USER MOD reduce.3.24.130724 H: found=0, std=0, add=1008, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1006 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 848 ASN : amide:sc= -1.95 K(o=-1.7,f=-8!) USER MOD Set 1.2: B 851 ASN : amide:sc= -0.564 K(o=-1.7,f=-4.4) USER MOD Set 1.3: B 882 ASN : amide:sc= 0.785 K(o=-1.7,f=-4.4!) USER MOD Set 2.1: B 870 GLN :FLIP amide:sc= -2 F(o=-2.2!,f=-0.86) USER MOD Set 2.2: B 874 THR OG1 : rot 70:sc= 1.14 USER MOD Set 3.1: A 248 THR OG1 : rot 51:sc= 0.891 USER MOD Set 3.2: A 251 GLN : amide:sc= 0.0225 X(o=0.91,f=0.47) USER MOD Set 4.1: A 240 THR OG1 : rot 103:sc= 2.3 USER MOD Set 4.2: A 250 SER OG : rot 153:sc= 0.153 USER MOD Single : A 233 SER OG : rot 1:sc= -0.0926 USER MOD Single : A 236 THR OG1 : rot 95:sc= 1.2 USER MOD Single : A 238 CYS SG : rot -73:sc= 0.613 USER MOD Single : A 241 THR OG1 : rot -99:sc= 1.27 USER MOD Single : A 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : A 246 ASN : amide:sc= -0.625 K(o=-0.62,f=-3.1!) USER MOD Single : A 247 LYS NZ :NH3+ 170:sc=-0.00237 (180deg=-0.114) USER MOD Single : A 252 THR OG1 : rot 65:sc= 1.26 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 THR OG1 : rot -90:sc= 0.469 USER MOD Single : A 259 SER OG : rot 65:sc= 1.23 USER MOD Single : A 262 GLN :FLIP amide:sc= -0.0901 F(o=-1.3,f=-0.09) USER MOD Single : A 267 SER OG : rot 180:sc= 0 USER MOD Single : A 274 CYS SG : rot 107:sc= -2! USER MOD Single : A 280 GLN :FLIP amide:sc= -0.43 F(o=-1.2,f=-0.43) USER MOD Single : A 281 LYS NZ :NH3+ -148:sc= 1.81 (180deg=1.02) USER MOD Single : A 290 HIS : no HD1:sc=-0.00203 X(o=-0.002,f=-0.064) USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 833 TYR OH : rot 180:sc= 0 USER MOD Single : B 834 ASN : amide:sc= -1.7! C(o=-1.7!,f=-1.8!) USER MOD Single : B 838 GLN : amide:sc= -1.65 K(o=-1.7,f=-3.5!) USER MOD Single : B 843 LYS NZ :NH3+ -165:sc= 1.31 (180deg=1.23) USER MOD Single : B 844 MET CE :methyl -116:sc= -2.13! (180deg=-3.02) USER MOD Single : B 850 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 852 CYS SG : rot 53:sc= -2.32! USER MOD Single : B 854 SER OG : rot 80:sc= 0.465 USER MOD Single : B 856 MET CE :methyl 164:sc= -0.101 (180deg=-0.447) USER MOD Single : B 857 HIS : no HE2:sc= -0.258 K(o=-0.26,f=-3.1!) USER MOD Single : B 858 HIS :FLIP no HE2:sc= 0.323 F(o=-1.1,f=0.32) USER MOD Single : B 860 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 861 ASN : amide:sc= -3.26! C(o=-3.3!,f=-12!) USER MOD Single : B 869 SER OG : rot -135:sc= 1.2 USER MOD Single : B 875 SER OG : rot 76:sc= 1.27 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= 0.204 X(o=0.2,f=0) USER MOD Single : B 887 TYR OH : rot 180:sc= 0 USER MOD Single : B 891 HIS : no HE2:sc= 0.965 K(o=0.97,f=-3!) USER MOD Single : B 892 THR OG1 : rot 180:sc= 0 USER MOD Single : B 893 SER OG : rot 47:sc= 0.367 USER MOD ----------------------------------------------------------------- ATOM 335 N ASP A 230 -12.185 3.133 -5.340 1.00 0.00 N ATOM 336 CA ASP A 230 -10.765 3.439 -5.202 1.00 0.00 C ATOM 337 C ASP A 230 -10.119 2.556 -4.147 1.00 0.00 C ATOM 338 O ASP A 230 -9.015 2.068 -4.340 1.00 0.00 O ATOM 339 CB ASP A 230 -10.502 4.922 -4.926 1.00 0.00 C ATOM 340 CG ASP A 230 -9.015 5.251 -4.855 1.00 0.00 C ATOM 341 OD1 ASP A 230 -8.318 5.166 -5.901 1.00 0.00 O ATOM 342 OD2 ASP A 230 -8.533 5.668 -3.792 1.00 0.00 O ATOM 0 HA ASP A 230 -10.301 3.220 -6.164 1.00 0.00 H new ATOM 0 HB2 ASP A 230 -10.966 5.521 -5.709 1.00 0.00 H new ATOM 0 HB3 ASP A 230 -10.978 5.203 -3.986 1.00 0.00 H new ATOM 347 N LEU A 231 -10.846 2.305 -3.066 1.00 0.00 N ATOM 348 CA LEU A 231 -10.376 1.447 -1.984 1.00 0.00 C ATOM 349 C LEU A 231 -9.928 0.108 -2.494 1.00 0.00 C ATOM 350 O LEU A 231 -8.781 -0.275 -2.295 1.00 0.00 O ATOM 351 CB LEU A 231 -11.437 1.271 -0.861 1.00 0.00 C ATOM 352 CG LEU A 231 -11.662 2.487 0.055 1.00 0.00 C ATOM 353 CD1 LEU A 231 -12.587 2.142 1.200 1.00 0.00 C ATOM 354 CD2 LEU A 231 -10.347 3.046 0.581 1.00 0.00 C ATOM 0 H LEU A 231 -11.778 2.690 -2.914 1.00 0.00 H new ATOM 0 HA LEU A 231 -9.516 1.955 -1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -12.388 1.011 -1.325 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -11.143 0.424 -0.241 1.00 0.00 H new ATOM 0 HG LEU A 231 -12.135 3.261 -0.549 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -12.728 3.020 1.831 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -13.551 1.820 0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -12.150 1.337 1.791 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -10.547 3.903 1.224 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -9.828 2.277 1.153 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -9.723 3.358 -0.257 1.00 0.00 H new ATOM 366 N VAL A 232 -10.798 -0.564 -3.207 1.00 0.00 N ATOM 367 CA VAL A 232 -10.500 -1.876 -3.684 1.00 0.00 C ATOM 368 C VAL A 232 -9.465 -1.865 -4.825 1.00 0.00 C ATOM 369 O VAL A 232 -8.585 -2.712 -4.852 1.00 0.00 O ATOM 370 CB VAL A 232 -11.773 -2.680 -4.062 1.00 0.00 C ATOM 371 CG1 VAL A 232 -12.501 -2.069 -5.260 1.00 0.00 C ATOM 372 CG2 VAL A 232 -11.443 -4.152 -4.303 1.00 0.00 C ATOM 0 H VAL A 232 -11.721 -0.215 -3.467 1.00 0.00 H new ATOM 0 HA VAL A 232 -10.040 -2.402 -2.847 1.00 0.00 H new ATOM 0 HB VAL A 232 -12.454 -2.624 -3.213 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -13.385 -2.663 -5.490 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -12.801 -1.049 -5.022 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -11.836 -2.059 -6.124 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -12.353 -4.691 -4.566 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -10.724 -4.235 -5.118 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -11.016 -4.582 -3.397 1.00 0.00 H new ATOM 382 N SER A 233 -9.519 -0.884 -5.717 1.00 0.00 N ATOM 383 CA SER A 233 -8.583 -0.861 -6.831 1.00 0.00 C ATOM 384 C SER A 233 -7.142 -0.673 -6.342 1.00 0.00 C ATOM 385 O SER A 233 -6.225 -1.379 -6.796 1.00 0.00 O ATOM 386 CB SER A 233 -8.978 0.193 -7.876 1.00 0.00 C ATOM 387 OG SER A 233 -9.160 1.465 -7.285 1.00 0.00 O ATOM 0 H SER A 233 -10.184 -0.111 -5.693 1.00 0.00 H new ATOM 0 HA SER A 233 -8.631 -1.831 -7.325 1.00 0.00 H new ATOM 0 HB2 SER A 233 -8.206 0.254 -8.643 1.00 0.00 H new ATOM 0 HB3 SER A 233 -9.898 -0.113 -8.374 1.00 0.00 H new ATOM 0 HG SER A 233 -8.985 1.407 -6.323 1.00 0.00 H new ATOM 393 N ARG A 234 -6.966 0.218 -5.368 1.00 0.00 N ATOM 394 CA ARG A 234 -5.653 0.501 -4.817 1.00 0.00 C ATOM 395 C ARG A 234 -5.092 -0.697 -4.095 1.00 0.00 C ATOM 396 O ARG A 234 -3.994 -1.143 -4.409 1.00 0.00 O ATOM 397 CB ARG A 234 -5.689 1.700 -3.870 1.00 0.00 C ATOM 398 CG ARG A 234 -6.139 2.992 -4.507 1.00 0.00 C ATOM 399 CD ARG A 234 -5.267 3.342 -5.670 1.00 0.00 C ATOM 400 NE ARG A 234 -5.652 4.590 -6.307 1.00 0.00 N ATOM 401 CZ ARG A 234 -4.867 5.250 -7.159 1.00 0.00 C ATOM 402 NH1 ARG A 234 -3.620 4.833 -7.368 1.00 0.00 N ATOM 403 NH2 ARG A 234 -5.310 6.333 -7.778 1.00 0.00 N ATOM 0 H ARG A 234 -7.723 0.756 -4.946 1.00 0.00 H new ATOM 0 HA ARG A 234 -5.003 0.741 -5.658 1.00 0.00 H new ATOM 0 HB2 ARG A 234 -6.355 1.469 -3.038 1.00 0.00 H new ATOM 0 HB3 ARG A 234 -4.693 1.845 -3.451 1.00 0.00 H new ATOM 0 HG2 ARG A 234 -7.174 2.899 -4.837 1.00 0.00 H new ATOM 0 HG3 ARG A 234 -6.111 3.795 -3.771 1.00 0.00 H new ATOM 0 HD2 ARG A 234 -4.233 3.415 -5.334 1.00 0.00 H new ATOM 0 HD3 ARG A 234 -5.308 2.537 -6.404 1.00 0.00 H new ATOM 0 HE ARG A 234 -6.569 4.981 -6.091 1.00 0.00 H new ATOM 0 HH11 ARG A 234 -3.268 4.011 -6.877 1.00 0.00 H new ATOM 0 HH12 ARG A 234 -3.017 5.335 -8.019 1.00 0.00 H new ATOM 0 HH21 ARG A 234 -6.258 6.668 -7.605 1.00 0.00 H new ATOM 0 HH22 ARG A 234 -4.704 6.833 -8.428 1.00 0.00 H new ATOM 417 N VAL A 235 -5.869 -1.249 -3.164 1.00 0.00 N ATOM 418 CA VAL A 235 -5.416 -2.388 -2.368 1.00 0.00 C ATOM 419 C VAL A 235 -5.057 -3.564 -3.245 1.00 0.00 C ATOM 420 O VAL A 235 -3.980 -4.124 -3.105 1.00 0.00 O ATOM 421 CB VAL A 235 -6.438 -2.795 -1.264 1.00 0.00 C ATOM 422 CG1 VAL A 235 -7.795 -3.076 -1.810 1.00 0.00 C ATOM 423 CG2 VAL A 235 -5.917 -3.921 -0.377 1.00 0.00 C ATOM 0 H VAL A 235 -6.811 -0.927 -2.943 1.00 0.00 H new ATOM 0 HA VAL A 235 -4.513 -2.065 -1.851 1.00 0.00 H new ATOM 0 HB VAL A 235 -6.551 -1.924 -0.619 1.00 0.00 H new ATOM 0 HG11 VAL A 235 -8.464 -3.354 -0.996 1.00 0.00 H new ATOM 0 HG12 VAL A 235 -8.179 -2.185 -2.307 1.00 0.00 H new ATOM 0 HG13 VAL A 235 -7.736 -3.895 -2.527 1.00 0.00 H new ATOM 0 HG21 VAL A 235 -6.666 -4.167 0.376 1.00 0.00 H new ATOM 0 HG22 VAL A 235 -5.713 -4.801 -0.988 1.00 0.00 H new ATOM 0 HG23 VAL A 235 -4.999 -3.601 0.116 1.00 0.00 H new ATOM 433 N THR A 236 -5.928 -3.879 -4.185 1.00 0.00 N ATOM 434 CA THR A 236 -5.688 -4.986 -5.090 1.00 0.00 C ATOM 435 C THR A 236 -4.367 -4.774 -5.854 1.00 0.00 C ATOM 436 O THR A 236 -3.527 -5.663 -5.883 1.00 0.00 O ATOM 437 CB THR A 236 -6.833 -5.201 -6.108 1.00 0.00 C ATOM 438 OG1 THR A 236 -8.105 -5.166 -5.445 1.00 0.00 O ATOM 439 CG2 THR A 236 -6.702 -6.567 -6.734 1.00 0.00 C ATOM 0 H THR A 236 -6.806 -3.385 -4.341 1.00 0.00 H new ATOM 0 HA THR A 236 -5.631 -5.880 -4.469 1.00 0.00 H new ATOM 0 HB THR A 236 -6.770 -4.412 -6.857 1.00 0.00 H new ATOM 0 HG1 THR A 236 -8.477 -4.261 -5.499 1.00 0.00 H new ATOM 0 HG21 THR A 236 -7.509 -6.718 -7.451 1.00 0.00 H new ATOM 0 HG22 THR A 236 -5.743 -6.642 -7.246 1.00 0.00 H new ATOM 0 HG23 THR A 236 -6.759 -7.330 -5.958 1.00 0.00 H new ATOM 447 N GLU A 237 -4.171 -3.571 -6.413 1.00 0.00 N ATOM 448 CA GLU A 237 -2.937 -3.254 -7.136 1.00 0.00 C ATOM 449 C GLU A 237 -1.719 -3.361 -6.250 1.00 0.00 C ATOM 450 O GLU A 237 -0.726 -3.968 -6.639 1.00 0.00 O ATOM 451 CB GLU A 237 -2.976 -1.868 -7.745 1.00 0.00 C ATOM 452 CG GLU A 237 -3.725 -1.766 -9.047 1.00 0.00 C ATOM 453 CD GLU A 237 -3.001 -2.492 -10.153 1.00 0.00 C ATOM 454 OE1 GLU A 237 -2.048 -1.925 -10.738 1.00 0.00 O ATOM 455 OE2 GLU A 237 -3.351 -3.625 -10.461 1.00 0.00 O ATOM 0 H GLU A 237 -4.847 -2.808 -6.377 1.00 0.00 H new ATOM 0 HA GLU A 237 -2.865 -3.993 -7.934 1.00 0.00 H new ATOM 0 HB2 GLU A 237 -3.430 -1.185 -7.027 1.00 0.00 H new ATOM 0 HB3 GLU A 237 -1.953 -1.529 -7.904 1.00 0.00 H new ATOM 0 HG2 GLU A 237 -4.725 -2.184 -8.928 1.00 0.00 H new ATOM 0 HG3 GLU A 237 -3.848 -0.717 -9.317 1.00 0.00 H new ATOM 462 N CYS A 238 -1.811 -2.804 -5.053 1.00 0.00 N ATOM 463 CA CYS A 238 -0.703 -2.791 -4.128 1.00 0.00 C ATOM 464 C CYS A 238 -0.180 -4.180 -3.830 1.00 0.00 C ATOM 465 O CYS A 238 1.010 -4.397 -3.878 1.00 0.00 O ATOM 466 CB CYS A 238 -1.054 -2.044 -2.846 1.00 0.00 C ATOM 467 SG CYS A 238 -1.245 -0.260 -3.060 1.00 0.00 S ATOM 0 H CYS A 238 -2.655 -2.351 -4.702 1.00 0.00 H new ATOM 0 HA CYS A 238 0.105 -2.250 -4.620 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -1.981 -2.452 -2.443 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -0.276 -2.229 -2.106 1.00 0.00 H new ATOM 0 HG CYS A 238 -0.077 0.284 -3.229 1.00 0.00 H new ATOM 473 N LEU A 239 -1.063 -5.132 -3.607 1.00 0.00 N ATOM 474 CA LEU A 239 -0.616 -6.492 -3.280 1.00 0.00 C ATOM 475 C LEU A 239 -0.049 -7.139 -4.561 1.00 0.00 C ATOM 476 O LEU A 239 0.929 -7.877 -4.539 1.00 0.00 O ATOM 477 CB LEU A 239 -1.789 -7.347 -2.728 1.00 0.00 C ATOM 478 CG LEU A 239 -2.905 -6.607 -1.954 1.00 0.00 C ATOM 479 CD1 LEU A 239 -3.971 -7.567 -1.483 1.00 0.00 C ATOM 480 CD2 LEU A 239 -2.369 -5.807 -0.787 1.00 0.00 C ATOM 0 H LEU A 239 -2.075 -5.006 -3.642 1.00 0.00 H new ATOM 0 HA LEU A 239 0.151 -6.444 -2.507 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -2.250 -7.869 -3.567 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -1.370 -8.109 -2.070 1.00 0.00 H new ATOM 0 HG LEU A 239 -3.350 -5.902 -2.656 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -4.742 -7.018 -0.942 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -4.417 -8.066 -2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -3.525 -8.311 -0.823 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -3.194 -5.308 -0.279 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -1.864 -6.475 -0.089 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -1.663 -5.061 -1.151 1.00 0.00 H new ATOM 492 N THR A 240 -0.629 -6.729 -5.663 1.00 0.00 N ATOM 493 CA THR A 240 -0.347 -7.221 -7.019 1.00 0.00 C ATOM 494 C THR A 240 1.032 -6.745 -7.553 1.00 0.00 C ATOM 495 O THR A 240 1.574 -7.299 -8.524 1.00 0.00 O ATOM 496 CB THR A 240 -1.508 -6.747 -7.955 1.00 0.00 C ATOM 497 OG1 THR A 240 -2.724 -7.433 -7.652 1.00 0.00 O ATOM 498 CG2 THR A 240 -1.206 -6.821 -9.436 1.00 0.00 C ATOM 0 H THR A 240 -1.349 -6.007 -5.654 1.00 0.00 H new ATOM 0 HA THR A 240 -0.294 -8.309 -6.997 1.00 0.00 H new ATOM 0 HB THR A 240 -1.623 -5.685 -7.740 1.00 0.00 H new ATOM 0 HG1 THR A 240 -3.314 -6.842 -7.139 1.00 0.00 H new ATOM 0 HG21 THR A 240 -2.070 -6.472 -10.001 1.00 0.00 H new ATOM 0 HG22 THR A 240 -0.345 -6.192 -9.664 1.00 0.00 H new ATOM 0 HG23 THR A 240 -0.985 -7.852 -9.711 1.00 0.00 H new ATOM 506 N THR A 241 1.610 -5.764 -6.904 1.00 0.00 N ATOM 507 CA THR A 241 2.895 -5.217 -7.331 1.00 0.00 C ATOM 508 C THR A 241 4.031 -6.225 -7.164 1.00 0.00 C ATOM 509 O THR A 241 5.131 -6.058 -7.721 1.00 0.00 O ATOM 510 CB THR A 241 3.223 -3.961 -6.552 1.00 0.00 C ATOM 511 OG1 THR A 241 3.301 -4.264 -5.161 1.00 0.00 O ATOM 512 CG2 THR A 241 2.161 -2.931 -6.791 1.00 0.00 C ATOM 0 H THR A 241 1.217 -5.320 -6.074 1.00 0.00 H new ATOM 0 HA THR A 241 2.802 -4.980 -8.391 1.00 0.00 H new ATOM 0 HB THR A 241 4.184 -3.569 -6.885 1.00 0.00 H new ATOM 0 HG1 THR A 241 2.461 -4.012 -4.724 1.00 0.00 H new ATOM 0 HG21 THR A 241 2.398 -2.027 -6.230 1.00 0.00 H new ATOM 0 HG22 THR A 241 2.115 -2.696 -7.854 1.00 0.00 H new ATOM 0 HG23 THR A 241 1.197 -3.320 -6.463 1.00 0.00 H new ATOM 520 N VAL A 242 3.772 -7.252 -6.400 1.00 0.00 N ATOM 521 CA VAL A 242 4.698 -8.315 -6.219 1.00 0.00 C ATOM 522 C VAL A 242 4.577 -9.238 -7.414 1.00 0.00 C ATOM 523 O VAL A 242 3.491 -9.669 -7.743 1.00 0.00 O ATOM 524 CB VAL A 242 4.388 -9.099 -4.932 1.00 0.00 C ATOM 525 CG1 VAL A 242 5.411 -10.184 -4.689 1.00 0.00 C ATOM 526 CG2 VAL A 242 4.318 -8.169 -3.751 1.00 0.00 C ATOM 0 H VAL A 242 2.900 -7.367 -5.884 1.00 0.00 H new ATOM 0 HA VAL A 242 5.708 -7.913 -6.133 1.00 0.00 H new ATOM 0 HB VAL A 242 3.417 -9.577 -5.059 1.00 0.00 H new ATOM 0 HG11 VAL A 242 5.163 -10.719 -3.772 1.00 0.00 H new ATOM 0 HG12 VAL A 242 5.409 -10.880 -5.527 1.00 0.00 H new ATOM 0 HG13 VAL A 242 6.400 -9.736 -4.592 1.00 0.00 H new ATOM 0 HG21 VAL A 242 4.098 -8.741 -2.850 1.00 0.00 H new ATOM 0 HG22 VAL A 242 5.274 -7.659 -3.632 1.00 0.00 H new ATOM 0 HG23 VAL A 242 3.531 -7.432 -3.914 1.00 0.00 H new ATOM 536 N LYS A 243 5.681 -9.524 -8.056 1.00 0.00 N ATOM 537 CA LYS A 243 5.721 -10.367 -9.250 1.00 0.00 C ATOM 538 C LYS A 243 5.055 -11.749 -9.033 1.00 0.00 C ATOM 539 O LYS A 243 4.397 -12.289 -9.933 1.00 0.00 O ATOM 540 CB LYS A 243 7.170 -10.507 -9.724 1.00 0.00 C ATOM 541 CG LYS A 243 7.357 -11.436 -10.897 1.00 0.00 C ATOM 542 CD LYS A 243 8.798 -11.456 -11.385 1.00 0.00 C ATOM 543 CE LYS A 243 9.757 -11.983 -10.328 1.00 0.00 C ATOM 544 NZ LYS A 243 11.134 -12.071 -10.842 1.00 0.00 N ATOM 0 H LYS A 243 6.597 -9.179 -7.769 1.00 0.00 H new ATOM 0 HA LYS A 243 5.133 -9.878 -10.027 1.00 0.00 H new ATOM 0 HB2 LYS A 243 7.548 -9.521 -9.994 1.00 0.00 H new ATOM 0 HB3 LYS A 243 7.778 -10.865 -8.893 1.00 0.00 H new ATOM 0 HG2 LYS A 243 7.057 -12.444 -10.612 1.00 0.00 H new ATOM 0 HG3 LYS A 243 6.703 -11.127 -11.712 1.00 0.00 H new ATOM 0 HD2 LYS A 243 8.868 -12.077 -12.278 1.00 0.00 H new ATOM 0 HD3 LYS A 243 9.096 -10.448 -11.673 1.00 0.00 H new ATOM 0 HE2 LYS A 243 9.734 -11.329 -9.457 1.00 0.00 H new ATOM 0 HE3 LYS A 243 9.428 -12.968 -9.