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 :FLIP amide:sc= -0.39 F(o=-5.5!,f=-2.6) USER MOD Set 1.2: B 850 LYS NZ :NH3+ -135:sc= -0.204 (180deg=0) USER MOD Set 1.3: B 851 ASN : amide:sc= -0.892 K(o=-2.6,f=-7) USER MOD Set 1.4: B 882 ASN : amide:sc= -1.13! C(o=-2.6!,f=-7!) USER MOD Single : A 233 SER OG : rot 180:sc= 0 USER MOD Single : A 236 THR OG1 : rot 78:sc= 1.14 USER MOD Single : A 238 CYS SG : rot -86:sc= 0.382 USER MOD Single : A 240 THR OG1 : rot 30:sc= 1.27 USER MOD Single : A 241 THR OG1 : rot -73:sc= 1.24 USER MOD Single : A 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot -130:sc= -0.0108 USER MOD Single : A 246 ASN : amide:sc= -0.924 K(o=-0.92,f=-9.5!) USER MOD Single : A 247 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 248 THR OG1 : rot 180:sc= 0 USER MOD Single : A 250 SER OG : rot 77:sc= -1.75! USER MOD Single : A 251 GLN :FLIP amide:sc= 0 F(o=-0.67,f=0) USER MOD Single : A 252 THR OG1 : rot 92:sc= 1.24 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 THR OG1 : rot -94:sc= 0.297 USER MOD Single : A 259 SER OG : rot 64:sc= 0.68 USER MOD Single : A 262 GLN : amide:sc= 0.952 K(o=0.95,f=-0.67) USER MOD Single : A 267 SER OG : rot 180:sc= -0.0684 USER MOD Single : A 274 CYS SG : rot -170:sc= -4.67! USER MOD Single : A 280 GLN : amide:sc= -0.0966 K(o=-0.097,f=-0.78) USER MOD Single : A 281 LYS NZ :NH3+ 162:sc= 1.23 (180deg=0.52!) USER MOD Single : A 290 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 833 TYR OH : rot -2:sc= 0.616 USER MOD Single : B 834 ASN : amide:sc= -2.23! X(o=-2.2!,f=-2) USER MOD Single : B 838 GLN : amide:sc= -0.379 K(o=-0.38,f=-1.5) USER MOD Single : B 843 LYS NZ :NH3+ -168:sc= 0.182 (180deg=-0.141) USER MOD Single : B 844 MET CE :methyl 167:sc= -0.309 (180deg=-0.52) USER MOD Single : B 852 CYS SG : rot 61:sc= -1.34! USER MOD Single : B 854 SER OG : rot 71:sc= 0.369 USER MOD Single : B 856 MET CE :methyl 163:sc= -0.146 (180deg=-0.58) USER MOD Single : B 857 HIS : no HE2:sc= 0.357 K(o=0.36,f=-6.3!) USER MOD Single : B 858 HIS :FLIP no HE2:sc= 0.118 F(o=-0.47,f=0.12) USER MOD Single : B 860 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 861 ASN : amide:sc= -4.89! C(o=-4.9!,f=-14!) USER MOD Single : B 869 SER OG : rot 180:sc= 0.0102 USER MOD Single : B 870 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : B 874 THR OG1 : rot 80:sc= 1.2 USER MOD Single : B 875 SER OG : rot 180:sc= 0 USER MOD Single : B 879 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 884 LYS NZ :NH3+ 149:sc= 1.23 (180deg=0.633) USER MOD Single : B 885 GLN : amide:sc= 0.465 X(o=0.47,f=0) USER MOD Single : B 887 TYR OH : rot 180:sc= 0 USER MOD Single : B 891 HIS : no HE2:sc= 0.984 K(o=0.98,f=-3.3!) USER MOD Single : B 892 THR OG1 : rot 180:sc= 0 USER MOD Single : B 893 SER OG : rot 180:sc= -1.15 USER MOD ----------------------------------------------------------------- ATOM 335 N ASP A 230 -12.546 2.549 -5.525 1.00 0.00 N ATOM 336 CA ASP A 230 -11.161 2.974 -5.469 1.00 0.00 C ATOM 337 C ASP A 230 -10.402 2.127 -4.476 1.00 0.00 C ATOM 338 O ASP A 230 -9.377 1.556 -4.815 1.00 0.00 O ATOM 339 CB ASP A 230 -11.033 4.462 -5.117 1.00 0.00 C ATOM 340 CG ASP A 230 -9.589 4.953 -5.163 1.00 0.00 C ATOM 341 OD1 ASP A 230 -9.118 5.363 -6.256 1.00 0.00 O ATOM 342 OD2 ASP A 230 -8.905 4.956 -4.136 1.00 0.00 O ATOM 0 HA ASP A 230 -10.729 2.839 -6.461 1.00 0.00 H new ATOM 0 HB2 ASP A 230 -11.635 5.049 -5.811 1.00 0.00 H new ATOM 0 HB3 ASP A 230 -11.439 4.632 -4.120 1.00 0.00 H new ATOM 347 N LEU A 231 -10.969 1.986 -3.278 1.00 0.00 N ATOM 348 CA LEU A 231 -10.361 1.222 -2.181 1.00 0.00 C ATOM 349 C LEU A 231 -9.961 -0.176 -2.583 1.00 0.00 C ATOM 350 O LEU A 231 -8.791 -0.556 -2.450 1.00 0.00 O ATOM 351 CB LEU A 231 -11.298 1.149 -0.977 1.00 0.00 C ATOM 352 CG LEU A 231 -11.472 2.439 -0.170 1.00 0.00 C ATOM 353 CD1 LEU A 231 -12.350 2.204 1.036 1.00 0.00 C ATOM 354 CD2 LEU A 231 -10.130 3.011 0.255 1.00 0.00 C ATOM 0 H LEU A 231 -11.869 2.400 -3.037 1.00 0.00 H new ATOM 0 HA LEU A 231 -9.453 1.763 -1.913 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -12.280 0.830 -1.327 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -10.931 0.373 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 231 -11.959 3.168 -0.817 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -12.459 3.134 1.594 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -13.331 1.859 0.710 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -11.894 1.449 1.676 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -10.289 3.926 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -9.604 2.284 0.874 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -9.533 3.234 -0.629 1.00 0.00 H new ATOM 366 N VAL A 232 -10.907 -0.919 -3.106 1.00 0.00 N ATOM 367 CA VAL A 232 -10.677 -2.287 -3.476 1.00 0.00 C ATOM 368 C VAL A 232 -9.634 -2.382 -4.581 1.00 0.00 C ATOM 369 O VAL A 232 -8.751 -3.238 -4.533 1.00 0.00 O ATOM 370 CB VAL A 232 -12.006 -3.018 -3.860 1.00 0.00 C ATOM 371 CG1 VAL A 232 -12.671 -2.418 -5.095 1.00 0.00 C ATOM 372 CG2 VAL A 232 -11.802 -4.509 -4.048 1.00 0.00 C ATOM 0 H VAL A 232 -11.855 -0.589 -3.285 1.00 0.00 H new ATOM 0 HA VAL A 232 -10.280 -2.805 -2.603 1.00 0.00 H new ATOM 0 HB VAL A 232 -12.679 -2.867 -3.016 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -13.588 -2.964 -5.316 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -12.908 -1.371 -4.908 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -11.992 -2.490 -5.945 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -12.751 -4.975 -4.314 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -11.078 -4.680 -4.845 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -11.430 -4.945 -3.121 1.00 0.00 H new ATOM 382 N SER A 233 -9.681 -1.455 -5.520 1.00 0.00 N ATOM 383 CA SER A 233 -8.758 -1.469 -6.608 1.00 0.00 C ATOM 384 C SER A 233 -7.341 -1.152 -6.102 1.00 0.00 C ATOM 385 O SER A 233 -6.395 -1.840 -6.461 1.00 0.00 O ATOM 386 CB SER A 233 -9.205 -0.500 -7.715 1.00 0.00 C ATOM 387 OG SER A 233 -8.413 -0.647 -8.894 1.00 0.00 O ATOM 0 H SER A 233 -10.354 -0.688 -5.539 1.00 0.00 H new ATOM 0 HA SER A 233 -8.739 -2.467 -7.046 1.00 0.00 H new ATOM 0 HB2 SER A 233 -10.253 -0.680 -7.955 1.00 0.00 H new ATOM 0 HB3 SER A 233 -9.132 0.525 -7.353 1.00 0.00 H new ATOM 0 HG SER A 233 -8.724 -0.018 -9.578 1.00 0.00 H new ATOM 393 N ARG A 234 -7.222 -0.154 -5.216 1.00 0.00 N ATOM 394 CA ARG A 234 -5.927 0.253 -4.657 1.00 0.00 C ATOM 395 C ARG A 234 -5.275 -0.900 -3.928 1.00 0.00 C ATOM 396 O ARG A 234 -4.130 -1.243 -4.216 1.00 0.00 O ATOM 397 CB ARG A 234 -6.071 1.410 -3.670 1.00 0.00 C ATOM 398 CG ARG A 234 -6.650 2.681 -4.215 1.00 0.00 C ATOM 399 CD ARG A 234 -5.790 3.281 -5.280 1.00 0.00 C ATOM 400 NE ARG A 234 -6.409 4.478 -5.830 1.00 0.00 N ATOM 401 CZ ARG A 234 -5.864 5.279 -6.737 1.00 0.00 C ATOM 402 NH1 ARG A 234 -4.646 5.033 -7.219 1.00 0.00 N ATOM 403 NH2 ARG A 234 -6.558 6.312 -7.183 1.00 0.00 N ATOM 0 H ARG A 234 -8.013 0.389 -4.870 1.00 0.00 H new ATOM 0 HA ARG A 234 -5.313 0.571 -5.499 1.00 0.00 H new ATOM 0 HB2 ARG A 234 -6.696 1.077 -2.842 1.00 0.00 H new ATOM 0 HB3 ARG A 234 -5.087 1.632 -3.257 1.00 0.00 H new ATOM 0 HG2 ARG A 234 -7.642 2.482 -4.620 1.00 0.00 H new ATOM 0 HG3 ARG A 234 -6.775 3.399 -3.404 1.00 0.00 H new ATOM 0 HD2 ARG A 234 -4.812 3.529 -4.868 1.00 0.00 H new ATOM 0 HD3 ARG A 234 -5.626 2.553 -6.074 1.00 0.00 H new ATOM 0 HE ARG A 234 -7.339 4.722 -5.490 1.00 0.00 H new ATOM 0 HH11 ARG A 234 -4.122 4.222 -6.891 1.00 0.00 H new ATOM 0 HH12 ARG A 234 -4.238 5.656 -7.916 1.00 0.00 H new ATOM 0 HH21 ARG A 234 -7.499 6.485 -6.830 1.00 0.00 H new ATOM 0 HH22 ARG A 234 -6.152 6.936 -7.880 1.00 0.00 H new ATOM 417 N VAL A 235 -6.028 -1.516 -2.999 1.00 0.00 N ATOM 418 CA VAL A 235 -5.495 -2.621 -2.206 1.00 0.00 C ATOM 419 C VAL A 235 -5.031 -3.741 -3.128 1.00 0.00 C ATOM 420 O VAL A 235 -3.921 -4.229 -2.992 1.00 0.00 O ATOM 421 CB VAL A 235 -6.511 -3.181 -1.139 1.00 0.00 C ATOM 422 CG1 VAL A 235 -5.862 -4.264 -0.287 1.00 0.00 C ATOM 423 CG2 VAL A 235 -7.030 -2.079 -0.236 1.00 0.00 C ATOM 0 H VAL A 235 -6.994 -1.267 -2.786 1.00 0.00 H new ATOM 0 HA VAL A 235 -4.652 -2.221 -1.642 1.00 0.00 H new ATOM 0 HB VAL A 235 -7.349 -3.608 -1.689 1.00 0.00 H new ATOM 0 HG11 VAL A 235 -6.583 -4.635 0.442 1.00 0.00 H new ATOM 0 HG12 VAL A 235 -5.538 -5.085 -0.927 1.00 0.00 H new ATOM 0 HG13 VAL A 235 -5.000 -3.849 0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 235 -7.728 -2.500 0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 235 -6.195 -1.617 0.291 1.00 0.00 H new ATOM 0 HG23 VAL A 235 -7.540 -1.326 -0.837 1.00 0.00 H new ATOM 433 N THR A 236 -5.858 -4.076 -4.116 1.00 0.00 N ATOM 434 CA THR A 236 -5.526 -5.127 -5.061 1.00 0.00 C ATOM 435 C THR A 236 -4.224 -4.787 -5.826 1.00 0.00 C ATOM 436 O THR A 236 -3.290 -5.598 -5.852 1.00 0.00 O ATOM 437 CB THR A 236 -6.674 -5.360 -6.067 1.00 0.00 C ATOM 438 OG1 THR A 236 -7.914 -5.548 -5.358 1.00 0.00 O ATOM 439 CG2 THR A 236 -6.418 -6.603 -6.894 1.00 0.00 C ATOM 0 H THR A 236 -6.762 -3.632 -4.279 1.00 0.00 H new ATOM 0 HA THR A 236 -5.375 -6.043 -4.489 1.00 0.00 H new ATOM 0 HB THR A 236 -6.730 -4.488 -6.718 1.00 0.00 H new ATOM 0 HG1 THR A 236 -8.259 -4.678 -5.066 1.00 0.00 H new ATOM 0 HG21 THR A 236 -7.239 -6.748 -7.596 1.00 0.00 H new ATOM 0 HG22 THR A 236 -5.485 -6.487 -7.446 1.00 0.00 H new ATOM 0 HG23 THR A 236 -6.346 -7.469 -6.236 1.00 0.00 H new ATOM 447 N GLU A 237 -4.155 -3.565 -6.385 1.00 0.00 N ATOM 448 CA GLU A 237 -2.989 -3.118 -7.146 1.00 0.00 C ATOM 449 C GLU A 237 -1.712 -3.230 -6.332 1.00 0.00 C ATOM 450 O GLU A 237 -0.699 -3.799 -6.804 1.00 0.00 O ATOM 451 CB GLU A 237 -3.147 -1.676 -7.641 1.00 0.00 C ATOM 452 CG GLU A 237 -4.260 -1.467 -8.653 1.00 0.00 C ATOM 453 CD GLU A 237 -4.138 -2.384 -9.836 1.00 0.00 C ATOM 454 OE1 GLU A 237 -3.076 -2.376 -10.505 1.00 0.00 O ATOM 455 OE2 GLU A 237 -5.111 -3.124 -10.132 1.00 0.00 O ATOM 0 H GLU A 237 -4.900 -2.872 -6.320 1.00 0.00 H new ATOM 0 HA GLU A 237 -2.919 -3.779 -8.010 1.00 0.00 H new ATOM 0 HB2 GLU A 237 -3.330 -1.030 -6.782 1.00 0.00 H new ATOM 0 HB3 GLU A 237 -2.205 -1.355 -8.086 1.00 0.00 H new ATOM 0 HG2 GLU A 237 -5.223 -1.629 -8.169 1.00 0.00 H new ATOM 0 HG3 GLU A 237 -4.246 -0.432 -8.996 1.00 0.00 H new ATOM 462 N CYS A 238 -1.772 -2.754 -5.102 1.00 0.00 N ATOM 463 CA CYS A 238 -0.630 -2.742 -4.238 1.00 0.00 C ATOM 464 C CYS A 238 -0.113 -4.138 -3.955 1.00 0.00 C ATOM 465 O CYS A 238 1.074 -4.350 -3.961 1.00 0.00 O ATOM 466 CB CYS A 238 -0.927 -1.992 -2.944 1.00 0.00 C ATOM 467 SG CYS A 238 -1.205 -0.222 -3.165 1.00 0.00 S ATOM 0 H CYS A 238 -2.618 -2.367 -4.684 1.00 0.00 H new ATOM 0 HA CYS A 238 0.162 -2.209 -4.764 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -1.808 -2.432 -2.476 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -0.095 -2.135 -2.255 1.00 0.00 H new ATOM 0 HG CYS A 238 -0.065 0.403 -3.138 1.00 0.00 H new ATOM 473 N LEU A 239 -0.997 -5.100 -3.801 1.00 0.00 N ATOM 474 CA LEU A 239 -0.566 -6.445 -3.454 1.00 0.00 C ATOM 475 C LEU A 239 -0.018 -7.142 -4.688 1.00 0.00 C ATOM 476 O LEU A 239 0.907 -7.945 -4.615 1.00 0.00 O ATOM 477 CB LEU A 239 -1.729 -7.273 -2.906 1.00 0.00 C ATOM 478 CG LEU A 239 -2.661 -6.601 -1.895 1.00 0.00 C ATOM 479 CD1 LEU A 239 -3.677 -7.565 -1.385 1.00 0.00 C ATOM 480 CD2 LEU A 239 -1.925 -5.950 -0.752 1.00 0.00 C ATOM 0 H LEU A 239 -2.005 -4.984 -3.908 1.00 0.00 H new ATOM 0 HA LEU A 239 0.205 -6.362 -2.688 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -2.333 -7.605 -3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -1.315 -8.167 -2.439 1.00 0.00 H new ATOM 0 HG LEU A 239 -3.169 -5.801 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -4.327 -7.063 -0.668 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -4.274 -7.938 -2.217 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -3.174 -8.399 -0.896 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -2.642 -5.492 -0.071 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -1.346 -6.702 -0.217 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -1.254 -5.184 -1.141 1.00 0.00 H new ATOM 492 N THR A 240 -0.566 -6.786 -5.822 1.00 0.00 N ATOM 493 CA THR A 240 -0.224 -7.434 -7.065 1.00 0.00 C ATOM 494 C THR A 240 0.960 -6.738 -7.751 1.00 0.00 C ATOM 495 O THR A 240 1.335 -7.069 -8.888 1.00 0.00 O ATOM 496 CB THR A 240 -1.456 -7.568 -8.014 1.00 0.00 C ATOM 497 OG1 THR A 240 -1.190 -8.529 -9.055 1.00 0.00 O ATOM 498 CG2 THR A 240 -1.811 -6.250 -8.662 1.00 0.00 C ATOM 0 H THR A 240 -1.259 -6.043 -5.911 1.00 0.00 H new ATOM 0 HA THR A 240 0.093 -8.449 -6.825 1.00 0.00 H new ATOM 0 HB THR A 240 -2.293 -7.898 -7.399 1.00 0.00 H new ATOM 0 HG1 THR A 240 -0.574 -9.213 -8.719 1.00 0.00 H new ATOM 0 HG21 THR A 240 -2.673 -6.386 -9.315 1.00 0.00 H new ATOM 0 HG22 THR A 240 -2.052 -5.518 -7.891 1.00 0.00 H new ATOM 0 HG23 THR A 240 -0.965 -5.893 -9.249 1.00 0.00 H new ATOM 506 N THR A 241 1.557 -5.777 -7.061 1.00 0.00 N ATOM 507 CA THR A 241 2.808 -5.196 -7.531 1.00 0.00 C ATOM 508 C THR A 241 3.907 -6.264 -7.481 1.00 0.00 C ATOM 509 O THR A 241 4.900 -6.207 -8.205 1.00 0.00 O ATOM 510 CB THR A 241 3.243 -4.023 -6.649 1.00 0.00 C ATOM 511 OG1 THR A 241 3.333 -4.447 -5.281 1.00 0.00 O ATOM 512 CG2 THR A 241 2.278 -2.870 -6.777 1.00 0.00 C ATOM 0 H THR A 241 1.203 -5.387 -6.187 1.00 0.00 H new ATOM 0 HA THR A 241 2.652 -4.837 -8.548 1.00 0.00 H new ATOM 0 HB THR A 241 4.224 -3.684 -6.982 1.00 0.00 H new ATOM 0 HG1 THR A 241 2.432 -4.564 -4.915 1.00 0.00 H new ATOM 0 HG21 THR A 241 2.607 -2.048 -6.141 1.00 0.00 H new ATOM 0 HG22 THR A 241 2.245 -2.536 -7.814 1.00 0.00 H new ATOM 0 HG23 THR A 241 1.284 -3.192 -6.468 1.00 0.00 H new ATOM 520 N VAL A 242 3.701 -7.250 -6.638 1.00 0.00 N ATOM 521 CA VAL A 242 4.595 -8.352 -6.539 1.00 0.00 C ATOM 522 C VAL A 242 4.360 -9.248 -7.741 1.00 0.00 C ATOM 523 O VAL A 242 3.264 -9.732 -7.947 1.00 0.00 O ATOM 524 CB VAL A 242 4.365 -9.164 -5.243 1.00 0.00 C ATOM 525 CG1 VAL A 242 5.418 -10.236 -5.081 1.00 0.00 C ATOM 526 CG2 VAL A 242 4.346 -8.256 -4.040 1.00 0.00 C ATOM 0 H VAL A 242 2.903 -7.299 -6.005 1.00 0.00 H new ATOM 0 HA VAL A 242 5.618 -7.978 -6.513 1.00 0.00 H new ATOM 0 HB VAL A 242 3.393 -9.652 -5.322 1.00 0.00 H new ATOM 0 HG11 VAL A 242 5.233 -10.792 -4.162 1.00 0.00 H new ATOM 0 HG12 VAL A 242 5.378 -10.917 -5.931 1.00 0.00 H new ATOM 0 HG13 VAL A 242 6.404 -9.773 -5.033 1.00 0.00 H new ATOM 0 HG21 VAL A 242 4.183 -8.848 -3.140 1.00 0.00 H new ATOM 0 HG22 VAL A 242 5.300 -7.734 -3.963 1.00 0.00 H new ATOM 0 HG23 VAL A 242 3.542 -7.528 -4.146 1.00 0.00 H new ATOM 536 N LYS A 243 5.397 -9.468 -8.512 1.00 0.00 N ATOM 537 CA LYS A 243 5.345 -10.260 -9.750 1.00 0.00 C ATOM 538 C LYS A 243 5.001 -11.746 -9.508 1.00 0.00 C ATOM 539 O LYS A 243 4.822 -12.524 -10.452 1.00 0.00 O ATOM 540 CB LYS A 243 6.688 -10.140 -10.445 1.00 0.00 C ATOM 541 CG LYS A 243 7.857 -10.709 -9.641 1.00 0.00 C ATOM 542 CD LYS A 243 9.190 -10.270 -10.214 1.00 0.00 C ATOM 543 CE LYS A 243 9.318 -10.623 -11.681 1.00 0.00 C ATOM 544 NZ LYS A 243 10.586 -10.142 -12.253 1.00 0.00 N ATOM 0 H LYS A 243 6.326 -9.101 -8.306 1.00 0.00 H new ATOM 0 HA LYS A 243 4.542 -9.864 -10.372 1.00 0.00 H new ATOM 0 HB2 LYS A 243 6.636 -10.654 -11.405 1.00 0.00 H new ATOM 0 HB3 LYS A 243 6.883 -9.089 -10.657 1.00 0.00 H new ATOM 0 HG2 LYS A 243 7.780 -10.382 -8.604 1.00 0.00 H new ATOM 0 HG3 LYS A 243 7.802 -11.798 -9.637 1.00 0.00 H new ATOM 0 HD2 LYS A 243 9.302 -9.193 -10.089 1.00 0.00 H new ATOM 0 HD3 LYS A 243 9.998 -10.742 -9.655 1.00 0.00 H new ATOM 0 HE2 LYS A 243 9.253 -11.704 -11.801 1.00 0.00 H new ATOM 0 HE3 LYS A 243 8.484 -10.190 -12.