1.00 0.00 H new ATOM 2024 N ARG B 853 8.590 10.509 -4.165 1.00 0.00 N ATOM 2025 CA ARG B 853 9.909 10.967 -3.854 1.00 0.00 C ATOM 2026 C ARG B 853 10.058 11.220 -2.354 1.00 0.00 C ATOM 2027 O ARG B 853 10.963 10.692 -1.742 1.00 0.00 O ATOM 2028 CB ARG B 853 10.268 12.220 -4.652 1.00 0.00 C ATOM 2029 CG ARG B 853 10.455 12.021 -6.155 1.00 0.00 C ATOM 2030 CD ARG B 853 11.452 10.915 -6.492 1.00 0.00 C ATOM 2031 NE ARG B 853 12.791 11.116 -5.900 1.00 0.00 N ATOM 2032 CZ ARG B 853 13.853 10.333 -6.177 1.00 0.00 C ATOM 2033 NH1 ARG B 853 13.768 9.426 -7.149 1.00 0.00 N ATOM 2034 NH2 ARG B 853 14.994 10.476 -5.496 1.00 0.00 N ATOM 0 H ARG B 853 8.064 11.137 -4.773 1.00 0.00 H new ATOM 0 HA ARG B 853 10.607 10.180 -4.140 1.00 0.00 H new ATOM 0 HB2 ARG B 853 9.485 12.963 -4.498 1.00 0.00 H new ATOM 0 HB3 ARG B 853 11.188 12.637 -4.243 1.00 0.00 H new ATOM 0 HG2 ARG B 853 9.492 11.784 -6.607 1.00 0.00 H new ATOM 0 HG3 ARG B 853 10.794 12.956 -6.600 1.00 0.00 H new ATOM 0 HD2 ARG B 853 11.052 9.961 -6.147 1.00 0.00 H new ATOM 0 HD3 ARG B 853 11.551 10.846 -7.575 1.00 0.00 H new ATOM 0 HE ARG B 853 12.919 11.889 -5.247 1.00 0.00 H new ATOM 0 HH11 ARG B 853 12.902 9.327 -7.679 1.00 0.00 H new ATOM 0 HH12 ARG B 853 14.568 8.831 -7.363 1.00 0.00 H new ATOM 0 HH21 ARG B 853 15.065 11.181 -4.762 1.00 0.00 H new ATOM 0 HH22 ARG B 853 15.794 9.880 -5.710 1.00 0.00 H new ATOM 2048 N SER B 854 9.132 11.977 -1.768 1.00 0.00 N ATOM 2049 CA SER B 854 9.156 12.298 -0.358 1.00 0.00 C ATOM 2050 C SER B 854 9.223 11.022 0.498 1.00 0.00 C ATOM 2051 O SER B 854 10.023 10.933 1.440 1.00 0.00 O ATOM 2052 CB SER B 854 7.920 13.122 -0.018 1.00 0.00 C ATOM 2053 OG SER B 854 7.820 14.248 -0.887 1.00 0.00 O ATOM 0 H SER B 854 8.342 12.383 -2.269 1.00 0.00 H new ATOM 0 HA SER B 854 10.050 12.880 -0.135 1.00 0.00 H new ATOM 0 HB2 SER B 854 7.027 12.504 -0.109 1.00 0.00 H new ATOM 0 HB3 SER B 854 7.972 13.457 1.018 1.00 0.00 H new ATOM 0 HG SER B 854 7.549 13.949 -1.780 1.00 0.00 H new ATOM 2059 N LEU B 855 8.435 10.015 0.131 1.00 0.00 N ATOM 2060 CA LEU B 855 8.445 8.767 0.849 1.00 0.00 C ATOM 2061 C LEU B 855 9.770 8.075 0.731 1.00 0.00 C ATOM 2062 O LEU B 855 10.300 7.673 1.697 1.00 0.00 O ATOM 2063 CB LEU B 855 7.336 7.805 0.422 1.00 0.00 C ATOM 2064 CG LEU B 855 5.974 7.899 1.127 1.00 0.00 C ATOM 2065 CD1 LEU B 855 6.096 7.756 2.648 1.00 0.00 C ATOM 2066 CD2 LEU B 855 5.235 9.146 0.741 1.00 0.00 C ATOM 0 H LEU B 855 7.788 10.049 -0.657 1.00 0.00 H new ATOM 0 HA LEU B 855 8.261 9.039 1.888 1.00 0.00 H new ATOM 0 HB2 LEU B 855 7.167 7.946 -0.646 1.00 0.00 H new ATOM 0 HB3 LEU B 855 7.709 6.789 0.554 1.00 0.00 H new ATOM 0 HG LEU B 855 5.382 7.052 0.781 1.00 0.00 H new ATOM 0 HD11 LEU B 855 5.107 7.829 3.101 1.00 0.00 H new ATOM 0 HD12 LEU B 855 6.534 6.787 2.888 1.00 0.00 H new ATOM 0 HD13 LEU B 855 6.733 8.550 3.038 1.00 0.00 H new ATOM 0 HD21 LEU B 855 4.277 9.176 1.260 1.00 0.00 H new ATOM 0 HD22 LEU B 855 5.826 10.019 1.018 1.00 0.00 H new ATOM 0 HD23 LEU B 855 5.065 9.150 -0.336 1.00 0.00 H new ATOM 2078 N MET B 856 10.328 8.002 -0.454 1.00 0.00 N ATOM 2079 CA MET B 856 11.589 7.264 -0.628 1.00 0.00 C ATOM 2080 C MET B 856 12.797 8.035 -0.080 1.00 0.00 C ATOM 2081 O MET B 856 13.905 7.501 0.014 1.00 0.00 O ATOM 2082 CB MET B 856 11.812 6.849 -2.083 1.00 0.00 C ATOM 2083 CG MET B 856 12.013 8.000 -3.039 1.00 0.00 C ATOM 2084 SD MET B 856 12.241 7.466 -4.742 1.00 0.00 S ATOM 2085 CE MET B 856 10.674 6.653 -5.070 1.00 0.00 C ATOM 0 H MET B 856 9.953 8.427 -1.302 1.00 0.00 H new ATOM 0 HA MET B 856 11.494 6.353 -0.036 1.00 0.00 H new ATOM 0 HB2 MET B 856 12.684 6.196 -2.132 1.00 0.00 H new ATOM 0 HB3 MET B 856 10.956 6.262 -2.416 1.00 0.00 H new ATOM 0 HG2 MET B 856 11.151 8.665 -2.985 1.00 0.00 H new ATOM 0 HG3 MET B 856 12.882 8.578 -2.726 1.00 0.00 H new ATOM 0 HE1 MET B 856 10.565 6.492 -6.143 1.00 0.00 H new ATOM 0 HE2 MET B 856 10.647 5.693 -4.555 1.00 0.00 H new ATOM 0 HE3 MET B 856 9.857 7.280 -4.712 1.00 0.00 H new ATOM 2095 N HIS B 857 12.585 9.283 0.250 1.00 0.00 N ATOM 2096 CA HIS B 857 13.615 10.100 0.847 1.00 0.00 C ATOM 2097 C HIS B 857 13.595 9.982 2.377 1.00 0.00 C ATOM 2098 O HIS B 857 14.638 9.932 3.019 1.00 0.00 O ATOM 2099 CB HIS B 857 13.490 11.572 0.404 1.00 0.00 C ATOM 2100 CG HIS B 857 14.102 11.889 -0.943 1.00 0.00 C ATOM 2101 ND1 HIS B 857 15.152 12.766 -1.118 1.00 0.00 N ATOM 2102 CD2 HIS B 857 13.766 11.471 -2.188 1.00 0.00 C ATOM 2103 CE1 HIS B 857 15.409 12.857 -2.422 1.00 0.00 C ATOM 2104 NE2 HIS B 857 14.594 12.087 -3.126 1.00 