USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=32 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= -6.71! C(o=-17!,f=-17!) USER MOD Set 1.2: A 673 HIS : no HE2:sc= -9.92! C(o=-17!,f=-16!) USER MOD Set 2.1: A 547 SER OG : rot 10:sc= -0.357! USER MOD Set 2.2: A 668 LYS NZ :NH3+ -109:sc= -0.377 (180deg=-0.629) USER MOD Single : A 543 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 549 MET CE :methyl -153:sc= -0.101 (180deg=-0.511) USER MOD Single : A 550 TYR OH : rot -19:sc= 0.827 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 552 THR OG1 : rot 180:sc= -0.0418 USER MOD Single : A 553 GLN : amide:sc= -2.19 K(o=-2.2,f=-0.11) USER MOD Single : A 554 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 564 CYS SG : rot -110:sc= -5.61! USER MOD Single : A 566 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 570 MET CE :methyl -171:sc= 0 (180deg=-0.0422) USER MOD Single : A 573 ASN : amide:sc= -1.75 K(o=-1.7,f=-2.7!) USER MOD Single : A 575 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 SER OG : rot -80:sc= -1.25! USER MOD Single : A 581 LYS NZ :NH3+ -112:sc= 2.72 (180deg=0.00228) USER MOD Single : A 585 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00382) USER MOD Single : A 593 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 594 HIS : no HE2:sc= -0.316 K(o=-0.32,f=-6.4!) USER MOD Single : A 595 LYS NZ :NH3+ -178:sc= 0.163 (180deg=0.162) USER MOD Single : A 596 THR OG1 : rot 142:sc= 0.454 USER MOD Single : A 597 GLN : amide:sc= -0.222 K(o=-0.22,f=-1.7!) USER MOD Single : A 599 LYS NZ :NH3+ -136:sc= -0.0639 (180deg=-1.83!) USER MOD Single : A 600 LYS NZ :NH3+ 149:sc= -0.23 (180deg=-0.966) 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= 0.973 K(o=0.97,f=-3.7!) USER MOD Single : A 608 ASN : amide:sc= -6.01! C(o=-6!,f=-9.8!) USER MOD Single : A 613 TYR OH : rot -119:sc= -0.0153 USER MOD Single : A 616 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 617 HIS : no HD1:sc= -5.8! C(o=-5.8!,f=-13!) USER MOD Single : A 618 SER OG : rot 180:sc= 0 USER MOD Single : A 622 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.036) USER MOD Single : A 623 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 624 SER OG : rot 180:sc= -0.155 USER MOD Single : A 628 SER OG : rot 180:sc= 0 USER MOD Single : A 632 TYR OH : rot 180:sc= 0 USER MOD Single : A 636 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= 0.185 K(o=0.19,f=-1.5!) USER MOD Single : A 640 TYR OH : rot -121:sc= 0.425 USER MOD Single : A 644 CYS SG : rot 96:sc= 1.09 USER MOD Single : A 645 GLN : amide:sc= -1.34 X(o=-1.3,f=-1) USER MOD Single : A 649 SER OG : rot -43:sc= 1.02 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 -29:sc= -2.74! USER MOD Single : A 663 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 664 ASN : amide:sc= -3.02! C(o=-3!,f=-6!) USER MOD Single : A 665 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.002) USER MOD Single : A 674 GLN : amide:sc= -0.12 X(o=-0.12,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=-0.45) USER MOD ----------------------------------------------------------------- ATOM 27 N GLY A 542 -2.487 -9.296 9.468 1.00 0.00 N ATOM 28 CA GLY A 542 -3.600 -9.171 8.547 1.00 0.00 C ATOM 29 C GLY A 542 -3.154 -8.987 7.109 1.00 0.00 C ATOM 30 O GLY A 542 -1.958 -8.982 6.815 1.00 0.00 O ATOM 0 HA2 GLY A 542 -4.226 -10.061 8.618 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -4.217 -8.323 8.843 1.00 0.00 H new ATOM 34 N LYS A 543 -4.123 -8.829 6.212 1.00 0.00 N ATOM 35 CA LYS A 543 -3.840 -8.636 4.795 1.00 0.00 C ATOM 36 C LYS A 543 -4.540 -7.380 4.287 1.00 0.00 C ATOM 37 O LYS A 543 -5.690 -7.118 4.638 1.00 0.00 O ATOM 38 CB LYS A 543 -4.298 -9.854 3.990 1.00 0.00 C ATOM 39 CG LYS A 543 -3.789 -11.175 4.543 1.00 0.00 C ATOM 40 CD LYS A 543 -3.852 -12.279 3.498 1.00 0.00 C ATOM 41 CE LYS A 543 -5.277 -12.761 3.284 1.00 0.00 C ATOM 42 NZ LYS A 543 -5.390 -14.240 3.427 1.00 0.00 N ATOM 0 H LYS A 543 -5.116 -8.831 6.444 1.00 0.00 H new ATOM 0 HA LYS A 543 -2.764 -8.518 4.668 1.00 0.00 H new ATOM 0 HB2 LYS A 543 -5.388 -9.875 3.967 1.00 0.00 H new ATOM 0 HB3 LYS A 543 -3.959 -9.746 2.960 1.00 0.00 H new ATOM 0 HG2 LYS A 543 -2.761 -11.055 4.886 1.00 0.00 H new ATOM 0 HG3 LYS A 543 -4.383 -11.460 5.411 1.00 0.00 H new ATOM 0 HD2 LYS A 543 -3.445 -11.913 2.555 1.00 0.00 H new ATOM 0 HD3 LYS A 543 -3.227 -13.115 3.812 1.00 0.00 H new ATOM 0 HE2 LYS A 543 -5.937 -12.275 4.003 1.00 0.00 H new ATOM 0 HE3 LYS A 543 -5.615 -12.465 2.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 -6.377 -14.529 3.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 -4.780 -14.704 2.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 -5.092 -14.520 4.383 1.00 0.00 H new ATOM 56 N ILE A 544 -3.842 -6.599 3.470 1.00 0.00 N ATOM 57 CA ILE A 544 -4.411 -5.369 2.936 1.00 0.00 C ATOM 58 C ILE A 544 -4.543 -5.418 1.418 1.00 0.00 C ATOM 59 O ILE A 544 -3.577 -5.685 0.705 1.00 0.00 O ATOM 60 CB ILE A 544 -3.569 -4.140 3.335 1.00 0.00 C ATOM 61 CG1 ILE A 544 -4.430 -2.875 3.300 1.00 0.00 C ATOM 62 CG2 ILE A 544 -2.360 -3.993 2.420 1.00 0.00 C ATOM 63 CD1 ILE A 544 -4.452 -2.189 1.951 1.00 0.00 C ATOM 0 H ILE A 544 -2.888 -6.794 3.165 1.00 0.00 H new ATOM 0 HA ILE A 544 -5.407 -5.276 3.370 1.00 0.00 H new ATOM 0 HB ILE A 544 -3.206 -4.285 4.352 1.00 0.00 H new ATOM 0 HG12 ILE A 544 -5.451 -3.133 3.583 1.00 0.00 H new ATOM 0 HG13 ILE A 544 -4.060 -2.174 4.048 1.00 0.00 H new ATOM 0 HG21 ILE A 544 -1.781 -3.120 2.720 1.00 0.00 H new ATOM 0 HG22 ILE A 544 -1.737 -4.884 2.494 1.00 0.00 H new ATOM 0 HG23 ILE A 544 -2.696 -3.869 1.390 1.00 0.00 H new ATOM 0 HD11 ILE A 544 -5.082 -1.301 2.004 1.00 0.00 H new ATOM 0 HD12 ILE A 544 -3.439 -1.898 1.674 1.00 0.00 H new ATOM 0 HD13 ILE A 544 -4.851 -2.873 1.202 1.00 0.00 H new ATOM 75 N LEU A 545 -5.750 -5.147 0.934 1.00 0.00 N ATOM 76 CA LEU A 545 -6.023 -5.146 -0.498 1.00 0.00 C ATOM 77 C LEU A 545 -5.547 -3.844 -1.127 1.00 0.00 C ATOM 78 O LEU A 545 -5.922 -2.757 -0.687 1.00 0.00 O ATOM 79 CB LEU A 545 -7.519 -5.324 -0.753 1.00 0.00 C ATOM 80 CG LEU A 545 -7.898 -5.631 -2.204 1.00 0.00 C ATOM 81 CD1 LEU A 545 -7.508 -7.053 -2.568 1.00 0.00 C ATOM 82 CD2 LEU A 545 -9.387 -5.418 -2.423 1.00 0.00 C ATOM 0 H LEU A 545 -6.558 -4.924 1.515 1.00 0.00 H new ATOM 0 HA LEU A 545 -5.483 -5.978 -0.951 1.00 0.00 H new ATOM 0 HB2 LEU A 545 -7.886 -6.131 -0.119 1.00 0.00 H new ATOM 0 HB3 LEU A 545 -8.035 -4.415 -0.443 1.00 0.00 H new ATOM 0 HG LEU A 545 -7.352 -4.946 -2.853 1.00 0.00 H new ATOM 0 HD11 LEU A 545 -7.785 -7.253 -3.603 1.00 0.00 H new ATOM 0 HD12 LEU A 545 -6.431 -7.176 -2.451 1.00 0.00 H new ATOM 0 HD13 LEU A 545 -8.027 -7.752 -1.912 1.00 0.00 H new ATOM 0 HD21 LEU A 545 -9.638 -5.641 -3.460 1.00 0.00 H new ATOM 0 HD22 LEU A 545 -9.950 -6.078 -1.763 1.00 0.00 H new ATOM 0 HD23 LEU A 545 -9.643 -4.382 -2.203 1.00 0.00 H new ATOM 94 N VAL A 546 -4.718 -3.957 -2.156 1.00 0.00 N ATOM 95 CA VAL A 546 -4.195 -2.784 -2.838 1.00 0.00 C ATOM 96 C VAL A 546 -4.522 -2.815 -4.325 1.00 0.00 C ATOM 97 O VAL A 546 -4.462 -3.867 -4.963 1.00 0.00 O ATOM 98 CB VAL A 546 -2.670 -2.665 -2.661 1.00 0.00 C ATOM 99 CG1 VAL A 546 -2.109 -1.584 -3.572 1.00 0.00 C ATOM 100 CG2 VAL A 546 -2.322 -2.382 -1.208 1.00 0.00 C ATOM 0 H VAL A 546 -4.395 -4.847 -2.535 1.00 0.00 H new ATOM 0 HA VAL A 546 -4.676 -1.917 -2.384 1.00 0.00 H new ATOM 0 HB VAL A 546 -2.215 -3.615 -2.941 1.00 0.00 H new ATOM 0 HG11 VAL A 546 -1.030 -1.515 -3.433 1.00 0.00 H new ATOM 0 HG12 VAL A 546 -2.326 -1.835 -4.610 1.00 0.00 H new ATOM 0 HG13 VAL A 546 -2.569 -0.627 -3.327 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -1.240 -2.301 -1.102 1.00 0.00 H new ATOM 0 HG22 VAL A 546 -2.788 -1.447 -0.898 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -2.688 -3.195 -0.581 1.00 0.00 H new ATOM 110 N SER A 547 -4.861 -1.655 -4.870 1.00 0.00 N ATOM 111 CA SER A 547 -5.190 -1.539 -6.284 1.00 0.00 C ATOM 112 C SER A 547 -4.189 -0.630 -6.985 1.00 0.00 C ATOM 113 O SER A 547 -3.717 0.348 -6.404 1.00 0.00 O ATOM 114 CB SER A 547 -6.608 -0.991 -6.460 1.00 0.00 C ATOM 115 OG SER A 547 -6.960 -0.918 -7.831 1.00 0.00 O ATOM 0 H SER A 547 -4.916 -0.778 -4.352 1.00 0.00 H new ATOM 0 HA SER A 547 -5.141 -2.531 -6.732 1.00 0.00 H new ATOM 0 HB2 SER A 547 -7.316 -1.630 -5.933 1.00 0.00 H new ATOM 0 HB3 SER A 547 -6.677 -0.000 -6.010 1.00 0.00 H new ATOM 0 HG SER A 547 -6.280 -1.375 -8.368 1.00 0.00 H new ATOM 121 N LEU A 548 -3.856 -0.957 -8.226 1.00 0.00 N ATOM 122 CA LEU A 548 -2.897 -0.158 -8.981 1.00 0.00 C ATOM 123 C LEU A 548 -3.441 0.234 -10.351 1.00 0.00 C ATOM 124 O LEU A 548 -4.380 -0.378 -10.862 1.00 0.00 O ATOM 125 CB LEU A 548 -1.582 -0.922 -9.144 1.00 0.00 C ATOM 126 CG LEU A 548 -0.872 -1.274 -7.836 1.00 0.00 C ATOM 127 CD1 LEU A 548 0.444 -1.984 -8.119 1.00 0.00 C ATOM 128 CD2 LEU A 548 -0.635 -0.023 -7.004 1.00 0.00 C ATOM 0 H LEU A 548 -4.231 -1.762 -8.729 1.00 0.00 H new ATOM 0 HA LEU A 548 -2.718 0.757 -8.417 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -1.780 -1.843 -9.692 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -0.907 -0.326 -9.757 1.00 0.00 H new ATOM 0 HG LEU A 548 -1.512 -1.948 -7.267 1.00 0.00 H new ATOM 0 HD11 LEU A 548 0.936 -2.227 -7.177 1.00 0.00 H new ATOM 0 HD12 LEU A 548 0.250 -2.901 -8.675 1.00 0.00 H new ATOM 0 HD13 LEU A 548 1.090 -1.333 -8.708 1.00 0.00 H new ATOM 0 HD21 LEU A 548 -0.129 -0.293 -6.077 1.00 0.00 H new ATOM 0 HD22 LEU A 548 -0.015 0.676 -7.566 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -1.591 0.446 -6.772 1.00 0.00 H new ATOM 140 N MET A 549 -2.833 1.261 -10.939 1.00 0.00 N ATOM 141 CA MET A 549 -3.230 1.755 -12.253 1.00 0.00 C ATOM 142 C MET A 549 -2.420 2.994 -12.614 1.00 0.00 C ATOM 143 O MET A 549 -2.618 4.064 -12.040 1.00 0.00 O ATOM 144 CB MET A 549 -4.723 2.088 -12.275 1.00 0.00 C ATOM 145 CG MET A 549 -5.362 1.922 -13.646 1.00 0.00 C ATOM 146 SD MET A 549 -5.790 3.500 -14.405 1.00 0.00 S ATOM 147 CE MET A 549 -7.050 4.084 -13.274 1.00 0.00 C ATOM 0 H MET A 549 -2.055 1.771 -10.520 1.00 0.00 H new ATOM 0 HA MET A 549 -3.035 0.973 -12.987 1.00 0.00 H new ATOM 0 HB2 MET A 549 -5.241 1.447 -11.562 1.00 0.00 H new ATOM 0 HB3 MET A 549 -4.863 3.116 -11.940 1.00 0.00 H new ATOM 0 HG2 MET A 549 -4.677 1.382 -14.300 1.00 0.00 H new ATOM 0 HG3 MET A 549 -6.260 1.312 -13.553 1.00 0.00 H new ATOM 0 HE1 MET A 549 -7.733 4.750 -13.802 1.00 0.00 H new ATOM 0 HE2 MET A 549 -7.606 3.234 -12.878 1.00 0.00 H new ATOM 0 HE3 MET A 549 -6.579 4.624 -12.452 1.00 0.00 H new ATOM 157 N TYR A 550 -1.497 2.842 -13.558 1.00 0.00 N ATOM 158 CA TYR A 550 -0.652 3.956 -13.975 1.00 0.00 C ATOM 159 C TYR A 550 -1.352 4.832 -15.007 1.00 0.00 C ATOM 160 O TYR A 550 -1.888 4.338 -15.999 1.00 0.00 O ATOM 161 CB TYR A 550 0.672 3.445 -14.542 1.00 0.00 C ATOM 162 CG TYR A 550 1.681 4.546 -14.767 1.00 0.00 C ATOM 163 CD1 TYR A 550 2.454 5.029 -13.718 1.00 0.00 C ATOM 164 CD2 TYR A 550 1.852 5.112 -16.024 1.00 0.00 C ATOM 165 CE1 TYR A 550 3.371 6.044 -13.915 1.00 0.00 C ATOM 166 CE2 TYR A 550 2.767 6.127 -16.230 1.00 0.00 C ATOM 167 CZ TYR A 550 3.523 6.590 -15.172 1.00 0.00 C ATOM 168 OH TYR A 550 4.435 7.601 -15.372 1.00 0.00 O ATOM 0 H TYR A 550 -1.315 1.965 -14.046 1.00 0.00 H new ATOM 0 HA TYR A 550 -0.453 4.562 -13.091 1.00 0.00 H new ATOM 0 HB2 TYR A 550 1.093 2.708 -13.859 1.00 0.00 H new ATOM 0 HB3 TYR A 550 0.484 2.934 -15.486 1.00 0.00 H new ATOM 0 HD1 TYR A 550 2.336 4.604 -12.732 1.00 0.00 H new ATOM 0 HD2 TYR A 550 1.261 4.753 -16.853 1.00 0.00 H new ATOM 0 HE1 TYR A 550 3.965 6.407 -13.089 1.00 0.00 H new ATOM 0 HE2 TYR A 550 2.890 6.556 -17.214 1.00 0.00 H new ATOM 0 HH TYR A 550 4.654 8.019 -14.513 1.00 0.00 H new ATOM 178 N SER A 551 -1.332 6.139 -14.767 1.00 0.00 N ATOM 179 CA SER A 551 -1.954 7.097 -15.674 1.00 0.00 C ATOM 180 C SER A 551 -0.899 7.826 -16.501 1.00 0.00 C ATOM 181 O SER A 551 -0.395 8.873 -16.095 1.00 0.00 O ATOM 182 CB SER A 551 -2.781 8.114 -14.888 1.00 0.00 C ATOM 183 OG SER A 551 -4.120 8.153 -15.354 1.00 0.00 O ATOM 0 H SER A 551 -0.890 6.560 -13.950 1.00 0.00 H new ATOM 0 HA SER A 551 -2.609 6.545 -16.348 1.00 0.00 H new ATOM 0 HB2 SER A 551 -2.769 7.857 -13.829 1.00 0.00 H new ATOM 0 HB3 SER A 551 -2.331 9.103 -14.981 1.00 0.00 H new ATOM 0 HG SER A 551 -4.628 8.810 -14.834 1.00 0.00 H new ATOM 189 N THR A 552 -0.576 7.272 -17.664 1.00 0.00 N ATOM 190 CA THR A 552 0.413 7.882 -18.545 1.00 0.00 C ATOM 191 C THR A 552 0.033 9.322 -18.850 1.00 0.00 C ATOM 192 O THR A 552 0.892 10.202 -18.924 1.00 0.00 O ATOM 193 CB THR A 552 0.535 7.091 -19.848 1.00 0.00 C ATOM 194 OG1 THR A 552 -0.373 7.581 -20.818 1.00 0.00 O ATOM 195 CG2 THR A 552 0.270 5.615 -19.673 1.00 0.00 C ATOM 0 H THR A 552 -0.982 6.406 -18.018 1.00 0.00 H new ATOM 0 HA THR A 552 1.377 7.869 -18.036 1.00 0.00 H new ATOM 0 HB THR A 552 1.567 7.223 -20.174 1.00 0.00 H new ATOM 0 HG1 THR A 552 -0.279 7.064 -21.645 1.00 0.00 H new ATOM 0 HG21 THR A 552 0.372 5.111 -20.634 1.00 0.00 H new ATOM 0 HG22 THR A 552 0.987 5.198 -18.966 1.00 0.00 H new ATOM 0 HG23 THR A 552 -0.741 5.469 -19.293 1.00 0.00 H new ATOM 203 N GLN A 553 -1.262 9.556 -19.017 1.00 0.00 N ATOM 204 CA GLN A 553 -1.763 10.893 -19.304 1.00 0.00 C ATOM 205 C GLN A 553 -1.197 11.890 -18.301 1.00 0.00 C ATOM 206 O GLN A 553 -0.726 12.964 -18.672 1.00 0.00 O ATOM 207 CB GLN A 553 -3.291 10.913 -19.251 1.00 0.00 C ATOM 208 CG GLN A 553 -3.930 11.641 -20.421 1.00 0.00 C ATOM 209 CD GLN A 553 -4.501 12.990 -20.028 1.00 0.00 C ATOM 210 OE1 GLN A 553 -5.479 13.457 -20.611 1.00 0.00 O ATOM 211 NE2 GLN A 553 -3.889 13.624 -19.035 1.00 0.00 N ATOM 0 H GLN A 553 -1.984 8.838 -18.959 1.00 0.00 H new ATOM 0 HA GLN A 553 -1.443 11.175 -20.307 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -3.659 9.887 -19.227 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -3.608 11.387 -18.322 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -3.187 11.780 -21.207 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -4.724 11.022 -20.839 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -3.081 13.199 -18.580 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -4.227 14.536 -18.727 1.00 0.00 H new ATOM 220 N GLN A 554 -1.243 11.515 -17.028 1.00 0.00 N ATOM 221 CA GLN A 554 -0.732 12.364 -15.961 1.00 0.00 C ATOM 222 C GLN A 554 0.749 12.093 -15.723 1.00 0.00 C ATOM 223 O GLN A 554 1.442 12.887 -15.087 1.00 0.00 O ATOM 224 CB GLN A 554 -1.522 12.134 -14.673 1.00 0.00 C ATOM 225 CG GLN A 554 -3.028 12.125 -14.876 1.00 0.00 C ATOM 226 CD GLN A 554 -3.739 13.150 -14.013 1.00 0.00 C ATOM 227 OE1 GLN A 554 -4.331 12.812 -12.988 1.00 0.00 O ATOM 228 NE2 GLN A 554 -3.684 14.410 -14.426 1.00 0.00 N ATOM 0 H GLN A 554 -1.630 10.626 -16.710 1.00 0.00 H new ATOM 0 HA GLN A 554 -0.850 13.404 -16.265 1.00 0.00 H new ATOM 0 HB2 GLN A 554 -1.217 11.184 -14.235 1.00 0.00 H new ATOM 0 HB3 GLN A 554 -1.265 12.913 -13.955 1.00 0.00 H new ATOM 0 HG2 GLN A 554 -3.251 12.321 -15.925 1.00 0.00 H new ATOM 0 HG3 GLN A 554 -3.416 11.132 -14.648 1.00 0.00 H new ATOM 0 HE21 GLN A 554 -3.182 14.645 -15.282 1.00 0.00 H new ATOM 0 HE22 GLN A 554 -4.144 15.144 -13.887 1.00 0.00 H new ATOM 237 N GLY A 555 1.227 10.967 -16.241 1.00 0.00 N ATOM 238 CA GLY A 555 2.624 10.611 -16.077 1.00 0.00 C ATOM 239 C GLY A 555 2.954 10.213 -14.654 1.00 0.00 C ATOM 240 O GLY A 555 3.980 10.618 -14.109 1.00 0.00 O ATOM 0 H GLY A 555 0.672 10.295 -16.771 1.00 0.00 H new ATOM 0 HA2 GLY A 555 2.867 9.787 -16.748 1.00 0.00 H new ATOM 0 HA3 GLY A 555 3.248 11.455 -16.370 1.00 0.00 H new ATOM 244 N GLY A 556 2.077 9.417 -14.052 1.00 0.00 N ATOM 245 CA GLY A 556 2.293 8.974 -12.686 1.00 0.00 C ATOM 246 C GLY A 556 1.601 7.659 -12.385 1.00 0.00 C ATOM 247 O GLY A 556 0.837 7.149 -13.204 1.00 0.00 O ATOM 0 H GLY A 556 1.221 9.071 -14.485 1.00 0.00 H new ATOM 0 HA2 GLY A 556 3.363 8.867 -12.507 1.00 0.00 H new ATOM 0 HA3 GLY A 556 1.930 9.738 -11.998 1.00 0.00 H new ATOM 251 N LEU A 557 1.870 7.109 -11.205 1.00 0.00 N ATOM 252 CA LEU A 557 1.270 5.844 -10.796 1.00 0.00 C ATOM 253 C LEU A 557 0.128 6.072 -9.814 1.00 0.00 C ATOM 254 O LEU A 557 0.257 6.846 -8.867 1.00 0.00 O ATOM 255 CB LEU A 557 2.323 4.940 -10.157 1.00 0.00 C ATOM 256 CG LEU A 557 1.768 3.722 -9.417 1.00 0.00 C ATOM 257 CD1 LEU A 557 1.533 2.572 -10.384 1.00 0.00 C ATOM 258 CD2 LEU A 557 2.713 3.299 -8.303 1.00 0.00 C ATOM 0 H LEU A 557 2.500 7.520 -10.515 1.00 0.00 H new ATOM 0 HA LEU A 557 0.870 5.360 -11.687 1.00 0.00 H new ATOM 0 HB2 LEU A 557 3.003 4.594 -10.935 1.00 0.00 H new ATOM 0 HB3 LEU A 557 2.913 5.533 -9.458 1.00 0.00 H new ATOM 0 HG LEU A 557 0.812 3.996 -8.971 1.00 0.00 H new ATOM 0 HD11 LEU A 557 1.138 1.714 -9.840 1.00 0.00 H new ATOM 0 HD12 LEU A 557 0.817 2.879 -11.147 1.00 0.00 H new ATOM 0 HD13 LEU A 557 2.475 2.298 -10.859 1.00 0.00 H new ATOM 0 HD21 LEU A 557 2.302 2.431 -7.787 1.00 0.00 H new ATOM 0 HD22 LEU A 557 3.684 3.043 -8.727 1.00 0.00 H new ATOM 0 HD23 LEU A 557 2.831 4.119 -7.595 1.00 0.00 H new ATOM 270 N ILE A 558 -0.988 5.389 -10.041 1.00 0.00 N ATOM 271 CA ILE A 558 -2.144 5.519 -9.167 1.00 0.00 C ATOM 272 C ILE A 558 -2.295 4.299 -8.268 1.00 0.00 C ATOM 273 O ILE A 558 -2.518 3.186 -8.746 1.00 0.00 O ATOM 274 CB ILE A 558 -3.445 5.712 -9.965 1.00 0.00 C ATOM 275 CG1 ILE A 558 -3.170 6.483 -11.258 1.00 0.00 C ATOM 276 CG2 ILE A 558 -4.478 6.434 -9.109 1.00 0.00 C ATOM 277 CD1 ILE A 558 -3.002 7.970 -11.053 1.00 0.00 C ATOM 0 H ILE A 558 -1.115 4.743 -10.820 1.00 0.00 H new ATOM 0 HA ILE A 558 -1.970 6.404 -8.555 1.00 0.00 H new ATOM 0 HB ILE A 558 -3.844 4.734 -10.235 1.00 0.00 H new ATOM 0 HG12 ILE A 558 -2.268 6.085 -11.723 1.00 0.00 H new ATOM 0 HG13 ILE A 558 -3.991 6.311 -11.955 1.00 0.00 H new ATOM 0 HG21 ILE A 558 -5.396 6.567 -9.681 1.00 0.00 H new ATOM 0 HG22 ILE A 558 -4.688 5.844 -8.217 1.00 0.00 H new ATOM 0 HG23 ILE A 558 -4.090 7.409 -8.815 1.00 0.00 H new ATOM 0 HD11 ILE A 558 -2.810 8.450 -12.013 1.00 0.00 H new ATOM 0 HD12 ILE A 558 -3.912 8.382 -10.617 1.00 0.00 H new ATOM 0 HD13 ILE A 558 -2.163 8.152 -10.382 1.00 0.00 H new ATOM 289 N VAL A 559 -2.182 4.519 -6.965 1.00 0.00 N ATOM 290 CA VAL A 559 -2.314 3.445 -5.994 1.00 0.00 C ATOM 291 C VAL A 559 -3.722 3.439 -5.410 1.00 0.00 C ATOM 292 O VAL A 559 -4.372 4.480 -5.345 1.00 0.00 O ATOM 293 CB VAL A 559 -1.286 3.598 -4.859 1.00 0.00 C ATOM 294 CG1 VAL A 559 -0.929 2.245 -4.265 1.00 0.00 C ATOM 295 CG2 VAL A 559 -0.041 4.312 -5.363 1.00 0.00 C ATOM 0 H VAL A 559 -1.999 5.435 -6.557 1.00 0.00 H new ATOM 0 HA VAL A 559 -2.127 2.501 -6.506 1.00 0.00 H new ATOM 0 HB VAL A 559 -1.734 4.203 -4.071 1.00 0.00 H new ATOM 0 HG11 VAL A 559 -0.201 2.380 -3.465 1.00 0.00 H new ATOM 0 HG12 VAL A 559 -1.827 1.776 -3.863 1.00 0.00 H new ATOM 0 HG13 VAL A 559 -0.503 1.608 -5.040 1.00 0.00 H new ATOM 0 HG21 VAL A 559 0.676 4.412 -4.548 1.00 0.00 H new ATOM 0 HG22 VAL A 559 0.407 3.735 -6.172 1.00 0.00 H new ATOM 0 HG23 VAL A 559 -0.313 5.301 -5.731 1.00 0.00 H new ATOM 305 N GLY A 560 -4.203 2.271 -5.005 1.00 0.00 N ATOM 306 CA GLY A 560 -5.543 2.191 -4.457 1.00 0.00 C ATOM 307 C GLY A 560 -5.644 1.323 -3.218 1.00 0.00 C ATOM 308 O GLY A 560 -5.589 0.097 -3.304 1.00 0.00 O ATOM 0 H GLY A 560 -3.696 1.387 -5.045 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -5.887 3.196 -4.215 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -6.215 1.799 -5.220 1.00 0.00 H new ATOM 312 N ILE A 561 -5.818 1.961 -2.066 1.00 0.00 N ATOM 313 CA ILE A 561 -5.957 1.239 -0.807 1.00 0.00 C ATOM 314 C ILE A 561 -7.416 0.859 -0.590 1.00 0.00 C ATOM 315 O ILE A 561 -8.219 1.680 -0.150 1.00 0.00 O ATOM 316 CB ILE A 561 -5.469 2.081 0.387 1.00 0.00 C ATOM 317 CG1 ILE A 561 -3.987 2.427 0.224 1.00 0.00 C ATOM 318 CG2 ILE A 561 -5.705 1.338 1.694 1.00 0.00 C ATOM 319 CD1 ILE A 561 -3.147 1.268 -0.263 1.00 0.00 C ATOM 0 H ILE A 561 -5.866 2.976 -1.978 1.00 0.00 H new ATOM 0 HA ILE A 561 -5.340 0.343 -0.868 1.00 0.00 H new ATOM 0 HB ILE A 561 -6.039 3.010 0.413 1.00 0.00 H new ATOM 0 HG12 ILE A 561 -3.891 3.255 -0.478 1.00 0.00 H new ATOM 0 HG13 ILE A 561 -3.595 2.772 1.181 1.00 0.00 H new ATOM 0 HG21 ILE A 561 -5.354 1.947 2.527 1.00 0.00 H new ATOM 0 HG22 ILE A 561 -6.770 1.140 1.812 1.00 0.00 H new ATOM 0 HG23 ILE A 561 -5.160 0.394 1.680 1.00 0.00 H new ATOM 0 HD11 ILE A 561 -2.108 1.585 -0.356 1.00 0.00 H new ATOM 0 HD12 ILE A 561 -3.213 0.446 0.450 1.00 0.00 H new ATOM 0 HD13 ILE A 561 -3.513 0.936 -1.235 1.00 0.00 H new ATOM 331 N ILE A 562 -7.761 -0.380 -0.927 1.00 0.00 N ATOM 332 CA ILE A 562 -9.135 -0.848 -0.796 1.00 0.00 C ATOM 333 C ILE A 562 -9.511 -1.149 0.651 1.00 0.00 C ATOM 334 O ILE A 562 -10.205 -0.361 1.291 1.00 0.00 O ATOM 335 CB ILE A 562 -9.385 -2.102 -1.655 1.00 0.00 C ATOM 336 CG1 ILE A 562 -8.906 -1.868 -3.089 1.00 0.00 C ATOM 337 CG2 ILE A 562 -10.862 -2.470 -1.638 1.00 0.00 C ATOM 338 CD1 ILE A 562 -7.725 -2.730 -3.480 1.00 0.00 C ATOM 0 H ILE A 562 -7.110 -1.075 -1.292 1.00 0.00 H new ATOM 0 HA ILE A 562 -9.765 -0.033 -1.152 1.00 0.00 H new ATOM 0 HB ILE A 562 -8.819 -2.932 -1.233 1.00 0.00 H new ATOM 0 HG12 ILE A 562 -9.730 -2.062 -3.775 1.00 0.00 H new ATOM 0 HG13 ILE A 562 -8.634 -0.819 -3.206 1.00 0.00 H new ATOM 0 HG21 ILE A 562 -11.023 -3.358 -2.249 1.00 0.00 H new ATOM 0 HG22 ILE A 562 -11.175 -2.673 -0.614 1.00 0.00 H new ATOM 0 HG23 ILE A 562 -11.448 -1.643 -2.039 1.00 0.00 H new ATOM 0 HD11 ILE A 562 -7.439 -2.511 -4.509 1.00 0.00 H new ATOM 0 HD12 ILE A 562 -6.885 -2.519 -2.818 1.00 0.00 H new ATOM 0 HD13 ILE A 562 -7.998 -3.782 -3.395 1.00 0.00 H new ATOM 350 N ARG A 563 -9.073 -2.295 1.161 1.00 0.00 N ATOM 351 CA ARG A 563 -9.399 -2.678 2.529 1.00 0.00 C ATOM 352 C ARG A 563 -8.374 -3.651 3.099 1.00 0.00 C ATOM 353 O ARG A 563 -7.526 -4.172 2.379 1.00 0.00 O ATOM 354 CB ARG A 563 -10.797 -3.307 2.573 1.00 0.00 C ATOM 355 CG ARG A 563 -10.797 -4.814 2.365 1.00 0.00 C ATOM 356 CD ARG A 563 -12.167 -5.323 1.944 1.00 0.00 C ATOM 357 NE ARG A 563 -13.250 -4.609 2.616 1.00 0.00 N ATOM 358 CZ ARG A 563 -14.447 -5.137 2.850 1.00 0.00 C ATOM 359 NH1 ARG A 563 -14.714 -6.379 2.468 1.00 0.00 N ATOM 360 NH2 ARG A 563 -15.380 -4.423 3.465 1.00 0.00 N ATOM 0 H ARG A 563 -8.498 -2.968 0.654 1.00 0.00 H new ATOM 0 HA ARG A 563 -9.381 -1.778 3.143 1.00 0.00 H new ATOM 0 HB2 ARG A 563 -11.257 -3.082 3.535 1.00 0.00 H new ATOM 0 HB3 ARG A 563 -11.418 -2.843 1.807 1.00 0.00 H new ATOM 0 HG2 ARG A 563 -10.062 -5.077 1.604 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -10.492 -5.309 3.287 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -12.277 -5.215 0.865 1.00 0.00 H new ATOM 0 HD3 ARG A 563 -12.242 -6.387 2.167 1.00 0.00 H new ATOM 0 HE ARG A 563 -13.078 -3.652 2.923 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -14.000 -6.931 1.993 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -15.634 -6.782 2.649 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -15.179 -3.467 3.759 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -16.298 -4.830 3.644 1.00 0.00 H new ATOM 374 N CYS A 564 -8.475 -3.898 4.400 1.00 0.00 N ATOM 375 CA CYS A 564 -7.574 -4.818 5.081 1.00 0.00 C ATOM 376 C CYS A 564 -8.374 -5.853 5.859 1.00 0.00 C ATOM 377 O CYS A 564 -9.543 -5.634 6.174 1.00 0.00 O ATOM 378 CB CYS A 564 -6.642 -4.059 6.024 1.00 0.00 C ATOM 379 SG CYS A 564 -7.459 -2.769 6.992 1.00 0.00 S ATOM 0 H CYS A 564 -9.176 -3.471 5.006 1.00 0.00 H new ATOM 0 HA CYS A 564 -6.968 -5.327 4.331 1.00 0.00 H new ATOM 0 HB2 CYS A 564 -6.176 -4.770 6.706 1.00 0.00 H new ATOM 0 HB3 CYS A 564 -5.841 -3.607 5.439 1.00 0.00 H new ATOM 0 HG CYS A 564 -7.070 -1.601 6.574 1.00 0.00 H new ATOM 385 N VAL A 565 -7.748 -6.984 6.162 1.00 0.00 N ATOM 386 CA VAL A 565 -8.428 -8.042 6.897 1.00 0.00 C ATOM 387 C VAL A 565 -7.502 -8.751 7.874 1.00 0.00 C ATOM 388 O VAL A 565 -6.319 -8.951 7.601 1.00 0.00 O ATOM 389 CB VAL A 565 -9.031 -9.086 5.943 1.00 0.00 C ATOM 390 CG1 VAL A 565 -10.053 -8.437 5.027 1.00 0.00 C ATOM 391 CG2 VAL A 565 -7.936 -9.769 5.136 1.00 0.00 C ATOM 0 H VAL A 565 -6.781 -7.191 5.913 1.00 0.00 H new ATOM 0 HA VAL A 565 -9.224 -7.554 7.460 1.00 0.00 H new ATOM 0 HB VAL A 565 -9.538 -9.847 6.536 1.00 0.00 H new ATOM 0 HG11 VAL A 565 -10.471 -9.189 4.358 1.00 0.00 H new ATOM 0 HG12 VAL A 565 -10.852 -8.000 5.625 1.00 0.00 H new ATOM 0 HG13 VAL A 565 -9.571 -7.656 4.439 1.00 0.00 H new ATOM 0 HG21 VAL A 565 -8.382 -10.504 4.467 1.00 0.00 H new ATOM 0 HG22 VAL A 565 -7.398 -9.024 4.550 1.00 0.00 H new ATOM 0 HG23 VAL A 565 -7.243 -10.268 5.813 1.00 0.00 H new ATOM 401 N HIS A 566 -8.064 -9.138 9.014 1.00 0.00 N ATOM 402 CA HIS A 566 -7.311 -9.844 10.048 1.00 0.00 C ATOM 403 C HIS A 566 -6.176 -8.985 10.591 1.00 0.00 C ATOM 404 O HIS A 566 -5.029 -9.426 10.658 1.00 0.00 O ATOM 405 CB HIS A 566 -6.745 -11.151 9.491 1.00 0.00 C ATOM 406 CG HIS A 566 -7.185 -12.363 10.249 1.00 0.00 C ATOM 407 ND1 HIS A 566 -7.932 -13.375 9.682 1.00 0.00 N ATOM 408 CD2 HIS A 566 -6.981 -12.725 11.538 1.00 0.00 C ATOM 409 CE1 HIS A 566 -8.168 -14.306 10.590 1.00 0.00 C ATOM 410 NE2 HIS A 566 -7.601 -13.936 11.723 1.00 0.00 N ATOM 0 H HIS A 566 -9.043 -8.974 9.247 1.00 0.00 H new ATOM 0 HA HIS A 566 -7.997 -10.064 10.866 1.00 0.00 H new ATOM 0 HB2 HIS A 566 -7.048 -11.254 8.449 1.00 0.00 H new ATOM 0 HB3 HIS A 566 -5.656 -11.100 9.503 1.00 0.00 H new ATOM 0 HD2 HIS A 566 -6.433 -12.166 12.282 1.00 0.00 H new ATOM 0 HE1 HIS A 566 -8.729 -15.215 10.432 1.00 0.00 H new ATOM 0 HE2 HIS A 566 -7.620 -14.464 12.595 1.00 0.00 H new ATOM 419 N LEU A 567 -6.499 -7.759 10.979 1.00 0.00 N ATOM 420 CA LEU A 567 -5.500 -6.844 11.514 1.00 0.00 C ATOM 421 C LEU A 567 -5.316 -7.045 13.014 1.00 0.00 C ATOM 422 O LEU A 567 -6.279 -7.287 13.742 1.00 0.00 O ATOM 423 CB LEU A 567 -5.905 -5.399 11.232 1.00 0.00 C ATOM 424 CG LEU A 567 -5.837 -4.986 9.764 1.00 0.00 C ATOM 425 CD1 LEU A 567 -5.786 -3.473 9.647 1.00 0.00 C ATOM 426 CD2 LEU A 567 -4.630 -5.620 9.089 1.00 0.00 C ATOM 0 H LEU A 567 -7.443 -7.375 10.934 1.00 0.00 H new ATOM 0 HA LEU A 567 -4.552 -7.057 11.021 1.00 0.00 H new ATOM 0 HB2 LEU A 567 -6.923 -5.246 11.590 1.00 0.00 H new ATOM 0 HB3 LEU A 567 -5.261 -4.737 11.811 1.00 0.00 H new ATOM 0 HG LEU A 567 -6.735 -5.341 9.258 1.00 0.00 H new ATOM 0 HD11 LEU A 567 -5.738 -3.191 8.595 1.00 0.00 H new ATOM 0 HD12 LEU A 567 -6.681 -3.043 10.097 1.00 0.00 H new ATOM 0 HD13 LEU A 567 -4.903 -3.098 10.164 1.00 0.00 H new ATOM 0 HD21 LEU A 567 -4.596 -5.315 8.043 1.00 0.00 H new ATOM 0 HD22 LEU A 567 -3.719 -5.294 9.591 1.00 0.00 H new ATOM 0 HD23 LEU A 567 -4.708 -6.706 9.148 1.00 0.00 H new ATOM 438 N ALA A 568 -4.072 -6.938 13.471 1.00 0.00 N ATOM 439 CA ALA A 568 -3.762 -7.105 14.885 1.00 0.00 C ATOM 440 C ALA A 568 -4.467 -6.045 15.727 1.00 0.00 C ATOM 441 O ALA A 568 -4.819 -4.975 15.231 1.00 0.00 O ATOM 442 CB ALA A 568 -2.258 -7.044 15.107 1.00 0.00 C ATOM 0 H ALA A 568 -3.264 -6.737 12.882 1.00 0.00 H new ATOM 0 HA ALA A 568 -4.124 -8.084 15.199 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -2.041 -7.170 16.168 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -1.774 -7.840 14.541 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -1.880 -6.078 14.772 1.00 0.00 H new ATOM 448 N ALA A 569 -4.672 -6.353 17.002 1.00 0.00 N ATOM 449 CA ALA A 569 -5.337 -5.433 17.918 1.00 0.00 C ATOM 450 C ALA A 569 -4.368 -4.917 18.977 1.00 0.00 C ATOM 451 O ALA A 569 -3.865 -5.686 19.797 1.00 0.00 O ATOM 452 CB ALA A 569 -6.522 -6.118 18.577 1.00 0.00 C ATOM 0 H ALA A 569 -4.386 -7.235 17.426 1.00 0.00 H new ATOM 0 HA ALA A 569 -5.695 -4.579 17.343 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -7.011 -5.422 19.259 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -7.231 -6.435 17.812 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -6.176 -6.989 19.134 1.00 0.00 H new ATOM 458 N MET A 570 -4.111 -3.613 18.955 1.00 0.00 N ATOM 459 CA MET A 570 -3.202 -3.000 19.919 1.00 0.00 C ATOM 460 C MET A 570 -3.928 -2.680 21.220 1.00 0.00 C ATOM 461 O MET A 570 -3.306 -2.553 22.274 1.00 0.00 O ATOM 462 CB MET A 570 -2.590 -1.725 19.338 1.00 0.00 C ATOM 463 CG MET A 570 -1.651 -1.975 18.170 1.00 0.00 C ATOM 464 SD MET A 570 -0.600 -3.418 18.417 1.00 0.00 S ATOM 465 CE MET A 570 -0.747 -4.212 16.819 1.00 0.00 C ATOM 0 H MET A 570 -4.517 -2.962 18.283 1.00 0.00 H new ATOM 0 HA MET A 570 -2.405 -3.712 20.132 1.00 0.00 H new ATOM 0 HB2 MET A 570 -3.393 -1.063 19.012 1.00 0.00 H new ATOM 0 HB3 MET A 570 -2.046 -1.203 20.125 1.00 0.00 H new ATOM 0 HG2 MET A 570 -2.237 -2.109 17.261 1.00 0.00 H new ATOM 0 HG3 MET A 570 -1.024 -1.096 18.019 1.00 0.00 H new ATOM 0 HE1 MET A 570 -0.286 -5.199 16.859 1.00 0.00 H new ATOM 0 HE2 MET A 570 -1.801 -4.314 16.559 1.00 0.00 H new ATOM 0 HE3 MET A 570 -0.244 -3.607 16.065 1.00 0.00 H new ATOM 475 N ASP A 571 -5.249 -2.548 21.139 1.00 0.00 N ATOM 476 CA ASP A 571 -6.058 -2.241 22.311 1.00 0.00 C ATOM 477 C ASP A 571 -6.472 -3.515 23.039 1.00 0.00 C ATOM 478 O ASP A 571 -6.494 -4.598 22.453 1.00 0.00 O ATOM 479 CB ASP A 571 -7.301 -1.447 21.903 1.00 0.00 C ATOM 480 CG ASP A 571 -7.076 0.052 21.963 1.00 0.00 C ATOM 481 OD1 ASP A 571 -6.354 0.578 21.090 1.00 0.00 O ATOM 482 OD2 ASP A 571 -7.620 0.698 22.882 1.00 0.00 O ATOM 0 H ASP A 571 -5.780 -2.649 20.274 1.00 0.00 H new ATOM 0 HA ASP A 571 -5.454 -1.638 22.989 1.00 0.00 H new ATOM 0 HB2 ASP A 571 -7.592 -1.728 20.891 1.00 0.00 H new ATOM 0 HB3 ASP A 571 -8.130 -1.714 22.558 1.00 0.00 H new ATOM 487 N ALA A 572 -6.797 -3.379 24.321 1.00 0.00 N ATOM 488 CA ALA A 572 -7.210 -4.519 25.128 1.00 0.00 C ATOM 489 C ALA A 572 -8.615 -4.981 24.754 1.00 0.00 C ATOM 490 O ALA A 572 -9.117 -5.969 25.290 1.00 0.00 O ATOM 491 CB ALA A 572 -7.143 -4.170 26.608 1.00 0.00 C ATOM 0 H ALA A 572 -6.782 -2.491 24.822 1.00 0.00 H new ATOM 0 HA ALA A 572 -6.522 -5.341 24.927 1.00 0.00 H new ATOM 0 HB1 ALA A 572 -7.454 -5.031 27.199 1.00 0.00 H new ATOM 0 HB2 ALA A 572 -6.121 -3.899 26.872 1.00 0.00 H new ATOM 0 HB3 ALA A 572 -7.806 -3.330 26.814 1.00 0.00 H new ATOM 497 N ASN A 573 -9.245 -4.263 23.830 1.00 0.00 N ATOM 498 CA ASN A 573 -10.592 -4.605 23.384 1.00 0.00 C ATOM 499 C ASN A 573 -10.545 -5.666 22.289 1.00 0.00 C ATOM 500 O ASN A 573 -11.571 -6.241 21.925 1.00 0.00 O ATOM 501 CB ASN A 573 -11.321 -3.359 22.872 1.00 0.00 C ATOM 502 CG ASN A 573 -10.651 -2.069 23.307 1.00 0.00 C ATOM 503 OD1 ASN A 573 -10.144 -1.964 24.424 1.00 0.00 O ATOM 504 ND2 ASN A 573 -10.646 -1.078 22.422 1.00 0.00 N ATOM 0 H ASN A 573 -8.846 -3.442 23.376 1.00 0.00 H new ATOM 0 HA ASN A 573 -11.138 -5.008 24.237 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -11.366 -3.391 