USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=27 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 657 HIS : no HD1:sc= -10! C(o=-19!,f=-25!) USER MOD Set 1.2: A 673 HIS : no HE2:sc= -8.61! C(o=-19!,f=-20!) USER MOD Set 2.1: A 597 GLN : amide:sc= -0.215 X(o=-0.41,f=-0.34) USER MOD Set 2.2: A 599 LYS NZ :NH3+ -114:sc= -0.194 (180deg=-0.266) USER MOD Single : A 543 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 547 SER OG : rot -147:sc= -0.402 USER MOD Single : A 549 MET CE :methyl -122:sc= -0.0257 (180deg=-3.07!) USER MOD Single : A 550 TYR OH : rot -27:sc= 1.2 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 552 THR OG1 : rot 180:sc= -0.135 USER MOD Single : A 553 GLN : amide:sc= -2.27 K(o=-2.3,f=0) USER MOD Single : A 554 GLN : amide:sc= -0.738 K(o=-0.74,f=0) USER MOD Single : A 564 CYS SG : rot -79:sc= -5.49! USER MOD Single : A 566 HIS : no HD1:sc= 0 X(o=0,f=-0.0046) USER MOD Single : A 570 MET CE :methyl -152:sc= -0.142 (180deg=-1.43!) USER MOD Single : A 573 ASN : amide:sc= -0.0398 X(o=-0.04,f=0.43) USER MOD Single : A 575 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 SER OG : rot 162:sc= -4.65! USER MOD Single : A 581 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 585 LYS NZ :NH3+ 174:sc=-0.000306 (180deg=-0.0509) USER MOD Single : A 593 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 594 HIS : no HE2:sc= -2.36! C(o=-2.4!,f=-5.3!) USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 140:sc= 1.64 USER MOD Single : A 600 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.966 K(o=-0.97,f=-3!) USER MOD Single : A 608 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 613 TYR OH : rot -118:sc= 0.0425 USER MOD Single : A 616 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 617 HIS : no HD1:sc= -4.17! C(o=-4.2!,f=-12!) 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+ 147:sc=-0.00701 (180deg=-0.107) USER MOD Single : A 624 SER OG : rot -6:sc= -0.738 USER MOD Single : A 628 SER OG : rot -150:sc= 0.484 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= 0.0776 K(o=0.078,f=-5.6!) USER MOD Single : A 640 TYR OH : rot 180:sc= 0 USER MOD Single : A 644 CYS SG : rot 81:sc= 1.2 USER MOD Single : A 645 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 649 SER OG : rot -38:sc= 0.206 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 -10:sc= -4.06! USER MOD Single : A 663 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 664 ASN : amide:sc= -6.23! C(o=-6.2!,f=-18!) USER MOD Single : A 665 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 668 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 674 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 676 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 677 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 27 N GLY A 542 -2.917 -9.989 9.235 1.00 0.00 N ATOM 28 CA GLY A 542 -3.943 -9.478 8.346 1.00 0.00 C ATOM 29 C GLY A 542 -3.436 -9.245 6.936 1.00 0.00 C ATOM 30 O GLY A 542 -2.242 -9.381 6.667 1.00 0.00 O ATOM 0 HA2 GLY A 542 -4.775 -10.182 8.316 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -4.331 -8.542 8.747 1.00 0.00 H new ATOM 34 N LYS A 543 -4.348 -8.892 6.036 1.00 0.00 N ATOM 35 CA LYS A 543 -3.996 -8.635 4.645 1.00 0.00 C ATOM 36 C LYS A 543 -4.640 -7.336 4.168 1.00 0.00 C ATOM 37 O LYS A 543 -5.767 -7.020 4.546 1.00 0.00 O ATOM 38 CB LYS A 543 -4.446 -9.800 3.762 1.00 0.00 C ATOM 39 CG LYS A 543 -4.160 -11.164 4.368 1.00 0.00 C ATOM 40 CD LYS A 543 -4.095 -12.247 3.302 1.00 0.00 C ATOM 41 CE LYS A 543 -5.422 -12.975 3.165 1.00 0.00 C ATOM 42 NZ LYS A 543 -5.238 -14.400 2.777 1.00 0.00 N ATOM 0 H LYS A 543 -5.339 -8.777 6.247 1.00 0.00 H new ATOM 0 HA LYS A 543 -2.913 -8.537 4.572 1.00 0.00 H new ATOM 0 HB2 LYS A 543 -5.516 -9.711 3.574 1.00 0.00 H new ATOM 0 HB3 LYS A 543 -3.946 -9.728 2.796 1.00 0.00 H new ATOM 0 HG2 LYS A 543 -3.216 -11.131 4.912 1.00 0.00 H new ATOM 0 HG3 LYS A 543 -4.936 -11.411 5.092 1.00 0.00 H new ATOM 0 HD2 LYS A 543 -3.823 -11.801 2.345 1.00 0.00 H new ATOM 0 HD3 LYS A 543 -3.311 -12.961 3.555 1.00 0.00 H new ATOM 0 HE2 LYS A 543 -5.963 -12.923 4.110 1.00 0.00 H new ATOM 0 HE3 LYS A 543 -6.036 -12.472 2.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 -6.167 -14.860 2.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 -4.744 -14.450 1.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 -4.674 -14.887 3.502 1.00 0.00 H new ATOM 56 N ILE A 544 -3.920 -6.584 3.341 1.00 0.00 N ATOM 57 CA ILE A 544 -4.438 -5.320 2.830 1.00 0.00 C ATOM 58 C ILE A 544 -4.577 -5.344 1.311 1.00 0.00 C ATOM 59 O ILE A 544 -3.617 -5.618 0.591 1.00 0.00 O ATOM 60 CB ILE A 544 -3.545 -4.132 3.249 1.00 0.00 C ATOM 61 CG1 ILE A 544 -4.372 -2.847 3.314 1.00 0.00 C ATOM 62 CG2 ILE A 544 -2.370 -3.963 2.294 1.00 0.00 C ATOM 63 CD1 ILE A 544 -4.451 -2.109 1.995 1.00 0.00 C ATOM 0 H ILE A 544 -2.985 -6.825 3.013 1.00 0.00 H new ATOM 0 HA ILE A 544 -5.427 -5.187 3.269 1.00 0.00 H new ATOM 0 HB ILE A 544 -3.142 -4.342 4.240 1.00 0.00 H new ATOM 0 HG12 ILE A 544 -5.381 -3.091 3.645 1.00 0.00 H new ATOM 0 HG13 ILE A 544 -3.941 -2.185 4.066 1.00 0.00 H new ATOM 0 HG21 ILE A 544 -1.759 -3.119 2.614 1.00 0.00 H new ATOM 0 HG22 ILE A 544 -1.766 -4.870 2.297 1.00 0.00 H new ATOM 0 HG23 ILE A 544 -2.743 -3.779 1.287 1.00 0.00 H new ATOM 0 HD11 ILE A 544 -5.053 -1.209 2.117 1.00 0.00 H new ATOM 0 HD12 ILE A 544 -3.447 -1.833 1.672 1.00 0.00 H new ATOM 0 HD13 ILE A 544 -4.910 -2.753 1.245 1.00 0.00 H new ATOM 75 N LEU A 545 -5.782 -5.049 0.833 1.00 0.00 N ATOM 76 CA LEU A 545 -6.055 -5.028 -0.598 1.00 0.00 C ATOM 77 C LEU A 545 -5.566 -3.729 -1.218 1.00 0.00 C ATOM 78 O LEU A 545 -5.963 -2.642 -0.801 1.00 0.00 O ATOM 79 CB LEU A 545 -7.555 -5.185 -0.860 1.00 0.00 C ATOM 80 CG LEU A 545 -7.935 -5.394 -2.328 1.00 0.00 C ATOM 81 CD1 LEU A 545 -7.575 -6.797 -2.782 1.00 0.00 C ATOM 82 CD2 LEU A 545 -9.419 -5.138 -2.539 1.00 0.00 C ATOM 0 H LEU A 545 -6.586 -4.821 1.418 1.00 0.00 H new ATOM 0 HA LEU A 545 -5.522 -5.862 -1.054 1.00 0.00 H new ATOM 0 HB2 LEU A 545 -7.923 -6.031 -0.281 1.00 0.00 H new ATOM 0 HB3 LEU A 545 -8.068 -4.298 -0.490 1.00 0.00 H new ATOM 0 HG LEU A 545 -7.370 -4.681 -2.928 1.00 0.00 H new ATOM 0 HD11 LEU A 545 -7.854 -6.924 -3.828 1.00 0.00 H new ATOM 0 HD12 LEU A 545 -6.502 -6.951 -2.671 1.00 0.00 H new ATOM 0 HD13 LEU A 545 -8.111 -7.525 -2.173 1.00 0.00 H new ATOM 0 HD21 LEU A 545 -9.669 -5.292 -3.589 1.00 0.00 H new ATOM 0 HD22 LEU A 545 -9.998 -5.826 -1.923 1.00 0.00 H new ATOM 0 HD23 LEU A 545 -9.655 -4.112 -2.256 1.00 0.00 H new ATOM 94 N VAL A 546 -4.706 -3.847 -2.220 1.00 0.00 N ATOM 95 CA VAL A 546 -4.170 -2.678 -2.897 1.00 0.00 C ATOM 96 C VAL A 546 -4.461 -2.736 -4.390 1.00 0.00 C ATOM 97 O VAL A 546 -4.349 -3.789 -5.015 1.00 0.00 O ATOM 98 CB VAL A 546 -2.651 -2.547 -2.684 1.00 0.00 C ATOM 99 CG1 VAL A 546 -2.080 -1.448 -3.567 1.00 0.00 C ATOM 100 CG2 VAL A 546 -2.338 -2.279 -1.220 1.00 0.00 C ATOM 0 H VAL A 546 -4.366 -4.739 -2.580 1.00 0.00 H new ATOM 0 HA VAL A 546 -4.661 -1.807 -2.464 1.00 0.00 H new ATOM 0 HB VAL A 546 -2.181 -3.489 -2.966 1.00 0.00 H new ATOM 0 HG11 VAL A 546 -1.005 -1.371 -3.402 1.00 0.00 H new ATOM 0 HG12 VAL A 546 -2.271 -1.686 -4.613 1.00 0.00 H new ATOM 0 HG13 VAL A 546 -2.554 -0.499 -3.319 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -1.260 -2.189 -1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 546 -2.820 -1.352 -0.909 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -2.710 -3.103 -0.612 1.00 0.00 H new ATOM 110 N SER A 547 -4.835 -1.597 -4.958 1.00 0.00 N ATOM 111 CA SER A 547 -5.139 -1.519 -6.379 1.00 0.00 C ATOM 112 C SER A 547 -4.149 -0.600 -7.084 1.00 0.00 C ATOM 113 O SER A 547 -3.953 0.545 -6.677 1.00 0.00 O ATOM 114 CB SER A 547 -6.566 -1.014 -6.593 1.00 0.00 C ATOM 115 OG SER A 547 -6.600 0.036 -7.544 1.00 0.00 O ATOM 0 H SER A 547 -4.935 -0.715 -4.456 1.00 0.00 H new ATOM 0 HA SER A 547 -5.054 -2.519 -6.804 1.00 0.00 H new ATOM 0 HB2 SER A 547 -7.198 -1.835 -6.931 1.00 0.00 H new ATOM 0 HB3 SER A 547 -6.977 -0.664 -5.646 1.00 0.00 H new ATOM 0 HG SER A 547 -7.314 0.666 -7.310 1.00 0.00 H new ATOM 121 N LEU A 548 -3.525 -1.107 -8.138 1.00 0.00 N ATOM 122 CA LEU A 548 -2.551 -0.328 -8.891 1.00 0.00 C ATOM 123 C LEU A 548 -3.124 0.126 -10.229 1.00 0.00 C ATOM 124 O LEU A 548 -4.001 -0.525 -10.796 1.00 0.00 O ATOM 125 CB LEU A 548 -1.280 -1.147 -9.118 1.00 0.00 C ATOM 126 CG LEU A 548 -0.431 -1.379 -7.868 1.00 0.00 C ATOM 127 CD1 LEU A 548 0.978 -1.798 -8.254 1.00 0.00 C ATOM 128 CD2 LEU A 548 -0.400 -0.126 -7.006 1.00 0.00 C ATOM 0 H LEU A 548 -3.675 -2.052 -8.491 1.00 0.00 H new ATOM 0 HA LEU A 548 -2.306 0.559 -8.306 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -1.559 -2.115 -9.535 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -0.669 -0.642 -9.866 1.00 0.00 H new ATOM 0 HG LEU A 548 -0.882 -2.184 -7.287 1.00 0.00 H new ATOM 0 HD11 LEU A 548 1.569 -1.959 -7.353 1.00 0.00 H new ATOM 0 HD12 LEU A 548 0.938 -2.722 -8.832 1.00 0.00 H new ATOM 0 HD13 LEU A 548 1.439 -1.014 -8.855 1.00 0.00 H new ATOM 0 HD21 LEU A 548 0.209 -0.309 -6.120 1.00 0.00 H new ATOM 0 HD22 LEU A 548 0.028 0.698 -7.577 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -1.415 0.132 -6.702 1.00 0.00 H new ATOM 140 N MET A 549 -2.618 1.248 -10.725 1.00 0.00 N ATOM 141 CA MET A 549 -3.069 1.802 -11.995 1.00 0.00 C ATOM 142 C MET A 549 -2.208 2.997 -12.385 1.00 0.00 C ATOM 143 O MET A 549 -2.065 3.945 -11.615 1.00 0.00 O ATOM 144 CB MET A 549 -4.536 2.225 -11.901 1.00 0.00 C ATOM 145 CG MET A 549 -5.282 2.145 -13.223 1.00 0.00 C ATOM 146 SD MET A 549 -6.474 3.482 -13.429 1.00 0.00 S ATOM 147 CE MET A 549 -5.434 4.756 -14.140 1.00 0.00 C ATOM 0 H MET A 549 -1.891 1.795 -10.264 1.00 0.00 H new ATOM 0 HA MET A 549 -2.974 1.032 -12.761 1.00 0.00 H new ATOM 0 HB2 MET A 549 -5.041 1.593 -11.170 1.00 0.00 H new ATOM 0 HB3 MET A 549 -4.587 3.248 -11.527 1.00 0.00 H new ATOM 0 HG2 MET A 549 -4.564 2.173 -14.043 1.00 0.00 H new ATOM 0 HG3 MET A 549 -5.800 1.188 -13.286 1.00 0.00 H new ATOM 0 HE1 MET A 549 -5.461 5.643 -13.507 1.00 0.00 H new ATOM 0 HE2 MET A 549 -4.409 4.392 -14.211 1.00 0.00 H new ATOM 0 HE3 MET A 549 -5.798 5.009 -15.136 1.00 0.00 H new ATOM 157 N TYR A 550 -1.628 2.947 -13.579 1.00 0.00 N ATOM 158 CA TYR A 550 -0.779 4.033 -14.051 1.00 0.00 C ATOM 159 C TYR A 550 -1.506 4.892 -15.079 1.00 0.00 C ATOM 160 O TYR A 550 -2.103 4.377 -16.025 1.00 0.00 O ATOM 161 CB TYR A 550 0.515 3.482 -14.651 1.00 0.00 C ATOM 162 CG TYR A 550 1.558 4.548 -14.891 1.00 0.00 C ATOM 163 CD1 TYR A 550 2.421 4.941 -13.876 1.00 0.00 C ATOM 164 CD2 TYR A 550 1.671 5.168 -16.128 1.00 0.00 C ATOM 165 CE1 TYR A 550 3.372 5.922 -14.086 1.00 0.00 C ATOM 166 CE2 TYR A 550 2.618 6.150 -16.348 1.00 0.00 C ATOM 167 CZ TYR A 550 3.466 6.523 -15.325 1.00 0.00 C ATOM 168 OH TYR A 550 4.410 7.502 -15.540 1.00 0.00 O ATOM 0 H TYR A 550 -1.729 2.171 -14.234 1.00 0.00 H new ATOM 0 HA TYR A 550 -0.533 4.659 -13.193 1.00 0.00 H new ATOM 0 HB2 TYR A 550 0.925 2.725 -13.982 1.00 0.00 H new ATOM 0 HB3 TYR A 550 0.288 2.985 -15.594 1.00 0.00 H new ATOM 0 HD1 TYR A 550 2.348 4.472 -12.906 1.00 0.00 H new ATOM 0 HD2 TYR A 550 1.009 4.878 -16.930 1.00 0.00 H new ATOM 0 HE1 TYR A 550 4.036 6.216 -13.287 1.00 0.00 H new ATOM 0 HE2 TYR A 550 2.694 6.623 -17.316 1.00 0.00 H new ATOM 0 HH TYR A 550 4.616 7.949 -14.693 1.00 0.00 H new ATOM 178 N SER A 551 -1.449 6.207 -14.887 1.00 0.00 N ATOM 179 CA SER A 551 -2.099 7.144 -15.795 1.00 0.00 C ATOM 180 C SER A 551 -1.075 7.849 -16.677 1.00 0.00 C ATOM 181 O SER A 551 -0.659 8.970 -16.386 1.00 0.00 O ATOM 182 CB SER A 551 -2.901 8.179 -15.005 1.00 0.00 C ATOM 183 OG SER A 551 -4.263 8.176 -15.393 1.00 0.00 O ATOM 0 H SER A 551 -0.958 6.647 -14.109 1.00 0.00 H new ATOM 0 HA SER A 551 -2.776 6.578 -16.435 1.00 0.00 H new ATOM 0 HB2 SER A 551 -2.823 7.967 -13.939 1.00 0.00 H new ATOM 0 HB3 SER A 551 -2.477 9.170 -15.164 1.00 0.00 H new ATOM 0 HG SER A 551 -4.753 8.845 -14.871 1.00 0.00 H new ATOM 189 N THR A 552 -0.677 7.188 -17.759 1.00 0.00 N ATOM 190 CA THR A 552 0.295 7.763 -18.683 1.00 0.00 C ATOM 191 C THR A 552 -0.080 9.199 -19.011 1.00 0.00 C ATOM 192 O THR A 552 0.778 10.079 -19.078 1.00 0.00 O ATOM 193 CB THR A 552 0.370 6.937 -19.967 1.00 0.00 C ATOM 194 OG1 THR A 552 -0.585 7.386 -20.910 1.00 0.00 O ATOM 195 CG2 THR A 552 0.134 5.464 -19.739 1.00 0.00 C ATOM 0 H THR A 552 -1.010 6.259 -18.017 1.00 0.00 H new ATOM 0 HA THR A 552 1.274 7.751 -18.204 1.00 0.00 H new ATOM 0 HB THR A 552 1.385 7.074 -20.341 1.00 0.00 H new ATOM 0 HG1 THR A 552 -0.519 6.846 -21.725 1.00 0.00 H new ATOM 0 HG21 THR A 552 0.201 4.934 -20.689 1.00 0.00 H new ATOM 0 HG22 THR A 552 0.888 5.077 -19.053 1.00 0.00 H new ATOM 0 HG23 THR A 552 -0.857 5.316 -19.310 1.00 0.00 H new ATOM 203 N GLN A 553 -1.374 9.430 -19.204 1.00 0.00 N ATOM 204 CA GLN A 553 -1.869 10.764 -19.511 1.00 0.00 C ATOM 205 C GLN A 553 -1.313 11.762 -18.506 1.00 0.00 C ATOM 206 O GLN A 553 -0.773 12.805 -18.877 1.00 0.00 O ATOM 207 CB GLN A 553 -3.397 10.785 -19.478 1.00 0.00 C ATOM 208 CG GLN A 553 -4.033 11.005 -20.841 1.00 0.00 C ATOM 209 CD GLN A 553 -4.182 12.473 -21.186 1.00 0.00 C ATOM 210 OE1 GLN A 553 -5.090 12.862 -21.921 1.00 0.00 O ATOM 211 NE2 GLN A 553 -3.287 13.300 -20.656 1.00 0.00 N ATOM 0 H GLN A 553 -2.096 8.712 -19.153 1.00 0.00 H new ATOM 0 HA GLN A 553 -1.539 11.041 -20.512 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -3.756 9.841 -19.067 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -3.727 11.573 -18.801 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -3.427 10.516 -21.604 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -5.014 10.530 -20.861 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -2.551 12.935 -20.052 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -3.337 14.300 -20.853 1.00 0.00 H new ATOM 220 N GLN A 554 -1.441 11.421 -17.231 1.00 0.00 N ATOM 221 CA GLN A 554 -0.942 12.268 -16.157 1.00 0.00 C ATOM 222 C GLN A 554 0.558 12.069 -15.981 1.00 0.00 C ATOM 223 O GLN A 554 1.241 12.893 -15.375 1.00 0.00 O ATOM 224 CB GLN A 554 -1.668 11.953 -14.847 1.00 0.00 C ATOM 225 CG GLN A 554 -3.155 11.694 -15.022 1.00 0.00 C ATOM 226 CD GLN A 554 -4.000 12.914 -14.707 1.00 0.00 C ATOM 227 OE1 GLN A 554 -5.029 12.814 -14.039 1.00 0.00 O ATOM 228 NE2 GLN A 554 -3.568 14.073 -15.190 1.00 0.00 N ATOM 0 H GLN A 554 -1.888 10.560 -16.915 1.00 0.00 H new ATOM 0 HA GLN A 554 -1.132 13.308 -16.422 1.00 0.00 H new ATOM 0 HB2 GLN A 554 -1.207 11.079 -14.387 1.00 0.00 H new ATOM 0 HB3 GLN A 554 -1.532 12.785 -14.157 1.00 0.00 H new ATOM 0 HG2 GLN A 554 -3.347 11.378 -16.048 1.00 0.00 H new ATOM 0 HG3 GLN A 554 -3.456 10.871 -14.374 1.00 0.00 H new ATOM 0 HE21 GLN A 554 -2.709 14.108 -15.739 1.00 0.00 H new ATOM 0 HE22 GLN A 554 -4.095 14.928 -15.012 1.00 0.00 H new ATOM 237 N GLY A 555 1.062 10.965 -16.522 1.00 0.00 N ATOM 238 CA GLY A 555 2.478 10.667 -16.422 1.00 0.00 C ATOM 239 C GLY A 555 2.882 10.244 -15.024 1.00 0.00 C ATOM 240 O GLY A 555 3.935 10.644 -14.527 1.00 0.00 O ATOM 0 H GLY A 555 0.514 10.270 -17.029 1.00 0.00 H new ATOM 0 HA2 GLY A 555 2.730 9.874 -17.126 1.00 0.00 H new ATOM 0 HA3 GLY A 555 3.053 11.546 -16.713 1.00 0.00 H new ATOM 244 N GLY A 