USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1053 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 617 HIS : no HD1:sc= -6.15! C(o=-13!,f=-20!) USER MOD Set 1.2: A 665 LYS NZ :NH3+ 167:sc= -7.05! (180deg=-7.45!) USER MOD Set 2.1: A 657 HIS : no HD1:sc= -6.44! C(o=-15!,f=-23!) USER MOD Set 2.2: A 673 HIS : no HE2:sc= -8.22! C(o=-15!,f=-15!) USER MOD Set 3.1: A 628 SER OG : rot -122:sc= 0.256 USER MOD Set 3.2: A 640 TYR OH : rot 180:sc= 0.342 USER MOD Set 4.1: A 597 GLN : amide:sc= 0.691 K(o=1.8,f=-13!) USER MOD Set 4.2: A 599 LYS NZ :NH3+ -144:sc= 1.14 (180deg=-0.564) USER MOD Set 5.1: A 552 THR OG1 : rot 180:sc=-0.00144 USER MOD Set 5.2: A 553 GLN : amide:sc= -2.62! K(o=-2.6!,f=0.18) USER MOD Set 6.1: A 551 SER OG : rot 120:sc= 0 USER MOD Set 6.2: A 554 GLN : amide:sc= -3.82! C(o=-3.8!,f=-3.3!) USER MOD Set 7.1: A 543 LYS NZ :NH3+ -123:sc= 0.523 (180deg=0) USER MOD Set 7.2: A 674 GLN : amide:sc= 0.214 K(o=0.74,f=-4.3!) USER MOD Single : A 547 SER OG : rot 39:sc= -0.0271! USER MOD Single : A 549 MET CE :methyl -139:sc= -0.182 (180deg=-2.07!) USER MOD Single : A 550 TYR OH : rot -22:sc= 1.09 USER MOD Single : A 564 CYS SG : rot -102:sc= -7.62! USER MOD Single : A 566 HIS : no HD1:sc= -0.425 X(o=-0.43,f=-0.68!) USER MOD Single : A 570 MET CE :methyl -165:sc= -0.0183 (180deg=-0.359) USER MOD Single : A 573 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 575 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 SER OG : rot -76:sc= -1.13! USER MOD Single : A 581 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 585 LYS NZ :NH3+ 158:sc= -0.568 (180deg=-2.24!) USER MOD Single : A 593 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 594 HIS : no HD1:sc= -1.19 X(o=-1.2,f=-0.98) USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 132:sc= 1.17 USER MOD Single : A 600 LYS NZ :NH3+ -149:sc= -0.15 (180deg=-1.02) USER MOD Single : A 601 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0 USER MOD Single : A 604 ASN : amide:sc= 1 K(o=1,f=-5.3!) USER MOD Single : A 608 ASN : amide:sc= -0.33 X(o=-0.33,f=-0.46) USER MOD Single : A 613 TYR OH : rot -125:sc= 0.0482 USER MOD Single : A 616 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0502) USER MOD Single : A 618 SER OG : rot 180:sc= 0 USER MOD Single : A 622 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 623 LYS NZ :NH3+ -118:sc= -2.15! (180deg=-4.4!) USER MOD Single : A 624 SER OG : rot 180:sc= 0 USER MOD Single : A 632 TYR OH : rot 180:sc= 0 USER MOD Single : A 636 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -1.07 K(o=-1.1,f=-0.096) USER MOD Single : A 644 CYS SG : rot 97:sc= 0.239 USER MOD Single : A 645 GLN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 649 SER OG : rot -54:sc= 0.00037 USER MOD Single : A 656 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 659 TYR OH : rot 180:sc= 0 USER MOD Single : A 661 CYS SG : rot -100:sc= -1.24 USER MOD Single : A 663 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 664 ASN : amide:sc= -2.82! K(o=-2.8!,f=-1.1) USER MOD Single : A 667 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 668 LYS NZ :NH3+ 164:sc= 0.0341 (180deg=0.00618) USER MOD Single : A 676 GLN : amide:sc= -1.33 K(o=-1.3,f=0.56) USER MOD Single : A 677 ASN : amide:sc= -0.161 K(o=-0.16,f=-1) USER MOD ----------------------------------------------------------------- ATOM 27 N GLY A 542 -2.933 -9.892 9.295 1.00 0.00 N ATOM 28 CA GLY A 542 -3.986 -9.427 8.411 1.00 0.00 C ATOM 29 C GLY A 542 -3.512 -9.232 6.984 1.00 0.00 C ATOM 30 O GLY A 542 -2.319 -9.337 6.698 1.00 0.00 O ATOM 0 HA2 GLY A 542 -4.806 -10.145 8.422 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -4.382 -8.485 8.789 1.00 0.00 H new ATOM 34 N LYS A 543 -4.452 -8.941 6.091 1.00 0.00 N ATOM 35 CA LYS A 543 -4.135 -8.721 4.685 1.00 0.00 C ATOM 36 C LYS A 543 -4.824 -7.458 4.181 1.00 0.00 C ATOM 37 O LYS A 543 -5.972 -7.187 4.533 1.00 0.00 O ATOM 38 CB LYS A 543 -4.570 -9.924 3.846 1.00 0.00 C ATOM 39 CG LYS A 543 -4.056 -11.253 4.374 1.00 0.00 C ATOM 40 CD LYS A 543 -4.683 -12.425 3.636 1.00 0.00 C ATOM 41 CE LYS A 543 -5.500 -13.299 4.573 1.00 0.00 C ATOM 42 NZ LYS A 543 -4.737 -14.499 5.019 1.00 0.00 N ATOM 0 H LYS A 543 -5.443 -8.852 6.317 1.00 0.00 H new ATOM 0 HA LYS A 543 -3.056 -8.598 4.589 1.00 0.00 H new ATOM 0 HB2 LYS A 543 -5.659 -9.955 3.808 1.00 0.00 H new ATOM 0 HB3 LYS A 543 -4.219 -9.789 2.823 1.00 0.00 H new ATOM 0 HG2 LYS A 543 -2.972 -11.293 4.268 1.00 0.00 H new ATOM 0 HG3 LYS A 543 -4.276 -11.332 5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 543 -5.321 -12.053 2.835 1.00 0.00 H new ATOM 0 HD3 LYS A 543 -3.901 -13.023 3.168 1.00 0.00 H new ATOM 0 HE2 LYS A 543 -5.801 -12.716 5.443 1.00 0.00 H new ATOM 0 HE3 LYS A 543 -6.414 -13.616 4.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 -5.266 -15.359 4.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 -3.809 -14.514 4.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 -4.603 -14.462 6.050 1.00 0.00 H new ATOM 56 N ILE A 544 -4.121 -6.684 3.364 1.00 0.00 N ATOM 57 CA ILE A 544 -4.680 -5.449 2.831 1.00 0.00 C ATOM 58 C ILE A 544 -4.787 -5.490 1.311 1.00 0.00 C ATOM 59 O ILE A 544 -3.813 -5.777 0.614 1.00 0.00 O ATOM 60 CB ILE A 544 -3.844 -4.224 3.251 1.00 0.00 C ATOM 61 CG1 ILE A 544 -4.703 -2.958 3.201 1.00 0.00 C ATOM 62 CG2 ILE A 544 -2.614 -4.080 2.364 1.00 0.00 C ATOM 63 CD1 ILE A 544 -4.658 -2.241 1.869 1.00 0.00 C ATOM 0 H ILE A 544 -3.170 -6.888 3.058 1.00 0.00 H new ATOM 0 HA ILE A 544 -5.682 -5.355 3.251 1.00 0.00 H new ATOM 0 HB ILE A 544 -3.502 -4.370 4.276 1.00 0.00 H new ATOM 0 HG12 ILE A 544 -5.736 -3.222 3.426 1.00 0.00 H new ATOM 0 HG13 ILE A 544 -4.371 -2.274 3.982 1.00 0.00 H new ATOM 0 HG21 ILE A 544 -2.039 -3.209 2.678 1.00 0.00 H new ATOM 0 HG22 ILE A 544 -1.996 -4.974 2.451 1.00 0.00 H new ATOM 0 HG23 ILE A 544 -2.926 -3.954 1.327 1.00 0.00 H new ATOM 0 HD11 ILE A 544 -5.291 -1.355 1.911 1.00 0.00 H new ATOM 0 HD12 ILE A 544 -3.632 -1.944 1.650 1.00 0.00 H new ATOM 0 HD13 ILE A 544 -5.018 -2.907 1.085 1.00 0.00 H new ATOM 75 N LEU A 545 -5.980 -5.192 0.806 1.00 0.00 N ATOM 76 CA LEU A 545 -6.225 -5.183 -0.631 1.00 0.00 C ATOM 77 C LEU A 545 -5.724 -3.885 -1.251 1.00 0.00 C ATOM 78 O LEU A 545 -6.019 -2.797 -0.756 1.00 0.00 O ATOM 79 CB LEU A 545 -7.720 -5.350 -0.911 1.00 0.00 C ATOM 80 CG LEU A 545 -8.083 -5.626 -2.373 1.00 0.00 C ATOM 81 CD1 LEU A 545 -7.728 -7.054 -2.754 1.00 0.00 C ATOM 82 CD2 LEU A 545 -9.562 -5.370 -2.606 1.00 0.00 C ATOM 0 H LEU A 545 -6.794 -4.953 1.373 1.00 0.00 H new ATOM 0 HA LEU A 545 -5.682 -6.016 -1.078 1.00 0.00 H new ATOM 0 HB2 LEU A 545 -8.099 -6.168 -0.299 1.00 0.00 H new ATOM 0 HB3 LEU A 545 -8.237 -4.446 -0.590 1.00 0.00 H new ATOM 0 HG LEU A 545 -7.507 -4.949 -3.004 1.00 0.00 H new ATOM 0 HD11 LEU A 545 -7.994 -7.229 -3.796 1.00 0.00 H new ATOM 0 HD12 LEU A 545 -6.657 -7.211 -2.621 1.00 0.00 H new ATOM 0 HD13 LEU A 545 -8.278 -7.748 -2.118 1.00 0.00 H new ATOM 0 HD21 LEU A 545 -9.806 -5.570 -3.649 1.00 0.00 H new ATOM 0 HD22 LEU A 545 -10.150 -6.025 -1.964 1.00 0.00 H new ATOM 0 HD23 LEU A 545 -9.793 -4.331 -2.372 1.00 0.00 H new ATOM 94 N VAL A 546 -4.966 -4.003 -2.333 1.00 0.00 N ATOM 95 CA VAL A 546 -4.428 -2.834 -3.012 1.00 0.00 C ATOM 96 C VAL A 546 -4.697 -2.894 -4.511 1.00 0.00 C ATOM 97 O VAL A 546 -4.515 -3.934 -5.144 1.00 0.00 O ATOM 98 CB VAL A 546 -2.911 -2.695 -2.778 1.00 0.00 C ATOM 99 CG1 VAL A 546 -2.318 -1.646 -3.706 1.00 0.00 C ATOM 100 CG2 VAL A 546 -2.624 -2.355 -1.324 1.00 0.00 C ATOM 0 H VAL A 546 -4.711 -4.895 -2.758 1.00 0.00 H new ATOM 0 HA VAL A 546 -4.934 -1.965 -2.591 1.00 0.00 H new ATOM 0 HB VAL A 546 -2.440 -3.652 -3.004 1.00 0.00 H new ATOM 0 HG11 VAL A 546 -1.246 -1.564 -3.524 1.00 0.00 H new ATOM 0 HG12 VAL A 546 -2.489 -1.938 -4.742 1.00 0.00 H new ATOM 0 HG13 VAL A 546 -2.793 -0.683 -3.517 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -1.548 -2.261 -1.178 1.00 0.00 H new ATOM 0 HG22 VAL A 546 -3.109 -1.413 -1.068 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -3.009 -3.147 -0.682 1.00 0.00 H new ATOM 110 N SER A 547 -5.125 -1.770 -5.073 1.00 0.00 N ATOM 111 CA SER A 547 -5.415 -1.690 -6.498 1.00 0.00 C ATOM 112 C SER A 547 -4.457 -0.719 -7.182 1.00 0.00 C ATOM 113 O SER A 547 -4.516 0.489 -6.953 1.00 0.00 O ATOM 114 CB SER A 547 -6.860 -1.242 -6.723 1.00 0.00 C ATOM 115 OG SER A 547 -6.996 0.157 -6.540 1.00 0.00 O ATOM 0 H SER A 547 -5.279 -0.901 -4.562 1.00 0.00 H new ATOM 0 HA SER A 547 -5.281 -2.681 -6.932 1.00 0.00 H new ATOM 0 HB2 SER A 547 -7.175 -1.512 -7.731 1.00 0.00 H new ATOM 0 HB3 SER A 547 -7.519 -1.768 -6.032 1.00 0.00 H new ATOM 0 HG SER A 547 -6.209 0.613 -6.906 1.00 0.00 H new ATOM 121 N LEU A 548 -3.570 -1.254 -8.014 1.00 0.00 N ATOM 122 CA LEU A 548 -2.595 -0.431 -8.718 1.00 0.00 C ATOM 123 C LEU A 548 -3.121 0.015 -10.079 1.00 0.00 C ATOM 124 O LEU A 548 -4.095 -0.535 -10.592 1.00 0.00 O ATOM 125 CB LEU A 548 -1.283 -1.195 -8.890 1.00 0.00 C ATOM 126 CG LEU A 548 -0.462 -1.366 -7.610 1.00 0.00 C ATOM 127 CD1 LEU A 548 0.937 -1.856 -7.939 1.00 0.00 C ATOM 128 CD2 LEU A 548 -0.402 -0.059 -6.834 1.00 0.00 C ATOM 0 H LEU A 548 -3.506 -2.252 -8.217 1.00 0.00 H new ATOM 0 HA LEU A 548 -2.416 0.460 -8.116 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -1.505 -2.182 -9.296 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -0.672 -0.677 -9.629 1.00 0.00 H new ATOM 0 HG LEU A 548 -0.951 -2.113 -6.984 1.00 0.00 H new ATOM 0 HD11 LEU A 548 1.508 -1.972 -7.018 1.00 0.00 H new ATOM 0 HD12 LEU A 548 0.875 -2.816 -8.451 1.00 0.00 H new ATOM 0 HD13 LEU A 548 1.434 -1.132 -8.585 1.00 0.00 H new ATOM 0 HD21 LEU A 548 0.186 -0.201 -5.927 1.00 0.00 H new ATOM 0 HD22 LEU A 548 0.063 0.710 -7.451 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -1.412 0.252 -6.567 1.00 0.00 H new ATOM 140 N MET A 549 -2.463 1.018 -10.653 1.00 0.00 N ATOM 141 CA MET A 549 -2.848 1.560 -11.954 1.00 0.00 C ATOM 142 C MET A 549 -1.983 2.768 -12.293 1.00 0.00 C ATOM 143 O MET A 549 -1.716 3.604 -11.431 1.00 0.00 O ATOM 144 CB MET A 549 -4.325 1.963 -11.944 1.00 0.00 C ATOM 145 CG MET A 549 -4.944 2.047 -13.329 1.00 0.00 C ATOM 146 SD MET A 549 -4.748 3.676 -14.078 1.00 0.00 S ATOM 147 CE MET A 549 -6.454 4.088 -14.439 1.00 0.00 C ATOM 0 H MET A 549 -1.654 1.476 -10.234 1.00 0.00 H new ATOM 0 HA MET A 549 -2.698 0.791 -12.712 1.00 0.00 H new ATOM 0 HB2 MET A 549 -4.885 1.242 -11.348 1.00 0.00 H new ATOM 0 HB3 MET A 549 -4.425 2.930 -11.451 1.00 0.00 H new ATOM 0 HG2 MET A 549 -4.486 1.297 -13.974 1.00 0.00 H new ATOM 0 HG3 MET A 549 -6.005 1.806 -13.264 1.00 0.00 H new ATOM 0 HE1 MET A 549 -6.514 4.564 -15.418 1.00 0.00 H new ATOM 0 HE2 MET A 549 -7.055 3.179 -14.440 1.00 0.00 H new ATOM 0 HE3 MET A 549 -6.832 4.772 -13.679 1.00 0.00 H new ATOM 157 N TYR A 550 -1.545 2.867 -13.546 1.00 0.00 N ATOM 158 CA TYR A 550 -0.710 3.988 -13.961 1.00 0.00 C ATOM 159 C TYR A 550 -1.393 4.813 -15.044 1.00 0.00 C ATOM 160 O TYR A 550 -1.887 4.274 -16.034 1.00 0.00 O ATOM 161 CB TYR A 550 0.652 3.501 -14.462 1.00 0.00 C ATOM 162 CG TYR A 550 1.649 4.620 -14.660 1.00 0.00 C ATOM 163 CD1 TYR A 550 2.472 5.037 -13.621 1.00 0.00 C ATOM 164 CD2 TYR A 550 1.764 5.263 -15.886 1.00 0.00 C ATOM 165 CE1 TYR A 550 3.382 6.064 -13.798 1.00 0.00 C ATOM 166 CE2 TYR A 550 2.669 6.290 -16.071 1.00 0.00 C ATOM 167 CZ TYR A 550 3.476 6.687 -15.025 1.00 0.00 C ATOM 168 OH TYR A 550 4.378 7.709 -15.205 1.00 0.00 O ATOM 0 H TYR A 550 -1.752 2.193 -14.283 1.00 0.00 H new ATOM 0 HA TYR A 550 -0.558 4.621 -13.087 1.00 0.00 H new ATOM 0 HB2 TYR A 550 1.058 2.783 -13.750 1.00 0.00 H new ATOM 0 HB3 TYR A 550 0.517 2.972 -15.406 1.00 0.00 H new ATOM 0 HD1 TYR A 550 2.400 4.551 -12.659 1.00 0.00 H new ATOM 0 HD2 TYR A 550 1.135 4.955 -16.708 1.00 0.00 H new ATOM 0 HE1 TYR A 550 4.015 6.376 -12.980 1.00 0.00 H new ATOM 0 HE2 TYR A 550 2.744 6.780 -17.030 1.00 0.00 H new ATOM 0 HH TYR A 550 4.611 8.096 -14.336 1.00 0.00 H new ATOM 178 N SER A 551 -1.415 6.125 -14.845 1.00 0.00 N ATOM 179 CA SER A 551 -2.033 7.035 -15.799 1.00 0.00 C ATOM 180 C SER A 551 -0.975 7.751 -16.633 1.00 0.00 C ATOM 181 O SER A 551 -0.603 8.886 -16.338 1.00 0.00 O ATOM 182 CB SER A 551 -2.903 8.060 -15.070 1.00 0.00 C ATOM 183 OG SER A 551 -4.118 8.284 -15.764 1.00 0.00 O ATOM 0 H SER A 551 -1.010 6.583 -14.028 1.00 0.00 H new ATOM 0 HA SER A 551 -2.661 6.447 -16.468 1.00 0.00 H new ATOM 0 HB2 SER A 551 -3.117 7.708 -14.061 1.00 0.00 H new ATOM 0 HB3 SER A 551 -2.359 8.999 -14.971 1.00 0.00 H new ATOM 0 HG SER A 551 -4.873 8.048 -15.186 1.00 0.00 H new ATOM 189 N THR A 552 -0.498 7.083 -17.680 1.00 0.00 N ATOM 190 CA THR A 552 0.512 7.667 -18.557 1.00 0.00 C ATOM 191 C THR A 552 0.076 9.054 -18.993 1.00 0.00 C ATOM 192 O THR A 552 0.896 9.954 -19.178 1.00 0.00 O ATOM 193 CB THR A 552 0.744 6.784 -19.785 1.00 0.00 C ATOM 194 OG1 THR A 552 -0.109 7.172 -20.847 1.00 0.00 O ATOM 195 CG2 THR A 552 0.510 5.315 -19.521 1.00 0.00 C ATOM 0 H THR A 552 -0.793 6.142 -17.941 1.00 0.00 H new ATOM 0 HA THR A 552 1.448 7.739 -18.004 1.00 0.00 H new ATOM 0 HB THR A 552 1.793 6.924 -20.047 1.00 0.00 H new ATOM 0 HG1 THR A 552 0.054 6.598 -21.624 1.00 0.00 H new ATOM 0 HG21 THR A 552 0.692 4.748 -20.434 1.00 0.00 H new ATOM 0 HG22 THR A 552 1.189 4.973 -18.740 1.00 0.00 H new ATOM 0 HG23 THR A 552 -0.520 5.163 -19.199 1.00 0.00 H new ATOM 203 N GLN A 553 -1.231 9.219 -19.141 1.00 0.00 N ATOM 204 CA GLN A 553 -1.803 10.497 -19.538 1.00 0.00 C ATOM 205 C GLN A 553 -1.368 11.578 -18.562 1.00 0.00 C ATOM 206 O GLN A 553 -0.902 12.646 -18.960 1.00 0.00 O ATOM 207 CB GLN A 553 -3.329 10.406 -19.577 1.00 0.00 C ATOM 208 CG GLN A 553 -3.880 9.947 -20.919 1.00 0.00 C ATOM 209 CD GLN A 553 -3.416 8.553 -21.299 1.00 0.00 C ATOM 210 OE1 GLN A 553 -3.143 8.275 -22.466 1.00 0.00 O ATOM 211 NE2 GLN A 553 -3.324 7.669 -20.312 1.00 0.00 N ATOM 0 H GLN A 553 -1.918 8.480 -18.991 1.00 0.00 H new ATOM 0 HA GLN A 553 -1.445 10.751 -20.536 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -3.663 9.716 -18.802 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -3.749 11.383 -19.337 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -4.969 9.966 -20.885 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -3.573 10.651 -21.693 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -3.561 7.943 -19.358 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -3.017 6.716 -20.508 1.00 0.00 H new ATOM 220 N GLN A 554 -1.507 11.278 -17.276 1.00 0.00 N ATOM 221 CA GLN A 554 -1.111 12.204 -16.226 1.00 0.00 C ATOM 222 C GLN A 554 0.382 12.074 -15.955 1.00 0.00 C ATOM 223 O GLN A 554 0.993 12.946 -15.338 1.00 0.00 O ATOM 224 CB GLN A 554 -1.904 11.932 -14.947 1.00 0.00 C ATOM 225 CG GLN A 554 -3.369 11.613 -15.193 1.00 0.00 C ATOM 226 CD GLN A 554 -4.035 10.965 -13.994 1.00 0.00 C ATOM 227 OE1 GLN A 554 -3.445 10.872 -12.918 1.00 0.00 O ATOM 228 NE2 GLN A 554 -5.270 10.513 -14.175 1.00 0.00 N ATOM 0 H GLN A 554 -1.893 10.397 -16.936 1.00 0.00 H new ATOM 0 HA GLN A 554 -1.325 13.220 -16.557 1.00 0.00 H new ATOM 0 HB2 GLN A 554 -1.444 11.099 -14.415 1.00 0.00 H new ATOM 0 HB3 GLN A 554 -1.835 12.803 -14.295 1.00 0.00 H new ATOM 0 HG2 GLN A 554 -3.899 12.531 -15.446 1.00 0.00 H new ATOM 0 HG3 GLN A 554 -3.453 10.949 -16.053 1.00 0.00 H new ATOM 0 HE21 GLN A 554 -5.721 10.611 -15.085 1.00 0.00 H