21.783 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -12.349 -3.370 23.234 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -10.210 -0.186 22.657 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -11.078 -1.209 21.507 1.00 0.00 H new ATOM 511 N GLY A 574 -9.348 -5.922 21.770 1.00 0.00 N ATOM 512 CA GLY A 574 -9.191 -6.914 20.723 1.00 0.00 C ATOM 513 C GLY A 574 -9.210 -6.304 19.336 1.00 0.00 C ATOM 514 O GLY A 574 -9.224 -7.021 18.336 1.00 0.00 O ATOM 0 H GLY A 574 -8.485 -5.460 22.056 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -8.251 -7.446 20.869 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -9.990 -7.651 20.803 1.00 0.00 H new ATOM 518 N TYR A 575 -9.218 -4.975 19.273 1.00 0.00 N ATOM 519 CA TYR A 575 -9.244 -4.274 17.994 1.00 0.00 C ATOM 520 C TYR A 575 -8.043 -3.349 17.832 1.00 0.00 C ATOM 521 O TYR A 575 -7.092 -3.406 18.612 1.00 0.00 O ATOM 522 CB TYR A 575 -10.535 -3.478 17.863 1.00 0.00 C ATOM 523 CG TYR A 575 -11.611 -4.237 17.137 1.00 0.00 C ATOM 524 CD1 TYR A 575 -11.908 -5.541 17.489 1.00 0.00 C ATOM 525 CD2 TYR A 575 -12.322 -3.653 16.103 1.00 0.00 C ATOM 526 CE1 TYR A 575 -12.892 -6.251 16.829 1.00 0.00 C ATOM 527 CE2 TYR A 575 -13.310 -4.350 15.435 1.00 0.00 C ATOM 528 CZ TYR A 575 -13.592 -5.650 15.803 1.00 0.00 C ATOM 529 OH TYR A 575 -14.575 -6.350 15.141 1.00 0.00 O ATOM 0 H TYR A 575 -9.207 -4.364 20.090 1.00 0.00 H new ATOM 0 HA TYR A 575 -9.195 -5.023 17.204 1.00 0.00 H new ATOM 0 HB2 TYR A 575 -10.893 -3.208 18.856 1.00 0.00 H new ATOM 0 HB3 TYR A 575 -10.332 -2.547 17.333 1.00 0.00 H new ATOM 0 HD1 TYR A 575 -11.362 -6.012 18.293 1.00 0.00 H new ATOM 0 HD2 TYR A 575 -12.101 -2.636 15.814 1.00 0.00 H new ATOM 0 HE1 TYR A 575 -13.112 -7.269 17.114 1.00 0.00 H new ATOM 0 HE2 TYR A 575 -13.858 -3.881 14.631 1.00 0.00 H new ATOM 0 HH TYR A 575 -14.971 -5.782 14.447 1.00 0.00 H new ATOM 539 N SER A 576 -8.093 -2.497 16.809 1.00 0.00 N ATOM 540 CA SER A 576 -7.006 -1.561 16.543 1.00 0.00 C ATOM 541 C SER A 576 -7.483 -0.380 15.698 1.00 0.00 C ATOM 542 O SER A 576 -8.653 -0.298 15.324 1.00 0.00 O ATOM 543 CB SER A 576 -5.855 -2.273 15.828 1.00 0.00 C ATOM 544 OG SER A 576 -4.897 -2.752 16.756 1.00 0.00 O ATOM 0 H SER A 576 -8.872 -2.437 16.154 1.00 0.00 H new ATOM 0 HA SER A 576 -6.657 -1.179 17.502 1.00 0.00 H new ATOM 0 HB2 SER A 576 -6.246 -3.105 15.242 1.00 0.00 H new ATOM 0 HB3 SER A 576 -5.377 -1.587 15.129 1.00 0.00 H new ATOM 0 HG SER A 576 -4.316 -2.015 17.036 1.00 0.00 H new ATOM 550 N ASP A 577 -6.555 0.523 15.392 1.00 0.00 N ATOM 551 CA ASP A 577 -6.849 1.701 14.577 1.00 0.00 C ATOM 552 C ASP A 577 -5.869 1.759 13.413 1.00 0.00 C ATOM 553 O ASP A 577 -5.125 2.726 13.250 1.00 0.00 O ATOM 554 CB ASP A 577 -6.740 2.970 15.426 1.00 0.00 C ATOM 555 CG ASP A 577 -7.703 2.966 16.598 1.00 0.00 C ATOM 556 OD1 ASP A 577 -7.580 2.073 17.464 1.00 0.00 O ATOM 557 OD2 ASP A 577 -8.577 3.855 16.651 1.00 0.00 O ATOM 0 H ASP A 577 -5.584 0.461 15.699 1.00 0.00 H new ATOM 0 HA ASP A 577 -7.866 1.633 14.191 1.00 0.00 H new ATOM 0 HB2 ASP A 577 -5.720 3.069 15.798 1.00 0.00 H new ATOM 0 HB3 ASP A 577 -6.937 3.841 14.800 1.00 0.00 H new ATOM 562 N PRO A 578 -5.837 0.686 12.614 1.00 0.00 N ATOM 563 CA PRO A 578 -4.919 0.548 11.476 1.00 0.00 C ATOM 564 C PRO A 578 -5.158 1.511 10.318 1.00 0.00 C ATOM 565 O PRO A 578 -6.292 1.832 9.964 1.00 0.00 O ATOM 566 CB PRO A 578 -5.151 -0.891 11.005 1.00 0.00 C ATOM 567 CG PRO A 578 -6.509 -1.245 11.498 1.00 0.00 C ATOM 568 CD PRO A 578 -6.677 -0.509 12.794 1.00 0.00 C ATOM 0 HA PRO A 578 -3.903 0.781 11.794 1.00 0.00 H new ATOM 0 HB2 PRO A 578 -5.094 -0.964 9.919 1.00 0.00 H new ATOM 0 HB3 PRO A 578 -4.396 -1.565 11.410 1.00 0.00 H new ATOM 0 HG2 PRO A 578 -7.275 -0.952 10.780 1.00 0.00 H new ATOM 0 HG3 PRO A 578 -6.604 -2.321 11.644 1.00 0.00 H new ATOM 0 HD2 PRO A 578 -7.719 -0.245 12.975 1.00 0.00 H new ATOM 0 HD3 PRO A 578 -6.348 -1.108 13.643 1.00 0.00 H new ATOM 576 N PHE A 579 -4.049 1.911 9.706 1.00 0.00 N ATOM 577 CA PHE A 579 -4.041 2.783 8.540 1.00 0.00 C ATOM 578 C PHE A 579 -2.925 2.307 7.620 1.00 0.00 C ATOM 579 O PHE A 579 -2.042 1.572 8.062 1.00 0.00 O ATOM 580 CB PHE A 579 -3.841 4.253 8.924 1.00 0.00 C ATOM 581 CG PHE A 579 -2.539 4.539 9.618 1.00 0.00 C ATOM 582 CD1 PHE A 579 -2.326 4.118 10.920 1.00 0.00 C ATOM 583 CD2 PHE A 579 -1.532 5.240 8.970 1.00 0.00 C ATOM 584 CE1 PHE A 579 -1.133 4.386 11.564 1.00 0.00 C ATOM 585 CE2 PHE A 579 -0.339 5.512 9.609 1.00 0.00 C ATOM 586 CZ PHE A 579 -0.138 5.084 10.907 1.00 0.00 C ATOM 0 H PHE A 579 -3.116 1.633 10.012 1.00 0.00 H new ATOM 0 HA PHE A 579 -5.006 2.729 8.037 1.00 0.00 H new ATOM 0 HB2 PHE A 579 -3.901 4.863 8.023 1.00 0.00 H new ATOM 0 HB3 PHE A 579 -4.661 4.562 9.573 1.00 0.00 H new ATOM 0 HD1 PHE A 579 -3.102 3.574 11.438 1.00 0.00 H new ATOM 0 HD2 PHE A 579 -1.683 5.576 7.955 1.00 0.00 H new ATOM 0 HE1 PHE A 579 -0.979 4.050 12.579 1.00 0.00 H new ATOM 0 HE2 PHE A 579 0.437 6.059 9.094 1.00 0.00 H new ATOM 0 HZ PHE A 579 0.796 5.295 11.407 1.00 0.00 H new ATOM 596 N VAL A 580 -2.958 2.681 6.350 1.00 0.00 N ATOM 597 CA VAL A 580 -1.926 2.219 5.429 1.00 0.00 C ATOM 598 C VAL A 580 -1.035 3.343 4.921 1.00 0.00 C ATOM 599 O VAL A 580 -1.508 4.422 4.567 1.00 0.00 O ATOM 600 CB VAL A 580 -2.530 1.482 4.219 1.00 0.00 C ATOM 601 CG1 VAL A 580 -1.433 0.807 3.412 1.00 0.00 C ATOM 602 CG2 VAL A 580 -3.564 0.465 4.673 1.00 0.00 C ATOM 0 H VAL A 580 -3.668 3.287 5.939 1.00 0.00 H new ATOM 0 HA VAL A 580 -1.313 1.531 6.011 1.00 0.00 H new ATOM 0 HB VAL A 580 -3.029 2.212 3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 580 -1.874 0.290 2.560 1.00 0.00 H new ATOM 0 HG12 VAL A 580 -0.729 1.559 3.056 1.00 0.00 H new ATOM 0 HG13 VAL A 580 -0.909 0.088 4.041 1.00 0.00 H new ATOM 0 HG21 VAL A 580 -3.979 -0.045 3.804 1.00 0.00 H new ATOM 0 HG22 VAL A 580 -3.092 -0.265 5.331 1.00 0.00 H new ATOM 0 HG23 VAL A 580 -4.364 0.974 5.211 1.00 0.00 H new ATOM 612 N LYS A 581 0.261 3.055 4.869 1.00 0.00 N ATOM 613 CA LYS A 581 1.254 4.004 4.384 1.00 0.00 C ATOM 614 C LYS A 581 1.911 3.458 3.124 1.00 0.00 C ATOM 615 O LYS A 581 2.296 2.289 3.073 1.00 0.00 O ATOM 616 CB LYS A 581 2.314 4.264 5.455 1.00 0.00 C ATOM 617 CG LYS A 581 1.763 4.266 6.869 1.00 0.00 C ATOM 618 CD LYS A 581 2.450 5.312 7.729 1.00 0.00 C ATOM 619 CE LYS A 581 2.458 4.916 9.197 1.00 0.00 C ATOM 620 NZ LYS A 581 3.795 4.429 9.633 1.00 0.00 N ATOM 0 H LYS A 581 0.651 2.159 5.161 1.00 0.00 H new ATOM 0 HA LYS A 581 0.757 4.946 4.153 1.00 0.00 H new ATOM 0 HB2 LYS A 581 3.090 3.503 5.378 1.00 0.00 H new ATOM 0 HB3 LYS A 581 2.789 5.225 5.258 1.00 0.00 H new ATOM 0 HG2 LYS A 581 0.691 4.461 6.843 1.00 0.00 H new ATOM 0 HG3 LYS A 581 1.897 3.281 7.315 1.00 0.00 H new ATOM 0 HD2 LYS A 581 3.475 5.451 7.384 1.00 0.00 H new ATOM 0 HD3 LYS A 581 1.942 6.269 7.613 1.00 0.00 H new ATOM 0 HE2 LYS A 581 2.167 5.772 9.806 1.00 0.00 H new ATOM 0 HE3 LYS A 581 1.715 4.137 9.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 3.742 3.412 9.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 4.487 4.588 8.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 4.092 4.946 10.485 1.00 0.00 H new ATOM 634 N LEU A 582 2.022 4.295 2.104 1.00 0.00 N ATOM 635 CA LEU A 582 2.614 3.871 0.845 1.00 0.00 C ATOM 636 C LEU A 582 3.845 4.697 0.501 1.00 0.00 C ATOM 637 O LEU A 582 3.847 5.920 0.639 1.00 0.00 O ATOM 638 CB LEU A 582 1.582 3.978 -0.272 1.00 0.00 C ATOM 639 CG LEU A 582 0.131 3.923 0.201 1.00 0.00 C ATOM 640 CD1 LEU A 582 -0.530 5.284 0.063 1.00 0.00 C ATOM 641 CD2 LEU A 582 -0.638 2.867 -0.572 1.00 0.00 C ATOM 0 H LEU A 582 1.712 5.267 2.123 1.00 0.00 H new ATOM 0 HA LEU A 582 2.930 2.833 0.952 1.00 0.00 H new ATOM 0 HB2 LEU A 582 1.741 4.913 -0.808 1.00 0.00 H new ATOM 0 HB3 LEU A 582 1.750 3.170 -0.984 1.00 0.00 H new ATOM 0 HG LEU A 582 0.121 3.649 1.256 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -1.563 5.223 0.405 1.00 0.00 H new ATOM 0 HD12 LEU A 582 0.010 6.014 0.667 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -0.512 5.593 -0.982 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -1.670 2.840 -0.223 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -0.620 3.109 -1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -0.176 1.892 -0.414 1.00 0.00 H new ATOM 653 N TRP A 583 4.890 4.016 0.048 1.00 0.00 N ATOM 654 CA TRP A 583 6.129 4.680 -0.323 1.00 0.00 C ATOM 655 C TRP A 583 6.790 3.975 -1.501 1.00 0.00 C ATOM 656 O TRP A 583 7.220 2.826 -1.393 1.00 0.00 O ATOM 657 CB TRP A 583 7.086 4.726 0.870 1.00 0.00 C ATOM 658 CG TRP A 583 8.514 4.965 0.487 1.00 0.00 C ATOM 659 CD1 TRP A 583 8.978 5.484 -0.688 1.00 0.00 C ATOM 660 CD2 TRP A 583 9.666 4.697 1.289 1.00 0.00 C ATOM 661 NE1 TRP A 583 10.347 5.537 -0.671 1.00 0.00 N ATOM 662 CE2 TRP A 583 10.795 5.067 0.535 1.00 0.00 C ATOM 663 CE3 TRP A 583 9.849 4.179 2.571 1.00 0.00 C ATOM 664 CZ2 TRP A 583 12.091 4.933 1.025 1.00 0.00 C ATOM 665 CZ3 TRP A 583 11.135 4.049 3.059 1.00 0.00 C ATOM 666 CH2 TRP A 583 12.241 4.425 2.287 1.00 0.00 C ATOM 0 H TRP A 583 4.902 3.003 -0.071 1.00 0.00 H new ATOM 0 HA TRP A 583 5.891 5.701 -0.623 1.00 0.00 H new ATOM 0 HB2 TRP A 583 6.765 5.514 1.552 1.00 0.00 H new ATOM 0 HB3 TRP A 583 7.018 3.785 1.416 1.00 0.00 H new ATOM 0 HD1 TRP A 583 8.356 5.806 -1.511 1.00 0.00 H new ATOM 0 HE1 TRP A 583 10.937 5.872 -1.433 1.00 0.00 H new ATOM 0 HE3 TRP A 583 9.001 3.885 3.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 583 12.947 5.219 0.431 1.00 0.00 H new ATOM 0 HZ3 TRP A 583 11.290 3.651 4.051 1.00 0.00 H new ATOM 0 HH2 TRP A 583 13.234 4.312 2.696 1.00 0.00 H new ATOM 677 N LEU A 584 6.874 4.677 -2.625 1.00 0.00 N ATOM 678 CA LEU A 584 7.489 4.132 -3.827 1.00 0.00 C ATOM 679 C LEU A 584 8.968 4.496 -3.887 1.00 0.00 C ATOM 680 O LEU A 584 9.323 5.667 -4.020 1.00 0.00 O ATOM 681 CB LEU A 584 6.770 4.657 -5.071 1.00 0.00 C ATOM 682 CG LEU A 584 7.380 4.227 -6.403 1.00 0.00 C ATOM 683 CD1 LEU A 584 6.926 2.822 -6.766 1.00 0.00 C ATOM 684 CD2 LEU A 584 7.006 5.212 -7.501 1.00 0.00 C ATOM 0 H LEU A 584 6.522 5.629 -2.728 1.00 0.00 H new ATOM 0 HA LEU A 584 7.401 3.046 -3.796 1.00 0.00 H new ATOM 0 HB2 LEU A 584 5.733 4.323 -5.040 1.00 0.00 H new ATOM 0 HB3 LEU A 584 6.756 5.746 -5.031 1.00 0.00 H new ATOM 0 HG LEU A 584 8.465 4.221 -6.302 1.00 0.00 H new ATOM 0 HD11 LEU A 584 7.370 2.531 -7.718 1.00 0.00 H new ATOM 0 HD12 LEU A 584 7.243 2.125 -5.990 1.00 0.00 H new ATOM 0 HD13 LEU A 584 5.839 2.801 -6.851 1.00 0.00 H new ATOM 0 HD21 LEU A 584 7.449 4.891 -8.444 1.00 0.00 H new ATOM 0 HD22 LEU A 584 5.921 5.248 -7.603 1.00 0.00 H new ATOM 0 HD23 LEU A 584 7.380 6.203 -7.243 1.00 0.00 H new ATOM 696 N LYS A 585 9.829 3.487 -3.785 1.00 0.00 N ATOM 697 CA LYS A 585 11.267 3.715 -3.825 1.00 0.00 C ATOM 698 C LYS A 585 11.902 3.039 -5.034 1.00 0.00 C ATOM 699 O LYS A 585 11.318 2.127 -5.615 1.00 0.00 O ATOM 700 CB LYS A 585 11.920 3.214 -2.536 1.00 0.00 C ATOM 701 CG LYS A 585 12.256 1.733 -2.560 1.00 0.00 C ATOM 702 CD LYS A 585 12.949 1.299 -1.279 1.00 0.00 C ATOM 703 CE LYS A 585 12.050 0.411 -0.433 1.00 0.00 C ATOM 704 NZ LYS A 585 10.856 1.145 0.069 1.00 0.00 N ATOM 0 H LYS A 585 9.557 2.510 -3.675 1.00 0.00 H new ATOM 0 HA LYS A 585 11.433 4.789 -3.914 1.00 0.00 H new ATOM 0 HB2 LYS A 585 12.833 3.782 -2.356 1.00 0.00 H new ATOM 0 HB3 LYS A 585 11.251 3.413 -1.699 1.00 0.00 H new ATOM 0 HG2 LYS A 585 11.343 1.154 -2.695 1.00 0.00 H new ATOM 0 HG3 LYS A 585 12.899 1.518 -3.414 1.00 0.00 H new ATOM 0 HD2 LYS A 585 13.866 0.763 -1.524 1.00 0.00 H new ATOM 0 HD3 LYS A 585 13.238 2.179 -0.704 1.00 0.00 H new ATOM 0 HE2 LYS A 585 11.727 -0.446 -1.024 1.00 0.00 H new ATOM 0 HE3 LYS A 585 12.617 0.020 0.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 585 10.287 0.514 0.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 585 11.163 1.968 0.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 585 10.282 1.467 -0.737 1.00 0.00 H new ATOM 812 N ALA A 592 7.864 10.534 -0.633 1.00 0.00 N ATOM 813 CA ALA A 592 7.288 9.379 -1.315 1.00 0.00 C ATOM 814 C ALA A 592 6.398 8.573 -0.375 1.00 0.00 C ATOM 815 O ALA A 592 5.557 7.792 -0.821 1.00 0.00 O ATOM 816 CB ALA A 592 8.388 8.499 -1.894 1.00 0.00 C ATOM 0 HA ALA A 592 6.668 9.745 -2.133 1.00 0.00 H new ATOM 0 HB1 ALA A 592 7.941 7.643 -2.399 1.00 0.00 H new ATOM 0 HB2 ALA A 592 8.976 9.075 -2.608 1.00 0.00 H new ATOM 0 HB3 ALA A 592 9.035 8.149 -1.090 1.00 0.00 H new ATOM 822 N LYS A 593 6.587 8.766 0.927 1.00 0.00 N ATOM 823 CA LYS A 593 5.799 8.058 1.927 1.00 0.00 C ATOM 824 C LYS A 593 4.412 8.679 2.068 1.00 0.00 C ATOM 825 O LYS A 593 4.266 9.901 2.065 1.00 0.00 O ATOM 826 CB LYS A 593 6.519 8.074 3.275 1.00 0.00 C ATOM 827 CG LYS A 593 7.889 7.415 3.242 1.00 0.00 C ATOM 828 CD LYS A 593 8.891 8.240 2.450 1.00 0.00 C ATOM 829 CE LYS A 593 10.315 7.758 2.678 1.00 0.00 C ATOM 830 NZ LYS A 593 11.053 8.633 3.631 1.00 0.00 N ATOM 0 H LYS A 593 7.280 9.407 1.313 1.00 0.00 H new ATOM 0 HA LYS A 593 5.681 7.026 1.598 1.00 0.00 H new ATOM 0 HB2 LYS A 593 6.630 9.107 3.606 1.00 0.00 H new ATOM 0 HB3 LYS A 593 5.899 7.567 4.014 1.00 0.00 H new ATOM 0 HG2 LYS A 593 8.253 7.280 4.261 1.00 0.00 H new ATOM 0 HG3 LYS A 593 7.805 6.422 2.800 1.00 0.00 H new ATOM 0 HD2 LYS A 593 8.652 8.183 1.388 1.00 0.00 H new ATOM 0 HD3 LYS A 593 8.810 9.288 2.739 1.00 0.00 H new ATOM 0 HE2 LYS A 593 10.296 6.738 3.062 1.00 0.00 H new ATOM 0 HE3 LYS A 593 10.845 7.730 1.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 593 12.019 8.270 3.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 593 11.094 9.601 3.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 593 10.562 8.640 4.548 1.00 0.00 H new ATOM 844 N HIS A 594 3.396 7.829 2.192 1.00 0.00 N ATOM 845 CA HIS A 594 2.019 8.297 2.334 1.00 0.00 C ATOM 846 C HIS A 594 1.308 7.578 3.476 1.00 0.00 C ATOM 847 O HIS A 594 1.877 6.701 4.121 1.00 0.00 O ATOM 848 CB HIS A 594 1.236 8.075 1.037 1.00 0.00 C ATOM 849 CG HIS A 594 1.866 8.690 -0.172 1.00 0.00 C ATOM 850 ND1 HIS A 594 2.809 9.695 -0.106 1.00 0.00 N ATOM 851 CD2 HIS A 594 1.681 8.437 -1.489 1.00 0.00 C ATOM 852 CE1 HIS A 594 3.174 10.033 -1.330 1.00 0.00 C ATOM 853 NE2 HIS A 594 2.504 9.284 -2.186 1.00 0.00 N ATOM 0 H HIS A 594 3.499 6.814 2.197 1.00 0.00 H new ATOM 0 HA HIS A 594 2.059 9.363 2.557 1.00 0.00 H new ATOM 0 HB2 HIS A 594 1.127 7.003 0.871 1.00 0.00 H new ATOM 0 HB3 HIS A 594 0.232 8.483 1.157 1.00 0.00 H new ATOM 0 HD1 HIS A 594 3.168 10.112 0.753 1.00 0.00 H new ATOM 0 HD2 HIS A 594 1.010 7.704 -1.912 1.00 0.00 H new ATOM 0 HE1 HIS A 594 3.897 10.793 -1.587 1.00 0.00 H new ATOM 862 N LYS A 595 0.053 7.952 3.708 1.00 0.00 N ATOM 863 CA LYS A 595 -0.752 7.339 4.760 1.00 0.00 C ATOM 864 C LYS A 595 -2.239 7.586 4.505 1.00 0.00 C ATOM 865 O LYS A 595 -2.656 8.722 4.280 1.00 0.00 O ATOM 866 CB LYS A 595 -0.333 7.873 6.137 1.00 0.00 C ATOM 867 CG LYS A 595 -1.227 8.978 6.684 1.00 0.00 C ATOM 868 CD LYS A 595 -0.976 10.299 5.976 1.00 0.00 C ATOM 869 CE LYS A 595 -2.230 11.158 5.941 1.00 0.00 C ATOM 870 NZ LYS A 595 -2.513 11.672 4.573 1.00 0.00 N ATOM 0 H LYS A 595 -0.430 8.679 3.180 1.00 0.00 H new ATOM 0 HA LYS A 595 -0.580 6.263 4.749 1.00 0.00 H new ATOM 0 HB2 LYS A 595 -0.324 7.045 6.846 1.00 0.00 H new ATOM 0 HB3 LYS A 595 0.688 8.248 6.072 1.00 0.00 H new ATOM 0 HG2 LYS A 595 -2.273 8.694 6.566 1.00 0.00 H new ATOM 0 HG3 LYS A 595 -1.048 9.097 7.753 1.00 0.00 H new ATOM 0 HD2 LYS A 595 -0.177 10.839 6.484 1.00 0.00 H new ATOM 0 HD3 LYS A 595 -0.635 10.109 4.958 1.00 0.00 H new ATOM 0 HE2 LYS A 595 -3.080 10.573 6.292 1.00 0.00 H new ATOM 0 HE3 LYS A 595 -2.115 11.997 6.