556 2.043 9.434 -14.388 1.00 0.00 N ATOM 245 CA GLY A 556 2.338 8.972 -13.046 1.00 0.00 C ATOM 246 C GLY A 556 1.628 7.678 -12.707 1.00 0.00 C ATOM 247 O GLY A 556 0.850 7.161 -13.508 1.00 0.00 O ATOM 0 H GLY A 556 1.165 9.090 -14.778 1.00 0.00 H new ATOM 0 HA2 GLY A 556 3.414 8.830 -12.943 1.00 0.00 H new ATOM 0 HA3 GLY A 556 2.048 9.740 -12.329 1.00 0.00 H new ATOM 251 N LEU A 557 1.897 7.155 -11.517 1.00 0.00 N ATOM 252 CA LEU A 557 1.280 5.913 -11.072 1.00 0.00 C ATOM 253 C LEU A 557 0.120 6.197 -10.127 1.00 0.00 C ATOM 254 O LEU A 557 0.045 7.268 -9.525 1.00 0.00 O ATOM 255 CB LEU A 557 2.316 5.028 -10.374 1.00 0.00 C ATOM 256 CG LEU A 557 1.736 3.942 -9.467 1.00 0.00 C ATOM 257 CD1 LEU A 557 1.203 2.783 -10.295 1.00 0.00 C ATOM 258 CD2 LEU A 557 2.786 3.455 -8.481 1.00 0.00 C ATOM 0 H LEU A 557 2.539 7.572 -10.843 1.00 0.00 H new ATOM 0 HA LEU A 557 0.896 5.389 -11.947 1.00 0.00 H new ATOM 0 HB2 LEU A 557 2.936 4.552 -11.134 1.00 0.00 H new ATOM 0 HB3 LEU A 557 2.973 5.664 -9.780 1.00 0.00 H new ATOM 0 HG LEU A 557 0.907 4.371 -8.904 1.00 0.00 H new ATOM 0 HD11 LEU A 557 0.794 2.020 -9.632 1.00 0.00 H new ATOM 0 HD12 LEU A 557 0.419 3.142 -10.962 1.00 0.00 H new ATOM 0 HD13 LEU A 557 2.013 2.355 -10.885 1.00 0.00 H new ATOM 0 HD21 LEU A 557 2.356 2.682 -7.844 1.00 0.00 H new ATOM 0 HD22 LEU A 557 3.635 3.044 -9.027 1.00 0.00 H new ATOM 0 HD23 LEU A 557 3.121 4.289 -7.865 1.00 0.00 H new ATOM 270 N ILE A 558 -0.784 5.233 -9.995 1.00 0.00 N ATOM 271 CA ILE A 558 -1.934 5.386 -9.115 1.00 0.00 C ATOM 272 C ILE A 558 -2.043 4.207 -8.156 1.00 0.00 C ATOM 273 O ILE A 558 -2.152 3.056 -8.577 1.00 0.00 O ATOM 274 CB ILE A 558 -3.250 5.521 -9.903 1.00 0.00 C ATOM 275 CG1 ILE A 558 -3.018 6.289 -11.208 1.00 0.00 C ATOM 276 CG2 ILE A 558 -4.303 6.216 -9.051 1.00 0.00 C ATOM 277 CD1 ILE A 558 -3.094 7.792 -11.051 1.00 0.00 C ATOM 0 H ILE A 558 -0.742 4.340 -10.485 1.00 0.00 H new ATOM 0 HA ILE A 558 -1.776 6.305 -8.550 1.00 0.00 H new ATOM 0 HB ILE A 558 -3.610 4.524 -10.155 1.00 0.00 H new ATOM 0 HG12 ILE A 558 -2.039 6.023 -11.606 1.00 0.00 H new ATOM 0 HG13 ILE A 558 -3.758 5.971 -11.943 1.00 0.00 H new ATOM 0 HG21 ILE A 558 -5.229 6.306 -9.619 1.00 0.00 H new ATOM 0 HG22 ILE A 558 -4.485 5.631 -8.149 1.00 0.00 H new ATOM 0 HG23 ILE A 558 -3.949 7.209 -8.774 1.00 0.00 H new ATOM 0 HD11 ILE A 558 -2.920 8.268 -12.016 1.00 0.00 H new ATOM 0 HD12 ILE A 558 -4.081 8.070 -10.682 1.00 0.00 H new ATOM 0 HD13 ILE A 558 -2.336 8.122 -10.341 1.00 0.00 H new ATOM 289 N VAL A 559 -2.008 4.506 -6.864 1.00 0.00 N ATOM 290 CA VAL A 559 -2.097 3.481 -5.834 1.00 0.00 C ATOM 291 C VAL A 559 -3.446 3.543 -5.131 1.00 0.00 C ATOM 292 O VAL A 559 -3.839 4.588 -4.625 1.00 0.00 O ATOM 293 CB VAL A 559 -0.979 3.656 -4.794 1.00 0.00 C ATOM 294 CG1 VAL A 559 -0.705 2.351 -4.068 1.00 0.00 C ATOM 295 CG2 VAL A 559 0.285 4.177 -5.461 1.00 0.00 C ATOM 0 H VAL A 559 -1.918 5.456 -6.504 1.00 0.00 H new ATOM 0 HA VAL A 559 -1.987 2.512 -6.320 1.00 0.00 H new ATOM 0 HB VAL A 559 -1.308 4.387 -4.056 1.00 0.00 H new ATOM 0 HG11 VAL A 559 0.090 2.501 -3.337 1.00 0.00 H new ATOM 0 HG12 VAL A 559 -1.610 2.022 -3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 559 -0.398 1.592 -4.787 1.00 0.00 H new ATOM 0 HG21 VAL A 559 1.069 4.296 -4.713 1.00 0.00 H new ATOM 0 HG22 VAL A 559 0.614 3.468 -6.221 1.00 0.00 H new ATOM 0 HG23 VAL A 559 0.079 5.140 -5.928 1.00 0.00 H new ATOM 305 N GLY A 560 -4.161 2.426 -5.111 1.00 0.00 N ATOM 306 CA GLY A 560 -5.465 2.407 -4.478 1.00 0.00 C ATOM 307 C GLY A 560 -5.534 1.508 -3.260 1.00 0.00 C ATOM 308 O GLY A 560 -5.337 0.297 -3.358 1.00 0.00 O ATOM 0 H GLY A 560 -3.864 1.539 -5.518 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -5.733 3.422 -4.186 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -6.208 2.078 -5.205 1.00 0.00 H new ATOM 312 N ILE A 561 -5.841 2.105 -2.114 1.00 0.00 N ATOM 313 CA ILE A 561 -5.968 1.359 -0.868 1.00 0.00 C ATOM 314 C ILE A 561 -7.430 1.014 -0.624 1.00 0.00 C ATOM 315 O ILE A 561 -8.208 1.856 -0.177 1.00 0.00 O ATOM 316 CB ILE A 561 -5.429 2.164 0.330 1.00 0.00 C ATOM 317 CG1 ILE A 561 -3.989 2.606 0.071 1.00 0.00 C ATOM 318 CG2 ILE A 561 -5.516 1.341 1.606 1.00 0.00 C ATOM 319 CD1 ILE A 561 -3.062 1.465 -0.293 1.00 0.00 C ATOM 0 H ILE A 561 -6.007 3.107 -2.022 1.00 0.00 H new ATOM 0 HA ILE A 561 -5.377 0.448 -0.962 1.00 0.00 H new ATOM 0 HB ILE A 561 -6.045 3.055 0.454 1.00 0.00 H new ATOM 0 HG12 ILE A 561 -3.982 3.340 -0.735 1.00 0.00 H new ATOM 0 HG13 ILE A 561 -3.605 3.106 0.961 1.00 0.00 H new ATOM 0 HG21 ILE A 561 -5.131 1.925 2.442 1.00 0.00 H new ATOM 0 HG22 ILE A 561 -6.556 1.075 1.797 1.00 0.00 H new ATOM 0 HG23 ILE A 561 -4.924 0.433 1.494 1.00 0.00 H new ATOM 0 HD11 ILE A 561 -2.057 1.852 -0.463 1.00 0.00 H new ATOM 0 HD12 ILE A 561 -3.039 0.741 0.521 1.00 0.00 H new ATOM 0 HD13 ILE A 561 -3.422 0.979 -1.200 1.00 0.00 H new ATOM 331 N ILE A 562 -7.811 -0.217 -0.952 1.00 0.00 N ATOM 332 CA ILE A 562 -9.191 -0.650 -0.795 1.00 0.00 C ATOM 333 C ILE A 562 -9.541 -0.979 0.651 1.00 0.00 C ATOM 334 O ILE A 562 -10.229 -0.207 1.317 1.00 0.00 O ATOM 335 CB ILE A 562 -9.500 -1.872 -1.681 1.00 0.00 C ATOM 336 CG1 ILE A 562 -8.967 -1.648 -3.097 1.00 0.00 C ATOM 337 CG2 ILE A 562 -10.996 -2.141 -1.708 1.00 0.00 C ATOM 338 CD1 ILE A 562 -7.673 -2.376 -3.378 1.00 0.00 C ATOM 0 H ILE A 562 -7.184 -0.929 -1.327 1.00 0.00 H new ATOM 0 HA ILE A 562 -9.805 0.193 -1.110 1.00 0.00 H new ATOM 0 HB ILE A 562 -9.002 -2.745 -1.259 1.00 0.00 H new ATOM 0 HG12 ILE A 562 -9.720 -1.972 -3.815 1.00 0.00 H new ATOM 0 HG13 ILE A 562 -8.815 -0.580 -3.254 1.00 0.00 H new ATOM 0 HG21 ILE A 562 -11.199 -3.007 -2.338 1.00 0.00 H new ATOM 0 HG22 ILE A 562 -11.349 -2.338 -0.696 1.00 0.00 H new ATOM 0 HG23 ILE A 562 -11.515 -1.271 -2.110 1.00 0.00 H new ATOM 0 HD11 ILE A 562 -7.355 -2.171 -4.400 1.00 0.00 H new ATOM 0 HD12 ILE A 562 -6.905 -2.035 -2.684 1.00 0.00 H new ATOM 0 HD13 ILE A 562 -7.824 -3.448 -3.253 1.00 0.00 H new ATOM 350 N ARG A 563 -9.089 -2.132 1.131 1.00 0.00 N ATOM 351 CA ARG A 563 -9.394 -2.543 2.496 1.00 0.00 C ATOM 352 C ARG A 563 -8.417 -3.596 3.005 1.00 0.00 C ATOM 353 O ARG A 563 -7.677 -4.202 2.233 1.00 0.00 O ATOM 354 CB ARG A 563 -10.818 -3.097 2.562 1.00 0.00 C ATOM 355 CG ARG A 563 -10.916 -4.564 2.176 1.00 0.00 C ATOM 356 CD ARG A 563 -12.286 -4.905 1.612 1.00 0.00 C ATOM 357 NE ARG A 563 -13.336 -4.062 2.176 1.00 0.00 N ATOM 358 CZ ARG A 563 -14.468 -3.772 1.541 1.00 0.00 C ATOM 359 NH1 ARG A 563 -14.693 -4.259 0.328 1.00 0.00 N ATOM 360 NH2 ARG A 563 -15.376 -2.998 2.120 1.00 0.00 N ATOM 0 H ARG A 563 -8.517 -2.791 0.603 1.00 0.00 H new ATOM 0 HA ARG A 563 -9.302 -1.664 3.134 1.00 0.00 H new ATOM 0 HB2 ARG A 563 -11.203 -2.969 3.574 1.00 0.00 H new ATOM 0 HB3 ARG A 563 -11.458 -2.512 1.901 1.00 0.00 H new ATOM 0 HG2 ARG A 563 -10.149 -4.798 1.437 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -10.717 -5.185 3.050 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -12.271 -4.789 0.528 1.00 0.00 H new ATOM 0 HD3 ARG A 563 -12.512 -5.951 1.817 1.00 0.00 H new ATOM 0 HE ARG A 563 -13.194 -3.674 3.109 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -13.998 -4.857 -0.119 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -15.562 -4.036 -0.158 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -15.207 -2.624 3.054 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -16.244 -2.777 1.632 1.00 0.00 H new ATOM 374 N CYS A 564 -8.443 -3.816 4.316 1.00 0.00 N ATOM 375 CA CYS A 564 -7.583 -4.805 4.951 1.00 0.00 C ATOM 376 C CYS A 564 -8.432 -5.828 5.693 1.00 0.00 C ATOM 377 O CYS A 564 -9.603 -5.579 5.980 1.00 0.00 O ATOM 378 CB CYS A 564 -6.613 -4.127 5.917 1.00 0.00 C ATOM 379 SG CYS A 564 -7.290 -2.663 6.733 1.00 0.00 S ATOM 0 H CYS A 564 -9.055 -3.318 4.962 1.00 0.00 H new ATOM 0 HA CYS A 564 -7.004 -5.314 4.180 1.00 0.00 H new ATOM 0 HB2 CYS A 564 -6.311 -4.847 6.678 1.00 0.00 H new ATOM 0 HB3 CYS A 564 -5.713 -3.843 5.372 1.00 0.00 H new ATOM 0 HG CYS A 564 -7.245 -1.652 5.917 1.00 0.00 H new ATOM 385 N VAL A 565 -7.853 -6.984 5.996 1.00 0.00 N ATOM 386 CA VAL A 565 -8.594 -8.027 6.695 1.00 0.00 C ATOM 387 C VAL A 565 -7.700 -8.866 7.600 1.00 0.00 C ATOM 388 O VAL A 565 -6.542 -9.134 7.283 1.00 0.00 O ATOM 389 CB VAL A 565 -9.309 -8.956 5.703 1.00 0.00 C ATOM 390 CG1 VAL A 565 -10.286 -8.164 4.854 1.00 0.00 C ATOM 391 CG2 VAL A 565 -8.301 -9.689 4.831 1.00 0.00 C ATOM 0 H VAL A 565 -6.886 -7.221 5.773 1.00 0.00 H new ATOM 0 HA VAL A 565 -9.328 -7.513 7.315 1.00 0.00 H new ATOM 0 HB VAL A 565 -9.869 -9.702 6.266 1.00 0.00 H new ATOM 0 HG11 VAL A 565 -10.786 -8.834 4.155 1.00 0.00 H new ATOM 0 HG12 VAL A 565 -11.028 -7.692 5.498 1.00 0.00 H new ATOM 0 HG13 VAL A 565 -9.747 -7.397 4.299 1.00 0.00 H new ATOM 0 HG21 VAL A 565 -8.828 -10.342 4.135 1.00 0.00 H new ATOM 0 HG22 VAL A 565 -7.709 -8.965 4.271 1.00 0.00 H new ATOM 0 HG23 VAL A 565 -7.642 -10.287 5.461 1.00 0.00 H new ATOM 401 N HIS A 566 -8.266 -9.285 8.727 1.00 0.00 N ATOM 402 CA HIS A 566 -7.548 -10.109 9.695 1.00 0.00 C ATOM 403 C HIS A 566 -6.421 -9.329 10.362 1.00 0.00 C ATOM 404 O HIS A 566 -5.305 -9.829 10.503 1.00 0.00 O ATOM 405 CB HIS A 566 -6.987 -11.359 9.016 1.00 0.00 C ATOM 406 CG HIS A 566 -7.535 -12.638 9.568 1.00 0.00 C ATOM 407 ND1 HIS A 566 -6.756 -13.577 10.211 1.00 0.00 N ATOM 408 CD2 HIS A 566 -8.796 -13.134 9.573 1.00 0.00 C ATOM 409 CE1 HIS A 566 -7.512 -14.593 10.586 1.00 0.00 C ATOM 410 NE2 HIS A 566 -8.753 -14.349 10.211 1.00 0.00 N ATOM 0 H HIS A 566 -9.226 -9.066 8.994 1.00 0.00 H new ATOM 0 HA HIS A 566 -8.257 -10.407 10.467 1.00 0.00 H new ATOM 0 HB2 HIS A 566 -7.204 -11.311 7.949 1.00 0.00 H new ATOM 0 HB3 HIS A 566 -5.902 -11.363 9.121 1.00 0.00 H new ATOM 0 HD2 HIS A 566 -9.672 -12.662 9.153 1.00 0.00 H new ATOM 0 HE1 HIS A 566 -7.172 -15.474 11.110 1.00 0.00 H new ATOM 0 HE2 HIS A 566 -9.551 -14.964 10.369 1.00 0.00 H new ATOM 419 N LEU A 567 -6.721 -8.104 10.779 1.00 0.00 N ATOM 420 CA LEU A 567 -5.733 -7.261 11.438 1.00 0.00 C ATOM 421 C LEU A 567 -5.680 -7.556 12.933 1.00 0.00 C ATOM 422 O LEU A 567 -6.696 -7.878 13.548 1.00 0.00 O ATOM 423 CB LEU A 567 -6.060 -5.784 11.212 1.00 0.00 C ATOM 424 CG LEU A 567 -5.954 -5.313 9.762 1.00 0.00 C ATOM 425 CD1 LEU A 567 -6.072 -3.800 9.687 1.00 0.00 C ATOM 426 CD2 LEU A 567 -4.644 -5.782 9.148 1.00 0.00 C ATOM 0 H LEU A 567 -7.640 -7.674 10.672 1.00 0.00 H new ATOM 0 HA LEU A 567 -4.757 -7.481 11.005 1.00 0.00 H new ATOM 0 HB2 LEU A 567 -7.073 -5.593 11.567 1.00 0.00 H new ATOM 0 HB3 LEU A 567 -5.389 -5.181 11.824 1.00 0.00 H new ATOM 0 HG LEU A 567 -6.775 -5.749 9.192 1.00 0.00 H new ATOM 0 HD11 LEU A 567 -5.995 -3.480 8.648 1.00 0.00 H new ATOM 0 HD12 LEU A 567 -7.035 -3.490 10.091 1.00 0.00 H new ATOM 0 HD13 LEU A 567 -5.271 -3.343 10.268 1.00 0.00 H new ATOM 0 HD21 LEU A 567 -4.583 -5.439 8.115 1.00 0.00 H new ATOM 0 HD22 LEU A 567 -3.809 -5.373 9.716 1.00 0.00 H new ATOM 0 HD23 LEU A 567 -4.600 -6.871 9.172 1.00 0.00 H new ATOM 438 N ALA A 568 -4.491 -7.446 13.513 1.00 0.00 N ATOM 439 CA ALA A 568 -4.311 -7.703 14.937 1.00 0.00 C ATOM 440 C ALA A 568 -5.007 -6.640 15.781 1.00 0.00 C ATOM 441 O ALA A 568 -5.405 -5.593 15.274 1.00 0.00 O ATOM 442 CB ALA A 568 -2.832 -7.757 15.282 1.00 0.00 C ATOM 0 H ALA A 568 -3.638 -7.181 13.020 1.00 0.00 H new ATOM 0 HA ALA A 568 -4.764 -8.668 15.163 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -2.714 -7.950 16.348 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -2.355 -8.556 14.714 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -2.365 -6.805 15.031 1.00 0.00 H new ATOM 448 N ALA A 569 -5.144 -6.921 17.073 1.00 0.00 N ATOM 449 CA ALA A 569 -5.784 -5.995 18.000 1.00 0.00 C ATOM 450 C ALA A 569 -4.760 -5.399 18.958 1.00 0.00 C ATOM 451 O ALA A 569 -4.083 -6.122 19.691 1.00 0.00 O ATOM 452 CB ALA A 569 -6.888 -6.699 18.766 1.00 0.00 C ATOM 0 H ALA A 569 -4.819 -7.787 17.503 1.00 0.00 H new ATOM 0 HA ALA A 569 -6.225 -5.180 17.427 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -7.358 -5.997 19.455 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -7.634 -7.075 18.066 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -6.466 -7.532 19.329 1.00 0.00 H new ATOM 458 N MET A 570 -4.641 -4.079 18.929 1.00 0.00 N ATOM 459 CA MET A 570 -3.686 -3.374 19.777 1.00 0.00 C ATOM 460 C MET A 570 -4.329 -2.927 21.084 1.00 0.00 C ATOM 461 O MET A 570 -3.638 -2.627 22.057 1.00 0.00 O ATOM 462 CB MET A 570 -3.131 -2.166 19.025 1.00 0.00 C ATOM 463 CG MET A 570 -2.827 -2.456 17.564 1.00 0.00 C ATOM 464 SD MET A 570 -2.397 -4.184 17.268 1.00 0.00 S ATOM 465 CE MET A 570 -0.732 -3.995 16.679 1.00 0.00 C ATOM 0 H MET A 570 -5.195 -3.472 18.326 1.00 0.00 H new ATOM 0 HA MET A 570 -2.874 -4.058 20.023 1.00 0.00 H new ATOM 0 HB2 MET A 570 -3.849 -1.348 19.084 1.00 0.00 H new ATOM 0 HB3 MET A 570 -2.220 -1.827 19.518 1.00 0.00 H new ATOM 0 HG2 MET A 570 -3.694 -2.193 16.958 1.00 0.00 H new ATOM 0 HG3 MET A 570 -2.005 -1.820 17.236 1.00 0.00 H new ATOM 0 HE1 MET A 570 -0.487 -4.819 16.009 1.00 0.00 H new ATOM 0 HE2 MET A 570 -0.641 -3.051 16.142 1.00 0.00 H new ATOM 0 HE3 MET A 570 -0.044 -3.999 17.525 1.00 0.00 H new ATOM 475 N ASP A 571 -5.657 -2.877 21.095 1.00 0.00 N ATOM 476 CA ASP A 571 -6.394 -2.458 22.282 1.00 0.00 C ATOM 477 C ASP A 571 -6.874 -3.661 23.087 1.00 0.00 C ATOM 478 O ASP A 571 -6.940 -4.778 22.575 1.00 0.00 O ATOM 479 CB ASP A 571 -7.589 -1.589 21.886 1.00 0.00 C ATOM 480 CG ASP A 571 -7.171 -0.211 21.410 1.00 0.00 C ATOM 481 OD1 ASP A 571 -5.967 -0.017 21.140 1.00 0.00 O ATOM 482 OD2 ASP A 571 -8.046 0.673 21.309 1.00 0.00 O ATOM 0 H ASP A 571 -6.244 -3.121 20.297 1.00 0.00 H new ATOM 0 HA ASP A 571 -5.717 -1.876 22.907 1.00 0.00 H new ATOM 0 HB2 ASP A 571 -8.151 -2.088 21.097 1.00 0.00 H new ATOM 0 HB3 ASP A 571 -8.259 -1.487 22.740 1.00 0.00 H new ATOM 487 N ALA A 572 -7.210 -3.423 24.351 1.00 0.00 N ATOM 488 CA ALA A 572 -7.687 -4.483 25.230 1.00 0.00 C ATOM 489 C ALA A 572 -9.084 -4.942 24.825 1.00 0.00 C ATOM 490 O ALA A 572 -9.596 -5.934 25.345 1.00 0.00 O ATOM 491 CB ALA A 572 -7.685 -4.011 26.676 1.00 0.00 C ATOM 0 H ALA A 572 -7.160 -2.503 24.789 1.00 0.00 H new ATOM 0 HA ALA A 572 -7.010 -5.332 25.136 1.00 0.00 H new ATOM 0 HB1 ALA A 572 -8.044 -4.813 27.321 1.00 0.00 H new ATOM 0 HB2 ALA A 572 -6.671 -3.737 26.968 1.00 0.00 H new ATOM 0 HB3 ALA A 572 -8.339 -3.145 26.777 1.00 0.00 H new ATOM 497 N ASN A 573 -9.696 -4.217 23.893 1.00 0.00 N ATOM 498 CA ASN A 573 -11.032 -4.553 23.420 1.00 0.00 C ATOM 499 C ASN A 573 -10.974 -5.645 22.357 1.00 0.00 C ATOM 500 O ASN A 573 -12.002 -6.190 21.956 1.00 0.00 O ATOM 501 CB ASN A 573 -11.724 -3.309 22.855 1.00 0.00 C ATOM 502 CG ASN A 573 -13.234 -3.401 22.938 1.00 0.00 C ATOM 503 OD1 ASN A 573 -13.859 -4.200 22.241 1.00 0.00 O ATOM 504 ND2 ASN A 573 -13.829 -2.578 23.795 1.00 0.00 N ATOM 0 H ASN A 573 -9.287 -3.394 23.451 1.00 0.00 H new ATOM 0 HA ASN A 573 -11.607 -4.927 24.267 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -11.386 -2.429 23.401 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -11.428 -3.172 21.815 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -14.844 -2.593 23.895 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -13.271 -1.932 24.353 1.00 0.00 H new ATOM 511 N GLY A 574 -9.764 -5.961 21.906 1.00 0.00 N ATOM 512 CA GLY A 574 -9.596 -6.989 20.896 1.00 0.00 C ATOM 513 C GLY A 574 -9.578 -6.427 19.489 1.00 0.00 C ATOM 514 O GLY A 574 -9.738 -7.166 18.518 1.00 0.00 O ATOM 0 H GLY A 574 -8.898 -5.524 22.222 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -8.665 -7.526 21.081 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -10.405 -7.714 20.983 1.00 0.00 H new ATOM 518 N TYR A 575 -9.395 -5.114 19.378 1.00 0.00 N ATOM 519 CA TYR A 575 -9.367 -4.456 18.077 1.00 0.00 C ATOM 520 C TYR A 575 -8.102 -3.619 17.891 1.00 0.00 C ATOM 521 O TYR A 575 -7.168 -3.697 18.689 1.00 0.00 O ATOM 522 CB TYR A 575 -10.598 -3.576 17.911 1.00 0.00 C ATOM 523 CG TYR A 575 -11.723 -4.285 17.210 1.00 0.00 C ATOM 524 CD1 TYR A 575 -12.119 -5.543 17.622 1.00 0.00 C ATOM 525 CD2 TYR A 575 -12.378 -3.702 16.140 1.00 0.00 C ATOM 526 CE1 TYR A 575 -13.149 -6.210 16.986 1.00 0.00 C ATOM 527 CE2 TYR A 575 -13.408 -4.358 15.495 1.00 0.00 C ATOM 528 CZ TYR A 575 -13.792 -5.612 15.922 1.00 0.00 C ATOM 529 OH TYR A 575 -14.818 -6.270 15.283 1.00 0.00 O ATOM 0 H TYR A 575 -9.264 -4.487 20.172 1.00 0.00 H new ATOM 0 HA TYR A 575 -9.367 -5.234 17.314 1.00 0.00 H new ATOM 0 HB2 TYR A 575 -10.938 -3.244 18.892 1.00 0.00 H new ATOM 0 HB3 TYR A 575 -10.329 -2.683 17.347 1.00 0.00 H new ATOM 0 HD1 TYR A 575 -11.616 -6.013 18.454 1.00 0.00 H new ATOM 0 HD2 TYR A 575 -12.080 -2.720 15.804 1.00 0.00 H new ATOM 0 HE1 TYR A 575 -13.448 -7.193 17.320 1.00 0.00 H new ATOM 0 HE2 TYR A 575 -13.910 -3.891 14.660 1.00 0.00 H new ATOM 0 HH TYR A 575 -15.163 -5.710 14.557 1.00 0.00 H new ATOM 539 N SER A 576 -8.085 -2.814 16.827 1.00 0.00 N ATOM 540 CA SER A 576 -6.940 -1.955 16.530 1.00 0.00 C ATOM 541 C SER A 576 -7.379 -0.705 15.767 1.00 0.00 C ATOM 542 O SER A 576 -8.561 -0.530 15.471 1.00 0.00 O ATOM 543 CB SER A 576 -5.894 -2.711 15.702 1.00 0.00 C ATOM 544 OG SER A 576 -5.170 -3.632 16.497 1.00 0.00 O ATOM 0 H SER A 576 -8.851 -2.740 16.158 1.00 0.00 H new ATOM 0 HA SER A 576 -6.498 -1.656 17.481 1.00 0.00 H new ATOM 0 HB2 SER A 576 -6.387 -3.241 14.887 1.00 0.00 H new ATOM 0 HB3 SER A 576 -5.204 -2.000 15.248 1.00 0.00 H new ATOM 0 HG SER A 576 -4.733 -4.291 15.918 1.00 0.00 H new ATOM 550 N ASP A 577 -6.414 0.148 15.438 1.00 0.00 N ATOM 551 CA ASP A 577 -6.685 1.375 14.690 1.00 0.00 C ATOM 552 C ASP A 577 -5.712 1.483 13.523 1.00 0.00 C ATOM 553 O ASP A 577 -4.922 2.422 13.432 1.00 0.00 O ATOM 554 CB ASP A 577 -6.556 2.601 15.600 1.00 0.00 C ATOM 555 CG ASP A 577 -7.205 2.386 16.954 1.00 0.00 C ATOM 556 OD1 ASP A 577 -8.450 2.307 17.011 1.00 0.00 O ATOM 557 OD2 ASP A 577 -6.467 2.297 17.958 1.00 0.00 O ATOM 0 H ASP A 577 -5.432 0.013 15.678 1.00 0.00 H new ATOM 0 HA ASP A 577 -7.706 1.339 14.309 1.00 0.00 H new ATOM 0 HB2 ASP A 577 -5.501 2.838 15.739 1.00 0.00 H new ATOM 0 HB3 ASP A 577 -7.014 3.462 15.113 1.00 0.00 H new ATOM 562 N PRO A 578 -5.741 0.480 12.639 1.00 0.00 N ATOM 563 CA PRO A 578 -4.842 0.393 11.482 1.00 0.00 C ATOM 564 C PRO A 578 -5.072 1.436 10.391 1.00 0.00 C ATOM 565 O PRO A 578 -6.193 1.880 10.141 1.00 0.00 O ATOM 566 CB PRO A 578 -5.124 -0.999 10.916 1.00 0.00 C ATOM 567 CG PRO A 578 -6.493 -1.339 11.392 1.00 0.00 C ATOM 568 CD PRO A 578 -6.636 -0.684 12.733 1.00 0.00 C ATOM 0 HA PRO A 578 -3.816 0.575 11.803 1.00 0.00 H new ATOM 0 HB2 PRO A 578 -5.073 -1.000 9.827 1.00 0.00 H new ATOM 0 HB3 PRO A 578 -4.392 -1.725 11.270 1.00 0.00 H new ATOM 0 HG2 PRO A 578 -7.250 -0.975 10.697 1.00 0.00 H new ATOM 0 HG3 PRO A 578 -6.623 -2.418 11.469 1.00 0.00 H new ATOM 0 HD2 PRO A 578 -7.666 -0.385 12.927 1.00 0.00 H new ATOM 0 HD3 PRO A 578 -6.341 -1.354 13.541 1.00 0.00 H new ATOM 576 N PHE A 579 -3.973 1.766 9.721 1.00 0.00 N ATOM 577 CA PHE A 579 -3.952 2.699 8.603 1.00 0.00 C ATOM 578 C PHE A 579 -2.867 2.238 7.635 1.00 0.00 C ATOM 579 O PHE A 579 -1.997 1.458 8.020 1.00 0.00 O ATOM 580 CB PHE A 579 -3.690 4.134 9.067 1.00 0.00 C ATOM 581 CG PHE A 579 -2.386 4.324 9.789 1.00 0.00 C ATOM 582 CD1 PHE A 579 -2.224 3.882 11.094 1.00 0.00 C ATOM 583 CD2 PHE A 579 -1.323 4.959 9.166 1.00 0.00 C ATOM 584 CE1 PHE A 579 -1.029 4.071 11.761 1.00 0.00 C ATOM 585 CE2 PHE A 579 -0.126 5.149 9.828 1.00 0.00 C ATOM 586 CZ PHE A 579 0.022 4.705 11.127 1.00 0.00 C ATOM 0 H PHE A 579 -3.054 1.384 9.945 1.00 0.00 H new ATOM 0 HA PHE A 579 -4.926 2.705 8.114 1.00 0.00 H new ATOM 0 HB2 PHE A 579 -3.710 4.793 8.199 1.00 0.00 H new ATOM 0 HB3 PHE A 579 -4.503 4.445 9.723 1.00 0.00 H new ATOM 0 HD1 PHE A 579 -3.042 3.384 11.594 1.00 0.00 H new ATOM 0 HD2 PHE A 579 -1.432 5.310 8.150 1.00 0.00 H new ATOM 0 HE1 PHE A 579 -0.917 3.723 12.777 1.00 0.00 H new ATOM 0 HE2 PHE A 579 0.694 5.645 9.330 1.00 0.00 H new ATOM 0 HZ PHE A 579 0.957 4.853 11.646 1.00 0.00 H new ATOM 596 N VAL A 580 -2.910 2.681 6.385 1.00 0.00 N ATOM 597 CA VAL A 580 -1.904 2.241 5.422 1.00 0.00 C ATOM 598 C VAL A 580 -1.022 3.378 4.932 1.00 0.00 C ATOM 599 O VAL A 580 -1.504 4.443 4.546 1.00 0.00 O ATOM 600 CB VAL A 580 -2.537 1.545 4.201 1.00 0.00 C ATOM 601 CG1 VAL A 580 -1.457 0.945 3.316 1.00 0.00 C ATOM 602 CG2 VAL A 580 -3.520 0.475 4.642 1.00 0.00 C ATOM 0 H VAL A 580 -3.609 3.327 6.019 1.00 0.00 H new ATOM 0 HA VAL A 580 -1.284 1.528 5.965 1.00 0.00 H new ATOM 0 HB VAL A 580 -3.083 2.292 3.625 1.00 0.00 H new ATOM 0 HG11 VAL A 580 -1.919 0.457 2.458 1.00 0.00 H new ATOM 0 HG12 VAL A 580 -0.791 1.735 2.969 1.00 0.00 H new ATOM 0 HG13 VAL A 580 -0.885 0.212 3.886 1.00 0.00 H new ATOM 0 HG21 VAL A 580 -3.955 -0.003 3.764 1.00 0.00 H new ATOM 0 HG22 VAL A 580 -3.000 -0.272 5.242 1.00 0.00 H new ATOM 0 HG23 VAL A 580 -4.312 0.931 5.236 1.00 0.00 H new ATOM 612 N LYS A 581 0.281 3.121 4.929 1.00 0.00 N ATOM 613 CA LYS A 581 1.264 4.089 4.465 1.00 0.00 C ATOM 614 C LYS A 581 1.965 3.547 3.227 1.00 0.00 C ATOM 615 O LYS A 581 2.369 2.385 3.193 1.00 0.00 O ATOM 616 CB LYS A 581 2.284 4.386 5.566 1.00 0.00 C ATOM 617 CG LYS A 581 1.662 4.936 6.840 1.00 0.00 C ATOM 618 CD LYS A 581 2.400 4.445 8.075 1.00 0.00 C ATOM 619 CE LYS A 581 3.216 5.556 8.714 1.00 0.00 C ATOM 620 NZ LYS A 581 4.614 5.126 8.995 1.00 0.00 N ATOM 0 H LYS A 581 0.683 2.239 5.247 1.00 0.00 H new ATOM 0 HA LYS A 581 0.756 5.019 4.212 1.00 0.00 H new ATOM 0 HB2 LYS A 581 2.827 3.471 5.803 1.00 0.00 H new ATOM 0 HB3 LYS A 581 3.014 5.102 5.190 1.00 0.00 H new ATOM 0 HG2 LYS A 581 1.679 6.026 6.814 1.00 0.00 H new ATOM 0 HG3 LYS A 581 0.616 4.634 6.896 1.00 0.00 H new ATOM 0 HD2 LYS A 581 1.683 4.057 8.798 1.00 0.00 H new ATOM 0 HD3 LYS A 581 3.058 3.619 7.803 1.00 0.00 H new ATOM 0 HE2 LYS A 581 3.229 6.423 8.054 1.00 0.00 H new ATOM 0 HE3 LYS A 581 2.739 5.869 9.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 5.138 5.912 9.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 4.604 4.314 9.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 5.078 4.851 8.106 1.00 0.00 H new ATOM 634 N LEU A 582 2.083 4.378 2.201 1.00 0.00 N ATOM 635 CA LEU A 582 2.710 3.955 0.957 1.00 0.00 C ATOM 636 C LEU A 582 3.926 4.806 0.618 1.00 0.00 C ATOM 637 O LEU A 582 3.917 6.024 0.792 1.00 0.00 O ATOM 638 CB LEU A 582 1.694 4.028 -0.178 1.00 0.00 C ATOM 639 CG LEU A 582 0.237 3.945 0.271 1.00 0.00 C ATOM 640 CD1 LEU A 582 -0.455 5.286 0.094 1.00 0.00 C ATOM 641 CD2 LEU A 582 -0.488 2.855 -0.497 1.00 0.00 C ATOM 0 H LEU A 582 1.755 5.344 2.205 1.00 0.00 H new ATOM 0 HA LEU A 582 3.051 2.928 1.086 1.00 0.00 H new ATOM 0 HB2 LEU A 582 1.841 4.962 -0.721 1.00 0.00 H new ATOM 0 HB3 LEU A 582 1.892 3.217 -0.879 1.00 0.00 H new ATOM 0 HG LEU A 582 0.213 3.692 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -1.492 5.206 0.420 1.00 0.00 H new ATOM 0 HD12 LEU A 582 0.056 6.041 0.692 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -0.426 5.575 -0.957 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -1.526 2.806 -0.167 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -0.456 3.079 -1.563 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -0.003 1.896 -0.313 1.00 0.00 H new ATOM 653 N TRP A 583 4.970 4.149 0.123 1.00 0.00 N ATOM 654 CA TRP A 583 6.197 4.840 -0.253 1.00 0.00 C ATOM 655 C TRP A 583 6.896 4.123 -1.404 1.00 0.00 C ATOM 656 O TRP A 583 7.290 2.963 -1.279 1.00 0.00 O ATOM 657 CB TRP A 583 7.141 4.944 0.945 1.00 0.00 C ATOM 658 CG TRP A 583 8.555 5.239 0.555 1.00 0.00 C ATOM 659 CD1 TRP A 583 8.979 5.829 -0.601 1.00 0.00 C ATOM 660 CD2 TRP A 583 9.730 4.958 1.317 1.00 0.00 C ATOM 661 NE1 TRP A 583 10.346 5.922 -0.608 1.00 0.00 N ATOM 662 CE2 TRP A 583 10.833 5.398 0.561 1.00 0.00 C ATOM 663 CE3 TRP A 583 9.956 4.377 2.567 1.00 0.00 C ATOM 664 CZ2 TRP A 583 12.143 5.273 1.016 1.00 0.00 C ATOM 665 CZ3 TRP A 583 11.257 4.254 3.018 1.00 0.00 C ATOM 666 CH2 TRP A 583 12.336 4.701 2.245 1.00 0.00 C ATOM 0 H TRP A 583 4.990 3.140 -0.027 1.00 0.00 H new ATOM 0 HA TRP A 583 5.929 5.844 -0.582 1.00 0.00 H new ATOM 0 HB2 TRP A 583 6.784 5.727 1.614 1.00 0.00 H new ATOM 0 HB3 TRP A 583 7.112 4.009 1.505 1.00 0.00 H new ATOM 0 HD1 TRP A 583 8.331 6.172 -1.394 1.00 0.00 H new ATOM 0 HE1 TRP A 583 10.910 6.317 -1.361 1.00 0.00 H new ATOM 0 HE3 TRP A 583 9.130 4.030 3.170 1.00 0.00 H new ATOM 0 HZ2 TRP A 583 12.977 5.615 0.421 1.00 0.00 H new ATOM 0 HZ3 TRP A 583 11.444 3.806 3.983 1.00 0.00 H new ATOM 0 HH2 TRP A 583 13.341 4.592 2.626 1.00 0.00 H new ATOM 677 N LEU A 584 7.054 4.825 -2.521 1.00 0.00 N ATOM 678 CA LEU A 584 7.715 4.263 -3.693 1.00 0.00 C ATOM 679 C LEU A 584 9.204 4.595 -3.686 1.00 0.00 C ATOM 680 O LEU A 584 9.600 5.737 -3.920 1.00 0.00 O ATOM 681 CB LEU A 584 7.057 4.788 -4.972 1.00 0.00 C ATOM 682 CG LEU A 584 7.532 4.135 -6.270 1.00 0.00 C ATOM 683 CD1 LEU A 584 6.968 2.728 -6.393 1.00 0.00 C ATOM 684 CD2 LEU A 584 7.128 4.979 -7.471 1.00 0.00 C ATOM 0 H LEU A 584 6.733 5.786 -2.639 1.00 0.00 H new ATOM 0 HA LEU A 584 7.608 3.179 -3.662 1.00 0.00 H new ATOM 0 HB2 LEU A 584 5.979 4.649 -4.889 1.00 0.00 H new ATOM 0 HB3 LEU A 584 7.236 5.861 -5.038 1.00 0.00 H new ATOM 0 HG LEU A 584 8.620 4.070 -6.246 1.00 0.00 H new ATOM 0 HD11 LEU A 584 7.315 2.277 -7.322 1.00 0.00 H new ATOM 0 HD12 LEU A 584 7.305 2.126 -5.549 1.00 0.00 H new ATOM 0 HD13 LEU A 584 5.879 2.772 -6.396 1.00 0.00 H new ATOM 0 HD21 LEU A 584 7.474 4.499 -8.386 1.00 0.00 H new ATOM 0 HD22 LEU A 584 6.043 5.075 -7.500 1.00 0.00 H new ATOM 0 HD23 LEU A 584 7.577 5.969 -7.388 1.00 0.00 H new ATOM 696 N LYS A 585 10.024 3.586 -3.407 1.00 0.00 N ATOM 697 CA LYS A 585 11.471 3.761 -3.360 1.00 0.00 C ATOM 698 C LYS A 585 12.093 3.534 -4.735 1.00 0.00 C ATOM 699 O LYS A 585 11.517 2.852 -5.582 1.00 0.00 O ATOM 700 CB LYS A 585 12.084 2.796 -2.342 1.00 0.00 C ATOM 701 CG LYS A 585 11.344 2.765 -1.015 1.00 0.00 C ATOM 702 CD LYS A 585 11.104 1.341 -0.543 1.00 0.00 C ATOM 703 CE LYS A 585 12.398 0.545 -0.490 1.00 0.00 C ATOM 704 NZ LYS A 585 13.384 1.149 0.449 1.00 0.00 N ATOM 0 H LYS A 585 9.709 2.636 -3.210 1.00 0.00 H new ATOM 0 HA LYS A 585 11.681 4.786 -3.054 1.00 0.00 H new ATOM 0 HB2 LYS A 585 12.096 1.792 -2.766 1.00 0.00 H new ATOM 0 HB3 LYS A 585 13.122 3.079 -2.164 1.00 0.00 H new ATOM 0 HG2 LYS A 585 11.919 3.306 -0.264 1.00 0.00 H new ATOM 0 HG3 LYS A 585 10.389 3.281 -1.118 1.00 0.00 H new ATOM 0 HD2 LYS A 585 10.645 1.357 0.445 1.00 0.00 H new ATOM 0 HD3 LYS A 585 10.400 0.848 -1.214 1.00 0.00 H new ATOM 0 HE2 LYS A 585 12.182 -0.478 -0.181 1.00 0.00 H new ATOM 0 HE3 LYS A 585 12.833 0.492 -1.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 585 14.211 0.524 0.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 585 13.686 2.076 0.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 585 12.944 1.270 1.384 1.00 0.00 H new ATOM 812 N ALA A 592 7.651 10.678 -0.855 1.00 0.00 N ATOM 813 CA ALA A 592 7.039 9.543 -1.535 1.00 0.00 C ATOM 814 C ALA A 592 6.187 8.720 -0.574 1.00 0.00 C ATOM 815 O ALA A 592 5.326 7.950 -0.998 1.00 0.00 O ATOM 816 CB ALA A 592 8.110 8.671 -2.175 1.00 0.00 C ATOM 0 HA ALA A 592 6.385 9.929 -2.317 1.00 0.00 H new ATOM 0 HB1 ALA A 592 7.639 7.827 -2.679 1.00 0.00 H new ATOM 0 HB2 ALA A 592 8.673 9.259 -2.900 1.00 0.00 H new ATOM 0 HB3 ALA A 592 8.787 8.301 -1.404 1.00 0.00 H new ATOM 822 N LYS A 593 6.432 8.886 0.721 1.00 0.00 N ATOM 823 CA LYS A 593 5.684 8.155 1.739 1.00 0.00 C ATOM 824 C LYS A 593 4.287 8.737 1.914 1.00 0.00 C ATOM 825 O LYS A 593 4.065 9.927 1.687 1.00 0.00 O ATOM 826 CB LYS A 593 6.430 8.185 3.073 1.00 0.00 C ATOM 827 CG LYS A 593 7.664 7.298 3.099 1.00 0.00 C ATOM 828 CD LYS A 593 8.636 7.735 4.180 1.00 0.00 C ATOM 829 CE LYS A 593 10.074 7.410 3.803 1.00 0.00 C ATOM 830 NZ LYS A 593 10.847 8.634 3.453 1.00 0.00 N ATOM 0 H LYS A 593 7.141 9.519 1.091 1.00 0.00 H new ATOM 0 HA LYS A 593 5.588 7.121 1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 593 6.725 9.211 3.292 1.00 0.00 H new ATOM 0 HB3 LYS A 593 5.751 7.873 3.867 1.00 0.00 H new ATOM 0 HG2 LYS A 593 7.367 6.263 3.271 1.00 0.00 H new ATOM 0 HG3 LYS A 593 8.158 7.331 2.128 1.00 0.00 H new ATOM 0 HD2 LYS A 593 8.537 8.807 4.348 1.00 0.00 H new ATOM 0 HD3 LYS A 593 8.384 7.241 5.118 1.00 0.00 H new ATOM 0 HE2 LYS A 593 10.560 6.899 4.634 1.00 0.00 H new ATOM 0 HE3 LYS A 593 10.081 6.722 2.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 593 11.821 8.370 3.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 593 10.398 9.109 2.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 593 10.863 9.280 4.268 1.00 0.00 H new ATOM 844 N HIS A 594 3.347 7.891 2.323 1.00 0.00 N ATOM 845 CA HIS A 594 1.969 8.321 2.532 1.00 0.00 C ATOM 846 C HIS A 594 1.333 7.578 3.703 1.00 0.00 C ATOM 847 O HIS A 594 1.946 6.696 4.301 1.00 0.00 O ATOM 848 CB HIS A 594 1.134 8.090 1.270 1.00 0.00 C ATOM 849 CG HIS A 594 1.613 8.862 0.078 1.00 0.00 C ATOM 850 ND1 HIS A 594 2.184 10.113 0.170 1.00 0.00 N ATOM 851 CD2 HIS A 594 1.601 8.552 -1.240 1.00 0.00 C ATOM 852 CE1 HIS A 594 2.501 10.540 -1.040 1.00 0.00 C ATOM 853 NE2 HIS A 594 2.158 9.610 -1.912 1.00 0.00 N ATOM 0 H HIS A 594 3.514 6.904 2.516 1.00 0.00 H new ATOM 0 HA HIS A 594 1.989 9.387 2.761 1.00 0.00 H new ATOM 0 HB2 HIS A 594 1.142 7.027 1.030 1.00 0.00 H new ATOM 0 HB3 HIS A 594 0.099 8.362 1.476 1.00 0.00 H new ATOM 0 HD1 HIS A 594 2.338 10.629 1.036 1.00 0.00 H new ATOM 0 HD2 HIS A 594 1.223 7.641 -1.680 1.00 0.00 H new ATOM 0 HE1 HIS A 594 2.962 11.488 -1.275 1.00 0.00 H new ATOM 862 N LYS A 595 0.093 7.945 4.016 1.00 0.00 N ATOM 863 CA LYS A 595 -0.647 7.319 5.105 1.00 0.00 C ATOM 864 C LYS A 595 -2.145 7.577 4.939 1.00 0.00 C ATOM 865 O LYS A 595 -2.585 8.726 4.924 1.00 0.00 O ATOM 866 CB LYS A 595 -0.140 7.837 6.464 1.00 0.00 C ATOM 867 CG LYS A 595 -1.121 8.727 7.217 1.00 0.00 C ATOM 868 CD LYS A 595 -1.166 10.129 6.633 1.00 0.00 C ATOM 869 CE LYS A 595 -0.857 11.181 7.687 1.00 0.00 C ATOM 870 NZ LYS A 595 -2.086 11.644 8.387 1.00 0.00 N ATOM 0 H LYS A 595 -0.422 8.677 3.527 1.00 0.00 H new ATOM 0 HA LYS A 595 -0.482 6.242 5.074 1.00 0.00 H new ATOM 0 HB2 LYS A 595 0.109 6.982 7.093 1.00 0.00 H new ATOM 0 HB3 LYS A 595 0.783 8.394 6.303 1.00 0.00 H new ATOM 0 HG2 LYS A 595 -2.117 8.285 7.180 1.00 0.00 H new ATOM 0 HG3 LYS A 595 -0.834 8.779 8.267 1.00 0.00 H new ATOM 0 HD2 LYS A 595 -0.448 10.208 5.817 1.00 0.00 H new ATOM 0 HD3 LYS A 595 -2.152 10.316 6.209 1.00 0.00 H new ATOM 0 HE2 LYS A 595 -0.157 10.771 8.415 1.00 0.00 H new ATOM 0 HE3 LYS A 595 -0.365 12.032 7.