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 10.635 -10.404 -13.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 10.638 -9.107 -12.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 11.383 -10.575 -11.744 1.00 0.00 H new ATOM 558 N SER A 244 4.958 -12.133 -8.269 1.00 0.00 N ATOM 559 CA SER A 244 4.609 -13.470 -7.895 1.00 0.00 C ATOM 560 C SER A 244 3.114 -13.525 -7.536 1.00 0.00 C ATOM 561 O SER A 244 2.502 -14.590 -7.523 1.00 0.00 O ATOM 562 CB SER A 244 5.453 -13.857 -6.691 1.00 0.00 C ATOM 563 OG SER A 244 6.818 -13.510 -6.913 1.00 0.00 O ATOM 0 H SER A 244 5.167 -11.522 -7.480 1.00 0.00 H new ATOM 0 HA SER A 244 4.795 -14.162 -8.716 1.00 0.00 H new ATOM 0 HB2 SER A 244 5.082 -13.350 -5.800 1.00 0.00 H new ATOM 0 HB3 SER A 244 5.368 -14.928 -6.508 1.00 0.00 H new ATOM 0 HG SER A 244 7.388 -14.281 -6.713 1.00 0.00 H new ATOM 569 N VAL A 245 2.540 -12.364 -7.279 1.00 0.00 N ATOM 570 CA VAL A 245 1.162 -12.247 -6.847 1.00 0.00 C ATOM 571 C VAL A 245 0.271 -11.747 -7.991 1.00 0.00 C ATOM 572 O VAL A 245 0.459 -10.644 -8.516 1.00 0.00 O ATOM 573 CB VAL A 245 1.062 -11.289 -5.620 1.00 0.00 C ATOM 574 CG1 VAL A 245 -0.375 -11.075 -5.185 1.00 0.00 C ATOM 575 CG2 VAL A 245 1.874 -11.837 -4.460 1.00 0.00 C ATOM 0 H VAL A 245 3.022 -11.469 -7.365 1.00 0.00 H new ATOM 0 HA VAL A 245 0.810 -13.235 -6.551 1.00 0.00 H new ATOM 0 HB VAL A 245 1.466 -10.324 -5.926 1.00 0.00 H new ATOM 0 HG11 VAL A 245 -0.399 -10.402 -4.328 1.00 0.00 H new ATOM 0 HG12 VAL A 245 -0.942 -10.637 -6.006 1.00 0.00 H new ATOM 0 HG13 VAL A 245 -0.817 -12.032 -4.908 1.00 0.00 H new ATOM 0 HG21 VAL A 245 1.796 -11.160 -3.610 1.00 0.00 H new ATOM 0 HG22 VAL A 245 1.491 -12.818 -4.179 1.00 0.00 H new ATOM 0 HG23 VAL A 245 2.919 -11.927 -4.758 1.00 0.00 H new ATOM 585 N ASN A 246 -0.675 -12.562 -8.371 1.00 0.00 N ATOM 586 CA ASN A 246 -1.646 -12.236 -9.421 1.00 0.00 C ATOM 587 C ASN A 246 -2.768 -11.435 -8.794 1.00 0.00 C ATOM 588 O ASN A 246 -2.902 -11.414 -7.566 1.00 0.00 O ATOM 589 CB ASN A 246 -2.247 -13.543 -9.978 1.00 0.00 C ATOM 590 CG ASN A 246 -3.235 -13.365 -11.139 1.00 0.00 C ATOM 591 OD1 ASN A 246 -4.432 -13.185 -10.943 1.00 0.00 O ATOM 592 ND2 ASN A 246 -2.759 -13.419 -12.311 1.00 0.00 N ATOM 0 H ASN A 246 -0.809 -13.488 -7.964 1.00 0.00 H new ATOM 0 HA ASN A 246 -1.160 -11.675 -10.219 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -1.432 -14.186 -10.311 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -2.754 -14.065 -9.167 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -3.375 -13.312 -13.117 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -1.760 -13.570 -12.449 1.00 0.00 H new ATOM 599 N LYS A 247 -3.589 -10.808 -9.611 1.00 0.00 N ATOM 600 CA LYS A 247 -4.757 -10.097 -9.122 1.00 0.00 C ATOM 601 C LYS A 247 -5.704 -11.042 -8.340 1.00 0.00 C ATOM 602 O LYS A 247 -6.363 -10.620 -7.380 1.00 0.00 O ATOM 603 CB LYS A 247 -5.516 -9.408 -10.274 1.00 0.00 C ATOM 604 CG LYS A 247 -6.789 -8.682 -9.828 1.00 0.00 C ATOM 605 CD LYS A 247 -7.572 -8.080 -10.987 1.00 0.00 C ATOM 606 CE LYS A 247 -6.825 -6.946 -11.659 1.00 0.00 C ATOM 607 NZ LYS A 247 -7.579 -6.393 -12.806 1.00 0.00 N ATOM 0 H LYS A 247 -3.469 -10.775 -10.623 1.00 0.00 H new ATOM 0 HA LYS A 247 -4.404 -9.326 -8.438 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -4.851 -8.692 -10.758 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -5.779 -10.156 -11.022 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -7.429 -9.381 -9.290 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -6.522 -7.890 -9.128 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -7.785 -8.857 -11.721 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -8.532 -7.714 -10.623 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -6.636 -6.155 -10.933 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -5.854 -7.303 -12.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -7.035 -5.620 -13.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -7.737 -7.141 -13.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -8.495 -6.029 -12.476 1.00 0.00 H new ATOM 621 N THR A 248 -5.697 -12.334 -8.687 1.00 0.00 N ATOM 622 CA THR A 248 -6.598 -13.270 -8.037 1.00 0.00 C ATOM 623 C THR A 248 -6.059 -13.549 -6.644 1.00 0.00 C ATOM 624 O THR A 248 -6.805 -13.688 -5.666 1.00 0.00 O ATOM 625 CB THR A 248 -6.799 -14.601 -8.858 1.00 0.00 C ATOM 626 OG1 THR A 248 -7.788 -15.433 -8.235 1.00 0.00 O ATOM 627 CG2 THR A 248 -5.504 -15.400 -8.993 1.00 0.00 C ATOM 0 H THR A 248 -5.090 -12.741 -9.398 1.00 0.00 H new ATOM 0 HA THR A 248 -7.590 -12.821 -7.977 1.00 0.00 H new ATOM 0 HB THR A 248 -7.128 -14.304 -9.854 1.00 0.00 H new ATOM 0 HG1 THR A 248 -7.901 -16.254 -8.758 1.00 0.00 H new ATOM 0 HG21 THR A 248 -5.694 -16.307 -9.566 1.00 0.00 H new ATOM 0 HG22 THR A 248 -4.756 -14.796 -9.507 1.00 0.00 H new ATOM 0 HG23 THR A 248 -5.136 -15.667 -8.002 1.00 0.00 H new ATOM 635 N ASP A 249 -4.752 -13.514 -6.560 1.00 0.00 N ATOM 636 CA ASP A 249 -4.054 -13.707 -5.339 1.00 0.00 C ATOM 637 C ASP A 249 -4.327 -12.537 -4.442 1.00 0.00 C ATOM 638 O ASP A 249 -4.715 -12.700 -3.296 1.00 0.00 O ATOM 639 CB ASP A 249 -2.554 -13.802 -5.584 1.00 0.00 C ATOM 640 CG ASP A 249 -2.093 -15.047 -6.276 1.00 0.00 C ATOM 641 OD1 ASP A 249 -2.364 -16.146 -5.793 1.00 0.00 O ATOM 642 OD2 ASP A 249 -1.390 -14.942 -7.278 1.00 0.00 O ATOM 0 H ASP A 249 -4.143 -13.346 -7.361 1.00 0.00 H new ATOM 0 HA ASP A 249 -4.392 -14.636 -4.879 1.00 0.00 H new ATOM 0 HB2 ASP A 249 -2.245 -12.941 -6.177 1.00 0.00 H new ATOM 0 HB3 ASP A 249 -2.041 -13.729 -4.625 1.00 0.00 H new ATOM 647 N SER A 250 -4.182 -11.352 -5.004 1.00 0.00 N ATOM 648 CA SER A 250 -4.398 -10.115 -4.298 1.00 0.00 C ATOM 649 C SER A 250 -5.787 -10.051 -3.690 1.00 0.00 C ATOM 650 O SER A 250 -5.908 -9.835 -2.500 1.00 0.00 O ATOM 651 CB SER A 250 -4.174 -8.957 -5.240 1.00 0.00 C ATOM 652 OG SER A 250 -2.899 -9.057 -5.820 1.00 0.00 O ATOM 0 H SER A 250 -3.907 -11.226 -5.978 1.00 0.00 H new ATOM 0 HA SER A 250 -3.686 -10.058 -3.475 1.00 0.00 H new ATOM 0 HB2 SER A 250 -4.938 -8.955 -6.017 1.00 0.00 H new ATOM 0 HB3 SER A 250 -4.266 -8.014 -4.701 1.00 0.00 H new ATOM 0 HG SER A 250 -2.913 -9.737 -6.526 1.00 0.00 H new ATOM 658 N GLN A 251 -6.832 -10.308 -4.483 1.00 0.00 N ATOM 659 CA GLN A 251 -8.203 -10.229 -3.963 1.00 0.00 C ATOM 660 C GLN A 251 -8.425 -11.255 -2.847 1.00 0.00 C ATOM 661 O GLN A 251 -9.244 -11.045 -1.952 1.00 0.00 O ATOM 662 CB GLN A 251 -9.267 -10.386 -5.050 1.00 0.00 C ATOM 663 CG GLN A 251 -9.342 -11.767 -5.679 1.00 0.00 C ATOM 664 CD GLN A 251 -10.500 -11.910 -6.651 1.00 0.00 C ATOM 665 OE1 GLN A 251 -10.887 -10.838 -7.292 1.00 0.00 O flip ATOM 666 NE2 GLN A 251 -11.052 -12.995 -6.816 1.00 0.00 N flip ATOM 0 H GLN A 251 -6.760 -10.567 -5.467 1.00 0.00 H new ATOM 0 HA GLN A 251 -8.316 -9.225 -3.554 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -10.240 -10.144 -4.623 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -9.073 -9.655 -5.835 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -8.408 -11.974 -6.201 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -9.440 -12.515 -4.892 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -10.729 -13.815 -6.302 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -11.833 -13.076 -7.467 1.00 0.00 H new ATOM 675 N THR A 252 -7.695 -12.358 -2.906 1.00 0.00 N ATOM 676 CA THR A 252 -7.750 -13.348 -1.856 1.00 0.00 C ATOM 677 C THR A 252 -7.187 -12.731 -0.537 1.00 0.00 C ATOM 678 O THR A 252 -7.730 -12.937 0.548 1.00 0.00 O ATOM 679 CB THR A 252 -6.987 -14.634 -2.253 1.00 0.00 C ATOM 680 OG1 THR A 252 -7.478 -15.099 -3.527 1.00 0.00 O ATOM 681 CG2 THR A 252 -7.233 -15.725 -1.238 1.00 0.00 C ATOM 0 H THR A 252 -7.060 -12.585 -3.671 1.00 0.00 H new ATOM 0 HA THR A 252 -8.788 -13.638 -1.694 1.00 0.00 H new ATOM 0 HB THR A 252 -5.922 -14.406 -2.301 1.00 0.00 H new ATOM 0 HG1 THR A 252 -6.933 -14.718 -4.247 1.00 0.00 H new ATOM 0 HG21 THR A 252 -6.690 -16.624 -1.531 1.00 0.00 H new ATOM 0 HG22 THR A 252 -6.887 -15.395 -0.258 1.00 0.00 H new ATOM 0 HG23 THR A 252 -8.300 -15.945 -1.191 1.00 0.00 H new ATOM 689 N LEU A 253 -6.155 -11.896 -0.660 1.00 0.00 N ATOM 690 CA LEU A 253 -5.631 -11.165 0.494 1.00 0.00 C ATOM 691 C LEU A 253 -6.643 -10.101 0.937 1.00 0.00 C ATOM 692 O LEU A 253 -6.742 -9.757 2.125 1.00 0.00 O ATOM 693 CB LEU A 253 -4.264 -10.506 0.222 1.00 0.00 C ATOM 694 CG LEU A 253 -2.990 -11.367 0.315 1.00 0.00 C ATOM 695 CD1 LEU A 253 -2.909 -12.133 1.628 1.00 0.00 C ATOM 696 CD2 LEU A 253 -2.838 -12.283 -0.862 1.00 0.00 C ATOM 0 H LEU A 253 -5.669 -11.710 -1.538 1.00 0.00 H new ATOM 0 HA LEU A 253 -5.477 -11.895 1.289 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -4.299 -10.076 -0.779 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -4.153 -9.677 0.921 1.00 0.00 H new ATOM 0 HG LEU A 253 -2.150 -10.673 0.294 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -1.994 -12.726 1.648 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -2.903 -11.429 2.460 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -3.771 -12.794 1.718 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -1.926 -12.869 -0.751 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -3.696 -12.953 -0.915 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -2.782 -11.693 -1.777 1.00 0.00 H new ATOM 708 N LEU A 254 -7.419 -9.613 -0.014 1.00 0.00 N ATOM 709 CA LEU A 254 -8.452 -8.645 0.282 1.00 0.00 C ATOM 710 C LEU A 254 -9.606 -9.272 1.050 1.00 0.00 C ATOM 711 O LEU A 254 -10.207 -8.638 1.879 1.00 0.00 O ATOM 712 CB LEU A 254 -9.018 -7.948 -0.961 1.00 0.00 C ATOM 713 CG LEU A 254 -8.260 -6.737 -1.494 1.00 0.00 C ATOM 714 CD1 LEU A 254 -7.092 -7.086 -2.360 1.00 0.00 C ATOM 715 CD2 LEU A 254 -9.189 -5.779 -2.172 1.00 0.00 C ATOM 0 H LEU A 254 -7.351 -9.873 -0.998 1.00 0.00 H new ATOM 0 HA LEU A 254 -7.956 -7.892 0.895 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -9.080 -8.685 -1.761 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -10.038 -7.635 -0.736 1.00 0.00 H new ATOM 0 HG LEU A 254 -7.830 -6.242 -0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -6.605 -6.172 -2.700 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -6.382 -7.685 -1.789 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -7.436 -7.656 -3.223 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -8.623 -4.924 -2.543 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -9.681 -6.278 -3.007 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -9.940 -5.436 -1.461 1.00 0.00 H new ATOM 727 N THR A 255 -9.918 -10.508 0.773 1.00 0.00 N ATOM 728 CA THR A 255 -11.022 -11.130 1.462 1.00 0.00 C ATOM 729 C THR A 255 -10.594 -11.633 2.861 1.00 0.00 C ATOM 730 O THR A 255 -11.433 -11.804 3.757 1.00 0.00 O ATOM 731 CB THR A 255 -11.711 -12.240 0.599 1.00 0.00 C ATOM 732 OG1 THR A 255 -12.909 -12.705 1.230 1.00 0.00 O ATOM 733 CG2 THR A 255 -10.784 -13.415 0.354 1.00 0.00 C ATOM 0 H THR A 255 -9.438 -11.096 0.092 1.00 0.00 H new ATOM 0 HA THR A 255 -11.784 -10.367 1.620 1.00 0.00 H new ATOM 0 HB THR A 255 -11.959 -11.788 -0.361 1.00 0.00 H new ATOM 0 HG1 THR A 255 -13.324 -13.397 0.674 1.00 0.00 H new ATOM 0 HG21 THR A 255 -11.298 -14.164 -0.248 1.00 0.00 H new ATOM 0 HG22 THR A 255 -9.894 -13.073 -0.174 1.00 0.00 H new ATOM 0 HG23 THR A 255 -10.493 -13.854 1.308 1.00 0.00 H new ATOM 741 N THR A 256 -9.296 -11.851 3.058 1.00 0.00 N ATOM 742 CA THR A 256 -8.824 -12.242 4.355 1.00 0.00 C ATOM 743 C THR A 256 -8.602 -11.009 5.275 1.00 0.00 C ATOM 744 O THR A 256 -9.133 -10.968 6.387 1.00 0.00 O ATOM 745 CB THR A 256 -7.578 -13.199 4.296 1.00 0.00 C ATOM 746 OG1 THR A 256 -7.253 -13.689 5.600 1.00 0.00 O ATOM 747 CG2 THR A 256 -6.381 -12.525 3.700 1.00 0.00 C ATOM 0 H THR A 256 -8.575 -11.762 2.342 1.00 0.00 H new ATOM 0 HA THR A 256 -9.615 -12.838 4.811 1.00 0.00 H new ATOM 0 HB THR A 256 -7.851 -14.035 3.653 1.00 0.00 H new ATOM 0 HG1 THR A 256 -6.567 -13.117 6.003 1.00 0.00 H new ATOM 0 HG21 THR A 256 -5.544 -13.222 3.679 1.00 0.00 H new ATOM 0 HG22 THR A 256 -6.612 -12.204 2.684 1.00 0.00 H new ATOM 0 HG23 THR A 256 -6.115 -11.657 4.303 1.00 0.00 H new ATOM 755 N PHE A 257 -7.895 -9.968 4.803 1.00 0.00 N ATOM 756 CA PHE A 257 -7.604 -8.829 5.701 1.00 0.00 C ATOM 757 C PHE A 257 -8.311 -7.540 5.270 1.00 0.00 C ATOM 758 O PHE A 257 -8.598 -6.680 6.099 1.00 0.00 O ATOM 759 CB PHE A 257 -6.091 -8.571 5.762 1.00 0.00 C ATOM 760 CG PHE A 257 -5.266 -9.806 5.971 1.00 0.00 C ATOM 761 CD1 PHE A 257 -5.553 -10.689 6.998 1.00 0.00 C ATOM 762 CD2 PHE A 257 -4.217 -10.094 5.119 1.00 0.00 C ATOM 763 CE1 PHE A 257 -4.813 -11.833 7.168 1.00 0.00 C ATOM 764 CE2 PHE A 257 -3.468 -11.238 5.288 1.00 0.00 C ATOM 765 CZ PHE A 257 -3.768 -12.112 6.313 1.00 0.00 C ATOM 0 H PHE A 257 -7.529 -9.887 3.855 1.00 0.00 H new ATOM 0 HA PHE A 257 -7.983 -9.106 6.685 1.00 0.00 H new ATOM 0 HB2 PHE A 257 -5.778 -8.091 4.835 1.00 0.00 H new ATOM 0 HB3 PHE A 257 -5.885 -7.869 6.570 1.00 0.00 H new ATOM 0 HD1 PHE A 257 -6.368 -10.475 7.673 1.00 0.00 H new ATOM 0 HD2 PHE A 257 -3.982 -9.415 4.312 1.00 0.00 H new ATOM 0 HE1 PHE A 257 -5.050 -12.515 7.972 1.00 0.00 H new ATOM 0 HE2 PHE A 257 -2.647 -11.451 4.619 1.00 0.00 H new ATOM 0 HZ PHE A 257 -3.186 -13.012 6.445 1.00 0.00 H new ATOM 775 N GLY A 258 -8.601 -7.439 3.983 1.00 0.00 N ATOM 776 CA GLY A 258 -9.319 -6.293 3.374 1.00 0.00 C ATOM 777 C GLY A 258 -8.747 -4.896 3.612 1.00 0.00 C ATOM 778 O GLY A 258 -9.392 -3.901 3.250 1.00 0.00 O ATOM 0 H GLY A 258 -8.346 -8.157 3.305 