USER MOD reduce.3.24.130724 H: found=0, std=0, add=815, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 811 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 475 ASN : amide:sc= -0.365! K(o=2!,f=-0.091) USER MOD Set 1.2: A 479 SER OG : rot 75:sc= 1.23 USER MOD Set 1.3: A 497 SER OG : rot -100:sc= 1.17 USER MOD Single : A 461 GLN : amide:sc= -0.072 X(o=-0.072,f=-0.046) USER MOD Single : A 482 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 THR OG1 : rot -61:sc= 1.04 USER MOD Single : A 487 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 491 CYS SG : rot -29:sc= -0.0269 USER MOD Single : A 494 MET CE :methyl -131:sc= -2.2 (180deg=-6.44!) USER MOD Single : A 498 CYS SG : rot 180:sc= -3.37! USER MOD Single : A 499 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 500 THR OG1 : rot 131:sc=0.000589 USER MOD Single : A 503 SER OG : rot 180:sc= 0 USER MOD Single : A 507 MET CE :methyl 172:sc=-0.00963 (180deg=-0.0421) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 510 HIS : no HD1:sc=-0.00306 X(o=-0.0031,f=-0.0028) USER MOD Single : A 523 SER OG : rot 180:sc= 0 USER MOD Single : A 525 HIS : no HD1:sc= -0.0481 X(o=-0.048,f=-0.048) USER MOD Single : A 529 THR OG1 : rot 65:sc= 1.28 USER MOD Single : A 531 THR OG1 : rot 180:sc= 0 USER MOD Single : A 532 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 545 THR OG1 : rot 180:sc= 0 USER MOD Single : A 550 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 551 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 553 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 231 N LEU A 460 -4.184 2.575 -10.235 1.00 0.00 N ATOM 232 CA LEU A 460 -4.365 3.961 -9.790 1.00 0.00 C ATOM 233 C LEU A 460 -5.508 4.670 -10.547 1.00 0.00 C ATOM 234 O LEU A 460 -6.235 5.458 -9.947 1.00 0.00 O ATOM 235 CB LEU A 460 -3.017 4.716 -9.789 1.00 0.00 C ATOM 236 CG LEU A 460 -2.665 5.493 -11.070 1.00 0.00 C ATOM 237 CD1 LEU A 460 -3.231 6.917 -11.086 1.00 0.00 C ATOM 238 CD2 LEU A 460 -1.152 5.635 -11.220 1.00 0.00 C ATOM 0 HA LEU A 460 -4.699 3.957 -8.752 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.019 5.417 -8.954 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -2.222 3.995 -9.598 1.00 0.00 H new ATOM 0 HG LEU A 460 -3.105 4.913 -11.881 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -2.947 7.411 -12.015 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.318 6.877 -11.013 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -2.831 7.477 -10.241 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -0.927 6.187 -12.132 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -0.750 6.173 -10.361 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.697 4.646 -11.273 1.00 0.00 H new ATOM 250 N GLN A 461 -5.725 4.365 -11.836 1.00 0.00 N ATOM 251 CA GLN A 461 -6.828 4.958 -12.609 1.00 0.00 C ATOM 252 C GLN A 461 -8.169 4.617 -11.955 1.00 0.00 C ATOM 253 O GLN A 461 -8.924 5.518 -11.608 1.00 0.00 O ATOM 254 CB GLN A 461 -6.866 4.540 -14.090 1.00 0.00 C ATOM 255 CG GLN A 461 -5.596 4.728 -14.933 1.00 0.00 C ATOM 256 CD GLN A 461 -4.783 5.972 -14.632 1.00 0.00 C ATOM 257 OE1 GLN A 461 -5.276 7.091 -14.676 1.00 0.00 O ATOM 258 NE2 GLN A 461 -3.505 5.800 -14.358 1.00 0.00 N ATOM 0 H GLN A 461 -5.150 3.710 -12.366 1.00 0.00 H new ATOM 0 HA GLN A 461 -6.647 6.033 -12.598 1.00 0.00 H new ATOM 0 HB2 GLN A 461 -7.139 3.486 -14.131 1.00 0.00 H new ATOM 0 HB3 GLN A 461 -7.670 5.096 -14.572 1.00 0.00 H new ATOM 0 HG2 GLN A 461 -4.957 3.856 -14.792 1.00 0.00 H new ATOM 0 HG3 GLN A 461 -5.881 4.748 -15.985 1.00 0.00 H new ATOM 0 HE21 GLN A 461 -3.112 4.859 -14.326 1.00 0.00 H new ATOM 0 HE22 GLN A 461 -2.909 6.608 -14.178 1.00 0.00 H new ATOM 267 N ARG A 462 -8.440 3.337 -11.672 1.00 0.00 N ATOM 268 CA ARG A 462 -9.649 2.948 -10.929 1.00 0.00 C ATOM 269 C ARG A 462 -9.743 3.618 -9.545 1.00 0.00 C ATOM 270 O ARG A 462 -10.822 4.034 -9.130 1.00 0.00 O ATOM 271 CB ARG A 462 -9.763 1.420 -10.828 1.00 0.00 C ATOM 272 CG ARG A 462 -8.715 0.738 -9.939 1.00 0.00 C ATOM 273 CD ARG A 462 -8.843 -0.787 -9.987 1.00 0.00 C ATOM 274 NE ARG A 462 -7.896 -1.416 -9.050 1.00 0.00 N ATOM 275 CZ ARG A 462 -7.715 -2.712 -8.869 1.00 0.00 C ATOM 276 NH1 ARG A 462 -8.386 -3.613 -9.537 1.00 0.00 N ATOM 277 NH2 ARG A 462 -6.840 -3.136 -8.002 1.00 0.00 N ATOM 0 H ARG A 462 -7.843 2.556 -11.944 1.00 0.00 H new ATOM 0 HA ARG A 462 -10.502 3.316 -11.500 1.00 0.00 H new ATOM 0 HB2 ARG A 462 -10.754 1.171 -10.448 1.00 0.00 H new ATOM 0 HB3 ARG A 462 -9.692 1.000 -11.831 1.00 0.00 H new ATOM 0 HG2 ARG A 462 -7.716 1.030 -10.263 1.00 0.00 H new ATOM 0 HG3 ARG A 462 -8.830 1.081 -8.911 1.00 0.00 H new ATOM 0 HD2 ARG A 462 -9.862 -1.080 -9.734 1.00 0.00 H new ATOM 0 HD3 ARG A 462 -8.651 -1.142 -11.000 1.00 0.00 H new ATOM 0 HE ARG A 462 -7.323 -0.789 -8.485 1.00 0.00 H new ATOM 0 HH11 ARG A 462 -9.079 -3.325 -10.228 1.00 0.00 H new ATOM 0 HH12 ARG A 462 -8.217 -4.604 -9.368 1.00 0.00 H new ATOM 0 HH21 ARG A 462 -6.293 -2.467 -7.461 1.00 0.00 H new ATOM 0 HH22 ARG A 462 -6.702 -4.137 -7.864 1.00 0.00 H new ATOM 291 N LEU A 463 -8.609 3.783 -8.860 1.00 0.00 N ATOM 292 CA LEU A 463 -8.534 4.438 -7.548 1.00 0.00 C ATOM 293 C LEU A 463 -8.972 5.911 -7.550 1.00 0.00 C ATOM 294 O LEU A 463 -9.549 6.347 -6.558 1.00 0.00 O ATOM 295 CB LEU A 463 -7.135 4.224 -6.936 1.00 0.00 C ATOM 296 CG LEU A 463 -6.485 5.391 -6.152 1.00 0.00 C ATOM 297 CD1 LEU A 463 -5.390 4.810 -5.273 1.00 0.00 C ATOM 298 CD2 LEU A 463 -5.778 6.431 -7.031 1.00 0.00 C ATOM 0 H LEU A 463 -7.704 3.462 -9.204 1.00 0.00 H new ATOM 0 HA LEU A 463 -9.271 3.956 -6.906 1.00 0.00 H new ATOM 0 HB2 LEU A 463 -7.194 3.367 -6.266 1.00 0.00 H new ATOM 0 HB3 LEU A 463 -6.458 3.950 -7.745 1.00 0.00 H new ATOM 0 HG LEU A 463 -7.299 5.880 -5.617 1.00 0.00 H new ATOM 0 HD11 LEU A 463 -4.914 5.611 -4.708 1.00 0.00 H new ATOM 0 HD12 LEU A 463 -5.823 4.087 -4.582 1.00 0.00 H new ATOM 0 HD13 LEU A 463 -4.646 4.315 -5.898 1.00 0.00 H new ATOM 0 HD21 LEU A 463 -5.352 7.211 -6.400 1.00 0.00 H new ATOM 0 HD22 LEU A 463 -4.982 5.948 -7.598 1.00 0.00 H new ATOM 0 HD23 LEU A 463 -6.497 6.874 -7.720 1.00 0.00 H new ATOM 310 N GLU A 464 -8.684 6.684 -8.604 1.00 0.00 N ATOM 311 CA GLU A 464 -9.158 8.074 -8.773 1.00 0.00 C ATOM 312 C GLU A 464 -10.533 8.149 -9.413 1.00 0.00 C ATOM 313 O GLU A 464 -11.337 8.990 -9.036 1.00 0.00 O ATOM 314 CB GLU A 464 -8.151 8.986 -9.492 1.00 0.00 C ATOM 315 CG GLU A 464 -7.799 8.611 -10.929 1.00 0.00 C ATOM 316 CD GLU A 464 -6.892 9.680 -11.524 1.00 0.00 C ATOM 317 OE1 GLU A 464 -5.698 9.732 -11.153 1.00 0.00 O ATOM 318 OE2 GLU A 464 -7.382 10.478 -12.354 1.00 0.00 O ATOM 0 H GLU A 464 -8.106 6.361 -9.380 1.00 0.00 H new ATOM 0 HA GLU A 464 -9.250 8.463 -7.759 1.00 0.00 H new ATOM 0 HB2 GLU A 464 -8.549 10.001 -9.492 1.00 0.00 H new ATOM 0 HB3 GLU A 464 -7.230 9.005 -8.909 1.00 0.00 H new ATOM 0 HG2 GLU A 464 -7.301 7.642 -10.952 1.00 0.00 H new ATOM 0 HG3 GLU A 464 -8.707 8.516 -11.525 1.00 0.00 H new ATOM 325 N ARG A 465 -10.829 7.238 -10.335 1.00 0.00 N ATOM 326 CA ARG A 465 -12.094 7.180 -11.058 1.00 0.00 C ATOM 327 C ARG A 465 -13.248 6.786 -10.149 1.00 0.00 C ATOM 328 O ARG A 465 -14.234 7.493 -10.128 1.00 0.00 O ATOM 329 CB ARG A 465 -11.992 6.206 -12.239 1.00 0.00 C ATOM 330 CG ARG A 465 -11.052 6.779 -13.305 1.00 0.00 C ATOM 331 CD ARG A 465 -11.744 7.836 -14.184 1.00 0.00 C ATOM 332 NE ARG A 465 -10.905 9.028 -14.389 1.00 0.00 N ATOM 333 CZ ARG A 465 -9.770 9.105 -15.065 1.00 0.00 C ATOM 334 NH1 ARG A 465 -9.246 8.078 -15.681 1.00 0.00 N ATOM 335 NH2 ARG A 465 -9.129 10.235 -15.135 1.00 0.00 N ATOM 0 H ARG A 465 -10.178 6.501 -10.607 1.00 0.00 H new ATOM 0 HA ARG A 465 -12.299 8.181 -11.437 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -11.621 5.241 -11.895 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -12.980 6.034 -12.667 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -10.184 7.225 -12.819 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -10.684 5.969 -13.935 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -11.990 7.397 -15.151 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -12.685 8.132 -13.720 1.00 0.00 H new ATOM 0 HE ARG A 465 -11.236 9.893 -13.961 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -9.714 7.172 -15.652 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -8.369 8.182 -16.191 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -9.501 11.062 -14.669 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -8.254 10.294 -15.656 1.00 0.00 H new ATOM 349 N LEU A 466 -13.141 5.727 -9.351 1.00 0.00 N ATOM 350 CA LEU A 466 -14.190 5.341 -8.391 1.00 0.00 C ATOM 351 C LEU A 466 -14.689 6.500 -7.469 1.00 0.00 C ATOM 352 O LEU A 466 -15.902 6.724 -7.418 1.00 0.00 O ATOM 353 CB LEU A 466 -13.727 4.107 -7.595 1.00 0.00 C ATOM 354 CG LEU A 466 -13.707 2.788 -8.390 1.00 0.00 C ATOM 355 CD1 LEU A 466 -13.005 1.704 -7.572 1.00 0.00 C ATOM 356 CD2 LEU A 466 -15.110 2.284 -8.730 1.00 0.00 C ATOM 0 H LEU A 466 -12.330 5.109 -9.346 1.00 0.00 H new ATOM 0 HA LEU A 466 -15.075 5.083 -8.972 1.00 0.00 H new ATOM 0 HB2 LEU A 466 -12.725 4.297 -7.210 1.00 0.00 H new ATOM 0 HB3 LEU A 466 -14.382 3.984 -6.732 1.00 0.00 H new ATOM 0 HG LEU A 466 -13.178 2.993 -9.321 1.00 0.00 H new ATOM 0 HD11 LEU A 466 -12.993 0.772 -8.137 1.00 0.00 H new ATOM 0 HD12 LEU A 466 -11.982 2.014 -7.360 1.00 0.00 H new ATOM 0 HD13 LEU A 466 -13.540 1.552 -6.634 1.00 0.00 H new ATOM 0 HD21 LEU A 466 -15.036 1.352 -9.290 1.00 0.00 H new ATOM 0 HD22 LEU A 466 -15.667 2.111 -7.809 1.00 0.00 H new ATOM 0 HD23 LEU A 466 -15.628 3.030 -9.333 1.00 0.00 H new ATOM 368 N PRO A 467 -13.820 7.280 -6.780 1.00 0.00 N ATOM 369 CA PRO A 467 -14.215 8.441 -5.967 1.00 0.00 C ATOM 370 C PRO A 467 -14.586 9.684 -6.791 1.00 0.00 C ATOM 371 O PRO A 467 -15.545 10.375 -6.446 1.00 0.00 O ATOM 372 CB PRO A 467 -13.016 8.748 -5.065 1.00 0.00 C ATOM 373 CG PRO A 467 -11.823 8.193 -5.834 1.00 0.00 C ATOM 374 CD PRO A 467 -12.412 6.999 -6.578 1.00 0.00 C ATOM 0 HA PRO A 467 -15.119 8.195 -5.409 1.00 0.00 H new ATOM 0 HB2 PRO A 467 -12.914 9.819 -4.888 1.00 0.00 H new ATOM 0 HB3 PRO A 467 -13.118 8.272 -4.090 1.00 0.00 H new ATOM 0 HG2 PRO A 467 -11.408 8.931 -6.521 1.00 0.00 H new ATOM 0 HG3 PRO A 467 -11.017 7.892 -5.165 1.00 0.00 H new ATOM 0 HD2 PRO A 467 -11.907 6.852 -7.533 1.00 0.00 H new ATOM 0 HD3 PRO A 467 -12.280 6.083 -6.003 1.00 0.00 H new ATOM 382 N GLU A 468 -13.876 9.971 -7.889 1.00 0.00 N ATOM 383 CA GLU A 468 -14.241 11.028 -8.866 1.00 0.00 C ATOM 384 C GLU A 468 -15.643 10.800 -9.410 1.00 0.00 C ATOM 385 O GLU A 468 -16.509 11.661 -9.270 1.00 0.00 O ATOM 386 CB GLU A 468 -13.240 11.086 -10.034 1.00 0.00 C ATOM 387 CG GLU A 468 -13.583 12.119 -11.108 1.00 0.00 C ATOM 388 CD GLU A 468 -12.466 12.208 -12.144 1.00 0.00 C ATOM 389 OE1 GLU A 468 -12.228 11.217 -12.870 1.00 0.00 O ATOM 390 OE2 GLU A 468 -11.853 13.294 -12.251 1.00 0.00 O ATOM 0 H GLU A 468 -13.020 9.475 -8.135 1.00 0.00 H new ATOM 0 HA GLU A 468 -14.211 11.980 -8.336 1.00 0.00 H new ATOM 0 HB2 GLU A 468 -12.249 11.308 -9.637 1.00 0.00 H new ATOM 0 HB3 GLU A 468 -13.184 10.101 -10.498 1.00 0.00 H new ATOM 0 HG2 GLU A 468 -14.519 11.847 -11.597 1.00 0.00 H new ATOM 0 HG3 GLU A 468 -13.737 13.094 -10.646 1.00 0.00 H new ATOM 397 N LEU A 469 -15.907 9.612 -9.950 1.00 0.00 N ATOM 398 CA LEU A 469 -17.224 9.253 -10.462 1.00 0.00 C ATOM 399 C LEU A 469 -18.318 9.353 -9.390 1.00 0.00 C ATOM 400 O LEU A 469 -19.454 9.683 -9.704 1.00 0.00 O ATOM 401 CB LEU A 469 -17.276 7.880 -11.167 1.00 0.00 C ATOM 402 CG LEU A 469 -17.623 8.013 -12.659 1.00 0.00 C ATOM 403 CD1 LEU A 469 -16.449 8.580 -13.458 1.00 0.00 C ATOM 404 CD2 LEU A 469 -18.000 6.648 -13.228 1.00 0.00 C ATOM 0 H LEU A 469 -15.212 8.872 -10.044 1.00 0.00 H new ATOM 0 HA LEU A 469 -17.427 10.000 -11.229 1.00 0.00 H new ATOM 0 HB2 LEU A 469 -16.312 7.381 -11.062 1.00 0.00 H new ATOM 0 HB3 LEU A 469 -18.017 7.248 -10.677 1.00 0.00 H new ATOM 0 HG LEU A 