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 -1.832 12.360 9.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 -2.743 12.059 7.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 -2.543 10.837 8.858 1.00 0.00 H new ATOM 884 N THR A 596 -2.924 6.506 4.809 1.00 0.00 N ATOM 885 CA THR A 596 -4.367 6.640 4.638 1.00 0.00 C ATOM 886 C THR A 596 -5.047 6.927 5.969 1.00 0.00 C ATOM 887 O THR A 596 -4.475 6.696 7.034 1.00 0.00 O ATOM 888 CB THR A 596 -4.954 5.371 4.019 1.00 0.00 C ATOM 889 OG1 THR A 596 -5.135 4.370 5.004 1.00 0.00 O ATOM 890 CG2 THR A 596 -4.093 4.786 2.923 1.00 0.00 C ATOM 0 H THR A 596 -2.584 5.544 4.819 1.00 0.00 H new ATOM 0 HA THR A 596 -4.548 7.479 3.966 1.00 0.00 H new ATOM 0 HB THR A 596 -5.907 5.676 3.586 1.00 0.00 H new ATOM 0 HG1 THR A 596 -5.984 3.906 4.847 1.00 0.00 H new ATOM 0 HG21 THR A 596 -4.568 3.888 2.528 1.00 0.00 H new ATOM 0 HG22 THR A 596 -3.976 5.517 2.123 1.00 0.00 H new ATOM 0 HG23 THR A 596 -3.113 4.531 3.327 1.00 0.00 H new ATOM 898 N GLN A 597 -6.273 7.432 5.901 1.00 0.00 N ATOM 899 CA GLN A 597 -7.033 7.749 7.102 1.00 0.00 C ATOM 900 C GLN A 597 -6.985 6.592 8.094 1.00 0.00 C ATOM 901 O GLN A 597 -6.779 5.440 7.712 1.00 0.00 O ATOM 902 CB GLN A 597 -8.485 8.073 6.743 1.00 0.00 C ATOM 903 CG GLN A 597 -9.363 6.841 6.592 1.00 0.00 C ATOM 904 CD GLN A 597 -10.264 6.914 5.374 1.00 0.00 C ATOM 905 OE1 GLN A 597 -11.152 7.763 5.295 1.00 0.00 O ATOM 906 NE2 GLN A 597 -10.040 6.021 4.417 1.00 0.00 N ATOM 0 H GLN A 597 -6.761 7.630 5.027 1.00 0.00 H new ATOM 0 HA GLN A 597 -6.581 8.624 7.569 1.00 0.00 H new ATOM 0 HB2 GLN A 597 -8.906 8.717 7.515 1.00 0.00 H new ATOM 0 HB3 GLN A 597 -8.503 8.638 5.811 1.00 0.00 H new ATOM 0 HG2 GLN A 597 -8.731 5.956 6.520 1.00 0.00 H new ATOM 0 HG3 GLN A 597 -9.975 6.724 7.486 1.00 0.00 H new ATOM 0 HE21 GLN A 597 -9.293 5.335 4.524 1.00 0.00 H new ATOM 0 HE22 GLN A 597 -10.615 6.021 3.575 1.00 0.00 H new ATOM 915 N ILE A 598 -7.181 6.908 9.368 1.00 0.00 N ATOM 916 CA ILE A 598 -7.165 5.899 10.421 1.00 0.00 C ATOM 917 C ILE A 598 -8.547 5.278 10.591 1.00 0.00 C ATOM 918 O ILE A 598 -9.533 5.991 10.784 1.00 0.00 O ATOM 919 CB ILE A 598 -6.738 6.501 11.776 1.00 0.00 C ATOM 920 CG1 ILE A 598 -5.686 7.605 11.585 1.00 0.00 C ATOM 921 CG2 ILE A 598 -6.227 5.410 12.703 1.00 0.00 C ATOM 922 CD1 ILE A 598 -4.252 7.113 11.550 1.00 0.00 C ATOM 0 H ILE A 598 -7.353 7.858 9.698 1.00 0.00 H new ATOM 0 HA ILE A 598 -6.444 5.139 10.120 1.00 0.00 H new ATOM 0 HB ILE A 598 -7.613 6.959 12.238 1.00 0.00 H new ATOM 0 HG12 ILE A 598 -5.898 8.133 10.655 1.00 0.00 H new ATOM 0 HG13 ILE A 598 -5.788 8.329 12.393 1.00 0.00 H new ATOM 0 HG21 ILE A 598 -5.930 5.851 13.655 1.00 0.00 H new ATOM 0 HG22 ILE A 598 -7.016 4.678 12.873 1.00 0.00 H new ATOM 0 HG23 ILE A 598 -5.368 4.918 12.247 1.00 0.00 H new ATOM 0 HD11 ILE A 598 -3.580 7.960 11.412 1.00 0.00 H new ATOM 0 HD12 ILE A 598 -4.016 6.612 12.489 1.00 0.00 H new ATOM 0 HD13 ILE A 598 -4.128 6.413 10.724 1.00 0.00 H new ATOM 934 N LYS A 599 -8.619 3.953 10.534 1.00 0.00 N ATOM 935 CA LYS A 599 -9.893 3.264 10.700 1.00 0.00 C ATOM 936 C LYS A 599 -10.055 2.793 12.139 1.00 0.00 C ATOM 937 O LYS A 599 -10.595 1.719 12.402 1.00 0.00 O ATOM 938 CB LYS A 599 -9.995 2.084 9.733 1.00 0.00 C ATOM 939 CG LYS A 599 -11.067 2.270 8.671 1.00 0.00 C ATOM 940 CD LYS A 599 -10.465 2.338 7.277 1.00 0.00 C ATOM 941 CE LYS A 599 -10.359 3.774 6.786 1.00 0.00 C ATOM 942 NZ LYS A 599 -11.700 4.377 6.541 1.00 0.00 N ATOM 0 H LYS A 599 -7.819 3.340 10.376 1.00 0.00 H new ATOM 0 HA LYS A 599 -10.698 3.963 10.472 1.00 0.00 H new ATOM 0 HB2 LYS A 599 -9.031 1.938 9.245 1.00 0.00 H new ATOM 0 HB3 LYS A 599 -10.207 1.177 10.299 1.00 0.00 H new ATOM 0 HG2 LYS A 599 -11.778 1.445 8.722 1.00 0.00 H new ATOM 0 HG3 LYS A 599 -11.625 3.184 8.872 1.00 0.00 H new ATOM 0 HD2 LYS A 599 -9.476 1.881 7.284 1.00 0.00 H new ATOM 0 HD3 LYS A 599 -11.079 1.760 6.586 1.00 0.00 H new ATOM 0 HE2 LYS A 599 -9.821 4.371 7.523 1.00 0.00 H new ATOM 0 HE3 LYS A 599 -9.775 3.801 5.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 -11.815 4.567 5.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 -12.440 3.717 6.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 -11.782 5.268 7.071 1.00 0.00 H new ATOM 956 N LYS A 600 -9.570 3.616 13.063 1.00 0.00 N ATOM 957 CA LYS A 600 -9.631 3.318 14.492 1.00 0.00 C ATOM 958 C LYS A 600 -10.827 2.439 14.846 1.00 0.00 C ATOM 959 O LYS A 600 -11.926 2.618 14.322 1.00 0.00 O ATOM 960 CB LYS A 600 -9.695 4.616 15.305 1.00 0.00 C ATOM 961 CG LYS A 600 -8.991 5.793 14.646 1.00 0.00 C ATOM 962 CD LYS A 600 -8.422 6.750 15.680 1.00 0.00 C ATOM 963 CE LYS A 600 -8.381 8.177 15.161 1.00 0.00 C ATOM 964 NZ LYS A 600 -9.583 8.954 15.574 1.00 0.00 N ATOM 0 H LYS A 600 -9.124 4.507 12.844 1.00 0.00 H new ATOM 0 HA LYS A 600 -8.723 2.768 14.742 1.00 0.00 H new ATOM 0 HB2 LYS A 600 -10.740 4.877 15.471 1.00 0.00 H new ATOM 0 HB3 LYS A 600 -9.250 4.442 16.285 1.00 0.00 H new ATOM 0 HG2 LYS A 600 -8.188 5.427 14.007 1.00 0.00 H new ATOM 0 HG3 LYS A 600 -9.693 6.325 14.003 1.00 0.00 H new ATOM 0 HD2 LYS A 600 -9.027 6.709 16.586 1.00 0.00 H new ATOM 0 HD3 LYS A 600 -7.416 6.433 15.954 1.00 0.00 H new ATOM 0 HE2 LYS A 600 -7.484 8.672 15.532 1.00 0.00 H new ATOM 0 HE3 LYS A 600 -8.312 8.166 14.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 600 -9.516 9.922 15.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 600 -10.438 8.496 15.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 600 -9.635 8.987 16.612 1.00 0.00 H new ATOM 978 N LYS A 601 -10.598 1.497 15.757 1.00 0.00 N ATOM 979 CA LYS A 601 -11.645 0.589 16.216 1.00 0.00 C ATOM 980 C LYS A 601 -12.082 -0.381 15.124 1.00 0.00 C ATOM 981 O LYS A 601 -13.256 -0.426 14.762 1.00 0.00 O ATOM 982 CB LYS A 601 -12.853 1.385 16.713 1.00 0.00 C ATOM 983 CG LYS A 601 -12.784 1.734 18.191 1.00 0.00 C ATOM 984 CD LYS A 601 -11.720 2.784 18.467 1.00 0.00 C ATOM 985 CE LYS A 601 -12.340 4.127 18.819 1.00 0.00 C ATOM 986 NZ LYS A 601 -11.307 5.187 18.989 1.00 0.00 N ATOM 0 H LYS A 601 -9.690 1.342 16.195 1.00 0.00 H new ATOM 0 HA LYS A 601 -11.228 0.002 17.035 1.00 0.00 H new ATOM 0 HB2 LYS A 601 -12.935 2.305 16.134 1.00 0.00 H new ATOM 0 HB3 LYS A 601 -13.759 0.809 16.526 1.00 0.00 H new ATOM 0 HG2 LYS A 601 -13.754 2.102 18.525 1.00 0.00 H new ATOM 0 HG3 LYS A 601 -12.568 0.835 18.768 1.00 0.00 H new ATOM 0 HD2 LYS A 601 -11.082 2.451 19.286 1.00 0.00 H new ATOM 0 HD3 LYS A 601 -11.081 2.895 17.591 1.00 0.00 H new ATOM 0 HE2 LYS A 601 -13.037 4.422 18.035 1.00 0.00 H new ATOM 0 HE3 LYS A 601 -12.917 4.031 19.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 601 -11.769 6.087 19.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 601 -10.656 4.918 19.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 601 -10.773 5.297 18.103 1.00 0.00 H new ATOM 1000 N THR A 602 -11.139 -1.165 14.610 1.00 0.00 N ATOM 1001 CA THR A 602 -11.455 -2.137 13.569 1.00 0.00 C ATOM 1002 C THR A 602 -10.214 -2.900 13.117 1.00 0.00 C ATOM 1003 O THR A 602 -9.106 -2.364 13.114 1.00 0.00 O ATOM 1004 CB THR A 602 -12.087 -1.435 12.375 1.00 0.00 C ATOM 1005 OG1 THR A 602 -12.712 -2.371 11.514 1.00 0.00 O ATOM 1006 CG2 THR A 602 -11.084 -0.657 11.563 1.00 0.00 C ATOM 0 H THR A 602 -10.159 -1.147 14.894 1.00 0.00 H new ATOM 0 HA THR A 602 -12.159 -2.855 13.989 1.00 0.00 H new ATOM 0 HB THR A 602 -12.819 -0.742 12.790 1.00 0.00 H new ATOM 0 HG1 THR A 602 -13.113 -1.900 10.754 1.00 0.00 H new ATOM 0 HG21 THR A 602 -11.589 -0.177 10.725 1.00 0.00 H new ATOM 0 HG22 THR A 602 -10.619 0.103 12.191 1.00 0.00 H new ATOM 0 HG23 THR A 602 -10.318 -1.334 11.186 1.00 0.00 H new ATOM 1014 N LEU A 603 -10.418 -4.155 12.726 1.00 0.00 N ATOM 1015 CA LEU A 603 -9.327 -5.005 12.259 1.00 0.00 C ATOM 1016 C LEU A 603 -9.527 -5.386 10.794 1.00 0.00 C ATOM 1017 O LEU A 603 -8.618 -5.904 10.147 1.00 0.00 O ATOM 1018 CB LEU A 603 -9.241 -6.274 13.108 1.00 0.00 C ATOM 1019 CG LEU A 603 -9.204 -6.051 14.621 1.00 0.00 C ATOM 1020 CD1 LEU A 603 -8.803 -7.331 15.339 1.00 0.00 C ATOM 1021 CD2 LEU A 603 -8.248 -4.924 14.973 1.00 0.00 C ATOM 0 H LEU A 603 -11.332 -4.607 12.723 1.00 0.00 H new ATOM 0 HA LEU A 603 -8.398 -4.443 12.354 1.00 0.00 H new ATOM 0 HB2 LEU A 603 -10.096 -6.907 12.872 1.00 0.00 H new ATOM 0 HB3 LEU A 603 -8.347 -6.825 12.817 1.00 0.00 H new ATOM 0 HG LEU A 603 -10.204 -5.769 14.950 1.00 0.00 H new ATOM 0 HD11 LEU A 603 -8.782 -7.154 16.414 1.00 0.00 H new ATOM 0 HD12 LEU A 603 -9.526 -8.116 15.115 1.00 0.00 H new ATOM 0 HD13 LEU A 603 -7.814 -7.642 15.003 1.00 0.00 H new ATOM 0 HD21 LEU A 603 -8.236 -4.781 16.054 1.00 0.00 H new ATOM 0 HD22 LEU A 603 -7.245 -5.177 14.629 1.00 0.00 H new ATOM 0 HD23 LEU A 603 -8.576 -4.004 14.489 1.00 0.00 H new ATOM 1033 N ASN A 604 -10.726 -5.132 10.282 1.00 0.00 N ATOM 1034 CA ASN A 604 -11.053 -5.452 8.896 1.00 0.00 C ATOM 1035 C ASN A 604 -11.776 -4.286 8.226 1.00 0.00 C ATOM 1036 O ASN A 604 -12.860 -4.451 7.666 1.00 0.00 O ATOM 1037 CB ASN A 604 -11.927 -6.706 8.839 1.00 0.00 C ATOM 1038 CG ASN A 604 -11.616 -7.678 9.961 1.00 0.00 C ATOM 1039 OD1 ASN A 604 -11.025 -8.734 9.736 1.00 0.00 O ATOM 1040 ND2 ASN A 604 -12.012 -7.323 11.178 1.00 0.00 N ATOM 0 H ASN A 604 -11.489 -4.705 10.806 1.00 0.00 H new ATOM 0 HA ASN A 604 -10.122 -5.637 8.359 1.00 0.00 H new ATOM 0 HB2 ASN A 604 -12.977 -6.417 8.893 1.00 0.00 H new ATOM 0 HB3 ASN A 604 -11.782 -7.204 7.880 1.00 0.00 H new ATOM 0 HD21 ASN A 604 -11.829 -7.936 11.973 1.00 0.00 H new ATOM 0 HD22 ASN A 604 -12.499 -6.438 11.318 1.00 0.00 H new ATOM 1047 N PRO A 605 -11.184 -3.083 8.289 1.00 0.00 N ATOM 1048 CA PRO A 605 -11.769 -1.873 7.704 1.00 0.00 C ATOM 1049 C PRO A 605 -11.565 -1.772 6.199 1.00 0.00 C ATOM 1050 O PRO A 605 -10.899 -2.609 5.591 1.00 0.00 O ATOM 1051 CB PRO A 605 -11.005 -0.754 8.400 1.00 0.00 C ATOM 1052 CG PRO A 605 -9.667 -1.340 8.692 1.00 0.00 C ATOM 1053 CD PRO A 605 -9.896 -2.806 8.955 1.00 0.00 C ATOM 0 HA PRO A 605 -12.850 -1.847 7.843 1.00 0.00 H new ATOM 0 HB2 PRO A 605 -10.922 0.126 7.762 1.00 0.00 H new ATOM 0 HB3 PRO A 605 -11.508 -0.439 9.314 1.00 0.00 H new ATOM 0 HG2 PRO A 605 -8.988 -1.197 7.851 1.00 0.00 H new ATOM 0 HG3 PRO A 605 -9.211 -0.857 9.556 1.00 0.00 H new ATOM 0 HD2 PRO A 605 -9.093 -3.417 8.543 1.00 0.00 H new ATOM 0 HD3 PRO A 605 -9.943 -3.019 10.023 1.00 0.00 H new ATOM 1061 N GLU A 606 -12.135 -0.724 5.614 1.00 0.00 N ATOM 1062 CA GLU A 606 -12.021 -0.473 4.183 1.00 0.00 C ATOM 1063 C GLU A 606 -11.552 0.957 3.937 1.00 0.00 C ATOM 1064 O GLU A 606 -12.247 1.914 4.272 1.00 0.00 O ATOM 1065 CB GLU A 606 -13.364 -0.713 3.494 1.00 0.00 C ATOM 1066 CG GLU A 606 -13.390 -0.269 2.040 1.00 0.00 C ATOM 1067 CD GLU A 606 -14.328 0.899 1.805 1.00 0.00 C ATOM 1068 OE1 GLU A 606 -14.156 1.942 2.469 1.00 0.00 O ATOM 1069 OE2 GLU A 606 -15.234 0.769 0.955 1.00 0.00 O ATOM 0 H GLU A 606 -12.686 -0.028 6.116 1.00 0.00 H new ATOM 0 HA GLU A 606 -11.287 -1.161 3.765 1.00 0.00 H new ATOM 0 HB2 GLU A 606 -13.605 -1.775 3.545 1.00 0.00 H new ATOM 0 HB3 GLU A 606 -14.143 -0.183 4.041 1.00 0.00 H new ATOM 0 HG2 GLU A 606 -12.383 0.011 1.731 1.00 0.00 H new ATOM 0 HG3 GLU A 606 -13.695 -1.107 1.413 1.00 0.00 H new ATOM 1076 N PHE A 607 -10.362 1.094 3.362 1.00 0.00 N ATOM 1077 CA PHE A 607 -9.796 2.410 3.088 1.00 0.00 C ATOM 1078 C PHE A 607 -10.393 3.022 1.825 1.00 0.00 C ATOM 1079 O PHE A 607 -10.813 4.179 1.827 1.00 0.00 O ATOM 1080 CB PHE A 607 -8.277 2.317 2.942 1.00 0.00 C ATOM 1081 CG PHE A 607 -7.593 1.705 4.130 1.00 0.00 C ATOM 1082 CD1 PHE A 607 -7.434 2.426 5.303 1.00 0.00 C ATOM 1083 CD2 PHE A 607 -7.107 0.410 4.072 1.00 0.00 C ATOM 1084 CE1 PHE A 607 -6.802 1.867 6.398 1.00 0.00 C ATOM 1085 CE2 PHE A 607 -6.474 -0.156 5.164 1.00 0.00 C ATOM 1086 CZ PHE A 607 -6.322 0.574 6.329 1.00 0.00 C ATOM 0 H PHE A 607 -9.772 0.312 3.077 1.00 0.00 H new ATOM 0 HA PHE A 607 -10.042 3.055 3.932 1.00 0.00 H new ATOM 0 HB2 PHE A 607 -8.041 1.729 2.055 1.00 0.00 H new ATOM 0 HB3 PHE A 607 -7.875 3.317 2.777 1.00 0.00 H new ATOM 0 HD1 PHE A 607 -7.809 3.437 5.362 1.00 0.00 H new ATOM 0 HD2 PHE A 607 -7.223 -0.164 3.165 1.00 0.00 H new ATOM 0 HE1 PHE A 607 -6.684 2.440 7.306 1.00 0.00 H new ATOM 0 HE2 PHE A 607 -6.099 -1.167 5.107 1.00 0.00 H new ATOM 0 HZ PHE A 607 -5.829 0.134 7.183 1.00 0.00 H new ATOM 1096 N ASN A 608 -10.417 2.249 0.745 1.00 0.00 N ATOM 1097 CA ASN A 608 -10.951 2.738 -0.519 1.00 0.00 C ATOM 1098 C ASN A 608 -10.340 4.095 -0.854 1.00 0.00 C ATOM 1099 O ASN A 608 -11.051 5.054 -1.152 1.00 0.00 O ATOM 1100 CB ASN A 608 -12.475 2.854 -0.446 1.00 0.00 C ATOM 1101 CG ASN A 608 -13.159 2.283 -1.671 1.00 0.00 C ATOM 1102 OD1 ASN A 608 -13.629 3.023 -2.536 1.00 0.00 O ATOM 1103 ND2 ASN A 608 -13.221 0.959 -1.752 1.00 0.00 N ATOM 0 H ASN A 608 -10.075 1.288 0.720 1.00 0.00 H new ATOM 0 HA ASN A 608 -10.693 2.027 -1.304 1.00 0.00 H new ATOM 0 HB2 ASN A 608 -12.834 2.334 0.442 1.00 0.00 H new ATOM 0 HB3 ASN A 608 -12.752 3.902 -0.335 1.00 0.00 H new ATOM 0 HD21 ASN A 608 -13.671 0.518 -2.554 1.00 0.00 H new ATOM 0 HD22 ASN A 608 -12.818 0.383 -1.012 1.00 0.00 H new ATOM 1110 N GLU A 609 -9.014 4.166 -0.785 1.00 0.00 N ATOM 1111 CA GLU A 609 -8.295 5.404 -1.062 1.00 0.00 C ATOM 1112 C GLU A 609 -7.531 5.315 -2.379 1.00 0.00 C ATOM 1113 O GLU A 609 -6.883 4.309 -2.667 1.00 0.00 O ATOM 1114 CB GLU A 609 -7.328 5.712 0.084 1.00 0.00 C ATOM 1115 CG GLU A 609 -7.963 6.497 1.221 1.00 0.00 C ATOM 1116 CD GLU A 609 -7.011 7.499 1.843 1.00 0.00 C ATOM 1117 OE1 GLU A 609 -5.809 7.182 1.959 1.00 0.00 O ATOM 1118 OE2 GLU A 609 -7.469 8.601 2.214 1.00 0.00 O ATOM 0 H GLU A 609 -8.415 3.378 -0.539 1.00 0.00 H new ATOM 0 HA GLU A 609 -9.024 6.209 -1.148 1.00 0.00 H new ATOM 0 HB2 GLU A 609 -6.933 4.775 0.477 1.00 0.00 H new ATOM 0 HB3 GLU A 609 -6.481 6.276 -0.308 1.00 0.00 H new ATOM 0 HG2 GLU A 609 -8.843 7.021 0.848 1.00 0.00 H new ATOM 0 HG3 GLU A 609 -8.306 5.803 1.989 1.00 0.00 H new ATOM 1125 N GLU A 610 -7.609 6.379 -3.174 1.00 0.00 N ATOM 1126 CA GLU A 610 -6.923 6.426 -4.458 1.00 0.00 C ATOM 1127 C GLU A 610 -5.765 7.419 -4.416 1.00 0.00 C ATOM 1128 O GLU A 610 -5.972 8.628 -4.316 1.00 0.00 O ATOM 1129 CB GLU A 610 -7.900 6.808 -5.571 1.00 0.00 C ATOM 1130 CG GLU A 610 -8.651 5.622 -6.154 1.00 0.00 C ATOM 1131 CD GLU A 610 -9.967 6.022 -6.793 1.00 0.00 C ATOM 1132 OE1 GLU A 610 -10.492 7.101 -6.445 1.00 0.00 O ATOM 1133 OE2 GLU A 610 -10.472 5.257 -7.641 1.00 0.00 O ATOM 0 H GLU A 610 -8.141 7.220 -2.950 1.00 0.00 H new ATOM 0 HA GLU A 610 -6.522 5.434 -4.665 1.00 0.00 H new ATOM 0 HB2 GLU A 610 -8.620 7.527 -5.180 1.00 0.00 H new ATOM 0 HB3 GLU A 610 -7.351 7.308 -6.369 1.00 0.00 H new ATOM 0 HG2 GLU A 610 -8.025 5.130 -6.898 1.00 0.00 H new ATOM 0 HG3 GLU A 610 -8.841 4.894 -5.366 1.00 0.00 H new ATOM 1140 N PHE A 611 -4.546 6.896 -4.481 1.00 0.00 N ATOM 1141 CA PHE A 611 -3.347 7.722 -4.439 1.00 0.00 C ATOM 1142 C PHE A 611 -2.835 8.040 -5.838 1.00 0.00 C ATOM 1143 O PHE A 611 -3.343 7.524 -6.833 1.00 0.00 O ATOM 1144 CB PHE A 611 -2.261 7.011 -3.647 1.00 0.00 C ATOM 1145 CG PHE A 611 -2.457 7.111 -2.169 1.00 0.00 C ATOM 1146 CD1 