0.00 N ATOM 0 H HIS B 857 11.695 9.763 0.114 1.00 0.00 H new ATOM 0 HA HIS B 857 14.577 9.729 0.494 1.00 0.00 H new ATOM 0 HB2 HIS B 857 12.434 11.839 0.378 1.00 0.00 H new ATOM 0 HB3 HIS B 857 13.960 12.204 1.158 1.00 0.00 H new ATOM 0 HD1 HIS B 857 15.647 13.260 -0.376 1.00 0.00 H new ATOM 0 HD2 HIS B 857 12.978 10.769 -2.418 1.00 0.00 H new ATOM 0 HE1 HIS B 857 16.182 13.478 -2.849 1.00 0.00 H new ATOM 2112 N HIS B 858 12.407 9.921 2.954 1.00 0.00 N ATOM 2113 CA HIS B 858 12.264 9.817 4.414 1.00 0.00 C ATOM 2114 C HIS B 858 12.096 8.365 4.855 1.00 0.00 C ATOM 2115 O HIS B 858 12.545 7.959 5.926 1.00 0.00 O ATOM 2116 CB HIS B 858 11.041 10.614 4.912 1.00 0.00 C ATOM 2117 CG HIS B 858 11.114 12.108 4.759 1.00 0.00 C ATOM 2118 ND1 HIS B 858 11.037 12.887 3.648 1.00 0.00 N flip ATOM 2119 CD2 HIS B 858 11.211 12.980 5.825 1.00 0.00 C flip ATOM 2120 CE1 HIS B 858 11.085 14.225 4.028 1.00 0.00 C flip ATOM 2121 NE2 HIS B 858 11.187 14.224 5.348 1.00 0.00 N flip ATOM 0 H HIS B 858 11.524 9.941 2.444 1.00 0.00 H new ATOM 0 HA HIS B 858 13.176 10.229 4.845 1.00 0.00 H new ATOM 0 HB2 HIS B 858 10.160 10.258 4.378 1.00 0.00 H new ATOM 0 HB3 HIS B 858 10.889 10.385 5.967 1.00 0.00 H new ATOM 0 HD1 HIS B 858 10.957 12.546 2.690 1.00 0.00 H new ATOM 0 HD2 HIS B 858 11.292 12.702 6.865 1.00 0.00 H new ATOM 0 HE1 HIS B 858 11.047 15.087 3.379 1.00 0.00 H new ATOM 2129 N VAL B 859 11.452 7.611 4.036 1.00 0.00 N ATOM 2130 CA VAL B 859 11.085 6.253 4.321 1.00 0.00 C ATOM 2131 C VAL B 859 11.891 5.254 3.480 1.00 0.00 C ATOM 2132 O VAL B 859 12.231 5.507 2.322 1.00 0.00 O ATOM 2133 CB VAL B 859 9.534 6.077 4.130 1.00 0.00 C ATOM 2134 CG1 VAL B 859 9.114 4.636 4.059 1.00 0.00 C ATOM 2135 CG2 VAL B 859 8.798 6.745 5.266 1.00 0.00 C ATOM 0 H VAL B 859 11.152 7.926 3.114 1.00 0.00 H new ATOM 0 HA VAL B 859 11.331 6.034 5.360 1.00 0.00 H new ATOM 0 HB VAL B 859 9.282 6.543 3.178 1.00 0.00 H new ATOM 0 HG11 VAL B 859 8.034 4.578 3.927 1.00 0.00 H new ATOM 0 HG12 VAL B 859 9.609 4.154 3.216 1.00 0.00 H new ATOM 0 HG13 VAL B 859 9.394 4.129 4.983 1.00 0.00 H new ATOM 0 HG21 VAL B 859 7.724 6.619 5.128 1.00 0.00 H new ATOM 0 HG22 VAL B 859 9.098 6.291 6.211 1.00 0.00 H new ATOM 0 HG23 VAL B 859 9.040 7.808 5.281 1.00 0.00 H new ATOM 2145 N LYS B 860 12.217 4.158 4.113 1.00 0.00 N ATOM 2146 CA LYS B 860 12.941 3.069 3.539 1.00 0.00 C ATOM 2147 C LYS B 860 11.976 2.208 2.745 1.00 0.00 C ATOM 2148 O LYS B 860 12.167 1.961 1.552 1.00 0.00 O ATOM 2149 CB LYS B 860 13.487 2.205 4.683 1.00 0.00 C ATOM 2150 CG LYS B 860 14.387 1.057 4.255 1.00 0.00 C ATOM 2151 CD LYS B 860 14.439 -0.053 5.306 1.00 0.00 C ATOM 2152 CE LYS B 860 14.765 0.444 6.715 1.00 0.00 C ATOM 2153 NZ LYS B 860 16.107 1.045 6.821 1.00 0.00 N ATOM 0 H LYS B 860 11.970 3.999 5.090 1.00 0.00 H new ATOM 0 HA LYS B 860 13.743 3.444 2.903 1.00 0.00 H new ATOM 0 HB2 LYS B 860 14.043 2.846 5.367 1.00 0.00 H new ATOM 0 HB3 LYS B 860 12.645 1.797 5.242 1.00 0.00 H new ATOM 0 HG2 LYS B 860 14.027 0.646 3.312 1.00 0.00 H new ATOM 0 HG3 LYS B 860 15.394 1.433 4.075 1.00 0.00 H new ATOM 0 HD2 LYS B 860 13.478 -0.567 5.326 1.00 0.00 H new ATOM 0 HD3 LYS B 860 15.187 -0.788 5.008 1.00 0.00 H new ATOM 0 HE2 LYS B 860 14.019 1.180 7.016 1.00 0.00 H new ATOM 0 HE3 LYS B 860 14.690 -0.389 7.414 1.00 0.00 H new ATOM 0 HZ1 LYS B 860 16.269 1.362 7.798 1.00 0.00 H new ATOM 0 HZ2 LYS B 860 16.825 0.338 6.563 1.00 0.00 H new ATOM 0 HZ3 LYS B 860 16.175 1.859 6.177 1.00 0.00 H new ATOM 2167 N ASN B 861 10.903 1.805 3.418 1.00 0.00 N ATOM 2168 CA ASN B 861 9.962 0.831 2.879 1.00 0.00 C ATOM 2169 C ASN B 861 8.591 1.075 3.414 1.00 0.00 C ATOM 2170 O ASN B 861 8.454 1.665 4.495 1.00 0.00 O ATOM 2171 CB ASN B 861 10.423 -0.624 3.182 1.00 0.00 C ATOM 2172 CG ASN B 861 10.840 -0.923 4.643 1.00 0.00 C ATOM 2173 OD1 ASN B 861 11.674 -1.780 4.881 1.00 0.00 O ATOM 2174 ND2 ASN B 861 10.305 -0.216 5.608 1.00 0.00 N ATOM 0 H ASN B 861 10.662 2.144 4.350 1.00 0.00 H new ATOM 0 HA ASN B 861 9.935 0.952 1.796 1.00 0.00 H new ATOM 0 HB2 ASN B 861 9.614 -1.302 2.912 1.00 0.00 H new ATOM 0 HB3 ASN B 861 11.266 -0.858 2.531 1.00 0.00 H new ATOM 0 HD21 ASN B 861 10.585 -0.379 6.575 1.00 0.00 H new ATOM 0 HD22 ASN B 861 9.609 0.497 5.392 1.00 0.00 H new ATOM 2181 N ILE B 862 7.578 0.594 2.690 1.00 0.00 N ATOM 2182 CA ILE B 862 6.165 0.784 3.049 1.00 0.00 C ATOM 2183 C ILE B 862 5.850 0.400 4.497 1.00 0.00 C ATOM 2184 O ILE B 862 4.925 0.945 5.079 1.00 0.00 O ATOM 2185 CB ILE B 862 5.155 0.051 2.119 1.00 0.00 C ATOM 2186 CG1 ILE B 862 5.600 -1.392 1.786 1.00 0.00 C ATOM 2187 CG2 ILE B 862 4.851 0.872 0.867 1.00 0.00 C ATOM 2188 CD1 ILE B 862 6.466 -1.526 0.560 1.00 0.00 C ATOM 0 H ILE B 862 7.712 0.058 1.833 1.00 0.00 H new ATOM 0 HA ILE B 862 6.031 1.858 2.918 1.00 0.00 H new ATOM 0 HB ILE B 862 4.221 -0.044 2.673 1.00 0.00 H new ATOM 0 HG12 ILE B 862 6.143 -1.795 2.641 1.00 0.00 H new ATOM 0 HG13 ILE B 862 4.711 -2.009 1.653 1.00 0.00 H new ATOM 0 HG21 ILE B 862 4.143 0.331 0.240 1.00 0.00 H new ATOM 0 HG22 ILE B 862 4.421 1.831 1.156 1.00 0.00 H new ATOM 0 HG23 ILE B 862 5.773 1.041 0.310 1.00 0.00 H new ATOM 0 HD11 ILE B 862 6.725 -2.574 0.411 1.00 0.00 H new ATOM 0 HD12 ILE B 862 5.923 -1.159 -0.311 1.00 0.00 H new ATOM 0 HD13 ILE B 862 7.377 -0.942 0.692 1.00 0.00 H new ATOM 2200 N ALA B 863 6.622 -0.545 5.061 1.00 0.00 N ATOM 2201 CA ALA B 863 6.476 -0.947 6.460 1.00 0.00 C ATOM 2202 C ALA B 863 6.501 0.271 7.388 1.00 0.00 C ATOM 2203 O ALA B 863 5.618 0.433 8.222 1.00 0.00 O ATOM 2204 CB ALA B 863 7.567 -1.932 6.847 1.00 0.00 C ATOM 0 H ALA B 863 7.357 -1.044 4.560 1.00 0.00 H new ATOM 0 HA ALA B 863 5.509 -1.437 6.571 1.00 0.00 H new ATOM 0 HB1 ALA B 863 7.443 -2.220 7.891 1.00 0.00 H new ATOM 0 HB2 ALA B 863 7.498 -2.818 6.215 1.00 0.00 H new ATOM 0 HB3 ALA B 863 8.543 -1.465 6.713 1.00 0.00 H new ATOM 2210 N GLU B 864 7.476 1.161 7.172 1.00 0.00 N ATOM 2211 CA GLU B 864 7.607 2.366 7.975 1.00 0.00 C ATOM 2212 C GLU B 864 6.395 3.260 7.771 1.00 0.00 C ATOM 2213 O GLU B 864 5.752 3.656 8.710 1.00 0.00 O ATOM 2214 CB GLU B 864 8.867 3.136 7.618 1.00 0.00 C ATOM 2215 CG GLU B 864 10.155 2.382 7.846 1.00 0.00 C ATOM 2216 CD GLU B 864 11.353 3.259 7.641 1.00 0.00 C ATOM 2217 OE1 GLU B 864 11.475 3.862 6.579 1.00 0.00 O ATOM 2218 OE2 GLU B 864 12.180 3.389 8.557 1.00 0.00 O ATOM 0 H GLU B 864 8.184 1.062 6.444 1.00 0.00 H new ATOM 0 HA GLU B 864 7.673 2.064 9.020 1.00 0.00 H new ATOM 0 HB2 GLU B 864 8.813 3.427 6.569 1.00 0.00 H new ATOM 0 HB3 GLU B 864 8.892 4.056 8.203 1.00 0.00 H new ATOM 0 HG2 GLU B 864 10.167 1.980 8.859 1.00 0.00 H new ATOM 0 HG3 GLU B 864 10.205 1.532 7.165 1.00 0.00 H new ATOM 2225 N LEU B 865 6.092 3.513 6.504 1.00 0.00 N ATOM 2226 CA LEU B 865 4.946 4.331 6.058 1.00 0.00 C ATOM 2227 C LEU B 865 3.625 3.897 6.690 1.00 0.00 C ATOM 2228 O LEU B 865 2.806 4.719 7.076 1.00 0.00 O ATOM 2229 CB LEU B 865 4.880 4.315 4.494 1.00 0.00 C ATOM 2230 CG LEU B 865 3.498 4.489 3.804 1.00 0.00 C ATOM 2231 CD1 LEU B 865 3.677 5.073 2.425 1.00 0.00 C ATOM 2232 CD2 LEU B 865 2.816 3.137 3.638 1.00 0.00 C ATOM 0 H LEU B 865 6.646 3.150 5.728 1.00 0.00 H new ATOM 0 HA LEU B 865 5.104 5.354 6.400 1.00 0.00 H new ATOM 0 HB2 LEU B 865 5.535 5.106 4.127 1.00 0.00 H new ATOM 0 HB3 LEU B 865 5.302 3.369 4.155 1.00 0.00 H new ATOM 0 HG LEU B 865 2.895 5.148 4.428 1.00 0.00 H new ATOM 0 HD11 LEU B 865 2.703 5.191 1.950 1.00 0.00 H new ATOM 0 HD12 LEU B 865 4.163 6.046 2.502 1.00 0.00 H new ATOM 0 HD13 LEU B 865 4.295 4.405 1.824 1.00 0.00 H new ATOM 0 HD21 LEU B 865 1.849 3.274 3.153 1.00 0.00 H new ATOM 0 HD22 LEU B 865 3.440 2.487 3.025 1.00 0.00 H new ATOM 0 HD23 LEU B 865 2.670 2.681 4.617 1.00 0.00 H new ATOM 2244 N ALA B 866 3.442 2.621 6.792 1.00 0.00 N ATOM 2245 CA ALA B 866 2.213 2.075 7.319 1.00 0.00 C ATOM 2246 C ALA B 866 2.242 1.921 8.835 1.00 0.00 C ATOM 2247 O ALA B 866 1.204 1.663 9.468 1.00 0.00 O ATOM 2248 CB ALA B 866 1.902 0.765 6.642 1.00 0.00 C ATOM 0 H ALA B 866 4.131 1.922 6.516 1.00 0.00 H new ATOM 0 HA ALA B 866 1.416 2.786 7.102 1.00 0.00 H new ATOM 0 HB1 ALA B 866 0.974 0.359 7.044 1.00 0.00 H new ATOM 0 HB2 ALA B 866 1.793 0.927 5.570 1.00 0.00 H new ATOM 0 HB3 ALA B 866 2.714 0.061 6.822 1.00 0.00 H new ATOM 2254 N ALA B 867 3.405 2.049 9.415 1.00 0.00 N ATOM 2255 CA ALA B 867 3.544 1.949 10.857 1.00 0.00 C ATOM 2256 C ALA B 867 3.609 3.325 11.499 1.00 0.00 C ATOM 2257 O ALA B 867 3.347 3.482 12.694 1.00 0.00 O ATOM 2258 CB ALA B 867 4.773 1.147 11.213 1.00 0.00 C ATOM 0 H ALA B 867 4.277 2.223 8.916 1.00 0.00 H new ATOM 0 HA ALA B 867 2.664 1.436 11.244 1.00 0.00 H new ATOM 0 HB1 ALA B 867 4.863 1.081 12.297 1.00 0.00 H new ATOM 0 HB2 ALA B 867 4.687 0.144 10.795 1.00 0.00 H new ATOM 0 HB3 ALA B 867 5.657 1.636 10.804 1.00 0.00 H new ATOM 2264 N LEU B 868 3.958 4.315 10.718 1.00 0.00 N ATOM 2265 CA LEU B 868 4.064 5.656 11.210 1.00 0.00 C ATOM 2266 C LEU B 868 2.698 6.345 11.315 1.00 0.00 C ATOM 2267 O LEU B 868 1.710 5.911 10.713 1.00 0.00 O ATOM 2268 CB LEU B 868 5.158 6.482 10.460 1.00 0.00 C ATOM 2269 CG LEU B 868 5.081 6.611 