USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1131 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 624 MET CE :methyl 160:sc= -2.01 (180deg=-2.66!) USER MOD Set 1.2: A 644 TYR OH : rot 7:sc= -1.09 USER MOD Set 2.1: A 536 MET CE :methyl -176:sc= -2.81 (180deg=-2.7) USER MOD Set 2.2: A 547 MET CE :methyl 180:sc= -0.668 (180deg=-0.503) USER MOD Set 2.3: A 606 MET CE :methyl -150:sc= -0.0309 (180deg=0) USER MOD Set 3.1: A 550 CYS SG : rot 32:sc= 0.835 USER MOD Set 3.2: A 612 THR OG1 : rot 153:sc= 1.38 USER MOD Set 3.3: A 613 HIS : +bothHN:sc= 1.41 K(o=3.6,f=-4.4!) USER MOD Set 4.1: A 539 HIS : no HE2:sc= -0.243 K(o=0.93,f=-2.5!) USER MOD Set 4.2: A 543 THR OG1 : rot -59:sc= 1.17 USER MOD Single : A -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -2 HIS : no HE2:sc= -0.362 K(o=-0.36,f=-2.5) USER MOD Single : A -3 SER OG : rot 180:sc= 0.013 USER MOD Single : A -4 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 516 SER OG : rot 180:sc= 0 USER MOD Single : A 520 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 522 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 528 THR OG1 : rot 170:sc= 0.0669 USER MOD Single : A 530 SER OG : rot 180:sc= 0.0196 USER MOD Single : A 532 ASN : amide:sc=-0.00435 X(o=-0.0043,f=-0.0043) USER MOD Single : A 545 LYS NZ :NH3+ -179:sc= 1.06 (180deg=1.04) USER MOD Single : A 551 MET CE :methyl 168:sc= -0.374 (180deg=-1) USER MOD Single : A 557 MET CE :methyl -105:sc= -1.86 (180deg=-3.3!) USER MOD Single : A 559 THR OG1 : rot 75:sc= 0.225 USER MOD Single : A 561 GLN : amide:sc= -3.07! C(o=-3.1!,f=-2.8!) USER MOD Single : A 563 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 564 TYR OH : rot 70:sc= -0.307 USER MOD Single : A 565 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 568 LYS NZ :NH3+ 159:sc= -0.0392 (180deg=-0.296) USER MOD Single : A 570 GLN :FLIP amide:sc= -5.41! C(o=-8.7!,f=-5.4!) USER MOD Single : A 576 TYR OH : rot -12:sc= 1.24 USER MOD Single : A 583 TYR OH : rot 180:sc= -0.287 USER MOD Single : A 584 THR OG1 : rot 180:sc= 0.0746 USER MOD Single : A 585 SER OG : rot 180:sc= 0.00629 USER MOD Single : A 586 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 591 SER OG : rot 170:sc= 0 USER MOD Single : A 594 THR OG1 : rot 180:sc= 0 USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 597 ASN : amide:sc= -1.79! C(o=-1.8!,f=-4.1!) USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD Single : A 600 ASN : amide:sc= -0.186 X(o=-0.19,f=-0.02) USER MOD Single : A 605 THR OG1 : rot 128:sc= 1.02 USER MOD Single : A 610 TYR OH : rot 180:sc= 0 USER MOD Single : A 616 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 623 CYS SG : rot -130:sc= -0.114 USER MOD Single : A 626 SER OG : rot 180:sc= 0 USER MOD Single : A 628 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 SER OG : rot 64:sc= 1.28 USER MOD Single : A 636 SER OG : rot 180:sc=7.21e-05 USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 642 THR OG1 : rot 180:sc= 0 USER MOD Single : A 643 THR OG1 : rot 180:sc= -0.183 USER MOD Single : A 645 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 647 TYR OH : rot 180:sc= 0 USER MOD Single : A 649 THR OG1 : rot 180:sc= 0 USER MOD Single : A 650 SER OG : rot 40:sc= 0.0686 USER MOD Single : A 651 SER OG : rot 180:sc=-0.00506 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 3.820 30.496 -27.281 1.00 0.00 N ATOM 2 CA GLY A -4 2.417 30.734 -26.903 1.00 0.00 C ATOM 3 C GLY A -4 1.611 29.485 -27.200 1.00 0.00 C ATOM 4 O GLY A -4 1.633 29.014 -28.333 1.00 0.00 O ATOM 0 H1 GLY A -4 4.383 31.348 -27.081 1.00 0.00 H new ATOM 0 H2 GLY A -4 4.196 29.696 -26.733 1.00 0.00 H new ATOM 0 H3 GLY A -4 3.874 30.276 -28.296 1.00 0.00 H new ATOM 0 HA2 GLY A -4 2.349 30.984 -25.844 1.00 0.00 H new ATOM 0 HA3 GLY A -4 2.016 31.582 -27.457 1.00 0.00 H new ATOM 8 N SER A -3 0.978 28.912 -26.184 1.00 0.00 N ATOM 9 CA SER A -3 0.397 27.578 -26.202 1.00 0.00 C ATOM 10 C SER A -3 -0.895 27.541 -27.030 1.00 0.00 C ATOM 11 O SER A -3 -1.790 28.355 -26.805 1.00 0.00 O ATOM 12 CB SER A -3 0.125 27.194 -24.736 1.00 0.00 C ATOM 13 OG SER A -3 1.179 27.671 -23.909 1.00 0.00 O ATOM 0 H SER A -3 0.851 29.384 -25.289 1.00 0.00 H new ATOM 0 HA SER A -3 1.079 26.869 -26.671 1.00 0.00 H new ATOM 0 HB2 SER A -3 -0.825 27.617 -24.410 1.00 0.00 H new ATOM 0 HB3 SER A -3 0.040 26.111 -24.644 1.00 0.00 H new ATOM 0 HG SER A -3 1.000 27.426 -22.977 1.00 0.00 H new ATOM 19 N HIS A -2 -1.037 26.580 -27.949 1.00 0.00 N ATOM 20 CA HIS A -2 -2.319 26.247 -28.570 1.00 0.00 C ATOM 21 C HIS A -2 -2.318 24.753 -28.869 1.00 0.00 C ATOM 22 O HIS A -2 -1.818 24.356 -29.920 1.00 0.00 O ATOM 23 CB HIS A -2 -2.577 27.077 -29.849 1.00 0.00 C ATOM 24 CG HIS A -2 -3.837 26.659 -30.591 1.00 0.00 C ATOM 25 ND1 HIS A -2 -4.019 25.448 -31.241 1.00 0.00 N ATOM 26 CD2 HIS A -2 -5.011 27.360 -30.673 1.00 0.00 C ATOM 27 CE1 HIS A -2 -5.292 25.398 -31.675 1.00 0.00 C ATOM 28 NE2 HIS A -2 -5.908 26.558 -31.361 1.00 0.00 N ATOM 0 H HIS A -2 -0.260 26.010 -28.283 1.00 0.00 H new ATOM 0 HA HIS A -2 -3.131 26.494 -27.886 1.00 0.00 H new ATOM 0 HB2 HIS A -2 -2.654 28.131 -29.581 1.00 0.00 H new ATOM 0 HB3 HIS A -2 -1.721 26.979 -30.516 1.00 0.00 H new ATOM 0 HD1 HIS A -2 -3.313 24.723 -31.368 1.00 0.00 H new ATOM 0 HD2 HIS A -2 -5.201 28.347 -30.278 1.00 0.00 H new ATOM 0 HE1 HIS A -2 -5.747 24.565 -32.191 1.00 0.00 H new ATOM 37 N MET A -1 -2.929 23.950 -28.000 1.00 0.00 N ATOM 38 CA MET A -1 -3.309 22.584 -28.348 1.00 0.00 C ATOM 39 C MET A -1 -4.804 22.609 -28.663 1.00 0.00 C ATOM 40 O MET A -1 -5.139 22.973 -29.790 1.00 0.00 O ATOM 41 CB MET A -1 -2.869 21.588 -27.262 1.00 0.00 C ATOM 42 CG MET A -1 -1.342 21.519 -27.137 1.00 0.00 C ATOM 43 SD MET A -1 -0.430 21.065 -28.638 1.00 0.00 S ATOM 44 CE MET A -1 -0.801 19.294 -28.736 1.00 0.00 C ATOM 0 H MET A -1 -3.172 24.223 -27.048 1.00 0.00 H new ATOM 0 HA MET A -1 -2.790 22.219 -29.234 1.00 0.00 H new ATOM 0 HB2 MET A -1 -3.299 21.881 -26.304 1.00 0.00 H new ATOM 0 HB3 MET A -1 -3.260 20.598 -27.497 1.00 0.00 H new ATOM 0 HG2 MET A -1 -0.982 22.491 -26.800 1.00 0.00 H new ATOM 0 HG3 MET A -1 -1.095 20.799 -26.356 1.00 0.00 H new ATOM 0 HE1 MET A -1 -0.310 18.867 -29.610 1.00 0.00 H new ATOM 0 HE2 MET A -1 -0.438 18.796 -27.837 1.00 0.00 H new ATOM 0 HE3 MET A -1 -1.878 19.152 -28.820 1.00 0.00 H new ATOM 54 N VAL A 513 -5.668 22.367 -27.665 1.00 0.00 N ATOM 55 CA VAL A 513 -7.078 21.982 -27.782 1.00 0.00 C ATOM 56 C VAL A 513 -7.086 20.497 -28.154 1.00 0.00 C ATOM 57 O VAL A 513 -6.710 20.140 -29.267 1.00 0.00 O ATOM 58 CB VAL A 513 -7.919 22.866 -28.740 1.00 0.00 C ATOM 59 CG1 VAL A 513 -9.405 22.478 -28.666 1.00 0.00 C ATOM 60 CG2 VAL A 513 -7.803 24.363 -28.394 1.00 0.00 C ATOM 0 H VAL A 513 -5.378 22.441 -26.690 1.00 0.00 H new ATOM 0 HA VAL A 513 -7.583 22.150 -26.831 1.00 0.00 H new ATOM 0 HB VAL A 513 -7.526 22.698 -29.743 1.00 0.00 H new ATOM 0 HG11 VAL A 513 -9.980 23.108 -29.344 1.00 0.00 H new ATOM 0 HG12 VAL A 513 -9.523 21.433 -28.954 1.00 0.00 H new ATOM 0 HG13 VAL A 513 -9.767 22.617 -27.647 1.00 0.00 H new ATOM 0 HG21 VAL A 513 -8.407 24.945 -29.090 1.00 0.00 H new ATOM 0 HG22 VAL A 513 -8.158 24.530 -27.377 1.00 0.00 H new ATOM 0 HG23 VAL A 513 -6.761 24.674 -28.470 1.00 0.00 H new ATOM 70 N LEU A 514 -7.447 19.628 -27.204 1.00 0.00 N ATOM 71 CA LEU A 514 -7.553 18.188 -27.381 1.00 0.00 C ATOM 72 C LEU A 514 -8.720 17.793 -26.474 1.00 0.00 C ATOM 73 O LEU A 514 -8.852 18.406 -25.406 1.00 0.00 O ATOM 74 CB LEU A 514 -6.261 17.482 -26.926 1.00 0.00 C ATOM 75 CG LEU A 514 -5.004 17.696 -27.792 1.00 0.00 C ATOM 76 CD1 LEU A 514 -3.785 17.101 -27.074 1.00 0.00 C ATOM 77 CD2 LEU A 514 -5.136 17.050 -29.174 1.00 0.00 C ATOM 0 H LEU A 514 -7.681 19.926 -26.257 1.00 0.00 H new ATOM 0 HA LEU A 514 -7.706 17.906 -28.423 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -6.034 17.812 -25.912 1.00 0.00 H new ATOM 0 HB3 LEU A 514 -6.460 16.411 -26.876 1.00 0.00 H new ATOM 0 HG LEU A 514 -4.882 18.770 -27.936 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -2.894 17.251 -27.684 1.00 0.00 H new ATOM 0 HD12 LEU A 514 -3.653 17.595 -26.111 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -3.941 16.034 -26.916 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -4.226 17.228 -29.747 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -5.290 15.977 -29.061 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -5.986 17.485 -29.699 1.00 0.00 H new ATOM 89 N PRO A 515 -9.556 16.808 -26.828 1.00 0.00 N ATOM 90 CA PRO A 515 -10.819 16.556 -26.148 1.00 0.00 C ATOM 91 C PRO A 515 -10.615 15.912 -24.767 1.00 0.00 C ATOM 92 O PRO A 515 -10.683 14.687 -24.638 1.00 0.00 O ATOM 93 CB PRO A 515 -11.623 15.680 -27.121 1.00 0.00 C ATOM 94 CG PRO A 515 -10.544 14.917 -27.891 1.00 0.00 C ATOM 95 CD PRO A 515 -9.411 15.939 -27.986 1.00 0.00 C ATOM 0 HA PRO A 515 -11.357 17.476 -25.920 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -12.293 15.003 -26.591 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -12.241 16.283 -27.787 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -10.232 14.015 -27.364 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -10.893 14.607 -28.876 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.439 15.445 -27.984 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -9.477 16.509 -28.912 1.00 0.00 H new ATOM 103 N SER A 516 -10.395 16.732 -23.734 1.00 0.00 N ATOM 104 CA SER A 516 -10.664 16.323 -22.350 1.00 0.00 C ATOM 105 C SER A 516 -11.321 17.447 -21.552 1.00 0.00 C ATOM 106 O SER A 516 -11.096 18.624 -21.847 1.00 0.00 O ATOM 107 CB SER A 516 -9.395 15.910 -21.595 1.00 0.00 C ATOM 108 OG SER A 516 -8.573 14.996 -22.301 1.00 0.00 O ATOM 0 H SER A 516 -10.032 17.681 -23.829 1.00 0.00 H new ATOM 0 HA SER A 516 -11.332 15.466 -22.433 1.00 0.00 H new ATOM 0 HB2 SER A 516 -8.814 16.803 -21.367 1.00 0.00 H new ATOM 0 HB3 SER A 516 -9.681 15.464 -20.642 1.00 0.00 H new ATOM 0 HG SER A 516 -7.785 14.780 -21.760 1.00 0.00 H new ATOM 114 N GLU A 517 -12.020 17.076 -20.477 1.00 0.00 N ATOM 115 CA GLU A 517 -12.562 17.966 -19.458 1.00 0.00 C ATOM 116 C GLU A 517 -11.748 17.790 -18.171 1.00 0.00 C ATOM 117 O GLU A 517 -12.243 17.260 -17.169 1.00 0.00 O ATOM 118 CB GLU A 517 -14.056 17.695 -19.232 1.00 0.00 C ATOM 119 CG GLU A 517 -14.942 18.193 -20.378 1.00 0.00 C ATOM 120 CD GLU A 517 -16.394 18.189 -19.911 1.00 0.00 C ATOM 121 OE1 GLU A 517 -17.043 17.113 -19.961 1.00 0.00 O ATOM 122 OE2 GLU A 517 -16.858 19.215 -19.366 1.00 0.00 O ATOM 0 H GLU A 517 -12.232 16.096 -20.288 1.00 0.00 H new ATOM 0 HA GLU A 517 -12.481 19.002 -19.788 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -14.208 16.623 -19.103 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -14.369 18.175 -18.305 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -14.644 19.198 -20.677 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -14.824 17.553 -21.252 1.00 0.00 H new ATOM 129 N ALA A 518 -10.498 18.264 -18.222 1.00 0.00 N ATOM 130 CA ALA A 518 -9.460 18.214 -17.188 1.00 0.00 C ATOM 131 C ALA A 518 -8.897 16.795 -16.994 1.00 0.00 C ATOM 132 O ALA A 518 -9.610 15.815 -17.211 1.00 0.00 O ATOM 133 CB ALA A 518 -9.970 18.781 -15.854 1.00 0.00 C ATOM 0 H ALA A 518 -10.158 18.733 -19.061 1.00 0.00 H new ATOM 0 HA ALA A 518 -8.642 18.844 -17.538 1.00 0.00 H new ATOM 0 HB1 ALA A 518 -9.176 18.729 -15.109 1.00 0.00 H new ATOM 0 HB2 ALA A 518 -10.271 19.819 -15.991 1.00 0.00 H new ATOM 0 HB3 ALA A 518 -10.825 18.197 -15.514 1.00 0.00 H new ATOM 139 N PRO A 519 -7.642 16.655 -16.522 1.00 0.00 N ATOM 140 CA PRO A 519 -7.088 15.353 -16.159 1.00 0.00 C ATOM 141 C PRO A 519 -7.680 14.801 -14.865 1.00 0.00 C ATOM 142 O PRO A 519 -7.737 13.591 -14.661 1.00 0.00 O ATOM 143 CB PRO A 519 -5.584 15.584 -16.012 1.00 0.00 C ATOM 144 CG PRO A 519 -5.499 17.049 -15.571 1.00 0.00 C ATOM 145 CD PRO A 519 -6.645 17.703 -16.342 1.00 0.00 C ATOM 0 HA PRO A 519 -7.325 14.609 -16.919 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -5.144 14.914 -15.273 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -5.056 15.414 -16.951 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -5.625 17.155 -14.493 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -4.536 17.492 -15.825 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -7.058 18.547 -15.790 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -6.302 18.088 -17.303 1.00 0.00 H new ATOM 153 N ASN A 520 -8.147 15.730 -14.035 1.00 0.00 N ATOM 154 CA ASN A 520 -8.638 15.621 -12.668 1.00 0.00 C ATOM 155 C ASN A 520 -7.477 15.456 -11.689 1.00 0.00 C ATOM 156 O ASN A 520 -6.599 14.619 -11.899 1.00 0.00 O ATOM 157 CB ASN A 520 -9.650 14.479 -12.509 1.00 0.00 C ATOM 158 CG ASN A 520 -10.640 14.795 -11.402 1.00 0.00 C ATOM 159 OD1 ASN A 520 -11.592 15.528 -11.649 1.00 0.00 O ATOM 160 ND2 ASN A 520 -10.470 14.299 -10.189 1.00 0.00 N ATOM 0 H ASN A 520 -8.195 16.700 -14.348 1.00 0.00 H new ATOM 0 HA ASN A 520 -9.160 16.549 -12.436 1.00 0.00 H new ATOM 0 HB2 ASN A 520 -10.182 14.324 -13.447 1.00 0.00 H new ATOM 0 HB3 ASN A 520 -9.126 13.550 -12.282 1.00 0.00 H new ATOM 0 HD21 ASN A 520 -11.134 14.525 -9.448 1.00 0.00 H new ATOM 0 HD22 ASN A 520 -9.675 13.690 -9.994 1.00 0.00 H new ATOM 167 N ALA A 521 -7.508 16.224 -10.598 1.00 0.00 N ATOM 168 CA ALA A 521 -6.650 16.085 -9.423 1.00 0.00 C ATOM 169 C ALA A 521 -5.154 16.168 -9.762 1.00 0.00 C ATOM 170 O ALA A 521 -4.429 15.180 -9.670 1.00 0.00 O ATOM 171 CB ALA A 521 -7.026 14.799 -8.666 1.00 0.00 C ATOM 0 H ALA A 521 -8.166 16.998 -10.507 1.00 0.00 H new ATOM 0 HA ALA A 521 -6.826 16.935 -8.764 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -6.387 14.693 -7.789 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -8.068 14.853 -8.351 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -6.889 13.938 -9.321 1.00 0.00 H new ATOM 177 N LYS A 522 -4.664 17.355 -10.132 1.00 0.00 N ATOM 178 CA LYS A 522 -3.256 17.542 -10.502 1.00 0.00 C ATOM 179 C LYS A 522 -2.298 17.597 -9.305 1.00 0.00 C ATOM 180 O LYS A 522 -1.116 17.278 -9.484 1.00 0.00 O ATOM 181 CB LYS A 522 -3.054 18.724 -11.471 1.00 0.00 C ATOM 182 CG LYS A 522 -3.522 20.122 -11.028 1.00 0.00 C ATOM 183 CD LYS A 522 -5.044 20.304 -11.120 1.00 0.00 C ATOM 184 CE LYS A 522 -5.470 21.757 -11.368 1.00 0.00 C ATOM 185 NZ LYS A 522 -5.595 22.554 -10.131 1.00 0.00 N ATOM 0 H LYS A 522 -5.224 18.206 -10.184 1.00 0.00 H new ATOM 0 HA LYS A 522 -2.983 16.636 -11.044 1.00 0.00 H new ATOM 0 HB2 LYS A 522 -1.990 18.787 -11.700 1.00 0.00 H new ATOM 0 HB3 LYS A 522 -3.567 18.482 -12.402 1.00 0.00 H new ATOM 0 HG2 LYS A 522 -3.202 20.297 -10.001 1.00 0.00 H new ATOM 0 HG3 LYS A 522 -3.034 20.875 -11.647 1.00 0.00 H new ATOM 0 HD2 LYS A 522 -5.429 19.678 -11.925 1.00 0.00 H new ATOM 0 HD3 LYS A 522 -5.501 19.952 -10.195 1.00 0.00 H new ATOM 0 HE2 LYS A 522 -4.743 22.233 -12.026 1.00 0.00 H new ATOM 0 HE3 LYS A 522 -6.426 21.763 -11.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 522 -5.885 23.524 -10.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 522 -6.309 22.122 -9.