USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=42 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 636 SER OG : rot 180:sc= 0.0204 USER MOD Set 1.2: A 637 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 624 MET CE :methyl -119:sc= -0.363 (180deg=-0.607) USER MOD Set 2.2: A 644 TYR OH : rot 180:sc= -0.0875 USER MOD Set 3.1: A 557 MET CE :methyl -148:sc= -1.01 (180deg=-0.223) USER MOD Set 3.2: A 561 GLN : amide:sc= -3.1 K(o=-4.1,f=-7.1!) USER MOD Set 4.1: A 539 HIS : no HD1:sc= -0.0532 X(o=1.1,f=0.98) USER MOD Set 4.2: A 543 THR OG1 : rot -63:sc= 1.15 USER MOD Set 5.1: A 536 MET CE :methyl 157:sc= -3.22 (180deg=-3.12!) USER MOD Set 5.2: A 547 MET CE :methyl 148:sc=-0.00433 (180deg=-1.22) USER MOD Set 5.3: A 605 THR OG1 : rot 24:sc= 0.33 USER MOD Set 5.4: A 606 MET CE :methyl -155:sc= -0.224 (180deg=0) USER MOD Set 6.1: A -3 SER OG : rot 180:sc= 0.943 USER MOD Set 6.2: A -4 GLY N :NH3+ 136:sc= 1.1 (180deg=0) USER MOD Single : A -1 MET CE :methyl 177:sc= 0 (180deg=-0.0106) USER MOD Single : A -2 HIS : no HE2:sc= 0.469 K(o=0.47,f=-2.4!) USER MOD Single : A 516 SER OG : rot 180:sc= 0 USER MOD Single : A 520 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 522 LYS NZ :NH3+ -171:sc= 1.27 (180deg=1.22) USER MOD Single : A 528 THR OG1 : rot -155:sc= 0.433 USER MOD Single : A 530 SER OG : rot 180:sc= 0 USER MOD Single : A 532 ASN : amide:sc= 0.26 K(o=0.26,f=-3!) USER MOD Single : A 545 LYS NZ :NH3+ -132:sc= 1.29 (180deg=-0.247) USER MOD Single : A 550 CYS SG : rot 180:sc= 0 USER MOD Single : A 551 MET CE :methyl 176:sc= -0.109 (180deg=-0.126) USER MOD Single : A 559 THR OG1 : rot 180:sc= 0 USER MOD Single : A 563 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 564 TYR OH : rot -30:sc= -0.0106 USER MOD Single : A 565 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 568 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 570 GLN :FLIP amide:sc= -1.54 F(o=-4.4!,f=-1.5) USER MOD Single : A 576 TYR OH : rot 180:sc= -0.0286 USER MOD Single : A 583 TYR OH : rot 30:sc= 0 USER MOD Single : A 584 THR OG1 : rot 35:sc= 0.734 USER MOD Single : A 585 SER OG : rot 180:sc= 0 USER MOD Single : A 586 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 591 SER OG : rot 180:sc= -0.0603 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= -1.02 K(o=-1,f=-5.7!) USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD Single : A 600 ASN : amide:sc= -0.0347 X(o=-0.035,f=-0.026) USER MOD Single : A 610 TYR OH : rot 180:sc= 0 USER MOD Single : A 612 THR OG1 : rot 180:sc= -0.0737 USER MOD Single : A 613 HIS : no HD1:sc= -0.217 X(o=-0.22,f=-0.24) USER MOD Single : A 616 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 623 CYS SG : rot -100:sc= -0.187 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 36:sc= 0.0479 USER MOD Single : A 642 THR OG1 : rot 180:sc= 0 USER MOD Single : A 643 THR OG1 : rot 81:sc= 0.254 USER MOD Single : A 645 ASN : amide:sc= 0.622 K(o=0.62,f=-0.24) 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 58:sc= 0.00936 USER MOD Single : A 651 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -21.702 8.562 18.714 1.00 0.00 N ATOM 2 CA GLY A -4 -21.229 8.987 17.387 1.00 0.00 C ATOM 3 C GLY A -4 -22.221 9.934 16.742 1.00 0.00 C ATOM 4 O GLY A -4 -21.960 11.139 16.650 1.00 0.00 O ATOM 0 H1 GLY A -4 -21.555 7.538 18.823 1.00 0.00 H new ATOM 0 H2 GLY A -4 -21.171 9.069 19.451 1.00 0.00 H new ATOM 0 H3 GLY A -4 -22.715 8.778 18.807 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -20.260 9.477 17.481 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -21.085 8.114 16.750 1.00 0.00 H new ATOM 8 N SER A -3 -23.370 9.396 16.327 1.00 0.00 N ATOM 9 CA SER A -3 -24.680 10.035 16.432 1.00 0.00 C ATOM 10 C SER A -3 -24.863 11.295 15.574 1.00 0.00 C ATOM 11 O SER A -3 -25.735 12.108 15.874 1.00 0.00 O ATOM 12 CB SER A -3 -25.016 10.278 17.920 1.00 0.00 C ATOM 13 OG SER A -3 -24.469 9.255 18.742 1.00 0.00 O ATOM 0 H SER A -3 -23.414 8.473 15.895 1.00 0.00 H new ATOM 0 HA SER A -3 -25.401 9.339 16.004 1.00 0.00 H new ATOM 0 HB2 SER A -3 -24.625 11.247 18.231 1.00 0.00 H new ATOM 0 HB3 SER A -3 -26.098 10.314 18.051 1.00 0.00 H new ATOM 0 HG SER A -3 -24.694 9.433 19.679 1.00 0.00 H new ATOM 19 N HIS A -2 -24.052 11.500 14.530 1.00 0.00 N ATOM 20 CA HIS A -2 -24.232 12.608 13.595 1.00 0.00 C ATOM 21 C HIS A -2 -23.631 12.237 12.242 1.00 0.00 C ATOM 22 O HIS A -2 -22.769 11.355 12.171 1.00 0.00 O ATOM 23 CB HIS A -2 -23.640 13.917 14.158 1.00 0.00 C ATOM 24 CG HIS A -2 -22.132 14.002 14.151 1.00 0.00 C ATOM 25 ND1 HIS A -2 -21.248 13.043 14.613 1.00 0.00 N ATOM 26 CD2 HIS A -2 -21.405 15.050 13.660 1.00 0.00 C ATOM 27 CE1 HIS A -2 -20.002 13.494 14.361 1.00 0.00 C ATOM 28 NE2 HIS A -2 -20.073 14.722 13.815 1.00 0.00 N ATOM 0 H HIS A -2 -23.255 10.902 14.313 1.00 0.00 H new ATOM 0 HA HIS A -2 -25.298 12.789 13.455 1.00 0.00 H new ATOM 0 HB2 HIS A -2 -24.037 14.753 13.581 1.00 0.00 H new ATOM 0 HB3 HIS A -2 -23.989 14.042 15.183 1.00 0.00 H new ATOM 0 HD1 HIS A -2 -21.493 12.160 15.061 1.00 0.00 H new ATOM 0 HD2 HIS A -2 -21.798 15.961 13.232 1.00 0.00 H new ATOM 0 HE1 HIS A -2 -19.089 12.954 14.566 1.00 0.00 H new ATOM 37 N MET A -1 -24.063 12.946 11.201 1.00 0.00 N ATOM 38 CA MET A -1 -23.855 12.641 9.787 1.00 0.00 C ATOM 39 C MET A -1 -23.289 13.884 9.081 1.00 0.00 C ATOM 40 O MET A -1 -23.709 14.260 7.987 1.00 0.00 O ATOM 41 CB MET A -1 -25.181 12.150 9.167 1.00 0.00 C ATOM 42 CG MET A -1 -25.718 10.850 9.793 1.00 0.00 C ATOM 43 SD MET A -1 -26.618 10.984 11.372 1.00 0.00 S ATOM 44 CE MET A -1 -28.172 11.728 10.809 1.00 0.00 C ATOM 0 H MET A -1 -24.601 13.803 11.331 1.00 0.00 H new ATOM 0 HA MET A -1 -23.128 11.838 9.664 1.00 0.00 H new ATOM 0 HB2 MET A -1 -25.933 12.932 9.275 1.00 0.00 H new ATOM 0 HB3 MET A -1 -25.035 11.994 8.098 1.00 0.00 H new ATOM 0 HG2 MET A -1 -26.380 10.376 9.068 1.00 0.00 H new ATOM 0 HG3 MET A -1 -24.875 10.176 9.943 1.00 0.00 H new ATOM 0 HE1 MET A -1 -28.855 11.826 11.653 1.00 0.00 H new ATOM 0 HE2 MET A -1 -27.972 12.713 10.388 1.00 0.00 H new ATOM 0 HE3 MET A -1 -28.625 11.093 10.048 1.00 0.00 H new ATOM 54 N VAL A 513 -22.383 14.582 9.765 1.00 0.00 N ATOM 55 CA VAL A 513 -21.732 15.817 9.351 1.00 0.00 C ATOM 56 C VAL A 513 -20.313 15.670 9.892 1.00 0.00 C ATOM 57 O VAL A 513 -20.109 15.823 11.097 1.00 0.00 O ATOM 58 CB VAL A 513 -22.494 17.031 9.940 1.00 0.00 C ATOM 59 CG1 VAL A 513 -21.744 18.345 9.711 1.00 0.00 C ATOM 60 CG2 VAL A 513 -23.910 17.171 9.357 1.00 0.00 C ATOM 0 H VAL A 513 -22.065 14.276 10.685 1.00 0.00 H new ATOM 0 HA VAL A 513 -21.723 15.987 8.274 1.00 0.00 H new ATOM 0 HB VAL A 513 -22.566 16.835 11.010 1.00 0.00 H new ATOM 0 HG11 VAL A 513 -22.314 19.169 10.140 1.00 0.00 H new ATOM 0 HG12 VAL A 513 -20.766 18.293 10.189 1.00 0.00 H new ATOM 0 HG13 VAL A 513 -21.617 18.510 8.641 1.00 0.00 H new ATOM 0 HG21 VAL A 513 -24.403 18.036 9.801 1.00 0.00 H new ATOM 0 HG22 VAL A 513 -23.847 17.304 8.277 1.00 0.00 H new ATOM 0 HG23 VAL A 513 -24.485 16.272 9.579 1.00 0.00 H new ATOM 70 N LEU A 514 -19.357 15.233 9.073 1.00 0.00 N ATOM 71 CA LEU A 514 -18.017 14.837 9.515 1.00 0.00 C ATOM 72 C LEU A 514 -16.949 15.558 8.673 1.00 0.00 C ATOM 73 O LEU A 514 -17.274 16.070 7.599 1.00 0.00 O ATOM 74 CB LEU A 514 -17.889 13.298 9.441 1.00 0.00 C ATOM 75 CG LEU A 514 -17.939 12.579 10.802 1.00 0.00 C ATOM 76 CD1 LEU A 514 -19.380 12.288 11.242 1.00 0.00 C ATOM 77 CD2 LEU A 514 -17.180 11.252 10.711 1.00 0.00 C ATOM 0 H LEU A 514 -19.493 15.142 8.066 1.00 0.00 H new ATOM 0 HA LEU A 514 -17.858 15.134 10.552 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -18.690 12.911 8.812 1.00 0.00 H new ATOM 0 HB3 LEU A 514 -16.949 13.049 8.949 1.00 0.00 H new ATOM 0 HG LEU A 514 -17.479 13.239 11.537 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -19.370 11.780 12.206 1.00 0.00 H new ATOM 0 HD12 LEU A 514 -19.930 13.225 11.331 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -19.865 11.652 10.502 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -17.217 10.745 11.675 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -17.641 10.621 9.951 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -16.142 11.445 10.442 1.00 0.00 H new ATOM 89 N PRO A 515 -15.674 15.571 9.104 1.00 0.00 N ATOM 90 CA PRO A 515 -14.553 16.258 8.453 1.00 0.00 C ATOM 91 C PRO A 515 -14.126 15.655 7.101 1.00 0.00 C ATOM 92 O PRO A 515 -12.971 15.810 6.699 1.00 0.00 O ATOM 93 CB PRO A 515 -13.430 16.316 9.494 1.00 0.00 C ATOM 94 CG PRO A 515 -13.672 15.065 10.324 1.00 0.00 C ATOM 95 CD PRO A 515 -15.196 14.978 10.350 1.00 0.00 C ATOM 0 HA PRO A 515 -14.853 17.262 8.153 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -12.445 16.307 9.027 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -13.487 17.220 10.100 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -13.223 14.182 9.869 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -13.253 15.155 11.326 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -15.523 13.942 10.435 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -15.599 15.511 11.211 1.00 0.00 H new ATOM 103 N SER A 516 -14.955 14.827 6.465 1.00 0.00 N ATOM 104 CA SER A 516 -14.694 14.310 5.129 1.00 0.00 C ATOM 105 C SER A 516 -14.484 15.457 4.130 1.00 0.00 C ATOM 106 O SER A 516 -13.468 15.476 3.430 1.00 0.00 O ATOM 107 CB SER A 516 -15.863 13.417 4.713 1.00 0.00 C ATOM 108 OG SER A 516 -15.965 12.304 5.590 1.00 0.00 O ATOM 0 H SER A 516 -15.831 14.496 6.868 1.00 0.00 H new ATOM 0 HA SER A 516 -13.777 13.721 5.135 1.00 0.00 H new ATOM 0 HB2 SER A 516 -16.791 13.989 4.729 1.00 0.00 H new ATOM 0 HB3 SER A 516 -15.720 13.071 3.689 1.00 0.00 H new ATOM 0 HG SER A 516 -16.718 11.739 5.316 1.00 0.00 H new ATOM 114 N GLU A 517 -15.420 16.413 4.078 1.00 0.00 N ATOM 115 CA GLU A 517 -15.455 17.501 3.105 1.00 0.00 C ATOM 116 C GLU A 517 -15.442 16.962 1.660 1.00 0.00 C ATOM 117 O GLU A 517 -15.647 15.762 1.455 1.00 0.00 O ATOM 118 CB GLU A 517 -14.310 18.478 3.416 1.00 0.00 C ATOM 119 CG GLU A 517 -14.719 19.945 3.228 1.00 0.00 C ATOM 120 CD GLU A 517 -15.408 20.484 4.488 1.00 0.00 C ATOM 121 OE1 GLU A 517 -14.728 20.610 5.537 1.00 0.00 O ATOM 122 OE2 GLU A 517 -16.621 20.797 4.459 1.00 0.00 O ATOM 0 H GLU A 517 -16.198 16.447 4.737 1.00 0.00 H new ATOM 0 HA GLU A 517 -16.391 18.054 3.187 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -13.977 18.326 4.443 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -13.461 18.255 2.769 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -13.838 20.547 3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -15.391 20.033 2.374 1.00 0.00 H new ATOM 129 N ALA A 518 -15.242 17.820 0.652 1.00 0.00 N ATOM 130 CA ALA A 518 -15.102 17.421 -0.747 1.00 0.00 C ATOM 131 C ALA A 518 -13.826 18.031 -1.339 1.00 0.00 C ATOM 132 O ALA A 518 -13.879 19.098 -1.950 1.00 0.00 O ATOM 133 CB ALA A 518 -16.336 17.807 -1.547 1.00 0.00 C ATOM 0 H ALA A 518 -15.172 18.828 0.792 1.00 0.00 H new ATOM 0 HA ALA A 518 -15.014 16.336 -0.800 1.00 0.00 H new ATOM 0 HB1 ALA A 518 -16.208 17.500 -2.585 1.00 0.00 H new ATOM 0 HB2 ALA A 518 -17.211 17.311 -1.127 1.00 0.00 H new ATOM 0 HB3 ALA A 518 -16.475 18.887 -1.503 1.00 0.00 H new ATOM 139 N PRO A 519 -12.666 17.396 -1.131 1.00 0.00 N ATOM 140 CA PRO A 519 -11.381 17.948 -1.532 1.00 0.00 C ATOM 141 C PRO A 519 -11.230 17.989 -3.057 1.00 0.00 C ATOM 142 O PRO A 519 -11.566 17.027 -3.757 1.00 0.00 O ATOM 143 CB PRO A 519 -10.331 17.041 -0.882 1.00 0.00 C ATOM 144 CG PRO A 519 -11.069 15.722 -0.649 1.00 0.00 C ATOM 145 CD PRO A 519 -12.514 16.137 -0.429 1.00 0.00 C ATOM 0 HA PRO A 519 -11.272 18.983 -1.209 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -9.466 16.904 -1.531 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -9.964 17.463 0.054 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -10.972 15.055 -1.506 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -10.671 15.190 0.216 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -13.202 15.386 -0.817 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -12.732 16.251 0.633 1.00 0.00 H new ATOM 153 N ASN A 520 -10.695 19.099 -3.577 1.00 0.00 N ATOM 154 CA ASN A 520 -10.485 19.311 -5.010 1.00 0.00 C ATOM 155 C ASN A 520 -9.336 20.261 -5.359 1.00 0.00 C ATOM 156 O ASN A 520 -9.145 20.556 -6.540 1.00 0.00 O ATOM 157 CB ASN A 520 -11.775 19.866 -5.643 1.00 0.00 C ATOM 158 CG ASN A 520 -11.972 21.339 -5.302 1.00 0.00 C ATOM 159 OD1 ASN A 520 -12.256 21.681 -4.160 1.00 0.00 O ATOM 160 ND2 ASN A 520 -11.826 22.246 -6.251 1.00 0.00 N ATOM 0 H ASN A 520 -10.392 19.886 -3.004 1.00 0.00 H new ATOM 0 HA ASN A 520 -10.215 18.333 -5.408 1.00 0.00 H new ATOM 0 HB2 ASN A 520 -11.733 19.744 -6.725 1.00 0.00 H new ATOM 0 HB3 ASN A 520 -12.632 19.291 -5.290 1.00 0.00 H new ATOM 0 HD21 ASN A 520 -11.950 23.235 -6.035 1.00 0.00 H new ATOM 0 HD22 ASN A 520 -11.590 21.957 -7.200 1.00 0.00 H new ATOM 167 N ALA A 521 -8.580 20.731 -4.371 1.00 0.00 N ATOM 168 CA ALA A 521 -7.634 21.835 -4.497 1.00 0.00 C ATOM 169 C ALA A 521 -6.407 21.588 -3.613 1.00 0.00 C ATOM 170 O ALA A 521 -6.259 22.216 -2.562 1.00 0.00 O ATOM 171 CB ALA A 521 -8.353 23.149 -4.158 1.00 0.00 C ATOM 0 H ALA A 521 -8.610 20.341 -3.429 1.00 0.00 H new ATOM 0 HA ALA A 521 -7.268 21.907 -5.521 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -7.654 23.980 -4.249 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -9.185 23.297 -4.847 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -8.731 23.104 -3.137 1.00 0.00 H new ATOM 177 N LYS A 522 -5.548 20.636 -3.989 1.00 0.00 N ATOM 178 CA LYS A 522 -4.281 20.336 -3.324 1.00 0.00 C ATOM 179 C LYS A 522 -3.333 19.639 -4.299 1.00 0.00 C ATOM 180 O LYS A 522 -3.748 19.237 -5.389 1.00 0.00 O ATOM 181 CB LYS A 522 -4.551 19.506 -2.063 1.00 0.00 C ATOM 182 CG LYS A 522 -5.197 18.128 -2.292 1.00 0.00 C ATOM 183 CD LYS A 522 -5.669 17.555 -0.946 1.00 0.00 C ATOM 184 CE LYS A 522 -6.498 16.285 -1.158 1.00 0.00 C ATOM 185 NZ LYS A 522 -7.205 15.862 0.071 1.00 0.00 N ATOM 0 H LYS A 522 -5.724 20.033 -4.793 1.00 0.00 H new ATOM 0 HA LYS A 522 -3.790 21.257 -3.009 1.00 0.00 H new ATOM 0 HB2 LYS A 522 -3.607 19.361 -1.538 1.00 0.00 H new ATOM 0 HB3 LYS A 522 -5.197 20.084 -1.402 1.00 0.00 H new ATOM 0 HG2 LYS A 522 -6.040 18.219 -2.977 1.00 0.00 H new ATOM 0 HG3 LYS A 522 -4.480 17.451 -2.757 1.00 0.00 H new ATOM 0 HD2 LYS A 522 -4.807 17.331 -0.318 1.00 0.00 H new ATOM 0 HD3 LYS A 522 -6.264 18.299 -0.417 1.00 0.00 H new ATOM 0 HE2 LYS A 522 -7.225 16.457 -1.951 1.00 0.00 H new ATOM 0 HE3 LYS A 522 -5.845 15.480 -1.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 522 -7.626 14.923 -0.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 522 -6.531 15.819 0.