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 11.761 -12.434 -10.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 11.159 -12.715 -11.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 11.456 -11.127 -11.136 1.00 0.00 H new ATOM 558 N SER A 244 5.179 -12.277 -7.847 1.00 0.00 N ATOM 559 CA SER A 244 4.608 -13.566 -7.525 1.00 0.00 C ATOM 560 C SER A 244 3.097 -13.443 -7.191 1.00 0.00 C ATOM 561 O SER A 244 2.376 -14.442 -7.160 1.00 0.00 O ATOM 562 CB SER A 244 5.381 -14.152 -6.349 1.00 0.00 C ATOM 563 OG SER A 244 5.040 -15.505 -6.087 1.00 0.00 O ATOM 0 H SER A 244 5.676 -11.832 -7.075 1.00 0.00 H new ATOM 0 HA SER A 244 4.689 -14.228 -8.387 1.00 0.00 H new ATOM 0 HB2 SER A 244 6.450 -14.084 -6.552 1.00 0.00 H new ATOM 0 HB3 SER A 244 5.187 -13.554 -5.458 1.00 0.00 H new ATOM 0 HG SER A 244 5.564 -15.833 -5.326 1.00 0.00 H new ATOM 569 N VAL A 245 2.625 -12.227 -6.977 1.00 0.00 N ATOM 570 CA VAL A 245 1.236 -11.999 -6.610 1.00 0.00 C ATOM 571 C VAL A 245 0.452 -11.424 -7.795 1.00 0.00 C ATOM 572 O VAL A 245 0.836 -10.419 -8.383 1.00 0.00 O ATOM 573 CB VAL A 245 1.122 -11.041 -5.393 1.00 0.00 C ATOM 574 CG1 VAL A 245 -0.328 -10.780 -5.020 1.00 0.00 C ATOM 575 CG2 VAL A 245 1.861 -11.611 -4.206 1.00 0.00 C ATOM 0 H VAL A 245 3.185 -11.378 -7.051 1.00 0.00 H new ATOM 0 HA VAL A 245 0.809 -12.962 -6.331 1.00 0.00 H new ATOM 0 HB VAL A 245 1.574 -10.091 -5.679 1.00 0.00 H new ATOM 0 HG11 VAL A 245 -0.368 -10.106 -4.165 1.00 0.00 H new ATOM 0 HG12 VAL A 245 -0.845 -10.325 -5.865 1.00 0.00 H new ATOM 0 HG13 VAL A 245 -0.813 -11.722 -4.763 1.00 0.00 H new ATOM 0 HG21 VAL A 245 1.772 -10.929 -3.360 1.00 0.00 H new ATOM 0 HG22 VAL A 245 1.432 -12.577 -3.940 1.00 0.00 H new ATOM 0 HG23 VAL A 245 2.913 -11.739 -4.460 1.00 0.00 H new ATOM 585 N ASN A 246 -0.608 -12.077 -8.161 1.00 0.00 N ATOM 586 CA ASN A 246 -1.446 -11.625 -9.257 1.00 0.00 C ATOM 587 C ASN A 246 -2.724 -11.029 -8.670 1.00 0.00 C ATOM 588 O ASN A 246 -2.924 -11.071 -7.459 1.00 0.00 O ATOM 589 CB ASN A 246 -1.777 -12.817 -10.167 1.00 0.00 C ATOM 590 CG ASN A 246 -2.472 -12.438 -11.465 1.00 0.00 C ATOM 591 OD1 ASN A 246 -2.294 -11.340 -11.985 1.00 0.00 O ATOM 592 ND2 ASN A 246 -3.256 -13.328 -11.990 1.00 0.00 N ATOM 0 H ASN A 246 -0.926 -12.938 -7.717 1.00 0.00 H new ATOM 0 HA ASN A 246 -0.931 -10.869 -9.850 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -0.854 -13.346 -10.404 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -2.412 -13.513 -9.618 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -3.747 -13.125 -12.861 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -3.382 -14.231 -11.532 1.00 0.00 H new ATOM 599 N LYS A 247 -3.603 -10.517 -9.514 1.00 0.00 N ATOM 600 CA LYS A 247 -4.846 -9.897 -9.068 1.00 0.00 C ATOM 601 C LYS A 247 -5.746 -10.894 -8.317 1.00 0.00 C ATOM 602 O LYS A 247 -6.499 -10.514 -7.412 1.00 0.00 O ATOM 603 CB LYS A 247 -5.597 -9.249 -10.253 1.00 0.00 C ATOM 604 CG LYS A 247 -6.840 -8.448 -9.847 1.00 0.00 C ATOM 605 CD LYS A 247 -7.506 -7.733 -11.034 1.00 0.00 C ATOM 606 CE LYS A 247 -8.189 -8.687 -12.010 1.00 0.00 C ATOM 607 NZ LYS A 247 -9.335 -9.393 -11.397 1.00 0.00 N ATOM 0 H LYS A 247 -3.479 -10.518 -10.526 1.00 0.00 H new ATOM 0 HA LYS A 247 -4.582 -9.109 -8.363 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -4.912 -8.590 -10.786 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -5.895 -10.031 -10.951 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -7.562 -9.119 -9.382 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -6.561 -7.710 -9.095 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -8.242 -7.024 -10.655 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -6.753 -7.155 -11.569 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -8.533 -8.128 -12.880 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -7.464 -9.418 -12.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -9.868 -9.896 -12.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -8.986 -10.076 -10.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -9.958 -8.704 -10.930 1.00 0.00 H new ATOM 621 N THR A 248 -5.595 -12.168 -8.618 1.00 0.00 N ATOM 622 CA THR A 248 -6.440 -13.163 -8.017 1.00 0.00 C ATOM 623 C THR A 248 -5.857 -13.543 -6.650 1.00 0.00 C ATOM 624 O THR A 248 -6.567 -13.923 -5.705 1.00 0.00 O ATOM 625 CB THR A 248 -6.642 -14.401 -8.947 1.00 0.00 C ATOM 626 OG1 THR A 248 -7.600 -15.303 -8.383 1.00 0.00 O ATOM 627 CG2 THR A 248 -5.333 -15.133 -9.213 1.00 0.00 C ATOM 0 H THR A 248 -4.899 -12.530 -9.270 1.00 0.00 H new ATOM 0 HA THR A 248 -7.438 -12.749 -7.871 1.00 0.00 H new ATOM 0 HB THR A 248 -7.016 -14.029 -9.901 1.00 0.00 H new ATOM 0 HG1 THR A 248 -8.408 -14.808 -8.134 1.00 0.00 H new ATOM 0 HG21 THR A 248 -5.520 -15.987 -9.864 1.00 0.00 H new ATOM 0 HG22 THR A 248 -4.629 -14.455 -9.696 1.00 0.00 H new ATOM 0 HG23 THR A 248 -4.912 -15.481 -8.270 1.00 0.00 H new ATOM 635 N ASP A 249 -4.572 -13.356 -6.533 1.00 0.00 N ATOM 636 CA ASP A 249 -3.887 -13.562 -5.297 1.00 0.00 C ATOM 637 C ASP A 249 -4.306 -12.463 -4.362 1.00 0.00 C ATOM 638 O ASP A 249 -4.738 -12.709 -3.240 1.00 0.00 O ATOM 639 CB ASP A 249 -2.378 -13.507 -5.497 1.00 0.00 C ATOM 640 CG ASP A 249 -1.804 -14.657 -6.257 1.00 0.00 C ATOM 641 OD1 ASP A 249 -1.710 -14.567 -7.495 1.00 0.00 O ATOM 642 OD2 ASP A 249 -1.404 -15.648 -5.648 1.00 0.00 O ATOM 0 H ASP A 249 -3.971 -13.055 -7.300 1.00 0.00 H new ATOM 0 HA ASP A 249 -4.137 -14.543 -4.894 1.00 0.00 H new ATOM 0 HB2 ASP A 249 -2.128 -12.584 -6.020 1.00 0.00 H new ATOM 0 HB3 ASP A 249 -1.898 -13.460 -4.520 1.00 0.00 H new ATOM 647 N SER A 250 -4.246 -11.253 -4.869 1.00 0.00 N ATOM 648 CA SER A 250 -4.625 -10.073 -4.148 1.00 0.00 C ATOM 649 C SER A 250 -6.080 -10.118 -3.673 1.00 0.00 C ATOM 650 O SER A 250 -6.363 -9.760 -2.534 1.00 0.00 O ATOM 651 CB SER A 250 -4.366 -8.868 -5.017 1.00 0.00 C ATOM 652 OG SER A 250 -3.014 -8.860 -5.406 1.00 0.00 O ATOM 0 H SER A 250 -3.924 -11.064 -5.818 1.00 0.00 H new ATOM 0 HA SER A 250 -4.020 -10.010 -3.243 1.00 0.00 H new ATOM 0 HB2 SER A 250 -5.010 -8.894 -5.896 1.00 0.00 H new ATOM 0 HB3 SER A 250 -4.606 -7.954 -4.473 1.00 0.00 H new ATOM 0 HG SER A 250 -2.923 -8.392 -6.262 1.00 0.00 H new ATOM 658 N GLN A 251 -7.003 -10.601 -4.517 1.00 0.00 N ATOM 659 CA GLN A 251 -8.404 -10.684 -4.099 1.00 0.00 C ATOM 660 C GLN A 251 -8.556 -11.698 -2.950 1.00 0.00 C ATOM 661 O GLN A 251 -9.426 -11.555 -2.092 1.00 0.00 O ATOM 662 CB GLN A 251 -9.349 -11.049 -5.256 1.00 0.00 C ATOM 663 CG GLN A 251 -9.183 -12.464 -5.775 1.00 0.00 C ATOM 664 CD GLN A 251 -10.161 -12.847 -6.864 1.00 0.00 C ATOM 665 OE1 GLN A 251 -9.830 -13.634 -7.757 1.00 0.00 O ATOM 666 NE2 GLN A 251 -11.380 -12.384 -6.763 1.00 0.00 N ATOM 0 H GLN A 251 -6.812 -10.930 -5.463 1.00 0.00 H new ATOM 0 HA GLN A 251 -8.692 -9.691 -3.754 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -10.379 -10.915 -4.925 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -9.185 -10.352 -6.077 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -8.169 -12.582 -6.156 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -9.294 -13.159 -4.943 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -11.619 -11.735 -6.013 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -12.092 -12.672 -7.434 1.00 0.00 H new ATOM 675 N THR A 252 -7.687 -12.708 -2.938 1.00 0.00 N ATOM 676 CA THR A 252 -7.680 -13.687 -1.871 1.00 0.00 C ATOM 677 C THR A 252 -7.239 -13.015 -0.539 1.00 0.00 C ATOM 678 O THR A 252 -7.849 -13.222 0.514 1.00 0.00 O ATOM 679 CB THR A 252 -6.756 -14.883 -2.219 1.00 0.00 C ATOM 680 OG1 THR A 252 -7.116 -15.409 -3.519 1.00 0.00 O ATOM 681 CG2 THR A 252 -6.906 -15.992 -1.187 1.00 0.00 C ATOM 0 H THR A 252 -6.982 -12.863 -3.659 1.00 0.00 H new ATOM 0 HA THR A 252 -8.691 -14.076 -1.750 1.00 0.00 H new ATOM 0 HB THR A 252 -5.724 -14.532 -2.224 1.00 0.00 H new ATOM 0 HG1 THR A 252 -6.934 -14.735 -4.207 1.00 0.00 H new ATOM 0 HG21 THR A 252 -6.250 -16.823 -1.448 1.00 0.00 H new ATOM 0 HG22 THR A 252 -6.636 -15.611 -0.202 1.00 0.00 H new ATOM 0 HG23 THR A 252 -7.940 -16.337 -1.171 1.00 0.00 H new ATOM 689 N LEU A 253 -6.218 -12.163 -0.604 1.00 0.00 N ATOM 690 CA LEU A 253 -5.779 -11.418 0.579 1.00 0.00 C ATOM 691 C LEU A 253 -6.832 -10.395 0.991 1.00 0.00 C ATOM 692 O LEU A 253 -7.006 -10.075 2.172 1.00 0.00 O ATOM 693 CB LEU A 253 -4.429 -10.725 0.365 1.00 0.00 C ATOM 694 CG LEU A 253 -3.167 -11.588 0.487 1.00 0.00 C ATOM 695 CD1 LEU A 253 -3.073 -12.622 -0.597 1.00 0.00 C ATOM 696 CD2 LEU A 253 -1.938 -10.729 0.492 1.00 0.00 C ATOM 0 H LEU A 253 -5.683 -11.971 -1.451 1.00 0.00 H new ATOM 0 HA LEU A 253 -5.650 -12.146 1.380 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -4.435 -10.275 -0.628 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -4.351 -9.910 1.084 1.00 0.00 H new ATOM 0 HG LEU A 253 -3.238 -12.119 1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -2.162 -13.206 -0.465 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -3.938 -13.283 -0.545 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -3.050 -12.129 -1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -1.053 -11.360 0.579 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -1.888 -10.160 -0.436 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -1.978 -10.042 1.337 1.00 0.00 H new ATOM 708 N LEU A 254 -7.553 -9.927 0.021 1.00 0.00 N ATOM 709 CA LEU A 254 -8.601 -8.974 0.228 1.00 0.00 C ATOM 710 C LEU A 254 -9.820 -9.568 0.904 1.00 0.00 C ATOM 711 O LEU A 254 -10.491 -8.895 1.656 1.00 0.00 O ATOM 712 CB LEU A 254 -8.968 -8.325 -1.073 1.00 0.00 C ATOM 713 CG LEU A 254 -8.227 -7.050 -1.370 1.00 0.00 C ATOM 714 CD1 LEU A 254 -8.389 -6.676 -2.792 1.00 0.00 C ATOM 715 CD2 LEU A 254 -8.815 -5.981 -0.535 1.00 0.00 C ATOM 0 H LEU A 254 -7.429 -10.200 -0.954 1.00 0.00 H new ATOM 0 HA LEU A 254 -8.217 -8.218 0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -8.784 -9.033 -1.881 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -10.038 -8.115 -1.070 1.00 0.00 H new ATOM 0 HG LEU A 254 -7.166 -7.186 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -7.846 -5.751 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -7.994 -7.471 -3.425 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -9.447 -6.530 -3.012 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -8.297 -5.042 -0.729 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -9.872 -5.869 -0.778 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -8.710 -6.243 0.518 1.00 0.00 H new ATOM 727 N THR A 255 -10.104 -10.819 0.642 1.00 0.00 N ATOM 728 CA THR A 255 -11.224 -11.442 1.289 1.00 0.00 C ATOM 729 C THR A 255 -10.835 -11.903 2.710 1.00 0.00 C ATOM 730 O THR A 255 -11.684 -12.025 3.585 1.00 0.00 O ATOM 731 CB THR A 255 -11.851 -12.600 0.432 1.00 0.00 C ATOM 732 OG1 THR A 255 -13.036 -13.114 1.054 1.00 0.00 O ATOM 733 CG2 THR A 255 -10.875 -13.738 0.219 1.00 0.00 C ATOM 0 H THR A 255 -9.584 -11.415 -0.003 1.00 0.00 H new ATOM 0 HA THR A 255 -12.011 -10.694 1.383 1.00 0.00 H new ATOM 0 HB THR A 255 -12.102 -12.169 -0.537 1.00 0.00 H new ATOM 0 HG1 THR A 255 -13.410 -13.833 0.502 1.00 0.00 H new ATOM 0 HG21 THR A 255 -11.349 -14.517 -0.378 1.00 0.00 H new ATOM 0 HG22 THR A 255 -9.992 -13.368 -0.302 1.00 0.00 H new ATOM 0 HG23 THR A 255 -10.580 -14.150 1.184 1.00 0.00 H new ATOM 741 N THR A 256 -9.545 -12.122 2.946 1.00 0.00 N ATOM 742 CA THR A 256 -9.119 -12.521 4.265 1.00 0.00 C ATOM 743 C THR A 256 -8.892 -11.308 5.206 1.00 0.00 C ATOM 744 O THR A 256 -9.424 -11.287 6.319 1.00 0.00 O ATOM 745 CB THR A 256 -7.899 -13.511 4.247 1.00 0.00 C ATOM 746 OG1 THR A 256 -7.575 -13.943 5.562 1.00 0.00 O ATOM 747 CG2 THR A 256 -6.691 -12.889 3.619 1.00 0.00 C ATOM 0 H THR A 256 -8.800 -12.031 2.255 1.00 0.00 H new ATOM 0 HA THR A 256 -9.949 -13.087 4.688 1.00 0.00 H new ATOM 0 HB THR A 256 -8.199 -14.371 3.648 1.00 0.00 H new ATOM 0 HG1 THR A 256 -6.921 -13.329 5.956 1.00 0.00 H new ATOM 0 HG21 THR A 256 -5.869 -13.604 3.625 1.00 0.00 H new ATOM 0 HG22 THR A 256 -6.919 -12.608 2.591 1.00 0.00 H new ATOM 0 HG23 THR A 256 -6.404 -12.001 4.183 1.00 0.00 H new ATOM 755 N PHE A 257 -8.150 -10.287 4.764 1.00 0.00 N ATOM 756 CA PHE A 257 -7.850 -9.166 5.671 1.00 0.00 C ATOM 757 C PHE A 257 -8.510 -7.859 5.229 1.00 0.00 C ATOM 758 O PHE A 257 -8.759 -6.982 6.049 1.00 0.00 O ATOM 759 CB PHE A 257 -6.332 -8.964 5.768 1.00 0.00 C ATOM 760 CG PHE A 257 -5.574 -10.228 6.059 1.00 0.00 C ATOM 761 CD1 PHE A 257 -5.968 -11.068 7.086 1.00 0.00 C ATOM 762 CD2 PHE A 257 -4.485 -10.588 5.286 1.00 0.00 C ATOM 763 CE1 PHE A 257 -5.296 -12.239 7.335 1.00 0.00 C ATOM 764 CE2 PHE A 257 -3.804 -11.759 5.536 1.00 0.00 C ATOM 765 CZ PHE A 257 -4.213 -12.588 6.562 1.00 0.00 C ATOM 0 H PHE A 257 -7.759 -10.209 3.825 1.00 0.00 H new ATOM 0 HA PHE A 257 -8.260 -9.427 6.646 1.00 0.00 H new ATOM 0 HB2 PHE A 257 -5.970 -8.541 4.831 1.00 0.00 H new ATOM 0 HB3 PHE A 257 -6.120 -8.235 6.550 1.00 0.00 H new ATOM 0 HD1 PHE A 257 -6.815 -10.799 7.699 1.00 0.00 H new ATOM 0 HD2 PHE A 257 -4.166 -9.945 4.479 1.00 0.00 H new ATOM 0 HE1 PHE A 257 -5.618 -12.886 8.138 1.00 0.00 H new ATOM 0 HE2 PHE A 257 -2.951 -12.028 4.930 1.00 0.00 H new ATOM 0 HZ PHE A 257 -3.683 -13.509 6.757 1.00 0.00 H new ATOM 775 N GLY A 258 -8.779 -7.746 3.932 1.00 0.00 N ATOM 776 CA GLY A 258 -9.464 -6.581 3.331 1.00 0.00 C ATOM 777 C GLY A 258 -8.826 -5.200 3.573 1.00 0.00 C ATOM 778 O GLY A 258 -9.407 -4.180 3.198 1.00 0.00 O ATOM 0 H GLY A 258 -8.529 -8.463 3.251 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -9.528 -6.742 2.255 