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -9.366 -6.459 2.298 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -10.345 -6.304 3.743 1.00 0.00 H new ATOM 782 N SER A 259 -7.568 -4.814 4.168 1.00 0.00 N ATOM 783 CA SER A 259 -6.940 -3.563 4.462 1.00 0.00 C ATOM 784 C SER A 259 -5.447 -3.722 4.266 1.00 0.00 C ATOM 785 O SER A 259 -4.930 -4.853 4.321 1.00 0.00 O ATOM 786 CB SER A 259 -7.251 -3.147 5.904 1.00 0.00 C ATOM 787 OG SER A 259 -6.696 -1.881 6.204 1.00 0.00 O ATOM 0 H SER A 259 -7.013 -5.628 4.431 1.00 0.00 H new ATOM 0 HA SER A 259 -7.317 -2.786 3.797 1.00 0.00 H new ATOM 0 HB2 SER A 259 -8.331 -3.118 6.052 1.00 0.00 H new ATOM 0 HB3 SER A 259 -6.855 -3.893 6.593 1.00 0.00 H new ATOM 0 HG SER A 259 -7.116 -1.198 5.641 1.00 0.00 H new ATOM 793 N LEU A 260 -4.751 -2.623 4.053 1.00 0.00 N ATOM 794 CA LEU A 260 -3.335 -2.687 3.834 1.00 0.00 C ATOM 795 C LEU A 260 -2.599 -2.763 5.171 1.00 0.00 C ATOM 796 O LEU A 260 -1.614 -3.479 5.276 1.00 0.00 O ATOM 797 CB LEU A 260 -2.863 -1.512 2.948 1.00 0.00 C ATOM 798 CG LEU A 260 -1.442 -1.605 2.331 1.00 0.00 C ATOM 799 CD1 LEU A 260 -1.328 -0.628 1.199 1.00 0.00 C ATOM 800 CD2 LEU A 260 -0.348 -1.302 3.351 1.00 0.00 C ATOM 0 H LEU A 260 -5.148 -1.684 4.028 1.00 0.00 H new ATOM 0 HA LEU A 260 -3.094 -3.598 3.286 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -3.577 -1.398 2.132 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -2.912 -0.601 3.544 1.00 0.00 H new ATOM 0 HG LEU A 260 -1.304 -2.628 1.981 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -0.331 -0.691 0.763 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -2.072 -0.864 0.438 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -1.498 0.382 1.572 1.00 0.00 H new ATOM 0 HD21 LEU A 260 0.628 -1.380 2.872 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -0.482 -0.292 3.739 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -0.407 -2.017 4.171 1.00 0.00 H new ATOM 812 N GLU A 261 -3.098 -2.060 6.204 1.00 0.00 N ATOM 813 CA GLU A 261 -2.478 -2.121 7.553 1.00 0.00 C ATOM 814 C GLU A 261 -2.394 -3.564 8.052 1.00 0.00 C ATOM 815 O GLU A 261 -1.393 -3.989 8.595 1.00 0.00 O ATOM 816 CB GLU A 261 -3.228 -1.256 8.592 1.00 0.00 C ATOM 817 CG GLU A 261 -4.720 -1.543 8.690 1.00 0.00 C ATOM 818 CD GLU A 261 -5.367 -0.982 9.931 1.00 0.00 C ATOM 819 OE1 GLU A 261 -5.071 0.153 10.324 1.00 0.00 O ATOM 820 OE2 GLU A 261 -6.161 -1.717 10.577 1.00 0.00 O ATOM 0 H GLU A 261 -3.914 -1.451 6.140 1.00 0.00 H new ATOM 0 HA GLU A 261 -1.473 -1.714 7.446 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -2.775 -1.412 9.571 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -3.088 -0.205 8.340 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -5.218 -1.130 7.813 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -4.875 -2.622 8.666 1.00 0.00 H new ATOM 827 N GLN A 262 -3.432 -4.313 7.789 1.00 0.00 N ATOM 828 CA GLN A 262 -3.534 -5.694 8.213 1.00 0.00 C ATOM 829 C GLN A 262 -2.628 -6.589 7.387 1.00 0.00 C ATOM 830 O GLN A 262 -2.190 -7.629 7.855 1.00 0.00 O ATOM 831 CB GLN A 262 -4.984 -6.146 8.121 1.00 0.00 C ATOM 832 CG GLN A 262 -5.911 -5.325 8.999 1.00 0.00 C ATOM 833 CD GLN A 262 -5.554 -5.441 10.466 1.00 0.00 C ATOM 834 OE1 GLN A 262 -5.084 -6.484 10.924 1.00 0.00 O ATOM 835 NE2 GLN A 262 -5.715 -4.379 11.201 1.00 0.00 N ATOM 0 H GLN A 262 -4.244 -3.982 7.268 1.00 0.00 H new ATOM 0 HA GLN A 262 -3.204 -5.771 9.249 1.00 0.00 H new ATOM 0 HB2 GLN A 262 -5.316 -6.078 7.085 1.00 0.00 H new ATOM 0 HB3 GLN A 262 -5.052 -7.195 8.409 1.00 0.00 H new ATOM 0 HG2 GLN A 262 -5.865 -4.279 8.696 1.00 0.00 H new ATOM 0 HG3 GLN A 262 -6.939 -5.655 8.849 1.00 0.00 H new ATOM 0 HE21 GLN A 262 -6.107 -3.531 10.792 1.00 0.00 H new ATOM 0 HE22 GLN A 262 -5.449 -4.395 12.186 1.00 0.00 H new ATOM 844 N LEU A 263 -2.328 -6.142 6.189 1.00 0.00 N ATOM 845 CA LEU A 263 -1.487 -6.873 5.254 1.00 0.00 C ATOM 846 C LEU A 263 -0.037 -6.681 5.665 1.00 0.00 C ATOM 847 O LEU A 263 0.715 -7.631 5.796 1.00 0.00 O ATOM 848 CB LEU A 263 -1.708 -6.294 3.837 1.00 0.00 C ATOM 849 CG LEU A 263 -1.398 -7.183 2.611 1.00 0.00 C ATOM 850 CD1 LEU A 263 0.084 -7.502 2.469 1.00 0.00 C ATOM 851 CD2 LEU A 263 -2.218 -8.452 2.649 1.00 0.00 C ATOM 0 H LEU A 263 -2.663 -5.249 5.827 1.00 0.00 H new ATOM 0 HA LEU A 263 -1.734 -7.935 5.257 1.00 0.00 H new ATOM 0 HB2 LEU A 263 -2.751 -5.986 3.766 1.00 0.00 H new ATOM 0 HB3 LEU A 263 -1.103 -5.392 3.751 1.00 0.00 H new ATOM 0 HG LEU A 263 -1.678 -6.607 1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 263 0.239 -8.129 1.591 1.00 0.00 H new ATOM 0 HD12 LEU A 263 0.647 -6.575 2.357 1.00 0.00 H new ATOM 0 HD13 LEU A 263 0.429 -8.031 3.357 1.00 0.00 H new ATOM 0 HD21 LEU A 263 -1.984 -9.063 1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 263 -1.984 -9.010 3.556 1.00 0.00 H new ATOM 0 HD23 LEU A 263 -3.279 -8.200 2.642 1.00 0.00 H new ATOM 863 N ILE A 264 0.332 -5.440 5.880 1.00 0.00 N ATOM 864 CA ILE A 264 1.686 -5.101 6.254 1.00 0.00 C ATOM 865 C ILE A 264 2.007 -5.627 7.661 1.00 0.00 C ATOM 866 O ILE A 264 3.122 -6.063 7.929 1.00 0.00 O ATOM 867 CB ILE A 264 1.969 -3.553 6.064 1.00 0.00 C ATOM 868 CG1 ILE A 264 3.436 -3.135 6.365 1.00 0.00 C ATOM 869 CG2 ILE A 264 1.002 -2.712 6.870 1.00 0.00 C ATOM 870 CD1 ILE A 264 3.794 -3.009 7.842 1.00 0.00 C ATOM 0 H ILE A 264 -0.295 -4.639 5.801 1.00 0.00 H new ATOM 0 HA ILE A 264 2.377 -5.604 5.578 1.00 0.00 H new ATOM 0 HB ILE A 264 1.811 -3.362 5.003 1.00 0.00 H new ATOM 0 HG12 ILE A 264 4.104 -3.865 5.908 1.00 0.00 H new ATOM 0 HG13 ILE A 264 3.630 -2.178 5.880 1.00 0.00 H new ATOM 0 HG21 ILE A 264 1.224 -1.656 6.717 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -0.018 -2.919 6.546 1.00 0.00 H new ATOM 0 HG23 ILE A 264 1.103 -2.955 7.928 1.00 0.00 H new ATOM 0 HD11 ILE A 264 4.839 -2.713 7.939 1.00 0.00 H new ATOM 0 HD12 ILE A 264 3.159 -2.255 8.307 1.00 0.00 H new ATOM 0 HD13 ILE A 264 3.641 -3.968 8.337 1.00 0.00 H new ATOM 882 N ALA A 265 1.011 -5.639 8.532 1.00 0.00 N ATOM 883 CA ALA A 265 1.189 -6.142 9.888 1.00 0.00 C ATOM 884 C ALA A 265 1.099 -7.674 9.930 1.00 0.00 C ATOM 885 O ALA A 265 1.155 -8.292 11.011 1.00 0.00 O ATOM 886 CB ALA A 265 0.162 -5.522 10.819 1.00 0.00 C ATOM 0 H ALA A 265 0.069 -5.306 8.326 1.00 0.00 H new ATOM 0 HA ALA A 265 2.186 -5.858 10.225 1.00 0.00 H new ATOM 0 HB1 ALA A 265 0.307 -5.907 11.828 1.00 0.00 H new ATOM 0 HB2 ALA A 265 0.282 -4.439 10.823 1.00 0.00 H new ATOM 0 HB3 ALA A 265 -0.841 -5.775 10.475 1.00 0.00 H new ATOM 892 N ALA A 266 0.964 -8.280 8.778 1.00 0.00 N ATOM 893 CA ALA A 266 0.888 -9.702 8.671 1.00 0.00 C ATOM 894 C ALA A 266 2.276 -10.270 8.388 1.00 0.00 C ATOM 895 O ALA A 266 3.096 -9.641 7.713 1.00 0.00 O ATOM 896 CB ALA A 266 -0.096 -10.079 7.576 1.00 0.00 C ATOM 0 H ALA A 266 0.904 -7.790 7.885 1.00 0.00 H new ATOM 0 HA ALA A 266 0.532 -10.126 9.610 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -0.153 -11.165 7.496 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -1.081 -9.681 7.819 1.00 0.00 H new ATOM 0 HB3 ALA A 266 0.239 -9.662 6.626 1.00 0.00 H new ATOM 902 N SER A 267 2.561 -11.404 8.953 1.00 0.00 N ATOM 903 CA SER A 267 3.811 -12.069 8.739 1.00 0.00 C ATOM 904 C SER A 267 3.581 -13.142 7.679 1.00 0.00 C ATOM 905 O SER A 267 2.443 -13.304 7.215 1.00 0.00 O ATOM 906 CB SER A 267 4.290 -12.687 10.069 1.00 0.00 C ATOM 907 OG SER A 267 5.551 -13.342 9.938 1.00 0.00 O ATOM 0 H SER A 267 1.927 -11.898 9.581 1.00 0.00 H new ATOM 0 HA SER A 267 4.582 -11.378 8.397 1.00 0.00 H new ATOM 0 HB2 SER A 267 4.366 -11.905 10.824 1.00 0.00 H new ATOM 0 HB3 SER A 267 3.547 -13.401 10.424 1.00 0.00 H new ATOM 0 HG SER A 267 5.816 -13.717 10.804 1.00 0.00 H new ATOM 913 N ARG A 268 4.630 -13.886 7.296 1.00 0.00 N ATOM 914 CA ARG A 268 4.470 -14.962 6.312 1.00 0.00 C ATOM 915 C ARG A 268 3.425 -15.949 6.767 1.00 0.00 C ATOM 916 O ARG A 268 2.645 -16.414 5.977 1.00 0.00 O ATOM 917 CB ARG A 268 5.751 -15.739 6.023 1.00 0.00 C ATOM 918 CG ARG A 268 6.790 -15.078 5.156 1.00 0.00 C ATOM 919 CD ARG A 268 7.643 -14.118 5.912 1.00 0.00 C ATOM 920 NE ARG A 268 8.322 -14.749 7.059 1.00 0.00 N ATOM 921 CZ ARG A 268 9.568 -14.454 7.469 1.00 0.00 C ATOM 922 NH1 ARG A 268 10.341 -13.635 6.756 1.00 0.00 N ATOM 923 NH2 ARG A 268 10.062 -15.025 8.554 1.00 0.00 N ATOM 0 H ARG A 268 5.580 -13.765 7.646 1.00 0.00 H new ATOM 0 HA ARG A 268 4.170 -14.457 5.393 1.00 0.00 H new ATOM 0 HB2 ARG A 268 6.217 -15.984 6.977 1.00 0.00 H new ATOM 0 HB3 ARG A 268 5.472 -16.682 5.553 1.00 0.00 H new ATOM 0 HG2 ARG A 268 7.422 -15.843 4.706 1.00 0.00 H new ATOM 0 HG3 ARG A 268 6.295 -14.553 4.339 1.00 0.00 H new ATOM 0 HD2 ARG A 268 8.389 -13.693 5.241 1.00 0.00 H new ATOM 0 HD3 ARG A 268 7.027 -13.292 6.268 1.00 0.00 H new ATOM 0 HE ARG A 268 7.809 -15.461 7.579 1.00 0.00 H new ATOM 0 HH11 ARG A 268 9.989 -13.226 5.891 1.00 0.00 H new ATOM 0 HH12 ARG A 268 11.285 -13.418 7.076 1.00 0.00 H new ATOM 0 HH21 ARG A 268 9.498 -15.691 9.082 1.00 0.00 H new ATOM 0 HH22 ARG A 268 11.008 -14.800 8.863 1.00 0.00 H new ATOM 937 N GLU A 269 3.405 -16.234 8.061 1.00 0.00 N ATOM 938 CA GLU A 269 2.433 -17.157 8.629 1.00 0.00 C ATOM 939 C GLU A 269 0.990 -16.686 8.382 1.00 0.00 C ATOM 940 O GLU A 269 0.118 -17.483 8.054 1.00 0.00 O ATOM 941 CB GLU A 269 2.678 -17.352 10.130 1.00 0.00 C ATOM 942 CG GLU A 269 2.665 -16.064 10.936 1.00 0.00 C ATOM 943 CD GLU A 269 2.713 -16.302 12.413 1.00 0.00 C ATOM 944 OE1 GLU A 269 1.645 -16.434 13.039 1.00 0.00 O ATOM 945 OE2 GLU A 269 3.825 -16.338 12.987 1.00 0.00 O ATOM 0 H GLU A 269 4.054 -15.837 8.740 1.00 0.00 H new ATOM 0 HA GLU A 269 2.564 -18.115 8.125 1.00 0.00 H new ATOM 0 HB2 GLU A 269 1.916 -18.023 10.527 1.00 0.00 H new ATOM 0 HB3 GLU A 269 3.641 -17.844 10.269 1.00 0.00 H new ATOM 0 HG2 GLU A 269 3.517 -15.450 10.644 1.00 0.00 H new ATOM 0 HG3 GLU A 269 1.766 -15.498 10.693 1.00 0.00 H new ATOM 952 N ASP A 270 0.772 -15.386 8.475 1.00 0.00 N ATOM 953 CA ASP A 270 -0.559 -14.806 8.334 1.00 0.00 C ATOM 954 C ASP A 270 -0.922 -14.731 6.871 1.00 0.00 C ATOM 955 O ASP A 270 -2.054 -14.974 6.483 1.00 0.00 O ATOM 956 CB ASP A 270 -0.610 -13.400 8.930 1.00 0.00 C ATOM 957 CG ASP A 270 -0.170 -13.317 10.367 1.00 0.00 C ATOM 958 OD1 ASP A 270 -0.942 -13.682 11.280 1.00 0.00 O ATOM 959 OD2 ASP A 270 0.959 -12.854 10.612 1.00 0.00 O ATOM 0 H ASP A 270 1.508 -14.702 8.650 1.00 0.00 H new ATOM 0 HA ASP A 270 -1.266 -15.440 8.869 1.00 0.00 H new ATOM 0 HB2 ASP A 270 0.020 -12.742 8.331 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -1.630 -13.023 8.853 1.00 0.00 H new ATOM 964 N LEU A 271 0.056 -14.427 6.056 1.00 0.00 N ATOM 965 CA LEU A 271 -0.140 -14.333 4.624 1.00 0.00 C ATOM 966 C LEU A 271 -0.371 -15.728 4.018 1.00 0.00 C ATOM 967 O LEU A 271 -1.154 -15.890 3.096 1.00 0.00 O ATOM 968 CB LEU A 271 1.061 -13.638 3.984 1.00 0.00 C ATOM 969 CG LEU A 271 1.357 -12.211 4.472 1.00 0.00 C ATOM 970 CD1 LEU A 271 2.662 -11.707 3.899 1.00 0.00 C ATOM 971 CD2 LEU A 271 0.225 -11.269 4.099 1.00 0.00 C ATOM 0 H LEU A 271 1.010 -14.237 6.362 1.00 0.00 H new ATOM 0 HA LEU A 271 -1.030 -13.737 4.421 1.00 0.00 H new ATOM 0 HB2 LEU A 271 1.945 -14.251 4.159 1.00 0.00 H new ATOM 0 HB3 LEU A 271 0.904 -13.606 2.906 1.00 0.00 H new ATOM 0 HG LEU A 271 1.443 -12.240 5.558 1.00 0.00 H new ATOM 0 HD11 LEU A 271 2.850 -10.695 4.258 1.00 0.00 H new ATOM 0 HD12 LEU A 271 3.475 -12.361 4.214 1.00 0.00 H new ATOM 0 HD13 LEU A 271 2.603 -11.700 2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 271 0.456 -10.265 4.454 1.00 0.00 H new ATOM 0 HD22 LEU A 271 0.107 -11.253 3.015 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -0.701 -11.613 4.559 1.00 0.00 H new ATOM 983 N ALA A 272 0.289 -16.730 4.572 1.00 0.00 N ATOM 984 CA ALA A 272 0.128 -18.103 4.121 1.00 0.00 C ATOM 985 C ALA A 272 -1.063 -18.767 4.812 1.00 0.00 C ATOM 986 O ALA A 272 -1.458 -19.872 4.457 1.00 0.00 O ATOM 987 CB ALA A 272 1.400 -18.902 4.358 1.00 0.00 C ATOM 0 H ALA A 272 0.948 -16.617 5.342 1.00 0.00 H new ATOM 0 HA ALA A 272 -0.068 -18.085 3.049 1.00 0.00 H new ATOM 0 HB1 ALA A 272 1.256 -19.926 4.013 1.00 0.00 H new ATOM 0 HB2 ALA A 272 2.224 -18.446 3.808 1.00 0.00 H new ATOM 0 HB3 ALA A 272 1.633 -18.907 5.423 1.00 0.00 H new ATOM 993 N LEU A 273 -1.619 -18.090 5.820 1.00 0.00 N ATOM 994 CA LEU A 273 -2.812 -18.538 6.514 1.00 0.00 C ATOM 995 C LEU A 273 -3.962 -18.394 5.597 1.00 0.00 C ATOM 996 O LEU A 273 -4.911 -19.207 5.619 1.00 0.00 O ATOM 997 CB LEU A 273 -3.003 -17.561 7.698 1.00 0.00 C ATOM 998 CG LEU A 273 -4.338 -17.493 8.494 1.00 0.00 C ATOM 999 CD1 LEU A 273 -5.553 -16.941 7.725 1.00 0.00 C ATOM 1000 CD2 LEU A 273 -4.621 -18.765 9.249 1.00 0.00 C ATOM 0 H LEU A 273 -1.245 -17.210 6.174 1.00 0.00 H new ATOM 0 HA LEU A 273 -2.733 -19.573 6.846 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -2.216 -17.781 8.419 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -2.813 -16.559 7.314 1.00 0.00 H new ATOM 0 HG LEU A 273 -4.164 -16.717 9.240 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -6.426 -16.940 8.377 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -5.344 -15.923 7.397 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -5.750 -17.569 6.856 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -5.563 -18.666 9.788 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -4.689 -19.597 8.548 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -3.815 -18.954 9.959 1.00 0.00 H new ATOM 1012 N CYS A 274 -3.862 -17.361 4.799 1.00 0.00 N ATOM 1013 CA CYS A 274 -4.864 -16.965 3.864 1.00 0.00 C ATOM 1014 C CYS A 274 -5.309 -18.192 3.028 1.00 0.00 C ATOM 1015 O CYS A 274 -4.448 -18.984 2.578 1.00 0.00 O ATOM 1016 CB CYS A 274 -4.315 -15.832 2.981 1.00 0.00 C ATOM 1017 SG CYS A 274 -5.440 -15.182 1.731 1.00 0.00 S ATOM 0 H CYS A 274 -3.043 -16.753 4.789 1.00 0.00 H new ATOM 0 HA CYS A 274 -5.743 -16.587 4.386 1.00 0.00 H new ATOM 0 HB2 CYS A 274 -4.010 -15.010 3.629 1.00 0.00 H new ATOM 0 HB3 CYS A 274 -3.417 -16.193 2.480 1.00 0.00 H new ATOM 0 HG CYS A 274 -4.789 -14.390 0.931 1.00 0.00 H new ATOM 1023 N PRO A 275 -6.630 -18.378 2.829 1.00 0.00 N ATOM 1024 CA PRO A 275 -7.169 -19.605 2.222 1.00 0.00 C ATOM 1025 C PRO A 275 -6.645 -19.878 0.801 1.00 0.00 C ATOM 1026 O PRO A 275 -6.896 -19.099 -0.131 1.00 0.00 O ATOM 1027 CB PRO A 275 -8.692 -19.368 2.206 1.00 0.00 C ATOM 1028 CG PRO A 275 -8.862 -17.884 2.322 1.00 0.00 C ATOM 1029 CD PRO A 275 -7.696 -17.387 3.125 1.00 0.00 C ATOM 0 HA PRO A 275 -6.864 -20.485 2.788 1.00 0.00 H new ATOM 0 HB2 PRO A 275 -9.139 -19.744 1.286 1.00 0.00 H new ATOM 0 HB3 PRO A 275 -9.179 -19.886 3.032 1.00 0.00 