USER MOD reduce.3.24.130724 H: found=0, std=0, add=628, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 627 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 520 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 565 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 504 THR OG1 : rot 24:sc= 0.0705 USER MOD Single : A 505 GLN : amide:sc= -1.52 X(o=-1.5,f=-1.9) USER MOD Single : A 506 GLN :FLIP amide:sc= -0.0296 F(o=-0.71,f=-0.03) USER MOD Single : A 508 THR OG1 : rot -160:sc= 1.39 USER MOD Single : A 511 GLN : amide:sc= -0.214 K(o=-0.21,f=-1.3) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 528 TYR OH : rot -11:sc= 0.263 USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= -0.0309 X(o=-0.031,f=-0.14) USER MOD Single : A 535 HIS : no HD1:sc= -2.85 K(o=-2.8,f=-3.8!) USER MOD Single : A 536 MET CE :methyl -164:sc=-0.00958 (180deg=-0.365) USER MOD Single : A 537 MET CE :methyl -124:sc= -0.303 (180deg=-4.59!) USER MOD Single : A 539 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0535) USER MOD Single : A 546 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 549 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 554 CYS SG : rot 27:sc= -1.67 USER MOD Single : A 555 CYS SG : rot 26:sc= -3.18 USER MOD Single : A 556 ASN : amide:sc= -0.668! C(o=-0.67!,f=-1.3!) USER MOD Single : A 564 GLN : amide:sc= -0.992 K(o=-0.99,f=-1.8!) USER MOD Single : A 567 ASN : amide:sc= 0.00492 K(o=0.0049,f=-0.7) USER MOD Single : A 569 MET CE :methyl 164:sc=-0.00609 (180deg=-0.343) USER MOD Single : A 570 HIS : no HD1:sc= -4.71! C(o=-4.7!,f=-5.2!) USER MOD Single : A 574 GLN :FLIP amide:sc= -1.13 F(o=-3.2!,f=-1.1) USER MOD Single : A 575 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 579 MET CE :methyl -178:sc= -0.348 (180deg=-0.369) USER MOD ----------------------------------------------------------------- ATOM 445 N THR A 504 -7.718 -7.158 8.148 1.00 0.00 N ATOM 446 CA THR A 504 -8.322 -7.716 6.944 1.00 0.00 C ATOM 447 C THR A 504 -8.189 -6.756 5.768 1.00 0.00 C ATOM 448 O THR A 504 -7.418 -7.000 4.840 1.00 0.00 O ATOM 449 CB THR A 504 -9.811 -8.041 7.162 1.00 0.00 C ATOM 450 OG1 THR A 504 -9.958 -8.963 8.247 1.00 0.00 O ATOM 451 CG2 THR A 504 -10.426 -8.632 5.901 1.00 0.00 C ATOM 0 HA THR A 504 -7.786 -8.638 6.719 1.00 0.00 H new ATOM 0 HB THR A 504 -10.331 -7.113 7.401 1.00 0.00 H new ATOM 0 HG1 THR A 504 -9.179 -8.899 8.839 1.00 0.00 H new ATOM 0 HG21 THR A 504 -11.478 -8.854 6.079 1.00 0.00 H new ATOM 0 HG22 THR A 504 -10.339 -7.916 5.084 1.00 0.00 H new ATOM 0 HG23 THR A 504 -9.902 -9.550 5.636 1.00 0.00 H new ATOM 459 N GLN A 505 -8.945 -5.663 5.813 1.00 0.00 N ATOM 460 CA GLN A 505 -8.911 -4.666 4.750 1.00 0.00 C ATOM 461 C GLN A 505 -7.475 -4.276 4.415 1.00 0.00 C ATOM 462 O GLN A 505 -7.055 -4.351 3.261 1.00 0.00 O ATOM 463 CB GLN A 505 -9.706 -3.426 5.159 1.00 0.00 C ATOM 464 CG GLN A 505 -11.198 -3.544 4.891 1.00 0.00 C ATOM 465 CD GLN A 505 -11.976 -2.339 5.381 1.00 0.00 C ATOM 466 OE1 GLN A 505 -11.461 -1.520 6.143 1.00 0.00 O ATOM 467 NE2 GLN A 505 -13.225 -2.223 4.945 1.00 0.00 N ATOM 0 H GLN A 505 -9.588 -5.446 6.574 1.00 0.00 H new ATOM 0 HA GLN A 505 -9.366 -5.104 3.862 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -9.550 -3.239 6.221 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -9.316 -2.561 4.622 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -11.362 -3.667 3.821 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -11.581 -4.441 5.377 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -13.612 -2.925 4.314 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -13.797 -1.432 5.241 1.00 0.00 H new ATOM 476 N GLN A 506 -6.727 -3.860 5.433 1.00 0.00 N ATOM 477 CA GLN A 506 -5.338 -3.457 5.245 1.00 0.00 C ATOM 478 C GLN A 506 -4.611 -4.426 4.318 1.00 0.00 C ATOM 479 O GLN A 506 -3.862 -4.011 3.433 1.00 0.00 O ATOM 480 CB GLN A 506 -4.619 -3.386 6.593 1.00 0.00 C ATOM 481 CG GLN A 506 -5.023 -2.187 7.435 1.00 0.00 C ATOM 482 CD GLN A 506 -4.115 -1.982 8.632 1.00 0.00 C ATOM 483 OE1 GLN A 506 -3.610 -0.764 8.790 1.00 0.00 O flip ATOM 484 NE2 GLN A 506 -3.871 -2.908 9.406 1.00 0.00 N flip ATOM 0 H GLN A 506 -7.059 -3.793 6.395 1.00 0.00 H new ATOM 0 HA GLN A 506 -5.332 -2.469 4.785 1.00 0.00 H new ATOM 0 HB2 GLN A 506 -4.824 -4.298 7.153 1.00 0.00 H new ATOM 0 HB3 GLN A 506 -3.543 -3.352 6.420 1.00 0.00 H new ATOM 0 HG2 GLN A 506 -5.008 -1.291 6.815 1.00 0.00 H new ATOM 0 HG3 GLN A 506 -6.048 -2.319 7.780 1.00 0.00 H new ATOM 0 HE21 GLN A 506 -4.281 -3.828 9.246 1.00 0.00 H new ATOM 0 HE22 GLN A 506 -3.259 -2.755 10.207 1.00 0.00 H new ATOM 493 N LEU A 507 -4.836 -5.718 4.527 1.00 0.00 N ATOM 494 CA LEU A 507 -4.202 -6.747 3.710 1.00 0.00 C ATOM 495 C LEU A 507 -4.662 -6.651 2.259 1.00 0.00 C ATOM 496 O LEU A 507 -3.845 -6.592 1.339 1.00 0.00 O ATOM 497 CB LEU A 507 -4.519 -8.136 4.267 1.00 0.00 C ATOM 498 CG LEU A 507 -4.099 -8.391 5.715 1.00 0.00 C ATOM 499 CD1 LEU A 507 -4.554 -9.769 6.168 1.00 0.00 C ATOM 500 CD2 LEU A 507 -2.591 -8.249 5.865 1.00 0.00 C ATOM 0 H LEU A 507 -5.453 -6.078 5.255 1.00 0.00 H new ATOM 0 HA LEU A 507 -3.124 -6.587 3.741 1.00 0.00 H new ATOM 0 HB2 LEU A 507 -5.594 -8.301 4.187 1.00 0.00 H new ATOM 0 HB3 LEU A 507 -4.035 -8.879 3.633 1.00 0.00 H new ATOM 0 HG LEU A 507 -4.579 -7.646 6.349 1.00 0.00 H new ATOM 0 HD11 LEU A 507 -4.246 -9.933 7.201 1.00 0.00 H new ATOM 0 HD12 LEU A 507 -5.640 -9.835 6.098 1.00 0.00 H new ATOM 0 HD13 LEU A 507 -4.103 -10.529 5.530 1.00 0.00 H new ATOM 0 HD21 LEU A 507 -2.309 -8.434 6.902 1.00 0.00 H new ATOM 0 HD22 LEU A 507 -2.092 -8.971 5.219 1.00 0.00 H new ATOM 0 HD23 LEU A 507 -2.291 -7.240 5.582 1.00 0.00 H new ATOM 512 N THR A 508 -5.977 -6.634 2.061 1.00 0.00 N ATOM 513 CA THR A 508 -6.546 -6.544 0.722 1.00 0.00 C ATOM 514 C THR A 508 -5.928 -5.392 -0.062 1.00 0.00 C ATOM 515 O THR A 508 -5.675 -5.510 -1.260 1.00 0.00 O ATOM 516 CB THR A 508 -8.074 -6.354 0.774 1.00 0.00 C ATOM 517 OG1 THR A 508 -8.660 -7.328 1.645 1.00 0.00 O ATOM 518 CG2 THR A 508 -8.682 -6.478 -0.615 1.00 0.00 C ATOM 0 H THR A 508 -6.667 -6.681 2.811 1.00 0.00 H new ATOM 0 HA THR A 508 -6.321 -7.484 0.218 1.00 0.00 H new ATOM 0 HB THR A 508 -8.281 -5.354 1.156 1.00 0.00 H new ATOM 0 HG1 THR A 508 -9.615 -7.416 1.442 1.00 0.00 H new ATOM 0 HG21 THR A 508 -9.761 -6.340 -0.553 1.00 0.00 H new ATOM 0 HG22 THR A 508 -8.256 -5.716 -1.268 1.00 0.00 H new ATOM 0 HG23 THR A 508 -8.465 -7.466 -1.020 1.00 0.00 H new ATOM 526 N ALA A 509 -5.687 -4.279 0.622 1.00 0.00 N ATOM 527 CA ALA A 509 -5.096 -3.106 -0.010 1.00 0.00 C ATOM 528 C ALA A 509 -3.664 -3.385 -0.453 1.00 0.00 C ATOM 529 O ALA A 509 -3.286 -3.092 -1.587 1.00 0.00 O ATOM 530 CB ALA A 509 -5.135 -1.918 0.939 1.00 0.00 C ATOM 0 H ALA A 509 -5.892 -4.165 1.615 1.00 0.00 H new ATOM 0 HA ALA A 509 -5.683 -2.867 -0.897 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -4.690 -1.050 0.453 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.169 -1.696 1.202 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -4.573 -2.155 1.843 1.00 0.00 H new ATOM 536 N PHE A 510 -2.870 -3.952 0.450 1.00 0.00 N ATOM 537 CA PHE A 510 -1.478 -4.269 0.152 1.00 0.00 C ATOM 538 C PHE A 510 -1.374 -5.150 -1.090 1.00 0.00 C ATOM 539 O PHE A 510 -0.523 -4.928 -1.950 1.00 0.00 O ATOM 540 CB PHE A 510 -0.827 -4.972 1.345 1.00 0.00 C ATOM 541 CG PHE A 510 0.557 -5.481 1.059 1.00 0.00 C ATOM 542 CD1 PHE A 510 1.636 -4.613 1.025 1.00 0.00 C ATOM 543 CD2 PHE A 510 0.778 -6.828 0.823 1.00 0.00 C ATOM 544 CE1 PHE A 510 2.910 -5.079 0.761 1.00 0.00 C ATOM 545 CE2 PHE A 510 2.050 -7.300 0.558 1.00 0.00 C ATOM 546 CZ PHE A 510 3.118 -6.424 0.528 1.00 0.00 C ATOM 0 H PHE A 510 -3.167 -4.201 1.394 1.00 0.00 H new ATOM 0 HA PHE A 510 -0.952 -3.334 -0.042 1.00 0.00 H new ATOM 0 HB2 PHE A 510 -0.784 -4.279 2.186 1.00 0.00 H new ATOM 0 HB3 PHE A 510 -1.456 -5.807 1.652 1.00 0.00 H new ATOM 0 HD1 PHE A 510 1.480 -3.560 1.207 1.00 0.00 H new ATOM 0 HD2 PHE A 510 -0.053 -7.517 0.846 1.00 0.00 H new ATOM 0 HE1 PHE A 510 3.743 -4.391 0.737 1.00 0.00 H new ATOM 0 HE2 PHE A 510 2.209 -8.352 0.375 1.00 0.00 H new ATOM 0 HZ PHE A 510 4.113 -6.790 0.323 1.00 0.00 H new ATOM 556 N GLN A 511 -2.246 -6.149 -1.174 1.00 0.00 N ATOM 557 CA GLN A 511 -2.252 -7.064 -2.310 1.00 0.00 C ATOM 558 C GLN A 511 -2.505 -6.312 -3.613 1.00 0.00 C ATOM 559 O GLN A 511 -1.745 -6.441 -4.574 1.00 0.00 O ATOM 560 CB GLN A 511 -3.316 -8.145 -2.115 1.00 0.00 C ATOM 561 CG GLN A 511 -3.097 -8.998 -0.877 1.00 0.00 C ATOM 562 CD GLN A 511 -1.789 -9.763 -0.919 1.00 0.00 C ATOM 563 OE1 GLN A 511 -0.721 -9.204 -0.667 1.00 0.00 O ATOM 564 NE2 GLN A 511 -1.865 -11.050 -1.238 1.00 0.00 N ATOM 0 H GLN A 511 -2.957 -6.346 -0.470 1.00 0.00 H new ATOM 0 HA GLN A 511 -1.272 -7.537 -2.370 1.00 0.00 H new ATOM 0 HB2 GLN A 511 -4.296 -7.671 -2.051 1.00 0.00 H new ATOM 0 HB3 GLN A 511 -3.331 -8.791 -2.993 1.00 0.00 H new ATOM 0 HG2 GLN A 511 -3.112 -8.360 0.007 1.00 0.00 H new ATOM 0 HG3 GLN A 511 -3.922 -9.703 -0.775 1.00 0.00 H new ATOM 0 HE21 GLN A 511 -2.771 -11.473 -1.439 1.00 0.00 H new ATOM 0 HE22 GLN A 511 -1.017 -11.616 -1.282 1.00 0.00 H new ATOM 573 