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 522 -4.679 22.578 -9.640 1.00 0.00 H new ATOM 199 N GLU A 523 -2.747 17.965 -8.099 1.00 0.00 N ATOM 200 CA GLU A 523 -1.916 17.810 -6.906 1.00 0.00 C ATOM 201 C GLU A 523 -1.792 16.314 -6.620 1.00 0.00 C ATOM 202 O GLU A 523 -2.766 15.568 -6.766 1.00 0.00 O ATOM 203 CB GLU A 523 -2.472 18.506 -5.652 1.00 0.00 C ATOM 204 CG GLU A 523 -2.657 20.018 -5.777 1.00 0.00 C ATOM 205 CD GLU A 523 -4.002 20.359 -6.403 1.00 0.00 C ATOM 206 OE1 GLU A 523 -5.056 20.165 -5.758 1.00 0.00 O ATOM 207 OE2 GLU A 523 -4.064 20.771 -7.580 1.00 0.00 O ATOM 0 H GLU A 523 -3.669 18.367 -7.927 1.00 0.00 H new ATOM 0 HA GLU A 523 -0.958 18.285 -7.117 1.00 0.00 H new ATOM 0 HB2 GLU A 523 -3.434 18.057 -5.403 1.00 0.00 H new ATOM 0 HB3 GLU A 523 -1.801 18.306 -4.817 1.00 0.00 H new ATOM 0 HG2 GLU A 523 -2.585 20.478 -4.792 1.00 0.00 H new ATOM 0 HG3 GLU A 523 -1.854 20.436 -6.384 1.00 0.00 H new ATOM 214 N GLU A 524 -0.625 15.861 -6.179 1.00 0.00 N ATOM 215 CA GLU A 524 -0.440 14.511 -5.674 1.00 0.00 C ATOM 216 C GLU A 524 0.762 14.439 -4.757 1.00 0.00 C ATOM 217 O GLU A 524 1.587 15.353 -4.703 1.00 0.00 O ATOM 218 CB GLU A 524 -0.246 13.508 -6.814 1.00 0.00 C ATOM 219 CG GLU A 524 0.985 13.820 -7.681 1.00 0.00 C ATOM 220 CD GLU A 524 1.178 12.872 -8.861 1.00 0.00 C ATOM 221 OE1 GLU A 524 0.339 11.971 -9.087 1.00 0.00 O ATOM 222 OE2 GLU A 524 2.240 13.011 -9.507 1.00 0.00 O ATOM 0 H GLU A 524 0.224 16.426 -6.163 1.00 0.00 H new ATOM 0 HA GLU A 524 -1.343 14.254 -5.121 1.00 0.00 H new ATOM 0 HB2 GLU A 524 -0.146 12.506 -6.397 1.00 0.00 H new ATOM 0 HB3 GLU A 524 -1.136 13.504 -7.443 1.00 0.00 H new ATOM 0 HG2 GLU A 524 0.900 14.839 -8.059 1.00 0.00 H new ATOM 0 HG3 GLU A 524 1.875 13.786 -7.053 1.00 0.00 H new ATOM 229 N ILE A 525 0.873 13.308 -4.073 1.00 0.00 N ATOM 230 CA ILE A 525 1.942 12.988 -3.155 1.00 0.00 C ATOM 231 C ILE A 525 2.786 11.915 -3.836 1.00 0.00 C ATOM 232 O ILE A 525 2.245 11.081 -4.580 1.00 0.00 O ATOM 233 CB ILE A 525 1.331 12.539 -1.818 1.00 0.00 C ATOM 234 CG1 ILE A 525 0.250 13.538 -1.352 1.00 0.00 C ATOM 235 CG2 ILE A 525 2.401 12.354 -0.729 1.00 0.00 C ATOM 236 CD1 ILE A 525 0.647 15.015 -1.311 1.00 0.00 C ATOM 0 H ILE A 525 0.185 12.559 -4.151 1.00 0.00 H new ATOM 0 HA ILE A 525 2.583 13.838 -2.922 1.00 0.00 H new ATOM 0 HB ILE A 525 0.865 11.568 -1.984 1.00 0.00 H new ATOM 0 HG12 ILE A 525 -0.613 13.436 -2.010 1.00 0.00 H new ATOM 0 HG13 ILE A 525 -0.075 13.246 -0.353 1.00 0.00 H new ATOM 0 HG21 ILE A 525 1.925 12.036 0.199 1.00 0.00 H new ATOM 0 HG22 ILE A 525 3.117 11.596 -1.047 1.00 0.00 H new ATOM 0 HG23 ILE A 525 2.921 13.298 -0.565 1.00 0.00 H new ATOM 0 HD11 ILE A 525 -0.199 15.610 -0.968 1.00 0.00 H new ATOM 0 HD12 ILE A 525 1.485 15.148 -0.627 1.00 0.00 H new ATOM 0 HD13 ILE A 525 0.939 15.341 -2.309 1.00 0.00 H new ATOM 248 N LEU A 526 4.083 11.922 -3.538 1.00 0.00 N ATOM 249 CA LEU A 526 5.041 10.863 -3.814 1.00 0.00 C ATOM 250 C LEU A 526 5.921 10.720 -2.577 1.00 0.00 C ATOM 251 O LEU A 526 5.841 11.524 -1.648 1.00 0.00 O ATOM 252 CB LEU A 526 5.884 11.171 -5.067 1.00 0.00 C ATOM 253 CG LEU A 526 5.856 10.084 -6.155 1.00 0.00 C ATOM 254 CD1 LEU A 526 6.417 8.754 -5.637 1.00 0.00 C ATOM 255 CD2 LEU A 526 4.443 9.872 -6.714 1.00 0.00 C ATOM 0 H LEU A 526 4.516 12.717 -3.069 1.00 0.00 H new ATOM 0 HA LEU A 526 4.520 9.929 -4.025 1.00 0.00 H new ATOM 0 HB2 LEU A 526 5.533 12.107 -5.501 1.00 0.00 H new ATOM 0 HB3 LEU A 526 6.918 11.330 -4.760 1.00 0.00 H new ATOM 0 HG LEU A 526 6.494 10.439 -6.964 1.00 0.00 H new ATOM 0 HD11 LEU A 526 6.382 8.010 -6.433 1.00 0.00 H new ATOM 0 HD12 LEU A 526 7.450 8.895 -5.317 1.00 0.00 H new ATOM 0 HD13 LEU A 526 5.819 8.411 -4.793 1.00 0.00 H new ATOM 0 HD21 LEU A 526 4.467 9.096 -7.479 1.00 0.00 H new ATOM 0 HD22 LEU A 526 3.775 9.566 -5.909 1.00 0.00 H new ATOM 0 HD23 LEU A 526 4.081 10.803 -7.152 1.00 0.00 H new ATOM 267 N GLY A 527 6.802 9.731 -2.615 1.00 0.00 N ATOM 268 CA GLY A 527 7.834 9.484 -1.618 1.00 0.00 C ATOM 269 C GLY A 527 7.311 9.200 -0.214 1.00 0.00 C ATOM 270 O GLY A 527 6.124 8.954 -0.001 1.00 0.00 O ATOM 0 H GLY A 527 6.818 9.050 -3.374 1.00 0.00 H new ATOM 0 HA2 GLY A 527 8.439 8.638 -1.943 1.00 0.00 H new ATOM 0 HA3 GLY A 527 8.494 10.350 -1.576 1.00 0.00 H new ATOM 274 N THR A 528 8.239 9.135 0.736 1.00 0.00 N ATOM 275 CA THR A 528 7.944 8.864 2.127 1.00 0.00 C ATOM 276 C THR A 528 7.170 10.035 2.733 1.00 0.00 C ATOM 277 O THR A 528 7.454 11.201 2.437 1.00 0.00 O ATOM 278 CB THR A 528 9.227 8.614 2.942 1.00 0.00 C ATOM 279 OG1 THR A 528 10.373 8.378 2.132 1.00 0.00 O ATOM 280 CG2 THR A 528 9.026 7.422 3.890 1.00 0.00 C ATOM 0 H THR A 528 9.233 9.273 0.551 1.00 0.00 H new ATOM 0 HA THR A 528 7.337 7.959 2.168 1.00 0.00 H new ATOM 0 HB THR A 528 9.413 9.528 3.506 1.00 0.00 H new ATOM 0 HG1 THR A 528 11.177 8.387 2.692 1.00 0.00 H new ATOM 0 HG21 THR A 528 9.939 7.254 4.461 1.00 0.00 H new ATOM 0 HG22 THR A 528 8.204 7.635 4.573 1.00 0.00 H new ATOM 0 HG23 THR A 528 8.792 6.530 3.309 1.00 0.00 H new ATOM 288 N VAL A 529 6.239 9.687 3.611 1.00 0.00 N ATOM 289 CA VAL A 529 5.362 10.535 4.398 1.00 0.00 C ATOM 290 C VAL A 529 5.138 9.824 5.742 1.00 0.00 C ATOM 291 O VAL A 529 5.313 8.606 5.847 1.00 0.00 O ATOM 292 CB VAL A 529 4.036 10.760 3.635 1.00 0.00 C ATOM 293 CG1 VAL A 529 4.185 11.803 2.522 1.00 0.00 C ATOM 294 CG2 VAL A 529 3.458 9.472 3.018 1.00 0.00 C ATOM 0 H VAL A 529 6.064 8.702 3.808 1.00 0.00 H new ATOM 0 HA VAL A 529 5.798 11.519 4.574 1.00 0.00 H new ATOM 0 HB VAL A 529 3.342 11.121 4.394 1.00 0.00 H new ATOM 0 HG11 VAL A 529 3.230 11.930 2.012 1.00 0.00 H new ATOM 0 HG12 VAL A 529 4.495 12.755 2.954 1.00 0.00 H new ATOM 0 HG13 VAL A 529 4.936 11.467 1.807 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.528 9.703 2.498 1.00 0.00 H new ATOM 0 HG22 VAL A 529 4.175 9.054 2.311 1.00 0.00 H new ATOM 0 HG23 VAL A 529 3.262 8.747 3.808 1.00 0.00 H new ATOM 304 N SER A 530 4.712 10.541 6.783 1.00 0.00 N ATOM 305 CA SER A 530 4.507 9.978 8.114 1.00 0.00 C ATOM 306 C SER A 530 3.075 9.456 8.241 1.00 0.00 C ATOM 307 O SER A 530 2.361 9.773 9.195 1.00 0.00 O ATOM 308 CB SER A 530 4.885 11.031 9.168 1.00 0.00 C ATOM 309 OG SER A 530 4.300 12.298 8.893 1.00 0.00 O ATOM 0 H SER A 530 4.498 11.537 6.723 1.00 0.00 H new ATOM 0 HA SER A 530 5.155 9.118 8.283 1.00 0.00 H new ATOM 0 HB2 SER A 530 4.564 10.690 10.152 1.00 0.00 H new ATOM 0 HB3 SER A 530 5.970 11.133 9.205 1.00 0.00 H new ATOM 0 HG SER A 530 4.564 12.938 9.587 1.00 0.00 H new ATOM 315 N TRP A 531 2.615 8.720 7.229 1.00 0.00 N ATOM 316 CA TRP A 531 1.265 8.186 7.177 1.00 0.00 C ATOM 317 C TRP A 531 1.250 6.824 7.858 1.00 0.00 C ATOM 318 O TRP A 531 2.309 6.269 8.161 1.00 0.00 O ATOM 319 CB TRP A 531 0.830 8.113 5.713 1.00 0.00 C ATOM 320 CG TRP A 531 0.616 9.422 5.021 1.00 0.00 C ATOM 321 CD1 TRP A 531 0.835 10.660 5.527 1.00 0.00 C ATOM 322 CD2 TRP A 531 0.171 9.634 3.649 1.00 0.00 C ATOM 323 NE1 TRP A 531 0.532 11.607 4.575 1.00 0.00 N ATOM 324 CE2 TRP A 531 0.190 11.030 3.374 1.00 0.00 C ATOM 325 CE3 TRP A 531 -0.187 8.775 2.589 1.00 0.00 C ATOM 326 CZ2 TRP A 531 -0.081 11.543 2.101 1.00 0.00 C ATOM 327 CZ3 TRP A 531 -0.490 9.282 1.315 1.00 0.00 C ATOM 328 CH2 TRP A 531 -0.427 10.664 1.067 1.00 0.00 C ATOM 0 H TRP A 531 3.181 8.478 6.415 1.00 0.00 H new ATOM 0 HA TRP A 531 0.558 8.826 7.705 1.00 0.00 H new ATOM 0 HB2 TRP A 531 1.583 7.552 5.160 1.00 0.00 H new ATOM 0 HB3 TRP A 531 -0.097 7.542 5.659 1.00 0.00 H new ATOM 0 HD1 TRP A 531 1.192 10.871 6.524 1.00 0.00 H new ATOM 0 HE1 TRP A 531 0.558 12.613 4.740 1.00 0.00 H new ATOM 0 HE3 TRP A 531 -0.229 7.709 2.760 1.00 0.00 H new ATOM 0 HZ2 TRP A 531 -0.024 12.606 1.918 1.00 0.00 H new ATOM 0 HZ3 TRP A 531 -0.773 8.606 0.521 1.00 0.00 H new ATOM 0 HH2 TRP A 531 -0.645 11.047 0.081 1.00 0.00 H new ATOM 339 N ASN A 532 0.058 6.266 8.087 1.00 0.00 N ATOM 340 CA ASN A 532 -0.104 5.096 8.949 1.00 0.00 C ATOM 341 C ASN A 532 -0.879 4.012 8.221 1.00 0.00 C ATOM 342 O ASN A 532 -0.264 3.056 7.755 1.00 0.00 O ATOM 343 CB ASN A 532 -0.714 5.507 10.293 1.00 0.00 C ATOM 344 CG ASN A 532 0.306 6.323 11.067 1.00 0.00 C ATOM 345 OD1 ASN A 532 1.131 5.778 11.791 1.00 0.00 O ATOM 346 ND2 ASN A 532 0.294 7.636 10.936 1.00 0.00 N ATOM 0 H ASN A 532 -0.813 6.610 7.683 1.00 0.00 H new ATOM 0 HA ASN A 532 0.869 4.664 9.183 1.00 0.00 H new ATOM 0 HB2 ASN A 532 -1.620 6.091 10.133 1.00 0.00 H new ATOM 0 HB3 ASN A 532 -1.001 4.623 10.863 1.00 0.00 H new ATOM 0 HD21 ASN A 532 0.975 8.205 11.439 1.00 0.00 H new ATOM 0 HD22 ASN A 532 -0.396 8.082 10.331 1.00 0.00 H new ATOM 353 N LEU A 533 -2.202 4.147 8.087 1.00 0.00 N ATOM 354 CA LEU A 533 -2.979 3.299 7.184 1.00 0.00 C ATOM 355 C LEU A 533 -4.242 4.010 6.707 1.00 0.00 C ATOM 356 O LEU A 533 -4.558 3.960 5.522 1.00 0.00 O ATOM 357 CB LEU A 533 -3.311 1.974 7.884 1.00 0.00 C ATOM 358 CG LEU A 533 -4.038 0.941 7.004 1.00 0.00 C ATOM 359 CD1 LEU A 533 -3.277 0.579 5.722 1.00 0.00 C ATOM 360 CD2 LEU A 533 -4.211 -0.326 7.843 1.00 0.00 C ATOM 0 H LEU A 533 -2.756 4.837 8.594 1.00 0.00 H new ATOM 0 HA LEU A 533 -2.382 3.086 6.297 1.00 0.00 H new ATOM 0 HB2 LEU A 533 -2.385 1.531 8.249 1.00 0.00 H new ATOM 0 HB3 LEU A 533 -3.929 2.186 8.757 1.00 0.00 H new ATOM 0 HG LEU A 533 -4.986 1.377 6.689 1.00 0.00 H new ATOM 0 HD11 LEU A 533 -3.850 -0.153 5.153 1.00 0.00 H new ATOM 0 HD12 LEU A 533 -3.134 1.475 5.119 1.00 0.00 H new ATOM 0 HD13 LEU A 533 -2.306 0.157 5.982 1.00 0.00 H new ATOM 0 HD21 LEU A 533 -4.724 -1.086 7.253 1.00 0.00 H new ATOM 0 HD22 LEU A 533 -3.232 -0.700 8.144 1.00 0.00 H new ATOM 0 HD23 LEU A 533 -4.800 -0.097 8.731 1.00 0.00 H new ATOM 372 N ARG A 534 -4.952 4.708 7.599 1.00 0.00 N ATOM 373 CA ARG A 534 -6.115 5.525 7.228 1.00 0.00 C ATOM 374 C ARG A 534 -5.736 6.594 6.207 1.00 0.00 C ATOM 375 O ARG A 534 -6.471 6.761 5.242 1.00 0.00 O ATOM 376 CB ARG A 534 -6.711 6.206 8.461 1.00 0.00 C ATOM 377 CG ARG A 534 -7.425 5.262 9.438 1.00 0.00 C ATOM 378 CD ARG A 534 -8.910 5.048 9.096 1.00 0.00 C ATOM 379 NE ARG A 534 -9.731 5.252 10.296 1.00 0.00 N ATOM 380 CZ ARG A 534 -11.025 5.564 10.381 1.00 0.00 C ATOM 381 NH1 ARG A 534 -11.831 5.434 9.334 1.00 0.00 N ATOM 382 NH2 ARG A 534 -11.493 5.995 11.546 1.00 0.00 N ATOM 0 H ARG A 534 -4.739 4.724 8.596 1.00 0.00 H new ATOM 0 HA ARG A 534 -6.853 4.856 6.786 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -5.913 6.722 8.995 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -7.418 6.967 8.132 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -6.916 4.298 9.439 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -7.346 5.666 10.447 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -9.216 5.742 8.313 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -9.062 4.041 8.707 1.00 0.00 H new ATOM 0 HE ARG A 534 -9.246 5.140 11.186 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -11.463 5.091 8.447 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -12.818 5.677 9.417 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -10.867 6.080 12.347 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -12.478 6.241 11.640 1.00 0.00 H new ATOM 396 N GLU A 535 -4.607 7.279 6.419 1.00 0.00 N ATOM 397 CA GLU A 535 -4.062 8.273 5.491 1.00 0.00 C ATOM 398 C GLU A 535 -3.937 7.700 4.082 1.00 0.00 C ATOM 399 O GLU A 535 -4.233 8.346 3.083 1.00 0.00 O ATOM 400 CB GLU A 535 -2.672 8.705 5.967 1.00 0.00 C ATOM 401 CG GLU A 535 -2.733 9.914 6.895 1.00 0.00 C ATOM 402 CD GLU A 535 -2.847 11.255 6.164 1.00 0.00 C ATOM 403 OE1 GLU A 535 -3.561 11.327 5.140 1.00 0.00 O ATOM 404 OE2 GLU A 535 -2.309 12.262 6.687 1.00 0.00 O ATOM 0 H GLU A 535 -4.037 7.155 7.256 1.00 0.00 H new ATOM 0 HA GLU A 535 -4.743 9.124 5.468 1.00 0.00 H new ATOM 0 HB2 GLU A 535 -2.193 7.875 6.485 1.00 0.00 H new ATOM 0 HB3 GLU A 535 -2.051 8.943 5.103 1.00 0.00 H new ATOM 0 HG2 GLU A 535 -3.586 9.803 7.564 1.00 0.00 H new ATOM 0 HG3 GLU A 535 -1.839 9.926 7.518 1.00 0.00 H new ATOM 411 N MET A 536 -3.470 6.462 3.998 1.00 0.00 N ATOM 412 CA MET A 536 -3.099 5.825 2.760 1.00 0.00 C ATOM 413 C MET A 536 -4.361 5.425 2.021 1.00 0.00 C ATOM 414 O MET A 536 -4.503 5.807 0.869 1.00 0.00 O ATOM 415 CB MET A 536 -2.211 4.639 3.091 1.00 0.00 C ATOM 416 CG MET A 536 -0.946 5.087 3.825 1.00 0.00 C ATOM 417 SD MET A 536 -0.096 3.710 4.592 1.00 0.00 S ATOM 418 CE MET A 536 0.600 3.033 3.082 1.00 0.00 C ATOM 0 H MET A 536 -3.339 5.865 4.815 1.00 0.00 H new ATOM 0 HA MET A 536 -2.539 6.494 2.106 1.00 0.00 H new ATOM 0 HB2 MET A 536 -2.762 3.929 3.709 1.00 0.00 H new ATOM 0 HB3 MET A 536 -1.938 4.118 2.173 1.00 0.00 H new ATOM 0 HG2 MET A 536 -0.275 5.582 3.123 1.00 0.00 H new ATOM 0 HG3 MET A 536 -1.209 5.821 4.587 1.00 0.00 H new ATOM 0 HE1 MET A 536 1.127 2.106 3.308 1.00 0.00 H new ATOM 0 HE2 MET A 536 -0.201 2.831 2.371 1.00 0.00 H new ATOM 0 HE3 MET A 536 1.297 3.750 2.649 1.00 0.00 H new ATOM 428 N LEU A 537 -5.293 4.743 2.696 1.00 0.00 N ATOM 429 CA LEU A 537 -6.668 4.562 2.285 1.00 0.00 C ATOM 430 C LEU A 537 -7.281 5.851 1.738 1.00 0.00 C ATOM 431 O LEU A 537 -7.862 5.848 0.653 1.00 0.00 O ATOM 432 CB LEU A 537 -7.432 4.069 3.527 1.00 0.00 C ATOM 433 CG LEU A 537 -7.575 2.553 3.525 1.00 0.00 C ATOM 434 CD1 LEU A 537 -6.353 1.664 3.423 1.00 0.00 C ATOM 435 CD2 LEU A 537 -8.416 2.085 4.715 1.00 0.00 C ATOM 0 H LEU A 537 -5.088 4.285 3.584 1.00 0.00 H new ATOM 0 HA LEU A 537 -6.727 3.841 1.470 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -6.907 4.385 4.428 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -8.420 4.529 3.555 1.00 0.00 H new ATOM 0 HG LEU A 537 -8.053 2.413 2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -6.661 0.619 3.438 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -5.827 1.874 2.492 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -5.690 1.859 4.266 1.00 0.00 H new ATOM 0 HD21 LEU A 537 -8.505 0.999 4.693 1.00 0.00 H new ATOM 0 HD22 LEU A 537 -7.934 2.391 5.644 1.00 0.00 H new ATOM 0 HD23 LEU A 537 -9.409 2.531 4.657 1.00 0.00 H new ATOM 447 N ALA A 538 -7.200 6.944 2.494 1.00 0.00 N ATOM 448 CA ALA A 538 -7.757 8.229 2.112 1.00 0.00 C ATOM 449 C ALA A 538 -7.120 8.720 0.812 1.00 0.00 C ATOM 450 O ALA A 538 -7.830 9.009 -0.152 1.00 0.00 O ATOM 451 CB ALA A 538 -7.574 9.224 3.263 1.00 0.00 C ATOM 0 H ALA A 538 -6.737 6.956 3.403 1.00 0.00 H new ATOM 0 HA ALA A 538 -8.826 8.130 1.922 1.00 0.00 H new ATOM 0 HB1 ALA A 538 -7.991 10.190 2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 538 -8.088 8.853 4.150 1.00 0.00 H new ATOM 0 HB3 ALA A 538 -6.512 9.338 3.480 1.00 0.00 H new ATOM 457 N HIS A 539 -5.794 8.814 0.767 1.00 0.00 N ATOM 458 CA HIS A 539 -5.084 9.362 -0.379 1.00 0.00 C ATOM 459 C HIS A 539 -5.175 8.465 -1.618 1.00 0.00 C ATOM 460 O HIS A 539 -5.231 8.957 -2.749 1.00 0.00 O ATOM 461 CB HIS A 539 -3.625 9.589 0.006 1.00 0.00 C ATOM 462 CG HIS A 539 -2.873 10.206 -1.139 1.00 0.00 C ATOM 463 ND1 HIS A 539 -3.116 11.459 -1.671 1.00 0.00 N ATOM 464 CD2 HIS A 539 -1.973 9.554 -1.938 1.00 0.00 C ATOM 465 CE1 HIS A 539 -2.364 11.565 -2.778 1.00 0.00 C ATOM 466 NE2 HIS A 539 -1.653 10.431 -2.959 1.00 0.00 N ATOM 0 H HIS A 539 -5.183 8.511 1.526 1.00 0.00 H new ATOM 0 HA HIS A 539 -5.559 10.306 -0.647 1.00 0.00 H new ATOM 0 HB2 HIS A 539 -3.569 10.239 0.879 1.00 0.00 H new ATOM 0 HB3 HIS A 539 -3.164 8.641 0.284 1.00 0.00 H new ATOM 0 HD1 HIS A 539 -3.746 12.167 -1.294 1.00 0.00 H new ATOM 0 HD2 HIS A 539 -1.589 8.554 -1.799 1.00 0.00 H new ATOM 0 HE1 HIS A 539 -2.332 12.428 -3.427 1.00 0.00 H new ATOM 475 N ALA A 540 -5.121 7.147 -1.434 1.00 0.00 N ATOM 476 CA ALA A 540 -5.267 6.189 -2.516 1.00 0.00 C ATOM 477 C ALA A 540 -6.625 6.351 -3.190 1.00 0.00 C ATOM 478 O ALA A 540 -6.681 6.221 -4.404 1.00 0.00 O ATOM 479 CB ALA A 540 -5.107 4.765 -1.991 1.00 0.00 C ATOM 0 H ALA A 540 -4.973 6.716 -0.521 1.00 0.00 H new ATOM 0 HA ALA A 540 -4.487 6.380 -3.253 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -5.219 4.059 -2.814 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -4.118 4.650 -1.546 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -5.869 4.567 -1.237 1.00 0.00 H new ATOM 485 N GLU A 541 -7.710 6.633 -2.463 1.00 0.00 N ATOM 486 CA GLU A 541 -8.989 6.972 -3.067 1.00 0.00 C ATOM 487 C GLU A 541 -8.928 8.323 -3.773 1.00 0.00 C ATOM 488 O GLU A 541 -9.309 8.433 -4.936 1.00 0.00 O ATOM 489 CB GLU A 541 -10.043 7.010 -1.954 1.00 0.00 C ATOM 490 CG GLU A 541 -10.986 5.827 -2.099 1.00 0.00 C ATOM 491 CD GLU A 541 -12.060 6.133 -3.141 1.00 0.00 C ATOM 492 OE1 GLU A 541 -13.096 6.736 -2.777 1.00 0.00 O ATOM 493 OE2 GLU A 541 -11.825 5.789 -4.316 1.00 0.00 O ATOM 0 H GLU A 541 -7.720 6.631 -1.443 1.00 0.00 H new ATOM 0 HA GLU A 541 -9.245 6.223 -3.817 1.00 0.00 H new ATOM 0 HB2 GLU A 541 -9.557 6.982 -0.979 1.00 0.00 H new ATOM 0 HB3 GLU A 541 -10.605 7.943 -2.004 1.00 0.00 H new ATOM 0 HG2 GLU A 541 -10.425 4.940 -2.394 1.00 0.00 H new ATOM 0 HG3 GLU A 541 -11.453 5.605 -1.139 1.00 0.00 H new ATOM 500 N GLU A 542 -8.414 9.331 -3.065 1.00 0.00 N ATOM 501 CA GLU A 542 -8.334 10.731 -3.485 1.00 0.00 C ATOM 502 C GLU A 542 -7.635 10.884 -4.838 1.00 0.00 C ATOM 503 O GLU A 542 -7.942 11.799 -5.597 1.00 0.00 O ATOM 504 CB GLU A 542 -7.534 11.462 -2.399 1.00 0.00 C ATOM 505 CG GLU A 542 -7.344 12.964 -2.608 1.00 0.00 C ATOM 506 CD GLU A 542 -6.343 13.581 -1.628 1.00 0.00 C ATOM 507 OE1 GLU A 542 -5.419 12.877 -1.143 1.00 0.00 O ATOM 508 OE2 GLU A 542 -6.449 14.805 -1.404 1.00 0.00 O ATOM 0 H GLU A 542 -8.022 9.185 -2.135 1.00 0.00 H new ATOM 0 HA GLU A 542 -9.336 11.143 -3.605 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -8.032 11.308 -1.442 