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 -3.356 12.280 4.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 -1.699 12.223 4.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 -2.682 10.872 3.930 1.00 0.00 H new ATOM 884 N THR A 596 -3.034 6.519 4.535 1.00 0.00 N ATOM 885 CA THR A 596 -4.470 6.634 4.299 1.00 0.00 C ATOM 886 C THR A 596 -5.218 6.926 5.593 1.00 0.00 C ATOM 887 O THR A 596 -4.657 6.831 6.685 1.00 0.00 O ATOM 888 CB THR A 596 -5.012 5.351 3.670 1.00 0.00 C ATOM 889 OG1 THR A 596 -5.360 4.409 4.671 1.00 0.00 O ATOM 890 CG2 THR A 596 -4.031 4.681 2.735 1.00 0.00 C ATOM 0 H THR A 596 -2.710 5.570 4.719 1.00 0.00 H new ATOM 0 HA THR A 596 -4.628 7.466 3.612 1.00 0.00 H new ATOM 0 HB THR A 596 -5.885 5.660 3.095 1.00 0.00 H new ATOM 0 HG1 THR A 596 -6.178 3.939 4.407 1.00 0.00 H new ATOM 0 HG21 THR A 596 -4.480 3.777 2.324 1.00 0.00 H new ATOM 0 HG22 THR A 596 -3.779 5.363 1.923 1.00 0.00 H new ATOM 0 HG23 THR A 596 -3.126 4.420 3.283 1.00 0.00 H new ATOM 898 N GLN A 597 -6.494 7.277 5.461 1.00 0.00 N ATOM 899 CA GLN A 597 -7.326 7.578 6.619 1.00 0.00 C ATOM 900 C GLN A 597 -7.115 6.537 7.713 1.00 0.00 C ATOM 901 O GLN A 597 -6.688 5.415 7.440 1.00 0.00 O ATOM 902 CB GLN A 597 -8.800 7.626 6.217 1.00 0.00 C ATOM 903 CG GLN A 597 -9.187 8.893 5.471 1.00 0.00 C ATOM 904 CD GLN A 597 -10.129 9.773 6.266 1.00 0.00 C ATOM 905 OE1 GLN A 597 -10.232 9.649 7.486 1.00 0.00 O ATOM 906 NE2 GLN A 597 -10.825 10.672 5.578 1.00 0.00 N ATOM 0 H GLN A 597 -6.973 7.360 4.564 1.00 0.00 H new ATOM 0 HA GLN A 597 -7.036 8.555 7.006 1.00 0.00 H new ATOM 0 HB2 GLN A 597 -9.025 6.763 5.591 1.00 0.00 H new ATOM 0 HB3 GLN A 597 -9.415 7.540 7.113 1.00 0.00 H new ATOM 0 HG2 GLN A 597 -8.286 9.457 5.229 1.00 0.00 H new ATOM 0 HG3 GLN A 597 -9.658 8.624 4.526 1.00 0.00 H new ATOM 0 HE21 GLN A 597 -10.709 10.742 4.567 1.00 0.00 H new ATOM 0 HE22 GLN A 597 -11.475 11.292 6.061 1.00 0.00 H new ATOM 915 N ILE A 598 -7.414 6.914 8.949 1.00 0.00 N ATOM 916 CA ILE A 598 -7.252 6.011 10.081 1.00 0.00 C ATOM 917 C ILE A 598 -8.516 5.199 10.332 1.00 0.00 C ATOM 918 O ILE A 598 -9.597 5.755 10.520 1.00 0.00 O ATOM 919 CB ILE A 598 -6.902 6.780 11.368 1.00 0.00 C ATOM 920 CG1 ILE A 598 -5.984 7.965 11.056 1.00 0.00 C ATOM 921 CG2 ILE A 598 -6.258 5.846 12.381 1.00 0.00 C ATOM 922 CD1 ILE A 598 -4.516 7.602 10.957 1.00 0.00 C ATOM 0 H ILE A 598 -7.770 7.838 9.193 1.00 0.00 H new ATOM 0 HA ILE A 598 -6.433 5.339 9.824 1.00 0.00 H new ATOM 0 HB ILE A 598 -7.822 7.173 11.800 1.00 0.00 H new ATOM 0 HG12 ILE A 598 -6.299 8.417 10.116 1.00 0.00 H new ATOM 0 HG13 ILE A 598 -6.109 8.721 11.831 1.00 0.00 H new ATOM 0 HG21 ILE A 598 -6.016 6.403 13.286 1.00 0.00 H new ATOM 0 HG22 ILE A 598 -6.951 5.040 12.625 1.00 0.00 H new ATOM 0 HG23 ILE A 598 -5.346 5.425 11.959 1.00 0.00 H new ATOM 0 HD11 ILE A 598 -3.934 8.496 10.734 1.00 0.00 H new ATOM 0 HD12 ILE A 598 -4.181 7.178 11.904 1.00 0.00 H new ATOM 0 HD13 ILE A 598 -4.375 6.870 10.162 1.00 0.00 H new ATOM 934 N LYS A 599 -8.369 3.879 10.353 1.00 0.00 N ATOM 935 CA LYS A 599 -9.494 2.990 10.603 1.00 0.00 C ATOM 936 C LYS A 599 -9.558 2.645 12.086 1.00 0.00 C ATOM 937 O LYS A 599 -9.226 1.533 12.496 1.00 0.00 O ATOM 938 CB LYS A 599 -9.367 1.717 9.765 1.00 0.00 C ATOM 939 CG LYS A 599 -9.920 1.857 8.356 1.00 0.00 C ATOM 940 CD LYS A 599 -9.534 3.185 7.727 1.00 0.00 C ATOM 941 CE LYS A 599 -10.639 4.217 7.884 1.00 0.00 C ATOM 942 NZ LYS A 599 -10.803 5.046 6.659 1.00 0.00 N ATOM 0 H LYS A 599 -7.481 3.402 10.200 1.00 0.00 H new ATOM 0 HA LYS A 599 -10.415 3.497 10.316 1.00 0.00 H new ATOM 0 HB2 LYS A 599 -8.316 1.434 9.707 1.00 0.00 H new ATOM 0 HB3 LYS A 599 -9.889 0.905 10.272 1.00 0.00 H new ATOM 0 HG2 LYS A 599 -9.549 1.040 7.737 1.00 0.00 H new ATOM 0 HG3 LYS A 599 -11.006 1.769 8.382 1.00 0.00 H new ATOM 0 HD2 LYS A 599 -8.620 3.556 8.190 1.00 0.00 H new ATOM 0 HD3 LYS A 599 -9.319 3.039 6.669 1.00 0.00 H new ATOM 0 HE2 LYS A 599 -11.578 3.712 8.109 1.00 0.00 H new ATOM 0 HE3 LYS A 599 -10.414 4.863 8.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 -10.910 6.045 6.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 -9.965 4.938 6.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 -11.649 4.735 6.140 1.00 0.00 H new ATOM 956 N LYS A 600 -9.964 3.623 12.887 1.00 0.00 N ATOM 957 CA LYS A 600 -10.052 3.455 14.333 1.00 0.00 C ATOM 958 C LYS A 600 -10.977 2.304 14.720 1.00 0.00 C ATOM 959 O LYS A 600 -11.954 2.011 14.030 1.00 0.00 O ATOM 960 CB LYS A 600 -10.536 4.753 14.983 1.00 0.00 C ATOM 961 CG LYS A 600 -9.783 5.988 14.513 1.00 0.00 C ATOM 962 CD LYS A 600 -8.646 6.343 15.458 1.00 0.00 C ATOM 963 CE LYS A 600 -8.485 7.848 15.596 1.00 0.00 C ATOM 964 NZ LYS A 600 -9.718 8.492 16.125 1.00 0.00 N ATOM 0 H LYS A 600 -10.240 4.548 12.556 1.00 0.00 H new ATOM 0 HA LYS A 600 -9.053 3.212 14.696 1.00 0.00 H new ATOM 0 HB2 LYS A 600 -11.597 4.882 14.770 1.00 0.00 H new ATOM 0 HB3 LYS A 600 -10.436 4.667 16.065 1.00 0.00 H new ATOM 0 HG2 LYS A 600 -9.385 5.814 13.513 1.00 0.00 H new ATOM 0 HG3 LYS A 600 -10.472 6.829 14.440 1.00 0.00 H new ATOM 0 HD2 LYS A 600 -8.836 5.905 16.438 1.00 0.00 H new ATOM 0 HD3 LYS A 600 -7.716 5.909 15.090 1.00 0.00 H new ATOM 0 HE2 LYS A 600 -7.649 8.064 16.261 1.00 0.00 H new ATOM 0 HE3 LYS A 600 -8.239 8.277 14.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 600 -9.460 9.331 16.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 600 -10.328 8.777 15.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 600 -10.229 7.818 16.731 1.00 0.00 H new ATOM 978 N LYS A 601 -10.659 1.668 15.844 1.00 0.00 N ATOM 979 CA LYS A 601 -11.446 0.554 16.367 1.00 0.00 C ATOM 980 C LYS A 601 -11.956 -0.362 15.259 1.00 0.00 C ATOM 981 O LYS A 601 -13.156 -0.416 14.990 1.00 0.00 O ATOM 982 CB LYS A 601 -12.625 1.082 17.184 1.00 0.00 C ATOM 983 CG LYS A 601 -12.365 2.436 17.824 1.00 0.00 C ATOM 984 CD LYS A 601 -11.185 2.381 18.781 1.00 0.00 C ATOM 985 CE LYS A 601 -11.484 3.113 20.078 1.00 0.00 C ATOM 986 NZ LYS A 601 -10.974 4.512 20.058 1.00 0.00 N ATOM 0 H LYS A 601 -9.851 1.909 16.417 1.00 0.00 H new ATOM 0 HA LYS A 601 -10.788 -0.035 17.005 1.00 0.00 H new ATOM 0 HB2 LYS A 601 -13.499 1.157 16.538 1.00 0.00 H new ATOM 0 HB3 LYS A 601 -12.867 0.361 17.965 1.00 0.00 H new ATOM 0 HG2 LYS A 601 -12.171 3.176 17.047 1.00 0.00 H new ATOM 0 HG3 LYS A 601 -13.255 2.763 18.361 1.00 0.00 H new ATOM 0 HD2 LYS A 601 -10.939 1.341 18.997 1.00 0.00 H new ATOM 0 HD3 LYS A 601 -10.309 2.823 18.306 1.00 0.00 H new ATOM 0 HE2 LYS A 601 -12.560 3.122 20.250 1.00 0.00 H new ATOM 0 HE3 LYS A 601 -11.033 2.574 20.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 601 -11.198 4.976 20.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 601 -9.943 4.504 19.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 601 -11.424 5.034 19.279 1.00 0.00 H new ATOM 1000 N THR A 602 -11.042 -1.091 14.627 1.00 0.00 N ATOM 1001 CA THR A 602 -11.408 -2.013 13.561 1.00 0.00 C ATOM 1002 C THR A 602 -10.172 -2.704 12.993 1.00 0.00 C ATOM 1003 O THR A 602 -9.111 -2.094 12.862 1.00 0.00 O ATOM 1004 CB THR A 602 -12.138 -1.266 12.452 1.00 0.00 C ATOM 1005 OG1 THR A 602 -12.909 -2.157 11.665 1.00 0.00 O ATOM 1006 CG2 THR A 602 -11.194 -0.538 11.536 1.00 0.00 C ATOM 0 H THR A 602 -10.044 -1.060 14.835 1.00 0.00 H new ATOM 0 HA THR A 602 -12.068 -2.773 13.978 1.00 0.00 H new ATOM 0 HB THR A 602 -12.781 -0.541 12.951 1.00 0.00 H new ATOM 0 HG1 THR A 602 -13.370 -1.656 10.960 1.00 0.00 H new ATOM 0 HG21 THR A 602 -11.763 -0.022 10.763 1.00 0.00 H new ATOM 0 HG22 THR A 602 -10.618 0.189 12.109 1.00 0.00 H new ATOM 0 HG23 THR A 602 -10.515 -1.253 11.071 1.00 0.00 H new ATOM 1014 N LEU A 603 -10.319 -3.980 12.658 1.00 0.00 N ATOM 1015 CA LEU A 603 -9.216 -4.760 12.103 1.00 0.00 C ATOM 1016 C LEU A 603 -9.536 -5.225 10.686 1.00 0.00 C ATOM 1017 O LEU A 603 -8.663 -5.711 9.967 1.00 0.00 O ATOM 1018 CB LEU A 603 -8.935 -5.973 12.988 1.00 0.00 C ATOM 1019 CG LEU A 603 -8.909 -5.688 14.490 1.00 0.00 C ATOM 1020 CD1 LEU A 603 -8.323 -6.868 15.249 1.00 0.00 C ATOM 1021 CD2 LEU A 603 -8.119 -4.421 14.778 1.00 0.00 C ATOM 0 H LEU A 603 -11.191 -4.498 12.761 1.00 0.00 H new ATOM 0 HA LEU A 603 -8.333 -4.122 12.069 1.00 0.00 H new ATOM 0 HB2 LEU A 603 -9.693 -6.731 12.791 1.00 0.00 H new ATOM 0 HB3 LEU A 603 -7.975 -6.400 12.698 1.00 0.00 H new ATOM 0 HG LEU A 603 -9.934 -5.539 14.829 1.00 0.00 H new ATOM 0 HD11 LEU A 603 -8.313 -6.646 16.316 1.00 0.00 H new ATOM 0 HD12 LEU A 603 -8.931 -7.755 15.069 1.00 0.00 H new ATOM 0 HD13 LEU A 603 -7.304 -7.051 14.907 1.00 0.00 H new ATOM 0 HD21 LEU A 603 -8.111 -4.233 15.852 1.00 0.00 H new ATOM 0 HD22 LEU A 603 -7.096 -4.542 14.423 1.00 0.00 H new ATOM 0 HD23 LEU A 603 -8.584 -3.578 14.266 1.00 0.00 H new ATOM 1033 N ASN A 604 -10.796 -5.074 10.293 1.00 0.00 N ATOM 1034 CA ASN A 604 -11.239 -5.478 8.964 1.00 0.00 C ATOM 1035 C ASN A 604 -11.986 -4.339 8.277 1.00 0.00 C ATOM 1036 O ASN A 604 -13.071 -4.534 7.730 1.00 0.00 O ATOM 1037 CB ASN A 604 -12.145 -6.707 9.060 1.00 0.00 C ATOM 1038 CG ASN A 604 -11.597 -7.759 10.005 1.00 0.00 C ATOM 1039 OD1 ASN A 604 -10.759 -8.575 9.626 1.00 0.00 O ATOM 1040 ND2 ASN A 604 -12.071 -7.742 11.245 1.00 0.00 N ATOM 0 H ASN A 604 -11.530 -4.674 10.877 1.00 0.00 H new ATOM 0 HA ASN A 604 -10.359 -5.727 8.371 1.00 0.00 H new ATOM 0 HB2 ASN A 604 -13.135 -6.400 9.398 1.00 0.00 H new ATOM 0 HB3 ASN A 604 -12.268 -7.142 8.068 1.00 0.00 H new ATOM 0 HD21 ASN A 604 -11.740 -8.425 11.927 1.00 0.00 H new ATOM 0 HD22 ASN A 604 -12.766 -7.046 11.516 1.00 0.00 H new ATOM 1047 N PRO A 605 -11.413 -3.125 8.312 1.00 0.00 N ATOM 1048 CA PRO A 605 -12.026 -1.938 7.708 1.00 0.00 C ATOM 1049 C PRO A 605 -11.834 -1.869 6.199 1.00 0.00 C ATOM 1050 O PRO A 605 -11.257 -2.768 5.591 1.00 0.00 O ATOM 1051 CB PRO A 605 -11.273 -0.793 8.374 1.00 0.00 C ATOM 1052 CG PRO A 605 -9.919 -1.352 8.647 1.00 0.00 C ATOM 1053 CD PRO A 605 -10.127 -2.811 8.961 1.00 0.00 C ATOM 0 HA PRO A 605 -13.106 -1.925 7.856 1.00 0.00 H new ATOM 0 HB2 PRO A 605 -11.219 0.080 7.723 1.00 0.00 H new ATOM 0 HB3 PRO A 605 -11.765 -0.475 9.293 1.00 0.00 H new ATOM 0 HG2 PRO A 605 -9.265 -1.228 7.784 1.00 0.00 H new ATOM 0 HG3 PRO A 605 -9.445 -0.837 9.483 1.00 0.00 H new ATOM 0 HD2 PRO A 605 -9.318 -3.425 8.566 1.00 0.00 H new ATOM 0 HD3 PRO A 605 -10.166 -2.988 10.036 1.00 0.00 H new ATOM 1061 N GLU A 606 -12.319 -0.780 5.608 1.00 0.00 N ATOM 1062 CA GLU A 606 -12.204 -0.562 4.171 1.00 0.00 C ATOM 1063 C GLU A 606 -11.694 0.848 3.889 1.00 0.00 C ATOM 1064 O GLU A 606 -12.365 1.834 4.194 1.00 0.00 O ATOM 1065 CB GLU A 606 -13.558 -0.777 3.497 1.00 0.00 C ATOM 1066 CG GLU A 606 -13.604 -0.308 2.051 1.00 0.00 C ATOM 1067 CD GLU A 606 -14.995 0.107 1.616 1.00 0.00 C ATOM 1068 OE1 GLU A 606 -15.976 -0.437 2.167 1.00 0.00 O ATOM 1069 OE2 GLU A 606 -15.104 0.976 0.727 1.00 0.00 O ATOM 0 H GLU A 606 -12.798 -0.031 6.107 1.00 0.00 H new ATOM 0 HA GLU A 606 -11.491 -1.279 3.764 1.00 0.00 H new ATOM 0 HB2 GLU A 606 -13.807 -1.837 3.534 1.00 0.00 H new ATOM 0 HB3 GLU A 606 -14.324 -0.249 4.065 1.00 0.00 H new ATOM 0 HG2 GLU A 606 -12.922 0.533 1.924 1.00 0.00 H new ATOM 0 HG3 GLU A 606 -13.248 -1.108 1.402 1.00 0.00 H new ATOM 1076 N PHE A 607 -10.499 0.938 3.315 1.00 0.00 N ATOM 1077 CA PHE A 607 -9.894 2.229 3.003 1.00 0.00 C ATOM 1078 C PHE A 607 -10.463 2.816 1.716 1.00 0.00 C ATOM 1079 O PHE A 607 -10.867 3.978 1.680 1.00 0.00 O ATOM 1080 CB PHE A 607 -8.377 2.084 2.875 1.00 0.00 C ATOM 1081 CG PHE A 607 -7.719 1.514 4.097 1.00 0.00 C ATOM 1082 CD1 PHE A 607 -7.648 2.251 5.269 1.00 0.00 C ATOM 1083 CD2 PHE A 607 -7.169 0.243 4.073 1.00 0.00 C ATOM 1084 CE1 PHE A 607 -7.039 1.731 6.395 1.00 0.00 C ATOM 1085 CE2 PHE A 607 -6.558 -0.284 5.198 1.00 0.00 C ATOM 1086 CZ PHE A 607 -6.493 0.462 6.361 1.00 0.00 C ATOM 0 H PHE A 607 -9.930 0.132 3.056 1.00 0.00 H new ATOM 0 HA PHE A 607 -10.128 2.910 3.821 1.00 0.00 H new ATOM 0 HB2 PHE A 607 -8.153 1.444 2.021 1.00 0.00 H new ATOM 0 HB3 PHE A 607 -7.944 3.062 2.663 1.00 0.00 H new ATOM 0 HD1 PHE A 607 -8.074 3.243 5.302 1.00 0.00 H new ATOM 0 HD2 PHE A 607 -7.217 -0.343 3.167 1.00 0.00 H new ATOM 0 HE1 PHE A 607 -6.990 2.316 7.301 1.00 0.00 H new ATOM 0 HE2 PHE A 607 -6.133 -1.276 5.168 1.00 0.00 H new ATOM 0 HZ PHE A 607 -6.017 0.054 7.240 1.00 0.00 H new ATOM 1096 N ASN A 608 -10.479 2.013 0.658 1.00 0.00 N ATOM 1097 CA ASN A 608 -10.986 2.463 -0.631 1.00 0.00 C ATOM 1098 C ASN A 608 -10.422 3.839 -0.969 1.00 0.00 C ATOM 1099 O ASN A 608 -11.162 4.760 -1.313 1.00 0.00 O ATOM 1100 CB ASN A 608 -12.516 2.508 -0.619 1.00 0.00 C ATOM 1101 CG ASN A 608 -13.060 3.430 0.455 1.00 0.00 C ATOM 1102 OD1 ASN A 608 -13.032 3.103 1.641 1.00 0.00 O ATOM 1103 ND2 ASN A 608 -13.561 4.588 0.042 1.00 0.00 N ATOM 0 H ASN A 608 -10.147 1.049 0.668 1.00 0.00 H new ATOM 0 HA ASN A 608 -10.666 1.754 -1.395 1.00 0.00 H new ATOM 0 HB2 ASN A 608 -12.874 2.839 -1.594 1.00 0.00 H new ATOM 0 HB3 ASN A 608 -12.905 1.502 -0.461 1.00 0.00 H new ATOM 0 HD21 ASN A 608 -13.944 5.249 0.719 1.00 0.00 H new ATOM 0 HD22 ASN A 608 -13.563 4.817 -0.952 1.00 0.00 H new ATOM 1110 N GLU A 609 -9.102 3.969 -0.860 1.00 0.00 N ATOM 1111 CA GLU A 609 -8.431 5.232 -1.145 1.00 0.00 C ATOM 1112 C GLU A 609 -7.607 5.140 -2.425 1.00 0.00 C ATOM 1113 O GLU A 609 -6.907 4.154 -2.655 1.00 0.00 O ATOM 1114 CB GLU A 609 -7.528 5.628 0.027 1.00 0.00 C ATOM 1115 CG GLU A 609 -8.112 6.725 0.901 1.00 0.00 C ATOM 1116 CD GLU A 609 -7.709 8.113 0.444 1.00 0.00 C ATOM 1117 OE1 GLU A 609 -6.514 8.313 0.140 1.00 0.00 O ATOM 1118 OE2 GLU A 609 -8.587 9.000 0.388 1.00 0.00 O ATOM 0 H GLU A 609 -8.477 3.214 -0.576 1.00 0.00 H new ATOM 0 HA GLU A 609 -9.197 5.995 -1.284 1.00 0.00 H new ATOM 0 HB2 GLU A 609 -7.338 4.748 0.642 1.00 0.00 H new ATOM 0 HB3 GLU A 609 -6.565 5.959 -0.363 1.00 0.00 H new ATOM 0 HG2 GLU A 609 -9.199 6.647 0.897 1.00 0.00 H new ATOM 0 HG3 GLU A 609 -7.785 6.577 1.930 1.00 0.00 H new ATOM 1125 N GLU A 610 -7.690 6.179 -3.249 1.00 0.00 N ATOM 1126 CA GLU A 610 -6.948 6.222 -4.502 1.00 0.00 C ATOM 1127 C GLU A 610 -5.825 7.252 -4.426 1.00 0.00 C ATOM 1128 O GLU A 610 -6.076 8.448 -4.280 1.00 0.00 O ATOM 1129 CB GLU A 610 -7.885 6.554 -5.665 1.00 0.00 C ATOM 1130 CG GLU A 610 -9.217 5.825 -5.600 1.00 0.00 C ATOM 1131 CD GLU A 610 -10.354 6.638 -6.186 1.00 0.00 C ATOM 1132 OE1 GLU A 610 -10.678 7.703 -5.619 1.00 0.00 O ATOM 1133 OE2 GLU A 610 -10.923 6.209 -7.212 1.00 0.00 O ATOM 0 H GLU A 610 -8.264 7.003 -3.071 1.00 0.00 H new ATOM 0 HA GLU A 610 -6.509 5.239 -4.673 1.00 0.00 H new ATOM 0 HB2 GLU A 610 -8.068 7.628 -5.678 1.00 0.00 H new ATOM 0 HB3 GLU A 610 -7.389 6.304 -6.603 1.00 0.00 H new ATOM 0 HG2 GLU A 610 -9.137 4.880 -6.137 1.00 0.00 H new ATOM 0 HG3 GLU A 610 -9.445 5.584 -4.562 1.00 0.00 H new ATOM 1140 N PHE A 611 -4.587 6.779 -4.511 1.00 0.00 N ATOM 1141 CA PHE A 611 -3.424 7.653 -4.437 1.00 0.00 C ATOM 1142 C PHE A 611 -2.899 8.020 -5.818 1.00 0.00 C ATOM 1143 