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -10.486 -6.555 3.710 1.00 0.00 H new ATOM 782 N SER A 259 -7.636 -5.160 4.117 1.00 0.00 N ATOM 783 CA SER A 259 -7.026 -3.912 4.491 1.00 0.00 C ATOM 784 C SER A 259 -5.525 -3.983 4.278 1.00 0.00 C ATOM 785 O SER A 259 -4.934 -5.070 4.344 1.00 0.00 O ATOM 786 CB SER A 259 -7.355 -3.620 5.973 1.00 0.00 C ATOM 787 OG SER A 259 -6.792 -2.389 6.420 1.00 0.00 O ATOM 0 H SER A 259 -7.068 -5.985 4.311 1.00 0.00 H new ATOM 0 HA SER A 259 -7.417 -3.106 3.871 1.00 0.00 H new ATOM 0 HB2 SER A 259 -8.437 -3.591 6.104 1.00 0.00 H new ATOM 0 HB3 SER A 259 -6.981 -4.434 6.593 1.00 0.00 H new ATOM 0 HG SER A 259 -7.208 -1.645 5.937 1.00 0.00 H new ATOM 793 N LEU A 260 -4.909 -2.833 4.032 1.00 0.00 N ATOM 794 CA LEU A 260 -3.480 -2.765 3.842 1.00 0.00 C ATOM 795 C LEU A 260 -2.745 -2.902 5.165 1.00 0.00 C ATOM 796 O LEU A 260 -1.780 -3.647 5.249 1.00 0.00 O ATOM 797 CB LEU A 260 -3.065 -1.485 3.126 1.00 0.00 C ATOM 798 CG LEU A 260 -1.550 -1.239 3.026 1.00 0.00 C ATOM 799 CD1 LEU A 260 -0.838 -2.389 2.336 1.00 0.00 C ATOM 800 CD2 LEU A 260 -1.276 0.047 2.310 1.00 0.00 C ATOM 0 H LEU A 260 -5.387 -1.935 3.961 1.00 0.00 H new ATOM 0 HA LEU A 260 -3.200 -3.605 3.206 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -3.479 -1.504 2.118 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -3.519 -0.639 3.641 1.00 0.00 H new ATOM 0 HG LEU A 260 -1.160 -1.171 4.042 1.00 0.00 H new ATOM 0 HD11 LEU A 260 0.230 -2.177 2.285 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -0.999 -3.308 2.900 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -1.233 -2.509 1.327 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -0.200 0.206 2.248 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -1.695 0.000 1.305 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -1.734 0.872 2.856 1.00 0.00 H new ATOM 812 N GLU A 261 -3.205 -2.187 6.191 1.00 0.00 N ATOM 813 CA GLU A 261 -2.624 -2.267 7.522 1.00 0.00 C ATOM 814 C GLU A 261 -2.564 -3.709 7.987 1.00 0.00 C ATOM 815 O GLU A 261 -1.537 -4.185 8.440 1.00 0.00 O ATOM 816 CB GLU A 261 -3.440 -1.421 8.503 1.00 0.00 C ATOM 817 CG GLU A 261 -3.289 -1.846 9.940 1.00 0.00 C ATOM 818 CD GLU A 261 -4.170 -1.093 10.893 1.00 0.00 C ATOM 819 OE1 GLU A 261 -5.426 -1.198 10.777 1.00 0.00 O ATOM 820 OE2 GLU A 261 -3.644 -0.407 11.781 1.00 0.00 O ATOM 0 H GLU A 261 -3.989 -1.539 6.119 1.00 0.00 H new ATOM 0 HA GLU A 261 -1.607 -1.876 7.485 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -3.138 -0.378 8.408 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -4.493 -1.474 8.226 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -3.511 -2.910 10.019 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -2.249 -1.714 10.240 1.00 0.00 H new ATOM 827 N GLN A 262 -3.661 -4.393 7.814 1.00 0.00 N ATOM 828 CA GLN A 262 -3.775 -5.785 8.194 1.00 0.00 C ATOM 829 C GLN A 262 -2.813 -6.675 7.395 1.00 0.00 C ATOM 830 O GLN A 262 -2.386 -7.706 7.885 1.00 0.00 O ATOM 831 CB GLN A 262 -5.212 -6.265 8.025 1.00 0.00 C ATOM 832 CG GLN A 262 -6.231 -5.537 8.898 1.00 0.00 C ATOM 833 CD GLN A 262 -5.927 -5.659 10.378 1.00 0.00 C ATOM 834 OE1 GLN A 262 -5.255 -4.687 10.933 1.00 0.00 O flip ATOM 835 NE2 GLN A 262 -6.345 -6.607 11.025 1.00 0.00 N flip ATOM 0 H GLN A 262 -4.510 -4.003 7.403 1.00 0.00 H new ATOM 0 HA GLN A 262 -3.496 -5.864 9.245 1.00 0.00 H new ATOM 0 HB2 GLN A 262 -5.500 -6.149 6.980 1.00 0.00 H new ATOM 0 HB3 GLN A 262 -5.254 -7.330 8.251 1.00 0.00 H new ATOM 0 HG2 GLN A 262 -6.253 -4.483 8.622 1.00 0.00 H new ATOM 0 HG3 GLN A 262 -7.225 -5.939 8.701 1.00 0.00 H new ATOM 0 HE21 GLN A 262 -6.867 -7.351 10.561 1.00 0.00 H new ATOM 0 HE22 GLN A 262 -6.172 -6.655 12.029 1.00 0.00 H new ATOM 844 N LEU A 263 -2.460 -6.244 6.191 1.00 0.00 N ATOM 845 CA LEU A 263 -1.564 -7.006 5.329 1.00 0.00 C ATOM 846 C LEU A 263 -0.128 -6.812 5.786 1.00 0.00 C ATOM 847 O LEU A 263 0.615 -7.760 5.947 1.00 0.00 O ATOM 848 CB LEU A 263 -1.652 -6.515 3.890 1.00 0.00 C ATOM 849 CG LEU A 263 -1.595 -7.580 2.819 1.00 0.00 C ATOM 850 CD1 LEU A 263 -2.962 -7.742 2.189 1.00 0.00 C ATOM 851 CD2 LEU A 263 -0.520 -7.265 1.794 1.00 0.00 C ATOM 0 H LEU A 263 -2.783 -5.365 5.787 1.00 0.00 H new ATOM 0 HA LEU A 263 -1.858 -8.054 5.386 1.00 0.00 H new ATOM 0 HB2 LEU A 263 -2.583 -5.961 3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 263 -0.838 -5.811 3.717 1.00 0.00 H new ATOM 0 HG LEU A 263 -1.320 -8.533 3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 263 -2.918 -8.510 1.417 1.00 0.00 H new ATOM 0 HD12 LEU A 263 -3.682 -8.036 2.953 1.00 0.00 H new ATOM 0 HD13 LEU A 263 -3.271 -6.797 1.743 1.00 0.00 H new ATOM 0 HD21 LEU A 263 -0.501 -8.047 1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 263 -0.737 -6.307 1.322 1.00 0.00 H new ATOM 0 HD23 LEU A 263 0.450 -7.215 2.288 1.00 0.00 H new ATOM 863 N ILE A 264 0.246 -5.562 6.000 1.00 0.00 N ATOM 864 CA ILE A 264 1.601 -5.225 6.393 1.00 0.00 C ATOM 865 C ILE A 264 1.883 -5.667 7.837 1.00 0.00 C ATOM 866 O ILE A 264 3.003 -6.036 8.179 1.00 0.00 O ATOM 867 CB ILE A 264 1.937 -3.696 6.084 1.00 0.00 C ATOM 868 CG1 ILE A 264 3.376 -3.250 6.485 1.00 0.00 C ATOM 869 CG2 ILE A 264 0.898 -2.746 6.650 1.00 0.00 C ATOM 870 CD1 ILE A 264 3.599 -2.955 7.967 1.00 0.00 C ATOM 0 H ILE A 264 -0.376 -4.759 5.907 1.00 0.00 H new ATOM 0 HA ILE A 264 2.300 -5.792 5.778 1.00 0.00 H new ATOM 0 HB ILE A 264 1.900 -3.635 4.996 1.00 0.00 H new ATOM 0 HG12 ILE A 264 4.074 -4.030 6.182 1.00 0.00 H new ATOM 0 HG13 ILE A 264 3.630 -2.356 5.915 1.00 0.00 H new ATOM 0 HG21 ILE A 264 1.175 -1.719 6.411 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -0.076 -2.970 6.214 1.00 0.00 H new ATOM 0 HG23 ILE A 264 0.847 -2.866 7.732 1.00 0.00 H new ATOM 0 HD11 ILE A 264 4.635 -2.655 8.126 1.00 0.00 H new ATOM 0 HD12 ILE A 264 2.935 -2.150 8.282 1.00 0.00 H new ATOM 0 HD13 ILE A 264 3.387 -3.850 8.552 1.00 0.00 H new ATOM 882 N ALA A 265 0.852 -5.686 8.663 1.00 0.00 N ATOM 883 CA ALA A 265 0.987 -6.144 10.042 1.00 0.00 C ATOM 884 C ALA A 265 0.903 -7.671 10.117 1.00 0.00 C ATOM 885 O ALA A 265 0.984 -8.263 11.198 1.00 0.00 O ATOM 886 CB ALA A 265 -0.080 -5.508 10.924 1.00 0.00 C ATOM 0 H ALA A 265 -0.090 -5.390 8.407 1.00 0.00 H new ATOM 0 HA ALA A 265 1.967 -5.837 10.408 1.00 0.00 H new ATOM 0 HB1 ALA A 265 0.037 -5.861 11.948 1.00 0.00 H new ATOM 0 HB2 ALA A 265 0.027 -4.424 10.900 1.00 0.00 H new ATOM 0 HB3 ALA A 265 -1.068 -5.783 10.556 1.00 0.00 H new ATOM 892 N ALA A 266 0.748 -8.300 8.976 1.00 0.00 N ATOM 893 CA ALA A 266 0.659 -9.729 8.894 1.00 0.00 C ATOM 894 C ALA A 266 2.030 -10.312 8.599 1.00 0.00 C ATOM 895 O ALA A 266 2.829 -9.707 7.893 1.00 0.00 O ATOM 896 CB ALA A 266 -0.335 -10.119 7.813 1.00 0.00 C ATOM 0 H ALA A 266 0.680 -7.826 8.075 1.00 0.00 H new ATOM 0 HA ALA A 266 0.310 -10.128 9.846 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -0.400 -11.205 7.753 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -1.316 -9.709 8.056 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -0.003 -9.722 6.853 1.00 0.00 H new ATOM 902 N SER A 267 2.312 -11.455 9.158 1.00 0.00 N ATOM 903 CA SER A 267 3.564 -12.105 8.934 1.00 0.00 C ATOM 904 C SER A 267 3.434 -13.056 7.735 1.00 0.00 C ATOM 905 O SER A 267 2.335 -13.245 7.204 1.00 0.00 O ATOM 906 CB SER A 267 3.943 -12.879 10.193 1.00 0.00 C ATOM 907 OG SER A 267 3.965 -12.030 11.339 1.00 0.00 O ATOM 0 H SER A 267 1.679 -11.958 9.780 1.00 0.00 H new ATOM 0 HA SER A 267 4.341 -11.373 8.714 1.00 0.00 H new ATOM 0 HB2 SER A 267 3.231 -13.689 10.352 1.00 0.00 H new ATOM 0 HB3 SER A 267 4.923 -13.337 10.059 1.00 0.00 H new ATOM 0 HG SER A 267 4.209 -12.554 12.130 1.00 0.00 H new ATOM 913 N ARG A 268 4.542 -13.673 7.331 1.00 0.00 N ATOM 914 CA ARG A 268 4.569 -14.658 6.228 1.00 0.00 C ATOM 915 C ARG A 268 3.627 -15.836 6.506 1.00 0.00 C ATOM 916 O ARG A 268 3.136 -16.483 5.592 1.00 0.00 O ATOM 917 CB ARG A 268 6.023 -15.118 5.994 1.00 0.00 C ATOM 918 CG ARG A 268 6.849 -14.042 5.311 1.00 0.00 C ATOM 919 CD ARG A 268 8.358 -14.128 5.562 1.00 0.00 C ATOM 920 NE ARG A 268 9.000 -15.374 5.145 1.00 0.00 N ATOM 921 CZ ARG A 268 10.253 -15.448 4.633 1.00 0.00 C ATOM 922 NH1 ARG A 268 10.938 -14.341 4.348 1.00 0.00 N ATOM 923 NH2 ARG A 268 10.820 -16.625 4.423 1.00 0.00 N ATOM 0 H ARG A 268 5.455 -13.510 7.755 1.00 0.00 H new ATOM 0 HA ARG A 268 4.204 -14.187 5.315 1.00 0.00 H new ATOM 0 HB2 ARG A 268 6.481 -15.377 6.949 1.00 0.00 H new ATOM 0 HB3 ARG A 268 6.025 -16.021 5.384 1.00 0.00 H new ATOM 0 HG2 ARG A 268 6.671 -14.095 4.237 1.00 0.00 H new ATOM 0 HG3 ARG A 268 6.495 -13.067 5.645 1.00 0.00 H new ATOM 0 HD2 ARG A 268 8.842 -13.300 5.043 1.00 0.00 H new ATOM 0 HD3 ARG A 268 8.539 -13.986 6.627 1.00 0.00 H new ATOM 0 HE ARG A 268 8.472 -16.241 5.246 1.00 0.00 H new ATOM 0 HH11 ARG A 268 10.520 -13.426 4.515 1.00 0.00 H new ATOM 0 HH12 ARG A 268 11.880 -14.409 3.963 1.00 0.00 H new ATOM 0 HH21 ARG A 268 10.314 -17.482 4.647 1.00 0.00 H new ATOM 0 HH22 ARG A 268 11.763 -16.675 4.038 1.00 0.00 H new ATOM 937 N GLU A 269 3.357 -16.059 7.769 1.00 0.00 N ATOM 938 CA GLU A 269 2.438 -17.091 8.216 1.00 0.00 C ATOM 939 C GLU A 269 1.017 -16.666 7.905 1.00 0.00 C ATOM 940 O GLU A 269 0.262 -17.406 7.301 1.00 0.00 O ATOM 941 CB GLU A 269 2.583 -17.257 9.708 1.00 0.00 C ATOM 942 CG GLU A 269 4.005 -17.459 10.151 1.00 0.00 C ATOM 943 CD GLU A 269 4.135 -17.447 11.637 1.00 0.00 C ATOM 944 OE1 GLU A 269 3.981 -18.506 12.265 1.00 0.00 O ATOM 945 OE2 GLU A 269 4.390 -16.360 12.204 1.00 0.00 O ATOM 0 H GLU A 269 3.773 -15.524 8.531 1.00 0.00 H new ATOM 0 HA GLU A 269 2.660 -18.030 7.709 1.00 0.00 H new ATOM 0 HB2 GLU A 269 2.177 -16.376 10.205 1.00 0.00 H new ATOM 0 HB3 GLU A 269 1.985 -18.109 10.031 1.00 0.00 H new ATOM 0 HG2 GLU A 269 4.374 -18.408 9.763 1.00 0.00 H new ATOM 0 HG3 GLU A 269 4.632 -16.675 9.726 1.00 0.00 H new ATOM 952 N ASP A 270 0.683 -15.455 8.305 1.00 0.00 N ATOM 953 CA ASP A 270 -0.651 -14.877 8.119 1.00 0.00 C ATOM 954 C ASP A 270 -0.943 -14.706 6.648 1.00 0.00 C ATOM 955 O ASP A 270 -2.037 -14.959 6.185 1.00 0.00 O ATOM 956 CB ASP A 270 -0.729 -13.510 8.770 1.00 0.00 C ATOM 957 CG ASP A 270 -0.414 -13.500 10.228 1.00 0.00 C ATOM 958 OD1 ASP A 270 -1.327 -13.675 11.060 1.00 0.00 O ATOM 959 OD2 ASP A 270 0.750 -13.274 10.581 1.00 0.00 O ATOM 0 H ASP A 270 1.335 -14.828 8.777 1.00 0.00 H new ATOM 0 HA ASP A 270 -1.375 -15.553 8.574 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -0.040 -12.838 8.258 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -1.732 -13.109 8.625 1.00 0.00 H new ATOM 964 N LEU A 271 0.054 -14.291 5.914 1.00 0.00 N ATOM 965 CA LEU A 271 -0.087 -14.095 4.491 1.00 0.00 C ATOM 966 C LEU A 271 -0.261 -15.438 3.758 1.00 0.00 C ATOM 967 O LEU A 271 -0.891 -15.496 2.711 1.00 0.00 O ATOM 968 CB LEU A 271 1.091 -13.291 3.941 1.00 0.00 C ATOM 969 CG LEU A 271 1.259 -11.869 4.495 1.00 0.00 C ATOM 970 CD1 LEU A 271 2.543 -11.245 3.985 1.00 0.00 C ATOM 971 CD2 LEU A 271 0.066 -10.996 4.121 1.00 0.00 C ATOM 0 H LEU A 271 0.982 -14.080 6.280 1.00 0.00 H new ATOM 0 HA LEU A 271 -0.993 -13.517 4.311 1.00 0.00 H new ATOM 0 HB2 LEU A 271 2.007 -13.847 4.140 1.00 0.00 H new ATOM 0 HB3 LEU A 271 0.986 -13.227 2.858 1.00 0.00 H new ATOM 0 HG LEU A 271 1.311 -11.936 5.582 1.00 0.00 H new ATOM 0 HD11 LEU A 271 2.643 -10.238 4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 271 3.393 -11.850 4.302 1.00 0.00 H new ATOM 0 HD13 LEU A 271 2.518 -11.198 2.896 1.00 0.00 H new ATOM 0 HD21 LEU A 271 0.208 -9.993 4.525 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.019 -10.942 3.036 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -0.845 -11.428 4.535 1.00 0.00 H new ATOM 983 N ALA A 272 0.286 -16.514 4.326 1.00 0.00 N ATOM 984 CA ALA A 272 0.101 -17.855 3.760 1.00 0.00 C ATOM 985 C ALA A 272 -1.164 -18.512 4.336 1.00 0.00 C ATOM 986 O ALA A 272 -1.580 -19.592 3.909 1.00 0.00 O ATOM 987 CB ALA A 272 1.321 -18.724 4.035 1.00 0.00 C ATOM 0 H ALA A 272 0.857 -16.486 5.171 1.00 0.00 H new ATOM 0 HA ALA A 272 -0.019 -17.759 2.681 1.00 0.00 H new ATOM 0 HB1 ALA A 272 1.166 -19.715 3.608 1.00 0.00 H new ATOM 0 HB2 ALA A 272 2.202 -18.268 3.583 1.00 0.00 H new ATOM 0 HB3 ALA A 272 1.470 -18.812 5.111 1.00 0.00 H new ATOM 993 N LEU A 273 -1.728 -17.870 5.345 1.00 0.00 N ATOM 994 CA LEU A 273 -2.948 -18.299 6.007 1.00 0.00 C ATOM 995 C LEU A 273 -4.156 -18.054 5.119 1.00 0.00 C ATOM 996 O LEU A 273 -5.197 -18.707 5.276 1.00 0.00 O ATOM 997 CB LEU A 273 -3.103 -17.511 7.279 1.00 0.00 C ATOM 998 CG LEU A 273 -4.380 -17.695 8.034 1.00 0.00 C ATOM 999 CD1 LEU A 273 -4.411 -19.034 8.719 1.00 0.00 C ATOM 1000 CD2 LEU A 273 -4.573 -16.545 8.970 1.00 0.00 C ATOM 0 H LEU A 273 -1.339 -17.012 5.737 1.00 0.00 H new ATOM 0 HA LEU A 273 -2.884 -19.366 6.219 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -2.277 -17.769 7.941 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -3.000 -16.453 7.038 1.00 0.00 H new ATOM 0 HG LEU A 273 -5.224 -17.698 7.344 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -5.350 -19.144 9.261 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -4.328 -19.826 7.974 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -3.578 -19.104 9.418 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -5.504 -16.677 9.522 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -3.739 -16.502 9.670 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -4.617 -15.616 8.401 1.00 0.00 H new ATOM 1012 N CYS A 274 -4.033 -17.047 4.269 1.00 0.00 N ATOM 1013 CA CYS A 274 -5.024 -16.744 3.243 1.00 0.00 C ATOM 1014 C CYS A 274 -5.398 -18.055 2.532 1.00 0.00 C ATOM 1015 O CYS A 274 -4.497 -18.797 2.102 1.00 0.00 O ATOM 1016 CB CYS A 274 -4.418 -15.782 2.241 1.00 0.00 C ATOM 1017 SG CYS A 274 -3.642 -14.333 2.970 1.00 0.00 S ATOM 0 H CYS A 274 -3.236 -16.410 4.270 1.00 0.00 H new ATOM 0 HA CYS A 274 -5.911 -16.293 3.688 1.00 0.00 H new ATOM 0 HB2 CYS A 274 -3.676 -16.316 1.648 1.00 0.00 H new ATOM 0 HB3 CYS A 274 -5.198 -15.453 1.555 1.00 0.00 H new ATOM 0 HG CYS A 274 -2.350 -14.443 2.883 1.00 0.00 H new ATOM 1023 N PRO A 275 -6.710 -18.356 2.398 1.00 0.00 N ATOM 1024 CA PRO A 275 -7.167 -19.672 1.933 1.00 0.00 C ATOM 1025 C PRO A 275 -6.554 -20.100 0.594 1.00 0.00 C ATOM 1026 O PRO A 275 -6.824 -19.488 -0.456 1.00 0.00 O ATOM 1027 CB PRO A 275 -8.694 -19.512 1.810 1.00 0.00 C ATOM 1028 CG PRO A 275 -8.950 -18.037 1.862 1.00 0.00 C ATOM 1029 CD PRO A 275 -7.833 -17.442 2.666 1.00 0.00 C ATOM 0 HA PRO A 275 -6.862 -20.456 2.626 1.00 0.00 H new ATOM 0 HB2 PRO A 275 -9.059 -19.941 0.877 1.00 0.00 H new ATOM 0 HB3 PRO A 275 -9.209 -20.028 2.620 