USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 735 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 501 GLN : amide:sc= 0.6 K(o=0.045,f=-2.4) USER MOD Set 1.2: A 503 HIS : no HD1:sc= -0.554 K(o=0.045,f=-6.2!) USER MOD Set 2.1: A 431 CYS SG : rot 12:sc= -1.71 USER MOD Set 2.2: A 510 MET CE :methyl 160:sc= -0.0731 (180deg=-0.428) USER MOD Single : A 433 TYR OH : rot 27:sc= 0.083 USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 ASN : amide:sc= -0.319 X(o=-0.32,f=-0.81) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 HIS : no HD1:sc= -0.121 K(o=-0.12,f=-2.8) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 452 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 459 SER OG : rot -59:sc= 0.931 USER MOD Single : A 461 TYR OH : rot 150:sc= 0 USER MOD Single : A 464 TYR OH : rot 180:sc= 0 USER MOD Single : A 467 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 469 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0207) USER MOD Single : A 471 THR OG1 : rot 150:sc= -1.5 USER MOD Single : A 480 ASN :FLIP amide:sc= -0.297 F(o=-2,f=-0.3) USER MOD Single : A 484 TYR OH : rot 180:sc= 0 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 489 CYS SG : rot -35:sc= 0.0229 USER MOD Single : A 491 HIS : no HD1:sc= -1.16 K(o=-1.2,f=-3.4) USER MOD Single : A 492 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 493 GLN : amide:sc= 0.0988 X(o=0.099,f=-0.17) USER MOD Single : A 494 TYR OH : rot 180:sc= 0 USER MOD Single : A 495 MET CE :methyl 140:sc= -3.46! (180deg=-5.33!) USER MOD Single : A 497 ASN : amide:sc= -0.0571 K(o=-0.057,f=-0.57) USER MOD Single : A 506 THR OG1 : rot 180:sc= 0.0171 USER MOD Single : A 507 LYS NZ :NH3+ 179:sc= 0.503 (180deg=0.502) USER MOD Single : A 508 LYS NZ :NH3+ -164:sc=-0.00898 (180deg=-0.19) USER MOD Single : A 513 LYS NZ :NH3+ -138:sc= -0.0875 (180deg=-0.843) USER MOD Single : A 516 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 332 N GLY A 429 -4.634 -14.442 -1.167 1.00 0.00 N ATOM 333 CA GLY A 429 -4.289 -13.863 0.118 1.00 0.00 C ATOM 334 C GLY A 429 -5.057 -12.588 0.404 1.00 0.00 C ATOM 335 O GLY A 429 -6.048 -12.289 -0.263 1.00 0.00 O ATOM 0 HA2 GLY A 429 -4.490 -14.589 0.906 1.00 0.00 H new ATOM 0 HA3 GLY A 429 -3.220 -13.653 0.143 1.00 0.00 H new ATOM 339 N PHE A 430 -4.601 -11.835 1.400 1.00 0.00 N ATOM 340 CA PHE A 430 -5.254 -10.587 1.775 1.00 0.00 C ATOM 341 C PHE A 430 -4.235 -9.459 1.910 1.00 0.00 C ATOM 342 O PHE A 430 -3.549 -9.347 2.927 1.00 0.00 O ATOM 343 CB PHE A 430 -6.017 -10.760 3.090 1.00 0.00 C ATOM 344 CG PHE A 430 -7.028 -11.871 3.055 1.00 0.00 C ATOM 345 CD1 PHE A 430 -8.060 -11.857 2.130 1.00 0.00 C ATOM 346 CD2 PHE A 430 -6.945 -12.929 3.945 1.00 0.00 C ATOM 347 CE1 PHE A 430 -8.991 -12.877 2.096 1.00 0.00 C ATOM 348 CE2 PHE A 430 -7.873 -13.953 3.916 1.00 0.00 C ATOM 349 CZ PHE A 430 -8.897 -13.927 2.989 1.00 0.00 C ATOM 0 H PHE A 430 -3.782 -12.068 1.962 1.00 0.00 H new ATOM 0 HA PHE A 430 -5.959 -10.324 0.986 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -5.304 -10.953 3.892 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -6.524 -9.826 3.332 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -8.137 -11.040 1.428 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -6.145 -12.954 4.671 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -9.792 -12.854 1.372 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -7.798 -14.772 4.616 1.00 0.00 H new ATOM 0 HZ PHE A 430 -9.623 -14.726 2.962 1.00 0.00 H new ATOM 359 N CYS A 431 -4.142 -8.627 0.879 1.00 0.00 N ATOM 360 CA CYS A 431 -3.206 -7.509 0.881 1.00 0.00 C ATOM 361 C CYS A 431 -3.915 -6.205 0.529 1.00 0.00 C ATOM 362 O CYS A 431 -4.992 -6.213 -0.067 1.00 0.00 O ATOM 363 CB CYS A 431 -2.068 -7.767 -0.108 1.00 0.00 C ATOM 364 SG CYS A 431 -0.859 -8.985 0.460 1.00 0.00 S ATOM 0 H CYS A 431 -4.703 -8.706 0.031 1.00 0.00 H new ATOM 0 HA CYS A 431 -2.792 -7.417 1.885 1.00 0.00 H new ATOM 0 HB2 CYS A 431 -2.492 -8.105 -1.053 1.00 0.00 H new ATOM 0 HB3 CYS A 431 -1.554 -6.827 -0.308 1.00 0.00 H new ATOM 0 HG CYS A 431 -1.320 -9.597 1.510 1.00 0.00 H new ATOM 370 N VAL A 432 -3.305 -5.085 0.905 1.00 0.00 N ATOM 371 CA VAL A 432 -3.879 -3.773 0.630 1.00 0.00 C ATOM 372 C VAL A 432 -2.845 -2.842 0.006 1.00 0.00 C ATOM 373 O VAL A 432 -1.692 -2.800 0.436 1.00 0.00 O ATOM 374 CB VAL A 432 -4.432 -3.123 1.912 1.00 0.00 C ATOM 375 CG1 VAL A 432 -5.772 -3.739 2.287 1.00 0.00 C ATOM 376 CG2 VAL A 432 -3.435 -3.260 3.052 1.00 0.00 C ATOM 0 H VAL A 432 -2.414 -5.060 1.401 1.00 0.00 H new ATOM 0 HA VAL A 432 -4.698 -3.926 -0.073 1.00 0.00 H new ATOM 0 HB VAL A 432 -4.587 -2.061 1.722 1.00 0.00 H new ATOM 0 HG11 VAL A 432 -6.148 -3.268 3.195 1.00 0.00 H new ATOM 0 HG12 VAL A 432 -6.484 -3.583 1.476 1.00 0.00 H new ATOM 0 HG13 VAL A 432 -5.646 -4.808 2.459 1.00 0.00 H new ATOM 0 HG21 VAL A 432 -3.843 -2.795 3.950 1.00 0.00 H new ATOM 0 HG22 VAL A 432 -3.245 -4.316 3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 432 -2.501 -2.767 2.780 1.00 0.00 H new ATOM 386 N TYR A 433 -3.266 -2.096 -1.009 1.00 0.00 N ATOM 387 CA TYR A 433 -2.377 -1.165 -1.694 1.00 0.00 C ATOM 388 C TYR A 433 -2.629 0.267 -1.235 1.00 0.00 C ATOM 389 O TYR A 433 -3.770 0.731 -1.206 1.00 0.00 O ATOM 390 CB TYR A 433 -2.565 -1.268 -3.208 1.00 0.00 C ATOM 391 CG TYR A 433 -1.588 -0.427 -3.999 1.00 0.00 C ATOM 392 CD1 TYR A 433 -0.263 -0.305 -3.597 1.00 0.00 C ATOM 393 CD2 TYR A 433 -1.990 0.246 -5.145 1.00 0.00 C ATOM 394 CE1 TYR A 433 0.633 0.463 -4.316 1.00 0.00 C ATOM 395 CE2 TYR A 433 -1.100 1.015 -5.871 1.00 0.00 C ATOM 396 CZ TYR A 433 0.210 1.120 -5.452 1.00 0.00 C ATOM 397 OH TYR A 433 1.098 1.887 -6.171 1.00 0.00 O ATOM 0 H TYR A 433 -4.218 -2.118 -1.376 1.00 0.00 H new ATOM 0 HA TYR A 433 -1.350 -1.432 -1.443 1.00 0.00 H new ATOM 0 HB2 TYR A 433 -2.460 -2.311 -3.508 1.00 0.00 H new ATOM 0 HB3 TYR A 433 -3.581 -0.964 -3.461 1.00 0.00 H new ATOM 0 HD1 TYR A 433 0.072 -0.819 -2.708 1.00 0.00 H new ATOM 0 HD2 TYR A 433 -3.015 0.167 -5.475 1.00 0.00 H new ATOM 0 HE1 TYR A 433 1.659 0.548 -3.990 1.00 0.00 H new ATOM 0 HE2 TYR A 433 -1.428 1.531 -6.761 1.00 0.00 H new ATOM 0 HH TYR A 433 2.007 1.548 -6.036 1.00 0.00 H new ATOM 407 N LEU A 434 -1.556 0.964 -0.877 1.00 0.00 N ATOM 408 CA LEU A 434 -1.659 2.346 -0.419 1.00 0.00 C ATOM 409 C LEU A 434 -0.855 3.279 -1.319 1.00 0.00 C ATOM 410 O LEU A 434 0.258 2.953 -1.734 1.00 0.00 O ATOM 411 CB LEU A 434 -1.167 2.463 1.025 1.00 0.00 C ATOM 412 CG LEU A 434 -2.102 1.908 2.099 1.00 0.00 C ATOM 413 CD1 LEU A 434 -1.335 1.629 3.383 1.00 0.00 C ATOM 414 CD2 LEU A 434 -3.248 2.875 2.360 1.00 0.00 C ATOM 0 H LEU A 434 -0.605 0.595 -0.895 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.707 2.641 -0.465 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.209 1.949 1.104 1.00 0.00 H new ATOM 0 HB3 LEU A 434 -0.982 3.515 1.241 1.00 0.00 H new ATOM 0 HG LEU A 434 -2.520 0.968 1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 434 -2.017 1.234 4.136 1.00 0.00 H new ATOM 0 HD12 LEU A 434 -0.550 0.899 3.186 1.00 0.00 H new ATOM 0 HD13 LEU A 434 -0.888 2.554 3.748 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -3.904 2.464 3.127 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -2.848 3.831 2.699 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -3.814 3.024 1.441 1.00 0.00 H new ATOM 426 N LYS A 435 -1.425 4.441 -1.617 1.00 0.00 N ATOM 427 CA LYS A 435 -0.762 5.425 -2.465 1.00 0.00 C ATOM 428 C LYS A 435 -0.909 6.829 -1.887 1.00 0.00 C ATOM 429 O LYS A 435 -2.020 7.330 -1.724 1.00 0.00 O ATOM 430 CB LYS A 435 -1.341 5.381 -3.881 1.00 0.00 C ATOM 431 CG LYS A 435 -0.791 4.246 -4.728 1.00 0.00 C ATOM 432 CD LYS A 435 -1.103 4.448 -6.201 1.00 0.00 C ATOM 433 CE LYS A 435 -2.568 4.172 -6.503 1.00 0.00 C ATOM 434 NZ LYS A 435 -2.825 4.085 -7.968 1.00 0.00 N ATOM 0 H LYS A 435 -2.346 4.725 -1.283 1.00 0.00 H new ATOM 0 HA LYS A 435 0.299 5.177 -2.505 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -2.425 5.284 -3.818 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -1.134 6.328 -4.379 1.00 0.00 H new ATOM 0 HG2 LYS A 435 0.288 4.177 -4.590 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -1.216 3.300 -4.391 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -0.857 5.470 -6.489 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -0.476 3.788 -6.801 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -2.868 3.239 -6.026 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -3.183 4.962 -6.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -3.834 3.896 -8.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -2.563 4.984 -8.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -2.258 3.314 -8.375 1.00 0.00 H new ATOM 448 N GLY A 436 0.221 7.459 -1.581 1.00 0.00 N ATOM 449 CA GLY A 436 0.195 8.800 -1.026 1.00 0.00 C ATOM 450 C GLY A 436 1.168 8.971 0.124 1.00 0.00 C ATOM 451 O GLY A 436 1.565 10.090 0.450 1.00 0.00 O ATOM 0 H GLY A 436 1.153 7.065 -1.707 1.00 0.00 H new ATOM 0 HA2 GLY A 436 0.434 9.519 -1.810 1.00 0.00 H new ATOM 0 HA3 GLY A 436 -0.814 9.028 -0.681 1.00 0.00 H new ATOM 455 N LEU A 437 1.552 7.859 0.741 1.00 0.00 N ATOM 456 CA LEU A 437 2.484 7.890 1.864 1.00 0.00 C ATOM 457 C LEU A 437 3.511 9.004 1.687 1.00 0.00 C ATOM 458 O LEU A 437 3.857 9.392 0.571 1.00 0.00 O ATOM 459 CB LEU A 437 3.193 6.542 2.000 1.00 0.00 C ATOM 460 CG LEU A 437 2.312 5.357 2.396 1.00 0.00 C ATOM 461 CD1 LEU A 437 3.089 4.054 2.287 1.00 0.00 C ATOM 462 CD2 LEU A 437 1.773 5.541 3.807 1.00 0.00 C ATOM 0 H LEU A 437 1.233 6.925 0.483 1.00 0.00 H new ATOM 0 HA LEU A 437 1.915 8.087 2.773 1.00 0.00 H new ATOM 0 HB2 LEU A 437 3.674 6.310 1.050 1.00 0.00 H new ATOM 0 HB3 LEU A 437 3.985 6.644 2.742 1.00 0.00 H new ATOM 0 HG LEU A 437 1.467 5.312 1.708 1.00 0.00 H new ATOM 0 HD11 LEU A 437 2.446 3.222 2.573 1.00 0.00 H new ATOM 0 HD12 LEU A 437 3.426 3.916 1.260 1.00 0.00 H new ATOM 0 HD13 LEU A 437 3.953 4.089 2.950 1.00 0.00 H new ATOM 0 HD21 LEU A 437 1.148 4.688 4.072 1.00 0.00 H new ATOM 0 HD22 LEU A 437 2.605 5.613 4.508 1.00 0.00 H new ATOM 0 HD23 LEU A 437 1.179 6.454 3.854 1.00 0.00 H new ATOM 474 N PRO A 438 4.014 9.529 2.814 1.00 0.00 N ATOM 475 CA PRO A 438 5.012 10.603 2.811 1.00 0.00 C ATOM 476 C PRO A 438 6.372 10.129 2.309 1.00 0.00 C ATOM 477 O PRO A 438 6.634 8.929 2.236 1.00 0.00 O ATOM 478 CB PRO A 438 5.098 11.012 4.283 1.00 0.00 C ATOM 479 CG PRO A 438 4.674 9.800 5.039 1.00 0.00 C ATOM 480 CD PRO A 438 3.648 9.115 4.179 1.00 0.00 C ATOM 0 HA PRO A 438 4.731 11.418 2.144 1.00 0.00 H new ATOM 0 HB2 PRO A 438 6.111 11.312 4.552 1.00 0.00 H new ATOM 0 HB3 PRO A 438 4.447 11.860 4.497 1.00 