O PHE A 611 -3.396 7.542 -6.838 1.00 0.00 O ATOM 1144 CB PHE A 611 -2.321 6.976 -3.639 1.00 0.00 C ATOM 1145 CG PHE A 611 -2.536 7.053 -2.163 1.00 0.00 C ATOM 1146 CD1 PHE A 611 -3.445 6.218 -1.541 1.00 0.00 C ATOM 1147 CD2 PHE A 611 -1.829 7.962 -1.403 1.00 0.00 C ATOM 1148 CE1 PHE A 611 -3.645 6.287 -0.174 1.00 0.00 C ATOM 1149 CE2 PHE A 611 -2.022 8.039 -0.038 1.00 0.00 C ATOM 1150 CZ PHE A 611 -2.931 7.200 0.579 1.00 0.00 C ATOM 0 H PHE A 611 -4.363 5.791 -4.632 1.00 0.00 H new ATOM 0 HA PHE A 611 -3.735 8.573 -3.942 1.00 0.00 H new ATOM 0 HB2 PHE A 611 -2.255 5.930 -3.937 1.00 0.00 H new ATOM 0 HB3 PHE A 611 -1.365 7.439 -3.886 1.00 0.00 H new ATOM 0 HD1 PHE A 611 -4.005 5.505 -2.128 1.00 0.00 H new ATOM 0 HD2 PHE A 611 -1.118 8.620 -1.880 1.00 0.00 H new ATOM 0 HE1 PHE A 611 -4.357 5.630 0.303 1.00 0.00 H new ATOM 0 HE2 PHE A 611 -1.463 8.754 0.547 1.00 0.00 H new ATOM 0 HZ PHE A 611 -3.083 7.258 1.647 1.00 0.00 H new ATOM 1160 N PHE A 612 -1.876 8.868 -5.834 1.00 0.00 N ATOM 1161 CA PHE A 612 -1.256 9.311 -7.076 1.00 0.00 C ATOM 1162 C PHE A 612 0.246 9.498 -6.889 1.00 0.00 C ATOM 1163 O PHE A 612 0.682 10.209 -5.984 1.00 0.00 O ATOM 1164 CB PHE A 612 -1.887 10.621 -7.547 1.00 0.00 C ATOM 1165 CG PHE A 612 -1.511 10.992 -8.952 1.00 0.00 C ATOM 1166 CD1 PHE A 612 -1.323 10.012 -9.912 1.00 0.00 C ATOM 1167 CD2 PHE A 612 -1.344 12.319 -9.313 1.00 0.00 C ATOM 1168 CE1 PHE A 612 -0.977 10.346 -11.207 1.00 0.00 C ATOM 1169 CE2 PHE A 612 -0.997 12.662 -10.607 1.00 0.00 C ATOM 1170 CZ PHE A 612 -0.814 11.673 -11.555 1.00 0.00 C ATOM 0 H PHE A 612 -1.456 9.265 -4.993 1.00 0.00 H new ATOM 0 HA PHE A 612 -1.422 8.544 -7.833 1.00 0.00 H new ATOM 0 HB2 PHE A 612 -2.972 10.538 -7.479 1.00 0.00 H new ATOM 0 HB3 PHE A 612 -1.585 11.424 -6.874 1.00 0.00 H new ATOM 0 HD1 PHE A 612 -1.448 8.973 -9.645 1.00 0.00 H new ATOM 0 HD2 PHE A 612 -1.486 13.095 -8.575 1.00 0.00 H new ATOM 0 HE1 PHE A 612 -0.834 9.571 -11.946 1.00 0.00 H new ATOM 0 HE2 PHE A 612 -0.869 13.700 -10.876 1.00 0.00 H new ATOM 0 HZ PHE A 612 -0.544 11.937 -12.567 1.00 0.00 H new ATOM 1180 N TYR A 613 1.035 8.856 -7.745 1.00 0.00 N ATOM 1181 CA TYR A 613 2.485 8.957 -7.664 1.00 0.00 C ATOM 1182 C TYR A 613 3.043 9.781 -8.816 1.00 0.00 C ATOM 1183 O TYR A 613 2.423 9.889 -9.874 1.00 0.00 O ATOM 1184 CB TYR A 613 3.109 7.565 -7.658 1.00 0.00 C ATOM 1185 CG TYR A 613 3.310 7.021 -6.266 1.00 0.00 C ATOM 1186 CD1 TYR A 613 2.265 6.418 -5.580 1.00 0.00 C ATOM 1187 CD2 TYR A 613 4.541 7.122 -5.636 1.00 0.00 C ATOM 1188 CE1 TYR A 613 2.441 5.927 -4.299 1.00 0.00 C ATOM 1189 CE2 TYR A 613 4.728 6.634 -4.357 1.00 0.00 C ATOM 1190 CZ TYR A 613 3.675 6.038 -3.692 1.00 0.00 C ATOM 1191 OH TYR A 613 3.857 5.551 -2.418 1.00 0.00 O ATOM 0 H TYR A 613 0.694 8.262 -8.501 1.00 0.00 H new ATOM 0 HA TYR A 613 2.739 9.464 -6.733 1.00 0.00 H new ATOM 0 HB2 TYR A 613 2.471 6.883 -8.221 1.00 0.00 H new ATOM 0 HB3 TYR A 613 4.070 7.600 -8.172 1.00 0.00 H new ATOM 0 HD1 TYR A 613 1.299 6.331 -6.054 1.00 0.00 H new ATOM 0 HD2 TYR A 613 5.366 7.589 -6.153 1.00 0.00 H new ATOM 0 HE1 TYR A 613 1.618 5.460 -3.778 1.00 0.00 H new ATOM 0 HE2 TYR A 613 5.693 6.718 -3.880 1.00 0.00 H new ATOM 0 HH TYR A 613 4.114 6.284 -1.821 1.00 0.00 H new ATOM 1201 N ASP A 614 4.216 10.363 -8.602 1.00 0.00 N ATOM 1202 CA ASP A 614 4.855 11.182 -9.622 1.00 0.00 C ATOM 1203 C ASP A 614 6.113 10.505 -10.154 1.00 0.00 C ATOM 1204 O ASP A 614 7.217 11.033 -10.025 1.00 0.00 O ATOM 1205 CB ASP A 614 5.203 12.562 -9.058 1.00 0.00 C ATOM 1206 CG ASP A 614 3.972 13.404 -8.790 1.00 0.00 C ATOM 1207 OD1 ASP A 614 2.860 12.962 -9.148 1.00 0.00 O ATOM 1208 OD2 ASP A 614 4.120 14.507 -8.224 1.00 0.00 O ATOM 0 H ASP A 614 4.743 10.283 -7.732 1.00 0.00 H new ATOM 0 HA ASP A 614 4.152 11.302 -10.447 1.00 0.00 H new ATOM 0 HB2 ASP A 614 5.766 12.442 -8.132 1.00 0.00 H new ATOM 0 HB3 ASP A 614 5.852 13.085 -9.760 1.00 0.00 H new ATOM 1213 N ILE A 615 5.936 9.331 -10.752 1.00 0.00 N ATOM 1214 CA ILE A 615 7.057 8.580 -11.302 1.00 0.00 C ATOM 1215 C ILE A 615 6.820 8.249 -12.772 1.00 0.00 C ATOM 1216 O ILE A 615 5.697 7.953 -13.179 1.00 0.00 O ATOM 1217 CB ILE A 615 7.299 7.274 -10.510 1.00 0.00 C ATOM 1218 CG1 ILE A 615 8.154 6.286 -11.313 1.00 0.00 C ATOM 1219 CG2 ILE A 615 5.980 6.636 -10.108 1.00 0.00 C ATOM 1220 CD1 ILE A 615 9.613 6.656 -11.361 1.00 0.00 C ATOM 0 H ILE A 615 5.028 8.881 -10.868 1.00 0.00 H new ATOM 0 HA ILE A 615 7.943 9.210 -11.217 1.00 0.00 H new ATOM 0 HB ILE A 615 7.848 7.532 -9.604 1.00 0.00 H new ATOM 0 HG12 ILE A 615 8.053 5.292 -10.876 1.00 0.00 H new ATOM 0 HG13 ILE A 615 7.768 6.228 -12.331 1.00 0.00 H new ATOM 0 HG21 ILE A 615 6.174 5.719 -9.552 1.00 0.00 H new ATOM 0 HG22 ILE A 615 5.417 7.328 -9.481 1.00 0.00 H new ATOM 0 HG23 ILE A 615 5.401 6.403 -11.002 1.00 0.00 H new ATOM 0 HD11 ILE A 615 10.158 5.914 -11.945 1.00 0.00 H new ATOM 0 HD12 ILE A 615 9.725 7.636 -11.825 1.00 0.00 H new ATOM 0 HD13 ILE A 615 10.014 6.686 -10.348 1.00 0.00 H new ATOM 1232 N LYS A 616 7.889 8.291 -13.558 1.00 0.00 N ATOM 1233 CA LYS A 616 7.798 7.983 -14.979 1.00 0.00 C ATOM 1234 C LYS A 616 7.575 6.490 -15.186 1.00 0.00 C ATOM 1235 O LYS A 616 8.222 5.660 -14.547 1.00 0.00 O ATOM 1236 CB LYS A 616 9.065 8.429 -15.708 1.00 0.00 C ATOM 1237 CG LYS A 616 8.965 9.824 -16.300 1.00 0.00 C ATOM 1238 CD LYS A 616 10.195 10.172 -17.121 1.00 0.00 C ATOM 1239 CE LYS A 616 11.084 11.168 -16.396 1.00 0.00 C ATOM 1240 NZ LYS A 616 12.157 10.490 -15.618 1.00 0.00 N ATOM 0 H LYS A 616 8.826 8.535 -13.236 1.00 0.00 H new ATOM 0 HA LYS A 616 6.948 8.526 -15.392 1.00 0.00 H new ATOM 0 HB2 LYS A 616 9.904 8.397 -15.013 1.00 0.00 H new ATOM 0 HB3 LYS A 616 9.284 7.719 -16.506 1.00 0.00 H new ATOM 0 HG2 LYS A 616 8.077 9.891 -16.928 1.00 0.00 H new ATOM 0 HG3 LYS A 616 8.844 10.552 -15.498 1.00 0.00 H new ATOM 0 HD2 LYS A 616 10.761 9.265 -17.333 1.00 0.00 H new ATOM 0 HD3 LYS A 616 9.888 10.588 -18.081 1.00 0.00 H new ATOM 0 HE2 LYS A 616 11.534 11.847 -17.120 1.00 0.00 H new ATOM 0 HE3 LYS A 616 10.477 11.775 -15.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 616 12.742 11.204 -15.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 616 11.728 9.861 -14.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 616 12.752 9.931 -16.262 1.00 0.00 H new ATOM 1254 N HIS A 617 6.652 6.158 -16.076 1.00 0.00 N ATOM 1255 CA HIS A 617 6.334 4.765 -16.362 1.00 0.00 C ATOM 1256 C HIS A 617 7.599 3.936 -16.562 1.00 0.00 C ATOM 1257 O HIS A 617 7.747 2.863 -15.977 1.00 0.00 O ATOM 1258 CB HIS A 617 5.453 4.668 -17.606 1.00 0.00 C ATOM 1259 CG HIS A 617 5.018 3.272 -17.912 1.00 0.00 C ATOM 1260 ND1 HIS A 617 5.363 2.613 -19.072 1.00 0.00 N ATOM 1261 CD2 HIS A 617 4.265 2.403 -17.198 1.00 0.00 C ATOM 1262 CE1 HIS A 617 4.841 1.401 -19.059 1.00 0.00 C ATOM 1263 NE2 HIS A 617 4.171 1.248 -17.932 1.00 0.00 N ATOM 0 H HIS A 617 6.109 6.834 -16.614 1.00 0.00 H new ATOM 0 HA HIS A 617 5.795 4.365 -15.503 1.00 0.00 H new ATOM 0 HB2 HIS A 617 4.572 5.294 -17.469 1.00 0.00 H new ATOM 0 HB3 HIS A 617 5.998 5.068 -18.461 1.00 0.00 H new ATOM 0 HD2 HIS A 617 3.821 2.585 -16.231 1.00 0.00 H new ATOM 0 HE1 HIS A 617 4.944 0.660 -19.838 1.00 0.00 H new ATOM 0 HE2 HIS A 617 3.665 0.407 -17.652 1.00 0.00 H new ATOM 1272 N SER A 618 8.503 4.434 -17.398 1.00 0.00 N ATOM 1273 CA SER A 618 9.751 3.733 -17.683 1.00 0.00 C ATOM 1274 C SER A 618 10.585 3.535 -16.421 1.00 0.00 C ATOM 1275 O SER A 618 11.552 2.774 -16.423 1.00 0.00 O ATOM 1276 CB SER A 618 10.564 4.500 -18.728 1.00 0.00 C ATOM 1277 OG SER A 618 10.873 3.678 -19.840 1.00 0.00 O ATOM 0 H SER A 618 8.396 5.321 -17.891 1.00 0.00 H new ATOM 0 HA SER A 618 9.494 2.749 -18.075 1.00 0.00 H new ATOM 0 HB2 SER A 618 10.002 5.372 -19.062 1.00 0.00 H new ATOM 0 HB3 SER A 618 11.486 4.868 -18.277 1.00 0.00 H new ATOM 0 HG SER A 618 11.391 4.193 -20.493 1.00 0.00 H new ATOM 1283 N ASP A 619 10.209 4.217 -15.344 1.00 0.00 N ATOM 1284 CA ASP A 619 10.934 4.099 -14.087 1.00 0.00 C ATOM 1285 C ASP A 619 10.130 3.287 -13.078 1.00 0.00 C ATOM 1286 O ASP A 619 10.693 2.646 -12.191 1.00 0.00 O ATOM 1287 CB ASP A 619 11.249 5.485 -13.527 1.00 0.00 C ATOM 1288 CG ASP A 619 12.257 6.237 -14.373 1.00 0.00 C ATOM 1289 OD1 ASP A 619 11.849 6.841 -15.387 1.00 0.00 O ATOM 1290 OD2 ASP A 619 13.456 6.223 -14.022 1.00 0.00 O ATOM 0 H ASP A 619 9.412 4.853 -15.317 1.00 0.00 H new ATOM 0 HA ASP A 619 11.872 3.577 -14.276 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.329 6.065 -13.463 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.634 5.385 -12.512 1.00 0.00 H new ATOM 1295 N LEU A 620 8.808 3.310 -13.228 1.00 0.00 N ATOM 1296 CA LEU A 620 7.921 2.565 -12.340 1.00 0.00 C ATOM 1297 C LEU A 620 8.559 1.236 -11.944 1.00 0.00 C ATOM 1298 O LEU A 620 8.920 1.029 -10.789 1.00 0.00 O ATOM 1299 CB LEU A 620 6.579 2.303 -13.037 1.00 0.00 C ATOM 1300 CG LEU A 620 5.404 3.212 -12.645 1.00 0.00 C ATOM 1301 CD1 LEU A 620 4.172 2.373 -12.368 1.00 0.00 C ATOM 1302 CD2 LEU A 620 5.730 4.075 -11.435 1.00 0.00 C ATOM 0 H LEU A 620 8.327 3.837 -13.957 1.00 0.00 H new ATOM 0 HA LEU A 620 7.752 3.159 -11.442 1.00 0.00 H new ATOM 0 HB2 LEU A 620 6.732 2.391 -14.113 1.00 0.00 H new ATOM 0 HB3 LEU A 620 6.290 1.271 -12.840 1.00 0.00 H new ATOM 0 HG LEU A 620 5.211 3.882 -13.483 1.00 0.00 H new ATOM 0 HD11 LEU A 620 3.343 3.024 -12.091 1.00 0.00 H new ATOM 0 HD12 LEU A 620 3.907 1.809 -13.262 1.00 0.00 H new ATOM 0 HD13 LEU A 620 4.379 1.681 -11.551 1.00 0.00 H new ATOM 0 HD21 LEU A 620 4.872 4.702 -11.193 1.00 0.00 H new ATOM 0 HD22 LEU A 620 5.964 3.435 -10.584 1.00 0.00 H new ATOM 0 HD23 LEU A 620 6.589 4.707 -11.660 1.00 0.00 H new ATOM 1314 N ALA A 621 8.696 0.346 -12.918 1.00 0.00 N ATOM 1315 CA ALA A 621 9.293 -0.966 -12.695 1.00 0.00 C ATOM 1316 C ALA A 621 10.526 -0.879 -11.790 1.00 0.00 C ATOM 1317 O ALA A 621 10.732 -1.725 -10.924 1.00 0.00 O ATOM 1318 CB ALA A 621 9.672 -1.584 -14.033 1.00 0.00 C ATOM 0 H ALA A 621 8.399 0.511 -13.880 1.00 0.00 H new ATOM 0 HA ALA A 621 8.558 -1.594 -12.192 1.00 0.00 H new ATOM 0 HB1 ALA A 621 10.118 -2.565 -13.867 1.00 0.00 H new ATOM 0 HB2 ALA A 621 8.780 -1.691 -14.650 1.00 0.00 H new ATOM 0 HB3 ALA A 621 10.390 -0.940 -14.541 1.00 0.00 H new ATOM 1324 N LYS A 622 11.347 0.151 -11.995 1.00 0.00 N ATOM 1325 CA LYS A 622 12.559 0.333 -11.206 1.00 0.00 C ATOM 1326 C LYS A 622 12.227 0.700 -9.770 1.00 0.00 C ATOM 1327 O LYS A 622 13.081 0.630 -8.885 1.00 0.00 O ATOM 1328 CB LYS A 622 13.436 1.421 -11.830 1.00 0.00 C ATOM 1329 CG LYS A 622 14.561 0.876 -12.696 1.00 0.00 C ATOM 1330 CD LYS A 622 14.025 0.041 -13.847 1.00 0.00 C ATOM 1331 CE LYS A 622 13.935 0.854 -15.130 1.00 0.00 C ATOM 1332 NZ LYS A 622 15.275 1.086 -15.736 1.00 0.00 N ATOM 0 H LYS A 622 11.192 0.870 -12.701 1.00 0.00 H new ATOM 0 HA LYS A 622 13.103 -0.611 -11.202 1.00 0.00 H new ATOM 0 HB2 LYS A 622 12.810 2.078 -12.434 1.00 0.00 H new ATOM 0 HB3 LYS A 622 13.864 2.031 -11.035 1.00 0.00 H new ATOM 0 HG2 LYS A 622 15.152 1.703 -13.090 1.00 0.00 H new ATOM 0 HG3 LYS A 622 15.230 0.269 -12.086 1.00 0.00 H new ATOM 0 HD2 LYS A 622 14.673 -0.821 -14.006 1.00 0.00 H new ATOM 0 HD3 LYS A 622 13.039 -0.345 -13.590 1.00 0.00 H new ATOM 0 HE2 LYS A 622 13.298 0.334 -15.845 1.00 0.00 H new ATOM 0 HE3 LYS A 622 13.461 1.813 -14.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 622 15.160 1.460 -16.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 622 15.803 1.771 -15.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 622 15.799 0.189 -15.773 1.00 0.00 H new ATOM 1346 N LYS A 623 10.986 1.100 -9.546 1.00 0.00 N ATOM 1347 CA LYS A 623 10.543 1.490 -8.217 1.00 0.00 C ATOM 1348 C LYS A 623 9.983 0.305 -7.439 1.00 0.00 C ATOM 1349 O LYS A 623 9.933 -0.819 -7.938 1.00 0.00 O ATOM 1350 CB LYS A 623 9.480 2.583 -8.305 1.00 0.00 C ATOM 1351 CG LYS A 623 9.700 3.563 -9.442 1.00 0.00 C ATOM 1352 CD LYS A 623 10.105 4.929 -8.919 1.00 0.00 C ATOM 1353 CE LYS A 623 11.504 5.304 -9.382 1.00 0.00 C ATOM 1354 NZ LYS A 623 12.404 5.608 -8.235 1.00 0.00 N ATOM 0 H LYS A 623 10.267 1.163 -10.267 1.00 0.00 H new ATOM 0 HA LYS A 623 11.416 1.870 -7.686 1.00 0.00 H new ATOM 0 HB2 LYS A 623 8.502 2.117 -8.424 1.00 0.00 H new ATOM 0 HB3 LYS A 623 9.459 3.132 -7.364 1.00 0.00 H new ATOM 0 HG2 LYS A 623 10.473 3.182 -10.109 1.00 0.00 H new ATOM 0 HG3 LYS A 623 8.787 3.652 -10.031 1.00 0.00 H new ATOM 0 HD2 LYS A 623 9.392 5.679 -9.263 1.00 0.00 H new ATOM 0 HD3 LYS A 623 10.067 4.930 -7.830 1.00 0.00 H new ATOM 0 HE2 LYS A 623 11.925 4.486 -9.967 1.00 0.00 H new ATOM 0 HE3 LYS A 623 11.449 6.171 -10.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 623 13.348 5.859 -8.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 623 12.016 6.405 -7.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 623 12.477 4.772 -7.620 1.00 0.00 H new ATOM 1368 N SER A 624 9.556 0.577 -6.209 1.00 0.00 N ATOM 1369 CA SER A 624 8.986 -0.446 -5.343 1.00 0.00 C ATOM 1370 C SER A 624 7.977 0.179 -4.383 1.00 0.00 C ATOM 1371 O SER A 624 8.347 0.948 -3.496 1.00 0.00 O ATOM 1372 CB SER A 624 10.089 -1.156 -4.556 1.00 0.00 C ATOM 1373 OG SER A 624 11.322 -1.114 -5.255 1.00 0.00 O ATOM 0 H SER A 624 9.595 1.506 -5.789 1.00 0.00 H new ATOM 0 HA SER A 624 8.474 -1.180 -5.965 1.00 0.00 H new ATOM 0 HB2 SER A 624 10.204 -0.685 -3.580 1.00 0.00 H new ATOM 0 HB3 SER A 624 9.803 -2.193 -4.378 1.00 0.00 H new ATOM 0 HG SER A 624 12.011 -1.573 -4.731 1.00 0.00 H new ATOM 1379 N LEU A 625 6.704 -0.149 -4.572 1.00 0.00 N ATOM 1380 CA LEU A 625 5.645 0.392 -3.726 1.00 0.00 C ATOM 1381 C LEU A 625 5.573 -0.351 -2.397 1.00 0.00 C ATOM 1382 O LEU A 625 5.243 -1.535 -2.354 1.00 0.00 O ATOM 1383 CB LEU A 625 4.297 0.305 -4.443 1.00 0.00 C ATOM 1384 CG LEU A 625 3.136 0.977 -3.711 1.00 0.00 C ATOM 1385 CD1 LEU A 625 3.393 2.468 -3.565 1.00 0.00 C ATOM 1386 CD2 LEU A 625 1.828 0.726 -4.445 1.00 0.00 C ATOM 0 H LEU A 625 6.380 -0.785 -5.301 1.00 0.00 H new ATOM 0 HA LEU A 625 5.877 1.438 -3.524 1.00 0.00 H new ATOM 0 HB2 LEU A 625 4.396 0.758 -5.430 1.00 0.00 H new ATOM 0 HB3 LEU A 625 4.051 -0.746 -4.598 1.00 0.00 H new ATOM 0 HG LEU A 625 3.057 0.544 -2.714 1.00 0.00 H new ATOM 0 HD11 LEU A 625 2.557 2.932 -3.042 1.00 0.00 H new ATOM 0 HD12 LEU A 625 4.309 2.625 -2.996 1.00 0.00 H new ATOM 0 HD13 LEU A 625 3.497 2.918 -4.552 1.00 0.00 H new ATOM 0 HD21 LEU A 625 1.012 1.211 -3.910 1.00 0.00 H new ATOM 0 HD22 LEU A 625 1.893 1.133 -5.454 1.00 0.00 H new ATOM 0 HD23 LEU A 625 1.640 -0.346 -4.497 1.00 0.00 H new ATOM 1398 N ASP A 626 5.884 0.353 -1.314 1.00 0.00 N ATOM 1399 CA ASP A 626 5.858 -0.244 0.016 1.00 0.00 C ATOM 1400 C ASP A 626 4.556 0.078 0.745 1.00 0.00 C ATOM 1401 O ASP A 626 4.359 1.196 1.219 1.00 0.00 O ATOM 1402 CB ASP A 626 7.048 0.249 0.839 1.00 0.00 C ATOM 1403 CG ASP A 626 7.444 -0.729 1.928 1.00 0.00 C ATOM 1404 OD1 ASP A 626 7.074 -1.917 1.822 1.00 0.00 O ATOM 1405 OD2 ASP A 626 8.125 -0.307 2.887 1.00 0.00 O ATOM 0 H ASP A 626 6.157 1.336 -1.331 1.00 0.00 H new ATOM 0 HA ASP A 626 5.923 -1.326 -0.103 1.00 0.00 H new ATOM 0 HB2 ASP A 626 7.899 0.416 0.178 1.00 0.00 H new ATOM 0 HB3 ASP A 626 6.801 1.210 1.290 1.00 0.00 H new ATOM 1410 N ILE A 627 3.676 -0.915 0.837 1.00 0.00 N ATOM 1411 CA ILE A 627 2.398 -0.745 1.518 1.00 0.00 C ATOM 1412 C ILE A 627 