new ATOM 0 HE22 GLN A 554 -5.768 10.067 -13.404 1.00 0.00 H new ATOM 237 N GLY A 555 0.963 10.975 -16.430 1.00 0.00 N ATOM 238 CA GLY A 555 2.383 10.742 -16.238 1.00 0.00 C ATOM 239 C GLY A 555 2.726 10.379 -14.807 1.00 0.00 C ATOM 240 O GLY A 555 3.738 10.832 -14.271 1.00 0.00 O ATOM 0 H GLY A 555 0.475 10.242 -16.944 1.00 0.00 H new ATOM 0 HA2 GLY A 555 2.709 9.940 -16.900 1.00 0.00 H new ATOM 0 HA3 GLY A 555 2.936 11.636 -16.525 1.00 0.00 H new ATOM 244 N GLY A 556 1.885 9.559 -14.187 1.00 0.00 N ATOM 245 CA GLY A 556 2.127 9.152 -12.815 1.00 0.00 C ATOM 246 C GLY A 556 1.484 7.821 -12.480 1.00 0.00 C ATOM 247 O GLY A 556 0.647 7.322 -13.231 1.00 0.00 O ATOM 0 H GLY A 556 1.042 9.169 -14.608 1.00 0.00 H new ATOM 0 HA2 GLY A 556 3.201 9.086 -12.644 1.00 0.00 H new ATOM 0 HA3 GLY A 556 1.743 9.917 -12.140 1.00 0.00 H new ATOM 251 N LEU A 557 1.876 7.248 -11.347 1.00 0.00 N ATOM 252 CA LEU A 557 1.331 5.967 -10.912 1.00 0.00 C ATOM 253 C LEU A 557 0.133 6.177 -9.993 1.00 0.00 C ATOM 254 O LEU A 557 -0.033 7.248 -9.410 1.00 0.00 O ATOM 255 CB LEU A 557 2.409 5.151 -10.195 1.00 0.00 C ATOM 256 CG LEU A 557 1.892 3.985 -9.351 1.00 0.00 C ATOM 257 CD1 LEU A 557 1.493 2.819 -10.241 1.00 0.00 C ATOM 258 CD2 LEU A 557 2.946 3.553 -8.342 1.00 0.00 C ATOM 0 H LEU A 557 2.568 7.650 -10.714 1.00 0.00 H new ATOM 0 HA LEU A 557 0.998 5.417 -11.792 1.00 0.00 H new ATOM 0 HB2 LEU A 557 3.101 4.760 -10.940 1.00 0.00 H new ATOM 0 HB3 LEU A 557 2.979 5.820 -9.550 1.00 0.00 H new ATOM 0 HG LEU A 557 1.009 4.317 -8.806 1.00 0.00 H new ATOM 0 HD11 LEU A 557 1.128 1.998 -9.624 1.00 0.00 H new ATOM 0 HD12 LEU A 557 0.706 3.136 -10.925 1.00 0.00 H new ATOM 0 HD13 LEU A 557 2.359 2.485 -10.813 1.00 0.00 H new ATOM 0 HD21 LEU A 557 2.563 2.722 -7.749 1.00 0.00 H new ATOM 0 HD22 LEU A 557 3.847 3.238 -8.869 1.00 0.00 H new ATOM 0 HD23 LEU A 557 3.184 4.389 -7.684 1.00 0.00 H new ATOM 270 N ILE A 558 -0.701 5.152 -9.870 1.00 0.00 N ATOM 271 CA ILE A 558 -1.882 5.234 -9.020 1.00 0.00 C ATOM 272 C ILE A 558 -1.943 4.063 -8.049 1.00 0.00 C ATOM 273 O ILE A 558 -1.924 2.901 -8.455 1.00 0.00 O ATOM 274 CB ILE A 558 -3.178 5.265 -9.853 1.00 0.00 C ATOM 275 CG1 ILE A 558 -2.956 6.017 -11.168 1.00 0.00 C ATOM 276 CG2 ILE A 558 -4.299 5.910 -9.052 1.00 0.00 C ATOM 277 CD1 ILE A 558 -3.104 7.516 -11.039 1.00 0.00 C ATOM 0 H ILE A 558 -0.582 4.258 -10.346 1.00 0.00 H new ATOM 0 HA ILE A 558 -1.800 6.165 -8.458 1.00 0.00 H new ATOM 0 HB ILE A 558 -3.463 4.240 -10.091 1.00 0.00 H new ATOM 0 HG12 ILE A 558 -1.958 5.790 -11.543 1.00 0.00 H new ATOM 0 HG13 ILE A 558 -3.666 5.652 -11.910 1.00 0.00 H new ATOM 0 HG21 ILE A 558 -5.210 5.927 -9.650 1.00 0.00 H new ATOM 0 HG22 ILE A 558 -4.473 5.336 -8.142 1.00 0.00 H new ATOM 0 HG23 ILE A 558 -4.018 6.930 -8.790 1.00 0.00 H new ATOM 0 HD11 ILE A 558 -2.933 7.983 -12.009 1.00 0.00 H new ATOM 0 HD12 ILE A 558 -4.110 7.754 -10.694 1.00 0.00 H new ATOM 0 HD13 ILE A 558 -2.375 7.893 -10.321 1.00 0.00 H new ATOM 289 N VAL A 559 -2.017 4.379 -6.762 1.00 0.00 N ATOM 290 CA VAL A 559 -2.082 3.358 -5.721 1.00 0.00 C ATOM 291 C VAL A 559 -3.438 3.385 -5.030 1.00 0.00 C ATOM 292 O VAL A 559 -3.827 4.396 -4.450 1.00 0.00 O ATOM 293 CB VAL A 559 -0.973 3.562 -4.675 1.00 0.00 C ATOM 294 CG1 VAL A 559 -0.808 2.325 -3.813 1.00 0.00 C ATOM 295 CG2 VAL A 559 0.337 3.920 -5.356 1.00 0.00 C ATOM 0 H VAL A 559 -2.034 5.337 -6.412 1.00 0.00 H new ATOM 0 HA VAL A 559 -1.939 2.390 -6.200 1.00 0.00 H new ATOM 0 HB VAL A 559 -1.263 4.388 -4.026 1.00 0.00 H new ATOM 0 HG11 VAL A 559 -0.018 2.494 -3.081 1.00 0.00 H new ATOM 0 HG12 VAL A 559 -1.744 2.115 -3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 559 -0.543 1.475 -4.443 1.00 0.00 H new ATOM 0 HG21 VAL A 559 1.112 4.061 -4.603 1.00 0.00 H new ATOM 0 HG22 VAL A 559 0.629 3.115 -6.030 1.00 0.00 H new ATOM 0 HG23 VAL A 559 0.212 4.841 -5.925 1.00 0.00 H new ATOM 305 N GLY A 560 -4.163 2.276 -5.106 1.00 0.00 N ATOM 306 CA GLY A 560 -5.477 2.213 -4.495 1.00 0.00 C ATOM 307 C GLY A 560 -5.537 1.314 -3.277 1.00 0.00 C ATOM 308 O GLY A 560 -5.244 0.121 -3.359 1.00 0.00 O ATOM 0 H GLY A 560 -3.866 1.422 -5.578 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -5.784 3.219 -4.209 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -6.195 1.858 -5.234 1.00 0.00 H new ATOM 312 N ILE A 561 -5.942 1.889 -2.150 1.00 0.00 N ATOM 313 CA ILE A 561 -6.070 1.141 -0.906 1.00 0.00 C ATOM 314 C ILE A 561 -7.537 0.827 -0.637 1.00 0.00 C ATOM 315 O ILE A 561 -8.279 1.671 -0.135 1.00 0.00 O ATOM 316 CB ILE A 561 -5.494 1.927 0.289 1.00 0.00 C ATOM 317 CG1 ILE A 561 -4.064 2.380 -0.011 1.00 0.00 C ATOM 318 CG2 ILE A 561 -5.536 1.081 1.551 1.00 0.00 C ATOM 319 CD1 ILE A 561 -3.152 1.255 -0.451 1.00 0.00 C ATOM 0 H ILE A 561 -6.188 2.876 -2.073 1.00 0.00 H new ATOM 0 HA ILE A 561 -5.503 0.217 -1.017 1.00 0.00 H new ATOM 0 HB ILE A 561 -6.108 2.813 0.451 1.00 0.00 H new ATOM 0 HG12 ILE A 561 -4.089 3.142 -0.790 1.00 0.00 H new ATOM 0 HG13 ILE A 561 -3.646 2.848 0.880 1.00 0.00 H new ATOM 0 HG21 ILE A 561 -5.126 1.651 2.385 1.00 0.00 H new ATOM 0 HG22 ILE A 561 -6.568 0.807 1.771 1.00 0.00 H new ATOM 0 HG23 ILE A 561 -4.945 0.177 1.403 1.00 0.00 H new ATOM 0 HD11 ILE A 561 -2.155 1.650 -0.646 1.00 0.00 H new ATOM 0 HD12 ILE A 561 -3.097 0.503 0.336 1.00 0.00 H new ATOM 0 HD13 ILE A 561 -3.547 0.801 -1.360 1.00 0.00 H new ATOM 331 N ILE A 562 -7.956 -0.380 -0.995 1.00 0.00 N ATOM 332 CA ILE A 562 -9.343 -0.787 -0.814 1.00 0.00 C ATOM 333 C ILE A 562 -9.676 -1.066 0.647 1.00 0.00 C ATOM 334 O ILE A 562 -10.352 -0.268 1.296 1.00 0.00 O ATOM 335 CB ILE A 562 -9.680 -2.033 -1.655 1.00 0.00 C ATOM 336 CG1 ILE A 562 -9.158 -1.869 -3.083 1.00 0.00 C ATOM 337 CG2 ILE A 562 -11.182 -2.278 -1.659 1.00 0.00 C ATOM 338 CD1 ILE A 562 -7.885 -2.639 -3.354 1.00 0.00 C ATOM 0 H ILE A 562 -7.357 -1.093 -1.411 1.00 0.00 H new ATOM 0 HA ILE A 562 -9.950 0.052 -1.154 1.00 0.00 H new ATOM 0 HB ILE A 562 -9.191 -2.898 -1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 562 -9.927 -2.197 -3.782 1.00 0.00 H new ATOM 0 HG13 ILE A 562 -8.981 -0.811 -3.277 1.00 0.00 H new ATOM 0 HG21 ILE A 562 -11.405 -3.162 -2.257 1.00 0.00 H new ATOM 0 HG22 ILE A 562 -11.528 -2.435 -0.637 1.00 0.00 H new ATOM 0 HG23 ILE A 562 -11.691 -1.413 -2.085 1.00 0.00 H new ATOM 0 HD11 ILE A 562 -7.574 -2.476 -4.386 1.00 0.00 H new ATOM 0 HD12 ILE A 562 -7.101 -2.295 -2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 562 -8.062 -3.702 -3.192 1.00 0.00 H new ATOM 350 N ARG A 563 -9.220 -2.204 1.160 1.00 0.00 N ATOM 351 CA ARG A 563 -9.505 -2.566 2.543 1.00 0.00 C ATOM 352 C ARG A 563 -8.520 -3.602 3.075 1.00 0.00 C ATOM 353 O ARG A 563 -7.709 -4.153 2.332 1.00 0.00 O ATOM 354 CB ARG A 563 -10.933 -3.110 2.652 1.00 0.00 C ATOM 355 CG ARG A 563 -11.039 -4.607 2.399 1.00 0.00 C ATOM 356 CD ARG A 563 -12.368 -4.975 1.759 1.00 0.00 C ATOM 357 NE ARG A 563 -13.427 -4.034 2.107 1.00 0.00 N ATOM 358 CZ ARG A 563 -14.609 -3.998 1.500 1.00 0.00 C ATOM 359 NH1 ARG A 563 -14.876 -4.844 0.515 1.00 0.00 N ATOM 360 NH2 ARG A 563 -15.525 -3.117 1.877 1.00 0.00 N ATOM 0 H ARG A 563 -8.659 -2.883 0.646 1.00 0.00 H new ATOM 0 HA ARG A 563 -9.401 -1.666 3.149 1.00 0.00 H new ATOM 0 HB2 ARG A 563 -11.321 -2.890 3.647 1.00 0.00 H new ATOM 0 HB3 ARG A 563 -11.568 -2.584 1.939 1.00 0.00 H new ATOM 0 HG2 ARG A 563 -10.222 -4.926 1.751 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -10.927 -5.144 3.341 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -12.252 -5.004 0.676 1.00 0.00 H new ATOM 0 HD3 ARG A 563 -12.657 -5.977 2.076 1.00 0.00 H new ATOM 0 HE ARG A 563 -13.251 -3.367 2.858 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -14.174 -5.524 0.222 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -15.783 -4.815 0.050 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -15.324 -2.464 2.635 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -16.431 -3.092 1.409 1.00 0.00 H new ATOM 374 N CYS A 564 -8.616 -3.867 4.375 1.00 0.00 N ATOM 375 CA CYS A 564 -7.761 -4.842 5.035 1.00 0.00 C ATOM 376 C CYS A 564 -8.609 -5.826 5.831 1.00 0.00 C ATOM 377 O CYS A 564 -9.762 -5.540 6.153 1.00 0.00 O ATOM 378 CB CYS A 564 -6.766 -4.142 5.959 1.00 0.00 C ATOM 379 SG CYS A 564 -7.486 -2.803 6.939 1.00 0.00 S ATOM 0 H CYS A 564 -9.286 -3.413 4.996 1.00 0.00 H new ATOM 0 HA CYS A 564 -7.204 -5.387 4.273 1.00 0.00 H new ATOM 0 HB2 CYS A 564 -6.332 -4.880 6.634 1.00 0.00 H new ATOM 0 HB3 CYS A 564 -5.950 -3.740 5.359 1.00 0.00 H new ATOM 0 HG CYS A 564 -7.170 -1.659 6.409 1.00 0.00 H new ATOM 385 N VAL A 565 -8.046 -6.989 6.138 1.00 0.00 N ATOM 386 CA VAL A 565 -8.780 -8.001 6.887 1.00 0.00 C ATOM 387 C VAL A 565 -7.895 -8.740 7.883 1.00 0.00 C ATOM 388 O VAL A 565 -6.715 -8.982 7.630 1.00 0.00 O ATOM 389 CB VAL A 565 -9.433 -9.022 5.941 1.00 0.00 C ATOM 390 CG1 VAL A 565 -10.420 -8.328 5.020 1.00 0.00 C ATOM 391 CG2 VAL A 565 -8.374 -9.764 5.140 1.00 0.00 C ATOM 0 H VAL A 565 -7.094 -7.253 5.883 1.00 0.00 H new ATOM 0 HA VAL A 565 -9.552 -7.469 7.443 1.00 0.00 H new ATOM 0 HB VAL A 565 -9.976 -9.753 6.539 1.00 0.00 H new ATOM 0 HG11 VAL A 565 -10.875 -9.062 4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 565 -11.196 -7.846 5.615 1.00 0.00 H new ATOM 0 HG13 VAL A 565 -9.898 -7.576 4.428 1.00 0.00 H new ATOM 0 HG21 VAL A 565 -8.856 -10.482 4.477 1.00 0.00 H new ATOM 0 HG22 VAL A 565 -7.800 -9.051 4.548 1.00 0.00 H new ATOM 0 HG23 VAL A 565 -7.706 -10.291 5.821 1.00 0.00 H new ATOM 401 N HIS A 566 -8.487 -9.102 9.016 1.00 0.00 N ATOM 402 CA HIS A 566 -7.779 -9.826 10.068 1.00 0.00 C ATOM 403 C HIS A 566 -6.556 -9.051 10.548 1.00 0.00 C ATOM 404 O HIS A 566 -5.437 -9.562 10.524 1.00 0.00 O ATOM 405 CB HIS A 566 -7.356 -11.209 9.570 1.00 0.00 C ATOM 406 CG HIS A 566 -7.866 -12.332 10.419 1.00 0.00 C ATOM 407 ND1 HIS A 566 -8.312 -12.156 11.712 1.00 0.00 N ATOM 408 CD2 HIS A 566 -8.000 -13.653 10.154 1.00 0.00 C ATOM 409 CE1 HIS A 566 -8.698 -13.319 12.205 1.00 0.00 C ATOM 410 NE2 HIS A 566 -8.520 -14.243 11.279 1.00 0.00 N ATOM 0 H HIS A 566 -9.464 -8.904 9.231 1.00 0.00 H new ATOM 0 HA HIS A 566 -8.462 -9.941 10.910 1.00 0.00 H new ATOM 0 HB2 HIS A 566 -7.714 -11.344 8.549 1.00 0.00 H new ATOM 0 HB3 HIS A 566 -6.268 -11.256 9.535 1.00 0.00 H new ATOM 0 HD2 HIS A 566 -7.745 -14.150 9.230 1.00 0.00 H new ATOM 0 HE1 HIS A 566 -9.092 -13.486 13.197 1.00 0.00 H new ATOM 0 HE2 HIS A 566 -8.734 -15.235 11.383 1.00 0.00 H new ATOM 419 N LEU A 567 -6.777 -7.817 10.989 1.00 0.00 N ATOM 420 CA LEU A 567 -5.691 -6.976 11.478 1.00 0.00 C ATOM 421 C LEU A 567 -5.467 -7.186 12.971 1.00 0.00 C ATOM 422 O LEU A 567 -6.396 -7.517 13.708 1.00 0.00 O ATOM 423 CB LEU A 567 -5.998 -5.504 11.206 1.00 0.00 C ATOM 424 CG LEU A 567 -6.101 -5.125 9.730 1.00 0.00 C ATOM 425 CD1 LEU A 567 -6.229 -3.617 9.582 1.00 0.00 C ATOM 426 CD2 LEU A 567 -4.894 -5.643 8.962 1.00 0.00 C ATOM 0 H LEU A 567 -7.697 -7.378 11.018 1.00 0.00 H new ATOM 0 HA LEU A 567 -4.782 -7.259 10.948 1.00 0.00 H new ATOM 0 HB2 LEU A 567 -6.937 -5.248 11.697 1.00 0.00 H new ATOM 0 HB3 LEU A 567 -5.220 -4.895 11.668 1.00 0.00 H new ATOM 0 HG LEU A 567 -6.994 -5.589 9.311 1.00 0.00 H new ATOM 0 HD11 LEU A 567 -6.302 -3.360 8.525 1.00 0.00 H new ATOM 0 HD12 LEU A 567 -7.125 -3.275 10.101 1.00 0.00 H new ATOM 0 HD13 LEU A 567 -5.353 -3.133 10.014 1.00 0.00 H new ATOM 0 HD21 LEU A 567 -4.984 -5.364 7.912 1.00 0.00 H new ATOM 0 HD22 LEU A 567 -3.985 -5.208 9.377 1.00 0.00 H new ATOM 0 HD23 LEU A 567 -4.848 -6.729 9.046 1.00 0.00 H new ATOM 438 N ALA A 568 -4.230 -6.986 13.413 1.00 0.00 N ATOM 439 CA ALA A 568 -3.888 -7.148 14.821 1.00 0.00 C ATOM 440 C ALA A 568 -4.521 -6.047 15.667 1.00 0.00 C ATOM 441 O ALA A 568 -4.816 -4.960 15.169 1.00 0.00 O ATOM 442 CB ALA A 568 -2.378 -7.154 15.003 1.00 0.00 C ATOM 0 H ALA A 568 -3.449 -6.712 12.817 1.00 0.00 H new ATOM 0 HA ALA A 568 -4.285 -8.106 15.158 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -2.139 -7.276 16.060 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -1.946 -7.979 14.436 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -1.964 -6.212 14.644 1.00 0.00 H new ATOM 448 N ALA A 569 -4.728 -6.337 16.947 1.00 0.00 N ATOM 449 CA ALA A 569 -5.328 -5.373 17.864 1.00 0.00 C ATOM 450 C ALA A 569 -4.300 -4.855 18.864 1.00 0.00 C ATOM 451 O ALA A 569 -3.747 -5.621 19.653 1.00 0.00 O ATOM 452 CB ALA A 569 -6.500 -6.009 18.595 1.00 0.00 C ATOM 0 H ALA A 569 -4.489 -7.232 17.374 1.00 0.00 H new ATOM 0 HA ALA A 569 -5.689 -4.525 17.281 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -6.941 -5.282 19.277 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -7.250 -6.329 17.871 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -6.150 -6.872 19.161 1.00 0.00 H new ATOM 458 N MET A 570 -4.051 -3.551 18.828 1.00 0.00 N ATOM 459 CA MET A 570 -3.092 -2.931 19.733 1.00 0.00 C ATOM 460 C MET A 570 -3.755 -2.567 21.058 1.00 0.00 C ATOM 461 O MET A 570 -3.082 -2.398 22.076 1.00 0.00 O ATOM 462 CB MET A 570 -2.487 -1.679 19.095 1.00 0.00 C ATOM 463 CG MET A 570 -1.592 -1.975 17.903 1.00 0.00 C ATOM 464 SD MET A 570 -0.520 -3.399 18.172 1.00 0.00 S ATOM 465 CE MET A 570 -0.676 -4.234 16.597 1.00 0.00 C ATOM 0 H MET A 570 -4.500 -2.903 18.181 1.00 0.00 H new ATOM 0 HA MET A 570 -2.297 -3.651 19.926 1.00 0.00 H new ATOM 0 HB2 MET A 570 -3.293 -1.017 18.778 1.00 0.00 H new ATOM 0 HB3 MET A 570 -1.910 -1.141 19.847 1.00 0.00 H new ATOM 0 HG2 MET A 570 -2.212 -2.153 17.024 1.00 0.00 H new ATOM 0 HG3 MET A 570 -0.979 -1.100 17.688 1.00 0.00 H new ATOM 0 HE1 MET A 570 -0.298 -5.252 16.686 1.00 0.00 H new ATOM 0 HE2 MET A 570 -1.725 -4.261 16.302 1.00 0.00 H new ATOM 0 HE3 MET A 570 -0.100 -3.698 15.842 1.00 0.00 H new ATOM 475 N ASP A 571 -5.078 -2.447 21.038 1.00 0.00 N ATOM 476 CA ASP A 571 -5.832 -2.100 22.237 1.00 0.00 C ATOM 477 C ASP A 571 -6.221 -3.351 23.016 1.00 0.00 C ATOM 478 O ASP A 571 -6.185 -4.462 22.487 1.00 0.00 O ATOM 479 CB ASP A 571 -7.087 -1.308 21.864 1.00 0.00 C ATOM 480 CG ASP A 571 -6.771 -0.080 21.034 1.00 0.00 C ATOM 481 OD1 ASP A 571 -6.499 -0.234 19.825 1.00 0.00 O ATOM 482 OD2 ASP A 571 -6.795 1.037 21.593 1.00 0.00 O ATOM 0 H ASP A 571 -5.650 -2.585 20.205 1.00 0.00 H new ATOM 0 HA ASP A 571 -5.195 -1.483 22.870 1.00 0.00 H new ATOM 0 HB2 ASP A 571 -7.768 -1.953 21.309 1.00 0.00 H new ATOM 0 HB3 ASP A 571 -7.605 -1.005 22.774 1.00 0.00 H new ATOM 487 N ALA A 572 -6.592 -3.163 24.279 1.00 0.00 N ATOM 488 CA ALA A 572 -6.988 -4.276 25.132 1.00 0.00 C ATOM 489 C ALA A 572 -8.404 -4.743 24.807 1.00 0.00 C ATOM 490 O ALA A 572 -8.881 -5.737 25.356 1.00 0.00 O ATOM 491 CB ALA A 572 -6.885 -3.880 26.596 1.00 0.00 C ATOM 0 H ALA A 572 -6.626 -2.250 24.733 1.00 0.00 H new ATOM 0 HA ALA A 572 -6.308 -5.106 24.942 1.00 0.00 H new ATOM 0 HB1 ALA A 572 -7.184 -4.721 27.222 1.00 0.00 H new ATOM 0 HB2 ALA A 572 -5.856 -3.603 26.827 1.00 0.00 H new ATOM 0 HB3 ALA A 572 -7.541 -3.032 26.790 1.00 0.00 H new ATOM 497 N ASN A 573 -9.071 -4.022 23.911 1.00 0.00 N ATOM 498 CA ASN A 573 -10.431 -4.367 23.514 1.00 0.00 C ATOM 499 C ASN A 573 -10.422 -5.449 22.439 1.00 0.00 C ATOM 500 O ASN A 573 -11.461 -6.024 22.115 1.00 0.00 O ATOM 501 CB ASN A 573 -11.165 -3.126 23.001 1.00 0.00 C ATOM 502 CG ASN A 573 -12.331 -2.737 23.889 1.00 0.00 C ATOM 503 OD1 ASN A 573 -13.483 -3.052 23.593 1.00 0.00 O ATOM 504 