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -6.551 10.998 -2.325 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -7.004 13.143 -3.628 1.00 0.00 H new ATOM 0 HG3 GLU A 542 -8.306 13.465 -2.500 1.00 0.00 H new ATOM 515 N THR A 543 -6.676 10.004 -5.129 1.00 0.00 N ATOM 516 CA THR A 543 -5.884 10.040 -6.351 1.00 0.00 C ATOM 517 C THR A 543 -6.047 8.756 -7.176 1.00 0.00 C ATOM 518 O THR A 543 -5.364 8.583 -8.186 1.00 0.00 O ATOM 519 CB THR A 543 -4.427 10.398 -5.999 1.00 0.00 C ATOM 520 OG1 THR A 543 -3.846 9.506 -5.053 1.00 0.00 O ATOM 521 CG2 THR A 543 -4.346 11.808 -5.405 1.00 0.00 C ATOM 0 H THR A 543 -6.426 9.234 -4.508 1.00 0.00 H new ATOM 0 HA THR A 543 -6.253 10.825 -7.012 1.00 0.00 H new ATOM 0 HB THR A 543 -3.875 10.328 -6.936 1.00 0.00 H new ATOM 0 HG1 THR A 543 -4.373 9.516 -4.227 1.00 0.00 H new ATOM 0 HG21 THR A 543 -3.309 12.042 -5.163 1.00 0.00 H new ATOM 0 HG22 THR A 543 -4.721 12.530 -6.130 1.00 0.00 H new ATOM 0 HG23 THR A 543 -4.950 11.856 -4.499 1.00 0.00 H new ATOM 529 N ARG A 544 -6.953 7.858 -6.762 1.00 0.00 N ATOM 530 CA ARG A 544 -7.217 6.529 -7.329 1.00 0.00 C ATOM 531 C ARG A 544 -5.937 5.684 -7.543 1.00 0.00 C ATOM 532 O ARG A 544 -5.972 4.721 -8.315 1.00 0.00 O ATOM 533 CB ARG A 544 -8.131 6.677 -8.563 1.00 0.00 C ATOM 534 CG ARG A 544 -9.449 7.451 -8.320 1.00 0.00 C ATOM 535 CD ARG A 544 -10.521 6.703 -7.501 1.00 0.00 C ATOM 536 NE ARG A 544 -11.354 5.823 -8.343 1.00 0.00 N ATOM 537 CZ ARG A 544 -12.108 4.800 -7.913 1.00 0.00 C ATOM 538 NH1 ARG A 544 -12.229 4.507 -6.625 1.00 0.00 N ATOM 539 NH2 ARG A 544 -12.737 4.019 -8.780 1.00 0.00 N ATOM 0 H ARG A 544 -7.562 8.055 -5.968 1.00 0.00 H new ATOM 0 HA ARG A 544 -7.763 5.929 -6.601 1.00 0.00 H new ATOM 0 HB2 ARG A 544 -7.572 7.182 -9.350 1.00 0.00 H new ATOM 0 HB3 ARG A 544 -8.376 5.682 -8.935 1.00 0.00 H new ATOM 0 HG2 ARG A 544 -9.212 8.384 -7.808 1.00 0.00 H new ATOM 0 HG3 ARG A 544 -9.876 7.717 -9.287 1.00 0.00 H new ATOM 0 HD2 ARG A 544 -10.035 6.109 -6.727 1.00 0.00 H new ATOM 0 HD3 ARG A 544 -11.159 7.427 -6.994 1.00 0.00 H new ATOM 0 HE ARG A 544 -11.357 6.010 -9.346 1.00 0.00 H new ATOM 0 HH11 ARG A 544 -11.740 5.067 -5.926 1.00 0.00 H new ATOM 0 HH12 ARG A 544 -12.811 3.722 -6.333 1.00 0.00 H new ATOM 0 HH21 ARG A 544 -12.649 4.194 -9.781 1.00 0.00 H new ATOM 0 HH22 ARG A 544 -13.309 3.243 -8.446 1.00 0.00 H new ATOM 553 N LYS A 545 -4.827 6.011 -6.854 1.00 0.00 N ATOM 554 CA LYS A 545 -3.529 5.324 -6.920 1.00 0.00 C ATOM 555 C LYS A 545 -3.627 3.909 -6.350 1.00 0.00 C ATOM 556 O LYS A 545 -4.474 3.629 -5.500 1.00 0.00 O ATOM 557 CB LYS A 545 -2.420 6.152 -6.232 1.00 0.00 C ATOM 558 CG LYS A 545 -2.005 7.355 -7.103 1.00 0.00 C ATOM 559 CD LYS A 545 -0.781 8.131 -6.590 1.00 0.00 C ATOM 560 CE LYS A 545 -0.473 9.216 -7.642 1.00 0.00 C ATOM 561 NZ LYS A 545 0.922 9.718 -7.652 1.00 0.00 N ATOM 0 H LYS A 545 -4.813 6.799 -6.207 1.00 0.00 H new ATOM 0 HA LYS A 545 -3.250 5.230 -7.969 1.00 0.00 H new ATOM 0 HB2 LYS A 545 -2.773 6.505 -5.263 1.00 0.00 H new ATOM 0 HB3 LYS A 545 -1.553 5.519 -6.044 1.00 0.00 H new ATOM 0 HG2 LYS A 545 -1.796 7.000 -8.112 1.00 0.00 H new ATOM 0 HG3 LYS A 545 -2.849 8.041 -7.175 1.00 0.00 H new ATOM 0 HD2 LYS A 545 -0.987 8.581 -5.619 1.00 0.00 H new ATOM 0 HD3 LYS A 545 0.072 7.466 -6.459 1.00 0.00 H new ATOM 0 HE2 LYS A 545 -0.704 8.816 -8.629 1.00 0.00 H new ATOM 0 HE3 LYS A 545 -1.143 10.059 -7.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 545 1.021 10.453 -8.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 545 1.153 10.120 -6.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 545 1.572 8.933 -7.861 1.00 0.00 H new ATOM 575 N LEU A 546 -2.746 3.025 -6.812 1.00 0.00 N ATOM 576 CA LEU A 546 -2.724 1.608 -6.468 1.00 0.00 C ATOM 577 C LEU A 546 -2.181 1.431 -5.042 1.00 0.00 C ATOM 578 O LEU A 546 -1.332 2.205 -4.602 1.00 0.00 O ATOM 579 CB LEU A 546 -1.897 0.893 -7.557 1.00 0.00 C ATOM 580 CG LEU A 546 -1.928 -0.655 -7.601 1.00 0.00 C ATOM 581 CD1 LEU A 546 -1.375 -1.202 -8.917 1.00 0.00 C ATOM 582 CD2 LEU A 546 -1.393 -1.534 -6.463 1.00 0.00 C ATOM 0 H LEU A 546 -2.002 3.286 -7.459 1.00 0.00 H new ATOM 0 HA LEU A 546 -3.718 1.161 -6.453 1.00 0.00 H new ATOM 0 HB2 LEU A 546 -2.234 1.260 -8.526 1.00 0.00 H new ATOM 0 HB3 LEU A 546 -0.858 1.202 -7.443 1.00 0.00 H new ATOM 0 HG LEU A 546 -3.005 -0.756 -7.467 1.00 0.00 H new ATOM 0 HD11 LEU A 546 -1.416 -2.291 -8.904 1.00 0.00 H new ATOM 0 HD12 LEU A 546 -1.973 -0.826 -9.747 1.00 0.00 H new ATOM 0 HD13 LEU A 546 -0.341 -0.879 -9.039 1.00 0.00 H new ATOM 0 HD21 LEU A 546 -1.523 -2.585 -6.723 1.00 0.00 H new ATOM 0 HD22 LEU A 546 -0.334 -1.327 -6.310 1.00 0.00 H new ATOM 0 HD23 LEU A 546 -1.941 -1.316 -5.546 1.00 0.00 H new ATOM 594 N MET A 547 -2.609 0.395 -4.318 1.00 0.00 N ATOM 595 CA MET A 547 -2.159 0.108 -2.956 1.00 0.00 C ATOM 596 C MET A 547 -1.769 -1.373 -2.789 1.00 0.00 C ATOM 597 O MET A 547 -2.626 -2.195 -2.470 1.00 0.00 O ATOM 598 CB MET A 547 -3.270 0.563 -2.002 1.00 0.00 C ATOM 599 CG MET A 547 -2.838 0.605 -0.537 1.00 0.00 C ATOM 600 SD MET A 547 -3.754 1.844 0.418 1.00 0.00 S ATOM 601 CE MET A 547 -3.100 1.501 2.060 1.00 0.00 C ATOM 0 H MET A 547 -3.290 -0.279 -4.668 1.00 0.00 H new ATOM 0 HA MET A 547 -1.247 0.657 -2.721 1.00 0.00 H new ATOM 0 HB2 MET A 547 -3.610 1.555 -2.300 1.00 0.00 H new ATOM 0 HB3 MET A 547 -4.122 -0.110 -2.102 1.00 0.00 H new ATOM 0 HG2 MET A 547 -2.986 -0.378 -0.089 1.00 0.00 H new ATOM 0 HG3 MET A 547 -1.771 0.823 -0.482 1.00 0.00 H new ATOM 0 HE1 MET A 547 -3.557 2.177 2.782 1.00 0.00 H new ATOM 0 HE2 MET A 547 -3.326 0.470 2.334 1.00 0.00 H new ATOM 0 HE3 MET A 547 -2.020 1.648 2.059 1.00 0.00 H new ATOM 611 N PRO A 548 -0.509 -1.782 -3.021 1.00 0.00 N ATOM 612 CA PRO A 548 -0.116 -3.170 -2.821 1.00 0.00 C ATOM 613 C PRO A 548 -0.092 -3.531 -1.328 1.00 0.00 C ATOM 614 O PRO A 548 0.454 -2.777 -0.512 1.00 0.00 O ATOM 615 CB PRO A 548 1.232 -3.333 -3.522 1.00 0.00 C ATOM 616 CG PRO A 548 1.765 -1.923 -3.754 1.00 0.00 C ATOM 617 CD PRO A 548 0.617 -0.968 -3.435 1.00 0.00 C ATOM 0 HA PRO A 548 -0.834 -3.869 -3.251 1.00 0.00 H new ATOM 0 HB2 PRO A 548 1.922 -3.914 -2.909 1.00 0.00 H new ATOM 0 HB3 PRO A 548 1.118 -3.866 -4.466 1.00 0.00 H new ATOM 0 HG2 PRO A 548 2.625 -1.723 -3.115 1.00 0.00 H new ATOM 0 HG3 PRO A 548 2.098 -1.799 -4.784 1.00 0.00 H new ATOM 0 HD2 PRO A 548 0.902 -0.273 -2.645 1.00 0.00 H new ATOM 0 HD3 PRO A 548 0.359 -0.369 -4.309 1.00 0.00 H new ATOM 625 N ILE A 549 -0.674 -4.686 -0.993 1.00 0.00 N ATOM 626 CA ILE A 549 -0.944 -5.194 0.351 1.00 0.00 C ATOM 627 C ILE A 549 -0.623 -6.696 0.342 1.00 0.00 C ATOM 628 O ILE A 549 -0.913 -7.382 -0.638 1.00 0.00 O ATOM 629 CB ILE A 549 -2.438 -4.944 0.672 1.00 0.00 C ATOM 630 CG1 ILE A 549 -2.842 -3.460 0.801 1.00 0.00 C ATOM 631 CG2 ILE A 549 -2.979 -5.724 1.876 1.00 0.00 C ATOM 632 CD1 ILE A 549 -2.273 -2.660 1.975 1.00 0.00 C ATOM 0 H ILE A 549 -0.992 -5.338 -1.710 1.00 0.00 H new ATOM 0 HA ILE A 549 -0.340 -4.698 1.110 1.00 0.00 H new ATOM 0 HB ILE A 549 -2.913 -5.339 -0.226 1.00 0.00 H new ATOM 0 HG12 ILE A 549 -2.552 -2.954 -0.120 1.00 0.00 H new ATOM 0 HG13 ILE A 549 -3.929 -3.414 0.861 1.00 0.00 H new ATOM 0 HG21 ILE A 549 -4.032 -5.483 2.022 1.00 0.00 H new ATOM 0 HG22 ILE A 549 -2.873 -6.793 1.694 1.00 0.00 H new ATOM 0 HG23 ILE A 549 -2.417 -5.450 2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 549 -2.645 -1.636 1.932 1.00 0.00 H new ATOM 0 HD12 ILE A 549 -2.583 -3.120 2.913 1.00 0.00 H new ATOM 0 HD13 ILE A 549 -1.185 -2.653 1.917 1.00 0.00 H new ATOM 644 N CYS A 550 -0.074 -7.230 1.435 1.00 0.00 N ATOM 645 CA CYS A 550 0.128 -8.661 1.598 1.00 0.00 C ATOM 646 C CYS A 550 -1.025 -9.198 2.434 1.00 0.00 C ATOM 647 O CYS A 550 -1.082 -8.908 3.631 1.00 0.00 O ATOM 648 CB CYS A 550 1.445 -8.930 2.324 1.00 0.00 C ATOM 649 SG CYS A 550 1.807 -10.700 2.148 1.00 0.00 S ATOM 0 H CYS A 550 0.242 -6.676 2.231 1.00 0.00 H new ATOM 0 HA CYS A 550 0.165 -9.147 0.623 1.00 0.00 H new ATOM 0 HB2 CYS A 550 2.248 -8.329 1.898 1.00 0.00 H new ATOM 0 HB3 CYS A 550 1.367 -8.657 3.376 1.00 0.00 H new ATOM 0 HG CYS A 550 1.345 -11.126 1.010 1.00 0.00 H new ATOM 655 N MET A 551 -1.935 -9.974 1.842 1.00 0.00 N ATOM 656 CA MET A 551 -3.147 -10.421 2.530 1.00 0.00 C ATOM 657 C MET A 551 -2.870 -11.227 3.810 1.00 0.00 C ATOM 658 O MET A 551 -3.743 -11.351 4.665 1.00 0.00 O ATOM 659 CB MET A 551 -4.046 -11.211 1.567 1.00 0.00 C ATOM 660 CG MET A 551 -3.459 -12.562 1.131 1.00 0.00 C ATOM 661 SD MET A 551 -4.610 -13.601 0.194 1.00 0.00 S ATOM 662 CE MET A 551 -4.861 -12.519 -1.235 1.00 0.00 C ATOM 0 H MET A 551 -1.854 -10.307 0.881 1.00 0.00 H new ATOM 0 HA MET A 551 -3.667 -9.520 2.855 1.00 0.00 H new ATOM 0 HB2 MET A 551 -5.010 -11.383 2.045 1.00 0.00 H new ATOM 0 HB3 MET A 551 -4.233 -10.605 0.681 1.00 0.00 H new ATOM 0 HG2 MET A 551 -2.572 -12.382 0.523 1.00 0.00 H new ATOM 0 HG3 MET A 551 -3.133 -13.107 2.017 1.00 0.00 H new ATOM 0 HE1 MET A 551 -5.371 -13.071 -2.024 1.00 0.00 H new ATOM 0 HE2 MET A 551 -5.468 -11.663 -0.941 1.00 0.00 H new ATOM 0 HE3 MET A 551 -3.895 -12.171 -1.602 1.00 0.00 H new ATOM 672 N ASP A 552 -1.670 -11.782 3.954 1.00 0.00 N ATOM 673 CA ASP A 552 -1.232 -12.556 5.110 1.00 0.00 C ATOM 674 C ASP A 552 -1.320 -11.769 6.424 1.00 0.00 C ATOM 675 O ASP A 552 -1.643 -12.354 7.461 1.00 0.00 O ATOM 676 CB ASP A 552 0.205 -12.982 4.825 1.00 0.00 C ATOM 677 CG ASP A 552 0.943 -13.517 6.043 1.00 0.00 C ATOM 678 OD1 ASP A 552 0.625 -14.633 6.512 1.00 0.00 O ATOM 679 OD2 ASP A 552 1.918 -12.859 6.466 1.00 0.00 O ATOM 0 H ASP A 552 -0.947 -11.701 3.239 1.00 0.00 H new ATOM 0 HA ASP A 552 -1.889 -13.415 5.248 1.00 0.00 H new ATOM 0 HB2 ASP A 552 0.199 -13.749 4.050 1.00 0.00 H new ATOM 0 HB3 ASP A 552 0.754 -12.129 4.426 1.00 0.00 H new ATOM 684 N VAL A 553 -1.074 -10.453 6.385 1.00 0.00 N ATOM 685 CA VAL A 553 -1.073 -9.600 7.571 1.00 0.00 C ATOM 686 C VAL A 553 -2.525 -9.293 7.955 1.00 0.00 C ATOM 687 O VAL A 553 -3.133 -8.355 7.429 1.00 0.00 O ATOM 688 CB VAL A 553 -0.232 -8.320 7.357 1.00 0.00 C ATOM 689 CG1 VAL A 553 0.123 -7.703 8.711 1.00 0.00 C ATOM 690 CG2 VAL A 553 1.084 -8.565 6.610 1.00 0.00 C ATOM 0 H VAL A 553 -0.869 -9.951 5.521 1.00 0.00 H new ATOM 0 HA VAL A 553 -0.595 -10.125 8.398 1.00 0.00 H new ATOM 0 HB VAL A 553 -0.851 -7.659 6.750 1.00 0.00 H new ATOM 0 HG11 VAL A 553 0.716 -6.801 8.556 1.00 0.00 H new ATOM 0 HG12 VAL A 553 -0.792 -7.448 9.246 1.00 0.00 H new ATOM 0 HG13 VAL A 553 0.699 -8.419 9.297 1.00 0.00 H new ATOM 0 HG21 VAL A 553 1.619 -7.622 6.497 1.00 0.00 H new ATOM 0 HG22 VAL A 553 1.698 -9.266 7.175 1.00 0.00 H new ATOM 0 HG23 VAL A 553 0.871 -8.982 5.625 1.00 0.00 H new ATOM 700 N ARG A 554 -3.113 -10.117 8.823 1.00 0.00 N ATOM 701 CA ARG A 554 -4.546 -10.066 9.109 1.00 0.00 C ATOM 702 C ARG A 554 -4.982 -8.761 9.778 1.00 0.00 C ATOM 703 O ARG A 554 -6.062 -8.289 9.449 1.00 0.00 O ATOM 704 CB ARG A 554 -4.977 -11.320 9.889 1.00 0.00 C ATOM 705 CG ARG A 554 -4.986 -12.569 8.984 1.00 0.00 C ATOM 706 CD ARG A 554 -6.279 -12.682 8.163 1.00 0.00 C ATOM 707 NE ARG A 554 -6.201 -13.712 7.112 1.00 0.00 N ATOM 708 CZ ARG A 554 -6.403 -15.029 7.240 1.00 0.00 C ATOM 709 NH1 ARG A 554 -6.604 -15.571 8.436 1.00 0.00 N ATOM 710 NH2 ARG A 554 -6.422 -15.805 6.163 1.00 0.00 N ATOM 0 H ARG A 554 -2.611 -10.835 9.345 1.00 0.00 H new ATOM 0 HA ARG A 554 -5.074 -10.070 8.156 1.00 0.00 H new ATOM 0 HB2 ARG A 554 -4.298 -11.481 10.727 1.00 0.00 H new ATOM 0 HB3 ARG A 554 -5.971 -11.166 10.309 1.00 0.00 H new ATOM 0 HG2 ARG A 554 -4.131 -12.532 8.309 1.00 0.00 H new ATOM 0 HG3 ARG A 554 -4.869 -13.462 9.599 1.00 0.00 H new ATOM 0 HD2 ARG A 554 -7.109 -12.913 8.831 1.00 0.00 H new ATOM 0 HD3 ARG A 554 -6.498 -11.718 7.705 1.00 0.00 H new ATOM 0 HE ARG A 554 -5.965 -13.382 6.176 1.00 0.00 H new ATOM 0 HH11 ARG A 554 -6.606 -14.982 9.269 1.00 0.00 H new ATOM 0 HH12 ARG A 554 -6.757 -16.576 8.521 1.00 0.00 H new ATOM 0 HH21 ARG A 554 -6.283 -15.398 5.238 1.00 0.00 H new ATOM 0 HH22 ARG A 554 -6.576 -16.809 6.260 1.00 0.00 H new ATOM 724 N ALA A 555 -4.174 -8.127 10.634 1.00 0.00 N ATOM 725 CA ALA A 555 -4.555 -6.868 11.287 1.00 0.00 C ATOM 726 C ALA A 555 -4.724 -5.726 10.275 1.00 0.00 C ATOM 727 O ALA A 555 -5.631 -4.893 10.392 1.00 0.00 O ATOM 728 CB ALA A 555 -3.517 -6.486 12.348 1.00 0.00 C ATOM 0 H ALA A 555 -3.247 -8.466 10.892 1.00 0.00 H new ATOM 0 HA ALA A 555 -5.520 -7.027 11.768 1.00 0.00 H new ATOM 0 HB1 ALA A 555 -3.811 -5.551 12.825 1.00 0.00 H new ATOM 0 HB2 ALA A 555 -3.458 -7.273 13.099 1.00 0.00 H new ATOM 0 HB3 ALA A 555 -2.543 -6.362 11.876 1.00 0.00 H new ATOM 734 N ILE A 556 -3.873 -5.691 9.244 1.00 0.00 N ATOM 735 CA ILE A 556 -4.013 -4.728 8.158 1.00 0.00 C ATOM 736 C ILE A 556 -5.360 -5.002 7.458 1.00 0.00 C ATOM 737 O ILE A 556 -6.149 -4.069 7.260 1.00 0.00 O ATOM 738 CB ILE A 556 -2.760 -4.799 7.265 1.00 0.00 C ATOM 739 CG1 ILE A 556 -1.474 -4.522 8.077 1.00 0.00 C ATOM 740 CG2 ILE A 556 -2.776 -3.888 6.024 1.00 0.00 C ATOM 741 CD1 ILE A 556 -1.390 -3.198 8.853 1.00 0.00 C ATOM 0 H ILE A 556 -3.079 -6.323 9.143 1.00 0.00 H new ATOM 0 HA ILE A 556 -4.055 -3.693 8.496 1.00 0.00 H new ATOM 0 HB ILE A 556 -2.770 -5.823 6.890 1.00 0.00 H new ATOM 0 HG12 ILE A 556 -1.345 -5.337 8.789 1.00 0.00 H new ATOM 0 HG13 ILE A 556 -0.629 -4.562 7.390 1.00 0.00 H new ATOM 0 HG21 ILE A 556 -1.848 -4.016 5.467 1.00 0.00 H new ATOM 0 HG22 ILE A 556 -3.621 -4.154 5.388 1.00 0.00 H new ATOM 0 HG23 ILE A 556 -2.871 -2.848 6.337 1.00 0.00 H new ATOM 0 HD11 ILE A 556 -0.434 -3.142 9.374 1.00 0.00 H new ATOM 0 HD12 ILE A 556 -1.474 -2.363 8.158 1.00 0.00 H new ATOM 0 HD13 ILE A 556 -2.202 -3.149 9.579 1.00 0.00 H new ATOM 753 N MET A 557 -5.679 -6.278 7.188 1.00 0.00 N ATOM 754 CA MET A 557 -6.932 -6.662 6.535 1.00 0.00 C ATOM 755 C MET A 557 -8.129 -6.269 7.394 1.00 0.00 C ATOM 756 O MET A 557 -9.121 -5.752 6.876 1.00 0.00 O ATOM 757 CB MET A 557 -7.018 -8.171 6.243 1.00 0.00 C ATOM 758 CG MET A 557 -5.829 -8.815 5.524 1.00 0.00 C ATOM 759 SD MET A 557 -6.230 -9.416 3.873 1.00 0.00 S ATOM 760 CE MET A 557 -6.551 -7.829 3.104 1.00 0.00 C ATOM 0 H MET A 557 -5.075 -7.067 7.417 1.00 0.00 H new ATOM 0 HA MET A 557 -6.949 -6.128 5.585 1.00 0.00 H new ATOM 0 HB2 MET A 557 -7.161 -8.691 7.190 1.00 0.00 H new ATOM 0 HB3 MET A 557 -7.911 -8.349 5.644 1.00 0.00 H new ATOM 0 HG2 MET A 557 -5.021 -8.087 5.451 1.00 0.00 H new ATOM 0 HG3 MET A 557 -5.457 -9.645 6.124 1.00 0.00 H new ATOM 0 HE1 MET A 557 -7.625 -7.698 2.975 1.00 0.00 H new ATOM 0 HE2 MET A 557 -6.162 -7.032 3.738 1.00 0.00 H new ATOM 0 HE3 MET A 557 -6.061 -7.791 2.131 1.00 0.00 H new ATOM 770 N ALA A 558 -8.036 -6.466 8.711 1.00 0.00 N ATOM 771 CA ALA A 558 -9.077 -6.137 9.667 1.00 0.00 C ATOM 772 C ALA A 558 -9.422 -4.651 9.623 1.00 0.00 C ATOM 773 O ALA A 558 -10.559 -4.297 9.932 1.00 0.00 O ATOM 774 CB ALA A 558 -8.642 -6.544 11.075 1.00 0.00 C ATOM 0 H ALA A 558 -7.207 -6.871 9.147 1.00 0.00 H new ATOM 0 HA ALA A 558 -9.975 -6.693 9.397 1.00 0.00 H new ATOM 0 HB1 ALA A 558 -9.429 -6.293 11.786 1.00 0.00 H new ATOM 0 HB2 ALA A 558 -8.457 -7.618 11.102 1.00 0.00 H new ATOM 0 HB3 ALA A 558 -7.729 -6.011 11.342 1.00 0.00 H new ATOM 780 N THR A 559 -8.485 -3.793 9.214 1.00 0.00 N ATOM 781 CA THR A 559 -8.732 -2.376 8.998 1.00 0.00 C ATOM 782 C THR A 559 -9.384 -2.155 7.626 1.00 0.00 C ATOM 783 O THR A 559 -10.424 -1.493 7.546 1.00 0.00 O ATOM 784 CB THR A 559 -7.418 -1.591 9.157 1.00 0.00 C ATOM 785 OG1 THR A 559 -6.745 -1.999 10.336 1.00 0.00 O ATOM 786 CG2 THR A 559 -7.703 -0.088 9.279 1.00 0.00 C ATOM 0 H THR A 559 -7.523 -4.072 9.023 1.00 0.00 H new ATOM 0 HA THR A 559 -9.431 -2.003 9.747 1.00 0.00 H new ATOM 0 HB THR A 559 -6.804 -1.788 8.278 1.00 0.00 H new ATOM 0 HG1 THR A 559 -6.332 -2.876 10.190 1.00 0.00 H new ATOM 0 HG21 THR A 559 -6.763 0.453 9.391 1.00 0.00 H new ATOM 0 HG22 THR A 559 -8.217 0.259 8.382 1.00 0.00 H new ATOM 0 HG23 THR A 559 -8.332 0.094 10.151 1.00 0.00 H new ATOM 794 N ILE A 560 -8.801 -2.698 6.551 1.00 0.00 N ATOM 795 CA ILE A 560 -9.274 -2.491 5.182 1.00 0.00 C ATOM 796 C ILE A 560 -10.680 -3.064 5.023 1.00 0.00 C ATOM 797 O ILE A 560 -11.617 -2.308 4.774 1.00 0.00 O ATOM 798 CB ILE A 560 -8.277 -3.075 4.158 1.00 0.00 C ATOM 799 CG1 ILE A 560 -6.946 -2.302 4.212 1.00 0.00 C ATOM 800 CG2 ILE A 560 -8.833 -2.983 2.727 1.00 0.00 C