H new ATOM 0 HG2 PRO A 275 -8.883 -17.417 1.337 1.00 0.00 H new ATOM 0 HG3 PRO A 275 -9.804 -17.638 2.812 1.00 0.00 H new ATOM 0 HD2 PRO A 275 -7.403 -16.380 2.828 1.00 0.00 H new ATOM 0 HD3 PRO A 275 -7.927 -17.351 4.190 1.00 0.00 H new ATOM 1037 N GLY A 276 -5.918 -21.003 0.670 1.00 0.00 N ATOM 1038 CA GLY A 276 -5.354 -21.490 -0.593 1.00 0.00 C ATOM 1039 C GLY A 276 -4.686 -20.420 -1.435 1.00 0.00 C ATOM 1040 O GLY A 276 -4.867 -20.389 -2.661 1.00 0.00 O ATOM 0 H GLY A 276 -5.704 -21.610 1.461 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -4.625 -22.271 -0.374 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -6.150 -21.951 -1.178 1.00 0.00 H new ATOM 1044 N LEU A 277 -3.904 -19.564 -0.820 1.00 0.00 N ATOM 1045 CA LEU A 277 -3.360 -18.452 -1.550 1.00 0.00 C ATOM 1046 C LEU A 277 -1.892 -18.655 -1.962 1.00 0.00 C ATOM 1047 O LEU A 277 -1.559 -18.515 -3.157 1.00 0.00 O ATOM 1048 CB LEU A 277 -3.559 -17.192 -0.638 1.00 0.00 C ATOM 1049 CG LEU A 277 -2.895 -15.841 -0.992 1.00 0.00 C ATOM 1050 CD1 LEU A 277 -1.422 -15.785 -0.575 1.00 0.00 C ATOM 1051 CD2 LEU A 277 -3.050 -15.532 -2.463 1.00 0.00 C ATOM 0 H LEU A 277 -3.637 -19.616 0.163 1.00 0.00 H new ATOM 0 HA LEU A 277 -3.880 -18.334 -2.501 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -4.632 -17.013 -0.571 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -3.218 -17.464 0.361 1.00 0.00 H new ATOM 0 HG LEU A 277 -3.416 -15.074 -0.419 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -1.004 -14.816 -0.846 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -1.343 -15.925 0.503 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -0.869 -16.574 -1.085 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -2.575 -14.577 -2.686 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -2.578 -16.319 -3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -4.109 -15.477 -2.714 1.00 0.00 H new ATOM 1063 N GLY A 278 -1.019 -18.980 -1.042 1.00 0.00 N ATOM 1064 CA GLY A 278 0.326 -19.226 -1.464 1.00 0.00 C ATOM 1065 C GLY A 278 1.349 -19.093 -0.369 1.00 0.00 C ATOM 1066 O GLY A 278 1.391 -18.047 0.281 1.00 0.00 O ATOM 0 H GLY A 278 -1.206 -19.076 -0.044 1.00 0.00 H new ATOM 0 HA2 GLY A 278 0.386 -20.231 -1.882 1.00 0.00 H new ATOM 0 HA3 GLY A 278 0.576 -18.532 -2.266 1.00 0.00 H new ATOM 1070 N PRO A 279 2.205 -20.071 -0.134 1.00 0.00 N ATOM 1071 CA PRO A 279 3.301 -19.891 0.806 1.00 0.00 C ATOM 1072 C PRO A 279 4.413 -18.968 0.219 1.00 0.00 C ATOM 1073 O PRO A 279 4.979 -18.116 0.925 1.00 0.00 O ATOM 1074 CB PRO A 279 3.822 -21.311 1.042 1.00 0.00 C ATOM 1075 CG PRO A 279 3.408 -22.081 -0.172 1.00 0.00 C ATOM 1076 CD PRO A 279 2.144 -21.442 -0.679 1.00 0.00 C ATOM 0 HA PRO A 279 2.983 -19.403 1.727 1.00 0.00 H new ATOM 0 HB2 PRO A 279 4.905 -21.319 1.164 1.00 0.00 H new ATOM 0 HB3 PRO A 279 3.396 -21.743 1.948 1.00 0.00 H new ATOM 0 HG2 PRO A 279 4.188 -22.053 -0.933 1.00 0.00 H new ATOM 0 HG3 PRO A 279 3.240 -23.130 0.073 1.00 0.00 H new ATOM 0 HD2 PRO A 279 2.105 -21.439 -1.768 1.00 0.00 H new ATOM 0 HD3 PRO A 279 1.258 -21.973 -0.330 1.00 0.00 H new ATOM 1084 N GLN A 280 4.674 -19.091 -1.091 1.00 0.00 N ATOM 1085 CA GLN A 280 5.730 -18.303 -1.737 1.00 0.00 C ATOM 1086 C GLN A 280 5.261 -16.862 -1.849 1.00 0.00 C ATOM 1087 O GLN A 280 6.063 -15.924 -1.791 1.00 0.00 O ATOM 1088 CB GLN A 280 6.025 -18.827 -3.137 1.00 0.00 C ATOM 1089 CG GLN A 280 7.380 -18.410 -3.702 1.00 0.00 C ATOM 1090 CD GLN A 280 8.561 -19.014 -2.957 1.00 0.00 C ATOM 1091 OE1 GLN A 280 8.464 -20.084 -2.360 1.00 0.00 O ATOM 1092 NE2 GLN A 280 9.695 -18.375 -3.049 1.00 0.00 N ATOM 0 H GLN A 280 4.173 -19.722 -1.717 1.00 0.00 H new ATOM 0 HA GLN A 280 6.637 -18.376 -1.137 1.00 0.00 H new ATOM 0 HB2 GLN A 280 5.973 -19.916 -3.121 1.00 0.00 H new ATOM 0 HB3 GLN A 280 5.243 -18.480 -3.812 1.00 0.00 H new ATOM 0 HG2 GLN A 280 7.433 -18.704 -4.750 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.459 -17.323 -3.671 1.00 0.00 H new ATOM 0 HE21 GLN A 280 9.742 -17.489 -3.552 1.00 0.00 H new ATOM 0 HE22 GLN A 280 10.535 -18.762 -2.618 1.00 0.00 H new ATOM 1101 N LYS A 281 3.942 -16.707 -1.993 1.00 0.00 N ATOM 1102 CA LYS A 281 3.293 -15.396 -2.092 1.00 0.00 C ATOM 1103 C LYS A 281 3.593 -14.613 -0.825 1.00 0.00 C ATOM 1104 O LYS A 281 3.998 -13.462 -0.881 1.00 0.00 O ATOM 1105 CB LYS A 281 1.771 -15.563 -2.208 1.00 0.00 C ATOM 1106 CG LYS A 281 1.308 -16.519 -3.296 1.00 0.00 C ATOM 1107 CD LYS A 281 1.518 -16.000 -4.693 1.00 0.00 C ATOM 1108 CE LYS A 281 1.197 -17.087 -5.714 1.00 0.00 C ATOM 1109 NZ LYS A 281 -0.180 -17.644 -5.565 1.00 0.00 N ATOM 0 H LYS A 281 3.291 -17.491 -2.044 1.00 0.00 H new ATOM 0 HA LYS A 281 3.668 -14.876 -2.973 1.00 0.00 H new ATOM 0 HB2 LYS A 281 1.385 -15.913 -1.250 1.00 0.00 H new ATOM 0 HB3 LYS A 281 1.327 -14.585 -2.392 1.00 0.00 H new ATOM 0 HG2 LYS A 281 1.840 -17.464 -3.186 1.00 0.00 H new ATOM 0 HG3 LYS A 281 0.248 -16.731 -3.153 1.00 0.00 H new ATOM 0 HD2 LYS A 281 0.883 -15.131 -4.865 1.00 0.00 H new ATOM 0 HD3 LYS A 281 2.550 -15.670 -4.815 1.00 0.00 H new ATOM 0 HE2 LYS A 281 1.310 -16.678 -6.718 1.00 0.00 H new ATOM 0 HE3 LYS A 281 1.922 -17.895 -5.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -0.452 -18.137 -6.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -0.199 -18.314 -4.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -0.850 -16.870 -5.382 1.00 0.00 H new ATOM 1123 N ALA A 282 3.420 -15.291 0.308 1.00 0.00 N ATOM 1124 CA ALA A 282 3.680 -14.755 1.623 1.00 0.00 C ATOM 1125 C ALA A 282 5.119 -14.287 1.751 1.00 0.00 C ATOM 1126 O ALA A 282 5.386 -13.245 2.349 1.00 0.00 O ATOM 1127 CB ALA A 282 3.385 -15.819 2.666 1.00 0.00 C ATOM 0 H ALA A 282 3.085 -16.254 0.326 1.00 0.00 H new ATOM 0 HA ALA A 282 3.033 -13.893 1.781 1.00 0.00 H new ATOM 0 HB1 ALA A 282 3.580 -15.418 3.660 1.00 0.00 H new ATOM 0 HB2 ALA A 282 2.339 -16.119 2.594 1.00 0.00 H new ATOM 0 HB3 ALA A 282 4.023 -16.685 2.493 1.00 0.00 H new ATOM 1133 N ARG A 283 6.043 -15.061 1.183 1.00 0.00 N ATOM 1134 CA ARG A 283 7.463 -14.702 1.217 1.00 0.00 C ATOM 1135 C ARG A 283 7.666 -13.377 0.480 1.00 0.00 C ATOM 1136 O ARG A 283 8.151 -12.410 1.049 1.00 0.00 O ATOM 1137 CB ARG A 283 8.348 -15.779 0.549 1.00 0.00 C ATOM 1138 CG ARG A 283 8.072 -17.216 0.972 1.00 0.00 C ATOM 1139 CD ARG A 283 8.129 -17.416 2.488 1.00 0.00 C ATOM 1140 NE ARG A 283 9.439 -17.106 3.074 1.00 0.00 N ATOM 1141 CZ ARG A 283 9.750 -17.267 4.371 1.00 0.00 C ATOM 1142 NH1 ARG A 283 8.883 -17.852 5.204 1.00 0.00 N ATOM 1143 NH2 ARG A 283 10.934 -16.871 4.817 1.00 0.00 N ATOM 0 H ARG A 283 5.838 -15.934 0.697 1.00 0.00 H new ATOM 0 HA ARG A 283 7.758 -14.618 2.263 1.00 0.00 H new ATOM 0 HB2 ARG A 283 8.223 -15.707 -0.531 1.00 0.00 H new ATOM 0 HB3 ARG A 283 9.392 -15.550 0.765 1.00 0.00 H new ATOM 0 HG2 ARG A 283 7.088 -17.513 0.609 1.00 0.00 H new ATOM 0 HG3 ARG A 283 8.799 -17.875 0.497 1.00 0.00 H new ATOM 0 HD2 ARG A 283 7.373 -16.787 2.957 1.00 0.00 H new ATOM 0 HD3 ARG A 283 7.872 -18.450 2.719 1.00 0.00 H new ATOM 0 HE ARG A 283 10.163 -16.743 2.454 1.00 0.00 H new ATOM 0 HH11 ARG A 283 7.982 -18.178 4.855 1.00 0.00 H new ATOM 0 HH12 ARG A 283 9.123 -17.972 6.188 1.00 0.00 H new ATOM 0 HH21 ARG A 283 11.604 -16.446 4.176 1.00 0.00 H new ATOM 0 HH22 ARG A 283 11.175 -16.991 5.801 1.00 0.00 H new ATOM 1157 N ARG A 284 7.268 -13.361 -0.792 1.00 0.00 N ATOM 1158 CA ARG A 284 7.367 -12.214 -1.660 1.00 0.00 C ATOM 1159 C ARG A 284 6.672 -10.968 -1.114 1.00 0.00 C ATOM 1160 O ARG A 284 7.206 -9.873 -1.229 1.00 0.00 O ATOM 1161 CB ARG A 284 6.806 -12.601 -3.000 1.00 0.00 C ATOM 1162 CG ARG A 284 7.498 -13.803 -3.622 1.00 0.00 C ATOM 1163 CD ARG A 284 8.912 -13.481 -4.085 1.00 0.00 C ATOM 1164 NE ARG A 284 9.873 -13.041 -3.026 1.00 0.00 N ATOM 1165 CZ ARG A 284 10.830 -13.816 -2.478 1.00 0.00 C ATOM 1166 NH1 ARG A 284 10.899 -15.089 -2.803 1.00 0.00 N ATOM 1167 NH2 ARG A 284 11.727 -13.306 -1.623 1.00 0.00 N ATOM 0 H ARG A 284 6.858 -14.175 -1.249 1.00 0.00 H new ATOM 0 HA ARG A 284 8.418 -11.936 -1.740 1.00 0.00 H new ATOM 0 HB2 ARG A 284 5.744 -12.819 -2.891 1.00 0.00 H new ATOM 0 HB3 ARG A 284 6.889 -11.752 -3.679 1.00 0.00 H new ATOM 0 HG2 ARG A 284 7.532 -14.615 -2.896 1.00 0.00 H new ATOM 0 HG3 ARG A 284 6.912 -14.158 -4.470 1.00 0.00 H new ATOM 0 HD2 ARG A 284 9.322 -14.365 -4.573 1.00 0.00 H new ATOM 0 HD3 ARG A 284 8.854 -12.698 -4.841 1.00 0.00 H new ATOM 0 HE ARG A 284 9.798 -12.080 -2.693 1.00 0.00 H new ATOM 0 HH11 ARG A 284 10.231 -15.483 -3.466 1.00 0.00 H new ATOM 0 HH12 ARG A 284 11.620 -15.682 -2.392 1.00 0.00 H new ATOM 0 HH21 ARG A 284 11.692 -12.317 -1.377 1.00 0.00 H new ATOM 0 HH22 ARG A 284 12.444 -13.907 -1.218 1.00 0.00 H new ATOM 1181 N LEU A 285 5.492 -11.136 -0.554 1.00 0.00 N ATOM 1182 CA LEU A 285 4.775 -10.035 0.067 1.00 0.00 C ATOM 1183 C LEU A 285 5.585 -9.421 1.196 1.00 0.00 C ATOM 1184 O LEU A 285 5.877 -8.241 1.166 1.00 0.00 O ATOM 1185 CB LEU A 285 3.410 -10.485 0.583 1.00 0.00 C ATOM 1186 CG LEU A 285 2.315 -10.713 -0.466 1.00 0.00 C ATOM 1187 CD1 LEU A 285 1.082 -11.311 0.189 1.00 0.00 C ATOM 1188 CD2 LEU A 285 1.947 -9.398 -1.146 1.00 0.00 C ATOM 0 H LEU A 285 5.004 -12.031 -0.515 1.00 0.00 H new ATOM 0 HA LEU A 285 4.619 -9.275 -0.699 1.00 0.00 H new ATOM 0 HB2 LEU A 285 3.546 -11.413 1.139 1.00 0.00 H new ATOM 0 HB3 LEU A 285 3.052 -9.738 1.291 1.00 0.00 H new ATOM 0 HG LEU A 285 2.695 -11.405 -1.217 1.00 0.00 H new ATOM 0 HD11 LEU A 285 0.310 -11.469 -0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 285 1.341 -12.265 0.649 1.00 0.00 H new ATOM 0 HD13 LEU A 285 0.709 -10.629 0.953 1.00 0.00 H new ATOM 0 HD21 LEU A 285 1.169 -9.577 -1.888 1.00 0.00 H new ATOM 0 HD22 LEU A 285 1.582 -8.692 -0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 285 2.827 -8.983 -1.637 1.00 0.00 H new ATOM 1200 N PHE A 286 5.993 -10.247 2.148 1.00 0.00 N ATOM 1201 CA PHE A 286 6.758 -9.793 3.312 1.00 0.00 C ATOM 1202 C PHE A 286 8.067 -9.127 2.850 1.00 0.00 C ATOM 1203 O PHE A 286 8.506 -8.092 3.392 1.00 0.00 O ATOM 1204 CB PHE A 286 7.072 -11.008 4.186 1.00 0.00 C ATOM 1205 CG PHE A 286 7.550 -10.672 5.559 1.00 0.00 C ATOM 1206 CD1 PHE A 286 8.882 -10.405 5.810 1.00 0.00 C ATOM 1207 CD2 PHE A 286 6.657 -10.636 6.600 1.00 0.00 C ATOM 1208 CE1 PHE A 286 9.308 -10.104 7.081 1.00 0.00 C ATOM 1209 CE2 PHE A 286 7.070 -10.341 7.867 1.00 0.00 C ATOM 1210 CZ PHE A 286 8.400 -10.070 8.115 1.00 0.00 C ATOM 0 H PHE A 286 5.806 -11.250 2.141 1.00 0.00 H new ATOM 0 HA PHE A 286 6.179 -9.064 3.880 1.00 0.00 H new ATOM 0 HB2 PHE A 286 6.176 -11.624 4.267 1.00 0.00 H new ATOM 0 HB3 PHE A 286 7.830 -11.612 3.688 1.00 0.00 H new ATOM 0 HD1 PHE A 286 9.595 -10.433 4.999 1.00 0.00 H new ATOM 0 HD2 PHE A 286 5.614 -10.844 6.414 1.00 0.00 H new ATOM 0 HE1 PHE A 286 10.351 -9.895 7.268 1.00 0.00 H new ATOM 0 HE2 PHE A 286 6.355 -10.320 8.676 1.00 0.00 H new ATOM 0 HZ PHE A 286 8.727 -9.832 9.116 1.00 0.00 H new ATOM 1220 N ASP A 287 8.636 -9.717 1.814 1.00 0.00 N ATOM 1221 CA ASP A 287 9.890 -9.283 1.208 1.00 0.00 C ATOM 1222 C ASP A 287 9.769 -7.850 0.749 1.00 0.00 C ATOM 1223 O ASP A 287 10.511 -6.991 1.208 1.00 0.00 O ATOM 1224 CB ASP A 287 10.134 -10.147 -0.022 1.00 0.00 C ATOM 1225 CG ASP A 287 11.499 -10.041 -0.632 1.00 0.00 C ATOM 1226 OD1 ASP A 287 11.743 -9.136 -1.445 1.00 0.00 O ATOM 1227 OD2 ASP A 287 12.315 -10.936 -0.392 1.00 0.00 O ATOM 0 H ASP A 287 8.231 -10.533 1.356 1.00 0.00 H new ATOM 0 HA ASP A 287 10.700 -9.371 1.932 1.00 0.00 H new ATOM 0 HB2 ASP A 287 9.957 -11.188 0.247 1.00 0.00 H new ATOM 0 HB3 ASP A 287 9.396 -9.884 -0.780 1.00 0.00 H new ATOM 1232 N VAL A 288 8.751 -7.576 -0.073 1.00 0.00 N ATOM 1233 CA VAL A 288 8.570 -6.247 -0.630 1.00 0.00 C ATOM 1234 C VAL A 288 8.131 -5.262 0.429 1.00 0.00 C ATOM 1235 O VAL A 288 8.463 -4.099 0.360 1.00 0.00 O ATOM 1236 CB VAL A 288 7.609 -6.204 -1.858 1.00 0.00 C ATOM 1237 CG1 VAL A 288 8.119 -7.101 -2.976 1.00 0.00 C ATOM 1238 CG2 VAL A 288 6.184 -6.568 -1.481 1.00 0.00 C ATOM 0 H VAL A 288 8.048 -8.257 -0.361 1.00 0.00 H new ATOM 0 HA VAL A 288 9.551 -5.951 -1.002 1.00 0.00 H new ATOM 0 HB VAL A 288 7.594 -5.176 -2.219 1.00 0.00 H new ATOM 0 HG11 VAL A 288 7.433 -7.055 -3.821 1.00 0.00 H new ATOM 0 HG12 VAL A 288 9.106 -6.764 -3.291 1.00 0.00 H new ATOM 0 HG13 VAL A 288 8.184 -8.128 -2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 288 5.551 -6.525 -2.367 1.00 0.00 H new ATOM 0 HG22 VAL A 288 6.163 -7.577 -1.069 1.00 0.00 H new ATOM 0 HG23 VAL A 288 5.814 -5.864 -0.736 1.00 0.00 H new ATOM 1248 N LEU A 289 7.427 -5.750 1.438 1.00 0.00 N ATOM 1249 CA LEU A 289 6.980 -4.911 2.531 1.00 0.00 C ATOM 1250 C LEU A 289 8.150 -4.342 3.323 1.00 0.00 C ATOM 1251 O LEU A 289 8.071 -3.222 3.835 1.00 0.00 O ATOM 1252 CB LEU A 289 6.010 -5.674 3.444 1.00 0.00 C ATOM 1253 CG LEU A 289 4.678 -6.099 2.798 1.00 0.00 C ATOM 1254 CD1 LEU A 289 3.882 -6.995 3.720 1.00 0.00 C ATOM 1255 CD2 LEU A 289 3.848 -4.892 2.392 1.00 0.00 C ATOM 0 H LEU A 289 7.153 -6.729 1.520 1.00 0.00 H new ATOM 0 HA LEU A 289 6.445 -4.066 2.098 1.00 0.00 H new ATOM 0 HB2 LEU A 289 6.514 -6.567 3.814 1.00 0.00 H new ATOM 0 HB3 LEU A 289 5.790 -5.051 4.311 1.00 0.00 H new ATOM 0 HG LEU A 289 4.923 -6.663 1.898 1.00 0.00 H new ATOM 0 HD11 LEU A 289 2.948 -7.278 3.235 1.00 0.00 H new ATOM 0 HD12 LEU A 289 4.460 -7.891 3.945 1.00 0.00 H new ATOM 0 HD13 LEU A 289 3.664 -6.463 4.646 1.00 0.00 H new ATOM 0 HD21 LEU A 289 2.915 -5.228 1.940 1.00 0.00 H new ATOM 0 HD22 LEU A 289 3.628 -4.289 3.273 1.00 0.00 H new ATOM 0 HD23 LEU A 289 4.405 -4.293 1.672 1.00 0.00 H new ATOM 1267 N HIS A 290 9.251 -5.081 3.377 1.00 0.00 N ATOM 1268 CA HIS A 290 10.394 -4.647 4.165 1.00 0.00 C ATOM 1269 C HIS A 290 11.572 -4.221 3.323 1.00 0.00 C ATOM 1270 O HIS A 290 12.577 -3.705 3.845 1.00 0.00 O ATOM 1271 CB HIS A 290 10.790 -5.696 5.193 1.00 0.00 C ATOM 1272 CG HIS A 290 9.815 -5.790 6.321 1.00 0.00 C ATOM 1273 ND1 HIS A 290 10.051 -5.287 7.586 1.00 0.00 N ATOM 1274 CD2 HIS A 290 8.576 -6.333 6.361 1.00 0.00 C ATOM 1275 CE1 HIS A 290 8.980 -5.538 8.337 1.00 0.00 C ATOM 1276 NE2 HIS A 290 8.051 -6.176 7.640 1.00 0.00 N ATOM 0 H HIS A 290 9.375 -5.970 2.892 1.00 0.00 H new ATOM 0 HA HIS A 290 10.071 -3.754 4.701 1.00 0.00 H new ATOM 0 HB2 HIS A 290 10.869 -6.667 4.704 1.00 0.00 H new ATOM 0 HB3 HIS A 290 11.777 -5.457 5.589 1.00 0.00 H new ATOM 0 HD2 HIS A 290 8.075 -6.812 5.533 1.00 0.00 H new ATOM 0 HE1 HIS A 290 8.882 -5.259 9.376 1.00 0.00 H new ATOM 0 HE2 HIS A 290 7.139 -6.488 7.973 1.00 0.00 H new ATOM 1284 N GLU A 291 11.457 -4.393 2.049 1.00 0.00 N ATOM 1285 CA GLU A 291 12.487 -3.991 