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 522 -7.955 16.547 0.293 1.00 0.00 H new ATOM 199 N GLU A 523 -2.061 19.499 -3.937 1.00 0.00 N ATOM 200 CA GLU A 523 -1.060 18.838 -4.767 1.00 0.00 C ATOM 201 C GLU A 523 -1.137 17.319 -4.582 1.00 0.00 C ATOM 202 O GLU A 523 -1.829 16.814 -3.689 1.00 0.00 O ATOM 203 CB GLU A 523 0.378 19.326 -4.490 1.00 0.00 C ATOM 204 CG GLU A 523 0.537 20.775 -4.009 1.00 0.00 C ATOM 205 CD GLU A 523 0.516 20.837 -2.479 1.00 0.00 C ATOM 206 OE1 GLU A 523 -0.534 20.558 -1.861 1.00 0.00 O ATOM 207 OE2 GLU A 523 1.594 21.050 -1.872 1.00 0.00 O ATOM 0 H GLU A 523 -1.693 19.845 -3.051 1.00 0.00 H new ATOM 0 HA GLU A 523 -1.292 19.102 -5.799 1.00 0.00 H new ATOM 0 HB2 GLU A 523 0.821 18.669 -3.742 1.00 0.00 H new ATOM 0 HB3 GLU A 523 0.959 19.206 -5.404 1.00 0.00 H new ATOM 0 HG2 GLU A 523 1.474 21.188 -4.383 1.00 0.00 H new ATOM 0 HG3 GLU A 523 -0.267 21.390 -4.415 1.00 0.00 H new ATOM 214 N GLU A 524 -0.367 16.566 -5.368 1.00 0.00 N ATOM 215 CA GLU A 524 -0.141 15.140 -5.165 1.00 0.00 C ATOM 216 C GLU A 524 1.233 14.906 -4.547 1.00 0.00 C ATOM 217 O GLU A 524 2.220 15.525 -4.936 1.00 0.00 O ATOM 218 CB GLU A 524 -0.272 14.374 -6.479 1.00 0.00 C ATOM 219 CG GLU A 524 -1.706 14.438 -7.026 1.00 0.00 C ATOM 220 CD GLU A 524 -1.894 13.512 -8.226 1.00 0.00 C ATOM 221 OE1 GLU A 524 -1.533 12.321 -8.107 1.00 0.00 O ATOM 222 OE2 GLU A 524 -2.434 13.942 -9.267 1.00 0.00 O ATOM 0 H GLU A 524 0.126 16.940 -6.179 1.00 0.00 H new ATOM 0 HA GLU A 524 -0.902 14.768 -4.479 1.00 0.00 H new ATOM 0 HB2 GLU A 524 0.418 14.789 -7.214 1.00 0.00 H new ATOM 0 HB3 GLU A 524 0.014 13.334 -6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 524 -2.408 14.162 -6.239 1.00 0.00 H new ATOM 0 HG3 GLU A 524 -1.939 15.462 -7.316 1.00 0.00 H new ATOM 229 N ILE A 525 1.288 14.019 -3.556 1.00 0.00 N ATOM 230 CA ILE A 525 2.445 13.815 -2.690 1.00 0.00 C ATOM 231 C ILE A 525 3.273 12.677 -3.291 1.00 0.00 C ATOM 232 O ILE A 525 2.682 11.758 -3.873 1.00 0.00 O ATOM 233 CB ILE A 525 1.993 13.501 -1.255 1.00 0.00 C ATOM 234 CG1 ILE A 525 0.760 14.319 -0.828 1.00 0.00 C ATOM 235 CG2 ILE A 525 3.134 13.758 -0.252 1.00 0.00 C ATOM 236 CD1 ILE A 525 0.790 15.823 -1.113 1.00 0.00 C ATOM 0 H ILE A 525 0.506 13.405 -3.327 1.00 0.00 H new ATOM 0 HA ILE A 525 3.054 14.717 -2.632 1.00 0.00 H new ATOM 0 HB ILE A 525 1.719 12.446 -1.249 1.00 0.00 H new ATOM 0 HG12 ILE A 525 -0.114 13.898 -1.324 1.00 0.00 H new ATOM 0 HG13 ILE A 525 0.616 14.180 0.244 1.00 0.00 H new ATOM 0 HG21 ILE A 525 2.790 13.529 0.757 1.00 0.00 H new ATOM 0 HG22 ILE A 525 3.985 13.123 -0.498 1.00 0.00 H new ATOM 0 HG23 ILE A 525 3.435 14.804 -0.304 1.00 0.00 H new ATOM 0 HD11 ILE A 525 -0.137 16.278 -0.763 1.00 0.00 H new ATOM 0 HD12 ILE A 525 1.635 16.275 -0.593 1.00 0.00 H new ATOM 0 HD13 ILE A 525 0.893 15.988 -2.185 1.00 0.00 H new ATOM 248 N LEU A 526 4.598 12.675 -3.128 1.00 0.00 N ATOM 249 CA LEU A 526 5.486 11.590 -3.486 1.00 0.00 C ATOM 250 C LEU A 526 6.562 11.446 -2.415 1.00 0.00 C ATOM 251 O LEU A 526 6.810 12.372 -1.642 1.00 0.00 O ATOM 252 CB LEU A 526 6.139 11.914 -4.816 1.00 0.00 C ATOM 253 CG LEU A 526 5.245 11.714 -6.050 1.00 0.00 C ATOM 254 CD1 LEU A 526 6.080 12.081 -7.265 1.00 0.00 C ATOM 255 CD2 LEU A 526 4.749 10.271 -6.216 1.00 0.00 C ATOM 0 H LEU A 526 5.094 13.470 -2.724 1.00 0.00 H new ATOM 0 HA LEU A 526 4.926 10.658 -3.564 1.00 0.00 H new ATOM 0 HB2 LEU A 526 6.475 12.951 -4.795 1.00 0.00 H new ATOM 0 HB3 LEU A 526 7.028 11.293 -4.927 1.00 0.00 H new ATOM 0 HG LEU A 526 4.358 12.338 -5.935 1.00 0.00 H new ATOM 0 HD11 LEU A 526 5.484 11.954 -8.168 1.00 0.00 H new ATOM 0 HD12 LEU A 526 6.401 13.120 -7.186 1.00 0.00 H new ATOM 0 HD13 LEU A 526 6.955 11.433 -7.314 1.00 0.00 H new ATOM 0 HD21 LEU A 526 4.124 10.201 -7.106 1.00 0.00 H new ATOM 0 HD22 LEU A 526 5.603 9.602 -6.319 1.00 0.00 H new ATOM 0 HD23 LEU A 526 4.167 9.983 -5.340 1.00 0.00 H new ATOM 267 N GLY A 527 7.252 10.307 -2.415 1.00 0.00 N ATOM 268 CA GLY A 527 8.246 9.966 -1.406 1.00 0.00 C ATOM 269 C GLY A 527 7.596 9.362 -0.160 1.00 0.00 C ATOM 270 O GLY A 527 6.442 8.921 -0.194 1.00 0.00 O ATOM 0 H GLY A 527 7.133 9.587 -3.127 1.00 0.00 H new ATOM 0 HA2 GLY A 527 8.962 9.258 -1.824 1.00 0.00 H new ATOM 0 HA3 GLY A 527 8.806 10.859 -1.129 1.00 0.00 H new ATOM 274 N THR A 528 8.343 9.288 0.937 1.00 0.00 N ATOM 275 CA THR A 528 7.937 8.678 2.192 1.00 0.00 C ATOM 276 C THR A 528 7.209 9.719 3.066 1.00 0.00 C ATOM 277 O THR A 528 7.448 10.919 2.934 1.00 0.00 O ATOM 278 CB THR A 528 9.194 8.089 2.864 1.00 0.00 C ATOM 279 OG1 THR A 528 9.966 7.361 1.925 1.00 0.00 O ATOM 280 CG2 THR A 528 8.856 7.100 3.978 1.00 0.00 C ATOM 0 H THR A 528 9.288 9.669 0.974 1.00 0.00 H new ATOM 0 HA THR A 528 7.228 7.866 2.034 1.00 0.00 H new ATOM 0 HB THR A 528 9.734 8.945 3.269 1.00 0.00 H new ATOM 0 HG1 THR A 528 10.502 6.688 2.394 1.00 0.00 H new ATOM 0 HG21 THR A 528 9.777 6.717 4.416 1.00 0.00 H new ATOM 0 HG22 THR A 528 8.271 7.604 4.747 1.00 0.00 H new ATOM 0 HG23 THR A 528 8.278 6.272 3.567 1.00 0.00 H new ATOM 288 N VAL A 529 6.332 9.265 3.960 1.00 0.00 N ATOM 289 CA VAL A 529 5.567 10.065 4.927 1.00 0.00 C ATOM 290 C VAL A 529 5.400 9.296 6.250 1.00 0.00 C ATOM 291 O VAL A 529 5.804 8.134 6.359 1.00 0.00 O ATOM 292 CB VAL A 529 4.197 10.506 4.341 1.00 0.00 C ATOM 293 CG1 VAL A 529 4.284 11.855 3.628 1.00 0.00 C ATOM 294 CG2 VAL A 529 3.556 9.470 3.408 1.00 0.00 C ATOM 0 H VAL A 529 6.121 8.270 4.037 1.00 0.00 H new ATOM 0 HA VAL A 529 6.129 10.975 5.137 1.00 0.00 H new ATOM 0 HB VAL A 529 3.547 10.601 5.211 1.00 0.00 H new ATOM 0 HG11 VAL A 529 3.303 12.123 3.235 1.00 0.00 H new ATOM 0 HG12 VAL A 529 4.613 12.619 4.333 1.00 0.00 H new ATOM 0 HG13 VAL A 529 4.998 11.787 2.807 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.603 9.852 3.040 1.00 0.00 H new ATOM 0 HG22 VAL A 529 4.220 9.279 2.565 1.00 0.00 H new ATOM 0 HG23 VAL A 529 3.388 8.542 3.955 1.00 0.00 H new ATOM 304 N SER A 530 4.788 9.938 7.251 1.00 0.00 N ATOM 305 CA SER A 530 4.524 9.403 8.588 1.00 0.00 C ATOM 306 C SER A 530 3.036 9.031 8.756 1.00 0.00 C ATOM 307 O SER A 530 2.481 9.077 9.860 1.00 0.00 O ATOM 308 CB SER A 530 5.074 10.396 9.631 1.00 0.00 C ATOM 309 OG SER A 530 4.729 11.755 9.370 1.00 0.00 O ATOM 0 H SER A 530 4.447 10.893 7.143 1.00 0.00 H new ATOM 0 HA SER A 530 5.048 8.460 8.745 1.00 0.00 H new ATOM 0 HB2 SER A 530 4.699 10.119 10.616 1.00 0.00 H new ATOM 0 HB3 SER A 530 6.160 10.307 9.666 1.00 0.00 H new ATOM 0 HG SER A 530 5.107 12.329 10.069 1.00 0.00 H new ATOM 315 N TRP A 531 2.367 8.710 7.641 1.00 0.00 N ATOM 316 CA TRP A 531 1.004 8.229 7.556 1.00 0.00 C ATOM 317 C TRP A 531 0.857 6.871 8.249 1.00 0.00 C ATOM 318 O TRP A 531 1.745 6.324 8.910 1.00 0.00 O ATOM 319 CB TRP A 531 0.544 8.198 6.074 1.00 0.00 C ATOM 320 CG TRP A 531 0.510 9.501 5.327 1.00 0.00 C ATOM 321 CD1 TRP A 531 0.783 10.717 5.853 1.00 0.00 C ATOM 322 CD2 TRP A 531 0.189 9.752 3.916 1.00 0.00 C ATOM 323 NE1 TRP A 531 0.614 11.690 4.897 1.00 0.00 N ATOM 324 CE2 TRP A 531 0.302 11.155 3.674 1.00 0.00 C ATOM 325 CE3 TRP A 531 -0.108 8.942 2.794 1.00 0.00 C ATOM 326 CZ2 TRP A 531 0.155 11.726 2.404 1.00 0.00 C ATOM 327 CZ3 TRP A 531 -0.245 9.506 1.508 1.00 0.00 C ATOM 328 CH2 TRP A 531 -0.107 10.895 1.308 1.00 0.00 C ATOM 0 H TRP A 531 2.802 8.788 6.722 1.00 0.00 H new ATOM 0 HA TRP A 531 0.346 8.917 8.087 1.00 0.00 H new ATOM 0 HB2 TRP A 531 1.202 7.518 5.533 1.00 0.00 H new ATOM 0 HB3 TRP A 531 -0.457 7.767 6.042 1.00 0.00 H new ATOM 0 HD1 TRP A 531 1.089 10.897 6.873 1.00 0.00 H new ATOM 0 HE1 TRP A 531 0.709 12.690 5.076 1.00 0.00 H new ATOM 0 HE3 TRP A 531 -0.232 7.877 2.924 1.00 0.00 H new ATOM 0 HZ2 TRP A 531 0.243 12.794 2.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 531 -0.458 8.865 0.665 1.00 0.00 H new ATOM 0 HH2 TRP A 531 -0.203 11.314 0.317 1.00 0.00 H new ATOM 339 N ASN A 532 -0.340 6.335 8.125 1.00 0.00 N ATOM 340 CA ASN A 532 -0.951 5.234 8.841 1.00 0.00 C ATOM 341 C ASN A 532 -1.925 4.638 7.835 1.00 0.00 C ATOM 342 O ASN A 532 -2.315 5.303 6.872 1.00 0.00 O ATOM 343 CB ASN A 532 -1.714 5.757 10.080 1.00 0.00 C ATOM 344 CG ASN A 532 -2.493 7.021 9.745 1.00 0.00 C ATOM 345 OD1 ASN A 532 -3.629 6.931 9.292 1.00 0.00 O ATOM 346 ND2 ASN A 532 -1.822 8.166 9.864 1.00 0.00 N ATOM 0 H ASN A 532 -0.988 6.709 7.432 1.00 0.00 H new ATOM 0 HA ASN A 532 -0.222 4.510 9.204 1.00 0.00 H new ATOM 0 HB2 ASN A 532 -2.398 4.989 10.442 1.00 0.00 H new ATOM 0 HB3 ASN A 532 -1.009 5.962 10.886 1.00 0.00 H new ATOM 0 HD21 ASN A 532 -2.252 9.042 9.569 1.00 0.00 H new ATOM 0 HD22 ASN A 532 -0.878 8.166 10.251 1.00 0.00 H new ATOM 353 N LEU A 533 -2.341 3.396 8.060 1.00 0.00 N ATOM 354 CA LEU A 533 -3.080 2.609 7.078 1.00 0.00 C ATOM 355 C LEU A 533 -4.357 3.333 6.620 1.00 0.00 C ATOM 356 O LEU A 533 -4.747 3.205 5.466 1.00 0.00 O ATOM 357 CB LEU A 533 -3.322 1.208 7.688 1.00 0.00 C ATOM 358 CG LEU A 533 -3.732 0.043 6.760 1.00 0.00 C ATOM 359 CD1 LEU A 533 -5.232 -0.015 6.478 1.00 0.00 C ATOM 360 CD2 LEU A 533 -2.937 0.007 5.451 1.00 0.00 C ATOM 0 H LEU A 533 -2.173 2.903 8.937 1.00 0.00 H new ATOM 0 HA LEU A 533 -2.506 2.484 6.160 1.00 0.00 H new ATOM 0 HB2 LEU A 533 -2.408 0.912 8.202 1.00 0.00 H new ATOM 0 HB3 LEU A 533 -4.097 1.310 8.448 1.00 0.00 H new ATOM 0 HG LEU A 533 -3.476 -0.852 7.327 1.00 0.00 H new ATOM 0 HD11 LEU A 533 -5.446 -0.857 5.820 1.00 0.00 H new ATOM 0 HD12 LEU A 533 -5.774 -0.140 7.415 1.00 0.00 H new ATOM 0 HD13 LEU A 533 -5.548 0.911 5.997 1.00 0.00 H new ATOM 0 HD21 LEU A 533 -3.273 -0.834 4.844 1.00 0.00 H new ATOM 0 HD22 LEU A 533 -3.096 0.936 4.903 1.00 0.00 H new ATOM 0 HD23 LEU A 533 -1.876 -0.107 5.673 1.00 0.00 H new ATOM 372 N ARG A 534 -4.982 4.141 7.484 1.00 0.00 N ATOM 373 CA ARG A 534 -6.197 4.886 7.164 1.00 0.00 C ATOM 374 C ARG A 534 -5.885 6.094 6.281 1.00 0.00 C ATOM 375 O ARG A 534 -6.515 6.255 5.242 1.00 0.00 O ATOM 376 CB ARG A 534 -6.929 5.324 8.447 1.00 0.00 C ATOM 377 CG ARG A 534 -7.321 4.160 9.380 1.00 0.00 C ATOM 378 CD ARG A 534 -6.267 3.781 10.435 1.00 0.00 C ATOM 379 NE ARG A 534 -6.107 4.822 11.466 1.00 0.00 N ATOM 380 CZ ARG A 534 -5.879 4.605 12.768 1.00 0.00 C ATOM 381 NH1 ARG A 534 -5.555 3.394 13.216 1.00 0.00 N ATOM 382 NH2 ARG A 534 -5.949 5.621 13.618 1.00 0.00 N ATOM 0 H ARG A 534 -4.651 4.295 8.436 1.00 0.00 H new ATOM 0 HA ARG A 534 -6.857 4.222 6.606 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -6.292 6.017 8.997 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -7.830 5.871 8.169 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -8.246 4.423 9.893 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -7.533 3.282 8.770 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -6.553 2.843 10.911 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -5.309 3.610 9.943 1.00 0.00 H new ATOM 0 HE ARG A 534 -6.176 5.793 11.161 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -5.477 2.613 12.564 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -5.385 3.247 14.211 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -6.175 6.556 13.278 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -5.777 5.467 14.612 1.00 0.00 H new ATOM 396 N GLU A 535 -4.920 6.933 6.657 1.00 0.00 N ATOM 397 CA GLU A 535 -4.514 8.086 5.855 1.00 0.00 C ATOM 398 C GLU A 535 -4.047 7.652 4.467 1.00 0.00 C ATOM 399 O GLU A 535 -4.311 8.331 3.472 1.00 0.00 O ATOM 400 CB GLU A 535 -3.406 8.851 6.589 1.00 0.00 C ATOM 401 CG GLU A 535 -4.034 9.895 7.524 1.00 0.00 C ATOM 402 CD GLU A 535 -4.458 11.175 6.795 1.00 0.00 C ATOM 403 OE1 GLU A 535 -3.906 11.486 5.716 1.00 0.00 O ATOM 404 OE2 GLU A 535 -5.396 11.866 7.255 1.00 0.00 O ATOM 0 H GLU A 535 -4.397 6.832 7.527 1.00 0.00 H new ATOM 0 HA GLU A 535 -5.373 8.743 5.719 1.00 0.00 H new ATOM 0 HB2 GLU A 535 -2.790 8.158 7.162 1.00 0.00 H new ATOM 0 HB3 GLU A 535 -2.750 9.340 5.869 1.00 0.00 H new ATOM 0 HG2 GLU A 535 -4.904 9.458 8.015 1.00 0.00 H new ATOM 0 HG3 GLU A 535 -3.320 10.149 8.307 1.00 0.00 H new ATOM 411 N MET A 536 -3.370 6.510 4.387 1.00 0.00 N ATOM 412 CA MET A 536 -2.957 5.914 3.138 1.00 0.00 C ATOM 413 C MET A 536 -4.163 5.556 2.276 1.00 0.00 C ATOM 414 O MET A 536 -4.178 5.936 1.107 1.00 0.00 O ATOM 415 CB MET A 536 -2.124 4.679 3.442 1.00 0.00 C ATOM 416 CG MET A 536 -0.769 5.070 4.040 1.00 0.00 C ATOM 417 SD MET A 536 0.276 3.659 4.444 1.00 0.00 S ATOM 418 CE MET A 536 0.314 2.998 2.767 1.00 0.00 C ATOM 0 H MET A 536 -3.093 5.970 5.207 1.00 0.00 H new ATOM 0 HA MET A 536 -2.360 6.630 2.574 1.00 0.00 H new ATOM 0 HB2 MET A 536 -2.661 4.035 4.138 1.00 0.00 H new ATOM 0 HB3 MET A 536 -1.971 4.104 2.529 1.00 0.00 H new ATOM 0 HG2 MET A 536 -0.242 5.712 3.334 1.00 0.00 H new ATOM 0 HG3 MET A 536 -0.936 5.658 4.942 1.00 0.00 H new ATOM 0 HE1 MET A 536 1.197 2.372 2.643 1.00 0.00 H new ATOM 0 HE2 MET A 536 -0.581 2.402 2.591 1.00 0.00 H new ATOM 0 HE3 MET A 536 0.349 3.820 2.052 1.00 0.00 H new ATOM 428 N LEU A 537 -5.166 4.865 2.836 1.00 0.00 N ATOM 429 CA LEU A 537 -6.407 4.527 2.134 1.00 0.00 C ATOM 430 C LEU A 537 -7.052 5.789 1.572 1.00 0.00 C ATOM 431 O LEU A 537 -7.380 5.839 0.389 1.00 0.00 O ATOM 432 CB LEU A 537 -7.405 3.812 3.066 1.00 0.00 C ATOM 433 CG LEU A 537 -7.053 2.356 3.394 1.00 0.00 C ATOM 434 CD1 LEU A 537 -7.869 1.848 4.592 1.00 0.00 C ATOM 435 CD2 LEU A 537 -7.318 1.451 2.204 1.00 0.00 C ATOM 0 H LEU A 537 -5.136 4.523 3.797 1.00 0.00 H new ATOM 0 HA LEU A 537 -6.152 3.849 1.319 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -7.475 4.373 3.998 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -8.392 3.837 2.605 1.00 0.00 H new ATOM 0 HG LEU A 537 -5.992 2.330 3.641 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -7.600 0.813 4.803 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -7.655 2.464 5.465 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -8.932 1.906 4.359 1.00 0.00 H new ATOM 0 HD21 LEU A 537 -7.060 0.424 2.463 1.00 0.00 H new ATOM 0 HD22 LEU A 537 -8.373 1.503 1.935 1.00 0.00 H new ATOM 0 HD23 LEU A 537 -6.711 1.775 1.358 1.00 0.00 H new ATOM 447 N ALA A 538 -7.190 6.827 2.399 1.00 0.00 N ATOM 448 CA ALA A 538 -7.747 8.102 1.978 1.00 0.00 C ATOM 449 C ALA A 538 -6.966 8.684 0.790 1.00 0.00 C ATOM 450 O ALA A 538 -7.574 9.053 -0.209 1.00 0.00 O ATOM 451 CB ALA A 538 -7.821 9.049 3.179 1.00 0.00 C ATOM 0 H ALA A 538 -6.916 6.801 3.381 1.00 0.00 H new ATOM 0 HA ALA A 538 -8.765 7.957 1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 538 -8.239 10.005 2.863 1.00 0.00 H new ATOM 0 HB2 ALA A 538 -8.457 8.612 3.949 1.00 0.00 H new ATOM 0 HB3 ALA A 538 -6.820 9.205 3.581 1.00 0.00 H new ATOM 457 N HIS A 539 -5.627 8.720 0.828 1.00 0.00 N ATOM 458 CA HIS A 539 -4.841 9.228 -0.301 1.00 0.00 C ATOM 459 C HIS A 539 -4.979 8.342 -1.545 1.00 0.00 C ATOM 460 O HIS A 539 -5.020 8.857 -2.665 1.00 0.00 O ATOM 461 CB HIS A 539 -3.363 9.376 0.080 1.00 0.00 C ATOM 462 CG HIS A 539 -2.562 10.011 -1.037 1.00 0.00 C ATOM 463 ND1 HIS A 539 -2.523 11.363 -1.339 1.00 0.00 N ATOM 464 CD2 HIS A 539 -1.812 9.347 -1.971 1.00 0.00 C ATOM 465 CE1 HIS A 539 -1.777 11.514 -2.446 1.00 0.00 C ATOM 466 NE2 HIS A 539 -1.322 10.307 -2.841 1.00 0.00 N ATOM 0 H HIS A 539 -5.070 8.406 1.623 1.00 0.00 H new ATOM 0 HA HIS A 539 -5.242 10.211 -0.547 1.00 0.00 H new ATOM 0 HB2 HIS A 539 -3.278 9.984 0.981 1.00 0.00 H new ATOM 0 HB3 HIS A 539 -2.947 8.396 0.316 1.00 0.00 H new ATOM 0 HD2 HIS A 539 -1.637 8.282 -2.020 1.00 0.00 H new ATOM 0 HE1 HIS A 539 -1.574 12.452 -2.941 1.00 0.00 H new ATOM 0 HE2 HIS A 539 -0.719 10.131 -3.645 1.00 0.00 H new ATOM 475 N ALA A 540 -4.996 7.020 -1.369 1.00 0.00 N ATOM 476 CA ALA A 540 -5.179 6.050 -2.439 1.00 0.00 C ATOM 477 C ALA A 540 -6.501 6.284 -3.154 1.00 0.00 C ATOM 478 O ALA A 540 -6.518 6.210 -4.378 1.00 0.00 O ATOM 479 CB ALA A 540 -5.132 4.625 -1.877 1.00 0.00 C ATOM 0 H ALA A 540 -4.879 6.587 -0.453 1.00 0.00 H new ATOM 0 HA ALA A 540 -4.369 6.175 -3.157 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -5.270 3.909 -2.688 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -4.166 4.453 -1.402 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -5.926 4.498 -1.141 1.00 0.00 H new ATOM 485 N GLU A 541 -7.579 6.575 -2.426 1.00 0.00 N ATOM 486 CA GLU A 541 -8.840 7.025 -2.987 1.00 0.00 C ATOM 487 C GLU A 541 -8.620 8.331 -3.743 1.00 0.00 C ATOM 488 O GLU A 541 -8.904 8.410 -4.934 1.00 0.00 O ATOM 489 CB GLU A 541 -9.862 7.220 -1.854 1.00 0.00 C ATOM 490 CG GLU A 541 -10.775 6.007 -1.657 1.00 0.00 C ATOM 491 CD GLU A 541 -12.245 6.402 -1.761 1.00 0.00 C ATOM 492 OE1 GLU A 541 -12.709 6.705 -2.884 1.00 0.00 O ATOM 493 OE2 GLU A 541 -12.946 6.439 -0.722 1.00 0.00 O ATOM 0 H GLU A 541 -7.594 6.501 -1.409 1.00 0.00 H new ATOM 0 HA GLU A 541 -9.226 6.279 -3.682 1.00 0.00 H new ATOM 0 HB2 GLU A 541 -9.331 7.423 -0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 541 -10.473 8.096 -2.070 1.00 0.00 H new ATOM 0 HG2 GLU A 541 -10.545 5.250 -2.406 1.00 0.00 H new ATOM 0 HG3 GLU A 541 -10.584 5.559 -0.682 1.00 0.00 H new ATOM 500 N GLU A 542 -8.071 9.338 -3.063 1.00 0.00 N ATOM 501 CA GLU A 542 -8.020 10.721 -3.528 1.00 0.00 C ATOM 502 C GLU A 542 -7.338 10.875 -4.887 1.00 0.00 C ATOM 503 O GLU A 542 -7.658 11.773 -5.665 1.00 0.00 O ATOM 504 CB GLU A 542 -7.258 11.568 -2.499 1.00 0.00 C ATOM 505 CG GLU A 542 -7.801 12.991 -2.485 1.00 0.00 C ATOM 506 CD GLU A 542 -9.000 13.079 -1.541 1.00 0.00 C ATOM 507 OE1 GLU A 542 -10.075 12.509 -1.849 1.00 0.00 O ATOM 508 OE2 GLU A 542 -8.822 13.704 -0.470 1.00 0.00 O ATOM 0 H GLU A 542 -7.638 9.209 -2.149 1.00 0.00 H new ATOM 0 HA GLU A 542 -9.051 11.056 -3.641 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -7.355 11.124 -1.508 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -6.195 11.579 -2.741 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -7.023 13.684 -2.165 1.00 0.00 H new ATOM 0 HG3 GLU A 542 -8.097 13.287 -3.492 1.00 0.00 