469 -18.464 8.701 -12.744 1.00 0.00 H new ATOM 0 HD11 LEU A 469 -16.729 8.661 -14.508 1.00 0.00 H new ATOM 0 HD12 LEU A 469 -16.191 9.567 -13.074 1.00 0.00 H new ATOM 0 HD13 LEU A 469 -15.589 7.917 -13.362 1.00 0.00 H new ATOM 0 HD21 LEU A 469 -18.245 6.750 -14.285 1.00 0.00 H new ATOM 0 HD22 LEU A 469 -17.161 5.962 -13.114 1.00 0.00 H new ATOM 0 HD23 LEU A 469 -18.864 6.256 -12.692 1.00 0.00 H new ATOM 416 N ALA A 470 -17.984 9.144 -8.120 1.00 0.00 N ATOM 417 CA ALA A 470 -18.949 9.236 -7.024 1.00 0.00 C ATOM 418 C ALA A 470 -19.527 10.658 -6.861 1.00 0.00 C ATOM 419 O ALA A 470 -20.681 10.812 -6.455 1.00 0.00 O ATOM 420 CB ALA A 470 -18.336 8.741 -5.712 1.00 0.00 C ATOM 0 H ALA A 470 -17.039 8.906 -7.820 1.00 0.00 H new ATOM 0 HA ALA A 470 -19.784 8.585 -7.284 1.00 0.00 H new ATOM 0 HB1 ALA A 470 -19.074 8.820 -4.913 1.00 0.00 H new ATOM 0 HB2 ALA A 470 -18.031 7.700 -5.823 1.00 0.00 H new ATOM 0 HB3 ALA A 470 -17.466 9.350 -5.464 1.00 0.00 H new ATOM 426 N ARG A 471 -18.761 11.700 -7.210 1.00 0.00 N ATOM 427 CA ARG A 471 -19.259 13.078 -7.210 1.00 0.00 C ATOM 428 C ARG A 471 -19.967 13.436 -8.528 1.00 0.00 C ATOM 429 O ARG A 471 -20.955 14.174 -8.517 1.00 0.00 O ATOM 430 CB ARG A 471 -18.132 14.050 -6.796 1.00 0.00 C ATOM 431 CG ARG A 471 -17.293 14.713 -7.900 1.00 0.00 C ATOM 432 CD ARG A 471 -18.006 15.921 -8.540 1.00 0.00 C ATOM 433 NE ARG A 471 -17.067 16.986 -8.939 1.00 0.00 N ATOM 434 CZ ARG A 471 -16.569 17.932 -8.155 1.00 0.00 C ATOM 435 NH1 ARG A 471 -16.794 17.969 -6.868 1.00 0.00 N ATOM 436 NH2 ARG A 471 -15.822 18.875 -8.655 1.00 0.00 N ATOM 0 H ARG A 471 -17.787 11.611 -7.498 1.00 0.00 H new ATOM 0 HA ARG A 471 -20.039 13.179 -6.456 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -18.581 14.844 -6.199 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -17.450 13.507 -6.142 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -16.340 15.038 -7.482 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -17.068 13.977 -8.672 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -18.564 15.587 -9.415 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -18.731 16.326 -7.834 1.00 0.00 H new ATOM 0 HE ARG A 471 -16.771 16.996 -9.915 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -17.372 17.252 -6.431 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -16.391 18.715 -6.301 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -15.618 18.888 -9.654 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -15.441 19.600 -8.047 1.00 0.00 H new ATOM 450 N VAL A 472 -19.506 12.909 -9.672 1.00 0.00 N ATOM 451 CA VAL A 472 -20.104 13.232 -10.984 1.00 0.00 C ATOM 452 C VAL A 472 -21.389 12.447 -11.285 1.00 0.00 C ATOM 453 O VAL A 472 -22.265 12.973 -11.967 1.00 0.00 O ATOM 454 CB VAL A 472 -19.121 13.085 -12.162 1.00 0.00 C ATOM 455 CG1 VAL A 472 -17.745 13.690 -11.874 1.00 0.00 C ATOM 456 CG2 VAL A 472 -18.970 11.634 -12.614 1.00 0.00 C ATOM 0 H VAL A 472 -18.722 12.258 -9.719 1.00 0.00 H new ATOM 0 HA VAL A 472 -20.367 14.286 -10.892 1.00 0.00 H new ATOM 0 HB VAL A 472 -19.568 13.655 -12.977 1.00 0.00 H new ATOM 0 HG11 VAL A 472 -17.099 13.554 -12.741 1.00 0.00 H new ATOM 0 HG12 VAL A 472 -17.852 14.754 -11.664 1.00 0.00 H new ATOM 0 HG13 VAL A 472 -17.302 13.193 -11.011 1.00 0.00 H new ATOM 0 HG21 VAL A 472 -18.267 11.583 -13.446 1.00 0.00 H new ATOM 0 HG22 VAL A 472 -18.596 11.032 -11.786 1.00 0.00 H new ATOM 0 HG23 VAL A 472 -19.939 11.250 -12.933 1.00 0.00 H new ATOM 466 N LEU A 473 -21.557 11.234 -10.743 1.00 0.00 N ATOM 467 CA LEU A 473 -22.777 10.425 -10.910 1.00 0.00 C ATOM 468 C LEU A 473 -24.036 11.205 -10.480 1.00 0.00 C ATOM 469 O LEU A 473 -25.080 11.137 -11.128 1.00 0.00 O ATOM 470 CB LEU A 473 -22.665 9.105 -10.103 1.00 0.00 C ATOM 471 CG LEU A 473 -22.577 7.787 -10.891 1.00 0.00 C ATOM 472 CD1 LEU A 473 -23.687 7.624 -11.927 1.00 0.00 C ATOM 473 CD2 LEU A 473 -21.224 7.635 -11.571 1.00 0.00 C ATOM 0 H LEU A 473 -20.845 10.780 -10.171 1.00 0.00 H new ATOM 0 HA LEU A 473 -22.874 10.188 -11.970 1.00 0.00 H new ATOM 0 HB2 LEU A 473 -21.782 9.175 -9.468 1.00 0.00 H new ATOM 0 HB3 LEU A 473 -23.529 9.043 -9.442 1.00 0.00 H new ATOM 0 HG LEU A 473 -22.704 6.999 -10.148 1.00 0.00 H new ATOM 0 HD11 LEU A 473 -23.564 6.673 -12.446 1.00 0.00 H new ATOM 0 HD12 LEU A 473 -24.656 7.642 -11.428 1.00 0.00 H new ATOM 0 HD13 LEU A 473 -23.635 8.440 -12.648 1.00 0.00 H new ATOM 0 HD21 LEU A 473 -21.196 6.693 -12.119 1.00 0.00 H new ATOM 0 HD22 LEU A 473 -21.070 8.462 -12.264 1.00 0.00 H new ATOM 0 HD23 LEU A 473 -20.436 7.640 -10.818 1.00 0.00 H new ATOM 485 N ARG A 474 -23.903 12.013 -9.425 1.00 0.00 N ATOM 486 CA ARG A 474 -24.955 12.901 -8.931 1.00 0.00 C ATOM 487 C ARG A 474 -25.323 13.961 -9.978 1.00 0.00 C ATOM 488 O ARG A 474 -26.506 14.169 -10.254 1.00 0.00 O ATOM 489 CB ARG A 474 -24.478 13.492 -7.589 1.00 0.00 C ATOM 490 CG ARG A 474 -25.322 14.637 -7.002 1.00 0.00 C ATOM 491 CD ARG A 474 -24.879 16.021 -7.506 1.00 0.00 C ATOM 492 NE ARG A 474 -25.487 17.109 -6.719 1.00 0.00 N ATOM 493 CZ ARG A 474 -25.061 17.588 -5.561 1.00 0.00 C ATOM 494 NH1 ARG A 474 -24.024 17.099 -4.933 1.00 0.00 N ATOM 495 NH2 ARG A 474 -25.682 18.588 -4.999 1.00 0.00 N ATOM 0 H ARG A 474 -23.043 12.068 -8.880 1.00 0.00 H new ATOM 0 HA ARG A 474 -25.881 12.353 -8.755 1.00 0.00 H new ATOM 0 HB2 ARG A 474 -24.440 12.686 -6.856 1.00 0.00 H new ATOM 0 HB3 ARG A 474 -23.458 13.853 -7.719 1.00 0.00 H new ATOM 0 HG2 ARG A 474 -26.369 14.479 -7.259 1.00 0.00 H new ATOM 0 HG3 ARG A 474 -25.254 14.612 -5.914 1.00 0.00 H new ATOM 0 HD2 ARG A 474 -23.793 16.097 -7.453 1.00 0.00 H new ATOM 0 HD3 ARG A 474 -25.156 16.132 -8.554 1.00 0.00 H new ATOM 0 HE ARG A 474 -26.326 17.539 -7.109 1.00 0.00 H new ATOM 0 HH11 ARG A 474 -23.507 16.316 -5.334 1.00 0.00 H new ATOM 0 HH12 ARG A 474 -23.731 17.500 -4.042 1.00 0.00 H new ATOM 0 HH21 ARG A 474 -26.497 19.002 -5.452 1.00 0.00 H new ATOM 0 HH22 ARG A 474 -25.353 18.956 -4.107 1.00 0.00 H new ATOM 509 N ASN A 475 -24.320 14.596 -10.600 1.00 0.00 N ATOM 510 CA ASN A 475 -24.546 15.609 -11.632 1.00 0.00 C ATOM 511 C ASN A 475 -25.139 15.006 -12.926 1.00 0.00 C ATOM 512 O ASN A 475 -26.009 15.610 -13.546 1.00 0.00 O ATOM 513 CB ASN A 475 -23.288 16.475 -11.846 1.00 0.00 C ATOM 514 CG ASN A 475 -22.504 16.195 -13.119 1.00 0.00 C ATOM 515 OD1 ASN A 475 -22.938 16.469 -14.230 1.00 0.00 O ATOM 516 ND2 ASN A 475 -21.310 15.671 -12.987 1.00 0.00 N ATOM 0 H ASN A 475 -23.335 14.421 -10.401 1.00 0.00 H new ATOM 0 HA ASN A 475 -25.317 16.293 -11.276 1.00 0.00 H new ATOM 0 HB2 ASN A 475 -23.587 17.523 -11.848 1.00 0.00 H new ATOM 0 HB3 ASN A 475 -22.623 16.335 -10.993 1.00 0.00 H new ATOM 0 HD21 ASN A 475 -20.738 15.490 -13.812 1.00 0.00 H new ATOM 0 HD22 ASN A 475 -20.952 15.444 -12.059 1.00 0.00 H new ATOM 523 N VAL A 476 -24.728 13.793 -13.305 1.00 0.00 N ATOM 524 CA VAL A 476 -25.247 13.089 -14.499 1.00 0.00 C ATOM 525 C VAL A 476 -26.731 12.719 -14.345 1.00 0.00 C ATOM 526 O VAL A 476 -27.522 12.957 -15.259 1.00 0.00 O ATOM 527 CB VAL A 476 -24.370 11.860 -14.842 1.00 0.00 C ATOM 528 CG1 VAL A 476 -24.957 10.953 -15.932 1.00 0.00 C ATOM 529 CG2 VAL A 476 -22.986 12.331 -15.308 1.00 0.00 C ATOM 0 H VAL A 476 -24.022 13.262 -12.795 1.00 0.00 H new ATOM 0 HA VAL A 476 -25.188 13.777 -15.343 1.00 0.00 H new ATOM 0 HB VAL A 476 -24.316 11.271 -13.926 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -24.282 10.117 -16.112 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -25.926 10.574 -15.607 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -25.081 11.524 -16.852 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -22.369 11.465 -15.549 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -23.094 12.958 -16.193 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -22.510 12.905 -14.513 1.00 0.00 H new ATOM 539 N PHE A 477 -27.144 12.233 -13.169 1.00 0.00 N ATOM 540 CA PHE A 477 -28.548 11.905 -12.877 1.00 0.00 C ATOM 541 C PHE A 477 -29.474 13.138 -12.828 1.00 0.00 C ATOM 542 O PHE A 477 -30.555 13.132 -13.425 1.00 0.00 O ATOM 543 CB PHE A 477 -28.620 11.060 -11.595 1.00 0.00 C ATOM 544 CG PHE A 477 -28.520 9.567 -11.877 1.00 0.00 C ATOM 545 CD1 PHE A 477 -27.321 9.006 -12.361 1.00 0.00 C ATOM 546 CD2 PHE A 477 -29.652 8.743 -11.716 1.00 0.00 C ATOM 547 CE1 PHE A 477 -27.249 7.639 -12.671 1.00 0.00 C ATOM 548 CE2 PHE A 477 -29.579 7.375 -12.029 1.00 0.00 C ATOM 549 CZ PHE A 477 -28.376 6.822 -12.498 1.00 0.00 C ATOM 0 H PHE A 477 -26.512 12.055 -12.388 1.00 0.00 H new ATOM 0 HA PHE A 477 -28.932 11.315 -13.710 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -27.814 11.355 -10.923 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -29.557 11.267 -11.079 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -26.451 9.632 -12.494 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -30.577 9.164 -11.351 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -26.327 7.217 -13.042 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -30.450 6.747 -11.909 1.00 0.00 H new ATOM 0 HZ PHE A 477 -28.319 5.768 -12.725 1.00 0.00 H new ATOM 559 N VAL A 478 -29.045 14.227 -12.181 1.00 0.00 N ATOM 560 CA VAL A 478 -29.818 15.486 -12.123 1.00 0.00 C ATOM 561 C VAL A 478 -29.797 16.277 -13.440 1.00 0.00 C ATOM 562 O VAL A 478 -30.806 16.877 -13.792 1.00 0.00 O ATOM 563 CB VAL A 478 -29.375 16.374 -10.944 1.00 0.00 C ATOM 564 CG1 VAL A 478 -27.994 16.987 -11.157 1.00 0.00 C ATOM 565 CG2 VAL A 478 -30.364 17.513 -10.683 1.00 0.00 C ATOM 0 H VAL A 478 -28.156 14.267 -11.682 1.00 0.00 H new ATOM 0 HA VAL A 478 -30.853 15.185 -11.958 1.00 0.00 H new ATOM 0 HB VAL A 478 -29.342 15.706 -10.083 1.00 0.00 H new ATOM 0 HG11 VAL A 478 -27.732 17.603 -10.296 1.00 0.00 H new ATOM 0 HG12 VAL A 478 -27.257 16.192 -11.272 1.00 0.00 H new ATOM 0 HG13 VAL A 478 -28.005 17.605 -12.055 1.00 0.00 H new ATOM 0 HG21 VAL A 478 -30.013 18.114 -9.844 1.00 0.00 H new ATOM 0 HG22 VAL A 478 -30.440 18.140 -11.572 1.00 0.00 H new ATOM 0 HG23 VAL A 478 -31.344 17.097 -10.447 1.00 0.00 H new ATOM 575 N SER A 479 -28.716 16.254 -14.224 1.00 0.00 N ATOM 576 CA SER A 479 -28.657 16.991 -15.502 1.00 0.00 C ATOM 577 C SER A 479 -29.651 16.468 -16.558 1.00 0.00 C ATOM 578 O SER A 479 -30.090 17.225 -17.429 1.00 0.00 O ATOM 579 CB SER A 479 -27.242 16.977 -16.092 1.00 0.00 C ATOM 580 OG SER A 479 -26.336 17.662 -15.248 1.00 0.00 O ATOM 0 H SER A 479 -27.867 15.735 -14.002 1.00 0.00 H new ATOM 0 HA SER A 479 -28.944 18.013 -15.256 1.00 0.00 H new ATOM 0 HB2 SER A 479 -26.911 15.948 -16.228 1.00 0.00 H new ATOM 0 HB3 SER A 479 -27.250 17.442 -17.078 1.00 0.00 H new ATOM 0 HG SER A 479 -26.128 17.104 -14.470 1.00 0.00 H new ATOM 586 N GLU A 480 -30.046 15.190 -16.458 1.00 0.00 N ATOM 587 CA GLU A 480 -31.148 14.582 -17.246 1.00 0.00 C ATOM 588 C GLU A 480 -32.521 14.683 -16.559 1.00 0.00 C ATOM 589 O GLU A 480 -33.552 14.513 -17.205 1.00 0.00 O ATOM 590 CB GLU A 480 -30.810 13.118 -17.572 1.00 0.00 C ATOM 591 CG GLU A 480 -31.670 12.477 -18.668 1.00 0.00 C ATOM 592 CD GLU A 480 -31.569 13.209 -20.003 1.00 0.00 C ATOM 593 OE1 GLU A 480 -30.438 13.441 -20.484 1.00 0.00 O ATOM 594 OE2 GLU A 480 -32.632 13.523 -20.586 1.00 0.00 O ATOM 0 H GLU A 480 -29.605 14.531 -15.817 1.00 0.00 H new ATOM 0 HA GLU A 480 -31.232 15.157 -18.168 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -29.764 13.062 -17.874 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -30.911 12.527 -16.662 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -31.364 11.440 -18.804 1.00 0.00 H new ATOM 0 HG3 GLU A 480 -32.711 12.462 -18.345 1.00 0.00 H new ATOM 601 N ARG A 481 -32.551 15.021 -15.266 1.00 0.00 N ATOM 602 CA ARG A 481 -33.749 15.135 -14.416 1.00 0.00 C ATOM 603 C ARG A 481 -34.602 13.842 -14.357 1.00 0.00 C ATOM 604 O ARG A 481 -35.835 13.899 -14.418 1.00 0.00 O ATOM 605 CB ARG A 481 -34.581 16.389 -14.796 1.00 0.00 C ATOM 606 CG ARG A 481 -33.821 17.728 -14.789 1.00 0.00 C ATOM 607 CD ARG