N LEU A 512 -3.577 -5.528 -3.639 1.00 0.00 N ATOM 574 CA LEU A 512 -3.931 -4.756 -4.825 1.00 0.00 C ATOM 575 C LEU A 512 -2.787 -3.836 -5.237 1.00 0.00 C ATOM 576 O LEU A 512 -2.372 -3.825 -6.397 1.00 0.00 O ATOM 577 CB LEU A 512 -5.194 -3.933 -4.563 1.00 0.00 C ATOM 578 CG LEU A 512 -6.443 -4.724 -4.173 1.00 0.00 C ATOM 579 CD1 LEU A 512 -7.474 -3.811 -3.528 1.00 0.00 C ATOM 580 CD2 LEU A 512 -7.032 -5.422 -5.390 1.00 0.00 C ATOM 0 H LEU A 512 -4.216 -5.410 -2.853 1.00 0.00 H new ATOM 0 HA LEU A 512 -4.122 -5.454 -5.640 1.00 0.00 H new ATOM 0 HB2 LEU A 512 -4.979 -3.218 -3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 512 -5.420 -3.356 -5.460 1.00 0.00 H new ATOM 0 HG LEU A 512 -6.157 -5.484 -3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 512 -8.356 -4.392 -3.257 1.00 0.00 H new ATOM 0 HD12 LEU A 512 -7.049 -3.358 -2.632 1.00 0.00 H new ATOM 0 HD13 LEU A 512 -7.757 -3.028 -4.231 1.00 0.00 H new ATOM 0 HD21 LEU A 512 -7.920 -5.980 -5.095 1.00 0.00 H new ATOM 0 HD22 LEU A 512 -7.303 -4.679 -6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 512 -6.295 -6.107 -5.808 1.00 0.00 H new ATOM 592 N LEU A 513 -2.279 -3.066 -4.281 1.00 0.00 N ATOM 593 CA LEU A 513 -1.180 -2.144 -4.544 1.00 0.00 C ATOM 594 C LEU A 513 0.050 -2.892 -5.048 1.00 0.00 C ATOM 595 O LEU A 513 0.686 -2.479 -6.018 1.00 0.00 O ATOM 596 CB LEU A 513 -0.831 -1.361 -3.277 1.00 0.00 C ATOM 597 CG LEU A 513 -1.742 -0.178 -2.946 1.00 0.00 C ATOM 598 CD1 LEU A 513 -1.393 0.400 -1.584 1.00 0.00 C ATOM 599 CD2 LEU A 513 -1.640 0.891 -4.024 1.00 0.00 C ATOM 0 H LEU A 513 -2.611 -3.062 -3.316 1.00 0.00 H new ATOM 0 HA LEU A 513 -1.501 -1.447 -5.318 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -0.844 -2.051 -2.433 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.190 -0.992 -3.372 1.00 0.00 H new ATOM 0 HG LEU A 513 -2.771 -0.535 -2.913 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -2.052 1.241 -1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -1.519 -0.367 -0.820 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -0.358 0.742 -1.588 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -2.295 1.725 -3.772 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -0.611 1.244 -4.090 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -1.941 0.470 -4.983 1.00 0.00 H new ATOM 611 N PHE A 514 0.378 -3.996 -4.385 1.00 0.00 N ATOM 612 CA PHE A 514 1.531 -4.803 -4.766 1.00 0.00 C ATOM 613 C PHE A 514 1.477 -5.161 -6.249 1.00 0.00 C ATOM 614 O PHE A 514 2.484 -5.089 -6.952 1.00 0.00 O ATOM 615 CB PHE A 514 1.589 -6.078 -3.923 1.00 0.00 C ATOM 616 CG PHE A 514 2.661 -7.036 -4.358 1.00 0.00 C ATOM 617 CD1 PHE A 514 3.999 -6.740 -4.149 1.00 0.00 C ATOM 618 CD2 PHE A 514 2.332 -8.232 -4.975 1.00 0.00 C ATOM 619 CE1 PHE A 514 4.987 -7.619 -4.548 1.00 0.00 C ATOM 620 CE2 PHE A 514 3.317 -9.115 -5.377 1.00 0.00 C ATOM 621 CZ PHE A 514 4.646 -8.809 -5.162 1.00 0.00 C ATOM 0 H PHE A 514 -0.139 -4.352 -3.581 1.00 0.00 H new ATOM 0 HA PHE A 514 2.431 -4.215 -4.584 1.00 0.00 H new ATOM 0 HB2 PHE A 514 1.756 -5.807 -2.880 1.00 0.00 H new ATOM 0 HB3 PHE A 514 0.623 -6.580 -3.971 1.00 0.00 H new ATOM 0 HD1 PHE A 514 4.272 -5.812 -3.669 1.00 0.00 H new ATOM 0 HD2 PHE A 514 1.294 -8.477 -5.144 1.00 0.00 H new ATOM 0 HE1 PHE A 514 6.026 -7.376 -4.380 1.00 0.00 H new ATOM 0 HE2 PHE A 514 3.047 -10.043 -5.859 1.00 0.00 H new ATOM 0 HZ PHE A 514 5.417 -9.498 -5.473 1.00 0.00 H new ATOM 631 N ALA A 515 0.295 -5.548 -6.715 1.00 0.00 N ATOM 632 CA ALA A 515 0.109 -5.917 -8.113 1.00 0.00 C ATOM 633 C ALA A 515 0.372 -4.730 -9.033 1.00 0.00 C ATOM 634 O ALA A 515 1.218 -4.800 -9.925 1.00 0.00 O ATOM 635 CB ALA A 515 -1.297 -6.456 -8.334 1.00 0.00 C ATOM 0 H ALA A 515 -0.548 -5.614 -6.145 1.00 0.00 H new ATOM 0 HA ALA A 515 0.829 -6.699 -8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -1.422 -6.728 -9.382 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -1.451 -7.336 -7.710 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -2.026 -5.691 -8.068 1.00 0.00 H new ATOM 641 N TRP A 516 -0.357 -3.642 -8.812 1.00 0.00 N ATOM 642 CA TRP A 516 -0.201 -2.439 -9.623 1.00 0.00 C ATOM 643 C TRP A 516 1.268 -2.052 -9.745 1.00 0.00 C ATOM 644 O TRP A 516 1.781 -1.870 -10.849 1.00 0.00 O ATOM 645 CB TRP A 516 -0.998 -1.283 -9.015 1.00 0.00 C ATOM 646 CG TRP A 516 -0.619 0.056 -9.571 1.00 0.00 C ATOM 647 CD1 TRP A 516 -1.212 0.708 -10.614 1.00 0.00 C ATOM 648 CD2 TRP A 516 0.440 0.905 -9.115 1.00 0.00 C ATOM 649 NE1 TRP A 516 -0.586 1.911 -10.833 1.00 0.00 N ATOM 650 CE2 TRP A 516 0.430 2.056 -9.926 1.00 0.00 C ATOM 651 CE3 TRP A 516 1.394 0.805 -8.099 1.00 0.00 C ATOM 652 CZ2 TRP A 516 1.338 3.097 -9.752 1.00 0.00 C ATOM 653 CZ3 TRP A 516 2.295 1.840 -7.927 1.00 0.00 C ATOM 654 CH2 TRP A 516 2.261 2.973 -8.750 1.00 0.00 C ATOM 0 H TRP A 516 -1.062 -3.568 -8.078 1.00 0.00 H new ATOM 0 HA TRP A 516 -0.585 -2.650 -10.621 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.061 -1.453 -9.188 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -0.848 -1.276 -7.935 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -2.050 0.333 -11.183 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -0.837 2.587 -11.554 1.00 0.00 H new ATOM 0 HE3 TRP A 516 1.427 -0.065 -7.460 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 1.314 3.971 -10.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 3.037 1.774 -7.145 1.00 0.00 H new ATOM 0 HH2 TRP A 516 2.978 3.765 -8.590 1.00 0.00 H new ATOM 665 N ARG A 517 1.940 -1.927 -8.605 1.00 0.00 N ATOM 666 CA ARG A 517 3.351 -1.559 -8.586 1.00 0.00 C ATOM 667 C ARG A 517 4.160 -2.463 -9.512 1.00 0.00 C ATOM 668 O ARG A 517 4.660 -2.020 -10.546 1.00 0.00 O ATOM 669 CB ARG A 517 3.903 -1.645 -7.162 1.00 0.00 C ATOM 670 CG ARG A 517 5.407 -1.445 -7.079 1.00 0.00 C ATOM 671 CD ARG A 517 5.980 -2.049 -5.806 1.00 0.00 C ATOM 672 NE ARG A 517 6.116 -3.500 -5.901 1.00 0.00 N ATOM 673 CZ ARG A 517 6.966 -4.208 -5.165 1.00 0.00 C ATOM 674 NH1 ARG A 517 7.750 -3.602 -4.285 1.00 0.00 N ATOM 675 NH2 ARG A 517 7.031 -5.525 -5.309 1.00 0.00 N ATOM 0 H ARG A 517 1.530 -2.075 -7.683 1.00 0.00 H new ATOM 0 HA ARG A 517 3.438 -0.532 -8.941 1.00 0.00 H new ATOM 0 HB2 ARG A 517 3.410 -0.894 -6.544 1.00 0.00 H new ATOM 0 HB3 ARG A 517 3.651 -2.619 -6.742 1.00 0.00 H new ATOM 0 HG2 ARG A 517 5.884 -1.901 -7.946 1.00 0.00 H new ATOM 0 HG3 ARG A 517 5.636 -0.380 -7.113 1.00 0.00 H new ATOM 0 HD2 ARG A 517 6.955 -1.606 -5.602 1.00 0.00 H new ATOM 0 HD3 ARG A 517 5.334 -1.800 -4.964 1.00 0.00 H new ATOM 0 HE ARG A 517 5.526 -3.997 -6.569 1.00 0.00 H new ATOM 0 HH11 ARG A 517 7.702 -2.590 -4.171 1.00 0.00 H new ATOM 0 HH12 ARG A 517 8.402 -4.148 -3.721 1.00 0.00 H new ATOM 0 HH21 ARG A 517 6.428 -5.994 -5.985 1.00 0.00 H new ATOM 0 HH22 ARG A 517 7.684 -6.068 -4.744 1.00 0.00 H new ATOM 689 N ASP A 518 4.285 -3.730 -9.133 1.00 0.00 N ATOM 690 CA ASP A 518 5.033 -4.696 -9.930 1.00 0.00 C ATOM 691 C ASP A 518 4.522 -4.728 -11.366 1.00 0.00 C ATOM 692 O ASP A 518 5.270 -5.026 -12.297 1.00 0.00 O ATOM 693 CB ASP A 518 4.932 -6.089 -9.307 1.00 0.00 C ATOM 694 CG ASP A 518 5.956 -7.052 -9.875 1.00 0.00 C ATOM 695 OD1 ASP A 518 6.271 -6.942 -11.078 1.00 0.00 O ATOM 696 OD2 ASP A 518 6.442 -7.916 -9.115 1.00 0.00 O ATOM 0 H ASP A 518 3.878 -4.112 -8.279 1.00 0.00 H new ATOM 0 HA ASP A 518 6.078 -4.388 -9.944 1.00 0.00 H new ATOM 0 HB2 ASP A 518 5.069 -6.012 -8.228 1.00 0.00 H new ATOM 0 HB3 ASP A 518 3.931 -6.487 -9.474 1.00 0.00 H new ATOM 701 N LYS A 519 3.241 -4.420 -11.540 1.00 0.00 N ATOM 702 CA LYS A 519 2.628 -4.413 -12.863 1.00 0.00 C ATOM 703 C LYS A 519 3.204 -3.293 -13.724 1.00 0.00 C ATOM 704 O LYS A 519 3.899 -3.547 -14.708 1.00 0.00 O ATOM 705 CB LYS A 519 1.111 -4.250 -12.743 1.00 0.00 C ATOM 706 CG LYS A 519 0.377 -4.395 -14.066 1.00 0.00 C ATOM 707 CD LYS A 519 0.269 -3.064 -14.792 1.00 0.00 C ATOM 708 CE LYS A 519 -0.725 -2.136 -14.111 1.00 0.00 C ATOM 709 NZ LYS A 519 -2.103 -2.309 -14.648 1.00 0.00 N ATOM 0 H LYS A 519 2.607 -4.172 -10.781 1.00 0.00 H new ATOM 0 HA LYS A 519 2.848 -5.366 -13.344 1.00 0.00 H new ATOM 0 HB2 LYS A 519 0.729 -4.992 -12.042 1.00 0.00 H new ATOM 0 HB3 LYS A 519 0.892 -3.269 -12.321 1.00 0.00 H new ATOM 0 HG2 LYS A 519 0.901 -5.113 -14.697 1.00 0.00 H new ATOM 0 HG3 LYS A 519 -0.621 -4.795 -13.888 1.00 0.00 H new ATOM 0 HD2 LYS A 519 1.248 -2.587 -14.827 1.00 0.00 H new ATOM 0 HD3 LYS A 519 -0.039 -3.235 -15.823 1.00 0.00 H new ATOM 0 HE2 LYS A 519 -0.726 -2.329 -13.038 1.00 0.00 H new ATOM 0 HE3 LYS A 519 -0.409 -1.102 -14.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 -2.751 -1.659 -14.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 -2.107 -2.100 -15.