ND2 ASN A 573 -12.035 -2.048 24.985 1.00 0.00 N ATOM 0 H ASN A 573 -8.692 -3.196 23.447 1.00 0.00 H new ATOM 0 HA ASN A 573 -10.954 -4.752 24.389 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -10.465 -2.293 22.939 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -11.528 -3.313 21.990 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -12.778 -1.758 25.621 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -11.065 -1.809 25.191 1.00 0.00 H new ATOM 511 N GLY A 574 -9.242 -5.721 21.892 1.00 0.00 N ATOM 512 CA GLY A 574 -9.119 -6.735 20.862 1.00 0.00 C ATOM 513 C GLY A 574 -9.161 -6.152 19.464 1.00 0.00 C ATOM 514 O GLY A 574 -9.196 -6.890 18.478 1.00 0.00 O ATOM 0 H GLY A 574 -8.369 -5.257 22.144 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -8.182 -7.275 20.999 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -9.924 -7.461 20.974 1.00 0.00 H new ATOM 518 N TYR A 575 -9.167 -4.825 19.374 1.00 0.00 N ATOM 519 CA TYR A 575 -9.214 -4.151 18.082 1.00 0.00 C ATOM 520 C TYR A 575 -8.008 -3.242 17.875 1.00 0.00 C ATOM 521 O TYR A 575 -7.039 -3.298 18.633 1.00 0.00 O ATOM 522 CB TYR A 575 -10.500 -3.346 17.961 1.00 0.00 C ATOM 523 CG TYR A 575 -11.598 -4.108 17.271 1.00 0.00 C ATOM 524 CD1 TYR A 575 -11.897 -5.405 17.652 1.00 0.00 C ATOM 525 CD2 TYR A 575 -12.326 -3.536 16.244 1.00 0.00 C ATOM 526 CE1 TYR A 575 -12.903 -6.117 17.027 1.00 0.00 C ATOM 527 CE2 TYR A 575 -13.335 -4.237 15.610 1.00 0.00 C ATOM 528 CZ TYR A 575 -13.620 -5.527 16.005 1.00 0.00 C ATOM 529 OH TYR A 575 -14.623 -6.230 15.379 1.00 0.00 O ATOM 0 H TYR A 575 -9.140 -4.198 20.178 1.00 0.00 H new ATOM 0 HA TYR A 575 -9.189 -4.917 17.307 1.00 0.00 H new ATOM 0 HB2 TYR A 575 -10.836 -3.053 18.956 1.00 0.00 H new ATOM 0 HB3 TYR A 575 -10.299 -2.428 17.410 1.00 0.00 H new ATOM 0 HD1 TYR A 575 -11.335 -5.868 18.450 1.00 0.00 H new ATOM 0 HD2 TYR A 575 -12.103 -2.526 15.932 1.00 0.00 H new ATOM 0 HE1 TYR A 575 -13.127 -7.127 17.336 1.00 0.00 H new ATOM 0 HE2 TYR A 575 -13.897 -3.777 14.810 1.00 0.00 H new ATOM 0 HH TYR A 575 -15.029 -5.671 14.684 1.00 0.00 H new ATOM 539 N SER A 576 -8.070 -2.408 16.837 1.00 0.00 N ATOM 540 CA SER A 576 -6.973 -1.494 16.532 1.00 0.00 C ATOM 541 C SER A 576 -7.444 -0.310 15.688 1.00 0.00 C ATOM 542 O SER A 576 -8.598 -0.251 15.265 1.00 0.00 O ATOM 543 CB SER A 576 -5.860 -2.240 15.793 1.00 0.00 C ATOM 544 OG SER A 576 -4.846 -2.663 16.687 1.00 0.00 O ATOM 0 H SER A 576 -8.863 -2.347 16.198 1.00 0.00 H new ATOM 0 HA SER A 576 -6.593 -1.106 17.477 1.00 0.00 H new ATOM 0 HB2 SER A 576 -6.278 -3.105 15.278 1.00 0.00 H new ATOM 0 HB3 SER A 576 -5.429 -1.592 15.030 1.00 0.00 H new ATOM 0 HG SER A 576 -4.286 -1.897 16.932 1.00 0.00 H new ATOM 550 N ASP A 577 -6.526 0.619 15.433 1.00 0.00 N ATOM 551 CA ASP A 577 -6.814 1.801 14.621 1.00 0.00 C ATOM 552 C ASP A 577 -5.888 1.802 13.411 1.00 0.00 C ATOM 553 O ASP A 577 -5.097 2.722 13.213 1.00 0.00 O ATOM 554 CB ASP A 577 -6.610 3.077 15.445 1.00 0.00 C ATOM 555 CG ASP A 577 -7.419 3.073 16.727 1.00 0.00 C ATOM 556 OD1 ASP A 577 -8.037 2.032 17.036 1.00 0.00 O ATOM 557 OD2 ASP A 577 -7.434 4.110 17.424 1.00 0.00 O ATOM 0 H ASP A 577 -5.568 0.576 15.780 1.00 0.00 H new ATOM 0 HA ASP A 577 -7.852 1.773 14.290 1.00 0.00 H new ATOM 0 HB2 ASP A 577 -5.553 3.185 15.686 1.00 0.00 H new ATOM 0 HB3 ASP A 577 -6.890 3.943 14.845 1.00 0.00 H new ATOM 562 N PRO A 578 -5.957 0.730 12.616 1.00 0.00 N ATOM 563 CA PRO A 578 -5.101 0.538 11.439 1.00 0.00 C ATOM 564 C PRO A 578 -5.341 1.508 10.289 1.00 0.00 C ATOM 565 O PRO A 578 -6.468 1.909 9.999 1.00 0.00 O ATOM 566 CB PRO A 578 -5.427 -0.886 10.986 1.00 0.00 C ATOM 567 CG PRO A 578 -6.781 -1.166 11.537 1.00 0.00 C ATOM 568 CD PRO A 578 -6.860 -0.413 12.833 1.00 0.00 C ATOM 0 HA PRO A 578 -4.061 0.716 11.711 1.00 0.00 H new ATOM 0 HB2 PRO A 578 -5.419 -0.966 9.899 1.00 0.00 H new ATOM 0 HB3 PRO A 578 -4.693 -1.598 11.363 1.00 0.00 H new ATOM 0 HG2 PRO A 578 -7.559 -0.839 10.847 1.00 0.00 H new ATOM 0 HG3 PRO A 578 -6.925 -2.235 11.696 1.00 0.00 H new ATOM 0 HD2 PRO A 578 -7.878 -0.087 13.047 1.00 0.00 H new ATOM 0 HD3 PRO A 578 -6.538 -1.026 13.675 1.00 0.00 H new ATOM 576 N PHE A 579 -4.242 1.823 9.616 1.00 0.00 N ATOM 577 CA PHE A 579 -4.232 2.686 8.448 1.00 0.00 C ATOM 578 C PHE A 579 -3.156 2.174 7.502 1.00 0.00 C ATOM 579 O PHE A 579 -2.265 1.438 7.926 1.00 0.00 O ATOM 580 CB PHE A 579 -3.962 4.145 8.821 1.00 0.00 C ATOM 581 CG PHE A 579 -2.630 4.377 9.478 1.00 0.00 C ATOM 582 CD1 PHE A 579 -2.407 3.974 10.785 1.00 0.00 C ATOM 583 CD2 PHE A 579 -1.603 5.012 8.793 1.00 0.00 C ATOM 584 CE1 PHE A 579 -1.186 4.196 11.394 1.00 0.00 C ATOM 585 CE2 PHE A 579 -0.384 5.238 9.398 1.00 0.00 C ATOM 586 CZ PHE A 579 -0.173 4.830 10.699 1.00 0.00 C ATOM 0 H PHE A 579 -3.317 1.478 9.873 1.00 0.00 H new ATOM 0 HA PHE A 579 -5.212 2.660 7.972 1.00 0.00 H new ATOM 0 HB2 PHE A 579 -4.021 4.756 7.920 1.00 0.00 H new ATOM 0 HB3 PHE A 579 -4.750 4.489 9.491 1.00 0.00 H new ATOM 0 HD1 PHE A 579 -3.196 3.481 11.334 1.00 0.00 H new ATOM 0 HD2 PHE A 579 -1.760 5.333 7.774 1.00 0.00 H new ATOM 0 HE1 PHE A 579 -1.024 3.874 12.412 1.00 0.00 H new ATOM 0 HE2 PHE A 579 0.405 5.734 8.853 1.00 0.00 H new ATOM 0 HZ PHE A 579 0.781 5.006 11.173 1.00 0.00 H new ATOM 596 N VAL A 580 -3.230 2.532 6.232 1.00 0.00 N ATOM 597 CA VAL A 580 -2.236 2.052 5.285 1.00 0.00 C ATOM 598 C VAL A 580 -1.304 3.161 4.829 1.00 0.00 C ATOM 599 O VAL A 580 -1.739 4.255 4.472 1.00 0.00 O ATOM 600 CB VAL A 580 -2.879 1.388 4.057 1.00 0.00 C ATOM 601 CG1 VAL A 580 -1.808 0.759 3.180 1.00 0.00 C ATOM 602 CG2 VAL A 580 -3.896 0.345 4.490 1.00 0.00 C ATOM 0 H VAL A 580 -3.949 3.139 5.838 1.00 0.00 H new ATOM 0 HA VAL A 580 -1.653 1.302 5.820 1.00 0.00 H new ATOM 0 HB VAL A 580 -3.398 2.152 3.477 1.00 0.00 H new ATOM 0 HG11 VAL A 580 -2.276 0.292 2.313 1.00 0.00 H new ATOM 0 HG12 VAL A 580 -1.113 1.529 2.846 1.00 0.00 H new ATOM 0 HG13 VAL A 580 -1.267 0.005 3.751 1.00 0.00 H new ATOM 0 HG21 VAL A 580 -4.342 -0.116 3.609 1.00 0.00 H new ATOM 0 HG22 VAL A 580 -3.401 -0.420 5.088 1.00 0.00 H new ATOM 0 HG23 VAL A 580 -4.676 0.822 5.084 1.00 0.00 H new ATOM 612 N LYS A 581 -0.013 2.859 4.845 1.00 0.00 N ATOM 613 CA LYS A 581 1.003 3.813 4.436 1.00 0.00 C ATOM 614 C LYS A 581 1.767 3.282 3.233 1.00 0.00 C ATOM 615 O LYS A 581 2.207 2.133 3.220 1.00 0.00 O ATOM 616 CB LYS A 581 1.952 4.094 5.600 1.00 0.00 C ATOM 617 CG LYS A 581 1.235 4.217 6.934 1.00 0.00 C ATOM 618 CD LYS A 581 2.210 4.258 8.097 1.00 0.00 C ATOM 619 CE LYS A 581 3.012 5.549 8.109 1.00 0.00 C ATOM 620 NZ LYS A 581 4.479 5.291 8.128 1.00 0.00 N ATOM 0 H LYS A 581 0.355 1.954 5.139 1.00 0.00 H new ATOM 0 HA LYS A 581 0.521 4.748 4.149 1.00 0.00 H new ATOM 0 HB2 LYS A 581 2.689 3.293 5.662 1.00 0.00 H new ATOM 0 HB3 LYS A 581 2.499 5.016 5.401 1.00 0.00 H new ATOM 0 HG2 LYS A 581 0.627 5.122 6.938 1.00 0.00 H new ATOM 0 HG3 LYS A 581 0.554 3.375 7.060 1.00 0.00 H new ATOM 0 HD2 LYS A 581 1.663 4.160 9.035 1.00 0.00 H new ATOM 0 HD3 LYS A 581 2.889 3.408 8.034 1.00 0.00 H new ATOM 0 HE2 LYS A 581 2.759 6.142 7.230 1.00 0.00 H new ATOM 0 HE3 LYS A 581 2.736 6.140 8.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 4.991 6.196 8.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 4.725 4.747 8.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 4.747 4.749 7.282 1.00 0.00 H new ATOM 634 N LEU A 582 1.900 4.119 2.215 1.00 0.00 N ATOM 635 CA LEU A 582 2.587 3.727 0.993 1.00 0.00 C ATOM 636 C LEU A 582 3.779 4.628 0.709 1.00 0.00 C ATOM 637 O LEU A 582 3.726 5.838 0.932 1.00 0.00 O ATOM 638 CB LEU A 582 1.613 3.770 -0.179 1.00 0.00 C ATOM 639 CG LEU A 582 0.143 3.647 0.212 1.00 0.00 C ATOM 640 CD1 LEU A 582 -0.577 4.971 0.013 1.00 0.00 C ATOM 641 CD2 LEU A 582 -0.523 2.544 -0.590 1.00 0.00 C ATOM 0 H LEU A 582 1.541 5.074 2.211 1.00 0.00 H new ATOM 0 HA LEU A 582 2.960 2.712 1.125 1.00 0.00 H new ATOM 0 HB2 LEU A 582 1.755 4.707 -0.718 1.00 0.00 H new ATOM 0 HB3 LEU A 582 1.860 2.964 -0.870 1.00 0.00 H new ATOM 0 HG LEU A 582 0.084 3.387 1.269 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -1.624 4.862 0.297 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -0.110 5.736 0.633 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -0.514 5.265 -1.035 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -1.571 2.467 -0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -0.455 2.775 -1.653 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -0.021 1.597 -0.392 1.00 0.00 H new ATOM 653 N TRP A 583 4.851 4.031 0.208 1.00 0.00 N ATOM 654 CA TRP A 583 6.055 4.780 -0.117 1.00 0.00 C ATOM 655 C TRP A 583 6.792 4.154 -1.296 1.00 0.00 C ATOM 656 O TRP A 583 7.329 3.050 -1.193 1.00 0.00 O ATOM 657 CB TRP A 583 6.984 4.858 1.098 1.00 0.00 C ATOM 658 CG TRP A 583 8.399 5.206 0.746 1.00 0.00 C ATOM 659 CD1 TRP A 583 8.840 5.796 -0.403 1.00 0.00 C ATOM 660 CD2 TRP A 583 9.557 4.985 1.554 1.00 0.00 C ATOM 661 NE1 TRP A 583 10.203 5.940 -0.367 1.00 0.00 N ATOM 662 CE2 TRP A 583 10.668 5.456 0.828 1.00 0.00 C ATOM 663 CE3 TRP A 583 9.761 4.432 2.819 1.00 0.00 C ATOM 664 CZ2 TRP A 583 11.965 5.390 1.331 1.00 0.00 C ATOM 665 CZ3 TRP A 583 11.049 4.368 3.317 1.00 0.00 C ATOM 666 CH2 TRP A 583 12.137 4.845 2.575 1.00 0.00 C ATOM 0 H TRP A 583 4.911 3.031 0.018 1.00 0.00 H new ATOM 0 HA TRP A 583 5.752 5.789 -0.398 1.00 0.00 H new ATOM 0 HB2 TRP A 583 6.597 5.602 1.794 1.00 0.00 H new ATOM 0 HB3 TRP A 583 6.972 3.900 1.617 1.00 0.00 H new ATOM 0 HD1 TRP A 583 8.207 6.105 -1.222 1.00 0.00 H new ATOM 0 HE1 TRP A 583 10.777 6.342 -1.108 1.00 0.00 H new ATOM 0 HE3 TRP A 583 8.928 4.061 3.398 1.00 0.00 H new ATOM 0 HZ2 TRP A 583 12.805 5.756 0.760 1.00 0.00 H new ATOM 0 HZ3 TRP A 583 11.219 3.943 4.295 1.00 0.00 H new ATOM 0 HH2 TRP A 583 13.131 4.782 2.992 1.00 0.00 H new ATOM 677 N LEU A 584 6.832 4.878 -2.410 1.00 0.00 N ATOM 678 CA LEU A 584 7.526 4.411 -3.603 1.00 0.00 C ATOM 679 C LEU A 584 8.971 4.889 -3.579 1.00 0.00 C ATOM 680 O LEU A 584 9.243 6.032 -3.218 1.00 0.00 O ATOM 681 CB LEU A 584 6.822 4.921 -4.867 1.00 0.00 C ATOM 682 CG LEU A 584 7.330 4.330 -6.184 1.00 0.00 C ATOM 683 CD1 LEU A 584 6.692 2.973 -6.438 1.00 0.00 C ATOM 684 CD2 LEU A 584 7.047 5.280 -7.342 1.00 0.00 C ATOM 0 H LEU A 584 6.391 5.792 -2.511 1.00 0.00 H new ATOM 0 HA LEU A 584 7.510 3.321 -3.615 1.00 0.00 H new ATOM 0 HB2 LEU A 584 5.756 4.709 -4.780 1.00 0.00 H new ATOM 0 HB3 LEU A 584 6.928 6.005 -4.910 1.00 0.00 H new ATOM 0 HG LEU A 584 8.409 4.195 -6.108 1.00 0.00 H new ATOM 0 HD11 LEU A 584 7.064 2.566 -7.378 1.00 0.00 H new ATOM 0 HD12 LEU A 584 6.945 2.294 -5.624 1.00 0.00 H new ATOM 0 HD13 LEU A 584 5.609 3.085 -6.494 1.00 0.00 H new ATOM 0 HD21 LEU A 584 7.415 4.843 -8.270 1.00 0.00 H new ATOM 0 HD22 LEU A 584 5.973 5.447 -7.421 1.00 0.00 H new ATOM 0 HD23 LEU A 584 7.550 6.230 -7.164 1.00 0.00 H new ATOM 696 N LYS A 585 9.897 4.011 -3.948 1.00 0.00 N ATOM 697 CA LYS A 585 11.312 4.360 -3.951 1.00 0.00 C ATOM 698 C LYS A 585 12.031 3.703 -5.131 1.00 0.00 C ATOM 699 O LYS A 585 11.487 2.799 -5.763 1.00 0.00 O ATOM 700 CB LYS A 585 11.953 3.927 -2.635 1.00 0.00 C ATOM 701 CG LYS A 585 12.318 2.455 -2.598 1.00 0.00 C ATOM 702 CD LYS A 585 12.665 2.002 -1.190 1.00 0.00 C ATOM 703 CE LYS A 585 14.092 1.483 -1.107 1.00 0.00 C ATOM 704 NZ LYS A 585 15.004 2.217 -2.025 1.00 0.00 N ATOM 0 H LYS A 585 9.694 3.057 -4.247 1.00 0.00 H new ATOM 0 HA LYS A 585 11.404 5.441 -4.056 1.00 0.00 H new ATOM 0 HB2 LYS A 585 12.851 4.521 -2.464 1.00 0.00 H new ATOM 0 HB3 LYS A 585 11.267 4.144 -1.816 1.00 0.00 H new ATOM 0 HG2 LYS A 585 11.485 1.863 -2.977 1.00 0.00 H new ATOM 0 HG3 LYS A 585 13.165 2.273 -3.259 1.00 0.00 H new ATOM 0 HD2 LYS A 585 12.539 2.834 -0.497 1.00 0.00 H new ATOM 0 HD3 LYS A 585 11.973 1.220 -0.878 1.00 0.00 H new ATOM 0 HE2 LYS A 585 14.454 1.578 -0.083 1.00 0.00 H new ATOM 0 HE3 LYS A 585 14.107 0.421 -1.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 585 15.985 2.116 -1.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 585 14.920 1.825 -2.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 585 14.745 3.224 -2.039 1.00 0.00 H new ATOM 812 N ALA A 592 7.917 10.503 -0.067 1.00 0.00 N ATOM 813 CA ALA A 592 7.097 9.694 -0.961 1.00 0.00 C ATOM 814 C ALA A 592 6.128 8.810 -0.180 1.00 0.00 C ATOM 815 O ALA A 592 5.257 8.165 -0.763 1.00 0.00 O ATOM 816 CB ALA A 592 7.984 8.841 -1.856 1.00 0.00 C ATOM 0 HA ALA A 592 6.507 10.370 -1.581 1.00 0.00 H new ATOM 0 HB1 ALA A 592 7.361 8.241 -2.520 1.00 0.00 H new ATOM 0 HB2 ALA A 592 8.630 9.487 -2.450 1.00 0.00 H new ATOM 0 HB3 ALA A 592 8.597 8.183 -1.240 1.00 0.00 H new ATOM 822 N LYS A 593 6.289 8.779 1.139 1.00 0.00 N ATOM 823 CA LYS A 593 5.428 7.968 1.994 1.00 0.00 C ATOM 824 C LYS A 593 4.016 8.544 2.061 1.00 0.00 C ATOM 825 O LYS A 593 3.804 9.729 1.802 1.00 0.00 O ATOM 826 CB LYS A 593 6.019 7.869 3.401 1.00 0.00 C ATOM 827 CG LYS A 593 7.313 7.073 3.463 1.00 0.00 C ATOM 828 CD LYS A 593 8.216 7.562 4.582 1.00 0.00 C ATOM 829 CE LYS A 593 9.685 7.364 4.238 1.00 0.00 C ATOM 830 NZ LYS A 593 10.570 8.239 5.054 1.00 0.00 N ATOM 0 H LYS A 593 7.006 9.305 1.639 1.00 0.00 H new ATOM 0 HA LYS A 593 5.369 6.970 1.559 1.00 0.00 H new ATOM 0 HB2 LYS A 593 6.202 8.874 3.781 1.00 0.00 H new ATOM 0 HB3 LYS A 593 5.286 7.407 4.062 1.00 0.00 H new ATOM 0 HG2 LYS A 593 7.085 6.018 3.613 1.00 0.00 H new ATOM 0 HG3 LYS A 593 7.837 7.154 2.510 1.00 0.00 H new ATOM 0 HD2 LYS A 593 8.024 8.618 4.771 1.00 0.00 H new ATOM 0 HD3 LYS A 593 7.981 7.026 5.502 1.00 0.00 H new ATOM 0 HE2 LYS A 593 9.958 6.321 4.399 1.00 0.00 H new ATOM 0 HE3 LYS A 593 9.842 7.575 3.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 593 11.562 8.073 4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 593 10.327 9.236 4.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 593 10.440 8.020 6.062 1.00 0.00 H new ATOM 844 N HIS A 594 3.056 7.695 2.413 1.00 0.00 N ATOM 845 CA HIS A 594 1.660 8.113 2.519 1.00 0.00 C ATOM 846 C HIS A 594 0.969 7.410 3.682 1.00 0.00 C ATOM 847 O HIS A 594 1.539 6.515 4.303 1.00 0.00 O ATOM 848 CB HIS A 594 0.905 7.807 1.223 1.00 0.00 C ATOM 849 CG HIS A 594 1.159 8.794 0.127 1.00 0.00 C ATOM 850 ND1 HIS A 594 1.280 10.150 0.345 1.00 0.00 N ATOM 851 CD2 HIS A 594 1.311 8.616 -1.208 1.00 0.00 C ATOM 852 CE1 HIS A 594 1.494 10.762 -0.805 1.00 0.00 C ATOM 853 NE2 HIS A 594 1.519 9.854 -1.764 1.00 0.00 N ATOM 0 H HIS A 594 3.218 6.712 2.630 1.00 0.00 H new ATOM 0 HA HIS A 594 1.650 9.188 2.697 1.00 0.00 H new ATOM 0 HB2 HIS A 594 1.186 6.813 0.876 1.00 0.00 H new ATOM 0 HB3 HIS A 594 -0.164 7.780 1.434 1.00 0.00 H new ATOM 0 HD2 HIS A 594 1.275 7.675 -1.736 1.00 0.00 H new ATOM 0 HE1 HIS A 594 1.626 11.825 -0.939 1.00 0.00 H new ATOM 0 HE2 HIS A 594 1.668 10.042 -2.755 1.00 0.00 H new ATOM 862 N LYS A 595 -0.267 7.816 3.960 1.00 0.00 N ATOM 863 CA LYS A 595 -1.057 7.224 5.037 1.00 0.00 C ATOM 864 C LYS A 595 -2.546 7.422 4.769 1.00 0.00 C ATOM 865 O LYS A 595 -3.037 8.551 4.752 1.00 0.00 O ATOM 866 CB LYS A 595 -0.684 7.840 6.389 1.00 0.00 C ATOM 867 CG LYS A 595 0.792 7.729 6.728 1.00 0.00 C ATOM 868 CD LYS A 595 1.589 8.882 6.139 1.00 0.00 C ATOM 869 CE LYS A 595 1.914 9.928 7.192 1.00 0.00 C ATOM 870 NZ LYS A 595 0.696 10.646 7.658 1.00 0.00 N ATOM 0 H LYS A 595 -0.746 8.558 3.450 1.00 0.00 H new ATOM 0 HA LYS A 595 -0.839 6.157 5.071 1.00 0.00 H new ATOM 0 HB2 LYS A 595 -0.969 8.892 6.389 1.00 0.00 H new ATOM 0 HB3 LYS A 595 -1.265 7.352 7.172 1.00 0.00 H new ATOM 0 HG2 LYS A 595 0.917 7.715 7.811 1.00 0.00 H new ATOM 0 HG3 LYS A 595 1.183 6.785 6.349 1.00 0.00 H new ATOM 0 HD2 LYS A 595 2.514 8.502 5.704 1.00 0.00 H new ATOM 0 HD3 LYS A 595 1.022 9.342 5.330 1.00 0.00 H new ATOM 0 HE2 LYS A 595 2.400 9.448 8.042 1.00 0.00 H new ATOM 0 HE3 LYS A 595 2.624 10.646 6.