ATOM 801 CD1 ILE A 560 -5.871 -2.904 3.300 1.00 0.00 C ATOM 0 H ILE A 560 -7.979 -3.299 6.610 1.00 0.00 H new ATOM 0 HA ILE A 560 -9.331 -1.421 4.981 1.00 0.00 H new ATOM 0 HB ILE A 560 -8.118 -4.122 4.417 1.00 0.00 H new ATOM 0 HG12 ILE A 560 -7.121 -1.265 3.924 1.00 0.00 H new ATOM 0 HG13 ILE A 560 -6.580 -2.290 5.239 1.00 0.00 H new ATOM 0 HG21 ILE A 560 -8.109 -3.402 2.028 1.00 0.00 H new ATOM 0 HG22 ILE A 560 -9.766 -3.543 2.662 1.00 0.00 H new ATOM 0 HG23 ILE A 560 -9.018 -1.939 2.475 1.00 0.00 H new ATOM 0 HD11 ILE A 560 -4.956 -2.317 3.380 1.00 0.00 H new ATOM 0 HD12 ILE A 560 -5.671 -3.932 3.603 1.00 0.00 H new ATOM 0 HD13 ILE A 560 -6.221 -2.891 2.268 1.00 0.00 H new ATOM 813 N GLN A 561 -10.863 -4.376 5.191 1.00 0.00 N ATOM 814 CA GLN A 561 -12.158 -5.008 4.960 1.00 0.00 C ATOM 815 C GLN A 561 -13.253 -4.389 5.861 1.00 0.00 C ATOM 816 O GLN A 561 -14.434 -4.444 5.526 1.00 0.00 O ATOM 817 CB GLN A 561 -12.092 -6.524 5.180 1.00 0.00 C ATOM 818 CG GLN A 561 -11.122 -7.349 4.308 1.00 0.00 C ATOM 819 CD GLN A 561 -11.381 -8.815 4.626 1.00 0.00 C ATOM 820 OE1 GLN A 561 -10.738 -9.406 5.489 1.00 0.00 O ATOM 821 NE2 GLN A 561 -12.316 -9.432 3.921 1.00 0.00 N ATOM 0 H GLN A 561 -10.128 -5.019 5.486 1.00 0.00 H new ATOM 0 HA GLN A 561 -12.420 -4.825 3.918 1.00 0.00 H new ATOM 0 HB2 GLN A 561 -11.830 -6.697 6.224 1.00 0.00 H new ATOM 0 HB3 GLN A 561 -13.095 -6.925 5.032 1.00 0.00 H new ATOM 0 HG2 GLN A 561 -11.288 -7.148 3.250 1.00 0.00 H new ATOM 0 HG3 GLN A 561 -10.087 -7.084 4.524 1.00 0.00 H new ATOM 0 HE21 GLN A 561 -12.838 -8.921 3.209 1.00 0.00 H new ATOM 0 HE22 GLN A 561 -12.515 -10.418 4.090 1.00 0.00 H new ATOM 830 N ARG A 562 -12.889 -3.782 7.003 1.00 0.00 N ATOM 831 CA ARG A 562 -13.799 -3.015 7.860 1.00 0.00 C ATOM 832 C ARG A 562 -14.184 -1.696 7.203 1.00 0.00 C ATOM 833 O ARG A 562 -15.368 -1.369 7.171 1.00 0.00 O ATOM 834 CB ARG A 562 -13.158 -2.827 9.248 1.00 0.00 C ATOM 835 CG ARG A 562 -13.907 -1.958 10.272 1.00 0.00 C ATOM 836 CD ARG A 562 -13.691 -0.441 10.092 1.00 0.00 C ATOM 837 NE ARG A 562 -14.042 0.317 11.304 1.00 0.00 N ATOM 838 CZ ARG A 562 -15.269 0.513 11.803 1.00 0.00 C ATOM 839 NH1 ARG A 562 -16.348 0.058 11.175 1.00 0.00 N ATOM 840 NH2 ARG A 562 -15.401 1.154 12.954 1.00 0.00 N ATOM 0 H ARG A 562 -11.934 -3.813 7.360 1.00 0.00 H new ATOM 0 HA ARG A 562 -14.729 -3.567 7.996 1.00 0.00 H new ATOM 0 HB2 ARG A 562 -13.015 -3.814 9.687 1.00 0.00 H new ATOM 0 HB3 ARG A 562 -12.167 -2.396 9.104 1.00 0.00 H new ATOM 0 HG2 ARG A 562 -14.973 -2.173 10.203 1.00 0.00 H new ATOM 0 HG3 ARG A 562 -13.589 -2.242 11.275 1.00 0.00 H new ATOM 0 HD2 ARG A 562 -12.649 -0.252 9.836 1.00 0.00 H new ATOM 0 HD3 ARG A 562 -14.294 -0.086 9.256 1.00 0.00 H new ATOM 0 HE ARG A 562 -13.268 0.738 11.818 1.00 0.00 H new ATOM 0 HH11 ARG A 562 -16.250 -0.451 10.296 1.00 0.00 H new ATOM 0 HH12 ARG A 562 -17.274 0.218 11.572 1.00 0.00 H new ATOM 0 HH21 ARG A 562 -14.575 1.491 13.448 1.00 0.00 H new ATOM 0 HH22 ARG A 562 -16.329 1.311 13.347 1.00 0.00 H new ATOM 854 N LYS A 563 -13.210 -0.910 6.734 1.00 0.00 N ATOM 855 CA LYS A 563 -13.452 0.364 6.055 1.00 0.00 C ATOM 856 C LYS A 563 -14.416 0.149 4.886 1.00 0.00 C ATOM 857 O LYS A 563 -15.344 0.935 4.685 1.00 0.00 O ATOM 858 CB LYS A 563 -12.111 0.915 5.531 1.00 0.00 C ATOM 859 CG LYS A 563 -12.221 2.294 4.860 1.00 0.00 C ATOM 860 CD LYS A 563 -11.702 3.488 5.665 1.00 0.00 C ATOM 861 CE LYS A 563 -11.383 4.665 4.724 1.00 0.00 C ATOM 862 NZ LYS A 563 -12.568 5.231 4.044 1.00 0.00 N ATOM 0 H LYS A 563 -12.221 -1.144 6.817 1.00 0.00 H new ATOM 0 HA LYS A 563 -13.894 1.076 6.752 1.00 0.00 H new ATOM 0 HB2 LYS A 563 -11.408 0.981 6.361 1.00 0.00 H new ATOM 0 HB3 LYS A 563 -11.693 0.206 4.816 1.00 0.00 H new ATOM 0 HG2 LYS A 563 -11.679 2.258 3.915 1.00 0.00 H new ATOM 0 HG3 LYS A 563 -13.269 2.474 4.620 1.00 0.00 H new ATOM 0 HD2 LYS A 563 -12.447 3.792 6.400 1.00 0.00 H new ATOM 0 HD3 LYS A 563 -10.807 3.202 6.218 1.00 0.00 H new ATOM 0 HE2 LYS A 563 -10.895 5.453 5.298 1.00 0.00 H new ATOM 0 HE3 LYS A 563 -10.670 4.331 3.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 563 -12.273 6.017 3.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 563 -13.023 4.494 3.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 563 -13.242 5.581 4.755 1.00 0.00 H new ATOM 876 N TYR A 564 -14.160 -0.883 4.089 1.00 0.00 N ATOM 877 CA TYR A 564 -14.812 -1.124 2.819 1.00 0.00 C ATOM 878 C TYR A 564 -15.615 -2.421 2.950 1.00 0.00 C ATOM 879 O TYR A 564 -15.108 -3.493 2.623 1.00 0.00 O ATOM 880 CB TYR A 564 -13.737 -1.210 1.724 1.00 0.00 C ATOM 881 CG TYR A 564 -12.721 -0.079 1.619 1.00 0.00 C ATOM 882 CD1 TYR A 564 -13.008 1.027 0.805 1.00 0.00 C ATOM 883 CD2 TYR A 564 -11.454 -0.165 2.240 1.00 0.00 C ATOM 884 CE1 TYR A 564 -12.074 2.062 0.650 1.00 0.00 C ATOM 885 CE2 TYR A 564 -10.493 0.851 2.084 1.00 0.00 C ATOM 886 CZ TYR A 564 -10.835 2.004 1.332 1.00 0.00 C ATOM 887 OH TYR A 564 -10.000 3.074 1.341 1.00 0.00 O ATOM 0 H TYR A 564 -13.468 -1.595 4.323 1.00 0.00 H new ATOM 0 HA TYR A 564 -15.495 -0.320 2.546 1.00 0.00 H new ATOM 0 HB2 TYR A 564 -13.186 -2.139 1.871 1.00 0.00 H new ATOM 0 HB3 TYR A 564 -14.246 -1.290 0.764 1.00 0.00 H new ATOM 0 HD1 TYR A 564 -13.957 1.082 0.293 1.00 0.00 H new ATOM 0 HD2 TYR A 564 -11.219 -1.027 2.846 1.00 0.00 H new ATOM 0 HE1 TYR A 564 -12.300 2.903 0.011 1.00 0.00 H new ATOM 0 HE2 TYR A 564 -9.513 0.755 2.529 1.00 0.00 H new ATOM 0 HH TYR A 564 -10.389 3.788 1.888 1.00 0.00 H new ATOM 897 N LYS A 565 -16.827 -2.373 3.515 1.00 0.00 N ATOM 898 CA LYS A 565 -17.593 -3.579 3.795 1.00 0.00 C ATOM 899 C LYS A 565 -17.979 -4.321 2.510 1.00 0.00 C ATOM 900 O LYS A 565 -17.990 -3.738 1.430 1.00 0.00 O ATOM 901 CB LYS A 565 -18.770 -3.229 4.707 1.00 0.00 C ATOM 902 CG LYS A 565 -19.999 -2.762 3.928 1.00 0.00 C ATOM 903 CD LYS A 565 -21.239 -2.549 4.807 1.00 0.00 C ATOM 904 CE LYS A 565 -21.754 -3.903 5.321 1.00 0.00 C ATOM 905 NZ LYS A 565 -22.973 -3.776 6.144 1.00 0.00 N ATOM 0 H LYS A 565 -17.294 -1.507 3.785 1.00 0.00 H new ATOM 0 HA LYS A 565 -16.975 -4.295 4.337 1.00 0.00 H new ATOM 0 HB2 LYS A 565 -19.033 -4.101 5.305 1.00 0.00 H new ATOM 0 HB3 LYS A 565 -18.466 -2.446 5.402 1.00 0.00 H new ATOM 0 HG2 LYS A 565 -19.762 -1.829 3.417 1.00 0.00 H new ATOM 0 HG3 LYS A 565 -20.232 -3.497 3.158 1.00 0.00 H new ATOM 0 HD2 LYS A 565 -20.993 -1.901 5.648 1.00 0.00 H new ATOM 0 HD3 LYS A 565 -22.019 -2.047 4.235 1.00 0.00 H new ATOM 0 HE2 LYS A 565 -21.961 -4.554 4.472 1.00 0.00 H new ATOM 0 HE3 LYS A 565 -20.973 -4.384 5.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 565 -23.276 -4.718 6.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 565 -22.773 -3.178 6.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 565 -23.730 -3.342 5.578 1.00 0.00 H new ATOM 919 N GLY A 566 -18.370 -5.588 2.626 1.00 0.00 N ATOM 920 CA GLY A 566 -18.845 -6.408 1.515 1.00 0.00 C ATOM 921 C GLY A 566 -17.748 -7.305 0.950 1.00 0.00 C ATOM 922 O GLY A 566 -18.032 -8.426 0.525 1.00 0.00 O ATOM 0 H GLY A 566 -18.365 -6.085 3.517 1.00 0.00 H new ATOM 0 HA2 GLY A 566 -19.679 -7.024 1.851 1.00 0.00 H new ATOM 0 HA3 GLY A 566 -19.226 -5.761 0.725 1.00 0.00 H new ATOM 926 N ILE A 567 -16.504 -6.837 0.995 1.00 0.00 N ATOM 927 CA ILE A 567 -15.320 -7.525 0.507 1.00 0.00 C ATOM 928 C ILE A 567 -14.995 -8.745 1.368 1.00 0.00 C ATOM 929 O ILE A 567 -15.180 -8.708 2.590 1.00 0.00 O ATOM 930 CB ILE A 567 -14.186 -6.484 0.519 1.00 0.00 C ATOM 931 CG1 ILE A 567 -12.990 -6.935 -0.316 1.00 0.00 C ATOM 932 CG2 ILE A 567 -13.738 -6.113 1.936 1.00 0.00 C ATOM 933 CD1 ILE A 567 -11.804 -5.973 -0.234 1.00 0.00 C ATOM 0 H ILE A 567 -16.287 -5.923 1.393 1.00 0.00 H new ATOM 0 HA ILE A 567 -15.470 -7.915 -0.500 1.00 0.00 H new ATOM 0 HB ILE A 567 -14.603 -5.586 0.063 1.00 0.00 H new ATOM 0 HG12 ILE A 567 -12.673 -7.923 0.018 1.00 0.00 H new ATOM 0 HG13 ILE A 567 -13.298 -7.035 -1.357 1.00 0.00 H new ATOM 0 HG21 ILE A 567 -12.937 -5.376 1.883 1.00 0.00 H new ATOM 0 HG22 ILE A 567 -14.581 -5.694 2.486 1.00 0.00 H new ATOM 0 HG23 ILE A 567 -13.377 -7.005 2.449 1.00 0.00 H new ATOM 0 HD11 ILE A 567 -10.987 -6.350 -0.849 1.00 0.00 H new ATOM 0 HD12 ILE A 567 -12.107 -4.990 -0.596 1.00 0.00 H new ATOM 0 HD13 ILE A 567 -11.472 -5.892 0.801 1.00 0.00 H new ATOM 945 N LYS A 568 -14.424 -9.801 0.781 1.00 0.00 N ATOM 946 CA LYS A 568 -14.153 -11.026 1.528 1.00 0.00 C ATOM 947 C LYS A 568 -12.893 -11.764 1.053 1.00 0.00 C ATOM 948 O LYS A 568 -12.865 -12.990 1.010 1.00 0.00 O ATOM 949 CB LYS A 568 -15.435 -11.873 1.514 1.00 0.00 C ATOM 950 CG LYS A 568 -15.534 -12.594 2.861 1.00 0.00 C ATOM 951 CD LYS A 568 -16.698 -13.583 2.938 1.00 0.00 C ATOM 952 CE LYS A 568 -16.264 -14.982 2.492 1.00 0.00 C ATOM 953 NZ LYS A 568 -15.345 -15.619 3.460 1.00 0.00 N ATOM 0 H LYS A 568 -14.144 -9.830 -0.199 1.00 0.00 H new ATOM 0 HA LYS A 568 -13.905 -10.786 2.562 1.00 0.00 H new ATOM 0 HB2 LYS A 568 -16.309 -11.241 1.354 1.00 0.00 H new ATOM 0 HB3 LYS A 568 -15.408 -12.593 0.696 1.00 0.00 H new ATOM 0 HG2 LYS A 568 -14.602 -13.127 3.049 1.00 0.00 H new ATOM 0 HG3 LYS A 568 -15.643 -11.854 3.654 1.00 0.00 H new ATOM 0 HD2 LYS A 568 -17.077 -13.625 3.959 1.00 0.00 H new ATOM 0 HD3 LYS A 568 -17.517 -13.235 2.308 1.00 0.00 H new ATOM 0 HE2 LYS A 568 -17.146 -15.610 2.364 1.00 0.00 H new ATOM 0 HE3 LYS A 568 -15.776 -14.916 1.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 -15.357 -16.650 3.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 -14.380 -15.261 3.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 -15.651 -15.395 4.428 1.00 0.00 H new ATOM 967 N ILE A 569 -11.825 -10.992 0.828 1.00 0.00 N ATOM 968 CA ILE A 569 -10.492 -11.357 0.335 1.00 0.00 C ATOM 969 C ILE A 569 -10.532 -12.075 -1.020 1.00 0.00 C ATOM 970 O ILE A 569 -11.431 -12.855 -1.335 1.00 0.00 O ATOM 971 CB ILE A 569 -9.631 -12.033 1.425 1.00 0.00 C ATOM 972 CG1 ILE A 569 -9.608 -11.217 2.737 1.00 0.00 C ATOM 973 CG2 ILE A 569 -8.168 -12.217 0.966 1.00 0.00 C ATOM 974 CD1 ILE A 569 -9.301 -9.722 2.532 1.00 0.00 C ATOM 0 H ILE A 569 -11.879 -9.989 1.006 1.00 0.00 H new ATOM 0 HA ILE A 569 -9.961 -10.432 0.112 1.00 0.00 H new ATOM 0 HB ILE A 569 -10.095 -13.003 1.601 1.00 0.00 H new ATOM 0 HG12 ILE A 569 -10.574 -11.316 3.233 1.00 0.00 H new ATOM 0 HG13 ILE A 569 -8.861 -11.644 3.407 1.00 0.00 H new ATOM 0 HG21 ILE A 569 -7.595 -12.696 1.760 1.00 0.00 H new ATOM 0 HG22 ILE A 569 -8.143 -12.842 0.073 1.00 0.00 H new ATOM 0 HG23 ILE A 569 -7.732 -11.244 0.740 1.00 0.00 H new ATOM 0 HD11 ILE A 569 -9.302 -9.215 3.497 1.00 0.00 H new ATOM 0 HD12 ILE A 569 -8.322 -9.612 2.065 1.00 0.00 H new ATOM 0 HD13 ILE A 569 -10.061 -9.279 1.889 1.00 0.00 H new ATOM 986 N GLN A 570 -9.595 -11.665 -1.874 1.00 0.00 N ATOM 987 CA GLN A 570 -9.502 -11.989 -3.285 1.00 0.00 C ATOM 988 C GLN A 570 -8.011 -11.907 -3.647 1.00 0.00 C ATOM 989 O GLN A 570 -7.223 -11.456 -2.816 1.00 0.00 O ATOM 990 CB GLN A 570 -10.336 -10.999 -4.134 1.00 0.00 C ATOM 991 CG GLN A 570 -11.535 -10.277 -3.469 1.00 0.00 C ATOM 992 CD GLN A 570 -11.220 -8.910 -2.863 1.00 0.00 C ATOM 993 OE1 GLN A 570 -10.938 -8.724 -1.569 1.00 0.00 O flip ATOM 994 NE2 GLN A 570 -11.282 -7.928 -3.581 1.00 0.00 N flip ATOM 0 H GLN A 570 -8.833 -11.058 -1.572 1.00 0.00 H new ATOM 0 HA GLN A 570 -9.901 -12.983 -3.490 1.00 0.00 H new ATOM 0 HB2 GLN A 570 -9.657 -10.234 -4.512 1.00 0.00 H new ATOM 0 HB3 GLN A 570 -10.716 -11.543 -4.999 1.00 0.00 H new ATOM 0 HG2 GLN A 570 -12.322 -10.154 -4.213 1.00 0.00 H new ATOM 0 HG3 GLN A 570 -11.936 -10.920 -2.685 1.00 0.00 H new ATOM 0 HE21 GLN A 570 -11.495 -8.034 -4.573 1.00 0.00 H new ATOM 0 HE22 GLN A 570 -11.121 -7.000 -3.190 1.00 0.00 H new ATOM 1003 N GLU A 571 -7.606 -12.260 -4.863 1.00 0.00 N ATOM 1004 CA GLU A 571 -6.234 -12.082 -5.337 1.00 0.00 C ATOM 1005 C GLU A 571 -6.257 -11.339 -6.672 1.00 0.00 C ATOM 1006 O GLU A 571 -7.275 -11.338 -7.374 1.00 0.00 O ATOM 1007 CB GLU A 571 -5.556 -13.451 -5.482 1.00 0.00 C ATOM 1008 CG GLU A 571 -4.037 -13.419 -5.237 1.00 0.00 C ATOM 1009 CD GLU A 571 -3.351 -14.639 -5.857 1.00 0.00 C ATOM 1010 OE1 GLU A 571 -3.851 -15.776 -5.697 1.00 0.00 O ATOM 1011 OE2 GLU A 571 -2.280 -14.479 -6.475 1.00 0.00 O ATOM 0 H GLU A 571 -8.225 -12.682 -5.555 1.00 0.00 H new ATOM 0 HA GLU A 571 -5.664 -11.493 -4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 571 -6.013 -14.149 -4.781 1.00 0.00 H new ATOM 0 HB3 GLU A 571 -5.745 -13.836 -6.484 1.00 0.00 H new ATOM 0 HG2 GLU A 571 -3.617 -12.507 -5.661 1.00 0.00 H new ATOM 0 HG3 GLU A 571 -3.839 -13.393 -4.165 1.00 0.00 H new ATOM 1018 N GLY A 572 -5.124 -10.750 -7.050 1.00 0.00 N ATOM 1019 CA GLY A 572 -5.036 -9.812 -8.168 1.00 0.00 C ATOM 1020 C GLY A 572 -5.056 -8.397 -7.646 1.00 0.00 C ATOM 1021 O GLY A 572 -4.821 -8.137 -6.456 1.00 0.00 O ATOM 0 H GLY A 572 -4.231 -10.912 -6.584 1.00 0.00 H new ATOM 0 HA2 GLY A 572 -4.121 -9.989 -8.733 1.00 0.00 H new ATOM 0 HA3 GLY A 572 -5.869 -9.969 -8.854 1.00 0.00 H new ATOM 1025 N ILE A 573 -5.243 -7.469 -8.573 1.00 0.00 N ATOM 1026 CA ILE A 573 -5.603 -6.111 -8.251 1.00 0.00 C ATOM 1027 C ILE A 573 -7.003 -6.177 -7.649 1.00 0.00 C ATOM 1028 O ILE A 573 -7.942 -6.650 -8.294 1.00 0.00 O ATOM 1029 CB ILE A 573 -5.479 -5.250 -9.517 1.00 0.00 C ATOM 1030 CG1 ILE A 573 -3.991 -5.300 -9.931 1.00 0.00 C ATOM 1031 CG2 ILE A 573 -6.034 -3.836 -9.270 1.00 0.00 C ATOM 1032 CD1 ILE A 573 -3.561 -4.321 -11.015 1.00 0.00 C ATOM 0 H ILE A 573 -5.147 -7.646 -9.573 1.00 0.00 H new ATOM 0 HA ILE A 573 -4.947 -5.636 -7.522 1.00 0.00 H new ATOM 0 HB ILE A 573 -6.081 -5.626 -10.344 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -3.383 -5.119 -9.045 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -3.764 -6.310 -10.272 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -5.936 -3.243 -10.179 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -7.086 -3.902 -8.991 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -5.474 -3.361 -8.465 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -2.498 -4.449 -11.221 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -4.132 -4.511 -11.924 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -3.745 -3.301 -10.678 1.00 0.00 H new ATOM 1044 N VAL A 574 -7.125 -5.746 -6.401 1.00 0.00 N ATOM 1045 CA VAL A 574 -8.361 -5.730 -5.653 1.00 0.00 C ATOM 1046 C VAL A 574 -8.944 -4.332 -5.781 1.00 0.00 C ATOM 1047 O VAL A 574 -8.621 -3.407 -5.037 1.00 0.00 O ATOM 1048 CB VAL A 574 -8.115 -6.258 -4.219 1.00 0.00 C ATOM 1049 CG1 VAL A 574 -9.136 -5.764 -3.187 1.00 0.00 C ATOM 1050 CG2 VAL A 574 -8.084 -7.793 -4.245 1.00 0.00 C ATOM 0 H VAL A 574 -6.333 -5.386 -5.868 1.00 0.00 H new ATOM 0 HA VAL A 574 -9.118 -6.411 -6.042 1.00 0.00 H new ATOM 0 HB VAL A 574 -7.154 -5.856 -3.896 1.00 0.00 H new ATOM 0 HG11 VAL A 574 -8.894 -6.179 -2.208 1.00 0.00 H new ATOM 0 HG12 VAL A 574 -9.106 -4.676 -3.138 1.00 0.00 H new ATOM 0 HG13 VAL A 574 -10.135 -6.086 -3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 574 -7.911 -8.171 -3.237 1.00 0.00 H new ATOM 0 HG22 VAL A 574 -9.037 -8.170 -4.615 1.00 0.00 H new ATOM 0 HG23 VAL A 574 -7.281 -8.130 -4.901 1.00 0.00 H new ATOM 1060 N ASP A 575 -9.800 -4.181 -6.782 1.00 0.00 N ATOM 1061 CA ASP A 575 -10.684 -3.043 -6.917 1.00 0.00 C ATOM 1062 C ASP A 575 -11.780 -3.161 -5.869 1.00 0.00 C ATOM 1063 O ASP A 575 -12.782 -3.856 -6.077 1.00 0.00 O ATOM 1064 CB ASP A 575 -11.268 -3.019 -8.324 1.00 0.00 C ATOM 1065 CG ASP A 575 -12.388 -1.984 -8.497 1.00 0.00 C ATOM 1066 OD1 ASP A 575 -12.403 -0.956 -7.779 1.00 0.00 O ATOM 1067 OD2 ASP A 575 -13.210 -2.196 -9.429 1.00 0.00 O ATOM 0 H ASP A 575 -9.897 -4.862 -7.535 1.00 0.00 H new ATOM 0 HA ASP A 575 -10.142 -2.110 -6.762 1.00 0.00 H new ATOM 0 HB2 ASP A 575 -10.472 -2.806 -9.037 1.00 0.00 H new ATOM 0 HB3 ASP A 575 -11.656 -4.008 -8.566 1.00 0.00 H new ATOM 1072 N TYR A 576 -11.567 -2.532 -4.714 1.00 0.00 N ATOM 1073 CA TYR A 576 -12.572 -2.477 -3.675 1.00 0.00 C ATOM 1074 C TYR A 576 -12.409 -1.172 -2.898 1.00 0.00 C ATOM 1075 O TYR A 576 -11.629 -1.089 -1.945 1.00 0.00 O ATOM 1076 CB TYR A 576 -12.536 -3.759 -2.823 1.00 0.00 C ATOM 1077 CG TYR A 576 -13.908 -4.071 -2.281 1.00 0.00 C ATOM 1078 CD1 TYR A 576 -14.428 -3.294 -1.236 1.00 0.00 C ATOM 1079 CD2 TYR A 576 -14.700 -5.062 -2.885 1.00 0.00 C ATOM 1080 CE1 TYR A 576 -15.762 -3.458 -0.827 1.00 0.00 