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 -2.415 -3.289 -14.495 1.00 0.00 H new ATOM 723 N THR A 520 2.911 -2.052 -13.347 1.00 0.00 N ATOM 724 CA THR A 520 3.400 -0.894 -14.084 1.00 0.00 C ATOM 725 C THR A 520 4.917 -0.934 -14.228 1.00 0.00 C ATOM 726 O THR A 520 5.484 -0.281 -15.103 1.00 0.00 O ATOM 727 CB THR A 520 2.996 0.423 -13.394 1.00 0.00 C ATOM 728 OG1 THR A 520 1.576 0.597 -13.464 1.00 0.00 O ATOM 729 CG2 THR A 520 3.690 1.610 -14.044 1.00 0.00 C ATOM 0 H THR A 520 2.337 -1.824 -12.535 1.00 0.00 H new ATOM 0 HA THR A 520 2.943 -0.933 -15.073 1.00 0.00 H new ATOM 0 HB THR A 520 3.304 0.370 -12.350 1.00 0.00 H new ATOM 0 HG1 THR A 520 1.327 1.435 -13.022 1.00 0.00 H new ATOM 0 HG21 THR A 520 3.389 2.528 -13.540 1.00 0.00 H new ATOM 0 HG22 THR A 520 4.770 1.489 -13.963 1.00 0.00 H new ATOM 0 HG23 THR A 520 3.409 1.665 -15.096 1.00 0.00 H new ATOM 737 N ALA A 521 5.568 -1.705 -13.363 1.00 0.00 N ATOM 738 CA ALA A 521 7.020 -1.832 -13.397 1.00 0.00 C ATOM 739 C ALA A 521 7.512 -2.141 -14.807 1.00 0.00 C ATOM 740 O ALA A 521 8.453 -1.516 -15.297 1.00 0.00 O ATOM 741 CB ALA A 521 7.477 -2.912 -12.428 1.00 0.00 C ATOM 0 H ALA A 521 5.113 -2.251 -12.631 1.00 0.00 H new ATOM 0 HA ALA A 521 7.451 -0.878 -13.092 1.00 0.00 H new ATOM 0 HB1 ALA A 521 8.563 -2.997 -12.463 1.00 0.00 H new ATOM 0 HB2 ALA A 521 7.166 -2.649 -11.417 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.030 -3.866 -12.709 1.00 0.00 H new ATOM 747 N ARG A 522 6.870 -3.109 -15.453 1.00 0.00 N ATOM 748 CA ARG A 522 7.245 -3.501 -16.807 1.00 0.00 C ATOM 749 C ARG A 522 7.063 -2.340 -17.780 1.00 0.00 C ATOM 750 O ARG A 522 7.987 -1.978 -18.509 1.00 0.00 O ATOM 751 CB ARG A 522 6.408 -4.698 -17.263 1.00 0.00 C ATOM 752 CG ARG A 522 6.802 -5.231 -18.631 1.00 0.00 C ATOM 753 CD ARG A 522 6.023 -4.544 -19.742 1.00 0.00 C ATOM 754 NE ARG A 522 6.408 -5.033 -21.063 1.00 0.00 N ATOM 755 CZ ARG A 522 5.796 -4.675 -22.186 1.00 0.00 C ATOM 756 NH1 ARG A 522 4.776 -3.829 -22.148 1.00 0.00 N ATOM 757 NH2 ARG A 522 6.205 -5.162 -23.351 1.00 0.00 N ATOM 0 H ARG A 522 6.089 -3.636 -15.062 1.00 0.00 H new ATOM 0 HA ARG A 522 8.298 -3.783 -16.798 1.00 0.00 H new ATOM 0 HB2 ARG A 522 6.504 -5.498 -16.529 1.00 0.00 H new ATOM 0 HB3 ARG A 522 5.357 -4.409 -17.284 1.00 0.00 H new ATOM 0 HG2 ARG A 522 7.870 -5.081 -18.787 1.00 0.00 H new ATOM 0 HG3 ARG A 522 6.622 -6.305 -18.670 1.00 0.00 H new ATOM 0 HD2 ARG A 522 4.956 -4.708 -19.592 1.00 0.00 H new ATOM 0 HD3 ARG A 522 6.191 -3.468 -19.691 1.00 0.00 H new ATOM 0 HE ARG A 522 7.190 -5.685 -21.127 1.00 0.00 H new ATOM 0 HH11 ARG A 522 4.460 -3.451 -21.255 1.00 0.00 H new ATOM 0 HH12 ARG A 522 4.308 -3.556 -23.012 1.00 0.00 H new ATOM 0 HH21 ARG A 522 6.990 -5.812 -23.385 1.00 0.00 H new ATOM 0 HH22 ARG A 522 5.734 -4.886 -24.213 1.00 0.00 H new ATOM 771 N ARG A 523 5.867 -1.760 -17.785 1.00 0.00 N ATOM 772 CA ARG A 523 5.564 -0.642 -18.669 1.00 0.00 C ATOM 773 C ARG A 523 6.634 0.441 -18.562 1.00 0.00 C ATOM 774 O ARG A 523 7.110 0.958 -19.573 1.00 0.00 O ATOM 775 CB ARG A 523 4.193 -0.053 -18.330 1.00 0.00 C ATOM 776 CG ARG A 523 3.837 1.175 -19.153 1.00 0.00 C ATOM 777 CD ARG A 523 2.338 1.430 -19.152 1.00 0.00 C ATOM 778 NE ARG A 523 2.021 2.823 -19.454 1.00 0.00 N ATOM 779 CZ ARG A 523 0.847 3.385 -19.184 1.00 0.00 C ATOM 780 NH1 ARG A 523 -0.114 2.676 -18.608 1.00 0.00 N ATOM 781 NH2 ARG A 523 0.634 4.659 -19.488 1.00 0.00 N ATOM 0 H ARG A 523 5.092 -2.046 -17.186 1.00 0.00 H new ATOM 0 HA ARG A 523 5.549 -1.015 -19.693 1.00 0.00 H new ATOM 0 HB2 ARG A 523 3.431 -0.817 -18.484 1.00 0.00 H new ATOM 0 HB3 ARG A 523 4.171 0.210 -17.272 1.00 0.00 H new ATOM 0 HG2 ARG A 523 4.356 2.046 -18.752 1.00 0.00 H new ATOM 0 HG3 ARG A 523 4.184 1.041 -20.178 1.00 0.00 H new ATOM 0 HD2 ARG A 523 1.859 0.782 -19.886 1.00 0.00 H new ATOM 0 HD3 ARG A 523 1.926 1.167 -18.178 1.00 0.00 H new ATOM 0 HE ARG A 523 2.740 3.396 -19.896 1.00 0.00 H new ATOM 0 HH11 ARG A 523 0.047 1.697 -18.371 1.00 0.00 H new ATOM 0 HH12 ARG A 523 -1.014 3.110 -18.402 1.00 0.00 H new ATOM 0 HH21 ARG A 523 1.372 5.208 -19.929 1.00 0.00 H new ATOM 0 HH22 ARG A 523 -0.267 5.089 -19.280 1.00 0.00 H new ATOM 795 N GLU A 524 7.007 0.778 -17.332 1.00 0.00 N ATOM 796 CA GLU A 524 8.020 1.800 -17.094 1.00 0.00 C ATOM 797 C GLU A 524 9.418 1.254 -17.369 1.00 0.00 C ATOM 798 O GLU A 524 10.357 2.014 -17.608 1.00 0.00 O ATOM 799 CB GLU A 524 7.933 2.311 -15.655 1.00 0.00 C ATOM 800 CG GLU A 524 6.870 3.377 -15.450 1.00 0.00 C ATOM 801 CD GLU A 524 7.093 4.598 -16.321 1.00 0.00 C ATOM 802 OE1 GLU A 524 7.793 5.529 -15.870 1.00 0.00 O ATOM 803 OE2 GLU A 524 6.567 4.622 -17.453 1.00 0.00 O ATOM 0 H GLU A 524 6.623 0.359 -16.485 1.00 0.00 H new ATOM 0 HA GLU A 524 7.832 2.628 -17.777 1.00 0.00 H new ATOM 0 HB2 GLU A 524 7.725 1.471 -14.992 1.00 0.00 H new ATOM 0 HB3 GLU A 524 8.902 2.716 -15.363 1.00 0.00 H new ATOM 0 HG2 GLU A 524 5.890 2.954 -15.668 1.00 0.00 H new ATOM 0 HG3 GLU A 524 6.861 3.679 -14.403 1.00 0.00 H new ATOM 810 N ASP A 525 9.548 -0.067 -17.331 1.00 0.00 N ATOM 811 CA ASP A 525 10.831 -0.716 -17.576 1.00 0.00 C ATOM 812 C ASP A 525 11.910 -0.152 -16.657 1.00 0.00 C ATOM 813 O ASP A 525 13.001 0.196 -17.105 1.00 0.00 O ATOM 814 CB ASP A 525 11.246 -0.539 -19.038 1.00 0.00 C ATOM 815 CG ASP A 525 12.503 -1.314 -19.381 1.00 0.00 C ATOM 816 OD1 ASP A 525 12.497 -2.553 -19.226 1.00 0.00 O ATOM 817 OD2 ASP A 525 13.492 -0.681 -19.805 1.00 0.00 O ATOM 0 H ASP A 525 8.781 -0.710 -17.133 1.00 0.00 H new ATOM 0 HA ASP A 525 10.718 -1.779 -17.364 1.00 0.00 H new ATOM 0 HB2 ASP A 525 10.433 -0.866 -19.686 1.00 0.00 H new ATOM 0 HB3 ASP A 525 11.409 0.520 -19.241 1.00 0.00 H new ATOM 822 N GLU A 526 11.595 -0.064 -15.368 1.00 0.00 N ATOM 823 CA GLU A 526 12.537 0.460 -14.386 1.00 0.00 C ATOM 824 C GLU A 526 12.549 -0.405 -13.129 1.00 0.00 C ATOM 825 O GLU A 526 11.721 -1.301 -12.971 1.00 0.00 O ATOM 826 CB GLU A 526 12.180 1.903 -14.023 1.00 0.00 C ATOM 827 CG GLU A 526 13.358 2.708 -13.500 1.00 0.00 C ATOM 828 CD GLU A 526 13.173 4.201 -13.689 1.00 0.00 C ATOM 829 OE1 GLU A 526 13.117 4.650 -14.853 1.00 0.00 O ATOM 830 OE2 GLU A 526 13.085 4.921 -12.672 1.00 0.00 O ATOM 0 H GLU A 526 10.696 -0.349 -14.980 1.00 0.00 H new ATOM 0 HA GLU A 526 13.533 0.441 -14.829 1.00 0.00 H new ATOM 0 HB2 GLU A 526 11.773 2.400 -14.904 1.00 0.00 H new ATOM 0 HB3 GLU A 526 11.393 1.895 -13.269 1.00 0.00 H new ATOM 0 HG2 GLU A 526 13.498 2.494 -12.440 1.00 0.00 H new ATOM 0 HG3 GLU A 526 14.266 2.390 -14.012 1.00 0.00 H new ATOM 837 N SER A 527 13.495 -0.128 -12.237 1.00 0.00 N ATOM 838 CA SER A 527 13.619 -0.883 -10.995 1.00 0.00 C ATOM 839 C SER A 527 12.339 -0.786 -10.171 1.00 0.00 C ATOM 840 O SER A 527 11.578 0.174 -10.294 1.00 0.00 O ATOM 841 CB SER A 527 14.805 -0.368 -10.177 1.00 0.00 C ATOM 842 OG SER A 527 15.318 -1.381 -9.329 1.00 0.00 O ATOM 0 H SER A 527 14.186 0.613 -12.351 1.00 0.00 H new ATOM 0 HA SER A 527 13.789 -1.929 -11.250 1.00 0.00 H new ATOM 0 HB2 SER A 527 15.590 -0.019 -10.848 1.00 0.00 H new ATOM 0 HB3 SER A 527 14.494 0.488 -9.579 1.00 0.00 H new ATOM 0 HG SER A 527 16.076 -1.027 -8.818 1.00 0.00 H new ATOM 848 N TYR A 528 12.107 -1.789 -9.331 1.00 0.00 N ATOM 849 CA TYR A 528 10.918 -1.820 -8.488 1.00 0.00 C ATOM 850 C TYR A 528 10.922 -0.660 -7.497 1.00 0.00 C ATOM 851 O TYR A 528 10.003 0.158 -7.477 1.00 0.00 O ATOM 852 CB TYR A 528 10.836 -3.149 -7.734 1.00 0.00 C ATOM 853 CG TYR A 528 10.422 -4.314 -8.605 1.00 0.00 C ATOM 854 CD1 TYR A 528 9.138 -4.393 -9.130 1.00 0.00 C ATOM 855 CD2 TYR A 528 11.315 -5.337 -8.901 1.00 0.00 C ATOM 856 CE1 TYR A 528 8.755 -5.456 -9.925 1.00 0.00 C ATOM 857 CE2 TYR A 528 10.941 -6.403 -9.696 1.00 0.00 C ATOM 858 CZ TYR A 528 9.660 -6.458 -10.205 1.00 0.00 C ATOM 859 OH TYR A 528 9.284 -7.519 -10.997 1.00 0.00 O ATOM 0 H TYR A 528 12.727 -2.591 -9.216 1.00 0.00 H new ATOM 0 HA TYR A 528 10.044 -1.721 -9.132 1.00 0.00 H new ATOM 0 HB2 TYR A 528 11.807 -3.366 -7.289 1.00 0.00 H new ATOM 0 HB3 TYR A 528 10.125 -3.049 -6.914 1.00 0.00 H new ATOM 0 HD1 TYR A 528 8.427 -3.610 -8.913 1.00 0.00 H new ATOM 0 HD2 TYR A 528 12.318 -5.298 -8.503 1.00 0.00 H new ATOM 0 HE1 TYR A 528 7.753 -5.502 -10.325 1.00 0.00 H new ATOM 0 HE2 TYR A 528 11.648 -7.189 -9.918 1.00 0.00 H new ATOM 0 HH TYR A 528 8.314 -7.497 -11.135 1.00 0.00 H new ATOM 869 N GLY A 529 11.965 -0.596 -6.675 1.00 0.00 N ATOM 870 CA GLY A 529 12.071 0.467 -5.693 1.00 0.00 C ATOM 871 C GLY A 529 11.581 1.799 -6.225 1.00 0.00 C ATOM 872 O GLY A 529 10.695 2.421 -5.639 1.00 0.00 O ATOM 0 H GLY A 529 12.738 -1.261 -6.672 1.00 0.00 H new ATOM 0 HA2 GLY A 529 11.494 0.199 -4.808 1.00 0.00 H new ATOM 0 HA3 GLY A 529 13.110 0.565 -5.379 1.00 0.00 H new ATOM 876 N TYR A 530 12.159 2.239 -7.337 1.00 0.00 N ATOM 877 CA TYR A 530 11.778 3.508 -7.946 1.00 0.00 C ATOM 878 C TYR A 530 10.261 3.653 -7.999 1.00 0.00 C ATOM 879 O TYR A 530 9.696 4.602 -7.454 1.00 0.00 O ATOM 880 CB TYR A 530 12.362 3.617 -9.355 1.00 0.00 C ATOM 881 CG TYR A 530 11.594 4.556 -10.258 1.00 0.00 C ATOM 882 CD1 TYR A 530 11.502 5.911 -9.966 1.00 0.00 C ATOM 883 CD2 TYR A 530 10.959 4.088 -11.402 1.00 0.00 C ATOM 884 CE1 TYR A 530 10.801 6.773 -10.787 1.00 0.00 C ATOM 885 CE2 TYR A 530 10.258 4.943 -12.230 1.00 0.00 C ATOM 886 CZ TYR A 530 10.181 6.284 -11.918 1.00 0.00 C ATOM 887 OH TYR A 530 9.481 7.138 -12.739 1.00 0.00 O ATOM 0 H TYR A 530 12.893 1.736 -7.835 1.00 0.00 H new ATOM 0 HA TYR A 530 12.180 4.313 -7.330 1.00 0.00 H new ATOM 0 HB2 TYR A 530 13.395 3.957 -9.286 1.00 0.00 H new ATOM 0 HB3 TYR A 530 12.382 2.626 -9.808 