8.929 1.00 0.00 C ATOM 2270 CD1 LEU B 868 3.912 7.444 8.478 1.00 0.00 C ATOM 2271 CD2 LEU B 868 6.381 7.172 8.378 1.00 0.00 C ATOM 0 H LEU B 868 4.175 4.210 9.727 1.00 0.00 H new ATOM 0 HA LEU B 868 4.424 5.599 12.237 1.00 0.00 H new ATOM 0 HB2 LEU B 868 5.151 7.490 10.875 1.00 0.00 H new ATOM 0 HB3 LEU B 868 6.126 6.044 10.704 1.00 0.00 H new ATOM 0 HG LEU B 868 4.927 5.608 8.531 1.00 0.00 H new ATOM 0 HD11 LEU B 868 3.905 7.502 7.390 1.00 0.00 H new ATOM 0 HD12 LEU B 868 2.985 6.986 8.823 1.00 0.00 H new ATOM 0 HD13 LEU B 868 3.998 8.448 8.895 1.00 0.00 H new ATOM 0 HD21 LEU B 868 6.310 7.257 7.294 1.00 0.00 H new ATOM 0 HD22 LEU B 868 6.563 8.157 8.808 1.00 0.00 H new ATOM 0 HD23 LEU B 868 7.204 6.505 8.637 1.00 0.00 H new ATOM 2283 N SER B 869 2.649 7.366 12.112 1.00 0.00 N ATOM 2284 CA SER B 869 1.440 8.099 12.404 1.00 0.00 C ATOM 2285 C SER B 869 1.157 9.136 11.317 1.00 0.00 C ATOM 2286 O SER B 869 2.031 9.441 10.484 1.00 0.00 O ATOM 2287 CB SER B 869 1.637 8.762 13.762 1.00 0.00 C ATOM 2288 OG SER B 869 0.538 9.556 14.186 1.00 0.00 O ATOM 0 H SER B 869 3.470 7.730 12.596 1.00 0.00 H new ATOM 0 HA SER B 869 0.579 7.432 12.428 1.00 0.00 H new ATOM 0 HB2 SER B 869 1.822 7.989 14.508 1.00 0.00 H new ATOM 0 HB3 SER B 869 2.529 9.387 13.723 1.00 0.00 H new ATOM 0 HG SER B 869 0.810 10.497 14.226 1.00 0.00 H new ATOM 2294 N GLN B 870 -0.056 9.693 11.341 1.00 0.00 N ATOM 2295 CA GLN B 870 -0.463 10.670 10.367 1.00 0.00 C ATOM 2296 C GLN B 870 0.409 11.909 10.389 1.00 0.00 C ATOM 2297 O GLN B 870 0.803 12.392 9.347 1.00 0.00 O ATOM 2298 CB GLN B 870 -1.940 11.039 10.469 1.00 0.00 C ATOM 2299 CG GLN B 870 -2.317 12.144 9.503 1.00 0.00 C ATOM 2300 CD GLN B 870 -3.776 12.421 9.417 1.00 0.00 C ATOM 2301 OE1 GLN B 870 -4.533 12.231 10.364 1.00 0.00 O ATOM 2302 NE2 GLN B 870 -4.178 12.901 8.279 1.00 0.00 N ATOM 0 H GLN B 870 -0.769 9.472 12.037 1.00 0.00 H new ATOM 0 HA GLN B 870 -0.323 10.186 9.401 1.00 0.00 H new ATOM 0 HB2 GLN B 870 -2.549 10.158 10.267 1.00 0.00 H new ATOM 0 HB3 GLN B 870 -2.165 11.355 11.487 1.00 0.00 H new ATOM 0 HG2 GLN B 870 -1.804 13.059 9.800 1.00 0.00 H new ATOM 0 HG3 GLN B 870 -1.951 11.881 8.510 1.00 0.00 H new ATOM 0 HE21 GLN B 870 -3.511 13.042 7.520 1.00 0.00 H new ATOM 0 HE22 GLN B 870 -5.161 13.137 8.144 1.00 0.00 H new ATOM 2311 N ASP B 871 0.736 12.394 11.557 1.00 0.00 N ATOM 2312 CA ASP B 871 1.582 13.586 11.694 1.00 0.00 C ATOM 2313 C ASP B 871 2.939 13.368 11.021 1.00 0.00 C ATOM 2314 O ASP B 871 3.478 14.279 10.389 1.00 0.00 O ATOM 2315 CB ASP B 871 1.740 13.995 13.175 1.00 0.00 C ATOM 2316 CG ASP B 871 2.382 12.936 14.045 1.00 0.00 C ATOM 2317 OD1 ASP B 871 1.838 11.820 14.136 1.00 0.00 O ATOM 2318 OD2 ASP B 871 3.401 13.219 14.701 1.00 0.00 O ATOM 0 H ASP B 871 0.435 11.990 12.444 1.00 0.00 H new ATOM 0 HA ASP B 871 1.087 14.412 11.184 1.00 0.00 H new ATOM 0 HB2 ASP B 871 2.339 14.904 13.227 1.00 0.00 H new ATOM 0 HB3 ASP B 871 0.757 14.236 13.581 1.00 0.00 H new ATOM 2323 N GLU B 872 3.432 12.139 11.087 1.00 0.00 N ATOM 2324 CA GLU B 872 4.672 11.762 10.431 1.00 0.00 C ATOM 2325 C GLU B 872 4.550 11.851 8.920 1.00 0.00 C ATOM 2326 O GLU B 872 5.331 12.547 8.269 1.00 0.00 O ATOM 2327 CB GLU B 872 5.105 10.352 10.841 1.00 0.00 C ATOM 2328 CG GLU B 872 5.675 10.271 12.233 1.00 0.00 C ATOM 2329 CD GLU B 872 6.908 11.124 12.346 1.00 0.00 C ATOM 2330 OE1 GLU B 872 7.984 10.694 11.887 1.00 0.00 O ATOM 2331 OE2 GLU B 872 6.807 12.273 12.826 1.00 0.00 O ATOM 0 H GLU B 872 2.983 11.378 11.596 1.00 0.00 H new ATOM 0 HA GLU B 872 5.436 12.469 10.754 1.00 0.00 H new ATOM 0 HB2 GLU B 872 4.247 9.684 10.771 1.00 0.00 H new ATOM 0 HB3 GLU B 872 5.850 9.990 10.132 1.00 0.00 H new ATOM 0 HG2 GLU B 872 4.930 10.600 12.957 1.00 0.00 H new ATOM 0 HG3 GLU B 872 5.918 9.236 12.473 1.00 0.00 H new ATOM 2338 N LEU B 873 3.560 11.174 8.366 1.00 0.00 N ATOM 2339 CA LEU B 873 3.363 11.159 6.920 1.00 0.00 C ATOM 2340 C LEU B 873 2.952 12.529 6.368 1.00 0.00 C ATOM 2341 O LEU B 873 3.343 12.900 5.271 1.00 0.00 O ATOM 2342 CB LEU B 873 2.424 9.998 6.487 1.00 0.00 C ATOM 2343 CG LEU B 873 1.076 9.867 7.214 1.00 0.00 C ATOM 2344 CD1 LEU B 873 0.038 10.800 6.649 1.00 0.00 C ATOM 2345 CD2 LEU B 873 0.578 8.431 7.232 1.00 0.00 C ATOM 0 H LEU B 873 2.878 10.627 8.891 1.00 0.00 H new ATOM 0 HA LEU B 873 4.329 10.953 6.458 1.00 0.00 H new ATOM 0 HB2 LEU B 873 2.222 10.108 5.422 1.00 0.00 H new ATOM 0 HB3 LEU B 873 2.967 9.061 6.613 1.00 0.00 H new ATOM 0 HG LEU B 873 1.249 10.164 8.248 1.00 0.00 H new ATOM 0 HD11 LEU B 873 -0.899 