USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=33 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 HE2:sc= -10.4! C(o=-17!,f=-19!) USER MOD Set 1.2: A 673 HIS : no HE2:sc= -6.76! C(o=-17!,f=-20!) USER MOD Set 2.1: A 570 MET CE :methyl -130:sc= -6.28! (180deg=-5.16!) USER MOD Set 2.2: A 576 SER OG : rot 149:sc= -0.79! USER MOD Single : A 543 LYS NZ :NH3+ 155:sc= -0.0783 (180deg=-0.527) USER MOD Single : A 547 SER OG : rot 180:sc= -1.87! USER MOD Single : A 549 MET CE :methyl -166:sc= -1.36 (180deg=-2.38!) USER MOD Single : A 550 TYR OH : rot -27:sc= -1.15! USER MOD Single : A 551 SER OG : rot 150:sc= -0.332 USER MOD Single : A 552 THR OG1 : rot 180:sc= -0.122 USER MOD Single : A 553 GLN : amide:sc= -2.22 K(o=-2.2,f=-0.095) USER MOD Single : A 554 GLN : amide:sc= -0.376 K(o=-0.38,f=-2.5!) USER MOD Single : A 564 CYS SG : rot -121:sc= -6.63! USER MOD Single : A 566 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 573 ASN : amide:sc= -0.0272 K(o=-0.027,f=-0.76) USER MOD Single : A 575 TYR OH : rot 180:sc= 0 USER MOD Single : A 581 LYS NZ :NH3+ -106:sc= 2.78 (180deg=-0.508) USER MOD Single : A 585 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 593 LYS NZ :NH3+ 165:sc= -0.11 (180deg=-0.523) USER MOD Single : A 594 HIS : no HD1:sc= -4.43 X(o=-4.4,f=-4.8!) USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 125:sc= 2.12 USER MOD Single : A 597 GLN : amide:sc= -0.957 K(o=-0.96,f=-4.3!) USER MOD Single : A 599 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 600 LYS NZ :NH3+ -152:sc= -0.436 (180deg=-1.91!) USER MOD Single : A 601 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0698) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0 USER MOD Single : A 604 ASN : amide:sc= -0.826 K(o=-0.83,f=-2.4!) USER MOD Single : A 608 ASN : amide:sc=-0.00391 K(o=-0.0039,f=-1.6!) USER MOD Single : A 613 TYR OH : rot -121:sc= 0.15 USER MOD Single : A 616 LYS NZ :NH3+ 159:sc= -0.158 (180deg=-0.584) USER MOD Single : A 617 HIS : no HD1:sc= -6.44! C(o=-6.4!,f=-14!) USER MOD Single : A 618 SER OG : rot 180:sc= 0 USER MOD Single : A 622 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 623 LYS NZ :NH3+ -120:sc= -2.2! (180deg=-4.58!) USER MOD Single : A 624 SER OG : rot 36:sc= -0.291 USER MOD Single : A 628 SER OG : rot 11:sc= 1.02 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= 0.111 USER MOD Single : A 638 ASN : amide:sc= -1.01 K(o=-1,f=-2.1!) USER MOD Single : A 640 TYR OH : rot 180:sc= 0 USER MOD Single : A 644 CYS SG : rot 180:sc= 0 USER MOD Single : A 645 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 649 SER OG : rot -51:sc= 0.0183 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 -31:sc= -4.21! USER MOD Single : A 663 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0169) USER MOD Single : A 664 ASN : amide:sc= -0.533 K(o=-0.53,f=-2.9!) USER MOD Single : A 665 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 668 LYS NZ :NH3+ -125:sc= 0.654 (180deg=-0.608!) USER MOD Single : A 674 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 676 GLN : amide:sc= -0.0767 X(o=-0.077,f=0) USER MOD Single : A 677 ASN : amide:sc= -0.337 K(o=-0.34,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 27 N GLY A 542 -3.201 -9.999 9.182 1.00 0.00 N ATOM 28 CA GLY A 542 -4.233 -9.390 8.366 1.00 0.00 C ATOM 29 C GLY A 542 -3.796 -9.197 6.927 1.00 0.00 C ATOM 30 O GLY A 542 -2.635 -9.427 6.589 1.00 0.00 O ATOM 0 HA2 GLY A 542 -5.127 -10.014 8.391 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -4.506 -8.425 8.792 1.00 0.00 H new ATOM 34 N LYS A 543 -4.727 -8.773 6.080 1.00 0.00 N ATOM 35 CA LYS A 543 -4.432 -8.549 4.670 1.00 0.00 C ATOM 36 C LYS A 543 -5.037 -7.232 4.199 1.00 0.00 C ATOM 37 O LYS A 543 -6.146 -6.873 4.595 1.00 0.00 O ATOM 38 CB LYS A 543 -4.970 -9.705 3.825 1.00 0.00 C ATOM 39 CG LYS A 543 -4.872 -11.058 4.511 1.00 0.00 C ATOM 40 CD LYS A 543 -6.193 -11.808 4.454 1.00 0.00 C ATOM 41 CE LYS A 543 -6.280 -12.685 3.217 1.00 0.00 C ATOM 42 NZ LYS A 543 -5.279 -13.788 3.246 1.00 0.00 N ATOM 0 H LYS A 543 -5.692 -8.578 6.345 1.00 0.00 H new ATOM 0 HA LYS A 543 -3.350 -8.498 4.550 1.00 0.00 H new ATOM 0 HB2 LYS A 543 -6.013 -9.508 3.577 1.00 0.00 H new ATOM 0 HB3 LYS A 543 -4.420 -9.743 2.885 1.00 0.00 H new ATOM 0 HG2 LYS A 543 -4.093 -11.653 4.034 1.00 0.00 H new ATOM 0 HG3 LYS A 543 -4.576 -10.919 5.551 1.00 0.00 H new ATOM 0 HD2 LYS A 543 -6.302 -12.424 5.347 1.00 0.00 H new ATOM 0 HD3 LYS A 543 -7.018 -11.096 4.455 1.00 0.00 H new ATOM 0 HE2 LYS A 543 -7.282 -13.106 3.141 1.00 0.00 H new ATOM 0 HE3 LYS A 543 -6.122 -12.075 2.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 -5.615 -14.577 2.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 -4.371 -13.442 2.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 -5.151 -14.115 4.225 1.00 0.00 H new ATOM 56 N ILE A 544 -4.308 -6.515 3.352 1.00 0.00 N ATOM 57 CA ILE A 544 -4.784 -5.240 2.835 1.00 0.00 C ATOM 58 C ILE A 544 -4.931 -5.273 1.319 1.00 0.00 C ATOM 59 O ILE A 544 -3.994 -5.619 0.599 1.00 0.00 O ATOM 60 CB ILE A 544 -3.848 -4.081 3.228 1.00 0.00 C ATOM 61 CG1 ILE A 544 -4.567 -2.740 3.062 1.00 0.00 C ATOM 62 CG2 ILE A 544 -2.575 -4.113 2.398 1.00 0.00 C ATOM 63 CD1 ILE A 544 -4.445 -2.155 1.671 1.00 0.00 C ATOM 0 H ILE A 544 -3.388 -6.794 3.010 1.00 0.00 H new ATOM 0 HA ILE A 544 -5.762 -5.070 3.284 1.00 0.00 H new ATOM 0 HB ILE A 544 -3.572 -4.199 4.276 1.00 0.00 H new ATOM 0 HG12 ILE A 544 -5.622 -2.871 3.301 1.00 0.00 H new ATOM 0 HG13 ILE A 544 -4.163 -2.029 3.783 1.00 0.00 H new ATOM 0 HG21 ILE A 544 -1.928 -3.286 2.692 1.00 0.00 H new ATOM 0 HG22 ILE A 544 -2.056 -5.057 2.565 1.00 0.00 H new ATOM 0 HG23 ILE A 544 -2.827 -4.019 1.342 1.00 0.00 H new ATOM 0 HD11 ILE A 544 -4.979 -1.206 1.628 1.00 0.00 H new ATOM 0 HD12 ILE A 544 -3.393 -1.991 1.436 1.00 0.00 H new ATOM 0 HD13 ILE A 544 -4.875 -2.846 0.946 1.00 0.00 H new ATOM 75 N LEU A 545 -6.116 -4.907 0.845 1.00 0.00 N ATOM 76 CA LEU A 545 -6.398 -4.888 -0.583 1.00 0.00 C ATOM 77 C LEU A 545 -5.832 -3.631 -1.227 1.00 0.00 C ATOM 78 O LEU A 545 -6.201 -2.515 -0.864 1.00 0.00 O ATOM 79 CB LEU A 545 -7.906 -4.957 -0.828 1.00 0.00 C ATOM 80 CG LEU A 545 -8.312 -5.288 -2.266 1.00 0.00 C ATOM 81 CD1 LEU A 545 -8.051 -6.754 -2.570 1.00 0.00 C ATOM 82 CD2 LEU A 545 -9.774 -4.949 -2.497 1.00 0.00 C ATOM 0 H LEU A 545 -6.899 -4.619 1.432 1.00 0.00 H new ATOM 0 HA LEU A 545 -5.921 -5.759 -1.034 1.00 0.00 H new ATOM 0 HB2 LEU A 545 -8.333 -5.708 -0.164 1.00 0.00 H new ATOM 0 HB3 LEU A 545 -8.348 -3.999 -0.553 1.00 0.00 H new ATOM 0 HG LEU A 545 -7.707 -4.684 -2.942 1.00 0.00 H new ATOM 0 HD11 LEU A 545 -8.346 -6.971 -3.597 1.00 0.00 H new ATOM 0 HD12 LEU A 545 -6.990 -6.968 -2.444 1.00 0.00 H new ATOM 0 HD13 LEU A 545 -8.630 -7.376 -1.887 1.00 0.00 H new ATOM 0 HD21 LEU A 545 -10.046 -5.191 -3.525 1.00 0.00 H new ATOM 0 HD22 LEU A 545 -10.394 -5.527 -1.812 1.00 0.00 H new ATOM 0 HD23 LEU A 545 -9.933 -3.885 -2.320 1.00 0.00 H new ATOM 94 N VAL A 546 -4.936 -3.819 -2.188 1.00 0.00 N ATOM 95 CA VAL A 546 -4.323 -2.697 -2.882 1.00 0.00 C ATOM 96 C VAL A 546 -4.605 -2.766 -4.377 1.00 0.00 C ATOM 97 O VAL A 546 -4.411 -3.805 -5.008 1.00 0.00 O ATOM 98 CB VAL A 546 -2.800 -2.662 -2.660 1.00 0.00 C ATOM 99 CG1 VAL A 546 -2.142 -1.670 -3.607 1.00 0.00 C ATOM 100 CG2 VAL A 546 -2.478 -2.324 -1.213 1.00 0.00 C ATOM 0 H VAL A 546 -4.619 -4.736 -2.503 1.00 0.00 H new ATOM 0 HA VAL A 546 -4.761 -1.788 -2.469 1.00 0.00 H new ATOM 0 HB VAL A 546 -2.399 -3.652 -2.875 1.00 0.00 H new ATOM 0 HG11 VAL A 546 -1.066 -1.661 -3.434 1.00 0.00 H new ATOM 0 HG12 VAL A 546 -2.341 -1.964 -4.638 1.00 0.00 H new ATOM 0 HG13 VAL A 546 -2.547 -0.674 -3.429 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -1.397 -2.304 -1.076 1.00 0.00 H new ATOM 0 HG22 VAL A 546 -2.893 -1.347 -0.967 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -2.913 -3.079 -0.558 1.00 0.00 H new ATOM 110 N SER A 547 -5.062 -1.655 -4.942 1.00 0.00 N ATOM 111 CA SER A 547 -5.366 -1.598 -6.365 1.00 0.00 C ATOM 112 C SER A 547 -4.432 -0.628 -7.084 1.00 0.00 C ATOM 113 O SER A 547 -4.570 0.589 -6.961 1.00 0.00 O ATOM 114 CB SER A 547 -6.822 -1.185 -6.582 1.00 0.00 C ATOM 115 OG SER A 547 -7.100 0.056 -5.955 1.00 0.00 O ATOM 0 H SER A 547 -5.230 -0.784 -4.438 1.00 0.00 H new ATOM 0 HA SER A 547 -5.215 -2.593 -6.783 1.00 0.00 H new ATOM 0 HB2 SER A 547 -7.027 -1.110 -7.650 1.00 0.00 H new ATOM 0 HB3 SER A 547 -7.484 -1.954 -6.184 1.00 0.00 H new ATOM 0 HG SER A 547 -8.037 0.298 -6.110 1.00 0.00 H new ATOM 121 N LEU A 548 -3.479 -1.177 -7.831 1.00 0.00 N ATOM 122 CA LEU A 548 -2.518 -0.366 -8.570 1.00 0.00 C ATOM 123 C LEU A 548 -3.067 0.042 -9.935 1.00 0.00 C ATOM 124 O LEU A 548 -4.021 -0.552 -10.437 1.00 0.00 O ATOM 125 CB LEU A 548 -1.209 -1.135 -8.756 1.00 0.00 C ATOM 126 CG LEU A 548 -0.423 -1.406 -7.473 1.00 0.00 C ATOM 127 CD1 LEU A 548 0.954 -1.961 -7.801 1.00 0.00 C ATOM 128 CD2 LEU A 548 -0.302 -0.137 -6.642 1.00 0.00 C ATOM 0 H LEU A 548 -3.352 -2.183 -7.941 1.00 0.00 H new ATOM 0 HA LEU A 548 -2.332 0.537 -7.989 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -1.432 -2.089 -9.234 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -0.572 -0.576 -9.441 1.00 0.00 H new ATOM 0 HG LEU A 548 -0.965 -2.149 -6.888 1.00 0.00 H new ATOM 0 HD11 LEU A 548 1.500 -2.148 -6.877 1.00 0.00 H new ATOM 0 HD12 LEU A 548 0.848 -2.894 -8.355 1.00 0.00 H new ATOM 0 HD13 LEU A 548 1.502 -1.239 -8.407 1.00 0.00 H new ATOM 0 HD21 LEU A 548 0.260 -0.350 -5.733 1.00 0.00 H new ATOM 0 HD22 LEU A 548 0.217 0.628 -7.219 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -1.297 0.221 -6.378 1.00 0.00 H new ATOM 140 N MET A 549 -2.447 1.057 -10.528 1.00 0.00 N ATOM 141 CA MET A 549 -2.850 1.558 -11.839 1.00 0.00 C ATOM 142 C MET A 549 -2.036 2.790 -12.207 1.00 0.00 C ATOM 143 O MET A 549 -2.021 3.775 -11.469 1.00 0.00 O ATOM 144 CB MET A 549 -4.340 1.905 -11.856 1.00 0.00 C ATOM 145 CG MET A 549 -4.916 2.039 -13.259 1.00 0.00 C ATOM 146 SD MET A 549 -6.398 3.068 -13.313 1.00 0.00 S ATOM 147 CE MET A 549 -6.843 3.128 -11.579 1.00 0.00 C ATOM 0 H MET A 549 -1.656 1.553 -10.117 1.00 0.00 H new ATOM 0 HA MET A 549 -2.665 0.771 -12.571 1.00 0.00 H new ATOM 0 HB2 MET A 549 -4.891 1.134 -11.318 1.00 0.00 H new ATOM 0 HB3 MET A 549 -4.493 2.840 -11.318 1.00 0.00 H new ATOM 0 HG2 MET A 549 -4.159 2.465 -13.918 1.00 0.00 H new ATOM 0 HG3 MET A 549 -5.153 1.048 -13.645 1.00 0.00 H new ATOM 0 HE1 MET A 549 -7.859 3.510 -11.477 1.00 0.00 H new ATOM 0 HE2 MET A 549 -6.787 2.126 -11.154 1.00 0.00 H new ATOM 0 HE3 MET A 549 -6.154 3.785 -11.049 1.00 0.00 H new ATOM 157 N TYR A 550 -1.359 2.734 -13.346 1.00 0.00 N ATOM 158 CA TYR A 550 -0.547 3.854 -13.795 1.00 0.00 C ATOM 159 C TYR A 550 -1.275 4.675 -14.850 1.00 0.00 C ATOM 160 O TYR A 550 -1.770 4.137 -15.841 1.00 0.00 O ATOM 161 CB TYR A 550 0.789 3.365 -14.351 1.00 0.00 C ATOM 162 CG TYR A 550 1.781 4.482 -14.570 1.00 0.00 C ATOM 163 CD1 TYR A 550 2.609 4.909 -13.542 1.00 0.00 C ATOM 164 CD2 TYR A 550 1.882 5.116 -15.802 1.00 0.00 C ATOM 165 CE1 TYR A 550 3.511 5.938 -13.732 1.00 0.00 C ATOM 166 CE2 TYR A 550 2.782 6.145 -16.002 1.00 0.00 C ATOM 167 CZ TYR A 550 3.594 6.553 -14.964 1.00 0.00 C ATOM 168 OH TYR A 550 4.491 7.578 -15.157 1.00 0.00 O ATOM 0 H TYR A 550 -1.356 1.929 -13.972 1.00 0.00 H new ATOM 0 HA TYR A 550 -0.360 4.491 -12.930 1.00 0.00 H new ATOM 0 HB2 TYR A 550 1.217 2.636 -13.663 1.00 0.00 H new ATOM 0 HB3 TYR A 550 0.616 2.849 -15.296 1.00 0.00 H new ATOM 0 HD1 TYR A 550 2.547 4.429 -12.577 1.00 0.00 H new ATOM 0 HD2 TYR A 550 1.247 4.800 -16.616 1.00 0.00 H new ATOM 0 HE1 TYR A 550 4.147 6.259 -12.921 1.00 0.00 H new ATOM 0 HE2 TYR A 550 2.850 6.627 -16.966 1.00 0.00 H new ATOM 0 HH TYR A 550 4.663 8.028 -14.303 1.00 0.00 H new ATOM 178 N SER A 551 -1.331 5.983 -14.631 1.00 0.00 N ATOM 179 CA SER A 551 -1.993 6.887 -15.563 1.00 0.00 C ATOM 180 C SER A 551 -0.974 7.593 -16.449 1.00 0.00 C ATOM 181 O SER A 551 -0.649 8.760 -16.228 1.00 0.00 O ATOM 182 CB SER A 551 -2.825 7.921 -14.802 1.00 0.00 C ATOM 183 OG SER A 551 -4.085 8.117 -15.419 1.00 0.00 O ATOM 0 H SER A 551 -0.925 6.442 -13.815 1.00 0.00 H new ATOM 0 HA SER A 551 -2.654 6.295 -16.197 1.00 0.00 H new ATOM 0 HB2 SER A 551 -2.968 7.591 -13.773 1.00 0.00 H new ATOM 0 HB3 SER A 551 -2.286 8.867 -14.761 1.00 0.00 H new ATOM 0 HG SER A 551 -4.748 8.361 -14.739 1.00 0.00 H new ATOM 189 N THR A 552 -0.476 6.883 -17.457 1.00 0.00 N ATOM 190 CA THR A 552 0.502 7.454 -18.375 1.00 0.00 C ATOM 191 C THR A 552 0.075 8.855 -18.784 1.00 0.00 C ATOM 192 O THR A 552 0.889 9.779 -18.833 1.00 0.00 O ATOM 193 CB THR A 552 0.656 6.575 -19.617 1.00 0.00 C ATOM 194 OG1 THR A 552 -0.301 6.923 -20.600 1.00 0.00 O ATOM 195 CG2 THR A 552 0.499 5.099 -19.327 1.00 0.00 C ATOM 0 H THR A 552 -0.732 5.916 -17.658 1.00 0.00 H new ATOM 0 HA THR A 552 1.464 7.505 -17.865 1.00 0.00 H new ATOM 0 HB THR A 552 1.670 6.754 -19.973 1.00 0.00 H new ATOM 0 HG1 THR A 552 -0.185 6.351 -21.387 1.00 0.00 H new ATOM 0 HG21 THR A 552 0.620 4.532 -20.250 1.00 0.00 H new ATOM 0 HG22 THR A 552 1.256 4.787 -18.608 1.00 0.00 H new ATOM 0 HG23 THR A 552 -0.492 4.913 -18.914 1.00 0.00 H new ATOM 203 N GLN A 553 -1.213 9.004 -19.065 1.00 0.00 N ATOM 204 CA GLN A 553 -1.764 10.293 -19.456 