A 481 -33.435 18.224 -13.388 1.00 0.00 C ATOM 608 NE ARG A 481 -34.581 18.782 -12.653 1.00 0.00 N ATOM 609 CZ ARG A 481 -34.515 19.479 -11.530 1.00 0.00 C ATOM 610 NH1 ARG A 481 -33.383 19.730 -10.928 1.00 0.00 N ATOM 611 NH2 ARG A 481 -35.603 19.946 -10.981 1.00 0.00 N ATOM 0 H ARG A 481 -31.696 15.235 -14.753 1.00 0.00 H new ATOM 0 HA ARG A 481 -33.393 15.270 -13.395 1.00 0.00 H new ATOM 0 HB2 ARG A 481 -34.999 16.236 -15.791 1.00 0.00 H new ATOM 0 HB3 ARG A 481 -35.421 16.467 -14.106 1.00 0.00 H new ATOM 0 HG2 ARG A 481 -32.916 17.623 -15.387 1.00 0.00 H new ATOM 0 HG3 ARG A 481 -34.437 18.485 -15.274 1.00 0.00 H new ATOM 0 HD2 ARG A 481 -33.009 17.398 -12.818 1.00 0.00 H new ATOM 0 HD3 ARG A 481 -32.659 18.984 -13.476 1.00 0.00 H new ATOM 0 HE ARG A 481 -35.509 18.617 -13.044 1.00 0.00 H new ATOM 0 HH11 ARG A 481 -32.508 19.385 -11.323 1.00 0.00 H new ATOM 0 HH12 ARG A 481 -33.374 20.271 -10.064 1.00 0.00 H new ATOM 0 HH21 ARG A 481 -36.509 19.774 -11.418 1.00 0.00 H new ATOM 0 HH22 ARG A 481 -35.548 20.483 -10.115 1.00 0.00 H new ATOM 625 N LYS A 482 -33.968 12.665 -14.246 1.00 0.00 N ATOM 626 CA LYS A 482 -34.653 11.359 -14.197 1.00 0.00 C ATOM 627 C LYS A 482 -34.078 10.440 -13.090 1.00 0.00 C ATOM 628 O LYS A 482 -32.867 10.469 -12.839 1.00 0.00 O ATOM 629 CB LYS A 482 -34.547 10.652 -15.563 1.00 0.00 C ATOM 630 CG LYS A 482 -35.277 11.384 -16.703 1.00 0.00 C ATOM 631 CD LYS A 482 -35.106 10.672 -18.057 1.00 0.00 C ATOM 632 CE LYS A 482 -35.987 9.427 -18.227 1.00 0.00 C ATOM 633 NZ LYS A 482 -37.401 9.774 -18.489 1.00 0.00 N ATOM 0 H LYS A 482 -32.953 12.590 -14.187 1.00 0.00 H new ATOM 0 HA LYS A 482 -35.699 11.552 -13.960 1.00 0.00 H new ATOM 0 HB2 LYS A 482 -33.494 10.548 -15.827 1.00 0.00 H new ATOM 0 HB3 LYS A 482 -34.954 9.645 -15.472 1.00 0.00 H new ATOM 0 HG2 LYS A 482 -36.338 11.457 -16.465 1.00 0.00 H new ATOM 0 HG3 LYS A 482 -34.897 12.403 -16.780 1.00 0.00 H new ATOM 0 HD2 LYS A 482 -35.333 11.377 -18.857 1.00 0.00 H new ATOM 0 HD3 LYS A 482 -34.061 10.383 -18.174 1.00 0.00 H new ATOM 0 HE2 LYS A 482 -35.605 8.823 -19.050 1.00 0.00 H new ATOM 0 HE3 LYS A 482 -35.926 8.815 -17.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 482 -37.958 8.902 -18.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 482 -37.776 10.328 -17.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 482 -37.465 10.336 -19.362 1.00 0.00 H new ATOM 647 N PRO A 483 -34.908 9.590 -12.444 1.00 0.00 N ATOM 648 CA PRO A 483 -34.473 8.662 -11.391 1.00 0.00 C ATOM 649 C PRO A 483 -33.707 7.442 -11.921 1.00 0.00 C ATOM 650 O PRO A 483 -33.007 6.786 -11.151 1.00 0.00 O ATOM 651 CB PRO A 483 -35.762 8.224 -10.689 1.00 0.00 C ATOM 652 CG PRO A 483 -36.805 8.283 -11.803 1.00 0.00 C ATOM 653 CD PRO A 483 -36.352 9.486 -12.630 1.00 0.00 C ATOM 0 HA PRO A 483 -33.768 9.158 -10.724 1.00 0.00 H new ATOM 0 HB2 PRO A 483 -35.673 7.220 -10.274 1.00 0.00 H new ATOM 0 HB3 PRO A 483 -36.017 8.889 -9.864 1.00 0.00 H new ATOM 0 HG2 PRO A 483 -36.817 7.367 -12.394 1.00 0.00 H new ATOM 0 HG3 PRO A 483 -37.811 8.420 -11.408 1.00 0.00 H new ATOM 0 HD2 PRO A 483 -36.600 9.350 -13.683 1.00 0.00 H new ATOM 0 HD3 PRO A 483 -36.853 10.396 -12.300 1.00 0.00 H new ATOM 661 N ALA A 484 -33.828 7.140 -13.216 1.00 0.00 N ATOM 662 CA ALA A 484 -33.229 5.997 -13.890 1.00 0.00 C ATOM 663 C ALA A 484 -32.746 6.417 -15.289 1.00 0.00 C ATOM 664 O ALA A 484 -33.507 7.017 -16.055 1.00 0.00 O ATOM 665 CB ALA A 484 -34.273 4.876 -13.969 1.00 0.00 C ATOM 0 H ALA A 484 -34.376 7.720 -13.851 1.00 0.00 H new ATOM 0 HA ALA A 484 -32.364 5.633 -13.336 1.00 0.00 H new ATOM 0 HB1 ALA A 484 -33.841 4.011 -14.472 1.00 0.00 H new ATOM 0 HB2 ALA A 484 -34.581 4.594 -12.962 1.00 0.00 H new ATOM 0 HB3 ALA A 484 -35.140 5.225 -14.529 1.00 0.00 H new ATOM 671 N LEU A 485 -31.492 6.107 -15.621 1.00 0.00 N ATOM 672 CA LEU A 485 -30.837 6.503 -16.877 1.00 0.00 C ATOM 673 C LEU A 485 -30.416 5.272 -17.679 1.00 0.00 C ATOM 674 O LEU A 485 -29.805 4.364 -17.116 1.00 0.00 O ATOM 675 CB LEU A 485 -29.584 7.344 -16.580 1.00 0.00 C ATOM 676 CG LEU A 485 -29.776 8.648 -15.794 1.00 0.00 C ATOM 677 CD1 LEU A 485 -28.460 9.423 -15.855 1.00 0.00 C ATOM 678 CD2 LEU A 485 -30.887 9.525 -16.356 1.00 0.00 C ATOM 0 H LEU A 485 -30.885 5.560 -15.011 1.00 0.00 H new ATOM 0 HA LEU A 485 -31.552 7.088 -17.456 1.00 0.00 H new ATOM 0 HB2 LEU A 485 -28.882 6.719 -16.028 1.00 0.00 H new ATOM 0 HB3 LEU A 485 -29.111 7.591 -17.531 1.00 0.00 H new ATOM 0 HG LEU A 485 -30.060 8.390 -14.774 1.00 0.00 H new ATOM 0 HD11 LEU A 485 -28.563 10.358 -15.304 1.00 0.00 H new ATOM 0 HD12 LEU A 485 -27.665 8.825 -15.410 1.00 0.00 H new ATOM 0 HD13 LEU A 485 -28.213 9.639 -16.894 1.00 0.00 H new ATOM 0 HD21 LEU A 485 -30.973 10.432 -15.757 1.00 0.00 H new ATOM 0 HD22 LEU A 485 -30.654 9.792 -17.387 1.00 0.00 H new ATOM 0 HD23 LEU A 485 -31.831 8.980 -16.327 1.00 0.00 H new ATOM 690 N THR A 486 -30.698 5.235 -18.983 1.00 0.00 N ATOM 691 CA THR A 486 -30.221 4.151 -19.839 1.00 0.00 C ATOM 692 C THR A 486 -28.746 4.380 -20.146 1.00 0.00 C ATOM 693 O THR A 486 -28.282 5.526 -20.175 1.00 0.00 O ATOM 694 CB THR A 486 -30.979 4.075 -21.184 1.00 0.00 C ATOM 695 OG1 THR A 486 -32.272 4.632 -21.120 1.00 0.00 O ATOM 696 CG2 THR A 486 -31.115 2.638 -21.690 1.00 0.00 C ATOM 0 H THR A 486 -31.253 5.941 -19.466 1.00 0.00 H new ATOM 0 HA THR A 486 -30.388 3.218 -19.301 1.00 0.00 H new ATOM 0 HB THR A 486 -30.370 4.659 -21.874 1.00 0.00 H new ATOM 0 HG1 THR A 486 -32.807 4.143 -20.460 1.00 0.00 H new ATOM 0 HG21 THR A 486 -31.654 2.635 -22.637 1.00 0.00 H new ATOM 0 HG22 THR A 486 -30.124 2.208 -21.835 1.00 0.00 H new ATOM 0 HG23 THR A 486 -31.664 2.045 -20.958 1.00 0.00 H new ATOM 704 N MET A 487 -28.018 3.318 -20.483 1.00 0.00 N ATOM 705 CA MET A 487 -26.651 3.415 -21.016 1.00 0.00 C ATOM 706 C MET A 487 -26.505 4.453 -22.156 1.00 0.00 C ATOM 707 O MET A 487 -25.447 5.063 -22.292 1.00 0.00 O ATOM 708 CB MET A 487 -26.185 2.031 -21.497 1.00 0.00 C ATOM 709 CG MET A 487 -27.218 1.386 -22.433 1.00 0.00 C ATOM 710 SD MET A 487 -26.536 0.520 -23.868 1.00 0.00 S ATOM 711 CE MET A 487 -27.946 0.767 -24.979 1.00 0.00 C ATOM 0 H MET A 487 -28.356 2.360 -20.396 1.00 0.00 H new ATOM 0 HA MET A 487 -26.019 3.766 -20.201 1.00 0.00 H new ATOM 0 HB2 MET A 487 -25.231 2.127 -22.016 1.00 0.00 H new ATOM 0 HB3 MET A 487 -26.016 1.383 -20.637 1.00 0.00 H new ATOM 0 HG2 MET A 487 -27.815 0.681 -21.855 1.00 0.00 H new ATOM 0 HG3 MET A 487 -27.896 2.162 -22.788 1.00 0.00 H new ATOM 0 HE1 MET A 487 -27.736 0.303 -25.943 1.00 0.00 H new ATOM 0 HE2 MET A 487 -28.836 0.313 -24.544 1.00 0.00 H new ATOM 0 HE3 MET A 487 -28.116 1.834 -25.120 1.00 0.00 H new ATOM 721 N GLU A 488 -27.574 4.715 -22.931 1.00 0.00 N ATOM 722 CA GLU A 488 -27.596 5.700 -24.036 1.00 0.00 C ATOM 723 C GLU A 488 -27.444 7.145 -23.545 1.00 0.00 C ATOM 724 O GLU A 488 -26.703 7.924 -24.143 1.00 0.00 O ATOM 725 CB GLU A 488 -28.897 5.565 -24.843 1.00 0.00 C ATOM 726 CG GLU A 488 -28.862 6.239 -26.216 1.00 0.00 C ATOM 727 CD GLU A 488 -28.048 5.423 -27.214 1.00 0.00 C ATOM 728 OE1 GLU A 488 -28.612 4.473 -27.803 1.00 0.00 O ATOM 729 OE2 GLU A 488 -26.859 5.749 -27.430 1.00 0.00 O ATOM 0 H GLU A 488 -28.467 4.239 -22.806 1.00 0.00 H new ATOM 0 HA GLU A 488 -26.738 5.479 -24.670 1.00 0.00 H new ATOM 0 HB2 GLU A 488 -29.119 4.506 -24.977 1.00 0.00 H new ATOM 0 HB3 GLU A 488 -29.716 5.991 -24.263 1.00 0.00 H new ATOM 0 HG2 GLU A 488 -29.879 6.363 -26.588 1.00 0.00 H new ATOM 0 HG3 GLU A 488 -28.433 7.237 -26.123 1.00 0.00 H new ATOM 736 N VAL A 489 -28.088 7.491 -22.423 1.00 0.00 N ATOM 737 CA VAL A 489 -27.859 8.774 -21.727 1.00 0.00 C ATOM 738 C VAL A 489 -26.494 8.781 -21.057 1.00 0.00 C ATOM 739 O VAL A 489 -25.706 9.701 -21.275 1.00 0.00 O ATOM 740 CB VAL A 489 -28.937 9.090 -20.667 1.00 0.00 C ATOM 741 CG1 VAL A 489 -28.528 10.211 -19.697 1.00 0.00 C ATOM 742 CG2 VAL A 489 -30.201 9.577 -21.372 1.00 0.00 C ATOM 0 H VAL A 489 -28.781 6.895 -21.970 1.00 0.00 H new ATOM 0 HA VAL A 489 -27.911 9.546 -22.495 1.00 0.00 H new ATOM 0 HB VAL A 489 -29.086 8.170 -20.102 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -29.330 10.382 -18.979 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -27.622 9.920 -19.166 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -28.341 11.127 -20.257 1.00 0.00 H new ATOM 0 HG21 VAL A 489 -30.967 9.802 -20.630 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -29.975 10.476 -21.945 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -30.565 8.800 -22.045 1.00 0.00 H new ATOM 752 N VAL A 490 -26.201 7.770 -20.234 1.00 0.00 N ATOM 753 CA VAL A 490 -24.996 7.789 -19.386 1.00 0.00 C ATOM 754 C VAL A 490 -23.722 7.859 -20.238 1.00 0.00 C ATOM 755 O VAL A 490 -22.853 8.678 -19.958 1.00 0.00 O ATOM 756 CB VAL A 490 -24.957 6.613 -18.390 1.00 0.00 C ATOM 757 CG1 VAL A 490 -23.800 6.776 -17.401 1.00 0.00 C ATOM 758 CG2 VAL A 490 -26.227 6.546 -17.531 1.00 0.00 C ATOM 0 H VAL A 490 -26.774 6.932 -20.134 1.00 0.00 H new ATOM 0 HA VAL A 490 -25.043 8.696 -18.784 1.00 0.00 H new ATOM 0 HB VAL A 490 -24.851 5.715 -18.999 1.00 0.00 H new ATOM 0 HG11 VAL A 490 -23.792 5.935 -16.708 1.00 0.00 H new ATOM 0 HG12 VAL A 490 -22.857 6.806 -17.946 1.00 0.00 H new ATOM 0 HG13 VAL A 490 -23.926 7.704 -16.843 1.00 0.00 H new ATOM 0 HG21 VAL A 490 -26.157 5.703 -16.844 1.00 0.00 H new ATOM 0 HG22 VAL A 490 -26.331 7.470 -16.963 1.00 0.00 H new ATOM 0 HG23 VAL A 490 -27.096 6.417 -18.176 1.00 0.00 H new ATOM 768 N CYS A 491 -23.654 7.127 -21.352 1.00 0.00 N ATOM 769 CA CYS A 491 -22.551 7.187 -22.322 1.00 0.00 C ATOM 770 C CYS A 491 -22.340 8.573 -22.974 1.00 0.00 C ATOM 771 O CYS A 491 -21.247 8.855 -23.459 1.00 0.00 O ATOM 772 CB CYS A 491 -22.784 6.123 -23.405 1.00 0.00 C ATOM 773 SG CYS A 491 -21.298 5.870 -24.417 1.00 0.00 S ATOM 0 H CYS A 491 -24.380 6.460 -21.614 1.00 0.00 H new ATOM 0 HA CYS A 491 -21.635 6.992 -21.764 1.00 0.00 H new ATOM 0 HB2 CYS A 491 -23.071 5.182 -22.936 1.00 0.00 H new ATOM 0 HB3 CYS A 491 -23.613 6.427 -24.044 1.00 0.00 H new ATOM 0 HG CYS A 491 -20.609 6.971 -24.459 1.00 0.00 H new ATOM 779 N ALA A 492 -23.358 9.437 -23.038 1.00 0.00 N ATOM 780 CA ALA A 492 -23.203 10.844 -23.432 1.00 0.00 C ATOM 781 C ALA A 492 -22.826 11.756 -22.245 1.00 0.00 C ATOM 782 O ALA A 492 -21.874 12.537 -22.292 1.00 0.00 O ATOM 783 CB ALA A 492 -24.517 11.320 -24.063 1.00 0.00 C ATOM 0 H ALA A 492 -24.320 9.180 -22.817 1.00 0.00 H new ATOM 0 HA ALA A 492 -22.383 10.908 -24.147 1.00 0.00 H new ATOM 0 HB1 ALA A 492 -24.420 12.364 -24.362 1.00 0.00 H new ATOM 0 HB2 ALA A 492 -24.742 10.711 -24.939 1.00 0.00 H new ATOM 0 HB3 ALA A 492 -25.325 11.224 -23.338 1.00 0.00 H new ATOM 789 N ARG A 493 -23.585 11.652 -21.155 1.00 0.00 N ATOM 790 CA ARG A 493 -23.525 12.572 -20.015 1.00 0.00 C ATOM 791 C ARG A 493 -22.287 12.356 -19.136 1.00 0.00 C ATOM 792 O ARG A 493 -21.593 13.308 -18.798 1.00 0.00 O ATOM 793 CB ARG A 493 -24.817 12.452 -19.187 1.00 0.00 C ATOM 794 CG ARG A 493 -25.807 13.591 -19.437 1.00 0.00 C ATOM 795 CD ARG A 493 -26.327 13.640 -20.876 1.00 0.00 C ATOM 796 NE ARG A 493 -27.102 14.870 -21.106 1.00 0.00 N ATOM 797 CZ ARG A 493 -27.630 15.266 -22.251 1.00 0.00 C ATOM 798 NH1 ARG A 493 -27.558 14.546 -23.340 1.00 0.00 N ATOM 799 NH2 ARG A 493 -28.231 16.421 -22.331 1.00 0.00 N ATOM 0 H ARG A 493 -24.275 10.910 -21.035 1.00 0.00 H new ATOM 0 HA ARG A 493 -23.438 13.583 -20.413 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -25.301 11.503 -19.418 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -24.560 12.430 -18.128 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -26.652 13.484 -18.757 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -25.325 14.540 -19.200 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -25.490 13.596 -21.572 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -26.951 12.768 -21.073 1.00 0.00 H new ATOM 0 HE ARG A 493 -27.246 15.478 -20.300 