PHE A 611 -3.344 6.274 -1.518 1.00 0.00 C ATOM 1147 CD2 PHE A 611 -1.755 8.045 -1.434 1.00 0.00 C ATOM 1148 CE1 PHE A 611 -3.527 6.364 -0.150 1.00 0.00 C ATOM 1149 CE2 PHE A 611 -1.930 8.145 -0.066 1.00 0.00 C ATOM 1150 CZ PHE A 611 -2.818 7.302 0.578 1.00 0.00 C ATOM 0 H PHE A 611 -4.362 5.896 -4.564 1.00 0.00 H new ATOM 0 HA PHE A 611 -3.606 8.663 -3.953 1.00 0.00 H new ATOM 0 HB2 PHE A 611 -2.238 5.960 -3.935 1.00 0.00 H new ATOM 0 HB3 PHE A 611 -1.291 7.434 -3.909 1.00 0.00 H new ATOM 0 HD1 PHE A 611 -3.900 5.542 -2.084 1.00 0.00 H new ATOM 0 HD2 PHE A 611 -1.061 8.705 -1.933 1.00 0.00 H new ATOM 0 HE1 PHE A 611 -4.221 5.704 0.348 1.00 0.00 H new ATOM 0 HE2 PHE A 611 -1.375 8.880 0.498 1.00 0.00 H new ATOM 0 HZ PHE A 611 -2.957 7.376 1.646 1.00 0.00 H new ATOM 1160 N PHE A 612 -1.816 8.889 -5.897 1.00 0.00 N ATOM 1161 CA PHE A 612 -1.216 9.283 -7.168 1.00 0.00 C ATOM 1162 C PHE A 612 0.286 9.489 -7.018 1.00 0.00 C ATOM 1163 O PHE A 612 0.732 10.367 -6.280 1.00 0.00 O ATOM 1164 CB PHE A 612 -1.868 10.564 -7.689 1.00 0.00 C ATOM 1165 CG PHE A 612 -1.504 10.889 -9.110 1.00 0.00 C ATOM 1166 CD1 PHE A 612 -1.298 9.878 -10.033 1.00 0.00 C ATOM 1167 CD2 PHE A 612 -1.371 12.206 -9.522 1.00 0.00 C ATOM 1168 CE1 PHE A 612 -0.964 10.172 -11.342 1.00 0.00 C ATOM 1169 CE2 PHE A 612 -1.037 12.506 -10.829 1.00 0.00 C ATOM 1170 CZ PHE A 612 -0.834 11.488 -11.740 1.00 0.00 C ATOM 0 H PHE A 612 -1.386 9.319 -5.078 1.00 0.00 H new ATOM 0 HA PHE A 612 -1.385 8.480 -7.886 1.00 0.00 H new ATOM 0 HB2 PHE A 612 -2.951 10.467 -7.613 1.00 0.00 H new ATOM 0 HB3 PHE A 612 -1.577 11.397 -7.049 1.00 0.00 H new ATOM 0 HD1 PHE A 612 -1.399 8.847 -9.727 1.00 0.00 H new ATOM 0 HD2 PHE A 612 -1.530 13.006 -8.814 1.00 0.00 H new ATOM 0 HE1 PHE A 612 -0.805 9.374 -12.052 1.00 0.00 H new ATOM 0 HE2 PHE A 612 -0.935 13.536 -11.138 1.00 0.00 H new ATOM 0 HZ PHE A 612 -0.574 11.721 -12.762 1.00 0.00 H new ATOM 1180 N TYR A 613 1.060 8.675 -7.724 1.00 0.00 N ATOM 1181 CA TYR A 613 2.509 8.766 -7.673 1.00 0.00 C ATOM 1182 C TYR A 613 3.038 9.536 -8.872 1.00 0.00 C ATOM 1183 O TYR A 613 2.447 9.508 -9.951 1.00 0.00 O ATOM 1184 CB TYR A 613 3.121 7.369 -7.630 1.00 0.00 C ATOM 1185 CG TYR A 613 3.450 6.919 -6.230 1.00 0.00 C ATOM 1186 CD1 TYR A 613 2.486 6.326 -5.427 1.00 0.00 C ATOM 1187 CD2 TYR A 613 4.721 7.099 -5.714 1.00 0.00 C ATOM 1188 CE1 TYR A 613 2.782 5.920 -4.138 1.00 0.00 C ATOM 1189 CE2 TYR A 613 5.030 6.696 -4.427 1.00 0.00 C ATOM 1190 CZ TYR A 613 4.057 6.107 -3.643 1.00 0.00 C ATOM 1191 OH TYR A 613 4.360 5.705 -2.363 1.00 0.00 O ATOM 0 H TYR A 613 0.705 7.943 -8.340 1.00 0.00 H new ATOM 0 HA TYR A 613 2.792 9.303 -6.767 1.00 0.00 H new ATOM 0 HB2 TYR A 613 2.428 6.659 -8.081 1.00 0.00 H new ATOM 0 HB3 TYR A 613 4.028 7.356 -8.234 1.00 0.00 H new ATOM 0 HD1 TYR A 613 1.489 6.179 -5.815 1.00 0.00 H new ATOM 0 HD2 TYR A 613 5.483 7.561 -6.325 1.00 0.00 H new ATOM 0 HE1 TYR A 613 2.022 5.460 -3.524 1.00 0.00 H new ATOM 0 HE2 TYR A 613 6.027 6.841 -4.037 1.00 0.00 H new ATOM 0 HH TYR A 613 4.627 6.483 -1.830 1.00 0.00 H new ATOM 1201 N ASP A 614 4.152 10.229 -8.678 1.00 0.00 N ATOM 1202 CA ASP A 614 4.748 11.008 -9.751 1.00 0.00 C ATOM 1203 C ASP A 614 6.032 10.357 -10.248 1.00 0.00 C ATOM 1204 O ASP A 614 7.128 10.874 -10.030 1.00 0.00 O ATOM 1205 CB ASP A 614 5.031 12.436 -9.282 1.00 0.00 C ATOM 1206 CG ASP A 614 3.915 13.397 -9.645 1.00 0.00 C ATOM 1207 OD1 ASP A 614 2.751 12.951 -9.722 1.00 0.00 O ATOM 1208 OD2 ASP A 614 4.206 14.593 -9.854 1.00 0.00 O ATOM 0 H ASP A 614 4.657 10.267 -7.793 1.00 0.00 H new ATOM 0 HA ASP A 614 4.037 11.042 -10.577 1.00 0.00 H new ATOM 0 HB2 ASP A 614 5.172 12.439 -8.201 1.00 0.00 H new ATOM 0 HB3 ASP A 614 5.964 12.783 -9.726 1.00 0.00 H new ATOM 1213 N ILE A 615 5.890 9.219 -10.917 1.00 0.00 N ATOM 1214 CA ILE A 615 7.036 8.495 -11.447 1.00 0.00 C ATOM 1215 C ILE A 615 6.838 8.173 -12.923 1.00 0.00 C ATOM 1216 O ILE A 615 5.722 7.905 -13.367 1.00 0.00 O ATOM 1217 CB ILE A 615 7.285 7.190 -10.653 1.00 0.00 C ATOM 1218 CG1 ILE A 615 8.173 6.216 -11.440 1.00 0.00 C ATOM 1219 CG2 ILE A 615 5.966 6.533 -10.274 1.00 0.00 C ATOM 1220 CD1 ILE A 615 9.645 6.543 -11.361 1.00 0.00 C ATOM 0 H ILE A 615 4.990 8.778 -11.105 1.00 0.00 H new ATOM 0 HA ILE A 615 7.910 9.138 -11.341 1.00 0.00 H new ATOM 0 HB ILE A 615 7.815 7.453 -9.737 1.00 0.00 H new ATOM 0 HG12 ILE A 615 8.013 5.206 -11.063 1.00 0.00 H new ATOM 0 HG13 ILE A 615 7.864 6.219 -12.485 1.00 0.00 H new ATOM 0 HG21 ILE A 615 6.163 5.617 -9.717 1.00 0.00 H new ATOM 0 HG22 ILE A 615 5.384 7.216 -9.656 1.00 0.00 H new ATOM 0 HG23 ILE A 615 5.405 6.294 -11.178 1.00 0.00 H new ATOM 0 HD11 ILE A 615 10.211 5.814 -11.940 1.00 0.00 H new ATOM 0 HD12 ILE A 615 9.818 7.540 -11.765 1.00 0.00 H new ATOM 0 HD13 ILE A 615 9.969 6.511 -10.321 1.00 0.00 H new ATOM 1232 N LYS A 616 7.931 8.193 -13.677 1.00 0.00 N ATOM 1233 CA LYS A 616 7.879 7.896 -15.101 1.00 0.00 C ATOM 1234 C LYS A 616 7.707 6.399 -15.328 1.00 0.00 C ATOM 1235 O LYS A 616 8.410 5.585 -14.732 1.00 0.00 O ATOM 1236 CB LYS A 616 9.146 8.389 -15.800 1.00 0.00 C ATOM 1237 CG LYS A 616 9.145 9.883 -16.076 1.00 0.00 C ATOM 1238 CD LYS A 616 10.152 10.250 -17.154 1.00 0.00 C ATOM 1239 CE LYS A 616 9.503 10.309 -18.528 1.00 0.00 C ATOM 1240 NZ LYS A 616 10.179 9.407 -19.501 1.00 0.00 N ATOM 0 H LYS A 616 8.863 8.412 -13.325 1.00 0.00 H new ATOM 0 HA LYS A 616 7.021 8.417 -15.526 1.00 0.00 H new ATOM 0 HB2 LYS A 616 10.011 8.142 -15.184 1.00 0.00 H new ATOM 0 HB3 LYS A 616 9.263 7.854 -16.742 1.00 0.00 H new ATOM 0 HG2 LYS A 616 8.148 10.196 -16.386 1.00 0.00 H new ATOM 0 HG3 LYS A 616 9.379 10.424 -15.159 1.00 0.00 H new ATOM 0 HD2 LYS A 616 10.600 11.216 -16.921 1.00 0.00 H new ATOM 0 HD3 LYS A 616 10.959 9.518 -17.163 1.00 0.00 H new ATOM 0 HE2 LYS A 616 8.452 10.031 -18.445 1.00 0.00 H new ATOM 0 HE3 LYS A 616 9.534 11.333 -18.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 616 9.707 9.477 -20.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 616 11.176 9.687 -19.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 616 10.128 8.426 -19.159 1.00 0.00 H new ATOM 1254 N HIS A 617 6.764 6.043 -16.191 1.00 0.00 N ATOM 1255 CA HIS A 617 6.493 4.644 -16.495 1.00 0.00 C ATOM 1256 C HIS A 617 7.788 3.859 -16.682 1.00 0.00 C ATOM 1257 O HIS A 617 7.968 2.790 -16.097 1.00 0.00 O ATOM 1258 CB HIS A 617 5.631 4.533 -17.751 1.00 0.00 C ATOM 1259 CG HIS A 617 5.139 3.146 -18.014 1.00 0.00 C ATOM 1260 ND1 HIS A 617 5.663 2.337 -18.998 1.00 0.00 N ATOM 1261 CD2 HIS A 617 4.166 2.422 -17.411 1.00 0.00 C ATOM 1262 CE1 HIS A 617 5.034 1.176 -18.991 1.00 0.00 C ATOM 1263 NE2 HIS A 617 4.121 1.201 -18.038 1.00 0.00 N ATOM 0 H HIS A 617 6.173 6.705 -16.694 1.00 0.00 H new ATOM 0 HA HIS A 617 5.953 4.216 -15.650 1.00 0.00 H new ATOM 0 HB2 HIS A 617 4.776 5.202 -17.656 1.00 0.00 H new ATOM 0 HB3 HIS A 617 6.208 4.875 -18.610 1.00 0.00 H new ATOM 0 HD2 HIS A 617 3.542 2.745 -16.591 1.00 0.00 H new ATOM 0 HE1 HIS A 617 5.233 0.346 -19.653 1.00 0.00 H new ATOM 0 HE2 HIS A 617 3.486 0.438 -17.805 1.00 0.00 H new ATOM 1272 N SER A 618 8.686 4.393 -17.503 1.00 0.00 N ATOM 1273 CA SER A 618 9.962 3.740 -17.773 1.00 0.00 C ATOM 1274 C SER A 618 10.755 3.521 -16.489 1.00 0.00 C ATOM 1275 O SER A 618 11.715 2.751 -16.467 1.00 0.00 O ATOM 1276 CB SER A 618 10.786 4.574 -18.757 1.00 0.00 C ATOM 1277 OG SER A 618 11.509 3.744 -19.649 1.00 0.00 O ATOM 0 H SER A 618 8.554 5.277 -17.994 1.00 0.00 H new ATOM 0 HA SER A 618 9.751 2.766 -18.214 1.00 0.00 H new ATOM 0 HB2 SER A 618 10.126 5.232 -19.322 1.00 0.00 H new ATOM 0 HB3 SER A 618 11.478 5.212 -18.207 1.00 0.00 H new ATOM 0 HG SER A 618 12.026 4.301 -20.268 1.00 0.00 H new ATOM 1283 N ASP A 619 10.351 4.199 -15.420 1.00 0.00 N ATOM 1284 CA ASP A 619 11.029 4.068 -14.137 1.00 0.00 C ATOM 1285 C ASP A 619 10.194 3.235 -13.171 1.00 0.00 C ATOM 1286 O ASP A 619 10.729 2.569 -12.285 1.00 0.00 O ATOM 1287 CB ASP A 619 11.310 5.449 -13.543 1.00 0.00 C ATOM 1288 CG ASP A 619 12.307 6.238 -14.367 1.00 0.00 C ATOM 1289 OD1 ASP A 619 12.110 6.345 -15.596 1.00 0.00 O ATOM 1290 OD2 ASP A 619 13.286 6.751 -13.784 1.00 0.00 O ATOM 0 H ASP A 619 9.560 4.843 -15.417 1.00 0.00 H new ATOM 0 HA ASP A 619 11.978 3.557 -14.299 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.377 6.008 -13.473 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.691 5.335 -12.528 1.00 0.00 H new ATOM 1295 N LEU A 620 8.878 3.271 -13.358 1.00 0.00 N ATOM 1296 CA LEU A 620 7.961 2.514 -12.515 1.00 0.00 C ATOM 1297 C LEU A 620 8.575 1.175 -12.117 1.00 0.00 C ATOM 1298 O LEU A 620 8.902 0.948 -10.955 1.00 0.00 O ATOM 1299 CB LEU A 620 6.644 2.270 -13.265 1.00 0.00 C ATOM 1300 CG LEU A 620 5.434 3.126 -12.856 1.00 0.00 C ATOM 1301 CD1 LEU A 620 4.254 2.230 -12.533 1.00 0.00 C ATOM 1302 CD2 LEU A 620 5.745 4.031 -11.672 1.00 0.00 C ATOM 0 H LEU A 620 8.423 3.818 -14.088 1.00 0.00 H new ATOM 0 HA LEU A 620 7.767 3.093 -11.612 1.00 0.00 H new ATOM 0 HB2 LEU A 620 6.826 2.428 -14.328 1.00 0.00 H new ATOM 0 HB3 LEU A 620 6.374 1.221 -13.141 1.00 0.00 H new ATOM 0 HG LEU A 620 5.186 3.770 -13.700 1.00 0.00 H new ATOM 0 HD11 LEU A 620 3.400 2.843 -12.244 1.00 0.00 H new ATOM 0 HD12 LEU A 620 3.995 1.638 -13.411 1.00 0.00 H new ATOM 0 HD13 LEU A 620 4.517 1.564 -11.711 1.00 0.00 H new ATOM 0 HD21 LEU A 620 4.861 4.616 -11.419 1.00 0.00 H new ATOM 0 HD22 LEU A 620 6.035 3.423 -10.815 1.00 0.00 H new ATOM 0 HD23 LEU A 620 6.563 4.703 -11.933 1.00 0.00 H new ATOM 1314 N ALA A 621 8.722 0.295 -13.098 1.00 0.00 N ATOM 1315 CA ALA A 621 9.293 -1.029 -12.879 1.00 0.00 C ATOM 1316 C ALA A 621 10.434 -1.000 -11.858 1.00 0.00 C ATOM 1317 O ALA A 621 10.460 -1.796 -10.922 1.00 0.00 O ATOM 1318 CB ALA A 621 9.792 -1.589 -14.202 1.00 0.00 C ATOM 0 H ALA A 621 8.450 0.476 -14.064 1.00 0.00 H new ATOM 0 HA ALA A 621 8.510 -1.670 -12.473 1.00 0.00 H new ATOM 0 HB1 ALA A 621 10.219 -2.579 -14.040 1.00 0.00 H new ATOM 0 HB2 ALA A 621 8.960 -1.663 -14.903 1.00 0.00 H new ATOM 0 HB3 ALA A 621 10.555 -0.927 -14.613 1.00 0.00 H new ATOM 1324 N LYS A 622 11.381 -0.085 -12.051 1.00 0.00 N ATOM 1325 CA LYS A 622 12.531 0.029 -11.161 1.00 0.00 C ATOM 1326 C LYS A 622 12.119 0.487 -9.769 1.00 0.00 C ATOM 1327 O LYS A 622 12.871 0.331 -8.807 1.00 0.00 O ATOM 1328 CB LYS A 622 13.554 1.005 -11.743 1.00 0.00 C ATOM 1329 CG LYS A 622 14.675 0.322 -12.508 1.00 0.00 C ATOM 1330 CD LYS A 622 14.136 -0.492 -13.672 1.00 0.00 C ATOM 1331 CE LYS A 622 13.364 0.380 -14.649 1.00 0.00 C ATOM 1332 NZ LYS A 622 13.606 -0.020 -16.062 1.00 0.00 N ATOM 0 H LYS A 622 11.374 0.588 -12.817 1.00 0.00 H new ATOM 0 HA LYS A 622 12.979 -0.961 -11.073 1.00 0.00 H new ATOM 0 HB2 LYS A 622 13.043 1.701 -12.408 1.00 0.00 H new ATOM 0 HB3 LYS A 622 13.984 1.594 -10.933 1.00 0.00 H new ATOM 0 HG2 LYS A 622 15.374 1.072 -12.879 1.00 0.00 H new ATOM 0 HG3 LYS A 622 15.233 -0.329 -11.835 1.00 0.00 H new ATOM 0 HD2 LYS A 622 14.962 -0.979 -14.191 1.00 0.00 H new ATOM 0 HD3 LYS A 622 13.486 -1.282 -13.295 1.00 0.00 H new ATOM 0 HE2 LYS A 622 12.298 0.314 -14.431 1.00 0.00 H new ATOM 0 HE3 LYS A 622 13.653 1.422 -14.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 622 13.062 0.599 -16.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 622 14.619 0.067 -16.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 622 13.306 -1.006 -16.200 1.00 0.00 H new ATOM 1346 N LYS A 623 10.930 1.059 -9.667 1.00 0.00 N ATOM 1347 CA LYS A 623 10.434 1.545 -8.388 1.00 0.00 C ATOM 1348 C LYS A 623 10.104 0.394 -7.446 1.00 0.00 C ATOM 1349 O LYS A 623 10.343 -0.772 -7.760 1.00 0.00 O ATOM 1350 CB LYS A 623 9.190 2.409 -8.585 1.00 0.00 C ATOM 1351 CG LYS A 623 9.363 3.506 -9.616 1.00 0.00 C ATOM 1352 CD LYS A 623 9.951 4.763 -9.001 1.00 0.00 C ATOM 1353 CE LYS A 623 11.351 5.036 -9.526 1.00 0.00 C ATOM 1354 NZ LYS A 623 12.387 4.834 -8.476 1.00 0.00 N ATOM 0 H LYS A 623 10.292 1.198 -10.451 1.00 0.00 H new ATOM 0 HA LYS A 623 11.226 2.146 -7.941 1.00 0.00 H new ATOM 0 HB2 LYS A 623 8.359 1.770 -8.884 1.00 0.00 H new ATOM 0 HB3 LYS A 623 8.918 2.860 -7.631 1.00 0.00 H new ATOM 0 HG2 LYS A 623 10.013 3.154 -10.417 1.00 0.00 H new ATOM 0 HG3 LYS A 623 8.398 3.738 -10.067 1.00 0.00 H new ATOM 0 HD2 LYS A 623 9.306 5.614 -9.222 1.00 0.00 H new ATOM 0 HD3 LYS A 623 9.982 4.659 -7.916 1.00 0.00 H new ATOM 0 HE2 LYS A 623 11.557 4.378 -10.370 1.00 0.00 H new ATOM 0 HE3 LYS A 623 11.406 6.059 -9.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 623 13.261 4.479 -8.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 623 12.581 5.739 -8.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 623 12.044 4.143 -7.778 1.00 0.00 H new ATOM 1368 N SER A 624 9.544 0.736 -6.290 1.00 0.00 N ATOM 1369 CA SER A 624 9.166 -0.255 -5.293 1.00 0.00 C ATOM 1370 C SER A 624 8.137 0.321 -4.327 1.00 0.00 C ATOM 1371 O SER A 624 8.470 1.119 -3.451 1.00 0.00 O ATOM 1372 CB SER A 624 10.393 -0.734 -4.521 1.00 0.00 C ATOM 1373 OG SER A 624 10.779 0.212 -3.539 1.00 0.00 O ATOM 0 H SER A 624 9.342 1.699 -6.021 1.00 0.00 H new ATOM 0 HA SER A 624 8.723 -1.105 -5.812 1.00 0.00 H new ATOM 0 HB2 SER A 624 10.176 -1.690 -4.044 1.00 0.00 H new ATOM 0 HB3 SER A 624 11.219 -0.903 -5.212 1.00 0.00 H new ATOM 0 HG SER A 624 10.228 1.017 -3.626 1.00 0.00 H new ATOM 1379 N LEU A 625 6.887 -0.085 -4.498 1.00 0.00 N ATOM 1380 CA LEU A 625 5.804 0.392 -3.646 1.00 0.00 C ATOM 1381 C LEU A 625 5.787 -0.357 -2.318 1.00 0.00 C ATOM 1382 O LEU A 625 5.616 -1.575 -2.283 1.00 0.00 O ATOM 1383 CB LEU A 625 4.458 0.229 -4.353 1.00 0.00 C ATOM 1384 CG LEU A 625 3.250 0.753 -3.574 1.00 0.00 C ATOM 1385 CD1 LEU A 625 3.397 2.241 -3.299 1.00 0.00 C ATOM 1386 CD2 LEU A 625 1.964 0.474 -4.336 1.00 0.00 C ATOM 0 H LEU A 625 6.596 -0.745 -5.220 1.00 0.00 H new ATOM 0 HA LEU A 625 5.974 1.450 -3.445 1.00 0.00 H new ATOM 0 HB2 LEU A 625 4.504 0.744 -5.312 1.00 0.00 H new ATOM 0 HB3 LEU A 625 4.303 -0.829 -4.566 1.00 0.00 H new ATOM 0 HG LEU A 625 3.203 0.231 -2.618 1.00 0.00 H new ATOM 0 HD11 LEU A 625 2.529 2.596 -2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 625 4.299 2.415 -2.712 1.00 0.00 H new ATOM 0 HD13 LEU A 625 3.469 2.780 -4.244 1.00 0.00 H new ATOM 0 HD21 LEU A 625 1.115 0.853 -3.768 1.00 0.00 H new ATOM 0 HD22 LEU A 625 2.001 0.969 -5.306 1.00 0.00 H new ATOM 0 HD23 LEU A 625 1.853 -0.601 -4.481 1.00 0.00 H new ATOM 1398 N ASP A 626 5.965 0.381 -1.228 1.00 0.00 N ATOM 1399 CA ASP A 626 5.969 -0.213 0.102 1.00 0.00 C ATOM 1400 C ASP A 626 4.665 0.085 0.834 1.00 0.00 C ATOM 1401 O ASP A 626 4.504 1.152 1.427 1.00 0.00 O ATOM 1402 CB ASP A 626 7.154 0.310 0.915 1.00 0.00 C ATOM 1403 CG ASP A 626 7.386 -0.493 2.180 1.00 0.00 C ATOM 1404 OD1 ASP A 626 6.394 -0.827 2.862 1.00 0.00 O ATOM 1405 OD2 ASP A 626 8.560 -0.788 2.490 1.00 0.00 O ATOM 0 H ASP A 626 6.108 1.391 -1.240 1.00 0.00 H new ATOM 0 HA ASP A 626 6.064 -1.293 -0.011 1.00 0.00 H new ATOM 0 HB2 ASP A 626 8.054 0.282 0.300 1.00 0.00 H new ATOM 0 HB3 ASP A 626 6.979 1.353 1.177 1.00 0.00 H new ATOM 1410 N ILE A 627 3.736 -0.866 0.790 1.00 0.00 N ATOM 1411 CA ILE A 627 2.448 -0.708 1.453 1.00 0.00 C ATOM 1412 C ILE A 627 2.501 -1.273 2.866 1.00 0.00 C ATOM 1413 O ILE A 627 2.485 -2.489 3.059 1.00 0.00 O ATOM 1414 CB ILE A 627 1.321 -1.409 