1.00 0.00 C ATOM 205 C GLN A 553 -1.345 11.364 -18.458 1.00 0.00 C ATOM 206 O GLN A 553 -0.901 12.448 -18.837 1.00 0.00 O ATOM 207 CB GLN A 553 -3.288 10.215 -19.531 1.00 0.00 C ATOM 208 CG GLN A 553 -3.867 10.791 -20.812 1.00 0.00 C ATOM 209 CD GLN A 553 -4.512 12.148 -20.602 1.00 0.00 C ATOM 210 OE1 GLN A 553 -5.446 12.520 -21.311 1.00 0.00 O ATOM 211 NE2 GLN A 553 -4.013 12.895 -19.624 1.00 0.00 N ATOM 0 H GLN A 553 -1.895 8.247 -19.029 1.00 0.00 H new ATOM 0 HA GLN A 553 -1.377 10.556 -20.441 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -3.594 9.173 -19.441 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -3.712 10.747 -18.680 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -3.076 10.880 -21.556 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -4.607 10.100 -21.215 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -3.238 12.546 -19.061 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -4.405 13.818 -19.436 1.00 0.00 H new ATOM 220 N GLN A 554 -1.484 11.043 -17.177 1.00 0.00 N ATOM 221 CA GLN A 554 -1.116 11.963 -16.110 1.00 0.00 C ATOM 222 C GLN A 554 0.384 11.898 -15.844 1.00 0.00 C ATOM 223 O GLN A 554 0.962 12.809 -15.251 1.00 0.00 O ATOM 224 CB GLN A 554 -1.893 11.634 -14.834 1.00 0.00 C ATOM 225 CG GLN A 554 -3.363 11.335 -15.081 1.00 0.00 C ATOM 226 CD GLN A 554 -4.284 12.285 -14.342 1.00 0.00 C ATOM 227 OE1 GLN A 554 -3.855 13.329 -13.852 1.00 0.00 O ATOM 228 NE2 GLN A 554 -5.560 11.926 -14.258 1.00 0.00 N ATOM 0 H GLN A 554 -1.851 10.148 -16.852 1.00 0.00 H new ATOM 0 HA GLN A 554 -1.370 12.975 -16.424 1.00 0.00 H new ATOM 0 HB2 GLN A 554 -1.432 10.774 -14.348 1.00 0.00 H new ATOM 0 HB3 GLN A 554 -1.812 12.472 -14.142 1.00 0.00 H new ATOM 0 HG2 GLN A 554 -3.567 11.395 -16.150 1.00 0.00 H new ATOM 0 HG3 GLN A 554 -3.579 10.312 -14.772 1.00 0.00 H new ATOM 0 HE21 GLN A 554 -5.872 11.051 -14.679 1.00 0.00 H new ATOM 0 HE22 GLN A 554 -6.227 12.525 -13.772 1.00 0.00 H new ATOM 237 N GLY A 555 1.007 10.812 -16.291 1.00 0.00 N ATOM 238 CA GLY A 555 2.435 10.641 -16.100 1.00 0.00 C ATOM 239 C GLY A 555 2.789 10.262 -14.677 1.00 0.00 C ATOM 240 O GLY A 555 3.784 10.737 -14.130 1.00 0.00 O ATOM 0 H GLY A 555 0.547 10.046 -16.783 1.00 0.00 H new ATOM 0 HA2 GLY A 555 2.799 9.870 -16.779 1.00 0.00 H new ATOM 0 HA3 GLY A 555 2.947 11.566 -16.364 1.00 0.00 H new ATOM 244 N GLY A 556 1.975 9.401 -14.077 1.00 0.00 N ATOM 245 CA GLY A 556 2.230 8.974 -12.714 1.00 0.00 C ATOM 246 C GLY A 556 1.537 7.670 -12.370 1.00 0.00 C ATOM 247 O GLY A 556 0.651 7.218 -13.095 1.00 0.00 O ATOM 0 H GLY A 556 1.146 8.992 -14.508 1.00 0.00 H new ATOM 0 HA2 GLY A 556 3.304 8.859 -12.569 1.00 0.00 H new ATOM 0 HA3 GLY A 556 1.896 9.751 -12.026 1.00 0.00 H new ATOM 251 N LEU A 557 1.940 7.068 -11.255 1.00 0.00 N ATOM 252 CA LEU A 557 1.353 5.812 -10.807 1.00 0.00 C ATOM 253 C LEU A 557 0.163 6.080 -9.893 1.00 0.00 C ATOM 254 O LEU A 557 0.038 7.164 -9.325 1.00 0.00 O ATOM 255 CB LEU A 557 2.400 4.969 -10.071 1.00 0.00 C ATOM 256 CG LEU A 557 1.837 3.876 -9.161 1.00 0.00 C ATOM 257 CD1 LEU A 557 1.383 2.677 -9.981 1.00 0.00 C ATOM 258 CD2 LEU A 557 2.875 3.457 -8.132 1.00 0.00 C ATOM 0 H LEU A 557 2.672 7.432 -10.645 1.00 0.00 H new ATOM 0 HA LEU A 557 1.007 5.260 -11.681 1.00 0.00 H new ATOM 0 HB2 LEU A 557 3.052 4.503 -10.810 1.00 0.00 H new ATOM 0 HB3 LEU A 557 3.021 5.634 -9.471 1.00 0.00 H new ATOM 0 HG LEU A 557 0.971 4.278 -8.635 1.00 0.00 H new ATOM 0 HD11 LEU A 557 0.986 1.911 -9.316 1.00 0.00 H new ATOM 0 HD12 LEU A 557 0.607 2.988 -10.681 1.00 0.00 H new ATOM 0 HD13 LEU A 557 2.230 2.273 -10.535 1.00 0.00 H new ATOM 0 HD21 LEU A 557 2.459 2.679 -7.492 1.00 0.00 H new ATOM 0 HD22 LEU A 557 3.759 3.074 -8.642 1.00 0.00 H new ATOM 0 HD23 LEU A 557 3.152 4.318 -7.523 1.00 0.00 H new ATOM 270 N ILE A 558 -0.712 5.091 -9.753 1.00 0.00 N ATOM 271 CA ILE A 558 -1.886 5.234 -8.903 1.00 0.00 C ATOM 272 C ILE A 558 -2.016 4.059 -7.941 1.00 0.00 C ATOM 273 O ILE A 558 -2.147 2.910 -8.361 1.00 0.00 O ATOM 274 CB ILE A 558 -3.180 5.347 -9.732 1.00 0.00 C ATOM 275 CG1 ILE A 558 -2.928 6.136 -11.020 1.00 0.00 C ATOM 276 CG2 ILE A 558 -4.278 6.001 -8.907 1.00 0.00 C ATOM 277 CD1 ILE A 558 -3.065 7.635 -10.852 1.00 0.00 C ATOM 0 H ILE A 558 -0.631 4.185 -10.215 1.00 0.00 H new ATOM 0 HA ILE A 558 -1.748 6.155 -8.336 1.00 0.00 H new ATOM 0 HB ILE A 558 -3.505 4.344 -10.007 1.00 0.00 H new ATOM 0 HG12 ILE A 558 -1.926 5.910 -11.384 1.00 0.00 H new ATOM 0 HG13 ILE A 558 -3.628 5.799 -11.785 1.00 0.00 H new ATOM 0 HG21 ILE A 558 -5.187 6.075 -9.504 1.00 0.00 H new ATOM 0 HG22 ILE A 558 -4.475 5.399 -8.020 1.00 0.00 H new ATOM 0 HG23 ILE A 558 -3.960 6.999 -8.605 1.00 0.00 H new ATOM 0 HD11 ILE A 558 -2.872 8.127 -11.805 1.00 0.00 H new ATOM 0 HD12 ILE A 558 -4.075 7.873 -10.518 1.00 0.00 H new ATOM 0 HD13 ILE A 558 -2.346 7.985 -10.111 1.00 0.00 H new ATOM 289 N VAL A 559 -1.987 4.358 -6.647 1.00 0.00 N ATOM 290 CA VAL A 559 -2.110 3.331 -5.623 1.00 0.00 C ATOM 291 C VAL A 559 -3.490 3.382 -4.983 1.00 0.00 C ATOM 292 O VAL A 559 -3.867 4.388 -4.386 1.00 0.00 O ATOM 293 CB VAL A 559 -1.042 3.495 -4.529 1.00 0.00 C ATOM 294 CG1 VAL A 559 -0.801 2.176 -3.817 1.00 0.00 C ATOM 295 CG2 VAL A 559 0.250 4.035 -5.120 1.00 0.00 C ATOM 0 H VAL A 559 -1.879 5.305 -6.283 1.00 0.00 H new ATOM 0 HA VAL A 559 -1.965 2.367 -6.111 1.00 0.00 H new ATOM 0 HB VAL A 559 -1.407 4.215 -3.796 1.00 0.00 H new ATOM 0 HG11 VAL A 559 -0.042 2.312 -3.046 1.00 0.00 H new ATOM 0 HG12 VAL A 559 -1.729 1.836 -3.357 1.00 0.00 H new ATOM 0 HG13 VAL A 559 -0.459 1.432 -4.536 1.00 0.00 H new ATOM 0 HG21 VAL A 559 0.994 4.144 -4.330 1.00 0.00 H new ATOM 0 HG22 VAL A 559 0.622 3.343 -5.875 1.00 0.00 H new ATOM 0 HG23 VAL A 559 0.062 5.006 -5.579 1.00 0.00 H new ATOM 305 N GLY A 560 -4.248 2.306 -5.126 1.00 0.00 N ATOM 306 CA GLY A 560 -5.586 2.275 -4.569 1.00 0.00 C ATOM 307 C GLY A 560 -5.700 1.452 -3.302 1.00 0.00 C ATOM 308 O GLY A 560 -5.688 0.222 -3.348 1.00 0.00 O ATOM 0 H GLY A 560 -3.964 1.457 -5.615 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -5.906 3.296 -4.359 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -6.271 1.873 -5.315 1.00 0.00 H new ATOM 312 N ILE A 561 -5.838 2.136 -2.171 1.00 0.00 N ATOM 313 CA ILE A 561 -5.988 1.468 -0.886 1.00 0.00 C ATOM 314 C ILE A 561 -7.460 1.173 -0.630 1.00 0.00 C ATOM 315 O ILE A 561 -8.185 2.012 -0.097 1.00 0.00 O ATOM 316 CB ILE A 561 -5.438 2.329 0.268 1.00 0.00 C ATOM 317 CG1 ILE A 561 -4.020 2.800 -0.055 1.00 0.00 C ATOM 318 CG2 ILE A 561 -5.462 1.546 1.572 1.00 0.00 C ATOM 319 CD1 ILE A 561 -3.075 1.670 -0.394 1.00 0.00 C ATOM 0 H ILE A 561 -5.849 3.155 -2.120 1.00 0.00 H new ATOM 0 HA ILE A 561 -5.417 0.540 -0.925 1.00 0.00 H new ATOM 0 HB ILE A 561 -6.074 3.206 0.386 1.00 0.00 H new ATOM 0 HG12 ILE A 561 -4.058 3.496 -0.893 1.00 0.00 H new ATOM 0 HG13 ILE A 561 -3.625 3.351 0.799 1.00 0.00 H new ATOM 0 HG21 ILE A 561 -5.070 2.168 2.377 1.00 0.00 H new ATOM 0 HG22 ILE A 561 -6.487 1.256 1.803 1.00 0.00 H new ATOM 0 HG23 ILE A 561 -4.846 0.653 1.471 1.00 0.00 H new ATOM 0 HD11 ILE A 561 -2.087 2.075 -0.612 1.00 0.00 H new ATOM 0 HD12 ILE A 561 -3.008 0.986 0.452 1.00 0.00 H new ATOM 0 HD13 ILE A 561 -3.448 1.133 -1.266 1.00 0.00 H new ATOM 331 N ILE A 562 -7.902 -0.008 -1.041 1.00 0.00 N ATOM 332 CA ILE A 562 -9.297 -0.390 -0.881 1.00 0.00 C ATOM 333 C ILE A 562 -9.660 -0.664 0.571 1.00 0.00 C ATOM 334 O ILE A 562 -10.313 0.156 1.215 1.00 0.00 O ATOM 335 CB ILE A 562 -9.645 -1.629 -1.729 1.00 0.00 C ATOM 336 CG1 ILE A 562 -9.162 -1.443 -3.169 1.00 0.00 C ATOM 337 CG2 ILE A 562 -11.145 -1.889 -1.695 1.00 0.00 C ATOM 338 CD1 ILE A 562 -8.096 -2.436 -3.583 1.00 0.00 C ATOM 0 H ILE A 562 -7.317 -0.715 -1.486 1.00 0.00 H new ATOM 0 HA ILE A 562 -9.881 0.462 -1.228 1.00 0.00 H new ATOM 0 HB ILE A 562 -9.136 -2.495 -1.306 1.00 0.00 H new ATOM 0 HG12 ILE A 562 -10.013 -1.534 -3.844 1.00 0.00 H new ATOM 0 HG13 ILE A 562 -8.770 -0.432 -3.284 1.00 0.00 H new ATOM 0 HG21 ILE A 562 -11.376 -2.767 -2.298 1.00 0.00 H new ATOM 0 HG22 ILE A 562 -11.461 -2.062 -0.666 1.00 0.00 H new ATOM 0 HG23 ILE A 562 -11.673 -1.024 -2.096 1.00 0.00 H new ATOM 0 HD11 ILE A 562 -7.801 -2.245 -4.615 1.00 0.00 H new ATOM 0 HD12 ILE A 562 -7.228 -2.330 -2.932 1.00 0.00 H new ATOM 0 HD13 ILE A 562 -8.490 -3.449 -3.500 1.00 0.00 H new ATOM 350 N ARG A 563 -9.267 -1.826 1.078 1.00 0.00 N ATOM 351 CA ARG A 563 -9.595 -2.194 2.446 1.00 0.00 C ATOM 352 C ARG A 563 -8.661 -3.272 2.983 1.00 0.00 C ATOM 353 O ARG A 563 -7.917 -3.897 2.229 1.00 0.00 O ATOM 354 CB ARG A 563 -11.031 -2.703 2.488 1.00 0.00 C ATOM 355 CG ARG A 563 -11.253 -3.916 1.599 1.00 0.00 C ATOM 356 CD ARG A 563 -12.537 -4.646 1.947 1.00 0.00 C ATOM 357 NE ARG A 563 -13.609 -3.729 2.327 1.00 0.00 N ATOM 358 CZ ARG A 563 -14.702 -4.107 2.982 1.00 0.00 C ATOM 359 NH1 ARG A 563 -14.856 -5.373 3.343 1.00 0.00 N ATOM 360 NH2 ARG A 563 -15.640 -3.219 3.280 1.00 0.00 N ATOM 0 H ARG A 563 -8.726 -2.523 0.566 1.00 0.00 H new ATOM 0 HA ARG A 563 -9.479 -1.311 3.074 1.00 0.00 H new ATOM 0 HB2 ARG A 563 -11.291 -2.959 3.515 1.00 0.00 H new ATOM 0 HB3 ARG A 563 -11.704 -1.903 2.178 1.00 0.00 H new ATOM 0 HG2 ARG A 563 -11.286 -3.600 0.556 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -10.409 -4.598 1.699 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -12.857 -5.242 1.092 1.00 0.00 H new ATOM 0 HD3 ARG A 563 -12.348 -5.340 2.766 1.00 0.00 H new ATOM 0 HE ARG A 563 -13.513 -2.745 2.076 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -14.135 -6.059 3.118 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -15.695 -5.662 3.846 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -15.524 -2.243 3.007 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -16.478 -3.512 3.783 1.00 0.00 H new ATOM 374 N CYS A 564 -8.725 -3.494 4.291 1.00 0.00 N ATOM 375 CA CYS A 564 -7.906 -4.508 4.942 1.00 0.00 C ATOM 376 C CYS A 564 -8.795 -5.499 5.684 1.00 0.00 C ATOM 377 O CYS A 564 -9.960 -5.210 5.958 1.00 0.00 O ATOM 378 CB CYS A 564 -6.914 -3.859 5.908 1.00 0.00 C ATOM 379 SG CYS A 564 -7.544 -2.377 6.728 1.00 0.00 S ATOM 0 H CYS A 564 -9.339 -2.982 4.924 1.00 0.00 H new ATOM 0 HA CYS A 564 -7.341 -5.043 4.178 1.00 0.00 H new ATOM 0 HB2 CYS A 564 -6.632 -4.589 6.667 1.00 0.00 H new ATOM 0 HB3 CYS A 564 -6.007 -3.601 5.361 1.00 0.00 H new ATOM 0 HG CYS A 564 -6.777 -1.366 6.446 1.00 0.00 H new ATOM 385 N VAL A 565 -8.253 -6.669 6.000 1.00 0.00 N ATOM 386 CA VAL A 565 -9.025 -7.688 6.698 1.00 0.00 C ATOM 387 C VAL A 565 -8.169 -8.498 7.660 1.00 0.00 C ATOM 388 O VAL A 565 -6.977 -8.702 7.436 1.00 0.00 O ATOM 389 CB VAL A 565 -9.698 -8.653 5.709 1.00 0.00 C ATOM 390 CG1 VAL A 565 -10.587 -7.887 4.746 1.00 0.00 C ATOM 391 CG2 VAL A 565 -8.653 -9.461 4.956 1.00 0.00 C ATOM 0 H VAL A 565 -7.291 -6.934 5.786 1.00 0.00 H new ATOM 0 HA VAL A 565 -9.785 -7.153 7.267 1.00 0.00 H new ATOM 0 HB VAL A 565 -10.322 -9.348 6.271 1.00 0.00 H new ATOM 0 HG11 VAL A 565 -11.057 -8.584 4.052 1.00 0.00 H new ATOM 0 HG12 VAL A 565 -11.358 -7.357 5.306 1.00 0.00 H new ATOM 0 HG13 VAL A 565 -9.986 -7.169 4.188 1.00 0.00 H new ATOM 0 HG21 VAL A 565 -9.149 -10.138 4.261 1.00 0.00 H new ATOM 0 HG22 VAL A 565 -8.001 -8.786 4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 565 -8.060 -10.039 5.665 1.00 0.00 H new ATOM 401 N HIS A 566 -8.802 -8.966 8.729 1.00 0.00 N ATOM 402 CA HIS A 566 -8.120 -9.771 9.736 1.00 0.00 C ATOM 403 C HIS A 566 -6.900 -9.047 10.290 1.00 0.00 C ATOM 404 O HIS A 566 -5.814 -9.618 10.377 1.00 0.00 O ATOM 405 CB HIS A 566 -7.701 -11.116 9.141 1.00 0.00 C ATOM 406 CG HIS A 566 -7.905 -12.271 10.071 1.00 0.00 C ATOM 407 ND1 HIS A 566 -7.196 -12.427 11.244 1.00 0.00 N ATOM 408 CD2 HIS A 566 -8.746 -13.329 9.999 1.00 0.00 C ATOM 409 CE1 HIS A 566 -7.592 -13.531 11.852 1.00 0.00 C ATOM 410 NE2 HIS A 566 -8.531 -14.096 11.118 1.00 0.00 N ATOM 0 H HIS A 566 -9.790 -8.801 8.922 1.00 0.00 H new ATOM 0 HA HIS A 566 -8.817 -9.941 10.557 1.00 0.00 H new ATOM 0 HB2 HIS A 566 -8.268 -11.292 8.227 1.00 0.00 H new ATOM 0 HB3 HIS A 566 -6.649 -11.068 8.860 1.00 0.00 H new ATOM 0 HD2 HIS A 566 -9.454 -13.532 9.209 1.00 0.00 H new ATOM 0 HE1 HIS A 566 -7.212 -13.907 12.790 1.00 0.00 H new ATOM 0 HE2 HIS A 566 -9.019 -14.963 11.345 1.00 0.00 H new ATOM 419 N LEU A 567 -7.085 -7.787 10.669 1.00 0.00 N ATOM 420 CA LEU A 567 -5.997 -6.991 11.219 1.00 0.00 C ATOM 421 C LEU A 567 -5.824 -7.268 12.709 1.00 0.00 C ATOM 422 O LEU A 567 -6.798 -7.494 13.425 1.00 0.00 O ATOM 423 CB LEU A 567 -6.257 -5.503 10.985 1.00 0.00 C ATOM 424 CG LEU A 567 -6.208 -5.061 9.521 1.00 0.00 C ATOM 425 CD1 LEU A 567 -6.235 -3.546 9.423 1.00 0.00 C ATOM 426 CD2 LEU A 567 -4.967 -5.620 8.840 1.00 0.00 C ATOM 0 H LEU A 567 -7.977 -7.297 10.605 1.00 0.00 H new ATOM 0 HA LEU A 567 -5.076 -7.272 10.708 1.00 0.00 H new ATOM 0 HB2 LEU A 567 -7.237 -5.252 11.392 1.00 0.00 H new ATOM 0 HB3 LEU A 567 -5.521 -4.928 11.547 1.00 0.00 H new ATOM 0 HG LEU A 567 -7.087 -5.453 9.010 1.00 0.00 H new ATOM 0 HD11 LEU A 567 -6.200 -3.248 8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 567 -7.151 -3.168 9.877 1.00 0.00 H new ATOM 0 HD13 LEU A 567 -5.373 -3.132 9.947 1.00 0.00 H new ATOM 0 HD21 LEU A 567 -4.946 -5.297 7.799 1.00 0.00 H new ATOM 0 HD22 LEU A 567 -4.076 -5.255 9.351 1.00 0.00 H new ATOM 0 HD23 LEU A 567 -4.989 -6.709 8.881 1.00 0.00 H new ATOM 438 N ALA A 568 -4.576 -7.257 13.166 1.00 0.00 N ATOM 439 CA ALA A 568 -4.273 -7.515 14.568 1.00 0.00 C ATOM 440 C ALA A 568 -4.757 -6.378 15.462 1.00 0.00 C ATOM 441 O ALA A 568 -4.807 -5.222 15.045 1.00 0.00 O ATOM 442 CB ALA A 568 -2.778 -7.730 14.751 1.00 0.00 C ATOM 0 H ALA A 568 -3.758 -7.072 12.585 1.00 0.00 H new ATOM 0 HA ALA A 568 -4.803 -8.420 14.864 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -2.564 -7.922 15.802 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -2.457 -8.584 14.154 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -2.240 -6.839 14.428 1.00 0.00 H new ATOM 448 N ALA A 569 -5.107 -6.719 16.699 1.00 0.00 N ATOM 449 CA ALA A 569 -5.583 -5.734 17.663 1.00 0.00 C ATOM 450 C ALA A 569 -4.627 -5.618 18.843 1.00 0.00 C ATOM 451 O ALA A 569 -4.537 -6.526 19.670 1.00 0.00 O ATOM 452 CB ALA A 569 -6.966 -6.106 18.160 1.00 0.00 C ATOM 0 H ALA A 569 -5.069 -7.673 17.057 1.00 0.00 H new ATOM 0 HA ALA A 569 -5.631 -4.769 17.159 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -7.307 -5.361 18.879 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -7.658 -6.142 17.318 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -6.929 -7.084 18.641 1.00 0.00 H new ATOM 458 N MET A 570 -3.918 -4.501 18.922 1.00 0.00 N ATOM 459 CA MET A 570 -2.975 -4.278 20.009 1.00 0.00 C ATOM 460 C MET A 570 -3.673 -3.664 21.215 1.00 0.00 C ATOM 461 O MET A 570 -3.195 -3.766 22.343 1.00 0.00 O ATOM 462 CB MET A 570 -1.831 -3.384 19.546 1.00 0.00 C ATOM 463 CG MET A 570 -0.732 -4.159 18.851 1.00 0.00 C ATOM 464 SD MET A 570 -0.269 -3.445 17.265 1.00 0.00 S ATOM 465 CE MET A 570 -1.751 -3.769 16.320 1.00 0.00 C ATOM 0 H MET A 570 -3.977 -3.737 18.249 1.00 0.00 H new ATOM 0 HA MET A 570 -2.565 -5.243 20.307 1.00 0.00 H new ATOM 0 HB2 MET A 570 -2.220 -2.624 18.868 1.00 0.00 H new ATOM 0 HB3 MET A 570 -1.413 -2.860 20.406 1.00 0.00 H new ATOM 0 HG2 MET A 570 0.145 -4.196 19.497 1.00 0.00 H new ATOM 0 HG3 MET A 570 -1.059 -5.188 18.699 1.00 0.00 H new ATOM 0 HE1 MET A 570 -1.484 -4.240 15.374 1.00 0.00 H new ATOM 0 HE2 MET A 570 -2.405 -4.434 16.885 1.00 0.00 H new ATOM 0 HE3 MET A 570 -2.270 -2.831 16.124 1.00 0.00 H new ATOM 475 N ASP A 571 -4.812 -3.032 20.963 1.00 0.00 N ATOM 476 CA ASP A 571 -5.587 -2.406 22.026 1.00 0.00 C ATOM 477 C ASP A 571 -6.221 -3.465 22.921 1.00 0.00 C ATOM 478 O ASP A 571 -6.526 -4.569 22.469 1.00 0.00 O ATOM 479 CB ASP A 571 -6.671 -1.504 21.433 1.00 0.00 C ATOM 480 CG ASP A 571 -6.098 -0.420 20.541 1.00 0.00 C ATOM 481 OD1 ASP A 571 -5.189 -0.728 19.741 1.00 0.00 O ATOM 482 OD2 ASP A 571 -6.558 0.737 20.642 1.00 0.00 O ATOM 0 H ASP A 571 -5.219 -2.939 20.032 1.00 0.00 H new ATOM 0 HA ASP A 571 -4.913 -1.798 22.629 1.00 0.00 H new ATOM 0 HB2 ASP A 571 -7.371 -2.111 20.858 1.00 0.00 H new ATOM 0 HB3 ASP A 571 -7.238 -1.043 22.241 1.00 0.00 H new ATOM 487 N ALA A 572 -6.412 -3.127 24.190 1.00 0.00 N ATOM 488 CA ALA A 572 -7.006 -4.055 25.144 1.00 0.00 C ATOM 489 C ALA A 572 -8.468 -4.333 24.809 1.00 0.00 C ATOM 490 O ALA A 572 -9.100 -5.193 25.423 1.00 0.00 O ATOM 491 CB ALA A 572 -6.881 -3.509 26.558 1.00 0.00 C ATOM 0 H ALA A 572 -6.165 -2.218 24.582 1.00 0.00 H new ATOM 0 HA ALA A 572 -6.463 -4.998 25.080 1.00 0.00 H new ATOM 0 HB1 ALA A 572 -7.329 -4.212 27.260 1.00 0.00 H new ATOM 0 HB2 ALA A 572 -5.828 -3.372 26.803 1.00 0.00 H new ATOM 0 HB3 ALA A 572 -7.397 -2.551 26.625 1.00 0.00 H new ATOM 497 N ASN A 573 -8.999 -3.603 23.835 1.00 0.00 N ATOM 498 CA ASN A 573 -10.386 -3.775 23.424 1.00 0.00 C ATOM 499 C ASN A 573 -10.522 -4.929 22.434 1.00 0.00 C ATOM 500 O ASN A 573 -11.631 -5.351 22.108 1.00 0.00 O ATOM 501 CB ASN A 573 -10.917 -2.485 22.797 1.00 0.00 C ATOM 502 CG ASN A 573 -12.432 -2.449 22.746 1.00 0.00 C ATOM 503 OD1 ASN A 573 -13.106 -2.884 23.679 1.00 0.00 O ATOM 504 ND2 ASN A 573 -12.975 -1.928 21.651 1.00 0.00 N ATOM 0 H ASN A 573 -8.490 -2.887 23.316 1.00 0.00 H new ATOM 0 HA ASN A 573 -10.975 -4.010 24.311 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -10.555 -1.630 23.369 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -10.520 -2.385 21.787 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -13.990 -1.877 21.560 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -12.377 -1.579 20.902 1.00 0.00 H new ATOM 511 N GLY A 574 -9.388 -5.433 21.958 1.00 0.00 N ATOM 512 CA GLY A 574 -9.409 -6.529 21.008 1.00 0.00 C ATOM 513 C GLY A 574 -9.387 -6.044 19.573 1.00 0.00 C ATOM 514 O GLY A 574 -9.498 -6.839 18.640 1.00 0.00 O ATOM 0 H GLY A 574 -8.457 -5.103 22.213 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -8.550 -7.176 21.184 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -10.302 -7.132 21.172 1.00 0.00 H new ATOM 518 N TYR A 575 -9.249 -4.734 19.397 1.00 0.00 N ATOM 519 CA TYR A 575 -9.219 -4.137 18.068 1.00 0.00 C ATOM 520 C TYR A 575 -7.964 -3.298 17.850 1.00 0.00 C ATOM 521 O TYR A 575 -7.027 -3.343 18.647 1.00 0.00 O ATOM 522 CB TYR A 575 -10.458 -3.275 17.858 1.00 0.00 C ATOM 523 CG TYR A 575 -11.573 -4.020 17.181 1.00 0.00 C ATOM 524 CD1 TYR A 575 -11.942 -5.279 17.619 1.00 0.00 C ATOM 525 CD2 TYR A 575 -12.249 -3.468 16.108 1.00 0.00 C ATOM 526 CE1 TYR A 575 -12.965 -5.975 17.003 1.00 0.00 C ATOM 527 CE2 TYR A 575 -13.274 -4.152 15.483 1.00 0.00 C ATOM 528 CZ TYR A 575 -13.629 -5.407 15.936 1.00 0.00 C ATOM 529 OH TYR A 575 -14.649 -6.094 15.319 1.00 0.00 O ATOM 0 H TYR A 575 -9.156 -4.064 20.161 1.00 0.00 H new ATOM 0 HA TYR A 575 -9.207 -4.950 17.342 1.00 0.00 H new ATOM 0 HB2 TYR A 575 -10.806 -2.905 18.822 1.00 0.00 H new ATOM 0 HB3 TYR A 575 -10.192 -2.404 17.259 1.00 0.00 H new ATOM 0 HD1 TYR A 575 -11.423 -5.725 18.455 1.00 0.00 H new ATOM 0 HD2 TYR A 575 -11.971 -2.487 15.753 1.00 0.00 H new ATOM 0 HE1 TYR A 575 -13.243 -6.958 17.355 1.00 0.00 H new ATOM 0 HE2 TYR A 575 -13.794 -3.708 14.647 1.00 0.00 H new ATOM 0 HH TYR A 575 -15.012 -5.553 14.587 1.00 0.00 H new ATOM 539 N SER A 576 -7.957 -2.536 16.758 1.00 0.00 N ATOM 540 CA SER A 576 -6.818 -1.686 16.425 1.00 0.00 C ATOM 541 C SER A 576 -7.253 -0.487 15.583 1.00 0.00 C ATOM 542 O SER A 576 -8.385 -0.429 15.103 1.00 0.00 O ATOM 543 CB SER A 576 -5.762 -2.493 15.666 1.00 0.00 C ATOM 544 OG SER A 576 -4.758 -2.976 16.542 1.00 0.00 O ATOM 0 H SER A 576 -8.727 -2.490 16.090 1.00 0.00 H new ATOM 0 HA SER A 576 -6.391 -1.316 17.357 1.00 0.00 H new ATOM 0 HB2 SER A 576 -6.238 -3.331 15.157 1.00 0.00 H new ATOM 0 HB3 SER A 576 -5.307 -1.869 14.897 1.00 0.00 H new ATOM 0 HG SER A 576 -4.407 -3.825 16.201 1.00 0.00 H new ATOM 550 N ASP A 577 -6.336 0.459 15.395 1.00 0.00 N ATOM 551 CA ASP A 577 -6.606 1.653 14.595 1.00 0.00 C ATOM 552 C ASP A 577 -5.664 1.675 13.398 1.00 0.00 C ATOM 553 O ASP A 577 -4.848 2.581 13.243 1.00 0.00 O ATOM 554 CB ASP A 577 -6.415 2.915 15.442 1.00 0.00 C ATOM 555 CG ASP A 577 -7.353 2.957 16.632 1.00 0.00 C ATOM 556 OD1 ASP A 577 -8.216 2.060 16.740 1.00 0.00 O ATOM 557 OD2 ASP A 577 -7.223 3.886 17.457 1.00 0.00 O ATOM 0 H ASP A 577 -5.395 0.422 15.787 1.00 0.00 H new ATOM 0 HA ASP A 577 -7.638 1.629 14.245 1.00 0.00 H new ATOM 0 HB2 ASP A 577 -5.384 2.962 15.793 1.00 0.00 H new ATOM 0 HB3 ASP A 577 -6.580 3.795 14.821 1.00 0.00 H new ATOM 562 N PRO A 578 -5.750 0.634 12.562 1.00 0.00 N ATOM 563 CA PRO A 578 -4.883 0.466 11.389 1.00 0.00 C ATOM 564 C PRO A 578 -5.094 1.468 10.261 1.00 0.00 C ATOM 565 O PRO A 578 -6.217 1.838 9.920 1.00 0.00 O ATOM 566 CB PRO A 578 -5.228 -0.939 10.893 1.00 0.00 C ATOM 567 CG PRO A 578 -6.602 -1.199 11.405 1.00 0.00 C ATOM 568 CD PRO A 578 -6.679 -0.495 12.729 1.00 0.00 C ATOM 0 HA PRO A 578 -3.844 0.625 11.678 1.00 0.00 H new ATOM 0 HB2 PRO A 578 -5.195 -0.993 9.805 1.00 0.00 H new ATOM 0 HB3 PRO A 578 -4.520 -1.676 11.270 1.00 0.00 H new ATOM 0 HG2 PRO A 578 -7.356 -0.820 10.715 1.00 0.00 H new ATOM 0 HG3 PRO A 578 -6.782 -2.268 11.518 1.00 0.00 H new ATOM 0 HD2 PRO A 578 -7.692 -0.155 12.946 1.00 0.00 H new ATOM 0 HD3 PRO A 578 -6.378 -1.146 13.550 1.00 0.00 H new ATOM 576 N PHE A 579 -3.972 1.840 9.654 1.00 0.00 N ATOM 577 CA PHE A 579 -3.934 2.736 8.508 1.00 0.00 C ATOM 578 C PHE A 579 -2.848 2.229 7.571 1.00 0.00 C ATOM 579 O PHE A 579 -1.989 1.455 7.993 1.00 0.00 O ATOM 580 CB PHE A 579 -3.665 4.187 8.916 1.00 0.00 C ATOM 581 CG PHE A 579 -2.348 4.409 9.600 1.00 0.00 C ATOM 582 CD1 PHE A 579 -2.142 3.961 10.895 1.00 0.00 C ATOM 583 CD2 PHE A 579 -1.320 5.087 8.959 1.00 0.00 C ATOM 584 CE1 PHE A 579 -0.938 4.178 11.536 1.00 0.00 C ATOM 585 CE2 PHE A 579 -0.117 5.312 9.595 1.00 0.00 C ATOM 586 CZ PHE A 579 0.076 4.855 10.886 1.00 0.00 C ATOM 0 H PHE A 579 -3.050 1.521 9.951 1.00 0.00 H new ATOM 0 HA PHE A 579 -4.906 2.737 8.015 1.00 0.00 H new ATOM 0 HB2 PHE A 579 -3.708 4.815 8.026 1.00 0.00 H new ATOM 0 HB3 PHE A 579 -4.464 4.519 9.579 1.00 0.00 H new ATOM 0 HD1 PHE A 579 -2.933 3.436 11.410 1.00 0.00 H new ATOM 0 HD2 PHE A 579 -1.464 5.443 7.950 1.00 0.00 H new ATOM 0 HE1 PHE A 579 -0.789 3.819 12.544 1.00 0.00 H new ATOM 0 HE2 PHE A 579 0.673 5.844 9.086 1.00 0.00 H new ATOM 0 HZ PHE A 579 1.018 5.027 11.385 1.00 0.00 H new ATOM 596 N VAL A 580 -2.877 2.625 6.310 1.00 0.00 N ATOM 597 CA VAL A 580 -1.871 2.140 5.375 1.00 0.00 C ATOM 598 C VAL A 580 -0.935 3.242 4.905 1.00 0.00 C ATOM 599 O VAL A 580 -1.367 4.335 4.542 1.00 0.00 O ATOM 600 CB VAL A 580 -2.507 1.467 4.146 1.00 0.00 C ATOM 601 CG1 VAL A 580 -1.429 0.839 3.276 1.00 0.00 C ATOM 602 CG2 VAL A 580 -3.527 0.423 4.570 1.00 0.00 C ATOM 0 H VAL A 580 -3.566 3.265 5.915 1.00 0.00 H new ATOM 0 HA VAL A 580 -1.290 1.402 5.929 1.00 0.00 H new ATOM 0 HB VAL A 580 -3.026 2.229 3.564 1.00 0.00 H new ATOM 0 HG11 VAL A 580 -1.891 0.366 2.409 1.00 0.00 H new ATOM 0 HG12 VAL A 580 -0.736 1.611 2.942 1.00 0.00 H new ATOM 0 HG13 VAL A 580 -0.887 0.090 3.853 1.00 0.00 H new ATOM 0 HG21 VAL A 580 -3.964 -0.040 3.685 1.00 0.00 H new ATOM 0 HG22 VAL A 580 -3.037 -0.340 5.174 1.00 0.00 H new ATOM 0 HG23 VAL A 580 -4.313 0.899 5.156 1.00 0.00 H new ATOM 612 N LYS A 581 0.354 2.927 4.900 1.00 0.00 N ATOM 613 CA LYS A 581 1.374 3.863 4.457 1.00 0.00 C ATOM 614 C LYS A 581 2.065 3.326 3.212 1.00 0.00 C ATOM 615 O LYS A 581 2.413 2.147 3.145 1.00 0.00 O ATOM 616 CB LYS A 581 2.403 4.103 5.563 1.00 0.00 C ATOM 617 CG LYS A 581 1.821 4.059 6.967 1.00 0.00 C ATOM 618 CD LYS A 581 2.625 4.928 7.919 1.00 0.00 C ATOM 619 CE LYS A 581 2.536 4.442 9.355 1.00 0.00 C ATOM 620 NZ LYS A 581 3.854 3.976 9.863 1.00 0.00 N ATOM 0 H LYS A 581 0.718 2.023 5.201 1.00 0.00 H new ATOM 0 HA LYS A 581 0.894 4.812 4.220 1.00 0.00 H new ATOM 0 HB2 LYS A 581 3.190 3.353 5.483 1.00 0.00 H new ATOM 0 HB3 LYS A 581 2.872 5.074 5.405 1.00 0.00 H new ATOM 0 HG2 LYS A 581 0.786 4.399 6.946 1.00 0.00 H new ATOM 0 HG3 LYS A 581 1.812 3.031 7.328 1.00 0.00 H new ATOM 0 HD2 LYS A 581 3.669 4.938 7.605 1.00 0.00 H new ATOM 0 HD3 LYS A 581 2.265 5.955 7.862 1.00 0.00 H new ATOM 0 HE2 LYS A 581 2.166 5.248 9.989 1.00 0.00 H new ATOM 0 HE3 LYS A 581 1.813 3.629 9.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 3.859 2.937 9.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 4.606 4.295 9.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 4.019 4.369 10.811 1.00 0.00 H new ATOM 634 N LEU A 582 2.249 4.188 2.220 1.00 0.00 N ATOM 635 CA LEU A 582 2.886 3.779 0.976 1.00 0.00 C ATOM 636 C LEU A 582 4.070 4.673 0.636 1.00 0.00 C ATOM 637 O LEU A 582 3.997 5.896 0.758 1.00 0.00 O ATOM 638 CB LEU A 582 1.872 3.811 -0.162 1.00 0.00 C ATOM 639 CG LEU A 582 0.422 3.614 0.273 1.00 0.00 C ATOM 640 CD1 LEU A 582 -0.363 4.907 0.114 1.00 0.00 C ATOM 641 CD2 LEU A 582 -0.219 2.492 -0.524 1.00 0.00 C ATOM 0 H LEU A 582 1.968 5.168 2.252 1.00 0.00 H new ATOM 0 HA LEU A 582 3.257 2.763 1.108 1.00 0.00 H new ATOM 0 HB2 LEU A 582 1.956 4.767 -0.679 1.00 0.00 H new ATOM 0 HB3 LEU A 582 2.130 3.035 -0.883 1.00 0.00 H new ATOM 0 HG LEU A 582 0.409 3.337 1.327 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -1.394 4.748 0.429 1.00 0.00 H new ATOM 0 HD12 LEU A 582 0.088 5.685 0.730 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -0.346 5.217 -0.931 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -1.253 2.362 -0.203 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -0.197 2.741 -1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 582 0.331 1.566 -0.357 1.00 0.00 H new ATOM 653 N TRP A 583 5.159 4.051 0.202 1.00 0.00 N ATOM 654 CA TRP A 583 6.361 4.788 -0.164 1.00 0.00 C ATOM 655 C TRP A 583 7.080 4.115 -1.328 1.00 0.00 C ATOM 656 O TRP A 583 7.527 2.973 -1.220 1.00 0.00 O ATOM 657 CB TRP A 583 7.300 4.907 1.035 1.00 0.00 C ATOM 658 CG TRP A 583 8.699 5.273 0.653 1.00 0.00 C ATOM 659 CD1 TRP A 583 9.103 5.877 -0.502 1.00 0.00 C ATOM 660 CD2 TRP A 583 9.880 5.059 1.429 1.00 0.00 C ATOM 661 NE1 TRP A 583 10.464 6.040 -0.498 1.00 0.00 N ATOM 662 CE2 TRP A 583 10.966 5.551 0.681 1.00 0.00 C ATOM 663 CE3 TRP A 583 10.123 4.497 2.683 1.00 0.00 C ATOM 664 CZ2 TRP A 583 12.276 5.497 1.149 1.00 0.00 C ATOM 665 CZ3 TRP A 583 11.423 4.446 3.149 1.00 0.00 C ATOM 666 CH2 TRP A 583 12.485 4.945 2.383 1.00 0.00 C ATOM 0 H TRP A 583 5.234 3.039 0.095 1.00 0.00 H new ATOM 0 HA TRP A 583 6.061 5.788 -0.478 1.00 0.00 H new ATOM 0 HB2 TRP A 583 6.909 5.658 