H new ATOM 515 N THR A 543 -6.375 10.001 -5.160 1.00 0.00 N ATOM 516 CA THR A 543 -5.561 10.025 -6.364 1.00 0.00 C ATOM 517 C THR A 543 -5.815 8.793 -7.245 1.00 0.00 C ATOM 518 O THR A 543 -5.169 8.626 -8.282 1.00 0.00 O ATOM 519 CB THR A 543 -4.091 10.207 -5.953 1.00 0.00 C ATOM 520 OG1 THR A 543 -3.663 9.226 -5.015 1.00 0.00 O ATOM 521 CG2 THR A 543 -3.839 11.585 -5.332 1.00 0.00 C ATOM 0 H THR A 543 -6.135 9.236 -4.530 1.00 0.00 H new ATOM 0 HA THR A 543 -5.840 10.870 -6.994 1.00 0.00 H new ATOM 0 HB THR A 543 -3.522 10.101 -6.877 1.00 0.00 H new ATOM 0 HG1 THR A 543 -4.178 9.319 -4.187 1.00 0.00 H new ATOM 0 HG21 THR A 543 -2.788 11.673 -5.055 1.00 0.00 H new ATOM 0 HG22 THR A 543 -4.090 12.361 -6.055 1.00 0.00 H new ATOM 0 HG23 THR A 543 -4.459 11.702 -4.443 1.00 0.00 H new ATOM 529 N ARG A 544 -6.742 7.922 -6.817 1.00 0.00 N ATOM 530 CA ARG A 544 -7.038 6.595 -7.351 1.00 0.00 C ATOM 531 C ARG A 544 -5.775 5.773 -7.628 1.00 0.00 C ATOM 532 O ARG A 544 -5.704 5.049 -8.626 1.00 0.00 O ATOM 533 CB ARG A 544 -8.051 6.689 -8.502 1.00 0.00 C ATOM 534 CG ARG A 544 -9.461 6.986 -7.952 1.00 0.00 C ATOM 535 CD ARG A 544 -9.808 8.473 -7.905 1.00 0.00 C ATOM 536 NE ARG A 544 -10.327 8.917 -9.207 1.00 0.00 N ATOM 537 CZ ARG A 544 -11.523 9.460 -9.453 1.00 0.00 C ATOM 538 NH1 ARG A 544 -12.313 9.900 -8.486 1.00 0.00 N ATOM 539 NH2 ARG A 544 -11.950 9.561 -10.702 1.00 0.00 N ATOM 0 H ARG A 544 -7.347 8.150 -6.028 1.00 0.00 H new ATOM 0 HA ARG A 544 -7.538 6.005 -6.583 1.00 0.00 H new ATOM 0 HB2 ARG A 544 -7.751 7.474 -9.196 1.00 0.00 H new ATOM 0 HB3 ARG A 544 -8.062 5.755 -9.063 1.00 0.00 H new ATOM 0 HG2 ARG A 544 -10.197 6.471 -8.569 1.00 0.00 H new ATOM 0 HG3 ARG A 544 -9.543 6.572 -6.947 1.00 0.00 H new ATOM 0 HD2 ARG A 544 -10.551 8.656 -7.128 1.00 0.00 H new ATOM 0 HD3 ARG A 544 -8.923 9.052 -7.642 1.00 0.00 H new ATOM 0 HE ARG A 544 -9.708 8.798 -10.009 1.00 0.00 H new ATOM 0 HH11 ARG A 544 -12.015 9.831 -7.513 1.00 0.00 H new ATOM 0 HH12 ARG A 544 -13.219 10.309 -8.714 1.00 0.00 H new ATOM 0 HH21 ARG A 544 -11.367 9.225 -11.469 1.00 0.00 H new ATOM 0 HH22 ARG A 544 -12.862 9.974 -10.897 1.00 0.00 H new ATOM 553 N LYS A 545 -4.775 5.885 -6.744 1.00 0.00 N ATOM 554 CA LYS A 545 -3.496 5.184 -6.863 1.00 0.00 C ATOM 555 C LYS A 545 -3.600 3.795 -6.259 1.00 0.00 C ATOM 556 O LYS A 545 -4.222 3.623 -5.210 1.00 0.00 O ATOM 557 CB LYS A 545 -2.362 6.016 -6.255 1.00 0.00 C ATOM 558 CG LYS A 545 -2.038 7.148 -7.238 1.00 0.00 C ATOM 559 CD LYS A 545 -0.995 8.134 -6.733 1.00 0.00 C ATOM 560 CE LYS A 545 -0.922 9.260 -7.767 1.00 0.00 C ATOM 561 NZ LYS A 545 0.070 10.292 -7.448 1.00 0.00 N ATOM 0 H LYS A 545 -4.836 6.475 -5.914 1.00 0.00 H new ATOM 0 HA LYS A 545 -3.252 5.055 -7.918 1.00 0.00 H new ATOM 0 HB2 LYS A 545 -2.661 6.422 -5.289 1.00 0.00 H new ATOM 0 HB3 LYS A 545 -1.482 5.396 -6.082 1.00 0.00 H new ATOM 0 HG2 LYS A 545 -1.687 6.712 -8.173 1.00 0.00 H new ATOM 0 HG3 LYS A 545 -2.956 7.691 -7.464 1.00 0.00 H new ATOM 0 HD2 LYS A 545 -1.273 8.524 -5.754 1.00 0.00 H new ATOM 0 HD3 LYS A 545 -0.026 7.649 -6.619 1.00 0.00 H new ATOM 0 HE2 LYS A 545 -0.687 8.832 -8.741 1.00 0.00 H new ATOM 0 HE3 LYS A 545 -1.903 9.726 -7.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 545 -0.362 11.232 -7.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 545 0.399 10.167 -6.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 545 0.878 10.210 -8.098 1.00 0.00 H new ATOM 575 N LEU A 546 -3.020 2.807 -6.936 1.00 0.00 N ATOM 576 CA LEU A 546 -3.060 1.410 -6.540 1.00 0.00 C ATOM 577 C LEU A 546 -2.354 1.222 -5.202 1.00 0.00 C ATOM 578 O LEU A 546 -1.250 1.736 -4.980 1.00 0.00 O ATOM 579 CB LEU A 546 -2.413 0.549 -7.635 1.00 0.00 C ATOM 580 CG LEU A 546 -2.446 -0.975 -7.409 1.00 0.00 C ATOM 581 CD1 LEU A 546 -3.857 -1.526 -7.628 1.00 0.00 C ATOM 582 CD2 LEU A 546 -1.503 -1.662 -8.403 1.00 0.00 C ATOM 0 H LEU A 546 -2.497 2.965 -7.797 1.00 0.00 H new ATOM 0 HA LEU A 546 -4.096 1.094 -6.417 1.00 0.00 H new ATOM 0 HB2 LEU A 546 -2.910 0.766 -8.580 1.00 0.00 H new ATOM 0 HB3 LEU A 546 -1.373 0.857 -7.744 1.00 0.00 H new ATOM 0 HG LEU A 546 -2.134 -1.173 -6.383 1.00 0.00 H new ATOM 0 HD11 LEU A 546 -3.857 -2.603 -7.463 1.00 0.00 H new ATOM 0 HD12 LEU A 546 -4.545 -1.052 -6.928 1.00 0.00 H new ATOM 0 HD13 LEU A 546 -4.175 -1.315 -8.649 1.00 0.00 H new ATOM 0 HD21 LEU A 546 -1.527 -2.740 -8.242 1.00 0.00 H new ATOM 0 HD22 LEU A 546 -1.823 -1.440 -9.421 1.00 0.00 H new ATOM 0 HD23 LEU A 546 -0.487 -1.296 -8.254 1.00 0.00 H new ATOM 594 N MET A 547 -2.967 0.416 -4.341 1.00 0.00 N ATOM 595 CA MET A 547 -2.514 0.138 -2.995 1.00 0.00 C ATOM 596 C MET A 547 -2.179 -1.360 -2.894 1.00 0.00 C ATOM 597 O MET A 547 -3.079 -2.185 -2.731 1.00 0.00 O ATOM 598 CB MET A 547 -3.601 0.610 -2.017 1.00 0.00 C ATOM 599 CG MET A 547 -3.041 0.819 -0.610 1.00 0.00 C ATOM 600 SD MET A 547 -4.135 1.781 0.464 1.00 0.00 S ATOM 601 CE MET A 547 -3.481 1.357 2.093 1.00 0.00 C ATOM 0 H MET A 547 -3.827 -0.078 -4.578 1.00 0.00 H new ATOM 0 HA MET A 547 -1.603 0.677 -2.736 1.00 0.00 H new ATOM 0 HB2 MET A 547 -4.036 1.542 -2.378 1.00 0.00 H new ATOM 0 HB3 MET A 547 -4.405 -0.125 -1.984 1.00 0.00 H new ATOM 0 HG2 MET A 547 -2.857 -0.153 -0.152 1.00 0.00 H new ATOM 0 HG3 MET A 547 -2.078 1.325 -0.682 1.00 0.00 H new ATOM 0 HE1 MET A 547 -3.604 2.205 2.767 1.00 0.00 H new ATOM 0 HE2 MET A 547 -4.021 0.497 2.489 1.00 0.00 H new ATOM 0 HE3 MET A 547 -2.422 1.112 2.008 1.00 0.00 H new ATOM 611 N PRO A 548 -0.907 -1.768 -3.038 1.00 0.00 N ATOM 612 CA PRO A 548 -0.520 -3.170 -2.901 1.00 0.00 C ATOM 613 C PRO A 548 -0.658 -3.596 -1.427 1.00 0.00 C ATOM 614 O PRO A 548 -0.223 -2.837 -0.559 1.00 0.00 O ATOM 615 CB PRO A 548 0.927 -3.217 -3.417 1.00 0.00 C ATOM 616 CG PRO A 548 1.476 -1.828 -3.137 1.00 0.00 C ATOM 617 CD PRO A 548 0.255 -0.925 -3.282 1.00 0.00 C ATOM 0 HA PRO A 548 -1.145 -3.865 -3.462 1.00 0.00 H new ATOM 0 HB2 PRO A 548 1.507 -3.984 -2.903 1.00 0.00 H new ATOM 0 HB3 PRO A 548 0.962 -3.450 -4.481 1.00 0.00 H new ATOM 0 HG2 PRO A 548 1.908 -1.761 -2.138 1.00 0.00 H new ATOM 0 HG3 PRO A 548 2.261 -1.557 -3.843 1.00 0.00 H new ATOM 0 HD2 PRO A 548 0.294 -0.101 -2.570 1.00 0.00 H new ATOM 0 HD3 PRO A 548 0.213 -0.484 -4.278 1.00 0.00 H new ATOM 625 N ILE A 549 -1.224 -4.770 -1.116 1.00 0.00 N ATOM 626 CA ILE A 549 -1.422 -5.246 0.261 1.00 0.00 C ATOM 627 C ILE A 549 -1.122 -6.749 0.320 1.00 0.00 C ATOM 628 O ILE A 549 -1.589 -7.498 -0.536 1.00 0.00 O ATOM 629 CB ILE A 549 -2.880 -4.987 0.707 1.00 0.00 C ATOM 630 CG1 ILE A 549 -3.367 -3.528 0.642 1.00 0.00 C ATOM 631 CG2 ILE A 549 -3.158 -5.524 2.114 1.00 0.00 C ATOM 632 CD1 ILE A 549 -2.786 -2.538 1.658 1.00 0.00 C ATOM 0 H ILE A 549 -1.562 -5.424 -1.822 1.00 0.00 H new ATOM 0 HA ILE A 549 -0.750 -4.709 0.930 1.00 0.00 H new ATOM 0 HB ILE A 549 -3.448 -5.536 -0.044 1.00 0.00 H new ATOM 0 HG12 ILE A 549 -3.154 -3.147 -0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 549 -4.451 -3.530 0.758 1.00 0.00 H new ATOM 0 HG21 ILE A 549 -4.194 -5.319 2.384 1.00 0.00 H new ATOM 0 HG22 ILE A 549 -2.984 -6.600 2.134 1.00 0.00 H new ATOM 0 HG23 ILE A 549 -2.494 -5.036 2.827 1.00 0.00 H new ATOM 0 HD11 ILE A 549 -3.219 -1.551 1.493 1.00 0.00 H new ATOM 0 HD12 ILE A 549 -3.021 -2.873 2.668 1.00 0.00 H new ATOM 0 HD13 ILE A 549 -1.704 -2.484 1.536 1.00 0.00 H new ATOM 644 N CYS A 550 -0.444 -7.215 1.370 1.00 0.00 N ATOM 645 CA CYS A 550 -0.151 -8.633 1.582 1.00 0.00 C ATOM 646 C CYS A 550 -1.255 -9.251 2.448 1.00 0.00 C ATOM 647 O CYS A 550 -1.374 -8.895 3.620 1.00 0.00 O ATOM 648 CB CYS A 550 1.215 -8.791 2.263 1.00 0.00 C ATOM 649 SG CYS A 550 1.725 -10.535 2.260 1.00 0.00 S ATOM 0 H CYS A 550 -0.079 -6.611 2.106 1.00 0.00 H new ATOM 0 HA CYS A 550 -0.118 -9.148 0.622 1.00 0.00 H new ATOM 0 HB2 CYS A 550 1.959 -8.187 1.744 1.00 0.00 H new ATOM 0 HB3 CYS A 550 1.163 -8.422 3.287 1.00 0.00 H new ATOM 0 HG CYS A 550 2.884 -10.649 2.838 1.00 0.00 H new ATOM 655 N MET A 551 -2.054 -10.174 1.898 1.00 0.00 N ATOM 656 CA MET A 551 -3.240 -10.721 2.577 1.00 0.00 C ATOM 657 C MET A 551 -2.910 -11.527 3.835 1.00 0.00 C ATOM 658 O MET A 551 -3.806 -11.803 4.635 1.00 0.00 O ATOM 659 CB MET A 551 -4.104 -11.559 1.615 1.00 0.00 C ATOM 660 CG MET A 551 -3.384 -12.814 1.109 1.00 0.00 C ATOM 661 SD MET A 551 -4.397 -13.991 0.181 1.00 0.00 S ATOM 662 CE MET A 551 -4.833 -12.972 -1.249 1.00 0.00 C ATOM 0 H MET A 551 -1.898 -10.564 0.969 1.00 0.00 H new ATOM 0 HA MET A 551 -3.812 -9.853 2.904 1.00 0.00 H new ATOM 0 HB2 MET A 551 -5.023 -11.853 2.122 1.00 0.00 H new ATOM 0 HB3 MET A 551 -4.393 -10.943 0.763 1.00 0.00 H new ATOM 0 HG2 MET A 551 -2.554 -12.502 0.476 1.00 0.00 H new ATOM 0 HG3 MET A 551 -2.954 -13.332 1.966 1.00 0.00 H new ATOM 0 HE1 MET A 551 -5.401 -13.569 -1.962 1.00 0.00 H new ATOM 0 HE2 MET A 551 -5.437 -12.126 -0.922 1.00 0.00 H new ATOM 0 HE3 MET A 551 -3.924 -12.606 -1.726 1.00 0.00 H new ATOM 672 N ASP A 552 -1.645 -11.920 4.002 1.00 0.00 N ATOM 673 CA ASP A 552 -1.182 -12.623 5.191 1.00 0.00 C ATOM 674 C ASP A 552 -1.209 -11.747 6.440 1.00 0.00 C ATOM 675 O ASP A 552 -1.333 -12.287 7.542 1.00 0.00 O ATOM 676 CB ASP A 552 0.250 -13.095 4.954 1.00 0.00 C ATOM 677 CG ASP A 552 0.816 -13.826 6.165 1.00 0.00 C ATOM 678 OD1 ASP A 552 0.603 -15.058 6.259 1.00 0.00 O ATOM 679 OD2 ASP A 552 1.528 -13.199 6.977 1.00 0.00 O ATOM 0 H ASP A 552 -0.913 -11.757 3.311 1.00 0.00 H new ATOM 0 HA ASP A 552 -1.858 -13.461 5.362 1.00 0.00 H new ATOM 0 HB2 ASP A 552 0.276 -13.755 4.087 1.00 0.00 H new ATOM 0 HB3 ASP A 552 0.881 -12.237 4.720 1.00 0.00 H new ATOM 684 N VAL A 553 -1.083 -10.426 6.285 1.00 0.00 N ATOM 685 CA VAL A 553 -1.043 -9.479 7.389 1.00 0.00 C ATOM 686 C VAL A 553 -2.488 -9.238 7.821 1.00 0.00 C ATOM 687 O VAL A 553 -3.075 -8.189 7.553 1.00 0.00 O ATOM 688 CB VAL A 553 -0.271 -8.204 6.988 1.00 0.00 C ATOM 689 CG1 VAL A 553 -0.027 -7.322 8.220 1.00 0.00 C ATOM 690 CG2 VAL A 553 1.106 -8.526 6.386 1.00 0.00 C ATOM 0 H VAL A 553 -1.005 -9.983 5.370 1.00 0.00 H new ATOM 0 HA VAL A 553 -0.492 -9.867 8.246 1.00 0.00 H new ATOM 0 HB VAL A 553 -0.885 -7.694 6.246 1.00 0.00 H new ATOM 0 HG11 VAL A 553 0.518 -6.426 7.924 1.00 0.00 H new ATOM 0 HG12 VAL A 553 -0.983 -7.036 8.658 1.00 0.00 H new ATOM 0 HG13 VAL A 553 0.558 -7.876 8.954 1.00 0.00 H new ATOM 0 HG21 VAL A 553 1.612 -7.598 6.119 1.00 0.00 H new ATOM 0 HG22 VAL A 553 1.705 -9.069 7.117 1.00 0.00 H new ATOM 0 HG23 VAL A 553 0.979 -9.140 5.494 1.00 0.00 H new ATOM 700 N ARG A 554 -3.074 -10.238 8.485 1.00 0.00 N ATOM 701 CA ARG A 554 -4.493 -10.304 8.822 1.00 0.00 C ATOM 702 C ARG A 554 -4.975 -9.027 9.509 1.00 0.00 C ATOM 703 O ARG A 554 -6.091 -8.596 9.231 1.00 0.00 O ATOM 704 CB ARG A 554 -4.764 -11.536 9.702 1.00 0.00 C ATOM 705 CG ARG A 554 -4.597 -12.903 9.013 1.00 0.00 C ATOM 706 CD ARG A 554 -5.605 -13.115 7.872 1.00 0.00 C ATOM 707 NE ARG A 554 -6.235 -14.443 7.942 1.00 0.00 N ATOM 708 CZ ARG A 554 -7.481 -14.768 7.577 1.00 0.00 C ATOM 709 NH1 ARG A 554 -8.280 -13.882 6.993 1.00 0.00 N ATOM 710 NH2 ARG A 554 -7.928 -15.993 7.825 1.00 0.00 N ATOM 0 H ARG A 554 -2.552 -11.051 8.813 1.00 0.00 H new ATOM 0 HA ARG A 554 -5.057 -10.398 7.894 1.00 0.00 H new ATOM 0 HB2 ARG A 554 -4.094 -11.499 10.561 1.00 0.00 H new ATOM 0 HB3 ARG A 554 -5.781 -11.467 10.088 1.00 0.00 H new ATOM 0 HG2 ARG A 554 -3.584 -12.986 8.619 1.00 0.00 H new ATOM 0 HG3 ARG A 554 -4.717 -13.696 9.752 1.00 0.00 H new ATOM 0 HD2 ARG A 554 -6.374 -12.344 7.918 1.00 0.00 H new ATOM 0 HD3 ARG A 554 -5.099 -13.003 6.913 1.00 0.00 H new ATOM 0 HE ARG A 554 -5.658 -15.200 8.309 1.00 0.00 H new ATOM 0 HH11 ARG A 554 -7.947 -12.934 6.815 1.00 0.00 H new ATOM 0 HH12 ARG A 554 -9.226 -14.149 6.722 1.00 0.00 H new ATOM 0 HH21 ARG A 554 -7.324 -16.672 8.288 1.00 0.00 H new ATOM 0 HH22 ARG A 554 -8.875 -16.255 7.553 1.00 0.00 H new ATOM 724 N ALA A 555 -4.141 -8.386 10.331 1.00 0.00 N ATOM 725 CA ALA A 555 -4.452 -7.126 10.989 1.00 0.00 C ATOM 726 C ALA A 555 -4.753 -5.983 10.019 1.00 0.00 C ATOM 727 O ALA A 555 -5.643 -5.175 10.290 1.00 0.00 O ATOM 728 CB ALA A 555 -3.269 -6.720 11.862 1.00 0.00 C ATOM 0 H ALA A 555 -3.212 -8.740 10.559 1.00 0.00 H new ATOM 0 HA ALA A 555 -5.355 -7.294 11.575 1.00 0.00 H new ATOM 0 HB1 ALA A 555 -3.491 -5.776 12.360 1.00 0.00 H new ATOM 0 HB2 ALA A 555 -3.087 -7.491 12.610 1.00 0.00 H new ATOM 0 HB3 ALA A 555 -2.382 -6.602 11.240 1.00 0.00 H new ATOM 734 N ILE A 556 -3.989 -5.834 8.936 1.00 0.00 N ATOM 735 CA ILE A 556 -4.219 -4.789 7.940 1.00 0.00 C ATOM 736 C ILE A 556 -5.543 -5.096 7.239 1.00 0.00 C ATOM 737 O ILE A 556 -6.373 -4.198 7.057 1.00 0.00 O ATOM 738 CB ILE A 556 -2.990 -4.708 7.009 1.00 0.00 C ATOM 739 CG1 ILE A 556 -1.853 -3.858 7.625 1.00 0.00 C ATOM 740 CG2 ILE A 556 -3.324 -4.110 5.631 1.00 0.00 C ATOM 741 CD1 ILE A 556 -1.554 -3.997 9.125 1.00 0.00 C ATOM 0 H ILE A 556 -3.193 -6.436 8.725 1.00 0.00 H new ATOM 0 HA ILE A 556 -4.320 -3.796 8.377 1.00 0.00 H new ATOM 0 HB ILE A 556 -2.665 -5.741 6.886 1.00 0.00 H new ATOM 0 HG12 ILE A 556 -0.936 -4.091 7.083 1.00 0.00 H new ATOM 0 HG13 ILE A 556 -2.082 -2.810 7.430 1.00 0.00 H new ATOM 0 HG21 ILE A 556 -2.422 -4.078 5.020 1.00 0.00 H new ATOM 0 HG22 ILE A 556 -4.074 -4.728 5.138 1.00 0.00 H new ATOM 0 HG23 ILE A 556 -3.713 -3.100 5.757 1.00 0.00 H new ATOM 0 HD11 ILE A 556 -0.732 -3.335 9.395 1.00 0.00 H new ATOM 0 HD12 ILE A 556 -2.440 -3.728 9.699 1.00 0.00 H new ATOM 0 HD13 ILE A 556 -1.278 -5.028 9.347 1.00 0.00 H new ATOM 753 N MET A 557 -5.769 -6.372 6.917 1.00 0.00 N ATOM 754 CA MET A 557 -6.990 -6.816 6.265 1.00 0.00 C ATOM 755 C MET A 557 -8.191 -6.504 7.164 1.00 0.00 C ATOM 756 O MET A 557 -9.214 -5.984 6.721 1.00 0.00 O ATOM 757 CB MET A 557 -6.903 -8.313 5.912 1.00 0.00 C ATOM 758 CG MET A 557 -5.574 -8.760 5.286 1.00 0.00 C ATOM 759 SD MET A 557 -4.887 -7.657 4.026 1.00 0.00 S ATOM 760 CE MET A 557 -6.217 -7.782 2.820 1.00 0.00 C ATOM 0 H MET A 557 -5.105 -7.123 7.104 1.00 0.00 H new ATOM 0 HA MET A 557 -7.121 -6.277 5.327 1.00 0.00 H new ATOM 0 HB2 MET A 557 -7.073 -8.894 6.818 1.00 0.00 H new ATOM 0 HB3 MET A 557 -7.711 -8.555 5.222 1.00 0.00 H new ATOM 0 HG2 MET A 557 -4.839 -8.873 6.083 1.00 0.00 H new ATOM 0 HG3 MET A 557 -5.717 -9.745 4.841 1.00 0.00 H new ATOM 0 HE1 MET A 557 -5.807 -7.685 1.815 1.00 0.00 H new ATOM 0 HE2 MET A 557 -6.709 -8.750 2.920 1.00 0.00 H new ATOM 0 HE3 MET A 557 -6.942 -6.987 2.994 1.00 0.00 H new ATOM 770 N ALA A 558 -8.046 -6.707 8.473 1.00 0.00 N ATOM 771 CA ALA A 558 -9.088 -6.414 9.439 1.00 0.00 C ATOM 772 C ALA A 558 -9.538 -4.947 9.408 1.00 0.00 C ATOM 773 O ALA A 558 -10.669 -4.672 9.811 1.00 0.00 O ATOM 774 CB ALA A 558 -8.603 -6.791 10.839 1.00 0.00 C ATOM 0 H ALA A 558 -7.194 -7.082 8.889 1.00 0.00 H new ATOM 0 HA ALA A 558 -9.960 -7.010 9.169 1.00 0.00 H new ATOM 0 HB1 ALA A 558 -9.385 -6.571 11.566 1.00 0.00 H new ATOM 0 HB2 ALA A 558 -8.368 -7.855 10.869 1.00 0.00 H new ATOM 0 HB3 ALA A 558 -7.710 -6.216 11.082 1.00 0.00 H new ATOM 780 N THR A 559 -8.712 -4.004 8.941 1.00 0.00 N ATOM 781 CA THR A 559 -9.164 -2.643 8.688 1.00 0.00 C ATOM 782 C THR A 559 -9.893 -2.598 7.342 1.00 0.00 C ATOM 783 O THR A 559 -11.040 -2.152 7.308 1.00 0.00 O ATOM 784 CB THR A 559 -7.994 -1.649 8.757 1.00 0.00 C ATOM 785 OG1 THR A 559 -7.288 -1.807 9.973 1.00 0.00 O ATOM 786 CG2 THR A 559 -8.463 -0.192 8.678 1.00 0.00 C ATOM 0 H THR A 559 -7.727 -4.165 8.732 1.00 0.00 H new ATOM 0 HA THR A 559 -9.865 -2.339 9.465 1.00 0.00 H new ATOM 0 HB THR A 559 -7.356 -1.865 7.900 1.00 0.00 H new ATOM 0 HG1 THR A 559 -6.544 -1.170 10.005 1.00 0.00 H new ATOM 0 HG21 THR A 559 -7.600 0.471 8.731 1.00 0.00 H new ATOM 0 HG22 THR A 559 -8.989 -0.029 7.737 1.00 0.00 H new ATOM 0 HG23 THR A 559 -9.135 0.020 9.510 1.00 0.00 H new ATOM 794 N ILE A 560 -9.269 -3.040 6.239 1.00 0.00 N ATOM 795 CA ILE A 560 -9.821 -2.875 4.895 1.00 0.00 C ATOM 796 C ILE A 560 -11.167 -3.603 4.804 1.00 0.00 C ATOM 797 O ILE A 560 -12.197 -2.972 4.573 1.00 0.00 O ATOM 798 CB ILE A 560 -8.818 -3.350 3.820 1.00 0.00 C ATOM 799 CG1 ILE A 560 -7.514 -2.529 3.845 1.00 0.00 C ATOM 800 CG2 ILE A 560 -9.458 -3.245 2.418 1.00 0.00 C ATOM 801 CD1 ILE A 560 -6.359 -3.268 3.159 1.00 0.00 C ATOM 0 H ILE A 560 -8.369 -3.520 6.259 1.00 0.00 H new ATOM 0 HA ILE A 560 -9.997 -1.817 4.701 1.00 0.00 H new