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 0.961 11.350 8.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 0.246 11.125 6.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 0.029 9.965 8.072 1.00 0.00 H new ATOM 884 N THR A 596 -3.260 6.321 4.550 1.00 0.00 N ATOM 885 CA THR A 596 -4.691 6.384 4.274 1.00 0.00 C ATOM 886 C THR A 596 -5.481 6.722 5.531 1.00 0.00 C ATOM 887 O THR A 596 -4.968 6.631 6.645 1.00 0.00 O ATOM 888 CB THR A 596 -5.182 5.056 3.698 1.00 0.00 C ATOM 889 OG1 THR A 596 -5.394 4.110 4.730 1.00 0.00 O ATOM 890 CG2 THR A 596 -4.221 4.445 2.704 1.00 0.00 C ATOM 0 H THR A 596 -2.872 5.378 4.558 1.00 0.00 H new ATOM 0 HA THR A 596 -4.853 7.176 3.542 1.00 0.00 H new ATOM 0 HB THR A 596 -6.113 5.291 3.181 1.00 0.00 H new ATOM 0 HG1 THR A 596 -6.271 3.689 4.613 1.00 0.00 H new ATOM 0 HG21 THR A 596 -4.630 3.505 2.334 1.00 0.00 H new ATOM 0 HG22 THR A 596 -4.075 5.131 1.870 1.00 0.00 H new ATOM 0 HG23 THR A 596 -3.264 4.258 3.191 1.00 0.00 H new ATOM 898 N GLN A 597 -6.737 7.109 5.340 1.00 0.00 N ATOM 899 CA GLN A 597 -7.605 7.458 6.456 1.00 0.00 C ATOM 900 C GLN A 597 -7.460 6.445 7.586 1.00 0.00 C ATOM 901 O GLN A 597 -7.362 5.241 7.346 1.00 0.00 O ATOM 902 CB GLN A 597 -9.061 7.519 5.993 1.00 0.00 C ATOM 903 CG GLN A 597 -9.553 6.225 5.365 1.00 0.00 C ATOM 904 CD GLN A 597 -10.871 6.393 4.638 1.00 0.00 C ATOM 905 OE1 GLN A 597 -11.934 6.084 5.177 1.00 0.00 O ATOM 906 NE2 GLN A 597 -10.810 6.884 3.406 1.00 0.00 N ATOM 0 H GLN A 597 -7.176 7.189 4.423 1.00 0.00 H new ATOM 0 HA GLN A 597 -7.309 8.439 6.828 1.00 0.00 H new ATOM 0 HB2 GLN A 597 -9.695 7.764 6.845 1.00 0.00 H new ATOM 0 HB3 GLN A 597 -9.171 8.328 5.271 1.00 0.00 H new ATOM 0 HG2 GLN A 597 -8.802 5.856 4.667 1.00 0.00 H new ATOM 0 HG3 GLN A 597 -9.665 5.468 6.142 1.00 0.00 H new ATOM 0 HE21 GLN A 597 -9.907 7.127 2.998 1.00 0.00 H new ATOM 0 HE22 GLN A 597 -11.666 7.018 2.868 1.00 0.00 H new ATOM 915 N ILE A 598 -7.448 6.941 8.817 1.00 0.00 N ATOM 916 CA ILE A 598 -7.317 6.081 9.987 1.00 0.00 C ATOM 917 C ILE A 598 -8.656 5.453 10.354 1.00 0.00 C ATOM 918 O ILE A 598 -9.631 6.159 10.608 1.00 0.00 O ATOM 919 CB ILE A 598 -6.796 6.865 11.208 1.00 0.00 C ATOM 920 CG1 ILE A 598 -5.726 7.878 10.787 1.00 0.00 C ATOM 921 CG2 ILE A 598 -6.252 5.911 12.259 1.00 0.00 C ATOM 922 CD1 ILE A 598 -4.329 7.303 10.723 1.00 0.00 C ATOM 0 H ILE A 598 -7.527 7.935 9.031 1.00 0.00 H new ATOM 0 HA ILE A 598 -6.601 5.302 9.726 1.00 0.00 H new ATOM 0 HB ILE A 598 -7.629 7.416 11.643 1.00 0.00 H new ATOM 0 HG12 ILE A 598 -5.987 8.282 9.809 1.00 0.00 H new ATOM 0 HG13 ILE A 598 -5.733 8.712 11.489 1.00 0.00 H new ATOM 0 HG21 ILE A 598 -5.888 6.481 13.114 1.00 0.00 H new ATOM 0 HG22 ILE A 598 -7.044 5.236 12.583 1.00 0.00 H new ATOM 0 HG23 ILE A 598 -5.433 5.331 11.835 1.00 0.00 H new ATOM 0 HD11 ILE A 598 -3.629 8.081 10.418 1.00 0.00 H new ATOM 0 HD12 ILE A 598 -4.046 6.925 11.705 1.00 0.00 H new ATOM 0 HD13 ILE A 598 -4.304 6.488 9.999 1.00 0.00 H new ATOM 934 N LYS A 599 -8.697 4.126 10.400 1.00 0.00 N ATOM 935 CA LYS A 599 -9.919 3.422 10.756 1.00 0.00 C ATOM 936 C LYS A 599 -9.854 2.971 12.209 1.00 0.00 C ATOM 937 O LYS A 599 -9.541 1.818 12.507 1.00 0.00 O ATOM 938 CB LYS A 599 -10.143 2.231 9.826 1.00 0.00 C ATOM 939 CG LYS A 599 -11.450 2.316 9.052 1.00 0.00 C ATOM 940 CD LYS A 599 -11.206 2.475 7.561 1.00 0.00 C ATOM 941 CE LYS A 599 -11.101 3.940 7.167 1.00 0.00 C ATOM 942 NZ LYS A 599 -12.381 4.668 7.388 1.00 0.00 N ATOM 0 H LYS A 599 -7.902 3.521 10.196 1.00 0.00 H new ATOM 0 HA LYS A 599 -10.764 4.101 10.641 1.00 0.00 H new ATOM 0 HB2 LYS A 599 -9.314 2.167 9.121 1.00 0.00 H new ATOM 0 HB3 LYS A 599 -10.134 1.313 10.413 1.00 0.00 H new ATOM 0 HG2 LYS A 599 -12.039 1.417 9.231 1.00 0.00 H new ATOM 0 HG3 LYS A 599 -12.036 3.159 9.418 1.00 0.00 H new ATOM 0 HD2 LYS A 599 -10.288 1.956 7.284 1.00 0.00 H new ATOM 0 HD3 LYS A 599 -12.018 2.005 7.006 1.00 0.00 H new ATOM 0 HE2 LYS A 599 -10.309 4.415 7.745 1.00 0.00 H new ATOM 0 HE3 LYS A 599 -10.818 4.014 6.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 -12.514 5.373 6.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 -13.172 3.993 7.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 -12.353 5.147 8.311 1.00 0.00 H new ATOM 956 N LYS A 600 -10.136 3.907 13.109 1.00 0.00 N ATOM 957 CA LYS A 600 -10.096 3.646 14.543 1.00 0.00 C ATOM 958 C LYS A 600 -10.892 2.400 14.923 1.00 0.00 C ATOM 959 O LYS A 600 -11.857 2.030 14.254 1.00 0.00 O ATOM 960 CB LYS A 600 -10.638 4.854 15.312 1.00 0.00 C ATOM 961 CG LYS A 600 -9.986 6.174 14.928 1.00 0.00 C ATOM 962 CD LYS A 600 -8.567 6.273 15.461 1.00 0.00 C ATOM 963 CE LYS A 600 -8.289 7.645 16.052 1.00 0.00 C ATOM 964 NZ LYS A 600 -8.847 8.737 15.206 1.00 0.00 N ATOM 0 H LYS A 600 -10.397 4.863 12.867 1.00 0.00 H new ATOM 0 HA LYS A 600 -9.054 3.471 14.811 1.00 0.00 H new ATOM 0 HB2 LYS A 600 -11.712 4.928 15.142 1.00 0.00 H new ATOM 0 HB3 LYS A 600 -10.495 4.687 16.379 1.00 0.00 H new ATOM 0 HG2 LYS A 600 -9.975 6.273 13.843 1.00 0.00 H new ATOM 0 HG3 LYS A 600 -10.580 7.001 15.318 1.00 0.00 H new ATOM 0 HD2 LYS A 600 -8.409 5.509 16.222 1.00 0.00 H new ATOM 0 HD3 LYS A 600 -7.860 6.072 14.656 1.00 0.00 H new ATOM 0 HE2 LYS A 600 -8.720 7.704 17.052 1.00 0.00 H new ATOM 0 HE3 LYS A 600 -7.213 7.783 16.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 600 -8.251 9.585 15.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 600 -8.867 8.431 14.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 600 -9.814 8.959 15.519 1.00 0.00 H new ATOM 978 N LYS A 601 -10.479 1.773 16.020 1.00 0.00 N ATOM 979 CA LYS A 601 -11.137 0.577 16.540 1.00 0.00 C ATOM 980 C LYS A 601 -11.734 -0.285 15.432 1.00 0.00 C ATOM 981 O LYS A 601 -12.946 -0.275 15.212 1.00 0.00 O ATOM 982 CB LYS A 601 -12.232 0.972 17.531 1.00 0.00 C ATOM 983 CG LYS A 601 -11.887 2.193 18.368 1.00 0.00 C ATOM 984 CD LYS A 601 -11.268 1.798 19.699 1.00 0.00 C ATOM 985 CE LYS A 601 -12.245 1.003 20.551 1.00 0.00 C ATOM 986 NZ LYS A 601 -11.941 1.124 22.003 1.00 0.00 N ATOM 0 H LYS A 601 -9.679 2.079 16.574 1.00 0.00 H new ATOM 0 HA LYS A 601 -10.374 -0.017 17.044 1.00 0.00 H new ATOM 0 HB2 LYS A 601 -13.153 1.167 16.982 1.00 0.00 H new ATOM 0 HB3 LYS A 601 -12.429 0.131 18.196 1.00 0.00 H new ATOM 0 HG2 LYS A 601 -11.194 2.829 17.817 1.00 0.00 H new ATOM 0 HG3 LYS A 601 -12.788 2.781 18.544 1.00 0.00 H new ATOM 0 HD2 LYS A 601 -10.370 1.205 19.523 1.00 0.00 H new ATOM 0 HD3 LYS A 601 -10.958 2.693 20.238 1.00 0.00 H new ATOM 0 HE2 LYS A 601 -13.260 1.353 20.362 1.00 0.00 H new ATOM 0 HE3 LYS A 601 -12.211 -0.047 20.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 601 -12.629 0.568 22.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 601 -10.982 0.766 22.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 601 -11.999 2.123 22.288 1.00 0.00 H new ATOM 1000 N THR A 602 -10.883 -1.044 14.748 1.00 0.00 N ATOM 1001 CA THR A 602 -11.337 -1.925 13.679 1.00 0.00 C ATOM 1002 C THR A 602 -10.168 -2.699 13.077 1.00 0.00 C ATOM 1003 O THR A 602 -9.071 -2.164 12.918 1.00 0.00 O ATOM 1004 CB THR A 602 -12.040 -1.117 12.595 1.00 0.00 C ATOM 1005 OG1 THR A 602 -12.898 -1.942 11.828 1.00 0.00 O ATOM 1006 CG2 THR A 602 -11.071 -0.456 11.651 1.00 0.00 C ATOM 0 H THR A 602 -9.877 -1.066 14.915 1.00 0.00 H new ATOM 0 HA THR A 602 -12.040 -2.641 14.104 1.00 0.00 H new ATOM 0 HB THR A 602 -12.609 -0.348 13.117 1.00 0.00 H new ATOM 0 HG1 THR A 602 -13.340 -1.403 11.139 1.00 0.00 H new ATOM 0 HG21 THR A 602 -11.623 0.107 10.898 1.00 0.00 H new ATOM 0 HG22 THR A 602 -10.424 0.221 12.209 1.00 0.00 H new ATOM 0 HG23 THR A 602 -10.463 -1.217 11.162 1.00 0.00 H new ATOM 1014 N LEU A 603 -10.415 -3.961 12.743 1.00 0.00 N ATOM 1015 CA LEU A 603 -9.387 -4.816 12.159 1.00 0.00 C ATOM 1016 C LEU A 603 -9.771 -5.245 10.746 1.00 0.00 C ATOM 1017 O LEU A 603 -8.950 -5.783 10.004 1.00 0.00 O ATOM 1018 CB LEU A 603 -9.176 -6.052 13.032 1.00 0.00 C ATOM 1019 CG LEU A 603 -9.050 -5.770 14.530 1.00 0.00 C ATOM 1020 CD1 LEU A 603 -8.470 -6.975 15.254 1.00 0.00 C ATOM 1021 CD2 LEU A 603 -8.188 -4.538 14.768 1.00 0.00 C ATOM 0 H LEU A 603 -11.320 -4.415 12.867 1.00 0.00 H new ATOM 0 HA LEU A 603 -8.460 -4.245 12.107 1.00 0.00 H new ATOM 0 HB2 LEU A 603 -10.010 -6.736 12.875 1.00 0.00 H new ATOM 0 HB3 LEU A 603 -8.275 -6.566 12.697 1.00 0.00 H new ATOM 0 HG LEU A 603 -10.046 -5.577 14.929 1.00 0.00 H new ATOM 0 HD11 LEU A 603 -8.388 -6.755 16.318 1.00 0.00 H new ATOM 0 HD12 LEU A 603 -9.124 -7.835 15.110 1.00 0.00 H new ATOM 0 HD13 LEU A 603 -7.482 -7.200 14.853 1.00 0.00 H new ATOM 0 HD21 LEU A 603 -8.108 -4.351 15.839 1.00 0.00 H new ATOM 0 HD22 LEU A 603 -7.194 -4.704 14.354 1.00 0.00 H new ATOM 0 HD23 LEU A 603 -8.644 -3.675 14.282 1.00 0.00 H new ATOM 1033 N ASN A 604 -11.023 -5.003 10.383 1.00 0.00 N ATOM 1034 CA ASN A 604 -11.523 -5.361 9.060 1.00 0.00 C ATOM 1035 C ASN A 604 -12.225 -4.171 8.415 1.00 0.00 C ATOM 1036 O ASN A 604 -13.349 -4.287 7.927 1.00 0.00 O ATOM 1037 CB ASN A 604 -12.488 -6.544 9.159 1.00 0.00 C ATOM 1038 CG ASN A 604 -11.960 -7.648 10.056 1.00 0.00 C ATOM 1039 OD1 ASN A 604 -10.952 -8.283 9.749 1.00 0.00 O ATOM 1040 ND2 ASN A 604 -12.642 -7.881 11.171 1.00 0.00 N ATOM 0 H ASN A 604 -11.714 -4.559 10.987 1.00 0.00 H new ATOM 0 HA ASN A 604 -10.675 -5.647 8.438 1.00 0.00 H new ATOM 0 HB2 ASN A 604 -13.447 -6.196 9.542 1.00 0.00 H new ATOM 0 HB3 ASN A 604 -12.670 -6.945 8.162 1.00 0.00 H new ATOM 0 HD21 ASN A 604 -12.335 -8.612 11.813 1.00 0.00 H new ATOM 0 HD22 ASN A 604 -13.473 -7.329 11.385 1.00 0.00 H new ATOM 1047 N PRO A 605 -11.567 -3.004 8.422 1.00 0.00 N ATOM 1048 CA PRO A 605 -12.120 -1.773 7.854 1.00 0.00 C ATOM 1049 C PRO A 605 -11.996 -1.706 6.337 1.00 0.00 C ATOM 1050 O PRO A 605 -11.489 -2.630 5.701 1.00 0.00 O ATOM 1051 CB PRO A 605 -11.263 -0.690 8.497 1.00 0.00 C ATOM 1052 CG PRO A 605 -9.939 -1.340 8.710 1.00 0.00 C ATOM 1053 CD PRO A 605 -10.226 -2.790 9.000 1.00 0.00 C ATOM 0 HA PRO A 605 -13.189 -1.683 8.048 1.00 0.00 H new ATOM 0 HB2 PRO A 605 -11.177 0.184 7.851 1.00 0.00 H new ATOM 0 HB3 PRO A 605 -11.694 -0.349 9.438 1.00 0.00 H new ATOM 0 HG2 PRO A 605 -9.308 -1.237 7.827 1.00 0.00 H new ATOM 0 HG3 PRO A 605 -9.406 -0.875 9.539 1.00 0.00 H new ATOM 0 HD2 PRO A 605 -9.484 -3.444 8.543 1.00 0.00 H new ATOM 0 HD3 PRO A 605 -10.214 -2.994 10.071 1.00 0.00 H new ATOM 1061 N GLU A 606 -12.458 -0.597 5.769 1.00 0.00 N ATOM 1062 CA GLU A 606 -12.402 -0.382 4.329 1.00 0.00 C ATOM 1063 C GLU A 606 -11.856 1.008 4.022 1.00 0.00 C ATOM 1064 O GLU A 606 -12.457 2.017 4.391 1.00 0.00 O ATOM 1065 CB GLU A 606 -13.794 -0.548 3.715 1.00 0.00 C ATOM 1066 CG GLU A 606 -13.952 0.136 2.368 1.00 0.00 C ATOM 1067 CD GLU A 606 -14.598 1.503 2.480 1.00 0.00 C ATOM 1068 OE1 GLU A 606 -15.022 1.869 3.597 1.00 0.00 O ATOM 1069 OE2 GLU A 606 -14.678 2.208 1.453 1.00 0.00 O ATOM 0 H GLU A 606 -12.879 0.172 6.290 1.00 0.00 H new ATOM 0 HA GLU A 606 -11.734 -1.124 3.892 1.00 0.00 H new ATOM 0 HB2 GLU A 606 -14.006 -1.611 3.600 1.00 0.00 H new ATOM 0 HB3 GLU A 606 -14.536 -0.147 4.405 1.00 0.00 H new ATOM 0 HG2 GLU A 606 -12.973 0.238 1.900 1.00 0.00 H new ATOM 0 HG3 GLU A 606 -14.554 -0.494 1.713 1.00 0.00 H new ATOM 1076 N PHE A 607 -10.708 1.056 3.353 1.00 0.00 N ATOM 1077 CA PHE A 607 -10.080 2.326 3.009 1.00 0.00 C ATOM 1078 C PHE A 607 -10.643 2.888 1.710 1.00 0.00 C ATOM 1079 O PHE A 607 -11.151 4.009 1.678 1.00 0.00 O ATOM 1080 CB PHE A 607 -8.565 2.155 2.887 1.00 0.00 C ATOM 1081 CG PHE A 607 -7.927 1.549 4.104 1.00 0.00 C ATOM 1082 CD1 PHE A 607 -7.894 2.243 5.303 1.00 0.00 C ATOM 1083 CD2 PHE A 607 -7.358 0.288 4.047 1.00 0.00 C ATOM 1084 CE1 PHE A 607 -7.305 1.689 6.424 1.00 0.00 C ATOM 1085 CE2 PHE A 607 -6.767 -0.272 5.165 1.00 0.00 C ATOM 1086 CZ PHE A 607 -6.740 0.430 6.356 1.00 0.00 C ATOM 0 H PHE A 607 -10.195 0.232 3.039 1.00 0.00 H new ATOM 0 HA PHE A 607 -10.299 3.032 3.810 1.00 0.00 H new ATOM 0 HB2 PHE A 607 -8.347 1.528 2.023 1.00 0.00 H new ATOM 0 HB3 PHE A 607 -8.112 3.128 2.697 1.00 0.00 H new ATOM 0 HD1 PHE A 607 -8.333 3.228 5.362 1.00 0.00 H new ATOM 0 HD2 PHE A 607 -7.376 -0.264 3.119 1.00 0.00 H new ATOM 0 HE1 PHE A 607 -7.286 2.240 7.353 1.00 0.00 H new ATOM 0 HE2 PHE A 607 -6.327 -1.257 5.108 1.00 0.00 H new ATOM 0 HZ PHE A 607 -6.279 -0.005 7.230 1.00 0.00 H new ATOM 1096 N ASN A 608 -10.540 2.111 0.637 1.00 0.00 N ATOM 1097 CA ASN A 608 -11.030 2.550 -0.663 1.00 0.00 C ATOM 1098 C ASN A 608 -10.433 3.907 -1.016 1.00 0.00 C ATOM 1099 O ASN A 608 -11.149 4.837 -1.387 1.00 0.00 O ATOM 1100 CB ASN A 608 -12.558 2.633 -0.658 1.00 0.00 C ATOM 1101 CG ASN A 608 -13.127 2.891 -2.040 1.00 0.00 C ATOM 1102 OD1 ASN A 608 -13.643 3.972 -2.320 1.00 0.00 O ATOM 1103 ND2 ASN A 608 -13.038 1.893 -2.913 1.00 0.00 N ATOM 0 H ASN A 608 -10.124 1.180 0.642 1.00 0.00 H new ATOM 0 HA ASN A 608 -10.724 1.822 -1.414 1.00 0.00 H new ATOM 0 HB2 ASN A 608 -12.969 1.702 -0.267 1.00 0.00 H new ATOM 0 HB3 ASN A 608 -12.874 3.429 0.016 1.00 0.00 H new ATOM 0 HD21 ASN A 608 -13.406 2.007 -3.858 1.00 0.00 H new ATOM 0 HD22 ASN A 608 -12.602 1.013 -2.639 1.00 0.00 H new ATOM 1110 N GLU A 609 -9.115 4.011 -0.881 1.00 0.00 N ATOM 1111 CA GLU A 609 -8.411 5.256 -1.169 1.00 0.00 C ATOM 1112 C GLU A 609 -7.599 5.147 -2.455 1.00 0.00 C ATOM 1113 O GLU A 609 -6.868 4.177 -2.660 1.00 0.00 O ATOM 1114 CB GLU A 609 -7.491 5.622 -0.001 1.00 0.00 C ATOM 1115 CG GLU A 609 -8.095 6.644 0.950 1.00 0.00 C ATOM 1116 CD GLU A 609 -8.779 7.785 0.223 1.00 0.00 C ATOM 1117 OE1 GLU A 609 -8.069 8.598 -0.405 1.00 0.00 O ATOM 1118 OE2 GLU A 609 -10.023 7.866 0.282 1.00 0.00 O ATOM 0 H GLU A 609 -8.512 3.248 -0.574 1.00 0.00 H new ATOM 0 HA GLU A 609 -9.156 6.041 -1.303 1.00 0.00 H new ATOM 0 HB2 GLU A 609 -7.248 4.718 0.557 1.00 0.00 H new ATOM 0 HB3 GLU A 609 -6.554 6.014 -0.396 1.00 0.00 H new ATOM 0 HG2 GLU A 609 -8.816 6.148 1.600 1.00 0.00 H new ATOM 0 HG3 GLU A 609 -7.311 7.045 1.592 1.00 0.00 H new ATOM 1125 N GLU A 610 -7.727 6.152 -3.316 1.00 0.00 N ATOM 1126 CA GLU A 610 -7.000 6.176 -4.579 1.00 0.00 C ATOM 1127 C GLU A 610 -5.865 7.195 -4.525 1.00 0.00 C ATOM 1128 O GLU A 610 -6.102 8.399 -4.438 1.00 0.00 O ATOM 1129 CB GLU A 610 -7.948 6.508 -5.735 1.00 0.00 C ATOM 1130 CG GLU A 610 -9.143 5.572 -5.829 1.00 0.00 C ATOM 1131 CD GLU A 610 -9.059 4.638 -7.018 1.00 0.00 C ATOM 1132 OE1 GLU A 610 -8.858 5.132 -8.148 1.00 0.00 O ATOM 1133 OE2 GLU A 610 -9.194 3.412 -6.822 1.00 0.00 O ATOM 0 H GLU A 610 -8.328 6.961 -3.161 1.00 0.00 H new ATOM 0 HA GLU A 610 -6.574 5.187 -4.747 1.00 0.00 H new ATOM 0 HB2 GLU A 610 -8.306 7.531 -5.618 1.00 0.00 H new ATOM 0 HB3 GLU A 610 -7.392 6.470 -6.672 1.00 0.00 H new ATOM 0 HG2 GLU A 610 -9.212 4.984 -4.914 1.00 0.00 H new ATOM 0 HG3 GLU A 610 -10.057 6.162 -5.899 1.00 0.00 H new ATOM 1140 N PHE A 611 -4.632 6.701 -4.561 1.00 0.00 N ATOM 1141 CA PHE A 611 -3.458 7.561 -4.500 1.00 0.00 C ATOM 1142 C PHE A 611 -2.951 7.932 -5.887 1.00 0.00 C ATOM 1143 O PHE A 611 -3.418 7.407 -6.899 1.00 0.00 O ATOM 1144 CB PHE A 611 -2.350 6.861 -3.731 1.00 0.00 C ATOM 1145 CG PHE A 611 -2.526 6.930 -2.248 1.00 0.00 C ATOM 1146 CD1 PHE A 611 -3.394 6.070 -1.601 1.00 0.00 C ATOM 1147 CD2 PHE A 611 -1.819 7.853 -1.503 1.00 0.00 C ATOM 1148 CE1 PHE A 611 -3.557 6.129 -0.231 1.00 0.00 C ATOM 1149 CE2 PHE A 611 -1.972 7.920 -0.132 1.00 0.00 C ATOM 1150 CZ PHE A 611 -2.844 7.056 0.507 1.00 0.00 C ATOM 0 H PHE A 611 -4.420 5.706 -4.632 1.00 0.00 H new ATOM 0 HA PHE A 611 -3.750 8.480 -3.992 1.00 0.00 H new ATOM 0 HB2 PHE A 611 -2.309 5.816 -4.037 1.00 0.00 H new ATOM 0 HB3 PHE A 611 -1.393 7.309 -3.998 1.00 0.00 H new ATOM 0 HD1 PHE A 611 -3.951 5.343 -2.174 1.00 0.00 H new ATOM 0 HD2 PHE A 611 -1.139 8.530 -1.998 1.00 0.00 H new ATOM 0 HE1 PHE A 611 -4.239 5.453 0.263 1.00 0.00 H new ATOM 0 HE2 PHE A 611 -1.412 8.645 0.440 1.00 0.00 H new ATOM 0 HZ PHE A 611 -2.967 7.106 1.579 1.00 0.00 H new ATOM 1160 N PHE A 612 -1.976 8.834 -5.915 1.00 0.00 N ATOM 1161 CA PHE A 612 -1.371 9.287 -7.161 1.00 0.00 C ATOM 1162 C PHE A 612 0.116 9.551 -6.961 1.00 0.00 C ATOM 1163 O PHE A 612 0.508 10.334 -6.096 1.00 0.00 O ATOM 1164 CB PHE A 612 -2.066 10.553 -7.665 1.00 0.00 C ATOM 1165 CG PHE A 612 -1.741 10.887 -9.093 1.00 0.00 C ATOM 1166 CD1 PHE A 612 -1.584 9.882 -10.033 1.00 0.00 C ATOM 1167 CD2 PHE A 612 -1.594 12.205 -9.494 1.00 0.00 C ATOM 1168 CE1 PHE A 612 -1.284 10.184 -11.347 1.00 0.00 C ATOM 1169 CE2 PHE A 612 -1.294 12.515 -10.807 1.00 0.00 C ATOM 1170 CZ PHE A 612 -1.138 11.503 -11.736 1.00 0.00 C ATOM 0 H PHE A 612 -1.585 9.269 -5.080 1.00 0.00 H new ATOM 0 HA PHE A 612 -1.492 8.502 -7.908 1.00 0.00 H new ATOM 0 HB2 PHE A 612 -3.144 10.430 -7.565 1.00 0.00 H new ATOM 0 HB3 PHE A 612 -1.781 11.392 -7.030 1.00 0.00 H new ATOM 0 HD1 PHE A 612 -1.697 8.850 -9.735 1.00 0.00 H new ATOM 0 HD2 PHE A 612 -1.715 12.999 -8.772 1.00 0.00 H new ATOM 0 HE1 PHE A 612 -1.164 9.391 -12.070 1.00 0.00 H new ATOM 0 HE2 PHE A 612 -1.182 13.546 -11.107 1.00 0.00 H new ATOM 0 HZ PHE A 612 -0.903 11.742 -12.763 1.00 0.00 H new ATOM 1180 N TYR A 613 0.942 8.888 -7.762 1.00 0.00 N ATOM 1181 CA TYR A 613 2.386 9.043 -7.670 1.00 0.00 C ATOM 1182 C TYR A 613 2.915 9.876 -8.829 1.00 0.00 C ATOM 1183 O TYR A 613 2.292 9.951 -9.888 1.00 0.00 O ATOM 1184 CB TYR A 613 3.059 7.673 -7.654 1.00 0.00 C ATOM 1185 CG TYR A 613 3.292 7.143 -6.261 1.00 0.00 C ATOM 1186 CD1 TYR A 613 2.280 6.495 -5.563 1.00 0.00 C ATOM 1187 CD2 TYR A 613 4.522 7.295 -5.643 1.00 0.00 C ATOM 1188 CE1 TYR A 613 2.490 6.011 -4.284 1.00 0.00 C ATOM 1189 CE2 TYR A 613 4.744 6.816 -4.366 1.00 0.00 C ATOM 1190 CZ TYR A 613 3.725 6.173 -3.690 1.00 0.00 C ATOM 1191 OH TYR A 613 3.942 5.694 -2.419 1.00 0.00 O ATOM 0 H TYR A 613 0.634 8.237 -8.484 1.00 0.00 H new ATOM 0 HA TYR A 613 2.619 9.564 -6.741 1.00 0.00 H new ATOM 0 HB2 TYR A 613 2.441 6.965 -8.207 1.00 0.00 H new ATOM 0 HB3 TYR A 613 4.014 7.738 -8.176 1.00 0.00 H new ATOM 0 HD1 TYR A 613 1.313 6.367 -6.027 1.00 0.00 H new ATOM 0 HD2 TYR A 613 5.321 7.797 -6.168 1.00 0.00 H new ATOM 0 HE1 TYR A 613 1.693 5.510 -3.754 1.00 0.00 H new ATOM 0 HE2 TYR A 613 5.709 6.944 -3.899 1.00 0.00 H new ATOM 0 HH TYR A 613 4.266 6.420 -1.847 1.00 0.00 H new ATOM 1201 N ASP A 614 4.066 10.503 -8.624 1.00 0.00 N ATOM 1202 CA ASP A 614 4.672 11.332 -9.657 1.00 0.00 C ATOM 1203 C ASP A 614 5.970 10.711 -10.163 1.00 0.00 C ATOM 1204 O ASP A 614 7.047 11.288 -10.009 1.00 0.00 O ATOM 1205 CB ASP A 614 4.938 12.740 -9.123 1.00 0.00 C ATOM 1206 CG ASP A 614 4.226 13.808 -9.930 1.00 0.00 C ATOM 1207 OD1 ASP A 614 4.619 14.033 -11.094 1.00 0.00 O ATOM 1208 OD2 ASP A 614 3.275 14.420 -9.398 1.00 0.00 O ATOM 0 H ASP A 614 4.597 10.454 -7.755 1.00 0.00 H new ATOM 0 HA ASP A 614 3.973 11.396 -10.491 1.00 0.00 H new ATOM 0 HB2 ASP A 614 4.615 12.798 -8.083 1.00 0.00 H new ATOM 0 HB3 ASP A 614 6.011 12.934 -9.135 1.00 0.00 H new ATOM 1213 N ILE A 615 5.860 9.533 -10.768 1.00 0.00 N ATOM 1214 CA ILE A 615 7.021 8.835 -11.299 1.00 0.00 C ATOM 1215 C ILE A 615 6.799 8.454 -12.756 1.00 0.00 C ATOM 1216 O ILE A 615 5.713 8.013 -13.134 1.00 0.00 O ATOM 1217 CB ILE A 615 7.338 7.565 -10.473 1.00 0.00 C ATOM 1218 CG1 ILE A 615 8.273 6.615 -11.235 1.00 0.00 C ATOM 1219 CG2 ILE A 615 6.055 6.851 -10.078 1.00 0.00 C ATOM 1220 CD1 ILE A 615 9.738 6.936 -11.066 1.00 0.00 C ATOM 0 H ILE A 615 4.976 9.042 -10.902 1.00 0.00 H new ATOM 0 HA ILE A 615 7.871 9.515 -11.232 1.00 0.00 H new ATOM 0 HB ILE A 615 7.855 7.880 -9.567 1.00 0.00 H new ATOM 0 HG12 ILE A 615 8.093 5.595 -10.897 1.00 0.00 H new ATOM 0 HG13 ILE A 615 8.023 6.648 -12.296 1.00 0.00 H new ATOM 0 HG21 ILE A 615 6.298 5.961 -9.498 1.00 0.00 H new ATOM 0 HG22 ILE A 615 5.437 7.518 -9.477 1.00 0.00 H new ATOM 0 HG23 ILE A 615 5.509 6.561 -10.976 1.00 0.00 H new ATOM 0 HD11 ILE A 615 10.335 6.222 -11.633 1.00 0.00 H new ATOM 0 HD12 ILE A 615 9.934 7.944 -11.431 1.00 0.00 H new ATOM 0 HD13 ILE A 615 10.005 6.874 -10.011 1.00 0.00 H new ATOM 1232 N LYS A 616 7.835 8.618 -13.570 1.00 0.00 N ATOM 1233 CA LYS A 616 7.751 8.279 -14.982 1.00 0.00 C ATOM 1234 C LYS A 616 7.700 6.766 -15.159 1.00 0.00 C ATOM 1235 O LYS A 616 8.494 6.035 -14.567 1.00 0.00 O ATOM 1236 CB LYS A 616 8.942 8.856 -15.748 1.00 0.00 C ATOM 1237 CG LYS A 616 8.789 10.329 -16.091 1.00 0.00 C ATOM 1238 CD LYS A 616 8.418 11.152 -14.869 1.00 0.00 C ATOM 1239 CE LYS A 616 8.733 12.626 -15.071 1.00 0.00 C ATOM 1240 NZ LYS A 616 8.056 13.178 -16.278 1.00 0.00 N ATOM 0 H LYS A 616 8.741 8.983 -13.276 1.00 0.00 H new ATOM 0 HA LYS A 616 6.836 8.714 -15.385 1.00 0.00 H new ATOM 0 HB2 LYS A 616 9.845 8.722 -15.153 1.00 0.00 H new ATOM 0 HB3 LYS A 616 9.080 8.289 -16.669 1.00 0.00 H new ATOM 0 HG2 LYS A 616 9.721 10.704 -16.513 1.00 0.00 H new ATOM 0 HG3 LYS A 616 8.022 10.447 -16.857 1.00 0.00 H new ATOM 0 HD2 LYS A 616 7.355 11.032 -14.657 1.00 0.00 H new ATOM 0 HD3 LYS A 616 8.960 10.779 -14.000 1.00 0.00 H new ATOM 0 HE2 LYS A 616 8.421 13.188 -14.191 1.00 0.00 H new ATOM 0 HE3 LYS A 616 9.811 12.757 -15.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 616 8.169 14.212 -16.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 616 8.482 12.767 -17.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 616 7.044 12.941 -16.247 1.00 0.00 H new ATOM 1254 N HIS A 617 6.757 6.302 -15.968 1.00 0.00 N ATOM 1255 CA HIS A 617 6.597 4.876 -16.212 1.00 0.00 C ATOM 1256 C HIS A 617 7.948 4.199 -16.436 1.00 0.00 C ATOM 1257 O HIS A 617 8.222 3.140 -15.875 1.00 0.00 O ATOM 1258 CB HIS A 617 5.692 4.640 -17.419 1.00 0.00 C ATOM 1259 CG HIS A 617 5.439 3.193 -17.692 1.00 0.00 C ATOM 1260 ND1 HIS A 617 6.338 2.389 -18.361 1.00 0.00 N ATOM 1261 CD2 HIS A 617 4.389 2.398 -17.374 1.00 0.00 C ATOM 1262 CE1 HIS A 617 5.853 1.164 -18.443 1.00 0.00 C ATOM 1263 NE2 HIS A 617 4.674 1.142 -17.852 1.00 0.00 N ATOM 0 H HIS A 617 6.091 6.893 -16.466 1.00 0.00 H new ATOM 0 HA HIS A 617 6.135 4.437 -15.328 1.00 0.00 H new ATOM 0 HB2 HIS A 617 4.740 5.144 -17.255 1.00 0.00 H new ATOM 0 HB3 HIS A 617 6.146 5.095 -18.299 1.00 0.00 H new ATOM 0 HD2 HIS A 617 3.496 2.696 -16.844 1.00 0.00 H new ATOM 0 HE1 HIS A 617 6.339 0.322 -18.914 1.00 0.00 H new ATOM 0 HE2 HIS A 617 4.071 0.324 -17.764 1.00 0.00 H new ATOM 1272 N SER A 618 8.787 4.816 -17.262 1.00 0.00 N ATOM 1273 CA SER A 618 10.107 4.267 -17.556 1.00 0.00 C ATOM 1274 C SER A 618 10.872 3.970 -16.271 1.00 0.00 C ATOM 1275 O SER A 618 11.756 3.115 -16.248 1.00 0.00 O ATOM 1276 CB SER A 618 10.905 5.238 -18.427 1.00 0.00 C ATOM 1277 OG SER A 618 10.852 4.863 -19.792 1.00 0.00 O ATOM 0 H SER A 618 8.578 5.693 -17.738 1.00 0.00 H new ATOM 0 HA SER A 618 9.970 3.332 -18.100 1.00 0.00 H new ATOM 0 HB2 SER A 618 10.509 6.247 -18.309 1.00 0.00 H new ATOM 0 HB3 SER A 618 11.942 5.262 -18.094 1.00 0.00 H new ATOM 0 HG SER A 618 11.369 5.501 -20.327 1.00 0.00 H new ATOM 1283 N ASP A 619 10.523 4.678 -15.202 1.00 0.00 N ATOM 1284 CA ASP A 619 11.177 4.485 -13.914 1.00 0.00 C ATOM 1285 C ASP A 619 10.314 3.623 -13.000 1.00 0.00 C ATOM 1286 O ASP A 619 10.825 2.900 -12.144 1.00 0.00 O ATOM 1287 CB ASP A 619 11.456 5.836 -13.251 1.00 0.00 C ATOM 1288 CG ASP A 619 12.478 6.654 -14.016 1.00 0.00 C ATOM 1289 OD1 ASP A 619 12.252 6.916 -15.216 1.00 0.00 O ATOM 1290 OD2 ASP A 619 13.505 7.034 -13.414 1.00 0.00 O ATOM 0 H ASP A 619 9.792 5.389 -15.202 1.00 0.00 H new ATOM 0 HA ASP A 619 12.124 3.973 -14.084 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.526 6.400 -13.175 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.813 5.672 -12.234 1.00 0.00 H new ATOM 1295 N LEU A 620 9.002 3.703 -13.195 1.00 0.00 N ATOM 1296 CA LEU A 620 8.054 2.932 -12.400 1.00 0.00 C ATOM 1297 C LEU A 620 8.631 1.566 -12.043 1.00 0.00 C ATOM 1298 O LEU A 620 8.918 1.285 -10.883 1.00 0.00 O ATOM 1299 CB LEU A 620 6.748 2.743 -13.184 1.00 0.00 C ATOM 1300 CG LEU A 620 5.535 3.579 -12.744 1.00 0.00 C ATOM 1301 CD1 LEU A 620 4.350 2.667 -12.490 1.00 0.00 C ATOM 1302 CD2 LEU A 620 5.830 4.416 -11.508 1.00 0.00 C ATOM 0 H LEU A 620 8.569 4.298 -13.901 1.00 0.00 H new ATOM 0 HA LEU A 620 7.855 3.481 -11.479 1.00 0.00 H new ATOM 0 HB2 LEU A 620 6.948 2.965 -14.232 1.00 0.00 H new ATOM 0 HB3 LEU A 620 6.470 1.690 -13.129 1.00 0.00 H new ATOM 0 HG LEU A 620 5.300 4.272 -13.552 1.00 0.00 H new ATOM 0 HD11 LEU A 620 3.492 3.263 -12.178 1.00 0.00 H new ATOM 0 HD12 LEU A 620 4.104 2.127 -13.404 1.00 0.00 H new ATOM 0 HD13 LEU A 620 4.601 1.954 -11.704 1.00 0.00 H new ATOM 0 HD21 LEU A 620 4.943 4.989 -11.236 1.00 0.00 H new ATOM 0 HD22 LEU A 620 6.106 3.760 -10.682 1.00 0.00 H new ATOM 0 HD23 LEU A 620 6.652 5.099 -11.719 1.00 0.00 H new ATOM 1314 N ALA A 621 8.790 0.723 -13.055 1.00 0.00 N ATOM 1315 CA ALA A 621 9.327 -0.621 -12.872 1.00 0.00 C ATOM 1316 C ALA A 621 10.393 -0.670 -11.775 1.00 0.00 C ATOM 1317 O ALA A 621 10.303 -1.472 -10.848 1.00 0.00 O ATOM 1318 CB ALA A 621 9.909 -1.117 -14.187 1.00 0.00 C ATOM 0 H ALA A 621 8.552 0.949 -14.021 1.00 0.00 H new ATOM 0 HA ALA A 621 8.509 -1.269 -12.558 1.00 0.00 H new ATOM 0 HB1 ALA A 621 10.311 -2.121 -14.051 1.00 0.00 H new ATOM 0 HB2 ALA A 621 9.127 -1.138 -14.946 1.00 0.00 H new ATOM 0 HB3 ALA A 621 10.707 -0.447 -14.507 1.00 0.00 H new ATOM 1324 N LYS A 622 11.409 0.184 -11.894 1.00 0.00 N ATOM 1325 CA LYS A 622 12.498 0.221 -10.923 1.00 0.00 C ATOM 1326 C LYS A 622 12.004 0.638 -9.548 1.00 0.00 C ATOM 1327 O LYS A 622 12.635 0.341 -8.534 1.00 0.00 O ATOM 1328 CB LYS A 622 13.592 1.182 -11.394 1.00 0.00 C ATOM 1329 CG LYS A 622 14.577 0.552 -12.366 1.00 0.00 C ATOM 1330 CD LYS A 622 14.537 1.238 -13.722 1.00 0.00 C ATOM 1331 CE LYS A 622 13.544 0.568 -14.658 1.00 0.00 C ATOM 1332 NZ LYS A 622 14.206 0.032 -15.879 1.00 0.00 N ATOM 0 H LYS A 622 11.499 0.859 -12.654 1.00 0.00 H new ATOM 0 HA LYS A 622 12.907 -0.786 -10.845 1.00 0.00 H new ATOM 0 HB2 LYS A 622 13.126 2.045 -11.870 1.00 0.00 H new ATOM 0 HB3 LYS A 622 14.137 1.552 -10.526 1.00 0.00 H new ATOM 0 HG2 LYS A 622 15.585 0.614 -11.955 1.00 0.00 H new ATOM 0 HG3 LYS A 622 14.346 -0.506 -12.485 1.00 0.00 H new ATOM 0 HD2 LYS A 622 14.266 2.286 -13.593 1.00 0.00 H new ATOM 0 HD3 LYS A 622 15.531 1.219 -14.170 1.00 0.00 H new ATOM 0 HE2 LYS A 622 13.040 -0.243 -14.132 1.00 0.00 H new ATOM 0 HE3 LYS A 622 12.776 1.286 -14.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 622 13.495 -0.417 -16.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 622 14.665 0.810 -16.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 622 14.921 -0.672 -15.606 1.00 0.00 H new ATOM 1346 N LYS A 623 10.876 1.332 -9.517 1.00 0.00 N ATOM 1347 CA LYS A 623 10.309 1.792 -8.263 1.00 0.00 C ATOM 1348 C LYS A 623 9.938 0.620 -7.363 1.00 0.00 C ATOM 1349 O LYS A 623 9.897 -0.528 -7.805 1.00 0.00 O ATOM 1350 CB LYS A 623 9.068 2.649 -8.510 1.00 0.00 C ATOM 1351 CG LYS A 623 9.297 3.803 -9.465 1.00 0.00 C ATOM 1352 CD LYS A 623 9.986 4.969 -8.777 1.00 0.00 C ATOM 1353 CE LYS A 623 11.423 5.125 -9.251 1.00 0.00 C ATOM 1354 NZ LYS A 623 11.925 6.514 -9.065 1.00 0.00 N ATOM 0 H LYS A 623 10.338 1.587 -10.345 1.00 0.00 H new ATOM 0 HA LYS A 623 11.070 2.393 -7.765 1.00 0.00 H new ATOM 0 HB2 LYS A 623 8.274 2.015 -8.906 1.00 0.00 H new ATOM 0 HB3 LYS A 623 8.716 3.044 -7.557 1.00 0.00 H new ATOM 0 HG2 LYS A 623 9.903 3.466 -10.306 1.00 0.00 H new ATOM 0 HG3 LYS A 623 8.342 4.133 -9.873 1.00 0.00 H new ATOM 0 HD2 LYS A 623 9.434 5.888 -8.976 1.00 0.00 H new ATOM 0 HD3 LYS A 623 9.972 4.816 -7.698 1.00 0.00 H new ATOM 0 HE2 LYS A 623 12.062 4.432 -8.704 1.00 0.00 H new ATOM 0 HE3 LYS A 623 11.488 4.854 -10.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 623 12.165 6.923 -9.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 623 11.189 7.091 -8.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 623 12.773 6.499 -8.463 1.00 0.00 H new ATOM 1368 N SER A 624 9.656 0.921 -6.100 1.00 0.00 N ATOM 1369 CA SER A 624 9.275 -0.099 -5.136 1.00 0.00 C ATOM 1370 C SER A 624 8.254 0.457 -4.150 1.00 0.00 C ATOM 1371 O SER A 624 8.604 1.192 -3.226 1.00 0.00 O ATOM 1372 CB SER A 624 10.503 -0.610 -4.389 1.00 0.00 C ATOM 1373 OG SER A 624 11.697 -0.121 -4.974 1.00 0.00 O ATOM 0 H SER A 624 9.685 1.868 -5.721 1.00 0.00 H new ATOM 0 HA SER A 624 8.823 -0.931 -5.675 1.00 0.00 H new ATOM 0 HB2 SER A 624 10.452 -0.300 -3.345 1.00 0.00 H new ATOM 0 HB3 SER A 624 10.510 -1.700 -4.398 1.00 0.00 H new ATOM 0 HG SER A 624 12.469 -0.462 -4.476 1.00 0.00 H new ATOM 1379 N LEU A 625 6.991 0.105 -4.358 1.00 0.00 N ATOM 1380 CA LEU A 625 5.914 0.573 -3.493 1.00 0.00 C ATOM 1381 C LEU A 625 5.850 -0.240 -2.207 1.00 0.00 C ATOM 1382 O LEU A 625 5.707 -1.461 -2.239 1.00 0.00 O ATOM 1383 CB LEU A 625 4.574 0.494 -4.226 1.00 0.00 C ATOM 1384 CG LEU A 625 3.380 1.049 -3.450 1.00 0.00 C ATOM 1385 CD1 LEU A 625 3.539 2.544 -3.220 1.00 0.00 C ATOM 1386 CD2 LEU A 625 2.083 0.758 -4.191 1.00 0.00 C ATOM 0 H LEU A 625 6.687 -0.503 -5.118 1.00 0.00 H new ATOM 0 HA LEU A 625 6.120 1.611 -3.232 1.00 0.00 H new ATOM 0 HB2 LEU A 625 4.660 1.036 -5.168 1.00 0.00 H new ATOM 0 HB3 LEU A 625 4.374 -0.548 -4.475 1.00 0.00 H new ATOM 0 HG LEU A 625 3.341 0.556 -2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 625 2.679 2.920 -2.666 1.00 0.00 H new ATOM 0 HD12 LEU A 625 4.448 2.729 -2.648 1.00 0.00 H new ATOM 0 HD13 LEU A 625 3.604 3.055 -4.181 1.00 0.00 H new ATOM 0 HD21 LEU A 625 1.243 1.160 -3.625 1.00 0.00 H new ATOM 0 HD22 LEU A 625 2.114 1.225 -5.175 1.00 0.00 H new ATOM 0 HD23 LEU A 625 1.962 -0.319 -4.304 1.00 0.00 H new ATOM 1398 N ASP A 626 5.957 0.447 -1.075 1.00 0.00 N ATOM 1399 CA ASP A 626 5.912 -0.211 0.225 1.00 0.00 C ATOM 1400 C ASP A 626 4.588 0.065 0.931 1.00 0.00 C ATOM 1401 O ASP A 626 4.415 1.108 1.561 1.00 0.00 O ATOM 1402 CB ASP A 626 7.078 0.259 1.097 1.00 0.00 C ATOM 1403 CG ASP A 626 6.994 -0.281 2.511 1.00 0.00 C ATOM 1404 OD1 ASP A 626 6.086 -1.092 2.784 1.00 0.00 O ATOM 1405 OD2 ASP A 626 7.840 0.108 3.345 1.00 0.00 O ATOM 0 H ASP A 626 6.075 1.459 -1.032 1.00 0.00 H new ATOM 0 HA ASP A 626 5.998 -1.286 0.064 1.00 0.00 H new ATOM 0 HB2 ASP A 626 8.018 -0.058 0.645 1.00 0.00 H new ATOM 0 HB3 ASP A 626 7.090 1.349 1.127 1.00 0.00 H new ATOM 1410 N ILE A 627 3.658 -0.880 0.827 1.00 0.00 N ATOM 1411 CA ILE A 627 