1.00 0.00 H new ATOM 0 HD1 TYR A 530 11.987 6.297 -9.082 1.00 0.00 H new ATOM 0 HD2 TYR A 530 11.015 3.038 -11.648 1.00 0.00 H new ATOM 0 HE1 TYR A 530 10.739 7.824 -10.545 1.00 0.00 H new ATOM 0 HE2 TYR A 530 9.773 4.563 -13.117 1.00 0.00 H new ATOM 0 HH TYR A 530 9.106 6.634 -13.492 1.00 0.00 H new ATOM 897 N VAL A 531 9.604 2.705 -8.660 1.00 0.00 N ATOM 898 CA VAL A 531 8.152 2.724 -8.784 1.00 0.00 C ATOM 899 C VAL A 531 7.489 2.991 -7.437 1.00 0.00 C ATOM 900 O VAL A 531 6.816 4.007 -7.254 1.00 0.00 O ATOM 901 CB VAL A 531 7.619 1.396 -9.352 1.00 0.00 C ATOM 902 CG1 VAL A 531 6.101 1.425 -9.446 1.00 0.00 C ATOM 903 CG2 VAL A 531 8.240 1.110 -10.711 1.00 0.00 C ATOM 0 H VAL A 531 10.055 1.913 -9.118 1.00 0.00 H new ATOM 0 HA VAL A 531 7.904 3.530 -9.474 1.00 0.00 H new ATOM 0 HB VAL A 531 7.901 0.592 -8.672 1.00 0.00 H new ATOM 0 HG11 VAL A 531 5.743 0.478 -9.850 1.00 0.00 H new ATOM 0 HG12 VAL A 531 5.678 1.579 -8.453 1.00 0.00 H new ATOM 0 HG13 VAL A 531 5.793 2.239 -10.102 1.00 0.00 H new ATOM 0 HG21 VAL A 531 7.852 0.168 -11.097 1.00 0.00 H new ATOM 0 HG22 VAL A 531 7.991 1.916 -11.402 1.00 0.00 H new ATOM 0 HG23 VAL A 531 9.323 1.042 -10.609 1.00 0.00 H new ATOM 913 N LEU A 532 7.683 2.073 -6.496 1.00 0.00 N ATOM 914 CA LEU A 532 7.104 2.209 -5.164 1.00 0.00 C ATOM 915 C LEU A 532 7.769 1.250 -4.182 1.00 0.00 C ATOM 916 O LEU A 532 7.710 0.029 -4.330 1.00 0.00 O ATOM 917 CB LEU A 532 5.598 1.945 -5.212 1.00 0.00 C ATOM 918 CG LEU A 532 4.863 2.012 -3.873 1.00 0.00 C ATOM 919 CD1 LEU A 532 4.593 3.457 -3.483 1.00 0.00 C ATOM 920 CD2 LEU A 532 3.562 1.224 -3.939 1.00 0.00 C ATOM 0 H LEU A 532 8.237 1.227 -6.631 1.00 0.00 H new ATOM 0 HA LEU A 532 7.277 3.229 -4.821 1.00 0.00 H new ATOM 0 HB2 LEU A 532 5.144 2.668 -5.890 1.00 0.00 H new ATOM 0 HB3 LEU A 532 5.436 0.957 -5.644 1.00 0.00 H new ATOM 0 HG LEU A 532 5.499 1.564 -3.109 1.00 0.00 H new ATOM 0 HD11 LEU A 532 4.069 3.484 -2.527 1.00 0.00 H new ATOM 0 HD12 LEU A 532 5.538 3.993 -3.394 1.00 0.00 H new ATOM 0 HD13 LEU A 532 3.978 3.931 -4.248 1.00 0.00 H new ATOM 0 HD21 LEU A 532 3.052 1.283 -2.977 1.00 0.00 H new ATOM 0 HD22 LEU A 532 2.922 1.643 -4.715 1.00 0.00 H new ATOM 0 HD23 LEU A 532 3.779 0.182 -4.171 1.00 0.00 H new ATOM 932 N PRO A 533 8.417 1.814 -3.151 1.00 0.00 N ATOM 933 CA PRO A 533 9.103 1.027 -2.122 1.00 0.00 C ATOM 934 C PRO A 533 8.129 0.272 -1.224 1.00 0.00 C ATOM 935 O PRO A 533 6.913 0.389 -1.374 1.00 0.00 O ATOM 936 CB PRO A 533 9.863 2.083 -1.316 1.00 0.00 C ATOM 937 CG PRO A 533 9.093 3.342 -1.519 1.00 0.00 C ATOM 938 CD PRO A 533 8.528 3.262 -2.911 1.00 0.00 C ATOM 0 HA PRO A 533 9.743 0.259 -2.556 1.00 0.00 H new ATOM 0 HB2 PRO A 533 9.913 1.815 -0.261 1.00 0.00 H new ATOM 0 HB3 PRO A 533 10.890 2.186 -1.667 1.00 0.00 H new ATOM 0 HG2 PRO A 533 8.298 3.436 -0.780 1.00 0.00 H new ATOM 0 HG3 PRO A 533 9.736 4.215 -1.408 1.00 0.00 H new ATOM 0 HD2 PRO A 533 7.559 3.756 -2.980 1.00 0.00 H new ATOM 0 HD3 PRO A 533 9.183 3.741 -3.639 1.00 0.00 H new ATOM 946 N ASN A 534 8.671 -0.503 -0.290 1.00 0.00 N ATOM 947 CA ASN A 534 7.849 -1.277 0.633 1.00 0.00 C ATOM 948 C ASN A 534 7.249 -0.380 1.711 1.00 0.00 C ATOM 949 O ASN A 534 6.028 -0.279 1.841 1.00 0.00 O ATOM 950 CB ASN A 534 8.680 -2.387 1.281 1.00 0.00 C ATOM 951 CG ASN A 534 9.588 -3.084 0.287 1.00 0.00 C ATOM 952 OD1 ASN A 534 10.767 -2.751 0.166 1.00 0.00 O ATOM 953 ND2 ASN A 534 9.042 -4.059 -0.431 1.00 0.00 N ATOM 0 H ASN A 534 9.676 -0.612 -0.152 1.00 0.00 H new ATOM 0 HA ASN A 534 7.034 -1.727 0.065 1.00 0.00 H new ATOM 0 HB2 ASN A 534 9.283 -1.964 2.085 1.00 0.00 H new ATOM 0 HB3 ASN A 534 8.012 -3.119 1.735 1.00 0.00 H new ATOM 0 HD21 ASN A 534 9.604 -4.565 -1.115 1.00 0.00 H new ATOM 0 HD22 ASN A 534 8.060 -4.302 -0.298 1.00 0.00 H new ATOM 960 N HIS A 535 8.115 0.270 2.482 1.00 0.00 N ATOM 961 CA HIS A 535 7.670 1.160 3.549 1.00 0.00 C ATOM 962 C HIS A 535 6.519 2.043 3.076 1.00 0.00 C ATOM 963 O HIS A 535 5.507 2.179 3.762 1.00 0.00 O ATOM 964 CB HIS A 535 8.831 2.031 4.032 1.00 0.00 C ATOM 965 CG HIS A 535 9.717 2.515 2.926 1.00 0.00 C ATOM 966 ND1 HIS A 535 9.462 3.663 2.205 1.00 0.00 N ATOM 967 CD2 HIS A 535 10.862 2.001 2.419 1.00 0.00 C ATOM 968 CE1 HIS A 535 10.411 3.833 1.302 1.00 0.00 C ATOM 969 NE2 HIS A 535 11.273 2.839 1.411 1.00 0.00 N ATOM 0 H HIS A 535 9.128 0.197 2.388 1.00 0.00 H new ATOM 0 HA HIS A 535 7.317 0.546 4.377 1.00 0.00 H new ATOM 0 HB2 HIS A 535 8.430 2.891 4.568 1.00 0.00 H new ATOM 0 HB3 HIS A 535 9.430 1.462 4.744 1.00 0.00 H new ATOM 0 HD2 HIS A 535 11.360 1.100 2.746 1.00 0.00 H new ATOM 0 HE1 HIS A 535 10.471 4.647 0.595 1.00 0.00 H new ATOM 0 HE2 HIS A 535 12.109 2.714 0.840 1.00 0.00 H new ATOM 977 N MET A 536 6.683 2.640 1.900 1.00 0.00 N ATOM 978 CA MET A 536 5.656 3.509 1.335 1.00 0.00 C ATOM 979 C MET A 536 4.400 2.715 0.991 1.00 0.00 C ATOM 980 O MET A 536 3.307 3.031 1.460 1.00 0.00 O ATOM 981 CB MET A 536 6.186 4.215 0.086 1.00 0.00 C ATOM 982 CG MET A 536 5.280 5.328 -0.414 1.00 0.00 C ATOM 983 SD MET A 536 6.011 6.262 -1.772 1.00 0.00 S ATOM 984 CE MET A 536 7.266 7.199 -0.901 1.00 0.00 C ATOM 0 H MET A 536 7.516 2.538 1.320 1.00 0.00 H new ATOM 0 HA MET A 536 5.397 4.257 2.084 1.00 0.00 H new ATOM 0 HB2 MET A 536 7.171 4.629 0.303 1.00 0.00 H new ATOM 0 HB3 MET A 536 6.317 3.480 -0.708 1.00 0.00 H new ATOM 0 HG2 MET A 536 4.332 4.900 -0.741 1.00 0.00 H new ATOM 0 HG3 MET A 536 5.056 6.006 0.409 1.00 0.00 H new ATOM 0 HE1 MET A 536 7.609 8.020 -1.530 1.00 0.00 H new ATOM 0 HE2 MET A 536 6.846 7.600 0.021 1.00 0.00 H new ATOM 0 HE3 MET A 536 8.107 6.548 -0.664 1.00 0.00 H new ATOM 994 N MET A 537 4.565 1.683 0.169 1.00 0.00 N ATOM 995 CA MET A 537 3.443 0.844 -0.237 1.00 0.00 C ATOM 996 C MET A 537 2.589 0.458 0.967 1.00 0.00 C ATOM 997 O MET A 537 1.363 0.566 0.931 1.00 0.00 O ATOM 998 CB MET A 537 3.950 -0.416 -0.942 1.00 0.00 C ATOM 999 CG MET A 537 2.837 -1.316 -1.452 1.00 0.00 C ATOM 1000 SD MET A 537 3.395 -2.448 -2.740 1.00 0.00 S ATOM 1001 CE MET A 537 4.441 -3.551 -1.792 1.00 0.00 C ATOM 0 H MET A 537 5.463 1.408 -0.228 1.00 0.00 H new ATOM 0 HA MET A 537 2.826 1.416 -0.930 1.00 0.00 H new ATOM 0 HB2 MET A 537 4.583 -0.124 -1.780 1.00 0.00 H new ATOM 0 HB3 MET A 537 4.576 -0.982 -0.252 1.00 0.00 H new ATOM 0 HG2 MET A 537 2.430 -1.891 -0.620 1.00 0.00 H new ATOM 0 HG3 MET A 537 2.026 -0.700 -1.841 1.00 0.00 H new ATOM 0 HE1 MET A 537 5.440 -3.570 -2.229 1.00 0.00 H new ATOM 0 HE2 MET A 537 4.502 -3.199 -0.762 1.00 0.00 H new ATOM 0 HE3 MET A 537 4.019 -4.556 -1.808 1.00 0.00 H new ATOM 1011 N LEU A 538 3.245 0.008 2.032 1.00 0.00 N ATOM 1012 CA LEU A 538 2.545 -0.394 3.247 1.00 0.00 C ATOM 1013 C LEU A 538 1.809 0.789 3.868 1.00 0.00 C ATOM 1014 O LEU A 538 0.603 0.727 4.109 1.00 0.00 O ATOM 1015 CB LEU A 538 3.532 -0.982 4.256 1.00 0.00 C ATOM 1016 CG LEU A 538 3.950 -2.434 4.019 1.00 0.00 C ATOM 1017 CD1 LEU A 538 5.228 -2.753 4.779 1.00 0.00 C ATOM 1018 CD2 LEU A 538 2.833 -3.383 4.427 1.00 0.00 C ATOM 0 H LEU A 538 4.259 -0.087 2.078 1.00 0.00 H new ATOM 0 HA LEU A 538 1.811 -1.155 2.980 1.00 0.00 H new ATOM 0 HB2 LEU A 538 4.429 -0.363 4.260 1.00 0.00 H new ATOM 0 HB3 LEU A 538 3.091 -0.910 5.250 1.00 0.00 H new ATOM 0 HG LEU A 538 4.143 -2.568 2.955 1.00 0.00 H new ATOM 0 HD11 LEU A 538 5.510 -3.790 4.598 1.00 0.00 H new ATOM 0 HD12 LEU A 538 6.028 -2.095 4.438 1.00 0.00 H new ATOM 0 HD13 LEU A 538 5.064 -2.602 5.846 1.00 0.00 H new ATOM 0 HD21 LEU A 538 3.147 -4.412 4.252 1.00 0.00 H new ATOM 0 HD22 LEU A 538 2.609 -3.247 5.485 1.00 0.00 H new ATOM 0 HD23 LEU A 538 1.941 -3.171 3.837 1.00 0.00 H new ATOM 1030 N LYS A 539 2.542 1.867 4.124 1.00 0.00 N ATOM 1031 CA LYS A 539 1.960 3.067 4.714 1.00 0.00 C ATOM 1032 C LYS A 539 0.590 3.360 4.111 1.00 0.00 C ATOM 1033 O LYS A 539 -0.389 3.546 4.833 1.00 0.00 O ATOM 1034 CB LYS A 539 2.889 4.265 4.505 1.00 0.00 C ATOM 1035 CG LYS A 539 2.399 5.538 5.173 1.00 0.00 C ATOM 1036 CD LYS A 539 3.530 6.532 5.377 1.00 0.00 C ATOM 1037 CE LYS A 539 3.010 7.876 5.862 1.00 0.00 C ATOM 1038 NZ LYS A 539 2.337 7.766 7.186 1.00 0.00 N ATOM 0 H LYS A 539 3.541 1.934 3.932 1.00 0.00 H new ATOM 0 HA LYS A 539 1.837 2.893 5.783 1.00 0.00 H new ATOM 0 HB2 LYS A 539 3.878 4.019 4.892 1.00 0.00 H new ATOM 0 HB3 LYS A 539 3.001 4.445 3.436 1.00 0.00 H new ATOM 0 HG2 LYS A 539 1.619 5.993 4.563 1.00 0.00 H new ATOM 0 HG3 LYS A 539 1.949 5.295 6.136 1.00 0.00 H new ATOM 0 HD2 LYS A 539 4.240 6.133 6.101 1.00 0.00 H new ATOM 0 HD3 LYS A 539 4.071 6.666 4.440 1.00 0.00 H new ATOM 0 HE2 LYS A 539 3.838 8.581 5.933 1.00 0.00 H new ATOM 0 HE3 LYS A 539 2.309 8.279 5.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 539 2.057 8.713 7.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 539 1.492 7.166 7.