1.721 1.00 0.00 H new ATOM 0 HB3 TRP A 583 7.313 3.959 1.574 1.00 0.00 H new ATOM 0 HD1 TRP A 583 8.446 6.182 -1.303 1.00 0.00 H new ATOM 0 HE1 TRP A 583 11.014 6.457 -1.249 1.00 0.00 H new ATOM 0 HE3 TRP A 583 9.310 4.109 3.279 1.00 0.00 H new ATOM 0 HZ2 TRP A 583 13.097 5.877 0.559 1.00 0.00 H new ATOM 0 HZ3 TRP A 583 11.624 4.015 4.119 1.00 0.00 H new ATOM 0 HH2 TRP A 583 13.490 4.893 2.775 1.00 0.00 H new ATOM 677 N LEU A 584 7.190 4.833 -2.441 1.00 0.00 N ATOM 678 CA LEU A 584 7.858 4.311 -3.626 1.00 0.00 C ATOM 679 C LEU A 584 9.321 4.737 -3.660 1.00 0.00 C ATOM 680 O LEU A 584 9.637 5.911 -3.855 1.00 0.00 O ATOM 681 CB LEU A 584 7.138 4.787 -4.890 1.00 0.00 C ATOM 682 CG LEU A 584 7.603 4.134 -6.193 1.00 0.00 C ATOM 683 CD1 LEU A 584 7.001 2.744 -6.334 1.00 0.00 C ATOM 684 CD2 LEU A 584 7.230 5.002 -7.386 1.00 0.00 C ATOM 0 H LEU A 584 6.824 5.779 -2.546 1.00 0.00 H new ATOM 0 HA LEU A 584 7.822 3.222 -3.586 1.00 0.00 H new ATOM 0 HB2 LEU A 584 6.070 4.602 -4.771 1.00 0.00 H new ATOM 0 HB3 LEU A 584 7.267 5.866 -4.977 1.00 0.00 H new ATOM 0 HG LEU A 584 8.688 4.038 -6.164 1.00 0.00 H new ATOM 0 HD11 LEU A 584 7.341 2.293 -7.266 1.00 0.00 H new ATOM 0 HD12 LEU A 584 7.316 2.124 -5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 584 5.914 2.818 -6.343 1.00 0.00 H new ATOM 0 HD21 LEU A 584 7.568 4.523 -8.305 1.00 0.00 H new ATOM 0 HD22 LEU A 584 6.148 5.128 -7.420 1.00 0.00 H new ATOM 0 HD23 LEU A 584 7.706 5.978 -7.289 1.00 0.00 H new ATOM 696 N LYS A 585 10.211 3.768 -3.467 1.00 0.00 N ATOM 697 CA LYS A 585 11.645 4.030 -3.471 1.00 0.00 C ATOM 698 C LYS A 585 12.203 3.990 -4.890 1.00 0.00 C ATOM 699 O LYS A 585 11.702 3.267 -5.752 1.00 0.00 O ATOM 700 CB LYS A 585 12.371 3.007 -2.595 1.00 0.00 C ATOM 701 CG LYS A 585 11.626 2.667 -1.314 1.00 0.00 C ATOM 702 CD LYS A 585 12.585 2.401 -0.166 1.00 0.00 C ATOM 703 CE LYS A 585 12.103 1.254 0.708 1.00 0.00 C ATOM 704 NZ LYS A 585 12.850 1.182 1.993 1.00 0.00 N ATOM 0 H LYS A 585 9.963 2.792 -3.306 1.00 0.00 H new ATOM 0 HA LYS A 585 11.809 5.029 -3.066 1.00 0.00 H new ATOM 0 HB2 LYS A 585 12.525 2.094 -3.169 1.00 0.00 H new ATOM 0 HB3 LYS A 585 13.358 3.394 -2.340 1.00 0.00 H new ATOM 0 HG2 LYS A 585 10.960 3.489 -1.050 1.00 0.00 H new ATOM 0 HG3 LYS A 585 11.000 1.790 -1.478 1.00 0.00 H new ATOM 0 HD2 LYS A 585 13.573 2.167 -0.563 1.00 0.00 H new ATOM 0 HD3 LYS A 585 12.689 3.302 0.439 1.00 0.00 H new ATOM 0 HE2 LYS A 585 11.039 1.376 0.913 1.00 0.00 H new ATOM 0 HE3 LYS A 585 12.218 0.314 0.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 585 12.491 0.387 2.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 585 13.862 1.040 1.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 585 12.720 2.069 2.520 1.00 0.00 H new ATOM 812 N ALA A 592 7.218 10.776 -1.123 1.00 0.00 N ATOM 813 CA ALA A 592 6.925 9.417 -1.554 1.00 0.00 C ATOM 814 C ALA A 592 6.146 8.666 -0.481 1.00 0.00 C ATOM 815 O ALA A 592 5.387 7.745 -0.779 1.00 0.00 O ATOM 816 CB ALA A 592 8.215 8.683 -1.893 1.00 0.00 C ATOM 0 HA ALA A 592 6.306 9.465 -2.450 1.00 0.00 H new ATOM 0 HB1 ALA A 592 7.982 7.668 -2.214 1.00 0.00 H new ATOM 0 HB2 ALA A 592 8.732 9.208 -2.696 1.00 0.00 H new ATOM 0 HB3 ALA A 592 8.856 8.647 -1.012 1.00 0.00 H new ATOM 822 N LYS A 593 6.335 9.076 0.770 1.00 0.00 N ATOM 823 CA LYS A 593 5.649 8.452 1.891 1.00 0.00 C ATOM 824 C LYS A 593 4.162 8.796 1.869 1.00 0.00 C ATOM 825 O LYS A 593 3.761 9.813 1.301 1.00 0.00 O ATOM 826 CB LYS A 593 6.276 8.917 3.204 1.00 0.00 C ATOM 827 CG LYS A 593 7.795 8.853 3.210 1.00 0.00 C ATOM 828 CD LYS A 593 8.299 7.462 3.561 1.00 0.00 C ATOM 829 CE LYS A 593 9.818 7.400 3.553 1.00 0.00 C ATOM 830 NZ LYS A 593 10.424 8.509 4.341 1.00 0.00 N ATOM 0 H LYS A 593 6.959 9.839 1.031 1.00 0.00 H new ATOM 0 HA LYS A 593 5.753 7.370 1.807 1.00 0.00 H new ATOM 0 HB2 LYS A 593 5.963 9.942 3.403 1.00 0.00 H new ATOM 0 HB3 LYS A 593 5.892 8.302 4.018 1.00 0.00 H new ATOM 0 HG2 LYS A 593 8.175 9.141 2.230 1.00 0.00 H new ATOM 0 HG3 LYS A 593 8.187 9.574 3.928 1.00 0.00 H new ATOM 0 HD2 LYS A 593 7.928 7.177 4.545 1.00 0.00 H new ATOM 0 HD3 LYS A 593 7.901 6.739 2.849 1.00 0.00 H new ATOM 0 HE2 LYS A 593 10.144 6.444 3.962 1.00 0.00 H new ATOM 0 HE3 LYS A 593 10.178 7.446 2.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 593 11.425 8.297 4.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 593 10.351 9.397 3.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 593 9.919 8.609 5.245 1.00 0.00 H new ATOM 844 N HIS A 594 3.346 7.946 2.485 1.00 0.00 N ATOM 845 CA HIS A 594 1.904 8.172 2.528 1.00 0.00 C ATOM 846 C HIS A 594 1.265 7.461 3.717 1.00 0.00 C ATOM 847 O HIS A 594 1.885 6.606 4.345 1.00 0.00 O ATOM 848 CB HIS A 594 1.249 7.688 1.233 1.00 0.00 C ATOM 849 CG HIS A 594 1.414 8.631 0.083 1.00 0.00 C ATOM 850 ND1 HIS A 594 1.371 10.003 0.221 1.00 0.00 N ATOM 851 CD2 HIS A 594 1.623 8.394 -1.234 1.00 0.00 C ATOM 852 CE1 HIS A 594 1.545 10.568 -0.961 1.00 0.00 C ATOM 853 NE2 HIS A 594 1.700 9.614 -1.860 1.00 0.00 N ATOM 0 H HIS A 594 3.656 7.098 2.959 1.00 0.00 H new ATOM 0 HA HIS A 594 1.743 9.244 2.639 1.00 0.00 H new ATOM 0 HB2 HIS A 594 1.673 6.721 0.962 1.00 0.00 H new ATOM 0 HB3 HIS A 594 0.185 7.530 1.412 1.00 0.00 H new ATOM 0 HD2 HIS A 594 1.712 7.426 -1.704 1.00 0.00 H new ATOM 0 HE1 HIS A 594 1.558 11.630 -1.158 1.00 0.00 H new ATOM 0 HE2 HIS A 594 1.852 9.759 -2.858 1.00 0.00 H new ATOM 862 N LYS A 595 0.017 7.824 4.011 1.00 0.00 N ATOM 863 CA LYS A 595 -0.729 7.227 5.118 1.00 0.00 C ATOM 864 C LYS A 595 -2.231 7.407 4.911 1.00 0.00 C ATOM 865 O LYS A 595 -2.745 8.523 4.992 1.00 0.00 O ATOM 866 CB LYS A 595 -0.314 7.853 6.454 1.00 0.00 C ATOM 867 CG LYS A 595 1.160 7.691 6.779 1.00 0.00 C ATOM 868 CD LYS A 595 1.993 8.814 6.182 1.00 0.00 C ATOM 869 CE LYS A 595 3.395 8.342 5.833 1.00 0.00 C ATOM 870 NZ LYS A 595 4.431 9.025 6.656 1.00 0.00 N ATOM 0 H LYS A 595 -0.502 8.534 3.494 1.00 0.00 H new ATOM 0 HA LYS A 595 -0.498 6.162 5.142 1.00 0.00 H new ATOM 0 HB2 LYS A 595 -0.557 8.915 6.437 1.00 0.00 H new ATOM 0 HB3 LYS A 595 -0.904 7.404 7.253 1.00 0.00 H new ATOM 0 HG2 LYS A 595 1.295 7.673 7.861 1.00 0.00 H new ATOM 0 HG3 LYS A 595 1.514 6.733 6.398 1.00 0.00 H new ATOM 0 HD2 LYS A 595 1.503 9.196 5.286 1.00 0.00 H new ATOM 0 HD3 LYS A 595 2.052 9.641 6.890 1.00 0.00 H new ATOM 0 HE2 LYS A 595 3.464 7.265 5.984 1.00 0.00 H new ATOM 0 HE3 LYS A 595 3.589 8.529 4.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 5.373 8.676 6.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 4.383 10.051 6.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 4.262 8.826 7.663 1.00 0.00 H new ATOM 884 N THR A 596 -2.930 6.309 4.641 1.00 0.00 N ATOM 885 CA THR A 596 -4.374 6.360 4.423 1.00 0.00 C ATOM 886 C THR A 596 -5.104 6.717 5.711 1.00 0.00 C ATOM 887 O THR A 596 -4.584 6.509 6.808 1.00 0.00 O ATOM 888 CB THR A 596 -4.886 5.017 3.899 1.00 0.00 C ATOM 889 OG1 THR A 596 -5.013 4.083 4.956 1.00 0.00 O ATOM 890 CG2 THR A 596 -3.994 4.400 2.847 1.00 0.00 C ATOM 0 H THR A 596 -2.523 5.376 4.568 1.00 0.00 H new ATOM 0 HA THR A 596 -4.572 7.133 3.680 1.00 0.00 H new ATOM 0 HB THR A 596 -5.852 5.237 3.445 1.00 0.00 H new ATOM 0 HG1 THR A 596 -5.927 3.729 4.972 1.00 0.00 H new ATOM 0 HG21 THR A 596 -4.419 3.450 2.521 1.00 0.00 H new ATOM 0 HG22 THR A 596 -3.917 5.074 1.994 1.00 0.00 H new ATOM 0 HG23 THR A 596 -3.002 4.230 3.265 1.00 0.00 H new ATOM 898 N GLN A 597 -6.314 7.247 5.574 1.00 0.00 N ATOM 899 CA GLN A 597 -7.110 7.619 6.734 1.00 0.00 C ATOM 900 C GLN A 597 -6.971 6.566 7.827 1.00 0.00 C ATOM 901 O GLN A 597 -6.725 5.394 7.545 1.00 0.00 O ATOM 902 CB GLN A 597 -8.579 7.782 6.342 1.00 0.00 C ATOM 903 CG GLN A 597 -9.164 6.562 5.650 1.00 0.00 C ATOM 904 CD GLN A 597 -9.907 6.915 4.376 1.00 0.00 C ATOM 905 OE1 GLN A 597 -9.321 6.961 3.295 1.00 0.00 O ATOM 906 NE2 GLN A 597 -11.205 7.168 4.499 1.00 0.00 N ATOM 0 H GLN A 597 -6.762 7.427 4.676 1.00 0.00 H new ATOM 0 HA GLN A 597 -6.744 8.572 7.116 1.00 0.00 H new ATOM 0 HB2 GLN A 597 -9.163 7.997 7.237 1.00 0.00 H new ATOM 0 HB3 GLN A 597 -8.677 8.645 5.683 1.00 0.00 H new ATOM 0 HG2 GLN A 597 -8.362 5.862 5.416 1.00 0.00 H new ATOM 0 HG3 GLN A 597 -9.843 6.052 6.333 1.00 0.00 H new ATOM 0 HE21 GLN A 597 -11.650 7.118 5.416 1.00 0.00 H new ATOM 0 HE22 GLN A 597 -11.757 7.412 3.677 1.00 0.00 H new ATOM 915 N ILE A 598 -7.122 6.990 9.075 1.00 0.00 N ATOM 916 CA ILE A 598 -7.005 6.078 10.205 1.00 0.00 C ATOM 917 C ILE A 598 -8.323 5.364 10.480 1.00 0.00 C ATOM 918 O ILE A 598 -9.343 6.002 10.744 1.00 0.00 O ATOM 919 CB ILE A 598 -6.567 6.816 11.486 1.00 0.00 C ATOM 920 CG1 ILE A 598 -5.558 7.920 11.157 1.00 0.00 C ATOM 921 CG2 ILE A 598 -5.980 5.833 12.487 1.00 0.00 C ATOM 922 CD1 ILE A 598 -4.128 7.434 11.071 1.00 0.00 C ATOM 0 H ILE A 598 -7.325 7.957 9.330 1.00 0.00 H new ATOM 0 HA ILE A 598 -6.244 5.346 9.934 1.00 0.00 H new ATOM 0 HB ILE A 598 -7.445 7.282 11.933 1.00 0.00 H new ATOM 0 HG12 ILE A 598 -5.833 8.380 10.208 1.00 0.00 H new ATOM 0 HG13 ILE A 598 -5.623 8.697 11.918 1.00 0.00 H new ATOM 0 HG21 ILE A 598 -5.675 6.368 13.386 1.00 0.00 H new ATOM 0 HG22 ILE A 598 -6.730 5.086 12.746 1.00 0.00 H new ATOM 0 HG23 ILE A 598 -5.113 5.340 12.047 1.00 0.00 H new ATOM 0 HD11 ILE A 598 -3.472 8.272 10.835 1.00 0.00 H new ATOM 0 HD12 ILE A 598 -3.833 7.001 12.027 1.00 0.00 H new ATOM 0 HD13 ILE A 598 -4.047 6.679 10.289 1.00 0.00 H new ATOM 934 N LYS A 599 -8.291 4.038 10.427 1.00 0.00 N ATOM 935 CA LYS A 599 -9.481 3.234 10.682 1.00 0.00 C ATOM 936 C LYS A 599 -9.574 2.891 12.165 1.00 0.00 C ATOM 937 O LYS A 599 -9.265 1.773 12.579 1.00 0.00 O ATOM 938 CB LYS A 599 -9.450 1.959 9.840 1.00 0.00 C ATOM 939 CG LYS A 599 -9.488 2.221 8.343 1.00 0.00 C ATOM 940 CD LYS A 599 -10.855 2.719 7.901 1.00 0.00 C ATOM 941 CE LYS A 599 -10.887 4.233 7.782 1.00 0.00 C ATOM 942 NZ LYS A 599 -12.174 4.801 8.267 1.00 0.00 N ATOM 0 H LYS A 599 -7.454 3.496 10.210 1.00 0.00 H new ATOM 0 HA LYS A 599 -10.362 3.811 10.402 1.00 0.00 H new ATOM 0 HB2 LYS A 599 -8.548 1.396 10.080 1.00 0.00 H new ATOM 0 HB3 LYS A 599 -10.299 1.332 10.113 1.00 0.00 H new ATOM 0 HG2 LYS A 599 -8.729 2.958 8.082 1.00 0.00 H new ATOM 0 HG3 LYS A 599 -9.241 1.305 7.806 1.00 0.00 H new ATOM 0 HD2 LYS A 599 -11.112 2.272 6.941 1.00 0.00 H new ATOM 0 HD3 LYS A 599 -11.610 2.394 8.616 1.00 0.00 H new ATOM 0 HE2 LYS A 599 -10.063 4.660 8.355 1.00 0.00 H new ATOM 0 HE3 LYS A 599 -10.733 4.519 6.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 -12.155 5.836 8.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 -12.958 4.414 7.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 -12.309 4.550 9.267 1.00 0.00 H new ATOM 956 N LYS A 600 -9.984 3.873 12.961 1.00 0.00 N ATOM 957 CA LYS A 600 -10.101 3.703 14.405 1.00 0.00 C ATOM 958 C LYS A 600 -10.965 2.499 14.775 1.00 0.00 C ATOM 959 O LYS A 600 -11.934 2.173 14.090 1.00 0.00 O ATOM 960 CB LYS A 600 -10.685 4.968 15.036 1.00 0.00 C ATOM 961 CG LYS A 600 -9.767 6.175 14.942 1.00 0.00 C ATOM 962 CD LYS A 600 -8.411 5.893 15.568 1.00 0.00 C ATOM 963 CE LYS A 600 -8.012 6.985 16.547 1.00 0.00 C ATOM 964 NZ LYS A 600 -8.425 8.335 16.072 1.00 0.00 N ATOM 0 H LYS A 600 -10.243 4.802 12.627 1.00 0.00 H new ATOM 0 HA LYS A 600 -9.098 3.523 14.793 1.00 0.00 H new ATOM 0 HB2 LYS A 600 -11.631 5.203 14.549 1.00 0.00 H new ATOM 0 HB3 LYS A 600 -10.907 4.772 16.085 1.00 0.00 H new ATOM 0 HG2 LYS A 600 -9.636 6.453 13.896 1.00 0.00 H new ATOM 0 HG3 LYS A 600 -10.230 7.026 15.442 1.00 0.00 H new ATOM 0 HD2 LYS A 600 -8.440 4.933 16.084 1.00 0.00 H new ATOM 0 HD3 LYS A 600 -7.657 5.812 14.785 1.00 0.00 H new ATOM 0 HE2 LYS A 600 -8.467 6.787 17.517 1.00 0.00 H new ATOM 0 HE3 LYS A 600 -6.932 6.966 16.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 600 -7.777 9.052 16.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 600 -8.394 8.362 15.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 600 -9.393 8.535 16.395 1.00 0.00 H new ATOM 978 N LYS A 601 -10.603 1.860 15.884 1.00 0.00 N ATOM 979 CA LYS A 601 -11.326 0.699 16.397 1.00 0.00 C ATOM 980 C LYS A 601 -11.913 -0.160 15.280 1.00 0.00 C ATOM 981 O LYS A 601 -13.126 -0.176 15.070 1.00 0.00 O ATOM 982 CB LYS A 601 -12.445 1.153 17.337 1.00 0.00 C ATOM 983 CG LYS A 601 -12.066 1.087 18.808 1.00 0.00 C ATOM 984 CD LYS A 601 -10.846 1.942 19.109 1.00 0.00 C ATOM 985 CE LYS A 601 -10.010 1.342 20.228 1.00 0.00 C ATOM 986 NZ LYS A 601 -10.807 1.135 21.468 1.00 0.00 N ATOM 0 H LYS A 601 -9.801 2.132 16.452 1.00 0.00 H new ATOM 0 HA LYS A 601 -10.607 0.086 16.940 1.00 0.00 H new ATOM 0 HB2 LYS A 601 -12.725 2.176 17.088 1.00 0.00 H new ATOM 0 HB3 LYS A 601 -13.325 0.532 17.168 1.00 0.00 H new ATOM 0 HG2 LYS A 601 -12.906 1.423 19.416 1.00 0.00 H new ATOM 0 HG3 LYS A 601 -11.864 0.053 19.087 1.00 0.00 H new ATOM 0 HD2 LYS A 601 -10.237 2.039 18.210 1.00 0.00 H new ATOM 0 HD3 LYS A 601 -11.164 2.946 19.389 1.00 0.00 H new ATOM 0 HE2 LYS A 601 -9.595 0.389 19.900 1.00 0.00 H new ATOM 0 HE3 LYS A 601 -9.167 1.999 20.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 601 -10.173 0.870 22.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 601 -11.306 2.015 21.