2.353 -0.742 1.462 1.00 0.00 C ATOM 1412 C ILE A 627 2.373 -1.344 2.861 1.00 0.00 C ATOM 1413 O ILE A 627 2.338 -2.564 3.023 1.00 0.00 O ATOM 1414 CB ILE A 627 1.247 -1.423 0.634 1.00 0.00 C ATOM 1415 CG1 ILE A 627 1.266 -0.904 -0.805 1.00 0.00 C ATOM 1416 CG2 ILE A 627 -0.113 -1.187 1.272 1.00 0.00 C ATOM 1417 CD1 ILE A 627 1.819 -1.900 -1.800 1.00 0.00 C ATOM 0 H ILE A 627 3.785 -1.749 0.309 1.00 0.00 H new ATOM 0 HA ILE A 627 2.135 0.324 1.525 1.00 0.00 H new ATOM 0 HB ILE A 627 1.435 -2.497 0.615 1.00 0.00 H new ATOM 0 HG12 ILE A 627 0.252 -0.635 -1.099 1.00 0.00 H new ATOM 0 HG13 ILE A 627 1.862 0.007 -0.846 1.00 0.00 H new ATOM 0 HG21 ILE A 627 -0.884 -1.674 0.675 1.00 0.00 H new ATOM 0 HG22 ILE A 627 -0.119 -1.601 2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 627 -0.312 -0.116 1.318 1.00 0.00 H new ATOM 0 HD11 ILE A 627 1.802 -1.464 -2.799 1.00 0.00 H new ATOM 0 HD12 ILE A 627 2.845 -2.151 -1.531 1.00 0.00 H new ATOM 0 HD13 ILE A 627 1.209 -2.803 -1.788 1.00 0.00 H new ATOM 1429 N SER A 628 2.444 -0.483 3.869 1.00 0.00 N ATOM 1430 CA SER A 628 2.486 -0.939 5.254 1.00 0.00 C ATOM 1431 C SER A 628 1.288 -0.437 6.052 1.00 0.00 C ATOM 1432 O SER A 628 0.942 0.743 6.005 1.00 0.00 O ATOM 1433 CB SER A 628 3.782 -0.478 5.923 1.00 0.00 C ATOM 1434 OG SER A 628 4.916 -0.921 5.197 1.00 0.00 O ATOM 0 H SER A 628 2.474 0.530 3.755 1.00 0.00 H new ATOM 0 HA SER A 628 2.448 -2.028 5.241 1.00 0.00 H new ATOM 0 HB2 SER A 628 3.792 0.610 5.992 1.00 0.00 H new ATOM 0 HB3 SER A 628 3.826 -0.862 6.942 1.00 0.00 H new ATOM 0 HG SER A 628 5.491 -1.457 5.783 1.00 0.00 H new ATOM 1440 N VAL A 629 0.671 -1.348 6.799 1.00 0.00 N ATOM 1441 CA VAL A 629 -0.477 -1.015 7.631 1.00 0.00 C ATOM 1442 C VAL A 629 -0.043 -0.863 9.087 1.00 0.00 C ATOM 1443 O VAL A 629 0.597 -1.754 9.644 1.00 0.00 O ATOM 1444 CB VAL A 629 -1.568 -2.098 7.542 1.00 0.00 C ATOM 1445 CG1 VAL A 629 -2.874 -1.593 8.137 1.00 0.00 C ATOM 1446 CG2 VAL A 629 -1.765 -2.540 6.100 1.00 0.00 C ATOM 0 H VAL A 629 0.950 -2.328 6.844 1.00 0.00 H new ATOM 0 HA VAL A 629 -0.888 -0.074 7.264 1.00 0.00 H new ATOM 0 HB VAL A 629 -1.244 -2.962 8.121 1.00 0.00 H new ATOM 0 HG11 VAL A 629 -3.632 -2.373 8.065 1.00 0.00 H new ATOM 0 HG12 VAL A 629 -2.720 -1.333 9.184 1.00 0.00 H new ATOM 0 HG13 VAL A 629 -3.207 -0.711 7.589 1.00 0.00 H new ATOM 0 HG21 VAL A 629 -2.540 -3.306 6.057 1.00 0.00 H new ATOM 0 HG22 VAL A 629 -2.066 -1.685 5.495 1.00 0.00 H new ATOM 0 HG23 VAL A 629 -0.831 -2.947 5.713 1.00 0.00 H new ATOM 1456 N TRP A 630 -0.373 0.272 9.694 1.00 0.00 N ATOM 1457 CA TRP A 630 0.010 0.529 11.078 1.00 0.00 C ATOM 1458 C TRP A 630 -1.202 0.859 11.943 1.00 0.00 C ATOM 1459 O TRP A 630 -2.169 1.455 11.471 1.00 0.00 O ATOM 1460 CB TRP A 630 1.006 1.684 11.125 1.00 0.00 C ATOM 1461 CG TRP A 630 2.285 1.398 10.399 1.00 0.00 C ATOM 1462 CD1 TRP A 630 2.441 1.230 9.053 1.00 0.00 C ATOM 1463 CD2 TRP A 630 3.586 1.248 10.978 1.00 0.00 C ATOM 1464 NE1 TRP A 630 3.761 0.984 8.760 1.00 0.00 N ATOM 1465 CE2 TRP A 630 4.484 0.991 9.924 1.00 0.00 C ATOM 1466 CE3 TRP A 630 4.080 1.308 12.284 1.00 0.00 C ATOM 1467 CZ2 TRP A 630 5.845 0.793 10.138 1.00 0.00 C ATOM 1468 CZ3 TRP A 630 5.431 1.111 12.494 1.00 0.00 C ATOM 1469 CH2 TRP A 630 6.300 0.856 11.426 1.00 0.00 C ATOM 0 H TRP A 630 -0.902 1.025 9.253 1.00 0.00 H new ATOM 0 HA TRP A 630 0.469 -0.376 11.476 1.00 0.00 H new ATOM 0 HB2 TRP A 630 0.543 2.571 10.693 1.00 0.00 H new ATOM 0 HB3 TRP A 630 1.232 1.917 12.166 1.00 0.00 H new ATOM 0 HD1 TRP A 630 1.644 1.283 8.326 1.00 0.00 H new ATOM 0 HE1 TRP A 630 4.141 0.822 7.827 1.00 0.00 H new ATOM 0 HE3 TRP A 630 3.418 1.505 13.114 1.00 0.00 H new ATOM 0 HZ2 TRP A 630 6.518 0.597 9.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 630 5.824 1.154 13.499 1.00 0.00 H new ATOM 0 HH2 TRP A 630 7.351 0.706 11.624 1.00 0.00 H new ATOM 1480 N ASP A 631 -1.133 0.480 13.217 1.00 0.00 N ATOM 1481 CA ASP A 631 -2.219 0.751 14.151 1.00 0.00 C ATOM 1482 C ASP A 631 -2.064 2.146 14.749 1.00 0.00 C ATOM 1483 O ASP A 631 -1.086 2.438 15.435 1.00 0.00 O ATOM 1484 CB ASP A 631 -2.263 -0.316 15.256 1.00 0.00 C ATOM 1485 CG ASP A 631 -2.741 0.225 16.594 1.00 0.00 C ATOM 1486 OD1 ASP A 631 -1.962 0.938 17.260 1.00 0.00 O ATOM 1487 OD2 ASP A 631 -3.896 -0.064 16.972 1.00 0.00 O ATOM 0 H ASP A 631 -0.339 -0.014 13.624 1.00 0.00 H new ATOM 0 HA ASP A 631 -3.163 0.712 13.608 1.00 0.00 H new ATOM 0 HB2 ASP A 631 -2.921 -1.126 14.943 1.00 0.00 H new ATOM 0 HB3 ASP A 631 -1.268 -0.743 15.379 1.00 0.00 H new ATOM 1492 N TYR A 632 -3.037 2.999 14.471 1.00 0.00 N ATOM 1493 CA TYR A 632 -3.028 4.369 14.963 1.00 0.00 C ATOM 1494 C TYR A 632 -3.174 4.419 16.479 1.00 0.00 C ATOM 1495 O TYR A 632 -3.507 3.420 17.117 1.00 0.00 O ATOM 1496 CB TYR A 632 -4.156 5.162 14.307 1.00 0.00 C ATOM 1497 CG TYR A 632 -4.214 6.605 14.745 1.00 0.00 C ATOM 1498 CD1 TYR A 632 -4.897 6.972 15.895 1.00 0.00 C ATOM 1499 CD2 TYR A 632 -3.586 7.598 14.007 1.00 0.00 C ATOM 1500 CE1 TYR A 632 -4.950 8.293 16.301 1.00 0.00 C ATOM 1501 CE2 TYR A 632 -3.633 8.920 14.403 1.00 0.00 C ATOM 1502 CZ TYR A 632 -4.317 9.263 15.551 1.00 0.00 C ATOM 1503 OH TYR A 632 -4.368 10.579 15.950 1.00 0.00 O ATOM 0 H TYR A 632 -3.850 2.764 13.902 1.00 0.00 H new ATOM 0 HA TYR A 632 -2.067 4.814 14.703 1.00 0.00 H new ATOM 0 HB2 TYR A 632 -4.034 5.124 13.225 1.00 0.00 H new ATOM 0 HB3 TYR A 632 -5.107 4.683 14.537 1.00 0.00 H new ATOM 0 HD1 TYR A 632 -5.395 6.215 16.482 1.00 0.00 H new ATOM 0 HD2 TYR A 632 -3.051 7.332 13.107 1.00 0.00 H new ATOM 0 HE1 TYR A 632 -5.484 8.564 17.200 1.00 0.00 H new ATOM 0 HE2 TYR A 632 -3.138 9.681 13.818 1.00 0.00 H new ATOM 0 HH TYR A 632 -3.871 11.133 15.313 1.00 0.00 H new ATOM 1513 N ASP A 633 -2.926 5.595 17.048 1.00 0.00 N ATOM 1514 CA ASP A 633 -3.031 5.792 18.489 1.00 0.00 C ATOM 1515 C ASP A 633 -3.208 7.271 18.817 1.00 0.00 C ATOM 1516 O ASP A 633 -2.384 8.104 18.441 1.00 0.00 O ATOM 1517 CB ASP A 633 -1.787 5.246 19.191 1.00 0.00 C ATOM 1518 CG ASP A 633 -2.019 3.875 19.796 1.00 0.00 C ATOM 1519 OD1 ASP A 633 -3.001 3.210 19.402 1.00 0.00 O ATOM 1520 OD2 ASP A 633 -1.221 3.465 20.665 1.00 0.00 O ATOM 0 H ASP A 633 -2.650 6.429 16.530 1.00 0.00 H new ATOM 0 HA ASP A 633 -3.906 5.249 18.846 1.00 0.00 H new ATOM 0 HB2 ASP A 633 -0.965 5.191 18.477 1.00 0.00 H new ATOM 0 HB3 ASP A 633 -1.482 5.939 19.975 1.00 0.00 H new ATOM 1525 N ILE A 634 -4.289 7.592 19.521 1.00 0.00 N ATOM 1526 CA ILE A 634 -4.570 8.976 19.896 1.00 0.00 C ATOM 1527 C ILE A 634 -3.865 9.347 21.197 1.00 0.00 C ATOM 1528 O ILE A 634 -3.984 8.646 22.201 1.00 0.00 O ATOM 1529 CB ILE A 634 -6.084 9.249 20.054 1.00 0.00 C ATOM 1530 CG1 ILE A 634 -6.847 7.959 20.377 1.00 0.00 C ATOM 1531 CG2 ILE A 634 -6.638 9.908 18.799 1.00 0.00 C ATOM 1532 CD1 ILE A 634 -7.135 7.095 19.166 1.00 0.00 C ATOM 0 H ILE A 634 -4.983 6.917 19.843 1.00 0.00 H new ATOM 0 HA ILE A 634 -4.191 9.592 19.080 1.00 0.00 H new ATOM 0 HB ILE A 634 -6.221 9.933 20.891 1.00 0.00 H new ATOM 0 HG12 ILE A 634 -6.270 7.378 21.096 1.00 0.00 H new ATOM 0 HG13 ILE A 634 -7.790 8.217 20.859 1.00 0.00 H new ATOM 0 HG21 ILE A 634 -7.705 10.094 18.926 1.00 0.00 H new ATOM 0 HG22 ILE A 634 -6.123 10.853 18.627 1.00 0.00 H new ATOM 0 HG23 ILE A 634 -6.484 9.250 17.944 1.00 0.00 H new ATOM 0 HD11 ILE A 634 -7.677 6.202 19.477 1.00 0.00 H new ATOM 0 HD12 ILE A 634 -7.739 7.657 18.454 1.00 0.00 H new ATOM 0 HD13 ILE A 634 -6.196 6.804 18.695 1.00 0.00 H new ATOM 1544 N GLY A 635 -3.131 10.455 21.170 1.00 0.00 N ATOM 1545 CA GLY A 635 -2.417 10.903 22.352 1.00 0.00 C ATOM 1546 C GLY A 635 -1.126 10.141 22.576 1.00 0.00 C ATOM 1547 O GLY A 635 -0.349 10.472 23.471 1.00 0.00 O ATOM 0 H GLY A 635 -3.018 11.051 20.350 1.00 0.00 H new ATOM 0 HA2 GLY A 635 -2.196 11.966 22.257 1.00 0.00 H new ATOM 0 HA3 GLY A 635 -3.059 10.788 23.225 1.00 0.00 H new ATOM 1551 N LYS A 636 -0.898 9.117 21.760 1.00 0.00 N ATOM 1552 CA LYS A 636 0.307 8.304 21.875 1.00 0.00 C ATOM 1553 C LYS A 636 0.890 7.999 20.498 1.00 0.00 C ATOM 1554 O LYS A 636 0.416 8.512 19.484 1.00 0.00 O ATOM 1555 CB LYS A 636 0.002 7.000 22.612 1.00 0.00 C ATOM 1556 CG LYS A 636 -1.075 7.139 23.676 1.00 0.00 C ATOM 1557 CD LYS A 636 -0.482 7.520 25.022 1.00 0.00 C ATOM 1558 CE LYS A 636 -0.451 6.335 25.973 1.00 0.00 C ATOM 1559 NZ LYS A 636 -0.565 6.760 27.395 1.00 0.00 N ATOM 0 H LYS A 636 -1.531 8.831 21.013 1.00 0.00 H new ATOM 0 HA LYS A 636 1.043 8.870 22.445 1.00 0.00 H new ATOM 0 HB2 LYS A 636 -0.310 6.248 21.888 1.00 0.00 H new ATOM 0 HB3 LYS A 636 0.917 6.634 23.078 1.00 0.00 H new ATOM 0 HG2 LYS A 636 -1.797 7.895 23.368 1.00 0.00 H new ATOM 0 HG3 LYS A 636 -1.619 6.199 23.770 1.00 0.00 H new ATOM 0 HD2 LYS A 636 0.530 7.901 24.880 1.00 0.00 H new ATOM 0 HD3 LYS A 636 -1.067 8.327 25.463 1.00 0.00 H new ATOM 0 HE2 LYS A 636 -1.267 5.654 25.731 1.00 0.00 H new ATOM 0 HE3 LYS A 636 0.478 5.782 25.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 636 -0.540 5.922 28.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 636 0.228 7.389 27.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 636 -1.463 7.266 27.535 1.00 0.00 H new ATOM 1573 N SER A 637 1.918 7.157 20.470 1.00 0.00 N ATOM 1574 CA SER A 637 2.565 6.782 19.218 1.00 0.00 C ATOM 1575 C SER A 637 1.798 5.660 18.526 1.00 0.00 C ATOM 1576 O SER A 637 1.023 4.943 19.157 1.00 0.00 O ATOM 1577 CB SER A 637 4.008 6.344 19.475 1.00 0.00 C ATOM 1578 OG SER A 637 4.927 7.267 18.917 1.00 0.00 O ATOM 0 H SER A 637 2.321 6.722 21.300 1.00 0.00 H new ATOM 0 HA SER A 637 2.569 7.654 18.565 1.00 0.00 H new ATOM 0 HB2 SER A 637 4.180 6.258 20.548 1.00 0.00 H new ATOM 0 HB3 SER A 637 4.174 5.356 19.046 1.00 0.00 H new ATOM 0 HG SER A 637 5.842 6.966 19.096 1.00 0.00 H new ATOM 1584 N ASN A 638 2.018 5.515 17.223 1.00 0.00 N ATOM 1585 CA ASN A 638 1.347 4.481 16.445 1.00 0.00 C ATOM 1586 C ASN A 638 2.008 3.122 16.658 1.00 0.00 C ATOM 1587 O ASN A 638 2.947 2.994 17.442 1.00 0.00 O ATOM 1588 CB ASN A 638 1.362 4.839 14.958 1.00 0.00 C ATOM 1589 CG ASN A 638 0.832 6.235 14.693 1.00 0.00 C ATOM 1590 OD1 ASN A 638 1.486 7.046 14.037 1.00 0.00 O ATOM 1591 ND2 ASN A 638 -0.359 6.521 15.204 1.00 0.00 N ATOM 0 H ASN A 638 2.656 6.101 16.684 1.00 0.00 H new ATOM 0 HA ASN A 638 0.314 4.420 16.787 1.00 0.00 H new ATOM 0 HB2 ASN A 638 2.381 4.762 14.579 1.00 0.00 H new ATOM 0 HB3 ASN A 638 0.762 4.115 14.407 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -0.768 7.444 15.059 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -0.866 5.817 15.741 1.00 0.00 H new ATOM 1598 N ASP A 639 1.510 2.112 15.953 1.00 0.00 N ATOM 1599 CA ASP A 639 2.051 0.762 16.060 1.00 0.00 C ATOM 1600 C ASP A 639 2.113 0.096 14.691 1.00 0.00 C ATOM 1601 O ASP A 639 1.307 0.390 13.808 1.00 0.00 O ATOM 1602 CB ASP A 639 1.198 -0.080 17.011 1.00 0.00 C ATOM 1603 CG ASP A 639 1.034 0.571 18.371 1.00 0.00 C ATOM 1604 OD1 ASP A 639 1.919 1.360 18.761 1.00 0.00 O ATOM 1605 OD2 ASP A 639 0.021 0.290 19.045 1.00 0.00 O ATOM 0 H ASP A 639 0.731 2.203 15.300 1.00 0.00 H new ATOM 0 HA ASP A 639 3.063 0.832 16.459 1.00 0.00 H new ATOM 0 HB2 ASP A 639 0.215 -0.241 16.567 1.00 0.00 H new ATOM 0 HB3 ASP A 639 1.657 -1.061 17.134 1.00 0.00 H new ATOM 1610 N TYR A 640 3.076 -0.803 14.518 1.00 0.00 N ATOM 1611 CA TYR A 640 3.242 -1.508 13.255 1.00 0.00 C ATOM 1612 C TYR A 640 2.426 -2.796 13.235 1.00 0.00 C ATOM 1613 O TYR A 640 2.700 -3.729 13.990 1.00 0.00 O ATOM 1614 CB TYR A 640 4.717 -1.827 13.013 1.00 0.00 C ATOM 1615 CG TYR A 640 5.067 -1.984 11.551 1.00 0.00 C ATOM 1616 CD1 TYR A 640 4.073 -2.152 10.595 1.00 0.00 C ATOM 1617 CD2 TYR A 640 6.389 -1.963 11.127 1.00 0.00 C ATOM 1618 CE1 TYR A 640 4.388 -2.296 9.256 1.00 0.00 C ATOM 1619 CE2 TYR A 640 6.712 -2.107 9.791 1.00 0.00 C ATOM 1620 CZ TYR A 640 5.708 -2.274 8.861 1.00 0.00 C ATOM 1621 OH TYR A 640 6.026 -2.417 7.530 1.00 0.00 O ATOM 0 H TYR A 640 3.752 -1.060 15.237 1.00 0.00 H new ATOM 0 HA TYR A 640 2.881 -0.857 12.459 1.00 0.00 H new ATOM 0 HB2 TYR A 640 5.328 -1.032 13.441 1.00 0.00 H new ATOM 0 HB3 TYR A 640 4.973 -2.746 13.541 1.00 0.00 H new ATOM 0 HD1 TYR A 640 3.038 -2.170 10.902 1.00 0.00 H new ATOM 0 HD2 TYR A 640 7.178 -1.832 11.853 1.00 0.00 H new ATOM 0 HE1 TYR A 640 3.604 -2.425 8.524 1.00 0.00 H new ATOM 0 HE2 TYR A 640 7.745 -2.089 9.477 1.00 0.00 H new ATOM 0 HH TYR A 640 6.999 -2.378 7.420 1.00 0.00 H new ATOM 1631 N ILE A 641 1.426 -2.840 12.361 1.00 0.00 N ATOM 1632 CA ILE A 641 0.574 -4.015 12.236 1.00 0.00 C ATOM 1633 C ILE A 641 1.128 -4.979 11.193 1.00 0.00 C ATOM 1634 O ILE A 641 1.085 -6.196 11.372 1.00 0.00 O ATOM 1635 CB ILE A 641 -0.867 -3.628 11.852 1.00 0.00 C ATOM 1636 CG1 ILE A 641 -1.532 -2.857 12.995 1.00 0.00 C ATOM 1637 CG2 ILE A 641 -1.675 -4.869 11.500 1.00 0.00 C ATOM 1638 CD1 ILE A 641 -3.027 -2.693 12.823 1.00 0.00 C ATOM 0 H ILE A 641 1.186 -2.076 11.730 1.00 0.00 H new ATOM 0 HA ILE A 641 0.559 -4.504 13.210 1.00 0.00 H new ATOM 0 HB ILE A 641 -0.833 -2.982 10.975 1.00 0.00 H new ATOM 0 HG12 ILE A 641 -1.337 -3.375 13.934 1.00 0.00 H new ATOM 0 HG13 ILE A 641 -1.073 -1.871 13.073 1.00 0.00 H new ATOM 0 HG21 ILE A 641 -2.690 -4.578 11.231 1.00 0.00 H new ATOM 0 HG22 ILE A 641 -1.209 -5.380 10.657 1.00 0.00 H new ATOM 0 HG23 ILE A 641 -1.705 -5.539 12.359 1.00 0.00 H new ATOM 0 HD11 ILE A 641 -3.432 -2.138 13.669 1.00 0.00 H new ATOM 0 HD12 ILE A 641 -3.230 -2.148 11.901 1.00 0.00 H new ATOM 0 HD13 ILE A 641 -3.498 -3.675 12.775 1.00 0.00 H new ATOM 1650 N GLY A 642 1.650 -4.426 10.102 1.00 0.00 N ATOM 1651 CA GLY A 642 2.208 -5.250 9.048 1.00 0.00 C ATOM 1652 C GLY A 642 2.119 -4.585 7.689 1.00 0.00 C ATOM 1653 O GLY A 642 1.323 -3.667 7.492 1.00 0.00 O ATOM 0 H GLY A 642 1.696 -3.422 9.930 1.00 0.00 H new ATOM 0 HA2 GLY A 642 3.251 -5.469 9.275 1.00 0.00 H new ATOM 0 HA3 GLY A 642 1.681 -6.204 9.018 1.00 0.00 H new ATOM 1657 N GLY A 643 2.939 -5.044 6.750 1.00 0.00 N ATOM 1658 CA GLY A 643 2.932 -4.469 5.418 1.00 0.00 C ATOM 1659 C GLY A 643 3.547 -5.385 4.379 1.00 0.00 C ATOM 1660 O GLY A 643 3.812 -6.556 4.650 1.00 0.00 O ATOM 0 H GLY A 643 3.607 -5.802 6.887 1.00 0.00 H new ATOM 0 HA2 GLY A 643 1.906 -4.240 5.132 1.00 0.00 H new ATOM 0 HA3 GLY A 643 3.477 -3.525 5.432 1.00 0.00 H new ATOM 1664 N CYS A 644 3.778 -4.845 3.185 1.00 0.00 N ATOM 1665 CA CYS A 644 4.369 -5.614 2.097 1.00 0.00 C ATOM 1666 C CYS A 644 4.970 -4.685 1.049 1.00 0.00 C ATOM 1667 O CYS A 644 4.476 -3.578 0.829 1.00 0.00 O ATOM 1668 CB CYS A 644 3.319 -6.521 1.451 1.00 0.00 C ATOM 1669 SG CYS A 644 3.448 -8.259 1.933 1.00 0.00 S ATOM 0 H CYS A 644 3.564 -3.876 2.948 1.00 0.00 H new ATOM 0 HA CYS A 644 5.164 -6.235 2.511 1.00 0.00 H new ATOM 0 HB2 CYS A 644 2.327 -6.155 1.714 1.00 0.00 H new ATOM 0 HB3 CYS A 644 3.409 -6.448 0.367 1.00 0.00 H new ATOM 0 HG CYS A 644 2.606 -8.507 2.892 1.00 0.00 H new ATOM 1675 N GLN A 645 6.041 -5.138 0.405 1.00 0.00 N ATOM 1676 CA GLN A 645 6.709 -4.341 -0.617 1.00 0.00 C ATOM 1677 C GLN A 645 6.221 -4.723 -2.010 1.00 0.00 C ATOM 1678 O GLN A 645 5.885 -5.879 -2.266 1.00 0.00 O ATOM 1679 CB GLN A 645 8.226 -4.525 -0.527 1.00 0.00 C ATOM 1680 CG GLN A 645 8.892 -3.611 0.490 1.00 0.00 C ATOM 1681 CD GLN A 645 10.406 -3.697 0.450 1.00 0.00 C ATOM 1682 OE1 GLN A 645 10.974 -4.786 0.364 1.00 0.00 O ATOM 1683 NE2 GLN A 645 11.066 -2.547 0.513 1.00 0.00 N ATOM 0 H GLN