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -27.082 13.644 -23.325 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -27.978 14.886 -24.205 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -28.294 17.021 -21.509 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -28.638 16.724 -23.216 1.00 0.00 H new ATOM 813 N MET A 494 -21.943 11.114 -18.822 1.00 0.00 N ATOM 814 CA MET A 494 -20.690 10.782 -18.131 1.00 0.00 C ATOM 815 C MET A 494 -19.410 11.237 -18.881 1.00 0.00 C ATOM 816 O MET A 494 -18.350 11.377 -18.275 1.00 0.00 O ATOM 817 CB MET A 494 -20.659 9.309 -17.703 1.00 0.00 C ATOM 818 CG MET A 494 -20.176 8.340 -18.783 1.00 0.00 C ATOM 819 SD MET A 494 -18.519 7.656 -18.485 1.00 0.00 S ATOM 820 CE MET A 494 -17.585 8.546 -19.743 1.00 0.00 C ATOM 0 H MET A 494 -22.522 10.302 -19.037 1.00 0.00 H new ATOM 0 HA MET A 494 -20.679 11.378 -17.219 1.00 0.00 H new ATOM 0 HB2 MET A 494 -20.012 9.212 -16.831 1.00 0.00 H new ATOM 0 HB3 MET A 494 -21.661 9.014 -17.391 1.00 0.00 H new ATOM 0 HG2 MET A 494 -20.887 7.518 -18.862 1.00 0.00 H new ATOM 0 HG3 MET A 494 -20.177 8.855 -19.744 1.00 0.00 H new ATOM 0 HE1 MET A 494 -16.977 7.842 -20.311 1.00 0.00 H new ATOM 0 HE2 MET A 494 -18.275 9.055 -20.416 1.00 0.00 H new ATOM 0 HE3 MET A 494 -16.938 9.281 -19.264 1.00 0.00 H new ATOM 830 N VAL A 495 -19.496 11.481 -20.199 1.00 0.00 N ATOM 831 CA VAL A 495 -18.414 12.082 -21.009 1.00 0.00 C ATOM 832 C VAL A 495 -18.425 13.612 -20.915 1.00 0.00 C ATOM 833 O VAL A 495 -17.420 14.221 -20.548 1.00 0.00 O ATOM 834 CB VAL A 495 -18.535 11.710 -22.508 1.00 0.00 C ATOM 835 CG1 VAL A 495 -17.365 12.234 -23.347 1.00 0.00 C ATOM 836 CG2 VAL A 495 -18.580 10.202 -22.731 1.00 0.00 C ATOM 0 H VAL A 495 -20.331 11.264 -20.744 1.00 0.00 H new ATOM 0 HA VAL A 495 -17.486 11.682 -20.601 1.00 0.00 H new ATOM 0 HB VAL A 495 -19.468 12.177 -22.823 1.00 0.00 H new ATOM 0 HG11 VAL A 495 -17.505 11.943 -24.388 1.00 0.00 H new ATOM 0 HG12 VAL A 495 -17.325 13.321 -23.277 1.00 0.00 H new ATOM 0 HG13 VAL A 495 -16.432 11.812 -22.974 1.00 0.00 H new ATOM 0 HG21 VAL A 495 -18.665 9.994 -23.798 1.00 0.00 H new ATOM 0 HG22 VAL A 495 -17.666 9.750 -22.345 1.00 0.00 H new ATOM 0 HG23 VAL A 495 -19.441 9.783 -22.210 1.00 0.00 H new ATOM 846 N ASP A 496 -19.556 14.234 -21.275 1.00 0.00 N ATOM 847 CA ASP A 496 -19.659 15.697 -21.453 1.00 0.00 C ATOM 848 C ASP A 496 -20.122 16.482 -20.219 1.00 0.00 C ATOM 849 O ASP A 496 -19.670 17.609 -20.006 1.00 0.00 O ATOM 850 CB ASP A 496 -20.570 16.023 -22.652 1.00 0.00 C ATOM 851 CG ASP A 496 -19.872 15.829 -24.015 1.00 0.00 C ATOM 852 OD1 ASP A 496 -19.021 16.676 -24.381 1.00 0.00 O ATOM 853 OD2 ASP A 496 -20.191 14.851 -24.733 1.00 0.00 O ATOM 0 H ASP A 496 -20.430 13.739 -21.453 1.00 0.00 H new ATOM 0 HA ASP A 496 -18.637 16.028 -21.635 1.00 0.00 H new ATOM 0 HB2 ASP A 496 -21.455 15.389 -22.611 1.00 0.00 H new ATOM 0 HB3 ASP A 496 -20.913 17.054 -22.570 1.00 0.00 H new ATOM 858 N SER A 497 -21.012 15.912 -19.408 1.00 0.00 N ATOM 859 CA SER A 497 -21.464 16.529 -18.154 1.00 0.00 C ATOM 860 C SER A 497 -20.384 16.472 -17.055 1.00 0.00 C ATOM 861 O SER A 497 -20.274 17.396 -16.242 1.00 0.00 O ATOM 862 CB SER A 497 -22.760 15.862 -17.668 1.00 0.00 C ATOM 863 OG SER A 497 -23.547 16.745 -16.891 1.00 0.00 O ATOM 0 H SER A 497 -21.443 15.008 -19.599 1.00 0.00 H new ATOM 0 HA SER A 497 -21.658 17.581 -18.361 1.00 0.00 H new ATOM 0 HB2 SER A 497 -23.338 15.521 -18.527 1.00 0.00 H new ATOM 0 HB3 SER A 497 -22.515 14.979 -17.078 1.00 0.00 H new ATOM 0 HG SER A 497 -23.416 16.549 -15.940 1.00 0.00 H new ATOM 869 N CYS A 498 -19.554 15.421 -17.030 1.00 0.00 N ATOM 870 CA CYS A 498 -18.411 15.331 -16.110 1.00 0.00 C ATOM 871 C CYS A 498 -17.207 16.182 -16.564 1.00 0.00 C ATOM 872 O CYS A 498 -16.989 16.411 -17.757 1.00 0.00 O ATOM 873 CB CYS A 498 -17.991 13.869 -15.929 1.00 0.00 C ATOM 874 SG CYS A 498 -19.452 12.849 -15.618 1.00 0.00 S ATOM 0 H CYS A 498 -19.654 14.612 -17.644 1.00 0.00 H new ATOM 0 HA CYS A 498 -18.741 15.738 -15.154 1.00 0.00 H new ATOM 0 HB2 CYS A 498 -17.473 13.516 -16.821 1.00 0.00 H new ATOM 0 HB3 CYS A 498 -17.291 13.782 -15.098 1.00 0.00 H new ATOM 0 HG CYS A 498 -19.092 11.609 -15.467 1.00 0.00 H new ATOM 880 N GLN A 499 -16.386 16.620 -15.603 1.00 0.00 N ATOM 881 CA GLN A 499 -15.148 17.383 -15.861 1.00 0.00 C ATOM 882 C GLN A 499 -14.087 16.601 -16.664 1.00 0.00 C ATOM 883 O GLN A 499 -13.317 17.196 -17.422 1.00 0.00 O ATOM 884 CB GLN A 499 -14.572 17.912 -14.536 1.00 0.00 C ATOM 885 CG GLN A 499 -14.087 16.808 -13.581 1.00 0.00 C ATOM 886 CD GLN A 499 -13.853 17.326 -12.175 1.00 0.00 C ATOM 887 OE1 GLN A 499 -13.307 18.400 -11.957 1.00 0.00 O ATOM 888 NE2 GLN A 499 -14.276 16.581 -11.173 1.00 0.00 N ATOM 0 H GLN A 499 -16.560 16.456 -14.611 1.00 0.00 H new ATOM 0 HA GLN A 499 -15.424 18.223 -16.498 1.00 0.00 H new ATOM 0 HB2 GLN A 499 -13.740 18.581 -14.755 1.00 0.00 H new ATOM 0 HB3 GLN A 499 -15.334 18.506 -14.032 1.00 0.00 H new ATOM 0 HG2 GLN A 499 -14.824 16.006 -13.552 1.00 0.00 H new ATOM 0 HG3 GLN A 499 -13.162 16.378 -13.966 1.00 0.00 H new ATOM 0 HE21 GLN A 499 -14.730 15.687 -11.359 1.00 0.00 H new ATOM 0 HE22 GLN A 499 -14.149 16.899 -10.212 1.00 0.00 H new ATOM 897 N THR A 500 -14.060 15.273 -16.513 1.00 0.00 N ATOM 898 CA THR A 500 -13.253 14.338 -17.325 1.00 0.00 C ATOM 899 C THR A 500 -14.116 13.546 -18.315 1.00 0.00 C ATOM 900 O THR A 500 -15.162 13.011 -17.941 1.00 0.00 O ATOM 901 CB THR A 500 -12.478 13.347 -16.433 1.00 0.00 C ATOM 902 OG1 THR A 500 -11.678 14.042 -15.500 1.00 0.00 O ATOM 903 CG2 THR A 500 -11.542 12.426 -17.222 1.00 0.00 C ATOM 0 H THR A 500 -14.615 14.798 -15.801 1.00 0.00 H new ATOM 0 HA THR A 500 -12.548 14.951 -17.886 1.00 0.00 H new ATOM 0 HB THR A 500 -13.242 12.743 -15.943 1.00 0.00 H new ATOM 0 HG1 THR A 500 -11.831 13.678 -14.603 1.00 0.00 H new ATOM 0 HG21 THR A 500 -11.028 11.754 -16.534 1.00 0.00 H new ATOM 0 HG22 THR A 500 -12.123 11.841 -17.935 1.00 0.00 H new ATOM 0 HG23 THR A 500 -10.808 13.027 -17.759 1.00 0.00 H new ATOM 911 N ALA A 501 -13.648 13.403 -19.556 1.00 0.00 N ATOM 912 CA ALA A 501 -14.219 12.509 -20.565 1.00 0.00 C ATOM 913 C ALA A 501 -13.490 11.138 -20.543 1.00 0.00 C ATOM 914 O ALA A 501 -12.258 11.083 -20.596 1.00 0.00 O ATOM 915 CB ALA A 501 -14.041 13.179 -21.935 1.00 0.00 C ATOM 0 H ALA A 501 -12.838 13.921 -19.897 1.00 0.00 H new ATOM 0 HA ALA A 501 -15.275 12.331 -20.361 1.00 0.00 H new ATOM 0 HB1 ALA A 501 -14.457 12.537 -22.711 1.00 0.00 H new ATOM 0 HB2 ALA A 501 -14.559 14.138 -21.941 1.00 0.00 H new ATOM 0 HB3 ALA A 501 -12.980 13.339 -22.127 1.00 0.00 H new ATOM 921 N LEU A 502 -14.241 10.034 -20.503 1.00 0.00 N ATOM 922 CA LEU A 502 -13.752 8.636 -20.549 1.00 0.00 C ATOM 923 C LEU A 502 -14.325 7.873 -21.774 1.00 0.00 C ATOM 924 O LEU A 502 -15.397 8.199 -22.287 1.00 0.00 O ATOM 925 CB LEU A 502 -14.091 7.975 -19.191 1.00 0.00 C ATOM 926 CG LEU A 502 -13.835 6.463 -19.036 1.00 0.00 C ATOM 927 CD1 LEU A 502 -12.352 6.161 -18.845 1.00 0.00 C ATOM 928 CD2 LEU A 502 -14.592 5.913 -17.831 1.00 0.00 C ATOM 0 H LEU A 502 -15.257 10.083 -20.434 1.00 0.00 H new ATOM 0 HA LEU A 502 -12.672 8.607 -20.690 1.00 0.00 H new ATOM 0 HB2 LEU A 502 -13.522 8.491 -18.418 1.00 0.00 H new ATOM 0 HB3 LEU A 502 -15.146 8.157 -18.985 1.00 0.00 H new ATOM 0 HG LEU A 502 -14.184 5.987 -19.953 1.00 0.00 H new ATOM 0 HD11 LEU A 502 -12.210 5.085 -18.739 1.00 0.00 H new ATOM 0 HD12 LEU A 502 -11.794 6.517 -19.711 1.00 0.00 H new ATOM 0 HD13 LEU A 502 -11.991 6.664 -17.948 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -14.399 4.844 -17.737 1.00 0.00 H new ATOM 0 HD22 LEU A 502 -14.257 6.423 -16.927 1.00 0.00 H new ATOM 0 HD23 LEU A 502 -15.661 6.079 -17.966 1.00 0.00 H new ATOM 940 N SER A 503 -13.602 6.858 -22.254 1.00 0.00 N ATOM 941 CA SER A 503 -13.991 6.033 -23.417 1.00 0.00 C ATOM 942 C SER A 503 -15.184 5.083 -23.140 1.00 0.00 C ATOM 943 O SER A 503 -15.316 4.575 -22.020 1.00 0.00 O ATOM 944 CB SER A 503 -12.785 5.197 -23.876 1.00 0.00 C ATOM 945 OG SER A 503 -11.761 6.023 -24.410 1.00 0.00 O ATOM 0 H SER A 503 -12.712 6.576 -21.843 1.00 0.00 H new ATOM 0 HA SER A 503 -14.314 6.728 -24.192 1.00 0.00 H new ATOM 0 HB2 SER A 503 -12.393 4.626 -23.034 1.00 0.00 H new ATOM 0 HB3 SER A 503 -13.104 4.476 -24.629 1.00 0.00 H new ATOM 0 HG SER A 503 -11.006 5.466 -24.692 1.00 0.00 H new ATOM 951 N PRO A 504 -16.022 4.756 -24.150 1.00 0.00 N ATOM 952 CA PRO A 504 -17.232 3.931 -23.984 1.00 0.00 C ATOM 953 C PRO A 504 -16.966 2.455 -23.644 1.00 0.00 C ATOM 954 O PRO A 504 -17.816 1.804 -23.035 1.00 0.00 O ATOM 955 CB PRO A 504 -18.002 4.072 -25.302 1.00 0.00 C ATOM 956 CG PRO A 504 -16.917 4.385 -26.329 1.00 0.00 C ATOM 957 CD PRO A 504 -15.930 5.230 -25.526 1.00 0.00 C ATOM 0 HA PRO A 504 -17.797 4.285 -23.121 1.00 0.00 H new ATOM 0 HB2 PRO A 504 -18.537 3.156 -25.552 1.00 0.00 H new ATOM 0 HB3 PRO A 504 -18.743 4.869 -25.248 1.00 0.00 H new ATOM 0 HG2 PRO A 504 -16.452 3.478 -26.717 1.00 0.00 H new ATOM 0 HG3 PRO A 504 -17.315 4.930 -27.185 1.00 0.00 H new ATOM 0 HD2 PRO A 504 -14.916 5.117 -25.911 1.00 0.00 H new ATOM 0 HD3 PRO A 504 -16.180 6.289 -25.591 1.00 0.00 H new ATOM 965 N GLY A 505 -15.790 1.922 -23.988 1.00 0.00 N ATOM 966 CA GLY A 505 -15.381 0.556 -23.616 1.00 0.00 C ATOM 967 C GLY A 505 -15.093 0.392 -22.116 1.00 0.00 C ATOM 968 O GLY A 505 -15.441 -0.630 -21.516 1.00 0.00 O ATOM 0 H GLY A 505 -15.090 2.424 -24.534 1.00 0.00 H new ATOM 0 HA2 GLY A 505 -16.166 -0.142 -23.906 1.00 0.00 H new ATOM 0 HA3 GLY A 505 -14.489 0.285 -24.181 1.00 0.00 H new ATOM 972 N GLU A 506 -14.508 1.425 -21.494 1.00 0.00 N ATOM 973 CA GLU A 506 -14.239 1.503 -20.038 1.00 0.00 C ATOM 974 C GLU A 506 -15.446 1.979 -19.239 1.00 0.00 C ATOM 975 O GLU A 506 -15.652 1.519 -18.120 1.00 0.00 O ATOM 976 CB GLU A 506 -13.095 2.476 -19.743 1.00 0.00 C ATOM 977 CG GLU A 506 -11.745 2.010 -20.288 1.00 0.00 C ATOM 978 CD GLU A 506 -11.063 1.055 -19.318 1.00 0.00 C ATOM 979 OE1 GLU A 506 -11.329 -0.166 -19.374 1.00 0.00 O ATOM 980 OE2 GLU A 506 -10.223 1.542 -18.529 1.00 0.00 O ATOM 0 H GLU A 506 -14.198 2.256 -21.997 1.00 0.00 H new ATOM 0 HA GLU A 506 -13.983 0.487 -19.738 1.00 0.00 H new ATOM 0 HB2 GLU A 506 -13.335 3.449 -20.172 1.00 0.00 H new ATOM 0 HB3 GLU A 506 -13.015 2.615 -18.665 1.00 0.00 H new ATOM 0 HG2 GLU A 506 -11.888 1.516 -21.249 1.00 0.00 H new ATOM 0 HG3 GLU A 506 -11.103 2.873 -20.465 1.00 0.00 H new ATOM 987 N MET A 507 -16.276 2.847 -19.824 1.00 0.00 N ATOM 988 CA MET A 507 -17.523 3.342 -19.220 1.00 0.00 C ATOM 989 C MET A 507 -18.365 2.203 -18.614 1.00 0.00 C ATOM 990 O MET A 507 -18.751 2.276 -17.446 1.00 0.00 O ATOM 991 CB MET A 507 -18.343 4.091 -20.285 1.00 0.00 C ATOM 992 CG MET A 507 -19.744 4.538 -19.827 1.00 0.00 C ATOM 993 SD MET A 507 -21.104 4.232 -20.990 1.00 0.00 S ATOM 994 CE MET A 507 -21.164 2.422 -21.056 1.00 0.00 C ATOM 0 H MET A 507 -16.099 3.235 -20.750 1.00 0.00 H new ATOM 0 HA MET A 507 -17.257 4.017 -18.407 1.00 0.00 H new ATOM 0 HB2 MET A 507 -17.782 4.970 -20.603 1.00 0.00 H new ATOM 0 HB3 MET A 507 -18.450 3.448 -21.159 1.00 0.00 H new ATOM 0 HG2 MET A 507 -19.975 4.033 -18.889 1.00 0.00 H new ATOM 0 HG3 MET A 507 -19.710 5.606 -19.613 1.00 0.00 H new ATOM 0 HE1 MET A 507 -22.042 2.107 -21.620 1.00 0.00 H new ATOM 0 HE2 MET A 507 -20.265 2.046 -21.544 1.00 0.00 H new ATOM 0 HE3 MET A 507 -21.221 2.023 -20.043 1.00 0.00 H new ATOM 1004 N GLU A 508 -18.618 1.133 -19.381 1.00 0.00 N ATOM 1005 CA GLU A 508 -19.435 -0.015 -18.933 1.00 0.00 C ATOM 1006 C GLU A 508 -18.826 -0.708 -17.718 1.00 0.00 C ATOM 1007 O GLU A 508 -19.514 -0.899 -16.720 1.00 0.00 O ATOM 1008 CB GLU A 508 -19.638 -1.020 -20.077 1.00 0.00 C ATOM 1009 CG GLU A 508 -20.695 -2.069 -19.738 1.00 0.00 C ATOM 1010 CD GLU A 508 -20.876 -3.024 -20.909 1.00 0.00 C ATOM 1011 OE1 GLU A 508 -21.712 -2.729 -21.795 1.00 0.00 O ATOM 1012 OE2 GLU A 508 -20.194 -4.072 -20.933 1.00 0.00 O ATOM 0 H GLU A 508 -18.263 1.034 -20.332 1.00 0.00 H new ATOM 0 HA GLU A 508 -20.407 0.379 -18.635 1.00 0.00 H new ATOM 0 HB2 GLU A 508 -19.934 -0.486 -20.980 1.00 0.00 H new ATOM 0 HB3 GLU A 508 -18.692 -1.516 -20.296 1.00 0.00 H new ATOM 0 HG2 GLU A 508 -20.396 -2.624 -18.849 1.00 0.00 H new ATOM 0 HG3 GLU A 508 -21.642 -1.581 -19.506 1.00 0.00 H new ATOM 1019 N LYS A 509 -17.525 -1.005 -17.781 1.00 0.00 N ATOM 1020 CA LYS A 509 -16.737 -1.629 -16.708 1.00 0.00 C ATOM 1021 C LYS A 509 -16.641 -0.763 -15.437 1.00 0.00 C ATOM 1022 O LYS A 509 -16.570 -1.308 -14.339 1.00 0.00 O ATOM 1023 CB LYS A 509 -15.316 -1.936 -17.218 1.00 0.00 C ATOM 1024 CG LYS A 509 -15.270 -2.990 -18.344 1.00 0.00 C ATOM 1025 CD LYS A 509 -14.675 -4.344 -17.920 1.00 0.00 C ATOM 1026 CE LYS A 509 -15.456 -5.013 -16.782 1.00 0.00 C ATOM 1027 NZ LYS A 509 -15.041 -6.420 -16.592 1.00 0.00 N ATOM 0 H LYS A 509 -16.967 -0.811 -18.613 1.00 0.00 H new ATOM 0 HA LYS A 509 -17.259 -2.545 -16.433 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -14.863 -1.013 -17.579 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -14.708 -2.284 -16.383 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -16.282 -3.152 -18.716 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -14.685 -2.593 -19.174 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -14.656 -5.012 -18.781 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -13.641 -4.198 -17.607 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -15.299 -4.458 -15.857 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -16.523 -4.974 -17.