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 601 -11.500 0.376 21.312 1.00 0.00 H new ATOM 1000 N THR A 602 -11.051 -0.888 14.579 1.00 0.00 N ATOM 1001 CA THR A 602 -11.494 -1.763 13.503 1.00 0.00 C ATOM 1002 C THR A 602 -10.315 -2.523 12.904 1.00 0.00 C ATOM 1003 O THR A 602 -9.207 -1.996 12.809 1.00 0.00 O ATOM 1004 CB THR A 602 -12.197 -0.952 12.421 1.00 0.00 C ATOM 1005 OG1 THR A 602 -13.040 -1.779 11.638 1.00 0.00 O ATOM 1006 CG2 THR A 602 -11.229 -0.269 11.491 1.00 0.00 C ATOM 0 H THR A 602 -10.043 -0.889 14.737 1.00 0.00 H new ATOM 0 HA THR A 602 -12.196 -2.487 13.917 1.00 0.00 H new ATOM 0 HB THR A 602 -12.779 -0.195 12.947 1.00 0.00 H new ATOM 0 HG1 THR A 602 -13.482 -1.238 10.951 1.00 0.00 H new ATOM 0 HG21 THR A 602 -11.782 0.295 10.740 1.00 0.00 H new ATOM 0 HG22 THR A 602 -10.595 0.411 12.061 1.00 0.00 H new ATOM 0 HG23 THR A 602 -10.608 -1.017 10.999 1.00 0.00 H new ATOM 1014 N LEU A 603 -10.560 -3.768 12.508 1.00 0.00 N ATOM 1015 CA LEU A 603 -9.519 -4.606 11.925 1.00 0.00 C ATOM 1016 C LEU A 603 -9.876 -5.010 10.498 1.00 0.00 C ATOM 1017 O LEU A 603 -9.036 -5.523 9.757 1.00 0.00 O ATOM 1018 CB LEU A 603 -9.315 -5.856 12.779 1.00 0.00 C ATOM 1019 CG LEU A 603 -9.180 -5.599 14.281 1.00 0.00 C ATOM 1020 CD1 LEU A 603 -8.736 -6.861 15.003 1.00 0.00 C ATOM 1021 CD2 LEU A 603 -8.202 -4.463 14.539 1.00 0.00 C ATOM 0 H LEU A 603 -11.472 -4.219 12.581 1.00 0.00 H new ATOM 0 HA LEU A 603 -8.595 -4.029 11.898 1.00 0.00 H new ATOM 0 HB2 LEU A 603 -10.156 -6.530 12.615 1.00 0.00 H new ATOM 0 HB3 LEU A 603 -8.420 -6.372 12.432 1.00 0.00 H new ATOM 0 HG LEU A 603 -10.156 -5.309 14.670 1.00 0.00 H new ATOM 0 HD11 LEU A 603 -8.646 -6.657 16.070 1.00 0.00 H new ATOM 0 HD12 LEU A 603 -9.473 -7.649 14.845 1.00 0.00 H new ATOM 0 HD13 LEU A 603 -7.771 -7.183 14.612 1.00 0.00 H new ATOM 0 HD21 LEU A 603 -8.117 -4.293 15.612 1.00 0.00 H new ATOM 0 HD22 LEU A 603 -7.224 -4.726 14.135 1.00 0.00 H new ATOM 0 HD23 LEU A 603 -8.563 -3.555 14.055 1.00 0.00 H new ATOM 1033 N ASN A 604 -11.127 -4.778 10.122 1.00 0.00 N ATOM 1034 CA ASN A 604 -11.600 -5.118 8.784 1.00 0.00 C ATOM 1035 C ASN A 604 -12.270 -3.912 8.130 1.00 0.00 C ATOM 1036 O ASN A 604 -13.363 -4.022 7.574 1.00 0.00 O ATOM 1037 CB ASN A 604 -12.586 -6.286 8.853 1.00 0.00 C ATOM 1038 CG ASN A 604 -11.963 -7.535 9.444 1.00 0.00 C ATOM 1039 OD1 ASN A 604 -11.753 -8.527 8.747 1.00 0.00 O ATOM 1040 ND2 ASN A 604 -11.664 -7.493 10.737 1.00 0.00 N ATOM 0 H ASN A 604 -11.834 -4.356 10.724 1.00 0.00 H new ATOM 0 HA ASN A 604 -10.741 -5.412 8.180 1.00 0.00 H new ATOM 0 HB2 ASN A 604 -13.448 -5.995 9.453 1.00 0.00 H new ATOM 0 HB3 ASN A 604 -12.954 -6.506 7.851 1.00 0.00 H new ATOM 0 HD21 ASN A 604 -11.243 -8.304 11.190 1.00 0.00 H new ATOM 0 HD22 ASN A 604 -11.855 -6.649 11.278 1.00 0.00 H new ATOM 1047 N PRO A 605 -11.622 -2.741 8.203 1.00 0.00 N ATOM 1048 CA PRO A 605 -12.154 -1.501 7.632 1.00 0.00 C ATOM 1049 C PRO A 605 -11.971 -1.410 6.121 1.00 0.00 C ATOM 1050 O PRO A 605 -11.393 -2.301 5.498 1.00 0.00 O ATOM 1051 CB PRO A 605 -11.324 -0.424 8.324 1.00 0.00 C ATOM 1052 CG PRO A 605 -10.015 -1.079 8.589 1.00 0.00 C ATOM 1053 CD PRO A 605 -10.321 -2.529 8.864 1.00 0.00 C ATOM 0 HA PRO A 605 -13.230 -1.416 7.787 1.00 0.00 H new ATOM 0 HB2 PRO A 605 -11.207 0.456 7.691 1.00 0.00 H new ATOM 0 HB3 PRO A 605 -11.796 -0.091 9.248 1.00 0.00 H new ATOM 0 HG2 PRO A 605 -9.348 -0.977 7.733 1.00 0.00 H new ATOM 0 HG3 PRO A 605 -9.514 -0.618 9.440 1.00 0.00 H new ATOM 0 HD2 PRO A 605 -9.552 -3.185 8.456 1.00 0.00 H new ATOM 0 HD3 PRO A 605 -10.377 -2.731 9.934 1.00 0.00 H new ATOM 1061 N GLU A 606 -12.462 -0.319 5.544 1.00 0.00 N ATOM 1062 CA GLU A 606 -12.355 -0.087 4.111 1.00 0.00 C ATOM 1063 C GLU A 606 -11.821 1.316 3.838 1.00 0.00 C ATOM 1064 O GLU A 606 -12.482 2.310 4.138 1.00 0.00 O ATOM 1065 CB GLU A 606 -13.718 -0.268 3.445 1.00 0.00 C ATOM 1066 CG GLU A 606 -13.720 0.058 1.960 1.00 0.00 C ATOM 1067 CD GLU A 606 -15.111 0.347 1.430 1.00 0.00 C ATOM 1068 OE1 GLU A 606 -16.030 -0.452 1.705 1.00 0.00 O ATOM 1069 OE2 GLU A 606 -15.280 1.374 0.737 1.00 0.00 O ATOM 0 H GLU A 606 -12.942 0.424 6.053 1.00 0.00 H new ATOM 0 HA GLU A 606 -11.658 -0.813 3.693 1.00 0.00 H new ATOM 0 HB2 GLU A 606 -14.046 -1.298 3.582 1.00 0.00 H new ATOM 0 HB3 GLU A 606 -14.446 0.368 3.949 1.00 0.00 H new ATOM 0 HG2 GLU A 606 -13.080 0.922 1.780 1.00 0.00 H new ATOM 0 HG3 GLU A 606 -13.291 -0.778 1.407 1.00 0.00 H new ATOM 1076 N PHE A 607 -10.620 1.390 3.275 1.00 0.00 N ATOM 1077 CA PHE A 607 -9.997 2.672 2.972 1.00 0.00 C ATOM 1078 C PHE A 607 -10.556 3.271 1.685 1.00 0.00 C ATOM 1079 O PHE A 607 -11.055 4.396 1.680 1.00 0.00 O ATOM 1080 CB PHE A 607 -8.481 2.512 2.844 1.00 0.00 C ATOM 1081 CG PHE A 607 -7.832 1.909 4.056 1.00 0.00 C ATOM 1082 CD1 PHE A 607 -7.740 2.626 5.240 1.00 0.00 C ATOM 1083 CD2 PHE A 607 -7.308 0.628 4.010 1.00 0.00 C ATOM 1084 CE1 PHE A 607 -7.139 2.074 6.356 1.00 0.00 C ATOM 1085 CE2 PHE A 607 -6.705 0.070 5.124 1.00 0.00 C ATOM 1086 CZ PHE A 607 -6.619 0.795 6.299 1.00 0.00 C ATOM 0 H PHE A 607 -10.059 0.577 3.020 1.00 0.00 H new ATOM 0 HA PHE A 607 -10.223 3.349 3.796 1.00 0.00 H new ATOM 0 HB2 PHE A 607 -8.263 1.888 1.978 1.00 0.00 H new ATOM 0 HB3 PHE A 607 -8.037 3.489 2.653 1.00 0.00 H new ATOM 0 HD1 PHE A 607 -8.142 3.627 5.291 1.00 0.00 H new ATOM 0 HD2 PHE A 607 -7.371 0.058 3.095 1.00 0.00 H new ATOM 0 HE1 PHE A 607 -7.076 2.642 7.272 1.00 0.00 H new ATOM 0 HE2 PHE A 607 -6.302 -0.931 5.076 1.00 0.00 H new ATOM 0 HZ PHE A 607 -6.147 0.363 7.169 1.00 0.00 H new ATOM 1096 N ASN A 608 -10.460 2.518 0.594 1.00 0.00 N ATOM 1097 CA ASN A 608 -10.947 2.988 -0.697 1.00 0.00 C ATOM 1098 C ASN A 608 -10.297 4.322 -1.047 1.00 0.00 C ATOM 1099 O ASN A 608 -10.969 5.266 -1.462 1.00 0.00 O ATOM 1100 CB ASN A 608 -12.470 3.135 -0.673 1.00 0.00 C ATOM 1101 CG ASN A 608 -13.076 3.104 -2.062 1.00 0.00 C ATOM 1102 OD1 ASN A 608 -12.419 3.443 -3.047 1.00 0.00 O ATOM 1103 ND2 ASN A 608 -14.337 2.696 -2.148 1.00 0.00 N ATOM 0 H ASN A 608 -10.051 1.584 0.578 1.00 0.00 H new ATOM 0 HA ASN A 608 -10.681 2.254 -1.457 1.00 0.00 H new ATOM 0 HB2 ASN A 608 -12.900 2.332 -0.074 1.00 0.00 H new ATOM 0 HB3 ASN A 608 -12.734 4.073 -0.185 1.00 0.00 H new ATOM 0 HD21 ASN A 608 -14.799 2.654 -3.057 1.00 0.00 H new ATOM 0 HD22 ASN A 608 -14.844 2.424 -1.305 1.00 0.00 H new ATOM 1110 N GLU A 609 -8.983 4.391 -0.860 1.00 0.00 N ATOM 1111 CA GLU A 609 -8.229 5.609 -1.137 1.00 0.00 C ATOM 1112 C GLU A 609 -7.402 5.472 -2.411 1.00 0.00 C ATOM 1113 O GLU A 609 -6.532 4.606 -2.509 1.00 0.00 O ATOM 1114 CB GLU A 609 -7.314 5.938 0.045 1.00 0.00 C ATOM 1115 CG GLU A 609 -7.780 7.133 0.859 1.00 0.00 C ATOM 1116 CD GLU A 609 -7.214 8.444 0.348 1.00 0.00 C ATOM 1117 OE1 GLU A 609 -6.127 8.421 -0.266 1.00 0.00 O ATOM 1118 OE2 GLU A 609 -7.859 9.491 0.561 1.00 0.00 O ATOM 0 H GLU A 609 -8.417 3.615 -0.517 1.00 0.00 H new ATOM 0 HA GLU A 609 -8.942 6.421 -1.282 1.00 0.00 H new ATOM 0 HB2 GLU A 609 -7.249 5.067 0.697 1.00 0.00 H new ATOM 0 HB3 GLU A 609 -6.308 6.132 -0.328 1.00 0.00 H new ATOM 0 HG2 GLU A 609 -8.869 7.179 0.839 1.00 0.00 H new ATOM 0 HG3 GLU A 609 -7.486 6.996 1.900 1.00 0.00 H new ATOM 1125 N GLU A 610 -7.670 6.342 -3.380 1.00 0.00 N ATOM 1126 CA GLU A 610 -6.943 6.327 -4.644 1.00 0.00 C ATOM 1127 C GLU A 610 -5.765 7.293 -4.592 1.00 0.00 C ATOM 1128 O GLU A 610 -5.943 8.511 -4.633 1.00 0.00 O ATOM 1129 CB GLU A 610 -7.870 6.697 -5.803 1.00 0.00 C ATOM 1130 CG GLU A 610 -8.698 5.531 -6.319 1.00 0.00 C ATOM 1131 CD GLU A 610 -9.000 4.506 -5.244 1.00 0.00 C ATOM 1132 OE1 GLU A 610 -9.788 4.822 -4.329 1.00 0.00 O ATOM 1133 OE2 GLU A 610 -8.448 3.388 -5.317 1.00 0.00 O ATOM 0 H GLU A 610 -8.385 7.066 -3.314 1.00 0.00 H new ATOM 0 HA GLU A 610 -6.565 5.318 -4.807 1.00 0.00 H new ATOM 0 HB2 GLU A 610 -8.541 7.493 -5.480 1.00 0.00 H new ATOM 0 HB3 GLU A 610 -7.272 7.097 -6.622 1.00 0.00 H new ATOM 0 HG2 GLU A 610 -9.635 5.909 -6.728 1.00 0.00 H new ATOM 0 HG3 GLU A 610 -8.165 5.047 -7.137 1.00 0.00 H new ATOM 1140 N PHE A 611 -4.564 6.741 -4.485 1.00 0.00 N ATOM 1141 CA PHE A 611 -3.350 7.544 -4.408 1.00 0.00 C ATOM 1142 C PHE A 611 -2.810 7.889 -5.791 1.00 0.00 C ATOM 1143 O PHE A 611 -3.277 7.368 -6.804 1.00 0.00 O ATOM 1144 CB PHE A 611 -2.281 6.798 -3.622 1.00 0.00 C ATOM 1145 CG PHE A 611 -2.396 6.984 -2.143 1.00 0.00 C ATOM 1146 CD1 PHE A 611 -3.399 6.353 -1.433 1.00 0.00 C ATOM 1147 CD2 PHE A 611 -1.499 7.788 -1.466 1.00 0.00 C ATOM 1148 CE1 PHE A 611 -3.507 6.516 -0.065 1.00 0.00 C ATOM 1149 CE2 PHE A 611 -1.599 7.960 -0.099 1.00 0.00 C ATOM 1150 CZ PHE A 611 -2.604 7.323 0.604 1.00 0.00 C ATOM 0 H PHE A 611 -4.404 5.734 -4.449 1.00 0.00 H new ATOM 0 HA PHE A 611 -3.605 8.475 -3.901 1.00 0.00 H new ATOM 0 HB2 PHE A 611 -2.345 5.735 -3.853 1.00 0.00 H new ATOM 0 HB3 PHE A 611 -1.298 7.136 -3.948 1.00 0.00 H new ATOM 0 HD1 PHE A 611 -4.107 5.725 -1.953 1.00 0.00 H new ATOM 0 HD2 PHE A 611 -0.712 8.287 -2.011 1.00 0.00 H new ATOM 0 HE1 PHE A 611 -4.294 6.015 0.480 1.00 0.00 H new ATOM 0 HE2 PHE A 611 -0.893 8.591 0.420 1.00 0.00 H new ATOM 0 HZ PHE A 611 -2.684 7.455 1.673 1.00 0.00 H new ATOM 1160 N PHE A 612 -1.809 8.762 -5.813 1.00 0.00 N ATOM 1161 CA PHE A 612 -1.177 9.183 -7.058 1.00 0.00 C ATOM 1162 C PHE A 612 0.316 9.404 -6.847 1.00 0.00 C ATOM 1163 O PHE A 612 0.723 10.197 -5.998 1.00 0.00 O ATOM 1164 CB PHE A 612 -1.829 10.464 -7.579 1.00 0.00 C ATOM 1165 CG PHE A 612 -1.458 10.788 -8.998 1.00 0.00 C ATOM 1166 CD1 PHE A 612 -1.276 9.778 -9.929 1.00 0.00 C ATOM 1167 CD2 PHE A 612 -1.290 12.103 -9.402 1.00 0.00 C ATOM 1168 CE1 PHE A 612 -0.935 10.073 -11.235 1.00 0.00 C ATOM 1169 CE2 PHE A 612 -0.950 12.405 -10.706 1.00 0.00 C ATOM 1170 CZ PHE A 612 -0.772 11.388 -11.624 1.00 0.00 C ATOM 0 H PHE A 612 -1.416 9.194 -4.977 1.00 0.00 H new ATOM 0 HA PHE A 612 -1.313 8.394 -7.798 1.00 0.00 H new ATOM 0 HB2 PHE A 612 -2.912 10.366 -7.508 1.00 0.00 H new ATOM 0 HB3 PHE A 612 -1.541 11.296 -6.937 1.00 0.00 H new ATOM 0 HD1 PHE A 612 -1.402 8.748 -9.630 1.00 0.00 H new ATOM 0 HD2 PHE A 612 -1.427 12.902 -8.688 1.00 0.00 H new ATOM 0 HE1 PHE A 612 -0.796 9.276 -11.951 1.00 0.00 H new ATOM 0 HE2 PHE A 612 -0.823 13.434 -11.008 1.00 0.00 H new ATOM 0 HZ PHE A 612 -0.506 11.621 -12.644 1.00 0.00 H new ATOM 1180 N TYR A 613 1.129 8.696 -7.622 1.00 0.00 N ATOM 1181 CA TYR A 613 2.576 8.809 -7.520 1.00 0.00 C ATOM 1182 C TYR A 613 3.132 9.651 -8.658 1.00 0.00 C ATOM 1183 O TYR A 613 2.546 9.719 -9.737 1.00 0.00 O ATOM 1184 CB TYR A 613 3.210 7.422 -7.529 1.00 0.00 C ATOM 1185 CG TYR A 613 3.444 6.869 -6.145 1.00 0.00 C ATOM 1186 CD1 TYR A 613 2.437 6.202 -5.463 1.00 0.00 C ATOM 1187 CD2 TYR A 613 4.671 7.024 -5.521 1.00 0.00 C ATOM 1188 CE1 TYR A 613 2.647 5.699 -4.191 1.00 0.00 C ATOM 1189 CE2 TYR A 613 4.893 6.526 -4.251 1.00 0.00 C ATOM 1190 CZ TYR A 613 3.877 5.865 -3.591 1.00 0.00 C ATOM 1191 OH TYR A 613 4.094 5.367 -2.326 1.00 0.00 O ATOM 0 H TYR A 613 0.808 8.036 -8.330 1.00 0.00 H new ATOM 0 HA TYR A 613 2.819 9.304 -6.580 1.00 0.00 H new ATOM 0 HB2 TYR A 613 2.566 6.739 -8.083 1.00 0.00 H new ATOM 0 HB3 TYR A 613 4.160 7.467 -8.061 1.00 0.00 H new ATOM 0 HD1 TYR A 613 1.473 6.073 -5.933 1.00 0.00 H new ATOM 0 HD2 TYR A 613 5.467 7.542 -6.035 1.00 0.00 H new ATOM 0 HE1 TYR A 613 1.854 5.181 -3.673 1.00 0.00 H new ATOM 0 HE2 TYR A 613 5.856 6.653 -3.778 1.00 0.00 H new ATOM 0 HH TYR A 613 4.353 6.098 -1.727 1.00 0.00 H new ATOM 1201 N ASP A 614 4.264 10.299 -8.410 1.00 0.00 N ATOM 1202 CA ASP A 614 4.889 11.140 -9.419 1.00 0.00 C ATOM 1203 C ASP A 614 6.130 10.472 -10.003 1.00 0.00 C ATOM 1204 O ASP A 614 7.248 10.957 -9.830 1.00 0.00 O ATOM 1205 CB ASP A 614 5.258 12.501 -8.824 1.00 0.00 C ATOM 1206 CG ASP A 614 4.916 13.650 -9.751 1.00 0.00 C ATOM 1207 OD1 ASP A 614 4.719 13.401 -10.959 1.00 0.00 O ATOM 1208 OD2 ASP A 614 4.845 14.800 -9.270 1.00 0.00 O ATOM 0 H ASP A 614 4.765 10.258 -7.522 1.00 0.00 H new ATOM 0 HA ASP A 614 4.169 11.286 -10.225 1.00 0.00 H new ATOM 0 HB2 ASP A 614 4.735 12.634 -7.877 1.00 0.00 H new ATOM 0 HB3 ASP A 614 6.325 12.521 -8.604 1.00 0.00 H new ATOM 1213 N ILE A 615 5.923 9.358 -10.696 1.00 0.00 N ATOM 1214 CA ILE A 615 7.023 8.624 -11.310 1.00 0.00 C ATOM 1215 C ILE A 615 6.669 8.222 -12.737 1.00 0.00 C ATOM 1216 O ILE A 615 5.542 7.817 -13.017 1.00 0.00 O ATOM 1217 CB ILE A 615 7.386 7.364 -10.488 1.00 0.00 C ATOM 1218 CG1 ILE A 615 8.251 6.392 -11.302 1.00 0.00 C ATOM 1219 CG2 ILE A 615 6.129 6.669 -9.987 1.00 0.00 C ATOM 1220 CD1 ILE A 615 9.730 6.677 -11.214 1.00 0.00 C ATOM 0 H ILE A 615 5.003 8.943 -10.847 1.00 0.00 H new ATOM 0 HA ILE A 615 7.889 9.286 -11.328 1.00 0.00 H new ATOM 0 HB ILE A 615 7.971 7.689 -9.627 1.00 0.00 H new ATOM 0 HG12 ILE A 615 8.065 5.376 -10.955 1.00 0.00 H new ATOM 0 HG13 ILE A 615 7.943 6.434 -12.347 1.00 0.00 H new ATOM 0 HG21 ILE A 615 6.406 5.786 -9.412 1.00 0.00 H new ATOM 0 HG22 ILE A 615 5.564 7.352 -9.353 1.00 0.00 H new ATOM 0 HG23 ILE A 615 5.515 6.370 -10.837 1.00 0.00 H new ATOM 0 HD11 ILE A 615 10.277 5.950 -11.814 1.00 0.00 H new ATOM 0 HD12 ILE A 615 9.930 7.681 -11.589 1.00 0.00 H new ATOM 0 HD13 ILE A 615 10.053 6.606 -10.175 1.00 0.00 H new ATOM 1232 N LYS A 616 7.642 8.331 -13.635 1.00 0.00 N ATOM 1233 CA LYS A 616 7.433 7.970 -15.031 1.00 0.00 C ATOM 1234 C LYS A 616 7.398 6.456 -15.192 1.00 0.00 C ATOM 1235 O LYS A 616 8.215 5.742 -14.612 1.00 0.00 O ATOM 1236 CB LYS A 616 8.537 8.563 -15.908 1.00 0.00 C ATOM 1237 CG LYS A 616 8.173 9.908 -16.518 1.00 0.00 C ATOM 1238 CD LYS A 616 7.251 9.745 -17.716 1.00 0.00 C ATOM 1239 CE LYS A 616 7.974 10.041 -19.020 1.00 0.00 C ATOM 1240 NZ LYS A 616 9.270 9.317 -19.114 1.00 0.00 N ATOM 0 H LYS A 616 8.581 8.666 -13.421 1.00 0.00 H new ATOM 0 HA LYS A 616 6.474 8.379 -15.349 1.00 0.00 H new ATOM 0 HB2 LYS A 616 9.442 8.677 -15.311 1.00 0.00 H new ATOM 0 HB3 LYS A 616 8.770 7.861 -16.709 1.00 0.00 H new ATOM 0 HG2 LYS A 616 7.688 10.530 -15.766 1.00 0.00 H new ATOM 0 HG3 LYS A 616 9.081 10.428 -16.824 1.00 0.00 H new ATOM 0 HD2 LYS A 616 6.859 8.728 -17.739 1.00 0.00 H new ATOM 0 HD3 LYS A 616 6.397 10.414 -17.613 1.00 0.00 H new ATOM 0 HE2 LYS A 616 7.339 9.758 -19.859 1.00 0.00 H new ATOM 0 HE3 LYS A 616 8.151 11.113 -19.