A 645 6.464 -6.051 0.572 1.00 0.00 H new ATOM 0 HA GLN A 645 6.466 -3.293 -0.441 1.00 0.00 H new ATOM 0 HB2 GLN A 645 8.443 -5.561 -0.268 1.00 0.00 H new ATOM 0 HB3 GLN A 645 8.664 -4.343 -1.508 1.00 0.00 H new ATOM 0 HG2 GLN A 645 8.585 -2.582 0.303 1.00 0.00 H new ATOM 0 HG3 GLN A 645 8.543 -3.871 1.490 1.00 0.00 H new ATOM 0 HE21 GLN A 645 10.553 -1.668 0.584 1.00 0.00 H new ATOM 0 HE22 GLN A 645 12.086 -2.542 0.491 1.00 0.00 H new ATOM 1692 N LEU A 646 6.182 -3.745 -2.908 1.00 0.00 N ATOM 1693 CA LEU A 646 5.734 -3.980 -4.274 1.00 0.00 C ATOM 1694 C LEU A 646 6.663 -3.304 -5.277 1.00 0.00 C ATOM 1695 O LEU A 646 6.443 -2.160 -5.672 1.00 0.00 O ATOM 1696 CB LEU A 646 4.304 -3.471 -4.459 1.00 0.00 C ATOM 1697 CG LEU A 646 3.217 -4.381 -3.885 1.00 0.00 C ATOM 1698 CD1 LEU A 646 1.836 -3.828 -4.204 1.00 0.00 C ATOM 1699 CD2 LEU A 646 3.367 -5.794 -4.426 1.00 0.00 C ATOM 0 H LEU A 646 6.456 -2.782 -2.714 1.00 0.00 H new ATOM 0 HA LEU A 646 5.755 -5.054 -4.456 1.00 0.00 H new ATOM 0 HB2 LEU A 646 4.220 -2.490 -3.992 1.00 0.00 H new ATOM 0 HB3 LEU A 646 4.118 -3.334 -5.524 1.00 0.00 H new ATOM 0 HG LEU A 646 3.330 -4.415 -2.801 1.00 0.00 H new ATOM 0 HD11 LEU A 646 1.075 -4.488 -3.788 1.00 0.00 H new ATOM 0 HD12 LEU A 646 1.732 -2.834 -3.768 1.00 0.00 H new ATOM 0 HD13 LEU A 646 1.710 -3.765 -5.285 1.00 0.00 H new ATOM 0 HD21 LEU A 646 2.586 -6.429 -4.008 1.00 0.00 H new ATOM 0 HD22 LEU A 646 3.279 -5.779 -5.512 1.00 0.00 H new ATOM 0 HD23 LEU A 646 4.344 -6.189 -4.146 1.00 0.00 H new ATOM 1711 N GLY A 647 7.698 -4.028 -5.691 1.00 0.00 N ATOM 1712 CA GLY A 647 8.646 -3.496 -6.652 1.00 0.00 C ATOM 1713 C GLY A 647 8.940 -4.494 -7.749 1.00 0.00 C ATOM 1714 O GLY A 647 8.960 -5.700 -7.502 1.00 0.00 O ATOM 0 H GLY A 647 7.897 -4.978 -5.376 1.00 0.00 H new ATOM 0 HA2 GLY A 647 8.248 -2.580 -7.089 1.00 0.00 H new ATOM 0 HA3 GLY A 647 9.572 -3.230 -6.142 1.00 0.00 H new ATOM 1718 N ILE A 648 9.152 -4.007 -8.965 1.00 0.00 N ATOM 1719 CA ILE A 648 9.420 -4.880 -10.082 1.00 0.00 C ATOM 1720 C ILE A 648 10.679 -5.715 -9.853 1.00 0.00 C ATOM 1721 O ILE A 648 10.931 -6.686 -10.566 1.00 0.00 O ATOM 1722 CB ILE A 648 9.524 -4.081 -11.392 1.00 0.00 C ATOM 1723 CG1 ILE A 648 8.836 -4.841 -12.509 1.00 0.00 C ATOM 1724 CG2 ILE A 648 10.966 -3.765 -11.750 1.00 0.00 C ATOM 1725 CD1 ILE A 648 9.033 -4.231 -13.875 1.00 0.00 C ATOM 0 H ILE A 648 9.142 -3.013 -9.195 1.00 0.00 H new ATOM 0 HA ILE A 648 8.579 -5.569 -10.168 1.00 0.00 H new ATOM 0 HB ILE A 648 9.021 -3.125 -11.250 1.00 0.00 H new ATOM 0 HG12 ILE A 648 9.209 -5.865 -12.522 1.00 0.00 H new ATOM 0 HG13 ILE A 648 7.768 -4.893 -12.296 1.00 0.00 H new ATOM 0 HG21 ILE A 648 10.994 -3.200 -12.682 1.00 0.00 H new ATOM 0 HG22 ILE A 648 11.418 -3.174 -10.953 1.00 0.00 H new ATOM 0 HG23 ILE A 648 11.523 -4.694 -11.872 1.00 0.00 H new ATOM 0 HD11 ILE A 648 8.511 -4.831 -14.620 1.00 0.00 H new ATOM 0 HD12 ILE A 648 8.634 -3.217 -13.882 1.00 0.00 H new ATOM 0 HD13 ILE A 648 10.097 -4.204 -14.111 1.00 0.00 H new ATOM 1737 N SER A 649 11.460 -5.340 -8.847 1.00 0.00 N ATOM 1738 CA SER A 649 12.678 -6.069 -8.520 1.00 0.00 C ATOM 1739 C SER A 649 12.360 -7.230 -7.581 1.00 0.00 C ATOM 1740 O SER A 649 13.256 -7.823 -6.979 1.00 0.00 O ATOM 1741 CB SER A 649 13.703 -5.136 -7.874 1.00 0.00 C ATOM 1742 OG SER A 649 15.024 -5.605 -8.084 1.00 0.00 O ATOM 0 H SER A 649 11.272 -4.538 -8.246 1.00 0.00 H new ATOM 0 HA SER A 649 13.102 -6.466 -9.442 1.00 0.00 H new ATOM 0 HB2 SER A 649 13.599 -4.134 -8.289 1.00 0.00 H new ATOM 0 HB3 SER A 649 13.507 -5.060 -6.805 1.00 0.00 H new ATOM 0 HG SER A 649 15.094 -6.534 -7.780 1.00 0.00 H new ATOM 1748 N ALA A 650 11.071 -7.539 -7.457 1.00 0.00 N ATOM 1749 CA ALA A 650 10.614 -8.617 -6.593 1.00 0.00 C ATOM 1750 C ALA A 650 10.464 -9.922 -7.367 1.00 0.00 C ATOM 1751 O ALA A 650 10.591 -9.950 -8.591 1.00 0.00 O ATOM 1752 CB ALA A 650 9.289 -8.235 -5.952 1.00 0.00 C ATOM 0 H ALA A 650 10.322 -7.052 -7.949 1.00 0.00 H new ATOM 0 HA ALA A 650 11.363 -8.772 -5.816 1.00 0.00 H new ATOM 0 HB1 ALA A 650 8.950 -9.045 -5.306 1.00 0.00 H new ATOM 0 HB2 ALA A 650 9.419 -7.329 -5.360 1.00 0.00 H new ATOM 0 HB3 ALA A 650 8.546 -8.057 -6.730 1.00 0.00 H new ATOM 1802 N ARG A 654 4.723 -10.166 -5.739 1.00 0.00 N ATOM 1803 CA ARG A 654 4.846 -8.717 -5.651 1.00 0.00 C ATOM 1804 C ARG A 654 5.137 -8.118 -7.020 1.00 0.00 C ATOM 1805 O ARG A 654 4.785 -6.972 -7.297 1.00 0.00 O ATOM 1806 CB ARG A 654 5.957 -8.340 -4.670 1.00 0.00 C ATOM 1807 CG ARG A 654 6.121 -9.334 -3.532 1.00 0.00 C ATOM 1808 CD ARG A 654 6.409 -8.638 -2.223 1.00 0.00 C ATOM 1809 NE ARG A 654 7.263 -9.439 -1.351 1.00 0.00 N ATOM 1810 CZ ARG A 654 6.801 -10.357 -0.510 1.00 0.00 C ATOM 1811 NH1 ARG A 654 5.497 -10.593 -0.432 1.00 0.00 N ATOM 1812 NH2 ARG A 654 7.640 -11.043 0.254 1.00 0.00 N ATOM 0 HA ARG A 654 3.900 -8.314 -5.290 1.00 0.00 H new ATOM 0 HB2 ARG A 654 6.899 -8.262 -5.212 1.00 0.00 H new ATOM 0 HB3 ARG A 654 5.745 -7.355 -4.254 1.00 0.00 H new ATOM 0 HG2 ARG A 654 5.214 -9.931 -3.436 1.00 0.00 H new ATOM 0 HG3 ARG A 654 6.933 -10.023 -3.764 1.00 0.00 H new ATOM 0 HD2 ARG A 654 6.890 -7.680 -2.421 1.00 0.00 H new ATOM 0 HD3 ARG A 654 5.470 -8.424 -1.713 1.00 0.00 H new ATOM 0 HE ARG A 654 8.271 -9.285 -1.390 1.00 0.00 H new ATOM 0 HH11 ARG A 654 4.848 -10.069 -1.019 1.00 0.00 H new ATOM 0 HH12 ARG A 654 5.144 -11.299 0.215 1.00 0.00 H new ATOM 0 HH21 ARG A 654 8.643 -10.866 0.197 1.00 0.00 H new ATOM 0 HH22 ARG A 654 7.282 -11.748 0.899 1.00 0.00 H new ATOM 1826 N LEU A 655 5.782 -8.905 -7.871 1.00 0.00 N ATOM 1827 CA LEU A 655 6.124 -8.457 -9.215 1.00 0.00 C ATOM 1828 C LEU A 655 4.926 -8.568 -10.149 1.00 0.00 C ATOM 1829 O LEU A 655 4.601 -7.628 -10.875 1.00 0.00 O ATOM 1830 CB LEU A 655 7.287 -9.280 -9.771 1.00 0.00 C ATOM 1831 CG LEU A 655 7.757 -8.863 -11.165 1.00 0.00 C ATOM 1832 CD1 LEU A 655 8.595 -7.601 -11.082 1.00 0.00 C ATOM 1833 CD2 LEU A 655 8.543 -9.986 -11.824 1.00 0.00 C ATOM 0 H LEU A 655 6.079 -9.857 -7.655 1.00 0.00 H new ATOM 0 HA LEU A 655 6.421 -7.410 -9.153 1.00 0.00 H new ATOM 0 HB2 LEU A 655 8.128 -9.206 -9.082 1.00 0.00 H new ATOM 0 HB3 LEU A 655 6.990 -10.328 -9.801 1.00 0.00 H new ATOM 0 HG LEU A 655 6.880 -8.657 -11.779 1.00 0.00 H new ATOM 0 HD11 LEU A 655 8.923 -7.316 -12.082 1.00 0.00 H new ATOM 0 HD12 LEU A 655 7.999 -6.796 -10.652 1.00 0.00 H new ATOM 0 HD13 LEU A 655 9.466 -7.783 -10.453 1.00 0.00 H new ATOM 0 HD21 LEU A 655 8.868 -9.669 -12.815 1.00 0.00 H new ATOM 0 HD22 LEU A 655 9.415 -10.226 -11.215 1.00 0.00 H new ATOM 0 HD23 LEU A 655 7.910 -10.869 -11.915 1.00 0.00 H new ATOM 1845 N LYS A 656 4.278 -9.727 -10.132 1.00 0.00 N ATOM 1846 CA LYS A 656 3.119 -9.965 -10.984 1.00 0.00 C ATOM 1847 C LYS A 656 2.104 -8.834 -10.856 1.00 0.00 C ATOM 1848 O LYS A 656 1.582 -8.347 -11.857 1.00 0.00 O ATOM 1849 CB LYS A 656 2.466 -11.302 -10.632 1.00 0.00 C ATOM 1850 CG LYS A 656 3.359 -12.504 -10.899 1.00 0.00 C ATOM 1851 CD LYS A 656 2.634 -13.811 -10.628 1.00 0.00 C ATOM 1852 CE LYS A 656 3.481 -14.754 -9.789 1.00 0.00 C ATOM 1853 NZ LYS A 656 4.212 -15.743 -10.630 1.00 0.00 N ATOM 0 H LYS A 656 4.535 -10.516 -9.538 1.00 0.00 H new ATOM 0 HA LYS A 656 3.462 -10.000 -12.018 1.00 0.00 H new ATOM 0 HB2 LYS A 656 2.187 -11.294 -9.578 1.00 0.00 H new ATOM 0 HB3 LYS A 656 1.545 -11.409 -11.205 1.00 0.00 H new ATOM 0 HG2 LYS A 656 3.698 -12.483 -11.935 1.00 0.00 H new ATOM 0 HG3 LYS A 656 4.248 -12.444 -10.272 1.00 0.00 H new ATOM 0 HD2 LYS A 656 1.695 -13.608 -10.113 1.00 0.00 H new ATOM 0 HD3 LYS A 656 2.381 -14.291 -11.573 1.00 0.00 H new ATOM 0 HE2 LYS A 656 4.196 -14.176 -9.204 1.00 0.00 H new ATOM 0 HE3 LYS A 656 2.843 -15.282 -9.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 656 4.777 -16.367 -10.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 656 3.529 -16.312 -11.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 656 4.841 -15.241 -11.289 1.00 0.00 H new ATOM 1867 N HIS A 657 1.830 -8.418 -9.624 1.00 0.00 N ATOM 1868 CA HIS A 657 0.877 -7.341 -9.379 1.00 0.00 C ATOM 1869 C HIS A 657 1.486 -5.992 -9.744 1.00 0.00 C ATOM 1870 O HIS A 657 1.063 -5.344 -10.702 1.00 0.00 O ATOM 1871 CB HIS A 657 0.439 -7.334 -7.914 1.00 0.00 C ATOM 1872 CG HIS A 657 -0.618 -6.317 -7.619 1.00 0.00 C ATOM 1873 ND1 HIS A 657 -1.094 -6.067 -6.348 1.00 0.00 N ATOM 1874 CD2 HIS A 657 -1.296 -5.485 -8.442 1.00 0.00 C ATOM 1875 CE1 HIS A 657 -2.020 -5.126 -6.405 1.00 0.00 C ATOM 1876 NE2 HIS A 657 -2.160 -4.756 -7.664 1.00 0.00 N ATOM 0 H HIS A 657 2.253 -8.809 -8.782 1.00 0.00 H new ATOM 0 HA HIS A 657 0.003 -7.513 -10.007 1.00 0.00 H new ATOM 0 HB2 HIS A 657 0.066 -8.323 -7.648 1.00 0.00 H new ATOM 0 HB3 HIS A 657 1.307 -7.140 -7.283 1.00 0.00 H new ATOM 0 HD2 HIS A 657 -1.179 -5.409 -9.513 1.00 0.00 H new ATOM 0 HE1 HIS A 657 -2.569 -4.728 -5.564 1.00 0.00 H new ATOM 0 HE2 HIS A 657 -2.806 -4.043 -8.004 1.00 0.00 H new ATOM 1885 N TRP A 658 2.487 -5.577 -8.975 1.00 0.00 N ATOM 1886 CA TRP A 658 3.163 -4.308 -9.215 1.00 0.00 C ATOM 1887 C TRP A 658 3.431 -4.111 -10.704 1.00 0.00 C ATOM 1888 O TRP A 658 2.739 -3.347 -11.378 1.00 0.00 O ATOM 1889 CB TRP A 658 4.482 -4.262 -8.439 1.00 0.00 C ATOM 1890 CG TRP A 658 5.394 -3.165 -8.891 1.00 0.00 C ATOM 1891 CD1 TRP A 658 6.611 -3.303 -9.494 1.00 0.00 C ATOM 1892 CD2 TRP A 658 5.159 -1.760 -8.776 1.00 0.00 C ATOM 1893 NE1 TRP A 658 7.148 -2.067 -9.762 1.00 0.00 N ATOM 1894 CE2 TRP A 658 6.273 -1.103 -9.329 1.00 0.00 C ATOM 1895 CE3 TRP A 658 4.111 -0.994 -8.257 1.00 0.00 C ATOM 1896 CZ2 TRP A 658 6.366 0.285 -9.378 1.00 0.00 C ATOM 1897 CZ3 TRP A 658 4.205 0.383 -8.307 1.00 0.00 C ATOM 1898 CH2 TRP A 658 5.326 1.011 -8.865 1.00 0.00 C ATOM 0 H TRP A 658 2.848 -6.102 -8.179 1.00 0.00 H new ATOM 0 HA TRP A 658 2.514 -3.503 -8.870 1.00 0.00 H new ATOM 0 HB2 TRP A 658 4.268 -4.133 -7.378 1.00 0.00 H new ATOM 0 HB3 TRP A 658 4.993 -5.219 -8.547 1.00 0.00 H new ATOM 0 HD1 TRP A 658 7.083 -4.246 -9.726 1.00 0.00 H new ATOM 0 HE1 TRP A 658 8.048 -1.895 -10.209 1.00 0.00 H new ATOM 0 HE3 TRP A 658 3.244 -1.470 -7.825 1.00 0.00 H new ATOM 0 HZ2 TRP A 658 7.230 0.772 -9.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 658 3.401 0.985 -7.910 1.00 0.00 H new ATOM 0 HH2 TRP A 658 5.370 2.090 -8.891 1.00 0.00 H new ATOM 1909 N TYR A 659 4.439 -4.810 -11.202 1.00 0.00 N ATOM 1910 CA TYR A 659 4.824 -4.738 -12.605 1.00 0.00 C ATOM 1911 C TYR A 659 3.600 -4.682 -13.519 1.00 0.00 C ATOM 1912 O TYR A 659 3.481 -3.780 -14.342 1.00 0.00 O ATOM 1913 CB TYR A 659 5.691 -5.956 -12.936 1.00 0.00 C ATOM 1914 CG TYR A 659 6.412 -5.920 -14.272 1.00 0.00 C ATOM 1915 CD1 TYR A 659 5.913 -5.218 -15.365 1.00 0.00 C ATOM 1916 CD2 TYR A 659 7.595 -6.626 -14.442 1.00 0.00 C ATOM 1917 CE1 TYR A 659 6.565 -5.220 -16.575 1.00 0.00 C ATOM 1918 CE2 TYR A 659 8.261 -6.628 -15.650 1.00 0.00 C ATOM 1919 CZ TYR A 659 7.742 -5.925 -16.716 1.00 0.00 C ATOM 1920 OH TYR A 659 8.397 -5.929 -17.925 1.00 0.00 O ATOM 0 H TYR A 659 5.014 -5.443 -10.646 1.00 0.00 H new ATOM 0 HA TYR A 659 5.390 -3.822 -12.774 1.00 0.00 H new ATOM 0 HB2 TYR A 659 6.435 -6.072 -12.148 1.00 0.00 H new ATOM 0 HB3 TYR A 659 5.059 -6.844 -12.911 1.00 0.00 H new ATOM 0 HD1 TYR A 659 4.994 -4.660 -15.260 1.00 0.00 H new ATOM 0 HD2 TYR A 659 8.002 -7.185 -13.612 1.00 0.00 H new ATOM 0 HE1 TYR A 659 6.157 -4.672 -17.412 1.00 0.00 H new ATOM 0 HE2 TYR A 659 9.184 -7.177 -15.760 1.00 0.00 H new ATOM 0 HH TYR A 659 9.210 -6.472 -17.855 1.00 0.00 H new ATOM 1930 N GLU A 660 2.695 -5.644 -13.380 1.00 0.00 N ATOM 1931 CA GLU A 660 1.503 -5.687 -14.217 1.00 0.00 C ATOM 1932 C GLU A 660 0.984 -4.285 -14.476 1.00 0.00 C ATOM 1933 O GLU A 660 0.659 -3.922 -15.607 1.00 0.00 O ATOM 1934 CB GLU A 660 0.407 -6.520 -13.552 1.00 0.00 C ATOM 1935 CG GLU A 660 0.252 -7.916 -14.128 1.00 0.00 C ATOM 1936 CD GLU A 660 0.053 -7.907 -15.631 1.00 0.00 C ATOM 1937 OE1 GLU A 660 -0.926 -7.286 -16.097 1.00 0.00 O ATOM 1938 OE2 GLU A 660 0.875 -8.522 -16.343 1.00 0.00 O ATOM 0 H GLU A 660 2.763 -6.401 -12.699 1.00 0.00 H new ATOM 0 HA GLU A 660 1.776 -6.149 -15.166 1.00 0.00 H new ATOM 0 HB2 GLU A 660 0.623 -6.600 -12.487 1.00 0.00 H new ATOM 0 HB3 GLU A 660 -0.542 -5.993 -13.646 1.00 0.00 H new ATOM 0 HG2 GLU A 660 1.136 -8.505 -13.886 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -0.598 -8.408 -13.655 1.00 0.00 H new ATOM 1945 N CYS A 661 0.914 -3.499 -13.413 1.00 0.00 N ATOM 1946 CA CYS A 661 0.441 -2.125 -13.513 1.00 0.00 C ATOM 1947 C CYS A 661 1.171 -1.395 -14.632 1.00 0.00 C ATOM 1948 O CYS A 661 0.573 -0.630 -15.387 1.00 0.00 O ATOM 1949 CB CYS A 661 0.645 -1.390 -12.188 1.00 0.00 C ATOM 1950 SG CYS A 661 0.262 0.375 -12.258 1.00 0.00 S ATOM 0 H CYS A 661 1.178 -3.788 -12.471 1.00 0.00 H new ATOM 0 HA CYS A 661 -0.625 -2.144 -13.741 1.00 0.00 H new ATOM 0 HB2 CYS A 661 0.021 -1.857 -11.426 1.00 0.00 H new ATOM 0 HB3 CYS A 661 1.681 -1.514 -11.871 1.00 0.00 H new ATOM 0 HG CYS A 661 1.364 1.054 -12.374 1.00 0.00 H new ATOM 1956 N LEU A 662 2.470 -1.649 -14.732 1.00 0.00 N ATOM 1957 CA LEU A 662 3.302 -1.034 -15.757 1.00 0.00 C ATOM 1958 C LEU A 662 2.880 -1.491 -17.149 1.00 0.00 C ATOM 1959 O LEU A 662 2.950 -0.725 -18.111 1.00 0.00 O ATOM 1960 CB LEU A 662 4.770 -1.378 -15.515 1.00 0.00 C ATOM 1961 CG LEU A 662 5.510 -0.413 -14.591 1.00 0.00 C ATOM 1962 CD1 LEU A 662 5.680 -1.015 -13.207 1.00 0.00 C ATOM 1963 CD2 LEU A 662 6.859 -0.056 -15.182 1.00 0.00 C ATOM 0 H LEU A 662 2.973 -2.282 -14.110 1.00 0.00 H new ATOM 0 HA LEU A 662 3.173 0.047 -15.699 1.00 0.00 H new ATOM 0 HB2 LEU A 662 4.829 -2.381 -15.092 1.00 0.00 H new ATOM 0 HB3 LEU A 662 5.285 -1.406 -16.475 1.00 0.00 H new ATOM 0 HG LEU A 662 4.916 0.496 -14.495 1.00 0.00 H new ATOM 0 HD11 LEU A 662 6.210 -0.310 -12.566 1.00 0.00 H new ATOM 0 HD12 LEU A 662 4.700 -1.228 -12.780 1.00 0.00 H new ATOM 0 HD13 LEU A 662 6.253 -1.940 -13.280 1.00 0.00 H new ATOM 0 HD21 LEU A 662 7.378 0.632 -14.515 1.00 0.00 H new ATOM 0 HD22 LEU A 662 7.454 -0.961 -15.304 1.00 0.00 H new ATOM 0 HD23 LEU A 662 6.717 0.418 -16.153 1.00 0.00 H new ATOM 1975 N LYS A 663 2.428 -2.736 -17.251 1.00 0.00 N ATOM 1976 CA LYS A 663 1.982 -3.280 -18.524 1.00 0.00 C ATOM 1977 C LYS A 663 0.583 -2.764 -18.832 1.00 0.00 C ATOM 1978 O LYS A 663 0.261 -2.434 -19.973 1.00 0.00 O ATOM 1979 CB LYS A 663 2.019 -4.817 -18.482 1.00 0.00 C ATOM 1980 CG LYS A 663 0.656 -5.494 -18.572 1.00 0.00 C ATOM 1981 CD LYS A 663 0.786 -6.954 -18.979 1.00 0.00 C ATOM 1982 CE LYS A 663 1.681 -7.114 -20.199 1.00 0.00 C ATOM 1983 NZ LYS A 663 1.108 -8.069 -21.187 1.00 0.00 N ATOM 0 H LYS A 663 2.362 -3.385 -16.467 1.00 0.00 H new ATOM 0 HA LYS A 663 2.651 -2.954 -19.321 1.00 0.00 H new ATOM 0 HB2 LYS A 663 2.641 -5.174 -19.303 1.00 0.00 H new ATOM 0 HB3 LYS A 663 2.503 -5.129 -17.557 1.00 0.00 H new ATOM 0 HG2 LYS A 663 0.151 -5.427 -17.608 1.00 0.00 H new ATOM 0 HG3 LYS A 663 0.034 -4.967 -19.295 1.00 0.00 H new ATOM 0 HD2 LYS A 663 1.195 -7.530 -18.148 1.00 0.00 H new ATOM 0 HD3 LYS A 663 -0.201 -7.362 -19.194 1.00 0.00 H new ATOM 0 HE2 LYS A 663 1.825 -6.143 -20.674 1.00 0.00 H new ATOM 0 HE3 LYS A 663 2.664 -7.464 -19.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 663 1.748 -8.150 -22.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 663 0.994 -9.002 -20.