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -15.589 -6.842 -15.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -15.214 -6.954 -17.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -14.028 -6.455 -16.360 1.00 0.00 H new ATOM 1041 N HIS A 510 -16.682 0.564 -15.562 1.00 0.00 N ATOM 1042 CA HIS A 510 -16.643 1.523 -14.450 1.00 0.00 C ATOM 1043 C HIS A 510 -18.016 1.728 -13.787 1.00 0.00 C ATOM 1044 O HIS A 510 -18.111 1.771 -12.557 1.00 0.00 O ATOM 1045 CB HIS A 510 -16.123 2.878 -14.954 1.00 0.00 C ATOM 1046 CG HIS A 510 -14.623 2.968 -15.115 1.00 0.00 C ATOM 1047 ND1 HIS A 510 -13.748 1.913 -15.399 1.00 0.00 N ATOM 1048 CD2 HIS A 510 -13.897 4.121 -15.022 1.00 0.00 C ATOM 1049 CE1 HIS A 510 -12.525 2.461 -15.493 1.00 0.00 C ATOM 1050 NE2 HIS A 510 -12.585 3.784 -15.269 1.00 0.00 N ATOM 0 H HIS A 510 -16.746 1.020 -16.472 1.00 0.00 H new ATOM 0 HA HIS A 510 -15.975 1.106 -13.697 1.00 0.00 H new ATOM 0 HB2 HIS A 510 -16.590 3.094 -15.915 1.00 0.00 H new ATOM 0 HB3 HIS A 510 -16.446 3.655 -14.261 1.00 0.00 H new ATOM 0 HD2 HIS A 510 -14.278 5.106 -14.798 1.00 0.00 H new ATOM 0 HE1 HIS A 510 -11.621 1.915 -15.717 1.00 0.00 H new ATOM 0 HE2 HIS A 510 -11.794 4.428 -15.280 1.00 0.00 H new ATOM 1058 N LEU A 511 -19.089 1.822 -14.581 1.00 0.00 N ATOM 1059 CA LEU A 511 -20.463 1.903 -14.076 1.00 0.00 C ATOM 1060 C LEU A 511 -20.837 0.650 -13.272 1.00 0.00 C ATOM 1061 O LEU A 511 -21.322 0.754 -12.146 1.00 0.00 O ATOM 1062 CB LEU A 511 -21.437 2.074 -15.254 1.00 0.00 C ATOM 1063 CG LEU A 511 -21.424 3.476 -15.889 1.00 0.00 C ATOM 1064 CD1 LEU A 511 -22.253 3.449 -17.172 1.00 0.00 C ATOM 1065 CD2 LEU A 511 -22.007 4.541 -14.958 1.00 0.00 C ATOM 0 H LEU A 511 -19.027 1.844 -15.599 1.00 0.00 H new ATOM 0 HA LEU A 511 -20.531 2.764 -13.412 1.00 0.00 H new ATOM 0 HB2 LEU A 511 -21.194 1.338 -16.021 1.00 0.00 H new ATOM 0 HB3 LEU A 511 -22.447 1.853 -14.910 1.00 0.00 H new ATOM 0 HG LEU A 511 -20.385 3.735 -16.091 1.00 0.00 H new ATOM 0 HD11 LEU A 511 -22.249 4.439 -17.629 1.00 0.00 H new ATOM 0 HD12 LEU A 511 -21.824 2.727 -17.867 1.00 0.00 H new ATOM 0 HD13 LEU A 511 -23.278 3.162 -16.937 1.00 0.00 H new ATOM 0 HD21 LEU A 511 -21.975 5.512 -15.452 1.00 0.00 H new ATOM 0 HD22 LEU A 511 -23.040 4.289 -14.719 1.00 0.00 H new ATOM 0 HD23 LEU A 511 -21.421 4.581 -14.040 1.00 0.00 H new ATOM 1077 N VAL A 512 -20.557 -0.534 -13.822 1.00 0.00 N ATOM 1078 CA VAL A 512 -20.803 -1.808 -13.123 1.00 0.00 C ATOM 1079 C VAL A 512 -19.959 -1.919 -11.847 1.00 0.00 C ATOM 1080 O VAL A 512 -20.469 -2.374 -10.823 1.00 0.00 O ATOM 1081 CB VAL A 512 -20.607 -3.020 -14.055 1.00 0.00 C ATOM 1082 CG1 VAL A 512 -19.168 -3.211 -14.532 1.00 0.00 C ATOM 1083 CG2 VAL A 512 -21.041 -4.326 -13.396 1.00 0.00 C ATOM 0 H VAL A 512 -20.157 -0.642 -14.754 1.00 0.00 H new ATOM 0 HA VAL A 512 -21.849 -1.815 -12.817 1.00 0.00 H new ATOM 0 HB VAL A 512 -21.236 -2.789 -14.915 1.00 0.00 H new ATOM 0 HG11 VAL A 512 -19.113 -4.084 -15.183 1.00 0.00 H new ATOM 0 HG12 VAL A 512 -18.847 -2.327 -15.083 1.00 0.00 H new ATOM 0 HG13 VAL A 512 -18.516 -3.359 -13.671 1.00 0.00 H new ATOM 0 HG21 VAL A 512 -20.885 -5.153 -14.089 1.00 0.00 H new ATOM 0 HG22 VAL A 512 -20.451 -4.492 -12.494 1.00 0.00 H new ATOM 0 HG23 VAL A 512 -22.097 -4.267 -13.133 1.00 0.00 H new ATOM 1093 N LEU A 513 -18.711 -1.429 -11.878 1.00 0.00 N ATOM 1094 CA LEU A 513 -17.784 -1.481 -10.743 1.00 0.00 C ATOM 1095 C LEU A 513 -18.393 -0.931 -9.441 1.00 0.00 C ATOM 1096 O LEU A 513 -18.390 -1.629 -8.437 1.00 0.00 O ATOM 1097 CB LEU A 513 -16.467 -0.743 -11.066 1.00 0.00 C ATOM 1098 CG LEU A 513 -15.165 -1.480 -10.699 1.00 0.00 C ATOM 1099 CD1 LEU A 513 -15.114 -1.901 -9.233 1.00 0.00 C ATOM 1100 CD2 LEU A 513 -14.924 -2.713 -11.570 1.00 0.00 C ATOM 0 H LEU A 513 -18.314 -0.980 -12.704 1.00 0.00 H new ATOM 0 HA LEU A 513 -17.572 -2.537 -10.577 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -16.449 -0.527 -12.134 1.00 0.00 H new ATOM 0 HB3 LEU A 513 -16.476 0.216 -10.547 1.00 0.00 H new ATOM 0 HG LEU A 513 -14.376 -0.751 -10.883 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -14.174 -2.415 -9.035 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -15.186 -1.018 -8.598 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -15.946 -2.571 -9.018 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -13.994 -3.195 -11.269 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -15.751 -3.412 -11.447 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -14.855 -2.412 -12.615 1.00 0.00 H new ATOM 1112 N LEU A 514 -18.971 0.275 -9.457 1.00 0.00 N ATOM 1113 CA LEU A 514 -19.595 0.898 -8.279 1.00 0.00 C ATOM 1114 C LEU A 514 -20.608 -0.043 -7.585 1.00 0.00 C ATOM 1115 O LEU A 514 -20.417 -0.416 -6.425 1.00 0.00 O ATOM 1116 CB LEU A 514 -20.254 2.220 -8.719 1.00 0.00 C ATOM 1117 CG LEU A 514 -19.270 3.389 -8.913 1.00 0.00 C ATOM 1118 CD1 LEU A 514 -19.992 4.564 -9.573 1.00 0.00 C ATOM 1119 CD2 LEU A 514 -18.684 3.887 -7.588 1.00 0.00 C ATOM 0 H LEU A 514 -19.021 0.854 -10.295 1.00 0.00 H new ATOM 0 HA LEU A 514 -18.826 1.101 -7.534 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -20.788 2.052 -9.654 1.00 0.00 H new ATOM 0 HB3 LEU A 514 -20.997 2.507 -7.975 1.00 0.00 H new ATOM 0 HG LEU A 514 -18.458 3.016 -9.537 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -19.294 5.390 -9.709 1.00 0.00 H new ATOM 0 HD12 LEU A 514 -20.381 4.254 -10.543 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -20.817 4.887 -8.938 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -17.997 4.711 -7.781 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -19.490 4.231 -6.940 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -18.147 3.074 -7.099 1.00 0.00 H new ATOM 1131 N ALA A 515 -21.627 -0.518 -8.307 1.00 0.00 N ATOM 1132 CA ALA A 515 -22.601 -1.485 -7.782 1.00 0.00 C ATOM 1133 C ALA A 515 -21.975 -2.835 -7.350 1.00 0.00 C ATOM 1134 O ALA A 515 -22.515 -3.520 -6.477 1.00 0.00 O ATOM 1135 CB ALA A 515 -23.675 -1.723 -8.838 1.00 0.00 C ATOM 0 H ALA A 515 -21.802 -0.244 -9.274 1.00 0.00 H new ATOM 0 HA ALA A 515 -23.027 -1.052 -6.877 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -24.404 -2.439 -8.460 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -24.175 -0.782 -9.067 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -23.214 -2.118 -9.743 1.00 0.00 H new ATOM 1141 N GLU A 516 -20.825 -3.216 -7.929 1.00 0.00 N ATOM 1142 CA GLU A 516 -20.031 -4.412 -7.564 1.00 0.00 C ATOM 1143 C GLU A 516 -19.338 -4.288 -6.205 1.00 0.00 C ATOM 1144 O GLU A 516 -19.013 -5.306 -5.594 1.00 0.00 O ATOM 1145 CB GLU A 516 -18.979 -4.732 -8.646 1.00 0.00 C ATOM 1146 CG GLU A 516 -18.832 -6.234 -8.876 1.00 0.00 C ATOM 1147 CD GLU A 516 -17.787 -6.495 -9.952 1.00 0.00 C ATOM 1148 OE1 GLU A 516 -18.153 -6.505 -11.148 1.00 0.00 O ATOM 1149 OE2 GLU A 516 -16.608 -6.715 -9.594 1.00 0.00 O ATOM 0 H GLU A 516 -20.403 -2.685 -8.691 1.00 0.00 H new ATOM 0 HA GLU A 516 -20.749 -5.229 -7.492 1.00 0.00 H new ATOM 0 HB2 GLU A 516 -19.262 -4.248 -9.581 1.00 0.00 H new ATOM 0 HB3 GLU A 516 -18.016 -4.315 -8.350 1.00 0.00 H new ATOM 0 HG2 GLU A 516 -18.541 -6.726 -7.948 1.00 0.00 H new ATOM 0 HG3 GLU A 516 -19.789 -6.660 -9.176 1.00 0.00 H new ATOM 1156 N LEU A 517 -19.157 -3.061 -5.706 1.00 0.00 N ATOM 1157 CA LEU A 517 -18.552 -2.774 -4.404 1.00 0.00 C ATOM 1158 C LEU A 517 -19.606 -2.436 -3.336 1.00 0.00 C ATOM 1159 O LEU A 517 -19.433 -2.799 -2.168 1.00 0.00 O ATOM 1160 CB LEU A 517 -17.556 -1.615 -4.557 1.00 0.00 C ATOM 1161 CG LEU A 517 -16.491 -1.833 -5.646 1.00 0.00 C ATOM 1162 CD1 LEU A 517 -15.579 -0.618 -5.692 1.00 0.00 C ATOM 1163 CD2 LEU A 517 -15.701 -3.124 -5.484 1.00 0.00 C ATOM 0 H LEU A 517 -19.435 -2.219 -6.210 1.00 0.00 H new ATOM 0 HA LEU A 517 -18.034 -3.671 -4.065 1.00 0.00 H new ATOM 0 HB2 LEU A 517 -18.109 -0.704 -4.784 1.00 0.00 H new ATOM 0 HB3 LEU A 517 -17.055 -1.454 -3.603 1.00 0.00 H new ATOM 0 HG LEU A 517 -17.010 -1.946 -6.598 1.00 0.00 H new ATOM 0 HD11 LEU A 517 -14.820 -0.762 -6.461 1.00 0.00 H new ATOM 0 HD12 LEU A 517 -16.167 0.270 -5.924 1.00 0.00 H new ATOM 0 HD13 LEU A 517 -15.095 -0.489 -4.724 1.00 0.00 H new ATOM 0 HD21 LEU A 517 -14.970 -3.207 -6.289 1.00 0.00 H new ATOM 0 HD22 LEU A 517 -15.185 -3.117 -4.524 1.00 0.00 H new ATOM 0 HD23 LEU A 517 -16.382 -3.974 -5.523 1.00 0.00 H new ATOM 1175 N LEU A 518 -20.710 -1.794 -3.735 1.00 0.00 N ATOM 1176 CA LEU A 518 -21.879 -1.561 -2.885 1.00 0.00 C ATOM 1177 C LEU A 518 -23.203 -1.565 -3.697 1.00 0.00 C ATOM 1178 O LEU A 518 -23.562 -0.552 -4.303 1.00 0.00 O ATOM 1179 CB LEU A 518 -21.666 -0.321 -1.977 1.00 0.00 C ATOM 1180 CG LEU A 518 -21.871 1.101 -2.536 1.00 0.00 C ATOM 1181 CD1 LEU A 518 -21.503 2.111 -1.456 1.00 0.00 C ATOM 1182 CD2 LEU A 518 -21.040 1.400 -3.777 1.00 0.00 C ATOM 0 H LEU A 518 -20.816 -1.415 -4.676 1.00 0.00 H new ATOM 0 HA LEU A 518 -21.989 -2.402 -2.201 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -22.333 -0.430 -1.122 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -20.646 -0.373 -1.595 1.00 0.00 H new ATOM 0 HG LEU A 518 -22.919 1.173 -2.828 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -21.644 3.121 -1.840 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -22.141 1.961 -0.585 1.00 0.00 H new ATOM 0 HD13 LEU A 518 -20.460 1.974 -1.170 1.00 0.00 H new ATOM 0 HD21 LEU A 518 -21.238 2.418 -4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 518 -19.981 1.296 -3.540 1.00 0.00 H new ATOM 0 HD23 LEU A 518 -21.305 0.700 -4.570 1.00 0.00 H new ATOM 1194 N PRO A 519 -23.985 -2.666 -3.695 1.00 0.00 N ATOM 1195 CA PRO A 519 -25.313 -2.724 -4.327 1.00 0.00 C ATOM 1196 C PRO A 519 -26.394 -1.922 -3.565 1.00 0.00 C ATOM 1197 O PRO A 519 -27.589 -2.083 -3.824 1.00 0.00 O ATOM 1198 CB PRO A 519 -25.631 -4.221 -4.428 1.00 0.00 C ATOM 1199 CG PRO A 519 -24.921 -4.816 -3.216 1.00 0.00 C ATOM 1200 CD PRO A 519 -23.661 -3.959 -3.098 1.00 0.00 C ATOM 0 HA PRO A 519 -25.308 -2.246 -5.306 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -26.705 -4.407 -4.396 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -25.261 -4.648 -5.360 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -25.536 -4.755 -2.318 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -24.680 -5.868 -3.366 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -23.367 -3.842 -2.055 