0.00 H new ATOM 0 HG2 PRO A 438 5.523 9.144 5.232 1.00 0.00 H new ATOM 0 HG3 PRO A 438 4.254 10.071 6.007 1.00 0.00 H new ATOM 0 HD2 PRO A 438 3.686 8.032 4.294 1.00 0.00 H new ATOM 0 HD3 PRO A 438 2.636 9.427 4.436 1.00 0.00 H new ATOM 488 N PHE A 439 7.234 11.080 1.964 1.00 0.00 N ATOM 489 CA PHE A 439 8.567 10.759 1.468 1.00 0.00 C ATOM 490 C PHE A 439 9.424 10.143 2.571 1.00 0.00 C ATOM 491 O PHE A 439 10.212 9.231 2.321 1.00 0.00 O ATOM 492 CB PHE A 439 9.247 12.016 0.921 1.00 0.00 C ATOM 493 CG PHE A 439 8.559 12.594 -0.282 1.00 0.00 C ATOM 494 CD1 PHE A 439 8.881 12.157 -1.557 1.00 0.00 C ATOM 495 CD2 PHE A 439 7.590 13.574 -0.138 1.00 0.00 C ATOM 496 CE1 PHE A 439 8.250 12.688 -2.666 1.00 0.00 C ATOM 497 CE2 PHE A 439 6.955 14.109 -1.244 1.00 0.00 C ATOM 498 CZ PHE A 439 7.285 13.664 -2.509 1.00 0.00 C ATOM 0 H PHE A 439 7.033 12.079 2.019 1.00 0.00 H new ATOM 0 HA PHE A 439 8.463 10.031 0.663 1.00 0.00 H new ATOM 0 HB2 PHE A 439 9.283 12.771 1.707 1.00 0.00 H new ATOM 0 HB3 PHE A 439 10.278 11.777 0.660 1.00 0.00 H new ATOM 0 HD1 PHE A 439 9.633 11.393 -1.685 1.00 0.00 H new ATOM 0 HD2 PHE A 439 7.328 13.924 0.849 1.00 0.00 H new ATOM 0 HE1 PHE A 439 8.511 12.340 -3.655 1.00 0.00 H new ATOM 0 HE2 PHE A 439 6.202 14.873 -1.119 1.00 0.00 H new ATOM 0 HZ PHE A 439 6.789 14.078 -3.374 1.00 0.00 H new ATOM 508 N GLU A 440 9.262 10.648 3.790 1.00 0.00 N ATOM 509 CA GLU A 440 10.022 10.148 4.930 1.00 0.00 C ATOM 510 C GLU A 440 9.179 9.190 5.766 1.00 0.00 C ATOM 511 O GLU A 440 9.309 9.139 6.989 1.00 0.00 O ATOM 512 CB GLU A 440 10.505 11.311 5.798 1.00 0.00 C ATOM 513 CG GLU A 440 11.389 12.299 5.056 1.00 0.00 C ATOM 514 CD GLU A 440 12.196 13.178 5.992 1.00 0.00 C ATOM 515 OE1 GLU A 440 11.619 13.682 6.978 1.00 0.00 O ATOM 516 OE2 GLU A 440 13.404 13.362 5.738 1.00 0.00 O ATOM 0 H GLU A 440 8.612 11.402 4.013 1.00 0.00 H new ATOM 0 HA GLU A 440 10.887 9.605 4.549 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.639 11.840 6.197 1.00 0.00 H new ATOM 0 HB3 GLU A 440 11.056 10.913 6.650 1.00 0.00 H new ATOM 0 HG2 GLU A 440 12.068 11.753 4.401 1.00 0.00 H new ATOM 0 HG3 GLU A 440 10.768 12.928 4.418 1.00 0.00 H new ATOM 523 N ALA A 441 8.316 8.432 5.098 1.00 0.00 N ATOM 524 CA ALA A 441 7.453 7.475 5.778 1.00 0.00 C ATOM 525 C ALA A 441 8.272 6.373 6.443 1.00 0.00 C ATOM 526 O ALA A 441 9.484 6.284 6.246 1.00 0.00 O ATOM 527 CB ALA A 441 6.455 6.875 4.799 1.00 0.00 C ATOM 0 H ALA A 441 8.196 8.462 4.086 1.00 0.00 H new ATOM 0 HA ALA A 441 6.906 8.006 6.557 1.00 0.00 H new ATOM 0 HB1 ALA A 441 5.817 6.162 5.321 1.00 0.00 H new ATOM 0 HB2 ALA A 441 5.840 7.668 4.374 1.00 0.00 H new ATOM 0 HB3 ALA A 441 6.992 6.364 4.000 1.00 0.00 H new ATOM 533 N GLU A 442 7.603 5.538 7.231 1.00 0.00 N ATOM 534 CA GLU A 442 8.271 4.444 7.926 1.00 0.00 C ATOM 535 C GLU A 442 7.279 3.342 8.288 1.00 0.00 C ATOM 536 O GLU A 442 6.073 3.578 8.360 1.00 0.00 O ATOM 537 CB GLU A 442 8.961 4.959 9.190 1.00 0.00 C ATOM 538 CG GLU A 442 10.298 5.631 8.923 1.00 0.00 C ATOM 539 CD GLU A 442 11.070 5.920 10.196 1.00 0.00 C ATOM 540 OE1 GLU A 442 11.361 4.962 10.943 1.00 0.00 O ATOM 541 OE2 GLU A 442 11.383 7.103 10.445 1.00 0.00 O ATOM 0 H GLU A 442 6.600 5.598 7.404 1.00 0.00 H new ATOM 0 HA GLU A 442 9.022 4.027 7.255 1.00 0.00 H new ATOM 0 HB2 GLU A 442 8.301 5.668 9.691 1.00 0.00 H new ATOM 0 HB3 GLU A 442 9.113 4.126 9.876 1.00 0.00 H new ATOM 0 HG2 GLU A 442 10.899 4.992 8.275 1.00 0.00 H new ATOM 0 HG3 GLU A 442 10.131 6.564 8.384 1.00 0.00 H new ATOM 548 N ASN A 443 7.795 2.139 8.514 1.00 0.00 N ATOM 549 CA ASN A 443 6.955 1.000 8.867 1.00 0.00 C ATOM 550 C ASN A 443 5.877 1.409 9.867 1.00 0.00 C ATOM 551 O ASN A 443 4.727 0.981 9.766 1.00 0.00 O ATOM 552 CB ASN A 443 7.808 -0.127 9.452 1.00 0.00 C ATOM 553 CG ASN A 443 9.126 -0.294 8.721 1.00 0.00 C ATOM 554 OD1 ASN A 443 10.133 0.312 9.088 1.00 0.00 O ATOM 555 ND2 ASN A 443 9.125 -1.119 7.681 1.00 0.00 N ATOM 0 H ASN A 443 8.791 1.927 8.459 1.00 0.00 H new ATOM 0 HA ASN A 443 6.468 0.644 7.959 1.00 0.00 H new ATOM 0 HB2 ASN A 443 8.003 0.078 10.505 1.00 0.00 H new ATOM 0 HB3 ASN A 443 7.250 -1.062 9.407 1.00 0.00 H new ATOM 0 HD21 ASN A 443 9.983 -1.272 7.150 1.00 0.00 H new ATOM 0 HD22 ASN A 443 8.267 -1.600 7.413 1.00 0.00 H new ATOM 562 N LYS A 444 6.257 2.240 10.831 1.00 0.00 N ATOM 563 CA LYS A 444 5.325 2.710 11.849 1.00 0.00 C ATOM 564 C LYS A 444 4.149 3.444 11.212 1.00 0.00 C ATOM 565 O LYS A 444 2.991 3.196 11.552 1.00 0.00 O ATOM 566 CB LYS A 444 6.040 3.632 12.839 1.00 0.00 C ATOM 567 CG LYS A 444 6.600 4.891 12.201 1.00 0.00 C ATOM 568 CD LYS A 444 7.376 5.727 13.205 1.00 0.00 C ATOM 569 CE LYS A 444 8.323 6.694 12.512 1.00 0.00 C ATOM 570 NZ LYS A 444 8.645 7.867 13.371 1.00 0.00 N ATOM 0 H LYS A 444 7.205 2.602 10.929 1.00 0.00 H new ATOM 0 HA LYS A 444 4.942 1.841 12.384 1.00 0.00 H new ATOM 0 HB2 LYS A 444 5.343 3.914 13.629 1.00 0.00 H new ATOM 0 HB3 LYS A 444 6.853 3.082 13.313 1.00 0.00 H new ATOM 0 HG2 LYS A 444 7.252 4.620 11.371 1.00 0.00 H new ATOM 0 HG3 LYS A 444 5.785 5.483 11.786 1.00 0.00 H new ATOM 0 HD2 LYS A 444 6.679 6.284 13.831 1.00 0.00 H new ATOM 0 HD3 LYS A 444 7.943 5.071 13.865 1.00 0.00 H new ATOM 0 HE2 LYS A 444 9.244 6.174 12.248 1.00 0.00 H new ATOM 0 HE3 LYS A 444 7.873 7.038 11.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 9.293 8.502 12.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 7.770 8.378 13.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 9.098 7.541 14.249 1.00 0.00 H new ATOM 584 N HIS A 445 4.453 4.348 10.286 1.00 0.00 N ATOM 585 CA HIS A 445 3.420 5.116 9.600 1.00 0.00 C ATOM 586 C HIS A 445 2.317 4.200 9.079 1.00 0.00 C ATOM 587 O HIS A 445 1.130 4.488 9.238 1.00 0.00 O ATOM 588 CB HIS A 445 4.029 5.909 8.443 1.00 0.00 C ATOM 589 CG HIS A 445 4.704 7.175 8.875 1.00 0.00 C ATOM 590 ND1 HIS A 445 6.062 7.264 9.099 1.00 0.00 N ATOM 591 CD2 HIS A 445 4.201 8.407 9.121 1.00 0.00 C ATOM 592 CE1 HIS A 445 6.365 8.497 9.466 1.00 0.00 C ATOM 593 NE2 HIS A 445 5.253 9.210 9.487 1.00 0.00 N ATOM 0 H HIS A 445 5.405 4.567 9.994 1.00 0.00 H new ATOM 0 HA HIS A 445 2.982 5.811 10.317 1.00 0.00 H new ATOM 0 HB2 HIS A 445 4.752 5.280 7.923 1.00 0.00 H new ATOM 0 HB3 HIS A 445 3.244 6.151 7.727 1.00 0.00 H new ATOM 0 HD2 HIS A 445 3.165 8.703 9.044 1.00 0.00 H new ATOM 0 HE1 HIS A 445 7.353 8.860 9.708 1.00 0.00 H new ATOM 0 HE2 HIS A 445 5.187 10.197 9.735 1.00 0.00 H new ATOM 602 N VAL A 446 2.716 3.096 8.456 1.00 0.00 N ATOM 603 CA VAL A 446 1.761 2.138 7.912 1.00 0.00 C ATOM 604 C VAL A 446 0.930 1.501 9.020 1.00 0.00 C ATOM 605 O VAL A 446 -0.286 1.355 8.892 1.00 0.00 O ATOM 606 CB VAL A 446 2.472 1.027 7.116 1.00 0.00 C ATOM 607 CG1 VAL A 446 1.467 -0.001 6.620 1.00 0.00 C ATOM 608 CG2 VAL A 446 3.255 1.622 5.956 1.00 0.00 C ATOM 0 H VAL A 446 3.694 2.843 8.315 1.00 0.00 H new ATOM 0 HA VAL A 446 1.104 2.692 7.241 1.00 0.00 H new ATOM 0 HB VAL A 446 3.175 0.522 7.778 1.00 0.00 H new ATOM 0 HG11 VAL A 446 1.987 -0.778 6.060 1.00 0.00 H new ATOM 0 HG12 VAL A 446 0.954 -0.449 7.471 1.00 0.00 H new ATOM 0 HG13 VAL A 446 0.738 0.486 5.973 1.00 0.00 H new ATOM 0 HG21 VAL A 446 3.751 0.823 5.404 1.00 0.00 H new ATOM 0 HG22 VAL A 446 2.574 2.153 5.291 1.00 0.00 H new ATOM 0 HG23 VAL A 446 4.002 2.316 6.340 1.00 0.00 H new ATOM 618 N ILE A 447 1.593 1.124 10.108 1.00 0.00 N ATOM 619 CA ILE A 447 0.915 0.504 11.239 1.00 0.00 C ATOM 620 C ILE A 447 -0.216 1.389 11.754 1.00 0.00 C ATOM 621 O ILE A 447 -1.366 0.957 11.839 1.00 0.00 O ATOM 622 CB ILE A 447 1.893 0.217 12.394 1.00 0.00 C ATOM 623 CG1 ILE A 447 2.900 -0.859 11.982 1.00 0.00 C ATOM 624 CG2 ILE A 447 1.132 -0.212 13.639 1.00 0.00 C ATOM 625 CD1 ILE A 447 4.039 -1.028 12.963 1.00 0.00 C ATOM 0 H ILE A 447 2.599 1.237 10.230 1.00 0.00 H new ATOM 0 HA ILE A 447 0.502 -0.439 10.881 1.00 0.00 H new ATOM 0 HB ILE A 447 2.439 1.132 12.624 1.00 0.00 H new ATOM 0 HG12 ILE A 447 2.379 -1.811 11.875 1.00 0.00 H new ATOM 0 HG13 ILE A 447 3.308 -0.607 11.003 1.00 0.00 H new ATOM 0 HG21 ILE A 447 1.837 -0.411 14.446 1.00 0.00 H new ATOM 0 HG22 ILE A 447 0.450 0.583 13.941 1.00 0.00 H new ATOM 0 HG23 ILE A 447 0.562 -1.116 13.424 1.00 0.00 H new ATOM 0 HD11 ILE A 447 4.713 -1.807 12.607 1.00 0.00 H new ATOM 0 HD12 ILE A 447 4.585 -0.089 13.052 1.00 0.00 H new ATOM 0 HD13 ILE A 447 3.641 -1.311 13.938 1.00 0.00 H new ATOM 637 N ASP A 448 0.119 2.628 12.095 1.00 0.00 N ATOM 638 CA ASP A 448 -0.868 3.576 12.599 1.00 0.00 C ATOM 639 C ASP A 448 -2.083 3.636 11.678 1.00 0.00 C ATOM 640 O ASP A 448 -3.224 3.681 12.140 1.00 0.00 O ATOM 641 CB ASP A 448 -0.248 4.967 12.737 1.00 0.00 C ATOM 642 CG ASP A 448 -0.973 5.826 13.754 1.00 0.00 C ATOM 643 OD1 ASP A 448 -0.715 5.659 14.965 1.00 0.00 O ATOM 644 OD2 ASP A 448 -1.799 6.665 13.339 1.00 0.00 O ATOM 0 H ASP A 448 1.067 3.000 12.032 1.00 0.00 H new ATOM 0 HA ASP A 448 -1.195 3.234 13.581 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.798 4.868 13.029 1.00 0.00 H new ATOM 0 HB3 ASP A 448 -0.263 5.466 11.768 1.00 0.00 H new ATOM 649 N PHE A 449 -1.830 3.638 10.374 1.00 0.00 N ATOM 650 CA PHE A 449 -2.903 3.696 9.387 1.00 0.00 C ATOM 651 C PHE A 449 -3.865 2.524 9.561 1.00 0.00 C ATOM 652 O PHE A 449 -5.081 2.683 9.454 1.00 0.00 O ATOM 653 CB PHE A 449 -2.323 3.688 7.971 1.00 0.00 C ATOM 654 CG PHE A 449 -3.169 4.427 6.973 1.00 0.00 C ATOM 655 CD1 PHE A 449 -3.521 5.750 7.189 1.00 0.00 C ATOM 656 CD2 PHE A 449 -3.611 3.799 5.820 1.00 0.00 C ATOM 657 CE1 PHE A 449 -4.300 6.432 6.273 1.00 0.00 C ATOM 658 CE2 PHE A 449 -4.389 4.476 4.900 1.00 0.00 C ATOM 659 CZ PHE A 449 -4.733 5.794 5.127 1.00 0.00 C ATOM 0 H PHE A 449 -0.892 3.600 9.975 1.00 0.00 H new ATOM 0 HA PHE A 449 -3.455 4.623 9.541 1.00 0.00 H new ATOM 0 HB2 PHE A 449 -1.328 4.132 7.992 1.00 0.00 H new ATOM 0 HB3 PHE A 449 -2.204 2.656 7.641 1.00 0.00 H new ATOM 0 HD1 PHE A 449 -3.183 6.254 8.083 1.00 0.00 H new ATOM 0 HD2 PHE A 449 -3.344 2.768 5.638 1.00 0.00 H new ATOM 0 HE1 PHE A 449 -4.570 7.462 6.453 1.00 0.00 H new ATOM 0 HE2 PHE A 449 -4.727 3.975 4.005 1.00 0.00 H new ATOM 0 HZ PHE A 449 -5.340 6.325 4.409 1.00 0.00 H new ATOM 669 N PHE A 450 -3.311 1.346 9.830 1.00 0.00 N ATOM 670 CA PHE A 450 -4.118 0.147 10.017 1.00 0.00 C ATOM 671 C PHE A 450 -3.882 -0.458 11.398 1.00 0.00 C ATOM 672 O PHE A 450 -3.875 -1.678 11.562 1.00 0.00 O ATOM 673 CB PHE A 450 -3.796 -0.885 8.934 1.00 0.00 C ATOM 674 CG PHE A 450 -4.039 -0.386 7.539 1.00 0.00 C ATOM 675 CD1 PHE A 450 -5.107 0.454 7.266 1.00 0.00 C ATOM 676 CD2 PHE A 450 -3.201 -0.758 6.500 1.00 0.00 C ATOM 677 CE1 PHE A 450 -5.334 0.915 5.983 1.00 0.00 C ATOM 678 CE2 PHE A 