10.674 7.192 1.00 0.00 H new ATOM 0 HD12 LEU B 873 0.381 11.830 6.750 1.00 0.00 H new ATOM 0 HD13 LEU B 873 -0.120 10.573 5.595 1.00 0.00 H new ATOM 0 HD21 LEU B 873 -0.377 8.384 7.755 1.00 0.00 H new ATOM 0 HD22 LEU B 873 0.449 8.078 6.209 1.00 0.00 H new ATOM 0 HD23 LEU B 873 1.304 7.800 7.745 1.00 0.00 H new ATOM 2357 N THR B 874 2.237 13.290 7.163 1.00 0.00 N ATOM 2358 CA THR B 874 1.797 14.609 6.798 1.00 0.00 C ATOM 2359 C THR B 874 3.001 15.539 6.573 1.00 0.00 C ATOM 2360 O THR B 874 3.031 16.288 5.603 1.00 0.00 O ATOM 2361 CB THR B 874 0.810 15.157 7.870 1.00 0.00 C ATOM 2362 OG1 THR B 874 -0.359 14.327 7.898 1.00 0.00 O ATOM 2363 CG2 THR B 874 0.412 16.594 7.620 1.00 0.00 C ATOM 0 H THR B 874 1.942 13.002 8.096 1.00 0.00 H new ATOM 0 HA THR B 874 1.257 14.562 5.852 1.00 0.00 H new ATOM 0 HB THR B 874 1.322 15.134 8.832 1.00 0.00 H new ATOM 0 HG1 THR B 874 -0.172 13.516 8.416 1.00 0.00 H new ATOM 0 HG21 THR B 874 -0.277 16.922 8.399 1.00 0.00 H new ATOM 0 HG22 THR B 874 1.301 17.225 7.633 1.00 0.00 H new ATOM 0 HG23 THR B 874 -0.075 16.673 6.648 1.00 0.00 H new ATOM 2371 N SER B 875 4.015 15.427 7.421 1.00 0.00 N ATOM 2372 CA SER B 875 5.220 16.212 7.249 1.00 0.00 C ATOM 2373 C SER B 875 6.044 15.729 6.047 1.00 0.00 C ATOM 2374 O SER B 875 6.663 16.531 5.355 1.00 0.00 O ATOM 2375 CB SER B 875 6.049 16.174 8.520 1.00 0.00 C ATOM 2376 OG SER B 875 5.332 16.749 9.601 1.00 0.00 O ATOM 0 H SER B 875 4.023 14.803 8.228 1.00 0.00 H new ATOM 0 HA SER B 875 4.927 17.242 7.047 1.00 0.00 H new ATOM 0 HB2 SER B 875 6.312 15.143 8.758 1.00 0.00 H new ATOM 0 HB3 SER B 875 6.983 16.715 8.368 1.00 0.00 H new ATOM 0 HG SER B 875 4.711 16.087 9.971 1.00 0.00 H new ATOM 2382 N ILE B 876 6.026 14.424 5.797 1.00 0.00 N ATOM 2383 CA ILE B 876 6.772 13.851 4.679 1.00 0.00 C ATOM 2384 C ILE B 876 6.181 14.323 3.349 1.00 0.00 C ATOM 2385 O ILE B 876 6.894 14.839 2.487 1.00 0.00 O ATOM 2386 CB ILE B 876 6.782 12.285 4.729 1.00 0.00 C ATOM 2387 CG1 ILE B 876 7.427 11.795 6.033 1.00 0.00 C ATOM 2388 CG2 ILE B 876 7.517 11.709 3.527 1.00 0.00 C ATOM 2389 CD1 ILE B 876 7.419 10.287 6.205 1.00 0.00 C ATOM 0 H ILE B 876 5.505 13.744 6.351 1.00 0.00 H new ATOM 0 HA ILE B 876 7.802 14.197 4.763 1.00 0.00 H new ATOM 0 HB ILE B 876 5.749 11.937 4.697 1.00 0.00 H new ATOM 0 HG12 ILE B 876 8.458 12.148 6.070 1.00 0.00 H new ATOM 0 HG13 ILE B 876 6.905 12.248 6.876 1.00 0.00 H new ATOM 0 HG21 ILE B 876 7.511 10.621 3.584 1.00 0.00 H new ATOM 0 HG22 ILE B 876 7.021 12.027 2.610 1.00 0.00 H new ATOM 0 HG23 ILE B 876 8.547 12.066 3.525 1.00 0.00 H new ATOM 0 HD11 ILE B 876 7.893 10.026 7.151 1.00 0.00 H new ATOM 0 HD12 ILE B 876 6.391 9.926 6.203 1.00 0.00 H new ATOM 0 HD13 ILE B 876 7.968 9.824 5.385 1.00 0.00 H new ATOM 2401 N LEU B 877 4.877 14.169 3.214 1.00 0.00 N ATOM 2402 CA LEU B 877 4.169 14.528 1.991 1.00 0.00 C ATOM 2403 C LEU B 877 4.003 16.032 1.867 1.00 0.00 C ATOM 2404 O LEU B 877 3.885 16.560 0.765 1.00 0.00 O ATOM 2405 CB LEU B 877 2.785 13.841 1.915 1.00 0.00 C ATOM 2406 CG LEU B 877 2.738 12.324 1.590 1.00 0.00 C ATOM 2407 CD1 LEU B 877 3.571 11.500 2.534 1.00 0.00 C ATOM 2408 CD2 LEU B 877 1.312 11.823 1.597 1.00 0.00 C ATOM 0 H LEU B 877 4.276 13.792 3.946 1.00 0.00 H new ATOM 0 HA LEU B 877 4.778 14.175 1.159 1.00 0.00 H new ATOM 0 HB2 LEU B 877 2.285 13.993 2.871 1.00 0.00 H new ATOM 0 HB3 LEU B 877 2.195 14.362 1.161 1.00 0.00 H new ATOM 0 HG LEU B 877 3.164 12.208 0.593 1.00 0.00 H new ATOM 0 HD11 LEU B 877 3.500 10.448 2.258 1.00 0.00 H new ATOM 0 HD12 LEU B 877 4.611 11.821 2.476 1.00 0.00 H new ATOM 0 HD13 LEU B 877 3.206 11.634 3.552 1.00 0.00 H new ATOM 0 HD21 LEU B 877 1.300 10.758 1.367 1.00 0.00 H new ATOM 0 HD22 LEU B 877 0.874 11.987 2.581 1.00 0.00 H new ATOM 0 HD23 LEU B 877 0.733 12.363 0.848 1.00 0.00 H new ATOM 2420 N GLY B 878 3.912 16.711 2.991 1.00 0.00 N ATOM 2421 CA GLY B 878 3.793 18.156 2.999 1.00 0.00 C ATOM 2422 C GLY B 878 2.358 18.620 2.832 1.00 0.00 C ATOM 2423 O GLY B 878 1.968 19.681 3.330 1.00 0.00 O ATOM 0 H GLY B 878 3.918 16.283 3.917 1.00 0.00 H new ATOM 0 HA2 GLY B 878 4.191 18.545 3.936 1.00 0.00 H new ATOM 0 HA3 GLY B 878 4.402 18.572 2.197 1.00 0.00 H new ATOM 2427 N ASN B 879 1.582 17.851 2.113 1.00 0.00 N ATOM 2428 CA ASN B 879 0.196 18.171 1.865 1.00 0.00 C ATOM 2429 C ASN B 879 -0.702 17.380 2.763 1.00 0.00 C ATOM 2430 O ASN B 879 -0.677 16.146 2.738 1.00 0.00 O ATOM 2431 CB ASN B 879 -0.181 17.893 0.428 1.00 0.00 C ATOM 2432 CG ASN B 879 -0.496 19.138 -0.351 1.00 0.00 C ATOM 2433 OD1 ASN B 879 