ATOM 0 HB ILE A 560 -8.570 -4.388 4.043 1.00 0.00 H new ATOM 0 HG12 ILE A 560 -7.678 -1.572 3.349 1.00 0.00 H new ATOM 0 HG13 ILE A 560 -7.243 -2.310 4.878 1.00 0.00 H new ATOM 0 HG21 ILE A 560 -8.744 -3.582 1.666 1.00 0.00 H new ATOM 0 HG22 ILE A 560 -10.350 -3.870 2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 560 -9.732 -2.209 2.220 1.00 0.00 H new ATOM 0 HD11 ILE A 560 -5.459 -2.654 3.199 1.00 0.00 H new ATOM 0 HD12 ILE A 560 -6.177 -4.213 3.671 1.00 0.00 H new ATOM 0 HD13 ILE A 560 -6.619 -3.463 2.119 1.00 0.00 H new ATOM 813 N GLN A 561 -11.192 -4.923 4.985 1.00 0.00 N ATOM 814 CA GLN A 561 -12.383 -5.724 4.803 1.00 0.00 C ATOM 815 C GLN A 561 -13.510 -5.335 5.780 1.00 0.00 C ATOM 816 O GLN A 561 -14.673 -5.599 5.480 1.00 0.00 O ATOM 817 CB GLN A 561 -12.029 -7.215 4.860 1.00 0.00 C ATOM 818 CG GLN A 561 -11.289 -7.730 3.604 1.00 0.00 C ATOM 819 CD GLN A 561 -9.994 -7.005 3.271 1.00 0.00 C ATOM 820 OE1 GLN A 561 -9.171 -6.761 4.124 1.00 0.00 O ATOM 821 NE2 GLN A 561 -9.770 -6.617 2.029 1.00 0.00 N ATOM 0 H GLN A 561 -10.373 -5.463 5.265 1.00 0.00 H new ATOM 0 HA GLN A 561 -12.785 -5.517 3.811 1.00 0.00 H new ATOM 0 HB2 GLN A 561 -11.408 -7.398 5.737 1.00 0.00 H new ATOM 0 HB3 GLN A 561 -12.945 -7.791 4.992 1.00 0.00 H new ATOM 0 HG2 GLN A 561 -11.069 -8.789 3.741 1.00 0.00 H new ATOM 0 HG3 GLN A 561 -11.960 -7.652 2.749 1.00 0.00 H new ATOM 0 HE21 GLN A 561 -10.456 -6.817 1.301 1.00 0.00 H new ATOM 0 HE22 GLN A 561 -8.911 -6.118 1.798 1.00 0.00 H new ATOM 830 N ARG A 562 -13.220 -4.679 6.916 1.00 0.00 N ATOM 831 CA ARG A 562 -14.236 -4.055 7.775 1.00 0.00 C ATOM 832 C ARG A 562 -14.749 -2.771 7.155 1.00 0.00 C ATOM 833 O ARG A 562 -15.953 -2.574 7.055 1.00 0.00 O ATOM 834 CB ARG A 562 -13.657 -3.803 9.177 1.00 0.00 C ATOM 835 CG ARG A 562 -14.546 -3.041 10.182 1.00 0.00 C ATOM 836 CD ARG A 562 -14.413 -1.503 10.115 1.00 0.00 C ATOM 837 NE ARG A 562 -14.361 -0.881 11.456 1.00 0.00 N ATOM 838 CZ ARG A 562 -13.859 0.335 11.737 1.00 0.00 C ATOM 839 NH1 ARG A 562 -13.545 1.187 10.767 1.00 0.00 N ATOM 840 NH2 ARG A 562 -13.663 0.706 12.996 1.00 0.00 N ATOM 0 H ARG A 562 -12.268 -4.567 7.265 1.00 0.00 H new ATOM 0 HA ARG A 562 -15.082 -4.736 7.870 1.00 0.00 H new ATOM 0 HB2 ARG A 562 -13.402 -4.768 9.616 1.00 0.00 H new ATOM 0 HB3 ARG A 562 -12.725 -3.249 9.063 1.00 0.00 H new ATOM 0 HG2 ARG A 562 -15.587 -3.311 10.005 1.00 0.00 H new ATOM 0 HG3 ARG A 562 -14.298 -3.371 11.191 1.00 0.00 H new ATOM 0 HD2 ARG A 562 -13.510 -1.243 9.562 1.00 0.00 H new ATOM 0 HD3 ARG A 562 -15.256 -1.092 9.560 1.00 0.00 H new ATOM 0 HE ARG A 562 -14.738 -1.421 12.235 1.00 0.00 H new ATOM 0 HH11 ARG A 562 -13.684 0.923 9.792 1.00 0.00 H new ATOM 0 HH12 ARG A 562 -13.165 2.105 10.998 1.00 0.00 H new ATOM 0 HH21 ARG A 562 -13.893 0.068 13.758 1.00 0.00 H new ATOM 0 HH22 ARG A 562 -13.282 1.629 13.202 1.00 0.00 H new ATOM 854 N LYS A 563 -13.843 -1.868 6.783 1.00 0.00 N ATOM 855 CA LYS A 563 -14.173 -0.565 6.221 1.00 0.00 C ATOM 856 C LYS A 563 -15.089 -0.755 5.011 1.00 0.00 C ATOM 857 O LYS A 563 -16.200 -0.234 4.985 1.00 0.00 O ATOM 858 CB LYS A 563 -12.857 0.153 5.856 1.00 0.00 C ATOM 859 CG LYS A 563 -13.066 1.549 5.262 1.00 0.00 C ATOM 860 CD LYS A 563 -13.303 2.632 6.315 1.00 0.00 C ATOM 861 CE LYS A 563 -11.985 3.275 6.774 1.00 0.00 C ATOM 862 NZ LYS A 563 -12.150 4.728 7.012 1.00 0.00 N ATOM 0 H LYS A 563 -12.839 -2.028 6.867 1.00 0.00 H new ATOM 0 HA LYS A 563 -14.711 0.054 6.939 1.00 0.00 H new ATOM 0 HB2 LYS A 563 -12.238 0.236 6.749 1.00 0.00 H new ATOM 0 HB3 LYS A 563 -12.305 -0.458 5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 563 -12.192 1.817 4.668 1.00 0.00 H new ATOM 0 HG3 LYS A 563 -13.918 1.522 4.582 1.00 0.00 H new ATOM 0 HD2 LYS A 563 -13.960 3.400 5.906 1.00 0.00 H new ATOM 0 HD3 LYS A 563 -13.815 2.199 7.174 1.00 0.00 H new ATOM 0 HE2 LYS A 563 -11.641 2.791 7.688 1.00 0.00 H new ATOM 0 HE3 LYS A 563 -11.216 3.113 6.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 563 -11.244 5.134 7.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 563 -12.456 5.191 6.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 563 -12.867 4.880 7.750 1.00 0.00 H new ATOM 876 N TYR A 564 -14.645 -1.513 4.016 1.00 0.00 N ATOM 877 CA TYR A 564 -15.274 -1.577 2.704 1.00 0.00 C ATOM 878 C TYR A 564 -16.261 -2.748 2.667 1.00 0.00 C ATOM 879 O TYR A 564 -16.205 -3.580 1.769 1.00 0.00 O ATOM 880 CB TYR A 564 -14.167 -1.671 1.645 1.00 0.00 C ATOM 881 CG TYR A 564 -13.269 -0.447 1.554 1.00 0.00 C ATOM 882 CD1 TYR A 564 -12.139 -0.314 2.382 1.00 0.00 C ATOM 883 CD2 TYR A 564 -13.573 0.576 0.642 1.00 0.00 C ATOM 884 CE1 TYR A 564 -11.339 0.840 2.326 1.00 0.00 C ATOM 885 CE2 TYR A 564 -12.778 1.732 0.561 1.00 0.00 C ATOM 886 CZ TYR A 564 -11.657 1.873 1.412 1.00 0.00 C ATOM 887 OH TYR A 564 -10.895 3.003 1.377 1.00 0.00 O ATOM 0 H TYR A 564 -13.823 -2.111 4.100 1.00 0.00 H new ATOM 0 HA TYR A 564 -15.857 -0.681 2.490 1.00 0.00 H new ATOM 0 HB2 TYR A 564 -13.549 -2.543 1.861 1.00 0.00 H new ATOM 0 HB3 TYR A 564 -14.628 -1.840 0.672 1.00 0.00 H new ATOM 0 HD1 TYR A 564 -11.884 -1.108 3.068 1.00 0.00 H new ATOM 0 HD2 TYR A 564 -14.430 0.473 -0.007 1.00 0.00 H new ATOM 0 HE1 TYR A 564 -10.484 0.938 2.978 1.00 0.00 H new ATOM 0 HE2 TYR A 564 -13.022 2.509 -0.148 1.00 0.00 H new ATOM 0 HH TYR A 564 -10.525 3.176 2.268 1.00 0.00 H new ATOM 897 N LYS A 565 -17.118 -2.869 3.690 1.00 0.00 N ATOM 898 CA LYS A 565 -17.579 -4.143 4.246 1.00 0.00 C ATOM 899 C LYS A 565 -18.131 -5.184 3.279 1.00 0.00 C ATOM 900 O LYS A 565 -18.117 -6.366 3.632 1.00 0.00 O ATOM 901 CB LYS A 565 -18.526 -3.917 5.433 1.00 0.00 C ATOM 902 CG LYS A 565 -19.975 -3.732 4.982 1.00 0.00 C ATOM 903 CD LYS A 565 -20.974 -3.749 6.145 1.00 0.00 C ATOM 904 CE LYS A 565 -21.172 -5.156 6.727 1.00 0.00 C ATOM 905 NZ LYS A 565 -22.235 -5.921 6.043 1.00 0.00 N ATOM 0 H LYS A 565 -17.519 -2.060 4.165 1.00 0.00 H new ATOM 0 HA LYS A 565 -16.653 -4.609 4.582 1.00 0.00 H new ATOM 0 HB2 LYS A 565 -18.464 -4.766 6.113 1.00 0.00 H new ATOM 0 HB3 LYS A 565 -18.205 -3.037 5.991 1.00 0.00 H new ATOM 0 HG2 LYS A 565 -20.065 -2.786 4.448 1.00 0.00 H new ATOM 0 HG3 LYS A 565 -20.234 -4.522 4.277 1.00 0.00 H new ATOM 0 HD2 LYS A 565 -20.624 -3.080 6.931 1.00 0.00 H new ATOM 0 HD3 LYS A 565 -21.934 -3.363 5.802 1.00 0.00 H new ATOM 0 HE2 LYS A 565 -20.234 -5.707 6.658 1.00 0.00 H new ATOM 0 HE3 LYS A 565 -21.416 -5.074 7.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 565 -22.322 -6.861 6.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 565 -23.139 -5.414 6.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 565 -21.994 -6.027 5.037 1.00 0.00 H new ATOM 919 N GLY A 566 -18.669 -4.790 2.126 1.00 0.00 N ATOM 920 CA GLY A 566 -19.173 -5.737 1.150 1.00 0.00 C ATOM 921 C GLY A 566 -18.097 -6.735 0.704 1.00 0.00 C ATOM 922 O GLY A 566 -18.435 -7.864 0.343 1.00 0.00 O ATOM 0 H GLY A 566 -18.765 -3.813 1.850 1.00 0.00 H new ATOM 0 HA2 GLY A 566 -20.017 -6.280 1.575 1.00 0.00 H new ATOM 0 HA3 GLY A 566 -19.548 -5.196 0.281 1.00 0.00 H new ATOM 926 N ILE A 567 -16.828 -6.324 0.772 1.00 0.00 N ATOM 927 CA ILE A 567 -15.641 -7.060 0.370 1.00 0.00 C ATOM 928 C ILE A 567 -15.320 -8.224 1.337 1.00 0.00 C ATOM 929 O ILE A 567 -15.528 -8.104 2.553 1.00 0.00 O ATOM 930 CB ILE A 567 -14.502 -6.024 0.288 1.00 0.00 C ATOM 931 CG1 ILE A 567 -13.383 -6.550 -0.611 1.00 0.00 C ATOM 932 CG2 ILE A 567 -13.976 -5.631 1.670 1.00 0.00 C ATOM 933 CD1 ILE A 567 -12.093 -5.725 -0.558 1.00 0.00 C ATOM 0 H ILE A 567 -16.594 -5.401 1.137 1.00 0.00 H new ATOM 0 HA ILE A 567 -15.788 -7.544 -0.595 1.00 0.00 H new ATOM 0 HB ILE A 567 -14.906 -5.113 -0.154 1.00 0.00 H new ATOM 0 HG12 ILE A 567 -13.156 -7.577 -0.326 1.00 0.00 H new ATOM 0 HG13 ILE A 567 -13.742 -6.577 -1.640 1.00 0.00 H new ATOM 0 HG21 ILE A 567 -13.175 -4.900 1.560 1.00 0.00 H new ATOM 0 HG22 ILE A 567 -14.785 -5.198 2.258 1.00 0.00 H new ATOM 0 HG23 ILE A 567 -13.592 -6.516 2.178 1.00 0.00 H new ATOM 0 HD11 ILE A 567 -11.351 -6.166 -1.224 1.00 0.00 H new ATOM 0 HD12 ILE A 567 -12.302 -4.703 -0.873 1.00 0.00 H new ATOM 0 HD13 ILE A 567 -11.707 -5.719 0.461 1.00 0.00 H new ATOM 945 N LYS A 568 -14.729 -9.327 0.848 1.00 0.00 N ATOM 946 CA LYS A 568 -14.523 -10.531 1.666 1.00 0.00 C ATOM 947 C LYS A 568 -13.335 -11.401 1.202 1.00 0.00 C ATOM 948 O LYS A 568 -13.395 -12.625 1.247 1.00 0.00 O ATOM 949 CB LYS A 568 -15.877 -11.273 1.700 1.00 0.00 C ATOM 950 CG LYS A 568 -16.146 -11.996 3.025 1.00 0.00 C ATOM 951 CD LYS A 568 -17.640 -11.978 3.391 1.00 0.00 C ATOM 952 CE LYS A 568 -17.986 -12.856 4.604 1.00 0.00 C ATOM 953 NZ LYS A 568 -17.564 -12.272 5.896 1.00 0.00 N ATOM 0 H LYS A 568 -14.386 -9.408 -0.109 1.00 0.00 H new ATOM 0 HA LYS A 568 -14.223 -10.258 2.678 1.00 0.00 H new ATOM 0 HB2 LYS A 568 -16.679 -10.558 1.516 1.00 0.00 H new ATOM 0 HB3 LYS A 568 -15.905 -11.999 0.887 1.00 0.00 H new ATOM 0 HG2 LYS A 568 -15.802 -13.028 2.953 1.00 0.00 H new ATOM 0 HG3 LYS A 568 -15.571 -11.523 3.821 1.00 0.00 H new ATOM 0 HD2 LYS A 568 -17.943 -10.951 3.598 1.00 0.00 H new ATOM 0 HD3 LYS A 568 -18.220 -12.315 2.532 1.00 0.00 H new ATOM 0 HE2 LYS A 568 -19.063 -13.024 4.625 1.00 0.00 H new ATOM 0 HE3 LYS A 568 -17.513 -13.831 4.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 -17.828 -12.915 6.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 -16.533 -12.136 5.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 -18.034 -11.355 6.032 1.00 0.00 H new ATOM 967 N ILE A 569 -12.214 -10.734 0.902 1.00 0.00 N ATOM 968 CA ILE A 569 -10.936 -11.185 0.339 1.00 0.00 C ATOM 969 C ILE A 569 -11.085 -11.908 -1.014 1.00 0.00 C ATOM 970 O ILE A 569 -12.054 -12.615 -1.283 1.00 0.00 O ATOM 971 CB ILE A 569 -10.069 -11.942 1.363 1.00 0.00 C ATOM 972 CG1 ILE A 569 -9.893 -11.222 2.717 1.00 0.00 C ATOM 973 CG2 ILE A 569 -8.663 -12.196 0.779 1.00 0.00 C ATOM 974 CD1 ILE A 569 -9.031 -9.955 2.658 1.00 0.00 C ATOM 0 H ILE A 569 -12.179 -9.729 1.072 1.00 0.00 H new ATOM 0 HA ILE A 569 -10.375 -10.280 0.103 1.00 0.00 H new ATOM 0 HB ILE A 569 -10.609 -12.869 1.557 1.00 0.00 H new ATOM 0 HG12 ILE A 569 -10.877 -10.958 3.104 1.00 0.00 H new ATOM 0 HG13 ILE A 569 -9.446 -11.917 3.428 1.00 0.00 H new ATOM 0 HG21 ILE A 569 -8.057 -12.732 1.510 1.00 0.00 H new ATOM 0 HG22 ILE A 569 -8.749 -12.793 -0.129 1.00 0.00 H new ATOM 0 HG23 ILE A 569 -8.189 -11.243 0.543 1.00 0.00 H new ATOM 0 HD11 ILE A 569 -8.962 -9.515 3.653 1.00 0.00 H new ATOM 0 HD12 ILE A 569 -8.032 -10.211 2.304 1.00 0.00 H new ATOM 0 HD13 ILE A 569 -9.485 -9.237 1.975 1.00 0.00 H new ATOM 986 N GLN A 570 -10.117 -11.655 -1.897 1.00 0.00 N ATOM 987 CA GLN A 570 -10.069 -12.067 -3.288 1.00 0.00 C ATOM 988 C GLN A 570 -8.615 -11.828 -3.702 1.00 0.00 C ATOM 989 O GLN A 570 -8.108 -10.735 -3.475 1.00 0.00 O ATOM 990 CB GLN A 570 -11.055 -11.231 -4.131 1.00 0.00 C ATOM 991 CG GLN A 570 -11.118 -9.716 -3.838 1.00 0.00 C ATOM 992 CD GLN A 570 -11.947 -9.329 -2.616 1.00 0.00 C ATOM 993 OE1 GLN A 570 -11.371 -8.728 -1.581 1.00 0.00 O flip ATOM 994 NE2 GLN A 570 -13.151 -9.540 -2.555 1.00 0.00 N flip ATOM 0 H GLN A 570 -9.291 -11.118 -1.633 1.00 0.00 H new ATOM 0 HA GLN A 570 -10.363 -13.106 -3.438 1.00 0.00 H new ATOM 0 HB2 GLN A 570 -10.798 -11.362 -5.182 1.00 0.00 H new ATOM 0 HB3 GLN A 570 -12.054 -11.645 -3.993 1.00 0.00 H new ATOM 0 HG2 GLN A 570 -10.102 -9.345 -3.701 1.00 0.00 H new ATOM 0 HG3 GLN A 570 -11.528 -9.209 -4.712 1.00 0.00 H new ATOM 0 HE21 GLN A 570 -13.628 -9.999 -3.331 1.00 0.00 H new ATOM 0 HE22 GLN A 570 -13.677 -9.256 -1.729 1.00 0.00 H new ATOM 1003 N GLU A 571 -7.891 -12.834 -4.172 1.00 0.00 N ATOM 1004 CA GLU A 571 -6.499 -12.690 -4.575 1.00 0.00 C ATOM 1005 C GLU A 571 -6.447 -11.983 -5.928 1.00 0.00 C ATOM 1006 O GLU A 571 -7.409 -12.038 -6.701 1.00 0.00 O ATOM 1007 CB GLU A 571 -5.917 -14.104 -4.641 1.00 0.00 C ATOM 1008 CG GLU A 571 -4.393 -14.236 -4.665 1.00 0.00 C ATOM 1009 CD GLU A 571 -4.070 -15.725 -4.541 1.00 0.00 C ATOM 1010 OE1 GLU A 571 -3.956 -16.227 -3.403 1.00 0.00 O ATOM 1011 OE2 GLU A 571 -4.108 -16.411 -5.589 1.00 0.00 O ATOM 0 H GLU A 571 -8.256 -13.780 -4.285 1.00 0.00 H new ATOM 0 HA GLU A 571 -5.918 -12.089 -3.875 1.00 0.00 H new ATOM 0 HB2 GLU A 571 -6.290 -14.663 -3.783 1.00 0.00 H new ATOM 0 HB3 GLU A 571 -6.312 -14.590 -5.533 1.00 0.00 H new ATOM 0 HG2 GLU A 571 -3.985 -13.829 -5.590 1.00 0.00 H new ATOM 0 HG3 GLU A 571 -3.945 -13.675 -3.845 1.00 0.00 H new ATOM 1018 N GLY A 572 -5.304 -11.397 -6.269 1.00 0.00 N ATOM 1019 CA GLY A 572 -5.139 -10.666 -7.521 1.00 0.00 C ATOM 1020 C GLY A 572 -5.447 -9.191 -7.349 1.00 0.00 C ATOM 1021 O GLY A 572 -5.242 -8.587 -6.299 1.00 0.00 O ATOM 0 H GLY A 572 -4.467 -11.415 -5.686 1.00 0.00 H new ATOM 0 HA2 GLY A 572 -4.117 -10.786 -7.881 1.00 0.00 H new ATOM 0 HA3 GLY A 572 -5.796 -11.090 -8.280 1.00 0.00 H new ATOM 1025 N ILE A 573 -5.849 -8.572 -8.448 1.00 0.00 N ATOM 1026 CA ILE A 573 -6.242 -7.173 -8.492 1.00 0.00 C ATOM 1027 C ILE A 573 -7.625 -7.077 -7.828 1.00 0.00 C ATOM 1028 O ILE A 573 -8.472 -7.959 -8.025 1.00 0.00 O ATOM 1029 CB ILE A 573 -6.163 -6.730 -9.964 1.00 0.00 C ATOM 1030 CG1 ILE A 573 -4.671 -6.635 -10.355 1.00 0.00 C ATOM 1031 CG2 ILE A 573 -6.840 -5.375 -10.227 1.00 0.00 C ATOM 1032 CD1 ILE A 573 -4.418 -6.434 -11.851 1.00 0.00 C ATOM 0 H ILE A 573 -5.912 -9.038 -9.353 1.00 0.00 H new ATOM 0 HA ILE A 573 -5.597 -6.490 -7.940 1.00 0.00 H new ATOM 0 HB ILE A 573 -6.697 -7.468 -10.563 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -4.217 -5.808 -9.808 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -4.165 -7.545 -10.033 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -6.748 -5.121 -11.283 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -7.895 -5.437 -9.959 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -6.358 -4.604 -9.626 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -3.345 -6.378 -12.034 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -4.838 -7.272 -12.407 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -4.891 -5.508 -12.179 1.00 0.00 H new ATOM 1044 N VAL A 574 -7.836 -6.034 -7.022 1.00 0.00 N ATOM 1045 CA VAL A 574 -9.027 -5.863 -6.198 1.00 0.00 C ATOM 1046 C VAL A 574 -9.451 -4.405 -6.245 1.00 0.00 C ATOM 1047 O VAL A 574 -9.044 -3.574 -5.437 1.00 0.00 O ATOM 1048 CB VAL A 574 -8.783 -6.352 -4.754 1.00 0.00 C ATOM 1049 CG1 VAL A 574 -10.063 -6.274 -3.910 1.00 0.00 C ATOM 1050 CG2 VAL A 574 -8.247 -7.777 -4.698 1.00 0.00 C ATOM 0 H VAL A 574 -7.167 -5.270 -6.924 1.00 0.00 H new ATOM 0 HA VAL A 574 -9.837 -6.476 -6.593 1.00 0.00 H new ATOM 0 HB VAL A 574 -8.028 -5.682 -4.343 1.00 0.00 H new ATOM 0 HG11 VAL A 574 -9.855 -6.626 -2.900 1.00 0.00 H new ATOM 0 HG12 VAL A 574 -10.410 -5.242 -3.870 1.00 0.00 H new ATOM 0 HG13 VAL A 574 -10.834 -6.899 -4.360 1.00 0.00 H new ATOM 0 HG21 VAL A 574 -8.094 -8.068 -3.659 1.00 0.00 H new ATOM 0 HG22 VAL A 574 -8.964 -8.454 -5.163 1.00 0.00 H new ATOM 0 HG23 VAL A 574 -7.299 -7.830 -5.233 1.00 0.00 H new ATOM 1060 N ASP A 575 -10.284 -4.088 -7.219 1.00 0.00 N ATOM 1061 CA ASP A 575 -10.934 -2.791 -7.327 1.00 0.00 C ATOM 1062 C ASP A 575 -12.147 -2.709 -6.404 1.00 0.00 C ATOM 1063 O ASP A 575 -13.263 -3.051 -6.805 1.00 0.00 O ATOM 1064 CB ASP A 575 -11.352 -2.564 -8.769 1.00 0.00 C ATOM 1065 CG ASP A 575 -12.079 -1.229 -8.917 1.00 0.00 C ATOM 1066 OD1 ASP A 575 -11.657 -0.241 -8.272 1.00 0.00 O ATOM 1067 OD2 ASP A 575 -12.997 -1.136 -9.763 1.00 0.00 O ATOM 0 H ASP A 575 -10.533 -4.733 -7.969 1.00 0.00 H new ATOM 0 HA ASP A 575 -10.232 -2.015 -7.022 1.00 0.00 H new ATOM 0 HB2 ASP A 575 -10.473 -2.579 -9.414 1.00 0.00 H new ATOM 0 HB3 ASP A 575 -12.002 -3.376 -9.097 1.00 0.00 H new ATOM 1072 N TYR A 576 -11.946 -2.284 -5.155 1.00 0.00 N ATOM 1073 CA TYR A 576 -13.021 -2.280 -4.171 1.00 0.00 C ATOM 1074 C TYR A 576 -12.946 -1.059 -3.258 1.00 0.00 C ATOM 1075 O TYR A 576 -12.521 -1.141 -2.106 1.00 0.00 O ATOM 1076 CB TYR A 576 -13.074 -3.624 -3.428 1.00 0.00 C ATOM 1077 CG TYR A 576 -14.481 -3.992 -2.999 1.00 0.00 C ATOM 1078 CD1 TYR A 576 -15.117 -3.284 -1.963 1.00 0.00 C ATOM 1079 CD2 TYR A 576 -15.170 -5.022 -3.668 1.00 0.00 C ATOM 1080 CE1 TYR A 576 -16.431 -3.609 -1.589 1.00 0.00 C ATOM 1081 CE2 TYR A 576 -16.483 -5.356 -3.296 1.00 0.00 C ATOM 1082 CZ TYR A 576 -17.124 -4.643 -2.259 1.00 