450 -3.423 -0.300 5.215 1.00 0.00 C ATOM 679 CZ PHE A 450 -4.491 0.537 4.956 1.00 0.00 C ATOM 0 H PHE A 450 -2.306 1.197 9.923 1.00 0.00 H new ATOM 0 HA PHE A 450 -5.168 0.430 9.938 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.752 -1.184 9.027 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -4.399 -1.777 9.102 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -5.770 0.752 8.065 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -2.365 -1.413 6.696 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -6.169 1.570 5.784 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -2.762 -0.596 4.414 1.00 0.00 H new ATOM 0 HZ PHE A 450 -4.667 0.895 3.952 1.00 0.00 H new ATOM 689 N LYS A 451 -3.689 0.405 12.390 1.00 0.00 N ATOM 690 CA LYS A 451 -3.453 -0.041 13.758 1.00 0.00 C ATOM 691 C LYS A 451 -4.624 -0.875 14.267 1.00 0.00 C ATOM 692 O LYS A 451 -5.655 -0.988 13.604 1.00 0.00 O ATOM 693 CB LYS A 451 -3.232 1.163 14.677 1.00 0.00 C ATOM 694 CG LYS A 451 -4.396 2.139 14.691 1.00 0.00 C ATOM 695 CD LYS A 451 -4.502 2.860 16.024 1.00 0.00 C ATOM 696 CE LYS A 451 -3.698 4.151 16.026 1.00 0.00 C ATOM 697 NZ LYS A 451 -4.242 5.143 16.994 1.00 0.00 N ATOM 0 H LYS A 451 -3.691 1.418 12.272 1.00 0.00 H new ATOM 0 HA LYS A 451 -2.558 -0.663 13.763 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -3.055 0.807 15.692 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -2.331 1.689 14.362 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -4.270 2.868 13.891 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -5.324 1.603 14.491 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -5.548 3.081 16.237 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -4.146 2.207 16.821 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -2.660 3.932 16.276 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -3.701 4.582 15.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -3.666 6.009 16.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -5.224 5.372 16.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -4.216 4.742 17.953 1.00 0.00 H new ATOM 711 N LYS A 452 -4.459 -1.457 15.450 1.00 0.00 N ATOM 712 CA LYS A 452 -5.502 -2.279 16.051 1.00 0.00 C ATOM 713 C LYS A 452 -5.950 -3.378 15.092 1.00 0.00 C ATOM 714 O LYS A 452 -7.132 -3.718 15.030 1.00 0.00 O ATOM 715 CB LYS A 452 -6.700 -1.412 16.445 1.00 0.00 C ATOM 716 CG LYS A 452 -6.410 -0.460 17.592 1.00 0.00 C ATOM 717 CD LYS A 452 -7.599 0.441 17.883 1.00 0.00 C ATOM 718 CE LYS A 452 -7.298 1.414 19.012 1.00 0.00 C ATOM 719 NZ LYS A 452 -7.332 0.746 20.343 1.00 0.00 N ATOM 0 H LYS A 452 -3.612 -1.374 16.012 1.00 0.00 H new ATOM 0 HA LYS A 452 -5.090 -2.747 16.945 1.00 0.00 H new ATOM 0 HB2 LYS A 452 -7.022 -0.835 15.578 1.00 0.00 H new ATOM 0 HB3 LYS A 452 -7.531 -2.060 16.723 1.00 0.00 H new ATOM 0 HG2 LYS A 452 -6.158 -1.031 18.485 1.00 0.00 H new ATOM 0 HG3 LYS A 452 -5.541 0.151 17.348 1.00 0.00 H new ATOM 0 HD2 LYS A 452 -7.864 0.997 16.984 1.00 0.00 H new ATOM 0 HD3 LYS A 452 -8.463 -0.169 18.148 1.00 0.00 H new ATOM 0 HE2 LYS A 452 -6.316 1.861 18.855 1.00 0.00 H new ATOM 0 HE3 LYS A 452 -8.024 2.227 18.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 452 -7.122 1.442 21.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 452 -8.276 0.342 20.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 452 -6.621 -0.013 20.369 1.00 0.00 H new ATOM 733 N LEU A 453 -4.998 -3.929 14.346 1.00 0.00 N ATOM 734 CA LEU A 453 -5.295 -4.991 13.391 1.00 0.00 C ATOM 735 C LEU A 453 -4.138 -5.981 13.301 1.00 0.00 C ATOM 736 O LEU A 453 -3.094 -5.790 13.926 1.00 0.00 O ATOM 737 CB LEU A 453 -5.581 -4.396 12.011 1.00 0.00 C ATOM 738 CG LEU A 453 -6.819 -3.504 11.908 1.00 0.00 C ATOM 739 CD1 LEU A 453 -6.810 -2.729 10.599 1.00 0.00 C ATOM 740 CD2 LEU A 453 -8.087 -4.336 12.029 1.00 0.00 C ATOM 0 H LEU A 453 -4.015 -3.658 14.384 1.00 0.00 H new ATOM 0 HA LEU A 453 -6.179 -5.525 13.740 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -4.712 -3.815 11.701 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -5.688 -5.215 11.299 1.00 0.00 H new ATOM 0 HG LEU A 453 -6.798 -2.789 12.730 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -7.698 -2.100 10.543 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -5.918 -2.104 10.553 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -6.807 -3.428 9.762 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -8.958 -3.685 11.954 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -8.115 -5.074 11.228 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -8.097 -4.845 12.993 1.00 0.00 H new ATOM 752 N ASP A 454 -4.329 -7.037 12.518 1.00 0.00 N ATOM 753 CA ASP A 454 -3.300 -8.055 12.343 1.00 0.00 C ATOM 754 C ASP A 454 -2.470 -7.780 11.093 1.00 0.00 C ATOM 755 O ASP A 454 -2.852 -8.162 9.986 1.00 0.00 O ATOM 756 CB ASP A 454 -3.937 -9.443 12.252 1.00 0.00 C ATOM 757 CG ASP A 454 -4.084 -10.102 13.609 1.00 0.00 C ATOM 758 OD1 ASP A 454 -4.649 -9.463 14.522 1.00 0.00 O ATOM 759 OD2 ASP A 454 -3.635 -11.258 13.759 1.00 0.00 O ATOM 0 H ASP A 454 -5.187 -7.210 11.994 1.00 0.00 H new ATOM 0 HA ASP A 454 -2.640 -8.022 13.210 1.00 0.00 H new ATOM 0 HB2 ASP A 454 -4.918 -9.360 11.784 1.00 0.00 H new ATOM 0 HB3 ASP A 454 -3.329 -10.077 11.607 1.00 0.00 H new ATOM 764 N ILE A 455 -1.335 -7.115 11.277 1.00 0.00 N ATOM 765 CA ILE A 455 -0.452 -6.789 10.165 1.00 0.00 C ATOM 766 C ILE A 455 0.939 -7.377 10.376 1.00 0.00 C ATOM 767 O ILE A 455 1.662 -6.978 11.289 1.00 0.00 O ATOM 768 CB ILE A 455 -0.328 -5.266 9.971 1.00 0.00 C ATOM 769 CG1 ILE A 455 -1.690 -4.662 9.624 1.00 0.00 C ATOM 770 CG2 ILE A 455 0.690 -4.950 8.886 1.00 0.00 C ATOM 771 CD1 ILE A 455 -1.768 -3.170 9.862 1.00 0.00 C ATOM 0 H ILE A 455 -1.005 -6.791 12.186 1.00 0.00 H new ATOM 0 HA ILE A 455 -0.897 -7.226 9.271 1.00 0.00 H new ATOM 0 HB ILE A 455 0.018 -4.823 10.905 1.00 0.00 H new ATOM 0 HG12 ILE A 455 -1.913 -4.867 8.577 1.00 0.00 H new ATOM 0 HG13 ILE A 455 -2.459 -5.157 10.217 1.00 0.00 H new ATOM 0 HG21 ILE A 455 0.766 -3.870 8.761 1.00 0.00 H new ATOM 0 HG22 ILE A 455 1.662 -5.351 9.171 1.00 0.00 H new ATOM 0 HG23 ILE A 455 0.373 -5.402 7.946 1.00 0.00 H new ATOM 0 HD11 ILE A 455 -2.762 -2.810 9.595 1.00 0.00 H new ATOM 0 HD12 ILE A 455 -1.577 -2.959 10.914 1.00 0.00 H new ATOM 0 HD13 ILE A 455 -1.022 -2.664 9.249 1.00 0.00 H new ATOM 783 N VAL A 456 1.309 -8.329 9.524 1.00 0.00 N ATOM 784 CA VAL A 456 2.615 -8.971 9.615 1.00 0.00 C ATOM 785 C VAL A 456 3.738 -7.966 9.388 1.00 0.00 C ATOM 786 O VAL A 456 4.049 -7.616 8.250 1.00 0.00 O ATOM 787 CB VAL A 456 2.750 -10.116 8.594 1.00 0.00 C ATOM 788 CG1 VAL A 456 3.871 -11.061 8.996 1.00 0.00 C ATOM 789 CG2 VAL A 456 1.433 -10.865 8.457 1.00 0.00 C ATOM 0 H VAL A 456 0.722 -8.672 8.763 1.00 0.00 H new ATOM 0 HA VAL A 456 2.697 -9.381 10.622 1.00 0.00 H new ATOM 0 HB VAL A 456 3.000 -9.687 7.624 1.00 0.00 H new ATOM 0 HG11 VAL A 456 3.951 -11.863 8.263 1.00 0.00 H new ATOM 0 HG12 VAL A 456 4.812 -10.512 9.038 1.00 0.00 H new ATOM 0 HG13 VAL A 456 3.655 -11.486 9.976 1.00 0.00 H new ATOM 0 HG21 VAL A 456 1.546 -11.671 7.732 1.00 0.00 H new ATOM 0 HG22 VAL A 456 1.150 -11.284 9.423 1.00 0.00 H new ATOM 0 HG23 VAL A 456 0.657 -10.178 8.118 1.00 0.00 H new ATOM 799 N GLU A 457 4.344 -7.508 10.479 1.00 0.00 N ATOM 800 CA GLU A 457 5.434 -6.542 10.397 1.00 0.00 C ATOM 801 C GLU A 457 6.337 -6.840 9.203 1.00 0.00 C ATOM 802 O GLU A 457 6.972 -5.941 8.652 1.00 0.00 O ATOM 803 CB GLU A 457 6.256 -6.558 11.688 1.00 0.00 C ATOM 804 CG GLU A 457 5.751 -5.588 12.743 1.00 0.00 C ATOM 805 CD GLU A 457 4.423 -6.015 13.339 1.00 0.00 C ATOM 806 OE1 GLU A 457 4.208 -7.235 13.496 1.00 0.00 O ATOM 807 OE2 GLU A 457 3.600 -5.128 13.649 1.00 0.00 O ATOM 0 H GLU A 457 4.099 -7.790 11.428 1.00 0.00 H new ATOM 0 HA GLU A 457 4.999 -5.552 10.263 1.00 0.00 H new ATOM 0 HB2 GLU A 457 6.249 -7.567 12.101 1.00 0.00 H new ATOM 0 HB3 GLU A 457 7.293 -6.318 11.452 1.00 0.00 H new ATOM 0 HG2 GLU A 457 6.492 -5.504 13.538 1.00 0.00 H new ATOM 0 HG3 GLU A 457 5.645 -4.598 12.300 1.00 0.00 H new ATOM 814 N ASP A 458 6.387 -8.107 8.809 1.00 0.00 N ATOM 815 CA ASP A 458 7.211 -8.525 7.680 1.00 0.00 C ATOM 816 C ASP A 458 6.562 -8.128 6.358 1.00 0.00 C ATOM 817 O ASP A 458 7.215 -7.565 5.479 1.00 0.00 O ATOM 818 CB ASP A 458 7.437 -10.037 7.718 1.00 0.00 C ATOM 819 CG ASP A 458 8.015 -10.503 9.040 1.00 0.00 C ATOM 820 OD1 ASP A 458 7.248 -10.604 10.021 1.00 0.00 O ATOM 821 OD2 ASP A 458 9.234 -10.769 9.093 1.00 0.00 O ATOM 0 H ASP A 458 5.867 -8.863 9.254 1.00 0.00 H new ATOM 0 HA ASP A 458 8.174 -8.020 7.758 1.00 0.00 H new ATOM 0 HB2 ASP A 458 6.491 -10.547 7.538 1.00 0.00 H new ATOM 0 HB3 ASP A 458 8.111 -10.321 6.910 1.00 0.00 H new ATOM 826 N SER A 459 5.274 -8.426 6.224 1.00 0.00 N ATOM 827 CA SER A 459 4.537 -8.104 5.007 1.00 0.00 C ATOM 828 C SER A 459 4.650 -6.618 4.680 1.00 0.00 C ATOM 829 O SER A 459 4.960 -6.242 3.549 1.00 0.00 O ATOM 830 CB SER A 459 3.066 -8.494 5.158 1.00 0.00 C ATOM 831 OG SER A 459 2.396 -7.623 6.052 1.00 0.00 O ATOM 0 H SER A 459 4.719 -8.890 6.943 1.00 0.00 H new ATOM 0 HA SER A 459 4.974 -8.673 4.186 1.00 0.00 H new ATOM 0 HB2 SER A 459 2.578 -8.466 4.184 1.00 0.00 H new ATOM 0 HB3 SER A 459 2.994 -9.519 5.522 1.00 0.00 H new ATOM 0 HG SER A 459 2.828 -7.660 6.931 1.00 0.00 H new ATOM 837 N ILE A 460 4.397 -5.779 5.678 1.00 0.00 N ATOM 838 CA ILE A 460 4.471 -4.334 5.498 1.00 0.00 C ATOM 839 C ILE A 460 5.630 -3.953 4.584 1.00 0.00 C ATOM 840 O ILE A 460 6.794 -4.012 4.982 1.00 0.00 O ATOM 841 CB ILE A 460 4.634 -3.606 6.846 1.00 0.00 C ATOM 842 CG1 ILE A 460 3.628 -4.145 7.866 1.00 0.00 C ATOM 843 CG2 ILE A 460 4.458 -2.106 6.662 1.00 0.00 C ATOM 844 CD1 ILE A 460 3.345 -3.185 9.000 1.00 0.00 C ATOM 0 H ILE A 460 4.139 -6.074 6.620 1.00 0.00 H new ATOM 0 HA ILE A 460 3.532 -4.025 5.039 1.00 0.00 H new ATOM 0 HB ILE A 460 5.640 -3.791 7.223 1.00 0.00 H new ATOM 0 HG12 ILE A 460 2.693 -4.377 7.355 1.00 0.00 H new ATOM 0 HG13 ILE A 460 4.006 -5.080 8.278 1.00 0.00 H new ATOM 0 HG21 ILE A 460 4.576 -1.605 7.623 1.00 0.00 H new ATOM 0 HG22 ILE A 460 5.209 -1.734 5.965 1.00 0.00 H new ATOM 0 HG23 ILE A 460 3.463 -1.902 6.266 1.00 0.00 H new ATOM 0 HD11 ILE A 460 2.624 -3.632 9.684 1.00 0.00 H new ATOM 0 HD12 ILE A 460 4.270 -2.972 9.536 1.00 0.00 H new ATOM 0 HD13 ILE A 460 2.937 -2.258 8.598 1.00 0.00 H new ATOM 856 N TYR A 461 5.305 -3.560 3.357 1.00 0.00 N ATOM 857 CA TYR A 461 6.319 -3.169 2.386 1.00 0.00 C ATOM 858 C TYR A 461 6.081 -1.745 1.893 1.00 0.00 C ATOM 859 O TYR A 461 4.939 -1.321 1.714 1.00 0.00 O ATOM 860 CB TYR A 461 6.321 -4.137 1.201 1.00 0.00 C ATOM 861 CG TYR