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 663 0.181 -7.723 -21.507 1.00 0.00 H new ATOM 1997 N ASN A 664 -0.235 -2.689 -17.790 1.00 0.00 N ATOM 1998 CA ASN A 664 -1.599 -2.202 -17.919 1.00 0.00 C ATOM 1999 C ASN A 664 -1.785 -0.927 -17.102 1.00 0.00 C ATOM 2000 O ASN A 664 -1.914 -0.977 -15.879 1.00 0.00 O ATOM 2001 CB ASN A 664 -2.595 -3.269 -17.462 1.00 0.00 C ATOM 2002 CG ASN A 664 -2.719 -4.407 -18.455 1.00 0.00 C ATOM 2003 OD1 ASN A 664 -3.334 -4.262 -19.512 1.00 0.00 O ATOM 2004 ND2 ASN A 664 -2.132 -5.551 -18.120 1.00 0.00 N ATOM 0 H ASN A 664 0.026 -2.961 -16.842 1.00 0.00 H new ATOM 0 HA ASN A 664 -1.787 -1.978 -18.969 1.00 0.00 H new ATOM 0 HB2 ASN A 664 -2.281 -3.666 -16.497 1.00 0.00 H new ATOM 0 HB3 ASN A 664 -3.573 -2.810 -17.315 1.00 0.00 H new ATOM 0 HD21 ASN A 664 -2.181 -6.353 -18.749 1.00 0.00 H new ATOM 0 HD22 ASN A 664 -1.633 -5.628 -17.234 1.00 0.00 H new ATOM 2011 N LYS A 665 -1.791 0.213 -17.783 1.00 0.00 N ATOM 2012 CA LYS A 665 -1.954 1.497 -17.116 1.00 0.00 C ATOM 2013 C LYS A 665 -3.428 1.858 -17.003 1.00 0.00 C ATOM 2014 O LYS A 665 -4.010 1.797 -15.924 1.00 0.00 O ATOM 2015 CB LYS A 665 -1.199 2.604 -17.862 1.00 0.00 C ATOM 2016 CG LYS A 665 -0.604 2.179 -19.199 1.00 0.00 C ATOM 2017 CD LYS A 665 0.552 1.205 -19.027 1.00 0.00 C ATOM 2018 CE LYS A 665 1.584 1.734 -18.049 1.00 0.00 C ATOM 2019 NZ LYS A 665 1.303 1.303 -16.652 1.00 0.00 N ATOM 0 H LYS A 665 -1.685 0.273 -18.796 1.00 0.00 H new ATOM 0 HA LYS A 665 -1.534 1.408 -16.114 1.00 0.00 H new ATOM 0 HB2 LYS A 665 -1.879 3.439 -18.031 1.00 0.00 H new ATOM 0 HB3 LYS A 665 -0.396 2.972 -17.223 1.00 0.00 H new ATOM 0 HG2 LYS A 665 -1.379 1.717 -19.810 1.00 0.00 H new ATOM 0 HG3 LYS A 665 -0.257 3.061 -19.738 1.00 0.00 H new ATOM 0 HD2 LYS A 665 0.172 0.247 -18.673 1.00 0.00 H new ATOM 0 HD3 LYS A 665 1.024 1.024 -19.993 1.00 0.00 H new ATOM 0 HE2 LYS A 665 2.574 1.386 -18.343 1.00 0.00 H new ATOM 0 HE3 LYS A 665 1.602 2.823 -18.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 665 2.134 1.493 -16.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 665 0.485 1.830 -16.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 665 1.093 0.284 -16.638 1.00 0.00 H new ATOM 2033 N ASP A 666 -4.029 2.226 -18.126 1.00 0.00 N ATOM 2034 CA ASP A 666 -5.441 2.589 -18.153 1.00 0.00 C ATOM 2035 C ASP A 666 -6.255 1.671 -17.244 1.00 0.00 C ATOM 2036 O ASP A 666 -7.291 2.069 -16.710 1.00 0.00 O ATOM 2037 CB ASP A 666 -5.981 2.518 -19.583 1.00 0.00 C ATOM 2038 CG ASP A 666 -5.157 3.340 -20.554 1.00 0.00 C ATOM 2039 OD1 ASP A 666 -4.418 4.237 -20.094 1.00 0.00 O ATOM 2040 OD2 ASP A 666 -5.250 3.089 -21.773 1.00 0.00 O ATOM 0 H ASP A 666 -3.562 2.281 -19.031 1.00 0.00 H new ATOM 0 HA ASP A 666 -5.535 3.611 -17.787 1.00 0.00 H new ATOM 0 HB2 ASP A 666 -5.995 1.479 -19.912 1.00 0.00 H new ATOM 0 HB3 ASP A 666 -7.012 2.871 -19.597 1.00 0.00 H new ATOM 2045 N LYS A 667 -5.775 0.443 -17.068 1.00 0.00 N ATOM 2046 CA LYS A 667 -6.451 -0.532 -16.221 1.00 0.00 C ATOM 2047 C LYS A 667 -5.707 -0.699 -14.901 1.00 0.00 C ATOM 2048 O LYS A 667 -4.481 -0.594 -14.853 1.00 0.00 O ATOM 2049 CB LYS A 667 -6.550 -1.879 -16.940 1.00 0.00 C ATOM 2050 CG LYS A 667 -7.585 -1.901 -18.052 1.00 0.00 C ATOM 2051 CD LYS A 667 -8.108 -3.307 -18.297 1.00 0.00 C ATOM 2052 CE LYS A 667 -7.480 -3.927 -19.534 1.00 0.00 C ATOM 2053 NZ LYS A 667 -8.501 -4.551 -20.422 1.00 0.00 N ATOM 0 H LYS A 667 -4.918 0.100 -17.502 1.00 0.00 H new ATOM 0 HA LYS A 667 -7.457 -0.168 -16.011 1.00 0.00 H new ATOM 0 HB2 LYS A 667 -5.575 -2.131 -17.358 1.00 0.00 H new ATOM 0 HB3 LYS A 667 -6.795 -2.653 -16.212 1.00 0.00 H new ATOM 0 HG2 LYS A 667 -8.414 -1.243 -17.792 1.00 0.00 H new ATOM 0 HG3 LYS A 667 -7.144 -1.511 -18.969 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -7.897 -3.931 -17.429 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -9.191 -3.278 -18.413 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -6.936 -3.161 -20.088 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -6.752 -4.680 -19.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -8.032 -4.963 -21.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -9.003 -5.299 -19.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -9.182 -3.828 -20.730 1.00 0.00 H new ATOM 2067 N LYS A 668 -6.453 -0.952 -13.833 1.00 0.00 N ATOM 2068 CA LYS A 668 -5.856 -1.122 -12.514 1.00 0.00 C ATOM 2069 C LYS A 668 -5.686 -2.597 -12.167 1.00 0.00 C ATOM 2070 O LYS A 668 -6.300 -3.469 -12.782 1.00 0.00 O ATOM 2071 CB LYS A 668 -6.715 -0.431 -11.452 1.00 0.00 C ATOM 2072 CG LYS A 668 -8.173 -0.861 -11.470 1.00 0.00 C ATOM 2073 CD LYS A 668 -8.517 -1.714 -10.260 1.00 0.00 C ATOM 2074 CE LYS A 668 -8.577 -3.190 -10.618 1.00 0.00 C ATOM 2075 NZ LYS A 668 -9.960 -3.621 -10.966 1.00 0.00 N ATOM 0 H LYS A 668 -7.469 -1.044 -13.854 1.00 0.00 H new ATOM 0 HA LYS A 668 -4.868 -0.663 -12.533 1.00 0.00 H new ATOM 0 HB2 LYS A 668 -6.296 -0.639 -10.467 1.00 0.00 H new ATOM 0 HB3 LYS A 668 -6.662 0.648 -11.600 1.00 0.00 H new ATOM 0 HG2 LYS A 668 -8.813 0.021 -11.489 1.00 0.00 H new ATOM 0 HG3 LYS A 668 -8.377 -1.422 -12.382 1.00 0.00 H new ATOM 0 HD2 LYS A 668 -7.772 -1.558 -9.480 1.00 0.00 H new ATOM 0 HD3 LYS A 668 -9.477 -1.398 -9.852 1.00 0.00 H new ATOM 0 HE2 LYS A 668 -7.913 -3.387 -11.460 1.00 0.00 H new ATOM 0 HE3 LYS A 668 -8.212 -3.782 -9.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 668 -9.925 -4.537 -11.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 668 -10.523 -3.715 -10.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 668 -10.399 -2.912 -11.587 1.00 0.00 H new ATOM 2089 N ILE A 669 -4.848 -2.865 -11.170 1.00 0.00 N ATOM 2090 CA ILE A 669 -4.588 -4.229 -10.723 1.00 0.00 C ATOM 2091 C ILE A 669 -4.898 -4.364 -9.235 1.00 0.00 C ATOM 2092 O ILE A 669 -4.236 -3.750 -8.399 1.00 0.00 O ATOM 2093 CB ILE A 669 -3.120 -4.643 -10.961 1.00 0.00 C ATOM 2094 CG1 ILE A 669 -2.561 -3.990 -12.236 1.00 0.00 C ATOM 2095 CG2 ILE A 669 -2.999 -6.162 -11.025 1.00 0.00 C ATOM 2096 CD1 ILE A 669 -2.620 -4.871 -13.467 1.00 0.00 C ATOM 0 H ILE A 669 -4.335 -2.151 -10.654 1.00 0.00 H new ATOM 0 HA ILE A 669 -5.234 -4.885 -11.307 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.524 -4.288 -10.120 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -3.116 -3.073 -12.433 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -1.524 -3.703 -12.058 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -1.958 -6.437 -11.193 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.341 -6.594 -10.085 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -3.611 -6.542 -11.843 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -2.206 -4.333 -14.320 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -2.040 -5.778 -13.294 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -3.656 -5.137 -13.674 1.00 0.00 H new ATOM 2108 N GLU A 670 -5.907 -5.164 -8.905 1.00 0.00 N ATOM 2109 CA GLU A 670 -6.294 -5.363 -7.512 1.00 0.00 C ATOM 2110 C GLU A 670 -5.816 -6.714 -6.996 1.00 0.00 C ATOM 2111 O GLU A 670 -6.017 -7.744 -7.639 1.00 0.00 O ATOM 2112 CB GLU A 670 -7.811 -5.257 -7.354 1.00 0.00 C ATOM 2113 CG GLU A 670 -8.245 -4.199 -6.351 1.00 0.00 C ATOM 2114 CD GLU A 670 -9.312 -3.275 -6.905 1.00 0.00 C ATOM 2115 OE1 GLU A 670 -9.433 -3.184 -8.144 1.00 0.00 O ATOM 2116 OE2 GLU A 670 -10.025 -2.643 -6.098 1.00 0.00 O ATOM 0 H GLU A 670 -6.469 -5.683 -9.579 1.00 0.00 H new ATOM 0 HA GLU A 670 -5.819 -4.579 -6.922 1.00 0.00 H new ATOM 0 HB2 GLU A 670 -8.254 -5.030 -8.324 1.00 0.00 H new ATOM 0 HB3 GLU A 670 -8.204 -6.225 -7.042 1.00 0.00 H new ATOM 0 HG2 GLU A 670 -8.623 -4.688 -5.453 1.00 0.00 H new ATOM 0 HG3 GLU A 670 -7.378 -3.609 -6.052 1.00 0.00 H new ATOM 2123 N ARG A 671 -5.182 -6.701 -5.829 1.00 0.00 N ATOM 2124 CA ARG A 671 -4.671 -7.925 -5.223 1.00 0.00 C ATOM 2125 C ARG A 671 -4.575 -7.800 -3.708 1.00 0.00 C ATOM 2126 O ARG A 671 -4.593 -6.698 -3.160 1.00 0.00 O ATOM 2127 CB ARG A 671 -3.299 -8.263 -5.798 1.00 0.00 C ATOM 2128 CG ARG A 671 -3.322 -8.505 -7.293 1.00 0.00 C ATOM 2129 CD ARG A 671 -4.035 -9.804 -7.628 1.00 0.00 C ATOM 2130 NE ARG A 671 -3.173 -10.730 -8.356 1.00 0.00 N ATOM 2131 CZ ARG A 671 -2.970 -10.669 -9.669 1.00 0.00 C ATOM 2132 NH1 ARG A 671 -3.562 -9.727 -10.390 1.00 0.00 N ATOM 2133 NH2 ARG A 671 -2.174 -11.550 -10.260 1.00 0.00 N ATOM 0 H ARG A 671 -5.010 -5.856 -5.284 1.00 0.00 H new ATOM 0 HA ARG A 671 -5.372 -8.727 -5.455 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -2.609 -7.448 -5.579 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -2.912 -9.151 -5.299 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -3.822 -7.674 -7.791 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -2.301 -8.538 -7.674 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -4.379 -10.276 -6.708 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -4.921 -9.588 -8.225 1.00 0.00 H new ATOM 0 HE ARG A 671 -2.700 -11.464 -7.829 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -4.174 -9.048 -9.938 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -3.405 -9.681 -11.397 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -1.717 -12.275 -9.707 1.00 0.00 H new ATOM 0 HH22 ARG A 671 -2.019 -11.502 -11.267 1.00 0.00 H new ATOM 2147 N TRP A 672 -4.467 -8.944 -3.041 1.00 0.00 N ATOM 2148 CA TRP A 672 -4.359 -8.977 -1.587 1.00 0.00 C ATOM 2149 C TRP A 672 -2.923 -9.256 -1.159 1.00 0.00 C ATOM 2150 O TRP A 672 -2.278 -10.168 -1.674 1.00 0.00 O ATOM 2151 CB TRP A 672 -5.292 -10.041 -1.008 1.00 0.00 C ATOM 2152 CG TRP A 672 -6.723 -9.610 -0.981 1.00 0.00 C ATOM 2153 CD1 TRP A 672 -7.658 -9.813 -1.955 1.00 0.00 C ATOM 2154 CD2 TRP A 672 -7.384 -8.894 0.069 1.00 0.00 C ATOM 2155 NE1 TRP A 672 -8.858 -9.265 -1.577 1.00 0.00 N ATOM 2156 CE2 TRP A 672 -8.715 -8.694 -0.340 1.00 0.00 C ATOM 2157 CE3 TRP A 672 -6.979 -8.402 1.314 1.00 0.00 C ATOM 2158 CZ2 TRP A 672 -9.642 -8.022 0.449 1.00 0.00 C ATOM 2159 CZ3 TRP A 672 -7.903 -7.737 2.100 1.00 0.00 C ATOM 2160 CH2 TRP A 672 -9.221 -7.552 1.664 1.00 0.00 C ATOM 0 H TRP A 672 -4.452 -9.862 -3.485 1.00 0.00 H new ATOM 0 HA TRP A 672 -4.653 -8.001 -1.202 1.00 0.00 H new ATOM 0 HB2 TRP A 672 -5.204 -10.953 -1.598 1.00 0.00 H new ATOM 0 HB3 TRP A 672 -4.972 -10.284 0.005 1.00 0.00 H new ATOM 0 HD1 TRP A 672 -7.479 -10.329 -2.887 1.00 0.00 H new ATOM 0 HE1 TRP A 672 -9.717 -9.280 -2.127 1.00 0.00 H new ATOM 0 HE3 TRP A 672 -5.964 -8.539 1.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 672 -10.659 -7.876 0.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 672 -7.603 -7.355 3.065 1.00 0.00 H new ATOM 0 HH2 TRP A 672 -9.920 -7.028 2.299 1.00 0.00 H new ATOM 2171 N HIS A 673 -2.430 -8.465 -0.213 1.00 0.00 N ATOM 2172 CA HIS A 673 -1.070 -8.628 0.283 1.00 0.00 C ATOM 2173 C HIS A 673 -1.070 -9.061 1.743 1.00 0.00 C ATOM 2174 O HIS A 673 -1.732 -8.450 2.583 1.00 0.00 O ATOM 2175 CB HIS A 673 -0.289 -7.324 0.127 1.00 0.00 C ATOM 2176 CG HIS A 673 -0.119 -6.896 -1.299 1.00 0.00 C ATOM 2177 ND1 HIS A 673 0.352 -7.720 -2.297 1.00 0.00 N ATOM 2178 CD2 HIS A 673 -0.371 -5.700 -1.890 1.00 0.00 C ATOM 2179 CE1 HIS A 673 0.373 -7.015 -3.437 1.00 0.00 C ATOM 2180 NE2 HIS A 673 -0.057 -5.783 -3.243 1.00 0.00 N ATOM 0 H HIS A 673 -2.951 -7.706 0.225 1.00 0.00 H new ATOM 0 HA HIS A 673 -0.587 -9.407 -0.307 1.00 0.00 H new ATOM 0 HB2 HIS A 673 -0.802 -6.535 0.676 1.00 0.00 H new ATOM 0 HB3 HIS A 673 0.694 -7.442 0.582 1.00 0.00 H new ATOM 0 HD1 HIS A 673 0.635 -8.694 -2.188 1.00 0.00 H new ATOM 0 HD2 HIS A 673 -0.754 -4.823 -1.389 1.00 0.00 H new ATOM 0 HE1 HIS A 673 0.699 -7.405 -4.390 1.00 0.00 H new ATOM 2188 N GLN A 674 -0.318 -10.114 2.042 1.00 0.00 N ATOM 2189 CA GLN A 674 -0.228 -10.623 3.404 1.00 0.00 C ATOM 2190 C GLN A 674 0.708 -9.755 4.234 1.00 0.00 C ATOM 2191 O GLN A 674 1.930 -9.857 4.125 1.00 0.00 O ATOM 2192 CB GLN A 674 0.264 -12.071 3.406 1.00 0.00 C ATOM 2193 CG GLN A 674 -0.546 -12.990 2.505 1.00 0.00 C ATOM 2194 CD GLN A 674 -0.916 -14.294 3.185 1.00 0.00 C ATOM 2195 OE1 GLN A 674 -2.060 -14.494 3.592 1.00 0.00 O ATOM 2196 NE2 GLN A 674 0.055 -15.192 3.309 1.00 0.00 N ATOM 0 H GLN A 674 0.237 -10.631 1.360 1.00 0.00 H new ATOM 0 HA GLN A 674 -1.224 -10.592 3.846 1.00 0.00 H new ATOM 0 HB2 GLN A 674 1.307 -12.092 3.089 1.00 0.00 H new ATOM 0 HB3 GLN A 674 0.233 -12.455 4.426 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -1.455 -12.477 2.192 1.00 0.00 H new ATOM 0 HG3 GLN A 674 0.026 -13.205 1.602 1.00 0.00 H new ATOM 0 HE21 GLN A 674 0.990 -14.984 2.957 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -0.134 -16.089 3.756 1.00 0.00 H new ATOM 2205 N LEU A 675 0.123 -8.896 5.059 1.00 0.00 N ATOM 2206 CA LEU A 675 0.897 -7.999 5.906 1.00 0.00 C ATOM 2207 C LEU A 675 2.057 -8.729 6.573 1.00 0.00 C ATOM 2208 O LEU A 675 1.875 -9.781 7.185 1.00 0.00 O ATOM 2209 CB LEU A 675 -0.002 -7.370 6.969 1.00 0.00 C ATOM 2210 CG LEU A 675 -1.114 -6.474 6.426 1.00 0.00 C ATOM 2211 CD1 LEU A 675 -2.073 -6.084 7.538 1.00 0.00 C ATOM 2212 CD2 LEU A 675 -0.523 -5.236 5.768 1.00 0.00 C ATOM 0 H LEU A 675 -0.888 -8.802 5.159 1.00 0.00 H new ATOM 0 HA LEU A 675 1.309 -7.214 5.272 1.00 0.00 H new ATOM 0 HB2 LEU A 675 -0.454 -8.167 7.559 1.00 0.00 H new ATOM 0 HB3 LEU A 675 0.618 -6.784 7.647 1.00 0.00 H new ATOM 0 HG LEU A 675 -1.672 -7.031 5.673 1.00 0.00 H new ATOM 0 HD11 LEU A 675 -2.859 -5.446 7.134 1.00 0.00 H new ATOM 0 HD12 LEU A 675 -2.519 -6.982 7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 675 -1.530 -5.544 8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 675 -1.328 -4.608 5.386 1.00 0.00 H new ATOM 0 HD22 LEU A 675 0.058 -4.676 6.501 1.00 0.00 H new ATOM 0 HD23 LEU A 675 0.125 -5.536 4.945 1.00 0.00 H new ATOM 2224 N GLN A 676 3.248 -8.156 6.451 1.00 0.00 N ATOM 2225 CA GLN A 676 4.446 -8.741 7.043 1.00 0.00 C ATOM 2226 C GLN A 676 5.078 -7.776 8.043 1.00 0.00 C ATOM 2227 O GLN A 676 4.732 -6.596 8.084 1.00 0.00 O ATOM 2228 CB GLN A 676 5.458 -9.099 5.953 1.00 0.00 C ATOM 2229 CG GLN A 676 4.835 -9.775 4.742 1.00 0.00 C ATOM 2230 CD GLN A 676 4.522 -11.237 4.989 1.00 0.00 C ATOM 2231 OE1 GLN A 676 3.363 -11.651 4.941 1.00 0.00 O ATOM 2232 NE2 GLN A 676 5.554 -12.028 5.257 1.00 0.00 N ATOM 0 H GLN A 676 3.411 -7.285 5.946 1.00 0.00 H new ATOM 0 HA GLN A 676 4.157 -9.650 7.570 1.00 0.00 H new ATOM 0 HB2 GLN A 676 5.968 -8.191 5.630 1.00 0.00 H new ATOM 0 HB3 GLN A 676 6.217 -9.757 6.376 1.00 0.00 H new ATOM 0 HG2 GLN A 676 3.918 -9.252 4.470 1.00 0.00 H new ATOM 0 HG3 GLN A 676 5.514 -9.691 3.894 1.00 0.00 H new ATOM 0 HE21 GLN A 676 6.498 -11.642 5.287 1.00 0.00 H new ATOM 0 HE22 GLN A 676 5.403 -13.021 5.433 1.00 0.00 H new ATOM 2241 N ASN A 677 6.004 -8.287 8.847 1.00 0.00 N ATOM 2242 CA ASN A 677 6.684 -7.470 9.845 1.00 0.00 C ATOM 2243 C ASN A 677 8.135 -7.222 9.446 1.00 0.00 C ATOM 2244 O ASN A 677 8.920 -8.161 9.313 1.00 0.00 O ATOM 2245 CB ASN A 677 6.628 -8.149 11.215 1.00 0.00 C ATOM 2246 CG ASN A 677 6.467 -7.154 12.348 1.00 0.00 C ATOM 2247 OD1 ASN A 677 5.744 -6.166 12.224 1.00 0.00 O ATOM 2248 ND2 ASN A 677 7.145 -7.410 13.461 1.00 0.00 N ATOM 0 H ASN A 677 6.301 -9.263 8.827 1.00 0.00 H new ATOM 0 HA ASN A 677 6.172 -6.509 9.903 1.00 0.00 H new ATOM 0 HB2 ASN A 677 5.797 -8.854 11.234 1.00 0.00 H new ATOM 0 HB3 ASN A 677 7.540 -8.726 11.369 1.00 0.00 H new ATOM 0 HD21 ASN A 677 7.078 -6.775 14.257 1.00 0.00 H new ATOM 0 HD22 ASN A 677 7.733 -8.241 13.520 1.00 0.00 H new