0.375 19.730 -0.961 1.00 0.00 O ATOM 2434 ND2 ASN B 879 -1.735 19.553 -0.329 1.00 0.00 N ATOM 0 H ASN B 879 1.893 16.981 1.680 1.00 0.00 H new ATOM 0 HA ASN B 879 0.071 19.234 2.069 1.00 0.00 H new ATOM 0 HB2 ASN B 879 0.637 17.364 -0.060 1.00 0.00 H new ATOM 0 HB3 ASN B 879 -1.046 17.230 0.407 1.00 0.00 H new ATOM 0 HD21 ASN B 879 -1.999 20.399 -0.834 1.00 0.00 H new ATOM 0 HD22 ASN B 879 -2.439 19.031 0.193 1.00 0.00 H new ATOM 2441 N ALA B 880 -1.515 18.081 3.522 1.00 0.00 N ATOM 2442 CA ALA B 880 -2.446 17.475 4.460 1.00 0.00 C ATOM 2443 C ALA B 880 -3.473 16.598 3.742 1.00 0.00 C ATOM 2444 O ALA B 880 -3.781 15.499 4.195 1.00 0.00 O ATOM 2445 CB ALA B 880 -3.140 18.555 5.268 1.00 0.00 C ATOM 0 H ALA B 880 -1.552 19.100 3.508 1.00 0.00 H new ATOM 0 HA ALA B 880 -1.880 16.832 5.134 1.00 0.00 H new ATOM 0 HB1 ALA B 880 -3.836 18.094 5.969 1.00 0.00 H new ATOM 0 HB2 ALA B 880 -2.397 19.131 5.820 1.00 0.00 H new ATOM 0 HB3 ALA B 880 -3.686 19.217 4.596 1.00 0.00 H new ATOM 2451 N ALA B 881 -3.975 17.084 2.612 1.00 0.00 N ATOM 2452 CA ALA B 881 -4.949 16.352 1.805 1.00 0.00 C ATOM 2453 C ALA B 881 -4.390 15.033 1.355 1.00 0.00 C ATOM 2454 O ALA B 881 -5.015 14.003 1.543 1.00 0.00 O ATOM 2455 CB ALA B 881 -5.375 17.157 0.601 1.00 0.00 C ATOM 0 H ALA B 881 -3.720 17.994 2.229 1.00 0.00 H new ATOM 0 HA ALA B 881 -5.821 16.172 2.433 1.00 0.00 H new ATOM 0 HB1 ALA B 881 -6.100 16.587 0.020 1.00 0.00 H new ATOM 0 HB2 ALA B 881 -5.829 18.092 0.930 1.00 0.00 H new ATOM 0 HB3 ALA B 881 -4.504 17.375 -0.018 1.00 0.00 H new ATOM 2461 N ASN B 882 -3.210 15.081 0.768 1.00 0.00 N ATOM 2462 CA ASN B 882 -2.503 13.883 0.279 1.00 0.00 C ATOM 2463 C ASN B 882 -2.321 12.905 1.406 1.00 0.00 C ATOM 2464 O ASN B 882 -2.610 11.713 1.279 1.00 0.00 O ATOM 2465 CB ASN B 882 -1.114 14.252 -0.236 1.00 0.00 C ATOM 2466 CG ASN B 882 -1.096 15.207 -1.402 1.00 0.00 C ATOM 2467 OD1 ASN B 882 -2.001 16.017 -1.587 1.00 0.00 O ATOM 2468 ND2 ASN B 882 -0.050 15.154 -2.159 1.00 0.00 N ATOM 0 H ASN B 882 -2.701 15.950 0.610 1.00 0.00 H new ATOM 0 HA ASN B 882 -3.098 13.448 -0.524 1.00 0.00 H new ATOM 0 HB2 ASN B 882 -0.545 14.692 0.583 1.00 0.00 H new ATOM 0 HB3 ASN B 882 -0.597 13.338 -0.527 1.00 0.00 H new ATOM 0 HD21 ASN B 882 0.045 15.800 -2.943 1.00 0.00 H new ATOM 0 HD22 ASN B 882 0.680 14.467 -1.973 1.00 0.00 H new ATOM 2475 N ALA B 883 -1.870 13.440 2.522 1.00 0.00 N ATOM 2476 CA ALA B 883 -1.601 12.681 3.710 1.00 0.00 C ATOM 2477 C ALA B 883 -2.848 12.015 4.246 1.00 0.00 C ATOM 2478 O ALA B 883 -2.786 10.900 4.731 1.00 0.00 O ATOM 2479 CB ALA B 883 -0.969 13.571 4.743 1.00 0.00 C ATOM 0 H ALA B 883 -1.679 14.437 2.623 1.00 0.00 H new ATOM 0 HA ALA B 883 -0.905 11.881 3.458 1.00 0.00 H new ATOM 0 HB1 ALA B 883 -0.765 12.994 5.645 1.00 0.00 H new ATOM 0 HB2 ALA B 883 -0.035 13.976 4.352 1.00 0.00 H new ATOM 0 HB3 ALA B 883 -1.648 14.390 4.982 1.00 0.00 H new ATOM 2485 N LYS B 884 -3.977 12.689 4.140 1.00 0.00 N ATOM 2486 CA LYS B 884 -5.235 12.130 4.577 1.00 0.00 C ATOM 2487 C LYS B 884 -5.598 10.893 3.771 1.00 0.00 C ATOM 2488 O LYS B 884 -5.985 9.869 4.344 1.00 0.00 O ATOM 2489 CB LYS B 884 -6.353 13.169 4.481 1.00 0.00 C ATOM 2490 CG LYS B 884 -7.749 12.577 4.575 1.00 0.00 C ATOM 2491 CD LYS B 884 -8.070 12.067 5.966 1.00 0.00 C ATOM 2492 CE LYS B 884 -9.244 11.121 5.918 1.00 0.00 C ATOM 2493 NZ LYS B 884 -9.791 10.839 7.258 1.00 0.00 N ATOM 0 H LYS B 884 -4.045 13.630 3.752 1.00 0.00 H new ATOM 0 HA LYS B 884 -5.120 11.835 5.620 1.00 0.00 H new ATOM 0 HB2 LYS B 884 -6.225 13.902 5.278 1.00 0.00 H new ATOM 0 HB3 LYS B 884 -6.258 13.705 3.537 1.00 0.00 H new ATOM 0 HG2 LYS B 884 -8.481 13.333 4.291 1.00 0.00 H new ATOM 0 HG3 LYS B 884 -7.842 11.759 3.861 1.00 0.00 H new ATOM 0 HD2 LYS B 884 -7.201 11.558 6.384 1.00 0.00 H new ATOM 0 HD3 LYS B 884 -8.296 12.905 6.625 1.00 0.00 H new ATOM 0 HE2 LYS B 884 -10.027 11.548 5.291 1.00 0.00 H new ATOM 0 HE3 LYS B 884 -8.936 10.186 5.450 1.00 0.00 H new ATOM 0 HZ1 LYS B 884 -10.595 10.185 7.174 1.00 0.00 H new ATOM 0 HZ2 LYS B 884 -9.053 10.407 7.850 1.00 0.00 H new ATOM 0 HZ3 LYS B 884 -10.111 11.726 7.696 1.00 0.00 H new ATOM 2507 N GLN B 885 -5.422 10.981 2.463 1.00 0.00 N ATOM 2508 CA GLN B 885 -5.821 9.911 1.550 1.00 0.00 C ATOM 2509 C GLN B 885 -5.006 8.682 1.841 1.00 0.00 C ATOM 2510 O GLN B 885 -5.533 7.579 1.963 1.00 0.00 O ATOM 2511 CB GLN B 885 -5.603 10.344 0.094 1.00 0.00 C ATOM 2512 CG GLN B 885 -6.068 11.759 -0.186 1.00 0.00 C ATOM 2513 CD GLN B 885 -7.493 12.029 0.245 1.00 0.00 C ATOM 2514 OE1 GLN