1.00 0.00 H new ATOM 0 HG2 PRO A 275 -8.976 -17.612 0.859 1.00 0.00 H new ATOM 0 HG3 PRO A 275 -9.915 -17.826 2.323 1.00 0.00 H new ATOM 0 HD2 PRO A 275 -7.608 -16.423 2.352 1.00 0.00 H new ATOM 0 HD3 PRO A 275 -8.077 -17.402 3.728 1.00 0.00 H new ATOM 1037 N GLY A 276 -5.759 -21.185 0.664 1.00 0.00 N ATOM 1038 CA GLY A 276 -5.057 -21.769 -0.479 1.00 0.00 C ATOM 1039 C GLY A 276 -4.398 -20.738 -1.375 1.00 0.00 C ATOM 1040 O GLY A 276 -4.543 -20.801 -2.602 1.00 0.00 O ATOM 0 H GLY A 276 -5.588 -21.685 1.537 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -4.297 -22.460 -0.114 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -5.763 -22.353 -1.069 1.00 0.00 H new ATOM 1044 N LEU A 277 -3.667 -19.805 -0.800 1.00 0.00 N ATOM 1045 CA LEU A 277 -3.172 -18.716 -1.603 1.00 0.00 C ATOM 1046 C LEU A 277 -1.711 -18.869 -2.022 1.00 0.00 C ATOM 1047 O LEU A 277 -1.393 -18.757 -3.226 1.00 0.00 O ATOM 1048 CB LEU A 277 -3.387 -17.412 -0.777 1.00 0.00 C ATOM 1049 CG LEU A 277 -2.837 -16.055 -1.290 1.00 0.00 C ATOM 1050 CD1 LEU A 277 -1.334 -15.882 -1.009 1.00 0.00 C ATOM 1051 CD2 LEU A 277 -3.136 -15.871 -2.763 1.00 0.00 C ATOM 0 H LEU A 277 -3.411 -19.780 0.187 1.00 0.00 H new ATOM 0 HA LEU A 277 -3.722 -18.694 -2.544 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -4.462 -17.292 -0.639 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -2.956 -17.581 0.210 1.00 0.00 H new ATOM 0 HG LEU A 277 -3.354 -15.275 -0.731 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -1.002 -14.916 -1.389 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -1.157 -15.930 0.065 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -0.777 -16.677 -1.504 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -2.740 -14.912 -3.098 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -2.669 -16.675 -3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -4.214 -15.893 -2.921 1.00 0.00 H new ATOM 1063 N GLY A 278 -0.830 -19.112 -1.100 1.00 0.00 N ATOM 1064 CA GLY A 278 0.529 -19.229 -1.498 1.00 0.00 C ATOM 1065 C GLY A 278 1.492 -19.024 -0.373 1.00 0.00 C ATOM 1066 O GLY A 278 1.517 -17.929 0.191 1.00 0.00 O ATOM 0 H GLY A 278 -1.021 -19.229 -0.105 1.00 0.00 H new ATOM 0 HA2 GLY A 278 0.690 -20.216 -1.930 1.00 0.00 H new ATOM 0 HA3 GLY A 278 0.735 -18.500 -2.282 1.00 0.00 H new ATOM 1070 N PRO A 279 2.314 -19.990 -0.012 1.00 0.00 N ATOM 1071 CA PRO A 279 3.341 -19.756 0.989 1.00 0.00 C ATOM 1072 C PRO A 279 4.432 -18.824 0.420 1.00 0.00 C ATOM 1073 O PRO A 279 4.930 -17.929 1.104 1.00 0.00 O ATOM 1074 CB PRO A 279 3.894 -21.155 1.271 1.00 0.00 C ATOM 1075 CG PRO A 279 3.622 -21.907 0.013 1.00 0.00 C ATOM 1076 CD PRO A 279 2.300 -21.391 -0.473 1.00 0.00 C ATOM 0 HA PRO A 279 2.968 -19.270 1.890 1.00 0.00 H new ATOM 0 HB2 PRO A 279 4.960 -21.125 1.497 1.00 0.00 H new ATOM 0 HB3 PRO A 279 3.400 -21.615 2.127 1.00 0.00 H new ATOM 0 HG2 PRO A 279 4.406 -21.738 -0.725 1.00 0.00 H new ATOM 0 HG3 PRO A 279 3.583 -22.981 0.196 1.00 0.00 H new ATOM 0 HD2 PRO A 279 2.211 -21.460 -1.557 1.00 0.00 H new ATOM 0 HD3 PRO A 279 1.466 -21.949 -0.048 1.00 0.00 H new ATOM 1084 N GLN A 280 4.734 -19.004 -0.867 1.00 0.00 N ATOM 1085 CA GLN A 280 5.738 -18.209 -1.547 1.00 0.00 C ATOM 1086 C GLN A 280 5.304 -16.827 -1.778 1.00 0.00 C ATOM 1087 O GLN A 280 6.130 -15.902 -1.757 1.00 0.00 O ATOM 1088 CB GLN A 280 6.168 -18.838 -2.836 1.00 0.00 C ATOM 1089 CG GLN A 280 7.148 -19.916 -2.606 1.00 0.00 C ATOM 1090 CD GLN A 280 8.443 -19.418 -1.962 1.00 0.00 C ATOM 1091 OE1 GLN A 280 8.868 -18.229 -2.300 1.00 0.00 O flip ATOM 1092 NE2 GLN A 280 9.077 -20.127 -1.187 1.00 0.00 N flip ATOM 0 H GLN A 280 4.287 -19.704 -1.459 1.00 0.00 H new ATOM 0 HA GLN A 280 6.596 -18.177 -0.875 1.00 0.00 H new ATOM 0 HB2 GLN A 280 5.298 -19.240 -3.355 1.00 0.00 H new ATOM 0 HB3 GLN A 280 6.605 -18.079 -3.485 1.00 0.00 H new ATOM 0 HG2 GLN A 280 6.700 -20.677 -1.967 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.382 -20.396 -3.556 1.00 0.00 H new ATOM 0 HE21 GLN A 280 8.725 -21.052 -0.938 1.00 0.00 H new ATOM 0 HE22 GLN A 280 9.956 -19.792 -0.792 1.00 0.00 H new ATOM 1101 N LYS A 281 4.022 -16.657 -1.967 1.00 0.00 N ATOM 1102 CA LYS A 281 3.499 -15.347 -2.178 1.00 0.00 C ATOM 1103 C LYS A 281 3.730 -14.519 -0.917 1.00 0.00 C ATOM 1104 O LYS A 281 4.162 -13.381 -0.985 1.00 0.00 O ATOM 1105 CB LYS A 281 2.003 -15.344 -2.564 1.00 0.00 C ATOM 1106 CG LYS A 281 1.642 -15.741 -4.014 1.00 0.00 C ATOM 1107 CD LYS A 281 2.129 -17.128 -4.403 1.00 0.00 C ATOM 1108 CE LYS A 281 1.521 -17.604 -5.721 1.00 0.00 C ATOM 1109 NZ LYS A 281 0.050 -17.791 -5.623 1.00 0.00 N ATOM 0 H LYS A 281 3.331 -17.407 -1.978 1.00 0.00 H new ATOM 0 HA LYS A 281 4.026 -14.909 -3.026 1.00 0.00 H new ATOM 0 HB2 LYS A 281 1.480 -16.021 -1.889 1.00 0.00 H new ATOM 0 HB3 LYS A 281 1.610 -14.344 -2.381 1.00 0.00 H new ATOM 0 HG2 LYS A 281 0.560 -15.698 -4.135 1.00 0.00 H new ATOM 0 HG3 LYS A 281 2.069 -15.009 -4.700 1.00 0.00 H new ATOM 0 HD2 LYS A 281 3.216 -17.119 -4.488 1.00 0.00 H new ATOM 0 HD3 LYS A 281 1.877 -17.835 -3.612 1.00 0.00 H new ATOM 0 HE2 LYS A 281 1.742 -16.879 -6.504 1.00 0.00 H new ATOM 0 HE3 LYS A 281 1.987 -18.544 -6.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -0.244 -18.565 -6.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -0.206 -18.025 -4.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -0.431 -16.914 -5.906 1.00 0.00 H new ATOM 1123 N ALA A 282 3.497 -15.156 0.231 1.00 0.00 N ATOM 1124 CA ALA A 282 3.689 -14.570 1.535 1.00 0.00 C ATOM 1125 C ALA A 282 5.140 -14.169 1.752 1.00 0.00 C ATOM 1126 O ALA A 282 5.421 -13.133 2.358 1.00 0.00 O ATOM 1127 CB ALA A 282 3.287 -15.578 2.579 1.00 0.00 C ATOM 0 H ALA A 282 3.161 -16.118 0.268 1.00 0.00 H new ATOM 0 HA ALA A 282 3.076 -13.672 1.610 1.00 0.00 H new ATOM 0 HB1 ALA A 282 3.427 -15.149 3.571 1.00 0.00 H new ATOM 0 HB2 ALA A 282 2.239 -15.844 2.443 1.00 0.00 H new ATOM 0 HB3 ALA A 282 3.904 -16.471 2.479 1.00 0.00 H new ATOM 1133 N ARG A 283 6.058 -14.996 1.261 1.00 0.00 N ATOM 1134 CA ARG A 283 7.483 -14.728 1.407 1.00 0.00 C ATOM 1135 C ARG A 283 7.816 -13.443 0.657 1.00 0.00 C ATOM 1136 O ARG A 283 8.418 -12.529 1.208 1.00 0.00 O ATOM 1137 CB ARG A 283 8.338 -15.869 0.828 1.00 0.00 C ATOM 1138 CG ARG A 283 7.928 -17.287 1.225 1.00 0.00 C ATOM 1139 CD ARG A 283 7.854 -17.495 2.719 1.00 0.00 C ATOM 1140 NE ARG A 283 7.543 -18.893 3.046 1.00 0.00 N ATOM 1141 CZ ARG A 283 6.670 -19.310 3.969 1.00 0.00 C ATOM 1142 NH1 ARG A 283 5.797 -18.462 4.501 1.00 0.00 N ATOM 1143 NH2 ARG A 283 6.630 -20.592 4.305 1.00 0.00 N ATOM 0 H ARG A 283 5.840 -15.857 0.759 1.00 0.00 H new ATOM 0 HA ARG A 283 7.707 -14.637 2.470 1.00 0.00 H new ATOM 0 HB2 ARG A 283 8.314 -15.797 -0.259 1.00 0.00 H new ATOM 0 HB3 ARG A 283 9.372 -15.712 1.135 1.00 0.00 H new ATOM 0 HG2 ARG A 283 6.956 -17.512 0.786 1.00 0.00 H new ATOM 0 HG3 ARG A 283 8.641 -17.995 0.802 1.00 0.00 H new ATOM 0 HD2 ARG A 283 8.803 -17.215 3.175 1.00 0.00 H new ATOM 0 HD3 ARG A 283 7.091 -16.841 3.142 1.00 0.00 H new ATOM 0 HE ARG A 283 8.039 -19.612 2.520 1.00 0.00 H new ATOM 0 HH11 ARG A 283 5.790 -17.486 4.206 1.00 0.00 H new ATOM 0 HH12 ARG A 283 5.134 -18.787 5.205 1.00 0.00 H new ATOM 0 HH21 ARG A 283 7.264 -21.256 3.860 1.00 0.00 H new ATOM 0 HH22 ARG A 283 5.966 -20.914 5.009 1.00 0.00 H new ATOM 1157 N ARG A 284 7.388 -13.390 -0.602 1.00 0.00 N ATOM 1158 CA ARG A 284 7.608 -12.240 -1.470 1.00 0.00 C ATOM 1159 C ARG A 284 6.920 -10.975 -0.967 1.00 0.00 C ATOM 1160 O ARG A 284 7.491 -9.890 -1.044 1.00 0.00 O ATOM 1161 CB ARG A 284 7.159 -12.557 -2.887 1.00 0.00 C ATOM 1162 CG ARG A 284 7.892 -13.720 -3.518 1.00 0.00 C ATOM 1163 CD ARG A 284 9.393 -13.493 -3.475 1.00 0.00 C ATOM 1164 NE ARG A 284 9.768 -12.245 -4.156 1.00 0.00 N ATOM 1165 CZ ARG A 284 10.817 -11.457 -3.844 1.00 0.00 C ATOM 1166 NH1 ARG A 284 11.700 -11.833 -2.926 1.00 0.00 N ATOM 1167 NH2 ARG A 284 10.986 -10.304 -4.478 1.00 0.00 N ATOM 0 H ARG A 284 6.876 -14.150 -1.050 1.00 0.00 H new ATOM 0 HA ARG A 284 8.679 -12.039 -1.462 1.00 0.00 H new ATOM 0 HB2 ARG A 284 6.091 -12.775 -2.879 1.00 0.00 H new ATOM 0 HB3 ARG A 284 7.299 -11.672 -3.508 1.00 0.00 H new ATOM 0 HG2 ARG A 284 7.643 -14.642 -2.992 1.00 0.00 H new ATOM 0 HG3 ARG A 284 7.567 -13.844 -4.551 1.00 0.00 H new ATOM 0 HD2 ARG A 284 9.727 -13.458 -2.438 1.00 0.00 H new ATOM 0 HD3 ARG A 284 9.903 -14.333 -3.946 1.00 0.00 H new ATOM 0 HE ARG A 284 9.181 -11.948 -4.936 1.00 0.00 H new ATOM 0 HH11 ARG A 284 11.589 -12.727 -2.448 1.00 0.00 H new ATOM 0 HH12 ARG A 284 12.489 -11.228 -2.699 1.00 0.00 H new ATOM 0 HH21 ARG A 284 10.324 -10.016 -5.199 1.00 0.00 H new ATOM 0 HH22 ARG A 284 11.778 -9.705 -4.245 1.00 0.00 H new ATOM 1181 N LEU A 285 5.702 -11.114 -0.480 1.00 0.00 N ATOM 1182 CA LEU A 285 4.958 -9.993 0.084 1.00 0.00 C ATOM 1183 C LEU A 285 5.715 -9.355 1.222 1.00 0.00 C ATOM 1184 O LEU A 285 5.974 -8.168 1.205 1.00 0.00 O ATOM 1185 CB LEU A 285 3.592 -10.449 0.565 1.00 0.00 C ATOM 1186 CG LEU A 285 2.540 -10.682 -0.507 1.00 0.00 C ATOM 1187 CD1 LEU A 285 1.407 -11.499 0.065 1.00 0.00 C ATOM 1188 CD2 LEU A 285 2.001 -9.345 -1.005 1.00 0.00 C ATOM 0 H LEU A 285 5.198 -12.001 -0.462 1.00 0.00 H new ATOM 0 HA LEU A 285 4.829 -9.250 -0.703 1.00 0.00 H new ATOM 0 HB2 LEU A 285 3.719 -11.375 1.126 1.00 0.00 H new ATOM 0 HB3 LEU A 285 3.209 -9.704 1.263 1.00 0.00 H new ATOM 0 HG LEU A 285 2.993 -11.219 -1.340 1.00 0.00 H new ATOM 0 HD11 LEU A 285 0.653 -11.665 -0.705 1.00 0.00 H new ATOM 0 HD12 LEU A 285 1.790 -12.459 0.412 1.00 0.00 H new ATOM 0 HD13 LEU A 285 0.959 -10.964 0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 285 1.248 -9.520 -1.773 1.00 0.00 H new ATOM 0 HD22 LEU A 285 1.552 -8.801 -0.174 1.00 0.00 H new ATOM 0 HD23 LEU A 285 2.817 -8.757 -1.425 1.00 0.00 H new ATOM 1200 N PHE A 286 6.116 -10.162 2.178 1.00 0.00 N ATOM 1201 CA PHE A 286 6.828 -9.674 3.345 1.00 0.00 C ATOM 1202 C PHE A 286 8.173 -9.059 2.925 1.00 0.00 C ATOM 1203 O PHE A 286 8.665 -8.101 3.541 1.00 0.00 O ATOM 1204 CB PHE A 286 7.051 -10.833 4.292 1.00 0.00 C ATOM 1205 CG PHE A 286 7.381 -10.442 5.694 1.00 0.00 C ATOM 1206 CD1 PHE A 286 6.366 -10.226 6.604 1.00 0.00 C ATOM 1207 CD2 PHE A 286 8.689 -10.305 6.109 1.00 0.00 C ATOM 1208 CE1 PHE A 286 6.645 -9.878 7.900 1.00 0.00 C ATOM 1209 CE2 PHE A 286 8.982 -9.960 7.408 1.00 0.00 C ATOM 1210 CZ PHE A 286 7.957 -9.743 8.309 1.00 0.00 C ATOM 0 H PHE A 286 5.961 -11.170 2.172 1.00 0.00 H new ATOM 0 HA PHE A 286 6.242 -8.901 3.842 1.00 0.00 H new ATOM 0 HB2 PHE A 286 6.154 -11.452 4.304 1.00 0.00 H new ATOM 0 HB3 PHE A 286 7.860 -11.452 3.902 1.00 0.00 H new ATOM 0 HD1 PHE A 286 5.338 -10.333 6.291 1.00 0.00 H new ATOM 0 HD2 PHE A 286 9.492 -10.470 5.406 1.00 0.00 H new ATOM 0 HE1 PHE A 286 5.840 -9.710 8.600 1.00 0.00 H new ATOM 0 HE2 PHE A 286 10.010 -9.859 7.723 1.00 0.00 H new ATOM 0 HZ PHE A 286 8.181 -9.469 9.329 1.00 0.00 H new ATOM 1220 N ASP A 287 8.747 -9.608 1.854 1.00 0.00 N ATOM 1221 CA ASP A 287 10.010 -9.120 1.315 1.00 0.00 C ATOM 1222 C ASP A 287 9.837 -7.697 0.838 1.00 0.00 C ATOM 1223 O ASP A 287 10.492 -6.808 1.336 1.00 0.00 O ATOM 1224 CB ASP A 287 10.470 -9.992 0.139 1.00 0.00 C ATOM 1225 CG ASP A 287 11.877 -9.674 -0.351 1.00 0.00 C ATOM 1226 OD1 ASP A 287 12.842 -10.147 0.278 1.00 0.00 O ATOM 1227 OD2 ASP A 287 12.037 -9.010 -1.399 1.00 0.00 O ATOM 0 H ASP A 287 8.351 -10.396 1.342 1.00 0.00 H new ATOM 0 HA ASP A 287 10.763 -9.163 2.102 1.00 0.00 H new ATOM 0 HB2 ASP A 287 10.428 -11.039 0.438 1.00 0.00 H new ATOM 0 HB3 ASP A 287 9.771 -9.868 -0.688 1.00 0.00 H new ATOM 1232 N VAL A 288 8.849 -7.469 -0.032 1.00 0.00 N ATOM 1233 CA VAL A 288 8.627 -6.131 -0.584 1.00 0.00 C ATOM 1234 C VAL A 288 8.158 -5.153 0.488 1.00 0.00 C ATOM 1235 O VAL A 288 8.417 -3.972 0.401 1.00 0.00 O ATOM 1236 CB VAL A 288 7.652 -6.102 -1.801 1.00 0.00 C ATOM 1237 CG1 VAL A 288 8.141 -7.010 -2.922 1.00 0.00 C ATOM 1238 CG2 VAL A 288 6.237 -6.452 -1.394 1.00 0.00 C ATOM 0 H VAL A 288 8.200 -8.182 -0.365 1.00 0.00 H new ATOM 0 HA VAL A 288 9.601 -5.815 -0.958 1.00 0.00 H new ATOM 0 HB VAL A 288 7.638 -5.080 -2.180 1.00 0.00 H new ATOM 0 HG11 VAL A 288 7.440 -6.968 -3.756 1.00 0.00 H new ATOM 0 HG12 VAL A 288 9.124 -6.678 -3.257 1.00 0.00 H new ATOM 0 HG13 VAL A 288 8.209 -8.035 -2.557 1.00 0.00 H new ATOM 0 HG21 VAL A 288 5.588 -6.421 -2.269 1.00 0.00 H new ATOM 0 HG22 VAL A 288 6.219 -7.454 -0.965 1.00 0.00 H new ATOM 0 HG23 VAL A 288 5.883 -5.734 -0.654 1.00 0.00 H new ATOM 1248 N LEU A 289 7.494 -5.662 1.509 1.00 0.00 N ATOM 1249 CA LEU A 289 7.026 -4.820 2.595 1.00 0.00 C ATOM 1250 C LEU A 289 8.196 -4.275 3.417 1.00 0.00 C ATOM 1251 O LEU A 289 8.135 -3.151 3.918 1.00 0.00 O ATOM 1252 CB LEU A 289 6.033 -5.580 3.494 1.00 0.00 C ATOM 1253 CG LEU A 289 4.720 -6.026 2.830 1.00 0.00 C ATOM 1254 CD1 LEU A 289 3.902 -6.882 3.773 1.00 0.00 C ATOM 1255 CD2 LEU A 289 3.902 -4.834 2.368 1.00 0.00 C ATOM 0 H LEU A 289 7.267 -6.651 1.609 1.00 0.00 H new ATOM 0 HA LEU A 289 6.503 -3.971 2.154 1.00 0.00 H new ATOM 0 HB2 LEU A 289 6.535 -6.464 3.888 1.00 0.00 H new ATOM 0 HB3 LEU A 289 5.788 -4.946 4.346 1.00 0.00 H new ATOM 0 HG LEU A 289 4.983 -6.621 1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 289 2.978 -7.185 3.280 1.00 0.00 H new ATOM 0 HD12 LEU A 289 4.474 -7.768 4.049 1.00 0.00 H new ATOM 0 HD13 LEU A 289 3.664 -6.310 4.670 1.00 0.00 H new ATOM 0 HD21 LEU A 289 2.980 -5.184 1.903 1.00 0.00 H new ATOM 0 HD22 LEU A 289 3.660 -4.205 3.224 1.00 0.00 H new ATOM 0 HD23 LEU A 289 4.477 -4.257 1.644 1.00 0.00 H new ATOM 1267 N HIS A 290 9.273 -5.050 3.510 1.00 0.00 N ATOM 1268 CA HIS A 290 10.420 -4.657 4.330 1.00 0.00 C ATOM 1269 C HIS A 290 11.582 -4.150 3.495 1.00 0.00 C ATOM 1270 O HIS A 290 12.537 -3.554 4.020 1.00 0.00 O ATOM 1271 CB HIS A 290 10.866 -5.795 5.251 1.00 0.00 C ATOM 1272 CG HIS A 290 9.944 -6.045 6.416 1.00 0.00 C ATOM 1273 ND1 HIS A 290 10.371 -6.146 7.720 1.00 0.00 N ATOM 1274 CD2 HIS A 290 8.599 -6.216 6.453 1.00 0.00 C ATOM 1275 CE1 HIS A 290 9.303 -6.366 8.487 1.00 0.00 C ATOM 1276 NE2 HIS A 290 8.200 -6.417 7.767 1.00 0.00 N ATOM 0 H HIS A 290 9.378 -5.946 3.034 1.00 0.00 H new ATOM 0 HA HIS A 290 10.086 -3.827 4.952 1.00 0.00 H new ATOM 0 HB2 HIS A 290 10.949 -6.710 4.665 1.00 0.00 H new ATOM 0 HB3 HIS A 290 11.862 -5.569 5.632 1.00 0.00 H new ATOM 0 HD2 HIS A 290 7.942 -6.199 5.596 1.00 0.00 H new ATOM 0 HE1 HIS A 290 9.337 -6.487 9.560 1.00 0.00 H new ATOM 0 HE2 HIS A 290 7.250 -6.572 8.105 1.00 0.00 H new ATOM 1284 N GLU A 291 11.508 -4.364 2.225 1.00 0.00 N ATOM 1285 CA GLU A 291 12.518 -3.925 1.308 1.00 0.00 C