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -22.823 -4.427 -3.615 1.00 0.00 H new ATOM 1208 N ASP A 520 -25.990 -1.079 -2.603 1.00 0.00 N ATOM 1209 CA ASP A 520 -26.861 -0.267 -1.734 1.00 0.00 C ATOM 1210 C ASP A 520 -27.063 1.173 -2.239 1.00 0.00 C ATOM 1211 O ASP A 520 -28.128 1.750 -2.015 1.00 0.00 O ATOM 1212 CB ASP A 520 -26.247 -0.244 -0.321 1.00 0.00 C ATOM 1213 CG ASP A 520 -27.063 0.580 0.697 1.00 0.00 C ATOM 1214 OD1 ASP A 520 -28.109 0.080 1.178 1.00 0.00 O ATOM 1215 OD2 ASP A 520 -26.637 1.714 1.031 1.00 0.00 O ATOM 0 H ASP A 520 -25.001 -0.937 -2.399 1.00 0.00 H new ATOM 0 HA ASP A 520 -27.849 -0.727 -1.733 1.00 0.00 H new ATOM 0 HB2 ASP A 520 -26.156 -1.268 0.043 1.00 0.00 H new ATOM 0 HB3 ASP A 520 -25.238 0.164 -0.380 1.00 0.00 H new ATOM 1220 N TRP A 521 -26.073 1.730 -2.946 1.00 0.00 N ATOM 1221 CA TRP A 521 -26.103 3.111 -3.452 1.00 0.00 C ATOM 1222 C TRP A 521 -26.333 3.190 -4.970 1.00 0.00 C ATOM 1223 O TRP A 521 -27.235 3.899 -5.424 1.00 0.00 O ATOM 1224 CB TRP A 521 -24.800 3.822 -3.079 1.00 0.00 C ATOM 1225 CG TRP A 521 -24.759 5.246 -3.528 1.00 0.00 C ATOM 1226 CD1 TRP A 521 -25.720 6.162 -3.273 1.00 0.00 C ATOM 1227 CD2 TRP A 521 -23.766 5.926 -4.357 1.00 0.00 C ATOM 1228 NE1 TRP A 521 -25.415 7.342 -3.910 1.00 0.00 N ATOM 1229 CE2 TRP A 521 -24.197 7.273 -4.548 1.00 0.00 C ATOM 1230 CE3 TRP A 521 -22.546 5.549 -4.966 1.00 0.00 C ATOM 1231 CZ2 TRP A 521 -23.459 8.203 -5.290 1.00 0.00 C ATOM 1232 CZ3 TRP A 521 -21.803 6.470 -5.729 1.00 0.00 C ATOM 1233 CH2 TRP A 521 -22.262 7.789 -5.894 1.00 0.00 C ATOM 0 H TRP A 521 -25.217 1.230 -3.187 1.00 0.00 H new ATOM 0 HA TRP A 521 -26.952 3.608 -2.982 1.00 0.00 H new ATOM 0 HB2 TRP A 521 -24.670 3.785 -1.997 1.00 0.00 H new ATOM 0 HB3 TRP A 521 -23.961 3.284 -3.520 1.00 0.00 H new ATOM 0 HD1 TRP A 521 -26.594 5.993 -2.662 1.00 0.00 H new ATOM 0 HE1 TRP A 521 -26.016 8.166 -3.910 1.00 0.00 H new ATOM 0 HE3 TRP A 521 -22.179 4.540 -4.844 1.00 0.00 H new ATOM 0 HZ2 TRP A 521 -23.805 9.221 -5.396 1.00 0.00 H new ATOM 0 HZ3 TRP A 521 -20.876 6.162 -6.190 1.00 0.00 H new ATOM 0 HH2 TRP A 521 -21.691 8.487 -6.488 1.00 0.00 H new ATOM 1244 N LEU A 522 -25.551 2.430 -5.744 1.00 0.00 N ATOM 1245 CA LEU A 522 -25.774 2.217 -7.175 1.00 0.00 C ATOM 1246 C LEU A 522 -26.355 0.811 -7.400 1.00 0.00 C ATOM 1247 O LEU A 522 -25.864 -0.173 -6.841 1.00 0.00 O ATOM 1248 CB LEU A 522 -24.462 2.389 -7.971 1.00 0.00 C ATOM 1249 CG LEU A 522 -24.704 2.378 -9.500 1.00 0.00 C ATOM 1250 CD1 LEU A 522 -25.303 3.688 -9.996 1.00 0.00 C ATOM 1251 CD2 LEU A 522 -23.424 2.174 -10.286 1.00 0.00 C ATOM 0 H LEU A 522 -24.732 1.938 -5.386 1.00 0.00 H new ATOM 0 HA LEU A 522 -26.483 2.963 -7.534 1.00 0.00 H new ATOM 0 HB2 LEU A 522 -23.986 3.327 -7.686 1.00 0.00 H new ATOM 0 HB3 LEU A 522 -23.771 1.588 -7.708 1.00 0.00 H new ATOM 0 HG LEU A 522 -25.392 1.548 -9.663 1.00 0.00 H new ATOM 0 HD11 LEU A 522 -25.455 3.633 -11.074 1.00 0.00 H new ATOM 0 HD12 LEU A 522 -26.260 3.860 -9.503 1.00 0.00 H new ATOM 0 HD13 LEU A 522 -24.623 4.509 -9.767 1.00 0.00 H new ATOM 0 HD21 LEU A 522 -23.648 2.174 -11.353 1.00 0.00 H new ATOM 0 HD22 LEU A 522 -22.727 2.981 -10.062 1.00 0.00 H new ATOM 0 HD23 LEU A 522 -22.975 1.220 -10.010 1.00 0.00 H new ATOM 1263 N SER A 523 -27.352 0.720 -8.275 1.00 0.00 N ATOM 1264 CA SER A 523 -27.884 -0.547 -8.778 1.00 0.00 C ATOM 1265 C SER A 523 -27.959 -0.542 -10.310 1.00 0.00 C ATOM 1266 O SER A 523 -28.611 0.317 -10.914 1.00 0.00 O ATOM 1267 CB SER A 523 -29.281 -0.807 -8.189 1.00 0.00 C ATOM 1268 OG SER A 523 -29.240 -0.929 -6.776 1.00 0.00 O ATOM 0 H SER A 523 -27.823 1.538 -8.663 1.00 0.00 H new ATOM 0 HA SER A 523 -27.208 -1.344 -8.468 1.00 0.00 H new ATOM 0 HB2 SER A 523 -29.950 0.008 -8.465 1.00 0.00 H new ATOM 0 HB3 SER A 523 -29.694 -1.718 -8.621 1.00 0.00 H new ATOM 0 HG SER A 523 -30.144 -1.092 -6.435 1.00 0.00 H new ATOM 1274 N LEU A 524 -27.340 -1.547 -10.933 1.00 0.00 N ATOM 1275 CA LEU A 524 -27.467 -1.850 -12.361 1.00 0.00 C ATOM 1276 C LEU A 524 -28.751 -2.675 -12.556 1.00 0.00 C ATOM 1277 O LEU A 524 -28.852 -3.810 -12.079 1.00 0.00 O ATOM 1278 CB LEU A 524 -26.230 -2.643 -12.843 1.00 0.00 C ATOM 1279 CG LEU A 524 -24.979 -1.835 -13.243 1.00 0.00 C ATOM 1280 CD1 LEU A 524 -25.151 -1.133 -14.587 1.00 0.00 C ATOM 1281 CD2 LEU A 524 -24.569 -0.791 -12.217 1.00 0.00 C ATOM 0 H LEU A 524 -26.718 -2.191 -10.444 1.00 0.00 H new ATOM 0 HA LEU A 524 -27.524 -0.932 -12.946 1.00 0.00 H new ATOM 0 HB2 LEU A 524 -25.944 -3.335 -12.051 1.00 0.00 H new ATOM 0 HB3 LEU A 524 -26.530 -3.246 -13.700 1.00 0.00 H new ATOM 0 HG LEU A 524 -24.191 -2.585 -13.308 1.00 0.00 H new ATOM 0 HD11 LEU A 524 -24.244 -0.577 -14.826 1.00 0.00 H new ATOM 0 HD12 LEU A 524 -25.337 -1.875 -15.364 1.00 0.00 H new ATOM 0 HD13 LEU A 524 -25.995 -0.445 -14.533 1.00 0.00 H new ATOM 0 HD21 LEU A 524 -23.682 -0.264 -12.569 1.00 0.00 H new ATOM 0 HD22 LEU A 524 -25.383 -0.079 -12.077 1.00 0.00 H new ATOM 0 HD23 LEU A 524 -24.348 -1.280 -11.268 1.00 0.00 H new ATOM 1293 N HIS A 525 -29.731 -2.094 -13.242 1.00 0.00 N ATOM 1294 CA HIS A 525 -31.033 -2.712 -13.528 1.00 0.00 C ATOM 1295 C HIS A 525 -31.203 -2.997 -15.035 1.00 0.00 C ATOM 1296 O HIS A 525 -30.590 -2.358 -15.892 1.00 0.00 O ATOM 1297 CB HIS A 525 -32.162 -1.846 -12.940 1.00 0.00 C ATOM 1298 CG HIS A 525 -33.526 -2.479 -13.054 1.00 0.00 C ATOM 1299 ND1 HIS A 525 -34.449 -2.237 -14.075 1.00 0.00 N ATOM 1300 CD2 HIS A 525 -34.038 -3.418 -12.207 1.00 0.00 C ATOM 1301 CE1 HIS A 525 -35.498 -3.037 -13.816 1.00 0.00 C ATOM 1302 NE2 HIS A 525 -35.279 -3.754 -12.700 1.00 0.00 N ATOM 0 H HIS A 525 -29.644 -1.154 -13.628 1.00 0.00 H new ATOM 0 HA HIS A 525 -31.085 -3.685 -13.040 1.00 0.00 H new ATOM 0 HB2 HIS A 525 -31.948 -1.648 -11.890 1.00 0.00 H new ATOM 0 HB3 HIS A 525 -32.173 -0.883 -13.450 1.00 0.00 H new ATOM 0 HD2 HIS A 525 -33.563 -3.819 -11.324 1.00 0.00 H new ATOM 0 HE1 HIS A 525 -36.391 -3.095 -14.420 1.00 0.00 H new ATOM 0 HE2 HIS A 525 -35.922 -4.431 -12.289 1.00 0.00 H new ATOM 1310 N ARG A 526 -32.008 -3.999 -15.376 1.00 0.00 N ATOM 1311 CA ARG A 526 -32.262 -4.408 -16.759 1.00 0.00 C ATOM 1312 C ARG A 526 -33.773 -4.422 -17.035 1.00 0.00 C ATOM 1313 O ARG A 526 -34.539 -5.095 -16.335 1.00 0.00 O ATOM 1314 CB ARG A 526 -31.602 -5.777 -16.995 1.00 0.00 C ATOM 1315 CG ARG A 526 -31.677 -6.261 -18.458 1.00 0.00 C ATOM 1316 CD ARG A 526 -30.335 -6.177 -19.201 1.00 0.00 C ATOM 1317 NE ARG A 526 -29.313 -7.076 -18.630 1.00 0.00 N ATOM 1318 CZ ARG A 526 -29.224 -8.389 -18.774 1.00 0.00 C ATOM 1319 NH1 ARG A 526 -30.079 -9.081 -19.478 1.00 0.00 N ATOM 1320 NH2 ARG A 526 -28.255 -9.046 -18.198 1.00 0.00 N ATOM 0 H ARG A 526 -32.512 -4.561 -14.690 1.00 0.00 H new ATOM 0 HA ARG A 526 -31.825 -3.697 -17.460 1.00 0.00 H new ATOM 0 HB2 ARG A 526 -30.556 -5.722 -16.693 1.00 0.00 H new ATOM 0 HB3 ARG A 526 -32.081 -6.516 -16.353 1.00 0.00 H new ATOM 0 HG2 ARG A 526 -32.028 -7.293 -18.473 1.00 0.00 H new ATOM 0 HG3 ARG A 526 -32.417 -5.665 -18.992 1.00 0.00 H new ATOM 0 HD2 ARG A 526 -30.489 -6.428 -20.251 1.00 0.00 H new ATOM 0 HD3 ARG A 526 -29.970 -5.151 -19.169 1.00 0.00 H new ATOM 0 HE ARG A 526 -28.592 -6.635 -18.059 1.00 0.00 H new ATOM 0 HH11 ARG A 526 -30.855 -8.611 -19.944 1.00 0.00 H new ATOM 0 HH12 ARG A 526 -29.971 -10.092 -19.561 1.00 0.00 H new ATOM 0 HH21 ARG A 526 -27.565 -8.548 -17.636 1.00 0.00 H new ATOM 0 HH22 ARG A 526 -28.188 -10.058 -18.310 1.00 0.00 H new ATOM 1334 N ILE A 527 -34.197 -3.677 -18.058 1.00 0.00 N ATOM 1335 CA ILE A 527 -35.581 -3.667 -18.548 1.00 0.00 C ATOM 1336 C ILE A 527 -35.809 -4.837 -19.547 1.00 0.00 C ATOM 1337 O ILE A 527 -34.976 -5.740 -19.660 1.00 0.00 O ATOM 1338 CB ILE A 527 -35.931 -2.239 -19.062 1.00 0.00 C ATOM 1339 CG1 ILE A 527 -37.373 -1.836 -18.684 1.00 0.00 C ATOM 1340 CG2 ILE A 527 -35.725 -2.014 -20.564 1.00 0.00 C ATOM 1341 CD1 ILE A 527 -37.468 -1.324 -17.240 1.00 0.00 C ATOM 0 H ILE A 527 -33.580 -3.053 -18.579 1.00 0.00 H new ATOM 0 HA ILE A 527 -36.296 -3.864 -17.749 1.00 0.00 H new ATOM 0 HB ILE A 527 -35.209 -1.600 -18.553 1.00 0.00 H new ATOM 0 HG12 ILE A 527 -37.724 -1.062 -19.367 1.00 0.00 H new ATOM 0 HG13 ILE A 527 -38.034 -2.694 -18.808 1.00 0.00 H new ATOM 0 HG21 ILE A 527 -35.997 -0.990 -20.819 1.00 0.00 H new ATOM 0 HG22 ILE A 527 -34.679 -2.186 -20.817 1.00 0.00 H new ATOM 0 HG23 ILE A 527 -36.353 -2.706 -21.125 1.00 0.00 H new ATOM 0 HD11 ILE A 527 -38.500 -1.052 -17.018 1.00 0.00 H new ATOM 0 HD12 ILE A 527 -37.143 -2.107 -16.554 1.00 0.00 H new ATOM 0 HD13 ILE A 527 -36.829 -0.449 -17.121 1.00 0.00 H new ATOM 1353 N ARG A 528 -36.921 -4.846 -20.286 1.00 0.00 N ATOM 1354 CA ARG A 528 -37.238 -5.812 -21.357 1.00 0.00 C ATOM 1355 C ARG A 528 -36.061 -6.162 -22.305 1.00 0.00 C ATOM 1356 O ARG A 528 -35.820 -7.337 -22.597 1.00 0.00 O ATOM 1357 CB ARG A 528 -38.367 -5.223 -22.216 1.00 0.00 C ATOM 1358 CG ARG A 528 -39.685 -4.986 -21.462 1.00 0.00 C ATOM 1359 CD ARG A 528 -40.813 -4.701 -22.464 1.00 0.00 C ATOM 1360 NE ARG A 528 -41.967 -4.030 -21.839 1.00 0.00 N ATOM 1361 CZ ARG A 528 -42.912 -4.570 -21.087 1.00 0.00 C ATOM 1362 NH1 ARG A 528 -42.913 -5.832 -20.748 1.00 0.00 N ATOM 1363 NH2 ARG A 528 -43.896 -3.831 -20.654 1.00 0.00 N ATOM 0 H ARG A 528 -37.659 -4.155 -20.154 1.00 0.00 H new ATOM 0 HA ARG A 528 -37.510 -6.738 -20.850 1.00 0.00 H new ATOM 0 HB2 ARG A 528 -38.029 -4.276 -22.638 1.00 0.00 H new ATOM 0 HB3 ARG A 528 -38.558 -5.895 -23.053 1.00 0.00 H new ATOM 0 HG2 ARG A 528 -39.933 -5.860 -20.860 1.00 0.00 H new ATOM 0 HG3 ARG A 528 -39.576 -4.147 -20.775 1.00 0.00 H new ATOM 0 HD2 ARG A 528 -40.428 -4.078 -23.272 1.00 0.00 H new ATOM 0 HD3 ARG A 528 -41.141 -5.638 -22.913 1.00 0.00 H new ATOM 0 HE ARG A 528 -42.047 -3.027 -22.007 1.00 0.00 H new ATOM 0 HH11 ARG A 528 -42.163 -6.446 -21.065 1.00 0.00 H new ATOM 0 HH12 ARG A 528 -43.664 -6.203 -20.166 1.00 0.00 H new ATOM 0 HH21 ARG A 528 -43.935 -2.841 -20.896 1.00 0.00 H new ATOM 0 HH22 ARG A 528 -44.627 -4.243 -20.074 1.00 0.00 H new ATOM 1377 N THR A 529 -35.340 -5.143 -22.784 1.00 0.00 N ATOM 1378 CA THR A 529 -34.268 -5.246 -23.807 1.00 0.00 C ATOM 1379 C THR A 529 -33.057 -4.329 -23.558 1.00 0.00 C ATOM 1380 O THR A 529 -32.004 -4.492 -24.180 1.00 0.00 O ATOM 1381 CB THR A 529 -34.809 -4.886 -25.210 1.00 0.00 C ATOM 1382 OG1 THR A 529 -35.572 -3.693 -25.198 1.00 0.00 O ATOM 1383 CG2 THR A 529 -35.696 -5.996 -25.778 1.00 0.00 C ATOM 0 H THR A 529 -35.484 -4.185 -22.465 1.00 0.00 H new ATOM 0 HA THR A 529 -33.939 -6.283 -23.741 1.00 0.00 H new ATOM 0 HB THR A 529 -33.926 -4.753 -25.836 1.00 0.00 H new ATOM 0 HG1 THR A 529 -34.993 -2.937 -24.967 1.00 0.00 H new ATOM 0 HG21 THR A 529 -36.056 -5.705 -26.765 1.00 0.00 H new ATOM 0 HG22 THR A 529 -35.119 -6.917 -25.860 1.00 0.00 H new ATOM 0 HG23 THR A 529 -36.546 -6.158 -25.115 1.00 0.00 H new ATOM 1391 N ASP A 530 -33.194 -3.373 -22.633 1.00 0.00 N ATOM 1392 CA ASP A 530 -32.261 -2.266 -22.366 1.00 0.00 C ATOM 1393 C ASP A 530 -31.812 -2.240 -20.897 1.00 0.00 C ATOM 1394 O ASP A 530 -32.310 -2.994 -20.062 1.00 0.00 O ATOM 1395 CB ASP A 530 -32.928 -0.940 -22.790 1.00 0.00 C ATOM 1396 CG ASP A 530 -33.143 -0.806 -24.316 1.00 0.00 C ATOM 1397 OD1 ASP A 530 -34.011 -1.521 -24.875 1.00 0.00 O ATOM 1398 OD2 ASP A 530 -32.448 0.025 -24.949 1.00 0.00 O ATOM 0 H ASP A 530 -34.004 -3.347 -22.014 1.00 0.00 H new ATOM 0 HA ASP A 530 -31.354 -2.411 -22.953 1.00 0.00 H new ATOM 0 HB2 ASP A 530 -33.892 -0.853 -22.288 1.00 0.00 H new ATOM 0 HB3 ASP A 530 -32.313 -0.109 -22.445 1.00 0.00 H new ATOM 1403 N THR A 531 -30.824 -1.411 -20.583 1.00 0.00 N ATOM 1404 CA THR A 531 -30.173 -1.356 -19.263 1.00 0.00 C ATOM 1405 C THR A 531 -30.292 0.042 -18.653 1.00 0.00 C ATOM 1406 O THR A 531 -29.595 0.959 -19.095 1.00 0.00 O ATOM 1407 CB THR A 531 -28.692 -1.795 -19.338 1.00 0.00 C ATOM 1408 OG1 THR A 531 -28.497 -2.863 -20.245 1.00 0.00 O ATOM 1409 CG2 THR A 531 -28.170 -2.267 -17.981 1.00 0.00 C ATOM 0 H THR A 531 -30.439 -0.740 -21.248 1.00 0.00 H new ATOM 0 HA THR A 531 -30.693 -2.060 -18.614 1.00 0.00 H new ATOM 0 HB THR A 531 -28.150 -0.911 -19.673 1.00 0.00 H new ATOM 0 HG1 THR A 531 -27.548 -3.108 -20.263 1.00 0.00 H new ATOM 0 HG21 THR A 531 -27.126 -2.567 -18.077 1.00 0.00 H new ATOM 0 HG22 THR A 531 -28.250 -1.455 -17.258 1.00 0.00 H new ATOM 0 HG23 THR A 531 -28.761 -3.116 -17.639 1.00 0.00 H new ATOM 1417 N TYR A 532 -31.171 0.219 -17.659 1.00 0.00 N ATOM 1418 CA TYR A 532 -31.259 1.462 -16.874 1.00 0.00 C ATOM 1419 C TYR A 532 -30.519 1.319 -15.535 1.00 0.00 C ATOM 1420 O TYR A 532 -30.533 0.266 -14.905 1.00 0.00 O ATOM 1421 CB TYR A 532 -32.716 1.898 -16.634 1.00 0.00 C ATOM 1422 CG TYR A 532 -33.487 2.340 -17.869 1.00 0.00 C ATOM 1423 CD1 TYR A 532 -33.862 1.412 -18.863 1.00 0.00 C ATOM 1424 CD2 TYR A 532 -33.872 3.689 -18.006 1.00 0.00 C ATOM 1425 CE1 TYR A 532 -34.603 1.834 -19.983 1.00 0.00 C ATOM 1426 CE2 TYR A 532 -34.633 4.102 -19.114 1.00 0.00 C ATOM 1427 CZ TYR A 532 -35.002 3.175 -20.101 1.00 0.00 C ATOM 1428 OH TYR A 532 -35.731 3.583 -21.175 1.00 0.00 O ATOM 0 H TYR A 532 -31.842 -0.494 -17.374 1.00 0.00 H new ATOM 0 HA TYR A 532 -30.776 2.242 -17.463 1.00 0.00 H new ATOM 0 HB2 TYR A 532 -33.252 1.069 -16.172 1.00 0.00 H new ATOM 0 HB3 TYR A 532 -32.716 2.718 -15.916 1.00 0.00 H new ATOM 0 HD1 TYR A 532 -33.580 0.374 -18.764 1.00 0.00 H new ATOM 0 HD2 TYR A 532 -33.581 4.409 -17.256 1.00 0.00 H new ATOM 0 HE1 TYR A 532 -34.865 1.124 -20.754 1.00 0.00 H new ATOM 0 HE2 TYR A 532 -34.934 5.135 -19.206 1.00 0.00 H new ATOM 0 HH TYR A 532 -35.922 4.541 -21.096 1.00 0.00 H new ATOM 1438 N VAL A 533 -29.903 2.391 -15.056 1.00 0.00 N ATOM 1439 CA VAL A 533 -29.143 2.412 -13.793 1.00 0.00 C ATOM 1440 C VAL A 533 -29.841 3.348 -12.807 1.00 0.00 C ATOM 1441 O VAL A 533 -30.373 4.374 -13.234 1.00 0.00 O ATOM 1442 CB VAL A 533 -27.675 2.847 -14.017 1.00 0.00 C ATOM 1443 CG1 VAL A 533 -26.809 2.322 -12.870 1.00 0.00 C ATOM 1444 CG2 VAL A 533 -27.067 2.308 -15.322 1.00 0.00 C ATOM 0 H VAL A 533 -29.912 3.291 -15.535 1.00 0.00 H new ATOM 0 HA VAL A 533 -29.116 1.402 -13.384 1.00 0.00 H new ATOM 0 HB VAL A 533 -27.689 3.936 -14.068 1.00 0.00 H new ATOM 0 HG11 VAL A 533 -25.774 2.627 -13.026 1.00 0.00 H new ATOM 0 HG12 VAL A 533 -27.169 2.730 -11.926 1.00 0.00 H new ATOM 0 HG13 VAL A 533 -26.865 1.234 -12.840 1.00 0.00 H new ATOM 0 HG21 VAL A 533 -26.037 2.653 -15.413 1.00 0.00 H new ATOM 0 HG22 VAL A 533 -27.085 1.218 -15.309 1.00 0.00 H new ATOM 0 HG23 VAL A 533 -27.647 2.671 -16.171 1.00 0.00 H new ATOM 1454 N LYS A 534 -29.836 3.022 -11.512 1.00 0.00 N ATOM 1455 CA LYS A 534 -30.436 3.854 -10.458 1.00 0.00 C ATOM 1456 C LYS A 534 -29.392 4.227 -9.391 1.00 0.00 C ATOM 1457 O LYS A 534 -28.716 3.353 -8.841 1.00 0.00 O ATOM 1458 CB LYS A 534 -31.634 3.118 -9.828 1.00 0.00 C ATOM 1459 CG LYS A 534 -32.678 4.117 -9.296 1.00 0.00 C ATOM 1460 CD LYS A 534 -33.649 3.531 -8.260 1.00 0.00 C ATOM 1461 CE LYS A 534 -33.055 3.581 -6.845 1.00 0.00 C ATOM 1462 NZ LYS A 534 -34.034 3.153 -5.823 1.00 0.00 N ATOM 0 H LYS A 534 -29.411 2.164 -11.159 1.00 0.00 H new ATOM 0 HA LYS A 534 -30.794 4.782 -10.905 1.00 0.00 H new ATOM 0 HB2 LYS A 534 -32.095 2.465 -10.569 1.00 0.00 H new ATOM 0 HB3 LYS A 534 -31.287 2.481 -9.014 1.00 0.00 H new ATOM 0 HG2 LYS A 534 -32.157 4.964 -8.849 1.00 0.00 H new ATOM 0 HG3 LYS A 534 -33.254 4.504 -10.137 1.00 0.00 H new ATOM 0 HD2 LYS A 534 -34.586 4.087 -8.283 1.00 0.00 H new ATOM 0 HD3 LYS A 534 -33.884 2.499 -8.522 1.00 0.00 H new ATOM 0 HE2 LYS A 534 -32.175 2.939 -6.797 1.00 0.00 H new ATOM 0 HE3 LYS A 534 -32.721 4.595 -6.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 534 -33.596 3.200 -4.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 534 -34.862 3.781 -5.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 534 -34.333 2.176 -6.017 1.00 0.00 H new ATOM 1476 N LEU A 535 -29.265 5.530 -9.122 1.00 0.00 N ATOM 1477 CA LEU A 535 -28.288 6.139 -8.216 1.00 0.00 C ATOM 1478 C LEU A 535 -28.959 7.189 -7.303 1.00 0.00 C ATOM 1479 O LEU A 535 -29.722 8.022 -7.803 1.00 0.00 O ATOM 1480 CB LEU A 535 -27.191 6.732 -9.125 1.00 0.00 C ATOM 1481 CG LEU A 535 -25.860 7.160 -8.490 1.00 0.00 C ATOM 1482 CD1 LEU A 535 -25.889 8.597 -7.978 1.00 0.00 C ATOM 1483 CD2 LEU A 535 -25.405 6.222 -7.381 1.00 0.00 C ATOM 0 H LEU A 535 -29.874 6.225 -9.554 1.00 0.00 H new ATOM 0 HA LEU A 535 -27.852 5.415 -7.528 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -26.967 5.996 -9.897 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -27.613 7.603 -9.627 1.00 0.00 H new ATOM 0 HG LEU A 535 -25.131 7.102 -9.298 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -24.923 8.847 -7.539 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -26.097 9.274 -8.806 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -26.668 8.698 -7.222 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -24.459 6.576 -6.971 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -26.157 6.199 -6.592 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -25.273 5.218 -7.785 1.00 0.00 H new ATOM 1495 N ASP A 536 -28.688 7.194 -5.988 1.00 0.00 N ATOM 1496 CA ASP A 536 -29.223 8.224 -5.081 1.00 0.00 C ATOM 1497 C ASP A 536 -28.339 9.473 -5.100 1.00 0.00 C ATOM 1498 O ASP A 536 -27.272 9.520 -4.486 1.00 0.00 O ATOM 1499 CB ASP A 536 -29.364 7.674 -3.648 1.00 0.00 C ATOM 1500 CG ASP A 536 -30.568 6.725 -3.481 1.00 0.00 C ATOM 1501 OD1 ASP A 536 -31.706 7.229 -3.311 1.00 0.00 O ATOM 1502 OD2 ASP A 536 -30.381 5.485 -3.502 1.00 0.00 O ATOM 0 H ASP A 536 -28.102 6.497 -5.529 1.00 0.00 H new ATOM 0 HA ASP A 536 -30.216 8.504 -5.433 1.00 0.00 H new ATOM 0 HB2 ASP A 536 -28.451 7.144 -3.377 1.00 0.00 H new ATOM 0 HB3 ASP A 536 -29.467 8.508 -2.953 1.00 0.00 H new ATOM 1507 N LYS A 537 -28.848 10.522 -5.739 1.00 0.00 N ATOM 1508 CA LYS A 537 -28.266 11.871 -5.772 1.00 0.00 C ATOM 1509 C LYS A 537 -28.399 12.642 -4.439 1.00 0.00 C ATOM 1510 O LYS A 537 -27.781 13.693 -4.263 1.00 0.00 O ATOM 1511 CB LYS A 537 -28.908 12.668 -6.928 1.00 0.00 C ATOM 1512 CG LYS A 537 -30.454 12.683 -6.934 1.00 0.00 C ATOM 1513 CD LYS A 537 -31.071 14.089 -6.980 1.00 0.00 C ATOM 1514 CE LYS A 537 -30.915 14.809 -5.633 1.00 0.00 C ATOM 1515 NZ LYS A 537 -31.656 16.086 -5.602 1.00 0.00 N ATOM 0 H LYS A 537 -29.715 10.458 -6.273 1.00 0.00 H new ATOM 0 HA LYS A 537 -27.194 11.755 -5.934 1.00 0.00 H new ATOM 0 HB2 LYS A 537 -28.550 13.697 -6.882 1.00 0.00 H new ATOM 0 HB3 LYS A 537 -28.560 12.251 -7.873 1.00 0.00 H new ATOM 0 HG2 LYS A 537 -30.808 12.115 -7.794 1.00 0.00 H new ATOM 0 HG3 LYS A 537 -30.814 12.169 -6.043 1.00 0.00 H new ATOM 0 HD2 LYS A 537 -30.592 14.674 -7.765 1.00 0.00 H new ATOM 0 HD3 LYS A 537 -32.128 14.017 -7.236 1.00 0.00 H new ATOM 0 HE2 LYS A 537 -31.273 14.162 -4.832 1.00 0.00 H new ATOM 0 HE3 LYS A 537 -29.858 14.998 -5.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 537 -31.525 16.541 -4.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 537 -31.298 16.714 -6.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 537 -32.668 15.904 -5.758 1.00 0.00 H new ATOM 1529 N ALA A 538 -29.213 12.136 -3.505 1.00 0.00 N ATOM 1530 CA ALA A 538 -29.484 12.752 -2.202 1.00 0.00 C ATOM 1531 C ALA A 538 -28.448 12.396 -1.110 1.00 0.00 C ATOM 1532 O ALA A 538 -28.473 12.959 -0.012 1.00 0.00 O ATOM 1533 CB ALA A 538 -30.897 12.342 -1.771 1.00 0.00 C ATOM 0 H ALA A 538 -29.717 11.259 -3.640 1.00 0.00 H new ATOM 0 HA ALA A 538 -29.405 13.833 -2.318 1.00 0.00 H new ATOM 0 HB1 ALA A 538 -31.126 12.787 -0.803 1.00 0.00 H new ATOM 0 HB2 ALA A 538 -31.618 12.691 -2.510 1.00 0.00 H new ATOM 0 HB3 ALA A 538 -30.953 11.256 -1.693 1.00 0.00 H new ATOM 1539 N VAL A 539 -27.541 11.457 -1.398 1.00 0.00 N ATOM 1540 CA VAL A 539 -26.429 11.054 -0.536 1.00 0.00 C ATOM 1541 C VAL A 539 -25.400 12.178 -0.308 1.00 0.00 C ATOM 1542 O VAL A 539 -25.263 13.095 -1.127 1.00 0.00 O ATOM 1543 CB VAL A 539 -25.752 9.831 -1.173 1.00 0.00 C ATOM 1544 CG1 VAL A 539 -24.855 10.258 -2.341 1.00 0.00 C ATOM 1545 CG2 VAL A 539 -24.988 9.001 -0.141 1.00 0.00 C ATOM 0 H VAL A 539 -27.564 10.936 -2.275 1.00 0.00 H new ATOM 0 HA VAL A 539 -26.830 10.814 0.449 1.00 0.00 H new ATOM 0 HB VAL A 539 -26.534 9.185 -1.571 1.00 0.00 H new ATOM 0 HG11 VAL A 539 -24.384 9.378 -2.779 1.00 0.00 H new ATOM 0 HG12 VAL A 539 -25.457 10.762 -3.097 1.00 0.00 H new ATOM 0 HG13 VAL A 539 -24.085 10.939 -1.978 1.00 0.00 H new ATOM 0 HG21 VAL A 539 -24.524 8.146 -0.633 1.00 0.00 H new ATOM 0 HG22 VAL A 539 -24.216 9.616 0.321 1.00 0.00 H new ATOM 0 HG23 VAL A 539 -25.678 8.648 0.625 1.00 0.00 H new ATOM 1555 N ASP A 540 -24.662 12.117 0.804 1.00 0.00 N ATOM 1556 CA ASP A 540 -23.494 12.979 1.045 1.00 0.00 C ATOM 1557 C ASP A 540 -22.241 12.360 0.414 1.00 0.00 C ATOM 1558 O ASP A 540 -21.848 11.262 0.811 1.00 0.00 O ATOM 1559 CB ASP A 540 -23.285 13.187 2.556 1.00 0.00 C ATOM 1560 CG ASP A 540 -24.382 14.050 3.212 1.00 0.00 C ATOM 1561 OD1 ASP A 540 -24.377 15.289 3.007 1.00 0.00 O ATOM 1562 OD2 ASP A 540 -25.233 13.495 3.949 1.00 0.00 O ATOM 0 H ASP A 540 -24.856 11.468 1.566 1.00 0.00 H new ATOM 0 HA ASP A 540 -23.675 13.950 0.583 1.00 0.00 H new ATOM 0 HB2 ASP A 540 -23.255 12.215 3.048 1.00 0.00 H new ATOM 0 HB3 ASP A 540 -22.316 13.658 2.720 1.00 0.00 H new ATOM 1567 N LEU A 541 -21.602 13.052 -0.540 1.00 0.00 N ATOM 1568 CA LEU A 541 -20.410 12.568 -1.264 1.00 0.00 C ATOM 1569 C LEU A 541 -19.339 12.030 -0.303 1.00 0.00 C ATOM 1570 O LEU A 541 -18.844 10.914 -0.466 1.00 0.00 O ATOM 1571 CB LEU A 541 -19.864 13.693 -2.167 1.00 0.00 C ATOM 1572 CG LEU A 541 -18.625 13.377 -3.041 1.00 0.00 C ATOM 1573 CD1 LEU A 541 -17.300 13.641 -2.325 1.00 0.00 C ATOM 1574 CD2 LEU A 541 -18.615 11.978 -3.656 1.00 0.00 C ATOM 0 H LEU A 541 -21.902 13.980 -0.838 1.00 0.00 H new ATOM 0 HA LEU A 541 -20.700 11.728 -1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 541 -20.669 14.012 -2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 541 -19.618 14.544 -1.531 1.00 0.00 H new ATOM 0 HG LEU A 541 -18.721 14.083 -3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 541 -16.472 13.400 -2.991 1.00 0.00 H new ATOM 0 HD12 LEU A 541 -17.243 14.692 -2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 541 -17.239 13.020 -1.431 1.00 0.00 H new ATOM 0 HD21 LEU A 541 -17.710 11.848 -4.250 1.00 0.00 H new ATOM 0 HD22 LEU A 541 -18.638 11.231 -2.862 1.00 0.00 H new ATOM 0 HD23 LEU A 541 -19.490 11.855 -4.295 1.00 0.00 H new ATOM 1586 N ALA A 542 -19.046 12.799 0.747 1.00 0.00 N ATOM 1587 CA ALA A 542 -18.076 12.456 1.786 1.00 0.00 C ATOM 1588 C ALA A 542 -18.328 11.094 2.478 1.00 0.00 C ATOM 1589 O ALA A 542 -17.394 10.501 3.023 1.00 0.00 O ATOM 1590 CB ALA A 542 -18.039 13.605 2.799 1.00 0.00 C ATOM 0 H ALA A 542 -19.491 13.704 0.902 1.00 0.00 H new ATOM 0 HA ALA A 542 -17.106 12.329 1.305 1.00 0.00 H new ATOM 0 HB1 ALA A 542 -17.321 13.373 3.586 1.00 0.00 H new ATOM 0 HB2 ALA A 542 -17.741 14.525 2.295 1.00 0.00 H new ATOM 0 HB3 ALA A 542 -19.028 13.736 3.237 1.00 0.00 H new ATOM 1596 N GLY A 543 -19.559 10.566 2.432 1.00 0.00 N ATOM 1597 CA GLY A 543 -19.891 9.219 2.914 1.00 0.00 C ATOM 1598 C GLY A 543 -19.452 8.095 1.965 1.00 0.00 C ATOM 1599 O GLY A 543 -18.816 7.135 2.406 1.00 0.00 O ATOM 0 H GLY A 543 -20.362 11.069 2.054 1.00 0.00 H new ATOM 0 HA2 GLY A 543 -19.422 9.065 3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 543 -20.968 9.153 3.066 1.00 0.00 H new ATOM 1603 N LEU A 544 -19.717 8.212 0.657 1.00 0.00 N ATOM 1604 CA LEU A 544 -19.301 7.214 -0.343 1.00 0.00 C ATOM 1605 C LEU A 544 -17.780 7.077 -0.402 1.00 0.00 C ATOM 1606 O LEU A 544 -17.260 5.993 -0.182 1.00 0.00 O ATOM 1607 CB LEU A 544 -19.768 7.543 -1.768 1.00 0.00 C ATOM 1608 CG LEU A 544 -21.264 7.730 -2.019 1.00 0.00 C ATOM 1609 CD1 LEU A 544 -22.163 6.603 -1.523 1.00 0.00 C ATOM 1610 CD2 LEU A 544 -21.729 9.011 -1.368 1.00 0.00 C ATOM 0 H LEU A 544 -20.226 9.001 0.260 1.00 