C ATOM 1081 CE2 TYR A 576 -16.027 -5.254 -2.468 1.00 0.00 C ATOM 1082 CZ TYR A 576 -16.567 -4.439 -1.452 1.00 0.00 C ATOM 1083 OH TYR A 576 -17.864 -4.590 -1.088 1.00 0.00 O ATOM 0 H TYR A 576 -10.697 -2.052 -4.481 1.00 0.00 H new ATOM 0 HA TYR A 576 -13.578 -2.457 -4.094 1.00 0.00 H new ATOM 0 HB2 TYR A 576 -12.178 -4.594 -3.426 1.00 0.00 H new ATOM 0 HB3 TYR A 576 -11.832 -3.636 -2.000 1.00 0.00 H new ATOM 0 HD1 TYR A 576 -13.800 -2.566 -0.743 1.00 0.00 H new ATOM 0 HD2 TYR A 576 -14.288 -5.677 -3.671 1.00 0.00 H new ATOM 0 HE1 TYR A 576 -16.170 -2.840 -0.041 1.00 0.00 H new ATOM 0 HE2 TYR A 576 -16.632 -6.024 -2.924 1.00 0.00 H new ATOM 0 HH TYR A 576 -18.035 -4.083 -0.267 1.00 0.00 H new ATOM 1093 N GLY A 577 -13.116 -0.124 -3.328 1.00 0.00 N ATOM 1094 CA GLY A 577 -12.898 1.236 -2.874 1.00 0.00 C ATOM 1095 C GLY A 577 -11.647 1.727 -3.574 1.00 0.00 C ATOM 1096 O GLY A 577 -11.677 2.134 -4.738 1.00 0.00 O ATOM 0 H GLY A 577 -13.867 -0.207 -4.013 1.00 0.00 H new ATOM 0 HA2 GLY A 577 -13.752 1.868 -3.117 1.00 0.00 H new ATOM 0 HA3 GLY A 577 -12.775 1.269 -1.791 1.00 0.00 H new ATOM 1100 N VAL A 578 -10.542 1.581 -2.859 1.00 0.00 N ATOM 1101 CA VAL A 578 -9.181 1.759 -3.335 1.00 0.00 C ATOM 1102 C VAL A 578 -8.827 0.595 -4.260 1.00 0.00 C ATOM 1103 O VAL A 578 -9.506 -0.436 -4.311 1.00 0.00 O ATOM 1104 CB VAL A 578 -8.283 1.888 -2.083 1.00 0.00 C ATOM 1105 CG1 VAL A 578 -6.780 1.705 -2.299 1.00 0.00 C ATOM 1106 CG2 VAL A 578 -8.496 3.259 -1.442 1.00 0.00 C ATOM 0 H VAL A 578 -10.575 1.320 -1.874 1.00 0.00 H new ATOM 0 HA VAL A 578 -9.041 2.659 -3.933 1.00 0.00 H new ATOM 0 HB VAL A 578 -8.597 1.059 -1.448 1.00 0.00 H new ATOM 0 HG11 VAL A 578 -6.259 1.819 -1.348 1.00 0.00 H new ATOM 0 HG12 VAL A 578 -6.589 0.710 -2.701 1.00 0.00 H new ATOM 0 HG13 VAL A 578 -6.419 2.456 -3.002 1.00 0.00 H new ATOM 0 HG21 VAL A 578 -7.863 3.350 -0.559 1.00 0.00 H new ATOM 0 HG22 VAL A 578 -8.236 4.039 -2.157 1.00 0.00 H new ATOM 0 HG23 VAL A 578 -9.541 3.367 -1.152 1.00 0.00 H new ATOM 1116 N ARG A 579 -7.780 0.795 -5.052 1.00 0.00 N ATOM 1117 CA ARG A 579 -7.280 -0.132 -6.045 1.00 0.00 C ATOM 1118 C ARG A 579 -6.096 -0.872 -5.446 1.00 0.00 C ATOM 1119 O ARG A 579 -4.943 -0.497 -5.648 1.00 0.00 O ATOM 1120 CB ARG A 579 -6.949 0.704 -7.282 1.00 0.00 C ATOM 1121 CG ARG A 579 -6.488 -0.151 -8.459 1.00 0.00 C ATOM 1122 CD ARG A 579 -6.491 0.693 -9.730 1.00 0.00 C ATOM 1123 NE ARG A 579 -6.092 -0.125 -10.875 1.00 0.00 N ATOM 1124 CZ ARG A 579 -5.064 0.093 -11.695 1.00 0.00 C ATOM 1125 NH1 ARG A 579 -4.349 1.211 -11.657 1.00 0.00 N ATOM 1126 NH2 ARG A 579 -4.726 -0.854 -12.556 1.00 0.00 N ATOM 0 H ARG A 579 -7.233 1.655 -5.012 1.00 0.00 H new ATOM 0 HA ARG A 579 -7.994 -0.900 -6.343 1.00 0.00 H new ATOM 0 HB2 ARG A 579 -7.829 1.277 -7.576 1.00 0.00 H new ATOM 0 HB3 ARG A 579 -6.169 1.423 -7.032 1.00 0.00 H new ATOM 0 HG2 ARG A 579 -5.488 -0.540 -8.270 1.00 0.00 H new ATOM 0 HG3 ARG A 579 -7.147 -1.011 -8.579 1.00 0.00 H new ATOM 0 HD2 ARG A 579 -7.485 1.108 -9.898 1.00 0.00 H new ATOM 0 HD3 ARG A 579 -5.808 1.535 -9.619 1.00 0.00 H new ATOM 0 HE ARG A 579 -6.661 -0.950 -11.066 1.00 0.00 H new ATOM 0 HH11 ARG A 579 -4.579 1.941 -10.983 1.00 0.00 H new ATOM 0 HH12 ARG A 579 -3.569 1.340 -12.302 1.00 0.00 H new ATOM 0 HH21 ARG A 579 -5.249 -1.729 -12.583 1.00 0.00 H new ATOM 0 HH22 ARG A 579 -3.943 -0.708 -13.193 1.00 0.00 H new ATOM 1140 N PHE A 580 -6.358 -1.870 -4.617 1.00 0.00 N ATOM 1141 CA PHE A 580 -5.301 -2.612 -3.958 1.00 0.00 C ATOM 1142 C PHE A 580 -4.631 -3.604 -4.921 1.00 0.00 C ATOM 1143 O PHE A 580 -5.107 -3.817 -6.030 1.00 0.00 O ATOM 1144 CB PHE A 580 -5.863 -3.296 -2.712 1.00 0.00 C ATOM 1145 CG PHE A 580 -6.397 -2.342 -1.661 1.00 0.00 C ATOM 1146 CD1 PHE A 580 -5.511 -1.738 -0.754 1.00 0.00 C ATOM 1147 CD2 PHE A 580 -7.770 -2.047 -1.585 1.00 0.00 C ATOM 1148 CE1 PHE A 580 -5.981 -0.910 0.274 1.00 0.00 C ATOM 1149 CE2 PHE A 580 -8.243 -1.206 -0.564 1.00 0.00 C ATOM 1150 CZ PHE A 580 -7.356 -0.645 0.371 1.00 0.00 C ATOM 0 H PHE A 580 -7.300 -2.184 -4.385 1.00 0.00 H new ATOM 0 HA PHE A 580 -4.518 -1.923 -3.642 1.00 0.00 H new ATOM 0 HB2 PHE A 580 -6.664 -3.971 -3.013 1.00 0.00 H new ATOM 0 HB3 PHE A 580 -5.081 -3.909 -2.265 1.00 0.00 H new ATOM 0 HD1 PHE A 580 -4.450 -1.915 -0.850 1.00 0.00 H new ATOM 0 HD2 PHE A 580 -8.456 -2.464 -2.307 1.00 0.00 H new ATOM 0 HE1 PHE A 580 -5.292 -0.480 0.985 1.00 0.00 H new ATOM 0 HE2 PHE A 580 -9.299 -0.988 -0.497 1.00 0.00 H new ATOM 0 HZ PHE A 580 -7.731 -0.012 1.162 1.00 0.00 H new ATOM 1160 N PHE A 581 -3.554 -4.262 -4.487 1.00 0.00 N ATOM 1161 CA PHE A 581 -2.897 -5.376 -5.171 1.00 0.00 C ATOM 1162 C PHE A 581 -2.507 -6.397 -4.104 1.00 0.00 C ATOM 1163 O PHE A 581 -1.632 -6.107 -3.289 1.00 0.00 O ATOM 1164 CB PHE A 581 -1.695 -4.907 -5.999 1.00 0.00 C ATOM 1165 CG PHE A 581 -0.762 -6.001 -6.493 1.00 0.00 C ATOM 1166 CD1 PHE A 581 -1.014 -6.662 -7.709 1.00 0.00 C ATOM 1167 CD2 PHE A 581 0.399 -6.323 -5.765 1.00 0.00 C ATOM 1168 CE1 PHE A 581 -0.091 -7.591 -8.214 1.00 0.00 C ATOM 1169 CE2 PHE A 581 1.335 -7.238 -6.277 1.00 0.00 C ATOM 1170 CZ PHE A 581 1.091 -7.863 -7.508 1.00 0.00 C ATOM 0 H PHE A 581 -3.096 -4.021 -3.608 1.00 0.00 H new ATOM 0 HA PHE A 581 -3.575 -5.834 -5.890 1.00 0.00 H new ATOM 0 HB2 PHE A 581 -2.066 -4.355 -6.863 1.00 0.00 H new ATOM 0 HB3 PHE A 581 -1.116 -4.206 -5.398 1.00 0.00 H new ATOM 0 HD1 PHE A 581 -1.921 -6.454 -8.256 1.00 0.00 H new ATOM 0 HD2 PHE A 581 0.572 -5.862 -4.804 1.00 0.00 H new ATOM 0 HE1 PHE A 581 -0.291 -8.097 -9.147 1.00 0.00 H new ATOM 0 HE2 PHE A 581 2.237 -7.458 -5.725 1.00 0.00 H new ATOM 0 HZ PHE A 581 1.814 -8.555 -7.914 1.00 0.00 H new ATOM 1180 N PHE A 582 -3.197 -7.536 -4.042 1.00 0.00 N ATOM 1181 CA PHE A 582 -3.056 -8.524 -2.973 1.00 0.00 C ATOM 1182 C PHE A 582 -2.119 -9.655 -3.402 1.00 0.00 C ATOM 1183 O PHE A 582 -2.513 -10.511 -4.195 1.00 0.00 O ATOM 1184 CB PHE A 582 -4.441 -9.045 -2.561 1.00 0.00 C ATOM 1185 CG PHE A 582 -5.298 -8.124 -1.704 1.00 0.00 C ATOM 1186 CD1 PHE A 582 -4.913 -6.805 -1.387 1.00 0.00 C ATOM 1187 CD2 PHE A 582 -6.506 -8.621 -1.187 1.00 0.00 C ATOM 1188 CE1 PHE A 582 -5.697 -6.021 -0.524 1.00 0.00 C ATOM 1189 CE2 PHE A 582 -7.315 -7.823 -0.363 1.00 0.00 C ATOM 1190 CZ PHE A 582 -6.888 -6.536 0.002 1.00 0.00 C ATOM 0 H PHE A 582 -3.883 -7.803 -4.748 1.00 0.00 H new ATOM 0 HA PHE A 582 -2.604 -8.051 -2.101 1.00 0.00 H new ATOM 0 HB2 PHE A 582 -4.998 -9.280 -3.468 1.00 0.00 H new ATOM 0 HB3 PHE A 582 -4.304 -9.981 -2.020 1.00 0.00 H new ATOM 0 HD1 PHE A 582 -4.009 -6.394 -1.811 1.00 0.00 H new ATOM 0 HD2 PHE A 582 -6.815 -9.628 -1.426 1.00 0.00 H new ATOM 0 HE1 PHE A 582 -5.381 -5.021 -0.266 1.00 0.00 H new ATOM 0 HE2 PHE A 582 -8.264 -8.198 -0.010 1.00 0.00 H new ATOM 0 HZ PHE A 582 -7.477 -5.945 0.687 1.00 0.00 H new ATOM 1200 N TYR A 583 -0.890 -9.663 -2.888 1.00 0.00 N ATOM 1201 CA TYR A 583 0.185 -10.576 -3.273 1.00 0.00 C ATOM 1202 C TYR A 583 0.479 -11.601 -2.178 1.00 0.00 C ATOM 1203 O TYR A 583 0.338 -11.329 -0.979 1.00 0.00 O ATOM 1204 CB TYR A 583 1.457 -9.801 -3.640 1.00 0.00 C ATOM 1205 CG TYR A 583 2.053 -8.964 -2.521 1.00 0.00 C ATOM 1206 CD1 TYR A 583 2.954 -9.539 -1.605 1.00 0.00 C ATOM 1207 CD2 TYR A 583 1.673 -7.618 -2.372 1.00 0.00 C ATOM 1208 CE1 TYR A 583 3.462 -8.777 -0.540 1.00 0.00 C ATOM 1209 CE2 TYR A 583 2.188 -6.845 -1.318 1.00 0.00 C ATOM 1210 CZ TYR A 583 3.082 -7.422 -0.393 1.00 0.00 C ATOM 1211 OH TYR A 583 3.535 -6.686 0.662 1.00 0.00 O ATOM 0 H TYR A 583 -0.604 -9.006 -2.162 1.00 0.00 H new ATOM 0 HA TYR A 583 -0.155 -11.122 -4.153 1.00 0.00 H new ATOM 0 HB2 TYR A 583 2.210 -10.512 -3.980 1.00 0.00 H new ATOM 0 HB3 TYR A 583 1.233 -9.146 -4.482 1.00 0.00 H new ATOM 0 HD1 TYR A 583 3.256 -10.569 -1.721 1.00 0.00 H new ATOM 0 HD2 TYR A 583 0.980 -7.176 -3.073 1.00 0.00 H new ATOM 0 HE1 TYR A 583 4.143 -9.226 0.167 1.00 0.00 H new ATOM 0 HE2 TYR A 583 1.899 -5.809 -1.216 1.00 0.00 H new ATOM 0 HH TYR A 583 3.176 -5.776 0.604 1.00 0.00 H new ATOM 1221 N THR A 584 0.902 -12.782 -2.631 1.00 0.00 N ATOM 1222 CA THR A 584 1.096 -13.976 -1.830 1.00 0.00 C ATOM 1223 C THR A 584 2.287 -13.733 -0.903 1.00 0.00 C ATOM 1224 O THR A 584 3.333 -13.273 -1.371 1.00 0.00 O ATOM 1225 CB THR A 584 1.290 -15.201 -2.759 1.00 0.00 C ATOM 1226 OG1 THR A 584 1.839 -14.843 -4.018 1.00 0.00 O ATOM 1227 CG2 THR A 584 -0.038 -15.917 -3.040 1.00 0.00 C ATOM 0 H THR A 584 1.127 -12.932 -3.614 1.00 0.00 H new ATOM 0 HA THR A 584 0.224 -14.193 -1.213 1.00 0.00 H new ATOM 0 HB THR A 584 1.977 -15.857 -2.224 1.00 0.00 H new ATOM 0 HG1 THR A 584 1.945 -15.646 -4.569 1.00 0.00 H new ATOM 0 HG21 THR A 584 0.140 -16.770 -3.695 1.00 0.00 H new ATOM 0 HG22 THR A 584 -0.470 -16.264 -2.101 1.00 0.00 H new ATOM 0 HG23 THR A 584 -0.729 -15.226 -3.524 1.00 0.00 H new ATOM 1235 N SER A 585 2.169 -14.040 0.391 1.00 0.00 N ATOM 1236 CA SER A 585 3.274 -13.886 1.331 1.00 0.00 C ATOM 1237 C SER A 585 4.481 -14.721 0.904 1.00 0.00 C ATOM 1238 O SER A 585 5.622 -14.275 1.050 1.00 0.00 O ATOM 1239 CB SER A 585 2.805 -14.235 2.746 1.00 0.00 C ATOM 1240 OG SER A 585 2.036 -15.424 2.768 1.00 0.00 O ATOM 0 H SER A 585 1.311 -14.399 0.811 1.00 0.00 H new ATOM 0 HA SER A 585 3.598 -12.845 1.330 1.00 0.00 H new ATOM 0 HB2 SER A 585 3.671 -14.350 3.398 1.00 0.00 H new ATOM 0 HB3 SER A 585 2.213 -13.412 3.146 1.00 0.00 H new ATOM 0 HG SER A 585 1.756 -15.616 3.687 1.00 0.00 H new ATOM 1246 N LYS A 586 4.233 -15.895 0.317 1.00 0.00 N ATOM 1247 CA LYS A 586 5.287 -16.796 -0.122 1.00 0.00 C ATOM 1248 C LYS A 586 6.006 -16.289 -1.369 1.00 0.00 C ATOM 1249 O LYS A 586 6.992 -16.910 -1.766 1.00 0.00 O ATOM 1250 CB LYS A 586 4.687 -18.190 -0.370 1.00 0.00 C ATOM 1251 CG LYS A 586 5.527 -19.304 0.267 1.00 0.00 C ATOM 1252 CD LYS A 586 4.981 -20.664 -0.179 1.00 0.00 C ATOM 1253 CE LYS A 586 5.183 -21.729 0.899 1.00 0.00 C ATOM 1254 NZ LYS A 586 4.547 -23.000 0.504 1.00 0.00 N ATOM 0 H LYS A 586 3.291 -16.243 0.135 1.00 0.00 H new ATOM 0 HA LYS A 586 6.037 -16.849 0.667 1.00 0.00 H new ATOM 0 HB2 LYS A 586 3.675 -18.225 0.033 1.00 0.00 H new ATOM 0 HB3 LYS A 586 4.609 -18.364 -1.443 1.00 0.00 H new ATOM 0 HG2 LYS A 586 6.571 -19.203 -0.029 1.00 0.00 H new ATOM 0 HG3 LYS A 586 5.495 -19.224 1.354 1.00 0.00 H new ATOM 0 HD2 LYS A 586 3.919 -20.574 -0.408 1.00 0.00 H new ATOM 0 HD3 LYS A 586 5.480 -20.974 -1.097 1.00 0.00 H new ATOM 0 HE2 LYS A 586 6.249 -21.887 1.066 1.00 0.00 H new ATOM 0 HE3 LYS A 586 4.760 -21.383 1.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 586 4.696 -23.709 1.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 586 3.527 -22.850 0.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 586 4.969 -23.338 -0.384 1.00 0.00 H new ATOM 1268 N GLU A 587 5.508 -15.251 -2.052 1.00 0.00 N ATOM 1269 CA GLU A 587 6.213 -14.706 -3.198 1.00 0.00 C ATOM 1270 C GLU A 587 7.318 -13.754 -2.707 1.00 0.00 C ATOM 1271 O GLU A 587 7.019 -12.857 -1.910 1.00 0.00 O ATOM 1272 CB GLU A 587 5.233 -14.025 -4.156 1.00 0.00 C ATOM 1273 CG GLU A 587 5.897 -13.787 -5.521 1.00 0.00 C ATOM 1274 CD GLU A 587 6.309 -15.096 -6.225 1.00 0.00 C ATOM 1275 OE1 GLU A 587 5.576 -16.102 -6.087 1.00 0.00 O ATOM 1276 OE2 GLU A 587 7.406 -15.167 -6.828 1.00 0.00 O ATOM 0 H GLU A 587 4.630 -14.783 -1.828 1.00 0.00 H new ATOM 0 HA GLU A 587 6.689 -15.509 -3.761 1.00 0.00 H new ATOM 0 HB2 GLU A 587 4.345 -14.645 -4.279 1.00 0.00 H new ATOM 0 HB3 GLU A 587 4.903 -13.076 -3.735 1.00 0.00 H new ATOM 0 HG2 GLU A 587 5.209 -13.236 -6.163 1.00 0.00 H new ATOM 0 HG3 GLU A 587 6.778 -13.160 -5.386 1.00 0.00 H new ATOM 1283 N PRO A 588 8.583 -13.921 -3.135 1.00 0.00 N ATOM 1284 CA PRO A 588 9.692 -13.065 -2.744 1.00 0.00 C ATOM 1285 C PRO A 588 9.473 -11.629 -3.184 1.00 0.00 C ATOM 1286 O PRO A 588 8.732 -11.324 -4.119 1.00 0.00 O ATOM 1287 CB PRO A 588 10.959 -13.614 -3.403 1.00 0.00 C ATOM 1288 CG PRO A 588 10.545 -14.969 -3.941 1.00 0.00 C ATOM 1289 CD PRO A 588 9.043 -14.828 -4.155 1.00 0.00 C ATOM 0 HA PRO A 588 9.778 -13.064 -1.657 1.00 0.00 H new ATOM 0 HB2 PRO A 588 11.308 -12.959 -4.201 1.00 0.00 H new ATOM 0 HB3 PRO A 588 11.774 -13.703 -2.685 1.00 0.00 H new ATOM 0 HG2 PRO A 588 11.062 -15.206 -4.871 1.00 0.00 H new ATOM 0 HG3 PRO A 588 10.776 -15.768 -3.236 1.00 0.00 H new ATOM 0 HD2 PRO A 588 8.825 -14.440 -5.150 1.00 0.00 H new ATOM 0 HD3 PRO A 588 8.544 -15.794 -4.073 1.00 0.00 H new ATOM 1297 N VAL A 589 10.200 -10.746 -2.525 1.00 0.00 N ATOM 1298 CA VAL A 589 10.031 -9.307 -2.686 1.00 0.00 C ATOM 1299 C VAL A 589 10.556 -8.901 -4.063 1.00 0.00 C ATOM 1300 O VAL A 589 9.962 -8.044 -4.715 1.00 0.00 O ATOM 1301 CB VAL A 589 10.752 -8.541 -1.547 1.00 0.00 C ATOM 1302 CG1 VAL A 589 10.473 -7.032 -1.561 1.00 0.00 C ATOM 1303 CG2 VAL A 589 10.339 -9.052 -0.163 1.00 0.00 C ATOM 0 H VAL A 589 10.928 -11.004 -1.859 1.00 0.00 H new ATOM 0 HA VAL A 589 8.974 -9.047 -2.622 1.00 0.00 H new ATOM 0 HB VAL A 589 11.811 -8.721 -1.731 1.00 0.00 H new ATOM 0 HG11 VAL A 589 11.007 -6.556 -0.739 1.00 0.00 H new ATOM 0 HG12 VAL A 589 10.811 -6.608 -2.507 1.00 0.00 H new ATOM 0 HG13 VAL A 589 9.403 -6.859 -1.447 1.00 0.00 H new ATOM 0 HG21 VAL A 589 10.868 -8.488 0.606 1.00 0.00 H new ATOM 0 HG22 VAL A 589 9.264 -8.923 -0.033 1.00 0.00 H new ATOM 0 HG23 VAL A 589 10.591 -10.109 -0.075 1.00 0.00 H new ATOM 1313 N ALA A 590 11.602 -9.571 -4.550 1.00 0.00 N ATOM 1314 CA ALA A 590 12.085 -9.401 -5.909 1.00 0.00 C ATOM 1315 C ALA A 590 10.955 -9.670 -6.905 1.00 0.00 C ATOM 1316 O ALA A 590 10.714 -8.862 -7.801 1.00 0.00 O ATOM 1317 CB ALA A 590 13.276 -10.335 -6.145 1.00 0.00 C ATOM 0 H ALA A 590 12.136 -10.248 -4.005 1.00 0.00 H new ATOM 0 HA ALA A 590 12.419 -8.374 -6.058 1.00 0.00 H new ATOM 0 HB1 ALA A 590 13.640 -10.209 -7.165 1.00 0.00 H new ATOM 0 HB2 ALA A 590 14.073 -10.093 -5.442 1.00 0.00 H new ATOM 0 HB3 ALA A 590 12.963 -11.368 -5.996 1.00 0.00 H new ATOM 1323 N SER A 591 10.246 -10.787 -6.746 1.00 0.00 N ATOM 1324 CA SER A 591 9.263 -11.244 -7.698 1.00 0.00 C ATOM 1325 C SER A 591 7.983 -10.407 -7.675 1.00 0.00 C ATOM 1326 O SER A 591 7.424 -10.107 -8.732 1.00 0.00 O ATOM 1327 CB SER A 591 8.990 -12.694 -7.357 1.00 0.00 C ATOM 1328 OG SER A 591 10.187 -13.453 -7.395 1.00 0.00 O ATOM 0 H SER A 591 10.348 -11.401 -5.938 1.00 0.00 H new ATOM 0 HA SER A 591 9.642 -11.138 -8.714 1.00 0.00 H new ATOM 0 HB2 SER A 591 8.543 -12.761 -6.365 1.00 0.00 H new ATOM 0 HB3 SER A 591 8.268 -13.108 -8.061 1.00 0.00 H new ATOM 0 HG SER A 591 10.022 -14.343 -7.019 1.00 0.00 H new ATOM 1334 N ILE A 592 7.492 -10.003 -6.503 1.00 0.00 N ATOM 1335 CA ILE A 592 6.324 -9.131 -6.451 1.00 0.00 C ATOM 1336 C ILE A 592 6.679 -7.750 -7.027 1.00 0.00 C ATOM 1337 O ILE A 592 5.878 -7.176 -7.765 1.00 0.00 O ATOM 1338 CB ILE A 592 5.716 -9.099 -5.034 1.00 0.00 C ATOM 1339 CG1 ILE A 592 6.633 -8.432 -4.006 1.00 0.00 C ATOM 1340 CG2 ILE A 592 5.427 -10.504 -4.499 1.00 0.00 C ATOM 1341 CD1 ILE A 592 6.242 -6.984 -3.756 1.00 0.00 C ATOM 0 H ILE A 592 7.878 -10.261 -5.595 1.00 0.00 H new ATOM 0 HA ILE A 592 5.531 -9.530 -7.084 1.00 0.00 H new ATOM 0 HB ILE A 592 4.797 -8.525 -5.151 1.00 0.00 H new ATOM 0 HG12 ILE A 592 6.592 -8.987 -3.069 1.00 0.00 H new ATOM 0 HG13 ILE A 592 7.664 -8.475 -4.357 1.00 0.00 H new ATOM 0 HG21 ILE A 592 5.000 -10.432 -3.499 1.00 0.00 H new ATOM 0 HG22 ILE A 592 4.721 -11.007 -5.160 1.00 0.00 H new ATOM 0 HG23 ILE A 592 6.354 -11.075 -4.457 1.00 0.00 H new ATOM 0 HD11 ILE A 592 6.917 -6.547 -3.020 1.00 0.00 H new ATOM 0 HD12 ILE A 592 6.308 -6.423 -4.688 1.00 0.00 H new ATOM 0 HD13 ILE A 592 5.220 -6.943 -3.380 1.00 0.00 H new ATOM 1353 N ILE A 593 7.892 -7.232 -6.771 1.00 0.00 N ATOM 1354 CA ILE A 593 8.367 -6.000 -7.400 1.00 0.00 C ATOM 1355 C ILE A 593 8.406 -6.199 -8.920 1.00 0.00 C ATOM 1356 O ILE A 593 7.862 -5.364 -9.631 1.00 0.00 O ATOM 1357 CB ILE A 593 9.699 -5.506 -6.778 1.00 0.00 C ATOM 1358 CG1 ILE A 593 9.409 -4.955 -5.364 1.00 0.00 C ATOM 1359 CG2 ILE A 593 10.328 -4.385 -7.623 1.00 0.00 C ATOM 1360 CD1 ILE A 593 10.650 -4.571 -4.551 1.00 0.00 C ATOM 0 H ILE A 593 8.561 -7.655 -6.128 1.00 0.00 H new ATOM 0 HA ILE A 593 7.670 -5.186 -7.201 1.00 0.00 H new ATOM 0 HB ILE A 593 10.396 -6.344 -6.740 1.00 0.00 H new ATOM 0 HG12 ILE A 593 8.768 -4.078 -5.457 1.00 0.00 H new ATOM 0 HG13 ILE A 593 8.846 -5.704 -4.807 1.00 0.00 H new ATOM 0 HG21 ILE A 593 11.260 -4.060 -7.161 1.00 0.00 H new ATOM 0 HG22 ILE A 593 10.531 -4.757 -8.627 1.00 0.00 H new ATOM 0 HG23 ILE A 593 9.639 -3.542 -7.681 1.00 0.00 H new ATOM 0 HD11 ILE A 593 10.344 -4.196 -3.575 1.00 0.00 H new ATOM 0 HD12 ILE A 593 11.285 -5.447 -4.420 1.00 0.00 H new ATOM 0 HD13 ILE A 593 11.206 -3.796 -5.079 1.00 0.00 H new ATOM 1372 N THR A 594 8.959 -7.306 -9.426 1.00 0.00 N ATOM 1373 CA THR A 594 8.936 -7.711 -10.835 1.00 0.00 C ATOM 1374 C THR A 594 7.563 -7.471 -11.489 1.00 0.00 C ATOM 1375 O THR A 594 7.477 -6.928 -12.590 1.00 0.00 O ATOM 1376 CB THR A 594 9.451 -9.166 -10.915 1.00 0.00 C ATOM 1377 OG1 THR A 594 10.819 -9.196 -11.287 1.00 0.00 O ATOM 1378 CG2 THR A 594 8.654 -10.126 -11.798 1.00 0.00 C ATOM 0 H THR A 594 9.457 -7.974 -8.838 1.00 0.00 H new ATOM 0 HA THR A 594 9.602 -7.086 -11.430 1.00 0.00 H new ATOM 0 HB THR A 594 9.309 -9.542 -9.902 1.00 0.00 H new ATOM 0 HG1 THR A 594 11.126 -10.126 -11.330 1.00 0.00 H new ATOM 0 HG21 THR A 594 9.115 -11.113 -11.771 1.00 0.00 H new ATOM 0 HG22 THR A 594 7.630 -10.193 -11.430 1.00 0.00 H new ATOM 0 HG23 THR A 594 8.648 -9.757 -12.824 1.00 0.00 H new ATOM 1386 N LYS A 595 6.487 -7.833 -10.793 1.00 0.00 N ATOM 1387 CA LYS A 595 5.123 -7.770 -11.332 1.00 0.00 C ATOM 1388 C LYS A 595 4.591 -6.339 -11.255 1.00 0.00 C ATOM 1389 O LYS A 595 4.000 -5.847 -12.220 1.00 0.00 O ATOM 1390 CB LYS A 595 4.175 -8.755 -10.620 1.00 0.00 C ATOM 1391 CG LYS A 595 3.111 -9.285 -11.606 1.00 0.00 C ATOM 1392 CD LYS A 595 2.013 -10.081 -10.886 1.00 0.00 C ATOM 1393 CE LYS A 595 0.642 -10.073 -11.584 1.00 0.00 C ATOM 1394 NZ LYS A 595 0.586 -10.834 -12.849 1.00 0.00 N ATOM 0 H LYS A 595 6.533 -8.180 -9.835 1.00 0.00 H new ATOM 0 HA LYS A 595 5.163 -8.072 -12.378 1.00 0.00 H new ATOM 0 HB2 LYS A 595 4.746 -9.587 -10.209 1.00 0.00 H new ATOM 0 HB3 LYS A 595 3.687 -8.259 -9.781 1.00 0.00 H new ATOM 0 HG2 LYS A 595 2.662 -8.448 -12.141 1.00 0.00 H new ATOM 0 HG3 LYS A 595 3.590 -9.919 -12.352 1.00 0.00 H new ATOM 0 HD2 LYS A 595 2.344 -11.114 -10.780 1.00 0.00 H new ATOM 0 HD3 LYS A 595 1.894 -9.679 -9.880 1.00 0.00 H new ATOM 0 HE2 LYS A 595 -0.101 -10.480 -10.898 1.00 0.00 H new ATOM 0 HE3 LYS A 595 0.358 -9.040 -11.