1.150 1.00 0.00 C ATOM 1286 C GLU A 291 12.426 -2.506 0.895 1.00 0.00 C ATOM 1287 O GLU A 291 11.354 -1.958 0.649 1.00 0.00 O ATOM 1288 CB GLU A 291 12.419 -4.777 -0.152 1.00 0.00 C ATOM 1289 CG GLU A 291 13.157 -6.084 -0.105 1.00 0.00 C ATOM 1290 CD GLU A 291 14.607 -5.916 0.261 1.00 0.00 C ATOM 1291 OE1 GLU A 291 15.421 -5.572 -0.622 1.00 0.00 O ATOM 1292 OE2 GLU A 291 14.965 -6.167 1.433 1.00 0.00 O ATOM 0 H GLU A 291 10.645 -4.817 1.600 1.00 0.00 H new ATOM 0 HA GLU A 291 13.447 -4.212 1.617 1.00 0.00 H new ATOM 0 HB2 GLU A 291 11.374 -4.968 -0.397 1.00 0.00 H new ATOM 0 HB3 GLU A 291 12.829 -4.167 -0.957 1.00 0.00 H new ATOM 0 HG2 GLU A 291 12.677 -6.742 0.619 1.00 0.00 H new ATOM 0 HG3 GLU A 291 13.085 -6.573 -1.077 1.00 0.00 H new ATOM 1299 N PRO A 292 13.568 -1.819 0.983 1.00 0.00 N ATOM 1300 CA PRO A 292 13.616 -0.408 0.716 1.00 0.00 C ATOM 1301 C PRO A 292 13.373 -0.154 -0.758 1.00 0.00 C ATOM 1302 O PRO A 292 13.753 -0.985 -1.608 1.00 0.00 O ATOM 1303 CB PRO A 292 15.034 0.017 1.117 1.00 0.00 C ATOM 1304 CG PRO A 292 15.839 -1.236 1.167 1.00 0.00 C ATOM 1305 CD PRO A 292 14.887 -2.383 1.325 1.00 0.00 C ATOM 0 HA PRO A 292 12.856 0.151 1.262 1.00 0.00 H new ATOM 0 HB2 PRO A 292 15.450 0.719 0.395 1.00 0.00 H new ATOM 0 HB3 PRO A 292 15.032 0.519 2.085 1.00 0.00 H new ATOM 0 HG2 PRO A 292 16.427 -1.350 0.256 1.00 0.00 H new ATOM 0 HG3 PRO A 292 16.543 -1.206 1.999 1.00 0.00 H new ATOM 0 HD2 PRO A 292 15.148 -3.210 0.664 1.00 0.00 H new ATOM 0 HD3 PRO A 292 14.900 -2.772 2.343 1.00 0.00 H new ATOM 1313 N PHE A 293 12.746 0.969 -1.076 1.00 0.00 N ATOM 1314 CA PHE A 293 12.426 1.283 -2.468 1.00 0.00 C ATOM 1315 C PHE A 293 13.709 1.415 -3.267 1.00 0.00 C ATOM 1316 O PHE A 293 13.795 0.961 -4.393 1.00 0.00 O ATOM 1317 CB PHE A 293 11.606 2.578 -2.596 1.00 0.00 C ATOM 1318 CG PHE A 293 10.497 2.717 -1.581 1.00 0.00 C ATOM 1319 CD1 PHE A 293 9.426 1.849 -1.581 1.00 0.00 C ATOM 1320 CD2 PHE A 293 10.539 3.718 -0.624 1.00 0.00 C ATOM 1321 CE1 PHE A 293 8.415 1.973 -0.654 1.00 0.00 C ATOM 1322 CE2 PHE A 293 9.529 3.851 0.305 1.00 0.00 C ATOM 1323 CZ PHE A 293 8.464 2.975 0.290 1.00 0.00 C ATOM 0 H PHE A 293 12.450 1.673 -0.400 1.00 0.00 H new ATOM 0 HA PHE A 293 11.819 0.467 -2.859 1.00 0.00 H new ATOM 0 HB2 PHE A 293 12.279 3.430 -2.500 1.00 0.00 H new ATOM 0 HB3 PHE A 293 11.175 2.623 -3.596 1.00 0.00 H new ATOM 0 HD1 PHE A 293 9.379 1.061 -2.318 1.00 0.00 H new ATOM 0 HD2 PHE A 293 11.374 4.403 -0.606 1.00 0.00 H new ATOM 0 HE1 PHE A 293 7.583 1.284 -0.667 1.00 0.00 H new ATOM 0 HE2 PHE A 293 9.572 4.639 1.042 1.00 0.00 H new ATOM 0 HZ PHE A 293 7.671 3.074 1.016 1.00 0.00 H new ATOM 1333 N LEU A 294 14.725 1.981 -2.632 1.00 0.00 N ATOM 1334 CA LEU A 294 16.012 2.186 -3.264 1.00 0.00 C ATOM 1335 C LEU A 294 16.904 0.968 -3.133 1.00 0.00 C ATOM 1336 O LEU A 294 18.092 1.074 -3.395 1.00 0.00 O ATOM 1337 CB LEU A 294 16.798 3.383 -2.693 1.00 0.00 C ATOM 1338 CG LEU A 294 16.173 4.795 -2.760 1.00 0.00 C ATOM 1339 CD1 LEU A 294 14.984 4.950 -1.843 1.00 0.00 C ATOM 1340 CD2 LEU A 294 17.220 5.843 -2.443 1.00 0.00 C ATOM 0 H LEU A 294 14.677 2.309 -1.667 1.00 0.00 H new ATOM 0 HA LEU A 294 15.767 2.383 -4.308 1.00 0.00 H new ATOM 0 HB2 LEU A 294 17.010 3.167 -1.646 1.00 0.00 H new ATOM 0 HB3 LEU A 294 17.756 3.423 -3.210 1.00 0.00 H new ATOM 0 HG LEU A 294 15.809 4.936 -3.778 1.00 0.00 H new ATOM 0 HD11 LEU A 294 14.586 5.961 -1.931 1.00 0.00 H new ATOM 0 HD12 LEU A 294 14.214 4.231 -2.121 1.00 0.00 H new ATOM 0 HD13 LEU A 294 15.293 4.771 -0.813 1.00 0.00 H new ATOM 0 HD21 LEU A 294 16.769 6.834 -2.493 1.00 0.00 H new ATOM 0 HD22 LEU A 294 17.613 5.673 -1.441 1.00 0.00 H new ATOM 0 HD23 LEU A 294 18.032 5.777 -3.167 1.00 0.00 H new ATOM 1352 N LYS A 295 16.369 -0.165 -2.645 1.00 0.00 N ATOM 1353 CA LYS A 295 17.134 -1.445 -2.528 1.00 0.00 C ATOM 1354 C LYS A 295 18.200 -1.411 -1.404 1.00 0.00 C ATOM 1355 O LYS A 295 18.466 -2.425 -0.750 1.00 0.00 O ATOM 1356 CB LYS A 295 17.809 -1.778 -3.879 1.00 0.00 C ATOM 1357 CG LYS A 295 18.680 -3.023 -3.891 1.00 0.00 C ATOM 1358 CD LYS A 295 19.561 -3.069 -5.130 1.00 0.00 C ATOM 1359 CE LYS A 295 20.631 -1.969 -5.106 1.00 0.00 C ATOM 1360 NZ LYS A 295 21.447 -1.927 -6.349 1.00 0.00 N ATOM 0 H LYS A 295 15.404 -0.232 -2.320 1.00 0.00 H new ATOM 0 HA LYS A 295 16.416 -2.221 -2.263 1.00 0.00 H new ATOM 0 HB2 LYS A 295 17.031 -1.894 -4.634 1.00 0.00 H new ATOM 0 HB3 LYS A 295 18.420 -0.927 -4.179 1.00 0.00 H new ATOM 0 HG2 LYS A 295 19.304 -3.041 -2.998 1.00 0.00 H new ATOM 0 HG3 LYS A 295 18.049 -3.911 -3.858 1.00 0.00 H new ATOM 0 HD2 LYS A 295 20.043 -4.044 -5.198 1.00 0.00 H new ATOM 0 HD3 LYS A 295 18.943 -2.956 -6.021 1.00 0.00 H new ATOM 0 HE2 LYS A 295 20.148 -1.003 -4.962 1.00 0.00 H new ATOM 0 HE3 LYS A 295 21.288 -2.127 -4.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 22.152 -1.166 -6.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 21.933 -2.838 -6.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 20.828 -1.748 -7.165 1.00 0.00 H new ATOM 1720 N TYR B 833 17.217 0.364 -7.034 1.00 0.00 N ATOM 1721 CA TYR B 833 15.795 0.356 -6.817 1.00 0.00 C ATOM 1722 C TYR B 833 15.254 -1.046 -6.794 1.00 0.00 C ATOM 1723 O TYR B 833 15.784 -1.938 -7.466 1.00 0.00 O ATOM 1724 CB TYR B 833 15.029 1.212 -7.829 1.00 0.00 C ATOM 1725 CG TYR B 833 15.009 2.690 -7.522 1.00 0.00 C ATOM 1726 CD1 TYR B 833 14.100 3.219 -6.604 1.00 0.00 C ATOM 1727 CD2 TYR B 833 15.871 3.561 -8.161 1.00 0.00 C ATOM 1728 CE1 TYR B 833 14.058 4.567 -6.348 1.00 0.00 C ATOM 1729 CE2 TYR B 833 15.833 4.911 -7.895 1.00 0.00 C ATOM 1730 CZ TYR B 833 14.925 5.406 -6.997 1.00 0.00 C ATOM 1731 OH TYR B 833 14.874 6.760 -6.756 1.00 0.00 O ATOM 0 HA TYR B 833 15.637 0.808 -5.838 1.00 0.00 H new ATOM 0 HB2 TYR B 833 15.470 1.066 -8.815 1.00 0.00 H new ATOM 0 HB3 TYR B 833 14.001 0.853 -7.883 1.00 0.00 H new ATOM 0 HD1 TYR B 833 13.420 2.558 -6.088 1.00 0.00 H new ATOM 0 HD2 TYR B 833 16.583 3.178 -8.877 1.00 0.00 H new ATOM 0 HE1 TYR B 833 13.346 4.964 -5.639 1.00 0.00 H new ATOM 0 HE2 TYR B 833 16.519 5.580 -8.394 1.00 0.00 H new ATOM 0 HH TYR B 833 14.148 6.953 -6.127 1.00 0.00 H new ATOM 1741 N ASN B 834 14.241 -1.241 -6.006 1.00 0.00 N ATOM 1742 CA ASN B 834 13.506 -2.485 -5.957 1.00 0.00 C ATOM 1743 C ASN B 834 12.129 -2.216 -6.528 1.00 0.00 C ATOM 1744 O ASN B 834 11.351 -1.450 -5.934 1.00 0.00 O ATOM 1745 CB ASN B 834 13.364 -3.007 -4.519 1.00 0.00 C ATOM 1746 CG ASN B 834 14.575 -3.721 -3.958 1.00 0.00 C ATOM 1747 OD1 ASN B 834 15.329 -4.382 -4.674 1.00 0.00 O ATOM 1748 ND2 ASN B 834 14.771 -3.594 -2.671 1.00 0.00 N ATOM 0 H ASN B 834 13.889 -0.531 -5.364 1.00 0.00 H new ATOM 0 HA ASN B 834 14.042 -3.244 -6.528 1.00 0.00 H new ATOM 0 HB2 ASN B 834 13.127 -2.165 -3.868 1.00 0.00 H new ATOM 0 HB3 ASN B 834 12.514 -3.688 -4.481 1.00 0.00 H new ATOM 0 HD21 ASN B 834 15.569 -4.050 -2.229 1.00 0.00 H new ATOM 0 HD22 ASN B 834 14.126 -3.039 -2.109 1.00 0.00 H new ATOM 1755 N PRO B 835 11.792 -2.836 -7.673 1.00 0.00 N ATOM 1756 CA PRO B 835 10.529 -2.573 -8.376 1.00 0.00 C ATOM 1757 C PRO B 835 9.286 -2.943 -7.567 1.00 0.00 C ATOM 1758 O PRO B 835 8.281 -2.252 -7.637 1.00 0.00 O ATOM 1759 CB PRO B 835 10.625 -3.426 -9.646 1.00 0.00 C ATOM 1760 CG PRO B 835 11.646 -4.467 -9.338 1.00 0.00 C ATOM 1761 CD PRO B 835 12.616 -3.836 -8.385 1.00 0.00 C ATOM 0 HA PRO B 835 10.410 -1.507 -8.571 1.00 0.00 H new ATOM 0 HB2 PRO B 835 9.664 -3.877 -9.891 1.00 0.00 H new ATOM 0 HB3 PRO B 835 10.923 -2.823 -10.504 1.00 0.00 H new ATOM 0 HG2 PRO B 835 11.182 -5.348 -8.894 1.00 0.00 H new ATOM 0 HG3 PRO B 835 12.151 -4.797 -10.246 1.00 0.00 H new ATOM 0 HD2 PRO B 835 13.041 -4.569 -7.699 1.00 0.00 H new ATOM 0 HD3 PRO B 835 13.450 -3.370 -8.910 1.00 0.00 H new ATOM 1769 N GLY B 836 9.382 -4.002 -6.781 1.00 0.00 N ATOM 1770 CA GLY B 836 8.257 -4.469 -5.991 1.00 0.00 C ATOM 1771 C GLY B 836 7.761 -3.445 -4.971 1.00 0.00 C ATOM 1772 O GLY B 836 6.658 -2.913 -5.112 1.00 0.00 O ATOM 0 H GLY B 836 10.232 -4.556 -6.673 1.00 0.00 H new ATOM 0 HA2 GLY B 836 7.437 -4.730 -6.660 1.00 0.00 H new ATOM 0 HA3 GLY B 836 8.544 -5.381 -5.468 1.00 0.00 H new ATOM 1776 N PRO B 837 8.560 -3.127 -3.937 1.00 0.00 N ATOM 1777 CA PRO B 837 8.145 -2.213 -2.875 1.00 0.00 C ATOM 1778 C PRO B 837 7.870 -0.795 -3.344 1.00 0.00 C ATOM 1779 O PRO B 837 6.979 -0.125 -2.794 1.00 0.00 O ATOM 1780 CB PRO B 837 9.298 -2.234 -1.887 1.00 0.00 C ATOM 1781 CG PRO B 837 10.460 -2.705 -2.671 1.00 0.00 C ATOM 1782 CD PRO B 837 9.907 -3.658 -3.686 1.00 0.00 C ATOM 0 HA PRO B 837 7.195 -2.537 -2.451 1.00 0.00 H new ATOM 0 HB2 PRO B 837 9.478 -1.244 -1.469 1.00 0.00 H new ATOM 0 HB3 PRO B 837 9.089 -2.900 -1.050 1.00 0.00 H new ATOM 0 HG2 PRO B 837 10.970 -1.871 -3.154 1.00 0.00 H new ATOM 0 HG3 PRO B 837 11.191 -3.197 -2.030 1.00 0.00 H new ATOM 0 HD2 PRO B 837 10.510 -3.675 -4.594 1.00 0.00 H new ATOM 0 HD3 PRO B 837 9.874 -4.679 -3.306 1.00 0.00 H new ATOM 1790 N GLN B 838 8.616 -0.326 -4.348 1.00 0.00 N ATOM 1791 CA GLN B 838 8.388 1.013 -4.863 1.00 0.00 C ATOM 1792 C GLN B 838 7.016 1.045 -5.445 1.00 0.00 C ATOM 1793 O GLN B 838 6.255 1.932 -5.139 1.00 0.00 O ATOM 1794 CB GLN B 838 9.450 1.440 -5.920 1.00 0.00 C ATOM 1795 CG GLN B 838 9.236 0.860 -7.314 1.00 0.00 C ATOM 1796 CD GLN B 838 10.353 1.151 -8.283 1.00 0.00 C ATOM 1797 OE1 GLN B 838 11.508 1.314 -7.911 1.00 0.00 O ATOM 1798 NE2 GLN B 838 10.022 1.195 -9.536 1.00 0.00 N ATOM 0 H GLN B 838 9.365 -0.845 -4.807 1.00 0.00 H new ATOM 0 HA GLN B 838 8.482 1.729 -4.046 1.00 0.00 H new ATOM 0 HB2 GLN B 838 9.454 2.528 -5.991 1.00 0.00 H new ATOM 0 HB3 GLN B 838 10.436 1.140 -5.565 1.00 0.00 H new ATOM 0 HG2 GLN B 838 9.114 -0.220 -7.231 1.00 0.00 H new ATOM 0 HG3 GLN B 838 8.305 1.255 -7.721 1.00 0.00 H new ATOM 0 HE21 GLN B 838 9.050 1.055 -9.812 1.00 0.00 H new ATOM 0 HE22 GLN B 838 10.734 1.370 -10.246 1.00 0.00 H new ATOM 1807 N ASP B 839 6.657 -0.014 -6.160 1.00 0.00 N ATOM 1808 CA ASP B 839 5.433 -0.025 -6.875 1.00 0.00 C ATOM 1809 C ASP B 839 4.288 -0.117 -5.900 1.00 0.00 C ATOM 1810 O ASP B 839 3.284 0.529 -6.076 1.00 0.00 O ATOM 1811 CB ASP B 839 5.378 -1.163 -7.877 1.00 0.00 C ATOM 1812 CG ASP B 839 4.522 -0.839 -9.078 1.00 0.00 C ATOM 1813 OD1 ASP B 839 4.600 0.311 -9.598 1.00 0.00 O ATOM 1814 OD2 ASP B 839 3.745 -1.702 -9.535 1.00 0.00 O ATOM 0 H ASP B 839 7.211 -0.866 -6.246 1.00 0.00 H new ATOM 0 HA ASP B 839 5.355 0.903 -7.442 1.00 0.00 H new ATOM 0 HB2 ASP B 839 6.389 -1.399 -8.209 1.00 0.00 H new ATOM 0 HB3 ASP B 839 4.987 -2.055 -7.387 1.00 0.00 H new ATOM 1819 N PHE B 840 4.494 -0.895 -4.823 1.00 0.00 N ATOM 1820 CA PHE B 840 3.509 -1.078 -3.733 1.00 0.00 C ATOM 1821 C PHE B 840 3.063 0.309 -3.200 1.00 0.00 C ATOM 1822 O PHE B 840 1.873 0.569 -2.998 1.00 0.00 O ATOM 1823 CB PHE B 840 4.161 -1.886 -2.588 1.00 0.00 C ATOM 1824 CG PHE B 840 3.236 -2.844 -1.869 1.00 0.00 C ATOM 1825 CD1 PHE B 840 2.136 -2.395 -1.153 1.00 0.00 C ATOM 1826 CD2 PHE B 840 3.465 -4.210 -1.941 1.00 0.00 C ATOM 1827 CE1 PHE B 840 1.286 -3.294 -0.521 1.00 0.00 C ATOM 1828 CE2 PHE B 840 2.614 -5.108 -1.311 1.00 0.00 C ATOM 1829 CZ PHE B 840 1.528 -4.646 -0.604 1.00 0.00 C ATOM 0 H PHE B 840 5.356 -1.421 -4.680 1.00 0.00 H new ATOM 0 HA PHE B 840 2.640 -1.616 -4.111 1.00 0.00 H new ATOM 0 HB2 PHE B 840 4.999 -2.452 -2.995 1.00 0.00 H new ATOM 0 HB3 PHE B 840 4.572 -1.187 -1.860 1.00 0.00 H new ATOM 0 HD1 PHE B 840 1.938 -1.335 -1.086 1.00 0.00 H new ATOM 0 HD2 PHE B 840 4.316 -4.580 -2.494 1.00 0.00 H new ATOM 0 HE1 PHE B 840 0.435 -2.931 0.036 1.00 0.00 H new ATOM 0 HE2 PHE B 840 2.805 -6.169 -1.376 1.00 0.00 H new ATOM 0 HZ PHE B 840 0.866 -5.344 -0.114 1.00 0.00 H new ATOM 1839 N LEU B 841 4.036 1.188 -3.026 1.00 0.00 N ATOM 1840 CA LEU B 841 3.810 2.564 -2.581 1.00 0.00 C ATOM 1841 C LEU B 841 3.286 3.440 -3.725 1.00 0.00 C ATOM 1842 O LEU B 841 2.420 4.278 -3.536 1.00 0.00 O ATOM 1843 CB LEU B 841 5.132 3.149 -2.046 1.00 0.00 C ATOM 1844 CG LEU B 841 5.206 4.675 -1.977 1.00 0.00 C ATOM 1845 CD1 LEU B 841 4.265 5.244 -0.926 1.00 0.00 C ATOM 1846 CD2 LEU B 841 6.630 5.144 -1.768 1.00 0.00 C ATOM 0 H LEU B 841 5.019 0.969 -3.190 1.00 0.00 H new ATOM 0 HA LEU B 841 3.058 2.552 -1.792 1.00 0.00 H new ATOM 0 HB2 LEU B 841 5.305 2.750 -1.046 1.00 0.00 H new ATOM 0 HB3 LEU B 841 5.946 2.793 -2.677 1.00 0.00 H new ATOM 0 HG LEU B 841 4.870 5.060 -2.940 1.00 0.00 H new ATOM 0 HD11 LEU B 841 4.350 6.331 -0.911 1.00 0.00 H new ATOM 0 HD12 LEU B 841 3.239 4.964 -1.166 1.00 0.00 H new ATOM 0 HD13 LEU B 841 4.530 4.846 0.053 1.00 0.00 H new ATOM 0 HD21 LEU B 841 6.652 6.233 -1.723 1.00 0.00 H new ATOM 0 HD22 LEU B 841 7.015 4.735 -0.834 1.00 0.00 H new ATOM 0 HD23 LEU B 841 7.251 4.803 -2.596 1.00 0.00 H new ATOM 1858 N LEU B 842 3.800 3.230 -4.895 1.00 0.00 N ATOM 1859 CA LEU B 842 3.444 4.029 -6.057 1.00 0.00 C ATOM 1860 C LEU B 842 1.980 3.888 -6.446 1.00 0.00 C ATOM 1861 O LEU B 842 1.406 4.756 -7.100 1.00 0.00 O ATOM 1862 CB LEU B 842 4.328 3.658 -7.227 1.00 0.00 C ATOM 1863 CG LEU B 842 5.834 3.963 -7.076 1.00 0.00 C ATOM 1864 CD1 LEU B 842 6.511 4.102 -8.386 1.00 0.00 C ATOM 1865 CD2 LEU B 842 6.141 5.144 -6.171 1.00 0.00 C ATOM 0 H LEU B 842 4.484 2.498 -5.087 1.00 0.00 H new ATOM 0 HA LEU B 842 3.601 5.073 -5.786 1.00 0.00 H new ATOM 0 HB2 LEU B 842 4.213 2.591 -7.416 1.00 0.00 H new ATOM 0 HB3 LEU B 842 3.961 4.180 -8.111 1.00 0.00 H new ATOM 0 HG LEU B 842 6.245 3.087 -6.574 1.00 0.00 H new ATOM 0 HD11 LEU B 842 7.568 4.316 -8.228 1.00 0.00 H new ATOM 0 HD12 LEU B 842 6.409 3.174 -8.949 1.00 0.00 H new ATOM 0 HD13 LEU B 842 6.055 4.918 -8.946 1.00 0.00 H new ATOM 0 HD21 LEU B 842 7.220 5.291 -6.118 1.00 0.00 H new ATOM 0 HD22 LEU B 842 5.671 6.042 -6.573 1.00 0.00 H new ATOM 0 HD23 LEU B 842 5.753 4.947 -5.172 1.00 0.00 H new ATOM 1877 N LYS B 843 1.386 2.819 -6.022 1.00 0.00 N ATOM 1878 CA LYS B 843 0.013 2.511 -6.333 1.00 0.00 C ATOM 1879 C LYS B 843 -0.952 3.072 -5.275 1.00 0.00 C ATOM 1880 O LYS B 843 -2.169 2.880 -5.378 1.00 0.00 O ATOM 1881 CB LYS B 843 -0.115 1.004 -6.441 1.00 0.00 C ATOM 1882 CG LYS B 843 0.753 0.407 -7.535 1.00 0.00 C ATOM 1883 CD LYS B 843 0.100 0.472 -8.881 1.00 0.00 C ATOM 1884 CE LYS B 843 0.947 -0.216 -9.935 1.00 0.00 C ATOM 1885 NZ LYS B 843 2.065 0.616 -10.387 1.00 0.00 N ATOM 0 H LYS B 843 1.843 2.118 -5.439 1.00 0.00 H new ATOM 0 HA LYS B 843 -0.260 2.982 -7.277 1.00 0.00 H new ATOM 0 HB2 LYS B 843 0.155 0.554 -5.486 1.00 0.00 H new ATOM 0 HB3 LYS B 843 -1.157 0.747 -6.632 1.00 0.00 H new ATOM 0 HG2 LYS B 843 1.705 0.937 -7.570 1.00 0.00 H new ATOM 0 HG3 LYS B 843 0.976 -0.632 -7.292 1.00 0.00 H new ATOM 0 HD2 LYS B 843 -0.882 0.001 -8.835 1.00 0.00 H new ATOM 0 HD3 LYS B 843 -0.059 1.513 -9.161 1.00 0.00 H new ATOM 0 HE2 LYS B 843 1.334 -1.151 -9.531 1.00 0.00 H new ATOM 0 HE3 LYS B 843 0.321 -0.473 -10.