B 885 -8.361 11.163 0.187 1.00 0.00 O ATOM 2515 NE2 GLN B 885 -7.698 13.188 0.794 1.00 0.00 N ATOM 0 H GLN B 885 -5.002 11.788 2.002 1.00 0.00 H new ATOM 0 HA GLN B 885 -6.879 9.694 1.695 1.00 0.00 H new ATOM 0 HB2 GLN B 885 -4.543 10.263 -0.147 1.00 0.00 H new ATOM 0 HB3 GLN B 885 -6.134 9.657 -0.565 1.00 0.00 H new ATOM 0 HG2 GLN B 885 -5.405 12.457 0.325 1.00 0.00 H new ATOM 0 HG3 GLN B 885 -5.977 11.957 -1.254 1.00 0.00 H new ATOM 0 HE21 GLN B 885 -6.949 13.879 0.821 1.00 0.00 H new ATOM 0 HE22 GLN B 885 -8.608 13.407 1.198 1.00 0.00 H new ATOM 2524 N LEU B 886 -3.725 8.907 1.999 1.00 0.00 N ATOM 2525 CA LEU B 886 -2.771 7.907 2.281 1.00 0.00 C ATOM 2526 C LEU B 886 -3.039 7.283 3.668 1.00 0.00 C ATOM 2527 O LEU B 886 -3.186 6.065 3.783 1.00 0.00 O ATOM 2528 CB LEU B 886 -1.410 8.607 2.166 1.00 0.00 C ATOM 2529 CG LEU B 886 -0.127 7.800 2.267 1.00 0.00 C ATOM 2530 CD1 LEU B 886 0.273 7.538 3.703 1.00 0.00 C ATOM 2531 CD2 LEU B 886 -0.221 6.503 1.483 1.00 0.00 C ATOM 0 H LEU B 886 -3.319 9.840 1.928 1.00 0.00 H new ATOM 0 HA LEU B 886 -2.812 7.064 1.591 1.00 0.00 H new ATOM 0 HB2 LEU B 886 -1.392 9.124 1.207 1.00 0.00 H new ATOM 0 HB3 LEU B 886 -1.373 9.372 2.942 1.00 0.00 H new ATOM 0 HG LEU B 886 0.659 8.407 1.819 1.00 0.00 H new ATOM 0 HD11 LEU B 886 1.196 6.958 3.724 1.00 0.00 H new ATOM 0 HD12 LEU B 886 0.429 8.487 4.216 1.00 0.00 H new ATOM 0 HD13 LEU B 886 -0.518 6.980 4.205 1.00 0.00 H new ATOM 0 HD21 LEU B 886 0.715 5.952 1.578 1.00 0.00 H new ATOM 0 HD22 LEU B 886 -1.039 5.899 1.875 1.00 0.00 H new ATOM 0 HD23 LEU B 886 -0.406 6.726 0.432 1.00 0.00 H new ATOM 2543 N TYR B 887 -3.148 8.131 4.691 1.00 0.00 N ATOM 2544 CA TYR B 887 -3.390 7.694 6.070 1.00 0.00 C ATOM 2545 C TYR B 887 -4.663 6.860 6.193 1.00 0.00 C ATOM 2546 O TYR B 887 -4.620 5.708 6.699 1.00 0.00 O ATOM 2547 CB TYR B 887 -3.434 8.911 7.024 1.00 0.00 C ATOM 2548 CG TYR B 887 -3.938 8.620 8.429 1.00 0.00 C ATOM 2549 CD1 TYR B 887 -3.143 7.969 9.377 1.00 0.00 C ATOM 2550 CD2 TYR B 887 -5.229 8.990 8.798 1.00 0.00 C ATOM 2551 CE1 TYR B 887 -3.629 7.705 10.644 1.00 0.00 C ATOM 2552 CE2 TYR B 887 -5.714 8.723 10.060 1.00 0.00 C ATOM 2553 CZ TYR B 887 -4.914 8.079 10.979 1.00 0.00 C ATOM 2554 OH TYR B 887 -5.403 7.807 12.243 1.00 0.00 O ATOM 0 H TYR B 887 -3.071 9.143 4.589 1.00 0.00 H new ATOM 0 HA TYR B 887 -2.558 7.052 6.360 1.00 0.00 H new ATOM 0 HB2 TYR B 887 -2.431 9.331 7.096 1.00 0.00 H new ATOM 0 HB3 TYR B 887 -4.070 9.677 6.580 1.00 0.00 H new ATOM 0 HD1 TYR B 887 -2.139 7.669 9.117 1.00 0.00 H new ATOM 0 HD2 TYR B 887 -5.861 9.495 8.083 1.00 0.00 H new ATOM 0 HE1 TYR B 887 -3.004 7.207 11.370 1.00 0.00 H new ATOM 0 HE2 TYR B 887 -6.718 9.018 10.328 1.00 0.00 H new ATOM 0 HH TYR B 887 -6.323 8.137 12.316 1.00 0.00 H new ATOM 2564 N ASP B 888 -5.788 7.418 5.736 1.00 0.00 N ATOM 2565 CA ASP B 888 -7.063 6.733 5.824 1.00 0.00 C ATOM 2566 C ASP B 888 -7.018 5.403 5.129 1.00 0.00 C ATOM 2567 O ASP B 888 -7.441 4.425 5.689 1.00 0.00 O ATOM 2568 CB ASP B 888 -8.179 7.579 5.251 1.00 0.00 C ATOM 2569 CG ASP B 888 -9.536 6.903 5.345 1.00 0.00 C ATOM 2570 OD1 ASP B 888 -10.107 6.855 6.460 1.00 0.00 O ATOM 2571 OD2 ASP B 888 -10.074 6.471 4.310 1.00 0.00 O ATOM 0 H ASP B 888 -5.833 8.341 5.304 1.00 0.00 H new ATOM 0 HA ASP B 888 -7.264 6.562 6.882 1.00 0.00 H new ATOM 0 HB2 ASP B 888 -8.215 8.532 5.780 1.00 0.00 H new ATOM 0 HB3 ASP B 888 -7.961 7.802 4.207 1.00 0.00 H new ATOM 2576 N PHE B 889 -6.419 5.380 3.943 1.00 0.00 N ATOM 2577 CA PHE B 889 -6.309 4.179 3.131 1.00 0.00 C ATOM 2578 C PHE B 889 -5.635 3.040 3.863 1.00 0.00 C ATOM 2579 O PHE B 889 -6.135 1.923 3.880 1.00 0.00 O ATOM 2580 CB PHE B 889 -5.544 4.465 1.858 1.00 0.00 C ATOM 2581 CG PHE B 889 -5.266 3.237 1.056 1.00 0.00 C ATOM 2582 CD1 PHE B 889 -6.266 2.635 0.336 1.00 0.00 C ATOM 2583 CD2 PHE B 889 -3.998 2.692 1.023 1.00 0.00 C ATOM 2584 CE1 PHE B 889 -6.016 1.513 -0.400 1.00 0.00 C ATOM 2585 CE2 PHE B 889 -3.738 1.569 0.282 1.00 0.00 C ATOM 2586 CZ PHE B 889 -4.745 0.977 -0.431 1.00 0.00 C ATOM 0 H PHE B 889 -5.993 6.203 3.517 1.00 0.00 H new ATOM 0 HA PHE B 889 -7.329 3.874 2.897 1.00 0.00 H new ATOM 0 HB2 PHE B 889 -6.112 5.169 1.250 1.00 0.00 H new ATOM 0 HB3 PHE B 889 -4.601 4.950 2.109 1.00 0.00 H new ATOM 0 HD1 PHE B 889 -7.262 3.053 0.352 1.00 0.00 H new ATOM 0 HD2 PHE B 889 -3.202 3.156 1.587 1.00 0.00 H new ATOM 0 HE1 PHE B 889 -6.813 1.045 -0.958 1.00 0.00 H new ATOM 0 HE2 PHE B 889 -2.742 1.153 0.261 1.00 0.00 H new ATOM 0 HZ PHE B 889 -4.545 0.092 -1.017 1.00 0.00 H new ATOM 