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 616 9.558 9.248 -20.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 616 9.996 9.835 -18.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 616 9.163 8.361 -18.718 1.00 0.00 H new ATOM 1254 N HIS A 617 6.443 5.971 -15.977 1.00 0.00 N ATOM 1255 CA HIS A 617 6.301 4.539 -16.207 1.00 0.00 C ATOM 1256 C HIS A 617 7.656 3.884 -16.450 1.00 0.00 C ATOM 1257 O HIS A 617 7.998 2.887 -15.815 1.00 0.00 O ATOM 1258 CB HIS A 617 5.378 4.278 -17.397 1.00 0.00 C ATOM 1259 CG HIS A 617 5.176 2.824 -17.677 1.00 0.00 C ATOM 1260 ND1 HIS A 617 5.899 2.131 -18.624 1.00 0.00 N ATOM 1261 CD2 HIS A 617 4.333 1.923 -17.119 1.00 0.00 C ATOM 1262 CE1 HIS A 617 5.511 0.869 -18.635 1.00 0.00 C ATOM 1263 NE2 HIS A 617 4.562 0.716 -17.730 1.00 0.00 N ATOM 0 H HIS A 617 5.757 6.547 -16.464 1.00 0.00 H new ATOM 0 HA HIS A 617 5.862 4.100 -15.311 1.00 0.00 H new ATOM 0 HB2 HIS A 617 4.411 4.743 -17.207 1.00 0.00 H new ATOM 0 HB3 HIS A 617 5.794 4.758 -18.283 1.00 0.00 H new ATOM 0 HD2 HIS A 617 3.614 2.118 -16.338 1.00 0.00 H new ATOM 0 HE1 HIS A 617 5.903 0.093 -19.276 1.00 0.00 H new ATOM 0 HE2 HIS A 617 4.078 -0.157 -17.519 1.00 0.00 H new ATOM 1272 N SER A 618 8.422 4.450 -17.375 1.00 0.00 N ATOM 1273 CA SER A 618 9.740 3.920 -17.705 1.00 0.00 C ATOM 1274 C SER A 618 10.564 3.674 -16.446 1.00 0.00 C ATOM 1275 O SER A 618 11.505 2.879 -16.454 1.00 0.00 O ATOM 1276 CB SER A 618 10.481 4.882 -18.635 1.00 0.00 C ATOM 1277 OG SER A 618 9.684 5.222 -19.757 1.00 0.00 O ATOM 0 H SER A 618 8.153 5.276 -17.910 1.00 0.00 H new ATOM 0 HA SER A 618 9.601 2.966 -18.214 1.00 0.00 H new ATOM 0 HB2 SER A 618 10.750 5.786 -18.089 1.00 0.00 H new ATOM 0 HB3 SER A 618 11.411 4.424 -18.971 1.00 0.00 H new ATOM 0 HG SER A 618 10.179 5.839 -20.335 1.00 0.00 H new ATOM 1283 N ASP A 619 10.208 4.360 -15.364 1.00 0.00 N ATOM 1284 CA ASP A 619 10.919 4.210 -14.101 1.00 0.00 C ATOM 1285 C ASP A 619 10.106 3.373 -13.117 1.00 0.00 C ATOM 1286 O ASP A 619 10.668 2.662 -12.282 1.00 0.00 O ATOM 1287 CB ASP A 619 11.226 5.582 -13.499 1.00 0.00 C ATOM 1288 CG ASP A 619 12.196 6.380 -14.348 1.00 0.00 C ATOM 1289 OD1 ASP A 619 12.367 6.035 -15.536 1.00 0.00 O ATOM 1290 OD2 ASP A 619 12.784 7.350 -13.824 1.00 0.00 O ATOM 0 H ASP A 619 9.433 5.023 -15.337 1.00 0.00 H new ATOM 0 HA ASP A 619 11.858 3.693 -14.297 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.298 6.143 -13.387 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.643 5.453 -12.500 1.00 0.00 H new ATOM 1295 N LEU A 620 8.783 3.458 -13.227 1.00 0.00 N ATOM 1296 CA LEU A 620 7.887 2.705 -12.357 1.00 0.00 C ATOM 1297 C LEU A 620 8.488 1.344 -12.015 1.00 0.00 C ATOM 1298 O LEU A 620 8.839 1.078 -10.869 1.00 0.00 O ATOM 1299 CB LEU A 620 6.529 2.505 -13.045 1.00 0.00 C ATOM 1300 CG LEU A 620 5.350 3.358 -12.542 1.00 0.00 C ATOM 1301 CD1 LEU A 620 4.197 2.459 -12.132 1.00 0.00 C ATOM 1302 CD2 LEU A 620 5.749 4.267 -11.385 1.00 0.00 C ATOM 0 H LEU A 620 8.307 4.044 -13.913 1.00 0.00 H new ATOM 0 HA LEU A 620 7.748 3.272 -11.436 1.00 0.00 H new ATOM 0 HB2 LEU A 620 6.658 2.702 -14.109 1.00 0.00 H new ATOM 0 HB3 LEU A 620 6.252 1.455 -12.946 1.00 0.00 H new ATOM 0 HG LEU A 620 5.036 4.001 -13.364 1.00 0.00 H new ATOM 0 HD11 LEU A 620 3.367 3.070 -11.777 1.00 0.00 H new ATOM 0 HD12 LEU A 620 3.873 1.869 -12.989 1.00 0.00 H new ATOM 0 HD13 LEU A 620 4.522 1.791 -11.334 1.00 0.00 H new ATOM 0 HD21 LEU A 620 4.885 4.849 -11.065 1.00 0.00 H new ATOM 0 HD22 LEU A 620 6.107 3.661 -10.553 1.00 0.00 H new ATOM 0 HD23 LEU A 620 6.541 4.942 -11.709 1.00 0.00 H new ATOM 1314 N ALA A 621 8.602 0.492 -13.025 1.00 0.00 N ATOM 1315 CA ALA A 621 9.160 -0.845 -12.852 1.00 0.00 C ATOM 1316 C ALA A 621 10.317 -0.853 -11.852 1.00 0.00 C ATOM 1317 O ALA A 621 10.299 -1.602 -10.877 1.00 0.00 O ATOM 1318 CB ALA A 621 9.628 -1.376 -14.198 1.00 0.00 C ATOM 0 H ALA A 621 8.313 0.704 -13.980 1.00 0.00 H new ATOM 0 HA ALA A 621 8.378 -1.490 -12.451 1.00 0.00 H new ATOM 0 HB1 ALA A 621 10.045 -2.375 -14.070 1.00 0.00 H new ATOM 0 HB2 ALA A 621 8.783 -1.421 -14.885 1.00 0.00 H new ATOM 0 HB3 ALA A 621 10.392 -0.713 -14.605 1.00 0.00 H new ATOM 1324 N LYS A 622 11.326 -0.022 -12.106 1.00 0.00 N ATOM 1325 CA LYS A 622 12.498 0.052 -11.241 1.00 0.00 C ATOM 1326 C LYS A 622 12.125 0.522 -9.845 1.00 0.00 C ATOM 1327 O LYS A 622 12.894 0.355 -8.898 1.00 0.00 O ATOM 1328 CB LYS A 622 13.541 0.994 -11.844 1.00 0.00 C ATOM 1329 CG LYS A 622 14.102 0.510 -13.171 1.00 0.00 C ATOM 1330 CD LYS A 622 14.516 1.674 -14.057 1.00 0.00 C ATOM 1331 CE LYS A 622 14.047 1.475 -15.490 1.00 0.00 C ATOM 1332 NZ LYS A 622 15.022 0.683 -16.289 1.00 0.00 N ATOM 0 H LYS A 622 11.354 0.610 -12.906 1.00 0.00 H new ATOM 0 HA LYS A 622 12.919 -0.950 -11.162 1.00 0.00 H new ATOM 0 HB2 LYS A 622 13.092 1.977 -11.986 1.00 0.00 H new ATOM 0 HB3 LYS A 622 14.360 1.117 -11.136 1.00 0.00 H new ATOM 0 HG2 LYS A 622 14.962 -0.135 -12.990 1.00 0.00 H new ATOM 0 HG3 LYS A 622 13.354 -0.093 -13.686 1.00 0.00 H new ATOM 0 HD2 LYS A 622 14.099 2.600 -13.662 1.00 0.00 H new ATOM 0 HD3 LYS A 622 15.601 1.779 -14.039 1.00 0.00 H new ATOM 0 HE2 LYS A 622 13.082 0.968 -15.489 1.00 0.00 H new ATOM 0 HE3 LYS A 622 13.896 2.446 -15.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 622 14.665 0.570 -17.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 622 15.936 1.179 -16.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 622 15.147 -0.254 -15.855 1.00 0.00 H new ATOM 1346 N LYS A 623 10.947 1.115 -9.720 1.00 0.00 N ATOM 1347 CA LYS A 623 10.488 1.608 -8.435 1.00 0.00 C ATOM 1348 C LYS A 623 10.209 0.459 -7.476 1.00 0.00 C ATOM 1349 O LYS A 623 10.339 -0.712 -7.832 1.00 0.00 O ATOM 1350 CB LYS A 623 9.224 2.453 -8.593 1.00 0.00 C ATOM 1351 CG LYS A 623 9.380 3.617 -9.554 1.00 0.00 C ATOM 1352 CD LYS A 623 10.119 4.776 -8.910 1.00 0.00 C ATOM 1353 CE LYS A 623 11.529 4.911 -9.465 1.00 0.00 C ATOM 1354 NZ LYS A 623 12.036 6.307 -9.361 1.00 0.00 N ATOM 0 H LYS A 623 10.296 1.265 -10.491 1.00 0.00 H new ATOM 0 HA LYS A 623 11.283 2.229 -8.023 1.00 0.00 H new ATOM 0 HB2 LYS A 623 8.412 1.814 -8.940 1.00 0.00 H new ATOM 0 HB3 LYS A 623 8.931 2.838 -7.616 1.00 0.00 H new ATOM 0 HG2 LYS A 623 9.921 3.288 -10.441 1.00 0.00 H new ATOM 0 HG3 LYS A 623 8.397 3.951 -9.886 1.00 0.00 H new ATOM 0 HD2 LYS A 623 9.569 5.701 -9.082 1.00 0.00 H new ATOM 0 HD3 LYS A 623 10.164 4.627 -7.831 1.00 0.00 H new ATOM 0 HE2 LYS A 623 12.197 4.241 -8.924 1.00 0.00 H new ATOM 0 HE3 LYS A 623 11.540 4.598 -10.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 623 12.258 6.667 -10.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 623 11.309 6.909 -8.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 623 12.896 6.321 -8.776 1.00 0.00 H new ATOM 1368 N SER A 624 9.811 0.808 -6.259 1.00 0.00 N ATOM 1369 CA SER A 624 9.496 -0.183 -5.242 1.00 0.00 C ATOM 1370 C SER A 624 8.503 0.385 -4.237 1.00 0.00 C ATOM 1371 O SER A 624 8.865 1.176 -3.367 1.00 0.00 O ATOM 1372 CB SER A 624 10.763 -0.639 -4.525 1.00 0.00 C ATOM 1373 OG SER A 624 11.256 0.369 -3.661 1.00 0.00 O ATOM 0 H SER A 624 9.699 1.775 -5.953 1.00 0.00 H new ATOM 0 HA SER A 624 9.045 -1.045 -5.734 1.00 0.00 H new ATOM 0 HB2 SER A 624 10.554 -1.542 -3.952 1.00 0.00 H new ATOM 0 HB3 SER A 624 11.526 -0.897 -5.259 1.00 0.00 H new ATOM 0 HG SER A 624 10.504 0.845 -3.251 1.00 0.00 H new ATOM 1379 N LEU A 625 7.247 -0.019 -4.371 1.00 0.00 N ATOM 1380 CA LEU A 625 6.193 0.452 -3.482 1.00 0.00 C ATOM 1381 C LEU A 625 6.210 -0.313 -2.164 1.00 0.00 C ATOM 1382 O LEU A 625 6.430 -1.523 -2.140 1.00 0.00 O ATOM 1383 CB LEU A 625 4.826 0.307 -4.153 1.00 0.00 C ATOM 1384 CG LEU A 625 3.657 0.926 -3.387 1.00 0.00 C ATOM 1385 CD1 LEU A 625 3.779 2.442 -3.362 1.00 0.00 C ATOM 1386 CD2 LEU A 625 2.334 0.506 -4.007 1.00 0.00 C ATOM 0 H LEU A 625 6.933 -0.673 -5.088 1.00 0.00 H new ATOM 0 HA LEU A 625 6.375 1.506 -3.271 1.00 0.00 H new ATOM 0 HB2 LEU A 625 4.874 0.763 -5.142 1.00 0.00 H new ATOM 0 HB3 LEU A 625 4.622 -0.754 -4.301 1.00 0.00 H new ATOM 0 HG LEU A 625 3.686 0.563 -2.360 1.00 0.00 H new ATOM 0 HD11 LEU A 625 2.938 2.866 -2.813 1.00 0.00 H new ATOM 0 HD12 LEU A 625 4.711 2.724 -2.873 1.00 0.00 H new ATOM 0 HD13 LEU A 625 3.775 2.824 -4.383 1.00 0.00 H new ATOM 0 HD21 LEU A 625 1.512 0.955 -3.450 1.00 0.00 H new ATOM 0 HD22 LEU A 625 2.295 0.841 -5.044 1.00 0.00 H new ATOM 0 HD23 LEU A 625 2.245 -0.580 -3.973 1.00 0.00 H new ATOM 1398 N ASP A 626 5.977 0.401 -1.070 1.00 0.00 N ATOM 1399 CA ASP A 626 5.967 -0.213 0.251 1.00 0.00 C ATOM 1400 C ASP A 626 4.651 0.064 0.968 1.00 0.00 C ATOM 1401 O ASP A 626 4.469 1.125 1.564 1.00 0.00 O ATOM 1402 CB ASP A 626 7.137 0.306 1.087 1.00 0.00 C ATOM 1403 CG ASP A 626 7.054 -0.137 2.535 1.00 0.00 C ATOM 1404 OD1 ASP A 626 6.108 0.288 3.232 1.00 0.00 O ATOM 1405 OD2 ASP A 626 7.933 -0.908 2.972 1.00 0.00 O ATOM 0 H ASP A 626 5.793 1.404 -1.071 1.00 0.00 H new ATOM 0 HA ASP A 626 6.071 -1.291 0.125 1.00 0.00 H new ATOM 0 HB2 ASP A 626 8.073 -0.047 0.655 1.00 0.00 H new ATOM 0 HB3 ASP A 626 7.156 1.395 1.044 1.00 0.00 H new ATOM 1410 N ILE A 627 3.738 -0.901 0.907 1.00 0.00 N ATOM 1411 CA ILE A 627 2.441 -0.766 1.554 1.00 0.00 C ATOM 1412 C ILE A 627 2.476 -1.341 2.963 1.00 0.00 C ATOM 1413 O ILE A 627 2.337 -2.549 3.156 1.00 0.00 O ATOM 1414 CB ILE A 627 1.333 -1.472 0.751 1.00 0.00 C ATOM 1415 CG1 ILE A 627 1.485 -1.168 -0.741 1.00 0.00 C ATOM 1416 CG2 ILE A 627 -0.039 -1.042 1.248 1.00 0.00 C ATOM 1417 CD1 ILE A 627 2.025 -2.334 -1.543 1.00 0.00 C ATOM 0 H ILE A 627 3.874 -1.784 0.416 1.00 0.00 H new ATOM 0 HA ILE A 627 2.218 0.300 1.600 1.00 0.00 H new ATOM 0 HB ILE A 627 1.428 -2.548 0.896 1.00 0.00 H new ATOM 0 HG12 ILE A 627 0.515 -0.877 -1.145 1.00 0.00 H new ATOM 0 HG13 ILE A 627 2.151 -0.314 -0.864 1.00 0.00 H new ATOM 0 HG21 ILE A 627 -0.811 -1.550 0.670 1.00 0.00 H new ATOM 0 HG22 ILE A 627 -0.143 -1.303 2.301 1.00 0.00 H new ATOM 0 HG23 ILE A 627 -0.147 0.036 1.129 1.00 0.00 H new ATOM 0 HD11 ILE A 627 2.107 -2.048 -2.592 1.00 0.00 H new ATOM 0 HD12 ILE A 627 3.009 -2.611 -1.165 1.00 0.00 H new ATOM 0 HD13 ILE A 627 1.348 -3.184 -1.451 1.00 0.00 H new ATOM 1429 N SER A 628 2.675 -0.471 3.946 1.00 0.00 N ATOM 1430 CA SER A 628 2.740 -0.900 5.340 1.00 0.00 C ATOM 1431 C SER A 628 1.544 -0.391 6.136 1.00 0.00 C ATOM 1432 O SER A 628 1.206 0.791 6.087 1.00 0.00 O ATOM 1433 CB SER A 628 4.038 -0.414 5.987 1.00 0.00 C ATOM 1434 OG SER A 628 3.988 0.977 6.252 1.00 0.00 O ATOM 0 H SER A 628 2.794 0.532 3.806 1.00 0.00 H new ATOM 0 HA SER A 628 2.718 -1.990 5.351 1.00 0.00 H new ATOM 0 HB2 SER A 628 4.211 -0.958 6.916 1.00 0.00 H new ATOM 0 HB3 SER A 628 4.879 -0.632 5.329 1.00 0.00 H new ATOM 0 HG SER A 628 3.073 1.302 6.123 1.00 0.00 H new ATOM 1440 N VAL A 629 0.917 -1.298 6.878 1.00 0.00 N ATOM 1441 CA VAL A 629 -0.234 -0.952 7.700 1.00 0.00 C ATOM 1442 C VAL A 629 0.173 -0.870 9.168 1.00 0.00 C ATOM 1443 O VAL A 629 0.776 -1.799 9.705 1.00 0.00 O ATOM 1444 CB VAL A 629 -1.368 -1.982 7.546 1.00 0.00 C ATOM 1445 CG1 VAL A 629 -2.657 -1.456 8.158 1.00 0.00 C ATOM 1446 CG2 VAL A 629 -1.570 -2.336 6.080 1.00 0.00 C ATOM 0 H VAL A 629 1.188 -2.280 6.926 1.00 0.00 H new ATOM 0 HA VAL A 629 -0.599 0.018 7.361 1.00 0.00 H new ATOM 0 HB VAL A 629 -1.085 -2.889 8.081 1.00 0.00 H new ATOM 0 HG11 VAL A 629 -3.446 -2.199 8.039 1.00 0.00 H new ATOM 0 HG12 VAL A 629 -2.502 -1.258 9.219 1.00 0.00 H new ATOM 0 HG13 VAL A 629 -2.948 -0.533 7.656 1.00 0.00 H new ATOM 0 HG21 VAL A 629 -2.375 -3.065 5.989 1.00 0.00 H new ATOM 0 HG22 VAL A 629 -1.830 -1.437 5.521 1.00 0.00 H new ATOM 0 HG23 VAL A 629 -0.650 -2.760 5.678 1.00 0.00 H new ATOM 1456 N TRP A 630 -0.143 0.249 9.812 1.00 0.00 N ATOM 1457 CA TRP A 630 0.212 0.445 11.212 1.00 0.00 C ATOM 1458 C TRP A 630 -1.018 0.741 12.062 1.00 0.00 C ATOM 1459 O TRP A 630 -1.967 1.370 11.598 1.00 0.00 O ATOM 1460 CB TRP A 630 1.198 1.599 11.337 1.00 0.00 C ATOM 1461 CG TRP A 630 2.463 1.403 10.559 1.00 0.00 C ATOM 1462 CD1 TRP A 630 2.605 1.455 9.204 1.00 0.00 C ATOM 1463 CD2 TRP A 630 3.763 1.126 11.089 1.00 0.00 C ATOM 1464 NE1 TRP A 630 3.916 1.246 8.857 1.00 0.00 N ATOM 1465 CE2 TRP A 630 4.647 1.034 9.998 1.00 0.00 C ATOM 1466 CE3 TRP A 630 4.265 0.951 12.381 1.00 0.00 C ATOM 1467 CZ2 TRP A 630 6.005 0.775 10.161 1.00 0.00 C ATOM 1468 CZ3 TRP A 630 5.613 0.693 12.542 1.00 0.00 C ATOM 1469 CH2 TRP A 630 6.470 0.607 11.437 1.00 0.00 