0.00 C ATOM 1083 OH TYR A 576 -18.418 -4.919 -1.952 1.00 0.00 O ATOM 0 H TYR A 576 -11.051 -1.940 -4.806 1.00 0.00 H new ATOM 0 HA TYR A 576 -13.976 -2.182 -4.687 1.00 0.00 H new ATOM 0 HB2 TYR A 576 -12.677 -4.408 -4.072 1.00 0.00 H new ATOM 0 HB3 TYR A 576 -12.430 -3.576 -2.550 1.00 0.00 H new ATOM 0 HD1 TYR A 576 -14.593 -2.488 -1.454 1.00 0.00 H new ATOM 0 HD2 TYR A 576 -14.687 -5.558 -4.471 1.00 0.00 H new ATOM 0 HE1 TYR A 576 -16.913 -3.068 -0.788 1.00 0.00 H new ATOM 0 HE2 TYR A 576 -17.001 -6.157 -3.802 1.00 0.00 H new ATOM 0 HH TYR A 576 -18.736 -5.659 -2.511 1.00 0.00 H new ATOM 1093 N GLY A 577 -13.389 0.096 -3.760 1.00 0.00 N ATOM 1094 CA GLY A 577 -13.483 1.331 -2.981 1.00 0.00 C ATOM 1095 C GLY A 577 -12.144 2.030 -2.761 1.00 0.00 C ATOM 1096 O GLY A 577 -12.146 3.216 -2.435 1.00 0.00 O ATOM 0 H GLY A 577 -13.695 0.200 -4.727 1.00 0.00 H new ATOM 0 HA2 GLY A 577 -14.161 2.018 -3.488 1.00 0.00 H new ATOM 0 HA3 GLY A 577 -13.926 1.104 -2.011 1.00 0.00 H new ATOM 1100 N VAL A 578 -11.041 1.312 -2.937 1.00 0.00 N ATOM 1101 CA VAL A 578 -9.695 1.734 -3.277 1.00 0.00 C ATOM 1102 C VAL A 578 -9.261 0.688 -4.309 1.00 0.00 C ATOM 1103 O VAL A 578 -9.703 -0.468 -4.266 1.00 0.00 O ATOM 1104 CB VAL A 578 -8.808 1.769 -2.005 1.00 0.00 C ATOM 1105 CG1 VAL A 578 -7.306 1.550 -2.244 1.00 0.00 C ATOM 1106 CG2 VAL A 578 -8.955 3.107 -1.276 1.00 0.00 C ATOM 0 H VAL A 578 -11.079 0.298 -2.831 1.00 0.00 H new ATOM 0 HA VAL A 578 -9.618 2.743 -3.681 1.00 0.00 H new ATOM 0 HB VAL A 578 -9.175 0.930 -1.414 1.00 0.00 H new ATOM 0 HG11 VAL A 578 -6.776 1.593 -1.292 1.00 0.00 H new ATOM 0 HG12 VAL A 578 -7.149 0.574 -2.703 1.00 0.00 H new ATOM 0 HG13 VAL A 578 -6.926 2.328 -2.907 1.00 0.00 H new ATOM 0 HG21 VAL A 578 -8.324 3.108 -0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 578 -8.651 3.918 -1.938 1.00 0.00 H new ATOM 0 HG23 VAL A 578 -9.995 3.249 -0.983 1.00 0.00 H new ATOM 1116 N ARG A 579 -8.403 1.075 -5.251 1.00 0.00 N ATOM 1117 CA ARG A 579 -7.781 0.132 -6.163 1.00 0.00 C ATOM 1118 C ARG A 579 -6.692 -0.581 -5.364 1.00 0.00 C ATOM 1119 O ARG A 579 -5.712 0.061 -4.979 1.00 0.00 O ATOM 1120 CB ARG A 579 -7.252 0.904 -7.391 1.00 0.00 C ATOM 1121 CG ARG A 579 -7.113 0.019 -8.638 1.00 0.00 C ATOM 1122 CD ARG A 579 -8.486 -0.336 -9.234 1.00 0.00 C ATOM 1123 NE ARG A 579 -8.682 0.225 -10.583 1.00 0.00 N ATOM 1124 CZ ARG A 579 -9.677 1.006 -11.024 1.00 0.00 C ATOM 1125 NH1 ARG A 579 -10.678 1.372 -10.228 1.00 0.00 N ATOM 1126 NH2 ARG A 579 -9.684 1.449 -12.274 1.00 0.00 N ATOM 0 H ARG A 579 -8.124 2.045 -5.399 1.00 0.00 H new ATOM 0 HA ARG A 579 -8.469 -0.617 -6.554 1.00 0.00 H new ATOM 0 HB2 ARG A 579 -7.926 1.731 -7.612 1.00 0.00 H new ATOM 0 HB3 ARG A 579 -6.282 1.339 -7.150 1.00 0.00 H new ATOM 0 HG2 ARG A 579 -6.513 0.536 -9.387 1.00 0.00 H new ATOM 0 HG3 ARG A 579 -6.580 -0.896 -8.378 1.00 0.00 H new ATOM 0 HD2 ARG A 579 -8.590 -1.420 -9.277 1.00 0.00 H new ATOM 0 HD3 ARG A 579 -9.271 0.033 -8.574 1.00 0.00 H new ATOM 0 HE ARG A 579 -7.967 -0.012 -11.270 1.00 0.00 H new ATOM 0 HH11 ARG A 579 -10.699 1.057 -9.258 1.00 0.00 H new ATOM 0 HH12 ARG A 579 -11.424 1.967 -10.588 1.00 0.00 H new ATOM 0 HH21 ARG A 579 -8.927 1.196 -12.909 1.00 0.00 H new ATOM 0 HH22 ARG A 579 -10.446 2.043 -12.600 1.00 0.00 H new ATOM 1140 N PHE A 580 -6.836 -1.875 -5.087 1.00 0.00 N ATOM 1141 CA PHE A 580 -5.831 -2.675 -4.394 1.00 0.00 C ATOM 1142 C PHE A 580 -5.263 -3.762 -5.311 1.00 0.00 C ATOM 1143 O PHE A 580 -5.819 -4.061 -6.367 1.00 0.00 O ATOM 1144 CB PHE A 580 -6.423 -3.344 -3.150 1.00 0.00 C ATOM 1145 CG PHE A 580 -7.002 -2.465 -2.067 1.00 0.00 C ATOM 1146 CD1 PHE A 580 -6.152 -1.873 -1.116 1.00 0.00 C ATOM 1147 CD2 PHE A 580 -8.398 -2.348 -1.933 1.00 0.00 C ATOM 1148 CE1 PHE A 580 -6.690 -1.207 -0.006 1.00 0.00 C ATOM 1149 CE2 PHE A 580 -8.940 -1.667 -0.831 1.00 0.00 C ATOM 1150 CZ PHE A 580 -8.087 -1.109 0.136 1.00 0.00 C ATOM 0 H PHE A 580 -7.669 -2.405 -5.343 1.00 0.00 H new ATOM 0 HA PHE A 580 -5.032 -1.996 -4.097 1.00 0.00 H new ATOM 0 HB2 PHE A 580 -7.208 -4.024 -3.481 1.00 0.00 H new ATOM 0 HB3 PHE A 580 -5.642 -3.955 -2.699 1.00 0.00 H new ATOM 0 HD1 PHE A 580 -5.081 -1.932 -1.241 1.00 0.00 H new ATOM 0 HD2 PHE A 580 -9.051 -2.781 -2.676 1.00 0.00 H new ATOM 0 HE1 PHE A 580 -6.037 -0.772 0.736 1.00 0.00 H new ATOM 0 HE2 PHE A 580 -10.011 -1.572 -0.727 1.00 0.00 H new ATOM 0 HZ PHE A 580 -8.505 -0.602 0.993 1.00 0.00 H new ATOM 1160 N PHE A 581 -4.174 -4.385 -4.859 1.00 0.00 N ATOM 1161 CA PHE A 581 -3.496 -5.520 -5.473 1.00 0.00 C ATOM 1162 C PHE A 581 -3.048 -6.427 -4.327 1.00 0.00 C ATOM 1163 O PHE A 581 -2.209 -6.017 -3.522 1.00 0.00 O ATOM 1164 CB PHE A 581 -2.334 -4.992 -6.331 1.00 0.00 C ATOM 1165 CG PHE A 581 -1.280 -5.995 -6.761 1.00 0.00 C ATOM 1166 CD1 PHE A 581 -1.603 -7.054 -7.629 1.00 0.00 C ATOM 1167 CD2 PHE A 581 0.052 -5.830 -6.339 1.00 0.00 C ATOM 1168 CE1 PHE A 581 -0.604 -7.953 -8.041 1.00 0.00 C ATOM 1169 CE2 PHE A 581 1.053 -6.724 -6.749 1.00 0.00 C ATOM 1170 CZ PHE A 581 0.715 -7.810 -7.574 1.00 0.00 C ATOM 0 H PHE A 581 -3.715 -4.088 -3.998 1.00 0.00 H new ATOM 0 HA PHE A 581 -4.133 -6.097 -6.143 1.00 0.00 H new ATOM 0 HB2 PHE A 581 -2.755 -4.538 -7.228 1.00 0.00 H new ATOM 0 HB3 PHE A 581 -1.837 -4.197 -5.775 1.00 0.00 H new ATOM 0 HD1 PHE A 581 -2.618 -7.176 -7.978 1.00 0.00 H new ATOM 0 HD2 PHE A 581 0.307 -5.005 -5.691 1.00 0.00 H new ATOM 0 HE1 PHE A 581 -0.850 -8.757 -8.719 1.00 0.00 H new ATOM 0 HE2 PHE A 581 2.075 -6.578 -6.433 1.00 0.00 H new ATOM 0 HZ PHE A 581 1.467 -8.534 -7.849 1.00 0.00 H new ATOM 1180 N PHE A 582 -3.674 -7.595 -4.188 1.00 0.00 N ATOM 1181 CA PHE A 582 -3.442 -8.608 -3.166 1.00 0.00 C ATOM 1182 C PHE A 582 -2.614 -9.755 -3.747 1.00 0.00 C ATOM 1183 O PHE A 582 -2.880 -10.222 -4.854 1.00 0.00 O ATOM 1184 CB PHE A 582 -4.783 -9.154 -2.642 1.00 0.00 C ATOM 1185 CG PHE A 582 -5.707 -8.203 -1.890 1.00 0.00 C ATOM 1186 CD1 PHE A 582 -5.341 -6.874 -1.590 1.00 0.00 C ATOM 1187 CD2 PHE A 582 -6.942 -8.692 -1.426 1.00 0.00 C ATOM 1188 CE1 PHE A 582 -6.208 -6.048 -0.854 1.00 0.00 C ATOM 1189 CE2 PHE A 582 -7.825 -7.858 -0.732 1.00 0.00 C ATOM 1190 CZ PHE A 582 -7.449 -6.542 -0.427 1.00 0.00 C ATOM 0 H PHE A 582 -4.410 -7.876 -4.836 1.00 0.00 H new ATOM 0 HA PHE A 582 -2.897 -8.151 -2.340 1.00 0.00 H new ATOM 0 HB2 PHE A 582 -5.336 -9.550 -3.494 1.00 0.00 H new ATOM 0 HB3 PHE A 582 -4.565 -9.995 -1.984 1.00 0.00 H new ATOM 0 HD1 PHE A 582 -4.390 -6.489 -1.928 1.00 0.00 H new ATOM 0 HD2 PHE A 582 -7.211 -9.722 -1.608 1.00 0.00 H new ATOM 0 HE1 PHE A 582 -5.919 -5.035 -0.618 1.00 0.00 H new ATOM 0 HE2 PHE A 582 -8.795 -8.227 -0.432 1.00 0.00 H new ATOM 0 HZ PHE A 582 -8.116 -5.908 0.138 1.00 0.00 H new ATOM 1200 N TYR A 583 -1.632 -10.225 -2.980 1.00 0.00 N ATOM 1201 CA TYR A 583 -0.599 -11.164 -3.420 1.00 0.00 C ATOM 1202 C TYR A 583 -0.170 -12.087 -2.266 1.00 0.00 C ATOM 1203 O TYR A 583 -0.698 -12.006 -1.150 1.00 0.00 O ATOM 1204 CB TYR A 583 0.570 -10.359 -4.014 1.00 0.00 C ATOM 1205 CG TYR A 583 0.995 -9.177 -3.165 1.00 0.00 C ATOM 1206 CD1 TYR A 583 1.764 -9.364 -2.005 1.00 0.00 C ATOM 1207 CD2 TYR A 583 0.543 -7.892 -3.499 1.00 0.00 C ATOM 1208 CE1 TYR A 583 2.105 -8.270 -1.193 1.00 0.00 C ATOM 1209 CE2 TYR A 583 0.861 -6.798 -2.684 1.00 0.00 C ATOM 1210 CZ TYR A 583 1.645 -6.978 -1.522 1.00 0.00 C ATOM 1211 OH TYR A 583 1.933 -5.938 -0.690 1.00 0.00 O ATOM 0 H TYR A 583 -1.529 -9.954 -2.002 1.00 0.00 H new ATOM 0 HA TYR A 583 -0.988 -11.824 -4.196 1.00 0.00 H new ATOM 0 HB2 TYR A 583 1.424 -11.023 -4.149 1.00 0.00 H new ATOM 0 HB3 TYR A 583 0.286 -10.000 -5.003 1.00 0.00 H new ATOM 0 HD1 TYR A 583 2.095 -10.356 -1.735 1.00 0.00 H new ATOM 0 HD2 TYR A 583 -0.053 -7.745 -4.388 1.00 0.00 H new ATOM 0 HE1 TYR A 583 2.719 -8.418 -0.317 1.00 0.00 H new ATOM 0 HE2 TYR A 583 0.505 -5.812 -2.945 1.00 0.00 H new ATOM 0 HH TYR A 583 2.785 -6.108 -0.237 1.00 0.00 H new ATOM 1221 N THR A 584 0.768 -12.993 -2.532 1.00 0.00 N ATOM 1222 CA THR A 584 0.937 -14.274 -1.857 1.00 0.00 C ATOM 1223 C THR A 584 2.211 -14.307 -1.033 1.00 0.00 C ATOM 1224 O THR A 584 3.281 -14.352 -1.609 1.00 0.00 O ATOM 1225 CB THR A 584 0.840 -15.402 -2.903 1.00 0.00 C ATOM 1226 OG1 THR A 584 1.559 -15.119 -4.093 1.00 0.00 O ATOM 1227 CG2 THR A 584 -0.617 -15.609 -3.340 1.00 0.00 C ATOM 0 H THR A 584 1.465 -12.844 -3.261 1.00 0.00 H new ATOM 0 HA THR A 584 0.137 -14.426 -1.132 1.00 0.00 H new ATOM 0 HB THR A 584 1.259 -16.281 -2.412 1.00 0.00 H new ATOM 0 HG1 THR A 584 2.370 -14.615 -3.873 1.00 0.00 H new ATOM 0 HG21 THR A 584 -0.665 -16.409 -4.079 1.00 0.00 H new ATOM 0 HG22 THR A 584 -1.222 -15.878 -2.474 1.00 0.00 H new ATOM 0 HG23 THR A 584 -1.000 -14.687 -3.778 1.00 0.00 H new ATOM 1235 N SER A 585 2.126 -14.336 0.302 1.00 0.00 N ATOM 1236 CA SER A 585 3.265 -14.190 1.213 1.00 0.00 C ATOM 1237 C SER A 585 4.431 -15.147 0.953 1.00 0.00 C ATOM 1238 O SER A 585 5.570 -14.847 1.318 1.00 0.00 O ATOM 1239 CB SER A 585 2.778 -14.336 2.655 1.00 0.00 C ATOM 1240 OG SER A 585 1.991 -15.503 2.811 1.00 0.00 O ATOM 0 H SER A 585 1.240 -14.465 0.790 1.00 0.00 H new ATOM 0 HA SER A 585 3.670 -13.195 1.029 1.00 0.00 H new ATOM 0 HB2 SER A 585 3.634 -14.378 3.329 1.00 0.00 H new ATOM 0 HB3 SER A 585 2.194 -13.459 2.936 1.00 0.00 H new ATOM 0 HG SER A 585 1.693 -15.575 3.742 1.00 0.00 H new ATOM 1246 N LYS A 586 4.142 -16.289 0.331 1.00 0.00 N ATOM 1247 CA LYS A 586 5.132 -17.255 -0.101 1.00 0.00 C ATOM 1248 C LYS A 586 6.057 -16.641 -1.150 1.00 0.00 C ATOM 1249 O LYS A 586 7.236 -17.009 -1.172 1.00 0.00 O ATOM 1250 CB LYS A 586 4.423 -18.503 -0.649 1.00 0.00 C ATOM 1251 CG LYS A 586 3.584 -19.213 0.429 1.00 0.00 C ATOM 1252 CD LYS A 586 2.837 -20.411 -0.165 1.00 0.00 C ATOM 1253 CE LYS A 586 2.017 -21.211 0.859 1.00 0.00 C ATOM 1254 NZ LYS A 586 0.792 -20.513 1.306 1.00 0.00 N ATOM 0 H LYS A 586 3.186 -16.568 0.111 1.00 0.00 H new ATOM 0 HA LYS A 586 5.747 -17.548 0.750 1.00 0.00 H new ATOM 0 HB2 LYS A 586 3.778 -18.217 -1.480 1.00 0.00 H new ATOM 0 HB3 LYS A 586 5.165 -19.196 -1.045 1.00 0.00 H new ATOM 0 HG2 LYS A 586 4.232 -19.548 1.239 1.00 0.00 H new ATOM 0 HG3 LYS A 586 2.870 -18.512 0.861 1.00 0.00 H new ATOM 0 HD2 LYS A 586 2.170 -20.056 -0.951 1.00 0.00 H new ATOM 0 HD3 LYS A 586 3.559 -21.078 -0.637 1.00 0.00 H new ATOM 0 HE2 LYS A 586 1.740 -22.170 0.422 1.00 0.00 H new ATOM 0 HE3 LYS A 586 2.642 -21.424 1.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 586 0.286 -21.106 1.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 586 1.050 -19.609 1.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 586 0.177 -20.332 0.487 1.00 0.00 H new ATOM 1268 N GLU A 587 5.570 -15.751 -2.026 1.00 0.00 N ATOM 1269 CA GLU A 587 6.451 -15.122 -3.011 1.00 0.00 C ATOM 1270 C GLU A 587 7.480 -14.223 -2.312 1.00 0.00 C ATOM 1271 O GLU A 587 7.209 -13.691 -1.230 1.00 0.00 O ATOM 1272 CB GLU A 587 5.688 -14.380 -4.126 1.00 0.00 C ATOM 1273 CG GLU A 587 5.440 -12.865 -3.989 1.00 0.00 C ATOM 1274 CD GLU A 587 3.995 -12.502 -3.657 1.00 0.00 C ATOM 1275 OE1 GLU A 587 3.095 -12.916 -4.432 1.00 0.00 O ATOM 1276 OE2 GLU A 587 3.782 -11.760 -2.673 1.00 0.00 O ATOM 0 H GLU A 587 4.594 -15.458 -2.071 1.00 0.00 H new ATOM 0 HA GLU A 587 6.987 -15.923 -3.520 1.00 0.00 H new ATOM 0 HB2 GLU A 587 6.231 -14.540 -5.057 1.00 0.00 H new ATOM 0 HB3 GLU A 587 4.717 -14.863 -4.236 1.00 0.00 H new ATOM 0 HG2 GLU A 587 6.092 -12.469 -3.210 1.00 0.00 H new ATOM 0 HG3 GLU A 587 5.722 -12.375 -4.921 1.00 0.00 H new ATOM 1283 N PRO A 588 8.657 -13.987 -2.909 1.00 0.00 N ATOM 1284 CA PRO A 588 9.561 -12.989 -2.391 1.00 0.00 C ATOM 1285 C PRO A 588 9.058 -11.592 -2.742 1.00 0.00 C ATOM 1286 O PRO A 588 8.421 -11.337 -3.761 1.00 0.00 O ATOM 1287 CB PRO A 588 10.917 -13.295 -3.022 1.00 0.00 C ATOM 1288 CG PRO A 588 10.587 -14.004 -4.328 1.00 0.00 C ATOM 1289 CD PRO A 588 9.207 -14.626 -4.091 1.00 0.00 C ATOM 0 HA PRO A 588 9.635 -13.014 -1.304 1.00 0.00 H new ATOM 0 HB2 PRO A 588 11.485 -12.382 -3.200 1.00 0.00 H new ATOM 0 HB3 PRO A 588 11.523 -13.926 -2.371 1.00 0.00 H new ATOM 0 HG2 PRO A 588 10.569 -13.306 -5.165 1.00 0.00 H new ATOM 0 HG3 PRO A 588 11.330 -14.766 -4.565 1.00 0.00 H new ATOM 0 HD2 PRO A 588 8.559 -14.468 -4.953 1.00 0.00 H new ATOM 0 HD3 PRO A 588 9.288 -15.703 -3.946 1.00 0.00 H new ATOM 1297 N VAL A 589 9.483 -10.655 -1.918 1.00 0.00 N ATOM 1298 CA VAL A 589 9.349 -9.217 -2.074 1.00 0.00 C ATOM 1299 C VAL A 589 9.932 -8.743 -3.402 1.00 0.00 C ATOM 1300 O VAL A 589 9.301 -7.968 -4.118 1.00 0.00 O ATOM 1301 CB VAL A 589 9.968 -8.598 -0.821 1.00 0.00 C ATOM 1302 CG1 VAL A 589 11.446 -8.696 -0.806 1.00 0.00 C ATOM 1303 CG2 VAL A 589 9.663 -7.105 -0.596 1.00 0.00 C ATOM 0 H VAL A 589 9.969 -10.896 -1.054 1.00 0.00 H new ATOM 0 HA VAL A 589 8.310 -8.893 -2.141 1.00 0.00 H new ATOM 0 HB VAL A 589 9.500 -9.189 -0.034 1.00 0.00 H new ATOM 0 HG11 VAL A 589 11.832 -8.241 0.106 1.00 0.00 H new ATOM 0 HG12 VAL A 589 11.741 -9.745 -0.841 1.00 0.00 H new ATOM 0 HG13 VAL A 589 11.854 -8.175 -1.672 1.00 0.00 H new ATOM 0 HG21 VAL A 589 10.150 -6.768 0.319 1.00 0.00 H new ATOM 0 HG22 VAL A 589 10.037 -6.526 -1.440 1.00 0.00 H new ATOM 0 HG23 VAL A 589 8.586 -6.963 -0.507 1.00 0.00 H new ATOM 1313 N ALA A 590 11.097 -9.308 -3.728 1.00 0.00 N ATOM 1314 CA ALA A 590 11.753 -9.169 -5.020 1.00 0.00 C ATOM 1315 C ALA A 590 10.763 -9.398 -6.169 1.00 0.00 C ATOM 1316 O ALA A 590 10.720 -8.595 -7.107 1.00 0.00 O ATOM 1317 CB ALA A 590 12.943 -10.129 -5.110 1.00 0.00 C ATOM 0 H ALA A 590 11.622 -9.892 -3.077 1.00 0.00 H new ATOM 0 HA ALA A 590 12.126 -8.149 -5.113 1.00 0.00 H new ATOM 0 HB1 ALA A 590 13.428 -10.018 -6.080 1.00 0.00 H new ATOM 0 HB2 ALA A 590 13.657 -9.899 -4.319 1.00 0.00 H new ATOM 0 HB3 ALA A 590 12.593 -11.155 -4.995 1.00 0.00 H new ATOM 1323 N SER A 591 9.929 -10.444 -6.073 1.00 0.00 N ATOM 1324 CA SER A 591 9.029 -10.792 -7.147 1.00 0.00 C ATOM 1325 C SER A 591 7.864 -9.817 -7.271 1.00 0.00 C ATOM 1326 O SER A 591 7.459 -9.538 -8.402 1.00 0.00 O ATOM 1327 CB SER A 591 8.544 -12.216 -6.924 1.00 0.00 C ATOM 1328 OG SER A 591 9.544 -13.080 -7.424 1.00 0.00 O ATOM 0 H SER A 591 9.870 -11.054 -5.258 1.00 0.00 H new ATOM 0 HA SER A 591 9.567 -10.727 -8.093 1.00 0.00 H new ATOM 0 HB2 SER A 591 8.370 -12.402 -5.864 1.00 0.00 H new ATOM 0 HB3 SER A 591 7.597 -12.385 -7.437 1.00 0.00 H new ATOM 0 HG SER A 591 9.266 -14.011 -7.296 1.00 0.00 H new ATOM 1334 N ILE A 592 7.339 -9.256 -6.173 1.00 0.00 N ATOM 1335 CA ILE A 592 6.279 -8.269 -6.302 1.00 0.00 C ATOM 1336 C ILE A 592 6.837 -6.944 -6.828 1.00 0.00 C ATOM 1337 O ILE A 592 6.161 -6.282 -7.606 1.00 0.00 O ATOM 1338 CB ILE A 592 5.448 -8.115 -5.016 1.00 0.00 C ATOM 1339 CG1 ILE A 592 6.162 -7.413 -3.843 1.00 0.00 C ATOM 1340 CG2 ILE A 592 4.915 -9.467 -4.531 1.00 0.00 C ATOM 1341 CD1 ILE A 592 5.295 -6.283 -3.289 1.00 0.00 C ATOM 0 H ILE A 592 7.625 -9.465 -5.217 1.00 0.00 H new ATOM 0 HA ILE A 592 5.571 -8.636 -7.045 1.00 0.00 H new ATOM 0 HB ILE A 592 4.632 -7.458 -5.317 1.00 0.00 H new ATOM 0 HG12 ILE A 592 6.376 -8.135 -3.055 1.00 0.00 H new ATOM 0 HG13 ILE A 592 7.119 -7.014 -4.178 1.00 0.00 H new ATOM 0 HG21 ILE A 592 4.332 -9.323 -3.621 1.00 0.00 H new ATOM 0 HG22 ILE A 592 4.282 -9.906 -5.302 1.00 0.00 H new ATOM 0 HG23 ILE A 592 5.751 -10.135 -4.325 1.00 0.00 H new ATOM 0 HD11 ILE A 592 5.814 -5.798 -2.462 1.00 0.00 H new ATOM 0 HD12 ILE A 592 5.103 -5.553 -4.075 1.00 0.00 H new ATOM 0 HD13 ILE A 592 4.349 -6.691 -2.934 1.00 0.00 H new ATOM 1353 N ILE A 593 8.080 -6.578 -6.491 1.00 0.00 N ATOM 1354 CA ILE A 593 8.731 -5.385 -7.031 1.00 0.00 C ATOM 1355 C ILE A 593 8.845 -5.551 -8.549 1.00 0.00 C ATOM 1356 O ILE A 593 8.330 -4.723 -9.297 1.00 0.00 O ATOM 1357 CB ILE A 593 10.075 -5.130 -6.308 1.00 0.00 C ATOM 1358 CG1 ILE A 593 9.780 -4.685 -4.855 1.00 0.00 C ATOM 1359 CG2 ILE A 593 10.924 -4.069 -7.033 1.00 0.00 C ATOM 1360 CD1 ILE A 593 11.021 -4.648 -3.960 1.00 0.00 C ATOM 0 H ILE A 593 8.660 -7.103 -5.836 1.00 0.00 H new ATOM 0 HA ILE A 593 8.142 -4.486 -6.848 1.00 0.00 H new ATOM 0 HB ILE A 593 10.653 -6.054 -6.309 1.00 0.00 H new ATOM 0 HG12 ILE A 593 9.326 -3.694 -4.873 1.00 0.00 H new ATOM 0 HG13 ILE A 593 9.048 -5.364 -4.418 1.00 0.00 H new ATOM 0 HG21 ILE A 593 11.859 -3.920 -6.493 1.00 0.00 H new ATOM 0 HG22 ILE A 593 11.140 -4.407 -8.047 1.00 0.00 H new ATOM 0 HG23 ILE A 593 10.374 -3.129 -7.073 1.00 0.00 H new ATOM 0 HD11 ILE A 593 10.737 -4.328 -2.958 1.00 0.00 H new ATOM 0 HD12 ILE A 593 11.464 -5.643 -3.911 1.00 0.00 H new ATOM 0 HD13 ILE A 593 11.747 -3.947 -4.373 1.00 0.00 H new ATOM 1372 N THR A 594 9.419 -6.670 -8.996 1.00 0.00 N ATOM 1373 CA THR A 594 9.449 -7.145 -10.380 1.00 0.00 C ATOM 1374 C THR A 594 8.072 -7.096 -11.078 1.00 0.00 C ATOM 1375 O THR A 594 8.013 -7.037 -12.301 1.00 0.00 O ATOM 1376 CB THR A 594 10.096 -8.539 -10.346 1.00 0.00 C ATOM 1377 OG1 THR A 594 11.506 -8.427 -10.426 1.00 0.00 O ATOM 1378 CG2 THR A 594 9.601 -9.549 -11.378 1.00 0.00 C ATOM 0 H THR A 594 9.904 -7.306 -8.363 1.00 0.00 H new ATOM 0 HA THR A 594 10.044 -6.478 -11.005 1.00 0.00 H new ATOM 0 HB THR A 594 9.778 -8.951 -9.388 1.00 0.00 H new ATOM 0 HG1 THR A 594 11.907 -9.321 -10.402 1.00 0.00 H new ATOM 0 HG21 THR A 594 10.134 -10.491 -11.250 1.00 0.00 H new ATOM 0 HG22 THR A 594 8.532 -9.715 -11.241 1.00 0.00 H new ATOM 0 HG23 THR A 594 9.782 -9.163 -12.381 1.00 0.00 H new ATOM 1386 N LYS A 595 6.960 -7.063 -10.349 1.00 0.00 N ATOM 1387 CA LYS A 595 5.603 -7.065 -10.907 1.00 0.00 C ATOM 1388 C LYS A 595 5.020 -5.660 -10.939 1.00 0.00 C ATOM 1389 O LYS A 595 4.489 -5.231 -11.960 1.00 0.00 O ATOM 1390 CB LYS A 595 4.695 -8.027 -10.121 1.00 0.00 C ATOM 1391 CG LYS A 595 3.803 -8.808 -11.095 1.00 0.00 C ATOM 1392 CD LYS A 595 2.867 -9.770 -10.356 1.00 0.00 C ATOM 1393 CE LYS A 595 2.409 -10.847 -11.337 1.00 0.00 C ATOM 1394 NZ LYS A 595 1.446 -11.790 -10.742 1.00 0.00 N ATOM 0 H LYS A 595 6.973 -7.033 -9.330 1.00 0.00 H new ATOM 0 HA LYS A 595 5.660 -7.419 -11.936 1.00 0.00 H new ATOM 0 HB2 LYS A 595 5.301 -8.717 -9.535 1.00 0.00 H new ATOM 0 HB3 LYS A 595 4.079 -7.467 -9.417 1.00 0.00 H new ATOM 0 HG2 LYS A 595 3.213 -8.110 -11.688 1.00 0.00 H new ATOM 0 HG3 LYS A 595 4.427 -9.369 -11.790 1.00 0.00 H new ATOM 0 HD2 LYS A 595 3.381 -10.223 -9.509 1.00 0.00 H new ATOM 0 HD3 LYS A 595 2.008 -9.231 -9.956 1.00 0.00 H new ATOM 0 HE2 LYS A 595 1.955 -10.371 -12.206 1.00 0.00 H new ATOM 0 HE3 LYS A 595 3.278 -11.400 -11.