ATOM 1286 C GLU A 291 12.375 -2.461 1.002 1.00 0.00 C ATOM 1287 O GLU A 291 11.282 -1.987 0.695 1.00 0.00 O ATOM 1288 CB GLU A 291 12.473 -4.753 0.038 1.00 0.00 C ATOM 1289 CG GLU A 291 13.236 -6.050 0.139 1.00 0.00 C ATOM 1290 CD GLU A 291 14.726 -5.850 0.171 1.00 0.00 C ATOM 1291 OE1 GLU A 291 15.299 -5.634 1.264 1.00 0.00 O ATOM 1292 OE2 GLU A 291 15.366 -5.932 -0.904 1.00 0.00 O ATOM 0 H GLU A 291 10.733 -4.857 1.782 1.00 0.00 H new ATOM 0 HA GLU A 291 13.491 -4.068 1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 291 11.434 -4.970 -0.208 1.00 0.00 H new ATOM 0 HB3 GLU A 291 12.879 -4.165 -0.785 1.00 0.00 H new ATOM 0 HG2 GLU A 291 12.926 -6.579 1.040 1.00 0.00 H new ATOM 0 HG3 GLU A 291 12.978 -6.685 -0.708 1.00 0.00 H new ATOM 1299 N PRO A 292 13.469 -1.707 1.118 1.00 0.00 N ATOM 1300 CA PRO A 292 13.457 -0.302 0.811 1.00 0.00 C ATOM 1301 C PRO A 292 13.236 -0.082 -0.681 1.00 0.00 C ATOM 1302 O PRO A 292 13.593 -0.944 -1.505 1.00 0.00 O ATOM 1303 CB PRO A 292 14.840 0.205 1.245 1.00 0.00 C ATOM 1304 CG PRO A 292 15.696 -1.003 1.388 1.00 0.00 C ATOM 1305 CD PRO A 292 14.793 -2.187 1.555 1.00 0.00 C ATOM 0 HA PRO A 292 12.652 0.228 1.320 1.00 0.00 H new ATOM 0 HB2 PRO A 292 15.254 0.890 0.505 1.00 0.00 H new ATOM 0 HB3 PRO A 292 14.777 0.752 2.186 1.00 0.00 H new ATOM 0 HG2 PRO A 292 16.331 -1.127 0.511 1.00 0.00 H new ATOM 0 HG3 PRO A 292 16.358 -0.903 2.248 1.00 0.00 H new ATOM 0 HD2 PRO A 292 15.129 -3.030 0.951 1.00 0.00 H new ATOM 0 HD3 PRO A 292 14.770 -2.526 2.591 1.00 0.00 H new ATOM 1313 N PHE A 293 12.662 1.058 -1.041 1.00 0.00 N ATOM 1314 CA PHE A 293 12.349 1.332 -2.446 1.00 0.00 C ATOM 1315 C PHE A 293 13.630 1.418 -3.269 1.00 0.00 C ATOM 1316 O PHE A 293 13.652 1.043 -4.431 1.00 0.00 O ATOM 1317 CB PHE A 293 11.530 2.621 -2.618 1.00 0.00 C ATOM 1318 CG PHE A 293 10.397 2.769 -1.637 1.00 0.00 C ATOM 1319 CD1 PHE A 293 9.327 1.899 -1.656 1.00 0.00 C ATOM 1320 CD2 PHE A 293 10.410 3.779 -0.695 1.00 0.00 C ATOM 1321 CE1 PHE A 293 8.291 2.032 -0.763 1.00 0.00 C ATOM 1322 CE2 PHE A 293 9.374 3.923 0.202 1.00 0.00 C ATOM 1323 CZ PHE A 293 8.311 3.046 0.167 1.00 0.00 C ATOM 0 H PHE A 293 12.404 1.802 -0.393 1.00 0.00 H new ATOM 0 HA PHE A 293 11.739 0.503 -2.806 1.00 0.00 H new ATOM 0 HB2 PHE A 293 12.197 3.478 -2.518 1.00 0.00 H new ATOM 0 HB3 PHE A 293 11.125 2.649 -3.630 1.00 0.00 H new ATOM 0 HD1 PHE A 293 9.303 1.101 -2.384 1.00 0.00 H new ATOM 0 HD2 PHE A 293 11.243 4.465 -0.661 1.00 0.00 H new ATOM 0 HE1 PHE A 293 7.461 1.341 -0.791 1.00 0.00 H new ATOM 0 HE2 PHE A 293 9.395 4.720 0.930 1.00 0.00 H new ATOM 0 HZ PHE A 293 7.496 3.154 0.868 1.00 0.00 H new ATOM 1333 N LEU A 294 14.705 1.869 -2.632 1.00 0.00 N ATOM 1334 CA LEU A 294 15.999 1.999 -3.291 1.00 0.00 C ATOM 1335 C LEU A 294 16.787 0.709 -3.183 1.00 0.00 C ATOM 1336 O LEU A 294 17.956 0.677 -3.536 1.00 0.00 O ATOM 1337 CB LEU A 294 16.863 3.123 -2.676 1.00 0.00 C ATOM 1338 CG LEU A 294 16.350 4.587 -2.760 1.00 0.00 C ATOM 1339 CD1 LEU A 294 15.115 4.833 -1.906 1.00 0.00 C ATOM 1340 CD2 LEU A 294 17.455 5.550 -2.377 1.00 0.00 C ATOM 0 H LEU A 294 14.705 2.153 -1.652 1.00 0.00 H new ATOM 0 HA LEU A 294 15.783 2.240 -4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 294 17.014 2.885 -1.623 1.00 0.00 H new ATOM 0 HB3 LEU A 294 17.842 3.087 -3.155 1.00 0.00 H new ATOM 0 HG LEU A 294 16.054 4.760 -3.795 1.00 0.00 H new ATOM 0 HD11 LEU A 294 14.804 5.873 -2.006 1.00 0.00 H new ATOM 0 HD12 LEU A 294 14.308 4.180 -2.237 1.00 0.00 H new ATOM 0 HD13 LEU A 294 15.347 4.623 -0.862 1.00 0.00 H new ATOM 0 HD21 LEU A 294 17.084 6.573 -2.440 1.00 0.00 H new ATOM 0 HD22 LEU A 294 17.780 5.344 -1.357 1.00 0.00 H new ATOM 0 HD23 LEU A 294 18.297 5.427 -3.058 1.00 0.00 H new ATOM 1352 N LYS A 295 16.164 -0.340 -2.630 1.00 0.00 N ATOM 1353 CA LYS A 295 16.790 -1.672 -2.426 1.00 0.00 C ATOM 1354 C LYS A 295 17.839 -1.637 -1.302 1.00 0.00 C ATOM 1355 O LYS A 295 17.894 -2.524 -0.447 1.00 0.00 O ATOM 1356 CB LYS A 295 17.436 -2.197 -3.727 1.00 0.00 C ATOM 1357 CG LYS A 295 18.075 -3.567 -3.588 1.00 0.00 C ATOM 1358 CD LYS A 295 18.852 -3.965 -4.830 1.00 0.00 C ATOM 1359 CE LYS A 295 20.006 -3.011 -5.097 1.00 0.00 C ATOM 1360 NZ LYS A 295 20.831 -3.455 -6.231 1.00 0.00 N ATOM 0 H LYS A 295 15.198 -0.296 -2.304 1.00 0.00 H new ATOM 0 HA LYS A 295 15.991 -2.353 -2.133 1.00 0.00 H new ATOM 0 HB2 LYS A 295 16.676 -2.239 -4.507 1.00 0.00 H new ATOM 0 HB3 LYS A 295 18.193 -1.486 -4.058 1.00 0.00 H new ATOM 0 HG2 LYS A 295 18.743 -3.569 -2.727 1.00 0.00 H new ATOM 0 HG3 LYS A 295 17.301 -4.309 -3.392 1.00 0.00 H new ATOM 0 HD2 LYS A 295 19.237 -4.978 -4.710 1.00 0.00 H new ATOM 0 HD3 LYS A 295 18.183 -3.978 -5.690 1.00 0.00 H new ATOM 0 HE2 LYS A 295 19.614 -2.015 -5.301 1.00 0.00 H new ATOM 0 HE3 LYS A 295 20.627 -2.933 -4.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 21.607 -2.779 -6.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 21.226 -4.395 -6.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 20.244 -3.505 -7.088 1.00 0.00 H new ATOM 1720 N TYR B 833 17.223 0.214 -7.213 1.00 0.00 N ATOM 1721 CA TYR B 833 15.834 0.321 -6.806 1.00 0.00 C ATOM 1722 C TYR B 833 15.183 -1.037 -6.845 1.00 0.00 C ATOM 1723 O TYR B 833 15.611 -1.922 -7.611 1.00 0.00 O ATOM 1724 CB TYR B 833 15.022 1.307 -7.671 1.00 0.00 C ATOM 1725 CG TYR B 833 15.206 2.780 -7.352 1.00 0.00 C ATOM 1726 CD1 TYR B 833 16.253 3.501 -7.890 1.00 0.00 C ATOM 1727 CD2 TYR B 833 14.311 3.452 -6.516 1.00 0.00 C ATOM 1728 CE1 TYR B 833 16.413 4.834 -7.611 1.00 0.00 C ATOM 1729 CE2 TYR B 833 14.468 4.796 -6.243 1.00 0.00 C ATOM 1730 CZ TYR B 833 15.525 5.479 -6.795 1.00 0.00 C ATOM 1731 OH TYR B 833 15.699 6.823 -6.533 1.00 0.00 O ATOM 0 HA TYR B 833 15.836 0.715 -5.790 1.00 0.00 H new ATOM 0 HB2 TYR B 833 15.287 1.146 -8.716 1.00 0.00 H new ATOM 0 HB3 TYR B 833 13.965 1.063 -7.569 1.00 0.00 H new ATOM 0 HD1 TYR B 833 16.958 3.007 -8.542 1.00 0.00 H new ATOM 0 HD2 TYR B 833 13.485 2.912 -6.077 1.00 0.00 H new ATOM 0 HE1 TYR B 833 17.244 5.377 -8.037 1.00 0.00 H new ATOM 0 HE2 TYR B 833 13.766 5.307 -5.601 1.00 0.00 H new ATOM 0 HH TYR B 833 14.986 7.135 -5.938 1.00 0.00 H new ATOM 1741 N ASN B 834 14.179 -1.205 -6.032 1.00 0.00 N ATOM 1742 CA ASN B 834 13.377 -2.410 -6.020 1.00 0.00 C ATOM 1743 C ASN B 834 12.013 -2.095 -6.588 1.00 0.00 C ATOM 1744 O ASN B 834 11.265 -1.298 -5.998 1.00 0.00 O ATOM 1745 CB ASN B 834 13.213 -2.995 -4.612 1.00 0.00 C ATOM 1746 CG ASN B 834 14.340 -3.889 -4.156 1.00 0.00 C ATOM 1747 OD1 ASN B 834 15.025 -4.521 -4.961 1.00 0.00 O ATOM 1748 ND2 ASN B 834 14.516 -3.975 -2.860 1.00 0.00 N ATOM 0 H ASN B 834 13.886 -0.506 -5.349 1.00 0.00 H new ATOM 0 HA ASN B 834 13.893 -3.156 -6.624 1.00 0.00 H new ATOM 0 HB2 ASN B 834 13.112 -2.173 -3.903 1.00 0.00 H new ATOM 0 HB3 ASN B 834 12.283 -3.562 -4.577 1.00 0.00 H new ATOM 0 HD21 ASN B 834 15.243 -4.583 -2.483 1.00 0.00 H new ATOM 0 HD22 ASN B 834 13.926 -3.434 -2.228 1.00 0.00 H new ATOM 1755 N PRO B 835 11.657 -2.698 -7.739 1.00 0.00 N ATOM 1756 CA PRO B 835 10.388 -2.425 -8.411 1.00 0.00 C ATOM 1757 C PRO B 835 9.174 -2.815 -7.577 1.00 0.00 C ATOM 1758 O PRO B 835 8.198 -2.092 -7.560 1.00 0.00 O ATOM 1759 CB PRO B 835 10.455 -3.257 -9.700 1.00 0.00 C ATOM 1760 CG PRO B 835 11.487 -4.299 -9.436 1.00 0.00 C ATOM 1761 CD PRO B 835 12.470 -3.683 -8.485 1.00 0.00 C ATOM 0 HA PRO B 835 10.263 -1.358 -8.593 1.00 0.00 H new ATOM 0 HB2 PRO B 835 9.489 -3.708 -9.929 1.00 0.00 H new ATOM 0 HB3 PRO B 835 10.729 -2.638 -10.555 1.00 0.00 H new ATOM 0 HG2 PRO B 835 11.036 -5.193 -9.005 1.00 0.00 H new ATOM 0 HG3 PRO B 835 11.978 -4.604 -10.360 1.00 0.00 H new ATOM 0 HD2 PRO B 835 12.907 -4.428 -7.821 1.00 0.00 H new ATOM 0 HD3 PRO B 835 13.295 -3.205 -9.014 1.00 0.00 H new ATOM 1769 N GLY B 836 9.276 -3.927 -6.849 1.00 0.00 N ATOM 1770 CA GLY B 836 8.168 -4.433 -6.047 1.00 0.00 C ATOM 1771 C GLY B 836 7.647 -3.427 -5.026 1.00 0.00 C ATOM 1772 O GLY B 836 6.542 -2.908 -5.177 1.00 0.00 O ATOM 0 H GLY B 836 10.121 -4.496 -6.800 1.00 0.00 H new ATOM 0 HA2 GLY B 836 7.352 -4.722 -6.710 1.00 0.00 H new ATOM 0 HA3 GLY B 836 8.489 -5.335 -5.526 1.00 0.00 H new ATOM 1776 N PRO B 837 8.436 -3.103 -3.990 1.00 0.00 N ATOM 1777 CA PRO B 837 8.013 -2.191 -2.937 1.00 0.00 C ATOM 1778 C PRO B 837 7.755 -0.776 -3.416 1.00 0.00 C ATOM 1779 O PRO B 837 6.897 -0.081 -2.862 1.00 0.00 O ATOM 1780 CB PRO B 837 9.162 -2.209 -1.937 1.00 0.00 C ATOM 1781 CG PRO B 837 10.331 -2.691 -2.707 1.00 0.00 C ATOM 1782 CD PRO B 837 9.781 -3.630 -3.735 1.00 0.00 C ATOM 0 HA PRO B 837 7.059 -2.513 -2.519 1.00 0.00 H new ATOM 0 HB2 PRO B 837 9.343 -1.216 -1.525 1.00 0.00 H new ATOM 0 HB3 PRO B 837 8.944 -2.868 -1.097 1.00 0.00 H new ATOM 0 HG2 PRO B 837 10.859 -1.861 -3.177 1.00 0.00 H new ATOM 0 HG3 PRO B 837 11.046 -3.197 -2.058 1.00 0.00 H new ATOM 0 HD2 PRO B 837 10.389 -3.636 -4.640 1.00 0.00 H new ATOM 0 HD3 PRO B 837 9.748 -4.655 -3.366 1.00 0.00 H new ATOM 1790 N GLN B 838 8.478 -0.333 -4.440 1.00 0.00 N ATOM 1791 CA GLN B 838 8.276 1.017 -4.905 1.00 0.00 C ATOM 1792 C GLN B 838 6.937 1.091 -5.590 1.00 0.00 C ATOM 1793 O GLN B 838 6.187 2.020 -5.376 1.00 0.00 O ATOM 1794 CB GLN B 838 9.405 1.506 -5.841 1.00 0.00 C ATOM 1795 CG GLN B 838 9.253 1.113 -7.309 1.00 0.00 C ATOM 1796 CD GLN B 838 10.469 1.433 -8.147 1.00 0.00 C ATOM 1797 OE1 GLN B 838 10.761 0.745 -9.119 1.00 0.00 O ATOM 1798 NE2 GLN B 838 11.160 2.488 -7.817 1.00 0.00 N ATOM 0 H GLN B 838 9.182 -0.873 -4.942 1.00 0.00 H new ATOM 0 HA GLN B 838 8.298 1.684 -4.043 1.00 0.00 H new ATOM 0 HB2 GLN B 838 9.462 2.593 -5.777 1.00 0.00 H new ATOM 0 HB3 GLN B 838 10.354 1.115 -5.474 1.00 0.00 H new ATOM 0 HG2 GLN B 838 9.049 0.044 -7.372 1.00 0.00 H new ATOM 0 HG3 GLN B 838 8.388 1.627 -7.727 1.00 0.00 H new ATOM 0 HE21 GLN B 838 10.891 3.040 -7.002 1.00 0.00 H new ATOM 0 HE22 GLN B 838 11.970 2.762 -8.374 1.00 0.00 H new ATOM 1807 N ASP B 839 6.606 0.044 -6.337 1.00 0.00 N ATOM 1808 CA ASP B 839 5.387 0.019 -7.094 1.00 0.00 C ATOM 1809 C ASP B 839 4.242 -0.063 -6.124 1.00 0.00 C ATOM 1810 O ASP B 839 3.257 0.607 -6.293 1.00 0.00 O ATOM 1811 CB ASP B 839 5.366 -1.170 -8.046 1.00 0.00 C ATOM 1812 CG ASP B 839 4.358 -1.079 -9.184 1.00 0.00 C ATOM 1813 OD1 ASP B 839 4.310 -0.046 -9.898 1.00 0.00 O ATOM 1814 OD2 ASP B 839 3.643 -2.072 -9.431 1.00 0.00 O ATOM 0 H ASP B 839 7.177 -0.797 -6.426 1.00 0.00 H new ATOM 0 HA ASP B 839 5.306 0.922 -7.699 1.00 0.00 H new ATOM 0 HB2 ASP B 839 6.361 -1.289 -8.474 1.00 0.00 H new ATOM 0 HB3 ASP B 839 5.157 -2.071 -7.470 1.00 0.00 H new ATOM 1819 N PHE B 840 4.444 -0.856 -5.048 1.00 0.00 N ATOM 1820 CA PHE B 840 3.474 -1.035 -3.954 1.00 0.00 C ATOM 1821 C PHE B 840 3.006 0.343 -3.474 1.00 0.00 C ATOM 1822 O PHE B 840 1.806 0.602 -3.379 1.00 0.00 O ATOM 1823 CB PHE B 840 4.155 -1.783 -2.783 1.00 0.00 C ATOM 1824 CG PHE B 840 3.256 -2.709 -1.990 1.00 0.00 C ATOM 1825 CD1 PHE B 840 2.158 -2.237 -1.283 1.00 0.00 C ATOM 1826 CD2 PHE B 840 3.520 -4.073 -1.966 1.00 0.00 C ATOM 1827 CE1 PHE B 840 1.343 -3.113 -0.572 1.00 0.00 C ATOM 1828 CE2 PHE B 840 2.706 -4.945 -1.256 1.00 0.00 C ATOM 1829 CZ PHE B 840 1.618 -4.461 -0.566 1.00 0.00 C ATOM 0 H PHE B 840 5.299 -1.396 -4.917 1.00 0.00 H new ATOM 0 HA PHE B 840 2.620 -1.614 -4.306 1.00 0.00 H new ATOM 0 HB2 PHE B 840 4.986 -2.365 -3.181 1.00 0.00 H new ATOM 0 HB3 PHE B 840 4.579 -1.046 -2.102 1.00 0.00 H new ATOM 0 HD1 PHE B 840 1.934 -1.180 -1.285 1.00 0.00 H new ATOM 0 HD2 PHE B 840 4.371 -4.460 -2.507 1.00 0.00 H new ATOM 0 HE1 PHE B 840 0.493 -2.734 -0.024 1.00 0.00 H new ATOM 0 HE2 PHE B 840 2.926 -6.002 -1.245 1.00 0.00 H new ATOM 0 HZ PHE B 840 0.980 -5.140 -0.020 1.00 0.00 H new ATOM 1839 N LEU B 841 3.978 1.231 -3.251 1.00 0.00 N ATOM 1840 CA LEU B 841 3.733 2.604 -2.815 1.00 0.00 C ATOM 1841 C LEU B 841 3.164 3.465 -3.941 1.00 0.00 C ATOM 1842 O LEU B 841 2.236 4.232 -3.735 1.00 0.00 O ATOM 1843 CB LEU B 841 5.021 3.224 -2.265 1.00 0.00 C ATOM 1844 CG LEU B 841 5.038 4.757 -2.145 1.00 0.00 C ATOM 1845 CD1 LEU B 841 4.015 5.240 -1.136 1.00 0.00 C ATOM 1846 CD2 LEU B 841 6.424 5.263 -1.794 1.00 0.00 C ATOM 0 H LEU B 841 4.967 1.013 -3.370 1.00 0.00 H new ATOM 0 HA LEU B 841 2.987 2.570 -2.021 1.00 0.00 H new ATOM 0 HB2 LEU B 841 5.211 2.801 -1.279 1.00 0.00 H new ATOM 0 HB3 LEU B 841 5.848 2.921 -2.907 1.00 0.00 H new ATOM 0 HG LEU B 841 4.767 5.166 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU B 841 4.051 6.328 -1.073 1.00 0.00 H new ATOM 0 HD12 LEU B 841 3.019 4.927 -1.450 1.00 0.00 H new ATOM 0 HD13 LEU B 841 4.238 4.813 -0.158 1.00 0.00 H new ATOM 0 HD21 LEU B 841 6.405 6.350 -1.716 1.00 0.00 H new ATOM 0 HD22 LEU B 841 6.737 4.836 -0.841 1.00 0.00 H new ATOM 0 HD23 LEU B 841 7.127 4.967 -2.572 1.00 0.00 H new ATOM 1858 N LEU B 842 3.704 3.324 -5.122 1.00 0.00 N ATOM 1859 CA LEU B 842 3.247 4.090 -6.270 1.00 0.00 C ATOM 1860 C LEU B 842 1.786 3.826 -6.631 1.00 0.00 C ATOM 1861 O LEU B 842 1.118 4.671 -7.246 1.00 0.00 O ATOM 1862 CB LEU B 842 4.147 3.867 -7.458 1.00 0.00 C ATOM 1863 CG LEU B 842 5.286 4.897 -7.613 1.00 0.00 C ATOM 1864 CD1 LEU B 842 6.384 4.760 -6.556 1.00 0.00 C ATOM 1865 CD2 LEU B 842 5.842 4.872 -8.999 1.00 0.00 C ATOM 0 H LEU B 842 4.469 2.681 -5.324 1.00 0.00 H new ATOM 0 HA LEU B 842 3.302 5.139 -5.979 1.00 0.00 H new ATOM 0 HB2 LEU B 842 4.585 2.872 -7.382 1.00 0.00 H new ATOM 0 HB3 LEU B 842 3.540 3.880 -8.363 1.00 0.00 H new ATOM 0 HG LEU B 842 4.840 5.877 -7.440 1.00 0.00 H new ATOM 0 HD11 LEU B 842 7.150 5.516 -6.727 1.00 0.00 H new ATOM 0 HD12 LEU B 842 5.954 4.898 -5.564 1.00 0.00 H new ATOM 0 HD13 LEU B 842 6.831 3.768 -6.622 1.00 0.00 H new ATOM 0 HD21 LEU B 842 6.643 5.606 -9.083 1.00 0.00 H new ATOM 0 HD22 LEU B 842 6.236 3.879 -9.215 1.00 0.00 H new ATOM 0 HD23 LEU B 842 5.053 5.112 -9.712 1.00 0.00 H new ATOM 1877 N LYS B 843 1.304 2.671 -6.237 1.00 0.00 N ATOM 1878 CA LYS B 843 -0.065 2.258 -6.468 1.00 0.00 C ATOM 1879 C LYS B 843 -0.999 2.816 -5.410 1.00 0.00 C ATOM 1880 O LYS B 843 -2.215 2.848 -5.608 1.00 0.00 O ATOM 1881 CB LYS B 843 -0.130 0.742 -6.458 1.00 0.00 C ATOM 1882 CG LYS B 843 0.689 0.108 -7.553 1.00 0.00 C ATOM 1883 CD LYS B 843 0.033 0.221 -8.884 1.00 0.00 C ATOM 1884 CE LYS B 843 0.845 -0.486 -9.933 1.00 0.00 C ATOM 1885 NZ LYS B 843 0.152 -0.477 -11.229 1.00 0.00 N ATOM 0 H LYS B 843 1.861 1.977 -5.737 1.00 0.00 H new ATOM 0 HA LYS B 843 -0.386 2.646 -7.435 1.00 0.00 H new ATOM 0 HB2 LYS B 843 0.219 0.376 -5.493 1.00 0.00 H new ATOM 0 HB3 LYS B 843 -1.169 0.428 -6.561 1.00 0.00 H new ATOM 0 HG2 LYS B 843 1.670 0.582 -7.592 1.00 0.00 H new ATOM 0 HG3 LYS B 843 0.853 -0.944 -7.319 1.00 0.00 H new ATOM 0 HD2 LYS B 843 -0.968 -0.208 -8.840 1.00 0.00 H new ATOM 0 HD3 LYS B 843 -0.082 1.271 -9.151 1.00 0.00 H new ATOM 0 HE2 LYS B 843 1.817 -0.003 -10.033 1.00 0.00 H new ATOM 0 HE3 LYS B 843 1.031 -1.514 -9.623 1.00 0.00 H new ATOM 0 HZ1 LYS B 843 0.593 -1.173 -11.863 1.00 0.00 H new ATOM 0 HZ2 LYS B 843 -0.849 -0.722 -11.089 1.00 0.00 H new ATOM 0 HZ3 LYS B 843 0.221 0.470 -11.653 1.00 0.00 H new ATOM 1899 N MET B 844 -0.427 3.287 -4.314 1.00 0.00 N ATOM 1900 CA MET B 844 -1.195 3.782 -3.183 1.00 0.00 C ATOM 1901 C MET B 844 -1.849 5.122 -3.553 1.00 0.00 C ATOM 1902 O MET B 844 -1.285 5.894 -4.341 1.00 0.00 O ATOM 1903 CB MET B 844 -0.290 3.922 -1.937 1.00 0.00 C ATOM 1904 CG MET B 844 0.464 2.640 -1.588 1.00 0.00 C ATOM 1905 SD MET B 844 1.554 2.778 -0.160 1.00 0.00 S ATOM 1906 CE MET B 844 0.376 2.884 1.149 1.00 0.00 C ATOM 0 H MET B 844 0.583 3.337 -4.183 1.00 0.00 H new ATOM 0 HA MET B 844 -1.983 3.069 -2.939 1.00 0.00 H new ATOM 0 HB2 MET B 844 0.429 4.723 -2.108 1.00 0.00 H new ATOM 0 HB3 MET B 844 -0.901 4.219 -1.085 1.00 0.00 H new ATOM 0 HG2 MET B 844 -0.260 1.847 -1.401 1.00 0.00 H new ATOM 0 HG3 MET B 844 1.055 2.335 -2.452 1.00 0.00 H new ATOM 0 HE1 MET B 844 0.460 3.856 1.636 1.00 0.00 H new ATOM 0 HE2 MET B 844 -0.629 2.766 0.744 1.00 0.00 H new ATOM 0 HE3 MET B 844 0.569 2.096 1.877 1.00 0.00 H new ATOM 1916 N PRO B 845 -3.049 5.408 -3.026 1.00 0.00 N ATOM 1917 CA PRO B 845 -3.798 6.619 -3.379 1.00 0.00 C ATOM 1918 C PRO B 845 -3.182 7.893 -2.802 1.00 0.00 C ATOM 1919 O PRO B 845 -2.586 7.882 -1.727 1.00 0.00 O ATOM 1920 CB PRO B 845 -5.173 6.378 -2.764 1.00 0.00 C ATOM 1921 CG PRO B 845 -4.918 5.468 -1.621 1.00 0.00 C ATOM 1922 CD PRO B 845 -3.767 4.595 -2.029 1.00 0.00 C ATOM 0 HA PRO B 845 -3.811 6.777 -4.457 1.00 0.00 H new ATOM 0 HB2 PRO B 845 -5.628 7.311 -2.433 1.00 0.00 H new ATOM 0 HB3 PRO B 845 -5.856 5.928 -3.484 1.00 0.00 H new ATOM 0 HG2 PRO B 845 -4.678 6.033 -0.720 1.00 0.00 H new ATOM 0 HG3 PRO B 845 -5.800 4.869 -1.396 1.00 0.00 H new ATOM 0 HD2 PRO B 845 -3.130 4.349 -1.179 1.00 0.00 H new ATOM 0 HD3 PRO B 845 -4.111 3.652 -2.454 1.00 0.00 H new ATOM 1930 N GLY B 846 -3.317 8.978 -3.545 1.00 0.00 N ATOM 1931 CA GLY B 846 -2.806 10.264 -3.122 1.00 0.00 C ATOM 1932 C GLY B 846 -1.323 10.443 -3.403 1.00 0.00 C ATOM 1933 O GLY B 846 -0.798 11.562 -3.317 1.00 0.00 O ATOM 0 H GLY B 846 -3.782 8.990 -4.453 1.00 0.00 H new ATOM 0 HA2 GLY B 846 -3.363 11.053 -3.628 1.00 0.00 H new ATOM 0 HA3 GLY B 846 -2.983 10.384 -2.053 1.00 0.00 H new ATOM 1937 N VAL B 847 -0.658 9.369 -3.770 1.00 0.00 N ATOM 1938 CA VAL B 847 0.771 9.389 -3.974 1.00 0.00 C ATOM 1939 C VAL B 847 1.138 9.780 -5.402 1.00 0.00 C ATOM 1940 O VAL B 847 1.015 8.978 -6.345 1.00 0.00 O ATOM 1941 CB VAL B 847 1.428 8.028 -3.629 1.00 0.00 C ATOM 1942 CG1 VAL B 847 2.940 8.120 -3.701 1.00 0.00 C ATOM 1943 CG2 VAL B 847 1.003 7.565 -2.262 1.00 0.00 C ATOM 0 H VAL B 847 -1.093 8.461 -3.934 1.00 0.00 H new ATOM 0 HA VAL B 847 1.159 10.146 -3.292 1.00 0.00 H new ATOM 0 HB VAL B 847 1.092 7.299 -4.367 1.00 0.00 H new ATOM 0 HG11 VAL B 847 3.376 7.152 -3.455 1.00 0.00 H new ATOM 0 HG12 VAL B 847 3.239 8.407 -4.709 1.00 0.00 H new ATOM 0 HG13 VAL B 847 3.293 8.868 -2.991 1.00 0.00 H new ATOM 0 HG21 VAL B 847 1.475 6.608 -2.039 1.00 0.00 H new ATOM 0 HG22 VAL B 847 1.306 8.301 -1.518 1.00 0.00 H new ATOM 0 HG23 VAL B 847 -0.081 7.450 -2.238 1.00 0.00 H new ATOM 1953 N ASN B 848 1.527 11.016 -5.551 1.00 0.00 N ATOM 1954 CA ASN B 848 2.067 11.532 -6.805 1.00 0.00 C ATOM 1955 C ASN B 848 3.580 11.400 -6.752 1.00 0.00 C ATOM 1956 O ASN B 848 4.121 11.087 -5.698 1.00 0.00 O ATOM 1957 CB ASN B 848 1.685 13.009 -7.028 1.00 0.00 C ATOM 1958 CG ASN B 848 2.009 13.869 -5.840 1.00 0.00 C ATOM 1959 OD1 ASN B 848 3.130 14.295 -5.666 1.00 0.00 O ATOM 1960 ND2 ASN B 848 1.031 14.156 -5.039 1.00 0.00 N ATOM 0 H ASN B 848 1.483 11.710 -4.805 1.00 0.00 H new ATOM 0 HA ASN B 848 1.649 10.960 -7.633 1.00 0.00 H new ATOM 0 HB2 ASN B 848 2.211 13.390 -7.903 1.00 0.00 H new ATOM 0 HB3 ASN B 848 0.619 13.077 -7.243 1.00 0.00 H new ATOM 0 HD21 ASN B 848 1.193 14.758 -4.232 1.00 0.00 H new ATOM 0 HD22 ASN B 848 0.100 13.780 -5.216 1.00 0.00 H new ATOM 1967 N ALA B 849 4.259 11.724 -7.844 1.00 0.00 N ATOM 1968 CA ALA B 849 5.723 11.524 -7.965 1.00 0.00 C ATOM 1969 C ALA B 849 6.515 12.302 -6.920 1.00 0.00 C ATOM 1970 O ALA B 849 7.552 11.847 -6.438 1.00 0.00 O ATOM 1971 CB ALA B 849 6.191 11.894 -9.355 1.00 0.00 C ATOM 0 H ALA B 849 3.827 12.131 -8.674 1.00 0.00 H new ATOM 0 HA ALA B 849 5.912 10.466 -7.784 1.00 0.00 H new ATOM 0 HB1 ALA B 849 7.268 11.742 -9.429 1.00 0.00 H new ATOM 0 HB2 ALA B 849 5.685 11.266 -10.088 1.00 0.00 H new ATOM 0 HB3 ALA B 849 5.958 12.941 -9.551 1.00 0.00 H new ATOM 1977 N LYS B 850 5.992 13.439 -6.549 1.00 0.00 N ATOM 1978 CA LYS B 850 6.624 14.321 -5.584 1.00 0.00 C ATOM 1979 C LYS B 850 6.557 13.633 -4.222 1.00 0.00 C ATOM 1980 O LYS B 850 7.544 13.538 -3.501 1.00 0.00 O ATOM 1981 CB LYS B 850 5.832 15.623 -5.567 1.00 0.00 C ATOM 1982 CG LYS B 850 5.536 16.124 -6.973 1.00 0.00 C ATOM 1983 CD LYS B 850 4.264 16.932 -7.023 1.00 0.00 C ATOM 1984 CE LYS B 850 3.807 17.129 -8.452 1.00 0.00 C ATOM 1985 NZ LYS B 850 2.605 17.976 -8.531 1.00 0.00 N ATOM 0 H LYS B 850 5.104 13.790 -6.908 1.00 0.00 H new ATOM 0 HA LYS B 850 7.664 14.533 -5.832 1.00 0.00 H new ATOM 0 HB2 LYS B 850 4.895 15.471 -5.031 1.00 0.00 H new ATOM 0 HB3 LYS B 850 6.393 16.382 -5.021 1.00 0.00 H new ATOM 0 HG2 LYS B 850 6.368 16.734 -7.324 1.00 0.00 H new ATOM 0 HG3 LYS B 850 5.454 15.275 -7.652 1.00 0.00 H new ATOM 0 HD2 LYS B 850 3.484 16.426 -6.454 1.00 0.00 H new ATOM 0 HD3 LYS B 850 4.425 17.901 -6.551 1.00 0.00 H new ATOM 0 HE2 LYS B 850 4.611 17.584 -9.031 1.00 0.00 H new ATOM 0 HE3 LYS B 850 3.598 16.159 -8.904 1.00 0.00 H new ATOM 0 HZ1 LYS B 850 2.323 18.087 -9.526 1.00 0.00 H new ATOM 0 HZ2 LYS B 850 1.830 17.530 -8.000 1.00 0.00 H new ATOM 0 HZ3 LYS B 850 2.811 18.910 -8.123 1.00 0.00 H new ATOM 1999 N ASN B 851 5.383 13.091 -3.928 1.00 0.00 N ATOM 2000 CA ASN B 851 5.144 12.344 -2.695 1.00 0.00 C ATOM 2001 C ASN B 851 5.959 11.057 -2.677 1.00 0.00 C ATOM 2002 O ASN B 851 6.524 10.701 -1.639 1.00 0.00 O ATOM 2003 CB ASN B 851 3.647 12.044 -2.502 1.00 0.00 C ATOM 2004 CG ASN B 851 2.801 13.247 -2.068 1.00 0.00 C ATOM 2005 OD1 ASN B 851 1.787 13.086 -1.414 1.00 0.00 O ATOM 2006 ND2 ASN B 851 3.203 14.446 -2.419 1.00 0.00 N ATOM 0 H ASN B 851 4.567 13.155 -4.537 1.00 0.00 H new ATOM 0 HA ASN B 851 5.468 12.968 -1.862 1.00 0.00 H new ATOM 0 HB2 ASN B 851 3.246 11.654 -3.437 1.00 0.00 H new ATOM 0 HB3 ASN B 851 3.542 11.256 -1.756 1.00 0.00 H new ATOM 0 HD21 ASN B 851 2.663 15.266 -2.144 1.00 0.00 H new ATOM 0 HD22 ASN B 851 4.056 14.558 -2.967 1.00 0.00 H new ATOM 2013 N CYS B 852 6.037 10.372 -3.841 1.00 0.00 N ATOM 2014 CA CYS B 852 6.856 9.159 -3.993 1.00 0.00 C ATOM 2015 C CYS B 852 8.284 9.465 -3.579 1.00 0.00 C ATOM 2016 O CYS B 852 8.891 8.734 -2.787 1.00 0.00 O ATOM 2017 CB CYS B 852 6.873 8.671 -5.458 1.00 0.00 C ATOM 2018 SG CYS B 852 5.266 8.262 -6.175 1.00 0.00 S ATOM 0 H CYS B 852 5.539 10.644 -4.688 1.00 0.00 H new ATOM 0 HA CYS B 852 6.423 8.381 -3.365 1.00 0.00 H new ATOM 0 HB2 CYS B 852 7.337 9.443 -6.072 1.00 0.00 H new ATOM 0 HB3 CYS B 852 7.511 7.789 -5.519 1.00 0.00 H new ATOM 0 HG CYS B 852 4.451 9.261 -6.011 1.00 0.00 H new ATOM 2024 N ARG B 853 8.796 10.577 -4.096 1.00 0.00 N ATOM 2025 CA ARG B 853 10.129 11.023 -3.797 1.00 0.00 C ATOM 2026 C ARG B 853 10.325 11.318 -2.331 1.00 0.00 C ATOM 2027 O ARG B 853 11.211 10.754 -1.722 1.00 0.00 O ATOM 2028 CB ARG B 853 10.551 12.190 -4.692 1.00 0.00 C ATOM 2029 CG ARG B 853 10.996 11.752 -6.074 1.00 0.00 C ATOM 2030 CD ARG B 853 12.272 10.936 -5.963 1.00 0.00 C ATOM 2031 NE ARG B 853 12.750 10.414 -7.230 1.00 0.00 N ATOM 2032 CZ ARG B 853 13.940 9.820 -7.375 1.00 0.00 C ATOM 2033 NH1 ARG B 853 14.806 9.805 -6.353 1.00 0.00 N ATOM 2034 NH2 ARG B 853 14.270 9.266 -8.532 1.00 0.00 N ATOM 0 H ARG B 853 8.287 11.188 -4.735 1.00 0.00 H new ATOM 0 HA ARG B 853 10.797 10.193 -4.026 1.00 0.00 H new ATOM 0 HB2 ARG B 853 9.717 12.885 -4.789 1.00 0.00 H new ATOM 0 HB3 ARG B 853 11.364 12.733 -4.211 1.00 0.00 H new ATOM 0 HG2 ARG B 853 10.214 11.160 -6.548 1.00 0.00 H new ATOM 0 HG3 ARG B 853 11.164 12.624 -6.707 1.00 0.00 H new ATOM 0 HD2 ARG B 853 13.051 11.557 -5.520 1.00 0.00 H new ATOM 0 HD3 ARG B 853 12.101 10.104 -5.280 1.00 0.00 H new ATOM 0 HE ARG B 853 12.150 10.504 -8.050 1.00 0.00 H new ATOM 0 HH11 ARG B 853 14.557 10.246 -5.467 1.00 0.00 H new ATOM 0 HH12 ARG B 853 15.714 9.353 -6.461 1.00 0.00 H new ATOM 0 HH21 ARG B 853 13.616 9.292 -9.315 1.00 0.00 H new ATOM 0 HH22 ARG B 853 15.178 8.814 -8.640 1.00 0.00 H new ATOM 2048 N SER B 854 9.471 12.133 -1.760 1.00 0.00 N ATOM 2049 CA SER B 854 9.567 12.478 -0.359 1.00 0.00 C ATOM 2050 C SER B 854 9.537 11.221 0.527 1.00 0.00 C ATOM 2051 O SER B 854 10.321 11.089 1.465 1.00 0.00 O ATOM 2052 CB SER B 854 8.440 13.428 -0.008 1.00 0.00 C ATOM 2053 OG SER B 854 8.474 14.568 -0.866 1.00 0.00 O ATOM 0 H SER B 854 8.693 12.575 -2.249 1.00 0.00 H new ATOM 0 HA SER B 854 10.521 12.971 -0.174 1.00 0.00 H new ATOM 0 HB2 SER B 854 7.481 12.919 -0.105 1.00 0.00 H new ATOM 0 HB3 SER B 854 8.530 13.743 1.032 1.00 0.00 H new ATOM 0 HG SER B 854 8.061 14.343 -1.726 1.00 0.00 H new ATOM 2059 N LEU B 855 8.680 10.282 0.189 1.00 0.00 N ATOM 2060 CA LEU B 855 8.584 9.057 0.921 1.00 0.00 C ATOM 2061 C LEU B 855 9.822 8.207 0.818 1.00 0.00 C ATOM 2062 O LEU B 855 10.287 7.728 1.801 1.00 0.00 O ATOM 2063 CB LEU B 855 7.340 8.284 0.567 1.00 0.00 C ATOM 2064 CG LEU B 855 6.069 8.755 1.278 1.00 0.00 C ATOM 2065 CD1 LEU B 855 4.882 8.015 0.760 1.00 0.00 C ATOM 2066 CD2 LEU B 855 6.177 8.548 2.787 1.00 0.00 C ATOM 0 H LEU B 855 8.037 10.354 -0.599 1.00 0.00 H new ATOM 0 HA LEU B 855 8.502 9.342 1.970 1.00 0.00 H new ATOM 0 HB2 LEU B 855 7.183 8.349 -0.510 1.00 0.00 H new ATOM 0 HB3 LEU B 855 7.503 7.232 0.803 1.00 0.00 H new ATOM 0 HG LEU B 855 5.950 9.820 1.078 1.00 0.00 H new ATOM 0 HD11 LEU B 855 3.985 8.360 1.274 1.00 0.00 H new ATOM 0 HD12 LEU B 855 4.779 8.196 -0.310 1.00 0.00 H new ATOM 0 HD13 LEU B 855 5.013 6.947 0.936 1.00 0.00 H new ATOM 0 HD21 LEU B 855 5.261 8.891 3.268 1.00 0.00 H new ATOM 0 HD22 LEU B 855 6.324 7.489 2.999 1.00 0.00 H new ATOM 0 HD23 LEU B 855 7.024 9.116 3.173 1.00 0.00 H new ATOM 2078 N MET B 856 10.401 8.086 -0.347 1.00 0.00 N ATOM 2079 CA MET B 856 11.596 7.242 -0.482 1.00 0.00 C ATOM 2080 C MET B 856 12.839 7.949 0.061 1.00 0.00 C ATOM 2081 O MET B 856 13.888 7.333 0.257 1.00 0.00 O ATOM 2082 CB MET B 856 11.816 6.785 -1.931 1.00 0.00 C ATOM 2083 CG MET B 856 12.027 7.914 -2.914 1.00 0.00 C ATOM 2084 SD MET B 856 12.328 7.351 -4.607 1.00 0.00 S ATOM 2085 CE MET B 856 10.781 6.520 -4.976 1.00 0.00 C ATOM 0 H MET B 856 10.088 8.541 -1.205 1.00 0.00 H new ATOM 0 HA MET B 856 11.424 6.349 0.119 1.00 0.00 H new ATOM 0 HB2 MET B 856 12.682 6.124 -1.964 1.00 0.00 H new ATOM 0 HB3 MET B 856 10.955 6.198 -2.249 1.00 0.00 H new ATOM 0 HG2 MET B 856 11.150 8.561 -2.905 1.00 0.00 H new ATOM 0 HG3 MET B 856 12.872 8.518 -2.585 1.00 0.00 H new ATOM 0 HE1 MET B 856 10.696 6.371 -6.052 1.00 0.00 H new ATOM 0 HE2 MET B 856 10.758 5.553 -4.473 1.00 0.00 H new ATOM 0 HE3 MET B 856 9.948 7.130 -4.627 1.00 0.00 H new ATOM 2095 N HIS B 857 12.708 9.232 0.308 1.00 0.00 N ATOM 2096 CA HIS B 857 13.800 10.032 0.826 1.00 0.00 C ATOM 2097 C HIS B 857 13.776 10.104 2.356 1.00 0.00 C ATOM 2098 O HIS B 857 14.787 10.410 2.978 1.00 0.00 O ATOM 2099 CB HIS B 857 13.769 11.451 0.231 1.00 0.00 C ATOM 2100 CG HIS B 857 14.084 11.550 -1.244 1.00 0.00 C ATOM 2101 ND1 HIS B 857 13.928 12.706 -1.973 1.00 0.00 N ATOM 2102 CD2 HIS B 857 14.536 10.615 -2.124 1.00 0.00 C ATOM 2103 CE1 HIS B 857 14.275 12.454 -3.235 1.00 0.00 C ATOM 2104 NE2 HIS B 857 14.654 11.195 -3.389 1.00 0.00 N ATOM 0 H HIS B 857 11.844 9.752 0.157 1.00 0.00 H new ATOM 0 HA HIS B 857 14.727 9.542 0.527 1.00 0.00 H new ATOM 0 HB2 HIS B 857 12.780 11.875 0.402 1.00 0.00 H new ATOM 0 HB3 HIS B 857 14.480 12.070 0.778 1.00 0.00 H new ATOM 0 HD1 HIS B 857 13.603 13.602 -1.610 1.00 0.00 H new ATOM 0 HD2 HIS B 857 14.767 9.588 -1.882 1.00 0.00 H new ATOM 0 HE1 HIS B 857 14.250 13.184 -4.031 1.00 0.00 H new ATOM 2112 N HIS B 858 12.622 9.856 2.952 1.00 0.00 N ATOM 2113 CA HIS B 858 12.490 9.905 4.422 1.00 0.00 C ATOM 2114 C HIS B 858 12.141 8.529 4.992 1.00 0.00 C ATOM 2115 O HIS B 858 12.475 8.194 6.135 1.00 0.00 O ATOM 2116 CB HIS B 858 11.399 10.913 4.854 1.00 0.00 C ATOM 2117 CG HIS B 858 11.676 12.367 4.539 1.00 0.00 C ATOM 2118 ND1 HIS B 858 11.557 13.049 3.373 1.00 0.00 N flip ATOM 2119 CD2 HIS B 858 12.064 13.304 5.476 1.00 0.00 C flip ATOM 2120 CE1 HIS B 858 11.865 14.389 3.585 1.00 0.00 C flip ATOM 2121 NE2 HIS B 858 12.161 14.486 4.870 1.00 0.00 N flip ATOM 0 H HIS B 858 11.762 9.619 2.457 1.00 0.00 H new ATOM 0 HA HIS B 858 13.455 10.226 4.815 1.00 0.00 H new ATOM 0 HB2 HIS B 858 10.461 10.630 4.375 1.00 0.00 H new ATOM 0 HB3 HIS B 858 11.249 10.817 5.929 1.00 0.00 H new ATOM 0 HD1 HIS B 858 11.284 12.642 2.478 1.00 0.00 H new ATOM 0 HD2 HIS B 858 12.256 13.111 6.521 1.00 0.00 H new ATOM 0 HE1 HIS B 858 11.863 15.183 2.853 1.00 0.00 H new ATOM 2129 N VAL B 859 11.462 7.758 4.200 1.00 0.00 N ATOM 2130 CA VAL B 859 10.978 6.456 4.572 1.00 0.00 C ATOM 2131 C VAL B 859 11.757 5.349 3.856 1.00 0.00 C ATOM 2132 O VAL B 859 12.167 5.509 2.708 1.00 0.00 O ATOM 2133 CB VAL B 859 9.440 6.383 4.284 1.00 0.00 C ATOM 2134 CG1 VAL B 859 8.959 4.990 4.024 1.00 0.00 C ATOM 2135 CG2 VAL B 859 8.682 6.949 5.449 1.00 0.00 C ATOM 0 H VAL B 859 11.219 8.022 3.245 1.00 0.00 H new ATOM 0 HA VAL B 859 11.138 6.297 5.638 1.00 0.00 H new ATOM 0 HB VAL B 859 9.262 6.966 3.380 1.00 0.00 H new ATOM 0 HG11 VAL B 859 7.886 5.005 3.831 1.00 0.00 H new ATOM 0 HG12 VAL B 859 9.478 4.582 3.156 1.00 0.00 H new ATOM 0 HG13 VAL B 859 9.162 4.366 4.895 1.00 0.00 H new ATOM 0 HG21 VAL B 859 7.612 6.897 5.247 1.00 0.00 H new ATOM 0 HG22 VAL B 859 8.910 6.373 6.346 1.00 0.00 H new ATOM 0 HG23 VAL B 859 8.973 7.988 5.602 1.00 0.00 H new ATOM 2145 N LYS B 860 12.008 4.260 4.567 1.00 0.00 N ATOM 2146 CA LYS B 860 12.708 3.120 4.004 1.00 0.00 C ATOM 2147 C LYS B 860 11.778 2.343 3.052 1.00 0.00 C ATOM 2148 O LYS B 860 12.095 2.133 1.880 1.00 0.00 O ATOM 2149 CB LYS B 860 13.131 2.179 5.147 1.00 0.00 C ATOM 2150 CG LYS B 860 14.012 1.011 4.716 1.00 0.00 C ATOM 2151 CD LYS B 860 14.065 -0.101 5.768 1.00 0.00 C ATOM 2152 CE LYS B 860 14.543 0.369 7.147 1.00 0.00 C ATOM 2153 NZ LYS B 860 15.936 0.853 7.143 1.00 0.00 N ATOM 0 H LYS B 860 11.734 4.144 5.543 1.00 0.00 H new ATOM 0 HA LYS B 860 13.579 3.474 3.453 1.00 0.00 H new ATOM 0 HB2 LYS B 860 13.664 2.760 5.900 1.00 0.00 H new ATOM 0 HB3 LYS B 860 12.235 1.784 5.625 1.00 0.00 H new ATOM 0 HG2 LYS B 860 13.635 0.602 3.778 1.00 0.00 H new ATOM 0 HG3 LYS B 860 15.022 1.373 4.523 1.00 0.00 H new ATOM 0 HD2 LYS B 860 13.072 -0.540 5.869 1.00 0.00 H new ATOM 0 HD3 LYS B 860 14.728 -0.891 5.414 1.00 0.00 H new ATOM 0 HE2 LYS B 860 13.889 1.166 7.499 1.00 0.00 H new ATOM 0 HE3 LYS B 860 14.453 -0.454 7.