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 843 2.488 0.196 -11.239 1.00 0.00 H new ATOM 0 HZ2 LYS B 843 1.719 1.572 -10.607 1.00 0.00 H new ATOM 0 HZ3 LYS B 843 2.782 0.672 -9.636 1.00 0.00 H new ATOM 1899 N MET B 844 -0.411 3.796 -4.291 1.00 0.00 N ATOM 1900 CA MET B 844 -1.215 4.383 -3.214 1.00 0.00 C ATOM 1901 C MET B 844 -2.064 5.552 -3.746 1.00 0.00 C ATOM 1902 O MET B 844 -1.679 6.211 -4.718 1.00 0.00 O ATOM 1903 CB MET B 844 -0.312 4.903 -2.083 1.00 0.00 C ATOM 1904 CG MET B 844 0.424 3.870 -1.318 1.00 0.00 C ATOM 1905 SD MET B 844 -0.640 2.862 -0.327 1.00 0.00 S ATOM 1906 CE MET B 844 0.584 2.359 0.821 1.00 0.00 C ATOM 0 H MET B 844 0.588 3.991 -4.218 1.00 0.00 H new ATOM 0 HA MET B 844 -1.870 3.602 -2.828 1.00 0.00 H new ATOM 0 HB2 MET B 844 0.412 5.596 -2.512 1.00 0.00 H new ATOM 0 HB3 MET B 844 -0.926 5.474 -1.387 1.00 0.00 H new ATOM 0 HG2 MET B 844 0.976 3.235 -2.011 1.00 0.00 H new ATOM 0 HG3 MET B 844 1.159 4.355 -0.676 1.00 0.00 H new ATOM 0 HE1 MET B 844 0.105 1.895 1.683 1.00 0.00 H new ATOM 0 HE2 MET B 844 1.253 1.641 0.348 1.00 0.00 H new ATOM 0 HE3 MET B 844 1.156 3.228 1.147 1.00 0.00 H new ATOM 1916 N PRO B 845 -3.235 5.819 -3.161 1.00 0.00 N ATOM 1917 CA PRO B 845 -4.051 6.961 -3.553 1.00 0.00 C ATOM 1918 C PRO B 845 -3.548 8.257 -2.898 1.00 0.00 C ATOM 1919 O PRO B 845 -3.114 8.256 -1.745 1.00 0.00 O ATOM 1920 CB PRO B 845 -5.441 6.599 -3.031 1.00 0.00 C ATOM 1921 CG PRO B 845 -5.192 5.726 -1.850 1.00 0.00 C ATOM 1922 CD PRO B 845 -3.871 5.026 -2.090 1.00 0.00 C ATOM 0 HA PRO B 845 -4.028 7.145 -4.627 1.00 0.00 H new ATOM 0 HB2 PRO B 845 -6.003 7.490 -2.752 1.00 0.00 H new ATOM 0 HB3 PRO B 845 -6.025 6.079 -3.790 1.00 0.00 H new ATOM 0 HG2 PRO B 845 -5.155 6.316 -0.934 1.00 0.00 H new ATOM 0 HG3 PRO B 845 -5.997 5.001 -1.730 1.00 0.00 H new ATOM 0 HD2 PRO B 845 -3.259 5.010 -1.188 1.00 0.00 H new ATOM 0 HD3 PRO B 845 -4.018 3.990 -2.394 1.00 0.00 H new ATOM 1930 N GLY B 846 -3.566 9.344 -3.649 1.00 0.00 N ATOM 1931 CA GLY B 846 -3.134 10.627 -3.121 1.00 0.00 C ATOM 1932 C GLY B 846 -1.648 10.847 -3.271 1.00 0.00 C ATOM 1933 O GLY B 846 -1.140 11.930 -2.971 1.00 0.00 O ATOM 0 H GLY B 846 -3.873 9.365 -4.621 1.00 0.00 H new ATOM 0 HA2 GLY B 846 -3.669 11.426 -3.635 1.00 0.00 H new ATOM 0 HA3 GLY B 846 -3.402 10.690 -2.066 1.00 0.00 H new ATOM 1937 N VAL B 847 -0.947 9.837 -3.735 1.00 0.00 N ATOM 1938 CA VAL B 847 0.470 9.949 -3.907 1.00 0.00 C ATOM 1939 C VAL B 847 0.754 10.643 -5.253 1.00 0.00 C ATOM 1940 O VAL B 847 0.007 10.469 -6.229 1.00 0.00 O ATOM 1941 CB VAL B 847 1.198 8.558 -3.807 1.00 0.00 C ATOM 1942 CG1 VAL B 847 1.055 7.717 -5.067 1.00 0.00 C ATOM 1943 CG2 VAL B 847 2.653 8.717 -3.400 1.00 0.00 C ATOM 0 H VAL B 847 -1.341 8.933 -3.997 1.00 0.00 H new ATOM 0 HA VAL B 847 0.874 10.552 -3.094 1.00 0.00 H new ATOM 0 HB VAL B 847 0.690 8.005 -3.017 1.00 0.00 H new ATOM 0 HG11 VAL B 847 1.579 6.771 -4.934 1.00 0.00 H new ATOM 0 HG12 VAL B 847 -0.001 7.524 -5.258 1.00 0.00 H new ATOM 0 HG13 VAL B 847 1.484 8.254 -5.913 1.00 0.00 H new ATOM 0 HG21 VAL B 847 3.124 7.736 -3.341 1.00 0.00 H new ATOM 0 HG22 VAL B 847 3.173 9.325 -4.140 1.00 0.00 H new ATOM 0 HG23 VAL B 847 2.707 9.204 -2.427 1.00 0.00 H new ATOM 1953 N ASN B 848 1.789 11.444 -5.283 1.00 0.00 N ATOM 1954 CA ASN B 848 2.176 12.183 -6.485 1.00 0.00 C ATOM 1955 C ASN B 848 3.626 11.885 -6.642 1.00 0.00 C ATOM 1956 O ASN B 848 4.213 11.331 -5.715 1.00 0.00 O ATOM 1957 CB ASN B 848 2.081 13.757 -6.364 1.00 0.00 C ATOM 1958 CG ASN B 848 0.865 14.384 -5.685 1.00 0.00 C ATOM 1959 OD1 ASN B 848 0.422 13.825 -4.609 1.00 0.00 O flip ATOM 1960 ND2 ASN B 848 0.415 15.451 -6.092 1.00 0.00 N flip ATOM 0 H ASN B 848 2.396 11.611 -4.480 1.00 0.00 H new ATOM 0 HA ASN B 848 1.511 11.886 -7.296 1.00 0.00 H new ATOM 0 HB2 ASN B 848 2.967 14.098 -5.828 1.00 0.00 H new ATOM 0 HB3 ASN B 848 2.140 14.167 -7.372 1.00 0.00 H new ATOM 0 HD21 ASN B 848 0.786 15.868 -6.946 1.00 0.00 H new ATOM 0 HD22 ASN B 848 -0.329 15.920 -5.576 1.00 0.00 H new ATOM 1967 N ALA B 849 4.232 12.325 -7.728 1.00 0.00 N ATOM 1968 CA ALA B 849 5.674 12.140 -7.962 1.00 0.00 C ATOM 1969 C ALA B 849 6.441 12.796 -6.831 1.00 0.00 C ATOM 1970 O ALA B 849 7.464 12.301 -6.367 1.00 0.00 O ATOM 1971 CB ALA B 849 6.060 12.763 -9.294 1.00 0.00 C ATOM 0 H ALA B 849 3.751 12.821 -8.478 1.00 0.00 H new ATOM 0 HA ALA B 849 5.915 11.077 -7.994 1.00 0.00 H new ATOM 0 HB1 ALA B 849 7.128 12.625 -9.465 1.00 0.00 H new ATOM 0 HB2 ALA B 849 5.499 12.283 -10.096 1.00 0.00 H new ATOM 0 HB3 ALA B 849 5.830 13.828 -9.278 1.00 0.00 H new ATOM 1977 N LYS B 850 5.890 13.899 -6.395 1.00 0.00 N ATOM 1978 CA LYS B 850 6.359 14.684 -5.261 1.00 0.00 C ATOM 1979 C LYS B 850 6.466 13.776 -4.036 1.00 0.00 C ATOM 1980 O LYS B 850 7.535 13.524 -3.496 1.00 0.00 O ATOM 1981 CB LYS B 850 5.268 15.711 -4.964 1.00 0.00 C ATOM 1982 CG LYS B 850 4.814 16.493 -6.169 1.00 0.00 C ATOM 1983 CD LYS B 850 3.480 17.124 -5.899 1.00 0.00 C ATOM 1984 CE LYS B 850 2.843 17.610 -7.164 1.00 0.00 C ATOM 1985 NZ LYS B 850 1.504 18.169 -6.910 1.00 0.00 N ATOM 0 H LYS B 850 5.063 14.301 -6.835 1.00 0.00 H new ATOM 0 HA LYS B 850 7.323 15.144 -5.478 1.00 0.00 H new ATOM 0 HB2 LYS B 850 4.409 15.198 -4.533 1.00 0.00 H new ATOM 0 HB3 LYS B 850 5.635 16.407 -4.210 1.00 0.00 H new ATOM 0 HG2 LYS B 850 5.547 17.263 -6.411 1.00 0.00 H new ATOM 0 HG3 LYS B 850 4.745 15.835 -7.035 1.00 0.00 H new ATOM 0 HD2 LYS B 850 2.825 16.401 -5.414 1.00 0.00 H new ATOM 0 HD3 LYS B 850 3.603 17.957 -5.207 1.00 0.00 H new ATOM 0 HE2 LYS B 850 3.475 18.370 -7.623 1.00 0.00 H new ATOM 0 HE3 LYS B 850 2.767 16.787 -7.875 1.00 0.00 H new ATOM 0 HZ1 LYS B 850 0.838 17.813 -7.625 1.00 0.00 H new ATOM 0 HZ2 LYS B 850 1.182 17.882 -5.964 1.00 0.00 H new ATOM 0 HZ3 LYS B 850 1.546 19.207 -6.962 1.00 0.00 H new ATOM 1999 N ASN B 851 5.326 13.217 -3.701 1.00 0.00 N ATOM 2000 CA ASN B 851 5.119 12.425 -2.502 1.00 0.00 C ATOM 2001 C ASN B 851 5.863 11.093 -2.549 1.00 0.00 C ATOM 2002 O ASN B 851 6.374 10.651 -1.525 1.00 0.00 O ATOM 2003 CB ASN B 851 3.608 12.231 -2.263 1.00 0.00 C ATOM 2004 CG ASN B 851 2.858 13.485 -1.779 1.00 0.00 C ATOM 2005 OD1 ASN B 851 1.790 13.377 -1.224 1.00 0.00 O ATOM 2006 ND2 ASN B 851 3.423 14.655 -1.934 1.00 0.00 N ATOM 0 H ASN B 851 4.486 13.302 -4.273 1.00 0.00 H new ATOM 0 HA ASN B 851 5.540 12.970 -1.657 1.00 0.00 H new ATOM 0 HB2 ASN B 851 3.150 11.888 -3.191 1.00 0.00 H new ATOM 0 HB3 ASN B 851 3.471 11.438 -1.528 1.00 0.00 H new ATOM 0 HD21 ASN B 851 2.962 15.495 -1.584 1.00 0.00 H new ATOM 0 HD22 ASN B 851 4.325 14.727 -2.405 1.00 0.00 H new ATOM 2013 N CYS B 852 5.943 10.462 -3.738 1.00 0.00 N ATOM 2014 CA CYS B 852 6.696 9.203 -3.890 1.00 0.00 C ATOM 2015 C CYS B 852 8.161 9.451 -3.533 1.00 0.00 C ATOM 2016 O CYS B 852 8.798 8.653 -2.828 1.00 0.00 O ATOM 2017 CB CYS B 852 6.609 8.660 -5.335 1.00 0.00 C ATOM 2018 SG CYS B 852 4.933 8.400 -5.965 1.00 0.00 S ATOM 0 H CYS B 852 5.502 10.798 -4.594 1.00 0.00 H new ATOM 0 HA CYS B 852 6.258 8.461 -3.222 1.00 0.00 H new ATOM 0 HB2 CYS B 852 7.125 9.355 -5.998 1.00 0.00 H new ATOM 0 HB3 CYS B 852 7.148 7.714 -5.383 1.00 0.00 H new ATOM 0 HG CYS B 852 4.291 9.531 -5.970 1.00 0.00 H new ATOM 2024 N ARG B 853 8.670 10.585 -3.992 1.00 0.00 N ATOM 2025 CA ARG B 853 10.020 10.987 -3.719 1.00 0.00 C ATOM 2026 C ARG B 853 10.210 11.270 -2.238 1.00 0.00 C ATOM 2027 O ARG B 853 11.137 10.753 -1.638 1.00 0.00 O ATOM 2028 CB ARG B 853 10.419 12.191 -4.563 1.00 0.00 C ATOM 2029 CG ARG B 853 10.529 11.913 -6.058 1.00 0.00 C ATOM 2030 CD ARG B 853 11.518 10.805 -6.386 1.00 0.00 C ATOM 2031 NE ARG B 853 12.874 11.105 -5.920 1.00 0.00 N ATOM 2032 CZ ARG B 853 13.977 10.467 -6.313 1.00 0.00 C ATOM 2033 NH1 ARG B 853 13.918 9.554 -7.272 1.00 0.00 N ATOM 2034 NH2 ARG B 853 15.138 10.756 -5.759 1.00 0.00 N ATOM 0 H ARG B 853 8.147 11.247 -4.565 1.00 0.00 H new ATOM 0 HA ARG B 853 10.677 10.161 -3.992 1.00 0.00 H new ATOM 0 HB2 ARG B 853 9.688 12.985 -4.408 1.00 0.00 H new ATOM 0 HB3 ARG B 853 11.378 12.566 -4.206 1.00 0.00 H new ATOM 0 HG2 ARG B 853 9.547 11.642 -6.445 1.00 0.00 H new ATOM 0 HG3 ARG B 853 10.832 12.826 -6.570 1.00 0.00 H new ATOM 0 HD2 ARG B 853 11.179 9.874 -5.931 1.00 0.00 H new ATOM 0 HD3 ARG B 853 11.535 10.646 -7.464 1.00 0.00 H new ATOM 0 HE ARG B 853 12.983 11.860 -5.243 1.00 0.00 H new ATOM 0 HH11 ARG B 853 13.025 9.336 -7.714 1.00 0.00 H new ATOM 0 HH12 ARG B 853 14.766 9.070 -7.568 1.00 0.00 H new ATOM 0 HH21 ARG B 853 15.192 11.467 -5.030 1.00 0.00 H new ATOM 0 HH22 ARG B 853 15.982 10.268 -6.059 1.00 0.00 H new ATOM 2048 N SER B 854 9.301 12.041 -1.643 1.00 0.00 N ATOM 2049 CA SER B 854 9.366 12.368 -0.226 1.00 0.00 C ATOM 2050 C SER B 854 9.418 11.081 0.616 1.00 0.00 C ATOM 2051 O SER B 854 10.239 10.940 1.527 1.00 0.00 O ATOM 2052 CB SER B 854 8.125 13.167 0.153 1.00 0.00 C ATOM 2053 OG SER B 854 7.926 14.257 -0.728 1.00 0.00 O ATOM 0 H SER B 854 8.505 12.453 -2.129 1.00 0.00 H new ATOM 0 HA SER B 854 10.265 12.953 -0.033 1.00 0.00 H new ATOM 0 HB2 SER B 854 7.251 12.516 0.133 1.00 0.00 H new ATOM 0 HB3 SER B 854 8.225 13.535 1.174 1.00 0.00 H new ATOM 0 HG SER B 854 7.647 13.922 -1.606 1.00 0.00 H new ATOM 2059 N LEU B 855 8.579 10.136 0.245 1.00 0.00 N ATOM 2060 CA LEU B 855 8.445 8.878 0.928 1.00 0.00 C ATOM 2061 C LEU B 855 9.756 8.109 0.862 1.00 0.00 C ATOM 2062 O LEU B 855 10.250 7.684 1.861 1.00 0.00 O ATOM 2063 CB LEU B 855 7.326 8.074 0.267 1.00 0.00 C ATOM 2064 CG LEU B 855 6.313 7.348 1.168 1.00 0.00 C ATOM 2065 CD1 LEU B 855 6.962 6.320 2.050 1.00 0.00 C ATOM 2066 CD2 LEU B 855 5.515 8.341 1.987 1.00 0.00 C ATOM 0 H LEU B 855 7.959 10.229 -0.560 1.00 0.00 H new ATOM 0 HA LEU B 855 8.200 9.051 1.976 1.00 0.00 H new ATOM 0 HB2 LEU B 855 6.768 8.752 -0.380 1.00 0.00 H new ATOM 0 HB3 LEU B 855 7.790 7.328 -0.378 1.00 0.00 H new ATOM 0 HG LEU B 855 5.629 6.811 0.511 1.00 0.00 H new ATOM 0 HD11 LEU B 855 6.203 5.837 2.665 1.00 0.00 H new ATOM 0 HD12 LEU B 855 7.458 5.572 1.432 1.00 0.00 H new ATOM 0 HD13 LEU B 855 7.697 6.804 2.693 1.00 0.00 H new ATOM 0 HD21 LEU B 855 4.805 7.806 2.617 1.00 0.00 H new ATOM 0 HD22 LEU B 855 6.191 8.921 2.615 1.00 0.00 H new ATOM 0 HD23 LEU B 855 4.974 9.012 1.319 1.00 0.00 H new ATOM 2078 N MET B 856 10.345 8.010 -0.316 1.00 0.00 N ATOM 2079 CA MET B 856 11.572 7.218 -0.475 1.00 0.00 C ATOM 2080 C MET B 856 12.811 7.945 0.063 1.00 0.00 C ATOM 2081 O MET B 856 13.856 7.333 0.283 1.00 0.00 O ATOM 2082 CB MET B 856 11.786 6.780 -1.934 1.00 0.00 C ATOM 2083 CG MET B 856 12.053 7.908 -2.915 1.00 0.00 C ATOM 2084 SD MET B 856 12.344 7.320 -4.599 1.00 0.00 S ATOM 2085 CE MET B 856 10.783 6.508 -4.955 1.00 0.00 C ATOM 0 H MET B 856 10.008 8.456 -1.169 1.00 0.00 H new ATOM 0 HA MET B 856 11.435 6.321 0.128 1.00 0.00 H new ATOM 0 HB2 MET B 856 12.624 6.084 -1.968 1.00 0.00 H new ATOM 0 HB3 MET B 856 10.903 6.233 -2.266 1.00 0.00 H new ATOM 0 HG2 MET B 856 11.204 8.591 -2.916 1.00 0.00 H new ATOM 0 HG3 MET B 856 12.920 8.477 -2.579 1.00 0.00 H new ATOM 0 HE1 MET B 856 10.686 6.362 -6.031 1.00 0.00 H new ATOM 0 HE2 MET B 856 10.753 5.541 -4.454 1.00 0.00 H new ATOM 0 HE3 MET B 856 9.961 7.127 -4.597 1.00 0.00 H new ATOM 2095 N HIS B 857 12.693 9.239 0.259 1.00 0.00 N ATOM 2096 CA HIS B 857 13.781 10.025 0.805 1.00 0.00 C ATOM 2097 C HIS B 857 13.802 9.964 2.321 1.00 0.00 C ATOM 2098 O HIS B 857 14.873 9.950 2.935 1.00 0.00 O ATOM 2099 CB HIS B 857 13.728 11.488 0.323 1.00 0.00 C ATOM 2100 CG HIS B 857 14.369 11.740 -1.019 1.00 0.00 C ATOM 2101 ND1 HIS B 857 15.515 12.488 -1.186 1.00 0.00 N ATOM 2102 CD2 HIS B 857 13.993 11.371 -2.265 1.00 0.00 C ATOM 2103 CE1 HIS B 857 15.790 12.553 -2.483 1.00 0.00 C ATOM 2104 NE2 HIS B 857 14.895 11.889 -3.189 1.00 0.00 N ATOM 0 H HIS B 857 11.850 9.773 0.048 1.00 0.00 H new ATOM 0 HA HIS B 857 14.707 9.585 0.434 1.00 0.00 H new ATOM 0 HB2 HIS B 857 12.685 11.802 0.275 1.00 0.00 H new ATOM 0 HB3 HIS B 857 14.217 12.118 1.066 1.00 0.00 H new ATOM 0 HD1 HIS B 857 16.060 12.919 -0.439 1.00 0.00 H new ATOM 0 HD2 HIS B 857 13.129 10.769 -2.505 1.00 0.00 H new ATOM 0 HE1 HIS B 857 16.634 13.079 -2.904 1.00 0.00 H new ATOM 2112 N HIS B 858 12.635 9.933 2.931 1.00 0.00 N ATOM 2113 CA HIS B 858 12.544 9.890 4.392 1.00 0.00 C ATOM 2114 C HIS B 858 12.375 8.459 4.894 1.00 0.00 C ATOM 2115 O HIS B 858 12.991 8.057 5.884 1.00 0.00 O ATOM 2116 CB HIS B 858 11.369 10.753 4.915 1.00 0.00 C ATOM 2117 CG HIS B 858 11.492 12.242 4.683 1.00 0.00 C ATOM 2118 ND1 HIS B 858 11.409 12.960 3.533 1.00 0.00 N flip ATOM 2119 CD2 HIS B 858 11.664 13.171 5.692 1.00 0.00 C flip ATOM 2120 CE1 HIS B 858 11.524 14.315 3.823 1.00 0.00 C flip ATOM 2121 NE2 HIS B 858 11.675 14.385 5.139 1.00 0.00 N flip ATOM 0 H HIS B 858 11.736 9.936 2.449 1.00 0.00 H new ATOM 0 HA HIS B 858 13.480 10.297 4.776 1.00 0.00 H new ATOM 0 HB2 HIS B 858 10.450 10.406 4.443 1.00 0.00 H new ATOM 0 HB3 HIS B 858 11.263 10.579 5.986 1.00 0.00 H new ATOM 0 HD1 HIS B 858 11.282 12.566 2.601 1.00 0.00 H new ATOM 0 HD2 HIS B 858 11.771 12.952 6.744 1.00 0.00 H new ATOM 0 HE1 HIS B 858 11.496 15.138 3.124 1.00 0.00 H new ATOM 2129 N VAL B 859 11.595 7.700 4.182 1.00 0.00 N ATOM 2130 CA VAL B 859 11.199 6.369 4.583 1.00 0.00 C ATOM 2131 C VAL B 859 11.914 5.269 3.788 1.00 0.00 C ATOM 2132 O VAL B 859 12.172 5.412 2.593 1.00 0.00 O ATOM 2133 CB VAL B 859 9.649 6.245 4.462 1.00 0.00 C ATOM 2134 CG1 VAL B 859 9.201 4.821 4.379 1.00 0.00 C ATOM 2135 CG2 VAL B 859 9.000 6.873 5.652 1.00 0.00 C ATOM 0 H VAL B 859 11.204 7.989 3.285 1.00 0.00 H new ATOM 0 HA VAL B 859 11.500 6.221 5.620 1.00 0.00 H new ATOM 0 HB VAL B 859 9.357 6.753 3.543 1.00 0.00 H new ATOM 0 HG11 VAL B 859 8.115 4.786 4.296 1.00 0.00 H new ATOM 0 HG12 VAL B 859 9.647 4.350 3.503 1.00 0.00 H new ATOM 0 HG13 VAL B 859 9.514 4.288 5.277 1.00 0.00 H new ATOM 0 HG21 VAL B 859 7.917 6.785 5.565 1.00 0.00 H new ATOM 0 HG22 VAL B 859 9.333 6.367 6.558 1.00 0.00 H new ATOM 0 HG23 VAL B 859 9.275 7.926 5.703 1.00 0.00 H new ATOM 2145 N LYS B 860 12.250 4.185 4.484 1.00 0.00 N ATOM 2146 CA LYS B 860 12.885 3.024 3.886 1.00 0.00 C ATOM 2147 C LYS B 860 11.901 2.243 2.989 1.00 0.00 C ATOM 2148 O LYS B 860 12.170 2.008 1.801 1.00 0.00 O ATOM 2149 CB LYS B 860 13.329 2.090 5.012 1.00 0.00 C ATOM 2150 CG LYS B 860 14.101 0.864 4.558 1.00 0.00 C ATOM 2151 CD LYS B 860 14.167 -0.203 5.646 1.00 0.00 C ATOM 2152 CE LYS B 860 14.719 0.305 6.979 1.00 0.00 C ATOM 2153 NZ LYS B 860 16.109 0.784 6.872 1.00 0.00 N ATOM 0 H LYS B 860 12.086 4.092 5.486 1.00 0.00 H new ATOM 0 HA LYS B 860 13.724 3.364 3.279 1.00 0.00 H new ATOM 0 HB2 LYS B 860 13.949 2.654 5.709 1.00 0.00 H new ATOM 0 HB3 LYS B 860 12.447 1.763 5.562 1.00 0.00 H new ATOM 0 HG2 LYS B 860 13.629 0.447 3.669 1.00 0.00 H new ATOM 0 HG3 LYS B 860 15.112 1.156 4.275 1.00 0.00 H new ATOM 0 HD2 LYS B 860 13.167 -0.606 5.808 1.00 0.00 H new ATOM 0 HD3 LYS B 860 14.789 -1.027 5.296 1.00 0.00 H new ATOM 0 HE2 LYS B 860 14.087 1.114 7.345 1.00 0.00 H new ATOM 0 HE3 LYS B 860 14.670 -0.496 7.