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 1.170 -12.498 -11.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 1.885 -12.268 -9.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 0.603 -11.271 -10.425 1.00 0.00 H new ATOM 1408 N LEU A 596 5.171 -4.912 -9.847 1.00 0.00 N ATOM 1409 CA LEU A 596 4.801 -3.506 -9.735 1.00 0.00 C ATOM 1410 C LEU A 596 5.568 -2.646 -10.746 1.00 0.00 C ATOM 1411 O LEU A 596 5.115 -1.552 -11.079 1.00 0.00 O ATOM 1412 CB LEU A 596 5.071 -3.015 -8.303 1.00 0.00 C ATOM 1413 CG LEU A 596 4.164 -3.612 -7.207 1.00 0.00 C ATOM 1414 CD1 LEU A 596 4.628 -3.112 -5.836 1.00 0.00 C ATOM 1415 CD2 LEU A 596 2.688 -3.262 -7.412 1.00 0.00 C ATOM 0 H LEU A 596 5.569 -5.285 -8.985 1.00 0.00 H new ATOM 0 HA LEU A 596 3.738 -3.410 -9.958 1.00 0.00 H new ATOM 0 HB2 LEU A 596 6.108 -3.238 -8.052 1.00 0.00 H new ATOM 0 HB3 LEU A 596 4.965 -1.930 -8.285 1.00 0.00 H new ATOM 0 HG LEU A 596 4.248 -4.697 -7.266 1.00 0.00 H new ATOM 0 HD11 LEU A 596 3.989 -3.532 -5.060 1.00 0.00 H new ATOM 0 HD12 LEU A 596 5.659 -3.423 -5.665 1.00 0.00 H new ATOM 0 HD13 LEU A 596 4.568 -2.024 -5.806 1.00 0.00 H new ATOM 0 HD21 LEU A 596 2.094 -3.707 -6.613 1.00 0.00 H new ATOM 0 HD22 LEU A 596 2.565 -2.179 -7.395 1.00 0.00 H new ATOM 0 HD23 LEU A 596 2.352 -3.651 -8.373 1.00 0.00 H new ATOM 1427 N ASN A 597 6.701 -3.134 -11.258 1.00 0.00 N ATOM 1428 CA ASN A 597 7.374 -2.546 -12.413 1.00 0.00 C ATOM 1429 C ASN A 597 6.445 -2.601 -13.623 1.00 0.00 C ATOM 1430 O ASN A 597 6.075 -1.557 -14.132 1.00 0.00 O ATOM 1431 CB ASN A 597 8.695 -3.260 -12.731 1.00 0.00 C ATOM 1432 CG ASN A 597 9.715 -3.180 -11.608 1.00 0.00 C ATOM 1433 OD1 ASN A 597 9.817 -2.198 -10.880 1.00 0.00 O ATOM 1434 ND2 ASN A 597 10.476 -4.241 -11.437 1.00 0.00 N ATOM 0 H ASN A 597 7.177 -3.952 -10.879 1.00 0.00 H new ATOM 0 HA ASN A 597 7.613 -1.510 -12.173 1.00 0.00 H new ATOM 0 HB2 ASN A 597 8.489 -4.308 -12.949 1.00 0.00 H new ATOM 0 HB3 ASN A 597 9.125 -2.825 -13.633 1.00 0.00 H new ATOM 0 HD21 ASN A 597 11.167 -4.257 -10.687 1.00 0.00 H new ATOM 0 HD22 ASN A 597 10.374 -5.047 -12.054 1.00 0.00 H new ATOM 1441 N SER A 598 6.018 -3.796 -14.054 1.00 0.00 N ATOM 1442 CA SER A 598 5.240 -4.086 -15.254 1.00 0.00 C ATOM 1443 C SER A 598 3.880 -3.364 -15.310 1.00 0.00 C ATOM 1444 O SER A 598 3.266 -3.256 -16.374 1.00 0.00 O ATOM 1445 CB SER A 598 5.052 -5.608 -15.260 1.00 0.00 C ATOM 1446 OG SER A 598 5.886 -6.269 -16.194 1.00 0.00 O ATOM 0 H SER A 598 6.226 -4.645 -13.529 1.00 0.00 H new ATOM 0 HA SER A 598 5.771 -3.721 -16.133 1.00 0.00 H new ATOM 0 HB2 SER A 598 5.255 -5.997 -14.262 1.00 0.00 H new ATOM 0 HB3 SER A 598 4.011 -5.838 -15.486 1.00 0.00 H new ATOM 0 HG SER A 598 5.724 -7.235 -16.152 1.00 0.00 H new ATOM 1452 N LEU A 599 3.396 -2.853 -14.182 1.00 0.00 N ATOM 1453 CA LEU A 599 2.193 -2.043 -14.114 1.00 0.00 C ATOM 1454 C LEU A 599 2.522 -0.661 -14.663 1.00 0.00 C ATOM 1455 O LEU A 599 1.822 -0.174 -15.549 1.00 0.00 O ATOM 1456 CB LEU A 599 1.719 -1.981 -12.656 1.00 0.00 C ATOM 1457 CG LEU A 599 1.177 -3.308 -12.104 1.00 0.00 C ATOM 1458 CD1 LEU A 599 0.808 -3.095 -10.632 1.00 0.00 C ATOM 1459 CD2 LEU A 599 -0.045 -3.799 -12.889 1.00 0.00 C ATOM 0 H LEU A 599 3.840 -2.995 -13.275 1.00 0.00 H new ATOM 0 HA LEU A 599 1.386 -2.471 -14.709 1.00 0.00 H new ATOM 0 HB2 LEU A 599 2.550 -1.655 -12.031 1.00 0.00 H new ATOM 0 HB3 LEU A 599 0.941 -1.223 -12.572 1.00 0.00 H new ATOM 0 HG LEU A 599 1.946 -4.074 -12.204 1.00 0.00 H new ATOM 0 HD11 LEU A 599 0.420 -4.025 -10.216 1.00 0.00 H new ATOM 0 HD12 LEU A 599 1.694 -2.791 -10.075 1.00 0.00 H new ATOM 0 HD13 LEU A 599 0.047 -2.318 -10.556 1.00 0.00 H new ATOM 0 HD21 LEU A 599 -0.396 -4.740 -12.465 1.00 0.00 H new ATOM 0 HD22 LEU A 599 -0.839 -3.055 -12.828 1.00 0.00 H new ATOM 0 HD23 LEU A 599 0.230 -3.951 -13.933 1.00 0.00 H new ATOM 1471 N ASN A 600 3.627 -0.067 -14.202 1.00 0.00 N ATOM 1472 CA ASN A 600 4.028 1.315 -14.456 1.00 0.00 C ATOM 1473 C ASN A 600 2.900 2.276 -14.097 1.00 0.00 C ATOM 1474 O ASN A 600 2.663 3.255 -14.811 1.00 0.00 O ATOM 1475 CB ASN A 600 4.539 1.535 -15.891 1.00 0.00 C ATOM 1476 CG ASN A 600 5.722 0.650 -16.210 1.00 0.00 C ATOM 1477 OD1 ASN A 600 6.856 0.990 -15.882 1.00 0.00 O ATOM 1478 ND2 ASN A 600 5.470 -0.509 -16.794 1.00 0.00 N ATOM 0 H ASN A 600 4.296 -0.563 -13.614 1.00 0.00 H new ATOM 0 HA ASN A 600 4.876 1.529 -13.806 1.00 0.00 H new ATOM 0 HB2 ASN A 600 3.734 1.334 -16.598 1.00 0.00 H new ATOM 0 HB3 ASN A 600 4.822 2.580 -16.019 1.00 0.00 H new ATOM 0 HD21 ASN A 600 6.232 -1.159 -16.988 1.00 0.00 H new ATOM 0 HD22 ASN A 600 4.514 -0.753 -17.051 1.00 0.00 H new ATOM 1485 N GLU A 601 2.213 2.022 -12.990 1.00 0.00 N ATOM 1486 CA GLU A 601 1.135 2.852 -12.493 1.00 0.00 C ATOM 1487 C GLU A 601 1.589 3.492 -11.172 1.00 0.00 C ATOM 1488 O GLU A 601 2.438 2.921 -10.475 1.00 0.00 O ATOM 1489 CB GLU A 601 -0.134 2.007 -12.317 1.00 0.00 C ATOM 1490 CG GLU A 601 -0.528 1.234 -13.582 1.00 0.00 C ATOM 1491 CD GLU A 601 -1.959 0.709 -13.471 1.00 0.00 C ATOM 1492 OE1 GLU A 601 -2.209 -0.230 -12.677 1.00 0.00 O ATOM 1493 OE2 GLU A 601 -2.855 1.283 -14.130 1.00 0.00 O ATOM 0 H GLU A 601 2.399 1.210 -12.401 1.00 0.00 H new ATOM 0 HA GLU A 601 0.896 3.645 -13.201 1.00 0.00 H new ATOM 0 HB2 GLU A 601 0.018 1.301 -11.501 1.00 0.00 H new ATOM 0 HB3 GLU A 601 -0.958 2.658 -12.026 1.00 0.00 H new ATOM 0 HG2 GLU A 601 -0.440 1.883 -14.453 1.00 0.00 H new ATOM 0 HG3 GLU A 601 0.159 0.402 -13.734 1.00 0.00 H new ATOM 1500 N PRO A 602 1.062 4.669 -10.807 1.00 0.00 N ATOM 1501 CA PRO A 602 1.433 5.344 -9.574 1.00 0.00 C ATOM 1502 C PRO A 602 0.860 4.622 -8.356 1.00 0.00 C ATOM 1503 O PRO A 602 -0.320 4.263 -8.357 1.00 0.00 O ATOM 1504 CB PRO A 602 0.874 6.759 -9.707 1.00 0.00 C ATOM 1505 CG PRO A 602 -0.224 6.675 -10.770 1.00 0.00 C ATOM 1506 CD PRO A 602 0.169 5.474 -11.623 1.00 0.00 C ATOM 0 HA PRO A 602 2.513 5.355 -9.425 1.00 0.00 H new ATOM 0 HB2 PRO A 602 0.472 7.112 -8.757 1.00 0.00 H new ATOM 0 HB3 PRO A 602 1.653 7.461 -10.004 1.00 0.00 H new ATOM 0 HG2 PRO A 602 -1.206 6.537 -10.318 1.00 0.00 H new ATOM 0 HG3 PRO A 602 -0.272 7.587 -11.365 1.00 0.00 H new ATOM 0 HD2 PRO A 602 -0.711 4.902 -11.917 1.00 0.00 H new ATOM 0 HD3 PRO A 602 0.663 5.794 -12.541 1.00 0.00 H new ATOM 1514 N LEU A 603 1.676 4.460 -7.306 1.00 0.00 N ATOM 1515 CA LEU A 603 1.313 3.643 -6.141 1.00 0.00 C ATOM 1516 C LEU A 603 1.293 4.449 -4.848 1.00 0.00 C ATOM 1517 O LEU A 603 1.855 5.547 -4.772 1.00 0.00 O ATOM 1518 CB LEU A 603 2.307 2.492 -5.939 1.00 0.00 C ATOM 1519 CG LEU A 603 2.580 1.585 -7.143 1.00 0.00 C ATOM 1520 CD1 LEU A 603 3.585 0.534 -6.677 1.00 0.00 C ATOM 1521 CD2 LEU A 603 1.314 0.898 -7.646 1.00 0.00 C ATOM 0 H LEU A 603 2.599 4.888 -7.240 1.00 0.00 H new ATOM 0 HA LEU A 603 0.313 3.263 -6.353 1.00 0.00 H new ATOM 0 HB2 LEU A 603 3.256 2.918 -5.615 1.00 0.00 H new ATOM 0 HB3 LEU A 603 1.942 1.869 -5.122 1.00 0.00 H new ATOM 0 HG LEU A 603 2.961 2.180 -7.973 1.00 0.00 H new ATOM 0 HD11 LEU A 603 3.814 -0.141 -7.502 1.00 0.00 H new ATOM 0 HD12 LEU A 603 4.499 1.026 -6.346 1.00 0.00 H new ATOM 0 HD13 LEU A 603 3.160 -0.035 -5.850 1.00 0.00 H new ATOM 0 HD21 LEU A 603 1.558 0.266 -8.500 1.00 0.00 H new ATOM 0 HD22 LEU A 603 0.892 0.285 -6.850 1.00 0.00 H new ATOM 0 HD23 LEU A 603 0.587 1.652 -7.948 1.00 0.00 H new ATOM 1533 N VAL A 604 0.747 3.853 -3.790 1.00 0.00 N ATOM 1534 CA VAL A 604 0.905 4.283 -2.407 1.00 0.00 C ATOM 1535 C VAL A 604 0.988 3.032 -1.520 1.00 0.00 C ATOM 1536 O VAL A 604 0.094 2.185 -1.530 1.00 0.00 O ATOM 1537 CB VAL A 604 -0.214 5.277 -2.024 1.00 0.00 C ATOM 1538 CG1 VAL A 604 -1.623 4.744 -2.283 1.00 0.00 C ATOM 1539 CG2 VAL A 604 -0.130 5.733 -0.561 1.00 0.00 C ATOM 0 H VAL A 604 0.159 3.024 -3.879 1.00 0.00 H new ATOM 0 HA VAL A 604 1.832 4.838 -2.260 1.00 0.00 H new ATOM 0 HB VAL A 604 -0.039 6.129 -2.681 1.00 0.00 H new ATOM 0 HG11 VAL A 604 -2.356 5.496 -1.990 1.00 0.00 H new ATOM 0 HG12 VAL A 604 -1.738 4.519 -3.343 1.00 0.00 H new ATOM 0 HG13 VAL A 604 -1.782 3.837 -1.700 1.00 0.00 H new ATOM 0 HG21 VAL A 604 -0.941 6.430 -0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 604 -0.215 4.867 0.095 1.00 0.00 H new ATOM 0 HG23 VAL A 604 0.826 6.226 -0.388 1.00 0.00 H new ATOM 1549 N THR A 605 2.082 2.867 -0.779 1.00 0.00 N ATOM 1550 CA THR A 605 2.279 1.755 0.149 1.00 0.00 C ATOM 1551 C THR A 605 3.281 2.103 1.263 1.00 0.00 C ATOM 1552 O THR A 605 3.454 3.272 1.607 1.00 0.00 O ATOM 1553 CB THR A 605 2.620 0.486 -0.649 1.00 0.00 C ATOM 1554 OG1 THR A 605 2.502 -0.669 0.158 1.00 0.00 O ATOM 1555 CG2 THR A 605 3.976 0.545 -1.345 1.00 0.00 C ATOM 0 H THR A 605 2.870 3.514 -0.807 1.00 0.00 H new ATOM 0 HA THR A 605 1.353 1.552 0.688 1.00 0.00 H new ATOM 0 HB THR A 605 1.883 0.426 -1.449 1.00 0.00 H new ATOM 0 HG1 THR A 605 1.888 -0.488 0.900 1.00 0.00 H new ATOM 0 HG21 THR A 605 4.147 -0.385 -1.888 1.00 0.00 H new ATOM 0 HG22 THR A 605 3.990 1.381 -2.044 1.00 0.00 H new ATOM 0 HG23 THR A 605 4.761 0.681 -0.601 1.00 0.00 H new ATOM 1563 N MET A 606 3.844 1.088 1.921 1.00 0.00 N ATOM 1564 CA MET A 606 4.880 1.120 2.952 1.00 0.00 C ATOM 1565 C MET A 606 6.112 0.333 2.465 1.00 0.00 C ATOM 1566 O MET A 606 6.117 -0.101 1.318 1.00 0.00 O ATOM 1567 CB MET A 606 4.353 0.544 4.269 1.00 0.00 C ATOM 1568 CG MET A 606 2.850 0.558 4.397 1.00 0.00 C ATOM 1569 SD MET A 606 2.056 -0.944 3.766 1.00 0.00 S ATOM 1570 CE MET A 606 0.442 -0.241 3.382 1.00 0.00 C ATOM 0 H MET A 606 3.557 0.129 1.725 1.00 0.00 H new ATOM 0 HA MET A 606 5.168 2.155 3.135 1.00 0.00 H new ATOM 0 HB2 MET A 606 4.705 -0.483 4.369 1.00 0.00 H new ATOM 0 HB3 MET A 606 4.781 1.110 5.096 1.00 0.00 H new ATOM 0 HG2 MET A 606 2.584 0.687 5.446 1.00 0.00 H new ATOM 0 HG3 MET A 606 2.456 1.421 3.860 1.00 0.00 H new ATOM 0 HE1 MET A 606 -0.312 -1.027 3.406 1.00 0.00 H new ATOM 0 HE2 MET A 606 0.194 0.523 4.118 1.00 0.00 H new ATOM 0 HE3 MET A 606 0.467 0.207 2.389 1.00 0.00 H new ATOM 1580 N PRO A 607 7.172 0.102 3.256 1.00 0.00 N ATOM 1581 CA PRO A 607 8.315 -0.705 2.838 1.00 0.00 C ATOM 1582 C PRO A 607 8.078 -2.198 2.603 1.00 0.00 C ATOM 1583 O PRO A 607 9.037 -2.941 2.388 1.00 0.00 O ATOM 1584 CB PRO A 607 9.459 -0.327 3.770 1.00 0.00 C ATOM 1585 CG PRO A 607 8.797 0.197 5.037 1.00 0.00 C ATOM 1586 CD PRO A 607 7.417 0.661 4.581 1.00 0.00 C ATOM 0 HA PRO A 607 8.573 -0.463 1.807 1.00 0.00 H new ATOM 0 HB2 PRO A 607 10.091 -1.189 3.985 1.00 0.00 H new ATOM 0 HB3 PRO A 607 10.098 0.432 3.319 1.00 0.00 H new ATOM 0 HG2 PRO A 607 8.723 -0.580 5.797 1.00 0.00 H new ATOM 0 HG3 PRO A 607 9.368 1.017 5.473 1.00 0.00 H new ATOM 0 HD2 PRO A 607 6.652 0.329 5.283 1.00 0.00 H new ATOM 0 HD3 PRO A 607 7.371 1.750 4.550 1.00 0.00 H new ATOM 1594 N ILE A 608 6.829 -2.639 2.662 1.00 0.00 N ATOM 1595 CA ILE A 608 6.301 -3.967 2.439 1.00 0.00 C ATOM 1596 C ILE A 608 7.126 -5.049 3.136 1.00 0.00 C ATOM 1597 O ILE A 608 6.865 -5.316 4.308 1.00 0.00 O ATOM 1598 CB ILE A 608 5.928 -4.237 0.954 1.00 0.00 C ATOM 1599 CG1 ILE A 608 4.873 -3.229 0.436 1.00 0.00 C ATOM 1600 CG2 ILE A 608 5.358 -5.659 0.783 1.00 0.00 C ATOM 1601 CD1 ILE A 608 4.520 -3.373 -1.053 1.00 0.00 C ATOM 0 H ILE A 608 6.076 -1.992 2.896 1.00 0.00 H new ATOM 0 HA ILE A 608 5.335 -4.020 2.941 1.00 0.00 H new ATOM 0 HB ILE A 608 6.846 -4.126 0.377 1.00 0.00 H new ATOM 0 HG12 ILE A 608 3.962 -3.344 1.024 1.00 0.00 H new ATOM 0 HG13 ILE A 608 5.240 -2.218 0.612 1.00 0.00 H new ATOM 0 HG21 ILE A 608 5.104 -5.826 -0.264 1.00 0.00 H new ATOM 0 HG22 ILE A 608 6.103 -6.390 1.096 1.00 0.00 H new ATOM 0 HG23 ILE A 608 4.463 -5.768 1.395 1.00 0.00 H new ATOM 0 HD11 ILE A 608 3.774 -2.626 -1.324 1.00 0.00 H new ATOM 0 HD12 ILE A 608 5.417 -3.226 -1.655 1.00 0.00 H new ATOM 0 HD13 ILE A 608 4.119 -4.370 -1.237 1.00 0.00 H new ATOM 1613 N GLY A 609 8.122 -5.633 2.439 1.00 0.00 N ATOM 1614 CA GLY A 609 8.958 -6.772 2.870 1.00 0.00 C ATOM 1615 C GLY A 609 9.385 -6.679 4.339 1.00 0.00 C ATOM 1616 O GLY A 609 9.487 -7.699 5.025 1.00 0.00 O ATOM 0 H GLY A 609 8.379 -5.304 1.508 1.00 0.00 H new ATOM 0 HA2 GLY A 609 8.406 -7.699 2.716 1.00 0.00 H new ATOM 0 HA3 GLY A 609 9.847 -6.822 2.241 1.00 0.00 H new ATOM 1620 N TYR A 610 9.566 -5.437 4.803 1.00 0.00 N ATOM 1621 CA TYR A 610 9.762 -4.983 6.179 1.00 0.00 C ATOM 1622 C TYR A 610 9.157 -5.909 7.246 1.00 0.00 C ATOM 1623 O TYR A 610 9.864 -6.415 8.108 1.00 0.00 O ATOM 1624 CB TYR A 610 9.198 -3.563 6.259 1.00 0.00 C ATOM 1625 CG TYR A 610 9.401 -2.930 7.608 1.00 0.00 C ATOM 1626 CD1 TYR A 610 10.700 -2.611 8.031 1.00 0.00 C ATOM 1627 CD2 TYR A 610 8.306 -2.729 8.467 1.00 0.00 C ATOM 1628 CE1 TYR A 610 10.913 -2.084 9.313 1.00 0.00 C ATOM 1629 CE2 TYR A 610 8.511 -2.255 9.774 1.00 0.00 C ATOM 1630 CZ TYR A 610 9.823 -1.911 10.198 1.00 0.00 C ATOM 1631 OH TYR A 610 10.037 -1.363 11.426 1.00 0.00 O ATOM 0 H TYR A 610 9.580 -4.648 4.157 1.00 0.00 H new ATOM 0 HA TYR A 610 10.827 -5.001 6.410 1.00 0.00 H new ATOM 0 HB2 TYR A 610 9.673 -2.945 5.498 1.00 0.00 H new ATOM 0 HB3 TYR A 610 8.132 -3.587 6.031 1.00 0.00 H new ATOM 0 HD1 TYR A 610 11.537 -2.772 7.368 1.00 0.00 H new ATOM 0 HD2 TYR A 610 7.305 -2.939 8.121 1.00 0.00 H new ATOM 0 HE1 TYR A 610 11.910 -1.810 9.625 1.00 0.00 H new ATOM 0 HE2 TYR A 610 7.677 -2.153 10.452 1.00 0.00 H new ATOM 0 HH TYR A 610 9.188 -1.311 11.913 1.00 0.00 H new ATOM 1641 N VAL A 611 7.869 -6.224 7.185 1.00 0.00 N ATOM 1642 CA VAL A 611 7.230 -6.991 8.258 1.00 0.00 C ATOM 1643 C VAL A 611 6.777 -8.371 7.789 1.00 0.00 C ATOM 1644 O VAL A 611 6.791 -9.336 8.556 1.00 0.00 O ATOM 1645 CB VAL A 611 6.159 -6.084 8.892 1.00 0.00 C ATOM 1646 CG1 VAL A 611 4.921 -6.814 9.388 1.00 0.00 C ATOM 1647 CG2 VAL A 611 6.790 -5.326 10.075 1.00 0.00 C ATOM 0 H VAL A 611 7.250 -5.966 6.417 1.00 0.00 H new ATOM 0 HA VAL A 611 7.932 -7.254 9.050 1.00 0.00 H new ATOM 0 HB VAL A 611 5.822 -5.415 8.100 1.00 0.00 H new ATOM 0 HG11 VAL A 611 4.223 -6.096 9.818 1.00 0.00 H new ATOM 0 HG12 VAL A 611 4.444 -7.329 8.554 1.00 0.00 H new ATOM 0 HG13 VAL A 611 5.207 -7.541 10.148 1.00 0.00 H new ATOM 0 HG21 VAL A 611 6.042 -4.679 10.533 1.00 0.00 H new ATOM 0 HG22 VAL A 611 7.153 -6.041 10.813 1.00 0.00 H new ATOM 0 HG23 VAL A 611 7.622 -4.720 9.717 1.00 0.00 H new ATOM 1657 N THR A 612 6.468 -8.497 6.505 1.00 0.00 N ATOM 1658 CA THR A 612 5.859 -9.681 5.918 1.00 0.00 C ATOM 1659 C THR A 612 6.954 -10.741 5.765 1.00 0.00 C ATOM 1660 O THR A 612 6.846 -11.896 6.180 1.00 0.00 O ATOM 1661 CB THR A 612 5.162 -9.299 4.584 1.00 0.00 C ATOM 1662 OG1 THR A 612 6.024 -9.301 3.463 1.00 0.00 O ATOM 1663 CG2 THR A 612 4.656 -7.854 4.608 1.00 0.00 C ATOM 0 H THR A 612 6.639 -7.757 5.825 1.00 0.00 H new ATOM 0 HA THR A 612 5.078 -10.101 6.552 1.00 0.00 H new ATOM 0 HB THR A 612 4.377 -10.050 4.496 1.00 0.00 H new ATOM 0 HG1 THR A 612 5.518 -9.054 2.661 1.00 0.00 H new ATOM 0 HG21 THR A 612 4.174 -7.621 3.658 1.00 0.00 H new ATOM 0 HG22 THR A 612 3.938 -7.734 5.419 1.00 0.00 H new ATOM 0 HG23 THR A 612 5.496 -7.177 4.764 1.00 0.00 H new ATOM 1671 N HIS A 613 8.070 -10.286 5.196 1.00 0.00 N ATOM 1672 CA HIS A 613 9.314 -11.030 5.104 1.00 0.00 C ATOM 1673 C HIS A 613 10.092 -10.850 6.409 1.00 0.00 C ATOM 1674 O HIS A 613 11.018 -11.618 6.660 1.00 0.00 O ATOM 1675 CB HIS A 613 10.122 -10.567 3.871 1.00 0.00 C ATOM 1676 CG HIS A 613 10.692 -11.733 3.099 1.00 0.00 C ATOM 1677 ND1 HIS A 613 11.450 -12.760 3.637 1.00 0.00 N ATOM 1678 CD2 HIS A 613 10.408 -12.027 1.792 1.00 0.00 C ATOM 1679 CE1 HIS A 613 11.560 -13.694 2.672 1.00 0.00 C ATOM 1680 NE2 HIS A 613 10.908 -13.299 1.559 1.00 0.00 N ATOM 0 H HIS A 613 8.129 -9.359 4.775 1.00 0.00 H new ATOM 0 HA HIS A 613 9.114 -12.093 4.969 1.00 0.00 H new ATOM 0 HB2 HIS A 613 9.479 -9.978 3.217 1.00 0.00 H new ATOM 0 HB3 HIS A 613 10.933 -9.914 4.193 1.00 0.00 H new ATOM 0 HD2 HIS A 613 9.896 -11.393 1.083 1.00 0.00 H new ATOM 0 HE1 HIS A 613 12.094 -14.627 2.775 1.00 0.00 H new ATOM 0 HE2 HIS A 613 10.802 -13.839 0.700 1.00 0.00 H new ATOM 1689 N GLY A 614 9.727 -9.867 7.240 1.00 0.00 N ATOM 1690 CA GLY A 614 10.487 -9.439 8.399 1.00 0.00 C ATOM 1691 C GLY A 614 11.796 -8.795 7.967 1.00 0.00 C ATOM 1692 O GLY A 614 12.810 -9.021 8.628 1.00 0.00 O ATOM 0 H GLY A 614 8.865 -9.336 7.112 1.00 0.00 H new ATOM 0 HA2 GLY A 614 9.901 -8.730 8.984 1.00 0.00 H new ATOM 0 HA3 GLY A 614 10.690 -10.294 9.044 1.00 0.00 H new ATOM 1696 N PHE A 615 11.817 -8.062 6.846 1.00 0.00 N ATOM 1697 CA PHE A 615 13.060 -7.355 6.502 1.00 0.00 C ATOM 1698 C PHE A 615 13.334 -6.218 7.484 1.00 0.00 C ATOM 1699 O PHE A 615 12.420 -5.571 7.980 1.00 0.00 O ATOM 1700 CB PHE A 615 12.987 -6.769 5.092 1.00 0.00 C ATOM 1701 CG PHE A 615 13.277 -7.695 3.933 1.00 0.00 C ATOM 1702 CD1 PHE A 615 13.404 -9.095 4.078 1.00 0.00 C ATOM 1703 CD2 PHE A 615 13.348 -7.126 2.651 1.00 0.00 C ATOM 1704 CE1 PHE A 615 13.462 -9.911 2.932 1.00 0.00 C ATOM 1705 CE2 PHE A 615 13.489 -7.927 1.525 1.00 0.00 C ATOM 1706 CZ PHE A 615 13.428 -9.328 1.654 1.00 0.00 C ATOM 0 H PHE A 615 11.040 -7.945 6.196 1.00 0.00 H new ATOM 0 HA PHE A 615 13.866 -8.087 6.553 1.00 0.00 H new ATOM 0 HB2 PHE A 615 11.988 -6.357 4.951 1.00 0.00 H new ATOM 0 HB3 PHE A 615 13.686 -5.935 5.038 1.00 0.00 H new ATOM 0 HD1 PHE A 615 13.456 -9.537 5.062 1.00 0.00 H new ATOM 0 HD2 PHE A 615 13.292 -6.053 2.539 1.00 0.00 H new ATOM 0 HE1 PHE A 615 13.533 -10.984 3.035 1.00 0.00 H new ATOM 0 HE2 PHE A 615 13.645 -7.478 0.555 1.00 0.00 H new ATOM 0 HZ PHE A 615 13.355 -9.951 0.775 1.00 0.00 H new ATOM 1716 N ASN A 616 14.599 -5.871 7.697 1.00 0.00 N ATOM 1717 CA ASN A 616 14.879 -4.649 8.445 1.00 0.00 C ATOM 1718 C ASN A 616 14.473 -3.442 7.615 1.00 0.00 C ATOM 1719 O ASN A 616 14.380 -3.533 6.390 1.00 0.00 O ATOM 1720 CB ASN A 616 16.363 -4.515 8.789 1.00 0.00 C ATOM 1721 CG ASN A 616 16.883 -5.674 9.624 1.00 0.00 C ATOM 1722 OD1 ASN A 616 16.129 -6.297 10.358 1.00 0.00 O ATOM 1723 ND2 ASN A 616 18.172 -5.973 9.602 1.00 0.00 N ATOM 0 H ASN A 616 15.416 -6.392 7.378 1.00 0.00 H new ATOM 0 HA ASN A 616 14.309 -4.699 9.373 1.00 0.00 H new ATOM 0 HB2 ASN A 616 16.940 -4.450 7.867 1.00 0.00 H new ATOM 0 HB3 ASN A 616 16.523 -3.583 9.331 1.00 0.00 H new ATOM 0 HD21 ASN A 616 18.532 -6.720 10.196 1.00 0.00 H new ATOM 0 HD22 ASN A 616 18.805 -5.456 8.991 1.00 0.00 H new ATOM 1730 N LEU A 617 14.356 -2.275 8.254 1.00 0.00 N ATOM 1731 CA LEU A 617 14.099 -1.014 7.559 1.00 0.00 C ATOM 1732 C LEU A 617 15.137 -0.777 6.453 1.00 0.00 C ATOM 1733 O LEU A 617 14.778 -0.298 5.380 1.00 0.00 O ATOM 1734 CB LEU A 617 14.065 0.149 8.571 1.00 0.00 C ATOM 1735 CG LEU A 617 13.487 1.452 7.977 1.00 0.00 C ATOM 1736 CD1 LEU A 617 11.997 1.302 7.637 1.00 0.00 C ATOM 1737 CD2 LEU A 617 13.644 2.621 8.958 1.00 0.00 C ATOM 0 H LEU A 617 14.437 -2.179 9.266 1.00 0.00 H new ATOM 0 HA LEU A 617 13.123 -1.069 7.076 1.00 0.00 H new ATOM 0 HB2 LEU A 617 13.468 -0.146 9.434 1.00 0.00 H new ATOM 0 HB3 LEU A 617 15.076 0.338 8.932 1.00 0.00 H new ATOM 0 HG LEU A 617 14.048 1.656 7.065 1.00 0.00 H new ATOM 0 HD11 LEU A 617 11.623 2.237 7.221 1.00 0.00 H new ATOM 0 HD12 LEU A 617 11.869 0.503 6.906 1.00 0.00 H new ATOM 0 HD13 LEU A 617 11.440 1.059 8.542 1.00 0.00 H new ATOM 0 HD21 LEU A 617 13.229 3.526 8.515 1.00 0.00 H new ATOM 0 HD22 LEU A 617 13.114 2.394 9.883 1.00 0.00 H new ATOM 0 HD23 LEU A 617 14.701 2.775 9.174 1.00 0.00 H new ATOM 1749 N GLU A 618 16.394 -1.172 6.693 1.00 0.00 N ATOM 1750 CA GLU A 618 17.479 -1.139 5.712 1.00 0.00 C ATOM 1751 C GLU A 618 17.130 -2.001 4.506 1.00 0.00 C ATOM 1752 O GLU A 618 17.010 -1.506 3.390 1.00 0.00 O ATOM 1753 CB GLU A 618 18.797 -1.671 6.299 1.00 0.00 C ATOM 1754 CG GLU A 618 19.250 -0.933 7.546 1.00 0.00 C ATOM 1755 CD GLU A 618 20.666 -1.346 7.931 1.00 0.00 C ATOM 1756 OE1 GLU A 618 20.840 -2.489 8.402 1.00 0.00 O ATOM 1757 OE2 GLU A 618 21.623 -0.561 7.739 1.00 0.00 O ATOM 0 H GLU A 618 16.689 -1.533 7.600 1.00 0.00 H new ATOM 0 HA GLU A 618 17.606 -0.096 5.422 1.00 0.00 H new ATOM 0 HB2 GLU A 618 18.679 -2.728 6.536 1.00 0.00 H new ATOM 0 HB3 GLU A 618 19.577 -1.599 5.541 1.00 0.00 H new ATOM 0 HG2 GLU A 618 19.214 0.142 7.372 1.00 0.00 H new ATOM 0 HG3 GLU A 618 18.567 -1.145 8.369 1.00 0.00 H new ATOM 1764 N GLU A 619 17.005 -3.308 4.741 1.00 0.00 N ATOM 1765 CA GLU A 619 16.833 -4.328 3.707 1.00 0.00 C ATOM 1766 C GLU A 619 15.588 -4.039 2.877 1.00 0.00 C ATOM 1767 O GLU A 619 15.584 -4.185 1.658 1.00 0.00 O ATOM 1768 CB GLU A 619 16.709 -5.728 4.319 1.00 0.00 C ATOM 1769 CG GLU A 619 17.810 -6.104 5.308 1.00 0.00 C ATOM 1770 CD GLU A 619 17.541 -7.478 5.896 1.00 0.00 C ATOM 1771 OE1 GLU A 619 16.703 -7.566 6.819 1.00 0.00 O ATOM 1772 OE2 GLU A 619 18.181 -8.457 5.442 1.00 0.00 O ATOM 0 H GLU A 619 17.021 -3.697 5.684 1.00 0.00 H new ATOM 0 HA GLU A 619 17.717 -4.298 3.070 1.00 0.00 H new ATOM 0 HB2 GLU A 619 15.747 -5.802 4.826 1.00 0.00 H new ATOM 0 HB3 GLU A 619 16.702 -6.461 3.512 1.00 0.00 H new ATOM 0 HG2 GLU A 619 18.777 -6.099 4.806 1.00 0.00 H new ATOM 0 HG3 GLU A 619 17.861 -5.363 6.106 1.00 0.00 H new ATOM 1779 N ALA A 620 14.526 -3.608 3.548 1.00 0.00 N ATOM 1780 CA ALA A 620 13.283 -3.215 2.942 1.00 0.00 C ATOM 1781 C ALA A 620 13.521 -2.039 1.999 1.00 0.00 C ATOM 1782 O ALA A 620 13.220 -2.176 0.816 1.00 0.00 O ATOM 1783 CB ALA A 620 12.284 -2.933 4.061 1.00 0.00 C ATOM 0 H ALA A 620 14.518 -3.524 4.564 1.00 0.00 H new ATOM 0 HA ALA A 620 12.859 -4.004 2.321 1.00 0.00 H new ATOM 0 HB1 ALA A 620 11.330 -2.632 3.629 1.00 0.00 H new ATOM 0 HB2 ALA A 620 12.144 -3.833 4.659 1.00 0.00 H new ATOM 0 HB3 ALA A 620 12.664 -2.132 4.695 1.00 0.00 H new ATOM 1789 N ALA A 621 14.104 -0.931 2.471 1.00 0.00 N ATOM 1790 CA ALA A 621 14.437 0.227 1.640 1.00 0.00 C ATOM 1791 C ALA A 621 15.323 -0.178 0.451 1.00 0.00 C ATOM 1792 O ALA A 621 15.077 0.209 -0.693 1.00 0.00 O ATOM 1793 CB ALA A 621 15.156 1.266 2.515 1.00 0.00 C ATOM 0 H ALA A 621 14.360 -0.814 3.451 1.00 0.00 H new ATOM 0 HA ALA A 621 13.520 0.652 1.232 1.00 0.00 H new ATOM 0 HB1 ALA A 621 15.412 2.136 1.911 1.00 0.00 H new ATOM 0 HB2 ALA A 621 14.501 1.571 3.331 1.00 0.00 H new ATOM 0 HB3 ALA A 621 16.067 0.829 2.925 1.00 0.00 H new ATOM 1799 N ARG A 622 16.341 -1.000 0.707 1.00 0.00 N ATOM 1800 CA ARG A 622 17.296 -1.486 -0.286 1.00 0.00 C ATOM 1801 C ARG A 622 16.600 -2.331 -1.354 1.00 0.00 C ATOM 1802 O ARG A 622 16.920 -2.189 -2.537 1.00 0.00 O ATOM 1803 CB ARG A 622 18.409 -2.256 0.430 1.00 0.00 C ATOM 1804 CG ARG A 622 19.348 -1.264 1.138 1.00 0.00 C ATOM 1805 CD ARG A 622 19.936 -1.819 2.436 1.00 0.00 C ATOM 1806 NE ARG A 622 21.378 -2.096 2.367 1.00 0.00 N ATOM 1807 CZ ARG A 622 22.001 -3.024 1.633 1.00 0.00 C ATOM 1808 NH1 ARG A 622 21.323 -3.876 0.885 1.00 0.00 N ATOM 1809 NH2 ARG A 622 23.323 -3.115 1.643 1.00 0.00 N ATOM 0 H ARG A 622 16.529 -1.357 1.644 1.00 0.00 H new ATOM 0 HA ARG A 622 17.742 -0.641 -0.811 1.00 0.00 H new ATOM 0 HB2 ARG A 622 17.979 -2.947 1.155 1.00 0.00 H new ATOM 0 HB3 ARG A 622 18.970 -2.855 -0.287 1.00 0.00 H new ATOM 0 HG2 ARG A 622 20.161 -0.997 0.463 1.00 0.00 H new ATOM 0 HG3 ARG A 622 18.801 -0.347 1.357 1.00 0.00 H new ATOM 0 HD2 ARG A 622 19.751 -1.107 3.241 1.00 0.00 H new ATOM 0 HD3 ARG A 622 19.412 -2.738 2.697 1.00 0.00 H new ATOM 0 HE ARG A 622 21.976 -1.509 2.949 1.00 0.00 H new ATOM 0 HH11 ARG A 622 20.304 -3.834 0.860 1.00 0.00 H new ATOM 0 HH12 ARG A 622 21.818 -4.576 0.333 1.00 0.00 H new ATOM 0 HH21 ARG A 622 23.874 -2.474 2.214 1.00 0.00 H new ATOM 0 HH22 ARG A 622 23.790 -3.826 1.080 1.00 0.00 H new ATOM 1823 N CYS A 623 15.628 -3.168 -0.974 1.00 0.00 N ATOM 1824 CA CYS A 623 14.762 -3.834 -1.936 1.00 0.00 C ATOM 1825 C CYS A 623 13.971 -2.790 -2.728 1.00 0.00 C ATOM 1826 O CYS A 623 13.927 -2.851 -3.960 1.00 0.00 O ATOM 1827 CB CYS A 623 13.806 -4.852 -1.274 1.00 0.00 C ATOM 1828 SG CYS A 623 14.137 -6.501 -1.965 1.00 0.00 S ATOM 0 H CYS A 623 15.426 -3.397 -0.001 1.00 0.00 H new ATOM 0 HA CYS A 623 15.401 -4.402 -2.612 1.00 0.00 H new ATOM 0 HB2 CYS A 623 13.951 -4.859 -0.194 1.00 0.00 H new ATOM 0 HB3 CYS A 623 12.769 -4.568 -1.454 1.00 0.00 H new ATOM 0 HG CYS A 623 13.248 -6.778 -2.872 1.00 0.00 H new ATOM 1834 N MET A 624 13.323 -1.860 -2.024 1.00 0.00 N ATOM 1835 CA MET A 624 12.340 -0.932 -2.569 1.00 0.00 C ATOM 1836 C MET A 624 12.908 -0.101 -3.713 1.00 0.00 C ATOM 1837 O MET A 624 12.183 0.074 -4.693 1.00 0.00 O ATOM 1838 CB MET A 624 11.779 -0.028 -1.463 1.00 0.00 C ATOM 1839 CG MET A 624 10.879 -0.778 -0.470 1.00 0.00 C ATOM 1840 SD MET A 624 9.128 -0.913 -0.886 1.00 0.00 S ATOM 1841 CE MET A 624 8.673 0.837 -0.840 1.00 0.00 C ATOM 0 H MET A 624 13.476 -1.731 -1.024 1.00 0.00 H new ATOM 0 HA MET A 624 11.525 -1.527 -2.980 1.00 0.00 H new ATOM 0 HB2 MET A 624 12.607 0.429 -0.920 1.00 0.00 H new ATOM 0 HB3 MET A 624 11.211 0.783 -1.918 1.00 0.00 H new ATOM 0 HG2 MET A 624 11.276 -1.786 -0.348 1.00 0.00 H new ATOM 0 HG3 MET A 624 10.959 -0.284 0.499 1.00 0.00 H new ATOM 0 HE1 MET A 624 7.911 0.995 -0.077 1.00 0.00 H new ATOM 0 HE2 MET A 624 9.553 1.436 -0.604 1.00 0.00 H new ATOM 0 HE3 MET A 624 8.281 1.137 -1.812 1.00 0.00 H new ATOM 1851 N ARG A 625 14.172 0.339 -3.640 1.00 0.00 N ATOM 1852 CA ARG A 625 14.850 1.045 -4.731 1.00 0.00 C ATOM 1853 C ARG A 625 14.720 0.394 -6.110 1.00 0.00 C ATOM 1854 O ARG A 625 14.721 1.127 -7.099 1.00 0.00 O ATOM 1855 CB ARG A 625 16.339 1.234 -4.430 1.00 0.00 C ATOM 1856 CG ARG A 625 16.611 2.246 -3.314 1.00 0.00 C ATOM 1857 CD ARG A 625 18.084 2.674 -3.284 1.00 0.00 C ATOM 1858 NE ARG A 625 18.520 3.321 -4.538 1.00 0.00 N ATOM 1859 CZ ARG A 625 18.100 4.500 -5.017 1.00 0.00 C ATOM 1860 NH1 ARG A 625 17.449 5.357 -4.242 1.00 0.00 N ATOM 1861 NH2 ARG A 625 18.320 4.822 -6.281 1.00 0.00 N ATOM 0 H ARG A 625 14.756 0.213 -2.813 1.00 0.00 H new ATOM 0 HA ARG A 625 14.331 2.002 -4.780 1.00 0.00 H new ATOM 0 HB2 ARG A 625 16.770 0.273 -4.151 1.00 0.00 H new ATOM 0 HB3 ARG A 625 16.847 1.560 -5.338 1.00 0.00 H new ATOM 0 HG2 ARG A 625 15.980 3.123 -3.456 1.00 0.00 H new ATOM 0 HG3 ARG A 625 16.339 1.810 -2.353 1.00 0.00 H new ATOM 0 HD2 ARG A 625 18.240 3.362 -2.453 1.00 0.00 H new ATOM 0 HD3 ARG A 625 18.707 1.800 -3.096 1.00 0.00 H new ATOM 0 HE ARG A 625 19.211 2.820 -5.096 1.00 0.00 H new ATOM 0 HH11 ARG A 625 17.262 5.122 -3.267 1.00 0.00 H new ATOM 0 HH12 ARG A 625 17.136 6.251 -4.621 1.00 0.00 H new ATOM 0 HH21 ARG A 625 18.811 4.172 -6.895 1.00 0.00 H new ATOM 0 HH22 ARG A 625 17.999 5.720 -6.642 1.00 0.00 H new ATOM 1875 N SER A 626 14.627 -0.933 -6.230 1.00 0.00 N ATOM 1876 CA SER A 626 14.482 -1.551 -7.548 1.00 0.00 C ATOM 1877 C SER A 626 13.135 -1.262 -8.211 1.00 0.00 C ATOM 1878 O SER A 626 13.010 -1.515 -9.409 1.00 0.00 O ATOM 1879 CB SER A 626 14.697 -3.062 -7.468 1.00 0.00 C ATOM 1880 OG SER A 626 16.049 -3.378 -7.725 1.00 0.00 O ATOM 0 H SER A 626 14.649 -1.587 -5.448 1.00 0.00 H new ATOM 0 HA SER A 626 15.252 -1.098 -8.172 1.00 0.00 H new ATOM 0 HB2 SER A 626 14.413 -3.425 -6.480 1.00 0.00 H new ATOM 0 HB3 SER A 626 14.055 -3.566 -8.190 1.00 0.00 H new ATOM 0 HG SER A 626 16.174 -4.348 -7.669 1.00 0.00 H new ATOM 1886 N LEU A 627 12.129 -0.765 -7.488 1.00 0.00 N ATOM 1887 CA LEU A 627 10.842 -0.438 -8.083 1.00 0.00 C ATOM 1888 C LEU A 627 11.009 0.696 -9.091 1.00 0.00 C ATOM 1889 O LEU A 627 11.578 1.743 -8.779 1.00 0.00 O ATOM 1890 CB LEU A 627 9.848 -0.074 -6.981 1.00 0.00 C ATOM 1891 CG LEU A 627 8.497 0.423 -7.522 1.00 0.00 C ATOM 1892 CD1 LEU A 627 7.723 -0.678 -8.252 1.00 0.00 C ATOM 1893 CD2 LEU A 627 7.676 0.937 -6.346 1.00 0.00 C ATOM 0 H LEU A 627 12.187 -0.582 -6.486 1.00 0.00 H new ATOM 0 HA LEU A 627 10.450 -1.302 -8.620 1.00 0.00 H new ATOM 0 HB2 LEU A 627 9.680 -0.947 -6.350 1.00 0.00 H new ATOM 0 HB3 LEU A 627 10.285 0.698 -6.348 1.00 0.00 H new ATOM 0 HG LEU A 627 8.683 1.214 -8.248 1.00 0.00 H new ATOM 0 HD11 LEU A 627 6.776 -0.278 -8.615 1.00 0.00 H new ATOM 0 HD12 LEU A 627 8.312 -1.039 -9.095 1.00 0.00 H new ATOM 0 HD13 LEU A 627 7.529 -1.502 -7.566 1.00 0.00 H new ATOM 0 HD21 LEU A 627 6.711 1.296 -6.705 1.00 0.00 H new ATOM 0 HD22 LEU A 627 7.520 0.129 -5.631 1.00 0.00 H new ATOM 0 HD23 LEU A 627 8.209 1.754 -5.860 1.00 0.00 H new ATOM 1905 N LYS A 628 10.499 0.480 -10.301 1.00 0.00 N ATOM 1906 CA LYS A 628 10.632 1.384 -11.440 1.00 0.00 C ATOM 1907 C LYS A 628 9.423 2.303 -11.646 1.00 0.00 C ATOM 1908 O LYS A 628 9.506 3.225 -12.463 1.00 0.00 O ATOM 1909 CB LYS A 628 10.960 0.531 -12.665 1.00 0.00 C ATOM 1910 CG LYS A 628 12.376 -0.056 -12.550 1.00 0.00 C ATOM 1911 CD LYS A 628 13.506 0.992 -12.606 1.00 0.00 C ATOM 1912 CE LYS A 628 13.988 1.421 -11.209 1.00 0.00 C ATOM 1913 NZ LYS A 628 14.698 2.716 -11.239 1.00 0.00 N ATOM 0 H LYS A 628 9.963 -0.359 -10.523 1.00 0.00 H new ATOM 0 HA LYS A 628 11.443 2.088 -11.250 1.00 0.00 H new ATOM 0 HB2 LYS A 628 10.232 -0.275 -12.759 1.00 0.00 H new ATOM 0 HB3 LYS A 628 10.883 1.137 -13.568 1.00 0.00 H new ATOM 0 HG2 LYS A 628 12.453 -0.606 -11.612 1.00 0.00 H new ATOM 0 HG3 LYS A 628 12.524 -0.776 -13.355 1.00 0.00 H new ATOM 0 HD2 LYS A 628 14.347 0.584 -13.167 1.00 0.00 H new ATOM 0 HD3 LYS A 628 13.156 1.869 -13.150 1.00 0.00 H new ATOM 0 HE2 LYS A 628 13.133 1.493 -10.537 1.00 0.00 H new ATOM 0 HE3 LYS A 628 14.649 0.655 -10.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 628 15.005 2.966 -10.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 628 15.529 2.642 -11.