A 461 7.494 -3.949 0.267 1.00 0.00 C ATOM 862 CD1 TYR A 461 7.614 -2.800 -0.506 1.00 0.00 C ATOM 863 CD2 TYR A 461 8.483 -4.919 0.157 1.00 0.00 C ATOM 864 CE1 TYR A 461 8.684 -2.624 -1.362 1.00 0.00 C ATOM 865 CE2 TYR A 461 9.557 -4.750 -0.695 1.00 0.00 C ATOM 866 CZ TYR A 461 9.653 -3.602 -1.453 1.00 0.00 C ATOM 867 OH TYR A 461 10.721 -3.430 -2.303 1.00 0.00 O ATOM 0 H TYR A 461 4.347 -3.504 3.012 1.00 0.00 H new ATOM 0 HA TYR A 461 7.291 -3.206 2.879 1.00 0.00 H new ATOM 0 HB2 TYR A 461 6.328 -5.160 1.578 1.00 0.00 H new ATOM 0 HB3 TYR A 461 5.396 -4.011 0.639 1.00 0.00 H new ATOM 0 HD1 TYR A 461 6.858 -2.032 -0.436 1.00 0.00 H new ATOM 0 HD2 TYR A 461 8.411 -5.820 0.748 1.00 0.00 H new ATOM 0 HE1 TYR A 461 8.762 -1.726 -1.957 1.00 0.00 H new ATOM 0 HE2 TYR A 461 10.318 -5.513 -0.767 1.00 0.00 H new ATOM 0 HH TYR A 461 11.504 -3.895 -1.942 1.00 0.00 H new ATOM 877 N ILE A 462 7.168 -1.013 1.674 1.00 0.00 N ATOM 878 CA ILE A 462 7.078 0.363 1.200 1.00 0.00 C ATOM 879 C ILE A 462 8.111 0.638 0.112 1.00 0.00 C ATOM 880 O ILE A 462 9.271 0.243 0.228 1.00 0.00 O ATOM 881 CB ILE A 462 7.280 1.369 2.349 1.00 0.00 C ATOM 882 CG1 ILE A 462 6.168 1.218 3.389 1.00 0.00 C ATOM 883 CG2 ILE A 462 7.318 2.790 1.808 1.00 0.00 C ATOM 884 CD1 ILE A 462 6.452 1.941 4.687 1.00 0.00 C ATOM 0 H ILE A 462 8.120 -1.349 1.817 1.00 0.00 H new ATOM 0 HA ILE A 462 6.077 0.490 0.788 1.00 0.00 H new ATOM 0 HB ILE A 462 8.234 1.160 2.832 1.00 0.00 H new ATOM 0 HG12 ILE A 462 5.235 1.595 2.969 1.00 0.00 H new ATOM 0 HG13 ILE A 462 6.018 0.159 3.598 1.00 0.00 H new ATOM 0 HG21 ILE A 462 7.461 3.489 2.632 1.00 0.00 H new ATOM 0 HG22 ILE A 462 8.142 2.888 1.101 1.00 0.00 H new ATOM 0 HG23 ILE A 462 6.378 3.012 1.303 1.00 0.00 H new ATOM 0 HD11 ILE A 462 5.622 1.790 5.377 1.00 0.00 H new ATOM 0 HD12 ILE A 462 7.367 1.548 5.130 1.00 0.00 H new ATOM 0 HD13 ILE A 462 6.572 3.007 4.491 1.00 0.00 H new ATOM 896 N ALA A 463 7.681 1.319 -0.945 1.00 0.00 N ATOM 897 CA ALA A 463 8.569 1.650 -2.053 1.00 0.00 C ATOM 898 C ALA A 463 9.394 2.894 -1.742 1.00 0.00 C ATOM 899 O ALA A 463 8.903 3.837 -1.121 1.00 0.00 O ATOM 900 CB ALA A 463 7.767 1.851 -3.330 1.00 0.00 C ATOM 0 H ALA A 463 6.724 1.652 -1.058 1.00 0.00 H new ATOM 0 HA ALA A 463 9.257 0.817 -2.197 1.00 0.00 H new ATOM 0 HB1 ALA A 463 8.443 2.098 -4.149 1.00 0.00 H new ATOM 0 HB2 ALA A 463 7.227 0.935 -3.568 1.00 0.00 H new ATOM 0 HB3 ALA A 463 7.056 2.665 -3.189 1.00 0.00 H new ATOM 906 N TYR A 464 10.649 2.890 -2.177 1.00 0.00 N ATOM 907 CA TYR A 464 11.543 4.018 -1.942 1.00 0.00 C ATOM 908 C TYR A 464 12.251 4.429 -3.229 1.00 0.00 C ATOM 909 O TYR A 464 12.500 3.602 -4.106 1.00 0.00 O ATOM 910 CB TYR A 464 12.575 3.663 -0.870 1.00 0.00 C ATOM 911 CG TYR A 464 11.985 3.519 0.515 1.00 0.00 C ATOM 912 CD1 TYR A 464 11.309 2.364 0.887 1.00 0.00 C ATOM 913 CD2 TYR A 464 12.104 4.539 1.451 1.00 0.00 C ATOM 914 CE1 TYR A 464 10.767 2.229 2.151 1.00 0.00 C ATOM 915 CE2 TYR A 464 11.567 4.412 2.718 1.00 0.00 C ATOM 916 CZ TYR A 464 10.899 3.256 3.062 1.00 0.00 C ATOM 917 OH TYR A 464 10.363 3.125 4.323 1.00 0.00 O ATOM 0 H TYR A 464 11.070 2.118 -2.694 1.00 0.00 H new ATOM 0 HA TYR A 464 10.942 4.859 -1.595 1.00 0.00 H new ATOM 0 HB2 TYR A 464 13.066 2.730 -1.145 1.00 0.00 H new ATOM 0 HB3 TYR A 464 13.345 4.434 -0.849 1.00 0.00 H new ATOM 0 HD1 TYR A 464 11.205 1.558 0.176 1.00 0.00 H new ATOM 0 HD2 TYR A 464 12.625 5.446 1.184 1.00 0.00 H new ATOM 0 HE1 TYR A 464 10.243 1.325 2.424 1.00 0.00 H new ATOM 0 HE2 TYR A 464 11.670 5.214 3.434 1.00 0.00 H new ATOM 0 HH TYR A 464 10.545 3.937 4.842 1.00 0.00 H new ATOM 927 N GLY A 465 12.574 5.715 -3.335 1.00 0.00 N ATOM 928 CA GLY A 465 13.251 6.215 -4.517 1.00 0.00 C ATOM 929 C GLY A 465 14.759 6.103 -4.412 1.00 0.00 C ATOM 930 O GLY A 465 15.300 5.629 -3.414 1.00 0.00 O ATOM 0 H GLY A 465 12.379 6.419 -2.623 1.00 0.00 H new ATOM 0 HA2 GLY A 465 12.908 5.660 -5.390 1.00 0.00 H new ATOM 0 HA3 GLY A 465 12.977 7.258 -4.675 1.00 0.00 H new ATOM 934 N PRO A 466 15.464 6.547 -5.464 1.00 0.00 N ATOM 935 CA PRO A 466 16.928 6.504 -5.511 1.00 0.00 C ATOM 936 C PRO A 466 17.568 7.491 -4.541 1.00 0.00 C ATOM 937 O PRO A 466 18.745 7.370 -4.203 1.00 0.00 O ATOM 938 CB PRO A 466 17.248 6.891 -6.957 1.00 0.00 C ATOM 939 CG PRO A 466 16.078 7.699 -7.401 1.00 0.00 C ATOM 940 CD PRO A 466 14.884 7.125 -6.688 1.00 0.00 C ATOM 0 HA PRO A 466 17.317 5.528 -5.221 1.00 0.00 H new ATOM 0 HB2 PRO A 466 18.172 7.466 -7.018 1.00 0.00 H new ATOM 0 HB3 PRO A 466 17.380 6.009 -7.583 1.00 0.00 H new ATOM 0 HG2 PRO A 466 16.213 8.751 -7.151 1.00 0.00 H new ATOM 0 HG3 PRO A 466 15.952 7.642 -8.482 1.00 0.00 H new ATOM 0 HD2 PRO A 466 14.145 7.893 -6.459 1.00 0.00 H new ATOM 0 HD3 PRO A 466 14.381 6.369 -7.291 1.00 0.00 H new ATOM 948 N ASN A 467 16.785 8.469 -4.096 1.00 0.00 N ATOM 949 CA ASN A 467 17.276 9.478 -3.165 1.00 0.00 C ATOM 950 C ASN A 467 16.977 9.079 -1.723 1.00 0.00 C ATOM 951 O ASN A 467 16.674 9.925 -0.884 1.00 0.00 O ATOM 952 CB ASN A 467 16.643 10.837 -3.471 1.00 0.00 C ATOM 953 CG ASN A 467 16.456 11.065 -4.959 1.00 0.00 C ATOM 954 OD1 ASN A 467 17.420 11.067 -5.724 1.00 0.00 O ATOM 955 ND2 ASN A 467 15.210 11.259 -5.375 1.00 0.00 N ATOM 0 H ASN A 467 15.808 8.584 -4.365 1.00 0.00 H new ATOM 0 HA ASN A 467 18.357 9.553 -3.287 1.00 0.00 H new ATOM 0 HB2 ASN A 467 15.677 10.906 -2.971 1.00 0.00 H new ATOM 0 HB3 ASN A 467 17.271 11.628 -3.061 1.00 0.00 H new ATOM 0 HD21 ASN A 467 15.022 11.418 -6.365 1.00 0.00 H new ATOM 0 HD22 ASN A 467 14.441 11.249 -4.705 1.00 0.00 H new ATOM 962 N GLY A 468 17.067 7.782 -1.443 1.00 0.00 N ATOM 963 CA GLY A 468 16.803 7.293 -0.102 1.00 0.00 C ATOM 964 C GLY A 468 15.522 7.856 0.479 1.00 0.00 C ATOM 965 O GLY A 468 15.462 8.189 1.663 1.00 0.00 O ATOM 0 H GLY A 468 17.318 7.062 -2.120 1.00 0.00 H new ATOM 0 HA2 GLY A 468 16.742 6.205 -0.121 1.00 0.00 H new ATOM 0 HA3 GLY A 468 17.638 7.554 0.548 1.00 0.00 H new ATOM 969 N LYS A 469 14.493 7.965 -0.354 1.00 0.00 N ATOM 970 CA LYS A 469 13.206 8.493 0.082 1.00 0.00 C ATOM 971 C LYS A 469 12.083 7.505 -0.216 1.00 0.00 C ATOM 972 O LYS A 469 12.314 6.447 -0.802 1.00 0.00 O ATOM 973 CB LYS A 469 12.920 9.830 -0.605 1.00 0.00 C ATOM 974 CG LYS A 469 13.641 11.007 0.029 1.00 0.00 C ATOM 975 CD LYS A 469 13.083 12.332 -0.462 1.00 0.00 C ATOM 976 CE LYS A 469 13.286 13.436 0.564 1.00 0.00 C ATOM 977 NZ LYS A 469 14.729 13.693 0.825 1.00 0.00 N ATOM 0 H LYS A 469 14.526 7.694 -1.337 1.00 0.00 H new ATOM 0 HA LYS A 469 13.252 8.649 1.160 1.00 0.00 H new ATOM 0 HB2 LYS A 469 13.210 9.759 -1.653 1.00 0.00 H new ATOM 0 HB3 LYS A 469 11.847 10.018 -0.583 1.00 0.00 H new ATOM 0 HG2 LYS A 469 13.547 10.951 1.114 1.00 0.00 H new ATOM 0 HG3 LYS A 469 14.705 10.951 -0.202 1.00 0.00 H new ATOM 0 HD2 LYS A 469 13.570 12.609 -1.397 1.00 0.00 H new ATOM 0 HD3 LYS A 469 12.020 12.223 -0.676 1.00 0.00 H new ATOM 0 HE2 LYS A 469 12.812 14.352 0.210 1.00 0.00 H new ATOM 0 HE3 LYS A 469 12.792 13.161 1.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 14.826 14.497 1.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 15.161 12.848 1.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 15.210 13.914 -0.070 1.00 0.00 H new ATOM 991 N ALA A 470 10.868 7.857 0.189 1.00 0.00 N ATOM 992 CA ALA A 470 9.709 7.003 -0.039 1.00 0.00 C ATOM 993 C ALA A 470 8.917 7.465 -1.258 1.00 0.00 C ATOM 994 O ALA A 470 8.372 8.569 -1.276 1.00 0.00 O ATOM 995 CB ALA A 470 8.818 6.982 1.195 1.00 0.00 C ATOM 0 H ALA A 470 10.660 8.728 0.677 1.00 0.00 H new ATOM 0 HA ALA A 470 10.067 5.992 -0.233 1.00 0.00 H new ATOM 0 HB1 ALA A 470 7.956 6.340 1.011 1.00 0.00 H new ATOM 0 HB2 ALA A 470 9.382 6.597 2.045 1.00 0.00 H new ATOM 0 HB3 ALA A 470 8.477 7.994 1.415 1.00 0.00 H new ATOM 1001 N THR A 471 8.858 6.613 -2.277 1.00 0.00 N ATOM 1002 CA THR A 471 8.135 6.934 -3.501 1.00 0.00 C ATOM 1003 C THR A 471 6.687 7.307 -3.202 1.00 0.00 C ATOM 1004 O THR A 471 6.138 8.232 -3.799 1.00 0.00 O ATOM 1005 CB THR A 471 8.156 5.755 -4.492 1.00 0.00 C ATOM 1006 OG1 THR A 471 7.386 4.665 -3.973 1.00 0.00 O ATOM 1007 CG2 THR A 471 9.582 5.295 -4.755 1.00 0.00 C ATOM 0 H THR A 471 9.303 5.695 -2.278 1.00 0.00 H new ATOM 0 HA THR A 471 8.641 7.787 -3.953 1.00 0.00 H new ATOM 0 HB THR A 471 7.720 6.092 -5.433 1.00 0.00 H new ATOM 0 HG1 THR A 471 7.000 4.155 -4.715 1.00 0.00 H new ATOM 0 HG21 THR A 471 9.572 4.462 -5.458 1.00 0.00 H new ATOM 0 HG22 THR A 471 10.158 6.119 -5.177 1.00 0.00 H new ATOM 0 HG23 THR A 471 10.039 4.975 -3.819 1.00 0.00 H new ATOM 1015 N GLY A 472 6.074 6.580 -2.273 1.00 0.00 N ATOM 1016 CA GLY A 472 4.694 6.850 -1.911 1.00 0.00 C ATOM 1017 C GLY A 472 3.782 5.670 -2.181 1.00 0.00 C ATOM 1018 O GLY A 472 2.587 5.843 -2.415 1.00 0.00 O ATOM 0 H GLY A 472 6.508 5.809 -1.765 1.00 0.00 H new ATOM 0 HA2 GLY A 472 4.643 7.110 -0.854 1.00 0.00 H new ATOM 0 HA3 GLY A 472 4.338 7.716 -2.469 1.00 0.00 H new ATOM 1022 N GLU A 473 4.348 4.468 -2.149 1.00 0.00 N ATOM 1023 CA GLU A 473 3.577 3.255 -2.395 1.00 0.00 C ATOM 1024 C GLU A 473 3.850 2.209 -1.318 1.00 0.00 C ATOM 1025 O GLU A 473 4.964 1.700 -1.200 1.00 0.00 O ATOM 1026 CB GLU A 473 3.911 2.682 -3.774 1.00 0.00 C ATOM 1027 CG GLU A 473 3.733 3.680 -4.907 1.00 0.00 C ATOM 1028 CD GLU A 473 4.424 3.242 -6.183 1.00 0.00 C ATOM 1029 OE1 GLU A 473 4.026 2.202 -6.747 1.00 0.00 O ATOM 1030 OE2 GLU A 473 5.363 3.941 -6.619 1.00 0.00 O ATOM 0 H GLU A 473 5.337 4.308 -1.955 1.00 0.00 H new ATOM 0 HA GLU A 473 2.519 3.516 -2.364 1.00 0.00 H new ATOM 0 HB2 GLU A 473 4.942 2.328 -3.771 1.00 0.00 H new ATOM 0 HB3 GLU A 473 3.277 1.815 -3.961 1.00 0.00 H new ATOM 0 HG2 GLU A 473 2.669 3.816 -5.102 1.00 0.00 H new ATOM 0 HG3 GLU A 473 4.127 4.648 -4.599 1.00 0.00 H new ATOM 1037 N GLY A 474 2.824 1.893 -0.534 1.00 0.00 N ATOM 1038 CA GLY A 474 2.973 0.910 0.523 1.00 0.00 C ATOM 1039 C GLY A 474 2.049 -0.278 0.345 1.00 0.00 C ATOM 1040 O GLY A 474 1.074 -0.209 -0.404 1.00 0.00 O ATOM 0 H GLY A 474 1.892 2.300 -0.612 1.00 0.00 H new ATOM 0 HA2 GLY A 474 4.006 0.562 0.548 1.00 0.00 H new ATOM 0 HA3 GLY A 474 2.772 1.382 1.485 1.00 0.00 H new ATOM 1044 N PHE A 475 2.354 -1.372 1.035 1.00 0.00 N ATOM 1045 CA PHE A 475 1.545 -2.582 0.947 1.00 0.00 C ATOM 1046 C PHE A 475 1.481 -3.292 2.296 1.00 0.00 C ATOM 1047 O PHE A 475 2.473 -3.360 3.022 1.00 0.00 O ATOM 1048 CB PHE A 475 2.114 -3.527 -0.113 1.00 0.00 C ATOM 1049 CG PHE A 475 2.427 -2.847 -1.415 1.00 0.00 C ATOM 1050 CD1 PHE A 475 3.668 -2.267 -1.629 1.00 0.00 C ATOM 1051 CD2 PHE A 475 1.481 -2.787 -2.426 1.00 0.00 C ATOM 1052 CE1 PHE A 475 3.959 -1.641 -2.826 1.00 0.00 C ATOM 1053 CE2 PHE A 475 1.767 -2.163 -3.625 1.00 0.00 C ATOM 1054 CZ PHE A 475 3.007 -1.588 -3.825 1.00 0.00 C ATOM 0 H PHE A 475 3.156 -1.445 1.661 1.00 0.00 H new ATOM 0 HA PHE A 475 0.534 -2.293 0.660 1.00 0.00 H new ATOM 0 HB2 PHE A 475 3.022 -3.990 0.274 1.00 0.00 H new ATOM 0 HB3 PHE A 475 1.399 -4.330 -0.294 1.00 0.00 H new ATOM 0 HD1 PHE A 475 4.416 -2.305 -0.851 1.00 0.00 H new ATOM 0 HD2 PHE A 475 0.509 -3.233 -2.275 1.00 0.00 H new ATOM 0 HE1 PHE A 475 4.930 -1.194 -2.980 1.00 0.00 H new ATOM 0 HE2 PHE A 475 1.022 -2.125 -4.405 1.00 0.00 H new ATOM 0 HZ PHE A 475 3.232 -1.098 -4.761 1.00 0.00 H new ATOM 1064 N VAL A 476 0.307 -3.821 2.626 1.00 0.00 N ATOM 1065 CA VAL A 476 0.112 -4.527 3.886 1.00 0.00 C ATOM 1066 C VAL A 476 -0.704 -5.798 3.684 1.00 0.00 C ATOM 1067 O VAL A 476 -1.571 -5.858 2.813 1.00 0.00 O ATOM 1068 CB VAL A 476 -0.594 -3.636 4.926 1.00 0.00 C ATOM 1069 CG1 VAL A 476 -1.225 -4.486 6.017 1.00 0.00 C ATOM 1070 CG2 VAL A 476 0.384 -2.632 5.518 1.00 0.00 C ATOM 0 H VAL A 476 -0.524 -3.774 2.037 1.00 0.00 H new ATOM 0 HA VAL A 476 1.102 -4.790 4.257 1.00 0.00 H new ATOM 0 HB VAL A 476 -1.389 -3.083 4.426 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -1.719 -3.839 6.742 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -1.958 -5.161 5.574 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -0.451 -5.068 6.518 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -0.131 -2.011 6.251 1.00 0.00 H new ATOM 0 HG22 VAL A 476 1.202 -3.164 6.004 1.00 0.00 H new ATOM 0 HG23 VAL A 476 0.783 -2.001 4.724 1.00 0.00 H new ATOM 1080 N GLU A 477 -0.422 -6.812 4.496 1.00 0.00 N ATOM 1081 CA GLU A 477 -1.131 -8.083 4.405 1.00 0.00 C ATOM 1082 C GLU A 477 -1.723 -8.473 5.757 1.00 0.00 C ATOM 1083 O GLU A 477 -1.002 -8.621 6.744 1.00 0.00 O ATOM 1084 CB GLU A 477 -0.190 -9.183 3.912 1.00 0.00 C ATOM 1085 CG GLU A 477 -0.800 -10.574 3.963 1.00 0.00 C ATOM 1086 CD GLU A 477 -0.020 -11.583 3.143 1.00 0.00 C ATOM 1087 OE1 GLU A 477 0.514 -11.200 2.081 1.00 0.00 O ATOM 1088 OE2 GLU A 477 0.055 -12.757 3.563 1.00 0.00 O ATOM 0 H GLU A 477 0.292 -6.778 5.224 1.00 0.00 H new ATOM 0 HA GLU A 477 -1.946 -7.965 3.691 1.00 0.00 H new ATOM 0 HB2 GLU A 477 0.107 -8.963 2.887 1.00 0.00 H new ATOM 0 HB3 GLU A 477 0.717 -9.171 4.516 1.00 0.00 H new ATOM 0 HG2 GLU A 477 -0.844 -10.910 4.999 1.00 0.00 H new ATOM 0 HG3 GLU A 477 -1.826 -10.530 3.598 1.00 0.00 H new ATOM 1095 N PHE A 478 -3.042 -8.637 5.793 1.00 0.00 N ATOM 1096 CA PHE A 478 -3.732 -9.009 7.023 1.00 0.00 C ATOM 1097 C PHE A 478 -3.911 -10.522 7.110 1.00 0.00 C ATOM 1098 O PHE A 478 -4.662 -11.115 6.336 1.00 0.00 O ATOM 1099 CB PHE A 478 -5.095 -8.318 7.096 1.00 0.00 C ATOM 1100 CG PHE A 478 -5.010 -6.819 7.066 1.00 0.00 C ATOM 1101 CD1 PHE A 478 -4.503 -6.119 8.149 1.00 0.00 C ATOM 1102 CD2 PHE A 478 -5.435 -6.109 5.955 1.00 0.00 C ATOM 1103 CE1 PHE A 478 -4.424 -4.739 8.125 1.00 0.00 C ATOM 1104 CE2 PHE A 478 -5.358 -4.730 5.924 1.00 0.00 C ATOM 1105 CZ PHE A 478 -4.851 -4.044 7.010 1.00 0.00 C ATOM 0 H PHE A 478 -3.654 -8.518 4.985 1.00 0.00 H new ATOM 0 HA PHE A 478 -3.122 -8.684 7.866 1.00 0.00 H new ATOM 0 HB2 PHE A 478 -5.710 -8.656 6.262 1.00 0.00 H new ATOM 0 HB3 PHE A 478 -5.601 -8.627 8.010 1.00 0.00 H new ATOM 0 HD1 PHE A 478 -4.166 -6.658 9.022 1.00 0.00 H new ATOM 0 HD2 PHE A 478 -5.832 -6.640 5.102 1.00 0.00 H new ATOM 0 HE1 PHE A 478 -4.029 -4.205 8.977 1.00 0.00 H new ATOM 0 HE2 PHE A 478 -5.694 -4.189 5.052 1.00 0.00 H new ATOM 0 HZ PHE A 478 -4.788 -2.966 6.988 1.00 0.00 H new ATOM 1115 N ARG A 479 -3.214 -11.140 8.059 1.00 0.00 N ATOM 1116 CA ARG A 479 -3.294 -12.583 8.247 1.00 0.00 C ATOM 1117 C ARG A 479 -4.745 -13.054 8.239 1.00 0.00 C ATOM 1118 O ARG A 479 -5.080 -14.055 7.607 1.00 0.00 O ATOM 1119 CB ARG A 479 -2.624 -12.985 9.563 1.00 0.00 C ATOM 1120 CG ARG A 479 -1.124 -12.740 9.582 1.00 0.00 C ATOM 1121 CD ARG A 479 -0.429 -13.623 10.606 1.00 0.00 C ATOM 1122 NE ARG A 479 -0.177 -14.966 10.090 1.00 0.00 N ATOM 1123 CZ ARG A 479 -1.001 -15.991 10.278 1.00 0.00 C ATOM 1124 NH1 ARG A 479 -2.122 -15.828 10.965 1.00 0.00 N ATOM 1125 NH2 ARG A 479 -0.703 -17.183 9.776 1.00 0.00 N ATOM 0 H ARG A 479 -2.588 -10.664 8.709 1.00 0.00 H new ATOM 0 HA ARG A 479 -2.771 -13.061 7.419 1.00 0.00 H new ATOM 0 HB2 ARG A 479 -3.085 -12.430 10.380 1.00 0.00 H new ATOM 0 HB3 ARG A 479 -2.813 -14.042 9.749 1.00 0.00 H new ATOM 0 HG2 ARG A 479 -0.710 -12.933 8.592 1.00 0.00 H new ATOM 0 HG3 ARG A 479 -0.928 -11.692 9.810 1.00 0.00 H new ATOM 0 HD2 ARG A 479 0.515 -13.164 10.899 1.00 0.00 H new ATOM 0 HD3 ARG A 479 -1.043 -13.689 11.504 1.00 0.00 H new ATOM 0 HE ARG A 479 0.678 -15.125 9.557 1.00 0.00 H new ATOM 0 HH11 ARG A 479 -2.355 -14.913 11.352 1.00 0.00 H new ATOM 0 HH12 ARG A 479 -2.752 -16.617 11.107 1.00 0.00 H new ATOM 0 HH21 ARG A 479 0.159 -17.312 9.246 1.00 0.00 H new ATOM 0 HH22 ARG A 479 -1.336 -17.970 9.920 1.00 0.00 H new ATOM 1139 N ASN A 480 -5.603 -12.323 8.944 1.00 0.00 N ATOM 1140 CA ASN A 480 -7.018 -12.666 9.019 1.00 0.00 C ATOM 1141 C ASN A 480 -7.799 -12.001 7.889 1.00 0.00 C ATOM 1142 O ASN A 480 -7.282 -11.127 7.195 1.00 0.00 O ATOM 1143 CB ASN A 480 -7.596 -12.244 10.371 1.00 0.00 C ATOM 1144 CG ASN A 480 -6.690 -12.615 11.528 1.00 0.00 C ATOM 1145 OD1 ASN A 480 -6.202 -11.608 12.244 1.00 0.00 O flip ATOM 1146 ND2 ASN A 480 -6.432 -13.793 11.776 1.00 0.00 N flip ATOM 0 H ASN A 480 -5.343 -11.490 9.471 1.00 0.00 H new ATOM 0 HA ASN A 480 -7.110 -13.747 8.914 1.00 0.00 H new ATOM 0 HB2 ASN A 480 -7.760 -11.166 10.373 1.00 0.00 H new ATOM 0 HB3 ASN A 480 -8.569 -12.715 10.510 1.00 0.00 H new ATOM 0 HD21 ASN A 480 -6.829 -14.534 11.199 1.00 0.00 H new ATOM 0 HD22 ASN A 480 -5.821 -14.027 12.558 1.00 0.00 H new ATOM 1153 N GLU A 481 -9.048 -12.422 7.712 1.00 0.00 N ATOM 1154 CA GLU A 481 -9.899 -11.867 6.667 1.00 0.00 C ATOM 1155 C GLU A 481 -10.856 -10.826 7.240 1.00 0.00 C ATOM 1156 O GLU A 481 -11.155 -9.821 6.597 1.00 0.00 O ATOM 1157 CB GLU A 481 -10.692 -12.981 5.979 1.00 0.00 C ATOM 1158 CG GLU A 481 -11.558 -12.492 4.831 1.00 0.00 C ATOM 1159 CD GLU A 481 -12.510 -13.558 4.323 1.00 0.00 C ATOM 1160 OE1 GLU A 481 -13.629 -13.661 4.868 1.00 0.00 O ATOM 1161 OE2 GLU A 481 -12.136 -14.288 3.382 1.00 0.00 O ATOM 0 H GLU A 481 -9.492 -13.145 8.278 1.00 0.00 H new ATOM 0 HA GLU A 481 -9.258 -11.380 5.932 1.00 0.00 H new ATOM 0 HB2 GLU A 481 -9.997 -13.732 5.604 1.00 0.00 H new ATOM 0 HB3 GLU A 481 -11.326 -13.473 6.717 1.00 0.00 H new ATOM 0 HG2 GLU A 481 -12.131 -11.624 5.157 1.00 0.00 H new ATOM 0 HG3 GLU A 481 -10.918 -12.162 4.013 1.00 0.00 H new ATOM 1168 N ALA A 482 -11.335 -11.076 8.455 1.00 0.00 N ATOM 1169 CA ALA A 482 -12.256 -10.161 9.116 1.00 0.00 C ATOM 1170 C ALA A 482 -11.651 -8.767 9.240 1.00 0.00 C ATOM 1171 O ALA A 482 -12.299 -7.768 8.925 1.00 0.00 O ATOM 1172 CB ALA A 482 -12.639 -10.697 10.488 1.00 0.00 C ATOM 0 H ALA A 482 -11.100 -11.905 9.001 1.00 0.00 H new ATOM 0 HA ALA A 482 -13.155 -10.085 8.504 1.00 0.00 H new ATOM 0 HB1 ALA A 482 -13.327 -10.003 10.970 1.00 0.00 H new ATOM 0 HB2 ALA A 482 -13.121 -11.668 10.378 1.00 0.00 H new ATOM 0 HB3 ALA A 482 -11.743 -10.804 11.100 1.00 0.00 H new ATOM 1178 N ASP A 483 -10.407 -8.706 9.702 1.00 0.00 N ATOM 1179 CA ASP A 483 -9.714 -7.434 9.867 1.00 0.00 C ATOM 1180 C ASP A 483 -9.393 -6.810 8.513 1.00 0.00 C ATOM 1181 O ASP A 483 -9.402 -5.588 8.363 1.00 0.00 O ATOM 1182 CB ASP A 483 -8.427 -7.630 10.670 1.00 0.00 C ATOM 1183 CG ASP A 483 -7.294 -8.174 9.823 1.00 0.00 C ATOM 1184 OD1 ASP A 483 -7.550 -9.072 8.994 1.00 0.00 O ATOM 1185 OD2 ASP A 483 -6.150 -7.700 9.988 1.00 0.00 O ATOM 0 H ASP A 483 -9.858 -9.523 9.969 1.00 0.00 H new ATOM 0 HA ASP A 483 -10.373 -6.758 10.411 1.00 0.00 H new ATOM 0 HB2 ASP A 483 -8.126 -6.678 11.106 1.00 0.00 H new ATOM 0 HB3 ASP A 483 -8.619 -8.313 11.497 1.00 0.00 H new ATOM 1190 N TYR A 484 -9.109 -7.656 7.529 1.00 0.00 N ATOM 1191 CA TYR A 484 -8.781 -7.188 6.188 1.00 0.00 C ATOM 1192 C TYR A 484 -9.874 -6.269 5.650 1.00 0.00 C ATOM 1193 O TYR A 484 -9.598 -5.164 5.181 1.00 0.00 O ATOM 1194 CB TYR A 484 -8.588 -8.376 5.243 1.00 0.00 C ATOM 1195 CG TYR A 484 -8.870 -8.049 3.794 1.00 0.00 C ATOM 1196 CD1 TYR A 484 -8.060 -7.167 3.090 1.00 0.00 C ATOM 1197 CD2 TYR A 484 -9.947 -8.623 3.130 1.00 0.00 C ATOM 1198 CE1 TYR A 484 -8.315 -6.865 1.766 1.00 0.00 C ATOM 1199 CE2 TYR A 484 -10.208 -8.328 1.805 1.00 0.00 C ATOM 1200 CZ TYR A 484 -9.390 -7.448 1.128 1.00 0.00 C ATOM 1201 OH TYR A 484 -9.646 -7.151 -0.191 1.00 0.00 O ATOM 0 H TYR A 484 -9.099 -8.670 7.635 1.00 0.00 H new ATOM 0 HA TYR A 484 -7.851 -6.623 6.245 1.00 0.00 H new ATOM 0 HB2 TYR A 484 -7.564 -8.738 5.332 1.00 0.00 H new ATOM 0 HB3 TYR A 484 -9.242 -9.189 5.557 1.00 0.00 H new ATOM 0 HD1 TYR A 484 -7.217 -6.710 3.586 1.00 0.00 H new ATOM 0 HD2 TYR A 484 -10.591 -9.311 3.658 1.00 0.00 H new ATOM 0 HE1 TYR A 484 -7.676 -6.176 1.234 1.00 0.00 H new ATOM 0 HE2 TYR A 484 -11.048 -8.784 1.303 1.00 0.00 H new ATOM 0 HH TYR A 484 -10.437 -7.646 -0.490 1.00 0.00 H new ATOM 1211 N LYS A 485 -11.117 -6.732 5.723 1.00 0.00 N ATOM 1212 CA LYS A 485 -12.253 -5.954 5.246 1.00 0.00 C ATOM 1213 C LYS A 485 -12.249 -4.555 5.855 1.00 0.00 C ATOM 1214 O LYS A 485 -12.535 -3.571 5.174 1.00 0.00 O ATOM 1215 CB LYS A 485 -13.565 -6.665 5.587 1.00 0.00 C ATOM 1216 CG LYS A 485 -13.704 -8.030 4.934 1.00 0.00 C ATOM 1217 CD LYS A 485 -15.022 -8.691 5.298 1.00 0.00 C ATOM 1218 CE LYS A 485 -15.355 -9.832 4.349 1.00 0.00 C ATOM 1219 NZ LYS A 485 -16.614 -10.527 4.737 1.00 0.00 N ATOM 0 H LYS A 485 -11.363 -7.644 6.109 1.00 0.00 H new ATOM 0 HA LYS A 485 -12.168 -5.861 4.163 1.00 0.00 H new ATOM 0 HB2 LYS A 485 -13.636 -6.780 6.669 1.00 0.00 H new ATOM 0 HB3 LYS A 485 -14.400 -6.037 5.278 1.00 0.00 H new ATOM 0 HG2 LYS A 485 -13.636 -7.925 3.851 1.00 0.00 H new ATOM 0 HG3 LYS A 485 -12.877 -8.669 5.245 1.00 0.00 H new ATOM 0 HD2 LYS A 485 -14.971 -9.069 6.319 1.00 0.00 H new ATOM 0 HD3 LYS A 485 -15.821 -7.950 5.272 1.00 0.00 H new ATOM 0 HE2 LYS A 485 -15.452 -9.444 3.335 1.00 0.00 H new ATOM 0 HE3 LYS A 485 -14.533 -10.548 4.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 -16.806 -11.298 4.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 -16.513 -10.919 5.