0.670 1.00 0.00 C ATOM 1415 CG1 ILE A 627 1.403 -1.054 -0.815 1.00 0.00 C ATOM 1416 CG2 ILE A 627 -0.037 -1.028 1.239 1.00 0.00 C ATOM 1417 CD1 ILE A 627 2.381 -1.911 -1.590 1.00 0.00 C ATOM 0 H ILE A 627 3.853 -1.754 0.302 1.00 0.00 H new ATOM 0 HA ILE A 627 2.234 0.360 1.493 1.00 0.00 H new ATOM 0 HB ILE A 627 1.445 -2.487 0.772 1.00 0.00 H new ATOM 0 HG12 ILE A 627 0.413 -1.155 -1.259 1.00 0.00 H new ATOM 0 HG13 ILE A 627 1.692 -0.008 -0.914 1.00 0.00 H new ATOM 0 HG21 ILE A 627 -0.822 -1.531 0.675 1.00 0.00 H new ATOM 0 HG22 ILE A 627 -0.091 -1.330 2.285 1.00 0.00 H new ATOM 0 HG23 ILE A 627 -0.173 0.051 1.166 1.00 0.00 H new ATOM 0 HD11 ILE A 627 2.386 -1.602 -2.635 1.00 0.00 H new ATOM 0 HD12 ILE A 627 3.380 -1.792 -1.172 1.00 0.00 H new ATOM 0 HD13 ILE A 627 2.082 -2.957 -1.522 1.00 0.00 H new ATOM 1429 N SER A 628 2.576 -0.385 3.853 1.00 0.00 N ATOM 1430 CA SER A 628 2.647 -0.808 5.248 1.00 0.00 C ATOM 1431 C SER A 628 1.425 -0.358 6.039 1.00 0.00 C ATOM 1432 O SER A 628 0.983 0.786 5.932 1.00 0.00 O ATOM 1433 CB SER A 628 3.917 -0.260 5.903 1.00 0.00 C ATOM 1434 OG SER A 628 3.790 1.123 6.186 1.00 0.00 O ATOM 0 H SER A 628 2.589 0.625 3.714 1.00 0.00 H new ATOM 0 HA SER A 628 2.671 -1.898 5.258 1.00 0.00 H new ATOM 0 HB2 SER A 628 4.119 -0.806 6.825 1.00 0.00 H new ATOM 0 HB3 SER A 628 4.769 -0.422 5.243 1.00 0.00 H new ATOM 0 HG SER A 628 4.672 1.548 6.142 1.00 0.00 H new ATOM 1440 N VAL A 629 0.894 -1.271 6.848 1.00 0.00 N ATOM 1441 CA VAL A 629 -0.265 -0.981 7.681 1.00 0.00 C ATOM 1442 C VAL A 629 0.152 -0.876 9.143 1.00 0.00 C ATOM 1443 O VAL A 629 0.722 -1.813 9.703 1.00 0.00 O ATOM 1444 CB VAL A 629 -1.347 -2.067 7.541 1.00 0.00 C ATOM 1445 CG1 VAL A 629 -2.627 -1.641 8.244 1.00 0.00 C ATOM 1446 CG2 VAL A 629 -1.610 -2.371 6.075 1.00 0.00 C ATOM 0 H VAL A 629 1.251 -2.222 6.943 1.00 0.00 H new ATOM 0 HA VAL A 629 -0.681 -0.032 7.344 1.00 0.00 H new ATOM 0 HB VAL A 629 -0.986 -2.978 8.018 1.00 0.00 H new ATOM 0 HG11 VAL A 629 -3.380 -2.422 8.134 1.00 0.00 H new ATOM 0 HG12 VAL A 629 -2.424 -1.479 9.303 1.00 0.00 H new ATOM 0 HG13 VAL A 629 -2.996 -0.716 7.800 1.00 0.00 H new ATOM 0 HG21 VAL A 629 -2.378 -3.141 5.995 1.00 0.00 H new ATOM 0 HG22 VAL A 629 -1.950 -1.466 5.571 1.00 0.00 H new ATOM 0 HG23 VAL A 629 -0.692 -2.724 5.606 1.00 0.00 H new ATOM 1456 N TRP A 630 -0.116 0.271 9.754 1.00 0.00 N ATOM 1457 CA TRP A 630 0.253 0.496 11.145 1.00 0.00 C ATOM 1458 C TRP A 630 -0.966 0.817 11.997 1.00 0.00 C ATOM 1459 O TRP A 630 -1.953 1.364 11.506 1.00 0.00 O ATOM 1460 CB TRP A 630 1.254 1.646 11.231 1.00 0.00 C ATOM 1461 CG TRP A 630 2.525 1.387 10.484 1.00 0.00 C ATOM 1462 CD1 TRP A 630 2.671 1.269 9.131 1.00 0.00 C ATOM 1463 CD2 TRP A 630 3.831 1.213 11.045 1.00 0.00 C ATOM 1464 NE1 TRP A 630 3.987 1.033 8.817 1.00 0.00 N ATOM 1465 CE2 TRP A 630 4.720 0.994 9.975 1.00 0.00 C ATOM 1466 CE3 TRP A 630 4.336 1.221 12.349 1.00 0.00 C ATOM 1467 CZ2 TRP A 630 6.084 0.787 10.170 1.00 0.00 C ATOM 1468 CZ3 TRP A 630 5.689 1.015 12.540 1.00 0.00 C ATOM 1469 CH2 TRP A 630 6.549 0.800 11.456 1.00 0.00 C ATOM 0 H TRP A 630 -0.587 1.059 9.309 1.00 0.00 H new ATOM 0 HA TRP A 630 0.704 -0.419 11.528 1.00 0.00 H new ATOM 0 HB2 TRP A 630 0.790 2.551 10.840 1.00 0.00 H new ATOM 0 HB3 TRP A 630 1.489 1.835 12.278 1.00 0.00 H new ATOM 0 HD1 TRP A 630 1.868 1.350 8.413 1.00 0.00 H new ATOM 0 HE1 TRP A 630 4.359 0.907 7.875 1.00 0.00 H new ATOM 0 HE3 TRP A 630 3.681 1.385 13.191 1.00 0.00 H new ATOM 0 HZ2 TRP A 630 6.750 0.622 9.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 630 6.090 1.020 13.543 1.00 0.00 H new ATOM 0 HH2 TRP A 630 7.601 0.641 11.639 1.00 0.00 H new ATOM 1480 N ASP A 631 -0.886 0.489 13.283 1.00 0.00 N ATOM 1481 CA ASP A 631 -1.979 0.764 14.204 1.00 0.00 C ATOM 1482 C ASP A 631 -1.849 2.175 14.761 1.00 0.00 C ATOM 1483 O ASP A 631 -0.760 2.612 15.135 1.00 0.00 O ATOM 1484 CB ASP A 631 -2.007 -0.260 15.344 1.00 0.00 C ATOM 1485 CG ASP A 631 -2.712 0.264 16.583 1.00 0.00 C ATOM 1486 OD1 ASP A 631 -3.925 0.552 16.499 1.00 0.00 O ATOM 1487 OD2 ASP A 631 -2.051 0.385 17.636 1.00 0.00 O ATOM 0 H ASP A 631 -0.078 0.034 13.708 1.00 0.00 H new ATOM 0 HA ASP A 631 -2.918 0.684 13.657 1.00 0.00 H new ATOM 0 HB2 ASP A 631 -2.507 -1.166 15.002 1.00 0.00 H new ATOM 0 HB3 ASP A 631 -0.985 -0.539 15.602 1.00 0.00 H new ATOM 1492 N TYR A 632 -2.966 2.883 14.803 1.00 0.00 N ATOM 1493 CA TYR A 632 -2.991 4.249 15.298 1.00 0.00 C ATOM 1494 C TYR A 632 -3.451 4.295 16.753 1.00 0.00 C ATOM 1495 O TYR A 632 -4.113 3.375 17.233 1.00 0.00 O ATOM 1496 CB TYR A 632 -3.922 5.086 14.427 1.00 0.00 C ATOM 1497 CG TYR A 632 -4.143 6.487 14.938 1.00 0.00 C ATOM 1498 CD1 TYR A 632 -5.097 6.743 15.909 1.00 0.00 C ATOM 1499 CD2 TYR A 632 -3.399 7.552 14.448 1.00 0.00 C ATOM 1500 CE1 TYR A 632 -5.307 8.024 16.382 1.00 0.00 C ATOM 1501 CE2 TYR A 632 -3.601 8.835 14.914 1.00 0.00 C ATOM 1502 CZ TYR A 632 -4.557 9.068 15.883 1.00 0.00 C ATOM 1503 OH TYR A 632 -4.761 10.345 16.351 1.00 0.00 O ATOM 0 H TYR A 632 -3.873 2.531 14.498 1.00 0.00 H new ATOM 0 HA TYR A 632 -1.981 4.657 15.251 1.00 0.00 H new ATOM 0 HB2 TYR A 632 -3.511 5.138 13.419 1.00 0.00 H new ATOM 0 HB3 TYR A 632 -4.885 4.581 14.352 1.00 0.00 H new ATOM 0 HD1 TYR A 632 -5.686 5.928 16.303 1.00 0.00 H new ATOM 0 HD2 TYR A 632 -2.650 7.373 13.690 1.00 0.00 H new ATOM 0 HE1 TYR A 632 -6.055 8.207 17.139 1.00 0.00 H new ATOM 0 HE2 TYR A 632 -3.014 9.653 14.523 1.00 0.00 H new ATOM 0 HH TYR A 632 -4.150 10.962 15.896 1.00 0.00 H new ATOM 1513 N ASP A 633 -3.097 5.372 17.446 1.00 0.00 N ATOM 1514 CA ASP A 633 -3.475 5.538 18.844 1.00 0.00 C ATOM 1515 C ASP A 633 -3.500 7.012 19.231 1.00 0.00 C ATOM 1516 O ASP A 633 -2.513 7.727 19.053 1.00 0.00 O ATOM 1517 CB ASP A 633 -2.507 4.778 19.752 1.00 0.00 C ATOM 1518 CG ASP A 633 -2.590 3.276 19.560 1.00 0.00 C ATOM 1519 OD1 ASP A 633 -3.719 2.754 19.451 1.00 0.00 O ATOM 1520 OD2 ASP A 633 -1.526 2.623 19.520 1.00 0.00 O ATOM 0 H ASP A 633 -2.549 6.142 17.062 1.00 0.00 H new ATOM 0 HA ASP A 633 -4.478 5.130 18.972 1.00 0.00 H new ATOM 0 HB2 ASP A 633 -1.489 5.111 19.552 1.00 0.00 H new ATOM 0 HB3 ASP A 633 -2.723 5.021 20.792 1.00 0.00 H new ATOM 1525 N ILE A 634 -4.632 7.460 19.763 1.00 0.00 N ATOM 1526 CA ILE A 634 -4.779 8.851 20.179 1.00 0.00 C ATOM 1527 C ILE A 634 -4.090 9.099 21.515 1.00 0.00 C ATOM 1528 O ILE A 634 -4.160 8.273 22.424 1.00 0.00 O ATOM 1529 CB ILE A 634 -6.259 9.275 20.296 1.00 0.00 C ATOM 1530 CG1 ILE A 634 -7.150 8.075 20.626 1.00 0.00 C ATOM 1531 CG2 ILE A 634 -6.717 9.945 19.009 1.00 0.00 C ATOM 1532 CD1 ILE A 634 -7.623 7.316 19.405 1.00 0.00 C ATOM 0 H ILE A 634 -5.459 6.883 19.916 1.00 0.00 H new ATOM 0 HA ILE A 634 -4.307 9.452 19.402 1.00 0.00 H new ATOM 0 HB ILE A 634 -6.346 9.991 21.113 1.00 0.00 H new ATOM 0 HG12 ILE A 634 -6.601 7.394 21.276 1.00 0.00 H new ATOM 0 HG13 ILE A 634 -8.018 8.421 21.187 1.00 0.00 H new ATOM 0 HG21 ILE A 634 -7.762 10.239 19.104 1.00 0.00 H new ATOM 0 HG22 ILE A 634 -6.107 10.829 18.822 1.00 0.00 H new ATOM 0 HG23 ILE A 634 -6.611 9.248 18.178 1.00 0.00 H new ATOM 0 HD11 ILE A 634 -8.249 6.480 19.716 1.00 0.00 H new ATOM 0 HD12 ILE A 634 -8.200 7.982 18.763 1.00 0.00 H new ATOM 0 HD13 ILE A 634 -6.761 6.939 18.855 1.00 0.00 H new ATOM 1544 N GLY A 635 -3.426 10.244 21.625 1.00 0.00 N ATOM 1545 CA GLY A 635 -2.732 10.586 22.852 1.00 0.00 C ATOM 1546 C GLY A 635 -1.399 9.874 22.986 1.00 0.00 C ATOM 1547 O GLY A 635 -0.625 10.159 23.900 1.00 0.00 O ATOM 0 H GLY A 635 -3.356 10.942 20.885 1.00 0.00 H new ATOM 0 HA2 GLY A 635 -2.569 11.663 22.885 1.00 0.00 H new ATOM 0 HA3 GLY A 635 -3.362 10.333 23.704 1.00 0.00 H new ATOM 1551 N LYS A 636 -1.128 8.946 22.073 1.00 0.00 N ATOM 1552 CA LYS A 636 0.121 8.193 22.096 1.00 0.00 C ATOM 1553 C LYS A 636 0.673 8.013 20.685 1.00 0.00 C ATOM 1554 O LYS A 636 0.133 8.560 19.723 1.00 0.00 O ATOM 1555 CB LYS A 636 -0.094 6.827 22.749 1.00 0.00 C ATOM 1556 CG LYS A 636 -1.552 6.408 22.817 1.00 0.00 C ATOM 1557 CD LYS A 636 -1.691 4.918 23.086 1.00 0.00 C ATOM 1558 CE LYS A 636 -1.045 4.529 24.406 1.00 0.00 C ATOM 1559 NZ LYS A 636 -1.665 3.308 24.990 1.00 0.00 N ATOM 0 H LYS A 636 -1.756 8.698 21.309 1.00 0.00 H new ATOM 0 HA LYS A 636 0.846 8.758 22.682 1.00 0.00 H new ATOM 0 HB2 LYS A 636 0.466 6.075 22.192 1.00 0.00 H new ATOM 0 HB3 LYS A 636 0.317 6.847 23.758 1.00 0.00 H new ATOM 0 HG2 LYS A 636 -2.057 6.969 23.603 1.00 0.00 H new ATOM 0 HG3 LYS A 636 -2.048 6.657 21.879 1.00 0.00 H new ATOM 0 HD2 LYS A 636 -2.747 4.647 23.102 1.00 0.00 H new ATOM 0 HD3 LYS A 636 -1.230 4.356 22.274 1.00 0.00 H new ATOM 0 HE2 LYS A 636 0.020 4.357 24.252 1.00 0.00 H new ATOM 0 HE3 LYS A 636 -1.136 5.355 25.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 636 -1.196 3.077 25.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 636 -2.676 3.480 25.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 636 -1.556 2.513 24.328 1.00 0.00 H new ATOM 1573 N SER A 637 1.750 7.245 20.571 1.00 0.00 N ATOM 1574 CA SER A 637 2.373 6.991 19.278 1.00 0.00 C ATOM 1575 C SER A 637 1.620 5.905 18.517 1.00 0.00 C ATOM 1576 O SER A 637 0.609 5.389 18.992 1.00 0.00 O ATOM 1577 CB SER A 637 3.835 6.581 19.464 1.00 0.00 C ATOM 1578 OG SER A 637 4.503 7.458 20.354 1.00 0.00 O ATOM 0 H SER A 637 2.210 6.787 21.358 1.00 0.00 H new ATOM 0 HA SER A 637 2.334 7.912 18.696 1.00 0.00 H new ATOM 0 HB2 SER A 637 3.884 5.562 19.848 1.00 0.00 H new ATOM 0 HB3 SER A 637 4.342 6.582 18.499 1.00 0.00 H new ATOM 0 HG SER A 637 5.435 7.173 20.457 1.00 0.00 H new ATOM 1584 N ASN A 638 2.119 5.564 17.334 1.00 0.00 N ATOM 1585 CA ASN A 638 1.492 4.540 16.507 1.00 0.00 C ATOM 1586 C ASN A 638 2.122 3.174 16.758 1.00 0.00 C ATOM 1587 O ASN A 638 2.954 3.017 17.652 1.00 0.00 O ATOM 1588 CB ASN A 638 1.617 4.905 15.026 1.00 0.00 C ATOM 1589 CG ASN A 638 3.060 5.009 14.577 1.00 0.00 C ATOM 1590 OD1 ASN A 638 3.962 5.222 15.388 1.00 0.00 O ATOM 1591 ND2 ASN A 638 3.287 4.860 13.277 1.00 0.00 N ATOM 0 H ASN A 638 2.956 5.982 16.926 1.00 0.00 H new ATOM 0 HA ASN A 638 0.437 4.488 16.776 1.00 0.00 H new ATOM 0 HB2 ASN A 638 1.106 4.153 14.425 1.00 0.00 H new ATOM 0 HB3 ASN A 638 1.114 5.855 14.845 1.00 0.00 H new ATOM 0 HD21 ASN A 638 4.239 4.921 12.915 1.00 0.00 H new ATOM 0 HD22 ASN A 638 2.510 4.685 12.640 1.00 0.00 H new ATOM 1598 N ASP A 639 1.720 2.189 15.962 1.00 0.00 N ATOM 1599 CA ASP A 639 2.244 0.835 16.096 1.00 0.00 C ATOM 1600 C ASP A 639 2.312 0.145 14.737 1.00 0.00 C ATOM 1601 O ASP A 639 1.504 0.421 13.850 1.00 0.00 O ATOM 1602 CB ASP A 639 1.373 0.019 17.052 1.00 0.00 C ATOM 1603 CG ASP A 639 1.553 0.437 18.497 1.00 0.00 C ATOM 1604 OD1 ASP A 639 1.133 1.561 18.847 1.00 0.00 O ATOM 1605 OD2 ASP A 639 2.113 -0.358 19.280 1.00 0.00 O ATOM 0 H ASP A 639 1.033 2.303 15.217 1.00 0.00 H new ATOM 0 HA ASP A 639 3.253 0.900 16.504 1.00 0.00 H new ATOM 0 HB2 ASP A 639 0.326 0.133 16.772 1.00 0.00 H new ATOM 0 HB3 ASP A 639 1.618 -1.038 16.949 1.00 0.00 H new ATOM 1610 N TYR A 640 3.280 -0.753 14.580 1.00 0.00 N ATOM 1611 CA TYR A 640 3.450 -1.479 13.328 1.00 0.00 C ATOM 1612 C TYR A 640 2.586 -2.735 13.306 1.00 0.00 C ATOM 1613 O TYR A 640 2.769 -3.642 14.118 1.00 0.00 O ATOM 1614 CB TYR A 640 4.918 -1.853 13.122 1.00 0.00 C ATOM 1615 CG TYR A 640 5.310 -1.998 11.667 1.00 0.00 C ATOM 1616 CD1 TYR A 640 4.346 -2.037 10.668 1.00 0.00 C ATOM 1617 CD2 TYR A 640 6.646 -2.097 11.295 1.00 0.00 C ATOM 1618 CE1 TYR A 640 4.701 -2.170 9.338 1.00 0.00 C ATOM 1619 CE2 TYR A 640 7.008 -2.229 9.967 1.00 0.00 C ATOM 1620 CZ TYR A 640 6.033 -2.265 8.994 1.00 0.00 C ATOM 1621 OH TYR A 640 6.391 -2.395 7.671 1.00 0.00 O ATOM 0 H TYR A 640 3.957 -0.994 15.304 1.00 0.00 H new ATOM 0 HA TYR A 640 3.133 -0.826 12.515 1.00 0.00 H new ATOM 0 HB2 TYR A 640 5.546 -1.092 13.584 1.00 0.00 H new ATOM 0 HB3 TYR A 640 5.121 -2.791 13.639 1.00 0.00 H new ATOM 0 HD1 TYR A 640 3.302 -1.962 10.934 1.00 0.00 H new ATOM 0 HD2 TYR A 640 7.413 -2.070 12.055 1.00 0.00 H new ATOM 0 HE1 TYR A 640 3.939 -2.199 8.573 1.00 0.00 H new ATOM 0 HE2 TYR A 640 8.050 -2.304 9.694 1.00 0.00 H new ATOM 0 HH TYR A 640 7.367 -2.448 7.600 1.00 0.00 H new ATOM 1631 N ILE A 641 1.649 -2.783 12.366 1.00 0.00 N ATOM 1632 CA ILE A 641 0.759 -3.928 12.231 1.00 0.00 C ATOM 1633 C ILE A 641 1.292 -4.904 11.189 1.00 0.00 C ATOM 1634 O ILE A 641 1.273 -6.118 11.393 1.00 0.00 O ATOM 1635 CB ILE A 641 -0.665 -3.491 11.834 1.00 0.00 C ATOM 1636 CG1 ILE A 641 -1.328 -2.730 12.983 1.00 0.00 C ATOM 1637 CG2 ILE A 641 -1.501 -4.700 11.441 1.00 0.00 C ATOM 1638 CD1 ILE A 641 -2.819 -2.541 12.803 1.00 0.00 C ATOM 0 H ILE A 641 1.487 -2.041 11.686 1.00 0.00 H new ATOM 0 HA ILE A 641 0.717 -4.420 13.203 1.00 0.00 H new ATOM 0 HB ILE A 641 -0.597 -2.825 10.973 1.00 0.00 H new ATOM 0 HG12 ILE A 641 -1.148 -3.266 13.915 1.00 0.00 H new ATOM 0 HG13 ILE A 641 -0.855 -1.753 13.081 1.00 0.00 H new ATOM 0 HG21 ILE A 641 -2.504 -4.374 11.163 1.00 0.00 H new ATOM 0 HG22 ILE A 641 -1.036 -5.204 10.594 1.00 0.00 H new ATOM 0 HG23 ILE A 641 -1.563 -5.389 12.284 1.00 0.00 H new ATOM 0 HD11 ILE A 641 -3.222 -1.994 13.655 1.00 0.00 H new ATOM 0 HD12 ILE A 641 -3.007 -1.978 11.889 1.00 0.00 H new ATOM 0 HD13 ILE A 641 -3.304 -3.515 12.735 1.00 0.00 H new ATOM 1650 N GLY A 642 1.773 -4.364 10.073 1.00 0.00 N ATOM 1651 CA GLY A 642 2.312 -5.200 9.018 1.00 0.00 C ATOM 1652 C GLY A 642 2.152 -4.578 7.645 1.00 0.00 C ATOM 1653 O GLY A 642 1.300 -3.714 7.441 1.00 0.00 O ATOM 0 H GLY A 642 1.799 -3.362 9.882 1.00 0.00 H new ATOM 0 HA2 GLY A 642 3.369 -5.384 9.209 1.00 0.00 H new ATOM 0 HA3 GLY A 642 1.812 -6.168 9.035 1.00 0.00 H new ATOM 1657 N GLY A 643 2.980 -5.017 6.703 1.00 0.00 N ATOM 1658 CA GLY A 643 2.920 -4.487 5.353 1.00 0.00 C ATOM 1659 C GLY A 643 3.524 -5.426 4.326 1.00 0.00 C ATOM 1660 O GLY A 643 3.677 -6.620 4.579 1.00 0.00 O ATOM 0 H GLY A 643 3.693 -5.732 6.851 1.00 0.00 H new ATOM 0 HA2 GLY A 643 1.881 -4.289 5.091 1.00 0.00 H new ATOM 0 HA3 GLY A 643 3.445 -3.532 5.319 1.00 0.00 H new ATOM 1664 N CYS A 644 3.869 -4.879 3.163 1.00 0.00 N ATOM 1665 CA CYS A 644 4.462 -5.670 2.089 1.00 0.00 C ATOM 1666 C CYS A 644 5.138 -4.768 1.061 1.00 0.00 C ATOM 1667 O CYS A 644 4.777 -3.600 0.914 1.00 0.00 O ATOM 1668 CB CYS A 644 3.397 -6.531 1.408 1.00 0.00 C ATOM 1669 SG CYS A 644 3.568 -8.304 1.725 1.00 0.00 S ATOM 0 H CYS A 644 3.748 -3.891 2.941 1.00 0.00 H new ATOM 0 HA CYS A 644 5.217 -6.323 2.528 1.00 0.00 H new ATOM 0 HB2 CYS A 644 2.412 -6.206 1.744 1.00 0.00 H new ATOM 0 HB3 CYS A 644 3.439 -6.359 0.332 1.00 0.00 H new ATOM 0 HG CYS A 644 3.050 -8.590 2.882 1.00 0.00 H new ATOM 1675 N GLN A 645 6.121 -5.316 0.353 1.00 0.00 N ATOM 1676 CA GLN A 645 6.847 -4.560 -0.662 1.00 0.00 C ATOM 1677 C GLN A 645 6.339 -4.897 -2.059 1.00 0.00 C ATOM 1678 O GLN A 645 6.110 -6.063 -2.382 1.00 0.00 O ATOM 1679 CB GLN A 645 8.345 -4.852 -0.570 1.00 0.00 C ATOM 1680 CG GLN A 645 9.107 -3.866 0.301 1.00 0.00 C ATOM 1681 CD GLN A 645 10.237 -4.521 1.071 1.00 0.00 C ATOM 1682 OE1 GLN A 645 10.301 -4.431 2.297 1.00 0.00 O ATOM 1683 NE2 GLN A 645 11.136 -5.184 0.353 1.00 0.00 N ATOM 0 H GLN A 645 6.433 -6.281 0.463 1.00 0.00 H new ATOM 0 HA GLN A 645 6.677 -3.499 -0.479 1.00 0.00 H new ATOM 0 HB2 GLN A 645 8.487 -5.858 -0.174 1.00 