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 628 14.060 3.453 -11.602 1.00 0.00 H new ATOM 1927 N ALA A 629 8.329 2.091 -10.912 1.00 0.00 N ATOM 1928 CA ALA A 629 7.139 2.935 -10.943 1.00 0.00 C ATOM 1929 C ALA A 629 7.184 3.977 -9.807 1.00 0.00 C ATOM 1930 O ALA A 629 7.890 3.765 -8.811 1.00 0.00 O ATOM 1931 CB ALA A 629 5.904 2.033 -10.816 1.00 0.00 C ATOM 0 H ALA A 629 8.247 1.307 -10.264 1.00 0.00 H new ATOM 0 HA ALA A 629 7.094 3.484 -11.884 1.00 0.00 H new ATOM 0 HB1 ALA A 629 5.003 2.645 -10.837 1.00 0.00 H new ATOM 0 HB2 ALA A 629 5.882 1.327 -11.646 1.00 0.00 H new ATOM 0 HB3 ALA A 629 5.949 1.485 -9.875 1.00 0.00 H new ATOM 1937 N PRO A 630 6.428 5.087 -9.904 1.00 0.00 N ATOM 1938 CA PRO A 630 6.232 6.006 -8.790 1.00 0.00 C ATOM 1939 C PRO A 630 5.463 5.351 -7.655 1.00 0.00 C ATOM 1940 O PRO A 630 4.501 4.620 -7.882 1.00 0.00 O ATOM 1941 CB PRO A 630 5.439 7.200 -9.320 1.00 0.00 C ATOM 1942 CG PRO A 630 4.955 6.793 -10.706 1.00 0.00 C ATOM 1943 CD PRO A 630 5.752 5.556 -11.101 1.00 0.00 C ATOM 0 HA PRO A 630 7.201 6.311 -8.394 1.00 0.00 H new ATOM 0 HB2 PRO A 630 4.599 7.434 -8.665 1.00 0.00 H new ATOM 0 HB3 PRO A 630 6.062 8.093 -9.370 1.00 0.00 H new ATOM 0 HG2 PRO A 630 3.886 6.578 -10.695 1.00 0.00 H new ATOM 0 HG3 PRO A 630 5.111 7.599 -11.423 1.00 0.00 H new ATOM 0 HD2 PRO A 630 5.094 4.784 -11.500 1.00 0.00 H new ATOM 0 HD3 PRO A 630 6.473 5.795 -11.883 1.00 0.00 H new ATOM 1951 N ALA A 631 5.822 5.685 -6.417 1.00 0.00 N ATOM 1952 CA ALA A 631 5.214 5.120 -5.236 1.00 0.00 C ATOM 1953 C ALA A 631 5.479 6.046 -4.060 1.00 0.00 C ATOM 1954 O ALA A 631 6.632 6.372 -3.762 1.00 0.00 O ATOM 1955 CB ALA A 631 5.829 3.752 -4.975 1.00 0.00 C ATOM 0 H ALA A 631 6.554 6.366 -6.214 1.00 0.00 H new ATOM 0 HA ALA A 631 4.138 5.010 -5.373 1.00 0.00 H new ATOM 0 HB1 ALA A 631 5.378 3.314 -4.085 1.00 0.00 H new ATOM 0 HB2 ALA A 631 5.647 3.102 -5.831 1.00 0.00 H new ATOM 0 HB3 ALA A 631 6.903 3.859 -4.822 1.00 0.00 H new ATOM 1961 N VAL A 632 4.412 6.478 -3.406 1.00 0.00 N ATOM 1962 CA VAL A 632 4.481 6.989 -2.043 1.00 0.00 C ATOM 1963 C VAL A 632 4.782 5.798 -1.123 1.00 0.00 C ATOM 1964 O VAL A 632 4.258 4.700 -1.330 1.00 0.00 O ATOM 1965 CB VAL A 632 3.162 7.713 -1.692 1.00 0.00 C ATOM 1966 CG1 VAL A 632 2.988 8.027 -0.203 1.00 0.00 C ATOM 1967 CG2 VAL A 632 3.079 9.055 -2.417 1.00 0.00 C ATOM 0 H VAL A 632 3.473 6.485 -3.804 1.00 0.00 H new ATOM 0 HA VAL A 632 5.273 7.728 -1.921 1.00 0.00 H new ATOM 0 HB VAL A 632 2.383 7.015 -1.999 1.00 0.00 H new ATOM 0 HG11 VAL A 632 2.036 8.535 -0.047 1.00 0.00 H new ATOM 0 HG12 VAL A 632 3.002 7.099 0.369 1.00 0.00 H new ATOM 0 HG13 VAL A 632 3.802 8.671 0.131 1.00 0.00 H new ATOM 0 HG21 VAL A 632 2.144 9.551 -2.158 1.00 0.00 H new ATOM 0 HG22 VAL A 632 3.918 9.683 -2.117 1.00 0.00 H new ATOM 0 HG23 VAL A 632 3.116 8.890 -3.494 1.00 0.00 H new ATOM 1977 N VAL A 633 5.597 6.029 -0.095 1.00 0.00 N ATOM 1978 CA VAL A 633 5.924 5.075 0.960 1.00 0.00 C ATOM 1979 C VAL A 633 5.489 5.685 2.294 1.00 0.00 C ATOM 1980 O VAL A 633 5.194 6.880 2.363 1.00 0.00 O ATOM 1981 CB VAL A 633 7.410 4.661 0.881 1.00 0.00 C ATOM 1982 CG1 VAL A 633 7.701 3.396 1.703 1.00 0.00 C ATOM 1983 CG2 VAL A 633 7.805 4.311 -0.559 1.00 0.00 C ATOM 0 H VAL A 633 6.067 6.926 0.029 1.00 0.00 H new ATOM 0 HA VAL A 633 5.381 4.137 0.843 1.00 0.00 H new ATOM 0 HB VAL A 633 7.970 5.513 1.265 1.00 0.00 H new ATOM 0 HG11 VAL A 633 8.758 3.142 1.618 1.00 0.00 H new ATOM 0 HG12 VAL A 633 7.454 3.577 2.749 1.00 0.00 H new ATOM 0 HG13 VAL A 633 7.098 2.570 1.326 1.00 0.00 H new ATOM 0 HG21 VAL A 633 8.856 4.023 -0.588 1.00 0.00 H new ATOM 0 HG22 VAL A 633 7.192 3.483 -0.913 1.00 0.00 H new ATOM 0 HG23 VAL A 633 7.649 5.178 -1.200 1.00 0.00 H new ATOM 1993 N SER A 634 5.408 4.899 3.362 1.00 0.00 N ATOM 1994 CA SER A 634 5.165 5.428 4.693 1.00 0.00 C ATOM 1995 C SER A 634 5.767 4.496 5.734 1.00 0.00 C ATOM 1996 O SER A 634 5.893 3.300 5.490 1.00 0.00 O ATOM 1997 CB SER A 634 3.651 5.581 4.866 1.00 0.00 C ATOM 1998 OG SER A 634 3.281 6.141 6.113 1.00 0.00 O ATOM 0 H SER A 634 5.509 3.885 3.327 1.00 0.00 H new ATOM 0 HA SER A 634 5.637 6.401 4.825 1.00 0.00 H new ATOM 0 HB2 SER A 634 3.263 6.209 4.064 1.00 0.00 H new ATOM 0 HB3 SER A 634 3.180 4.604 4.761 1.00 0.00 H new ATOM 0 HG SER A 634 3.941 6.816 6.377 1.00 0.00 H new ATOM 2004 N VAL A 635 6.050 5.034 6.917 1.00 0.00 N ATOM 2005 CA VAL A 635 6.566 4.322 8.082 1.00 0.00 C ATOM 2006 C VAL A 635 5.793 4.784 9.317 1.00 0.00 C ATOM 2007 O VAL A 635 5.126 5.819 9.290 1.00 0.00 O ATOM 2008 CB VAL A 635 8.087 4.564 8.241 1.00 0.00 C ATOM 2009 CG1 VAL A 635 8.909 3.488 7.533 1.00 0.00 C ATOM 2010 CG2 VAL A 635 8.540 5.949 7.766 1.00 0.00 C ATOM 0 H VAL A 635 5.919 6.029 7.098 1.00 0.00 H new ATOM 0 HA VAL A 635 6.426 3.249 7.954 1.00 0.00 H new ATOM 0 HB VAL A 635 8.269 4.511 9.314 1.00 0.00 H new ATOM 0 HG11 VAL A 635 9.971 3.694 7.668 1.00 0.00 H new ATOM 0 HG12 VAL A 635 8.672 2.512 7.956 1.00 0.00 H new ATOM 0 HG13 VAL A 635 8.672 3.490 6.469 1.00 0.00 H new ATOM 0 HG21 VAL A 635 9.616 6.048 7.907 1.00 0.00 H new ATOM 0 HG22 VAL A 635 8.300 6.068 6.709 1.00 0.00 H new ATOM 0 HG23 VAL A 635 8.026 6.718 8.343 1.00 0.00 H new ATOM 2020 N SER A 636 5.890 4.025 10.408 1.00 0.00 N ATOM 2021 CA SER A 636 5.145 4.264 11.634 1.00 0.00 C ATOM 2022 C SER A 636 5.785 5.317 12.552 1.00 0.00 C ATOM 2023 O SER A 636 5.220 5.569 13.622 1.00 0.00 O ATOM 2024 CB SER A 636 4.991 2.919 12.357 1.00 0.00 C ATOM 2025 OG SER A 636 6.256 2.309 12.557 1.00 0.00 O ATOM 0 H SER A 636 6.503 3.211 10.461 1.00 0.00 H new ATOM 0 HA SER A 636 4.173 4.681 11.369 1.00 0.00 H new ATOM 0 HB2 SER A 636 4.499 3.071 13.318 1.00 0.00 H new ATOM 0 HB3 SER A 636 4.351 2.258 11.773 1.00 0.00 H new ATOM 0 HG SER A 636 6.137 1.454 13.021 1.00 0.00 H new ATOM 2031 N SER A 637 6.947 5.890 12.208 1.00 0.00 N ATOM 2032 CA SER A 637 7.680 6.802 13.095 1.00 0.00 C ATOM 2033 C SER A 637 8.305 7.958 12.304 1.00 0.00 C ATOM 2034 O SER A 637 8.628 7.780 11.129 1.00 0.00 O ATOM 2035 CB SER A 637 8.747 5.997 13.852 1.00 0.00 C ATOM 2036 OG SER A 637 8.115 5.024 14.670 1.00 0.00 O ATOM 0 H SER A 637 7.404 5.734 11.309 1.00 0.00 H new ATOM 0 HA SER A 637 6.991 7.249 13.811 1.00 0.00 H new ATOM 0 HB2 SER A 637 9.421 5.512 13.146 1.00 0.00 H new ATOM 0 HB3 SER A 637 9.354 6.664 14.465 1.00 0.00 H new ATOM 0 HG SER A 637 8.796 4.509 15.152 1.00 0.00 H new ATOM 2042 N PRO A 638 8.512 9.135 12.923 1.00 0.00 N ATOM 2043 CA PRO A 638 8.982 10.321 12.217 1.00 0.00 C ATOM 2044 C PRO A 638 10.445 10.177 11.794 1.00 0.00 C ATOM 2045 O PRO A 638 10.756 10.385 10.624 1.00 0.00 O ATOM 2046 CB PRO A 638 8.758 11.494 13.174 1.00 0.00 C ATOM 2047 CG PRO A 638 8.752 10.850 14.559 1.00 0.00 C ATOM 2048 CD PRO A 638 8.184 9.458 14.303 1.00 0.00 C ATOM 0 HA PRO A 638 8.437 10.479 11.286 1.00 0.00 H new ATOM 0 HB2 PRO A 638 9.549 12.238 13.084 1.00 0.00 H new ATOM 0 HB3 PRO A 638 7.817 12.003 12.967 1.00 0.00 H new ATOM 0 HG2 PRO A 638 9.755 10.802 14.984 1.00 0.00 H new ATOM 0 HG3 PRO A 638 8.135 11.412 15.260 1.00 0.00 H new ATOM 0 HD2 PRO A 638 8.617 8.729 14.987 1.00 0.00 H new ATOM 0 HD3 PRO A 638 7.106 9.442 14.461 1.00 0.00 H new ATOM 2056 N ASP A 639 11.334 9.744 12.701 1.00 0.00 N ATOM 2057 CA ASP A 639 12.762 9.553 12.402 1.00 0.00 C ATOM 2058 C ASP A 639 12.961 8.504 11.317 1.00 0.00 C ATOM 2059 O ASP A 639 13.976 8.490 10.634 1.00 0.00 O ATOM 2060 CB ASP A 639 13.540 9.077 13.643 1.00 0.00 C ATOM 2061 CG ASP A 639 14.018 10.227 14.514 1.00 0.00 C ATOM 2062 OD1 ASP A 639 13.152 10.977 15.022 1.00 0.00 O ATOM 2063 OD2 ASP A 639 15.246 10.373 14.716 1.00 0.00 O ATOM 0 H ASP A 639 11.083 9.516 13.663 1.00 0.00 H new ATOM 0 HA ASP A 639 13.135 10.522 12.071 1.00 0.00 H new ATOM 0 HB2 ASP A 639 12.904 8.419 14.235 1.00 0.00 H new ATOM 0 HB3 ASP A 639 14.399 8.487 13.324 1.00 0.00 H new ATOM 2068 N ALA A 640 11.984 7.623 11.143 1.00 0.00 N ATOM 2069 CA ALA A 640 12.043 6.565 10.163 1.00 0.00 C ATOM 2070 C ALA A 640 11.896 7.171 8.775 1.00 0.00 C ATOM 2071 O ALA A 640 12.556 6.695 7.867 1.00 0.00 O ATOM 2072 CB ALA A 640 10.978 5.505 10.441 1.00 0.00 C ATOM 0 H ALA A 640 11.122 7.630 11.688 1.00 0.00 H new ATOM 0 HA ALA A 640 13.007 6.060 10.222 1.00 0.00 H new ATOM 0 HB1 ALA A 640 11.043 4.718 9.689 1.00 0.00 H new ATOM 0 HB2 ALA A 640 11.141 5.076 11.430 1.00 0.00 H new ATOM 0 HB3 ALA A 640 9.990 5.963 10.403 1.00 0.00 H new ATOM 2078 N VAL A 641 11.104 8.233 8.589 1.00 0.00 N ATOM 2079 CA VAL A 641 10.978 8.905 7.295 1.00 0.00 C ATOM 2080 C VAL A 641 12.347 9.446 6.864 1.00 0.00 C ATOM 2081 O VAL A 641 12.685 9.398 5.683 1.00 0.00 O ATOM 2082 CB VAL A 641 9.909 10.019 7.377 1.00 0.00 C ATOM 2083 CG1 VAL A 641 9.686 10.724 6.030 1.00 0.00 C ATOM 2084 CG2 VAL A 641 8.550 9.455 7.816 1.00 0.00 C ATOM 0 H VAL A 641 10.536 8.647 9.328 1.00 0.00 H new ATOM 0 HA VAL A 641 10.646 8.196 6.537 1.00 0.00 H new ATOM 0 HB VAL A 641 10.293 10.732 8.107 1.00 0.00 H new ATOM 0 HG11 VAL A 641 8.926 11.497 6.145 1.00 0.00 H new ATOM 0 HG12 VAL A 641 10.619 11.180 5.699 1.00 0.00 H new ATOM 0 HG13 VAL A 641 9.355 9.996 5.289 1.00 0.00 H new ATOM 0 HG21 VAL A 641 7.819 10.262 7.864 1.00 0.00 H new ATOM 0 HG22 VAL A 641 8.217 8.707 7.097 1.00 0.00 H new ATOM 0 HG23 VAL A 641 8.648 8.995 8.799 1.00 0.00 H new ATOM 2094 N THR A 642 13.153 9.914 7.814 1.00 0.00 N ATOM 2095 CA THR A 642 14.487 10.434 7.607 1.00 0.00 C ATOM 2096 C THR A 642 15.461 9.280 7.354 1.00 0.00 C ATOM 2097 O THR A 642 16.175 9.296 6.352 1.00 0.00 O ATOM 2098 CB THR A 642 14.821 11.223 8.886 1.00 0.00 C ATOM 2099 OG1 THR A 642 13.876 12.262 9.105 1.00 0.00 O ATOM 2100 CG2 THR A 642 16.225 11.833 8.874 1.00 0.00 C ATOM 0 H THR A 642 12.872 9.939 8.794 1.00 0.00 H new ATOM 0 HA THR A 642 14.562 11.082 6.734 1.00 0.00 H new ATOM 0 HB THR A 642 14.779 10.494 9.695 1.00 0.00 H new ATOM 0 HG1 THR A 642 14.108 12.748 9.924 1.00 0.00 H new ATOM 0 HG21 THR A 642 16.394 12.375 9.805 1.00 0.00 H new ATOM 0 HG22 THR A 642 16.966 11.039 8.776 1.00 0.00 H new ATOM 0 HG23 THR A 642 16.316 12.520 8.033 1.00 0.00 H new ATOM 2108 N THR A 643 15.506 8.283 8.236 1.00 0.00 N ATOM 2109 CA THR A 643 16.499 7.225 8.183 1.00 0.00 C ATOM 2110 C THR A 643 16.246 6.260 7.014 1.00 0.00 C ATOM 2111 O THR A 643 17.195 5.837 6.360 1.00 0.00 O ATOM 2112 CB THR A 643 16.529 6.529 9.550 1.00 0.00 C ATOM 2113 OG1 THR A 643 16.839 7.470 10.558 1.00 0.00 O ATOM 2114 CG2 THR A 643 17.565 5.416 9.609 1.00 0.00 C ATOM 0 H THR A 643 14.848 8.191 9.010 1.00 0.00 H new ATOM 0 HA THR A 643 17.485 7.645 7.985 1.00 0.00 H new ATOM 0 HB THR A 643 15.542 6.094 9.706 1.00 0.00 H new ATOM 0 HG1 THR A 643 16.030 7.967 10.802 1.00 0.00 H new ATOM 0 HG21 THR A 643 17.547 4.954 10.596 1.00 0.00 H new ATOM 0 HG22 THR A 643 17.336 4.665 8.853 1.00 0.00 H new ATOM 0 HG23 THR A 643 18.555 5.830 9.420 1.00 0.00 H new ATOM 2122 N TYR A 644 14.984 5.967 6.686 1.00 0.00 N ATOM 2123 CA TYR A 644 14.597 5.208 5.507 1.00 0.00 C ATOM 2124 C TYR A 644 15.174 5.873 4.258 1.00 0.00 C ATOM 2125 O TYR A 644 15.830 5.224 3.448 1.00 0.00 O ATOM 2126 CB TYR A 644 13.064 5.160 5.450 1.00 0.00 C ATOM 2127 CG TYR A 644 12.519 4.396 4.279 1.00 0.00 C ATOM 2128 CD1 TYR A 644 12.411 3.004 4.373 1.00 0.00 C ATOM 2129 CD2 TYR A 644 12.124 5.066 3.109 1.00 0.00 C ATOM 2130 CE1 TYR A 644 12.011 2.257 3.257 1.00 0.00 C ATOM 2131 CE2 TYR A 644 11.691 4.327 1.995 1.00 0.00 C ATOM 2132 CZ TYR A 644 11.674 2.915 2.051 1.00 0.00 C ATOM 2133 OH TYR A 644 11.314 2.183 0.967 1.00 0.00 O ATOM 0 H TYR A 644 14.188 6.261 7.252 1.00 0.00 H new ATOM 0 HA TYR A 644 14.987 4.191 5.555 1.00 0.00 H new ATOM 0 HB2 TYR A 644 12.691 4.710 6.370 1.00 0.00 H new ATOM 0 HB3 TYR A 644 12.680 6.180 5.416 1.00 0.00 H new ATOM 0 HD1 TYR A 644 12.636 2.506 5.305 1.00 0.00 H new ATOM 0 HD2 TYR A 644 12.153 6.145 3.066 1.00 0.00 H new ATOM 0 HE1 TYR A 644 11.960 1.180 3.318 1.00 0.00 H new ATOM 0 HE2 TYR A 644 11.372 4.837 1.098 1.00 0.00 H new ATOM 0 HH TYR A 644 11.112 2.783 0.219 1.00 0.00 H new ATOM 2143 N ASN A 645 14.952 7.185 4.140 1.00 0.00 N ATOM 2144 CA ASN A 645 15.504 8.026 3.082 1.00 0.00 C ATOM 2145 C ASN A 645 17.029 7.970 3.083 1.00 0.00 C ATOM 2146 O ASN A 645 17.637 7.849 2.022 1.00 0.00 O ATOM 2147 CB ASN A 645 14.991 9.464 3.255 1.00 0.00 C ATOM 2148 CG ASN A 645 13.763 9.701 2.394 1.00 0.00 C ATOM 2149 OD1 ASN A 645 13.758 9.464 1.192 1.00 0.00 O ATOM 2150 ND2 ASN A 645 12.662 10.149 2.977 1.00 0.00 N ATOM 0 H ASN A 645 14.367 7.702 4.797 1.00 0.00 H new ATOM 0 HA ASN A 645 15.172 7.652 2.113 1.00 0.00 H new ATOM 0 HB2 ASN A 645 14.748 9.646 4.302 1.00 0.00 H new ATOM 0 HB3 ASN A 645 15.775 10.171 2.982 1.00 0.00 H new ATOM 0 HD21 ASN A 645 11.816 10.295 2.426 1.00 0.00 H new ATOM 0 HD22 ASN A 645 12.660 10.348 3.977 1.00 0.00 H new ATOM 2157 N GLY A 646 17.631 7.969 4.272 1.00 0.00 N ATOM 2158 CA GLY A 646 19.041 7.726 4.506 1.00 0.00 C ATOM 2159 C GLY A 646 19.513 6.489 3.756 1.00 0.00 C ATOM 2160 O GLY A 646 20.451 6.595 2.976 1.00 0.00 O ATOM 0 H GLY A 646 17.118 8.147 5.135 1.00 0.00 H new ATOM 0 HA2 GLY A 646 19.621 8.592 4.187 1.00 0.00 H new ATOM 0 HA3 GLY A 646 19.219 7.598 5.574 1.00 0.00 H new ATOM 2164 N TYR A 647 18.865 5.333 3.924 1.00 0.00 N ATOM 2165 CA TYR A 647 19.270 4.096 3.252 1.00 0.00 C ATOM 2166 C TYR A 647 18.940 4.100 1.758 1.00 0.00 C ATOM 2167 O TYR A 647 19.548 3.332 1.008 1.00 0.00 O ATOM 2168 CB TYR A 647 18.563 2.877 3.863 1.00 0.00 C ATOM 2169 CG TYR A 647 18.497 2.771 5.375 1.00 0.00 C ATOM 2170 CD1 TYR A 647 19.643 2.951 6.175 1.00 0.00 C ATOM 2171 CD2 TYR A 647 17.274 2.425 5.976 1.00 0.00 C ATOM 2172 CE1 TYR A 647 19.569 2.787 7.572 1.00 0.00 C ATOM 2173 CE2 TYR A 647 17.199 2.245 7.364 1.00 0.00 C ATOM 2174 CZ TYR A 647 18.344 2.414 8.170 1.00 0.00 C ATOM 2175 OH TYR A 647 18.246 2.181 9.510 1.00 0.00 O ATOM 0 H TYR A 647 18.049 5.229 4.527 1.00 0.00 H new ATOM 0 HA TYR A 647 20.350 4.035 3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 647 17.542 2.859 3.483 1.00 0.00 H new ATOM 0 HB3 TYR A 647 19.059 1.982 3.488 1.00 0.00 H new ATOM 0 HD1 TYR A 647 20.583 3.216 5.714 1.00 0.00 H new ATOM 0 HD2 TYR A 647 16.391 2.298 5.367 1.00 0.00 H new ATOM 0 HE1 TYR A 647 20.445 2.946 8.184 1.00 0.00 H new ATOM 0 HE2 TYR A 647 16.258 1.975 7.820 1.00 0.00 H new ATOM 0 HH TYR A 647 17.323 1.937 9.733 1.00 0.00 H new ATOM 2185 N LEU A 648 17.982 4.915 1.303 1.00 0.00 N ATOM 2186 CA LEU A 648 17.710 5.043 -0.125 1.00 0.00 C ATOM 2187 C LEU A 648 18.835 5.803 -0.818 1.00 0.00 C ATOM 2188 O LEU A 648 19.046 5.596 -2.008 1.00 0.00 O ATOM 2189 CB LEU A 648 16.385 5.764 -0.425 1.00 0.00 C ATOM 2190 CG LEU A 648 15.088 5.049 -0.012 1.00 0.00 C ATOM 2191 CD1 LEU A 648 13.906 5.740 -0.697 1.00 0.00 C ATOM 2192 CD2 LEU A 648 15.004 3.572 -0.410 1.00 0.00 C ATOM 0 H LEU A 648 17.388 5.490 1.901 1.00 0.00 H new ATOM 0 HA LEU A 648 17.637 4.024 -0.506 1.00 0.00 H new ATOM 0 HB2 LEU A 648 16.409 6.734 0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 648 16.339 5.955 -1.497 1.00 0.00 H new ATOM 0 HG LEU A 648 15.069 5.102 1.077 1.00 0.00 H new ATOM 0 HD11 LEU A 648 12.979 5.242 -0.412 1.00 0.00 H new ATOM 0 HD12 LEU A 648 13.867 6.785 -0.388 1.00 0.00 H new ATOM 0 HD13 LEU A 648 14.030 5.686 -1.779 1.00 0.00 H new ATOM 0 HD21 LEU A 648 14.053 3.158 -0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 648 15.076 3.483 -1.494 1.00 0.00 H new ATOM 0 HD23 LEU A 648 15.823 3.023 0.055 1.00 0.00 H new ATOM 2204 N THR A 649 19.533 6.680 -0.109 1.00 0.00 N ATOM 2205 CA THR A 649 20.550 7.553 -0.667 1.00 0.00 C ATOM 2206 C THR A 649 21.931 6.957 -0.399 1.00 0.00 C ATOM 2207 O THR A 649 22.741 6.841 -1.323 1.00 0.00 O ATOM 2208 CB THR A 649 20.316 8.940 -0.052 1.00 0.00 C ATOM 2209 OG1 THR A 649 19.093 9.431 -0.561 1.00 0.00 O ATOM 2210 CG2 THR A 649 21.427 9.942 -0.342 1.00 0.00 C ATOM 0 H THR A 649 19.402 6.805 0.895 1.00 0.00 H new ATOM 0 HA THR A 649 20.492 7.652 -1.751 1.00 0.00 H new ATOM 0 HB THR A 649 20.298 8.824 1.032 1.00 0.00 H new ATOM 0 HG1 THR A 649 18.914 10.318 -0.184 1.00 0.00 H new ATOM 0 HG21 THR A 649 21.187 10.897 0.126 1.00 0.00 H new ATOM 0 HG22 THR A 649 22.369 9.567 0.059 1.00 0.00 H new ATOM 0 HG23 THR A 649 21.521 10.080 -1.419 1.00 0.00 H new ATOM 2218 N SER A 650 22.134 6.503 0.837 1.00 0.00 N ATOM 2219 CA SER A 650 23.310 5.892 1.422 1.00 0.00 C ATOM 2220 C SER A 650 24.432 6.907 1.642 1.00 0.00 C ATOM 2221 O SER A 650 25.159 7.317 0.730 1.00 0.00 O ATOM 2222 CB SER A 650 23.659 4.611 0.677 1.00 0.00 C ATOM 2223 OG SER A 650 22.722 3.626 1.061 1.00 0.00 O ATOM 0 H SER A 650 21.385 6.566 1.527 1.00 0.00 H new ATOM 0 HA SER A 650 23.104 5.560 2.440 1.00 0.00 H new ATOM 0 HB2 SER A 650 23.625 4.773 -0.400 1.00 0.00 H new ATOM 0 HB3 SER A 650 24.672 4.291 0.919 1.00 0.00 H new ATOM 0 HG SER A 650 21.816 3.938 0.854 1.00 0.00 H new ATOM 2229 N SER A 651 24.506 7.371 2.888 1.00 0.00 N ATOM 2230 CA SER A 651 25.552 8.236 3.421 1.00 0.00 C ATOM 2231 C SER A 651 26.824 7.445 3.702 1.00 0.00 C ATOM 2232 O SER A 651 27.824 8.066 4.119 1.00 0.00 O ATOM 2233 CB SER A 651 25.038 8.867 4.718 1.00 0.00 C ATOM 2234 OG SER A 651 23.747 9.428 4.520 1.00 0.00 O ATOM 0 H SER A 651 23.801 7.141 3.588 1.00 0.00 H new ATOM 0 HA SER A 651 25.792 9.006 2.688 1.00 0.00 H new ATOM 0 HB2 SER A 651 24.997 8.114 5.505 1.00 0.00 H new ATOM 0 HB3 SER A 651 25.730 9.640 5.053 1.00 0.00 H new ATOM 0 HG SER A 651 23.431 9.826 5.358 1.00 0.00 H new TER 2240 SER A 651