2596 N ILE B 890 -4.494 3.330 4.450 1.00 0.00 N ATOM 2597 CA ILE B 890 -3.716 2.332 5.168 1.00 0.00 C ATOM 2598 C ILE B 890 -4.539 1.751 6.298 1.00 0.00 C ATOM 2599 O ILE B 890 -4.468 0.564 6.591 1.00 0.00 O ATOM 2600 CB ILE B 890 -2.431 2.961 5.756 1.00 0.00 C ATOM 2601 CG1 ILE B 890 -1.596 3.584 4.642 1.00 0.00 C ATOM 2602 CG2 ILE B 890 -1.611 1.923 6.531 1.00 0.00 C ATOM 2603 CD1 ILE B 890 -0.394 4.349 5.137 1.00 0.00 C ATOM 0 H ILE B 890 -4.076 4.261 4.446 1.00 0.00 H new ATOM 0 HA ILE B 890 -3.441 1.545 4.465 1.00 0.00 H new ATOM 0 HB ILE B 890 -2.722 3.743 6.457 1.00 0.00 H new ATOM 0 HG12 ILE B 890 -1.261 2.796 3.968 1.00 0.00 H new ATOM 0 HG13 ILE B 890 -2.227 4.255 4.059 1.00 0.00 H new ATOM 0 HG21 ILE B 890 -0.714 2.394 6.933 1.00 0.00 H new ATOM 0 HG22 ILE B 890 -2.209 1.525 7.350 1.00 0.00 H new ATOM 0 HG23 ILE B 890 -1.326 1.111 5.862 1.00 0.00 H new ATOM 0 HD11 ILE B 890 0.149 4.762 4.287 1.00 0.00 H new ATOM 0 HD12 ILE B 890 -0.721 5.160 5.788 1.00 0.00 H new ATOM 0 HD13 ILE B 890 0.260 3.678 5.694 1.00 0.00 H new ATOM 2615 N HIS B 891 -5.361 2.590 6.872 1.00 0.00 N ATOM 2616 CA HIS B 891 -6.138 2.211 8.037 1.00 0.00 C ATOM 2617 C HIS B 891 -7.577 1.848 7.685 1.00 0.00 C ATOM 2618 O HIS B 891 -8.446 1.754 8.580 1.00 0.00 O ATOM 2619 CB HIS B 891 -6.115 3.345 9.066 1.00 0.00 C ATOM 2620 CG HIS B 891 -4.749 3.571 9.605 1.00 0.00 C ATOM 2621 ND1 HIS B 891 -3.805 4.316 8.963 1.00 0.00 N ATOM 2622 CD2 HIS B 891 -4.144 3.049 10.690 1.00 0.00 C ATOM 2623 CE1 HIS B 891 -2.676 4.218 9.639 1.00 0.00 C ATOM 2624 NE2 HIS B 891 -2.821 3.458 10.709 1.00 0.00 N ATOM 0 H HIS B 891 -5.514 3.547 6.554 1.00 0.00 H new ATOM 0 HA HIS B 891 -5.679 1.318 8.460 1.00 0.00 H new ATOM 0 HB2 HIS B 891 -6.480 4.262 8.605 1.00 0.00 H new ATOM 0 HB3 HIS B 891 -6.794 3.107 9.885 1.00 0.00 H new ATOM 0 HD1 HIS B 891 -3.947 4.855 8.109 1.00 0.00 H new ATOM 0 HD2 HIS B 891 -4.615 2.414 11.426 1.00 0.00 H new ATOM 0 HE1 HIS B 891 -1.752 4.698 9.354 1.00 0.00 H new ATOM 2632 N THR B 892 -7.846 1.613 6.422 1.00 0.00 N ATOM 2633 CA THR B 892 -9.184 1.353 6.028 1.00 0.00 C ATOM 2634 C THR B 892 -9.268 0.125 5.117 1.00 0.00 C ATOM 2635 O THR B 892 -8.335 -0.207 4.365 1.00 0.00 O ATOM 2636 CB THR B 892 -9.840 2.608 5.349 1.00 0.00 C ATOM 2637 OG1 THR B 892 -11.272 2.528 5.415 1.00 0.00 O ATOM 2638 CG2 THR B 892 -9.448 2.704 3.893 1.00 0.00 C ATOM 0 H THR B 892 -7.158 1.599 5.669 1.00 0.00 H new ATOM 0 HA THR B 892 -9.752 1.135 6.933 1.00 0.00 H new ATOM 0 HB THR B 892 -9.485 3.486 5.888 1.00 0.00 H new ATOM 0 HG1 THR B 892 -11.664 3.319 4.989 1.00 0.00 H new ATOM 0 HG21 THR B 892 -9.916 3.582 3.447 1.00 0.00 H new ATOM 0 HG22 THR B 892 -8.364 2.790 3.813 1.00 0.00 H new ATOM 0 HG23 THR B 892 -9.780 1.809 3.367 1.00 0.00 H new ATOM 2646 N SER B 893 -10.369 -0.532 5.224 1.00 0.00 N ATOM 2647 CA SER B 893 -10.694 -1.663 4.447 1.00 0.00 C ATOM 2648 C SER B 893 -11.681 -1.212 3.368 1.00 0.00 C ATOM 2649 O SER B 893 -12.396 -0.233 3.554 1.00 0.00 O ATOM 2650 CB SER B 893 -11.357 -2.676 5.366 1.00 0.00 C ATOM 2651 OG SER B 893 -10.538 -2.946 6.501 1.00 0.00 O ATOM 0 H SER B 893 -11.099 -0.278 5.890 1.00 0.00 H new ATOM 0 HA SER B 893 -9.815 -2.108 3.981 1.00 0.00 H new ATOM 0 HB2 SER B 893 -12.325 -2.297 5.693 1.00 0.00 H new ATOM 0 HB3 SER B 893 -11.545 -3.600 4.820 1.00 0.00 H new ATOM 0 HG SER B 893 -10.985 -3.599 7.079 1.00 0.00 H new ATOM 2657 N PHE B 894 -11.742 -1.899 2.257 1.00 0.00 N ATOM 2658 CA PHE B 894 -12.696 -1.497 1.221 1.00 0.00 C ATOM 2659 C PHE B 894 -14.105 -1.977 1.589 1.00 0.00 C ATOM 2660 O PHE B 894 -15.108 -1.348 1.259 1.00 0.00 O ATOM 2661 CB PHE B 894 -12.292 -2.022 -0.180 1.00 0.00 C ATOM 2662 CG PHE B 894 -12.492 -3.507 -0.397 1.00 0.00 C ATOM 2663 CD1 PHE B 894 -11.627 -4.429 0.153 1.00 0.00 C ATOM 2664 CD2 PHE B 894 -13.565 -3.967 -1.148 1.00 0.00 C ATOM 2665 CE1 PHE B 894 -11.822 -5.784 -0.042 1.00 0.00 C ATOM 2666 CE2 PHE B 894 -13.764 -5.319 -1.347 1.00 0.00 C ATOM 2667 CZ PHE B 894 -12.890 -6.229 -0.791 1.00 0.00 C ATOM 0 H PHE B 894 -11.170 -2.714 2.037 1.00 0.00 H new ATOM 0 HA PHE B 894 -12.688 -0.408 1.170 1.00 0.00 H new ATOM 0 HB2 PHE B 894 -12.866 -1.481 -0.932 1.00 0.00 H new ATOM 0 HB3 PHE B 894 -11.242 -1.785 -0.350 1.00 0.00 H new ATOM 0 HD1 PHE B 894 -10.788 -4.089 0.742 1.00 0.00 H new ATOM 0 HD2 PHE B 894 -14.254 -3.258 -1.583 1.00 0.00 H new ATOM 0 HE1 PHE B 894 -11.136 -6.495 0.394 1.00 0.00 H new ATOM 0 HE2 PHE B 894 -14.601 -5.662 -1.936 1.00 0.00 H new ATOM 0 HZ PHE B 894 -13.042 -7.288 -0.942 1.00 0.00 H new