0.00 H new ATOM 0 HA LEU A 544 -19.772 6.289 -0.011 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -19.263 8.457 -2.080 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -19.419 6.746 -2.424 1.00 0.00 H new ATOM 0 HG LEU A 544 -21.360 7.746 -3.105 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -23.202 6.839 -1.753 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -21.885 5.672 -2.016 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -22.046 6.492 -0.445 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -22.796 9.144 -1.547 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -21.545 8.961 -0.295 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -21.182 9.854 -1.791 1.00 0.00 H new ATOM 1622 N THR A 545 -17.048 8.162 -0.648 1.00 0.00 N ATOM 1623 CA THR A 545 -15.572 8.116 -0.725 1.00 0.00 C ATOM 1624 C THR A 545 -14.926 7.585 0.569 1.00 0.00 C ATOM 1625 O THR A 545 -13.851 6.987 0.516 1.00 0.00 O ATOM 1626 CB THR A 545 -14.966 9.467 -1.172 1.00 0.00 C ATOM 1627 OG1 THR A 545 -13.585 9.585 -0.915 1.00 0.00 O ATOM 1628 CG2 THR A 545 -15.668 10.674 -0.559 1.00 0.00 C ATOM 0 H THR A 545 -17.445 9.089 -0.799 1.00 0.00 H new ATOM 0 HA THR A 545 -15.330 7.393 -1.504 1.00 0.00 H new ATOM 0 HB THR A 545 -15.123 9.465 -2.251 1.00 0.00 H new ATOM 0 HG1 THR A 545 -13.268 10.460 -1.223 1.00 0.00 H new ATOM 0 HG21 THR A 545 -15.194 11.589 -0.913 1.00 0.00 H new ATOM 0 HG22 THR A 545 -16.718 10.672 -0.852 1.00 0.00 H new ATOM 0 HG23 THR A 545 -15.595 10.625 0.527 1.00 0.00 H new ATOM 1636 N ALA A 546 -15.606 7.665 1.720 1.00 0.00 N ATOM 1637 CA ALA A 546 -15.147 6.992 2.945 1.00 0.00 C ATOM 1638 C ALA A 546 -15.303 5.450 2.908 1.00 0.00 C ATOM 1639 O ALA A 546 -14.381 4.722 3.285 1.00 0.00 O ATOM 1640 CB ALA A 546 -15.875 7.589 4.155 1.00 0.00 C ATOM 0 H ALA A 546 -16.475 8.188 1.830 1.00 0.00 H new ATOM 0 HA ALA A 546 -14.075 7.171 3.026 1.00 0.00 H new ATOM 0 HB1 ALA A 546 -15.537 7.092 5.064 1.00 0.00 H new ATOM 0 HB2 ALA A 546 -15.657 8.655 4.221 1.00 0.00 H new ATOM 0 HB3 ALA A 546 -16.949 7.445 4.041 1.00 0.00 H new ATOM 1646 N ARG A 547 -16.456 4.939 2.462 1.00 0.00 N ATOM 1647 CA ARG A 547 -16.771 3.498 2.412 1.00 0.00 C ATOM 1648 C ARG A 547 -16.309 2.754 1.133 1.00 0.00 C ATOM 1649 O ARG A 547 -15.798 1.634 1.215 1.00 0.00 O ATOM 1650 CB ARG A 547 -18.265 3.302 2.720 1.00 0.00 C ATOM 1651 CG ARG A 547 -19.242 3.826 1.654 1.00 0.00 C ATOM 1652 CD ARG A 547 -20.613 4.107 2.284 1.00 0.00 C ATOM 1653 NE ARG A 547 -21.707 4.077 1.299 1.00 0.00 N ATOM 1654 CZ ARG A 547 -22.998 3.993 1.584 1.00 0.00 C ATOM 1655 NH1 ARG A 547 -23.453 4.039 2.807 1.00 0.00 N ATOM 1656 NH2 ARG A 547 -23.875 3.847 0.632 1.00 0.00 N ATOM 0 H ARG A 547 -17.216 5.525 2.117 1.00 0.00 H new ATOM 0 HA ARG A 547 -16.170 3.016 3.184 1.00 0.00 H new ATOM 0 HB2 ARG A 547 -18.450 2.238 2.864 1.00 0.00 H new ATOM 0 HB3 ARG A 547 -18.490 3.795 3.666 1.00 0.00 H new ATOM 0 HG2 ARG A 547 -18.847 4.737 1.204 1.00 0.00 H new ATOM 0 HG3 ARG A 547 -19.345 3.094 0.853 1.00 0.00 H new ATOM 0 HD2 ARG A 547 -20.809 3.369 3.062 1.00 0.00 H new ATOM 0 HD3 ARG A 547 -20.593 5.083 2.769 1.00 0.00 H new ATOM 0 HE ARG A 547 -21.449 4.125 0.313 1.00 0.00 H new ATOM 0 HH11 ARG A 547 -22.806 4.143 3.588 1.00 0.00 H new ATOM 0 HH12 ARG A 547 -24.456 3.971 2.981 1.00 0.00 H new ATOM 0 HH21 ARG A 547 -23.569 3.797 -0.340 1.00 0.00 H new ATOM 0 HH22 ARG A 547 -24.868 3.783 0.858 1.00 0.00 H new ATOM 1670 N LEU A 548 -16.416 3.375 -0.047 1.00 0.00 N ATOM 1671 CA LEU A 548 -15.886 2.869 -1.331 1.00 0.00 C ATOM 1672 C LEU A 548 -14.341 2.781 -1.326 1.00 0.00 C ATOM 1673 O LEU A 548 -13.763 1.913 -1.985 1.00 0.00 O ATOM 1674 CB LEU A 548 -16.516 3.702 -2.484 1.00 0.00 C ATOM 1675 CG LEU A 548 -15.793 3.898 -3.831 1.00 0.00 C ATOM 1676 CD1 LEU A 548 -14.614 4.872 -3.765 1.00 0.00 C ATOM 1677 CD2 LEU A 548 -15.419 2.580 -4.497 1.00 0.00 C ATOM 0 H LEU A 548 -16.888 4.274 -0.144 1.00 0.00 H new ATOM 0 HA LEU A 548 -16.182 1.833 -1.496 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -17.483 3.251 -2.707 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -16.713 4.697 -2.084 1.00 0.00 H new ATOM 0 HG LEU A 548 -16.529 4.377 -4.477 1.00 0.00 H new ATOM 0 HD11 LEU A 548 -14.157 4.957 -4.751 1.00 0.00 H new ATOM 0 HD12 LEU A 548 -14.969 5.851 -3.444 1.00 0.00 H new ATOM 0 HD13 LEU A 548 -13.876 4.502 -3.053 1.00 0.00 H new ATOM 0 HD21 LEU A 548 -14.913 2.780 -5.441 1.00 0.00 H new ATOM 0 HD22 LEU A 548 -14.755 2.017 -3.842 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -16.322 1.999 -4.685 1.00 0.00 H new ATOM 1689 N ALA A 549 -13.657 3.601 -0.514 1.00 0.00 N ATOM 1690 CA ALA A 549 -12.199 3.556 -0.347 1.00 0.00 C ATOM 1691 C ALA A 549 -11.623 2.168 0.008 1.00 0.00 C ATOM 1692 O ALA A 549 -10.460 1.897 -0.291 1.00 0.00 O ATOM 1693 CB ALA A 549 -11.723 4.609 0.655 1.00 0.00 C ATOM 0 H ALA A 549 -14.107 4.321 0.051 1.00 0.00 H new ATOM 0 HA ALA A 549 -11.803 3.787 -1.336 1.00 0.00 H new ATOM 0 HB1 ALA A 549 -10.639 4.551 0.757 1.00 0.00 H new ATOM 0 HB2 ALA A 549 -12.001 5.601 0.300 1.00 0.00 H new ATOM 0 HB3 ALA A 549 -12.189 4.427 1.623 1.00 0.00 H new ATOM 1699 N HIS A 550 -12.416 1.265 0.592 1.00 0.00 N ATOM 1700 CA HIS A 550 -12.039 -0.142 0.789 1.00 0.00 C ATOM 1701 C HIS A 550 -11.463 -0.817 -0.482 1.00 0.00 C ATOM 1702 O HIS A 550 -10.566 -1.657 -0.373 1.00 0.00 O ATOM 1703 CB HIS A 550 -13.252 -0.927 1.316 1.00 0.00 C ATOM 1704 CG HIS A 550 -13.523 -0.749 2.792 1.00 0.00 C ATOM 1705 ND1 HIS A 550 -13.559 -1.791 3.727 1.00 0.00 N ATOM 1706 CD2 HIS A 550 -13.779 0.427 3.438 1.00 0.00 C ATOM 1707 CE1 HIS A 550 -13.838 -1.215 4.910 1.00 0.00 C ATOM 1708 NE2 HIS A 550 -13.975 0.113 4.766 1.00 0.00 N ATOM 0 H HIS A 550 -13.346 1.490 0.945 1.00 0.00 H new ATOM 0 HA HIS A 550 -11.232 -0.156 1.521 1.00 0.00 H new ATOM 0 HB2 HIS A 550 -14.137 -0.621 0.758 1.00 0.00 H new ATOM 0 HB3 HIS A 550 -13.098 -1.987 1.113 1.00 0.00 H new ATOM 0 HD2 HIS A 550 -13.820 1.411 2.995 1.00 0.00 H new ATOM 0 HE1 HIS A 550 -13.938 -1.746 5.845 1.00 0.00 H new ATOM 0 HE2 HIS A 550 -14.188 0.776 5.511 1.00 0.00 H new ATOM 1716 N HIS A 551 -11.932 -0.442 -1.681 1.00 0.00 N ATOM 1717 CA HIS A 551 -11.353 -0.892 -2.956 1.00 0.00 C ATOM 1718 C HIS A 551 -10.114 -0.079 -3.405 1.00 0.00 C ATOM 1719 O HIS A 551 -9.094 -0.658 -3.787 1.00 0.00 O ATOM 1720 CB HIS A 551 -12.447 -0.894 -4.030 1.00 0.00 C ATOM 1721 CG HIS A 551 -12.156 -1.854 -5.155 1.00 0.00 C ATOM 1722 ND1 HIS A 551 -11.764 -1.512 -6.453 1.00 0.00 N ATOM 1723 CD2 HIS A 551 -12.270 -3.212 -5.070 1.00 0.00 C ATOM 1724 CE1 HIS A 551 -11.662 -2.676 -7.119 1.00 0.00 C ATOM 1725 NE2 HIS A 551 -11.957 -3.710 -6.314 1.00 0.00 N ATOM 0 H HIS A 551 -12.728 0.186 -1.794 1.00 0.00 H new ATOM 0 HA HIS A 551 -10.978 -1.904 -2.805 1.00 0.00 H new ATOM 0 HB2 HIS A 551 -13.400 -1.157 -3.571 1.00 0.00 H new ATOM 0 HB3 HIS A 551 -12.555 0.112 -4.435 1.00 0.00 H new ATOM 0 HD2 HIS A 551 -12.551 -3.783 -4.198 1.00 0.00 H new ATOM 0 HE1 HIS A 551 -11.382 -2.767 -8.158 1.00 0.00 H new ATOM 0 HE2 HIS A 551 -11.950 -4.695 -6.579 1.00 0.00 H new ATOM 1733 N VAL A 552 -10.160 1.260 -3.314 1.00 0.00 N ATOM 1734 CA VAL A 552 -9.039 2.160 -3.706 1.00 0.00 C ATOM 1735 C VAL A 552 -7.780 1.964 -2.839 1.00 0.00 C ATOM 1736 O VAL A 552 -6.653 2.207 -3.273 1.00 0.00 O ATOM 1737 CB VAL A 552 -9.445 3.651 -3.775 1.00 0.00 C ATOM 1738 CG1 VAL A 552 -10.875 3.853 -4.312 1.00 0.00 C ATOM 1739 CG2 VAL A 552 -9.277 4.437 -2.470 1.00 0.00 C ATOM 0 H VAL A 552 -10.977 1.761 -2.965 1.00 0.00 H new ATOM 0 HA VAL A 552 -8.782 1.858 -4.721 1.00 0.00 H new ATOM 0 HB VAL A 552 -8.726 4.065 -4.483 1.00 0.00 H new ATOM 0 HG11 VAL A 552 -11.107 4.918 -4.339 1.00 0.00 H new ATOM 0 HG12 VAL A 552 -10.947 3.440 -5.318 1.00 0.00 H new ATOM 0 HG13 VAL A 552 -11.584 3.344 -3.659 1.00 0.00 H new ATOM 0 HG21 VAL A 552 -9.589 5.470 -2.625 1.00 0.00 H new ATOM 0 HG22 VAL A 552 -9.892 3.985 -1.691 1.00 0.00 H new ATOM 0 HG23 VAL A 552 -8.231 4.416 -2.164 1.00 0.00 H new ATOM 1749 N HIS A 553 -7.958 1.442 -1.625 1.00 0.00 N ATOM 1750 CA HIS A 553 -6.902 0.974 -0.718 1.00 0.00 C ATOM 1751 C HIS A 553 -5.885 -0.011 -1.351 1.00 0.00 C ATOM 1752 O HIS A 553 -4.800 -0.201 -0.799 1.00 0.00 O ATOM 1753 CB HIS A 553 -7.508 0.439 0.593 1.00 0.00 C ATOM 1754 CG HIS A 553 -7.556 1.479 1.688 1.00 0.00 C ATOM 1755 ND1 HIS A 553 -6.441 2.140 2.217 1.00 0.00 N ATOM 1756 CD2 HIS A 553 -8.672 1.906 2.350 1.00 0.00 C ATOM 1757 CE1 HIS A 553 -6.915 2.956 3.173 1.00 0.00 C ATOM 1758 NE2 HIS A 553 -8.249 2.838 3.274 1.00 0.00 N ATOM 0 H HIS A 553 -8.889 1.327 -1.225 1.00 0.00 H new ATOM 0 HA HIS A 553 -6.298 1.852 -0.487 1.00 0.00 H new ATOM 0 HB2 HIS A 553 -8.518 0.077 0.399 1.00 0.00 H new ATOM 0 HB3 HIS A 553 -6.923 -0.415 0.935 1.00 0.00 H new ATOM 0 HD2 HIS A 553 -9.687 1.578 2.182 1.00 0.00 H new ATOM 0 HE1 HIS A 553 -6.308 3.615 3.776 1.00 0.00 H new ATOM 0 HE2 HIS A 553 -8.847 3.350 3.923 1.00 0.00 H new ATOM 1766 N ALA A 554 -6.198 -0.623 -2.504 1.00 0.00 N ATOM 1767 CA ALA A 554 -5.246 -1.398 -3.316 1.00 0.00 C ATOM 1768 C ALA A 554 -3.917 -0.645 -3.590 1.00 0.00 C ATOM 1769 O ALA A 554 -2.851 -1.267 -3.655 1.00 0.00 O ATOM 1770 CB ALA A 554 -5.917 -1.780 -4.639 1.00 0.00 C ATOM 0 H ALA A 554 -7.135 -0.593 -2.905 1.00 0.00 H new ATOM 0 HA ALA A 554 -4.979 -2.288 -2.746 1.00 0.00 H new ATOM 0 HB1 ALA A 554 -5.219 -2.355 -5.248 1.00 0.00 H new ATOM 0 HB2 ALA A 554 -6.803 -2.382 -4.437 1.00 0.00 H new ATOM 0 HB3 ALA A 554 -6.206 -0.876 -5.175 1.00 0.00 H new ATOM 1776 N GLU A 555 -3.981 0.688 -3.764 1.00 0.00 N ATOM 1777 CA GLU A 555 -2.811 1.607 -3.818 1.00 0.00 C ATOM 1778 C GLU A 555 -2.681 2.518 -2.587 1.00 0.00 C ATOM 1779 O GLU A 555 -1.575 2.952 -2.268 1.00 0.00 O ATOM 1780 CB GLU A 555 -2.822 2.456 -5.099 1.00 0.00 C ATOM 1781 CG GLU A 555 -1.626 2.213 -6.014 1.00 0.00 C ATOM 1782 CD GLU A 555 -0.330 2.750 -5.417 1.00 0.00 C ATOM 1783 OE1 GLU A 555 -0.133 3.985 -5.436 1.00 0.00 O ATOM 1784 OE2 GLU A 555 0.506 1.930 -4.976 1.00 0.00 O ATOM 0 H GLU A 555 -4.869 1.177 -3.875 1.00 0.00 H new ATOM 0 HA GLU A 555 -1.937 0.956 -3.823 1.00 0.00 H new ATOM 0 HB2 GLU A 555 -3.738 2.249 -5.652 1.00 0.00 H new ATOM 0 HB3 GLU A 555 -2.848 3.510 -4.824 1.00 0.00 H new ATOM 0 HG2 GLU A 555 -1.523 1.144 -6.200 1.00 0.00 H new ATOM 0 HG3 GLU A 555 -1.805 2.689 -6.978 1.00 0.00 H new ATOM 1791 N GLY A 556 -3.780 2.769 -1.867 1.00 0.00 N ATOM 1792 CA GLY A 556 -3.773 3.437 -0.549 1.00 0.00 C ATOM 1793 C GLY A 556 -4.245 4.898 -0.519 1.00 0.00 C ATOM 1794 O GLY A 556 -3.788 5.643 0.353 1.00 0.00 O ATOM 0 H GLY A 556 -4.715 2.512 -2.183 1.00 0.00 H new ATOM 0 HA2 GLY A 556 -4.403 2.861 0.129 1.00 0.00 H new ATOM 0 HA3 GLY A 556 -2.759 3.398 -0.152 1.00 0.00 H new ATOM 1798 N LEU A 557 -5.118 5.287 -1.463 1.00 0.00 N ATOM 1799 CA LEU A 557 -5.745 6.616 -1.674 1.00 0.00 C ATOM 1800 C LEU A 557 -4.909 7.525 -2.605 1.00 0.00 C ATOM 1801 O LEU A 557 -5.504 8.128 -3.526 1.00 0.00 O ATOM 1802 CB LEU A 557 -6.091 7.334 -0.348 1.00 0.00 C ATOM 1803 CG LEU A 557 -7.118 8.475 -0.495 1.00 0.00 C ATOM 1804 CD1 LEU A 557 -8.546 7.940 -0.627 1.00 0.00 C ATOM 1805 CD2 LEU A 557 -7.069 9.387 0.733 1.00 0.00 C ATOM 1806 OXT LEU A 557 -3.679 7.647 -2.407 1.00 0.00 O ATOM 0 H LEU A 557 -5.437 4.622 -2.167 1.00 0.00 H new ATOM 0 HA LEU A 557 -6.689 6.416 -2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 557 -6.479 6.600 0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 557 -5.175 7.738 0.083 1.00 0.00 H new ATOM 0 HG LEU A 557 -6.856 9.025 -1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 557 -9.239 8.775 -0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 557 -8.615 7.302 -1.508 1.00 0.00 H new ATOM 0 HD13 LEU A 557 -8.802 7.362 0.261 1.00 0.00 H new ATOM 0 HD21 LEU A 557 -7.798 10.190 0.620 1.00 0.00 H new ATOM 0 HD22 LEU A 557 -7.303 8.808 1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 557 -6.071 9.814 0.829 1.00 0.00 H new