0.00 H new ATOM 0 HB3 GLN A 645 8.771 -4.841 -1.573 1.00 0.00 H new ATOM 0 HG2 GLN A 645 9.512 -3.071 -0.325 1.00 0.00 H new ATOM 0 HG3 GLN A 645 8.417 -3.398 1.003 1.00 0.00 H new ATOM 0 HE21 GLN A 645 11.043 -5.233 -0.662 1.00 0.00 H new ATOM 0 HE22 GLN A 645 11.919 -5.645 0.816 1.00 0.00 H new ATOM 1692 N LEU A 646 6.161 -3.870 -2.885 1.00 0.00 N ATOM 1693 CA LEU A 646 5.677 -4.064 -4.245 1.00 0.00 C ATOM 1694 C LEU A 646 6.604 -3.412 -5.266 1.00 0.00 C ATOM 1695 O LEU A 646 6.476 -2.229 -5.575 1.00 0.00 O ATOM 1696 CB LEU A 646 4.265 -3.498 -4.387 1.00 0.00 C ATOM 1697 CG LEU A 646 3.157 -4.420 -3.883 1.00 0.00 C ATOM 1698 CD1 LEU A 646 1.798 -3.940 -4.370 1.00 0.00 C ATOM 1699 CD2 LEU A 646 3.415 -5.851 -4.334 1.00 0.00 C ATOM 0 H LEU A 646 6.345 -2.898 -2.636 1.00 0.00 H new ATOM 0 HA LEU A 646 5.659 -5.136 -4.442 1.00 0.00 H new ATOM 0 HB2 LEU A 646 4.210 -2.555 -3.844 1.00 0.00 H new ATOM 0 HB3 LEU A 646 4.082 -3.272 -5.438 1.00 0.00 H new ATOM 0 HG LEU A 646 3.155 -4.396 -2.793 1.00 0.00 H new ATOM 0 HD11 LEU A 646 1.022 -4.610 -4.000 1.00 0.00 H new ATOM 0 HD12 LEU A 646 1.614 -2.932 -3.999 1.00 0.00 H new ATOM 0 HD13 LEU A 646 1.783 -3.934 -5.460 1.00 0.00 H new ATOM 0 HD21 LEU A 646 2.617 -6.497 -3.968 1.00 0.00 H new ATOM 0 HD22 LEU A 646 3.442 -5.890 -5.423 1.00 0.00 H new ATOM 0 HD23 LEU A 646 4.370 -6.192 -3.935 1.00 0.00 H new ATOM 1711 N GLY A 647 7.533 -4.203 -5.792 1.00 0.00 N ATOM 1712 CA GLY A 647 8.469 -3.706 -6.782 1.00 0.00 C ATOM 1713 C GLY A 647 8.764 -4.748 -7.839 1.00 0.00 C ATOM 1714 O GLY A 647 8.851 -5.938 -7.533 1.00 0.00 O ATOM 0 H GLY A 647 7.654 -5.186 -5.548 1.00 0.00 H new ATOM 0 HA2 GLY A 647 8.060 -2.813 -7.254 1.00 0.00 H new ATOM 0 HA3 GLY A 647 9.397 -3.411 -6.291 1.00 0.00 H new ATOM 1718 N ILE A 648 8.905 -4.316 -9.087 1.00 0.00 N ATOM 1719 CA ILE A 648 9.170 -5.230 -10.172 1.00 0.00 C ATOM 1720 C ILE A 648 10.411 -6.076 -9.900 1.00 0.00 C ATOM 1721 O ILE A 648 10.615 -7.118 -10.523 1.00 0.00 O ATOM 1722 CB ILE A 648 9.302 -4.472 -11.504 1.00 0.00 C ATOM 1723 CG1 ILE A 648 8.654 -5.271 -12.616 1.00 0.00 C ATOM 1724 CG2 ILE A 648 10.751 -4.156 -11.830 1.00 0.00 C ATOM 1725 CD1 ILE A 648 8.904 -4.705 -13.993 1.00 0.00 C ATOM 0 H ILE A 648 8.839 -3.337 -9.364 1.00 0.00 H new ATOM 0 HA ILE A 648 8.321 -5.909 -10.248 1.00 0.00 H new ATOM 0 HB ILE A 648 8.784 -3.518 -11.407 1.00 0.00 H new ATOM 0 HG12 ILE A 648 9.026 -6.295 -12.580 1.00 0.00 H new ATOM 0 HG13 ILE A 648 7.579 -5.316 -12.441 1.00 0.00 H new ATOM 0 HG21 ILE A 648 10.802 -3.620 -12.778 1.00 0.00 H new ATOM 0 HG22 ILE A 648 11.175 -3.536 -11.040 1.00 0.00 H new ATOM 0 HG23 ILE A 648 11.317 -5.084 -11.907 1.00 0.00 H new ATOM 0 HD11 ILE A 648 8.410 -5.329 -14.738 1.00 0.00 H new ATOM 0 HD12 ILE A 648 8.507 -3.691 -14.047 1.00 0.00 H new ATOM 0 HD13 ILE A 648 9.976 -4.686 -14.189 1.00 0.00 H new ATOM 1737 N SER A 649 11.226 -5.635 -8.950 1.00 0.00 N ATOM 1738 CA SER A 649 12.426 -6.372 -8.581 1.00 0.00 C ATOM 1739 C SER A 649 12.063 -7.526 -7.649 1.00 0.00 C ATOM 1740 O SER A 649 12.936 -8.237 -7.150 1.00 0.00 O ATOM 1741 CB SER A 649 13.438 -5.446 -7.905 1.00 0.00 C ATOM 1742 OG SER A 649 14.720 -6.048 -7.846 1.00 0.00 O ATOM 0 H SER A 649 11.078 -4.774 -8.423 1.00 0.00 H new ATOM 0 HA SER A 649 12.880 -6.776 -9.486 1.00 0.00 H new ATOM 0 HB2 SER A 649 13.499 -4.506 -8.454 1.00 0.00 H new ATOM 0 HB3 SER A 649 13.099 -5.205 -6.897 1.00 0.00 H new ATOM 0 HG SER A 649 14.624 -7.005 -7.658 1.00 0.00 H new ATOM 1748 N ALA A 650 10.762 -7.700 -7.418 1.00 0.00 N ATOM 1749 CA ALA A 650 10.260 -8.754 -6.550 1.00 0.00 C ATOM 1750 C ALA A 650 10.116 -10.070 -7.303 1.00 0.00 C ATOM 1751 O ALA A 650 10.217 -10.112 -8.529 1.00 0.00 O ATOM 1752 CB ALA A 650 8.920 -8.342 -5.963 1.00 0.00 C ATOM 0 H ALA A 650 10.033 -7.115 -7.827 1.00 0.00 H new ATOM 0 HA ALA A 650 10.980 -8.904 -5.746 1.00 0.00 H new ATOM 0 HB1 ALA A 650 8.548 -9.135 -5.314 1.00 0.00 H new ATOM 0 HB2 ALA A 650 9.042 -7.426 -5.384 1.00 0.00 H new ATOM 0 HB3 ALA A 650 8.207 -8.169 -6.769 1.00 0.00 H new ATOM 1802 N ARG A 654 4.162 -10.563 -5.951 1.00 0.00 N ATOM 1803 CA ARG A 654 4.117 -9.106 -5.957 1.00 0.00 C ATOM 1804 C ARG A 654 4.444 -8.554 -7.338 1.00 0.00 C ATOM 1805 O ARG A 654 3.832 -7.587 -7.791 1.00 0.00 O ATOM 1806 CB ARG A 654 5.088 -8.543 -4.924 1.00 0.00 C ATOM 1807 CG ARG A 654 4.750 -8.942 -3.498 1.00 0.00 C ATOM 1808 CD ARG A 654 5.997 -9.020 -2.640 1.00 0.00 C ATOM 1809 NE ARG A 654 6.324 -10.394 -2.270 1.00 0.00 N ATOM 1810 CZ ARG A 654 5.813 -11.010 -1.209 1.00 0.00 C ATOM 1811 NH1 ARG A 654 4.956 -10.376 -0.419 1.00 0.00 N ATOM 1812 NH2 ARG A 654 6.160 -12.261 -0.935 1.00 0.00 N ATOM 0 HA ARG A 654 3.104 -8.798 -5.698 1.00 0.00 H new ATOM 0 HB2 ARG A 654 6.096 -8.884 -5.160 1.00 0.00 H new ATOM 0 HB3 ARG A 654 5.095 -7.455 -4.997 1.00 0.00 H new ATOM 0 HG2 ARG A 654 4.056 -8.219 -3.070 1.00 0.00 H new ATOM 0 HG3 ARG A 654 4.244 -9.908 -3.498 1.00 0.00 H new ATOM 0 HD2 ARG A 654 6.836 -8.581 -3.180 1.00 0.00 H new ATOM 0 HD3 ARG A 654 5.853 -8.426 -1.737 1.00 0.00 H new ATOM 0 HE ARG A 654 6.980 -10.909 -2.857 1.00 0.00 H new ATOM 0 HH11 ARG A 654 4.688 -9.414 -0.625 1.00 0.00 H new ATOM 0 HH12 ARG A 654 4.565 -10.851 0.395 1.00 0.00 H new ATOM 0 HH21 ARG A 654 6.820 -12.751 -1.539 1.00 0.00 H new ATOM 0 HH22 ARG A 654 5.767 -12.732 -0.120 1.00 0.00 H new ATOM 1826 N LEU A 655 5.410 -9.175 -8.005 1.00 0.00 N ATOM 1827 CA LEU A 655 5.810 -8.740 -9.338 1.00 0.00 C ATOM 1828 C LEU A 655 4.622 -8.772 -10.290 1.00 0.00 C ATOM 1829 O LEU A 655 4.446 -7.872 -11.112 1.00 0.00 O ATOM 1830 CB LEU A 655 6.927 -9.629 -9.884 1.00 0.00 C ATOM 1831 CG LEU A 655 7.447 -9.221 -11.263 1.00 0.00 C ATOM 1832 CD1 LEU A 655 8.296 -7.967 -11.155 1.00 0.00 C ATOM 1833 CD2 LEU A 655 8.243 -10.353 -11.894 1.00 0.00 C ATOM 0 H LEU A 655 5.928 -9.977 -7.647 1.00 0.00 H new ATOM 0 HA LEU A 655 6.178 -7.717 -9.261 1.00 0.00 H new ATOM 0 HB2 LEU A 655 7.758 -9.620 -9.179 1.00 0.00 H new ATOM 0 HB3 LEU A 655 6.564 -10.656 -9.936 1.00 0.00 H new ATOM 0 HG LEU A 655 6.592 -9.008 -11.905 1.00 0.00 H new ATOM 0 HD11 LEU A 655 8.660 -7.688 -12.144 1.00 0.00 H new ATOM 0 HD12 LEU A 655 7.695 -7.155 -10.747 1.00 0.00 H new ATOM 0 HD13 LEU A 655 9.144 -8.157 -10.497 1.00 0.00 H new ATOM 0 HD21 LEU A 655 8.604 -10.042 -12.874 1.00 0.00 H new ATOM 0 HD22 LEU A 655 9.092 -10.600 -11.257 1.00 0.00 H new ATOM 0 HD23 LEU A 655 7.605 -11.230 -12.004 1.00 0.00 H new ATOM 1845 N LYS A 656 3.813 -9.817 -10.174 1.00 0.00 N ATOM 1846 CA LYS A 656 2.642 -9.974 -11.025 1.00 0.00 C ATOM 1847 C LYS A 656 1.689 -8.795 -10.865 1.00 0.00 C ATOM 1848 O LYS A 656 1.170 -8.272 -11.850 1.00 0.00 O ATOM 1849 CB LYS A 656 1.919 -11.282 -10.699 1.00 0.00 C ATOM 1850 CG LYS A 656 2.532 -12.499 -11.373 1.00 0.00 C ATOM 1851 CD LYS A 656 2.043 -13.792 -10.741 1.00 0.00 C ATOM 1852 CE LYS A 656 2.801 -14.995 -11.277 1.00 0.00 C ATOM 1853 NZ LYS A 656 2.087 -15.642 -12.414 1.00 0.00 N ATOM 0 H LYS A 656 3.947 -10.569 -9.498 1.00 0.00 H new ATOM 0 HA LYS A 656 2.979 -10.004 -12.061 1.00 0.00 H new ATOM 0 HB2 LYS A 656 1.926 -11.432 -9.619 1.00 0.00 H new ATOM 0 HB3 LYS A 656 0.875 -11.196 -11.002 1.00 0.00 H new ATOM 0 HG2 LYS A 656 2.281 -12.494 -12.434 1.00 0.00 H new ATOM 0 HG3 LYS A 656 3.618 -12.447 -11.302 1.00 0.00 H new ATOM 0 HD2 LYS A 656 2.163 -13.738 -9.659 1.00 0.00 H new ATOM 0 HD3 LYS A 656 0.978 -13.914 -10.938 1.00 0.00 H new ATOM 0 HE2 LYS A 656 3.793 -14.683 -11.602 1.00 0.00 H new ATOM 0 HE3 LYS A 656 2.942 -15.721 -10.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 656 2.637 -16.458 -12.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 656 1.150 -15.963 -12.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 656 1.975 -14.957 -13.189 1.00 0.00 H new ATOM 1867 N HIS A 657 1.465 -8.377 -9.624 1.00 0.00 N ATOM 1868 CA HIS A 657 0.577 -7.255 -9.351 1.00 0.00 C ATOM 1869 C HIS A 657 1.238 -5.940 -9.737 1.00 0.00 C ATOM 1870 O HIS A 657 0.817 -5.273 -10.683 1.00 0.00 O ATOM 1871 CB HIS A 657 0.191 -7.224 -7.871 1.00 0.00 C ATOM 1872 CG HIS A 657 -0.650 -6.041 -7.504 1.00 0.00 C ATOM 1873 ND1 HIS A 657 -1.131 -5.824 -6.230 1.00 0.00 N ATOM 1874 CD2 HIS A 657 -1.103 -5.010 -8.256 1.00 0.00 C ATOM 1875 CE1 HIS A 657 -1.847 -4.712 -6.217 1.00 0.00 C ATOM 1876 NE2 HIS A 657 -1.842 -4.199 -7.432 1.00 0.00 N ATOM 0 H HIS A 657 1.885 -8.797 -8.795 1.00 0.00 H new ATOM 0 HA HIS A 657 -0.324 -7.385 -9.950 1.00 0.00 H new ATOM 0 HB2 HIS A 657 -0.351 -8.137 -7.625 1.00 0.00 H new ATOM 0 HB3 HIS A 657 1.098 -7.218 -7.266 1.00 0.00 H new ATOM 0 HD2 HIS A 657 -0.917 -4.855 -9.309 1.00 0.00 H new ATOM 0 HE1 HIS A 657 -2.350 -4.295 -5.357 1.00 0.00 H new ATOM 0 HE2 HIS A 657 -2.312 -3.338 -7.714 1.00 0.00 H new ATOM 1885 N TRP A 658 2.282 -5.577 -9.002 1.00 0.00 N ATOM 1886 CA TRP A 658 3.011 -4.343 -9.269 1.00 0.00 C ATOM 1887 C TRP A 658 3.248 -4.175 -10.765 1.00 0.00 C ATOM 1888 O TRP A 658 2.551 -3.417 -11.439 1.00 0.00 O ATOM 1889 CB TRP A 658 4.349 -4.353 -8.528 1.00 0.00 C ATOM 1890 CG TRP A 658 5.277 -3.267 -8.975 1.00 0.00 C ATOM 1891 CD1 TRP A 658 6.457 -3.418 -9.643 1.00 0.00 C ATOM 1892 CD2 TRP A 658 5.094 -1.861 -8.791 1.00 0.00 C ATOM 1893 NE1 TRP A 658 7.024 -2.190 -9.884 1.00 0.00 N ATOM 1894 CE2 TRP A 658 6.202 -1.216 -9.371 1.00 0.00 C ATOM 1895 CE3 TRP A 658 4.099 -1.086 -8.191 1.00 0.00 C ATOM 1896 CZ2 TRP A 658 6.339 0.170 -9.368 1.00 0.00 C ATOM 1897 CZ3 TRP A 658 4.236 0.289 -8.188 1.00 0.00 C ATOM 1898 CH2 TRP A 658 5.349 0.905 -8.774 1.00 0.00 C ATOM 0 H TRP A 658 2.643 -6.119 -8.217 1.00 0.00 H new ATOM 0 HA TRP A 658 2.412 -3.504 -8.914 1.00 0.00 H new ATOM 0 HB2 TRP A 658 4.166 -4.249 -7.459 1.00 0.00 H new ATOM 0 HB3 TRP A 658 4.832 -5.319 -8.676 1.00 0.00 H new ATOM 0 HD1 TRP A 658 6.883 -4.365 -9.939 1.00 0.00 H new ATOM 0 HE1 TRP A 658 7.909 -2.028 -10.364 1.00 0.00 H new ATOM 0 HE3 TRP A 658 3.237 -1.553 -7.737 1.00 0.00 H new ATOM 0 HZ2 TRP A 658 7.196 0.648 -9.819 1.00 0.00 H new ATOM 0 HZ3 TRP A 658 3.473 0.898 -7.727 1.00 0.00 H new ATOM 0 HH2 TRP A 658 5.428 1.982 -8.757 1.00 0.00 H new ATOM 1909 N TYR A 659 4.237 -4.898 -11.272 1.00 0.00 N ATOM 1910 CA TYR A 659 4.588 -4.862 -12.683 1.00 0.00 C ATOM 1911 C TYR A 659 3.348 -4.715 -13.562 1.00 0.00 C ATOM 1912 O TYR A 659 3.270 -3.806 -14.386 1.00 0.00 O ATOM 1913 CB TYR A 659 5.342 -6.148 -13.024 1.00 0.00 C ATOM 1914 CG TYR A 659 6.049 -6.169 -14.365 1.00 0.00 C ATOM 1915 CD1 TYR A 659 5.545 -5.504 -15.479 1.00 0.00 C ATOM 1916 CD2 TYR A 659 7.231 -6.882 -14.513 1.00 0.00 C ATOM 1917 CE1 TYR A 659 6.193 -5.552 -16.691 1.00 0.00 C ATOM 1918 CE2 TYR A 659 7.887 -6.935 -15.724 1.00 0.00 C ATOM 1919 CZ TYR A 659 7.365 -6.269 -16.813 1.00 0.00 C ATOM 1920 OH TYR A 659 8.017 -6.319 -18.023 1.00 0.00 O ATOM 0 H TYR A 659 4.818 -5.526 -10.716 1.00 0.00 H new ATOM 0 HA TYR A 659 5.219 -3.995 -12.876 1.00 0.00 H new ATOM 0 HB2 TYR A 659 6.081 -6.330 -12.243 1.00 0.00 H new ATOM 0 HB3 TYR A 659 4.636 -6.978 -12.995 1.00 0.00 H new ATOM 0 HD1 TYR A 659 4.628 -4.940 -15.390 1.00 0.00 H new ATOM 0 HD2 TYR A 659 7.644 -7.405 -13.663 1.00 0.00 H new ATOM 0 HE1 TYR A 659 5.786 -5.030 -17.544 1.00 0.00 H new ATOM 0 HE2 TYR A 659 8.805 -7.495 -15.820 1.00 0.00 H new ATOM 0 HH TYR A 659 8.826 -6.865 -17.936 1.00 0.00 H new ATOM 1930 N GLU A 660 2.383 -5.612 -13.395 1.00 0.00 N ATOM 1931 CA GLU A 660 1.165 -5.570 -14.192 1.00 0.00 C ATOM 1932 C GLU A 660 0.723 -4.134 -14.410 1.00 0.00 C ATOM 1933 O GLU A 660 0.353 -3.745 -15.515 1.00 0.00 O ATOM 1934 CB GLU A 660 0.045 -6.351 -13.504 1.00 0.00 C ATOM 1935 CG GLU A 660 -0.220 -7.716 -14.114 1.00 0.00 C ATOM 1936 CD GLU A 660 -0.357 -7.667 -15.624 1.00 0.00 C ATOM 1937 OE1 GLU A 660 0.684 -7.634 -16.313 1.00 0.00 O ATOM 1938 OE2 GLU A 660 -1.505 -7.663 -16.116 1.00 0.00 O ATOM 0 H GLU A 660 2.421 -6.374 -12.718 1.00 0.00 H new ATOM 0 HA GLU A 660 1.377 -6.029 -15.158 1.00 0.00 H new ATOM 0 HB2 GLU A 660 0.298 -6.478 -12.451 1.00 0.00 H new ATOM 0 HB3 GLU A 660 -0.872 -5.763 -13.543 1.00 0.00 H new ATOM 0 HG2 GLU A 660 0.593 -8.392 -13.849 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -1.132 -8.131 -13.684 1.00 0.00 H new ATOM 1945 N CYS A 661 0.770 -3.352 -13.343 1.00 0.00 N ATOM 1946 CA CYS A 661 0.377 -1.949 -13.409 1.00 0.00 C ATOM 1947 C CYS A 661 1.060 -1.259 -14.583 1.00 0.00 C ATOM 1948 O CYS A 661 0.473 -0.408 -15.250 1.00 0.00 O ATOM 1949 CB CYS A 661 0.732 -1.236 -12.104 1.00 0.00 C ATOM 1950 SG CYS A 661 0.212 0.495 -12.042 1.00 0.00 S ATOM 0 H CYS A 661 1.076 -3.662 -12.421 1.00 0.00 H new ATOM 0 HA CYS A 661 -0.702 -1.901 -13.555 1.00 0.00 H new ATOM 0 HB2 CYS A 661 0.273 -1.772 -11.273 1.00 0.00 H new ATOM 0 HB3 CYS A 661 1.811 -1.285 -11.958 1.00 0.00 H new ATOM 0 HG CYS A 661 -0.187 0.871 -13.221 1.00 0.00 H new ATOM 1956 N LEU A 662 2.307 -1.642 -14.825 1.00 0.00 N ATOM 1957 CA LEU A 662 3.093 -1.079 -15.913 1.00 0.00 C ATOM 1958 C LEU A 662 2.534 -1.499 -17.268 1.00 0.00 C ATOM 1959 O LEU A 662 2.470 -0.696 -18.200 1.00 0.00 O ATOM 1960 CB LEU A 662 4.545 -1.526 -15.787 1.00 0.00 C ATOM 1961 CG LEU A 662 5.377 -0.707 -14.806 1.00 0.00 C ATOM 1962 CD1 LEU A 662 5.495 -1.418 -13.468 1.00 0.00 C ATOM 1963 CD2 LEU A 662 6.748 -0.436 -15.388 1.00 0.00 C ATOM 0 H LEU A 662 2.799 -2.347 -14.276 1.00 0.00 H new ATOM 0 HA LEU A 662 3.041 0.008 -15.846 1.00 0.00 H new ATOM 0 HB2 LEU A 662 4.564 -2.571 -15.476 1.00 0.00 H new ATOM 0 HB3 LEU A 662 5.013 -1.477 -16.770 1.00 0.00 H new ATOM 0 HG LEU A 662 4.873 0.244 -14.636 1.00 0.00 H new ATOM 0 HD11 LEU A 662 6.093 -0.813 -12.786 1.00 0.00 H new ATOM 0 HD12 LEU A 662 4.501 -1.566 -13.046 1.00 0.00 H new ATOM 0 HD13 LEU A 662 5.976 -2.386 -13.611 1.00 0.00 H new ATOM 0 HD21 LEU A 662 7.335 0.149 -14.680 1.00 0.00 H new ATOM 0 HD22 LEU A 662 7.254 -1.382 -15.584 1.00 0.00 H new ATOM 0 HD23 LEU A 662 6.644 0.120 -16.320 1.00 0.00 H new ATOM 1975 N LYS A 663 2.122 -2.756 -17.371 1.00 0.00 N ATOM 1976 CA LYS A 663 1.562 -3.275 -18.607 1.00 0.00 C ATOM 1977 C LYS A 663 0.110 -2.837 -18.735 1.00 0.00 C ATOM 1978 O LYS A 663 -0.389 -2.584 -19.833 1.00 0.00 O ATOM 1979 CB LYS A 663 1.690 -4.805 -18.625 1.00 0.00 C ATOM 1980 CG LYS A 663 0.368 -5.559 -18.629 1.00 0.00 C ATOM 1981 CD LYS A 663 0.551 -6.995 -19.093 1.00 0.00 C ATOM 1982 CE LYS A 663 -0.785 -7.701 -19.261 1.00 0.00 C ATOM 1983 NZ LYS A 663 -0.807 -8.566 -20.472 1.00 0.00 N ATOM 0 H LYS A 663 2.166 -3.434 -16.611 1.00 0.00 H new ATOM 0 HA LYS A 663 2.111 -2.878 -19.461 1.00 0.00 H new ATOM 0 HB2 LYS A 663 2.261 -5.097 -19.507 1.00 0.00 H new ATOM 0 HB3 LYS A 663 2.267 -5.117 -17.754 1.00 0.00 H new ATOM 0 HG2 LYS A 663 -0.061 -5.550 -17.627 1.00 0.00 H new ATOM 0 HG3 LYS A 663 -0.341 -5.051 -19.283 1.00 0.00 H new ATOM 0 HD2 LYS A 663 1.091 -7.007 -20.040 1.00 0.00 H new ATOM 0 HD3 LYS A 663 1.162 -7.537 -18.371 1.00 0.00 H new ATOM 0 HE2 LYS A 663 -0.989 -8.307 -18.378 1.00 0.00 H new ATOM 0 HE3 LYS A 663 -1.581 -6.960 -19.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 663 -1.735 -9.029 -20.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 663 -0.638 -7.984 -21.