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 539 2.992 7.342 7.874 1.00 0.00 H new ATOM 1052 N ILE A 540 0.529 3.398 2.784 1.00 0.00 N ATOM 1053 CA ILE A 540 -0.722 3.666 2.085 1.00 0.00 C ATOM 1054 C ILE A 540 -1.731 2.546 2.316 1.00 0.00 C ATOM 1055 O ILE A 540 -2.879 2.798 2.681 1.00 0.00 O ATOM 1056 CB ILE A 540 -0.495 3.833 0.571 1.00 0.00 C ATOM 1057 CG1 ILE A 540 0.479 4.982 0.302 1.00 0.00 C ATOM 1058 CG2 ILE A 540 -1.819 4.077 -0.139 1.00 0.00 C ATOM 1059 CD1 ILE A 540 1.179 4.880 -1.035 1.00 0.00 C ATOM 0 H ILE A 540 1.331 3.247 2.172 1.00 0.00 H new ATOM 0 HA ILE A 540 -1.118 4.597 2.490 1.00 0.00 H new ATOM 0 HB ILE A 540 -0.059 2.913 0.181 1.00 0.00 H new ATOM 0 HG12 ILE A 540 -0.064 5.926 0.348 1.00 0.00 H new ATOM 0 HG13 ILE A 540 1.227 5.006 1.094 1.00 0.00 H new ATOM 0 HG21 ILE A 540 -1.642 4.193 -1.208 1.00 0.00 H new ATOM 0 HG22 ILE A 540 -2.484 3.230 0.029 1.00 0.00 H new ATOM 0 HG23 ILE A 540 -2.280 4.983 0.253 1.00 0.00 H new ATOM 0 HD11 ILE A 540 1.854 5.727 -1.158 1.00 0.00 H new ATOM 0 HD12 ILE A 540 1.750 3.952 -1.077 1.00 0.00 H new ATOM 0 HD13 ILE A 540 0.439 4.887 -1.835 1.00 0.00 H new ATOM 1071 N ALA A 541 -1.294 1.309 2.102 1.00 0.00 N ATOM 1072 CA ALA A 541 -2.158 0.151 2.291 1.00 0.00 C ATOM 1073 C ALA A 541 -2.819 0.177 3.665 1.00 0.00 C ATOM 1074 O ALA A 541 -3.972 -0.226 3.817 1.00 0.00 O ATOM 1075 CB ALA A 541 -1.365 -1.135 2.109 1.00 0.00 C ATOM 0 H ALA A 541 -0.347 1.084 1.798 1.00 0.00 H new ATOM 0 HA ALA A 541 -2.945 0.189 1.538 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -2.023 -1.992 2.253 1.00 0.00 H new ATOM 0 HB2 ALA A 541 -0.946 -1.165 1.103 1.00 0.00 H new ATOM 0 HB3 ALA A 541 -0.557 -1.171 2.840 1.00 0.00 H new ATOM 1081 N GLU A 542 -2.080 0.652 4.663 1.00 0.00 N ATOM 1082 CA GLU A 542 -2.596 0.729 6.025 1.00 0.00 C ATOM 1083 C GLU A 542 -3.530 1.924 6.187 1.00 0.00 C ATOM 1084 O GLU A 542 -4.542 1.843 6.882 1.00 0.00 O ATOM 1085 CB GLU A 542 -1.442 0.829 7.026 1.00 0.00 C ATOM 1086 CG GLU A 542 -0.455 -0.322 6.934 1.00 0.00 C ATOM 1087 CD GLU A 542 0.429 -0.432 8.162 1.00 0.00 C ATOM 1088 OE1 GLU A 542 -0.035 -0.062 9.261 1.00 0.00 O ATOM 1089 OE2 GLU A 542 1.583 -0.887 8.024 1.00 0.00 O ATOM 0 H GLU A 542 -1.123 0.989 4.554 1.00 0.00 H new ATOM 0 HA GLU A 542 -3.162 -0.181 6.224 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -0.910 1.766 6.862 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -1.850 0.866 8.036 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -1.002 -1.255 6.800 1.00 0.00 H new ATOM 0 HG3 GLU A 542 0.171 -0.190 6.051 1.00 0.00 H new ATOM 1096 N GLU A 543 -3.181 3.032 5.541 1.00 0.00 N ATOM 1097 CA GLU A 543 -3.988 4.245 5.615 1.00 0.00 C ATOM 1098 C GLU A 543 -5.381 4.007 5.041 1.00 0.00 C ATOM 1099 O GLU A 543 -6.381 4.467 5.595 1.00 0.00 O ATOM 1100 CB GLU A 543 -3.302 5.387 4.862 1.00 0.00 C ATOM 1101 CG GLU A 543 -2.069 5.927 5.568 1.00 0.00 C ATOM 1102 CD GLU A 543 -2.415 6.838 6.730 1.00 0.00 C ATOM 1103 OE1 GLU A 543 -3.235 7.760 6.538 1.00 0.00 O ATOM 1104 OE2 GLU A 543 -1.865 6.628 7.831 1.00 0.00 O ATOM 0 H GLU A 543 -2.346 3.115 4.961 1.00 0.00 H new ATOM 0 HA GLU A 543 -4.089 4.521 6.665 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -3.018 5.038 3.869 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -4.015 6.199 4.722 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -1.468 5.093 5.931 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -1.455 6.474 4.852 1.00 0.00 H new ATOM 1111 N LEU A 544 -5.440 3.286 3.926 1.00 0.00 N ATOM 1112 CA LEU A 544 -6.711 2.987 3.275 1.00 0.00 C ATOM 1113 C LEU A 544 -7.485 4.267 2.976 1.00 0.00 C ATOM 1114 O LEU A 544 -8.657 4.409 3.326 1.00 0.00 O ATOM 1115 CB LEU A 544 -7.553 2.063 4.156 1.00 0.00 C ATOM 1116 CG LEU A 544 -6.982 0.666 4.402 1.00 0.00 C ATOM 1117 CD1 LEU A 544 -8.013 -0.221 5.082 1.00 0.00 C ATOM 1118 CD2 LEU A 544 -6.520 0.041 3.093 1.00 0.00 C ATOM 0 H LEU A 544 -4.623 2.898 3.454 1.00 0.00 H new ATOM 0 HA LEU A 544 -6.498 2.485 2.331 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -7.700 2.549 5.121 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -8.537 1.956 3.700 1.00 0.00 H new ATOM 0 HG LEU A 544 -6.120 0.759 5.063 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -7.588 -1.211 5.249 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -8.296 0.218 6.039 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -8.895 -0.307 4.447 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -6.116 -0.953 3.287 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -7.365 -0.037 2.409 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -5.747 0.665 2.645 1.00 0.00 H new ATOM 1130 N PRO A 545 -6.816 5.222 2.312 1.00 0.00 N ATOM 1131 CA PRO A 545 -7.422 6.506 1.949 1.00 0.00 C ATOM 1132 C PRO A 545 -8.485 6.360 0.865 1.00 0.00 C ATOM 1133 O PRO A 545 -8.180 6.006 -0.274 1.00 0.00 O ATOM 1134 CB PRO A 545 -6.237 7.323 1.429 1.00 0.00 C ATOM 1135 CG PRO A 545 -5.255 6.307 0.956 1.00 0.00 C ATOM 1136 CD PRO A 545 -5.417 5.120 1.865 1.00 0.00 C ATOM 0 HA PRO A 545 -7.938 6.966 2.792 1.00 0.00 H new ATOM 0 HB2 PRO A 545 -6.539 7.988 0.620 1.00 0.00 H new ATOM 0 HB3 PRO A 545 -5.812 7.949 2.214 1.00 0.00 H new ATOM 0 HG2 PRO A 545 -5.446 6.033 -0.082 1.00 0.00 H new ATOM 0 HG3 PRO A 545 -4.238 6.697 1.001 1.00 0.00 H new ATOM 0 HD2 PRO A 545 -5.230 4.183 1.340 1.00 0.00 H new ATOM 0 HD3 PRO A 545 -4.723 5.159 2.705 1.00 0.00 H new ATOM 1144 N LYS A 546 -9.733 6.635 1.227 1.00 0.00 N ATOM 1145 CA LYS A 546 -10.842 6.535 0.285 1.00 0.00 C ATOM 1146 C LYS A 546 -10.603 7.422 -0.933 1.00 0.00 C ATOM 1147 O LYS A 546 -10.848 7.013 -2.067 1.00 0.00 O ATOM 1148 CB LYS A 546 -12.154 6.931 0.967 1.00 0.00 C ATOM 1149 CG LYS A 546 -12.172 8.365 1.466 1.00 0.00 C ATOM 1150 CD LYS A 546 -13.098 8.529 2.660 1.00 0.00 C ATOM 1151 CE LYS A 546 -12.986 9.920 3.265 1.00 0.00 C ATOM 1152 NZ LYS A 546 -11.768 10.060 4.111 1.00 0.00 N ATOM 0 H LYS A 546 -10.002 6.929 2.166 1.00 0.00 H new ATOM 0 HA LYS A 546 -10.910 5.500 -0.049 1.00 0.00 H new ATOM 0 HB2 LYS A 546 -12.976 6.789 0.265 1.00 0.00 H new ATOM 0 HB3 LYS A 546 -12.334 6.261 1.807 1.00 0.00 H new ATOM 0 HG2 LYS A 546 -11.162 8.667 1.743 1.00 0.00 H new ATOM 0 HG3 LYS A 546 -12.493 9.027 0.662 1.00 0.00 H new ATOM 0 HD2 LYS A 546 -14.127 8.347 2.351 1.00 0.00 H new ATOM 0 HD3 LYS A 546 -12.855 7.782 3.416 1.00 0.00 H new ATOM 0 HE2 LYS A 546 -12.961 10.662 2.467 1.00 0.00 H new ATOM 0 HE3 LYS A 546 -13.871 10.127 3.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 546 -11.728 11.022 4.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 546 -11.803 9.369 4.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 546 -10.921 9.887 3.532 1.00 0.00 H new ATOM 1166 N GLU A 547 -10.121 8.637 -0.689 1.00 0.00 N ATOM 1167 CA GLU A 547 -9.848 9.580 -1.767 1.00 0.00 C ATOM 1168 C GLU A 547 -8.408 9.448 -2.254 1.00 0.00 C ATOM 1169 O GLU A 547 -7.539 8.917 -1.563 1.00 0.00 O ATOM 1170 CB GLU A 547 -10.111 11.013 -1.300 1.00 0.00 C ATOM 1171 CG GLU A 547 -11.539 11.477 -1.531 1.00 0.00 C ATOM 1172 CD GLU A 547 -11.825 12.824 -0.896 1.00 0.00 C ATOM 1173 OE1 GLU A 547 -11.558 13.855 -1.549 1.00 0.00 O ATOM 1174 OE2 GLU A 547 -12.315 12.848 0.252 1.00 0.00 O ATOM 0 H GLU A 547 -9.912 8.991 0.245 1.00 0.00 H new ATOM 0 HA GLU A 547 -10.516 9.348 -2.596 1.00 0.00 H new ATOM 0 HB2 GLU A 547 -9.881 11.087 -0.237 1.00 0.00 H new ATOM 0 HB3 GLU A 547 -9.431 11.686 -1.821 1.00 0.00 H new ATOM 0 HG2 GLU A 547 -11.729 11.537 -2.603 1.00 0.00 H new ATOM 0 HG3 GLU A 547 -12.228 10.735 -1.127 1.00 0.00 H new ATOM 1181 N PRO A 548 -8.149 9.942 -3.474 1.00 0.00 N ATOM 1182 CA PRO A 548 -6.816 9.891 -4.082 1.00 0.00 C ATOM 1183 C PRO A 548 -5.827 10.821 -3.387 1.00 0.00 C ATOM 1184 O PRO A 548 -4.614 10.664 -3.524 1.00 0.00 O ATOM 1185 CB PRO A 548 -7.064 10.352 -5.520 1.00 0.00 C ATOM 1186 CG PRO A 548 -8.293 11.191 -5.443 1.00 0.00 C ATOM 1187 CD PRO A 548 -9.137 10.588 -4.354 1.00 0.00 C ATOM 0 HA PRO A 548 -6.372 8.898 -4.009 1.00 0.00 H new ATOM 0 HB2 PRO A 548 -6.219 10.923 -5.904 1.00 0.00 H new ATOM 0 HB3 PRO A 548 -7.206 9.503 -6.189 1.00 0.00 H new ATOM 0 HG2 PRO A 548 -8.044 12.228 -5.216 1.00 0.00 H new ATOM 0 HG3 PRO A 548 -8.825 11.192 -6.394 1.00 0.00 H new ATOM 0 HD2 PRO A 548 -9.711 11.348 -3.824 1.00 0.00 H new ATOM 0 HD3 PRO A 548 -9.852 9.868 -4.752 1.00 0.00 H new ATOM 1195 N GLN A 549 -6.353 11.788 -2.643 1.00 0.00 N ATOM 1196 CA GLN A 549 -5.515 12.743 -1.928 1.00 0.00 C ATOM 1197 C GLN A 549 -4.789 12.069 -0.768 1.00 0.00 C ATOM 1198 O GLN A 549 -3.662 12.431 -0.433 1.00 0.00 O ATOM 1199 CB GLN A 549 -6.360 13.907 -1.408 1.00 0.00 C ATOM 1200 CG GLN A 549 -5.545 14.997 -0.732 1.00 0.00 C ATOM 1201 CD GLN A 549 -6.412 16.042 -0.058 1.00 0.00 C ATOM 1202 OE1 GLN A 549 -7.062 15.769 0.951 1.00 0.00 O ATOM 1203 NE2 GLN A 549 -6.427 17.248 -0.615 1.00 0.00 N ATOM 0 H GLN A 549 -7.355 11.931 -2.520 1.00 0.00 H new ATOM 0 HA GLN A 549 -4.770 13.127 -2.625 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -6.914 14.342 -2.239 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -7.095 13.523 -0.701 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -4.885 14.545 0.009 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -4.908 15.481 -1.473 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -5.873 17.430 -1.451 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -6.993 17.992 -0.206 1.00 0.00 H new ATOM 1212 N GLY A 550 -5.444 11.085 -0.158 1.00 0.00 N ATOM 1213 CA GLY