2.488 -1.236 2.959 1.00 0.00 C ATOM 1413 O ILE A 627 2.583 -2.437 3.211 1.00 0.00 O ATOM 1414 CB ILE A 627 1.270 -1.508 0.797 1.00 0.00 C ATOM 1415 CG1 ILE A 627 1.310 -1.218 -0.704 1.00 0.00 C ATOM 1416 CG2 ILE A 627 -0.083 -1.130 1.380 1.00 0.00 C ATOM 1417 CD1 ILE A 627 1.966 -2.315 -1.514 1.00 0.00 C ATOM 0 H ILE A 627 3.825 -1.846 0.448 1.00 0.00 H new ATOM 0 HA ILE A 627 2.166 0.320 1.507 1.00 0.00 H new ATOM 0 HB ILE A 627 1.420 -2.577 0.946 1.00 0.00 H new ATOM 0 HG12 ILE A 627 0.292 -1.070 -1.065 1.00 0.00 H new ATOM 0 HG13 ILE A 627 1.846 -0.284 -0.871 1.00 0.00 H new ATOM 0 HG21 ILE A 627 -0.869 -1.677 0.860 1.00 0.00 H new ATOM 0 HG22 ILE A 627 -0.106 -1.382 2.440 1.00 0.00 H new ATOM 0 HG23 ILE A 627 -0.245 -0.059 1.258 1.00 0.00 H new ATOM 0 HD11 ILE A 627 1.959 -2.042 -2.569 1.00 0.00 H new ATOM 0 HD12 ILE A 627 2.995 -2.448 -1.180 1.00 0.00 H new ATOM 0 HD13 ILE A 627 1.417 -3.247 -1.377 1.00 0.00 H new ATOM 1429 N SER A 628 2.470 -0.300 3.902 1.00 0.00 N ATOM 1430 CA SER A 628 2.562 -0.646 5.319 1.00 0.00 C ATOM 1431 C SER A 628 1.288 -0.279 6.067 1.00 0.00 C ATOM 1432 O SER A 628 0.619 0.701 5.736 1.00 0.00 O ATOM 1433 CB SER A 628 3.761 0.054 5.961 1.00 0.00 C ATOM 1434 OG SER A 628 4.977 -0.371 5.370 1.00 0.00 O ATOM 0 H SER A 628 2.393 0.700 3.714 1.00 0.00 H new ATOM 0 HA SER A 628 2.696 -1.726 5.386 1.00 0.00 H new ATOM 0 HB2 SER A 628 3.657 1.133 5.851 1.00 0.00 H new ATOM 0 HB3 SER A 628 3.780 -0.157 7.030 1.00 0.00 H new ATOM 0 HG SER A 628 5.728 0.092 5.797 1.00 0.00 H new ATOM 1440 N VAL A 629 0.966 -1.072 7.082 1.00 0.00 N ATOM 1441 CA VAL A 629 -0.220 -0.837 7.891 1.00 0.00 C ATOM 1442 C VAL A 629 0.153 -0.692 9.363 1.00 0.00 C ATOM 1443 O VAL A 629 0.733 -1.602 9.957 1.00 0.00 O ATOM 1444 CB VAL A 629 -1.240 -1.980 7.740 1.00 0.00 C ATOM 1445 CG1 VAL A 629 -2.561 -1.611 8.396 1.00 0.00 C ATOM 1446 CG2 VAL A 629 -1.443 -2.322 6.271 1.00 0.00 C ATOM 0 H VAL A 629 1.513 -1.886 7.364 1.00 0.00 H new ATOM 0 HA VAL A 629 -0.674 0.088 7.536 1.00 0.00 H new ATOM 0 HB VAL A 629 -0.846 -2.862 8.245 1.00 0.00 H new ATOM 0 HG11 VAL A 629 -3.268 -2.432 8.278 1.00 0.00 H new ATOM 0 HG12 VAL A 629 -2.400 -1.421 9.457 1.00 0.00 H new ATOM 0 HG13 VAL A 629 -2.964 -0.715 7.924 1.00 0.00 H new ATOM 0 HG21 VAL A 629 -2.167 -3.132 6.183 1.00 0.00 H new ATOM 0 HG22 VAL A 629 -1.814 -1.445 5.741 1.00 0.00 H new ATOM 0 HG23 VAL A 629 -0.494 -2.635 5.836 1.00 0.00 H new ATOM 1456 N TRP A 630 -0.166 0.460 9.943 1.00 0.00 N ATOM 1457 CA TRP A 630 0.153 0.723 11.341 1.00 0.00 C ATOM 1458 C TRP A 630 -1.103 0.976 12.162 1.00 0.00 C ATOM 1459 O TRP A 630 -2.056 1.585 11.678 1.00 0.00 O ATOM 1460 CB TRP A 630 1.068 1.936 11.437 1.00 0.00 C ATOM 1461 CG TRP A 630 2.309 1.813 10.615 1.00 0.00 C ATOM 1462 CD1 TRP A 630 2.403 1.905 9.258 1.00 0.00 C ATOM 1463 CD2 TRP A 630 3.633 1.570 11.095 1.00 0.00 C ATOM 1464 NE1 TRP A 630 3.710 1.754 8.864 1.00 0.00 N ATOM 1465 CE2 TRP A 630 4.484 1.540 9.975 1.00 0.00 C ATOM 1466 CE3 TRP A 630 4.179 1.382 12.364 1.00 0.00 C ATOM 1467 CZ2 TRP A 630 5.856 1.328 10.090 1.00 0.00 C ATOM 1468 CZ3 TRP A 630 5.538 1.168 12.478 1.00 0.00 C ATOM 1469 CH2 TRP A 630 6.365 1.143 11.348 1.00 0.00 C ATOM 0 H TRP A 630 -0.644 1.225 9.467 1.00 0.00 H new ATOM 0 HA TRP A 630 0.652 -0.159 11.743 1.00 0.00 H new ATOM 0 HB2 TRP A 630 0.518 2.822 11.120 1.00 0.00 H new ATOM 0 HB3 TRP A 630 1.346 2.090 12.480 1.00 0.00 H new ATOM 0 HD1 TRP A 630 1.571 2.072 8.590 1.00 0.00 H new ATOM 0 HE1 TRP A 630 4.049 1.794 7.903 1.00 0.00 H new ATOM 0 HE3 TRP A 630 3.550 1.403 13.242 1.00 0.00 H new ATOM 0 HZ2 TRP A 630 6.495 1.310 9.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 630 5.971 1.017 13.456 1.00 0.00 H new ATOM 0 HH2 TRP A 630 7.425 0.975 11.471 1.00 0.00 H new ATOM 1480 N ASP A 631 -1.093 0.521 13.413 1.00 0.00 N ATOM 1481 CA ASP A 631 -2.233 0.718 14.302 1.00 0.00 C ATOM 1482 C ASP A 631 -2.158 2.090 14.969 1.00 0.00 C ATOM 1483 O ASP A 631 -1.256 2.362 15.761 1.00 0.00 O ATOM 1484 CB ASP A 631 -2.296 -0.398 15.356 1.00 0.00 C ATOM 1485 CG ASP A 631 -2.874 0.065 16.682 1.00 0.00 C ATOM 1486 OD1 ASP A 631 -2.152 0.745 17.441 1.00 0.00 O ATOM 1487 OD2 ASP A 631 -4.049 -0.254 16.961 1.00 0.00 O ATOM 0 H ASP A 631 -0.312 0.016 13.831 1.00 0.00 H new ATOM 0 HA ASP A 631 -3.146 0.675 13.708 1.00 0.00 H new ATOM 0 HB2 ASP A 631 -2.900 -1.220 14.971 1.00 0.00 H new ATOM 0 HB3 ASP A 631 -1.293 -0.790 15.521 1.00 0.00 H new ATOM 1492 N TYR A 632 -3.113 2.946 14.633 1.00 0.00 N ATOM 1493 CA TYR A 632 -3.173 4.293 15.183 1.00 0.00 C ATOM 1494 C TYR A 632 -3.562 4.272 16.658 1.00 0.00 C ATOM 1495 O TYR A 632 -4.089 3.279 17.159 1.00 0.00 O ATOM 1496 CB TYR A 632 -4.177 5.130 14.391 1.00 0.00 C ATOM 1497 CG TYR A 632 -4.292 6.558 14.866 1.00 0.00 C ATOM 1498 CD1 TYR A 632 -5.035 6.878 15.994 1.00 0.00 C ATOM 1499 CD2 TYR A 632 -3.660 7.588 14.182 1.00 0.00 C ATOM 1500 CE1 TYR A 632 -5.143 8.186 16.430 1.00 0.00 C ATOM 1501 CE2 TYR A 632 -3.762 8.897 14.609 1.00 0.00 C ATOM 1502 CZ TYR A 632 -4.504 9.191 15.734 1.00 0.00 C ATOM 1503 OH TYR A 632 -4.610 10.495 16.163 1.00 0.00 O ATOM 0 H TYR A 632 -3.863 2.729 13.976 1.00 0.00 H new ATOM 0 HA TYR A 632 -2.181 4.738 15.102 1.00 0.00 H new ATOM 0 HB2 TYR A 632 -3.887 5.129 13.340 1.00 0.00 H new ATOM 0 HB3 TYR A 632 -5.157 4.657 14.452 1.00 0.00 H new ATOM 0 HD1 TYR A 632 -5.537 6.093 16.540 1.00 0.00 H new ATOM 0 HD2 TYR A 632 -3.079 7.361 13.301 1.00 0.00 H new ATOM 0 HE1 TYR A 632 -5.724 8.419 17.310 1.00 0.00 H new ATOM 0 HE2 TYR A 632 -3.264 9.686 14.065 1.00 0.00 H new ATOM 0 HH TYR A 632 -4.100 11.079 15.563 1.00 0.00 H new ATOM 1513 N ASP A 633 -3.299 5.379 17.346 1.00 0.00 N ATOM 1514 CA ASP A 633 -3.621 5.500 18.763 1.00 0.00 C ATOM 1515 C ASP A 633 -3.684 6.967 19.179 1.00 0.00 C ATOM 1516 O ASP A 633 -2.740 7.724 18.955 1.00 0.00 O ATOM 1517 CB ASP A 633 -2.583 4.760 19.609 1.00 0.00 C ATOM 1518 CG ASP A 633 -3.131 3.480 20.209 1.00 0.00 C ATOM 1519 OD1 ASP A 633 -4.328 3.190 19.998 1.00 0.00 O ATOM 1520 OD2 ASP A 633 -2.364 2.766 20.889 1.00 0.00 O ATOM 0 H ASP A 633 -2.862 6.208 16.943 1.00 0.00 H new ATOM 0 HA ASP A 633 -4.600 5.050 18.930 1.00 0.00 H new ATOM 0 HB2 ASP A 633 -1.715 4.526 18.992 1.00 0.00 H new ATOM 0 HB3 ASP A 633 -2.238 5.414 20.409 1.00 0.00 H new ATOM 1525 N ILE A 634 -4.799 7.362 19.785 1.00 0.00 N ATOM 1526 CA ILE A 634 -4.974 8.742 20.229 1.00 0.00 C ATOM 1527 C ILE A 634 -4.422 8.943 21.635 1.00 0.00 C ATOM 1528 O ILE A 634 -4.655 8.129 22.527 1.00 0.00 O ATOM 1529 CB ILE A 634 -6.455 9.181 20.209 1.00 0.00 C ATOM 1530 CG1 ILE A 634 -7.389 7.977 20.365 1.00 0.00 C ATOM 1531 CG2 ILE A 634 -6.762 9.944 18.929 1.00 0.00 C ATOM 1532 CD1 ILE A 634 -7.625 7.213 19.080 1.00 0.00 C ATOM 0 H ILE A 634 -5.592 6.750 19.980 1.00 0.00 H new ATOM 0 HA ILE A 634 -4.418 9.359 19.523 1.00 0.00 H new ATOM 0 HB ILE A 634 -6.627 9.844 21.057 1.00 0.00 H new ATOM 0 HG12 ILE A 634 -6.970 7.298 21.108 1.00 0.00 H new ATOM 0 HG13 ILE A 634 -8.348 8.321 20.753 1.00 0.00 H new ATOM 0 HG21 ILE A 634 -7.809 10.247 18.928 1.00 0.00 H new ATOM 0 HG22 ILE A 634 -6.128 10.829 18.872 1.00 0.00 H new ATOM 0 HG23 ILE A 634 -6.569 9.303 18.068 1.00 0.00 H new ATOM 0 HD11 ILE A 634 -8.296 6.376 19.272 1.00 0.00 H new ATOM 0 HD12 ILE A 634 -8.074 7.875 18.340 1.00 0.00 H new ATOM 0 HD13 ILE A 634 -6.675 6.837 18.701 1.00 0.00 H new ATOM 1544 N GLY A 635 -3.690 10.036 21.822 1.00 0.00 N ATOM 1545 CA GLY A 635 -3.115 10.332 23.121 1.00 0.00 C ATOM 1546 C GLY A 635 -1.809 9.599 23.363 1.00 0.00 C ATOM 1547 O GLY A 635 -1.058 9.944 24.275 1.00 0.00 O ATOM 0 H GLY A 635 -3.485 10.723 21.096 1.00 0.00 H new ATOM 0 HA2 GLY A 635 -2.945 11.406 23.203 1.00 0.00 H new ATOM 0 HA3 GLY A 635 -3.828 10.062 23.900 1.00 0.00 H new ATOM 1551 N LYS A 636 -1.537 8.585 22.547 1.00 0.00 N ATOM 1552 CA LYS A 636 -0.314 7.804 22.681 1.00 0.00 C ATOM 1553 C LYS A 636 0.385 7.653 21.334 1.00 0.00 C ATOM 1554 O LYS A 636 0.071 8.359 20.376 1.00 0.00 O ATOM 1555 CB LYS A 636 -0.623 6.423 23.264 1.00 0.00 C ATOM 1556 CG LYS A 636 -1.845 6.399 24.166 1.00 0.00 C ATOM 1557 CD LYS A 636 -1.504 5.883 25.555 1.00 0.00 C ATOM 1558 CE LYS A 636 -1.692 4.377 25.653 1.00 0.00 C ATOM 1559 NZ LYS A 636 -0.434 3.638 25.352 1.00 0.00 N ATOM 0 H LYS A 636 -2.147 8.286 21.787 1.00 0.00 H new ATOM 0 HA LYS A 636 0.352 8.336 23.360 1.00 0.00 H new ATOM 0 HB2 LYS A 636 -0.773 5.719 22.446 1.00 0.00 H new ATOM 0 HB3 LYS A 636 0.242 6.076 23.830 1.00 0.00 H new ATOM 0 HG2 LYS A 636 -2.262 7.403 24.242 1.00 0.00 H new ATOM 0 HG3 LYS A 636 -2.614 5.768 23.721 1.00 0.00 H new ATOM 0 HD2 LYS A 636 -0.472 6.138 25.796 1.00 0.00 H new ATOM 0 HD3 LYS A 636 -2.135 6.378 26.293 1.00 0.00 H new ATOM 0 HE2 LYS A 636 -2.034 4.119 26.655 1.00 0.00 H new ATOM 0 HE3 LYS A 636 -2.472 4.063 24.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 636 -0.605 2.615 25.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 636 -0.121 3.864 24.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 636 0.304 3.918 26.029 1.00 0.00 H new ATOM 1573 N SER A 637 1.335 6.725 21.269 1.00 0.00 N ATOM 1574 CA SER A 637 2.079 6.478 20.039 1.00 0.00 C ATOM 1575 C SER A 637 1.403 5.394 19.206 1.00 0.00 C ATOM 1576 O SER A 637 0.631 4.588 19.726 1.00 0.00 O ATOM 1577 CB SER A 637 3.516 6.067 20.364 1.00 0.00 C ATOM 1578 OG SER A 637 4.408 6.476 19.341 1.00 0.00 O ATOM 0 H SER A 637 1.607 6.132 22.053 1.00 0.00 H new ATOM 0 HA SER A 637 2.095 7.401 19.459 1.00 0.00 H new ATOM 0 HB2 SER A 637 3.818 6.510 21.313 1.00 0.00 H new ATOM 0 HB3 SER A 637 3.569 4.985 20.486 1.00 0.00 H new ATOM 0 HG SER A 637 5.320 6.203 19.574 1.00 0.00 H new ATOM 1584 N ASN A 638 1.698 5.379 17.911 1.00 0.00 N ATOM 1585 CA ASN A 638 1.118 4.391 17.009 1.00 0.00 C ATOM 1586 C ASN A 638 1.710 3.009 17.264 1.00 0.00 C ATOM 1587 O ASN A 638 2.328 2.770 18.301 1.00 0.00 O ATOM 1588 CB ASN A 638 1.347 4.799 15.552 1.00 0.00 C ATOM 1589 CG ASN A 638 1.438 6.303 15.382 1.00 0.00 C ATOM 1590 OD1 ASN A 638 2.486 6.903 15.616 1.00 0.00 O ATOM 1591 ND2 ASN A 638 0.334 6.920 14.974 1.00 0.00 N ATOM 0 H ASN A 638 2.334 6.038 17.463 1.00 0.00 H new ATOM 0 HA ASN A 638 0.046 4.348 17.200 1.00 0.00 H new ATOM 0 HB2 ASN A 638 2.266 4.338 15.188 1.00 0.00 H new ATOM 0 HB3 ASN A 638 0.533 4.415 14.937 1.00 0.00 H new ATOM 0 HD21 ASN A 638 0.334 7.932 14.843 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -0.513 6.382 14.792 1.00 0.00 H new ATOM 1598 N ASP A 639 1.516 2.103 16.312 1.00 0.00 N ATOM 1599 CA ASP A 639 2.028 0.744 16.434 1.00 0.00 C ATOM 1600 C ASP A 639 2.106 0.076 15.067 1.00 0.00 C ATOM 1601 O ASP A 639 1.225 0.258 14.227 1.00 0.00 O ATOM 1602 CB ASP A 639 1.135 -0.078 17.365 1.00 0.00 C ATOM 1603 CG ASP A 639 0.920 0.600 18.704 1.00 0.00 C ATOM 1604 OD1 ASP A 639 0.021 1.462 18.795 1.00 0.00 O ATOM 1605 OD2 ASP A 639 1.648 0.266 19.663 1.00 0.00 O ATOM 0 H ASP A 639 1.007 2.286 15.447 1.00 0.00 H new ATOM 0 HA ASP A 639 3.031 0.793 16.857 1.00 0.00 H new ATOM 0 HB2 ASP A 639 0.170 -0.245 16.886 1.00 0.00 H new ATOM 0 HB3 ASP A 639 1.585 -1.058 17.525 1.00 0.00 H new ATOM 1610 N TYR A 640 3.163 -0.696 14.848 1.00 0.00 N ATOM 1611 CA TYR A 640 3.348 -1.386 13.580 1.00 0.00 C ATOM 1612 C TYR A 640 2.505 -2.653 13.514 1.00 0.00 C ATOM 1613 O TYR A 640 2.617 -3.531 14.369 1.00 0.00 O ATOM 1614 CB TYR A 640 4.822 -1.737 13.368 1.00 0.00 C ATOM 1615 CG TYR A 640 5.136 -2.180 11.957 1.00 0.00 C ATOM 1616 CD1 TYR A 640 4.514 -1.583 10.867 1.00 0.00 C ATOM 1617 CD2 TYR A 640 6.048 -3.199 11.713 1.00 0.00 C ATOM 1618 CE1 TYR A 640 4.794 -1.987 9.575 1.00 0.00 C ATOM 1619 CE2 TYR A 640 6.334 -3.607 10.424 1.00 0.00 C ATOM 1620 CZ TYR A 640 5.705 -3.000 9.359 1.00 0.00 C ATOM 1621 OH TYR A 640 5.987 -3.404 8.075 1.00 0.00 O ATOM 0 H TYR A 640 3.903 -0.859 15.531 1.00 0.00 H new ATOM 0 HA TYR A 640 3.023 -0.711 12.788 1.00 0.00 H new ATOM 0 HB2 TYR A 640 5.434 -0.869 13.613 1.00 0.00 H new ATOM 0 HB3 TYR A 640 5.102 -2.530 14.061 1.00 0.00 H new ATOM 0 HD1 TYR A 640 3.800 -0.790 11.032 1.00 0.00 H new ATOM 0 HD2 TYR A 640 6.542 -3.680 12.544 1.00 0.00 H new ATOM 0 HE1 TYR A 640 4.302 -1.512 8.739 1.00 0.00 H new ATOM 0 HE2 TYR A 640 7.048 -4.399 10.252 1.00 0.00 H new ATOM 0 HH TYR A 640 5.777 -4.356 7.978 1.00 0.00 H new ATOM 1631 N ILE A 641 1.669 -2.742 12.488 1.00 0.00 N ATOM 1632 CA ILE A 641 0.815 -3.905 12.300 1.00 0.00 C ATOM 1633 C ILE A 641 1.388 -4.819 11.223 1.00 0.00 C ATOM 1634 O ILE A 641 1.312 -6.044 11.328 1.00 0.00 O ATOM 1635 CB ILE A 641 -0.622 -3.495 11.919 1.00 0.00 C ATOM 1636 CG1 ILE A 641 -1.337 -2.888 13.129 1.00 0.00 C ATOM 1637 CG2 ILE A 641 -1.397 -4.691 11.386 1.00 0.00 C ATOM 1638 CD1 ILE A 641 -2.787 -2.542 12.864 1.00 0.00 C ATOM 0 H ILE A 641 1.565 -2.022 11.773 1.00 0.00 H new ATOM 0 HA ILE A 641 0.779 -4.441 13.249 1.00 0.00 H new ATOM 0 HB ILE A 641 -0.571 -2.743 11.131 1.00 0.00 H new ATOM 0 HG12 ILE A 641 -1.286 -3.590 13.961 1.00 0.00 H new ATOM 0 HG13 ILE A 641 -0.808 -1.987 13.439 1.00 0.00 H new ATOM 0 HG21 ILE A 641 -2.408 -4.381 11.123 1.00 0.00 H new ATOM 0 HG22 ILE A 641 -0.896 -5.084 10.501 1.00 0.00 H new ATOM 0 HG23 ILE A 641 -1.442 -5.466 12.152 1.00 0.00 H new ATOM 0 HD11 ILE A 641 -3.230 -2.117 13.765 1.00 0.00 H new ATOM 0 HD12 ILE A 641 -2.845 -1.816 12.053 1.00 0.00 H new ATOM 0 HD13 ILE A 641 -3.331 -3.444 12.583 1.00 0.00 H new ATOM 1650 N GLY A 642 1.971 -4.216 10.190 1.00 0.00 N ATOM 1651 CA GLY A 642 2.556 -4.992 9.114 1.00 0.00 C ATOM 1652 C GLY A 642 2.392 -4.329 7.762 1.00 0.00 C ATOM 1653 O GLY A 642 1.532 -3.465 7.586 1.00 0.00 O ATOM 0 H GLY A 642 2.048 -3.205 10.080 1.00 0.00 H new ATOM 0 HA2 GLY A 642 3.617 -5.142 9.315 1.00 0.00 H new ATOM 0 HA3 GLY A 642 2.093 -5.979 9.089 1.00 0.00 H new ATOM 1657 N GLY A 643 3.221 -4.731 6.806 1.00 0.00 N ATOM 1658 CA GLY A 643 3.153 -4.160 5.473 1.00 0.00 C ATOM 1659 C GLY A 643 3.673 -5.103 4.406 1.00 0.00 C ATOM 1660 O GLY A 643 3.767 -6.310 4.625 1.00 0.00 O ATOM 0 H GLY A 643 3.940 -5.443 6.930 1.00 0.00 H new ATOM 0 HA2 GLY A 643 2.120 -3.897 5.247 1.00 0.00 H new ATOM 0 HA3 GLY A 643 3.730 -3.236 5.448 1.00 0.00 H new ATOM 1664 N CYS A 644 4.010 -4.546 3.247 1.00 0.00 N ATOM 1665 CA CYS A 644 4.524 -5.341 2.137 1.00 0.00 C ATOM 1666 C CYS A 644 5.135 -4.441 1.067 1.00 0.00 C ATOM 1667 O CYS A 644 4.761 -3.276 0.935 1.00 0.00 O ATOM 1668 CB CYS A 644 3.405 -6.189 1.529 1.00 0.00 C ATOM 1669 SG CYS A 644 3.607 -7.967 1.778 1.00 0.00 S ATOM 0 H CYS A 644 3.936 -3.548 3.052 1.00 0.00 H new ATOM 0 HA CYS A 644 5.301 -6.001 2.521 1.00 0.00 H new ATOM 0 HB2 CYS A 644 2.453 -5.879 1.960 1.00 0.00 H new ATOM 0 HB3 CYS A 644 3.351 -5.987 0.459 1.00 0.00 H new ATOM 0 HG CYS A 644 2.916 -8.341 2.814 1.00 0.00 H new ATOM 1675 N GLN A 645 6.079 -4.987 0.307 1.00 0.00 N ATOM 1676 CA GLN A 645 6.738 -4.229 -0.750 1.00 0.00 C ATOM 1677 C GLN A 645 6.262 -4.682 -2.126 1.00 0.00 C ATOM 1678 O GLN A 645 6.113 -5.876 -2.382 1.00 0.00 O ATOM 1679 CB GLN A 645 8.258 -4.380 -0.643 1.00 0.00 C ATOM 1680 CG GLN A 645 8.809 -5.584 -1.389 1.00 0.00 C ATOM 1681 CD GLN A 645 10.014 -6.194 -0.703 1.00 0.00 C ATOM 1682 OE1 GLN A 645 10.644 -5.564 0.146 1.00 0.00 O ATOM 1683 NE2 GLN A 645 10.342 -7.428 -1.067 1.00 0.00 N ATOM 0 H GLN A 645 6.404 -5.949 0.403 1.00 0.00 