C ATOM 0 H TRP A 630 -0.642 1.031 9.388 1.00 0.00 H new ATOM 0 HA TRP A 630 0.667 -0.477 11.574 1.00 0.00 H new ATOM 0 HB2 TRP A 630 0.714 2.516 11.000 1.00 0.00 H new ATOM 0 HB3 TRP A 630 1.448 1.738 12.389 1.00 0.00 H new ATOM 0 HD1 TRP A 630 1.802 1.635 8.505 1.00 0.00 H new ATOM 0 HE1 TRP A 630 4.286 1.248 7.907 1.00 0.00 H new ATOM 0 HE3 TRP A 630 3.611 1.016 13.238 1.00 0.00 H new ATOM 0 HZ2 TRP A 630 6.668 0.709 9.311 1.00 0.00 H new ATOM 0 HZ3 TRP A 630 6.012 0.555 13.536 1.00 0.00 H new ATOM 0 HH2 TRP A 630 7.519 0.404 11.595 1.00 0.00 H new ATOM 1480 N ASP A 631 -0.985 0.297 13.315 1.00 0.00 N ATOM 1481 CA ASP A 631 -2.093 0.529 14.236 1.00 0.00 C ATOM 1482 C ASP A 631 -1.940 1.884 14.923 1.00 0.00 C ATOM 1483 O ASP A 631 -1.046 2.082 15.745 1.00 0.00 O ATOM 1484 CB ASP A 631 -2.175 -0.602 15.271 1.00 0.00 C ATOM 1485 CG ASP A 631 -2.676 -0.139 16.630 1.00 0.00 C ATOM 1486 OD1 ASP A 631 -3.719 0.546 16.676 1.00 0.00 O ATOM 1487 OD2 ASP A 631 -2.025 -0.463 17.645 1.00 0.00 O ATOM 0 H ASP A 631 -0.205 -0.224 13.715 1.00 0.00 H new ATOM 0 HA ASP A 631 -3.023 0.538 13.667 1.00 0.00 H new ATOM 0 HB2 ASP A 631 -2.836 -1.382 14.894 1.00 0.00 H new ATOM 0 HB3 ASP A 631 -1.188 -1.050 15.389 1.00 0.00 H new ATOM 1492 N TYR A 632 -2.823 2.808 14.572 1.00 0.00 N ATOM 1493 CA TYR A 632 -2.807 4.150 15.140 1.00 0.00 C ATOM 1494 C TYR A 632 -3.026 4.110 16.649 1.00 0.00 C ATOM 1495 O TYR A 632 -3.474 3.102 17.197 1.00 0.00 O ATOM 1496 CB TYR A 632 -3.884 5.007 14.478 1.00 0.00 C ATOM 1497 CG TYR A 632 -3.977 6.406 15.037 1.00 0.00 C ATOM 1498 CD1 TYR A 632 -4.660 6.658 16.218 1.00 0.00 C ATOM 1499 CD2 TYR A 632 -3.379 7.475 14.383 1.00 0.00 C ATOM 1500 CE1 TYR A 632 -4.745 7.937 16.733 1.00 0.00 C ATOM 1501 CE2 TYR A 632 -3.460 8.756 14.890 1.00 0.00 C ATOM 1502 CZ TYR A 632 -4.144 8.983 16.066 1.00 0.00 C ATOM 1503 OH TYR A 632 -4.226 10.258 16.576 1.00 0.00 O ATOM 0 H TYR A 632 -3.566 2.651 13.891 1.00 0.00 H new ATOM 0 HA TYR A 632 -1.828 4.590 14.951 1.00 0.00 H new ATOM 0 HB2 TYR A 632 -3.682 5.066 13.408 1.00 0.00 H new ATOM 0 HB3 TYR A 632 -4.849 4.514 14.594 1.00 0.00 H new ATOM 0 HD1 TYR A 632 -5.133 5.841 16.743 1.00 0.00 H new ATOM 0 HD2 TYR A 632 -2.842 7.301 13.462 1.00 0.00 H new ATOM 0 HE1 TYR A 632 -5.280 8.117 17.654 1.00 0.00 H new ATOM 0 HE2 TYR A 632 -2.990 9.577 14.368 1.00 0.00 H new ATOM 0 HH TYR A 632 -3.748 10.878 15.986 1.00 0.00 H new ATOM 1513 N ASP A 633 -2.709 5.216 17.316 1.00 0.00 N ATOM 1514 CA ASP A 633 -2.873 5.313 18.762 1.00 0.00 C ATOM 1515 C ASP A 633 -2.936 6.772 19.204 1.00 0.00 C ATOM 1516 O ASP A 633 -2.069 7.574 18.858 1.00 0.00 O ATOM 1517 CB ASP A 633 -1.720 4.603 19.476 1.00 0.00 C ATOM 1518 CG ASP A 633 -2.203 3.518 20.419 1.00 0.00 C ATOM 1519 OD1 ASP A 633 -2.372 2.368 19.964 1.00 0.00 O ATOM 1520 OD2 ASP A 633 -2.411 3.819 21.613 1.00 0.00 O ATOM 0 H ASP A 633 -2.337 6.058 16.877 1.00 0.00 H new ATOM 0 HA ASP A 633 -3.812 4.828 19.030 1.00 0.00 H new ATOM 0 HB2 ASP A 633 -1.052 4.165 18.734 1.00 0.00 H new ATOM 0 HB3 ASP A 633 -1.138 5.335 20.036 1.00 0.00 H new ATOM 1525 N ILE A 634 -3.966 7.108 19.974 1.00 0.00 N ATOM 1526 CA ILE A 634 -4.138 8.472 20.465 1.00 0.00 C ATOM 1527 C ILE A 634 -3.431 8.664 21.803 1.00 0.00 C ATOM 1528 O ILE A 634 -3.436 7.774 22.653 1.00 0.00 O ATOM 1529 CB ILE A 634 -5.626 8.849 20.630 1.00 0.00 C ATOM 1530 CG1 ILE A 634 -6.478 7.607 20.915 1.00 0.00 C ATOM 1531 CG2 ILE A 634 -6.129 9.580 19.394 1.00 0.00 C ATOM 1532 CD1 ILE A 634 -6.850 6.817 19.678 1.00 0.00 C ATOM 0 H ILE A 634 -4.693 6.457 20.271 1.00 0.00 H new ATOM 0 HA ILE A 634 -3.695 9.126 19.714 1.00 0.00 H new ATOM 0 HB ILE A 634 -5.716 9.519 21.485 1.00 0.00 H new ATOM 0 HG12 ILE A 634 -5.934 6.956 21.599 1.00 0.00 H new ATOM 0 HG13 ILE A 634 -7.391 7.915 21.425 1.00 0.00 H new ATOM 0 HG21 ILE A 634 -7.180 9.839 19.527 1.00 0.00 H new ATOM 0 HG22 ILE A 634 -5.547 10.490 19.247 1.00 0.00 H new ATOM 0 HG23 ILE A 634 -6.021 8.936 18.521 1.00 0.00 H new ATOM 0 HD11 ILE A 634 -7.452 5.955 19.964 1.00 0.00 H new ATOM 0 HD12 ILE A 634 -7.422 7.450 19.000 1.00 0.00 H new ATOM 0 HD13 ILE A 634 -5.944 6.476 19.178 1.00 0.00 H new ATOM 1544 N GLY A 635 -2.824 9.833 21.982 1.00 0.00 N ATOM 1545 CA GLY A 635 -2.122 10.121 23.219 1.00 0.00 C ATOM 1546 C GLY A 635 -0.774 9.431 23.296 1.00 0.00 C ATOM 1547 O GLY A 635 -0.022 9.627 24.251 1.00 0.00 O ATOM 0 H GLY A 635 -2.806 10.585 21.293 1.00 0.00 H new ATOM 0 HA2 GLY A 635 -1.981 11.198 23.311 1.00 0.00 H new ATOM 0 HA3 GLY A 635 -2.736 9.807 24.063 1.00 0.00 H new ATOM 1551 N LYS A 636 -0.468 8.620 22.289 1.00 0.00 N ATOM 1552 CA LYS A 636 0.798 7.898 22.247 1.00 0.00 C ATOM 1553 C LYS A 636 1.249 7.669 20.809 1.00 0.00 C ATOM 1554 O LYS A 636 0.713 8.268 19.876 1.00 0.00 O ATOM 1555 CB LYS A 636 0.670 6.558 22.973 1.00 0.00 C ATOM 1556 CG LYS A 636 -0.562 6.460 23.859 1.00 0.00 C ATOM 1557 CD LYS A 636 -0.799 5.032 24.324 1.00 0.00 C ATOM 1558 CE LYS A 636 0.132 4.659 25.467 1.00 0.00 C ATOM 1559 NZ LYS A 636 -0.619 4.194 26.666 1.00 0.00 N ATOM 0 H LYS A 636 -1.079 8.446 21.491 1.00 0.00 H new ATOM 0 HA LYS A 636 1.549 8.506 22.751 1.00 0.00 H new ATOM 0 HB2 LYS A 636 0.641 5.756 22.235 1.00 0.00 H new ATOM 0 HB3 LYS A 636 1.559 6.398 23.583 1.00 0.00 H new ATOM 0 HG2 LYS A 636 -0.442 7.111 24.725 1.00 0.00 H new ATOM 0 HG3 LYS A 636 -1.435 6.816 23.312 1.00 0.00 H new ATOM 0 HD2 LYS A 636 -1.835 4.919 24.645 1.00 0.00 H new ATOM 0 HD3 LYS A 636 -0.647 4.346 23.490 1.00 0.00 H new ATOM 0 HE2 LYS A 636 0.814 3.874 25.139 1.00 0.00 H new ATOM 0 HE3 LYS A 636 0.743 5.521 25.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 636 0.052 3.949 27.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 636 -1.251 4.952 26.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 636 -1.183 3.356 26.419 1.00 0.00 H new ATOM 1573 N SER A 637 2.238 6.799 20.637 1.00 0.00 N ATOM 1574 CA SER A 637 2.764 6.491 19.312 1.00 0.00 C ATOM 1575 C SER A 637 1.865 5.496 18.585 1.00 0.00 C ATOM 1576 O SER A 637 0.798 5.131 19.077 1.00 0.00 O ATOM 1577 CB SER A 637 4.182 5.930 19.421 1.00 0.00 C ATOM 1578 OG SER A 637 4.433 5.426 20.722 1.00 0.00 O ATOM 0 H SER A 637 2.692 6.294 21.399 1.00 0.00 H new ATOM 0 HA SER A 637 2.790 7.416 18.736 1.00 0.00 H new ATOM 0 HB2 SER A 637 4.320 5.136 18.687 1.00 0.00 H new ATOM 0 HB3 SER A 637 4.905 6.711 19.185 1.00 0.00 H new ATOM 0 HG SER A 637 5.346 5.072 20.765 1.00 0.00 H new ATOM 1584 N ASN A 638 2.305 5.063 17.407 1.00 0.00 N ATOM 1585 CA ASN A 638 1.542 4.111 16.607 1.00 0.00 C ATOM 1586 C ASN A 638 2.033 2.686 16.841 1.00 0.00 C ATOM 1587 O ASN A 638 2.772 2.420 17.790 1.00 0.00 O ATOM 1588 CB ASN A 638 1.645 4.459 15.120 1.00 0.00 C ATOM 1589 CG ASN A 638 2.125 5.880 14.886 1.00 0.00 C ATOM 1590 OD1 ASN A 638 1.742 6.802 15.605 1.00 0.00 O ATOM 1591 ND2 ASN A 638 2.969 6.062 13.877 1.00 0.00 N ATOM 0 H ASN A 638 3.186 5.357 16.985 1.00 0.00 H new ATOM 0 HA ASN A 638 0.498 4.173 16.916 1.00 0.00 H new ATOM 0 HB2 ASN A 638 2.329 3.763 14.634 1.00 0.00 H new ATOM 0 HB3 ASN A 638 0.670 4.327 14.651 1.00 0.00 H new ATOM 0 HD21 ASN A 638 3.326 6.995 13.673 1.00 0.00 H new ATOM 0 HD22 ASN A 638 3.260 5.268 13.306 1.00 0.00 H new ATOM 1598 N ASP A 639 1.619 1.772 15.969 1.00 0.00 N ATOM 1599 CA ASP A 639 2.017 0.374 16.078 1.00 0.00 C ATOM 1600 C ASP A 639 2.140 -0.266 14.700 1.00 0.00 C ATOM 1601 O ASP A 639 1.379 0.053 13.787 1.00 0.00 O ATOM 1602 CB ASP A 639 1.003 -0.404 16.920 1.00 0.00 C ATOM 1603 CG ASP A 639 1.130 -0.105 18.401 1.00 0.00 C ATOM 1604 OD1 ASP A 639 2.151 -0.498 19.001 1.00 0.00 O ATOM 1605 OD2 ASP A 639 0.205 0.522 18.960 1.00 0.00 O ATOM 0 H ASP A 639 1.007 1.975 15.178 1.00 0.00 H new ATOM 0 HA ASP A 639 2.991 0.339 16.566 1.00 0.00 H new ATOM 0 HB2 ASP A 639 -0.006 -0.158 16.588 1.00 0.00 H new ATOM 0 HB3 ASP A 639 1.141 -1.472 16.755 1.00 0.00 H new ATOM 1610 N TYR A 640 3.101 -1.173 14.554 1.00 0.00 N ATOM 1611 CA TYR A 640 3.316 -1.856 13.284 1.00 0.00 C ATOM 1612 C TYR A 640 2.489 -3.133 13.207 1.00 0.00 C ATOM 1613 O TYR A 640 2.784 -4.118 13.882 1.00 0.00 O ATOM 1614 CB TYR A 640 4.797 -2.188 13.099 1.00 0.00 C ATOM 1615 CG TYR A 640 5.207 -2.337 11.650 1.00 0.00 C ATOM 1616 CD1 TYR A 640 4.257 -2.336 10.635 1.00 0.00 C ATOM 1617 CD2 TYR A 640 6.543 -2.481 11.298 1.00 0.00 C ATOM 1618 CE1 TYR A 640 4.627 -2.474 9.312 1.00 0.00 C ATOM 1619 CE2 TYR A 640 6.921 -2.620 9.976 1.00 0.00 C ATOM 1620 CZ TYR A 640 5.960 -2.615 8.987 1.00 0.00 C ATOM 1621 OH TYR A 640 6.333 -2.752 7.670 1.00 0.00 O ATOM 0 H TYR A 640 3.741 -1.451 15.298 1.00 0.00 H new ATOM 0 HA TYR A 640 2.998 -1.186 12.485 1.00 0.00 H new ATOM 0 HB2 TYR A 640 5.397 -1.403 13.559 1.00 0.00 H new ATOM 0 HB3 TYR A 640 5.022 -3.113 13.629 1.00 0.00 H new ATOM 0 HD1 TYR A 640 3.212 -2.225 10.886 1.00 0.00 H new ATOM 0 HD2 TYR A 640 7.298 -2.484 12.070 1.00 0.00 H new ATOM 0 HE1 TYR A 640 3.876 -2.472 8.535 1.00 0.00 H new ATOM 0 HE2 TYR A 640 7.964 -2.732 9.719 1.00 0.00 H new ATOM 0 HH TYR A 640 7.307 -2.840 7.613 1.00 0.00 H new ATOM 1631 N ILE A 641 1.453 -3.112 12.374 1.00 0.00 N ATOM 1632 CA ILE A 641 0.588 -4.271 12.206 1.00 0.00 C ATOM 1633 C ILE A 641 1.138 -5.208 11.134 1.00 0.00 C ATOM 1634 O ILE A 641 1.096 -6.429 11.285 1.00 0.00 O ATOM 1635 CB ILE A 641 -0.847 -3.854 11.833 1.00 0.00 C ATOM 1636 CG1 ILE A 641 -1.534 -3.192 13.027 1.00 0.00 C ATOM 1637 CG2 ILE A 641 -1.648 -5.058 11.357 1.00 0.00 C ATOM 1638 CD1 ILE A 641 -2.763 -2.398 12.648 1.00 0.00 C ATOM 0 H ILE A 641 1.194 -2.305 11.806 1.00 0.00 H new ATOM 0 HA ILE A 641 0.562 -4.793 13.162 1.00 0.00 H new ATOM 0 HB ILE A 641 -0.797 -3.133 11.017 1.00 0.00 H new ATOM 0 HG12 ILE A 641 -1.815 -3.961 13.747 1.00 0.00 H new ATOM 0 HG13 ILE A 641 -0.824 -2.532 13.526 1.00 0.00 H new ATOM 0 HG21 ILE A 641 -2.659 -4.743 11.098 1.00 0.00 H new ATOM 0 HG22 ILE A 641 -1.167 -5.491 10.480 1.00 0.00 H new ATOM 0 HG23 ILE A 641 -1.692 -5.803 12.152 1.00 0.00 H new ATOM 0 HD11 ILE A 641 -3.201 -1.956 13.543 1.00 0.00 H new ATOM 0 HD12 ILE A 641 -2.485 -1.607 11.951 1.00 0.00 H new ATOM 0 HD13 ILE A 641 -3.491 -3.058 12.176 1.00 0.00 H new ATOM 1650 N GLY A 642 1.656 -4.630 10.055 1.00 0.00 N ATOM 1651 CA GLY A 642 2.208 -5.433 8.982 1.00 0.00 C ATOM 1652 C GLY A 642 2.110 -4.753 7.631 1.00 0.00 C ATOM 1653 O GLY A 642 1.381 -3.774 7.471 1.00 0.00 O ATOM 0 H GLY A 642 1.703 -3.622 9.906 1.00 0.00 H new ATOM 0 HA2 GLY A 642 3.254 -5.652 9.199 1.00 0.00 H new ATOM 0 HA3 GLY A 642 1.684 -6.388 8.942 1.00 0.00 H new ATOM 1657 N GLY A 643 2.849 -5.274 6.658 1.00 0.00 N ATOM 1658 CA GLY A 643 2.833 -4.701 5.326 1.00 0.00 C ATOM 1659 C GLY A 643 3.547 -5.570 4.310 1.00 0.00 C ATOM 1660 O GLY A 643 3.743 -6.765 4.531 1.00 0.00 O ATOM 0 H GLY A 643 3.459 -6.084 6.769 1.00 0.00 H new ATOM 0 HA2 GLY A 643 1.800 -4.553 5.010 1.00 0.00 H new ATOM 0 HA3 GLY A 643 3.303 -3.718 5.352 1.00 0.00 H new ATOM 1664 N CYS A 644 3.937 -4.967 3.191 1.00 0.00 N ATOM 1665 CA CYS A 644 4.634 -5.690 2.135 1.00 0.00 C ATOM 1666 C CYS A 644 5.167 -4.728 1.079 1.00 0.00 C ATOM 1667 O CYS A 644 4.634 -3.633 0.897 1.00 0.00 O ATOM 1668 CB CYS A 644 3.698 -6.712 1.486 1.00 0.00 C ATOM 1669 SG CYS A 644 4.179 -8.433 1.763 1.00 0.00 S ATOM 0 H CYS A 644 3.782 -3.979 2.993 1.00 0.00 H new ATOM 0 HA CYS A 644 5.479 -6.214 2.582 1.00 0.00 H new ATOM 0 HB2 CYS A 644 2.690 -6.561 1.871 1.00 0.00 H new ATOM 0 HB3 CYS A 644 3.661 -6.525 0.413 1.00 0.00 H new ATOM 0 HG CYS A 644 3.327 -9.221 1.178 1.00 0.00 H new ATOM 1675 N GLN A 645 6.223 -5.142 0.385 1.00 0.00 N ATOM 1676 CA GLN A 645 6.827 -4.314 -0.652 1.00 0.00 C ATOM 1677 C GLN A 645 6.324 -4.720 -2.033 1.00 0.00 C ATOM 1678 O GLN A 645 5.866 -5.845 -2.232 1.00 0.00 O ATOM 1679 CB GLN A 645 8.351 -4.426 -0.598 1.00 0.00 C ATOM 1680 CG GLN A 645 9.024 -3.252 0.094 1.00 0.00 C ATOM 1681 CD GLN A 645 10.530 -3.402 0.165 1.00 0.00 C ATOM 1682 OE1 GLN A 645 11.116 -3.396 1.248 1.00 0.00 O ATOM 1683 NE2 GLN A 645 11.167 -3.537 -0.992 1.00 0.00 N ATOM 0 H GLN A 645 6.677 -6.045 0.522 1.00 0.00 H new ATOM 0 HA GLN A 645 6.539 -3.279 -0.470 1.00 0.00 H new ATOM 0 HB2 GLN A 645 8.621 -5.346 -0.079 1.00 0.00 H new ATOM 0 HB3 GLN A 645 8.737 -4.508 -1.614 1.00 0.00 H new ATOM 0 HG2 GLN A 645 8.779 -2.333 -0.438 1.00 0.00 H new ATOM 0 HG3 GLN A 645 8.625 -3.153 1.103 1.00 0.00 H new ATOM 0 HE21 GLN A 645 10.642 -3.537 -1.866 1.00 0.00 H new ATOM 0 HE22 GLN A 645 12.182 -3.641 -1.006 1.00 0.00 H new ATOM 1692 N LEU A 646 6.408 -3.795 -2.984 1.00 0.00 N ATOM 1693 CA LEU A 646 5.957 -4.058 -4.346 1.00 0.00 C ATOM 1694 C LEU A 646 6.858 -3.372 -5.369 1.00 0.00 C ATOM 1695 O LEU A 646 6.654 -2.207 -5.713 1.00 0.00 O ATOM 1696 CB LEU A 646 4.513 -3.588 -4.523 1.00 0.00 C ATOM 1697 CG LEU A 646 3.465 -4.483 -3.863 1.00 0.00 C ATOM 1698 CD1 LEU A 646 2.061 -4.008 -4.212 1.00 0.00 C ATOM 1699 CD2 LEU A 646 3.662 -5.932 -4.285 1.00 0.00 C ATOM 0 H LEU A 646 6.784 -2.858 -2.837 1.00 0.00 H new ATOM 0 HA LEU A 646 6.009 -5.134 -4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 646 4.420 -2.581 -4.115 1.00 0.00 H new ATOM 0 HB3 LEU A 646 4.295 -3.521 -5.589 1.00 0.00 H new ATOM 0 HG LEU A 646 3.588 -4.420 -2.782 1.00 0.00 H new ATOM 0 HD11 LEU A 646 1.328 -4.657 -3.733 1.00 0.00 H new ATOM 0 HD12 LEU A 646 