A 550 -4.845 10.376 0.958 1.00 0.00 C ATOM 1214 C GLY A 550 -3.620 9.582 0.551 1.00 0.00 C ATOM 1215 O GLY A 550 -2.725 9.349 1.363 1.00 0.00 O ATOM 0 H GLY A 550 -6.378 10.767 -0.417 1.00 0.00 H new ATOM 0 HA2 GLY A 550 -4.569 11.091 1.733 1.00 0.00 H new ATOM 0 HA3 GLY A 550 -5.582 9.702 1.394 1.00 0.00 H new ATOM 1219 N ILE A 551 -3.580 9.165 -0.710 1.00 0.00 N ATOM 1220 CA ILE A 551 -2.455 8.392 -1.223 1.00 0.00 C ATOM 1221 C ILE A 551 -1.268 9.294 -1.542 1.00 0.00 C ATOM 1222 O ILE A 551 -0.113 8.893 -1.394 1.00 0.00 O ATOM 1223 CB ILE A 551 -2.843 7.606 -2.489 1.00 0.00 C ATOM 1224 CG1 ILE A 551 -3.894 6.546 -2.156 1.00 0.00 C ATOM 1225 CG2 ILE A 551 -1.612 6.963 -3.111 1.00 0.00 C ATOM 1226 CD1 ILE A 551 -5.317 7.037 -2.308 1.00 0.00 C ATOM 0 H ILE A 551 -4.313 9.349 -1.395 1.00 0.00 H new ATOM 0 HA ILE A 551 -2.173 7.688 -0.440 1.00 0.00 H new ATOM 0 HB ILE A 551 -3.271 8.300 -3.212 1.00 0.00 H new ATOM 0 HG12 ILE A 551 -3.745 5.682 -2.804 1.00 0.00 H new ATOM 0 HG13 ILE A 551 -3.743 6.206 -1.132 1.00 0.00 H new ATOM 0 HG21 ILE A 551 -1.902 6.411 -4.005 1.00 0.00 H new ATOM 0 HG22 ILE A 551 -0.894 7.737 -3.380 1.00 0.00 H new ATOM 0 HG23 ILE A 551 -1.157 6.279 -2.394 1.00 0.00 H new ATOM 0 HD11 ILE A 551 -6.008 6.233 -2.056 1.00 0.00 H new ATOM 0 HD12 ILE A 551 -5.484 7.882 -1.640 1.00 0.00 H new ATOM 0 HD13 ILE A 551 -5.486 7.350 -3.338 1.00 0.00 H new ATOM 1238 N ILE A 552 -1.560 10.515 -1.978 1.00 0.00 N ATOM 1239 CA ILE A 552 -0.516 11.475 -2.314 1.00 0.00 C ATOM 1240 C ILE A 552 0.114 12.066 -1.057 1.00 0.00 C ATOM 1241 O ILE A 552 1.303 12.381 -1.036 1.00 0.00 O ATOM 1242 CB ILE A 552 -1.064 12.620 -3.187 1.00 0.00 C ATOM 1243 CG1 ILE A 552 -1.782 12.056 -4.415 1.00 0.00 C ATOM 1244 CG2 ILE A 552 0.062 13.552 -3.606 1.00 0.00 C ATOM 1245 CD1 ILE A 552 -2.495 13.108 -5.235 1.00 0.00 C ATOM 0 H ILE A 552 -2.510 10.862 -2.107 1.00 0.00 H new ATOM 0 HA ILE A 552 0.243 10.931 -2.876 1.00 0.00 H new ATOM 0 HB ILE A 552 -1.783 13.192 -2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 552 -1.056 11.545 -5.047 1.00 0.00 H new ATOM 0 HG13 ILE A 552 -2.505 11.308 -4.091 1.00 0.00 H new ATOM 0 HG21 ILE A 552 -0.341 14.356 -4.222 1.00 0.00 H new ATOM 0 HG22 ILE A 552 0.532 13.976 -2.719 1.00 0.00 H new ATOM 0 HG23 ILE A 552 0.803 12.993 -4.178 1.00 0.00 H new ATOM 0 HD11 ILE A 552 -2.981 12.636 -6.089 1.00 0.00 H new ATOM 0 HD12 ILE A 552 -3.245 13.603 -4.618 1.00 0.00 H new ATOM 0 HD13 ILE A 552 -1.773 13.844 -5.590 1.00 0.00 H new ATOM 1257 N ALA A 553 -0.692 12.211 -0.011 1.00 0.00 N ATOM 1258 CA ALA A 553 -0.213 12.760 1.252 1.00 0.00 C ATOM 1259 C ALA A 553 0.918 11.913 1.825 1.00 0.00 C ATOM 1260 O ALA A 553 1.854 12.437 2.429 1.00 0.00 O ATOM 1261 CB ALA A 553 -1.357 12.862 2.251 1.00 0.00 C ATOM 0 H ALA A 553 -1.680 11.956 -0.013 1.00 0.00 H new ATOM 0 HA ALA A 553 0.178 13.759 1.060 1.00 0.00 H new ATOM 0 HB1 ALA A 553 -0.985 13.273 3.189 1.00 0.00 H new ATOM 0 HB2 ALA A 553 -2.133 13.515 1.851 1.00 0.00 H new ATOM 0 HB3 ALA A 553 -1.774 11.871 2.429 1.00 0.00 H new ATOM 1267 N CYS A 554 0.825 10.602 1.633 1.00 0.00 N ATOM 1268 CA CYS A 554 1.840 9.682 2.132 1.00 0.00 C ATOM 1269 C CYS A 554 3.192 9.960 1.483 1.00 0.00 C ATOM 1270 O CYS A 554 4.163 10.292 2.165 1.00 0.00 O ATOM 1271 CB CYS A 554 1.422 8.235 1.867 1.00 0.00 C ATOM 1272 SG CYS A 554 -0.363 7.957 1.941 1.00 0.00 S ATOM 0 H CYS A 554 0.057 10.152 1.135 1.00 0.00 H new ATOM 0 HA CYS A 554 1.935 9.834 3.207 1.00 0.00 H new ATOM 0 HB2 CYS A 554 1.785 7.938 0.883 1.00 0.00 H new ATOM 0 HB3 CYS A 554 1.910 7.588 2.596 1.00 0.00 H new ATOM 0 HG CYS A 554 -0.986 9.059 1.646 1.00 0.00 H new ATOM 1278 N CYS A 555 3.249 9.820 0.163 1.00 0.00 N ATOM 1279 CA CYS A 555 4.483 10.054 -0.578 1.00 0.00 C ATOM 1280 C CYS A 555 4.902 11.518 -0.488 1.00 0.00 C ATOM 1281 O CYS A 555 4.167 12.411 -0.908 1.00 0.00 O ATOM 1282 CB CYS A 555 4.307 9.650 -2.042 1.00 0.00 C ATOM 1283 SG CYS A 555 2.705 10.103 -2.746 1.00 0.00 S ATOM 0 H CYS A 555 2.455 9.546 -0.416 1.00 0.00 H new ATOM 0 HA CYS A 555 5.268 9.443 -0.132 1.00 0.00 H new ATOM 0 HB2 CYS A 555 5.096 10.115 -2.633 1.00 0.00 H new ATOM 0 HB3 CYS A 555 4.438 8.571 -2.128 1.00 0.00 H new ATOM 0 HG CYS A 555 2.228 11.132 -2.111 1.00 0.00 H new ATOM 1289 N ASN A 556 6.088 11.756 0.063 1.00 0.00 N ATOM 1290 CA ASN A 556 6.604 13.112 0.210 1.00 0.00 C ATOM 1291 C ASN A 556 8.128 13.125 0.131 1.00 0.00 C ATOM 1292 O ASN A 556 8.825 12.669 1.038 1.00 0.00 O ATOM 1293 CB ASN A 556 6.145 13.713 1.540 1.00 0.00 C ATOM 1294 CG ASN A 556 6.912 13.153 2.722 1.00 0.00 C ATOM 1295 OD1 ASN A 556 7.816 13.800 3.253 1.00 0.00 O ATOM 1296 ND2 ASN A 556 6.554 11.945 3.141 1.00 0.00 N ATOM 0 H ASN A 556 6.709 11.028 0.415 1.00 0.00 H new ATOM 0 HA ASN A 556 6.210 13.715 -0.608 1.00 0.00 H new ATOM 0 HB2 ASN A 556 6.270 14.795 1.509 1.00 0.00 H new ATOM 0 HB3 ASN A 556 5.081 13.519 1.676 1.00 0.00 H new ATOM 0 HD21 ASN A 556 7.034 11.517 3.933 1.00 0.00 H new ATOM 0 HD22 ASN A 556 5.799 11.445 2.671 1.00 0.00 H new ATOM 1303 N PRO A 557 8.658 13.661 -0.978 1.00 0.00 N ATOM 1304 CA PRO A 557 7.839 14.207 -2.064 1.00 0.00 C ATOM 1305 C PRO A 557 7.092 13.119 -2.829 1.00 0.00 C ATOM 1306 O PRO A 557 7.294 11.928 -2.590 1.00 0.00 O ATOM 1307 CB PRO A 557 8.863 14.892 -2.972 1.00 0.00 C ATOM 1308 CG PRO A 557 10.143 14.177 -2.706 1.00 0.00 C ATOM 1309 CD PRO A 557 10.100 13.776 -1.257 1.00 0.00 C ATOM 0 HA PRO A 557 7.064 14.877 -1.692 1.00 0.00 H new ATOM 0 HB2 PRO A 557 8.577 14.814 -4.021 1.00 0.00 H new ATOM 0 HB3 PRO A 557 8.948 15.954 -2.743 1.00 0.00 H new ATOM 0 HG2 PRO A 557 10.243 13.303 -3.350 1.00 0.00 H new ATOM 0 HG3 PRO A 557 10.999 14.821 -2.907 1.00 0.00 H new ATOM 0 HD2 PRO A 557 10.619 12.833 -1.085 1.00 0.00 H new ATOM 0 HD3 PRO A 557 10.575 14.522 -0.619 1.00 0.00 H new ATOM 1317 N VAL A 558 6.228 13.536 -3.749 1.00 0.00 N ATOM 1318 CA VAL A 558 5.452 12.597 -4.550 1.00 0.00 C ATOM 1319 C VAL A 558 6.165 12.270 -5.857 1.00 0.00 C ATOM 1320 O VAL A 558 6.599 13.155 -6.595 1.00 0.00 O ATOM 1321 CB VAL A 558 4.052 13.154 -4.868 1.00 0.00 C ATOM 1322 CG1 VAL A 558 3.240 12.140 -5.658 1.00 0.00 C ATOM 1323 CG2 VAL A 558 3.331 13.544 -3.586 1.00 0.00 C ATOM 0 H VAL A 558 6.048 14.518 -3.958 1.00 0.00 H new ATOM 0 HA VAL A 558 5.348 11.687 -3.959 1.00 0.00 H new ATOM 0 HB VAL A 558 4.166 14.048 -5.481 1.00 0.00 H new ATOM 0 HG11 VAL A 558 2.254 12.552 -5.873 1.00 0.00 H new ATOM 0 HG12 VAL A 558 3.751 11.914 -6.594 1.00 0.00 H new ATOM 0 HG13 VAL A 558 3.132 11.226 -5.074 1.00 0.00 H new ATOM 0 HG21 VAL A 558 2.343 13.936 -3.829 1.00 0.00 H new ATOM 0 HG22 VAL A 558 3.227 12.668 -2.946 1.00 0.00 H new ATOM 0 HG23 VAL A 558 3.906 14.308 -3.063 1.00 0.00 H new ATOM 1333 N PRO A 559 6.290 10.968 -6.153 1.00 0.00 N ATOM 1334 CA PRO A 559 6.949 10.493 -7.373 1.00 0.00 C ATOM 1335 C PRO A 559 6.139 10.801 -8.628 1.00 0.00 C ATOM 1336 O PRO A 559 4.934 11.050 -8.572 1.00 0.00 O ATOM 1337 CB PRO A 559 7.047 8.980 -7.158 1.00 0.00 C ATOM 1338 CG PRO A 559 5.938 8.660 -6.216 1.00 0.00 C ATOM 1339 CD PRO A 559 5.796 9.859 -5.320 1.00 0.00 C ATOM 0 HA PRO A 559 7.912 10.978 -7.530 1.00 0.00 H new ATOM 0 HB2 PRO A 559 6.937 8.438 -8.098 1.00 0.00 H new ATOM 0 HB3 PRO A 559 8.014 8.701 -6.740 1.00 0.00 H new ATOM 0 HG2 PRO A 559 5.012 8.465 -6.756 1.00 0.00 H new ATOM 0 HG3 PRO A 559 6.164 7.765 -5.637 1.00 0.00 H new ATOM 0 HD2 PRO A 559 4.760 10.014 -5.017 1.00 0.00 H new ATOM 0 HD3 PRO A 559 6.382 9.750 -4.407 1.00 0.00 H new ATOM 1347 N PRO A 560 6.812 10.784 -9.788 1.00 0.00 N ATOM 1348 CA PRO A 560 6.173 11.058 -11.078 1.00 0.00 C ATOM 1349 C PRO A 560 5.221 9.945 -11.502 1.00 0.00 C ATOM 1350 O PRO A 560 4.565 10.037 -12.540 1.00 0.00 O ATOM 1351 CB PRO A 560 7.355 11.148 -12.047 1.00 0.00 C ATOM 1352 CG PRO A 560 8.428 10.332 -11.413 1.00 0.00 C ATOM 1353 CD PRO A 560 8.249 10.494 -9.928 1.00 0.00 C ATOM 0 HA PRO A 560 5.560 11.959 -11.046 1.00 0.00 H new ATOM 0 HB2 PRO A 560 7.091 10.759 -13.031 1.00 0.00 H new ATOM 0 HB3 PRO A 560 7.674 12.181 -12.188 1.00 0.00 H new ATOM 0 HG2 PRO A 560 8.345 9.285 -11.704 1.00 0.00 H new ATOM 0 HG3 PRO A 560 9.415 10.673 -11.727 1.00 0.00 H new ATOM 0 HD2 PRO A 560 8.531 9.590 -9.388 1.00 0.00 H new ATOM 0 HD3 PRO A 560 8.863 11.305 -9.535 1.00 0.00 H new ATOM 1361 N LEU A 561 5.149 8.894 -10.692 1.00 0.00 N ATOM 1362 CA LEU A 561 4.276 7.763 -10.983 1.00 0.00 C ATOM 1363 C LEU A 561 3.014 7.815 -10.128 1.00 0.00 C ATOM 1364 O LEU A 561 1.905 7.946 -10.646 1.00 0.00 O ATOM 1365 CB LEU A 561 5.016 6.446 -10.741 1.00 0.00 C ATOM 1366 CG LEU A 561 6.173 6.142 -11.693 1.00 0.00 C ATOM 1367 CD1 LEU A 561 6.938 4.912 -11.228 1.00 0.00 C ATOM 1368 CD2 LEU A 561 5.659 5.947 -13.112 1.00 0.00 C ATOM 0 H LEU A 561 5.685 8.802 -9.829 1.00 0.00 H new ATOM 0 HA LEU A 561 3.985 7.821 -12.032 1.00 0.00 H new ATOM 0 HB2 LEU A 561 5.402 6.451 -9.722 1.00 0.00 H new ATOM 0 HB3 LEU A 561 4.296 5.631 -10.805 1.00 0.00 H new ATOM 0 HG LEU A 561 6.855 6.992 -11.688 1.00 0.00 H new ATOM 0 HD11 LEU A 561 7.758 4.711 -11.918 1.00 0.00 H new ATOM 0 HD12 LEU A 561 7.339 5.089 -10.230 1.00 0.00 H new