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 860 16.434 1.117 7.802 1.00 0.00 H new ATOM 0 HZ2 LYS B 860 16.720 0.007 6.549 1.00 0.00 H new ATOM 0 HZ3 LYS B 860 16.155 1.567 6.189 1.00 0.00 H new ATOM 2167 N ASN B 861 10.760 1.866 3.563 1.00 0.00 N ATOM 2168 CA ASN B 861 9.802 0.988 2.896 1.00 0.00 C ATOM 2169 C ASN B 861 8.374 1.261 3.352 1.00 0.00 C ATOM 2170 O ASN B 861 8.137 2.046 4.275 1.00 0.00 O ATOM 2171 CB ASN B 861 10.186 -0.469 3.218 1.00 0.00 C ATOM 2172 CG ASN B 861 10.255 -0.744 4.721 1.00 0.00 C ATOM 2173 OD1 ASN B 861 9.500 -0.215 5.502 1.00 0.00 O ATOM 2174 ND2 ASN B 861 11.197 -1.504 5.127 1.00 0.00 N ATOM 0 H ASN B 861 10.475 2.159 4.498 1.00 0.00 H new ATOM 0 HA ASN B 861 9.838 1.172 1.822 1.00 0.00 H new ATOM 0 HB2 ASN B 861 9.458 -1.141 2.763 1.00 0.00 H new ATOM 0 HB3 ASN B 861 11.153 -0.694 2.767 1.00 0.00 H new ATOM 0 HD21 ASN B 861 11.322 -1.673 6.125 1.00 0.00 H new ATOM 0 HD22 ASN B 861 11.825 -1.942 4.453 1.00 0.00 H new ATOM 2181 N ILE B 862 7.438 0.576 2.732 1.00 0.00 N ATOM 2182 CA ILE B 862 6.026 0.684 3.063 1.00 0.00 C ATOM 2183 C ILE B 862 5.741 0.254 4.519 1.00 0.00 C ATOM 2184 O ILE B 862 4.771 0.706 5.116 1.00 0.00 O ATOM 2185 CB ILE B 862 5.100 -0.119 2.102 1.00 0.00 C ATOM 2186 CG1 ILE B 862 5.685 -1.509 1.758 1.00 0.00 C ATOM 2187 CG2 ILE B 862 4.763 0.690 0.850 1.00 0.00 C ATOM 2188 CD1 ILE B 862 6.565 -1.558 0.523 1.00 0.00 C ATOM 0 H ILE B 862 7.634 -0.080 1.975 1.00 0.00 H new ATOM 0 HA ILE B 862 5.792 1.742 2.944 1.00 0.00 H new ATOM 0 HB ILE B 862 4.164 -0.301 2.630 1.00 0.00 H new ATOM 0 HG12 ILE B 862 6.265 -1.861 2.611 1.00 0.00 H new ATOM 0 HG13 ILE B 862 4.860 -2.208 1.623 1.00 0.00 H new ATOM 0 HG21 ILE B 862 4.115 0.102 0.200 1.00 0.00 H new ATOM 0 HG22 ILE B 862 4.251 1.608 1.137 1.00 0.00 H new ATOM 0 HG23 ILE B 862 5.682 0.938 0.319 1.00 0.00 H new ATOM 0 HD11 ILE B 862 6.923 -2.576 0.371 1.00 0.00 H new ATOM 0 HD12 ILE B 862 5.989 -1.243 -0.347 1.00 0.00 H new ATOM 0 HD13 ILE B 862 7.416 -0.890 0.656 1.00 0.00 H new ATOM 2200 N ALA B 863 6.578 -0.631 5.070 1.00 0.00 N ATOM 2201 CA ALA B 863 6.431 -1.073 6.461 1.00 0.00 C ATOM 2202 C ALA B 863 6.576 0.098 7.433 1.00 0.00 C ATOM 2203 O ALA B 863 5.723 0.292 8.306 1.00 0.00 O ATOM 2204 CB ALA B 863 7.416 -2.187 6.803 1.00 0.00 C ATOM 0 H ALA B 863 7.363 -1.055 4.575 1.00 0.00 H new ATOM 0 HA ALA B 863 5.424 -1.477 6.567 1.00 0.00 H new ATOM 0 HB1 ALA B 863 7.278 -2.489 7.841 1.00 0.00 H new ATOM 0 HB2 ALA B 863 7.240 -3.042 6.150 1.00 0.00 H new ATOM 0 HB3 ALA B 863 8.435 -1.827 6.662 1.00 0.00 H new ATOM 2210 N GLU B 864 7.642 0.887 7.251 1.00 0.00 N ATOM 2211 CA GLU B 864 7.905 2.088 8.069 1.00 0.00 C ATOM 2212 C GLU B 864 6.728 3.025 7.926 1.00 0.00 C ATOM 2213 O GLU B 864 6.209 3.546 8.901 1.00 0.00 O ATOM 2214 CB GLU B 864 9.138 2.826 7.552 1.00 0.00 C ATOM 2215 CG GLU B 864 10.400 2.000 7.389 1.00 0.00 C ATOM 2216 CD GLU B 864 11.010 1.555 8.679 1.00 0.00 C ATOM 2217 OE1 GLU B 864 11.845 2.301 9.227 1.00 0.00 O ATOM 2218 OE2 GLU B 864 10.706 0.446 9.154 1.00 0.00 O ATOM 0 H GLU B 864 8.348 0.715 6.535 1.00 0.00 H new ATOM 0 HA GLU B 864 8.062 1.784 9.104 1.00 0.00 H new ATOM 0 HB2 GLU B 864 8.892 3.268 6.586 1.00 0.00 H new ATOM 0 HB3 GLU B 864 9.354 3.649 8.233 1.00 0.00 H new ATOM 0 HG2 GLU B 864 10.171 1.121 6.786 1.00 0.00 H new ATOM 0 HG3 GLU B 864 11.135 2.584 6.835 1.00 0.00 H new ATOM 2225 N LEU B 865 6.335 3.205 6.688 1.00 0.00 N ATOM 2226 CA LEU B 865 5.214 4.024 6.283 1.00 0.00 C ATOM 2227 C LEU B 865 3.939 3.654 7.026 1.00 0.00 C ATOM 2228 O LEU B 865 3.276 4.500 7.600 1.00 0.00 O ATOM 2229 CB LEU B 865 4.999 3.853 4.778 1.00 0.00 C ATOM 2230 CG LEU B 865 3.702 4.406 4.207 1.00 0.00 C ATOM 2231 CD1 LEU B 865 3.590 5.878 4.465 1.00 0.00 C ATOM 2232 CD2 LEU B 865 3.580 4.092 2.734 1.00 0.00 C ATOM 0 H LEU B 865 6.808 2.765 5.899 1.00 0.00 H new ATOM 0 HA LEU B 865 5.443 5.062 6.526 1.00 0.00 H new ATOM 0 HB2 LEU B 865 5.830 4.330 4.259 1.00 0.00 H new ATOM 0 HB3 LEU B 865 5.047 2.789 4.546 1.00 0.00 H new ATOM 0 HG LEU B 865 2.872 3.917 4.716 1.00 0.00 H new ATOM 0 HD11 LEU B 865 2.655 6.250 4.047 1.00 0.00 H new ATOM 0 HD12 LEU B 865 3.606 6.061 5.539 1.00 0.00 H new ATOM 0 HD13 LEU B 865 4.428 6.394 3.996 1.00 0.00 H new ATOM 0 HD21 LEU B 865 2.644 4.499 2.352 1.00 0.00 H new ATOM 0 HD22 LEU B 865 4.416 4.539 2.196 1.00 0.00 H new ATOM 0 HD23 LEU B 865 3.592 3.012 2.590 1.00 0.00 H new ATOM 2244 N ALA B 866 3.618 2.402 7.034 1.00 0.00 N ATOM 2245 CA ALA B 866 2.395 1.983 7.641 1.00 0.00 C ATOM 2246 C ALA B 866 2.524 1.887 9.167 1.00 0.00 C ATOM 2247 O ALA B 866 1.535 1.677 9.872 1.00 0.00 O ATOM 2248 CB ALA B 866 1.930 0.679 7.050 1.00 0.00 C ATOM 0 H ALA B 866 4.181 1.654 6.630 1.00 0.00 H new ATOM 0 HA ALA B 866 1.641 2.742 7.430 1.00 0.00 H new ATOM 0 HB1 ALA B 866 0.997 0.376 7.525 1.00 0.00 H new ATOM 0 HB2 ALA B 866 1.768 0.802 5.979 1.00 0.00 H new ATOM 0 HB3 ALA B 866 2.687 -0.087 7.217 1.00 0.00 H new ATOM 2254 N ALA B 867 3.742 2.011 9.665 1.00 0.00 N ATOM 2255 CA ALA B 867 3.990 1.988 11.088 1.00 0.00 C ATOM 2256 C ALA B 867 4.140 3.401 11.625 1.00 0.00 C ATOM 2257 O ALA B 867 4.315 3.607 12.827 1.00 0.00 O ATOM 2258 CB ALA B 867 5.232 1.169 11.403 1.00 0.00 C ATOM 0 H ALA B 867 4.579 2.130 9.095 1.00 0.00 H new ATOM 0 HA ALA B 867 3.135 1.520 11.576 1.00 0.00 H new ATOM 0 HB1 ALA B 867 5.401 1.164 12.480 1.00 0.00 H new ATOM 0 HB2 ALA B 867 5.092 0.146 11.053 1.00 0.00 H new ATOM 0 HB3 ALA B 867 6.094 1.609 10.902 1.00 0.00 H new ATOM 2264 N LEU B 868 4.099 4.374 10.740 1.00 0.00 N ATOM 2265 CA LEU B 868 4.189 5.744 11.157 1.00 0.00 C ATOM 2266 C LEU B 868 2.803 6.385 11.211 1.00 0.00 C ATOM 2267 O LEU B 868 1.869 5.933 10.534 1.00 0.00 O ATOM 2268 CB LEU B 868 5.252 6.548 10.343 1.00 0.00 C ATOM 2269 CG LEU B 868 5.114 6.649 8.817 1.00 0.00 C ATOM 2270 CD1 LEU B 868 3.967 7.536 8.396 1.00 0.00 C ATOM 2271 CD2 LEU B 868 6.409 7.139 8.208 1.00 0.00 C ATOM 0 H LEU B 868 4.004 4.236 9.734 1.00 0.00 H new ATOM 0 HA LEU B 868 4.569 5.771 12.178 1.00 0.00 H new ATOM 0 HB2 LEU B 868 5.267 7.564 10.738 1.00 0.00 H new ATOM 0 HB3 LEU B 868 6.227 6.109 10.555 1.00 0.00 H new ATOM 0 HG LEU B 868 4.893 5.648 8.447 1.00 0.00 H new ATOM 0 HD11 LEU B 868 3.915 7.572 7.308 1.00 0.00 H new ATOM 0 HD12 LEU B 868 3.033 7.135 8.791 1.00 0.00 H new ATOM 0 HD13 LEU B 868 4.123 8.542 8.785 1.00 0.00 H new ATOM 0 HD21 LEU B 868 6.299 7.207 7.126 1.00 0.00 H new ATOM 0 HD22 LEU B 868 6.651 8.123 8.610 1.00 0.00 H new ATOM 0 HD23 LEU B 868 7.211 6.441 8.448 1.00 0.00 H new ATOM 2283 N SER B 869 2.665 7.387 12.020 1.00 0.00 N ATOM 2284 CA SER B 869 1.397 8.014 12.258 1.00 0.00 C ATOM 2285 C SER B 869 1.141 9.135 11.239 1.00 0.00 C ATOM 2286 O SER B 869 2.026 9.473 10.431 1.00 0.00 O ATOM 2287 CB SER B 869 1.380 8.535 13.697 1.00 0.00 C ATOM 2288 OG SER B 869 0.097 8.967 14.097 1.00 0.00 O ATOM 0 H SER B 869 3.438 7.800 12.542 1.00 0.00 H new ATOM 0 HA SER B 869 0.591 7.291 12.131 1.00 0.00 H new ATOM 0 HB2 SER B 869 1.722 7.748 14.370 1.00 0.00 H new ATOM 0 HB3 SER B 869 2.084 9.362 13.790 1.00 0.00 H new ATOM 0 HG SER B 869 0.134 9.289 15.022 1.00 0.00 H new ATOM 2294 N GLN B 870 -0.049 9.732 11.304 1.00 0.00 N ATOM 2295 CA GLN B 870 -0.461 10.725 10.340 1.00 0.00 C ATOM 2296 C GLN B 870 0.429 11.952 10.329 1.00 0.00 C ATOM 2297 O GLN B 870 0.779 12.434 9.267 1.00 0.00 O ATOM 2298 CB GLN B 870 -1.935 11.117 10.479 1.00 0.00 C ATOM 2299 CG GLN B 870 -2.325 12.208 9.498 1.00 0.00 C ATOM 2300 CD GLN B 870 -3.786 12.493 9.430 1.00 0.00 C ATOM 2301 OE1 GLN B 870 -4.534 12.311 10.400 1.00 0.00 O ATOM 2302 NE2 GLN B 870 -4.197 12.983 8.297 1.00 0.00 N ATOM 0 H GLN B 870 -0.743 9.536 12.025 1.00 0.00 H new ATOM 0 HA GLN B 870 -0.345 10.238 9.372 1.00 0.00 H new ATOM 0 HB2 GLN B 870 -2.561 10.240 10.315 1.00 0.00 H new ATOM 0 HB3 GLN B 870 -2.126 11.458 11.496 1.00 0.00 H new ATOM 0 HG2 GLN B 870 -1.802 13.125 9.769 1.00 0.00 H new ATOM 0 HG3 GLN B 870 -1.977 11.925 8.504 1.00 0.00 H new ATOM 0 HE21 GLN B 870 -3.539 13.113 7.529 1.00 0.00 H new ATOM 0 HE22 GLN B 870 -5.177 13.237 8.177 1.00 0.00 H new ATOM 2311 N ASP B 871 0.813 12.437 11.487 1.00 0.00 N ATOM 2312 CA ASP B 871 1.661 13.638 11.562 1.00 0.00 C ATOM 2313 C ASP B 871 2.981 13.418 10.836 1.00 0.00 C ATOM 2314 O ASP B 871 3.471 14.300 10.133 1.00 0.00 O ATOM 2315 CB ASP B 871 1.915 14.055 13.007 1.00 0.00 C ATOM 2316 CG ASP B 871 2.726 15.331 13.104 1.00 0.00 C ATOM 2317 OD1 ASP B 871 2.138 16.428 13.011 1.00 0.00 O ATOM 2318 OD2 ASP B 871 3.952 15.255 13.291 1.00 0.00 O ATOM 0 H ASP B 871 0.563 12.034 12.390 1.00 0.00 H new ATOM 0 HA ASP B 871 1.122 14.447 11.068 1.00 0.00 H new ATOM 0 HB2 ASP B 871 0.961 14.194 13.516 1.00 0.00 H new ATOM 0 HB3 ASP B 871 2.440 13.253 13.527 1.00 0.00 H new ATOM 2323 N GLU B 872 3.501 12.212 10.955 1.00 0.00 N ATOM 2324 CA GLU B 872 4.737 11.824 10.304 1.00 0.00 C ATOM 2325 C GLU B 872 4.585 11.898 8.789 1.00 0.00 C ATOM 2326 O GLU B 872 5.312 12.632 8.120 1.00 0.00 O ATOM 2327 CB GLU B 872 5.128 10.412 10.730 1.00 0.00 C ATOM 2328 CG GLU B 872 5.460 10.283 12.202 1.00 0.00 C ATOM 2329 CD GLU B 872 6.676 11.088 12.583 1.00 0.00 C ATOM 2330 OE1 GLU B 872 7.809 10.587 12.404 1.00 0.00 O ATOM 2331 OE2 GLU B 872 6.525 12.232 13.058 1.00 0.00 O ATOM 0 H GLU B 872 3.075 11.469 11.509 1.00 0.00 H new ATOM 0 HA GLU B 872 5.525 12.514 10.605 1.00 0.00 H new ATOM 0 HB2 GLU B 872 4.310 9.732 10.491 1.00 0.00 H new ATOM 0 HB3 GLU B 872 5.990 10.092 10.144 1.00 0.00 H new ATOM 0 HG2 GLU B 872 4.607 10.613 12.795 1.00 0.00 H new ATOM 0 HG3 GLU B 872 5.630 9.234 12.444 1.00 0.00 H new ATOM 2338 N LEU B 873 3.596 11.195 8.259 1.00 0.00 N ATOM 2339 CA LEU B 873 3.364 11.186 6.818 1.00 0.00 C ATOM 2340 C LEU B 873 2.942 12.554 6.290 1.00 0.00 C ATOM 2341 O LEU B 873 3.280 12.919 5.185 1.00 0.00 O ATOM 2342 CB LEU B 873 2.413 10.035 6.390 1.00 0.00 C ATOM 2343 CG LEU B 873 1.081 9.895 7.138 1.00 0.00 C ATOM 2344 CD1 LEU B 873 0.033 10.836 6.599 1.00 0.00 C ATOM 2345 CD2 LEU B 873 0.588 8.458 7.128 1.00 0.00 C ATOM 0 H LEU B 873 2.944 10.626 8.798 1.00 0.00 H new ATOM 0 HA LEU B 873 4.320 10.974 6.339 1.00 0.00 H new ATOM 0 HB2 LEU B 873 2.191 10.160 5.330 1.00 0.00 H new ATOM 0 HB3 LEU B 873 2.956 9.095 6.493 1.00 0.00 H new ATOM 0 HG LEU B 873 1.265 10.176 8.175 1.00 0.00 H new ATOM 0 HD11 LEU B 873 -0.895 10.705 7.156 1.00 0.00 H new ATOM 0 HD12 LEU B 873 0.378 11.864 6.706 1.00 0.00 H new ATOM 0 HD13 LEU B 873 -0.143 10.620 5.545 1.00 0.00 H new ATOM 0 HD21 LEU B 873 -0.358 8.394 7.666 1.00 0.00 H new ATOM 0 HD22 LEU B 873 0.442 8.130 6.099 1.00 0.00 H new ATOM 0 HD23 LEU B 873 1.325 7.817 7.612 1.00 0.00 H new ATOM 2357 N THR B 874 2.257 13.317 7.105 1.00 0.00 N ATOM 2358 CA THR B 874 1.859 14.650 6.752 1.00 0.00 C ATOM 2359 C THR B 874 3.103 15.560 6.607 1.00 0.00 C ATOM 2360 O THR B 874 3.188 16.368 5.677 1.00 0.00 O ATOM 2361 CB THR B 874 0.850 15.194 7.800 1.00 0.00 C ATOM 2362 OG1 THR B 874 -0.332 14.382 7.784 1.00 0.00 O ATOM 2363 CG2 THR B 874 0.483 16.638 7.556 1.00 0.00 C ATOM 0 H THR B 874 1.960 13.026 8.036 1.00 0.00 H new ATOM 0 HA THR B 874 1.355 14.639 5.786 1.00 0.00 H new ATOM 0 HB THR B 874 1.331 15.148 8.777 1.00 0.00 H new ATOM 0 HG1 THR B 874 -0.170 13.559 8.290 1.00 0.00 H new ATOM 0 HG21 THR B 874 -0.225 16.967 8.317 1.00 0.00 H new ATOM 0 HG22 THR B 874 1.381 17.255 7.604 1.00 0.00 H new ATOM 0 HG23 THR B 874 0.028 16.736 6.571 1.00 0.00 H new ATOM 2371 N SER B 875 4.078 15.370 7.485 1.00 0.00 N ATOM 2372 CA SER B 875 5.322 16.112 7.438 1.00 0.00 C ATOM 2373 C SER B 875 6.129 15.698 6.192 1.00 0.00 C ATOM 2374 O SER B 875 6.648 16.545 5.463 1.00 0.00 O ATOM 2375 CB SER B 875 6.134 15.841 8.722 1.00 0.00 C ATOM 2376 OG SER B 875 7.290 16.677 8.817 1.00 0.00 O ATOM 0 H SER B 875 4.025 14.696 8.249 1.00 0.00 H new ATOM 0 HA SER B 875 5.108 17.179 7.376 1.00 0.00 H new ATOM 0 HB2 SER B 875 5.498 16.003 9.593 1.00 0.00 H new ATOM 0 HB3 SER B 875 6.441 14.795 8.741 1.00 0.00 H new ATOM 0 HG SER B 875 7.774 16.474 9.645 1.00 0.00 H new ATOM 2382 N ILE B 876 6.199 14.396 5.954 1.00 0.00 N ATOM 2383 CA ILE B 876 6.935 13.838 4.825 1.00 0.00 C ATOM 2384 C ILE B 876 6.317 14.268 3.483 1.00 0.00 C ATOM 2385 O ILE B 876 7.009 14.790 2.613 1.00 0.00 O ATOM 2386 CB ILE B 876 6.994 12.282 4.919 1.00 0.00 C ATOM 2387 CG1 ILE B 876 7.733 11.860 6.202 1.00 0.00 C ATOM 2388 CG2 ILE B 876 7.667 11.675 3.689 1.00 0.00 C ATOM 2389 CD1 ILE B 876 7.762 10.365 6.442 1.00 0.00 C ATOM 0 H ILE B 876 5.746 13.694 6.539 1.00 0.00 H new ATOM 0 HA ILE B 876 7.951 14.230 4.869 1.00 0.00 H new ATOM 0 HB ILE B 876 5.972 11.905 4.956 1.00 0.00 H new ATOM 0 HG12 ILE B 876 8.758 12.228 6.155 1.00 0.00 H new ATOM 0 HG13 ILE B 876 7.259 12.344 7.056 1.00 0.00 H new ATOM 0 HG21 ILE B 876 7.692 10.590 3.786 1.00 0.00 H new ATOM 0 HG22 ILE B 876 7.105 11.946 2.795 1.00 0.00 H new ATOM 0 HG23 ILE B 876 8.685 12.055 3.606 1.00 0.00 H new ATOM 0 HD11 ILE B 876 8.301 10.155 7.366 1.00 0.00 H new ATOM 0 HD12 ILE B 876 6.742 9.990 6.524 1.00 0.00 H new ATOM 0 HD13 ILE B 876 8.264 9.872 5.609 1.00 0.00 H new ATOM 2401 N LEU B 877 5.019 14.064 3.339 1.00 0.00 N ATOM 2402 CA LEU B 877 4.304 14.397 2.102 1.00 0.00 C ATOM 2403 C LEU B 877 4.234 15.893 1.879 1.00 0.00 C ATOM 2404 O LEU B 877 4.400 16.366 0.755 1.00 0.00 O ATOM 2405 CB LEU B 877 2.890 13.784 2.082 1.00 0.00 C ATOM 2406 CG LEU B 877 2.757 12.301 1.663 1.00 0.00 C ATOM 2407 CD1 LEU B 877 3.681 11.381 2.438 1.00 0.00 C ATOM 2408 CD2 LEU B 877 1.323 11.842 1.820 1.00 0.00 C ATOM 0 H LEU B 877 4.427 13.665 4.067 1.00 0.00 H new ATOM 0 HA LEU B 877 4.875 13.961 1.283 1.00 0.00 H new ATOM 0 HB2 LEU B 877 2.464 13.891 3.080 1.00 0.00 H new ATOM 0 HB3 LEU B 877 2.275 14.380 1.407 1.00 0.00 H new ATOM 0 HG LEU B 877 3.055 12.243 0.616 1.00 0.00 H new ATOM 0 HD11 LEU B 877 3.541 10.355 2.099 1.00 0.00 H new ATOM 0 HD12 LEU B 877 4.716 11.680 2.272 1.00 0.00 H new ATOM 0 HD13 