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 -17.403 -9.850 4.722 1.00 0.00 H new ATOM 1233 N ALA A 486 -11.920 -4.475 7.140 1.00 0.00 N ATOM 1234 CA ALA A 486 -11.874 -3.197 7.839 1.00 0.00 C ATOM 1235 C ALA A 486 -10.918 -2.229 7.151 1.00 0.00 C ATOM 1236 O ALA A 486 -11.282 -1.095 6.844 1.00 0.00 O ATOM 1237 CB ALA A 486 -11.467 -3.404 9.290 1.00 0.00 C ATOM 0 H ALA A 486 -11.681 -5.281 7.718 1.00 0.00 H new ATOM 0 HA ALA A 486 -12.872 -2.760 7.812 1.00 0.00 H new ATOM 0 HB1 ALA A 486 -11.437 -2.441 9.800 1.00 0.00 H new ATOM 0 HB2 ALA A 486 -12.192 -4.053 9.782 1.00 0.00 H new ATOM 0 HB3 ALA A 486 -10.481 -3.866 9.329 1.00 0.00 H new ATOM 1243 N ALA A 487 -9.692 -2.685 6.914 1.00 0.00 N ATOM 1244 CA ALA A 487 -8.683 -1.859 6.261 1.00 0.00 C ATOM 1245 C ALA A 487 -9.279 -1.091 5.086 1.00 0.00 C ATOM 1246 O ALA A 487 -9.006 0.096 4.905 1.00 0.00 O ATOM 1247 CB ALA A 487 -7.518 -2.719 5.796 1.00 0.00 C ATOM 0 H ALA A 487 -9.374 -3.621 7.164 1.00 0.00 H new ATOM 0 HA ALA A 487 -8.317 -1.133 6.987 1.00 0.00 H new ATOM 0 HB1 ALA A 487 -6.772 -2.090 5.310 1.00 0.00 H new ATOM 0 HB2 ALA A 487 -7.068 -3.218 6.655 1.00 0.00 H new ATOM 0 HB3 ALA A 487 -7.877 -3.467 5.089 1.00 0.00 H new ATOM 1253 N LEU A 488 -10.092 -1.776 4.290 1.00 0.00 N ATOM 1254 CA LEU A 488 -10.726 -1.158 3.130 1.00 0.00 C ATOM 1255 C LEU A 488 -11.558 0.052 3.545 1.00 0.00 C ATOM 1256 O LEU A 488 -11.633 1.044 2.818 1.00 0.00 O ATOM 1257 CB LEU A 488 -11.610 -2.174 2.405 1.00 0.00 C ATOM 1258 CG LEU A 488 -10.886 -3.163 1.492 1.00 0.00 C ATOM 1259 CD1 LEU A 488 -9.948 -2.428 0.547 1.00 0.00 C ATOM 1260 CD2 LEU A 488 -10.119 -4.188 2.316 1.00 0.00 C ATOM 0 H LEU A 488 -10.328 -2.759 4.426 1.00 0.00 H new ATOM 0 HA LEU A 488 -9.940 -0.822 2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 488 -12.166 -2.740 3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 488 -12.342 -1.629 1.809 1.00 0.00 H new ATOM 0 HG LEU A 488 -11.631 -3.690 0.896 1.00 0.00 H new ATOM 0 HD11 LEU A 488 -9.441 -3.148 -0.095 1.00 0.00 H new ATOM 0 HD12 LEU A 488 -10.521 -1.734 -0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 488 -9.209 -1.875 1.126 1.00 0.00 H new ATOM 0 HD21 LEU A 488 -9.610 -4.884 1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 488 -9.384 -3.678 2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -10.814 -4.737 2.952 1.00 0.00 H new ATOM 1272 N CYS A 489 -12.178 -0.036 4.716 1.00 0.00 N ATOM 1273 CA CYS A 489 -13.003 1.052 5.228 1.00 0.00 C ATOM 1274 C CYS A 489 -12.139 2.236 5.653 1.00 0.00 C ATOM 1275 O CYS A 489 -12.654 3.278 6.060 1.00 0.00 O ATOM 1276 CB CYS A 489 -13.845 0.569 6.410 1.00 0.00 C ATOM 1277 SG CYS A 489 -15.080 1.763 6.974 1.00 0.00 S ATOM 0 H CYS A 489 -12.125 -0.850 5.329 1.00 0.00 H new ATOM 0 HA CYS A 489 -13.667 1.379 4.428 1.00 0.00 H new ATOM 0 HB2 CYS A 489 -14.351 -0.355 6.129 1.00 0.00 H new ATOM 0 HB3 CYS A 489 -13.181 0.329 7.241 1.00 0.00 H new ATOM 0 HG CYS A 489 -14.609 2.968 6.845 1.00 0.00 H new ATOM 1283 N ARG A 490 -10.825 2.066 5.558 1.00 0.00 N ATOM 1284 CA ARG A 490 -9.890 3.119 5.935 1.00 0.00 C ATOM 1285 C ARG A 490 -9.633 4.064 4.765 1.00 0.00 C ATOM 1286 O ARG A 490 -8.655 4.812 4.759 1.00 0.00 O ATOM 1287 CB ARG A 490 -8.569 2.511 6.412 1.00 0.00 C ATOM 1288 CG ARG A 490 -8.729 1.539 7.569 1.00 0.00 C ATOM 1289 CD ARG A 490 -8.614 2.245 8.911 1.00 0.00 C ATOM 1290 NE ARG A 490 -7.458 3.136 8.963 1.00 0.00 N ATOM 1291 CZ ARG A 490 -7.363 4.169 9.792 1.00 0.00 C ATOM 1292 NH1 ARG A 490 -8.351 4.440 10.634 1.00 0.00 N ATOM 1293 NH2 ARG A 490 -6.279 4.933 9.781 1.00 0.00 N ATOM 0 H ARG A 490 -10.384 1.210 5.223 1.00 0.00 H new ATOM 0 HA ARG A 490 -10.335 3.690 6.750 1.00 0.00 H new ATOM 0 HB2 ARG A 490 -8.094 1.995 5.578 1.00 0.00 H new ATOM 0 HB3 ARG A 490 -7.897 3.314 6.714 1.00 0.00 H new ATOM 0 HG2 ARG A 490 -9.698 1.045 7.499 1.00 0.00 H new ATOM 0 HG3 ARG A 490 -7.969 0.761 7.500 1.00 0.00 H new ATOM 0 HD2 ARG A 490 -9.522 2.818 9.098 1.00 0.00 H new ATOM 0 HD3 ARG A 490 -8.536 1.503 9.706 1.00 0.00 H new ATOM 0 HE ARG A 490 -6.681 2.955 8.328 1.00 0.00 H new ATOM 0 HH11 ARG A 490 -9.186 3.854 10.646 1.00 0.00 H new ATOM 0 HH12 ARG A 490 -8.276 5.234 11.270 1.00 0.00 H new ATOM 0 HH21 ARG A 490 -5.517 4.727 9.135 1.00 0.00 H new ATOM 0 HH22 ARG A 490 -6.208 5.726 10.418 1.00 0.00 H new ATOM 1307 N HIS A 491 -10.519 4.025 3.774 1.00 0.00 N ATOM 1308 CA HIS A 491 -10.389 4.878 2.598 1.00 0.00 C ATOM 1309 C HIS A 491 -10.619 6.342 2.960 1.00 0.00 C ATOM 1310 O HIS A 491 -11.354 6.653 3.898 1.00 0.00 O ATOM 1311 CB HIS A 491 -11.381 4.446 1.517 1.00 0.00 C ATOM 1312 CG HIS A 491 -11.240 5.209 0.236 1.00 0.00 C ATOM 1313 ND1 HIS A 491 -10.019 5.579 -0.289 1.00 0.00 N ATOM 1314 CD2 HIS A 491 -12.174 5.669 -0.628 1.00 0.00 C ATOM 1315 CE1 HIS A 491 -10.210 6.236 -1.419 1.00 0.00 C ATOM 1316 NE2 HIS A 491 -11.509 6.304 -1.648 1.00 0.00 N ATOM 0 H HIS A 491 -11.334 3.412 3.762 1.00 0.00 H new ATOM 0 HA HIS A 491 -9.375 4.772 2.213 1.00 0.00 H new ATOM 0 HB2 HIS A 491 -11.245 3.384 1.314 1.00 0.00 H new ATOM 0 HB3 HIS A 491 -12.396 4.571 1.895 1.00 0.00 H new ATOM 0 HD2 HIS A 491 -13.244 5.557 -0.533 1.00 0.00 H new ATOM 0 HE1 HIS A 491 -9.435 6.648 -2.049 1.00 0.00 H new ATOM 0 HE2 HIS A 491 -11.947 6.755 -2.451 1.00 0.00 H new ATOM 1325 N LYS A 492 -9.984 7.238 2.212 1.00 0.00 N ATOM 1326 CA LYS A 492 -10.118 8.669 2.453 1.00 0.00 C ATOM 1327 C LYS A 492 -9.592 9.040 3.836 1.00 0.00 C ATOM 1328 O LYS A 492 -10.285 9.690 4.619 1.00 0.00 O ATOM 1329 CB LYS A 492 -11.583 9.094 2.322 1.00 0.00 C ATOM 1330 CG LYS A 492 -12.158 8.875 0.934 1.00 0.00 C ATOM 1331 CD LYS A 492 -11.779 10.003 -0.011 1.00 0.00 C ATOM 1332 CE LYS A 492 -11.741 9.530 -1.456 1.00 0.00 C ATOM 1333 NZ LYS A 492 -11.650 10.669 -2.411 1.00 0.00 N ATOM 0 H LYS A 492 -9.371 6.998 1.433 1.00 0.00 H new ATOM 0 HA LYS A 492 -9.525 9.195 1.705 1.00 0.00 H new ATOM 0 HB2 LYS A 492 -12.180 8.538 3.045 1.00 0.00 H new ATOM 0 HB3 LYS A 492 -11.671 10.149 2.580 1.00 0.00 H new ATOM 0 HG2 LYS A 492 -11.796 7.928 0.535 1.00 0.00 H new ATOM 0 HG3 LYS A 492 -13.244 8.801 0.996 1.00 0.00 H new ATOM 0 HD2 LYS A 492 -12.496 10.818 0.087 1.00 0.00 H new ATOM 0 HD3 LYS A 492 -10.804 10.401 0.268 1.00 0.00 H new ATOM 0 HE2 LYS A 492 -10.887 8.867 -1.599 1.00 0.00 H new ATOM 0 HE3 LYS A 492 -12.636 8.947 -1.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 -11.626 10.305 -3.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 -12.477 11.288 -2.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 -10.783 11.211 -2.223 1.00 0.00 H new ATOM 1347 N GLN A 493 -8.365 8.624 4.129 1.00 0.00 N ATOM 1348 CA GLN A 493 -7.747 8.913 5.417 1.00 0.00 C ATOM 1349 C GLN A 493 -6.469 9.726 5.238 1.00 0.00 C ATOM 1350 O GLN A 493 -5.757 9.571 4.245 1.00 0.00 O ATOM 1351 CB GLN A 493 -7.438 7.614 6.163 1.00 0.00 C ATOM 1352 CG GLN A 493 -8.679 6.879 6.644 1.00 0.00 C ATOM 1353 CD GLN A 493 -9.481 7.683 7.649 1.00 0.00 C ATOM 1354 OE1 GLN A 493 -9.210 7.645 8.849 1.00 0.00 O ATOM 1355 NE2 GLN A 493 -10.474 8.418 7.162 1.00 0.00 N ATOM 0 H GLN A 493 -7.779 8.085 3.491 1.00 0.00 H new ATOM 0 HA GLN A 493 -8.452 9.502 6.004 1.00 0.00 H new ATOM 0 HB2 GLN A 493 -6.867 6.956 5.508 1.00 0.00 H new ATOM 0 HB3 GLN A 493 -6.804 7.839 7.021 1.00 0.00 H new ATOM 0 HG2 GLN A 493 -9.310 6.641 5.788 1.00 0.00 H new ATOM 0 HG3 GLN A 493 -8.384 5.932 7.095 1.00 0.00 H new ATOM 0 HE21 GLN A 493 -10.663 8.420 6.160 1.00 0.00 H new ATOM 0 HE22 GLN A 493 -11.047 8.981 7.790 1.00 0.00 H new ATOM 1364 N TYR A 494 -6.183 10.591 6.204 1.00 0.00 N ATOM 1365 CA TYR A 494 -4.992 11.431 6.151 1.00 0.00 C ATOM 1366 C TYR A 494 -3.983 11.011 7.215 1.00 0.00 C ATOM 1367 O TYR A 494 -4.272 11.050 8.411 1.00 0.00 O ATOM 1368 CB TYR A 494 -5.370 12.901 6.342 1.00 0.00 C ATOM 1369 CG TYR A 494 -6.091 13.499 5.155 1.00 0.00 C ATOM 1370 CD1 TYR A 494 -7.395 13.129 4.851 1.00 0.00 C ATOM 1371 CD2 TYR A 494 -5.468 14.436 4.339 1.00 0.00 C ATOM 1372 CE1 TYR A 494 -8.057 13.673 3.767 1.00 0.00 C ATOM 1373 CE2 TYR A 494 -6.123 14.986 3.255 1.00 0.00 C ATOM 1374 CZ TYR A 494 -7.417 14.601 2.972 1.00 0.00 C ATOM 1375 OH TYR A 494 -8.074 15.146 1.893 1.00 0.00 O ATOM 0 H TYR A 494 -6.760 10.729 7.034 1.00 0.00 H new ATOM 0 HA TYR A 494 -4.533 11.306 5.170 1.00 0.00 H new ATOM 0 HB2 TYR A 494 -6.002 12.993 7.225 1.00 0.00 H new ATOM 0 HB3 TYR A 494 -4.466 13.478 6.536 1.00 0.00 H new ATOM 0 HD1 TYR A 494 -7.900 12.404 5.472 1.00 0.00 H new ATOM 0 HD2 TYR A 494 -4.454 14.739 4.557 1.00 0.00 H new ATOM 0 HE1 TYR A 494 -9.070 13.373 3.543 1.00 0.00 H new ATOM 0 HE2 TYR A 494 -5.625 15.714 2.632 1.00 0.00 H new ATOM 0 HH TYR A 494 -7.484 15.783 1.438 1.00 0.00 H new ATOM 1385 N MET A 495 -2.796 10.611 6.771 1.00 0.00 N ATOM 1386 CA MET A 495 -1.742 10.186 7.684 1.00 0.00 C ATOM 1387 C MET A 495 -1.116 11.386 8.388 1.00 0.00 C ATOM 1388 O MET A 495 -0.088 11.906 7.954 1.00 0.00 O ATOM 1389 CB MET A 495 -0.666 9.405 6.927 1.00 0.00 C ATOM 1390 CG MET A 495 0.173 8.505 7.820 1.00 0.00 C ATOM 1391 SD MET A 495 -0.655 6.953 8.216 1.00 0.00 S ATOM 1392 CE MET A 495 -0.110 5.922 6.856 1.00 0.00 C ATOM 0 H MET A 495 -2.540 10.572 5.784 1.00 0.00 H new ATOM 0 HA MET A 495 -2.188 9.537 8.438 1.00 0.00 H new ATOM 0 HB2 MET A 495 -1.143 8.797 6.158 1.00 0.00 H new ATOM 0 HB3 MET A 495 -0.010 10.109 6.415 1.00 0.00 H new ATOM 0 HG2 MET A 495 1.121 8.291 7.326 1.00 0.00 H new ATOM 0 HG3 MET A 495 0.408 9.033 8.744 1.00 0.00 H new ATOM 0 HE1 MET A 495 0.111 4.920 7.225 1.00 0.00 H new ATOM 0 HE2 MET A 495 -0.897 5.866 6.104 1.00 0.00 H new ATOM 0 HE3 MET A 495 0.788 6.351 6.411 1.00 0.00 H new ATOM 1402 N GLY A 496 -1.742 11.821 9.477 1.00 0.00 N ATOM 1403 CA GLY A 496 -1.232 12.957 10.222 1.00 0.00 C ATOM 1404 C GLY A 496 -1.462 14.272 9.505 1.00 0.00 C ATOM 1405 O GLY A 496 -2.384 15.016 9.838 1.00 0.00 O ATOM 0 H GLY A 496 -2.593 11.407 9.857 1.00 0.00 H new ATOM 0 HA2 GLY A 496 -1.712 12.991 11.200 1.00 0.00 H new ATOM 0 HA3 GLY A 496 -0.164 12.824 10.396 1.00 0.00 H new ATOM 1409 N ASN A 497 -0.621 14.561 8.517 1.00 0.00 N ATOM 1410 CA ASN A 497 -0.736 15.797 7.752 1.00 0.00 C ATOM 1411 C ASN A 497 -0.812 15.506 6.257 1.00 0.00 C ATOM 1412 O ASN A 497 -1.124 16.389 5.457 1.00 0.00 O ATOM 1413 CB ASN A 497 0.453 16.715 8.045 1.00 0.00 C ATOM 1414 CG ASN A 497 1.759 15.952 8.153 1.00 0.00 C ATOM 1415 OD1 ASN A 497 2.021 15.287 9.155 1.00 0.00 O ATOM 1416 ND2 ASN A 497 2.587 16.046 7.118 1.00 0.00 N ATOM 0 H ASN A 497 0.147 13.956 8.228 1.00 0.00 H new ATOM 0 HA ASN A 497 -1.656 16.298 8.054 1.00 0.00 H new ATOM 0 HB2 ASN A 497 0.536 17.461 7.255 1.00 0.00 H new ATOM 0 HB3 ASN A 497 0.272 17.254 8.975 1.00 0.00 H new ATOM 0 HD21 ASN A 497 3.481 15.555 7.134 1.00 0.00 H new ATOM 0 HD22 ASN A 497 2.329 16.609 6.308 1.00 0.00 H new ATOM 1423 N ARG A 498 -0.526 14.263 5.886 1.00 0.00 N ATOM 1424 CA ARG A 498 -0.561 13.855 4.487 1.00 0.00 C ATOM 1425 C ARG A 498 -1.815 13.037 4.191 1.00 0.00 C ATOM 1426 O ARG A 498 -2.566 12.682 5.099 1.00 0.00 O ATOM 1427 CB ARG A 498 