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 -0.372 -10.774 -13.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 1.268 -10.435 -13.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 0.823 -11.830 -12.666 1.00 0.00 H new ATOM 1408 N LEU A 596 4.878 -5.637 -10.156 1.00 0.00 N ATOM 1409 CA LEU A 596 4.618 -4.209 -10.009 1.00 0.00 C ATOM 1410 C LEU A 596 5.291 -3.422 -11.139 1.00 0.00 C ATOM 1411 O LEU A 596 4.699 -2.475 -11.644 1.00 0.00 O ATOM 1412 CB LEU A 596 5.104 -3.717 -8.629 1.00 0.00 C ATOM 1413 CG LEU A 596 4.096 -3.696 -7.458 1.00 0.00 C ATOM 1414 CD1 LEU A 596 2.953 -4.705 -7.527 1.00 0.00 C ATOM 1415 CD2 LEU A 596 4.854 -3.857 -6.138 1.00 0.00 C ATOM 0 H LEU A 596 5.305 -6.056 -9.330 1.00 0.00 H new ATOM 0 HA LEU A 596 3.543 -4.040 -10.074 1.00 0.00 H new ATOM 0 HB2 LEU A 596 5.945 -4.343 -8.331 1.00 0.00 H new ATOM 0 HB3 LEU A 596 5.488 -2.705 -8.754 1.00 0.00 H new ATOM 0 HG LEU A 596 3.601 -2.728 -7.532 1.00 0.00 H new ATOM 0 HD11 LEU A 596 2.315 -4.592 -6.651 1.00 0.00 H new ATOM 0 HD12 LEU A 596 2.366 -4.529 -8.429 1.00 0.00 H new ATOM 0 HD13 LEU A 596 3.361 -5.716 -7.551 1.00 0.00 H new ATOM 0 HD21 LEU A 596 4.147 -3.843 -5.308 1.00 0.00 H new ATOM 0 HD22 LEU A 596 5.392 -4.805 -6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 596 5.564 -3.038 -6.024 1.00 0.00 H new ATOM 1427 N ASN A 597 6.498 -3.798 -11.566 1.00 0.00 N ATOM 1428 CA ASN A 597 7.214 -3.124 -12.661 1.00 0.00 C ATOM 1429 C ASN A 597 6.533 -3.348 -14.008 1.00 0.00 C ATOM 1430 O ASN A 597 6.759 -2.603 -14.955 1.00 0.00 O ATOM 1431 CB ASN A 597 8.649 -3.637 -12.822 1.00 0.00 C ATOM 1432 CG ASN A 597 9.462 -3.624 -11.545 1.00 0.00 C ATOM 1433 OD1 ASN A 597 9.472 -2.667 -10.780 1.00 0.00 O ATOM 1434 ND2 ASN A 597 10.161 -4.712 -11.292 1.00 0.00 N ATOM 0 H ASN A 597 7.012 -4.581 -11.163 1.00 0.00 H new ATOM 0 HA ASN A 597 7.210 -2.069 -12.387 1.00 0.00 H new ATOM 0 HB2 ASN A 597 8.617 -4.656 -13.208 1.00 0.00 H new ATOM 0 HB3 ASN A 597 9.158 -3.029 -13.569 1.00 0.00 H new ATOM 0 HD21 ASN A 597 10.726 -4.770 -10.445 1.00 0.00 H new ATOM 0 HD22 ASN A 597 10.137 -5.496 -11.944 1.00 0.00 H new ATOM 1441 N SER A 598 5.742 -4.410 -14.116 1.00 0.00 N ATOM 1442 CA SER A 598 4.909 -4.727 -15.264 1.00 0.00 C ATOM 1443 C SER A 598 3.649 -3.856 -15.310 1.00 0.00 C ATOM 1444 O SER A 598 2.949 -3.850 -16.319 1.00 0.00 O ATOM 1445 CB SER A 598 4.537 -6.208 -15.164 1.00 0.00 C ATOM 1446 OG SER A 598 4.934 -6.954 -16.297 1.00 0.00 O ATOM 0 H SER A 598 5.663 -5.102 -13.371 1.00 0.00 H new ATOM 0 HA SER A 598 5.458 -4.525 -16.184 1.00 0.00 H new ATOM 0 HB2 SER A 598 5.001 -6.634 -14.274 1.00 0.00 H new ATOM 0 HB3 SER A 598 3.458 -6.298 -15.036 1.00 0.00 H new ATOM 0 HG SER A 598 4.674 -7.891 -16.179 1.00 0.00 H new ATOM 1452 N LEU A 599 3.305 -3.184 -14.209 1.00 0.00 N ATOM 1453 CA LEU A 599 2.160 -2.283 -14.118 1.00 0.00 C ATOM 1454 C LEU A 599 2.601 -0.900 -14.576 1.00 0.00 C ATOM 1455 O LEU A 599 2.006 -0.344 -15.496 1.00 0.00 O ATOM 1456 CB LEU A 599 1.585 -2.244 -12.687 1.00 0.00 C ATOM 1457 CG LEU A 599 1.031 -3.584 -12.181 1.00 0.00 C ATOM 1458 CD1 LEU A 599 0.637 -3.477 -10.715 1.00 0.00 C ATOM 1459 CD2 LEU A 599 -0.209 -4.024 -12.957 1.00 0.00 C ATOM 0 H LEU A 599 3.829 -3.255 -13.337 1.00 0.00 H new ATOM 0 HA LEU A 599 1.359 -2.645 -14.763 1.00 0.00 H new ATOM 0 HB2 LEU A 599 2.367 -1.909 -12.005 1.00 0.00 H new ATOM 0 HB3 LEU A 599 0.789 -1.500 -12.650 1.00 0.00 H new ATOM 0 HG LEU A 599 1.826 -4.317 -12.322 1.00 0.00 H new ATOM 0 HD11 LEU A 599 0.246 -4.435 -10.372 1.00 0.00 H new ATOM 0 HD12 LEU A 599 1.511 -3.209 -10.122 1.00 0.00 H new ATOM 0 HD13 LEU A 599 -0.129 -2.711 -10.599 1.00 0.00 H new ATOM 0 HD21 LEU A 599 -0.565 -4.976 -12.564 1.00 0.00 H new ATOM 0 HD22 LEU A 599 -0.991 -3.272 -12.850 1.00 0.00 H new ATOM 0 HD23 LEU A 599 0.043 -4.138 -14.011 1.00 0.00 H new ATOM 1471 N ASN A 600 3.662 -0.353 -13.970 1.00 0.00 N ATOM 1472 CA ASN A 600 4.152 1.013 -14.207 1.00 0.00 C ATOM 1473 C ASN A 600 3.133 2.061 -13.758 1.00 0.00 C ATOM 1474 O ASN A 600 3.201 3.220 -14.165 1.00 0.00 O ATOM 1475 CB ASN A 600 4.623 1.241 -15.661 1.00 0.00 C ATOM 1476 CG ASN A 600 5.446 0.089 -16.212 1.00 0.00 C ATOM 1477 OD1 ASN A 600 6.670 0.073 -16.084 1.00 0.00 O ATOM 1478 ND2 ASN A 600 4.794 -0.896 -16.803 1.00 0.00 N ATOM 0 H ASN A 600 4.219 -0.861 -13.283 1.00 0.00 H new ATOM 0 HA ASN A 600 5.039 1.136 -13.586 1.00 0.00 H new ATOM 0 HB2 ASN A 600 3.752 1.394 -16.298 1.00 0.00 H new ATOM 0 HB3 ASN A 600 5.215 2.155 -15.705 1.00 0.00 H new ATOM 0 HD21 ASN A 600 5.306 -1.699 -17.169 1.00 0.00 H new ATOM 0 HD22 ASN A 600 3.779 -0.854 -16.894 1.00 0.00 H new ATOM 1485 N GLU A 601 2.202 1.663 -12.898 1.00 0.00 N ATOM 1486 CA GLU A 601 1.135 2.441 -12.316 1.00 0.00 C ATOM 1487 C GLU A 601 1.589 2.987 -10.949 1.00 0.00 C ATOM 1488 O GLU A 601 2.433 2.370 -10.291 1.00 0.00 O ATOM 1489 CB GLU A 601 -0.113 1.546 -12.181 1.00 0.00 C ATOM 1490 CG GLU A 601 -0.471 0.928 -13.539 1.00 0.00 C ATOM 1491 CD GLU A 601 -1.830 0.253 -13.551 1.00 0.00 C ATOM 1492 OE1 GLU A 601 -1.950 -0.944 -13.220 1.00 0.00 O ATOM 1493 OE2 GLU A 601 -2.836 0.903 -13.906 1.00 0.00 O ATOM 0 H GLU A 601 2.181 0.699 -12.566 1.00 0.00 H new ATOM 0 HA GLU A 601 0.886 3.291 -12.951 1.00 0.00 H new ATOM 0 HB2 GLU A 601 0.073 0.757 -11.452 1.00 0.00 H new ATOM 0 HB3 GLU A 601 -0.952 2.133 -11.808 1.00 0.00 H new ATOM 0 HG2 GLU A 601 -0.453 1.707 -14.301 1.00 0.00 H new ATOM 0 HG3 GLU A 601 0.292 0.199 -13.811 1.00 0.00 H new ATOM 1500 N PRO A 602 1.064 4.136 -10.512 1.00 0.00 N ATOM 1501 CA PRO A 602 1.507 4.822 -9.303 1.00 0.00 C ATOM 1502 C PRO A 602 0.962 4.145 -8.048 1.00 0.00 C ATOM 1503 O PRO A 602 -0.229 3.833 -7.988 1.00 0.00 O ATOM 1504 CB PRO A 602 0.938 6.233 -9.430 1.00 0.00 C ATOM 1505 CG PRO A 602 -0.287 6.073 -10.320 1.00 0.00 C ATOM 1506 CD PRO A 602 0.071 4.910 -11.230 1.00 0.00 C ATOM 0 HA PRO A 602 2.593 4.811 -9.209 1.00 0.00 H new ATOM 0 HB2 PRO A 602 0.670 6.642 -8.456 1.00 0.00 H new ATOM 0 HB3 PRO A 602 1.664 6.915 -9.873 1.00 0.00 H new ATOM 0 HG2 PRO A 602 -1.181 5.861 -9.734 1.00 0.00 H new ATOM 0 HG3 PRO A 602 -0.487 6.980 -10.891 1.00 0.00 H new ATOM 0 HD2 PRO A 602 -0.808 4.305 -11.455 1.00 0.00 H new ATOM 0 HD3 PRO A 602 0.466 5.266 -12.182 1.00 0.00 H new ATOM 1514 N LEU A 603 1.800 3.975 -7.018 1.00 0.00 N ATOM 1515 CA LEU A 603 1.410 3.291 -5.786 1.00 0.00 C ATOM 1516 C LEU A 603 1.407 4.226 -4.573 1.00 0.00 C ATOM 1517 O LEU A 603 2.037 5.286 -4.563 1.00 0.00 O ATOM 1518 CB LEU A 603 2.362 2.122 -5.468 1.00 0.00 C ATOM 1519 CG LEU A 603 2.619 1.097 -6.584 1.00 0.00 C ATOM 1520 CD1 LEU A 603 3.804 0.234 -6.124 1.00 0.00 C ATOM 1521 CD2 LEU A 603 1.384 0.232 -6.916 1.00 0.00 C ATOM 0 H LEU A 603 2.764 4.308 -7.018 1.00 0.00 H new ATOM 0 HA LEU A 603 0.399 2.925 -5.964 1.00 0.00 H new ATOM 0 HB2 LEU A 603 3.322 2.541 -5.168 1.00 0.00 H new ATOM 0 HB3 LEU A 603 1.964 1.588 -4.605 1.00 0.00 H new ATOM 0 HG LEU A 603 2.844 1.619 -7.514 1.00 0.00 H new ATOM 0 HD11 LEU A 603 4.027 -0.513 -6.886 1.00 0.00 H new ATOM 0 HD12 LEU A 603 4.677 0.868 -5.970 1.00 0.00 H new ATOM 0 HD13 LEU A 603 3.549 -0.266 -5.189 1.00 0.00 H new ATOM 0 HD21 LEU A 603 1.635 -0.470 -7.711 1.00 0.00 H new ATOM 0 HD22 LEU A 603 1.077 -0.321 -6.028 1.00 0.00 H new ATOM 0 HD23 LEU A 603 0.567 0.875 -7.243 1.00 0.00 H new ATOM 1533 N VAL A 604 0.808 3.751 -3.485 1.00 0.00 N ATOM 1534 CA VAL A 604 0.980 4.223 -2.120 1.00 0.00 C ATOM 1535 C VAL A 604 0.964 2.984 -1.227 1.00 0.00 C ATOM 1536 O VAL A 604 0.030 2.188 -1.290 1.00 0.00 O ATOM 1537 CB VAL A 604 -0.102 5.273 -1.771 1.00 0.00 C ATOM 1538 CG1 VAL A 604 -1.520 4.826 -2.126 1.00 0.00 C ATOM 1539 CG2 VAL A 604 -0.109 5.668 -0.285 1.00 0.00 C ATOM 0 H VAL A 604 0.147 2.976 -3.540 1.00 0.00 H new ATOM 0 HA VAL A 604 1.925 4.745 -1.973 1.00 0.00 H new ATOM 0 HB VAL A 604 0.178 6.131 -2.382 1.00 0.00 H new ATOM 0 HG11 VAL A 604 -2.227 5.610 -1.854 1.00 0.00 H new ATOM 0 HG12 VAL A 604 -1.584 4.635 -3.197 1.00 0.00 H new ATOM 0 HG13 VAL A 604 -1.762 3.914 -1.580 1.00 0.00 H new ATOM 0 HG21 VAL A 604 -0.891 6.407 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL A 604 -0.300 4.785 0.325 1.00 0.00 H new ATOM 0 HG23 VAL A 604 0.858 6.092 -0.017 1.00 0.00 H new ATOM 1549 N THR A 605 2.008 2.766 -0.435 1.00 0.00 N ATOM 1550 CA THR A 605 2.094 1.629 0.486 1.00 0.00 C ATOM 1551 C THR A 605 3.143 1.910 1.568 1.00 0.00 C ATOM 1552 O THR A 605 3.504 3.060 1.794 1.00 0.00 O ATOM 1553 CB THR A 605 2.306 0.337 -0.317 1.00 0.00 C ATOM 1554 OG1 THR A 605 2.258 -0.829 0.485 1.00 0.00 O ATOM 1555 CG2 THR A 605 3.538 0.406 -1.232 1.00 0.00 C ATOM 0 H THR A 605 2.826 3.375 -0.411 1.00 0.00 H new ATOM 0 HA THR A 605 1.161 1.485 1.030 1.00 0.00 H new ATOM 0 HB THR A 605 1.451 0.252 -0.987 1.00 0.00 H new ATOM 0 HG1 THR A 605 1.621 -1.466 0.099 1.00 0.00 H new ATOM 0 HG21 THR A 605 3.640 -0.533 -1.776 1.00 0.00 H new ATOM 0 HG22 THR A 605 3.419 1.225 -1.941 1.00 0.00 H new ATOM 0 HG23 THR A 605 4.430 0.575 -0.629 1.00 0.00 H new ATOM 1563 N MET A 606 3.537 0.900 2.336 1.00 0.00 N ATOM 1564 CA MET A 606 4.692 0.910 3.228 1.00 0.00 C ATOM 1565 C MET A 606 5.882 0.310 2.454 1.00 0.00 C ATOM 1566 O MET A 606 5.722 0.008 1.272 1.00 0.00 O ATOM 1567 CB MET A 606 4.368 0.149 4.522 1.00 0.00 C ATOM 1568 CG MET A 606 2.896 0.211 4.907 1.00 0.00 C ATOM 1569 SD MET A 606 1.908 -1.181 4.279 1.00 0.00 S ATOM 1570 CE MET A 606 0.277 -0.411 4.357 1.00 0.00 C ATOM 0 H MET A 606 3.037 0.011 2.355 1.00 0.00 H new ATOM 0 HA MET A 606 4.953 1.922 3.536 1.00 0.00 H new ATOM 0 HB2 MET A 606 4.662 -0.894 4.405 1.00 0.00 H new ATOM 0 HB3 MET A 606 4.966 0.559 5.336 1.00 0.00 H new ATOM 0 HG2 MET A 606 2.816 0.239 5.994 1.00 0.00 H new ATOM 0 HG3 MET A 606 2.472 1.143 4.532 1.00 0.00 H new ATOM 0 HE1 MET A 606 -0.478 -1.176 4.536 1.00 0.00 H new ATOM 0 HE2 MET A 606 0.256 0.316 5.169 1.00 0.00 H new ATOM 0 HE3 MET A 606 0.067 0.093 3.413 1.00 0.00 H new ATOM 1580 N PRO A 607 7.074 0.081 3.038 1.00 0.00 N ATOM 1581 CA PRO A 607 8.159 -0.610 2.335 1.00 0.00 C ATOM 1582 C PRO A 607 7.915 -2.123 2.123 1.00 0.00 C ATOM 1583 O PRO A 607 8.828 -2.927 2.273 1.00 0.00 O ATOM 1584 CB PRO A 607 9.412 -0.313 3.161 1.00 0.00 C ATOM 1585 CG PRO A 607 8.950 0.176 4.533 1.00 0.00 C ATOM 1586 CD PRO A 607 7.476 0.512 4.368 1.00 0.00 C ATOM 0 HA PRO A 607 8.250 -0.248 1.311 1.00 0.00 H new ATOM 0 HB2 PRO A 607 10.027 -1.207 3.260 1.00 0.00 H new ATOM 0 HB3 PRO A 607 10.025 0.443 2.670 1.00 0.00 H new ATOM 0 HG2 PRO A 607 9.095 -0.592 5.293 1.00 0.00 H new ATOM 0 HG3 PRO A 607 9.519 1.050 4.850 1.00 0.00 H new ATOM 0 HD2 PRO A 607 6.881 0.009 5.130 1.00 0.00 H new ATOM 0 HD3 PRO A 607 7.311 1.583 4.490 1.00 0.00 H new ATOM 1594 N ILE A 608 6.707 -2.512 1.711 1.00 0.00 N ATOM 1595 CA ILE A 608 6.258 -3.814 1.229 1.00 0.00 C ATOM 1596 C ILE A 608 6.930 -4.995 1.933 1.00 0.00 C ATOM 1597 O ILE A 608 6.415 -5.447 2.953 1.00 0.00 O ATOM 1598 CB ILE A 608 6.272 -3.798 -0.320 1.00 0.00 C ATOM 1599 CG1 ILE A 608 5.172 -2.866 -0.877 1.00 0.00 C ATOM 1600 CG2 ILE A 608 6.172 -5.164 -1.000 1.00 0.00 C ATOM 1601 CD1 ILE A 608 3.748 -3.397 -0.697 1.00 0.00 C ATOM 0 H ILE A 608 5.935 -1.845 1.708 1.00 0.00 H new ATOM 0 HA ILE A 608 5.222 -3.993 1.516 1.00 0.00 H new ATOM 0 HB ILE A 608 7.264 -3.419 -0.566 1.00 0.00 H new ATOM 0 HG12 ILE A 608 5.251 -1.896 -0.386 1.00 0.00 H new ATOM 0 HG13 ILE A 608 5.355 -2.701 -1.939 1.00 0.00 H new ATOM 0 HG21 ILE A 608 6.191 -5.034 -2.082 1.00 0.00 H new ATOM 0 HG22 ILE A 608 7.014 -5.785 -0.694 1.00 0.00 H new ATOM 0 HG23 ILE A 608 5.240 -5.648 -0.709 1.00 0.00 H new ATOM 0 HD11 ILE A 608 3.038 -2.683 -1.115 1.00 0.00 H new ATOM 0 HD12 ILE A 608 3.648 -4.352 -1.212 1.00 0.00 H new ATOM 0 HD13 ILE A 608 3.542 -3.534 0.365 1.00 0.00 H new ATOM 1613 N GLY A 609 8.054 -5.509 1.432 1.00 0.00 N ATOM 1614 CA GLY A 609 8.870 -6.483 2.139 1.00 0.00 C ATOM 1615 C GLY A 609 9.572 -5.803 3.299 1.00 0.00 C ATOM 1616 O GLY A 609 10.758 -5.568 3.219 1.00 0.00 O ATOM 0 H GLY A 609 8.422 -5.255 0.515 1.00 0.00 H new ATOM 0 HA2 GLY A 609 8.247 -7.299 2.504 1.00 0.00 H new ATOM 0 HA3 GLY A 609 9.603 -6.920 1.461 1.00 0.00 H new ATOM 1620 N TYR A 610 8.853 -5.475 4.363 1.00 0.00 N ATOM 1621 CA TYR A 610 9.352 -4.851 5.576 1.00 0.00 C ATOM 1622 C TYR A 610 9.079 -5.698 6.814 1.00 0.00 C ATOM 1623 O TYR A 610 9.986 -5.888 7.611 1.00 0.00 O ATOM 1624 CB TYR A 610 8.740 -3.452 5.676 1.00 0.00 C ATOM 1625 CG TYR A 610 9.048 -2.704 6.954 1.00 0.00 C ATOM 1626 CD1 TYR A 610 10.383 -2.441 7.325 1.00 0.00 C ATOM 1627 CD2 TYR A 610 7.988 -2.284 7.780 1.00 0.00 C ATOM 1628 CE1 TYR A 610 10.651 -1.738 8.509 1.00 0.00 C ATOM 1629 CE2 TYR A 610 8.258 -1.632 8.994 1.00 0.00 C ATOM 1630 CZ TYR A 610 9.592 -1.337 9.349 1.00 0.00 C ATOM 1631 OH TYR A 610 9.865 -0.733 10.534 1.00 0.00 O ATOM 0 H TYR A 610 7.849 -5.648 4.403 1.00 0.00 H new ATOM 0 HA TYR A 610 10.438 -4.768 5.526 1.00 0.00 H new ATOM 0 HB2 TYR A 610 9.092 -2.858 4.832 1.00 0.00 H new ATOM 0 HB3 TYR A 610 7.658 -3.538 5.576 1.00 0.00 H new ATOM 0 HD1 TYR A 610 11.196 -2.780 6.700 1.00 0.00 H new ATOM 0 HD2 TYR A 610 6.966 -2.463 7.480 1.00 0.00 H new ATOM 0 HE1 TYR A 610 11.670 -1.503 8.778 1.00 0.00 H new ATOM 0 HE2 TYR A 610 7.448 -1.357 9.654 1.00 0.00 H new ATOM 0 HH TYR A 610 9.026 -0.518 10.993 1.00 0.00 H new ATOM 1641 N VAL A 611 7.872 -6.239 6.980 1.00 0.00 N ATOM 1642 CA VAL A 611 7.447 -6.928 8.201 1.00 0.00 C ATOM 1643 C VAL A 611 6.688 -8.205 7.835 1.00 0.00 C ATOM 1644 O VAL A 611 6.962 -9.242 8.430 1.00 0.00 O ATOM 1645 CB VAL A 611 6.667 -5.956 9.127 1.00 0.00 C ATOM 1646 CG1 VAL A 611 5.798 -6.639 10.192 1.00 0.00 C ATOM 1647 CG2 VAL A 611 7.624 -5.018 9.873 1.00 0.00 C ATOM 0 H VAL A 611 7.150 -6.211 6.260 1.00 0.00 H new ATOM 0 HA VAL A 611 8.312 -7.247 8.782 1.00 0.00 H new ATOM 0 HB VAL A 611 6.011 -5.418 8.443 1.00 0.00 H new ATOM 0 HG11 VAL A 611 5.292 -5.881 10.790 1.00 0.00 H new ATOM 0 HG12 VAL A 611 5.056 -7.272 9.705 1.00 0.00 H new ATOM 0 HG13 VAL A 611 6.428 -7.250 10.838 1.00 0.00 H new ATOM 0 HG21 VAL A 611 7.051 -4.348 10.514 1.00 0.00 H new ATOM 0 HG22 VAL A 611 8.309 -5.607 10.483 1.00 0.00 H new ATOM 0 HG23 VAL A 611 8.194 -4.431 9.152 1.00 0.00 H new ATOM 1657 N THR A 612 5.840 -8.203 6.799 1.00 0.00 N ATOM 1658 CA THR A 612 5.220 -9.415 6.252 1.00 0.00 C ATOM 1659 C THR A 612 6.268 -10.505 5.985 1.00 0.00 C ATOM 1660 O THR A 612 6.022 -11.689 6.224 1.00 0.00 O ATOM 1661 CB THR A 612 4.397 -9.093 4.978 1.00 0.00 C ATOM 1662 OG1 THR A 612 4.258 -10.231 4.148 1.00 0.00 O ATOM 1663 CG2 THR A 612 5.000 -8.019 4.069 1.00 0.00 C ATOM 0 H THR A 612 5.563 -7.351 6.312 1.00 0.00 H new ATOM 0 HA THR A 612 4.530 -9.804 7.000 1.00 0.00 H new ATOM 0 HB THR A 612 3.451 -8.738 5.388 1.00 0.00 H new ATOM 0 HG1 THR A 612 3.432 -10.156 3.626 1.00 0.00 H new ATOM 0 HG21 THR A 612 4.351 -7.866 3.207 1.00 0.00 H new ATOM 0 HG22 THR A 612 5.094 -7.085 4.623 1.00 0.00 H new ATOM 0 HG23 THR A 612 5.985 -8.340 3.730 1.00 0.00 H new ATOM 1671 N HIS A 613 7.416 -10.099 5.439 1.00 0.00 N ATOM 1672 CA HIS A 613 8.508 -10.969 5.021 1.00 0.00 C ATOM 1673 C HIS A 613 9.634 -10.982 6.063 1.00 0.00 C ATOM 1674 O HIS A 613 10.702 -11.516 5.770 1.00 0.00 O ATOM 1675 CB HIS A 613 9.001 -10.503 3.638 1.00 0.00 C ATOM 1676 CG HIS A 613 8.092 -10.889 2.486 1.00 0.00 C ATOM 1677 ND1 HIS A 613 6.699 -10.856 2.451 1.00 0.00 N ATOM 1678 CD2 HIS A 613 8.534 -11.425 1.304 1.00 0.00 C ATOM 1679 CE1 HIS A 613 6.322 -11.354 1.258 1.00 0.00 C ATOM 1680 NE2 HIS A 613 7.413 -11.700 0.551 1.00 0.00 N ATOM 0 H HIS A 613 7.615 -9.113 5.271 1.00 0.00 H new ATOM 0 HA HIS A 613 8.156 -11.998 4.942 1.00 0.00 H new ATOM 0 HB2 HIS A 613 9.110 -9.419 3.651 1.00 0.00 H new ATOM 0 HB3 HIS A 613 9.992 -10.921 3.459 1.00 0.00 H new ATOM 0 HD1 HIS A 613 6.082 -10.518 3.190 1.00 0.00 H new ATOM 0 HD2 HIS A 613 9.561 -11.598 1.018 1.00 0.00 H new ATOM 0 HE1 HIS A 613 5.301 -11.459 0.921 1.00 0.00 H new ATOM 0 HE2 HIS A 613 7.411 -12.100 -0.387 1.00 0.00 H new ATOM 1689 N GLY A 614 9.440 -10.382 7.244 1.00 0.00 N ATOM 1690 CA GLY A 614 10.462 -10.365 8.281 1.00 0.00 C ATOM 1691 C GLY A 614 11.748 -9.691 7.821 1.00 0.00 C ATOM 1692 O GLY A 614 12.835 -10.161 8.161 1.00 0.00 O ATOM 0 H GLY A 614 8.577 -9.901 7.500 1.00 0.00 H new ATOM 0 HA2 GLY A 614 10.077 -9.845 9.158 1.00 0.00 H new ATOM 0 HA3 GLY A 614 10.681 -11.388 8.588 1.00 0.00 H new ATOM 1696 N PHE A 615 11.636 -8.647 6.996 1.00 0.00 N ATOM 1697 CA PHE A 615 12.794 -7.847 6.609 1.00 0.00 C ATOM 1698 C PHE A 615 13.084 -6.859 7.753 1.00 0.00 C ATOM 1699 O PHE A 615 12.453 -6.892 8.815 1.00 0.00 O ATOM 1700 CB PHE A 615 12.521 -7.184 5.245 1.00 0.00 C ATOM 1701 CG PHE A 615 12.769 -8.041 4.001 1.00 0.00 C ATOM 1702 CD1 PHE A 615 12.837 -9.449 4.053 1.00 0.00 C ATOM 1703 CD2 PHE A 615 12.936 -7.412 2.751 1.00 0.00 C ATOM 1704 CE1 PHE A 615 13.085 -10.196 2.887 1.00 0.00 C ATOM 1705 CE2 PHE A 615 13.191 -8.150 1.588 1.00 0.00 C ATOM 1706 CZ PHE A 615 13.268 -9.549 1.654 1.00 0.00 C ATOM 0 H PHE A 615 10.755 -8.338 6.585 1.00 0.00 H new ATOM 0 HA PHE A 615 13.692 -8.449 6.468 1.00 0.00 H new ATOM 0 HB2 PHE A 615 11.482 -6.854 5.229 1.00 0.00 H new ATOM 0 HB3 PHE A 615 13.141 -6.290 5.171 1.00 0.00 H new ATOM 0 HD1 PHE A 615 12.698 -9.958 4.995 1.00 0.00 H new ATOM 0 HD2 PHE A 615 12.866 -6.336 2.688 1.00 0.00 H new ATOM 0 HE1 PHE A 615 13.135 -11.274 2.940 1.00 0.00 H new ATOM 0 HE2 PHE A 615 13.328 -7.644 0.644 1.00 0.00 H new ATOM 0 HZ PHE A 615 13.467 -10.125 0.762 1.00 0.00 H new ATOM 1716 N ASN A 616 14.038 -5.962 7.538 1.00 0.00 N ATOM 1717 CA ASN A 616 14.240 -4.762 8.338 1.00 0.00 C ATOM 1718 C ASN A 616 14.040 -3.567 7.432 1.00 0.00 C ATOM 1719 O ASN A 616 14.012 -3.734 6.211 1.00 0.00 O ATOM 1720 CB ASN A 616 15.666 -4.729 8.894 1.00 0.00 C ATOM 1721 CG ASN A 616 16.015 -5.950 9.725 1.00 0.00 C ATOM 1722 OD1 ASN A 616 15.256 -6.344 10.604 1.00 0.00 O ATOM 1723 ND2 ASN A 616 17.182 -6.534 9.519 1.00 0.00 N ATOM 0 H ASN A 616 14.713 -6.053 6.779 1.00 0.00 H new ATOM 0 HA ASN A 616 13.538 -4.749 9.172 1.00 0.00 H new ATOM 0 HB2 ASN A 616 16.370 -4.649 8.066 1.00 0.00 H new ATOM 0 HB3 ASN A 616 15.790 -3.835 9.505 1.00 0.00 H new ATOM 0 HD21 ASN A 616 17.465 -7.326 10.096 1.00 0.00 H new ATOM 0 HD22 ASN A 616 17.800 -6.193 8.783 1.00 0.00 H new ATOM 1730 N LEU A 617 13.983 -2.359 8.008 1.00 0.00 N ATOM 1731 CA LEU A 617 13.866 -1.118 7.241 1.00 0.00 C ATOM 1732 C LEU A 617 14.910 -1.133 6.124 1.00 0.00 C ATOM 1733 O LEU A 617 14.561 -0.929 4.967 1.00 0.00 O ATOM 1734 CB LEU A 617 14.006 0.134 8.148 1.00 0.00 C ATOM 1735 CG LEU A 617 13.419 1.435 7.541 1.00 0.00 C ATOM 1736 CD1 LEU A 617 14.022 1.727 6.190 1.00 0.00 C ATOM 1737 CD2 LEU A 617 11.885 1.455 7.570 1.00 0.00 C ATOM 0 H LEU A 617 14.017 -2.218 9.018 1.00 0.00 H new ATOM 0 HA LEU A 617 12.871 -1.058 6.800 1.00 0.00 H new ATOM 0 HB2 LEU A 617 13.511 -0.064 9.099 1.00 0.00 H new ATOM 0 HB3 LEU A 617 15.062 0.294 8.366 1.00 0.00 H new ATOM 0 HG LEU A 617 13.711 2.268 8.181 1.00 0.00 H new ATOM 0 HD11 LEU A 617 13.591 2.645 5.790 1.00 0.00 H new ATOM 0 HD12 LEU A 617 15.101 1.847 6.291 1.00 0.00 H new ATOM 0 HD13 LEU A 617 13.811 0.901 5.511 1.00 0.00 H new ATOM 0 HD21 LEU A 617 11.525 2.387 7.134 1.00 0.00 H new ATOM 0 HD22 LEU A 617 11.499 0.613 6.996 1.00 0.00 H new ATOM 0 HD23 LEU A 617 11.540 1.380 8.601 1.00 0.00 H new ATOM 1749 N GLU A 618 16.165 -1.410 6.473 1.00 0.00 N ATOM 1750 CA GLU A 618 17.307 -1.377 5.576 1.00 0.00 C ATOM 1751 C GLU A 618 17.032 -2.203 4.313 1.00 0.00 C ATOM 1752 O GLU A 618 17.029 -1.669 3.203 1.00 0.00 O ATOM 1753 CB GLU A 618 18.499 -1.898 6.383 1.00 0.00 C ATOM 1754 CG GLU A 618 19.843 -1.799 5.663 1.00 0.00 C ATOM 1755 CD GLU A 618 20.943 -2.177 6.648 1.00 0.00 C ATOM 1756 OE1 GLU A 618 21.073 -3.383 6.961 1.00 0.00 O ATOM 1757 OE2 GLU A 618 21.627 -1.273 7.184 1.00 0.00 O ATOM 0 H GLU A 618 16.418 -1.673 7.425 1.00 0.00 H new ATOM 0 HA GLU A 618 17.516 -0.369 5.217 1.00 0.00 H new ATOM 0 HB2 GLU A 618 18.560 -1.341 7.318 1.00 0.00 H new ATOM 0 HB3 GLU A 618 18.317 -2.940 6.644 1.00 0.00 H new ATOM 0 HG2 GLU A 618 19.861 -2.464 4.800 1.00 0.00 H new ATOM 0 HG3 GLU A 618 20.000 -0.787 5.289 1.00 0.00 H new ATOM 1764 N GLU A 619 16.772 -3.500 4.483 1.00 0.00 N ATOM 1765 CA GLU A 619 16.559 -4.441 3.388 1.00 0.00 C ATOM 1766 C GLU A 619 15.316 -4.081 2.588 1.00 0.00 C ATOM 1767 O GLU A 619 15.317 -4.191 1.363 1.00 0.00 O ATOM 1768 CB GLU A 619 16.454 -5.872 3.941 1.00 0.00 C ATOM 1769 CG GLU A 619 17.785 -6.237 4.624 1.00 0.00 C ATOM 1770 CD GLU A 619 18.163 -7.706 4.451 1.00 0.00 C ATOM 1771 OE1 GLU A 619 18.437 -8.130 3.305 1.00 0.00 O ATOM 1772 OE2 GLU A 619 18.274 -8.421 5.478 1.00 0.00 O ATOM 0 H GLU A 619 16.703 -3.932 5.404 1.00 0.00 H new ATOM 0 HA GLU A 619 17.413 -4.384 2.713 1.00 0.00 H new ATOM 0 HB2 GLU A 619 15.632 -5.942 4.654 1.00 0.00 H new ATOM 0 HB3 GLU A 619 16.238 -6.573 3.135 1.00 0.00 H new ATOM 0 HG2 GLU A 619 18.580 -5.613 4.215 1.00 0.00 H new ATOM 0 HG3 GLU A 619 17.716 -6.009 5.688 1.00 0.00 H new ATOM 1779 N ALA A 620 14.271 -3.635 3.280 1.00 0.00 N ATOM 1780 CA ALA A 620 12.987 -3.286 2.713 1.00 0.00 C ATOM 1781 C ALA A 620 13.099 -2.067 1.803 1.00 0.00 C ATOM 1782 O ALA A 620 12.642 -2.097 0.664 1.00 0.00 O ATOM 1783 CB ALA A 620 12.040 -3.022 3.882 1.00 0.00 C ATOM 0 H ALA A 620 14.305 -3.504 4.291 1.00 0.00 H new ATOM 0 HA ALA A 620 12.608 -4.097 2.091 1.00 0.00 H new ATOM 0 HB1 ALA A 620 11.055 -2.754 3.499 1.00 0.00 H new ATOM 0 HB2 ALA A 620 11.959 -3.920 4.495 1.00 0.00 H new ATOM 0 HB3 ALA A 620 12.429 -2.203 4.488 1.00 0.00 H new ATOM 1789 N ALA A 621 13.720 -0.997 2.299 1.00 0.00 N ATOM 1790 CA ALA A 621 14.041 0.207 1.556 1.00 0.00 C ATOM 1791 C ALA A 621 14.932 -0.143 0.366 1.00 0.00 C ATOM 1792 O ALA A 621 14.616 0.255 -0.749 1.00 0.00 O ATOM 1793 CB ALA A 621 14.751 1.185 2.500 1.00 0.00 C ATOM 0 H ALA A 621 14.023 -0.950 3.272 1.00 0.00 H new ATOM 0 HA ALA A 621 13.132 0.671 1.172 1.00 0.00 H new ATOM 0 HB1 ALA A 621 15.000 2.097 1.958 1.00 0.00 H new ATOM 0 HB2 ALA A 621 14.093 1.427 3.335 1.00 0.00 H new ATOM 0 HB3 ALA A 621 15.665 0.727 2.879 1.00 0.00 H new ATOM 1799 N ARG A 622 16.018 -0.901 0.566 1.00 0.00 N ATOM 1800 CA ARG A 622 16.917 -1.302 -0.523 1.00 0.00 C ATOM 1801 C ARG A 622 16.145 -2.040 -1.614 1.00 0.00 C ATOM 1802 O ARG A 622 16.261 -1.660 -2.777 1.00 0.00 O ATOM 1803 CB ARG A 622 18.082 -2.135 0.017 1.00 0.00 C ATOM 1804 CG ARG A 622 19.098 -1.231 0.739 1.00 0.00 C ATOM 1805 CD ARG A 622 19.719 -1.918 1.958 1.00 0.00 C ATOM 1806 NE ARG A 622 21.167 -2.108 1.858 1.00 0.00 N ATOM 1807 CZ ARG A 622 21.817 -3.082 1.217 1.00 0.00 C ATOM 1808 NH1 ARG A 622 21.183 -3.902 0.373 1.00 0.00 N ATOM 1809 NH2 ARG A 622 23.122 -3.210 1.402 1.00 0.00 N ATOM 0 H ARG A 622 16.297 -1.252 1.482 1.00 0.00 H new ATOM 0 HA ARG A 622 17.341 -0.405 -0.975 1.00 0.00 H new ATOM 0 HB2 ARG A 622 17.707 -2.893 0.704 1.00 0.00 H new ATOM 0 HB3 ARG A 622 18.572 -2.661 -0.802 1.00 0.00 H new ATOM 0 HG2 ARG A 622 19.887 -0.946 0.043 1.00 0.00 H new ATOM 0 HG3 ARG A 622 18.604 -0.312 1.054 1.00 0.00 H new ATOM 0 HD2 ARG A 622 19.501 -1.326 2.847 1.00 0.00 H new ATOM 0 HD3 ARG A 622 19.244 -2.889 2.097 1.00 0.00 H new ATOM 0 HE ARG A 622 21.746 -1.416 2.333 1.00 0.00 H new ATOM 0 HH11 ARG A 622 20.183 -3.790 0.208 1.00 0.00 H new ATOM 0 HH12 ARG A 622 21.700 -4.640 -0.106 1.00 0.00 H new ATOM 0 HH21 ARG A 622 23.614 -2.570 2.026 1.00 0.00 H new ATOM 0 HH22 ARG A 622 23.635 -3.948 0.921 1.00 0.00 H new ATOM 1823 N CYS A 623 15.320 -3.022 -1.241 1.00 0.00 N ATOM 1824 CA CYS A 623 14.378 -3.688 -2.131 1.00 0.00 C ATOM 1825 C CYS A 623 13.530 -2.670 -2.884 1.00 0.00 C ATOM 1826 O CYS A 623 13.414 -2.748 -4.106 1.00 0.00 O ATOM 1827 CB CYS A 623 13.521 -4.687 -1.333 1.00 0.00 C ATOM 1828 SG CYS A 623 14.239 -6.336 -1.520 1.00 0.00 S ATOM 0 H CYS A 623 15.292 -3.382 -0.287 1.00 0.00 H new ATOM 0 HA CYS A 623 14.930 -4.252 -2.883 1.00 0.00 H new ATOM 0 HB2 CYS A 623 13.491 -4.404 -0.281 1.00 0.00 H new ATOM 0 HB3 CYS A 623 12.493 -4.678 -1.695 1.00 0.00 H new ATOM 0 HG CYS A 623 13.309 -7.178 -1.862 1.00 0.00 H new ATOM 1834 N MET A 624 12.945 -1.706 -2.178 1.00 0.00 N ATOM 1835 CA MET A 624 12.050 -0.742 -2.788 1.00 0.00 C ATOM 1836 C MET A 624 12.730 0.117 -3.852 1.00 0.00 C ATOM 1837 O MET A 624 12.093 0.399 -4.862 1.00 0.00 O ATOM 1838 CB MET A 624 11.328 0.071 -1.714 1.00 0.00 C ATOM 1839 CG MET A 624 11.791 1.505 -1.469 1.00 0.00 C ATOM 1840 SD MET A 624 10.872 2.795 -2.363 1.00 0.00 S ATOM 1841 CE MET A 624 9.184 2.414 -1.809 1.00 0.00 C ATOM 0 H MET A 624 13.080 -1.576 -1.175 1.00 0.00 H new ATOM 0 HA MET A 624 11.289 -1.296 -3.338 1.00 0.00 H new ATOM 0 HB2 MET A 624 10.270 0.101 -1.973 1.00 0.00 H new ATOM 0 HB3 MET A 624 11.410 -0.472 -0.772 1.00 0.00 H new ATOM 0 HG2 MET A 624 11.724 1.711 -0.401 1.00 0.00 H new ATOM 0 HG3 MET A 624 12.844 1.579 -1.742 1.00 0.00 H new ATOM 0 HE1 MET A 624 8.547 3.286 -1.958 1.00 0.00 H new ATOM 0 HE2 MET A 624 8.793 1.576 -2.385 1.00 0.00 H new ATOM 0 HE3 MET A 624 9.199 2.152 -0.751 1.00 0.00 H new ATOM 1851 N ARG A 625 14.013 0.478 -3.700 1.00 0.00 N ATOM 1852 CA ARG A 625 14.741 1.222 -4.727 1.00 0.00 C ATOM 1853 C ARG A 625 14.697 0.527 -6.083 1.00 0.00 C ATOM 1854 O ARG A 625 14.745 1.192 -7.122 1.00 0.00 O ATOM 1855 CB ARG A 625 16.208 1.387 -4.317 1.00 0.00 C ATOM 1856 CG ARG A 625 16.390 2.171 -3.009 1.00 0.00 C ATOM 1857 CD ARG A 625 17.850 2.482 -2.678 1.00 0.00 C ATOM 1858 NE ARG A 625 18.767 1.391 -3.043 1.00 0.00 N ATOM 1859 CZ ARG A 625 20.102 1.458 -3.048 1.00 0.00 C ATOM 1860 NH1 ARG A 625 20.753 2.511 -2.565 1.00 0.00 N ATOM 1861 NH2 ARG A 625 20.783 0.451 -3.577 1.00 0.00 N ATOM 0 H ARG A 625 14.566 0.263 -2.870 1.00 0.00 H new ATOM 0 HA ARG A 625 14.253 2.192 -4.818 1.00 0.00 H new ATOM 0 HB2 ARG A 625 16.660 0.401 -4.207 1.00 0.00 H new ATOM 0 HB3 ARG A 625 16.746 1.897 -5.116 1.00 0.00 H new ATOM 0 HG2 ARG A 625 15.834 3.106 -3.076 1.00 0.00 H new ATOM 0 HG3 ARG A 625 15.954 1.600 -2.189 1.00 0.00 H new ATOM 0 HD2 ARG A 625 18.149 3.391 -3.200 1.00 0.00 H new ATOM 0 HD3 ARG A 625 17.940 2.683 -1.610 1.00 0.00 H new ATOM 0 HE ARG A 625 18.346 0.503 -3.317 1.00 0.00 H new ATOM 0 HH11 ARG A 625 20.233 3.298 -2.176 1.00 0.00 H new ATOM 0 HH12 ARG A 625 21.773 2.532 -2.583 1.00 0.00 H new ATOM 0 HH21 ARG A 625 20.287 -0.350 -3.968 1.00 0.00 H new ATOM 0 HH22 ARG A 625 21.803 0.478 -3.593 1.00 0.00 H new ATOM 1875 N SER A 626 14.650 -0.802 -6.101 1.00 0.00 N ATOM 1876 CA SER A 626 14.630 -1.592 -7.320 1.00 0.00 C ATOM 1877 C SER A 626 13.288 -1.492 -8.063 1.00 0.00 C ATOM 1878 O SER A 626 13.203 -1.926 -9.213 1.00 0.00 O ATOM 1879 CB SER A 626 14.970 -3.037 -6.947 1.00 0.00 C ATOM 1880 OG SER A 626 16.142 -3.074 -6.144 1.00 0.00 O ATOM 0 H SER A 626 14.624 -1.366 -5.252 1.00 0.00 H new ATOM 0 HA SER A 626 15.371 -1.202 -8.017 1.00 0.00 H new ATOM 0 HB2 SER A 626 14.136 -3.487 -6.408 1.00 0.00 H new ATOM 0 HB3 SER A 626 15.121 -3.628 -7.851 1.00 0.00 H new ATOM 0 HG SER A 626 16.349 -4.003 -5.910 1.00 0.00 H new ATOM 1886 N LEU A 627 12.235 -0.934 -7.453 1.00 0.00 N ATOM 1887 CA LEU A 627 10.939 -0.724 -8.090 1.00 0.00 C ATOM 1888 C LEU A 627 11.076 0.279 -9.229 1.00 0.00 C ATOM 1889 O LEU A 627 11.744 1.308 -9.113 1.00 0.00 O ATOM 1890 CB LEU A 627 9.939 -0.216 -7.034 1.00 0.00 C ATOM 1891 CG LEU A 627 8.522 0.095 -7.548 1.00 0.00 C ATOM 1892 CD1 LEU A 627 7.750 -1.162 -7.955 1.00 0.00 C ATOM 1893 CD2 LEU A 627 7.723 0.841 -6.477 1.00 0.00 C ATOM 0 H LEU A 627 12.265 -0.612 -6.486 1.00 0.00 H new ATOM 0 HA LEU A 627 10.573 -1.663 -8.506 1.00 0.00 H new ATOM 0 HB2 LEU A 627 9.863 -0.963 -6.244 1.00 0.00 H new ATOM 0 HB3 LEU A 627 10.347 0.687 -6.580 1.00 0.00 H new ATOM 0 HG LEU A 627 8.645 0.715 -8.436 1.00 0.00 H new ATOM 0 HD11 LEU A 627 6.758 -0.881 -8.309 1.00 0.00 H new ATOM 0 HD12 LEU A 627 8.287 -1.677 -8.751 1.00 0.00 H new ATOM 0 HD13 LEU A 627 7.654 -1.824 -7.095 1.00 0.00 H new ATOM 0 HD21 LEU A 627 6.722 1.055 -6.853 1.00 0.00 H new ATOM 0 HD22 LEU A 627 7.650 0.224 -5.582 1.00 0.00 H new ATOM 0 HD23 LEU A 627 8.227 1.776 -6.233 1.00 0.00 H new ATOM 1905 N LYS A 628 10.401 -0.013 -10.334 1.00 0.00 N ATOM 1906 CA LYS A 628 10.463 0.734 -11.584 1.00 0.00 C ATOM 1907 C LYS A 628 9.190 1.564 -11.766 1.00 0.00 C ATOM 1908 O LYS A 628 8.719 1.726 -12.890 1.00 0.00 O ATOM 1909 CB LYS A 628 10.691 -0.283 -12.718 1.00 0.00 C ATOM 1910 CG LYS A 628 11.867 -1.263 -12.492 1.00 0.00 C ATOM 1911 CD LYS A 628 13.247 -0.700 -12.854 1.00 0.00 C ATOM 1912 CE LYS A 628 13.774 0.317 -11.828 1.00 0.00 C ATOM 1913 NZ LYS A 628 14.355 1.512 -12.478 1.00 0.00 N ATOM 0 H LYS A 628 9.768 -0.811 -10.385 1.00 0.00 H new ATOM 0 HA LYS A 628 11.286 1.449 -11.587 1.00 0.00 H new ATOM 0 HB2 LYS A 628 9.777 -0.861 -12.856 1.00 0.00 H new ATOM 0 HB3 LYS A 628 10.866 0.263 -13.645 1.00 0.00 H new ATOM 0 HG2 LYS A 628 11.876 -1.564 -11.444 1.00 0.00 H new ATOM 0 HG3 LYS A 628 11.691 -2.163 -13.081 1.00 0.00 H new ATOM 0 HD2 LYS A 628 13.957 -1.523 -12.938 1.00 0.00 H new ATOM 0 HD3 LYS A 628 13.193 -0.224 -13.833 1.00 0.00 H new ATOM 0 HE2 LYS A 628 12.961 0.622 -11.170 1.00 0.00 H new ATOM 0 HE3 LYS A 628 14.529 -0.158 -11.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 628 14.698 2.171 -11.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 628 15.148 1.225 -13.