H new ATOM 0 HA GLN A 645 6.476 -3.178 -0.627 1.00 0.00 H new ATOM 0 HB2 GLN A 645 8.731 -3.477 -1.029 1.00 0.00 H new ATOM 0 HB3 GLN A 645 8.533 -4.459 0.409 1.00 0.00 H new ATOM 0 HG2 GLN A 645 8.028 -6.338 -1.481 1.00 0.00 H new ATOM 0 HG3 GLN A 645 9.084 -5.285 -2.400 1.00 0.00 H new ATOM 0 HE21 GLN A 645 9.792 -7.914 -1.775 1.00 0.00 H new ATOM 0 HE22 GLN A 645 11.144 -7.890 -0.638 1.00 0.00 H new ATOM 1692 N LEU A 646 6.026 -3.718 -3.009 1.00 0.00 N ATOM 1693 CA LEU A 646 5.566 -4.013 -4.360 1.00 0.00 C ATOM 1694 C LEU A 646 6.502 -3.403 -5.398 1.00 0.00 C ATOM 1695 O LEU A 646 6.310 -2.267 -5.831 1.00 0.00 O ATOM 1696 CB LEU A 646 4.146 -3.483 -4.564 1.00 0.00 C ATOM 1697 CG LEU A 646 3.034 -4.398 -4.051 1.00 0.00 C ATOM 1698 CD1 LEU A 646 1.671 -3.859 -4.457 1.00 0.00 C ATOM 1699 CD2 LEU A 646 3.227 -5.815 -4.572 1.00 0.00 C ATOM 0 H LEU A 646 6.146 -2.724 -2.813 1.00 0.00 H new ATOM 0 HA LEU A 646 5.565 -5.095 -4.489 1.00 0.00 H new ATOM 0 HB2 LEU A 646 4.060 -2.517 -4.066 1.00 0.00 H new ATOM 0 HB3 LEU A 646 3.989 -3.308 -5.628 1.00 0.00 H new ATOM 0 HG LEU A 646 3.082 -4.423 -2.962 1.00 0.00 H new ATOM 0 HD11 LEU A 646 0.891 -4.523 -4.083 1.00 0.00 H new ATOM 0 HD12 LEU A 646 1.533 -2.864 -4.035 1.00 0.00 H new ATOM 0 HD13 LEU A 646 1.611 -3.804 -5.544 1.00 0.00 H new ATOM 0 HD21 LEU A 646 2.427 -6.453 -4.197 1.00 0.00 H new ATOM 0 HD22 LEU A 646 3.205 -5.808 -5.662 1.00 0.00 H new ATOM 0 HD23 LEU A 646 4.188 -6.200 -4.231 1.00 0.00 H new ATOM 1711 N GLY A 647 7.510 -4.169 -5.796 1.00 0.00 N ATOM 1712 CA GLY A 647 8.459 -3.693 -6.783 1.00 0.00 C ATOM 1713 C GLY A 647 8.754 -4.741 -7.834 1.00 0.00 C ATOM 1714 O GLY A 647 8.803 -5.933 -7.529 1.00 0.00 O ATOM 0 H GLY A 647 7.687 -5.113 -5.452 1.00 0.00 H new ATOM 0 HA2 GLY A 647 8.064 -2.798 -7.264 1.00 0.00 H new ATOM 0 HA3 GLY A 647 9.386 -3.406 -6.286 1.00 0.00 H new ATOM 1718 N ILE A 648 8.937 -4.305 -9.075 1.00 0.00 N ATOM 1719 CA ILE A 648 9.210 -5.215 -10.162 1.00 0.00 C ATOM 1720 C ILE A 648 10.455 -6.062 -9.896 1.00 0.00 C ATOM 1721 O ILE A 648 10.691 -7.065 -10.569 1.00 0.00 O ATOM 1722 CB ILE A 648 9.345 -4.445 -11.487 1.00 0.00 C ATOM 1723 CG1 ILE A 648 8.720 -5.238 -12.616 1.00 0.00 C ATOM 1724 CG2 ILE A 648 10.789 -4.099 -11.797 1.00 0.00 C ATOM 1725 CD1 ILE A 648 9.095 -4.741 -13.992 1.00 0.00 C ATOM 0 H ILE A 648 8.900 -3.322 -9.346 1.00 0.00 H new ATOM 0 HA ILE A 648 8.365 -5.899 -10.240 1.00 0.00 H new ATOM 0 HB ILE A 648 8.810 -3.501 -11.382 1.00 0.00 H new ATOM 0 HG12 ILE A 648 9.019 -6.282 -12.523 1.00 0.00 H new ATOM 0 HG13 ILE A 648 7.635 -5.207 -12.512 1.00 0.00 H new ATOM 0 HG21 ILE A 648 10.838 -3.556 -12.741 1.00 0.00 H new ATOM 0 HG22 ILE A 648 11.193 -3.477 -10.999 1.00 0.00 H new ATOM 0 HG23 ILE A 648 11.374 -5.015 -11.875 1.00 0.00 H new ATOM 0 HD11 ILE A 648 8.609 -5.359 -14.747 1.00 0.00 H new ATOM 0 HD12 ILE A 648 8.771 -3.707 -14.106 1.00 0.00 H new ATOM 0 HD13 ILE A 648 10.176 -4.798 -14.117 1.00 0.00 H new ATOM 1737 N SER A 649 11.240 -5.662 -8.902 1.00 0.00 N ATOM 1738 CA SER A 649 12.444 -6.399 -8.542 1.00 0.00 C ATOM 1739 C SER A 649 12.112 -7.482 -7.521 1.00 0.00 C ATOM 1740 O SER A 649 12.999 -8.028 -6.863 1.00 0.00 O ATOM 1741 CB SER A 649 13.500 -5.449 -7.974 1.00 0.00 C ATOM 1742 OG SER A 649 14.693 -6.143 -7.655 1.00 0.00 O ATOM 0 H SER A 649 11.064 -4.834 -8.333 1.00 0.00 H new ATOM 0 HA SER A 649 12.844 -6.870 -9.440 1.00 0.00 H new ATOM 0 HB2 SER A 649 13.715 -4.664 -8.699 1.00 0.00 H new ATOM 0 HB3 SER A 649 13.111 -4.960 -7.081 1.00 0.00 H new ATOM 0 HG SER A 649 14.471 -6.985 -7.204 1.00 0.00 H new ATOM 1748 N ALA A 650 10.821 -7.782 -7.392 1.00 0.00 N ATOM 1749 CA ALA A 650 10.352 -8.791 -6.452 1.00 0.00 C ATOM 1750 C ALA A 650 10.190 -10.149 -7.126 1.00 0.00 C ATOM 1751 O ALA A 650 10.579 -10.333 -8.279 1.00 0.00 O ATOM 1752 CB ALA A 650 9.030 -8.352 -5.839 1.00 0.00 C ATOM 0 H ALA A 650 10.079 -7.336 -7.932 1.00 0.00 H new ATOM 0 HA ALA A 650 11.101 -8.895 -5.667 1.00 0.00 H new ATOM 0 HB1 ALA A 650 8.685 -9.111 -5.137 1.00 0.00 H new ATOM 0 HB2 ALA A 650 9.169 -7.407 -5.313 1.00 0.00 H new ATOM 0 HB3 ALA A 650 8.288 -8.223 -6.627 1.00 0.00 H new ATOM 1802 N ARG A 654 4.143 -10.086 -5.691 1.00 0.00 N ATOM 1803 CA ARG A 654 4.526 -8.684 -5.590 1.00 0.00 C ATOM 1804 C ARG A 654 4.923 -8.130 -6.953 1.00 0.00 C ATOM 1805 O ARG A 654 4.825 -6.928 -7.199 1.00 0.00 O ATOM 1806 CB ARG A 654 5.684 -8.524 -4.606 1.00 0.00 C ATOM 1807 CG ARG A 654 5.619 -9.480 -3.426 1.00 0.00 C ATOM 1808 CD ARG A 654 5.756 -8.742 -2.114 1.00 0.00 C ATOM 1809 NE ARG A 654 6.206 -9.616 -1.035 1.00 0.00 N ATOM 1810 CZ ARG A 654 7.469 -10.000 -0.876 1.00 0.00 C ATOM 1811 NH1 ARG A 654 8.402 -9.582 -1.721 1.00 0.00 N ATOM 1812 NH2 ARG A 654 7.800 -10.799 0.130 1.00 0.00 N ATOM 0 HA ARG A 654 3.666 -8.122 -5.226 1.00 0.00 H new ATOM 0 HB2 ARG A 654 6.624 -8.678 -5.136 1.00 0.00 H new ATOM 0 HB3 ARG A 654 5.693 -7.500 -4.233 1.00 0.00 H new ATOM 0 HG2 ARG A 654 4.673 -10.021 -3.445 1.00 0.00 H new ATOM 0 HG3 ARG A 654 6.412 -10.223 -3.513 1.00 0.00 H new ATOM 0 HD2 ARG A 654 6.463 -7.921 -2.233 1.00 0.00 H new ATOM 0 HD3 ARG A 654 4.796 -8.300 -1.845 1.00 0.00 H new ATOM 0 HE ARG A 654 5.513 -9.951 -0.366 1.00 0.00 H new ATOM 0 HH11 ARG A 654 8.151 -8.965 -2.494 1.00 0.00 H new ATOM 0 HH12 ARG A 654 9.371 -9.877 -1.598 1.00 0.00 H new ATOM 0 HH21 ARG A 654 7.085 -11.120 0.783 1.00 0.00 H new ATOM 0 HH22 ARG A 654 8.769 -11.093 0.250 1.00 0.00 H new ATOM 1826 N LEU A 655 5.376 -9.016 -7.832 1.00 0.00 N ATOM 1827 CA LEU A 655 5.794 -8.618 -9.172 1.00 0.00 C ATOM 1828 C LEU A 655 4.617 -8.633 -10.141 1.00 0.00 C ATOM 1829 O LEU A 655 4.466 -7.731 -10.965 1.00 0.00 O ATOM 1830 CB LEU A 655 6.895 -9.549 -9.680 1.00 0.00 C ATOM 1831 CG LEU A 655 7.431 -9.216 -11.074 1.00 0.00 C ATOM 1832 CD1 LEU A 655 8.359 -8.015 -11.012 1.00 0.00 C ATOM 1833 CD2 LEU A 655 8.149 -10.418 -11.669 1.00 0.00 C ATOM 0 H LEU A 655 5.463 -10.014 -7.642 1.00 0.00 H new ATOM 0 HA LEU A 655 6.180 -7.600 -9.116 1.00 0.00 H new ATOM 0 HB2 LEU A 655 7.724 -9.526 -8.973 1.00 0.00 H new ATOM 0 HB3 LEU A 655 6.512 -10.569 -9.689 1.00 0.00 H new ATOM 0 HG LEU A 655 6.588 -8.966 -11.719 1.00 0.00 H new ATOM 0 HD11 LEU A 655 8.732 -7.791 -12.012 1.00 0.00 H new ATOM 0 HD12 LEU A 655 7.814 -7.153 -10.627 1.00 0.00 H new ATOM 0 HD13 LEU A 655 9.198 -8.237 -10.353 1.00 0.00 H new ATOM 0 HD21 LEU A 655 8.524 -10.164 -12.660 1.00 0.00 H new ATOM 0 HD22 LEU A 655 8.984 -10.698 -11.026 1.00 0.00 H new ATOM 0 HD23 LEU A 655 7.455 -11.255 -11.747 1.00 0.00 H new ATOM 1845 N LYS A 656 3.790 -9.667 -10.042 1.00 0.00 N ATOM 1846 CA LYS A 656 2.629 -9.806 -10.914 1.00 0.00 C ATOM 1847 C LYS A 656 1.732 -8.575 -10.841 1.00 0.00 C ATOM 1848 O LYS A 656 1.462 -7.933 -11.853 1.00 0.00 O ATOM 1849 CB LYS A 656 1.831 -11.055 -10.537 1.00 0.00 C ATOM 1850 CG LYS A 656 2.483 -12.353 -10.988 1.00 0.00 C ATOM 1851 CD LYS A 656 1.527 -13.528 -10.871 1.00 0.00 C ATOM 1852 CE LYS A 656 2.260 -14.808 -10.501 1.00 0.00 C ATOM 1853 NZ LYS A 656 1.323 -15.950 -10.312 1.00 0.00 N ATOM 0 H LYS A 656 3.902 -10.423 -9.366 1.00 0.00 H new ATOM 0 HA LYS A 656 2.989 -9.905 -11.938 1.00 0.00 H new ATOM 0 HB2 LYS A 656 1.701 -11.080 -9.455 1.00 0.00 H new ATOM 0 HB3 LYS A 656 0.836 -10.986 -10.976 1.00 0.00 H new ATOM 0 HG2 LYS A 656 2.815 -12.254 -12.022 1.00 0.00 H new ATOM 0 HG3 LYS A 656 3.371 -12.544 -10.385 1.00 0.00 H new ATOM 0 HD2 LYS A 656 0.771 -13.310 -10.117 1.00 0.00 H new ATOM 0 HD3 LYS A 656 1.003 -13.668 -11.817 1.00 0.00 H new ATOM 0 HE2 LYS A 656 2.979 -15.054 -11.283 1.00 0.00 H new ATOM 0 HE3 LYS A 656 2.828 -14.649 -9.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 656 1.862 -16.803 -10.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 656 0.653 -15.727 -9.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 656 0.799 -16.119 -11.194 1.00 0.00 H new ATOM 1867 N HIS A 657 1.272 -8.249 -9.639 1.00 0.00 N ATOM 1868 CA HIS A 657 0.402 -7.096 -9.441 1.00 0.00 C ATOM 1869 C HIS A 657 1.088 -5.812 -9.889 1.00 0.00 C ATOM 1870 O HIS A 657 0.566 -5.067 -10.719 1.00 0.00 O ATOM 1871 CB HIS A 657 0.004 -6.982 -7.969 1.00 0.00 C ATOM 1872 CG HIS A 657 -0.872 -5.806 -7.672 1.00 0.00 C ATOM 1873 ND1 HIS A 657 -1.255 -5.456 -6.394 1.00 0.00 N ATOM 1874 CD2 HIS A 657 -1.443 -4.894 -8.497 1.00 0.00 C ATOM 1875 CE1 HIS A 657 -2.022 -4.382 -6.445 1.00 0.00 C ATOM 1876 NE2 HIS A 657 -2.151 -4.022 -7.709 1.00 0.00 N ATOM 0 H HIS A 657 1.487 -8.767 -8.787 1.00 0.00 H new ATOM 0 HA HIS A 657 -0.493 -7.240 -10.047 1.00 0.00 H new ATOM 0 HB2 HIS A 657 -0.513 -7.894 -7.670 1.00 0.00 H new ATOM 0 HB3 HIS A 657 0.907 -6.914 -7.362 1.00 0.00 H new ATOM 0 HD2 HIS A 657 -1.357 -4.860 -9.573 1.00 0.00 H new ATOM 0 HE1 HIS A 657 -2.468 -3.883 -5.597 1.00 0.00 H new ATOM 0 HE2 HIS A 657 -2.690 -3.224 -8.045 1.00 0.00 H new ATOM 1885 N TRP A 658 2.261 -5.561 -9.326 1.00 0.00 N ATOM 1886 CA TRP A 658 3.034 -4.369 -9.649 1.00 0.00 C ATOM 1887 C TRP A 658 3.367 -4.311 -11.139 1.00 0.00 C ATOM 1888 O TRP A 658 2.720 -3.600 -11.907 1.00 0.00 O ATOM 1889 CB TRP A 658 4.323 -4.353 -8.824 1.00 0.00 C ATOM 1890 CG TRP A 658 5.251 -3.236 -9.184 1.00 0.00 C ATOM 1891 CD1 TRP A 658 6.487 -3.349 -9.754 1.00 0.00 C ATOM 1892 CD2 TRP A 658 5.020 -1.837 -8.993 1.00 0.00 C ATOM 1893 NE1 TRP A 658 7.040 -2.103 -9.930 1.00 0.00 N ATOM 1894 CE2 TRP A 658 6.156 -1.158 -9.471 1.00 0.00 C ATOM 1895 CE3 TRP A 658 3.961 -1.094 -8.465 1.00 0.00 C ATOM 1896 CZ2 TRP A 658 6.259 0.231 -9.435 1.00 0.00 C ATOM 1897 CZ3 TRP A 658 4.065 0.283 -8.430 1.00 0.00 C ATOM 1898 CH2 TRP A 658 5.207 0.933 -8.913 1.00 0.00 C ATOM 0 H TRP A 658 2.702 -6.172 -8.638 1.00 0.00 H new ATOM 0 HA TRP A 658 2.432 -3.494 -9.405 1.00 0.00 H new ATOM 0 HB2 TRP A 658 4.067 -4.275 -7.767 1.00 0.00 H new ATOM 0 HB3 TRP A 658 4.842 -5.302 -8.957 1.00 0.00 H new ATOM 0 HD1 TRP A 658 6.960 -4.281 -10.026 1.00 0.00 H new ATOM 0 HE1 TRP A 658 7.956 -1.912 -10.335 1.00 0.00 H new ATOM 0 HE3 TRP A 658 3.076 -1.588 -8.091 1.00 0.00 H new ATOM 0 HZ2 TRP A 658 7.139 0.736 -9.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 658 3.253 0.867 -8.024 1.00 0.00 H new ATOM 0 HH2 TRP A 658 5.259 2.011 -8.873 1.00 0.00 H new ATOM 1909 N TYR A 659 4.390 -5.061 -11.527 1.00 0.00 N ATOM 1910 CA TYR A 659 4.844 -5.112 -12.912 1.00 0.00 C ATOM 1911 C TYR A 659 3.680 -5.124 -13.904 1.00 0.00 C ATOM 1912 O TYR A 659 3.536 -4.200 -14.705 1.00 0.00 O ATOM 1913 CB TYR A 659 5.718 -6.348 -13.099 1.00 0.00 C ATOM 1914 CG TYR A 659 6.538 -6.373 -14.375 1.00 0.00 C ATOM 1915 CD1 TYR A 659 6.204 -5.591 -15.476 1.00 0.00 C ATOM 1916 CD2 TYR A 659 7.652 -7.197 -14.473 1.00 0.00 C ATOM 1917 CE1 TYR A 659 6.954 -5.631 -16.633 1.00 0.00 C ATOM 1918 CE2 TYR A 659 8.407 -7.242 -15.627 1.00 0.00 C ATOM 1919 CZ TYR A 659 8.054 -6.458 -16.706 1.00 0.00 C ATOM 1920 OH TYR A 659 8.804 -6.501 -17.859 1.00 0.00 O ATOM 0 H TYR A 659 4.928 -5.651 -10.892 1.00 0.00 H new ATOM 0 HA TYR A 659 5.419 -4.209 -13.118 1.00 0.00 H new ATOM 0 HB2 TYR A 659 6.396 -6.426 -12.249 1.00 0.00 H new ATOM 0 HB3 TYR A 659 5.079 -7.231 -13.079 1.00 0.00 H new ATOM 0 HD1 TYR A 659 5.343 -4.941 -15.424 1.00 0.00 H new ATOM 0 HD2 TYR A 659 7.932 -7.813 -13.631 1.00 0.00 H new ATOM 0 HE1 TYR A 659 6.680 -5.017 -17.478 1.00 0.00 H new ATOM 0 HE2 TYR A 659 9.270 -7.888 -15.685 1.00 0.00 H new ATOM 0 HH TYR A 659 9.544 -7.133 -17.744 1.00 0.00 H new ATOM 1930 N GLU A 660 2.863 -6.170 -13.873 1.00 0.00 N ATOM 1931 CA GLU A 660 1.744 -6.264 -14.802 1.00 0.00 C ATOM 1932 C GLU A 660 1.036 -4.922 -14.913 1.00 0.00 C ATOM 1933 O GLU A 660 0.530 -4.560 -15.975 1.00 0.00 O ATOM 1934 CB GLU A 660 0.759 -7.353 -14.372 1.00 0.00 C ATOM 1935 CG GLU A 660 -0.296 -6.871 -13.389 1.00 0.00 C ATOM 1936 CD GLU A 660 -0.976 -8.013 -12.659 1.00 0.00 C ATOM 1937 OE1 GLU A 660 -0.410 -9.126 -12.639 1.00 0.00 O ATOM 1938 OE2 GLU A 660 -2.076 -7.795 -12.109 1.00 0.00 O ATOM 0 H GLU A 660 2.951 -6.953 -13.226 1.00 0.00 H new ATOM 0 HA GLU A 660 2.139 -6.536 -15.781 1.00 0.00 H new ATOM 0 HB2 GLU A 660 0.263 -7.751 -15.257 1.00 0.00 H new ATOM 0 HB3 GLU A 660 1.315 -8.175 -13.921 1.00 0.00 H new ATOM 0 HG2 GLU A 660 0.167 -6.204 -12.662 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -1.046 -6.288 -13.923 1.00 0.00 H new ATOM 1945 N CYS A 661 1.022 -4.176 -13.813 1.00 0.00 N ATOM 1946 CA CYS A 661 0.393 -2.861 -13.801 1.00 0.00 C ATOM 1947 C CYS A 661 1.074 -1.958 -14.821 1.00 0.00 C ATOM 1948 O CYS A 661 0.422 -1.179 -15.516 1.00 0.00 O ATOM 1949 CB CYS A 661 0.474 -2.238 -12.406 1.00 0.00 C ATOM 1950 SG CYS A 661 -0.600 -0.801 -12.178 1.00 0.00 S ATOM 0 H CYS A 661 1.436 -4.457 -12.924 1.00 0.00 H new ATOM 0 HA CYS A 661 -0.659 -2.972 -14.065 1.00 0.00 H new ATOM 0 HB2 CYS A 661 0.213 -2.995 -11.666 1.00 0.00 H new ATOM 0 HB3 CYS A 661 1.505 -1.943 -12.211 1.00 0.00 H new ATOM 0 HG CYS A 661 -0.768 -0.200 -13.318 1.00 0.00 H new ATOM 1956 N LEU A 662 2.394 -2.089 -14.914 1.00 0.00 N ATOM 1957 CA LEU A 662 3.180 -1.309 -15.859 1.00 0.00 C ATOM 1958 C LEU A 662 2.745 -1.623 -17.285 1.00 0.00 C ATOM 1959 O LEU A 662 2.836 -0.780 -18.177 1.00 0.00 O ATOM 1960 CB LEU A 662 4.668 -1.615 -15.687 1.00 0.00 C ATOM 1961 CG LEU A 662 5.395 -0.737 -14.668 1.00 0.00 C ATOM 1962 CD1 LEU A 662 5.599 -1.488 -13.361 1.00 0.00 C ATOM 1963 CD2 LEU A 662 6.727 -0.274 -15.228 1.00 0.00 C ATOM 0 H LEU A 662 2.942 -2.732 -14.342 1.00 0.00 H new ATOM 0 HA LEU A 662 3.014 -0.250 -15.663 1.00 0.00 H new ATOM 0 HB2 LEU A 662 4.777 -2.658 -15.389 1.00 0.00 H new ATOM 0 HB3 LEU A 662 5.160 -1.507 -16.654 1.00 0.00 H new ATOM 0 HG LEU A 662 4.779 0.139 -14.466 1.00 0.00 H new ATOM 0 HD11 LEU A 662 6.118 -0.846 -12.649 1.00 0.00 H new ATOM 0 HD12 LEU A 662 4.631 -1.775 -12.951 1.00 0.00 H new ATOM 0 HD13 LEU A 662 6.195 -2.382 -13.544 1.00 0.00 H new ATOM 0 HD21 LEU A 662 7.234 0.350 -14.492 1.00 0.00 H new ATOM 0 HD22 LEU A 662 7.347 -1.141 -15.457 1.00 0.00 H new ATOM 0 HD23 LEU A 662 6.559 0.302 -16.138 1.00 0.00 H new ATOM 1975 N LYS A 663 2.261 -2.843 -17.488 1.00 0.00 N ATOM 1976 CA LYS A 663 1.798 -3.273 -18.797 1.00 0.00 C ATOM 1977 C LYS A 663 0.385 -2.757 -19.042 1.00 0.00 C ATOM 1978 O LYS A 663 0.044 -2.333 -20.147 1.00 0.00 O ATOM 1979 CB LYS A 663 1.853 -4.807 -18.894 1.00 0.00 C ATOM 1980 CG LYS A 663 0.495 -5.490 -19.002 1.00 0.00 C ATOM 1981 CD LYS A 663 0.635 -7.003 -19.039 1.00 0.00 C ATOM 1982 CE LYS A 663 0.304 -7.559 -20.414 1.00 0.00 C ATOM 1983 NZ LYS A 663 -0.904 -8.429 -20.387 1.00 0.00 N ATOM 0 H LYS A 663 2.180 -3.552 -16.759 1.00 0.00 H new ATOM 0 HA LYS A 663 2.450 -2.860 -19.567 1.00 0.00 H new ATOM 0 HB2 LYS A 663 2.452 -5.081 -19.763 1.00 0.00 H new ATOM 0 HB3 LYS A 663 2.370 -5.194 -18.016 1.00 0.00 H new ATOM 0 HG2 LYS A 663 -0.127 -5.202 -18.155 1.00 0.00 H new ATOM 0 HG3 LYS A 663 -0.015 -5.148 -19.903 1.00 0.00 H new ATOM 0 HD2 LYS A 663 1.653 -7.282 -18.768 1.00 0.00 H new ATOM 0 HD3 LYS A 663 -0.026 -7.449 -18.296 1.00 0.00 H new ATOM 0 HE2 LYS A 663 0.142 -6.735 -21.109 1.00 0.00 H new ATOM 0 HE3 LYS A 663 1.154 -8.130 -20.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 663 -1.095 -8.788 -21.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 663 -0.741 -9.230 -19.