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 663 -0.064 -9.290 -20.395 1.00 0.00 H new ATOM 1997 N ASN A 664 -0.555 -2.748 -17.593 1.00 0.00 N ATOM 1998 CA ASN A 664 -1.951 -2.338 -17.539 1.00 0.00 C ATOM 1999 C ASN A 664 -2.081 -0.947 -16.922 1.00 0.00 C ATOM 2000 O ASN A 664 -2.936 -0.714 -16.068 1.00 0.00 O ATOM 2001 CB ASN A 664 -2.765 -3.348 -16.728 1.00 0.00 C ATOM 2002 CG ASN A 664 -3.404 -4.411 -17.601 1.00 0.00 C ATOM 2003 OD1 ASN A 664 -4.391 -4.156 -18.289 1.00 0.00 O ATOM 2004 ND2 ASN A 664 -2.841 -5.613 -17.575 1.00 0.00 N ATOM 0 H ASN A 664 -0.146 -2.956 -16.682 1.00 0.00 H new ATOM 0 HA ASN A 664 -2.339 -2.303 -18.557 1.00 0.00 H new ATOM 0 HB2 ASN A 664 -2.117 -3.826 -15.994 1.00 0.00 H new ATOM 0 HB3 ASN A 664 -3.542 -2.822 -16.173 1.00 0.00 H new ATOM 0 HD21 ASN A 664 -3.227 -6.369 -18.141 1.00 0.00 H new ATOM 0 HD22 ASN A 664 -2.023 -5.780 -16.989 1.00 0.00 H new ATOM 2011 N LYS A 665 -1.224 -0.029 -17.359 1.00 0.00 N ATOM 2012 CA LYS A 665 -1.239 1.338 -16.846 1.00 0.00 C ATOM 2013 C LYS A 665 -2.665 1.796 -16.551 1.00 0.00 C ATOM 2014 O LYS A 665 -3.181 1.575 -15.458 1.00 0.00 O ATOM 2015 CB LYS A 665 -0.579 2.289 -17.848 1.00 0.00 C ATOM 2016 CG LYS A 665 0.940 2.252 -17.815 1.00 0.00 C ATOM 2017 CD LYS A 665 1.530 2.461 -19.198 1.00 0.00 C ATOM 2018 CE LYS A 665 0.944 1.488 -20.206 1.00 0.00 C ATOM 2019 NZ LYS A 665 1.901 1.185 -21.305 1.00 0.00 N ATOM 0 H LYS A 665 -0.511 -0.206 -18.066 1.00 0.00 H new ATOM 0 HA LYS A 665 -0.674 1.355 -15.914 1.00 0.00 H new ATOM 0 HB2 LYS A 665 -0.918 2.037 -18.853 1.00 0.00 H new ATOM 0 HB3 LYS A 665 -0.913 3.306 -17.645 1.00 0.00 H new ATOM 0 HG2 LYS A 665 1.310 3.024 -17.140 1.00 0.00 H new ATOM 0 HG3 LYS A 665 1.273 1.294 -17.417 1.00 0.00 H new ATOM 0 HD2 LYS A 665 1.340 3.483 -19.525 1.00 0.00 H new ATOM 0 HD3 LYS A 665 2.612 2.335 -19.156 1.00 0.00 H new ATOM 0 HE2 LYS A 665 0.668 0.563 -19.700 1.00 0.00 H new ATOM 0 HE3 LYS A 665 0.030 1.907 -20.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 665 1.464 0.518 -21.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 665 2.145 2.064 -21.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 665 2.764 0.762 -20.907 1.00 0.00 H new ATOM 2033 N ASP A 666 -3.294 2.438 -17.531 1.00 0.00 N ATOM 2034 CA ASP A 666 -4.658 2.930 -17.374 1.00 0.00 C ATOM 2035 C ASP A 666 -5.536 1.899 -16.670 1.00 0.00 C ATOM 2036 O ASP A 666 -6.510 2.251 -16.004 1.00 0.00 O ATOM 2037 CB ASP A 666 -5.257 3.279 -18.738 1.00 0.00 C ATOM 2038 CG ASP A 666 -4.267 3.994 -19.636 1.00 0.00 C ATOM 2039 OD1 ASP A 666 -3.126 4.237 -19.189 1.00 0.00 O ATOM 2040 OD2 ASP A 666 -4.632 4.311 -20.788 1.00 0.00 O ATOM 0 H ASP A 666 -2.880 2.630 -18.443 1.00 0.00 H new ATOM 0 HA ASP A 666 -4.622 3.829 -16.758 1.00 0.00 H new ATOM 0 HB2 ASP A 666 -5.595 2.366 -19.228 1.00 0.00 H new ATOM 0 HB3 ASP A 666 -6.136 3.908 -18.596 1.00 0.00 H new ATOM 2045 N LYS A 667 -5.189 0.626 -16.825 1.00 0.00 N ATOM 2046 CA LYS A 667 -5.949 -0.454 -16.206 1.00 0.00 C ATOM 2047 C LYS A 667 -5.578 -0.608 -14.735 1.00 0.00 C ATOM 2048 O LYS A 667 -4.453 -0.312 -14.333 1.00 0.00 O ATOM 2049 CB LYS A 667 -5.704 -1.765 -16.952 1.00 0.00 C ATOM 2050 CG LYS A 667 -6.570 -1.923 -18.192 1.00 0.00 C ATOM 2051 CD LYS A 667 -5.728 -2.190 -19.428 1.00 0.00 C ATOM 2052 CE LYS A 667 -6.140 -3.482 -20.113 1.00 0.00 C ATOM 2053 NZ LYS A 667 -7.468 -3.361 -20.773 1.00 0.00 N ATOM 0 H LYS A 667 -4.387 0.317 -17.374 1.00 0.00 H new ATOM 0 HA LYS A 667 -7.008 -0.204 -16.266 1.00 0.00 H new ATOM 0 HB2 LYS A 667 -4.654 -1.820 -17.241 1.00 0.00 H new ATOM 0 HB3 LYS A 667 -5.893 -2.600 -16.277 1.00 0.00 H new ATOM 0 HG2 LYS A 667 -7.272 -2.743 -18.045 1.00 0.00 H new ATOM 0 HG3 LYS A 667 -7.162 -1.020 -18.342 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -5.830 -1.359 -20.125 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -4.676 -2.245 -19.148 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -5.389 -3.755 -20.855 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -6.171 -4.288 -19.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -7.713 -4.263 -21.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -8.189 -3.126 -20.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -7.432 -2.609 -21.491 1.00 0.00 H new ATOM 2067 N LYS A 668 -6.537 -1.060 -13.935 1.00 0.00 N ATOM 2068 CA LYS A 668 -6.320 -1.241 -12.505 1.00 0.00 C ATOM 2069 C LYS A 668 -5.808 -2.643 -12.185 1.00 0.00 C ATOM 2070 O LYS A 668 -6.032 -3.588 -12.940 1.00 0.00 O ATOM 2071 CB LYS A 668 -7.619 -0.984 -11.741 1.00 0.00 C ATOM 2072 CG LYS A 668 -8.373 0.247 -12.219 1.00 0.00 C ATOM 2073 CD LYS A 668 -9.105 0.931 -11.077 1.00 0.00 C ATOM 2074 CE LYS A 668 -8.181 1.179 -9.895 1.00 0.00 C ATOM 2075 NZ LYS A 668 -8.511 2.447 -9.188 1.00 0.00 N ATOM 0 H LYS A 668 -7.474 -1.308 -14.253 1.00 0.00 H new ATOM 0 HA LYS A 668 -5.560 -0.524 -12.194 1.00 0.00 H new ATOM 0 HB2 LYS A 668 -8.266 -1.856 -11.837 1.00 0.00 H new ATOM 0 HB3 LYS A 668 -7.391 -0.871 -10.681 1.00 0.00 H new ATOM 0 HG2 LYS A 668 -7.674 0.948 -12.676 1.00 0.00 H new ATOM 0 HG3 LYS A 668 -9.088 -0.040 -12.990 1.00 0.00 H new ATOM 0 HD2 LYS A 668 -9.518 1.879 -11.423 1.00 0.00 H new ATOM 0 HD3 LYS A 668 -9.946 0.314 -10.760 1.00 0.00 H new ATOM 0 HE2 LYS A 668 -8.253 0.345 -9.197 1.00 0.00 H new ATOM 0 HE3 LYS A 668 -7.149 1.215 -10.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 668 -7.858 2.579 -8.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 668 -8.418 3.246 -9.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 668 -9.488 2.403 -8.833 1.00 0.00 H new ATOM 2089 N ILE A 669 -5.134 -2.761 -11.046 1.00 0.00 N ATOM 2090 CA ILE A 669 -4.596 -4.038 -10.593 1.00 0.00 C ATOM 2091 C ILE A 669 -4.806 -4.191 -9.091 1.00 0.00 C ATOM 2092 O ILE A 669 -4.047 -3.644 -8.291 1.00 0.00 O ATOM 2093 CB ILE A 669 -3.090 -4.171 -10.900 1.00 0.00 C ATOM 2094 CG1 ILE A 669 -2.754 -3.527 -12.252 1.00 0.00 C ATOM 2095 CG2 ILE A 669 -2.670 -5.634 -10.865 1.00 0.00 C ATOM 2096 CD1 ILE A 669 -2.875 -4.460 -13.444 1.00 0.00 C ATOM 0 H ILE A 669 -4.946 -1.981 -10.416 1.00 0.00 H new ATOM 0 HA ILE A 669 -5.129 -4.821 -11.133 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.528 -3.640 -10.131 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -3.414 -2.673 -12.407 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -1.736 -3.140 -12.212 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -1.605 -5.712 -11.083 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -2.869 -6.046 -9.876 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -3.235 -6.193 -11.611 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -2.619 -3.920 -14.356 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -2.194 -5.302 -13.318 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -3.898 -4.828 -13.515 1.00 0.00 H new ATOM 2108 N GLU A 670 -5.848 -4.922 -8.710 1.00 0.00 N ATOM 2109 CA GLU A 670 -6.157 -5.124 -7.299 1.00 0.00 C ATOM 2110 C GLU A 670 -5.727 -6.506 -6.828 1.00 0.00 C ATOM 2111 O GLU A 670 -5.992 -7.512 -7.486 1.00 0.00 O ATOM 2112 CB GLU A 670 -7.654 -4.937 -7.050 1.00 0.00 C ATOM 2113 CG GLU A 670 -8.266 -3.797 -7.844 1.00 0.00 C ATOM 2114 CD GLU A 670 -9.079 -4.281 -9.029 1.00 0.00 C ATOM 2115 OE1 GLU A 670 -10.246 -4.680 -8.824 1.00 0.00 O ATOM 2116 OE2 GLU A 670 -8.552 -4.263 -10.160 1.00 0.00 O ATOM 0 H GLU A 670 -6.490 -5.383 -9.355 1.00 0.00 H new ATOM 0 HA GLU A 670 -5.600 -4.380 -6.730 1.00 0.00 H new ATOM 0 HB2 GLU A 670 -8.173 -5.862 -7.300 1.00 0.00 H new ATOM 0 HB3 GLU A 670 -7.817 -4.757 -5.987 1.00 0.00 H new ATOM 0 HG2 GLU A 670 -8.904 -3.204 -7.188 1.00 0.00 H new ATOM 0 HG3 GLU A 670 -7.473 -3.138 -8.197 1.00 0.00 H new ATOM 2123 N ARG A 671 -5.061 -6.540 -5.682 1.00 0.00 N ATOM 2124 CA ARG A 671 -4.586 -7.792 -5.108 1.00 0.00 C ATOM 2125 C ARG A 671 -4.457 -7.689 -3.594 1.00 0.00 C ATOM 2126 O ARG A 671 -4.406 -6.593 -3.037 1.00 0.00 O ATOM 2127 CB ARG A 671 -3.238 -8.171 -5.716 1.00 0.00 C ATOM 2128 CG ARG A 671 -3.307 -8.413 -7.209 1.00 0.00 C ATOM 2129 CD ARG A 671 -4.020 -9.718 -7.519 1.00 0.00 C ATOM 2130 NE ARG A 671 -3.101 -10.743 -8.005 1.00 0.00 N ATOM 2131 CZ ARG A 671 -3.473 -11.758 -8.776 1.00 0.00 C ATOM 2132 NH1 ARG A 671 -4.738 -11.879 -9.153 1.00 0.00 N ATOM 2133 NH2 ARG A 671 -2.579 -12.653 -9.174 1.00 0.00 N ATOM 0 H ARG A 671 -4.837 -5.712 -5.130 1.00 0.00 H new ATOM 0 HA ARG A 671 -5.318 -8.566 -5.338 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -2.519 -7.376 -5.516 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -2.865 -9.070 -5.225 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -3.829 -7.586 -7.691 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -2.299 -8.438 -7.623 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -4.523 -10.078 -6.621 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -4.792 -9.540 -8.267 1.00 0.00 H new ATOM 0 HE ARG A 671 -2.119 -10.676 -7.738 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -5.428 -11.191 -8.851 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -5.021 -12.660 -9.745 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -1.604 -12.562 -8.888 1.00 0.00 H new ATOM 0 HH22 ARG A 671 -2.866 -13.432 -9.766 1.00 0.00 H new ATOM 2147 N TRP A 672 -4.395 -8.841 -2.937 1.00 0.00 N ATOM 2148 CA TRP A 672 -4.262 -8.884 -1.487 1.00 0.00 C ATOM 2149 C TRP A 672 -2.825 -9.191 -1.089 1.00 0.00 C ATOM 2150 O TRP A 672 -2.216 -10.133 -1.598 1.00 0.00 O ATOM 2151 CB TRP A 672 -5.206 -9.928 -0.891 1.00 0.00 C ATOM 2152 CG TRP A 672 -6.640 -9.502 -0.909 1.00 0.00 C ATOM 2153 CD1 TRP A 672 -7.560 -9.765 -1.881 1.00 0.00 C ATOM 2154 CD2 TRP A 672 -7.320 -8.732 0.091 1.00 0.00 C ATOM 2155 NE1 TRP A 672 -8.770 -9.204 -1.551 1.00 0.00 N ATOM 2156 CE2 TRP A 672 -8.647 -8.564 -0.345 1.00 0.00 C ATOM 2157 CE3 TRP A 672 -6.933 -8.168 1.312 1.00 0.00 C ATOM 2158 CZ2 TRP A 672 -9.589 -7.857 0.394 1.00 0.00 C ATOM 2159 CZ3 TRP A 672 -7.871 -7.467 2.047 1.00 0.00 C ATOM 2160 CH2 TRP A 672 -9.187 -7.316 1.586 1.00 0.00 C ATOM 0 H TRP A 672 -4.435 -9.756 -3.385 1.00 0.00 H new ATOM 0 HA TRP A 672 -4.531 -7.904 -1.093 1.00 0.00 H new ATOM 0 HB2 TRP A 672 -5.103 -10.861 -1.446 1.00 0.00 H new ATOM 0 HB3 TRP A 672 -4.907 -10.134 0.137 1.00 0.00 H new ATOM 0 HD1 TRP A 672 -7.366 -10.332 -2.779 1.00 0.00 H new ATOM 0 HE1 TRP A 672 -9.621 -9.255 -2.112 1.00 0.00 H new ATOM 0 HE3 TRP A 672 -5.921 -8.278 1.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 672 -10.603 -7.739 0.040 1.00 0.00 H new ATOM 0 HZ3 TRP A 672 -7.586 -7.028 2.992 1.00 0.00 H new ATOM 0 HH2 TRP A 672 -9.897 -6.762 2.183 1.00 0.00 H new ATOM 2171 N HIS A 673 -2.287 -8.388 -0.181 1.00 0.00 N ATOM 2172 CA HIS A 673 -0.918 -8.571 0.282 1.00 0.00 C ATOM 2173 C HIS A 673 -0.886 -8.975 1.749 1.00 0.00 C ATOM 2174 O HIS A 673 -1.504 -8.330 2.595 1.00 0.00 O ATOM 2175 CB HIS A 673 -0.114 -7.284 0.085 1.00 0.00 C ATOM 2176 CG HIS A 673 -0.013 -6.854 -1.345 1.00 0.00 C ATOM 2177 ND1 HIS A 673 0.175 -7.723 -2.397 1.00 0.00 N ATOM 2178 CD2 HIS A 673 -0.080 -5.614 -1.891 1.00 0.00 C ATOM 2179 CE1 HIS A 673 0.218 -6.999 -3.525 1.00 0.00 C ATOM 2180 NE2 HIS A 673 0.067 -5.714 -3.271 1.00 0.00 N ATOM 0 H HIS A 673 -2.777 -7.604 0.249 1.00 0.00 H new ATOM 0 HA HIS A 673 -0.470 -9.370 -0.308 1.00 0.00 H new ATOM 0 HB2 HIS A 673 -0.576 -6.485 0.664 1.00 0.00 H new ATOM 0 HB3 HIS A 673 0.890 -7.428 0.484 1.00 0.00 H new ATOM 0 HD1 HIS A 673 0.265 -8.737 -2.330 1.00 0.00 H new ATOM 0 HD2 HIS A 673 -0.224 -4.695 -1.342 1.00 0.00 H new ATOM 0 HE1 HIS A 673 0.358 -7.414 -4.512 1.00 0.00 H new ATOM 2188 N GLN A 674 -0.153 -10.041 2.045 1.00 0.00 N ATOM 2189 CA GLN A 674 -0.032 -10.521 3.415 1.00 0.00 C ATOM 2190 C GLN A 674 0.865 -9.589 4.218 1.00 0.00 C ATOM 2191 O GLN A 674 2.043 -9.421 3.904 1.00 0.00 O ATOM 2192 CB GLN A 674 0.533 -11.942 3.440 1.00 0.00 C ATOM 2193 CG GLN A 674 -0.437 -12.973 3.995 1.00 0.00 C ATOM 2194 CD GLN A 674 0.251 -14.265 4.390 1.00 0.00 C ATOM 2195 OE1 GLN A 674 0.741 -14.404 5.511 1.00 0.00 O ATOM 2196 NE2 GLN A 674 0.290 -15.220 3.467 1.00 0.00 N ATOM 0 H GLN A 674 0.365 -10.588 1.357 1.00 0.00 H new ATOM 0 HA GLN A 674 -1.025 -10.535 3.865 1.00 0.00 H new ATOM 0 HB2 GLN A 674 0.816 -12.230 2.427 1.00 0.00 H new ATOM 0 HB3 GLN A 674 1.443 -11.952 4.040 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -0.947 -12.557 4.864 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -1.202 -13.186 3.248 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -0.129 -15.061 2.551 1.00 0.00 H new ATOM 0 HE22 GLN A 674 0.739 -16.112 3.675 1.00 0.00 H new ATOM 2205 N LEU A 675 0.296 -8.975 5.245 1.00 0.00 N ATOM 2206 CA LEU A 675 1.041 -8.046 6.081 1.00 0.00 C ATOM 2207 C LEU A 675 2.177 -8.742 6.817 1.00 0.00 C ATOM 2208 O LEU A 675 1.979 -9.762 7.477 1.00 0.00 O ATOM 2209 CB LEU A 675 0.112 -7.373 7.087 1.00 0.00 C ATOM 2210 CG LEU A 675 -1.028 -6.571 6.467 1.00 0.00 C ATOM 2211 CD1 LEU A 675 -1.980 -6.076 7.545 1.00 0.00 C ATOM 2212 CD2 LEU A 675 -0.476 -5.407 5.660 1.00 0.00 C ATOM 0 H LEU A 675 -0.678 -9.103 5.519 1.00 0.00 H new ATOM 0 HA LEU A 675 1.473 -7.290 5.425 1.00 0.00 H new ATOM 0 HB2 LEU A 675 -0.312 -8.138 7.737 1.00 0.00 H new ATOM 0 HB3 LEU A 675 0.703 -6.710 7.719 1.00 0.00 H new ATOM 0 HG LEU A 675 -1.586 -7.222 5.794 1.00 0.00 H new ATOM 0 HD11 LEU A 675 -2.787 -5.506 7.084 1.00 0.00 H new ATOM 0 HD12 LEU A 675 -2.398 -6.928 8.081 1.00 0.00 H new ATOM 0 HD13 LEU A 675 -1.438 -5.438 8.244 1.00 0.00 H new ATOM 0 HD21 LEU A 675 -1.301 -4.844 5.223 1.00 0.00 H new ATOM 0 HD22 LEU A 675 0.104 -4.754 6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 675 0.165 -5.787 4.865 1.00 0.00 H new ATOM 2224 N GLN A 676 3.368 -8.168 6.701 1.00 0.00 N ATOM 2225 CA GLN A 676 4.553 -8.709 7.354 1.00 0.00 C ATOM 2226 C GLN A 676 5.219 -7.644 8.221 1.00 0.00 C ATOM 2227 O GLN A 676 4.978 -6.450 8.045 1.00 0.00 O ATOM 2228 CB GLN A 676 5.544 -9.229 6.312 1.00 0.00 C ATOM 2229 CG GLN A 676 5.204 -10.614 5.787 1.00 0.00 C ATOM 2230 CD GLN A 676 6.112 -11.045 4.652 1.00 0.00 C ATOM 2231 OE1 GLN A 676 7.323 -11.184 4.829 1.00 0.00 O ATOM 2232 NE2 GLN A 676 5.531 -11.261 3.478 1.00 0.00 N ATOM 0 H GLN A 676 3.539 -7.322 6.157 1.00 0.00 H new ATOM 0 HA GLN A 676 4.245 -9.537 7.992 1.00 0.00 H new ATOM 0 HB2 GLN A 676 5.579 -8.531 5.476 1.00 0.00 H new ATOM 0 HB3 GLN A 676 6.542 -9.251 6.751 1.00 0.00 H new ATOM 0 HG2 GLN A 676 5.278 -11.335 6.601 1.00 0.00 H new ATOM 0 HG3 GLN A 676 4.169 -10.625 5.444 1.00 0.00 H new ATOM 0 HE21 GLN A 676 4.524 -11.134 3.376 1.00 0.00 H new ATOM 0 HE22 GLN A 676 6.091 -11.554 2.678 1.00 0.00 H new ATOM 2241 N ASN A 677 6.053 -8.081 9.159 1.00 0.00 N ATOM 2242 CA ASN A 677 6.746 -7.159 10.051 1.00 0.00 C ATOM 2243 C ASN A 677 8.188 -6.941 9.604 1.00 0.00 C ATOM 2244 O ASN A 677 9.075 -7.729 9.930 1.00 0.00 O ATOM 2245 CB ASN A 677 6.720 -7.687 11.487 1.00 0.00 C ATOM 2246 CG ASN A 677 5.443 -7.318 12.217 1.00 0.00 C ATOM 2247 OD1 ASN A 677 4.566 -8.157 12.420 1.00 0.00 O ATOM 2248 ND2 ASN A 677 5.334 -6.056 12.616 1.00 0.00 N ATOM 0 H ASN A 677 6.265 -9.066 9.321 1.00 0.00 H new ATOM 0 HA ASN A 677 6.226 -6.202 10.012 1.00 0.00 H new ATOM 0 HB2 ASN A 677 6.827 -8.772 11.474 1.00 0.00 H new ATOM 0 HB3 ASN A 677 7.575 -7.289 12.033 1.00 0.00 H new ATOM 0 HD21 ASN A 677 4.498 -5.749 13.113 1.00 0.00 H new ATOM 0 HD22 ASN A 677 6.087 -5.394 12.426 1.00 0.00 H new