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 628 13.628 1.981 -13.055 1.00 0.00 H new ATOM 1927 N ALA A 629 8.593 2.029 -10.669 1.00 0.00 N ATOM 1928 CA ALA A 629 7.377 2.823 -10.662 1.00 0.00 C ATOM 1929 C ALA A 629 7.349 3.744 -9.433 1.00 0.00 C ATOM 1930 O ALA A 629 8.067 3.473 -8.463 1.00 0.00 O ATOM 1931 CB ALA A 629 6.182 1.873 -10.633 1.00 0.00 C ATOM 0 H ALA A 629 8.959 1.855 -9.733 1.00 0.00 H new ATOM 0 HA ALA A 629 7.337 3.447 -11.555 1.00 0.00 H new ATOM 0 HB1 ALA A 629 5.258 2.451 -10.627 1.00 0.00 H new ATOM 0 HB2 ALA A 629 6.204 1.233 -11.515 1.00 0.00 H new ATOM 0 HB3 ALA A 629 6.229 1.256 -9.736 1.00 0.00 H new ATOM 1937 N PRO A 630 6.513 4.799 -9.426 1.00 0.00 N ATOM 1938 CA PRO A 630 6.340 5.680 -8.279 1.00 0.00 C ATOM 1939 C PRO A 630 5.626 4.974 -7.125 1.00 0.00 C ATOM 1940 O PRO A 630 4.735 4.147 -7.334 1.00 0.00 O ATOM 1941 CB PRO A 630 5.507 6.870 -8.783 1.00 0.00 C ATOM 1942 CG PRO A 630 5.398 6.696 -10.293 1.00 0.00 C ATOM 1943 CD PRO A 630 5.640 5.212 -10.511 1.00 0.00 C ATOM 0 HA PRO A 630 7.306 5.998 -7.887 1.00 0.00 H new ATOM 0 HB2 PRO A 630 4.521 6.880 -8.319 1.00 0.00 H new ATOM 0 HB3 PRO A 630 5.987 7.816 -8.533 1.00 0.00 H new ATOM 0 HG2 PRO A 630 4.417 6.998 -10.660 1.00 0.00 H new ATOM 0 HG3 PRO A 630 6.136 7.302 -10.819 1.00 0.00 H new ATOM 0 HD2 PRO A 630 4.703 4.655 -10.495 1.00 0.00 H new ATOM 0 HD3 PRO A 630 6.104 5.028 -11.480 1.00 0.00 H new ATOM 1951 N ALA A 631 5.977 5.347 -5.893 1.00 0.00 N ATOM 1952 CA ALA A 631 5.422 4.784 -4.676 1.00 0.00 C ATOM 1953 C ALA A 631 5.513 5.818 -3.554 1.00 0.00 C ATOM 1954 O ALA A 631 6.615 6.202 -3.153 1.00 0.00 O ATOM 1955 CB ALA A 631 6.204 3.519 -4.315 1.00 0.00 C ATOM 0 H ALA A 631 6.675 6.070 -5.717 1.00 0.00 H new ATOM 0 HA ALA A 631 4.374 4.522 -4.820 1.00 0.00 H new ATOM 0 HB1 ALA A 631 5.795 3.087 -3.401 1.00 0.00 H new ATOM 0 HB2 ALA A 631 6.121 2.796 -5.127 1.00 0.00 H new ATOM 0 HB3 ALA A 631 7.253 3.772 -4.159 1.00 0.00 H new ATOM 1961 N VAL A 632 4.370 6.287 -3.058 1.00 0.00 N ATOM 1962 CA VAL A 632 4.300 6.933 -1.747 1.00 0.00 C ATOM 1963 C VAL A 632 4.616 5.860 -0.690 1.00 0.00 C ATOM 1964 O VAL A 632 4.238 4.697 -0.877 1.00 0.00 O ATOM 1965 CB VAL A 632 2.906 7.558 -1.536 1.00 0.00 C ATOM 1966 CG1 VAL A 632 2.732 8.224 -0.164 1.00 0.00 C ATOM 1967 CG2 VAL A 632 2.561 8.617 -2.584 1.00 0.00 C ATOM 0 H VAL A 632 3.476 6.232 -3.546 1.00 0.00 H new ATOM 0 HA VAL A 632 5.021 7.746 -1.667 1.00 0.00 H new ATOM 0 HB VAL A 632 2.236 6.703 -1.621 1.00 0.00 H new ATOM 0 HG11 VAL A 632 1.728 8.641 -0.087 1.00 0.00 H new ATOM 0 HG12 VAL A 632 2.878 7.483 0.622 1.00 0.00 H new ATOM 0 HG13 VAL A 632 3.466 9.022 -0.051 1.00 0.00 H new ATOM 0 HG21 VAL A 632 1.568 9.019 -2.382 1.00 0.00 H new ATOM 0 HG22 VAL A 632 3.294 9.422 -2.542 1.00 0.00 H new ATOM 0 HG23 VAL A 632 2.574 8.165 -3.576 1.00 0.00 H new ATOM 1977 N VAL A 633 5.263 6.240 0.417 1.00 0.00 N ATOM 1978 CA VAL A 633 5.691 5.325 1.473 1.00 0.00 C ATOM 1979 C VAL A 633 5.254 5.824 2.840 1.00 0.00 C ATOM 1980 O VAL A 633 5.378 7.009 3.127 1.00 0.00 O ATOM 1981 CB VAL A 633 7.201 5.062 1.410 1.00 0.00 C ATOM 1982 CG1 VAL A 633 7.592 4.000 2.450 1.00 0.00 C ATOM 1983 CG2 VAL A 633 7.635 4.571 0.032 1.00 0.00 C ATOM 0 H VAL A 633 5.507 7.212 0.605 1.00 0.00 H new ATOM 0 HA VAL A 633 5.197 4.368 1.307 1.00 0.00 H new ATOM 0 HB VAL A 633 7.702 6.008 1.618 1.00 0.00 H new ATOM 0 HG11 VAL A 633 8.666 3.819 2.399 1.00 0.00 H new ATOM 0 HG12 VAL A 633 7.331 4.354 3.447 1.00 0.00 H new ATOM 0 HG13 VAL A 633 7.057 3.073 2.242 1.00 0.00 H new ATOM 0 HG21 VAL A 633 8.711 4.397 0.030 1.00 0.00 H new ATOM 0 HG22 VAL A 633 7.116 3.642 -0.203 1.00 0.00 H new ATOM 0 HG23 VAL A 633 7.388 5.324 -0.717 1.00 0.00 H new ATOM 1993 N SER A 634 4.824 4.909 3.707 1.00 0.00 N ATOM 1994 CA SER A 634 4.490 5.163 5.090 1.00 0.00 C ATOM 1995 C SER A 634 5.396 4.309 5.968 1.00 0.00 C ATOM 1996 O SER A 634 5.811 3.215 5.578 1.00 0.00 O ATOM 1997 CB SER A 634 3.010 4.818 5.236 1.00 0.00 C ATOM 1998 OG SER A 634 2.637 4.293 6.497 1.00 0.00 O ATOM 0 H SER A 634 4.697 3.932 3.445 1.00 0.00 H new ATOM 0 HA SER A 634 4.644 6.198 5.396 1.00 0.00 H new ATOM 0 HB2 SER A 634 2.423 5.717 5.046 1.00 0.00 H new ATOM 0 HB3 SER A 634 2.744 4.094 4.465 1.00 0.00 H new ATOM 0 HG SER A 634 2.789 4.969 7.191 1.00 0.00 H new ATOM 2004 N VAL A 635 5.633 4.795 7.183 1.00 0.00 N ATOM 2005 CA VAL A 635 6.212 4.052 8.288 1.00 0.00 C ATOM 2006 C VAL A 635 5.414 4.439 9.531 1.00 0.00 C ATOM 2007 O VAL A 635 4.970 5.584 9.636 1.00 0.00 O ATOM 2008 CB VAL A 635 7.716 4.367 8.445 1.00 0.00 C ATOM 2009 CG1 VAL A 635 8.576 3.454 7.570 1.00 0.00 C ATOM 2010 CG2 VAL A 635 8.081 5.823 8.121 1.00 0.00 C ATOM 0 H VAL A 635 5.416 5.760 7.431 1.00 0.00 H new ATOM 0 HA VAL A 635 6.154 2.977 8.116 1.00 0.00 H new ATOM 0 HB VAL A 635 7.923 4.191 9.501 1.00 0.00 H new ATOM 0 HG11 VAL A 635 9.628 3.705 7.707 1.00 0.00 H new ATOM 0 HG12 VAL A 635 8.410 2.415 7.855 1.00 0.00 H new ATOM 0 HG13 VAL A 635 8.303 3.591 6.524 1.00 0.00 H new ATOM 0 HG21 VAL A 635 9.153 5.968 8.254 1.00 0.00 H new ATOM 0 HG22 VAL A 635 7.810 6.045 7.089 1.00 0.00 H new ATOM 0 HG23 VAL A 635 7.539 6.491 8.790 1.00 0.00 H new ATOM 2020 N SER A 636 5.227 3.526 10.484 1.00 0.00 N ATOM 2021 CA SER A 636 4.429 3.793 11.679 1.00 0.00 C ATOM 2022 C SER A 636 5.150 4.669 12.719 1.00 0.00 C ATOM 2023 O SER A 636 4.574 4.941 13.775 1.00 0.00 O ATOM 2024 CB SER A 636 3.925 2.469 12.266 1.00 0.00 C ATOM 2025 OG SER A 636 4.963 1.526 12.460 1.00 0.00 O ATOM 0 H SER A 636 5.622 2.586 10.450 1.00 0.00 H new ATOM 0 HA SER A 636 3.569 4.391 11.377 1.00 0.00 H new ATOM 0 HB2 SER A 636 3.433 2.663 13.219 1.00 0.00 H new ATOM 0 HB3 SER A 636 3.174 2.044 11.600 1.00 0.00 H new ATOM 0 HG SER A 636 4.590 0.702 12.837 1.00 0.00 H new ATOM 2031 N SER A 637 6.376 5.136 12.448 1.00 0.00 N ATOM 2032 CA SER A 637 7.071 6.121 13.274 1.00 0.00 C ATOM 2033 C SER A 637 7.502 7.326 12.440 1.00 0.00 C ATOM 2034 O SER A 637 7.751 7.170 11.242 1.00 0.00 O ATOM 2035 CB SER A 637 8.296 5.485 13.926 1.00 0.00 C ATOM 2036 OG SER A 637 7.935 4.681 15.037 1.00 0.00 O ATOM 0 H SER A 637 6.916 4.834 11.637 1.00 0.00 H new ATOM 0 HA SER A 637 6.383 6.462 14.047 1.00 0.00 H new ATOM 0 HB2 SER A 637 8.825 4.877 13.192 1.00 0.00 H new ATOM 0 HB3 SER A 637 8.984 6.266 14.249 1.00 0.00 H new ATOM 0 HG SER A 637 8.741 4.287 15.431 1.00 0.00 H new ATOM 2042 N PRO A 638 7.623 8.521 13.044 1.00 0.00 N ATOM 2043 CA PRO A 638 8.091 9.707 12.345 1.00 0.00 C ATOM 2044 C PRO A 638 9.600 9.625 12.121 1.00 0.00 C ATOM 2045 O PRO A 638 10.066 9.858 11.014 1.00 0.00 O ATOM 2046 CB PRO A 638 7.684 10.882 13.234 1.00 0.00 C ATOM 2047 CG PRO A 638 7.675 10.299 14.647 1.00 0.00 C ATOM 2048 CD PRO A 638 7.281 8.838 14.426 1.00 0.00 C ATOM 0 HA PRO A 638 7.657 9.816 11.351 1.00 0.00 H new ATOM 0 HB2 PRO A 638 8.389 11.709 13.149 1.00 0.00 H new ATOM 0 HB3 PRO A 638 6.704 11.270 12.957 1.00 0.00 H new ATOM 0 HG2 PRO A 638 8.652 10.384 15.123 1.00 0.00 H new ATOM 0 HG3 PRO A 638 6.961 10.815 15.290 1.00 0.00 H new ATOM 0 HD2 PRO A 638 7.813 8.184 15.117 1.00 0.00 H new ATOM 0 HD3 PRO A 638 6.216 8.692 14.605 1.00 0.00 H new ATOM 2056 N ASP A 639 10.383 9.210 13.120 1.00 0.00 N ATOM 2057 CA ASP A 639 11.850 9.194 13.027 1.00 0.00 C ATOM 2058 C ASP A 639 12.370 8.187 12.000 1.00 0.00 C ATOM 2059 O ASP A 639 13.463 8.303 11.459 1.00 0.00 O ATOM 2060 CB ASP A 639 12.447 8.859 14.394 1.00 0.00 C ATOM 2061 CG ASP A 639 13.828 9.488 14.499 1.00 0.00 C ATOM 2062 OD1 ASP A 639 13.883 10.733 14.647 1.00 0.00 O ATOM 2063 OD2 ASP A 639 14.847 8.772 14.455 1.00 0.00 O ATOM 0 H ASP A 639 10.022 8.876 14.014 1.00 0.00 H new ATOM 0 HA ASP A 639 12.157 10.187 12.699 1.00 0.00 H new ATOM 0 HB2 ASP A 639 11.802 9.233 15.189 1.00 0.00 H new ATOM 0 HB3 ASP A 639 12.515 7.779 14.521 1.00 0.00 H new ATOM 2068 N ALA A 640 11.522 7.218 11.683 1.00 0.00 N ATOM 2069 CA ALA A 640 11.749 6.210 10.670 1.00 0.00 C ATOM 2070 C ALA A 640 11.716 6.856 9.295 1.00 0.00 C ATOM 2071 O ALA A 640 12.476 6.428 8.446 1.00 0.00 O ATOM 2072 CB ALA A 640 10.702 5.103 10.792 1.00 0.00 C ATOM 0 H ALA A 640 10.620 7.113 12.148 1.00 0.00 H new ATOM 0 HA ALA A 640 12.731 5.758 10.812 1.00 0.00 H new ATOM 0 HB1 ALA A 640 10.880 4.348 10.026 1.00 0.00 H new ATOM 0 HB2 ALA A 640 10.772 4.643 11.778 1.00 0.00 H new ATOM 0 HB3 ALA A 640 9.707 5.527 10.659 1.00 0.00 H new ATOM 2078 N VAL A 641 10.908 7.897 9.064 1.00 0.00 N ATOM 2079 CA VAL A 641 10.875 8.622 7.794 1.00 0.00 C ATOM 2080 C VAL A 641 12.272 9.195 7.503 1.00 0.00 C ATOM 2081 O VAL A 641 12.733 9.148 6.360 1.00 0.00 O ATOM 2082 CB VAL A 641 9.792 9.726 7.854 1.00 0.00 C ATOM 2083 CG1 VAL A 641 9.691 10.523 6.553 1.00 0.00 C ATOM 2084 CG2 VAL A 641 8.388 9.184 8.158 1.00 0.00 C ATOM 0 H VAL A 641 10.256 8.260 9.759 1.00 0.00 H new ATOM 0 HA VAL A 641 10.612 7.950 6.977 1.00 0.00 H new ATOM 0 HB VAL A 641 10.123 10.369 8.670 1.00 0.00 H new ATOM 0 HG11 VAL A 641 8.916 11.283 6.651 1.00 0.00 H new ATOM 0 HG12 VAL A 641 10.647 11.004 6.346 1.00 0.00 H new ATOM 0 HG13 VAL A 641 9.438 9.851 5.733 1.00 0.00 H new ATOM 0 HG21 VAL A 641 7.677 10.010 8.186 1.00 0.00 H new ATOM 0 HG22 VAL A 641 8.094 8.478 7.381 1.00 0.00 H new ATOM 0 HG23 VAL A 641 8.394 8.678 9.124 1.00 0.00 H new ATOM 2094 N THR A 642 12.964 9.677 8.541 1.00 0.00 N ATOM 2095 CA THR A 642 14.305 10.212 8.455 1.00 0.00 C ATOM 2096 C THR A 642 15.258 9.080 8.087 1.00 0.00 C ATOM 2097 O THR A 642 15.998 9.245 7.115 1.00 0.00 O ATOM 2098 CB THR A 642 14.644 10.871 9.809 1.00 0.00 C ATOM 2099 OG1 THR A 642 14.023 12.137 9.910 1.00 0.00 O ATOM 2100 CG2 THR A 642 16.145 11.093 10.033 1.00 0.00 C ATOM 0 H THR A 642 12.585 9.701 9.488 1.00 0.00 H new ATOM 0 HA THR A 642 14.397 10.974 7.681 1.00 0.00 H new ATOM 0 HB THR A 642 14.279 10.172 10.561 1.00 0.00 H new ATOM 0 HG1 THR A 642 14.245 12.542 10.774 1.00 0.00 H new ATOM 0 HG21 THR A 642 16.303 11.560 11.005 1.00 0.00 H new ATOM 0 HG22 THR A 642 16.663 10.135 10.002 1.00 0.00 H new ATOM 0 HG23 THR A 642 16.537 11.743 9.251 1.00 0.00 H new ATOM 2108 N THR A 643 15.232 7.955 8.821 1.00 0.00 N ATOM 2109 CA THR A 643 16.116 6.833 8.529 1.00 0.00 C ATOM 2110 C THR A 643 15.914 6.381 7.085 1.00 0.00 C ATOM 2111 O THR A 643 16.853 6.128 6.336 1.00 0.00 O ATOM 2112 CB THR A 643 15.849 5.621 9.448 1.00 0.00 C ATOM 2113 OG1 THR A 643 15.131 5.917 10.630 1.00 0.00 O ATOM 2114 CG2 THR A 643 17.171 4.957 9.827 1.00 0.00 C ATOM 0 H THR A 643 14.609 7.806 9.615 1.00 0.00 H new ATOM 0 HA THR A 643 17.135 7.181 8.697 1.00 0.00 H new ATOM 0 HB THR A 643 15.215 4.953 8.864 1.00 0.00 H new ATOM 0 HG1 THR A 643 15.005 5.096 11.150 1.00 0.00 H new ATOM 0 HG21 THR A 643 16.976 4.103 10.475 1.00 0.00 H new ATOM 0 HG22 THR A 643 17.680 4.619 8.925 1.00 0.00 H new ATOM 0 HG23 THR A 643 17.801 5.675 10.352 1.00 0.00 H new ATOM 2122 N TYR A 644 14.641 6.271 6.723 1.00 0.00 N ATOM 2123 CA TYR A 644 14.151 5.681 5.511 1.00 0.00 C ATOM 2124 C TYR A 644 14.704 6.404 4.297 1.00 0.00 C ATOM 2125 O TYR A 644 15.315 5.772 3.437 1.00 0.00 O ATOM 2126 CB TYR A 644 12.625 5.623 5.573 1.00 0.00 C ATOM 2127 CG TYR A 644 12.043 4.838 4.448 1.00 0.00 C ATOM 2128 CD1 TYR A 644 11.753 5.427 3.208 1.00 0.00 C ATOM 2129 CD2 TYR A 644 11.875 3.469 4.654 1.00 0.00 C ATOM 2130 CE1 TYR A 644 11.257 4.626 2.173 1.00 0.00 C ATOM 2131 CE2 TYR A 644 11.468 2.646 3.603 1.00 0.00 C ATOM 2132 CZ TYR A 644 11.124 3.235 2.368 1.00 0.00 C ATOM 2133 OH TYR A 644 10.583 2.483 1.384 1.00 0.00 O ATOM 0 H TYR A 644 13.886 6.618 7.315 1.00 0.00 H new ATOM 0 HA TYR A 644 14.504 4.655 5.408 1.00 0.00 H new ATOM 0 HB2 TYR A 644 12.319 5.179 6.520 1.00 0.00 H new ATOM 0 HB3 TYR A 644 12.224 6.636 5.552 1.00 0.00 H new ATOM 0 HD1 TYR A 644 11.910 6.484 3.054 1.00 0.00 H new ATOM 0 HD2 TYR A 644 12.060 3.045 5.630 1.00 0.00 H new ATOM 0 HE1 TYR A 644 10.977 5.071 1.229 1.00 0.00 H new ATOM 0 HE2 TYR A 644 11.417 1.575 3.733 1.00 0.00 H new ATOM 0 HH TYR A 644 10.448 3.036 0.586 1.00 0.00 H new ATOM 2143 N ASN A 645 14.541 7.727 4.260 1.00 0.00 N ATOM 2144 CA ASN A 645 15.111 8.570 3.228 1.00 0.00 C ATOM 2145 C ASN A 645 16.618 8.380 3.132 1.00 0.00 C ATOM 2146 O ASN A 645 17.144 8.252 2.031 1.00 0.00 O ATOM 2147 CB ASN A 645 14.776 10.034 3.543 1.00 0.00 C ATOM 2148 CG ASN A 645 14.146 10.651 2.319 1.00 0.00 C ATOM 2149 OD1 ASN A 645 14.754 10.799 1.269 1.00 0.00 O ATOM 2150 ND2 ASN A 645 12.862 10.929 2.404 1.00 0.00 N ATOM 0 H ASN A 645 14.002 8.242 4.957 1.00 0.00 H new ATOM 0 HA ASN A 645 14.684 8.291 2.265 1.00 0.00 H new ATOM 0 HB2 ASN A 645 14.094 10.093 4.391 1.00 0.00 H new ATOM 0 HB3 ASN A 645 15.678 10.579 3.821 1.00 0.00 H new ATOM 0 HD21 ASN A 645 12.360 11.274 1.586 1.00 0.00 H new ATOM 0 HD22 ASN A 645 12.370 10.800 3.288 1.00 0.00 H new ATOM 2157 N GLY A 646 17.291 8.276 4.279 1.00 0.00 N ATOM 2158 CA GLY A 646 18.713 7.996 4.392 1.00 0.00 C ATOM 2159 C GLY A 646 19.125 6.763 3.589 1.00 0.00 C ATOM 2160 O GLY A 646 20.101 6.806 2.839 1.00 0.00 O ATOM 0 H GLY A 646 16.838 8.390 5.186 1.00 0.00 H new ATOM 0 HA2 GLY A 646 19.280 8.860 4.045 1.00 0.00 H new ATOM 0 HA3 GLY A 646 18.970 7.847 5.441 1.00 0.00 H new ATOM 2164 N TYR A 647 18.364 5.667 3.672 1.00 0.00 N ATOM 2165 CA TYR A 647 18.656 4.472 2.883 1.00 0.00 C ATOM 2166 C TYR A 647 18.424 4.722 1.384 1.00 0.00 C ATOM 2167 O TYR A 647 19.130 4.140 0.559 1.00 0.00 O ATOM 2168 CB TYR A 647 17.811 3.280 3.356 1.00 0.00 C ATOM 2169 CG TYR A 647 18.015 2.864 4.804 1.00 0.00 C ATOM 2170 CD1 TYR A 647 19.212 2.260 5.227 1.00 0.00 C ATOM 2171 CD2 TYR A 647 16.978 3.037 5.733 1.00 0.00 C ATOM 2172 CE1 TYR A 647 19.341 1.800 6.552 1.00 0.00 C ATOM 2173 CE2 TYR A 647 17.104 2.616 7.061 1.00 0.00 C ATOM 2174 CZ TYR A 647 18.283 1.965 7.473 1.00 0.00 C ATOM 2175 OH TYR A 647 18.364 1.469 8.738 1.00 0.00 O ATOM 0 H TYR A 647 17.546 5.585 4.275 1.00 0.00 H new ATOM 0 HA TYR A 647 19.709 4.233 3.032 1.00 0.00 H new ATOM 0 HB2 TYR A 647 16.758 3.524 3.211 1.00 0.00 H new ATOM 0 HB3 TYR A 647 18.031 2.425 2.717 1.00 0.00 H new ATOM 0 HD1 TYR A 647 20.034 2.149 4.535 1.00 0.00 H new ATOM 0 HD2 TYR A 647 16.059 3.507 5.415 1.00 0.00 H new ATOM 0 HE1 TYR A 647 20.255 1.318 6.866 1.00 0.00 H new ATOM 0 HE2 TYR A 647 16.303 2.789 7.765 1.00 0.00 H new ATOM 0 HH TYR A 647 17.541 1.681 9.226 1.00 0.00 H new ATOM 2185 N LEU A 648 17.446 5.564 1.015 1.00 0.00 N ATOM 2186 CA LEU A 648 17.064 5.813 -0.386 1.00 0.00 C ATOM 2187 C LEU A 648 17.952 6.855 -1.076 1.00 0.00 C ATOM 2188 O LEU A 648 17.896 6.990 -2.303 1.00 0.00 O ATOM 2189 CB LEU A 648 15.607 6.300 -0.501 1.00 0.00 C ATOM 2190 CG LEU A 648 14.495 5.409 0.078 1.00 0.00 C ATOM 2191 CD1 LEU A 648 13.180 5.632 -0.677 1.00 0.00 C ATOM 2192 CD2 LEU A 648 14.754 3.906 0.023 1.00 0.00 C ATOM 0 H LEU A 648 16.892 6.097 1.686 1.00 0.00 H new ATOM 0 HA LEU A 648 17.189 4.851 -0.882 1.00 0.00 H new ATOM 0 HB2 LEU A 648 15.542 7.273 -0.014 1.00 0.00 H new ATOM 0 HB3 LEU A 648 15.391 6.458 -1.558 1.00 0.00 H new ATOM 0 HG LEU A 648 14.455 5.710 1.125 1.00 0.00 H new ATOM 0 HD11 LEU A 648 12.405 4.993 -0.254 1.00 0.00 H new ATOM 0 HD12 LEU A 648 12.880 6.676 -0.585 1.00 0.00 H new ATOM 0 HD13 LEU A 648 13.319 5.385 -1.730 1.00 0.00 H new ATOM 0 HD21 LEU A 648 13.907 3.375 0.457 1.00 0.00 H new ATOM 0 HD22 LEU A 648 14.883 3.597 -1.014 1.00 0.00 H new ATOM 0 HD23 LEU A 648 15.657 3.672 0.587 1.00 0.00 H new ATOM 2204 N THR A 649 18.737 7.598 -0.302 1.00 0.00 N ATOM 2205 CA THR A 649 19.665 8.623 -0.777 1.00 0.00 C ATOM 2206 C THR A 649 21.116 8.223 -0.477 1.00 0.00 C ATOM 2207 O THR A 649 22.059 8.880 -0.926 1.00 0.00 O ATOM 2208 CB THR A 649 19.231 10.007 -0.260 1.00 0.00 C ATOM 2209 OG1 THR A 649 19.740 11.001 -1.122 1.00 0.00 O ATOM 2210 CG2 THR A 649 19.701 10.292 1.164 1.00 0.00 C ATOM 0 H THR A 649 18.746 7.500 0.713 1.00 0.00 H new ATOM 0 HA THR A 649 19.628 8.703 -1.863 1.00 0.00 H new ATOM 0 HB THR A 649 18.141 10.016 -0.244 1.00 0.00 H new ATOM 0 HG1 THR A 649 19.466 11.885 -0.800 1.00 0.00 H new ATOM 0 HG21 THR A 649 19.362 11.283 1.468 1.00 0.00 H new ATOM 0 HG22 THR A 649 19.287 9.544 1.840 1.00 0.00 H new ATOM 0 HG23 THR A 649 20.790 10.253 1.202 1.00 0.00 H new ATOM 2218 N SER A 650 21.287 7.100 0.225 1.00 0.00 N ATOM 2219 CA SER A 650 22.512 6.585 0.792 1.00 0.00 C ATOM 2220 C SER A 650 23.314 7.666 1.504 1.00 0.00 C ATOM 2221 O SER A 650 24.276 8.226 0.972 1.00 0.00 O ATOM 2222 CB SER A 650 23.271 5.750 -0.230 1.00 0.00 C ATOM 2223 OG SER A 650 23.457 6.405 -1.477 1.00 0.00 O ATOM 0 H SER A 650 20.498 6.484 0.422 1.00 0.00 H new ATOM 0 HA SER A 650 22.273 5.888 1.595 1.00 0.00 H new ATOM 0 HB2 SER A 650 24.246 5.486 0.181 1.00 0.00 H new ATOM 0 HB3 SER A 650 22.732 4.817 -0.396 1.00 0.00 H new ATOM 0 HG SER A 650 23.668 7.349 -1.322 1.00 0.00 H new ATOM 2229 N SER A 651 22.878 7.966 2.721 1.00 0.00 N ATOM 2230 CA SER A 651 23.657 8.708 3.695 1.00 0.00 C ATOM 2231 C SER A 651 24.968 7.969 3.916 1.00 0.00 C ATOM 2232 O SER A 651 26.021 8.648 3.961 1.00 0.00 O ATOM 2233 CB SER A 651 22.859 8.843 4.995 1.00 0.00 C ATOM 2234 OG SER A 651 21.638 9.520 4.770 1.00 0.00 O ATOM 0 H SER A 651 21.956 7.694 3.062 1.00 0.00 H new ATOM 0 HA SER A 651 23.874 9.714 3.337 1.00 0.00 H new ATOM 0 HB2 SER A 651 22.660 7.854 5.409 1.00 0.00 H new ATOM 0 HB3 SER A 651 23.449 9.385 5.734 1.00 0.00 H new ATOM 0 HG SER A 651 21.144 9.593 5.613 1.00 0.00 H new TER 2240 SER A 651