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 663 -1.721 -7.878 -20.054 1.00 0.00 H new ATOM 1997 N ASN A 664 -0.428 -2.800 -17.994 1.00 0.00 N ATOM 1998 CA ASN A 664 -1.807 -2.340 -18.071 1.00 0.00 C ATOM 1999 C ASN A 664 -1.968 -0.984 -17.387 1.00 0.00 C ATOM 2000 O ASN A 664 -2.874 -0.793 -16.575 1.00 0.00 O ATOM 2001 CB ASN A 664 -2.742 -3.364 -17.428 1.00 0.00 C ATOM 2002 CG ASN A 664 -3.656 -4.030 -18.438 1.00 0.00 C ATOM 2003 OD1 ASN A 664 -3.837 -3.535 -19.550 1.00 0.00 O ATOM 2004 ND2 ASN A 664 -4.238 -5.160 -18.052 1.00 0.00 N ATOM 0 H ASN A 664 -0.153 -3.151 -17.076 1.00 0.00 H new ATOM 0 HA ASN A 664 -2.070 -2.228 -19.123 1.00 0.00 H new ATOM 0 HB2 ASN A 664 -2.149 -4.126 -16.922 1.00 0.00 H new ATOM 0 HB3 ASN A 664 -3.346 -2.872 -16.666 1.00 0.00 H new ATOM 0 HD21 ASN A 664 -4.864 -5.654 -18.688 1.00 0.00 H new ATOM 0 HD22 ASN A 664 -4.059 -5.534 -17.120 1.00 0.00 H new ATOM 2011 N LYS A 665 -1.083 -0.049 -17.718 1.00 0.00 N ATOM 2012 CA LYS A 665 -1.127 1.287 -17.133 1.00 0.00 C ATOM 2013 C LYS A 665 -2.566 1.744 -16.922 1.00 0.00 C ATOM 2014 O LYS A 665 -3.135 1.562 -15.845 1.00 0.00 O ATOM 2015 CB LYS A 665 -0.394 2.285 -18.031 1.00 0.00 C ATOM 2016 CG LYS A 665 1.120 2.232 -17.897 1.00 0.00 C ATOM 2017 CD LYS A 665 1.803 2.640 -19.191 1.00 0.00 C ATOM 2018 CE LYS A 665 1.486 1.666 -20.311 1.00 0.00 C ATOM 2019 NZ LYS A 665 2.311 1.924 -21.523 1.00 0.00 N ATOM 0 H LYS A 665 -0.327 -0.191 -18.388 1.00 0.00 H new ATOM 0 HA LYS A 665 -0.631 1.245 -16.163 1.00 0.00 H new ATOM 0 HB2 LYS A 665 -0.665 2.093 -19.069 1.00 0.00 H new ATOM 0 HB3 LYS A 665 -0.736 3.293 -17.794 1.00 0.00 H new ATOM 0 HG2 LYS A 665 1.439 2.892 -17.091 1.00 0.00 H new ATOM 0 HG3 LYS A 665 1.428 1.223 -17.623 1.00 0.00 H new ATOM 0 HD2 LYS A 665 1.481 3.642 -19.475 1.00 0.00 H new ATOM 0 HD3 LYS A 665 2.881 2.683 -19.038 1.00 0.00 H new ATOM 0 HE2 LYS A 665 1.658 0.647 -19.965 1.00 0.00 H new ATOM 0 HE3 LYS A 665 0.430 1.741 -20.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 665 2.064 1.237 -22.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 665 2.128 2.888 -21.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 665 3.319 1.828 -21.284 1.00 0.00 H new ATOM 2033 N ASP A 666 -3.150 2.341 -17.957 1.00 0.00 N ATOM 2034 CA ASP A 666 -4.523 2.827 -17.887 1.00 0.00 C ATOM 2035 C ASP A 666 -5.439 1.790 -17.244 1.00 0.00 C ATOM 2036 O ASP A 666 -6.483 2.130 -16.686 1.00 0.00 O ATOM 2037 CB ASP A 666 -5.035 3.179 -19.285 1.00 0.00 C ATOM 2038 CG ASP A 666 -5.968 4.374 -19.275 1.00 0.00 C ATOM 2039 OD1 ASP A 666 -5.732 5.304 -18.475 1.00 0.00 O ATOM 2040 OD2 ASP A 666 -6.933 4.379 -20.068 1.00 0.00 O ATOM 0 H ASP A 666 -2.693 2.500 -18.855 1.00 0.00 H new ATOM 0 HA ASP A 666 -4.531 3.724 -17.268 1.00 0.00 H new ATOM 0 HB2 ASP A 666 -4.187 3.389 -19.937 1.00 0.00 H new ATOM 0 HB3 ASP A 666 -5.556 2.319 -19.706 1.00 0.00 H new ATOM 2045 N LYS A 667 -5.042 0.524 -17.324 1.00 0.00 N ATOM 2046 CA LYS A 667 -5.828 -0.561 -16.747 1.00 0.00 C ATOM 2047 C LYS A 667 -5.569 -0.672 -15.250 1.00 0.00 C ATOM 2048 O LYS A 667 -4.424 -0.618 -14.803 1.00 0.00 O ATOM 2049 CB LYS A 667 -5.495 -1.884 -17.439 1.00 0.00 C ATOM 2050 CG LYS A 667 -6.399 -2.197 -18.622 1.00 0.00 C ATOM 2051 CD LYS A 667 -7.863 -1.979 -18.279 1.00 0.00 C ATOM 2052 CE LYS A 667 -8.225 -2.620 -16.950 1.00 0.00 C ATOM 2053 NZ LYS A 667 -8.127 -4.105 -17.003 1.00 0.00 N ATOM 0 H LYS A 667 -4.181 0.224 -17.782 1.00 0.00 H new ATOM 0 HA LYS A 667 -6.884 -0.340 -16.901 1.00 0.00 H new ATOM 0 HB2 LYS A 667 -4.460 -1.855 -17.781 1.00 0.00 H new ATOM 0 HB3 LYS A 667 -5.568 -2.693 -16.712 1.00 0.00 H new ATOM 0 HG2 LYS A 667 -6.125 -1.566 -19.467 1.00 0.00 H new ATOM 0 HG3 LYS A 667 -6.247 -3.231 -18.933 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -8.073 -0.910 -18.238 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -8.489 -2.396 -19.068 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -7.563 -2.240 -16.172 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -9.239 -2.333 -16.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -8.398 -4.504 -16.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -8.765 -4.469 -17.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -7.149 -4.381 -17.225 1.00 0.00 H new ATOM 2067 N LYS A 668 -6.640 -0.818 -14.478 1.00 0.00 N ATOM 2068 CA LYS A 668 -6.528 -0.926 -13.028 1.00 0.00 C ATOM 2069 C LYS A 668 -6.208 -2.353 -12.597 1.00 0.00 C ATOM 2070 O LYS A 668 -6.457 -3.310 -13.330 1.00 0.00 O ATOM 2071 CB LYS A 668 -7.822 -0.455 -12.358 1.00 0.00 C ATOM 2072 CG LYS A 668 -9.064 -1.202 -12.821 1.00 0.00 C ATOM 2073 CD LYS A 668 -9.149 -2.592 -12.209 1.00 0.00 C ATOM 2074 CE LYS A 668 -8.795 -2.578 -10.731 1.00 0.00 C ATOM 2075 NZ LYS A 668 -9.602 -1.580 -9.975 1.00 0.00 N ATOM 0 H LYS A 668 -7.596 -0.864 -14.832 1.00 0.00 H new ATOM 0 HA LYS A 668 -5.705 -0.285 -12.711 1.00 0.00 H new ATOM 0 HB2 LYS A 668 -7.723 -0.569 -11.279 1.00 0.00 H new ATOM 0 HB3 LYS A 668 -7.955 0.609 -12.555 1.00 0.00 H new ATOM 0 HG2 LYS A 668 -9.953 -0.631 -12.552 1.00 0.00 H new ATOM 0 HG3 LYS A 668 -9.055 -1.283 -13.908 1.00 0.00 H new ATOM 0 HD2 LYS A 668 -10.157 -2.985 -12.338 1.00 0.00 H new ATOM 0 HD3 LYS A 668 -8.474 -3.265 -12.738 1.00 0.00 H new ATOM 0 HE2 LYS A 668 -8.957 -3.570 -10.310 1.00 0.00 H new ATOM 0 HE3 LYS A 668 -7.735 -2.351 -10.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 668 -8.994 -0.786 -9.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 668 -10.372 -1.228 -10.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 668 -10.004 -2.029 -9.127 1.00 0.00 H new ATOM 2089 N ILE A 669 -5.656 -2.481 -11.396 1.00 0.00 N ATOM 2090 CA ILE A 669 -5.299 -3.781 -10.841 1.00 0.00 C ATOM 2091 C ILE A 669 -5.653 -3.842 -9.361 1.00 0.00 C ATOM 2092 O ILE A 669 -5.744 -2.810 -8.697 1.00 0.00 O ATOM 2093 CB ILE A 669 -3.797 -4.079 -11.013 1.00 0.00 C ATOM 2094 CG1 ILE A 669 -3.322 -3.622 -12.402 1.00 0.00 C ATOM 2095 CG2 ILE A 669 -3.531 -5.563 -10.790 1.00 0.00 C ATOM 2096 CD1 ILE A 669 -2.429 -4.617 -13.118 1.00 0.00 C ATOM 0 H ILE A 669 -5.445 -1.693 -10.784 1.00 0.00 H new ATOM 0 HA ILE A 669 -5.867 -4.533 -11.389 1.00 0.00 H new ATOM 0 HB ILE A 669 -3.230 -3.521 -10.268 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -4.195 -3.423 -13.024 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -2.784 -2.680 -12.297 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -2.467 -5.765 -10.914 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.838 -5.840 -9.782 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -4.097 -6.147 -11.515 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -2.141 -4.214 -14.089 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -1.535 -4.799 -12.521 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -2.968 -5.554 -13.259 1.00 0.00 H new ATOM 2108 N GLU A 670 -5.854 -5.049 -8.843 1.00 0.00 N ATOM 2109 CA GLU A 670 -6.199 -5.220 -7.436 1.00 0.00 C ATOM 2110 C GLU A 670 -5.747 -6.584 -6.922 1.00 0.00 C ATOM 2111 O GLU A 670 -5.988 -7.609 -7.560 1.00 0.00 O ATOM 2112 CB GLU A 670 -7.707 -5.061 -7.236 1.00 0.00 C ATOM 2113 CG GLU A 670 -8.125 -3.646 -6.871 1.00 0.00 C ATOM 2114 CD GLU A 670 -9.623 -3.437 -6.974 1.00 0.00 C ATOM 2115 OE1 GLU A 670 -10.306 -4.309 -7.550 1.00 0.00 O ATOM 2116 OE2 GLU A 670 -10.113 -2.399 -6.478 1.00 0.00 O ATOM 0 H GLU A 670 -5.785 -5.918 -9.372 1.00 0.00 H new ATOM 0 HA GLU A 670 -5.680 -4.449 -6.867 1.00 0.00 H new ATOM 0 HB2 GLU A 670 -8.220 -5.358 -8.151 1.00 0.00 H new ATOM 0 HB3 GLU A 670 -8.035 -5.742 -6.451 1.00 0.00 H new ATOM 0 HG2 GLU A 670 -7.800 -3.426 -5.854 1.00 0.00 H new ATOM 0 HG3 GLU A 670 -7.617 -2.940 -7.528 1.00 0.00 H new ATOM 2123 N ARG A 671 -5.089 -6.586 -5.767 1.00 0.00 N ATOM 2124 CA ARG A 671 -4.600 -7.824 -5.169 1.00 0.00 C ATOM 2125 C ARG A 671 -4.478 -7.699 -3.654 1.00 0.00 C ATOM 2126 O ARG A 671 -4.568 -6.604 -3.098 1.00 0.00 O ATOM 2127 CB ARG A 671 -3.244 -8.194 -5.765 1.00 0.00 C ATOM 2128 CG ARG A 671 -3.296 -8.441 -7.259 1.00 0.00 C ATOM 2129 CD ARG A 671 -4.019 -9.739 -7.577 1.00 0.00 C ATOM 2130 NE ARG A 671 -3.176 -10.665 -8.331 1.00 0.00 N ATOM 2131 CZ ARG A 671 -3.043 -10.628 -9.653 1.00 0.00 C ATOM 2132 NH1 ARG A 671 -3.698 -9.720 -10.362 1.00 0.00 N ATOM 2133 NH2 ARG A 671 -2.255 -11.501 -10.265 1.00 0.00 N ATOM 0 H ARG A 671 -4.882 -5.746 -5.227 1.00 0.00 H new ATOM 0 HA ARG A 671 -5.323 -8.609 -5.390 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -2.534 -7.393 -5.560 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -2.868 -9.088 -5.268 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -3.802 -7.610 -7.750 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -2.283 -8.479 -7.659 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -4.338 -10.213 -6.649 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -4.920 -9.521 -8.150 1.00 0.00 H new ATOM 0 HE ARG A 671 -2.662 -11.379 -7.814 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -4.305 -9.048 -9.893 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -3.595 -9.693 -11.376 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -1.751 -12.201 -9.721 1.00 0.00 H new ATOM 0 HH22 ARG A 671 -2.153 -11.472 -11.279 1.00 0.00 H new ATOM 2147 N TRP A 672 -4.271 -8.834 -2.994 1.00 0.00 N ATOM 2148 CA TRP A 672 -4.130 -8.863 -1.542 1.00 0.00 C ATOM 2149 C TRP A 672 -2.676 -9.082 -1.145 1.00 0.00 C ATOM 2150 O TRP A 672 -2.000 -9.961 -1.681 1.00 0.00 O ATOM 2151 CB TRP A 672 -5.008 -9.964 -0.944 1.00 0.00 C ATOM 2152 CG TRP A 672 -6.456 -9.593 -0.893 1.00 0.00 C ATOM 2153 CD1 TRP A 672 -7.405 -9.868 -1.834 1.00 0.00 C ATOM 2154 CD2 TRP A 672 -7.121 -8.867 0.148 1.00 0.00 C ATOM 2155 NE1 TRP A 672 -8.619 -9.356 -1.445 1.00 0.00 N ATOM 2156 CE2 TRP A 672 -8.470 -8.737 -0.231 1.00 0.00 C ATOM 2157 CE3 TRP A 672 -6.707 -8.313 1.365 1.00 0.00 C ATOM 2158 CZ2 TRP A 672 -9.406 -8.077 0.557 1.00 0.00 C ATOM 2159 CZ3 TRP A 672 -7.639 -7.659 2.150 1.00 0.00 C ATOM 2160 CH2 TRP A 672 -8.976 -7.546 1.744 1.00 0.00 C ATOM 0 H TRP A 672 -4.197 -9.747 -3.442 1.00 0.00 H new ATOM 0 HA TRP A 672 -4.455 -7.899 -1.149 1.00 0.00 H new ATOM 0 HB2 TRP A 672 -4.892 -10.874 -1.533 1.00 0.00 H new ATOM 0 HB3 TRP A 672 -4.661 -10.191 0.064 1.00 0.00 H new ATOM 0 HD1 TRP A 672 -7.228 -10.410 -2.751 1.00 0.00 H new ATOM 0 HE1 TRP A 672 -9.489 -9.425 -1.973 1.00 0.00 H new ATOM 0 HE3 TRP A 672 -5.679 -8.395 1.685 1.00 0.00 H new ATOM 0 HZ2 TRP A 672 -10.436 -7.986 0.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 672 -7.332 -7.228 3.091 1.00 0.00 H new ATOM 0 HH2 TRP A 672 -9.681 -7.030 2.380 1.00 0.00 H new ATOM 2171 N HIS A 673 -2.197 -8.277 -0.202 1.00 0.00 N ATOM 2172 CA HIS A 673 -0.821 -8.386 0.262 1.00 0.00 C ATOM 2173 C HIS A 673 -0.767 -8.802 1.728 1.00 0.00 C ATOM 2174 O HIS A 673 -1.422 -8.200 2.580 1.00 0.00 O ATOM 2175 CB HIS A 673 -0.089 -7.057 0.072 1.00 0.00 C ATOM 2176 CG HIS A 673 -0.066 -6.588 -1.350 1.00 0.00 C ATOM 2177 ND1 HIS A 673 0.232 -7.400 -2.421 1.00 0.00 N ATOM 2178 CD2 HIS A 673 -0.315 -5.358 -1.870 1.00 0.00 C ATOM 2179 CE1 HIS A 673 0.156 -6.657 -3.534 1.00 0.00 C ATOM 2180 NE2 HIS A 673 -0.172 -5.412 -3.255 1.00 0.00 N ATOM 0 H HIS A 673 -2.741 -7.544 0.254 1.00 0.00 H new ATOM 0 HA HIS A 673 -0.327 -9.155 -0.332 1.00 0.00 H new ATOM 0 HB2 HIS A 673 -0.566 -6.296 0.690 1.00 0.00 H new ATOM 0 HB3 HIS A 673 0.936 -7.161 0.429 1.00 0.00 H new ATOM 0 HD1 HIS A 673 0.469 -8.391 -2.376 1.00 0.00 H new ATOM 0 HD2 HIS A 673 -0.581 -4.479 -1.301 1.00 0.00 H new ATOM 0 HE1 HIS A 673 0.340 -7.031 -4.530 1.00 0.00 H new ATOM 2188 N GLN A 674 0.019 -9.833 2.011 1.00 0.00 N ATOM 2189 CA GLN A 674 0.169 -10.332 3.371 1.00 0.00 C ATOM 2190 C GLN A 674 1.093 -9.427 4.175 1.00 0.00 C ATOM 2191 O GLN A 674 2.279 -9.304 3.870 1.00 0.00 O ATOM 2192 CB GLN A 674 0.721 -11.760 3.355 1.00 0.00 C ATOM 2193 CG GLN A 674 1.865 -11.956 2.375 1.00 0.00 C ATOM 2194 CD GLN A 674 2.540 -13.305 2.528 1.00 0.00 C ATOM 2195 OE1 GLN A 674 2.655 -14.067 1.569 1.00 0.00 O ATOM 2196 NE2 GLN A 674 2.992 -13.607 3.740 1.00 0.00 N ATOM 0 H GLN A 674 0.564 -10.341 1.314 1.00 0.00 H new ATOM 0 HA GLN A 674 -0.813 -10.337 3.844 1.00 0.00 H new ATOM 0 HB2 GLN A 674 1.063 -12.020 4.357 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -0.085 -12.450 3.104 1.00 0.00 H new ATOM 0 HG2 GLN A 674 1.488 -11.856 1.357 1.00 0.00 H new ATOM 0 HG3 GLN A 674 2.602 -11.166 2.520 1.00 0.00 H new ATOM 0 HE21 GLN A 674 2.875 -12.945 4.507 1.00 0.00 H new ATOM 0 HE22 GLN A 674 3.456 -14.501 3.903 1.00 0.00 H new ATOM 2205 N LEU A 675 0.540 -8.786 5.199 1.00 0.00 N ATOM 2206 CA LEU A 675 1.314 -7.883 6.041 1.00 0.00 C ATOM 2207 C LEU A 675 2.493 -8.598 6.686 1.00 0.00 C ATOM 2208 O LEU A 675 2.354 -9.700 7.217 1.00 0.00 O ATOM 2209 CB LEU A 675 0.423 -7.274 7.120 1.00 0.00 C ATOM 2210 CG LEU A 675 -0.762 -6.469 6.597 1.00 0.00 C ATOM 2211 CD1 LEU A 675 -1.704 -6.108 7.735 1.00 0.00 C ATOM 2212 CD2 LEU A 675 -0.274 -5.219 5.883 1.00 0.00 C ATOM 0 H LEU A 675 -0.441 -8.875 5.465 1.00 0.00 H new ATOM 0 HA LEU A 675 1.706 -7.089 5.405 1.00 0.00 H new ATOM 0 HB2 LEU A 675 0.047 -8.076 7.755 1.00 0.00 H new ATOM 0 HB3 LEU A 675 1.032 -6.627 7.751 1.00 0.00 H new ATOM 0 HG LEU A 675 -1.312 -7.081 5.882 1.00 0.00 H new ATOM 0 HD11 LEU A 675 -2.544 -5.534 7.344 1.00 0.00 H new ATOM 0 HD12 LEU A 675 -2.075 -7.020 8.204 1.00 0.00 H new ATOM 0 HD13 LEU A 675 -1.170 -5.511 8.474 1.00 0.00 H new ATOM 0 HD21 LEU A 675 -1.130 -4.653 5.514 1.00 0.00 H new ATOM 0 HD22 LEU A 675 0.297 -4.603 6.578 1.00 0.00 H new ATOM 0 HD23 LEU A 675 0.361 -5.504 5.044 1.00 0.00 H new ATOM 2224 N GLN A 676 3.653 -7.954 6.643 1.00 0.00 N ATOM 2225 CA GLN A 676 4.865 -8.514 7.227 1.00 0.00 C ATOM 2226 C GLN A 676 5.506 -7.519 8.191 1.00 0.00 C ATOM 2227 O GLN A 676 5.236 -6.320 8.129 1.00 0.00 O ATOM 2228 CB GLN A 676 5.861 -8.892 6.130 1.00 0.00 C ATOM 2229 CG GLN A 676 5.504 -10.176 5.401 1.00 0.00 C ATOM 2230 CD GLN A 676 6.727 -10.948 4.947 1.00 0.00 C ATOM 2231 OE1 GLN A 676 6.870 -12.135 5.242 1.00 0.00 O ATOM 2232 NE2 GLN A 676 7.619 -10.277 4.228 1.00 0.00 N ATOM 0 H GLN A 676 3.780 -7.040 6.208 1.00 0.00 H new ATOM 0 HA GLN A 676 4.592 -9.412 7.781 1.00 0.00 H new ATOM 0 HB2 GLN A 676 5.919 -8.078 5.407 1.00 0.00 H new ATOM 0 HB3 GLN A 676 6.852 -8.998 6.571 1.00 0.00 H new ATOM 0 HG2 GLN A 676 4.904 -10.807 6.057 1.00 0.00 H new ATOM 0 HG3 GLN A 676 4.887 -9.938 4.535 1.00 0.00 H new ATOM 0 HE21 GLN A 676 7.460 -9.294 4.007 1.00 0.00 H new ATOM 0 HE22 GLN A 676 8.463 -10.744 3.897 1.00 0.00 H new ATOM 2241 N ASN A 677 6.354 -8.024 9.081 1.00 0.00 N ATOM 2242 CA ASN A 677 7.032 -7.176 10.056 1.00 0.00 C ATOM 2243 C ASN A 677 8.465 -6.885 9.621 1.00 0.00 C ATOM 2244 O ASN A 677 9.416 -7.445 10.166 1.00 0.00 O ATOM 2245 CB ASN A 677 7.031 -7.844 11.431 1.00 0.00 C ATOM 2246 CG ASN A 677 5.629 -8.063 11.967 1.00 0.00 C ATOM 2247 OD1 ASN A 677 4.741 -7.233 11.773 1.00 0.00 O ATOM 2248 ND2 ASN A 677 5.423 -9.187 12.646 1.00 0.00 N ATOM 0 H ASN A 677 6.588 -9.015 9.148 1.00 0.00 H new ATOM 0 HA ASN A 677 6.491 -6.232 10.117 1.00 0.00 H new ATOM 0 HB2 ASN A 677 7.546 -8.802 11.367 1.00 0.00 H new ATOM 0 HB3 ASN A 677 7.593 -7.227 12.132 1.00 0.00 H new ATOM 0 HD21 ASN A 677 4.500 -9.389 13.030 1.00 0.00 H new ATOM 0 HD22 ASN A 677 6.188 -9.848 12.783 1.00 0.00 H new