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 860 16.201 1.156 8.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 860 16.569 0.087 6.835 1.00 0.00 H new ATOM 0 HZ3 LYS B 860 16.022 1.657 6.489 1.00 0.00 H new ATOM 2167 N ASN B 861 10.618 1.963 3.569 1.00 0.00 N ATOM 2168 CA ASN B 861 9.671 1.104 2.861 1.00 0.00 C ATOM 2169 C ASN B 861 8.239 1.403 3.286 1.00 0.00 C ATOM 2170 O ASN B 861 8.008 2.167 4.231 1.00 0.00 O ATOM 2171 CB ASN B 861 10.024 -0.358 3.181 1.00 0.00 C ATOM 2172 CG ASN B 861 10.086 -0.635 4.683 1.00 0.00 C ATOM 2173 OD1 ASN B 861 9.339 -0.086 5.465 1.00 0.00 O ATOM 2174 ND2 ASN B 861 11.016 -1.407 5.093 1.00 0.00 N ATOM 0 H ASN B 861 10.303 2.243 4.498 1.00 0.00 H new ATOM 0 HA ASN B 861 9.740 1.288 1.789 1.00 0.00 H new ATOM 0 HB2 ASN B 861 9.283 -1.015 2.725 1.00 0.00 H new ATOM 0 HB3 ASN B 861 10.986 -0.602 2.731 1.00 0.00 H new ATOM 0 HD21 ASN B 861 11.140 -1.570 6.092 1.00 0.00 H new ATOM 0 HD22 ASN B 861 11.635 -1.861 4.421 1.00 0.00 H new ATOM 2181 N ILE B 862 7.292 0.778 2.611 1.00 0.00 N ATOM 2182 CA ILE B 862 5.870 0.923 2.916 1.00 0.00 C ATOM 2183 C ILE B 862 5.548 0.526 4.373 1.00 0.00 C ATOM 2184 O ILE B 862 4.592 1.024 4.946 1.00 0.00 O ATOM 2185 CB ILE B 862 4.945 0.110 1.959 1.00 0.00 C ATOM 2186 CG1 ILE B 862 5.482 -1.324 1.713 1.00 0.00 C ATOM 2187 CG2 ILE B 862 4.696 0.864 0.654 1.00 0.00 C ATOM 2188 CD1 ILE B 862 6.372 -1.484 0.498 1.00 0.00 C ATOM 0 H ILE B 862 7.483 0.150 1.830 1.00 0.00 H new ATOM 0 HA ILE B 862 5.663 1.983 2.769 1.00 0.00 H new ATOM 0 HB ILE B 862 3.981 -0.002 2.455 1.00 0.00 H new ATOM 0 HG12 ILE B 862 6.039 -1.642 2.595 1.00 0.00 H new ATOM 0 HG13 ILE B 862 4.633 -2.000 1.612 1.00 0.00 H new ATOM 0 HG21 ILE B 862 4.048 0.271 0.009 1.00 0.00 H new ATOM 0 HG22 ILE B 862 4.216 1.818 0.871 1.00 0.00 H new ATOM 0 HG23 ILE B 862 5.646 1.042 0.149 1.00 0.00 H new ATOM 0 HD11 ILE B 862 6.693 -2.522 0.417 1.00 0.00 H new ATOM 0 HD12 ILE B 862 5.818 -1.204 -0.398 1.00 0.00 H new ATOM 0 HD13 ILE B 862 7.246 -0.841 0.600 1.00 0.00 H new ATOM 2200 N ALA B 863 6.352 -0.369 4.962 1.00 0.00 N ATOM 2201 CA ALA B 863 6.155 -0.787 6.354 1.00 0.00 C ATOM 2202 C ALA B 863 6.372 0.381 7.315 1.00 0.00 C ATOM 2203 O ALA B 863 5.601 0.575 8.244 1.00 0.00 O ATOM 2204 CB ALA B 863 7.061 -1.959 6.714 1.00 0.00 C ATOM 0 H ALA B 863 7.142 -0.816 4.497 1.00 0.00 H new ATOM 0 HA ALA B 863 5.122 -1.120 6.454 1.00 0.00 H new ATOM 0 HB1 ALA B 863 6.891 -2.245 7.752 1.00 0.00 H new ATOM 0 HB2 ALA B 863 6.838 -2.805 6.063 1.00 0.00 H new ATOM 0 HB3 ALA B 863 8.103 -1.667 6.584 1.00 0.00 H new ATOM 2210 N GLU B 864 7.426 1.156 7.083 1.00 0.00 N ATOM 2211 CA GLU B 864 7.719 2.356 7.887 1.00 0.00 C ATOM 2212 C GLU B 864 6.579 3.335 7.744 1.00 0.00 C ATOM 2213 O GLU B 864 6.079 3.865 8.722 1.00 0.00 O ATOM 2214 CB GLU B 864 8.997 3.039 7.404 1.00 0.00 C ATOM 2215 CG GLU B 864 10.244 2.183 7.418 1.00 0.00 C ATOM 2216 CD GLU B 864 10.606 1.709 8.786 1.00 0.00 C ATOM 2217 OE1 GLU B 864 11.157 2.509 9.561 1.00 0.00 O ATOM 2218 OE2 GLU B 864 10.340 0.543 9.113 1.00 0.00 O ATOM 0 H GLU B 864 8.102 0.979 6.340 1.00 0.00 H new ATOM 0 HA GLU B 864 7.846 2.050 8.925 1.00 0.00 H new ATOM 0 HB2 GLU B 864 8.834 3.395 6.387 1.00 0.00 H new ATOM 0 HB3 GLU B 864 9.174 3.917 8.025 1.00 0.00 H new ATOM 0 HG2 GLU B 864 10.095 1.321 6.768 1.00 0.00 H new ATOM 0 HG3 GLU B 864 11.075 2.754 7.005 1.00 0.00 H new ATOM 2225 N LEU B 865 6.203 3.543 6.503 1.00 0.00 N ATOM 2226 CA LEU B 865 5.097 4.389 6.091 1.00 0.00 C ATOM 2227 C LEU B 865 3.812 4.034 6.827 1.00 0.00 C ATOM 2228 O LEU B 865 3.189 4.874 7.447 1.00 0.00 O ATOM 2229 CB LEU B 865 4.897 4.210 4.578 1.00 0.00 C ATOM 2230 CG LEU B 865 3.589 4.718 3.980 1.00 0.00 C ATOM 2231 CD1 LEU B 865 3.426 6.189 4.194 1.00 0.00 C ATOM 2232 CD2 LEU B 865 3.504 4.364 2.517 1.00 0.00 C ATOM 0 H LEU B 865 6.680 3.108 5.713 1.00 0.00 H new ATOM 0 HA LEU B 865 5.333 5.425 6.333 1.00 0.00 H new ATOM 0 HB2 LEU B 865 5.719 4.712 4.067 1.00 0.00 H new ATOM 0 HB3 LEU B 865 4.982 3.148 4.350 1.00 0.00 H new ATOM 0 HG LEU B 865 2.767 4.224 4.497 1.00 0.00 H new ATOM 0 HD11 LEU B 865 2.484 6.518 3.756 1.00 0.00 H new ATOM 0 HD12 LEU B 865 3.423 6.403 5.263 1.00 0.00 H new ATOM 0 HD13 LEU B 865 4.252 6.719 3.720 1.00 0.00 H new ATOM 0 HD21 LEU B 865 2.564 4.734 2.107 1.00 0.00 H new ATOM 0 HD22 LEU B 865 4.338 4.820 1.983 1.00 0.00 H new ATOM 0 HD23 LEU B 865 3.549 3.281 2.402 1.00 0.00 H new ATOM 2244 N ALA B 866 3.442 2.798 6.757 1.00 0.00 N ATOM 2245 CA ALA B 866 2.213 2.349 7.370 1.00 0.00 C ATOM 2246 C ALA B 866 2.296 2.319 8.906 1.00 0.00 C ATOM 2247 O ALA B 866 1.270 2.246 9.586 1.00 0.00 O ATOM 2248 CB ALA B 866 1.802 0.987 6.830 1.00 0.00 C ATOM 0 H ALA B 866 3.971 2.068 6.280 1.00 0.00 H new ATOM 0 HA ALA B 866 1.447 3.078 7.105 1.00 0.00 H new ATOM 0 HB1 ALA B 866 0.874 0.671 7.307 1.00 0.00 H new ATOM 0 HB2 ALA B 866 1.652 1.053 5.752 1.00 0.00 H new ATOM 0 HB3 ALA B 866 2.585 0.260 7.043 1.00 0.00 H new ATOM 2254 N ALA B 867 3.504 2.347 9.449 1.00 0.00 N ATOM 2255 CA ALA B 867 3.681 2.319 10.891 1.00 0.00 C ATOM 2256 C ALA B 867 3.847 3.723 11.461 1.00 0.00 C ATOM 2257 O ALA B 867 3.917 3.905 12.681 1.00 0.00 O ATOM 2258 CB ALA B 867 4.877 1.453 11.268 1.00 0.00 C ATOM 0 H ALA B 867 4.372 2.389 8.915 1.00 0.00 H new ATOM 0 HA ALA B 867 2.780 1.885 11.324 1.00 0.00 H new ATOM 0 HB1 ALA B 867 4.993 1.445 12.352 1.00 0.00 H new ATOM 0 HB2 ALA B 867 4.716 0.435 10.913 1.00 0.00 H new ATOM 0 HB3 ALA B 867 5.779 1.859 10.810 1.00 0.00 H new ATOM 2264 N LEU B 868 3.929 4.709 10.600 1.00 0.00 N ATOM 2265 CA LEU B 868 4.101 6.064 11.050 1.00 0.00 C ATOM 2266 C LEU B 868 2.773 6.829 11.163 1.00 0.00 C ATOM 2267 O LEU B 868 1.769 6.465 10.551 1.00 0.00 O ATOM 2268 CB LEU B 868 5.242 6.796 10.278 1.00 0.00 C ATOM 2269 CG LEU B 868 5.178 6.901 8.759 1.00 0.00 C ATOM 2270 CD1 LEU B 868 4.058 7.774 8.305 1.00 0.00 C ATOM 2271 CD2 LEU B 868 6.491 7.418 8.220 1.00 0.00 C ATOM 0 H LEU B 868 3.879 4.596 9.587 1.00 0.00 H new ATOM 0 HA LEU B 868 4.455 6.029 12.080 1.00 0.00 H new ATOM 0 HB2 LEU B 868 5.304 7.810 10.672 1.00 0.00 H new ATOM 0 HB3 LEU B 868 6.178 6.298 10.531 1.00 0.00 H new ATOM 0 HG LEU B 868 4.992 5.901 8.368 1.00 0.00 H new ATOM 0 HD11 LEU B 868 4.051 7.820 7.216 1.00 0.00 H new ATOM 0 HD12 LEU B 868 3.111 7.364 8.657 1.00 0.00 H new ATOM 0 HD13 LEU B 868 4.192 8.777 8.709 1.00 0.00 H new ATOM 0 HD21 LEU B 868 6.436 7.490 7.134 1.00 0.00 H new ATOM 0 HD22 LEU B 868 6.693 8.404 8.639 1.00 0.00 H new ATOM 0 HD23 LEU B 868 7.293 6.734 8.498 1.00 0.00 H new ATOM 2283 N SER B 869 2.796 7.862 11.959 1.00 0.00 N ATOM 2284 CA SER B 869 1.643 8.634 12.316 1.00 0.00 C ATOM 2285 C SER B 869 1.253 9.584 11.196 1.00 0.00 C ATOM 2286 O SER B 869 2.052 9.862 10.276 1.00 0.00 O ATOM 2287 CB SER B 869 1.979 9.411 13.601 1.00 0.00 C ATOM 2288 OG SER B 869 0.925 10.236 14.056 1.00 0.00 O ATOM 0 H SER B 869 3.655 8.201 12.393 1.00 0.00 H new ATOM 0 HA SER B 869 0.790 7.976 12.484 1.00 0.00 H new ATOM 0 HB2 SER B 869 2.239 8.702 14.387 1.00 0.00 H new ATOM 0 HB3 SER B 869 2.860 10.027 13.423 1.00 0.00 H new ATOM 0 HG SER B 869 1.283 11.111 14.313 1.00 0.00 H new ATOM 2294 N GLN B 870 0.044 10.109 11.305 1.00 0.00 N ATOM 2295 CA GLN B 870 -0.508 11.043 10.355 1.00 0.00 C ATOM 2296 C GLN B 870 0.397 12.258 10.247 1.00 0.00 C ATOM 2297 O GLN B 870 0.728 12.677 9.160 1.00 0.00 O ATOM 2298 CB GLN B 870 -1.939 11.455 10.777 1.00 0.00 C ATOM 2299 CG GLN B 870 -2.651 12.531 9.923 1.00 0.00 C ATOM 2300 CD GLN B 870 -3.211 12.028 8.617 1.00 0.00 C ATOM 2301 OE1 GLN B 870 -2.485 12.181 7.574 1.00 0.00 O flip ATOM 2302 NE2 GLN B 870 -4.338 11.568 8.553 1.00 0.00 N flip ATOM 0 H GLN B 870 -0.589 9.889 12.074 1.00 0.00 H new ATOM 0 HA GLN B 870 -0.570 10.567 9.376 1.00 0.00 H new ATOM 0 HB2 GLN B 870 -2.561 10.560 10.778 1.00 0.00 H new ATOM 0 HB3 GLN B 870 -1.897 11.815 11.805 1.00 0.00 H new ATOM 0 HG2 GLN B 870 -3.463 12.962 10.509 1.00 0.00 H new ATOM 0 HG3 GLN B 870 -1.946 13.336 9.715 1.00 0.00 H new ATOM 0 HE21 GLN B 870 -4.893 11.458 9.402 1.00 0.00 H new ATOM 0 HE22 GLN B 870 -4.726 11.293 7.651 1.00 0.00 H new ATOM 2311 N ASP B 871 0.831 12.779 11.369 1.00 0.00 N ATOM 2312 CA ASP B 871 1.703 13.962 11.380 1.00 0.00 C ATOM 2313 C ASP B 871 3.046 13.671 10.716 1.00 0.00 C ATOM 2314 O ASP B 871 3.609 14.541 10.052 1.00 0.00 O ATOM 2315 CB ASP B 871 1.927 14.494 12.798 1.00 0.00 C ATOM 2316 CG ASP B 871 2.656 13.524 13.687 1.00 0.00 C ATOM 2317 OD1 ASP B 871 2.000 12.630 14.267 1.00 0.00 O ATOM 2318 OD2 ASP B 871 3.889 13.634 13.824 1.00 0.00 O ATOM 0 H ASP B 871 0.603 12.413 12.294 1.00 0.00 H new ATOM 0 HA ASP B 871 1.189 14.732 10.805 1.00 0.00 H new ATOM 0 HB2 ASP B 871 2.493 15.424 12.745 1.00 0.00 H new ATOM 0 HB3 ASP B 871 0.962 14.733 13.246 1.00 0.00 H new ATOM 2323 N GLU B 872 3.528 12.437 10.849 1.00 0.00 N ATOM 2324 CA GLU B 872 4.797 12.043 10.255 1.00 0.00 C ATOM 2325 C GLU B 872 4.687 12.073 8.745 1.00 0.00 C ATOM 2326 O GLU B 872 5.425 12.791 8.072 1.00 0.00 O ATOM 2327 CB GLU B 872 5.234 10.649 10.731 1.00 0.00 C ATOM 2328 CG GLU B 872 5.450 10.544 12.227 1.00 0.00 C ATOM 2329 CD GLU B 872 5.952 9.196 12.662 1.00 0.00 C ATOM 2330 OE1 GLU B 872 7.151 8.920 12.508 1.00 0.00 O ATOM 2331 OE2 GLU B 872 5.157 8.390 13.192 1.00 0.00 O ATOM 0 H GLU B 872 3.056 11.694 11.364 1.00 0.00 H new ATOM 0 HA GLU B 872 5.558 12.754 10.577 1.00 0.00 H new ATOM 0 HB2 GLU B 872 4.479 9.922 10.432 1.00 0.00 H new ATOM 0 HB3 GLU B 872 6.158 10.376 10.222 1.00 0.00 H new ATOM 0 HG2 GLU B 872 6.163 11.307 12.539 1.00 0.00 H new ATOM 0 HG3 GLU B 872 4.511 10.757 12.738 1.00 0.00 H new ATOM 2338 N LEU B 873 3.713 11.348 8.223 1.00 0.00 N ATOM 2339 CA LEU B 873 3.491 11.291 6.789 1.00 0.00 C ATOM 2340 C LEU B 873 3.110 12.657 6.209 1.00 0.00 C ATOM 2341 O LEU B 873 3.511 12.997 5.107 1.00 0.00 O ATOM 2342 CB LEU B 873 2.518 10.139 6.408 1.00 0.00 C ATOM 2343 CG LEU B 873 1.199 10.022 7.171 1.00 0.00 C ATOM 2344 CD1 LEU B 873 0.188 10.916 6.581 1.00 0.00 C ATOM 2345 CD2 LEU B 873 0.688 8.592 7.207 1.00 0.00 C ATOM 0 H LEU B 873 3.061 10.789 8.773 1.00 0.00 H new ATOM 0 HA LEU B 873 4.438 11.041 6.311 1.00 0.00 H new ATOM 0 HB2 LEU B 873 2.281 10.240 5.349 1.00 0.00 H new ATOM 0 HB3 LEU B 873 3.055 9.198 6.526 1.00 0.00 H new ATOM 0 HG LEU B 873 1.387 10.325 8.201 1.00 0.00 H new ATOM 0 HD11 LEU B 873 -0.747 10.823 7.134 1.00 0.00 H new ATOM 0 HD12 LEU B 873 0.539 11.947 6.633 1.00 0.00 H new ATOM 0 HD13 LEU B 873 0.022 10.641 5.539 1.00 0.00 H new ATOM 0 HD21 LEU B 873 -0.251 8.555 7.759 1.00 0.00 H new ATOM 0 HD22 LEU B 873 0.525 8.238 6.189 1.00 0.00 H new ATOM 0 HD23 LEU B 873 1.423 7.955 7.699 1.00 0.00 H new ATOM 2357 N THR B 874 2.411 13.458 6.989 1.00 0.00 N ATOM 2358 CA THR B 874 2.035 14.790 6.587 1.00 0.00 C ATOM 2359 C THR B 874 3.285 15.689 6.445 1.00 0.00 C ATOM 2360 O THR B 874 3.426 16.410 5.456 1.00 0.00 O ATOM 2361 CB THR B 874 1.038 15.388 7.608 1.00 0.00 C ATOM 2362 OG1 THR B 874 -0.140 14.570 7.656 1.00 0.00 O ATOM 2363 CG2 THR B 874 0.656 16.808 7.269 1.00 0.00 C ATOM 0 H THR B 874 2.089 13.198 7.921 1.00 0.00 H new ATOM 0 HA THR B 874 1.547 14.740 5.614 1.00 0.00 H new ATOM 0 HB THR B 874 1.529 15.406 8.581 1.00 0.00 H new ATOM 0 HG1 THR B 874 0.073 13.715 8.085 1.00 0.00 H new ATOM 0 HG21 THR B 874 -0.045 17.184 8.014 1.00 0.00 H new ATOM 0 HG22 THR B 874 1.549 17.433 7.263 1.00 0.00 H new ATOM 0 HG23 THR B 874 0.188 16.834 6.285 1.00 0.00 H new ATOM 2371 N SER B 875 4.209 15.586 7.398 1.00 0.00 N ATOM 2372 CA SER B 875 5.437 16.364 7.370 1.00 0.00 C ATOM 2373 C SER B 875 6.322 15.959 6.177 1.00 0.00 C ATOM 2374 O SER B 875 7.075 16.774 5.637 1.00 0.00 O ATOM 2375 CB SER B 875 6.189 16.191 8.691 1.00 0.00 C ATOM 2376 OG SER B 875 5.374 16.596 9.792 1.00 0.00 O ATOM 0 H SER B 875 4.125 14.965 8.203 1.00 0.00 H new ATOM 0 HA SER B 875 5.181 17.416 7.245 1.00 0.00 H new ATOM 0 HB2 SER B 875 6.483 15.149 8.814 1.00 0.00 H new ATOM 0 HB3 SER B 875 7.105 16.781 8.674 1.00 0.00 H new ATOM 0 HG SER B 875 4.705 15.904 9.976 1.00 0.00 H new ATOM 2382 N ILE B 876 6.206 14.716 5.767 1.00 0.00 N ATOM 2383 CA ILE B 876 6.961 14.197 4.647 1.00 0.00 C ATOM 2384 C ILE B 876 6.326 14.629 3.309 1.00 0.00 C ATOM 2385 O ILE B 876 6.991 15.227 2.462 1.00 0.00 O ATOM 2386 CB ILE B 876 7.053 12.643 4.715 1.00 0.00 C ATOM 2387 CG1 ILE B 876 7.769 12.204 6.004 1.00 0.00 C ATOM 2388 CG2 ILE B 876 7.771 12.085 3.491 1.00 0.00 C ATOM 2389 CD1 ILE B 876 7.796 10.705 6.222 1.00 0.00 C ATOM 0 H ILE B 876 5.584 14.034 6.201 1.00 0.00 H new ATOM 0 HA ILE B 876 7.968 14.610 4.704 1.00 0.00 H new ATOM 0 HB ILE B 876 6.039 12.243 4.725 1.00 0.00 H new ATOM 0 HG12 ILE B 876 8.794 12.575 5.981 1.00 0.00 H new ATOM 0 HG13 ILE B 876 7.279 12.675 6.856 1.00 0.00 H new ATOM 0 HG21 ILE B 876 7.822 10.999 3.563 1.00 0.00 H new ATOM 0 HG22 ILE B 876 7.224 12.364 2.590 1.00 0.00 H new ATOM 0 HG23 ILE B 876 8.781 12.493 3.444 1.00 0.00 H new ATOM 0 HD11 ILE B 876 8.319 10.482 7.152 1.00 0.00 H new ATOM 0 HD12 ILE B 876 6.775 10.327 6.280 1.00 0.00 H new ATOM 0 HD13 ILE B 876 8.313 10.226 5.391 1.00 0.00 H new ATOM 2401 N LEU B 877 5.041 14.361 3.156 1.00 0.00 N ATOM 2402 CA LEU B 877 4.311 14.618 1.902 1.00 0.00 C ATOM 2403 C LEU B 877 4.049 16.098 1.670 1.00 0.00 C ATOM 2404 O LEU B 877 3.953 16.551 0.526 1.00 0.00 O ATOM 2405 CB LEU B 877 2.981 13.889 1.930 1.00 0.00 C ATOM 2406 CG LEU B 877 3.045 12.387 2.177 1.00 0.00 C ATOM 2407 CD1 LEU B 877 1.661 11.812 2.213 1.00 0.00 C ATOM 2408 CD2 LEU B 877 3.885 11.692 1.128 1.00 0.00 C ATOM 0 H LEU B 877 4.462 13.958 3.893 1.00 0.00 H new ATOM 0 HA LEU B 877 4.940 14.257 1.088 1.00 0.00 H new ATOM 0 HB2 LEU B 877 2.360 14.338 2.705 1.00 0.00 H new ATOM 0 HB3 LEU B 877 2.476 14.059 0.979 1.00 0.00 H new ATOM 0 HG LEU B 877 3.521 12.221 3.143 1.00 0.00 H new ATOM 0 HD11 LEU B 877 1.718 10.738 2.390 1.00 0.00 H new ATOM 0 HD12 LEU B 877 1.092 12.282 3.015 1.00 0.00 H new ATOM 