0.686 13.041 4.138 1.00 0.00 C ATOM 1428 CG ARG A 498 1.864 13.892 3.693 1.00 0.00 C ATOM 1429 CD ARG A 498 1.859 14.106 2.188 1.00 0.00 C ATOM 1430 NE ARG A 498 3.205 14.317 1.661 1.00 0.00 N ATOM 1431 CZ ARG A 498 3.870 15.460 1.783 1.00 0.00 C ATOM 1432 NH1 ARG A 498 3.318 16.489 2.411 1.00 0.00 N ATOM 1433 NH2 ARG A 498 5.091 15.576 1.276 1.00 0.00 N ATOM 0 H ARG A 498 -0.267 13.520 6.535 1.00 0.00 H new ATOM 0 HA ARG A 498 -0.581 14.755 3.873 1.00 0.00 H new ATOM 0 HB2 ARG A 498 0.981 12.453 5.007 1.00 0.00 H new ATOM 0 HB3 ARG A 498 0.439 12.335 3.345 1.00 0.00 H new ATOM 0 HG2 ARG A 498 1.829 14.857 4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 498 2.795 13.410 3.990 1.00 0.00 H new ATOM 0 HD2 ARG A 498 1.410 13.241 1.700 1.00 0.00 H new ATOM 0 HD3 ARG A 498 1.236 14.967 1.946 1.00 0.00 H new ATOM 0 HE ARG A 498 3.659 13.545 1.173 1.00 0.00 H new ATOM 0 HH11 ARG A 498 2.380 16.404 2.802 1.00 0.00 H new ATOM 0 HH12 ARG A 498 3.832 17.365 2.503 1.00 0.00 H new ATOM 0 HH21 ARG A 498 5.519 14.787 0.792 1.00 0.00 H new ATOM 0 HH22 ARG A 498 5.601 16.454 1.370 1.00 0.00 H new ATOM 1447 N PHE A 499 -2.035 12.742 2.914 1.00 0.00 N ATOM 1448 CA PHE A 499 -3.198 11.967 2.497 1.00 0.00 C ATOM 1449 C PHE A 499 -2.772 10.702 1.757 1.00 0.00 C ATOM 1450 O PHE A 499 -1.857 10.731 0.933 1.00 0.00 O ATOM 1451 CB PHE A 499 -4.107 12.813 1.604 1.00 0.00 C ATOM 1452 CG PHE A 499 -5.336 12.084 1.138 1.00 0.00 C ATOM 1453 CD1 PHE A 499 -6.347 11.765 2.029 1.00 0.00 C ATOM 1454 CD2 PHE A 499 -5.478 11.719 -0.191 1.00 0.00 C ATOM 1455 CE1 PHE A 499 -7.479 11.095 1.604 1.00 0.00 C ATOM 1456 CE2 PHE A 499 -6.608 11.049 -0.622 1.00 0.00 C ATOM 1457 CZ PHE A 499 -7.609 10.736 0.277 1.00 0.00 C ATOM 0 H PHE A 499 -1.423 13.028 2.150 1.00 0.00 H new ATOM 0 HA PHE A 499 -3.749 11.675 3.391 1.00 0.00 H new ATOM 0 HB2 PHE A 499 -4.409 13.707 2.150 1.00 0.00 H new ATOM 0 HB3 PHE A 499 -3.541 13.147 0.735 1.00 0.00 H new ATOM 0 HD1 PHE A 499 -6.250 12.043 3.068 1.00 0.00 H new ATOM 0 HD2 PHE A 499 -4.698 11.960 -0.898 1.00 0.00 H new ATOM 0 HE1 PHE A 499 -8.261 10.853 2.309 1.00 0.00 H new ATOM 0 HE2 PHE A 499 -6.708 10.771 -1.661 1.00 0.00 H new ATOM 0 HZ PHE A 499 -8.492 10.211 -0.057 1.00 0.00 H new ATOM 1467 N ILE A 500 -3.442 9.595 2.056 1.00 0.00 N ATOM 1468 CA ILE A 500 -3.134 8.320 1.419 1.00 0.00 C ATOM 1469 C ILE A 500 -4.405 7.613 0.962 1.00 0.00 C ATOM 1470 O ILE A 500 -5.390 7.550 1.697 1.00 0.00 O ATOM 1471 CB ILE A 500 -2.356 7.390 2.369 1.00 0.00 C ATOM 1472 CG1 ILE A 500 -0.950 7.942 2.619 1.00 0.00 C ATOM 1473 CG2 ILE A 500 -2.283 5.984 1.791 1.00 0.00 C ATOM 1474 CD1 ILE A 500 -0.911 9.051 3.646 1.00 0.00 C ATOM 0 H ILE A 500 -4.202 9.555 2.735 1.00 0.00 H new ATOM 0 HA ILE A 500 -2.513 8.542 0.551 1.00 0.00 H new ATOM 0 HB ILE A 500 -2.883 7.344 3.322 1.00 0.00 H new ATOM 0 HG12 ILE A 500 -0.303 7.129 2.949 1.00 0.00 H new ATOM 0 HG13 ILE A 500 -0.542 8.313 1.679 1.00 0.00 H new ATOM 0 HG21 ILE A 500 -1.730 5.338 2.473 1.00 0.00 H new ATOM 0 HG22 ILE A 500 -3.292 5.593 1.658 1.00 0.00 H new ATOM 0 HG23 ILE A 500 -1.775 6.013 0.827 1.00 0.00 H new ATOM 0 HD11 ILE A 500 0.116 9.394 3.772 1.00 0.00 H new ATOM 0 HD12 ILE A 500 -1.532 9.881 3.309 1.00 0.00 H new ATOM 0 HD13 ILE A 500 -1.289 8.679 4.598 1.00 0.00 H new ATOM 1486 N GLN A 501 -4.375 7.081 -0.256 1.00 0.00 N ATOM 1487 CA GLN A 501 -5.525 6.377 -0.810 1.00 0.00 C ATOM 1488 C GLN A 501 -5.446 4.884 -0.509 1.00 0.00 C ATOM 1489 O GLN A 501 -4.366 4.293 -0.524 1.00 0.00 O ATOM 1490 CB GLN A 501 -5.606 6.601 -2.321 1.00 0.00 C ATOM 1491 CG GLN A 501 -6.416 7.826 -2.712 1.00 0.00 C ATOM 1492 CD GLN A 501 -6.803 7.827 -4.178 1.00 0.00 C ATOM 1493 OE1 GLN A 501 -7.714 7.109 -4.592 1.00 0.00 O ATOM 1494 NE2 GLN A 501 -6.111 8.635 -4.973 1.00 0.00 N ATOM 0 H GLN A 501 -3.567 7.124 -0.877 1.00 0.00 H new ATOM 0 HA GLN A 501 -6.425 6.776 -0.341 1.00 0.00 H new ATOM 0 HB2 GLN A 501 -4.596 6.701 -2.720 1.00 0.00 H new ATOM 0 HB3 GLN A 501 -6.047 5.720 -2.787 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -7.318 7.870 -2.102 1.00 0.00 H new ATOM 0 HG3 GLN A 501 -5.839 8.724 -2.492 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -5.364 9.213 -4.588 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -6.326 8.678 -5.969 1.00 0.00 H new ATOM 1503 N VAL A 502 -6.597 4.279 -0.234 1.00 0.00 N ATOM 1504 CA VAL A 502 -6.659 2.855 0.070 1.00 0.00 C ATOM 1505 C VAL A 502 -7.351 2.083 -1.048 1.00 0.00 C ATOM 1506 O VAL A 502 -8.418 2.476 -1.520 1.00 0.00 O ATOM 1507 CB VAL A 502 -7.403 2.596 1.394 1.00 0.00 C ATOM 1508 CG1 VAL A 502 -7.562 1.102 1.633 1.00 0.00 C ATOM 1509 CG2 VAL A 502 -6.672 3.255 2.553 1.00 0.00 C ATOM 0 H VAL A 502 -7.500 4.754 -0.216 1.00 0.00 H new ATOM 0 HA VAL A 502 -5.630 2.507 0.165 1.00 0.00 H new ATOM 0 HB VAL A 502 -8.398 3.037 1.325 1.00 0.00 H new ATOM 0 HG11 VAL A 502 -8.090 0.938 2.573 1.00 0.00 H new ATOM 0 HG12 VAL A 502 -8.132 0.661 0.815 1.00 0.00 H new ATOM 0 HG13 VAL A 502 -6.578 0.635 1.683 1.00 0.00 H new ATOM 0 HG21 VAL A 502 -7.211 3.062 3.480 1.00 0.00 H new ATOM 0 HG22 VAL A 502 -5.664 2.846 2.627 1.00 0.00 H new ATOM 0 HG23 VAL A 502 -6.615 4.330 2.383 1.00 0.00 H new ATOM 1519 N HIS A 503 -6.735 0.982 -1.468 1.00 0.00 N ATOM 1520 CA HIS A 503 -7.292 0.154 -2.532 1.00 0.00 C ATOM 1521 C HIS A 503 -6.854 -1.299 -2.374 1.00 0.00 C ATOM 1522 O HIS A 503 -5.683 -1.598 -2.138 1.00 0.00 O ATOM 1523 CB HIS A 503 -6.860 0.683 -3.899 1.00 0.00 C ATOM 1524 CG HIS A 503 -7.269 2.102 -4.148 1.00 0.00 C ATOM 1525 ND1 HIS A 503 -8.581 2.488 -4.323 1.00 0.00 N ATOM 1526 CD2 HIS A 503 -6.530 3.232 -4.250 1.00 0.00 C ATOM 1527 CE1 HIS A 503 -8.632 3.793 -4.523 1.00 0.00 C ATOM 1528 NE2 HIS A 503 -7.400 4.268 -4.483 1.00 0.00 N ATOM 0 H HIS A 503 -5.851 0.643 -1.088 1.00 0.00 H new ATOM 0 HA HIS A 503 -8.379 0.198 -2.462 1.00 0.00 H new ATOM 0 HB2 HIS A 503 -5.776 0.606 -3.983 1.00 0.00 H new ATOM 0 HB3 HIS A 503 -7.286 0.049 -4.676 1.00 0.00 H new ATOM 0 HD2 HIS A 503 -5.456 3.305 -4.164 1.00 0.00 H new ATOM 0 HE1 HIS A 503 -9.528 4.372 -4.691 1.00 0.00 H new ATOM 0 HE2 HIS A 503 -7.138 5.246 -4.605 1.00 0.00 H new ATOM 1537 N PRO A 504 -7.815 -2.225 -2.506 1.00 0.00 N ATOM 1538 CA PRO A 504 -7.553 -3.662 -2.382 1.00 0.00 C ATOM 1539 C PRO A 504 -6.733 -4.205 -3.548 1.00 0.00 C ATOM 1540 O PRO A 504 -6.969 -3.849 -4.703 1.00 0.00 O ATOM 1541 CB PRO A 504 -8.953 -4.280 -2.380 1.00 0.00 C ATOM 1542 CG PRO A 504 -9.803 -3.296 -3.107 1.00 0.00 C ATOM 1543 CD PRO A 504 -9.233 -1.941 -2.788 1.00 0.00 C ATOM 0 HA PRO A 504 -6.969 -3.894 -1.491 1.00 0.00 H new ATOM 0 HB2 PRO A 504 -8.958 -5.250 -2.877 1.00 0.00 H new ATOM 0 HB3 PRO A 504 -9.314 -4.440 -1.364 1.00 0.00 H new ATOM 0 HG2 PRO A 504 -9.786 -3.484 -4.181 1.00 0.00 H new ATOM 0 HG3 PRO A 504 -10.843 -3.367 -2.787 1.00 0.00 H new ATOM 0 HD2 PRO A 504 -9.346 -1.251 -3.624 1.00 0.00 H new ATOM 0 HD3 PRO A 504 -9.730 -1.488 -1.931 1.00 0.00 H new ATOM 1551 N ILE A 505 -5.770 -5.066 -3.239 1.00 0.00 N ATOM 1552 CA ILE A 505 -4.918 -5.659 -4.262 1.00 0.00 C ATOM 1553 C ILE A 505 -4.585 -7.109 -3.928 1.00 0.00 C ATOM 1554 O ILE A 505 -4.433 -7.470 -2.761 1.00 0.00 O ATOM 1555 CB ILE A 505 -3.607 -4.868 -4.428 1.00 0.00 C ATOM 1556 CG1 ILE A 505 -2.870 -5.320 -5.691 1.00 0.00 C ATOM 1557 CG2 ILE A 505 -2.723 -5.043 -3.202 1.00 0.00 C ATOM 1558 CD1 ILE A 505 -1.797 -4.354 -6.143 1.00 0.00 C ATOM 0 H ILE A 505 -5.560 -5.369 -2.288 1.00 0.00 H new ATOM 0 HA ILE A 505 -5.476 -5.624 -5.198 1.00 0.00 H new ATOM 0 HB ILE A 505 -3.849 -3.810 -4.529 1.00 0.00 H new ATOM 0 HG12 ILE A 505 -2.417 -6.294 -5.508 1.00 0.00 H new ATOM 0 HG13 ILE A 505 -3.593 -5.451 -6.496 1.00 0.00 H new ATOM 0 HG21 ILE A 505 -1.800 -4.478 -3.335 1.00 0.00 H new ATOM 0 HG22 ILE A 505 -3.248 -4.678 -2.320 1.00 0.00 H new ATOM 0 HG23 ILE A 505 -2.486 -6.099 -3.072 1.00 0.00 H new ATOM 0 HD11 ILE A 505 -1.317 -4.739 -7.043 1.00 0.00 H new ATOM 0 HD12 ILE A 505 -2.247 -3.385 -6.358 1.00 0.00 H new ATOM 0 HD13 ILE A 505 -1.053 -4.242 -5.354 1.00 0.00 H new ATOM 1570 N THR A 506 -4.471 -7.937 -4.962 1.00 0.00 N ATOM 1571 CA THR A 506 -4.155 -9.348 -4.780 1.00 0.00 C ATOM 1572 C THR A 506 -2.700 -9.537 -4.367 1.00 0.00 C ATOM 1573 O THR A 506 -1.838 -8.723 -4.700 1.00 0.00 O ATOM 1574 CB THR A 506 -4.421 -10.154 -6.065 1.00 0.00 C ATOM 1575 OG1 THR A 506 -3.673 -9.600 -7.154 1.00 0.00 O ATOM 1576 CG2 THR A 506 -5.903 -10.152 -6.409 1.00 0.00 C ATOM 0 H THR A 506 -4.593 -7.654 -5.934 1.00 0.00 H new ATOM 0 HA THR A 506 -4.806 -9.717 -3.987 1.00 0.00 H new ATOM 0 HB THR A 506 -4.106 -11.183 -5.894 1.00 0.00 H new ATOM 0 HG1 THR A 506 -3.846 -10.119 -7.967 1.00 0.00 H new ATOM 0 HG21 THR A 506 -6.066 -10.728 -7.320 1.00 0.00 H new ATOM 0 HG22 THR A 506 -6.467 -10.600 -5.591 1.00 0.00 H new ATOM 0 HG23 THR A 506 -6.240 -9.127 -6.563 1.00 0.00 H new ATOM 1584 N LYS A 507 -2.431 -10.616 -3.640 1.00 0.00 N ATOM 1585 CA LYS A 507 -1.079 -10.914 -3.182 1.00 0.00 C ATOM 1586 C LYS A 507 -0.107 -10.969 -4.356 1.00 0.00 C ATOM 1587 O LYS A 507 0.969 -10.372 -4.313 1.00 0.00 O ATOM 1588 CB LYS A 507 -1.057 -12.244 -2.425 1.00 0.00 C ATOM 1589 CG LYS A 507 0.008 -12.310 -1.344 1.00 0.00 C ATOM 1590 CD LYS A 507 1.385 -12.566 -1.932 1.00 0.00 C ATOM 1591 CE LYS A 507 2.307 -13.235 -0.924 1.00 0.00 C ATOM 1592 NZ LYS A 507 2.524 -12.384 0.279 1.00 0.00 N ATOM 0 H LYS A 507 -3.132 -11.300 -3.355 1.00 0.00 H new ATOM 0 HA LYS A 507 -0.765 -10.115 -2.510 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -2.034 -12.411 -1.972 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -0.893 -13.054 -3.135 1.00 0.00 H new ATOM 0 HG2 LYS A 507 0.018 -11.374 -0.785 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -0.239 -13.101 -0.636 1.00 0.00 H new ATOM 0 HD2 LYS A 507 1.292 -13.197 -2.816 1.00 0.00 H new ATOM 0 HD3 LYS A 507 1.824 -11.623 -2.258 1.00 0.00 H new ATOM 0 HE2 LYS A 507 1.881 -14.191 -0.620 1.00 0.00 H new ATOM 0 HE3 LYS A 507 3.266 -13.449 -1.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 3.144 -12.882 0.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 2.970 -11.488 -0.