ATOM 0 HD13 LEU A 561 6.266 4.054 -11.203 1.00 0.00 H new ATOM 0 HD21 LEU A 561 6.496 5.732 -13.776 1.00 0.00 H new ATOM 0 HD22 LEU A 561 4.956 5.115 -13.133 1.00 0.00 H new ATOM 0 HD23 LEU A 561 5.156 6.855 -13.445 1.00 0.00 H new ATOM 1380 N VAL A 562 3.191 7.713 -8.814 1.00 0.00 N ATOM 1381 CA VAL A 562 2.068 7.752 -7.886 1.00 0.00 C ATOM 1382 C VAL A 562 1.094 8.867 -8.248 1.00 0.00 C ATOM 1383 O VAL A 562 -0.121 8.705 -8.135 1.00 0.00 O ATOM 1384 CB VAL A 562 2.545 7.953 -6.435 1.00 0.00 C ATOM 1385 CG1 VAL A 562 1.356 8.049 -5.491 1.00 0.00 C ATOM 1386 CG2 VAL A 562 3.477 6.825 -6.020 1.00 0.00 C ATOM 0 H VAL A 562 4.102 7.603 -8.369 1.00 0.00 H new ATOM 0 HA VAL A 562 1.560 6.791 -7.964 1.00 0.00 H new ATOM 0 HB VAL A 562 3.099 8.890 -6.379 1.00 0.00 H new ATOM 0 HG11 VAL A 562 1.712 8.191 -4.471 1.00 0.00 H new ATOM 0 HG12 VAL A 562 0.731 8.895 -5.778 1.00 0.00 H new ATOM 0 HG13 VAL A 562 0.772 7.130 -5.547 1.00 0.00 H new ATOM 0 HG21 VAL A 562 3.804 6.983 -4.992 1.00 0.00 H new ATOM 0 HG22 VAL A 562 2.950 5.873 -6.091 1.00 0.00 H new ATOM 0 HG23 VAL A 562 4.345 6.809 -6.679 1.00 0.00 H new ATOM 1396 N ARG A 563 1.635 9.999 -8.686 1.00 0.00 N ATOM 1397 CA ARG A 563 0.814 11.143 -9.064 1.00 0.00 C ATOM 1398 C ARG A 563 0.128 10.899 -10.406 1.00 0.00 C ATOM 1399 O ARG A 563 -1.036 11.252 -10.591 1.00 0.00 O ATOM 1400 CB ARG A 563 1.669 12.409 -9.139 1.00 0.00 C ATOM 1401 CG ARG A 563 0.854 13.690 -9.217 1.00 0.00 C ATOM 1402 CD ARG A 563 0.341 14.108 -7.848 1.00 0.00 C ATOM 1403 NE ARG A 563 -0.712 15.116 -7.943 1.00 0.00 N ATOM 1404 CZ ARG A 563 -0.476 16.410 -8.134 1.00 0.00 C ATOM 1405 NH1 ARG A 563 0.770 16.850 -8.251 1.00 0.00 N ATOM 1406 NH2 ARG A 563 -1.487 17.266 -8.209 1.00 0.00 N ATOM 0 H ARG A 563 2.639 10.149 -8.788 1.00 0.00 H new ATOM 0 HA ARG A 563 0.047 11.276 -8.301 1.00 0.00 H new ATOM 0 HB2 ARG A 563 2.316 12.453 -8.263 1.00 0.00 H new ATOM 0 HB3 ARG A 563 2.318 12.348 -10.012 1.00 0.00 H new ATOM 0 HG2 ARG A 563 1.467 14.488 -9.636 1.00 0.00 H new ATOM 0 HG3 ARG A 563 0.012 13.546 -9.894 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -0.041 13.233 -7.321 1.00 0.00 H new ATOM 0 HD3 ARG A 563 1.167 14.501 -7.256 1.00 0.00 H new ATOM 0 HE ARG A 563 -1.681 14.810 -7.858 1.00 0.00 H new ATOM 0 HH11 ARG A 563 1.550 16.195 -8.194 1.00 0.00 H new ATOM 0 HH12 ARG A 563 0.948 17.844 -8.398 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -2.446 16.931 -8.120 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -1.305 18.259 -8.356 1.00 0.00 H new ATOM 1420 N GLN A 564 0.859 10.294 -11.337 1.00 0.00 N ATOM 1421 CA GLN A 564 0.321 10.005 -12.661 1.00 0.00 C ATOM 1422 C GLN A 564 -0.777 8.949 -12.584 1.00 0.00 C ATOM 1423 O GLN A 564 -1.915 9.196 -12.981 1.00 0.00 O ATOM 1424 CB GLN A 564 1.436 9.530 -13.595 1.00 0.00 C ATOM 1425 CG GLN A 564 2.149 10.663 -14.315 1.00 0.00 C ATOM 1426 CD GLN A 564 3.319 10.179 -15.149 1.00 0.00 C ATOM 1427 OE1 GLN A 564 4.443 10.658 -15.000 1.00 0.00 O ATOM 1428 NE2 GLN A 564 3.060 9.224 -16.035 1.00 0.00 N ATOM 0 H GLN A 564 1.824 9.995 -11.199 1.00 0.00 H new ATOM 0 HA GLN A 564 -0.110 10.924 -13.059 1.00 0.00 H new ATOM 0 HB2 GLN A 564 2.165 8.962 -13.018 1.00 0.00 H new ATOM 0 HB3 GLN A 564 1.014 8.849 -14.334 1.00 0.00 H new ATOM 0 HG2 GLN A 564 1.439 11.183 -14.959 1.00 0.00 H new ATOM 0 HG3 GLN A 564 2.505 11.387 -13.582 1.00 0.00 H new ATOM 0 HE21 GLN A 564 2.113 8.855 -16.125 1.00 0.00 H new ATOM 0 HE22 GLN A 564 3.808 8.859 -16.625 1.00 0.00 H new ATOM 1437 N GLN A 565 -0.427 7.775 -12.070 1.00 0.00 N ATOM 1438 CA GLN A 565 -1.384 6.682 -11.942 1.00 0.00 C ATOM 1439 C GLN A 565 -2.148 6.778 -10.626 1.00 0.00 C ATOM 1440 O GLN A 565 -2.733 5.799 -10.164 1.00 0.00 O ATOM 1441 CB GLN A 565 -0.666 5.334 -12.031 1.00 0.00 C ATOM 1442 CG GLN A 565 0.131 5.152 -13.313 1.00 0.00 C ATOM 1443 CD GLN A 565 -0.735 4.725 -14.482 1.00 0.00 C ATOM 1444 OE1 GLN A 565 -1.530 5.509 -15.000 1.00 0.00 O ATOM 1445 NE2 GLN A 565 -0.585 3.474 -14.904 1.00 0.00 N ATOM 0 H GLN A 565 0.511 7.556 -11.736 1.00 0.00 H new ATOM 0 HA GLN A 565 -2.098 6.761 -12.762 1.00 0.00 H new ATOM 0 HB2 GLN A 565 0.005 5.232 -11.178 1.00 0.00 H new ATOM 0 HB3 GLN A 565 -1.402 4.534 -11.954 1.00 0.00 H new ATOM 0 HG2 GLN A 565 0.633 6.087 -13.560 1.00 0.00 H new ATOM 0 HG3 GLN A 565 0.909 4.406 -13.150 1.00 0.00 H new ATOM 0 HE21 GLN A 565 0.086 2.858 -14.445 1.00 0.00 H new ATOM 0 HE22 GLN A 565 -1.141 3.130 -15.687 1.00 0.00 H new ATOM 1454 N ILE A 566 -2.137 7.964 -10.027 1.00 0.00 N ATOM 1455 CA ILE A 566 -2.830 8.188 -8.764 1.00 0.00 C ATOM 1456 C ILE A 566 -4.251 7.638 -8.811 1.00 0.00 C ATOM 1457 O ILE A 566 -4.687 6.938 -7.899 1.00 0.00 O ATOM 1458 CB ILE A 566 -2.882 9.686 -8.408 1.00 0.00 C ATOM 1459 CG1 ILE A 566 -3.439 9.878 -6.996 1.00 0.00 C ATOM 1460 CG2 ILE A 566 -3.727 10.442 -9.424 1.00 0.00 C ATOM 1461 CD1 ILE A 566 -2.697 9.087 -5.941 1.00 0.00 C ATOM 0 H ILE A 566 -1.656 8.784 -10.396 1.00 0.00 H new ATOM 0 HA ILE A 566 -2.264 7.660 -7.996 1.00 0.00 H new ATOM 0 HB ILE A 566 -1.869 10.087 -8.436 1.00 0.00 H new ATOM 0 HG12 ILE A 566 -3.400 10.937 -6.739 1.00 0.00 H new ATOM 0 HG13 ILE A 566 -4.489 9.586 -6.986 1.00 0.00 H new ATOM 0 HG21 ILE A 566 -3.755 11.499 -9.160 1.00 0.00 H new ATOM 0 HG22 ILE A 566 -3.291 10.328 -10.417 1.00 0.00 H new ATOM 0 HG23 ILE A 566 -4.741 10.041 -9.424 1.00 0.00 H new ATOM 0 HD11 ILE A 566 -3.146 9.271 -4.965 1.00 0.00 H new ATOM 0 HD12 ILE A 566 -2.758 8.024 -6.173 1.00 0.00 H new ATOM 0 HD13 ILE A 566 -1.652 9.395 -5.923 1.00 0.00 H new ATOM 1473 N ASN A 567 -4.968 7.959 -9.883 1.00 0.00 N ATOM 1474 CA ASN A 567 -6.341 7.496 -10.051 1.00 0.00 C ATOM 1475 C ASN A 567 -6.448 5.999 -9.775 1.00 0.00 C ATOM 1476 O ASN A 567 -7.275 5.564 -8.976 1.00 0.00 O ATOM 1477 CB ASN A 567 -6.835 7.802 -11.466 1.00 0.00 C ATOM 1478 CG ASN A 567 -6.778 9.282 -11.792 1.00 0.00 C ATOM 1479 OD1 ASN A 567 -5.733 9.804 -12.179 1.00 0.00 O ATOM 1480 ND2 ASN A 567 -7.906 9.966 -11.635 1.00 0.00 N ATOM 0 H ASN A 567 -4.621 8.538 -10.648 1.00 0.00 H new ATOM 0 HA ASN A 567 -6.967 8.025 -9.333 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -6.230 7.251 -12.186 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -7.860 7.448 -11.574 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -7.929 10.965 -11.838 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -8.749 9.492 -11.312 1.00 0.00 H new ATOM 1487 N GLU A 568 -5.604 5.219 -10.443 1.00 0.00 N ATOM 1488 CA GLU A 568 -5.604 3.771 -10.270 1.00 0.00 C ATOM 1489 C GLU A 568 -5.416 3.399 -8.802 1.00 0.00 C ATOM 1490 O GLU A 568 -6.225 2.672 -8.226 1.00 0.00 O ATOM 1491 CB GLU A 568 -4.500 3.133 -11.115 1.00 0.00 C ATOM 1492 CG GLU A 568 -4.670 1.636 -11.311 1.00 0.00 C ATOM 1493 CD GLU A 568 -6.015 1.277 -11.913 1.00 0.00 C ATOM 1494 OE1 GLU A 568 -6.184 1.459 -13.137 1.00 0.00 O ATOM 1495 OE2 GLU A 568 -6.897 0.813 -11.161 1.00 0.00 O ATOM 0 H GLU A 568 -4.912 5.565 -11.108 1.00 0.00 H new ATOM 0 HA GLU A 568 -6.570 3.391 -10.603 1.00 0.00 H new ATOM 0 HB2 GLU A 568 -4.475 3.618 -12.091 1.00 0.00 H new ATOM 0 HB3 GLU A 568 -3.537 3.322 -10.641 1.00 0.00 H new ATOM 0 HG2 GLU A 568 -3.875 1.265 -11.959 1.00 0.00 H new ATOM 0 HG3 GLU A 568 -4.560 1.132 -10.351 1.00 0.00 H new ATOM 1502 N MET A 569 -4.341 3.902 -8.203 1.00 0.00 N ATOM 1503 CA MET A 569 -4.046 3.623 -6.803 1.00 0.00 C ATOM 1504 C MET A 569 -5.281 3.838 -5.934 1.00 0.00 C ATOM 1505 O MET A 569 -5.622 2.995 -5.103 1.00 0.00 O ATOM 1506 CB MET A 569 -2.902 4.514 -6.313 1.00 0.00 C ATOM 1507 CG MET A 569 -1.609 4.323 -7.088 1.00 0.00 C ATOM 1508 SD MET A 569 -0.204 5.139 -6.306 1.00 0.00 S ATOM 1509 CE MET A 569 0.460 3.800 -5.319 1.00 0.00 C ATOM 0 H MET A 569 -3.660 4.505 -8.666 1.00 0.00 H new ATOM 0 HA MET A 569 -3.744 2.579 -6.722 1.00 0.00 H new ATOM 0 HB2 MET A 569 -3.209 5.558 -6.385 1.00 0.00 H new ATOM 0 HB3 MET A 569 -2.718 4.308 -5.259 1.00 0.00 H new ATOM 0 HG2 MET A 569 -1.400 3.257 -7.181 1.00 0.00 H new ATOM 0 HG3 MET A 569 -1.734 4.713 -8.098 1.00 0.00 H new ATOM 0 HE1 MET A 569 1.473 4.048 -5.004 1.00 0.00 H new ATOM 0 HE2 MET A 569 -0.167 3.650 -4.440 1.00 0.00 H new ATOM 0 HE3 MET A 569 0.478 2.885 -5.912 1.00 0.00 H new ATOM 1519 N HIS A 570 -5.948 4.971 -6.130 1.00 0.00 N ATOM 1520 CA HIS A 570 -7.146 5.295 -5.364 1.00 0.00 C ATOM 1521 C HIS A 570 -8.182 4.181 -5.477 1.00 0.00 C ATOM 1522 O HIS A 570 -8.709 3.705 -4.471 1.00 0.00 O ATOM 1523 CB HIS A 570 -7.745 6.616 -5.849 1.00 0.00 C ATOM 1524 CG HIS A 570 -9.185 6.792 -5.478 1.00 0.00 C ATOM 1525 ND1 HIS A 570 -10.098 7.435 -6.287 1.00 0.00 N ATOM 1526 CD2 HIS A 570 -9.869 6.404 -4.376 1.00 0.00 C ATOM 1527 CE1 HIS A 570 -11.280 7.437 -5.699 1.00 0.00 C ATOM 1528 NE2 HIS A 570 -11.169 6.816 -4.538 1.00 0.00 N ATOM 0 H HIS A 570 -5.679 5.680 -6.812 1.00 0.00 H new ATOM 0 HA HIS A 570 -6.861 5.396 -4.317 1.00 0.00 H new ATOM 0 HB2 HIS A 570 -7.168 7.442 -5.433 1.00 0.00 H new ATOM 0 HB3 HIS A 570 -7.648 6.673 -6.933 1.00 0.00 H new ATOM 0 HD2 HIS A 570 -9.467 5.870 -3.528 1.00 0.00 H new ATOM 0 HE1 HIS A 570 -12.184 7.872 -6.099 1.00 0.00 H new ATOM 0 HE2 HIS A 570 -11.926 6.667 -3.871 1.00 0.00 H new ATOM 1536 N LEU A 571 -8.469 3.770 -6.707 1.00 0.00 N ATOM 1537 CA LEU A 571 -9.443 2.712 -6.952 1.00 0.00 C ATOM 1538 C LEU A 571 -9.131 1.479 -6.110 1.00 0.00 C ATOM 1539 O LEU A 571 -10.016 0.910 -5.470 1.00 0.00 O ATOM 1540 CB LEU A 571 -9.458 2.339 -8.436 1.00 0.00 C ATOM 1541 CG LEU A 571 -9.998 3.406 -9.390 1.00 0.00 C ATOM 1542 CD1 LEU A 571 -9.725 3.017 -10.835 1.00 0.00 C ATOM 1543 CD2 LEU A 571 -11.488 3.618 -9.165 1.00 0.00 C ATOM 0 H LEU A 571 -8.041 4.153 -7.550 1.00 0.00 H new ATOM 0 HA LEU A 571 -10.427 3.085 -6.667 1.00 0.00 H new ATOM 0 HB2 LEU A 571 -8.441 2.091 -8.738 1.00 0.00 H new ATOM 0 HB3 LEU A 571 -10.056 1.436 -8.557 1.00 0.00 H new ATOM 0 HG LEU A 571 -9.483 4.344 -9.184 1.00 0.00 H new ATOM 0 HD11 LEU A 571 -10.116 3.788 -11.499 1.00 0.00 H new ATOM 0 HD12 LEU A 571 -8.650 2.917 -10.988 1.00 0.00 H new ATOM 0 HD13 LEU A 571 -10.213 2.067 -11.054 1.00 0.00 H new ATOM 0 HD21 LEU A 571 -11.855 4.380 -9.852 1.00 0.00 H new ATOM 0 HD22 LEU A 571 -12.019 2.683 -9.343 1.00 0.00 H new ATOM 0 HD23 LEU A 571 -11.658 3.943 -8.139 1.00 0.00 H new ATOM 1555 N LEU A 572 -7.866 1.071 -6.114 1.00 0.00 N ATOM 1556 CA LEU A 572 -7.436 -0.093 -5.348 1.00 0.00 C ATOM 1557 C LEU A 572 -7.804 0.056 -3.875 1.00 0.00 C ATOM 1558 O LEU A 572 -8.349 -0.864 -3.265 1.00 0.00 O ATOM 1559 CB LEU A 572 -5.925 -0.292 -5.490 1.00 0.00 C ATOM 1560 CG LEU A 572 -5.382 -0.307 -6.919 1.00 0.00 C ATOM 1561 CD1 LEU A 572 -3.864 -0.396 -6.912 1.00 0.00 C ATOM 1562 CD2 LEU A 572 -5.982 -1.463 -7.706 1.00 0.00 C ATOM 0 H LEU A 572 -7.121 1.529 -6.639 1.00 0.00 H new ATOM 0 HA LEU A 572 -7.951 -0.968 -5.745 1.00 0.00 H new ATOM 0 HB2 LEU A 572 -5.421 0.502 -4.939 1.00 0.00 H new ATOM 0 HB3 LEU A 572 -5.656 -1.233 -5.010 1.00 0.00 H new ATOM 0 HG LEU A 572 -5.669 0.625 -7.406 1.00 0.00 H new ATOM 0 HD11 LEU A 572 -3.495 -0.406 -7.938 1.00 0.00 H new ATOM 0 HD12 LEU A 572 -3.451 0.465 -6.386 1.00 0.00 H new ATOM 0 HD13 LEU A 572 -3.556 -1.311 -6.407 1.00 0.00 H new ATOM 0 HD21 LEU A 572 -5.584 -1.458 -8.721 1.00 0.00 H new ATOM 0 HD22 LEU A 572 -5.726 -2.405 -7.221 1.00 0.00 H new ATOM 0 HD23 LEU A 572 -7.066 -1.355 -7.741 1.00 0.00 H new ATOM 1574 N ILE A 573 -7.506 1.222 -3.312 1.00 0.00 N ATOM 1575 CA ILE A 573 -7.809 1.493 -1.912 1.00 0.00 C ATOM 1576 C ILE A 573 -9.296 1.313 -1.627 1.00 0.00 C ATOM 1577 O ILE A 573 -9.680 0.827 -0.564 1.00 0.00 O ATOM 1578 CB ILE A 573 -7.389 2.919 -1.511 1.00 0.00 C ATOM 1579 CG1 ILE A 573 -5.887 3.113 -1.729 1.00 0.00 C ATOM 1580 CG2 ILE A 573 -7.759 3.192 -0.061 1.00 0.00 C ATOM 1581 CD1 ILE A 573 -5.042 2.018 -1.117 1.00 0.00 C ATOM 0 H ILE A 573 -7.055 1.994 -3.803 1.00 0.00 H new ATOM 0 HA ILE A 573 -7.239 0.776 -1.321 1.00 0.00 H new ATOM 0 HB ILE A 573 -7.923 3.630 -2.142 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -5.686 3.160 -2.799 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -5.587 4.072 -1.306 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -7.456 4.204 0.208 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -8.837 3.091 0.065 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -7.250 2.477 0.585 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -3.989 2.220 -1.310 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.214 1.984 -0.041 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -5.314 1.059 -1.558 1.00 0.00 H new ATOM 1593 N GLN A 574 -10.129 1.709 -2.585 1.00 0.00 N ATOM 1594 CA GLN A 574 -11.574 1.590 -2.437 1.00 0.00 C ATOM 1595 C GLN A 574 -12.007 0.129 -2.472 1.00 0.00 C ATOM 1596 O GLN A 574 -12.914 -0.277 -1.745 1.00 0.00 O ATOM 1597 CB GLN A 574 -12.287 2.372 -3.541 1.00 0.00 C ATOM 1598 CG GLN A 574 -11.963 3.858 -3.542 1.00 0.00 C ATOM 1599 CD GLN A 574 -12.867 4.653 -2.621 1.00 0.00 C ATOM 1600 OE1 GLN A 574 -12.550 4.649 -1.332 1.00 0.00 O flip ATOM 1601 NE2 GLN A 574 -13.840 5.264 -3.064 1.00 0.00 N flip ATOM 0 H GLN A 574 -9.827 2.115 -3.471 1.00 0.00 H new ATOM 0 HA GLN A 574 -11.850 2.008 -1.469 1.00 0.00 H new ATOM 0 HB2 GLN A 574 -12.015 1.949 -4.508 1.00 0.00 H new ATOM 0 HB3 GLN A 574 -13.364 2.244 -3.428 1.00 0.00 H new ATOM 0 HG2 GLN A 574 -10.926 4.000 -3.238 1.00 0.00 H new ATOM 0 HG3 GLN A 574 -12.054 4.245 -4.557 1.00 0.00 H new ATOM 0 HE21 GLN A 574 -14.046 5.239 -4.063 1.00 0.00 H new ATOM 0 HE22 GLN A 574 -14.440 5.795 -2.432 1.00 0.00 H new ATOM 1610 N GLN A 575 -11.354 -0.657 -3.322 1.00 0.00 N ATOM 1611 CA GLN A 575 -11.673 -2.074 -3.452 1.00 0.00 C ATOM 1612 C GLN A 575 -11.442 -2.807 -2.135 1.00 0.00 C ATOM 1613 O GLN A 575 -12.246 -3.647 -1.732 1.00 0.00 O ATOM 1614 CB GLN A 575 -10.828 -2.709 -4.558 1.00 0.00 C ATOM 1615 CG GLN A 575 -11.233 -2.276 -5.958 1.00 0.00 C ATOM 1616 CD GLN A 575 -10.809 -3.269 -7.021 1.00 0.00 C ATOM 1617 OE1 GLN A 575 -11.642 -3.954 -7.615 1.00 0.00 O ATOM 1618 NE2 GLN A 575 -9.507 -3.353 -7.268 1.00 0.00 N ATOM 0 H GLN A 575 -10.601 -0.337 -3.931 1.00 0.00 H new ATOM 0 HA GLN A 575 -12.727 -2.161 -3.715 1.00 0.00 H new ATOM 0 HB2 GLN A 575 -9.781 -2.453 -4.396 1.00 0.00 H new ATOM 0 HB3 GLN A 575 -10.906 -3.794 -4.486 1.00 0.00 H new ATOM 0 HG2 GLN A 575 -12.315 -2.149 -5.996 1.00 0.00 H new ATOM 0 HG3 GLN A 575 -10.790 -1.304 -6.176 1.00 0.00 H new ATOM 0 HE21 GLN A 575 -8.851 -2.766 -6.752 1.00 0.00 H new ATOM 0 HE22 GLN A 575 -9.163 -4.004 -7.974 1.00 0.00 H new ATOM 1627 N ALA A 576 -10.339 -2.483 -1.468 1.00 0.00 N ATOM 1628 CA ALA A 576 -10.004 -3.109 -0.196 1.00 0.00 C ATOM 1629 C ALA A 576 -11.092 -2.859 0.843 1.00 0.00 C ATOM 1630 O ALA A 576 -11.513 -3.776 1.548 1.00 0.00 O ATOM 1631 CB ALA A 576 -8.663 -2.596 0.308 1.00 0.00 C ATOM 0 H ALA A 576 -9.662 -1.790 -1.788 1.00 0.00 H new ATOM 0 HA ALA A 576 -9.932 -4.185 -0.357 1.00 0.00 H new ATOM 0 HB1 ALA A 576 -8.425 -3.072 1.259 1.00 0.00 H new ATOM 0 HB2 ALA A 576 -7.886 -2.832 -0.420 1.00 0.00 H new ATOM 0 HB3 ALA A 576 -8.715 -1.516 0.446 1.00 0.00 H new ATOM 1637 N ARG A 577 -11.542 -1.612 0.933 1.00 0.00 N ATOM 1638 CA ARG A 577 -12.580 -1.241 1.888 1.00 0.00 C ATOM 1639 C ARG A 577 -13.937 -1.787 1.454 1.00 0.00 C ATOM 1640 O ARG A 577 -14.730 -2.233 2.283 1.00 0.00 O ATOM 1641 CB ARG A 577 -12.652 0.281 2.030 1.00 0.00 C ATOM 1642 CG ARG A 577 -11.490 0.875 2.808 1.00 0.00 C ATOM 1643 CD ARG A 577 -11.649 2.377 2.987 1.00 0.00 C ATOM 1644 NE ARG A 577 -12.648 2.705 4.000 1.00 0.00 N ATOM 1645 CZ ARG A 577 -12.992 3.948 4.319 1.00 0.00 C ATOM 1646 NH1 ARG A 577 -12.420 4.975 3.706 1.00 0.00 N ATOM 1647 NH2 ARG A 577 -13.910 4.165 5.252 1.00 0.00 N ATOM 0 H ARG A 577 -11.204 -0.841 0.356 1.00 0.00 H new ATOM 0 HA ARG A 577 -12.324 -1.677 2.854 1.00 0.00 H new ATOM 0 HB2 ARG A 577 -12.680 0.729 1.037 1.00 0.00 H new ATOM 0 HB3 ARG A 577 -13.585 0.547 2.527 1.00 0.00 H new ATOM 0 HG2 ARG A 577 -11.422 0.396 3.785 1.00 0.00 H new ATOM 0 HG3 ARG A 577 -10.556 0.667 2.285 1.00 0.00 H new ATOM 0 HD2 ARG A 577 -10.690 2.812 3.269 1.00 0.00 H new ATOM 0 HD3 ARG A 577 -11.935 2.827 2.036 1.00 0.00 H new ATOM 0 HE ARG A 577 -13.107 1.937 4.490 1.00 0.00 H new ATOM 0 HH11 ARG A 577 -11.714 4.812 2.988 1.00 0.00 H new ATOM 0 HH12 ARG A 577 -12.686 5.928 3.952 1.00 0.00 H new ATOM 0 HH21 ARG A 577 -14.352 3.377 5.725 1.00 0.00 H new ATOM 0 HH22 ARG A 577 -14.173 5.120 5.496 1.00 0.00 H new ATOM 1661 N GLU A 578 -14.197 -1.747 0.151 1.00 0.00 N ATOM 1662 CA GLU A 578 -15.459 -2.236 -0.391 1.00 0.00 C ATOM 1663 C GLU A 578 -15.887 -3.524 0.306 1.00 0.00 C ATOM 1664 O GLU A 578 -17.045 -3.677 0.693 1.00 0.00 O ATOM 1665 CB GLU A 578 -15.334 -2.476 -1.897 1.00 0.00 C ATOM 1666 CG GLU A 578 -15.692 -1.262 -2.738 1.00 0.00 C ATOM 1667 CD GLU A 578 -16.012 -1.623 -4.176 1.00 0.00 C ATOM 1668 OE1 GLU A 578 -17.164 -2.026 -4.443 1.00 0.00 O ATOM 1669 OE2 GLU A 578 -15.113 -1.502 -5.033 1.00 0.00 O ATOM 0 H GLU A 578 -13.551 -1.381 -0.548 1.00 0.00 H new ATOM 0 HA GLU A 578 -16.220 -1.476 -0.213 1.00 0.00 H new ATOM 0 HB2 GLU A 578 -14.311 -2.777 -2.125 1.00 0.00 H new ATOM 0 HB3 GLU A 578 -15.981 -3.307 -2.179 1.00 0.00 H new ATOM 0 HG2 GLU A 578 -16.550 -0.757 -2.294 1.00 0.00 H new ATOM 0 HG3 GLU A 578 -14.863 -0.555 -2.721 1.00 0.00 H new ATOM 1676 N MET A 579 -14.944 -4.448 0.462 1.00 0.00 N ATOM 1677 CA MET A 579 -15.223 -5.723 1.113 1.00 0.00 C ATOM 1678 C MET A 579 -15.281 -5.558 2.628 1.00 0.00 C ATOM 1679 O MET A 579 -14.582 -4.731 3.214 1.00 0.00 O ATOM 1680 CB MET A 579 -14.156 -6.754 0.740 1.00 0.00 C ATOM 1681 CG MET A 579 -12.738 -6.296 1.038 1.00 0.00 C ATOM 1682 SD MET A 579 -11.619 -7.670 1.369 1.00 0.00 S ATOM 1683 CE MET A 579 -12.162 -8.162 3.003 1.00 0.00 C ATOM 0 H MET A 579 -13.980 -4.338 0.147 1.00 0.00 H new ATOM 0 HA MET A 579 -16.195 -6.075 0.767 1.00 0.00 H new ATOM 0 HB2 MET A 579 -14.352 -7.679 1.282 1.00 0.00 H new ATOM 0 HB3 MET A 579 -14.239 -6.983 -0.322 1.00 0.00 H new ATOM 0 HG2 MET A 579 -12.361 -5.721 0.192 1.00 0.00 H new ATOM 0 HG3 MET A 579 -12.750 -5.627 1.898 1.00 0.00 H new ATOM 0 HE1 MET A 579 -11.540 -8.982 3.362 1.00 0.00 H new ATOM 0 HE2 MET A 579 -12.076 -7.316 3.685 1.00 0.00 H new ATOM 0 HE3 MET A 579 -13.201 -8.488 2.958 1.00 0.00 H new