0 HD13 LEU B 877 1.165 11.997 1.260 1.00 0.00 H new ATOM 0 HD21 LEU B 877 3.911 10.622 1.333 1.00 0.00 H new ATOM 0 HD22 LEU B 877 3.451 11.863 0.143 1.00 0.00 H new ATOM 0 HD23 LEU B 877 4.899 12.090 1.152 1.00 0.00 H new ATOM 2420 N GLY B 878 3.875 16.837 2.734 1.00 0.00 N ATOM 2421 CA GLY B 878 3.620 18.254 2.624 1.00 0.00 C ATOM 2422 C GLY B 878 2.145 18.547 2.613 1.00 0.00 C ATOM 2423 O GLY B 878 1.670 19.419 3.334 1.00 0.00 O ATOM 0 H GLY B 878 3.905 16.483 3.690 1.00 0.00 H new ATOM 0 HA2 GLY B 878 4.090 18.776 3.458 1.00 0.00 H new ATOM 0 HA3 GLY B 878 4.075 18.637 1.711 1.00 0.00 H new ATOM 2427 N ASN B 879 1.424 17.799 1.818 1.00 0.00 N ATOM 2428 CA ASN B 879 -0.001 17.958 1.694 1.00 0.00 C ATOM 2429 C ASN B 879 -0.741 17.159 2.718 1.00 0.00 C ATOM 2430 O ASN B 879 -0.634 15.928 2.760 1.00 0.00 O ATOM 2431 CB ASN B 879 -0.484 17.552 0.325 1.00 0.00 C ATOM 2432 CG ASN B 879 -0.836 18.718 -0.544 1.00 0.00 C ATOM 2433 OD1 ASN B 879 0.004 19.235 -1.267 1.00 0.00 O ATOM 2434 ND2 ASN B 879 -2.069 19.156 -0.473 1.00 0.00 N ATOM 0 H ASN B 879 1.812 17.058 1.235 1.00 0.00 H new ATOM 0 HA ASN B 879 -0.203 19.017 1.853 1.00 0.00 H new ATOM 0 HB2 ASN B 879 0.289 16.961 -0.166 1.00 0.00 H new ATOM 0 HB3 ASN B 879 -1.358 16.909 0.431 1.00 0.00 H new ATOM 0 HD21 ASN B 879 -2.359 19.957 -1.034 1.00 0.00 H new ATOM 0 HD22 ASN B 879 -2.739 18.696 0.143 1.00 0.00 H new ATOM 2441 N ALA B 880 -1.520 17.852 3.505 1.00 0.00 N ATOM 2442 CA ALA B 880 -2.341 17.259 4.538 1.00 0.00 C ATOM 2443 C ALA B 880 -3.404 16.332 3.930 1.00 0.00 C ATOM 2444 O ALA B 880 -3.708 15.272 4.479 1.00 0.00 O ATOM 2445 CB ALA B 880 -2.992 18.367 5.337 1.00 0.00 C ATOM 0 H ALA B 880 -1.607 18.867 3.448 1.00 0.00 H new ATOM 0 HA ALA B 880 -1.716 16.652 5.193 1.00 0.00 H new ATOM 0 HB1 ALA B 880 -3.614 17.934 6.120 1.00 0.00 H new ATOM 0 HB2 ALA B 880 -2.221 18.990 5.790 1.00 0.00 H new ATOM 0 HB3 ALA B 880 -3.610 18.976 4.678 1.00 0.00 H new ATOM 2451 N ALA B 881 -3.941 16.732 2.781 1.00 0.00 N ATOM 2452 CA ALA B 881 -4.947 15.947 2.079 1.00 0.00 C ATOM 2453 C ALA B 881 -4.367 14.629 1.624 1.00 0.00 C ATOM 2454 O ALA B 881 -4.920 13.578 1.928 1.00 0.00 O ATOM 2455 CB ALA B 881 -5.494 16.710 0.886 1.00 0.00 C ATOM 0 H ALA B 881 -3.692 17.604 2.314 1.00 0.00 H new ATOM 0 HA ALA B 881 -5.766 15.754 2.772 1.00 0.00 H new ATOM 0 HB1 ALA B 881 -6.243 16.103 0.378 1.00 0.00 H new ATOM 0 HB2 ALA B 881 -5.950 17.640 1.227 1.00 0.00 H new ATOM 0 HB3 ALA B 881 -4.682 16.936 0.195 1.00 0.00 H new ATOM 2461 N ASN B 882 -3.234 14.700 0.918 1.00 0.00 N ATOM 2462 CA ASN B 882 -2.509 13.511 0.410 1.00 0.00 C ATOM 2463 C ASN B 882 -2.193 12.581 1.544 1.00 0.00 C ATOM 2464 O ASN B 882 -2.358 11.365 1.442 1.00 0.00 O ATOM 2465 CB ASN B 882 -1.184 13.904 -0.244 1.00 0.00 C ATOM 2466 CG ASN B 882 -1.308 14.730 -1.501 1.00 0.00 C ATOM 2467 OD1 ASN B 882 -2.251 15.503 -1.680 1.00 0.00 O ATOM 2468 ND2 ASN B 882 -0.346 14.598 -2.355 1.00 0.00 N ATOM 0 H ASN B 882 -2.785 15.584 0.677 1.00 0.00 H new ATOM 0 HA ASN B 882 -3.154 13.030 -0.325 1.00 0.00 H new ATOM 0 HB2 ASN B 882 -0.591 14.461 0.481 1.00 0.00 H new ATOM 0 HB3 ASN B 882 -0.629 12.995 -0.479 1.00 0.00 H new ATOM 0 HD21 ASN B 882 -0.349 15.145 -3.216 1.00 0.00 H new ATOM 0 HD22 ASN B 882 0.416 13.946 -2.168 1.00 0.00 H new ATOM 2475 N ALA B 883 -1.755 13.182 2.628 1.00 0.00 N ATOM 2476 CA ALA B 883 -1.424 12.497 3.839 1.00 0.00 C ATOM 2477 C ALA B 883 -2.607 11.708 4.338 1.00 0.00 C ATOM 2478 O ALA B 883 -2.490 10.530 4.672 1.00 0.00 O ATOM 2479 CB ALA B 883 -1.013 13.514 4.864 1.00 0.00 C ATOM 0 H ALA B 883 -1.618 14.191 2.684 1.00 0.00 H new ATOM 0 HA ALA B 883 -0.606 11.800 3.655 1.00 0.00 H new ATOM 0 HB1 ALA B 883 -0.757 13.009 5.795 1.00 0.00 H new ATOM 0 HB2 ALA B 883 -0.147 14.067 4.501 1.00 0.00 H new ATOM 0 HB3 ALA B 883 -1.837 14.205 5.041 1.00 0.00 H new ATOM 2485 N LYS B 884 -3.740 12.364 4.398 1.00 0.00 N ATOM 2486 CA LYS B 884 -4.950 11.735 4.821 1.00 0.00 C ATOM 2487 C LYS B 884 -5.351 10.590 3.886 1.00 0.00 C ATOM 2488 O LYS B 884 -5.767 9.533 4.360 1.00 0.00 O ATOM 2489 CB LYS B 884 -6.083 12.754 4.928 1.00 0.00 C ATOM 2490 CG LYS B 884 -7.416 12.103 5.166 1.00 0.00 C ATOM 2491 CD LYS B 884 -7.428 11.378 6.515 1.00 0.00 C ATOM 2492 CE LYS B 884 -8.682 10.561 6.727 1.00 0.00 C ATOM 2493 NZ LYS B 884 -9.888 11.381 6.902 1.00 0.00 N ATOM 0 H LYS B 884 -3.841 13.349 4.153 1.00 0.00 H new ATOM 0 HA LYS B 884 -4.766 11.310 5.808 1.00 0.00 H new ATOM 0 HB2 LYS B 884 -5.869 13.447 5.742 1.00 0.00 H new ATOM 0 HB3 LYS B 884 -6.127 13.342 4.011 1.00 0.00 H new ATOM 0 HG2 LYS B 884 -8.204 12.856 5.145 1.00 0.00 H new ATOM 0 HG3 LYS B 884 -7.630 11.396 4.365 1.00 0.00 H new ATOM 0 HD2 LYS B 884 -6.558 10.724 6.579 1.00 0.00 H new ATOM 0 HD3 LYS B 884 -7.336 12.110 7.317 1.00 0.00 H new ATOM 0 HE2 LYS B 884 -8.823 9.897 5.874 1.00 0.00 H new ATOM 0 HE3 LYS B 884 -8.551 9.928 7.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 884 -10.712 10.762 7.043 1.00 0.00 H new ATOM 0 HZ2 LYS B 884 -9.772 11.997 7.732 1.00 0.00 H new ATOM 0 HZ3 LYS B 884 -10.036 11.966 6.055 1.00 0.00 H new ATOM 2507 N GLN B 885 -5.195 10.806 2.575 1.00 0.00 N ATOM 2508 CA GLN B 885 -5.581 9.820 1.564 1.00 0.00 C ATOM 2509 C GLN B 885 -4.883 8.500 1.856 1.00 0.00 C ATOM 2510 O GLN B 885 -5.516 7.435 1.874 1.00 0.00 O ATOM 2511 CB GLN B 885 -5.172 10.275 0.168 1.00 0.00 C ATOM 2512 CG GLN B 885 -5.626 11.664 -0.266 1.00 0.00 C ATOM 2513 CD GLN B 885 -7.110 11.901 -0.155 1.00 0.00 C ATOM 2514 OE1 GLN B 885 -7.862 11.631 -1.084 1.00 0.00 O ATOM 2515 NE2 GLN B 885 -7.527 12.468 0.948 1.00 0.00 N ATOM 0 H GLN B 885 -4.800 11.664 2.189 1.00 0.00 H new ATOM 0 HA GLN B 885 -6.664 9.706 1.601 1.00 0.00 H new ATOM 0 HB2 GLN B 885 -4.084 10.238 0.104 1.00 0.00 H new ATOM 0 HB3 GLN B 885 -5.558 9.552 -0.551 1.00 0.00 H new ATOM 0 HG2 GLN B 885 -5.106 12.407 0.338 1.00 0.00 H new ATOM 0 HG3 GLN B 885 -5.322 11.825 -1.300 1.00 0.00 H new ATOM 0 HE21 GLN B 885 -6.866 12.675 1.697 1.00 0.00 H new ATOM 0 HE22 GLN B 885 -8.513 12.703 1.059 1.00 0.00 H new ATOM 2524 N LEU B 886 -3.583 8.596 2.110 1.00 0.00 N ATOM 2525 CA LEU B 886 -2.773 7.450 2.472 1.00 0.00 C ATOM 2526 C LEU B 886 -3.187 6.889 3.788 1.00 0.00 C ATOM 2527 O LEU B 886 -3.626 5.751 3.856 1.00 0.00 O ATOM 2528 CB LEU B 886 -1.290 7.798 2.535 1.00 0.00 C ATOM 2529 CG LEU B 886 -0.531 7.761 1.233 1.00 0.00 C ATOM 2530 CD1 LEU B 886 0.879 8.265 1.442 1.00 0.00 C ATOM 2531 CD2 LEU B 886 -0.495 6.348 0.701 1.00 0.00 C ATOM 0 H LEU B 886 -3.065 9.474 2.069 1.00 0.00 H new ATOM 0 HA LEU B 886 -2.930 6.707 1.691 1.00 0.00 H new ATOM 0 HB2 LEU B 886 -1.193 8.798 2.958 1.00 0.00 H new ATOM 0 HB3 LEU B 886 -0.808 7.110 3.230 1.00 0.00 H new ATOM 0 HG LEU B 886 -1.035 8.403 0.511 1.00 0.00 H new ATOM 0 HD11 LEU B 886 1.420 8.235 0.496 1.00 0.00 H new ATOM 0 HD12 LEU B 886 0.848 9.291 1.810 1.00 0.00 H new ATOM 0 HD13 LEU B 886 1.387 7.633 2.171 1.00 0.00 H new ATOM 0 HD21 LEU B 886 0.055 6.327 -0.240 1.00 0.00 H new ATOM 0 HD22 LEU B 886 -0.001 5.699 1.424 1.00 0.00 H new ATOM 0 HD23 LEU B 886 -1.513 5.996 0.534 1.00 0.00 H new ATOM 2543 N TYR B 887 -3.073 7.714 4.822 1.00 0.00 N ATOM 2544 CA TYR B 887 -3.328 7.322 6.200 1.00 0.00 C ATOM 2545 C TYR B 887 -4.634 6.551 6.342 1.00 0.00 C ATOM 2546 O TYR B 887 -4.638 5.429 6.868 1.00 0.00 O ATOM 2547 CB TYR B 887 -3.315 8.562 7.107 1.00 0.00 C ATOM 2548 CG TYR B 887 -3.690 8.288 8.541 1.00 0.00 C ATOM 2549 CD1 TYR B 887 -2.764 7.791 9.448 1.00 0.00 C ATOM 2550 CD2 TYR B 887 -4.986 8.512 8.977 1.00 0.00 C ATOM 2551 CE1 TYR B 887 -3.127 7.525 10.753 1.00 0.00 C ATOM 2552 CE2 TYR B 887 -5.356 8.258 10.269 1.00 0.00 C ATOM 2553 CZ TYR B 887 -4.425 7.757 11.158 1.00 0.00 C ATOM 2554 OH TYR B 887 -4.793 7.486 12.453 1.00 0.00 O ATOM 0 H TYR B 887 -2.796 8.691 4.723 1.00 0.00 H new ATOM 0 HA TYR B 887 -2.531 6.647 6.512 1.00 0.00 H new ATOM 0 HB2 TYR B 887 -2.319 9.005 7.083 1.00 0.00 H new ATOM 0 HB3 TYR B 887 -4.003 9.303 6.699 1.00 0.00 H new ATOM 0 HD1 TYR B 887 -1.748 7.610 9.129 1.00 0.00 H new ATOM 0 HD2 TYR B 887 -5.719 8.895 8.282 1.00 0.00 H new ATOM 0 HE1 TYR B 887 -2.400 7.138 11.452 1.00 0.00 H new ATOM 0 HE2 TYR B 887 -6.369 8.448 10.592 1.00 0.00 H new ATOM 0 HH TYR B 887 -5.740 7.705 12.577 1.00 0.00 H new ATOM 2564 N ASP B 888 -5.712 7.129 5.843 1.00 0.00 N ATOM 2565 CA ASP B 888 -7.026 6.507 5.909 1.00 0.00 C ATOM 2566 C ASP B 888 -7.051 5.194 5.173 1.00 0.00 C ATOM 2567 O ASP B 888 -7.437 4.206 5.740 1.00 0.00 O ATOM 2568 CB ASP B 888 -8.082 7.443 5.365 1.00 0.00 C ATOM 2569 CG ASP B 888 -9.505 6.914 5.485 1.00 0.00 C ATOM 2570 OD1 ASP B 888 -10.003 6.792 6.618 1.00 0.00 O ATOM 2571 OD2 ASP B 888 -10.162 6.660 4.449 1.00 0.00 O ATOM 0 H ASP B 888 -5.704 8.039 5.382 1.00 0.00 H new ATOM 0 HA ASP B 888 -7.246 6.303 6.957 1.00 0.00 H new ATOM 0 HB2 ASP B 888 -8.014 8.395 5.892 1.00 0.00 H new ATOM 0 HB3 ASP B 888 -7.868 7.644 4.315 1.00 0.00 H new ATOM 2576 N PHE B 889 -6.561 5.189 3.931 1.00 0.00 N ATOM 2577 CA PHE B 889 -6.544 3.991 3.089 1.00 0.00 C ATOM 2578 C PHE B 889 -5.787 2.848 3.746 1.00 0.00 C ATOM 2579 O PHE B 889 -6.260 1.707 3.782 1.00 0.00 O ATOM 2580 CB PHE B 889 -5.929 4.286 1.717 1.00 0.00 C ATOM 2581 CG PHE B 889 -5.665 3.044 0.909 1.00 0.00 C ATOM 2582 CD1 PHE B 889 -6.684 2.414 0.224 1.00 0.00 C ATOM 2583 CD2 PHE B 889 -4.390 2.497 0.865 1.00 0.00 C ATOM 2584 CE1 PHE B 889 -6.441 1.266 -0.492 1.00 0.00 C ATOM 2585 CE2 PHE B 889 -4.141 1.350 0.150 1.00 0.00 C ATOM 2586 CZ PHE B 889 -5.165 0.733 -0.526 1.00 0.00 C ATOM 0 H PHE B 889 -6.165 6.015 3.481 1.00 0.00 H new ATOM 0 HA PHE B 889 -7.583 3.688 2.958 1.00 0.00 H new ATOM 0 HB2 PHE B 889 -6.598 4.940 1.158 1.00 0.00 H new ATOM 0 HB3 PHE B 889 -4.994 4.829 1.854 1.00 0.00 H new ATOM 0 HD1 PHE B 889 -7.682 2.827 0.251 1.00 0.00 H new ATOM 0 HD2 PHE B 889 -3.584 2.978 1.399 1.00 0.00 H new ATOM 0 HE1 PHE B 889 -7.244 0.781 -1.027 1.00 0.00 H new ATOM 0 HE2 PHE B 889 -3.144 0.936 0.120 1.00 0.00 H new ATOM 0 HZ PHE B 889 -4.973 -0.171 -1.086 1.00 0.00 H new ATOM 2596 N ILE B 890 -4.616 3.165 4.251 1.00 0.00 N ATOM 2597 CA ILE B 890 -3.755 2.199 4.888 1.00 0.00 C ATOM 2598 C ILE B 890 -4.476 1.573 6.072 1.00 0.00 C ATOM 2599 O ILE B 890 -4.434 0.365 6.270 1.00 0.00 O ATOM 2600 CB ILE B 890 -2.428 2.876 5.364 1.00 0.00 C ATOM 2601 CG1 ILE B 890 -1.686 3.489 4.162 1.00 0.00 C ATOM 2602 CG2 ILE B 890 -1.537 1.868 6.084 1.00 0.00 C ATOM 2603 CD1 ILE B 890 -0.512 4.394 4.517 1.00 0.00 C ATOM 0 H ILE B 890 -4.233 4.110 4.230 1.00 0.00 H new ATOM 0 HA ILE B 890 -3.505 1.421 4.167 1.00 0.00 H new ATOM 0 HB ILE B 890 -2.677 3.672 6.066 1.00 0.00 H new ATOM 0 HG12 ILE B 890 -1.322 2.680 3.529 1.00 0.00 H new ATOM 0 HG13 ILE B 890 -2.399 4.062 3.569 1.00 0.00 H new ATOM 0 HG21 ILE B 890 -0.619 2.359 6.407 1.00 0.00 H new ATOM 0 HG22 ILE B 890 -2.063 1.474 6.954 1.00 0.00 H new ATOM 0 HG23 ILE B 890 -1.292 1.050 5.407 1.00 0.00 H new ATOM 0 HD11 ILE B 890 -0.057 4.775 3.603 1.00 0.00 H new ATOM 0 HD12 ILE B 890 -0.866 5.229 5.121 1.00 0.00 H new ATOM 0 HD13 ILE B 890 0.228 3.826 5.081 1.00 0.00 H new ATOM 2615 N HIS B 891 -5.225 2.387 6.765 1.00 0.00 N ATOM 2616 CA HIS B 891 -5.876 1.973 7.995 1.00 0.00 C ATOM 2617 C HIS B 891 -7.362 1.682 7.791 1.00 0.00 C ATOM 2618 O HIS B 891 -8.148 1.694 8.753 1.00 0.00 O ATOM 2619 CB HIS B 891 -5.690 3.046 9.072 1.00 0.00 C ATOM 2620 CG HIS B 891 -4.275 3.172 9.507 1.00 0.00 C ATOM 2621 ND1 HIS B 891 -3.345 3.899 8.825 1.00 0.00 N ATOM 2622 CD2 HIS B 891 -3.619 2.589 10.532 1.00 0.00 C ATOM 2623 CE1 HIS B 891 -2.176 3.735 9.418 1.00 0.00 C ATOM 2624 NE2 HIS B 891 -2.280 2.950 10.471 1.00 0.00 N ATOM 0 H HIS B 891 -5.406 3.355 6.500 1.00 0.00 H new ATOM 0 HA HIS B 891 -5.406 1.045 8.319 1.00 0.00 H new ATOM 0 HB2 HIS B 891 -6.036 4.006 8.689 1.00 0.00 H new ATOM 0 HB3 HIS B 891 -6.312 2.804 9.934 1.00 0.00 H new ATOM 0 HD1 HIS B 891 -3.521 4.471 7.999 1.00 0.00 H new ATOM 0 HD2 HIS B 891 -4.063 1.947 11.278 1.00 0.00 H new ATOM 0 HE1 HIS B 891 -1.254 4.186 9.083 1.00 0.00 H new ATOM 2632 N THR B 892 -7.755 1.394 6.569 1.00 0.00 N ATOM 2633 CA THR B 892 -9.141 1.154 6.298 1.00 0.00 C ATOM 2634 C THR B 892 -9.302 -0.115 5.444 1.00 0.00 C ATOM 2635 O THR B 892 -8.309 -0.685 4.957 1.00 0.00 O ATOM 2636 CB THR B 892 -9.802 2.398 5.600 1.00 0.00 C ATOM 2637 OG1 THR B 892 -11.225 2.371 5.752 1.00 0.00 O ATOM 2638 CG2 THR B 892 -9.483 2.437 4.112 1.00 0.00 C ATOM 0 H THR B 892 -7.137 1.323 5.761 1.00 0.00 H new ATOM 0 HA THR B 892 -9.658 0.998 7.245 1.00 0.00 H new ATOM 0 HB THR B 892 -9.391 3.284 6.083 1.00 0.00 H new ATOM 0 HG1 THR B 892 -11.616 3.155 5.312 1.00 0.00 H new ATOM 0 HG21 THR B 892 -9.956 3.310 3.661 1.00 0.00 H new ATOM 0 HG22 THR B 892 -8.404 2.497 3.973 1.00 0.00 H new ATOM 0 HG23 THR B 892 -9.861 1.533 3.635 1.00 0.00 H new ATOM 2646 N SER B 893 -10.519 -0.558 5.316 1.00 0.00 N ATOM 2647 CA SER B 893 -10.882 -1.697 4.533 1.00 0.00 C ATOM 2648 C SER B 893 -11.908 -1.249 3.511 1.00 0.00 C ATOM 2649 O SER B 893 -12.664 -0.310 3.753 1.00 0.00 O ATOM 2650 CB SER B 893 -11.509 -2.750 5.466 1.00 0.00 C ATOM 2651 OG SER B 893 -11.945 -3.914 4.769 1.00 0.00 O ATOM 0 H SER B 893 -11.316 -0.116 5.774 1.00 0.00 H new ATOM 0 HA SER B 893 -10.014 -2.125 4.031 1.00 0.00 H new ATOM 0 HB2 SER B 893 -10.780 -3.037 6.224 1.00 0.00 H new ATOM 0 HB3 SER B 893 -12.356 -2.307 5.990 1.00 0.00 H new ATOM 0 HG SER B 893 -11.242 -4.210 4.154 1.00 0.00 H new ATOM 2657 N PHE B 894 -11.965 -1.916 2.392 1.00 0.00 N ATOM 2658 CA PHE B 894 -12.970 -1.604 1.388 1.00 0.00 C ATOM 2659 C PHE B 894 -14.304 -2.190 1.864 1.00 0.00 C ATOM 2660 O PHE B 894 -15.374 -1.754 1.481 1.00 0.00 O ATOM 2661 CB PHE B 894 -12.586 -2.194 0.011 1.00 0.00 C ATOM 2662 CG PHE B 894 -12.778 -3.683 -0.104 1.00 0.00 C ATOM 2663 CD1 PHE B 894 -11.958 -4.565 0.581 1.00 0.00 C ATOM 2664 CD2 PHE B 894 -13.806 -4.193 -0.877 1.00 0.00 C ATOM 2665 CE1 PHE B 894 -12.161 -5.930 0.488 1.00 0.00 C ATOM 2666 CE2 PHE B 894 -14.015 -5.550 -0.973 1.00 0.00 C ATOM 2667 CZ PHE B 894 -13.190 -6.423 -0.291 1.00 0.00 C ATOM 0 H PHE B 894 -11.334 -2.678 2.143 1.00 0.00 H new ATOM 0 HA PHE B 894 -13.046 -0.524 1.266 1.00 0.00 H new ATOM 0 HB2 PHE B 894 -13.180 -1.703 -0.759 1.00 0.00 H new ATOM 0 HB3 PHE B 894 -11.542 -1.958 -0.193 1.00 0.00 H new ATOM 0 HD1 PHE B 894 -11.154 -4.184 1.193 1.00 0.00 H new ATOM 0 HD2 PHE B 894 -14.454 -3.516 -1.413 1.00 0.00 H new ATOM 0 HE1 PHE B 894 -11.516 -6.610 1.024 1.00 0.00 H new ATOM 0 HE2 PHE B 894 -14.822 -5.931 -1.580 1.00 0.00 H new ATOM 0 HZ PHE B 894 -13.349 -7.489 -0.367 1.00 0.00 H new