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 1.610 -12.187 0.734 1.00 0.00 H new ATOM 1606 N LYS A 508 -0.494 -11.687 -5.405 1.00 0.00 N ATOM 1607 CA LYS A 508 0.342 -11.818 -6.593 1.00 0.00 C ATOM 1608 C LYS A 508 0.597 -10.456 -7.232 1.00 0.00 C ATOM 1609 O LYS A 508 1.741 -10.020 -7.350 1.00 0.00 O ATOM 1610 CB LYS A 508 -0.321 -12.752 -7.608 1.00 0.00 C ATOM 1611 CG LYS A 508 0.664 -13.430 -8.545 1.00 0.00 C ATOM 1612 CD LYS A 508 0.130 -14.760 -9.048 1.00 0.00 C ATOM 1613 CE LYS A 508 0.177 -15.826 -7.964 1.00 0.00 C ATOM 1614 NZ LYS A 508 1.574 -16.232 -7.646 1.00 0.00 N ATOM 0 H LYS A 508 -1.381 -12.187 -5.457 1.00 0.00 H new ATOM 0 HA LYS A 508 1.299 -12.242 -6.288 1.00 0.00 H new ATOM 0 HB2 LYS A 508 -0.884 -13.516 -7.072 1.00 0.00 H new ATOM 0 HB3 LYS A 508 -1.038 -12.182 -8.199 1.00 0.00 H new ATOM 0 HG2 LYS A 508 0.871 -12.776 -9.392 1.00 0.00 H new ATOM 0 HG3 LYS A 508 1.610 -13.589 -8.027 1.00 0.00 H new ATOM 0 HD2 LYS A 508 -0.897 -14.634 -9.392 1.00 0.00 H new ATOM 0 HD3 LYS A 508 0.716 -15.087 -9.907 1.00 0.00 H new ATOM 0 HE2 LYS A 508 -0.306 -15.449 -7.062 1.00 0.00 H new ATOM 0 HE3 LYS A 508 -0.390 -16.699 -8.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 1.563 -17.128 -7.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 2.109 -16.357 -8.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 2.027 -15.495 -7.068 1.00 0.00 H new ATOM 1628 N GLY A 509 -0.478 -9.788 -7.640 1.00 0.00 N ATOM 1629 CA GLY A 509 -0.349 -8.482 -8.260 1.00 0.00 C ATOM 1630 C GLY A 509 0.518 -7.539 -7.449 1.00 0.00 C ATOM 1631 O GLY A 509 1.301 -6.771 -8.007 1.00 0.00 O ATOM 0 H GLY A 509 -1.436 -10.128 -7.552 1.00 0.00 H new ATOM 0 HA2 GLY A 509 0.078 -8.597 -9.256 1.00 0.00 H new ATOM 0 HA3 GLY A 509 -1.339 -8.043 -8.386 1.00 0.00 H new ATOM 1635 N MET A 510 0.376 -7.595 -6.129 1.00 0.00 N ATOM 1636 CA MET A 510 1.152 -6.738 -5.240 1.00 0.00 C ATOM 1637 C MET A 510 2.647 -6.985 -5.416 1.00 0.00 C ATOM 1638 O MET A 510 3.435 -6.043 -5.509 1.00 0.00 O ATOM 1639 CB MET A 510 0.751 -6.980 -3.784 1.00 0.00 C ATOM 1640 CG MET A 510 1.580 -6.189 -2.785 1.00 0.00 C ATOM 1641 SD MET A 510 1.414 -6.809 -1.100 1.00 0.00 S ATOM 1642 CE MET A 510 2.309 -8.356 -1.219 1.00 0.00 C ATOM 0 H MET A 510 -0.269 -8.225 -5.651 1.00 0.00 H new ATOM 0 HA MET A 510 0.940 -5.701 -5.499 1.00 0.00 H new ATOM 0 HB2 MET A 510 -0.300 -6.721 -3.657 1.00 0.00 H new ATOM 0 HB3 MET A 510 0.846 -8.043 -3.562 1.00 0.00 H new ATOM 0 HG2 MET A 510 2.629 -6.225 -3.080 1.00 0.00 H new ATOM 0 HG3 MET A 510 1.276 -5.143 -2.815 1.00 0.00 H new ATOM 0 HE1 MET A 510 2.604 -8.683 -0.222 1.00 0.00 H new ATOM 0 HE2 MET A 510 1.670 -9.112 -1.674 1.00 0.00 H new ATOM 0 HE3 MET A 510 3.198 -8.215 -1.833 1.00 0.00 H new ATOM 1652 N LEU A 511 3.031 -8.256 -5.460 1.00 0.00 N ATOM 1653 CA LEU A 511 4.432 -8.627 -5.624 1.00 0.00 C ATOM 1654 C LEU A 511 4.973 -8.132 -6.962 1.00 0.00 C ATOM 1655 O LEU A 511 6.082 -7.603 -7.036 1.00 0.00 O ATOM 1656 CB LEU A 511 4.593 -10.145 -5.526 1.00 0.00 C ATOM 1657 CG LEU A 511 4.428 -10.748 -4.131 1.00 0.00 C ATOM 1658 CD1 LEU A 511 4.132 -12.237 -4.225 1.00 0.00 C ATOM 1659 CD2 LEU A 511 5.674 -10.503 -3.292 1.00 0.00 C ATOM 0 H LEU A 511 2.392 -9.047 -5.384 1.00 0.00 H new ATOM 0 HA LEU A 511 5.003 -8.155 -4.825 1.00 0.00 H new ATOM 0 HB2 LEU A 511 3.865 -10.611 -6.190 1.00 0.00 H new ATOM 0 HB3 LEU A 511 5.582 -10.410 -5.900 1.00 0.00 H new ATOM 0 HG LEU A 511 3.584 -10.260 -3.643 1.00 0.00 H new ATOM 0 HD11 LEU A 511 4.018 -12.649 -3.222 1.00 0.00 H new ATOM 0 HD12 LEU A 511 3.211 -12.390 -4.787 1.00 0.00 H new ATOM 0 HD13 LEU A 511 4.955 -12.740 -4.733 1.00 0.00 H new ATOM 0 HD21 LEU A 511 5.538 -10.939 -2.302 1.00 0.00 H new ATOM 0 HD22 LEU A 511 6.535 -10.963 -3.776 1.00 0.00 H new ATOM 0 HD23 LEU A 511 5.843 -9.430 -3.196 1.00 0.00 H new ATOM 1671 N GLU A 512 4.181 -8.305 -8.015 1.00 0.00 N ATOM 1672 CA GLU A 512 4.581 -7.875 -9.350 1.00 0.00 C ATOM 1673 C GLU A 512 5.336 -6.550 -9.291 1.00 0.00 C ATOM 1674 O GLU A 512 6.460 -6.440 -9.781 1.00 0.00 O ATOM 1675 CB GLU A 512 3.355 -7.735 -10.254 1.00 0.00 C ATOM 1676 CG GLU A 512 2.694 -9.061 -10.591 1.00 0.00 C ATOM 1677 CD GLU A 512 3.660 -10.056 -11.203 1.00 0.00 C ATOM 1678 OE1 GLU A 512 3.890 -9.983 -12.429 1.00 0.00 O ATOM 1679 OE2 GLU A 512 4.187 -10.908 -10.458 1.00 0.00 O ATOM 0 H GLU A 512 3.259 -8.740 -7.970 1.00 0.00 H new ATOM 0 HA GLU A 512 5.244 -8.634 -9.764 1.00 0.00 H new ATOM 0 HB2 GLU A 512 2.626 -7.089 -9.766 1.00 0.00 H new ATOM 0 HB3 GLU A 512 3.651 -7.240 -11.179 1.00 0.00 H new ATOM 0 HG2 GLU A 512 2.263 -9.488 -9.685 1.00 0.00 H new ATOM 0 HG3 GLU A 512 1.871 -8.886 -11.284 1.00 0.00 H new ATOM 1686 N LYS A 513 4.710 -5.545 -8.687 1.00 0.00 N ATOM 1687 CA LYS A 513 5.320 -4.227 -8.562 1.00 0.00 C ATOM 1688 C LYS A 513 6.565 -4.285 -7.683 1.00 0.00 C ATOM 1689 O LYS A 513 7.665 -3.953 -8.127 1.00 0.00 O ATOM 1690 CB LYS A 513 4.316 -3.231 -7.977 1.00 0.00 C ATOM 1691 CG LYS A 513 3.020 -3.141 -8.763 1.00 0.00 C ATOM 1692 CD LYS A 513 2.041 -2.175 -8.116 1.00 0.00 C ATOM 1693 CE LYS A 513 0.795 -1.991 -8.968 1.00 0.00 C ATOM 1694 NZ LYS A 513 -0.202 -3.072 -8.733 1.00 0.00 N ATOM 0 H LYS A 513 3.779 -5.619 -8.276 1.00 0.00 H new ATOM 0 HA LYS A 513 5.614 -3.895 -9.557 1.00 0.00 H new ATOM 0 HB2 LYS A 513 4.089 -3.518 -6.950 1.00 0.00 H new ATOM 0 HB3 LYS A 513 4.777 -2.244 -7.938 1.00 0.00 H new ATOM 0 HG2 LYS A 513 3.233 -2.817 -9.782 1.00 0.00 H new ATOM 0 HG3 LYS A 513 2.566 -4.129 -8.832 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.758 -2.547 -7.131 1.00 0.00 H new ATOM 0 HD3 LYS A 513 2.526 -1.210 -7.965 1.00 0.00 H new ATOM 0 HE2 LYS A 513 0.342 -1.025 -8.745 1.00 0.00 H new ATOM 0 HE3 LYS A 513 1.074 -1.977 -10.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -0.608 -3.373 -9.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 0.265 -3.882 -8.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -0.960 -2.717 -8.116 1.00 0.00 H new ATOM 1708 N ILE A 514 6.385 -4.710 -6.437 1.00 0.00 N ATOM 1709 CA ILE A 514 7.495 -4.814 -5.498 1.00 0.00 C ATOM 1710 C ILE A 514 8.774 -5.253 -6.204 1.00 0.00 C ATOM 1711 O ILE A 514 9.869 -4.808 -5.861 1.00 0.00 O ATOM 1712 CB ILE A 514 7.182 -5.808 -4.364 1.00 0.00 C ATOM 1713 CG1 ILE A 514 5.940 -5.358 -3.592 1.00 0.00 C ATOM 1714 CG2 ILE A 514 8.375 -5.938 -3.429 1.00 0.00 C ATOM 1715 CD1 ILE A 514 5.427 -6.395 -2.616 1.00 0.00 C ATOM 0 H ILE A 514 5.481 -4.988 -6.054 1.00 0.00 H new ATOM 0 HA ILE A 514 7.640 -3.822 -5.071 1.00 0.00 H new ATOM 0 HB ILE A 514 6.981 -6.786 -4.802 1.00 0.00 H new ATOM 0 HG12 ILE A 514 6.172 -4.442 -3.048 1.00 0.00 H new ATOM 0 HG13 ILE A 514 5.149 -5.116 -4.302 1.00 0.00 H new ATOM 0 HG21 ILE A 514 8.138 -6.644 -2.633 1.00 0.00 H new ATOM 0 HG22 ILE A 514 9.238 -6.298 -3.989 1.00 0.00 H new ATOM 0 HG23 ILE A 514 8.605 -4.965 -2.995 1.00 0.00 H new ATOM 0 HD11 ILE A 514 4.546 -6.008 -2.104 1.00 0.00 H new ATOM 0 HD12 ILE A 514 5.163 -7.304 -3.156 1.00 0.00 H new ATOM 0 HD13 ILE A 514 6.202 -6.620 -1.884 1.00 0.00 H new ATOM 1727 N ASP A 515 8.626 -6.128 -7.194 1.00 0.00 N ATOM 1728 CA ASP A 515 9.768 -6.625 -7.951 1.00 0.00 C ATOM 1729 C ASP A 515 10.438 -5.496 -8.729 1.00 0.00 C ATOM 1730 O ASP A 515 11.653 -5.316 -8.658 1.00 0.00 O ATOM 1731 CB ASP A 515 9.328 -7.731 -8.911 1.00 0.00 C ATOM 1732 CG ASP A 515 10.426 -8.744 -9.171 1.00 0.00 C ATOM 1733 OD1 ASP A 515 10.789 -9.481 -8.229 1.00 0.00 O ATOM 1734 OD2 ASP A 515 10.923 -8.800 -10.315 1.00 0.00 O ATOM 0 H ASP A 515 7.726 -6.507 -7.490 1.00 0.00 H new ATOM 0 HA ASP A 515 10.491 -7.034 -7.245 1.00 0.00 H new ATOM 0 HB2 ASP A 515 8.458 -8.241 -8.498 1.00 0.00 H new ATOM 0 HB3 ASP A 515 9.018 -7.285 -9.856 1.00 0.00 H new ATOM 1739 N MET A 516 9.636 -4.740 -9.472 1.00 0.00 N ATOM 1740 CA MET A 516 10.151 -3.628 -10.263 1.00 0.00 C ATOM 1741 C MET A 516 10.713 -2.534 -9.361 1.00 0.00 C ATOM 1742 O MET A 516 11.623 -1.802 -9.751 1.00 0.00 O ATOM 1743 CB MET A 516 9.049 -3.055 -11.155 1.00 0.00 C ATOM 1744 CG MET A 516 8.028 -2.220 -10.399 1.00 0.00 C ATOM 1745 SD MET A 516 7.231 -0.985 -11.443 1.00 0.00 S ATOM 1746 CE MET A 516 5.530 -1.130 -10.901 1.00 0.00 C ATOM 0 H MET A 516 8.628 -4.877 -9.543 1.00 0.00 H new ATOM 0 HA MET A 516 10.957 -4.005 -10.892 1.00 0.00 H new ATOM 0 HB2 MET A 516 9.504 -2.441 -11.932 1.00 0.00 H new ATOM 0 HB3 MET A 516 8.536 -3.875 -11.657 1.00 0.00 H new ATOM 0 HG2 MET A 516 7.268 -2.877 -9.976 1.00 0.00 H new ATOM 0 HG3 MET A 516 8.519 -1.721 -9.563 1.00 0.00 H new ATOM 0 HE1 MET A 516 4.910 -0.427 -11.457 1.00 0.00 H new ATOM 0 HE2 MET A 516 5.176 -2.145 -11.080 1.00 0.00 H new ATOM 0 HE3 MET A 516 5.467 -0.906 -9.836 1.00 0.00 H new ATOM 1756 N ILE A 517 10.164 -2.426 -8.156 1.00 0.00 N ATOM 1757 CA ILE A 517 10.611 -1.421 -7.200 1.00 0.00 C ATOM 1758 C ILE A 517 12.046 -1.683 -6.757 1.00 0.00 C ATOM 1759 O ILE A 517 12.862 -0.764 -6.684 1.00 0.00 O ATOM 1760 CB ILE A 517 9.702 -1.382 -5.957 1.00 0.00 C ATOM 1761 CG1 ILE A 517 8.289 -0.941 -6.346 1.00 0.00 C ATOM 1762 CG2 ILE A 517 10.283 -0.449 -4.905 1.00 0.00 C ATOM 1763 CD1 ILE A 517 7.235 -1.330 -5.333 1.00 0.00 C ATOM 0 H ILE A 517 9.409 -3.023 -7.819 1.00 0.00 H new ATOM 0 HA ILE A 517 10.560 -0.458 -7.708 1.00 0.00 H new ATOM 0 HB ILE A 517 9.646 -2.385 -5.534 1.00 0.00 H new ATOM 0 HG12 ILE A 517 8.277 0.141 -6.474 1.00 0.00 H new ATOM 0 HG13 ILE A 517 8.033 -1.379 -7.311 1.00 0.00 H new ATOM 0 HG21 ILE A 517 9.629 -0.432 -4.033 1.00 0.00 H new ATOM 0 HG22 ILE A 517 11.271 -0.803 -4.611 1.00 0.00 H new ATOM 0 HG23 ILE A 517 10.365 0.557 -5.316 1.00 0.00 H new ATOM 0 HD11 ILE A 517 6.258 -0.986 -5.674 1.00 0.00 H new ATOM 0 HD12 ILE A 517 7.219 -2.414 -5.222 1.00 0.00 H new ATOM 0 HD13 ILE A 517 7.467 -0.871 -4.372 1.00 0.00 H new ATOM 1775 N ARG A 518 12.349 -2.944 -6.466 1.00 0.00 N ATOM 1776 CA ARG A 518 13.686 -3.328 -6.031 1.00 0.00 C ATOM 1777 C ARG A 518 14.684 -3.217 -7.180 1.00 0.00 C ATOM 1778 O ARG A 518 15.681 -2.500 -7.085 1.00 0.00 O ATOM 1779 CB ARG A 518 13.678 -4.757 -5.485 1.00 0.00 C ATOM 1780 CG ARG A 518 12.797 -4.936 -4.259 1.00 0.00 C ATOM 1781 CD ARG A 518 12.578 -6.406 -3.941 1.00 0.00 C ATOM 1782 NE ARG A 518 12.342 -6.628 -2.517 1.00 0.00 N ATOM 1783 CZ ARG A 518 12.365 -7.828 -1.946 1.00 0.00 C ATOM 1784 NH1 ARG A 518 12.613 -8.907 -2.674 1.00 0.00 N ATOM 1785 NH2 ARG A 518 12.141 -7.949 -0.644 1.00 0.00 N ATOM 0 H ARG A 518 11.686 -3.717 -6.524 1.00 0.00 H new ATOM 0 HA ARG A 518 13.993 -2.646 -5.238 1.00 0.00 H new ATOM 0 HB2 ARG A 518 13.338 -5.434 -6.268 1.00 0.00 H new ATOM 0 HB3 ARG A 518 14.698 -5.047 -5.234 1.00 0.00 H new ATOM 0 HG2 ARG A 518 13.258 -4.442 -3.403 1.00 0.00 H new ATOM 0 HG3 ARG A 518 11.835 -4.452 -4.427 1.00 0.00 H new ATOM 0 HD2 ARG A 518 11.727 -6.778 -4.512 1.00 0.00 H new ATOM 0 HD3 ARG A 518 13.449 -6.979 -4.258 1.00 0.00 H new ATOM 0 HE ARG A 518 12.149 -5.818 -1.928 1.00 0.00 H new ATOM 0 HH11 ARG A 518 12.787 -8.818 -3.675 1.00 0.00 H new ATOM 0 HH12 ARG A 518 12.630 -9.827 -2.233 1.00 0.00 H new ATOM 0 HH21 ARG A 518 11.951 -7.121 -0.080 1.00 0.00 H new ATOM 0 HH22 ARG A 518 12.159 -8.870 -0.207 1.00 0.00 H new