LEU B 877 3.451 11.446 3.501 1.00 0.00 H new ATOM 0 HD21 LEU B 877 1.241 10.797 1.522 1.00 0.00 H new ATOM 0 HD22 LEU B 877 1.019 11.948 2.861 1.00 0.00 H new ATOM 0 HD23 LEU B 877 0.675 12.451 1.189 1.00 0.00 H new ATOM 2420 N GLY B 878 3.964 16.631 2.936 1.00 0.00 N ATOM 2421 CA GLY B 878 3.938 18.066 2.843 1.00 0.00 C ATOM 2422 C GLY B 878 2.574 18.630 2.527 1.00 0.00 C ATOM 2423 O GLY B 878 2.373 19.843 2.598 1.00 0.00 O ATOM 0 H GLY B 878 3.761 16.258 3.863 1.00 0.00 H new ATOM 0 HA2 GLY B 878 4.286 18.488 3.785 1.00 0.00 H new ATOM 0 HA3 GLY B 878 4.640 18.384 2.072 1.00 0.00 H new ATOM 2427 N ASN B 879 1.635 17.778 2.162 1.00 0.00 N ATOM 2428 CA ASN B 879 0.287 18.238 1.856 1.00 0.00 C ATOM 2429 C ASN B 879 -0.697 17.455 2.697 1.00 0.00 C ATOM 2430 O ASN B 879 -0.678 16.222 2.675 1.00 0.00 O ATOM 2431 CB ASN B 879 -0.031 18.019 0.385 1.00 0.00 C ATOM 2432 CG ASN B 879 -0.856 19.152 -0.202 1.00 0.00 C ATOM 2433 OD1 ASN B 879 -0.320 20.142 -0.693 1.00 0.00 O ATOM 2434 ND2 ASN B 879 -2.150 19.019 -0.167 1.00 0.00 N ATOM 0 H ASN B 879 1.775 16.772 2.070 1.00 0.00 H new ATOM 0 HA ASN B 879 0.215 19.303 2.075 1.00 0.00 H new ATOM 0 HB2 ASN B 879 0.899 17.922 -0.175 1.00 0.00 H new ATOM 0 HB3 ASN B 879 -0.572 17.080 0.269 1.00 0.00 H new ATOM 0 HD21 ASN B 879 -2.748 19.749 -0.554 1.00 0.00 H new ATOM 0 HD22 ASN B 879 -2.566 18.185 0.248 1.00 0.00 H new ATOM 2441 N ALA B 880 -1.564 18.152 3.412 1.00 0.00 N ATOM 2442 CA ALA B 880 -2.510 17.515 4.336 1.00 0.00 C ATOM 2443 C ALA B 880 -3.527 16.633 3.619 1.00 0.00 C ATOM 2444 O ALA B 880 -3.802 15.529 4.062 1.00 0.00 O ATOM 2445 CB ALA B 880 -3.203 18.552 5.198 1.00 0.00 C ATOM 0 H ALA B 880 -1.638 19.169 3.375 1.00 0.00 H new ATOM 0 HA ALA B 880 -1.927 16.859 4.982 1.00 0.00 H new ATOM 0 HB1 ALA B 880 -3.899 18.056 5.875 1.00 0.00 H new ATOM 0 HB2 ALA B 880 -2.460 19.098 5.779 1.00 0.00 H new ATOM 0 HB3 ALA B 880 -3.749 19.248 4.561 1.00 0.00 H new ATOM 2451 N ALA B 881 -4.070 17.117 2.502 1.00 0.00 N ATOM 2452 CA ALA B 881 -5.051 16.345 1.716 1.00 0.00 C ATOM 2453 C ALA B 881 -4.455 15.036 1.254 1.00 0.00 C ATOM 2454 O ALA B 881 -5.073 13.980 1.381 1.00 0.00 O ATOM 2455 CB ALA B 881 -5.517 17.128 0.508 1.00 0.00 C ATOM 0 H ALA B 881 -3.853 18.036 2.116 1.00 0.00 H new ATOM 0 HA ALA B 881 -5.904 16.147 2.365 1.00 0.00 H new ATOM 0 HB1 ALA B 881 -6.239 16.535 -0.053 1.00 0.00 H new ATOM 0 HB2 ALA B 881 -5.985 18.057 0.835 1.00 0.00 H new ATOM 0 HB3 ALA B 881 -4.663 17.357 -0.129 1.00 0.00 H new ATOM 2461 N ASN B 882 -3.243 15.131 0.740 1.00 0.00 N ATOM 2462 CA ASN B 882 -2.472 13.990 0.245 1.00 0.00 C ATOM 2463 C ASN B 882 -2.294 12.996 1.354 1.00 0.00 C ATOM 2464 O ASN B 882 -2.555 11.803 1.195 1.00 0.00 O ATOM 2465 CB ASN B 882 -1.082 14.453 -0.213 1.00 0.00 C ATOM 2466 CG ASN B 882 -1.082 15.397 -1.386 1.00 0.00 C ATOM 2467 OD1 ASN B 882 -2.014 16.174 -1.590 1.00 0.00 O ATOM 2468 ND2 ASN B 882 -0.028 15.362 -2.136 1.00 0.00 N ATOM 0 H ASN B 882 -2.750 16.020 0.650 1.00 0.00 H new ATOM 0 HA ASN B 882 -3.006 13.540 -0.592 1.00 0.00 H new ATOM 0 HB2 ASN B 882 -0.582 14.939 0.625 1.00 0.00 H new ATOM 0 HB3 ASN B 882 -0.490 13.575 -0.472 1.00 0.00 H new ATOM 0 HD21 ASN B 882 0.053 15.995 -2.932 1.00 0.00 H new ATOM 0 HD22 ASN B 882 0.722 14.702 -1.931 1.00 0.00 H new ATOM 2475 N ALA B 883 -1.891 13.521 2.499 1.00 0.00 N ATOM 2476 CA ALA B 883 -1.659 12.739 3.682 1.00 0.00 C ATOM 2477 C ALA B 883 -2.924 12.052 4.140 1.00 0.00 C ATOM 2478 O ALA B 883 -2.888 10.917 4.524 1.00 0.00 O ATOM 2479 CB ALA B 883 -1.076 13.614 4.756 1.00 0.00 C ATOM 0 H ALA B 883 -1.716 14.518 2.625 1.00 0.00 H new ATOM 0 HA ALA B 883 -0.942 11.951 3.454 1.00 0.00 H new ATOM 0 HB1 ALA B 883 -0.900 13.021 5.653 1.00 0.00 H new ATOM 0 HB2 ALA B 883 -0.133 14.036 4.409 1.00 0.00 H new ATOM 0 HB3 ALA B 883 -1.772 14.421 4.985 1.00 0.00 H new ATOM 2485 N LYS B 884 -4.034 12.749 4.066 1.00 0.00 N ATOM 2486 CA LYS B 884 -5.344 12.198 4.389 1.00 0.00 C ATOM 2487 C LYS B 884 -5.669 11.009 3.491 1.00 0.00 C ATOM 2488 O LYS B 884 -6.082 9.975 3.990 1.00 0.00 O ATOM 2489 CB LYS B 884 -6.396 13.308 4.238 1.00 0.00 C ATOM 2490 CG LYS B 884 -7.870 12.902 4.004 1.00 0.00 C ATOM 2491 CD LYS B 884 -8.670 12.484 5.248 1.00 0.00 C ATOM 2492 CE LYS B 884 -8.461 11.036 5.629 1.00 0.00 C ATOM 2493 NZ LYS B 884 -9.465 10.566 6.611 1.00 0.00 N ATOM 0 H LYS B 884 -4.061 13.727 3.777 1.00 0.00 H new ATOM 0 HA LYS B 884 -5.345 11.835 5.417 1.00 0.00 H new ATOM 0 HB2 LYS B 884 -6.360 13.923 5.137 1.00 0.00 H new ATOM 0 HB3 LYS B 884 -6.091 13.943 3.406 1.00 0.00 H new ATOM 0 HG2 LYS B 884 -8.384 13.740 3.533 1.00 0.00 H new ATOM 0 HG3 LYS B 884 -7.888 12.076 3.293 1.00 0.00 H new ATOM 0 HD2 LYS B 884 -8.384 13.119 6.087 1.00 0.00 H new ATOM 0 HD3 LYS B 884 -9.731 12.656 5.065 1.00 0.00 H new ATOM 0 HE2 LYS B 884 -8.512 10.416 4.734 1.00 0.00 H new ATOM 0 HE3 LYS B 884 -7.462 10.912 6.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 884 -9.645 9.552 6.465 1.00 0.00 H new ATOM 0 HZ2 LYS B 884 -9.106 10.718 7.575 1.00 0.00 H new ATOM 0 HZ3 LYS B 884 -10.350 11.097 6.484 1.00 0.00 H new ATOM 2507 N GLN B 885 -5.432 11.147 2.187 1.00 0.00 N ATOM 2508 CA GLN B 885 -5.785 10.095 1.229 1.00 0.00 C ATOM 2509 C GLN B 885 -4.986 8.840 1.540 1.00 0.00 C ATOM 2510 O GLN B 885 -5.535 7.748 1.713 1.00 0.00 O ATOM 2511 CB GLN B 885 -5.468 10.519 -0.217 1.00 0.00 C ATOM 2512 CG GLN B 885 -5.995 11.882 -0.669 1.00 0.00 C ATOM 2513 CD GLN B 885 -7.444 12.116 -0.334 1.00 0.00 C ATOM 2514 OE1 GLN B 885 -8.348 11.742 -1.076 1.00 0.00 O ATOM 2515 NE2 GLN B 885 -7.672 12.820 0.729 1.00 0.00 N ATOM 0 H GLN B 885 -5.000 11.971 1.770 1.00 0.00 H new ATOM 0 HA GLN B 885 -6.856 9.911 1.318 1.00 0.00 H new ATOM 0 HB2 GLN B 885 -4.385 10.515 -0.342 1.00 0.00 H new ATOM 0 HB3 GLN B 885 -5.869 9.760 -0.889 1.00 0.00 H new ATOM 0 HG2 GLN B 885 -5.394 12.665 -0.206 1.00 0.00 H new ATOM 0 HG3 GLN B 885 -5.862 11.973 -1.747 1.00 0.00 H new ATOM 0 HE21 GLN B 885 -6.896 13.113 1.323 1.00 0.00 H new ATOM 0 HE22 GLN B 885 -8.627 13.081 0.973 1.00 0.00 H new ATOM 2524 N LEU B 886 -3.700 9.046 1.653 1.00 0.00 N ATOM 2525 CA LEU B 886 -2.727 8.041 1.897 1.00 0.00 C ATOM 2526 C LEU B 886 -2.969 7.358 3.261 1.00 0.00 C ATOM 2527 O LEU B 886 -3.120 6.136 3.336 1.00 0.00 O ATOM 2528 CB LEU B 886 -1.381 8.783 1.802 1.00 0.00 C ATOM 2529 CG LEU B 886 -0.063 8.044 1.962 1.00 0.00 C ATOM 2530 CD1 LEU B 886 0.248 7.729 3.409 1.00 0.00 C ATOM 2531 CD2 LEU B 886 0.001 6.800 1.095 1.00 0.00 C ATOM 0 H LEU B 886 -3.291 9.977 1.571 1.00 0.00 H new ATOM 0 HA LEU B 886 -2.762 7.219 1.182 1.00 0.00 H new ATOM 0 HB2 LEU B 886 -1.355 9.273 0.829 1.00 0.00 H new ATOM 0 HB3 LEU B 886 -1.398 9.571 2.555 1.00 0.00 H new ATOM 0 HG LEU B 886 0.714 8.723 1.611 1.00 0.00 H new ATOM 0 HD11 LEU B 886 1.200 7.201 3.470 1.00 0.00 H new ATOM 0 HD12 LEU B 886 0.311 8.657 3.978 1.00 0.00 H new ATOM 0 HD13 LEU B 886 -0.542 7.102 3.823 1.00 0.00 H new ATOM 0 HD21 LEU B 886 0.960 6.303 1.241 1.00 0.00 H new ATOM 0 HD22 LEU B 886 -0.805 6.121 1.373 1.00 0.00 H new ATOM 0 HD23 LEU B 886 -0.106 7.081 0.047 1.00 0.00 H new ATOM 2543 N TYR B 887 -3.041 8.165 4.307 1.00 0.00 N ATOM 2544 CA TYR B 887 -3.231 7.696 5.677 1.00 0.00 C ATOM 2545 C TYR B 887 -4.503 6.900 5.833 1.00 0.00 C ATOM 2546 O TYR B 887 -4.477 5.781 6.375 1.00 0.00 O ATOM 2547 CB TYR B 887 -3.223 8.895 6.649 1.00 0.00 C ATOM 2548 CG TYR B 887 -3.717 8.607 8.052 1.00 0.00 C ATOM 2549 CD1 TYR B 887 -2.931 7.934 8.986 1.00 0.00 C ATOM 2550 CD2 TYR B 887 -4.990 9.010 8.435 1.00 0.00 C ATOM 2551 CE1 TYR B 887 -3.404 7.680 10.254 1.00 0.00 C ATOM 2552 CE2 TYR B 887 -5.466 8.761 9.698 1.00 0.00 C ATOM 2553 CZ TYR B 887 -4.671 8.094 10.608 1.00 0.00 C ATOM 2554 OH TYR B 887 -5.140 7.849 11.884 1.00 0.00 O ATOM 0 H TYR B 887 -2.968 9.180 4.231 1.00 0.00 H new ATOM 0 HA TYR B 887 -2.403 7.029 5.917 1.00 0.00 H new ATOM 0 HB2 TYR B 887 -2.205 9.280 6.714 1.00 0.00 H new ATOM 0 HB3 TYR B 887 -3.837 9.688 6.223 1.00 0.00 H new ATOM 0 HD1 TYR B 887 -1.939 7.608 8.712 1.00 0.00 H new ATOM 0 HD2 TYR B 887 -5.617 9.529 7.725 1.00 0.00 H new ATOM 0 HE1 TYR B 887 -2.785 7.158 10.969 1.00 0.00 H new ATOM 0 HE2 TYR B 887 -6.457 9.085 9.978 1.00 0.00 H new ATOM 0 HH TYR B 887 -6.049 8.205 11.972 1.00 0.00 H new ATOM 2564 N ASP B 888 -5.600 7.465 5.353 1.00 0.00 N ATOM 2565 CA ASP B 888 -6.913 6.859 5.508 1.00 0.00 C ATOM 2566 C ASP B 888 -6.936 5.511 4.863 1.00 0.00 C ATOM 2567 O ASP B 888 -7.343 4.558 5.475 1.00 0.00 O ATOM 2568 CB ASP B 888 -7.982 7.742 4.896 1.00 0.00 C ATOM 2569 CG ASP B 888 -9.394 7.320 5.229 1.00 0.00 C ATOM 2570 OD1 ASP B 888 -10.000 6.540 4.482 1.00 0.00 O ATOM 2571 OD2 ASP B 888 -9.941 7.828 6.238 1.00 0.00 O ATOM 0 H ASP B 888 -5.606 8.351 4.848 1.00 0.00 H new ATOM 0 HA ASP B 888 -7.119 6.749 6.573 1.00 0.00 H new ATOM 0 HB2 ASP B 888 -7.831 8.767 5.236 1.00 0.00 H new ATOM 0 HB3 ASP B 888 -7.860 7.744 3.813 1.00 0.00 H new ATOM 2576 N PHE B 889 -6.405 5.444 3.650 1.00 0.00 N ATOM 2577 CA PHE B 889 -6.355 4.225 2.871 1.00 0.00 C ATOM 2578 C PHE B 889 -5.652 3.090 3.596 1.00 0.00 C ATOM 2579 O PHE B 889 -6.188 1.985 3.699 1.00 0.00 O ATOM 2580 CB PHE B 889 -5.683 4.462 1.525 1.00 0.00 C ATOM 2581 CG PHE B 889 -5.417 3.186 0.796 1.00 0.00 C ATOM 2582 CD1 PHE B 889 -6.452 2.471 0.247 1.00 0.00 C ATOM 2583 CD2 PHE B 889 -4.130 2.690 0.693 1.00 0.00 C ATOM 2584 CE1 PHE B 889 -6.216 1.290 -0.392 1.00 0.00 C ATOM 2585 CE2 PHE B 889 -3.886 1.507 0.046 1.00 0.00 C ATOM 2586 CZ PHE B 889 -4.927 0.805 -0.497 1.00 0.00 C ATOM 0 H PHE B 889 -5.993 6.248 3.177 1.00 0.00 H new ATOM 0 HA PHE B 889 -7.391 3.926 2.714 1.00 0.00 H new ATOM 0 HB2 PHE B 889 -6.316 5.103 0.912 1.00 0.00 H new ATOM 0 HB3 PHE B 889 -4.744 4.994 1.678 1.00 0.00 H new ATOM 0 HD1 PHE B 889 -7.462 2.847 0.322 1.00 0.00 H new ATOM 0 HD2 PHE B 889 -3.309 3.241 1.127 1.00 0.00 H new ATOM 0 HE1 PHE B 889 -7.038 0.733 -0.817 1.00 0.00 H new ATOM 0 HE2 PHE B 889 -2.877 1.131 -0.035 1.00 0.00 H new ATOM 0 HZ PHE B 889 -4.741 -0.128 -1.008 1.00 0.00 H new ATOM 2596 N ILE B 890 -4.460 3.364 4.081 1.00 0.00 N ATOM 2597 CA ILE B 890 -3.651 2.367 4.759 1.00 0.00 C ATOM 2598 C ILE B 890 -4.389 1.843 5.971 1.00 0.00 C ATOM 2599 O ILE B 890 -4.351 0.654 6.273 1.00 0.00 O ATOM 2600 CB ILE B 890 -2.291 2.971 5.203 1.00 0.00 C ATOM 2601 CG1 ILE B 890 -1.531 3.488 3.983 1.00 0.00 C ATOM 2602 CG2 ILE B 890 -1.444 1.944 5.969 1.00 0.00 C ATOM 2603 CD1 ILE B 890 -0.250 4.220 4.322 1.00 0.00 C ATOM 0 H ILE B 890 -4.022 4.283 4.018 1.00 0.00 H new ATOM 0 HA ILE B 890 -3.461 1.549 4.064 1.00 0.00 H new ATOM 0 HB ILE B 890 -2.491 3.802 5.880 1.00 0.00 H new ATOM 0 HG12 ILE B 890 -1.295 2.647 3.331 1.00 0.00 H new ATOM 0 HG13 ILE B 890 -2.181 4.156 3.419 1.00 0.00 H new ATOM 0 HG21 ILE B 890 -0.499 2.400 6.265 1.00 0.00 H new ATOM 0 HG22 ILE B 890 -1.984 1.618 6.858 1.00 0.00 H new ATOM 0 HG23 ILE B 890 -1.247 1.084 5.328 1.00 0.00 H new ATOM 0 HD11 ILE B 890 0.231 4.556 3.403 1.00 0.00 H new ATOM 0 HD12 ILE B 890 -0.479 5.082 4.948 1.00 0.00 H new ATOM 0 HD13 ILE B 890 0.421 3.550 4.859 1.00 0.00 H new ATOM 2615 N HIS B 891 -5.138 2.724 6.584 1.00 0.00 N ATOM 2616 CA HIS B 891 -5.815 2.419 7.824 1.00 0.00 C ATOM 2617 C HIS B 891 -7.302 2.157 7.611 1.00 0.00 C ATOM 2618 O HIS B 891 -8.094 2.258 8.553 1.00 0.00 O ATOM 2619 CB HIS B 891 -5.611 3.563 8.833 1.00 0.00 C ATOM 2620 CG HIS B 891 -4.182 3.707 9.230 1.00 0.00 C ATOM 2621 ND1 HIS B 891 -3.255 4.344 8.457 1.00 0.00 N ATOM 2622 CD2 HIS B 891 -3.506 3.200 10.284 1.00 0.00 C ATOM 2623 CE1 HIS B 891 -2.072 4.199 9.023 1.00 0.00 C ATOM 2624 NE2 HIS B 891 -2.154 3.513 10.147 1.00 0.00 N ATOM 0 H HIS B 891 -5.297 3.671 6.241 1.00 0.00 H new ATOM 0 HA HIS B 891 -5.378 1.504 8.224 1.00 0.00 H new ATOM 0 HB2 HIS B 891 -5.962 4.498 8.397 1.00 0.00 H new ATOM 0 HB3 HIS B 891 -6.217 3.377 9.720 1.00 0.00 H new ATOM 0 HD1 HIS B 891 -3.444 4.846 7.590 1.00 0.00 H new ATOM 0 HD2 HIS B 891 -3.942 2.643 11.100 1.00 0.00 H new ATOM 0 HE1 HIS B 891 -1.152 4.593 8.617 1.00 0.00 H new ATOM 2632 N THR B 892 -7.692 1.811 6.399 1.00 0.00 N ATOM 2633 CA THR B 892 -9.075 1.550 6.127 1.00 0.00 C ATOM 2634 C THR B 892 -9.212 0.263 5.300 1.00 0.00 C ATOM 2635 O THR B 892 -8.238 -0.231 4.717 1.00 0.00 O ATOM 2636 CB THR B 892 -9.770 2.767 5.407 1.00 0.00 C ATOM 2637 OG1 THR B 892 -11.197 2.692 5.545 1.00 0.00 O ATOM 2638 CG2 THR B 892 -9.444 2.793 3.924 1.00 0.00 C ATOM 0 H THR B 892 -7.069 1.707 5.598 1.00 0.00 H new ATOM 0 HA THR B 892 -9.588 1.412 7.079 1.00 0.00 H new ATOM 0 HB THR B 892 -9.391 3.672 5.882 1.00 0.00 H new ATOM 0 HG1 THR B 892 -11.610 3.457 5.093 1.00 0.00 H new ATOM 0 HG21 THR B 892 -9.939 3.645 3.458 1.00 0.00 H new ATOM 0 HG22 THR B 892 -8.366 2.882 3.790 1.00 0.00 H new ATOM 0 HG23 THR B 892 -9.793 1.871 3.459 1.00 0.00 H new ATOM 2646 N SER B 893 -10.386 -0.287 5.308 1.00 0.00 N ATOM 2647 CA SER B 893 -10.714 -1.464 4.573 1.00 0.00 C ATOM 2648 C SER B 893 -11.725 -1.122 3.484 1.00 0.00 C ATOM 2649 O SER B 893 -12.490 -0.179 3.621 1.00 0.00 O ATOM 2650 CB SER B 893 -11.333 -2.467 5.533 1.00 0.00 C ATOM 2651 OG SER B 893 -10.444 -2.777 6.588 1.00 0.00 O ATOM 0 H SER B 893 -11.168 0.086 5.846 1.00 0.00 H new ATOM 0 HA SER B 893 -9.818 -1.880 4.112 1.00 0.00 H new ATOM 0 HB2 SER B 893 -12.259 -2.061 5.941 1.00 0.00 H new ATOM 0 HB3 SER B 893 -11.594 -3.378 4.994 1.00 0.00 H new ATOM 0 HG SER B 893 -10.866 -3.423 7.192 1.00 0.00 H new ATOM 2657 N PHE B 894 -11.756 -1.890 2.419 1.00 0.00 N ATOM 2658 CA PHE B 894 -12.744 -1.647 1.371 1.00 0.00 C ATOM 2659 C PHE B 894 -14.093 -2.217 1.820 1.00 0.00 C ATOM 2660 O PHE B 894 -15.143 -1.779 1.407 1.00 0.00 O ATOM 2661 CB PHE B 894 -12.316 -2.285 0.027 1.00 0.00 C ATOM 2662 CG PHE B 894 -12.435 -3.791 -0.032 1.00 0.00 C ATOM 2663 CD1 PHE B 894 -11.518 -4.605 0.603 1.00 0.00 C ATOM 2664 CD2 PHE B 894 -13.489 -4.383 -0.716 1.00 0.00 C ATOM 2665 CE1 PHE B 894 -11.646 -5.980 0.555 1.00 0.00 C ATOM 2666 CE2 PHE B 894 -13.621 -5.754 -0.766 1.00 0.00 C ATOM 2667 CZ PHE B 894 -12.698 -6.555 -0.129 1.00 0.00 C ATOM 0 H PHE B 894 -11.127 -2.674 2.249 1.00 0.00 H new ATOM 0 HA PHE B 894 -12.826 -0.572 1.210 1.00 0.00 H new ATOM 0 HB2 PHE B 894 -12.922 -1.856 -0.771 1.00 0.00 H new ATOM 0 HB3 PHE B 894 -11.281 -2.009 -0.176 1.00 0.00 H new ATOM 0 HD1 PHE B 894 -10.693 -4.163 1.142 1.00 0.00 H new ATOM 0 HD2 PHE B 894 -14.216 -3.760 -1.216 1.00 0.00 H new ATOM 0 HE1 PHE B 894 -10.921 -6.606 1.054 1.00 0.00 H new ATOM 0 HE2 PHE B 894 -14.445 -6.199 -1.303 1.00 0.00 H new ATOM 0 HZ PHE B 894 -12.798 -7.630 -0.165 1.00 0.00 H new