1.925 -2.985 -3.860 1.00 0.00 H new ATOM 0 HD13 LEU A 646 1.924 -4.041 -5.293 1.00 0.00 H new ATOM 0 HD21 LEU A 646 2.908 -6.556 -3.806 1.00 0.00 H new ATOM 0 HD22 LEU A 646 3.565 -6.012 -5.368 1.00 0.00 H new ATOM 0 HD23 LEU A 646 4.655 -6.267 -3.984 1.00 0.00 H new ATOM 1711 N GLY A 647 7.851 -4.108 -5.855 1.00 0.00 N ATOM 1712 CA GLY A 647 8.770 -3.570 -6.841 1.00 0.00 C ATOM 1713 C GLY A 647 9.103 -4.588 -7.912 1.00 0.00 C ATOM 1714 O GLY A 647 9.242 -5.776 -7.621 1.00 0.00 O ATOM 0 H GLY A 647 8.037 -5.073 -5.582 1.00 0.00 H new ATOM 0 HA2 GLY A 647 8.331 -2.686 -7.303 1.00 0.00 H new ATOM 0 HA3 GLY A 647 9.687 -3.249 -6.347 1.00 0.00 H new ATOM 1718 N ILE A 648 9.216 -4.134 -9.156 1.00 0.00 N ATOM 1719 CA ILE A 648 9.513 -5.020 -10.259 1.00 0.00 C ATOM 1720 C ILE A 648 10.816 -5.789 -10.042 1.00 0.00 C ATOM 1721 O ILE A 648 11.090 -6.771 -10.730 1.00 0.00 O ATOM 1722 CB ILE A 648 9.550 -4.242 -11.586 1.00 0.00 C ATOM 1723 CG1 ILE A 648 8.933 -5.075 -12.692 1.00 0.00 C ATOM 1724 CG2 ILE A 648 10.958 -3.808 -11.951 1.00 0.00 C ATOM 1725 CD1 ILE A 648 9.207 -4.543 -14.078 1.00 0.00 C ATOM 0 H ILE A 648 9.105 -3.155 -9.419 1.00 0.00 H new ATOM 0 HA ILE A 648 8.711 -5.756 -10.310 1.00 0.00 H new ATOM 0 HB ILE A 648 8.963 -3.332 -11.459 1.00 0.00 H new ATOM 0 HG12 ILE A 648 9.313 -6.094 -12.622 1.00 0.00 H new ATOM 0 HG13 ILE A 648 7.855 -5.125 -12.538 1.00 0.00 H new ATOM 0 HG21 ILE A 648 10.937 -3.262 -12.894 1.00 0.00 H new ATOM 0 HG22 ILE A 648 11.355 -3.163 -11.167 1.00 0.00 H new ATOM 0 HG23 ILE A 648 11.594 -4.687 -12.054 1.00 0.00 H new ATOM 0 HD11 ILE A 648 8.734 -5.191 -14.816 1.00 0.00 H new ATOM 0 HD12 ILE A 648 8.802 -3.535 -14.167 1.00 0.00 H new ATOM 0 HD13 ILE A 648 10.283 -4.519 -14.252 1.00 0.00 H new ATOM 1737 N SER A 649 11.608 -5.351 -9.069 1.00 0.00 N ATOM 1738 CA SER A 649 12.863 -6.022 -8.754 1.00 0.00 C ATOM 1739 C SER A 649 12.618 -7.136 -7.741 1.00 0.00 C ATOM 1740 O SER A 649 13.550 -7.641 -7.114 1.00 0.00 O ATOM 1741 CB SER A 649 13.882 -5.023 -8.201 1.00 0.00 C ATOM 1742 OG SER A 649 15.207 -5.486 -8.395 1.00 0.00 O ATOM 0 H SER A 649 11.404 -4.538 -8.488 1.00 0.00 H new ATOM 0 HA SER A 649 13.266 -6.455 -9.670 1.00 0.00 H new ATOM 0 HB2 SER A 649 13.755 -4.059 -8.693 1.00 0.00 H new ATOM 0 HB3 SER A 649 13.701 -4.865 -7.138 1.00 0.00 H new ATOM 0 HG SER A 649 15.288 -6.400 -8.051 1.00 0.00 H new ATOM 1748 N ALA A 650 11.349 -7.508 -7.585 1.00 0.00 N ATOM 1749 CA ALA A 650 10.954 -8.551 -6.650 1.00 0.00 C ATOM 1750 C ALA A 650 10.854 -9.908 -7.341 1.00 0.00 C ATOM 1751 O ALA A 650 11.399 -10.106 -8.426 1.00 0.00 O ATOM 1752 CB ALA A 650 9.622 -8.188 -6.011 1.00 0.00 C ATOM 0 H ALA A 650 10.572 -7.096 -8.101 1.00 0.00 H new ATOM 0 HA ALA A 650 11.720 -8.627 -5.878 1.00 0.00 H new ATOM 0 HB1 ALA A 650 9.329 -8.971 -5.311 1.00 0.00 H new ATOM 0 HB2 ALA A 650 9.720 -7.243 -5.477 1.00 0.00 H new ATOM 0 HB3 ALA A 650 8.861 -8.090 -6.786 1.00 0.00 H new ATOM 1802 N ARG A 654 4.945 -10.015 -5.703 1.00 0.00 N ATOM 1803 CA ARG A 654 5.396 -8.632 -5.622 1.00 0.00 C ATOM 1804 C ARG A 654 5.697 -8.083 -7.011 1.00 0.00 C ATOM 1805 O ARG A 654 5.608 -6.879 -7.249 1.00 0.00 O ATOM 1806 CB ARG A 654 6.644 -8.536 -4.742 1.00 0.00 C ATOM 1807 CG ARG A 654 6.557 -9.361 -3.468 1.00 0.00 C ATOM 1808 CD ARG A 654 6.541 -8.477 -2.238 1.00 0.00 C ATOM 1809 NE ARG A 654 7.186 -9.114 -1.095 1.00 0.00 N ATOM 1810 CZ ARG A 654 8.495 -9.336 -1.017 1.00 0.00 C ATOM 1811 NH1 ARG A 654 9.291 -8.973 -2.012 1.00 0.00 N ATOM 1812 NH2 ARG A 654 9.007 -9.921 0.057 1.00 0.00 N ATOM 0 HA ARG A 654 4.599 -8.036 -5.178 1.00 0.00 H new ATOM 0 HB2 ARG A 654 7.510 -8.863 -5.318 1.00 0.00 H new ATOM 0 HB3 ARG A 654 6.812 -7.492 -4.478 1.00 0.00 H new ATOM 0 HG2 ARG A 654 5.655 -9.973 -3.490 1.00 0.00 H new ATOM 0 HG3 ARG A 654 7.405 -10.044 -3.416 1.00 0.00 H new ATOM 0 HD2 ARG A 654 7.046 -7.537 -2.461 1.00 0.00 H new ATOM 0 HD3 ARG A 654 5.510 -8.232 -1.982 1.00 0.00 H new ATOM 0 HE ARG A 654 6.601 -9.405 -0.312 1.00 0.00 H new ATOM 0 HH11 ARG A 654 8.900 -8.523 -2.839 1.00 0.00 H new ATOM 0 HH12 ARG A 654 10.295 -9.144 -1.951 1.00 0.00 H new ATOM 0 HH21 ARG A 654 8.397 -10.201 0.825 1.00 0.00 H new ATOM 0 HH22 ARG A 654 10.011 -10.091 0.115 1.00 0.00 H new ATOM 1826 N LEU A 655 6.055 -8.979 -7.923 1.00 0.00 N ATOM 1827 CA LEU A 655 6.373 -8.595 -9.292 1.00 0.00 C ATOM 1828 C LEU A 655 5.128 -8.631 -10.173 1.00 0.00 C ATOM 1829 O LEU A 655 4.811 -7.659 -10.860 1.00 0.00 O ATOM 1830 CB LEU A 655 7.441 -9.527 -9.866 1.00 0.00 C ATOM 1831 CG LEU A 655 7.975 -9.132 -11.243 1.00 0.00 C ATOM 1832 CD1 LEU A 655 8.817 -7.871 -11.145 1.00 0.00 C ATOM 1833 CD2 LEU A 655 8.783 -10.271 -11.845 1.00 0.00 C ATOM 0 H LEU A 655 6.132 -9.979 -7.738 1.00 0.00 H new ATOM 0 HA LEU A 655 6.755 -7.574 -9.277 1.00 0.00 H new ATOM 0 HB2 LEU A 655 8.277 -9.570 -9.168 1.00 0.00 H new ATOM 0 HB3 LEU A 655 7.027 -10.533 -9.929 1.00 0.00 H new ATOM 0 HG LEU A 655 7.128 -8.928 -11.898 1.00 0.00 H new ATOM 0 HD11 LEU A 655 9.189 -7.604 -12.134 1.00 0.00 H new ATOM 0 HD12 LEU A 655 8.208 -7.056 -10.755 1.00 0.00 H new ATOM 0 HD13 LEU A 655 9.659 -8.047 -10.476 1.00 0.00 H new ATOM 0 HD21 LEU A 655 9.156 -9.974 -12.825 1.00 0.00 H new ATOM 0 HD22 LEU A 655 9.624 -10.505 -11.192 1.00 0.00 H new ATOM 0 HD23 LEU A 655 8.149 -11.151 -11.950 1.00 0.00 H new ATOM 1845 N LYS A 656 4.428 -9.759 -10.151 1.00 0.00 N ATOM 1846 CA LYS A 656 3.220 -9.928 -10.950 1.00 0.00 C ATOM 1847 C LYS A 656 2.273 -8.743 -10.779 1.00 0.00 C ATOM 1848 O LYS A 656 1.985 -8.025 -11.735 1.00 0.00 O ATOM 1849 CB LYS A 656 2.504 -11.223 -10.565 1.00 0.00 C ATOM 1850 CG LYS A 656 3.208 -12.477 -11.055 1.00 0.00 C ATOM 1851 CD LYS A 656 2.273 -13.676 -11.056 1.00 0.00 C ATOM 1852 CE LYS A 656 2.977 -14.932 -10.572 1.00 0.00 C ATOM 1853 NZ LYS A 656 3.296 -15.858 -11.694 1.00 0.00 N ATOM 0 H LYS A 656 4.677 -10.572 -9.587 1.00 0.00 H new ATOM 0 HA LYS A 656 3.519 -9.980 -11.997 1.00 0.00 H new ATOM 0 HB2 LYS A 656 2.412 -11.269 -9.480 1.00 0.00 H new ATOM 0 HB3 LYS A 656 1.492 -11.203 -10.970 1.00 0.00 H new ATOM 0 HG2 LYS A 656 3.590 -12.311 -12.062 1.00 0.00 H new ATOM 0 HG3 LYS A 656 4.068 -12.685 -10.418 1.00 0.00 H new ATOM 0 HD2 LYS A 656 1.415 -13.470 -10.417 1.00 0.00 H new ATOM 0 HD3 LYS A 656 1.889 -13.838 -12.063 1.00 0.00 H new ATOM 0 HE2 LYS A 656 3.897 -14.657 -10.056 1.00 0.00 H new ATOM 0 HE3 LYS A 656 2.346 -15.445 -9.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 656 3.776 -16.702 -11.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 656 2.416 -16.142 -12.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 656 3.919 -15.378 -12.374 1.00 0.00 H new ATOM 1867 N HIS A 657 1.794 -8.545 -9.557 1.00 0.00 N ATOM 1868 CA HIS A 657 0.876 -7.451 -9.260 1.00 0.00 C ATOM 1869 C HIS A 657 1.465 -6.122 -9.708 1.00 0.00 C ATOM 1870 O HIS A 657 0.860 -5.388 -10.492 1.00 0.00 O ATOM 1871 CB HIS A 657 0.582 -7.409 -7.759 1.00 0.00 C ATOM 1872 CG HIS A 657 -0.645 -6.629 -7.405 1.00 0.00 C ATOM 1873 ND1 HIS A 657 -0.686 -5.717 -6.370 1.00 0.00 N ATOM 1874 CD2 HIS A 657 -1.886 -6.635 -7.946 1.00 0.00 C ATOM 1875 CE1 HIS A 657 -1.899 -5.198 -6.290 1.00 0.00 C ATOM 1876 NE2 HIS A 657 -2.646 -5.738 -7.235 1.00 0.00 N ATOM 0 H HIS A 657 2.026 -9.129 -8.754 1.00 0.00 H new ATOM 0 HA HIS A 657 -0.053 -7.621 -9.804 1.00 0.00 H new ATOM 0 HB2 HIS A 657 0.471 -8.429 -7.391 1.00 0.00 H new ATOM 0 HB3 HIS A 657 1.438 -6.975 -7.243 1.00 0.00 H new ATOM 0 HD1 HIS A 657 0.098 -5.480 -5.762 1.00 0.00 H new ATOM 0 HD2 HIS A 657 -2.217 -7.234 -8.782 1.00 0.00 H new ATOM 0 HE1 HIS A 657 -2.224 -4.458 -5.573 1.00 0.00 H new ATOM 1885 N TRP A 658 2.650 -5.825 -9.200 1.00 0.00 N ATOM 1886 CA TRP A 658 3.341 -4.587 -9.531 1.00 0.00 C ATOM 1887 C TRP A 658 3.619 -4.494 -11.028 1.00 0.00 C ATOM 1888 O TRP A 658 2.925 -3.790 -11.762 1.00 0.00 O ATOM 1889 CB TRP A 658 4.654 -4.503 -8.751 1.00 0.00 C ATOM 1890 CG TRP A 658 5.501 -3.330 -9.131 1.00 0.00 C ATOM 1891 CD1 TRP A 658 6.711 -3.361 -9.761 1.00 0.00 C ATOM 1892 CD2 TRP A 658 5.201 -1.951 -8.899 1.00 0.00 C ATOM 1893 NE1 TRP A 658 7.183 -2.084 -9.937 1.00 0.00 N ATOM 1894 CE2 TRP A 658 6.272 -1.199 -9.416 1.00 0.00 C ATOM 1895 CE3 TRP A 658 4.128 -1.279 -8.307 1.00 0.00 C ATOM 1896 CZ2 TRP A 658 6.299 0.192 -9.356 1.00 0.00 C ATOM 1897 CZ3 TRP A 658 4.157 0.100 -8.247 1.00 0.00 C ATOM 1898 CH2 TRP A 658 5.236 0.824 -8.770 1.00 0.00 C ATOM 0 H TRP A 658 3.157 -6.428 -8.552 1.00 0.00 H new ATOM 0 HA TRP A 658 2.698 -3.752 -9.254 1.00 0.00 H new ATOM 0 HB2 TRP A 658 4.431 -4.450 -7.685 1.00 0.00 H new ATOM 0 HB3 TRP A 658 5.222 -5.419 -8.913 1.00 0.00 H new ATOM 0 HD1 TRP A 658 7.222 -4.259 -10.075 1.00 0.00 H new ATOM 0 HE1 TRP A 658 8.066 -1.834 -10.382 1.00 0.00 H new ATOM 0 HE3 TRP A 658 3.291 -1.829 -7.903 1.00 0.00 H new ATOM 0 HZ2 TRP A 658 7.130 0.753 -9.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 658 3.334 0.629 -7.789 1.00 0.00 H new ATOM 0 HH2 TRP A 658 5.229 1.902 -8.710 1.00 0.00 H new ATOM 1909 N TYR A 659 4.649 -5.205 -11.465 1.00 0.00 N ATOM 1910 CA TYR A 659 5.054 -5.219 -12.863 1.00 0.00 C ATOM 1911 C TYR A 659 3.862 -5.304 -13.813 1.00 0.00 C ATOM 1912 O TYR A 659 3.618 -4.383 -14.592 1.00 0.00 O ATOM 1913 CB TYR A 659 5.994 -6.398 -13.100 1.00 0.00 C ATOM 1914 CG TYR A 659 6.774 -6.339 -14.396 1.00 0.00 C ATOM 1915 CD1 TYR A 659 6.365 -5.537 -15.456 1.00 0.00 C ATOM 1916 CD2 TYR A 659 7.923 -7.100 -14.560 1.00 0.00 C ATOM 1917 CE1 TYR A 659 7.076 -5.498 -16.637 1.00 0.00 C ATOM 1918 CE2 TYR A 659 8.641 -7.067 -15.737 1.00 0.00 C ATOM 1919 CZ TYR A 659 8.214 -6.265 -16.774 1.00 0.00 C ATOM 1920 OH TYR A 659 8.926 -6.230 -17.951 1.00 0.00 O ATOM 0 H TYR A 659 5.227 -5.788 -10.860 1.00 0.00 H new ATOM 0 HA TYR A 659 5.563 -4.278 -13.073 1.00 0.00 H new ATOM 0 HB2 TYR A 659 6.699 -6.455 -12.271 1.00 0.00 H new ATOM 0 HB3 TYR A 659 5.410 -7.318 -13.086 1.00 0.00 H new ATOM 0 HD1 TYR A 659 5.475 -4.934 -15.352 1.00 0.00 H new ATOM 0 HD2 TYR A 659 8.261 -7.730 -13.751 1.00 0.00 H new ATOM 0 HE1 TYR A 659 6.743 -4.870 -17.450 1.00 0.00 H new ATOM 0 HE2 TYR A 659 9.533 -7.666 -15.846 1.00 0.00 H new ATOM 0 HH TYR A 659 9.700 -6.827 -17.883 1.00 0.00 H new ATOM 1930 N GLU A 660 3.132 -6.412 -13.772 1.00 0.00 N ATOM 1931 CA GLU A 660 1.997 -6.580 -14.664 1.00 0.00 C ATOM 1932 C GLU A 660 1.173 -5.300 -14.709 1.00 0.00 C ATOM 1933 O GLU A 660 0.570 -4.973 -15.731 1.00 0.00 O ATOM 1934 CB GLU A 660 1.137 -7.771 -14.234 1.00 0.00 C ATOM 1935 CG GLU A 660 0.031 -7.407 -13.261 1.00 0.00 C ATOM 1936 CD GLU A 660 -0.428 -8.588 -12.428 1.00 0.00 C ATOM 1937 OE1 GLU A 660 0.237 -9.644 -12.477 1.00 0.00 O ATOM 1938 OE2 GLU A 660 -1.454 -8.457 -11.728 1.00 0.00 O ATOM 0 H GLU A 660 3.303 -7.195 -13.141 1.00 0.00 H new ATOM 0 HA GLU A 660 2.370 -6.786 -15.667 1.00 0.00 H new ATOM 0 HB2 GLU A 660 0.694 -8.226 -15.120 1.00 0.00 H new ATOM 0 HB3 GLU A 660 1.778 -8.524 -13.776 1.00 0.00 H new ATOM 0 HG2 GLU A 660 0.381 -6.615 -12.599 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -0.818 -7.007 -13.815 1.00 0.00 H new ATOM 1945 N CYS A 661 1.172 -4.565 -13.600 1.00 0.00 N ATOM 1946 CA CYS A 661 0.446 -3.305 -13.530 1.00 0.00 C ATOM 1947 C CYS A 661 1.031 -2.327 -14.539 1.00 0.00 C ATOM 1948 O CYS A 661 0.303 -1.614 -15.232 1.00 0.00 O ATOM 1949 CB CYS A 661 0.524 -2.718 -12.119 1.00 0.00 C ATOM 1950 SG CYS A 661 -0.730 -1.463 -11.771 1.00 0.00 S ATOM 0 H CYS A 661 1.663 -4.820 -12.743 1.00 0.00 H new ATOM 0 HA CYS A 661 -0.603 -3.485 -13.767 1.00 0.00 H new ATOM 0 HB2 CYS A 661 0.424 -3.526 -11.395 1.00 0.00 H new ATOM 0 HB3 CYS A 661 1.511 -2.280 -11.973 1.00 0.00 H new ATOM 0 HG CYS A 661 -1.029 -0.832 -12.868 1.00 0.00 H new ATOM 1956 N LEU A 662 2.358 -2.319 -14.629 1.00 0.00 N ATOM 1957 CA LEU A 662 3.065 -1.457 -15.563 1.00 0.00 C ATOM 1958 C LEU A 662 2.616 -1.746 -16.990 1.00 0.00 C ATOM 1959 O LEU A 662 2.692 -0.883 -17.866 1.00 0.00 O ATOM 1960 CB LEU A 662 4.574 -1.674 -15.437 1.00 0.00 C ATOM 1961 CG LEU A 662 5.288 -0.707 -14.492 1.00 0.00 C ATOM 1962 CD1 LEU A 662 5.628 -1.388 -13.177 1.00 0.00 C ATOM 1963 CD2 LEU A 662 6.547 -0.163 -15.144 1.00 0.00 C ATOM 0 H LEU A 662 2.967 -2.906 -14.060 1.00 0.00 H new ATOM 0 HA LEU A 662 2.834 -0.419 -15.325 1.00 0.00 H new ATOM 0 HB2 LEU A 662 4.752 -2.693 -15.093 1.00 0.00 H new ATOM 0 HB3 LEU A 662 5.022 -1.589 -16.427 1.00 0.00 H new ATOM 0 HG LEU A 662 4.614 0.124 -14.283 1.00 0.00 H new ATOM 0 HD11 LEU A 662 6.135 -0.680 -12.521 1.00 0.00 H new ATOM 0 HD12 LEU A 662 4.712 -1.733 -12.699 1.00 0.00 H new ATOM 0 HD13 LEU A 662 6.281 -2.240 -13.367 1.00 0.00 H new ATOM 0 HD21 LEU A 662 7.044 0.524 -14.459 1.00 0.00 H new ATOM 0 HD22 LEU A 662 7.219 -0.988 -15.382 1.00 0.00 H new ATOM 0 HD23 LEU A 662 6.283 0.366 -16.060 1.00 0.00 H new ATOM 1975 N LYS A 663 2.141 -2.966 -17.214 1.00 0.00 N ATOM 1976 CA LYS A 663 1.672 -3.373 -18.530 1.00 0.00 C ATOM 1977 C LYS A 663 0.238 -2.898 -18.745 1.00 0.00 C ATOM 1978 O LYS A 663 -0.107 -2.379 -19.807 1.00 0.00 O ATOM 1979 CB LYS A 663 1.776 -4.900 -18.679 1.00 0.00 C ATOM 1980 CG LYS A 663 0.439 -5.628 -18.749 1.00 0.00 C ATOM 1981 CD LYS A 663 0.626 -7.112 -19.015 1.00 0.00 C ATOM 1982 CE LYS A 663 0.734 -7.401 -20.503 1.00 0.00 C ATOM 1983 NZ LYS A 663 -0.593 -7.358 -21.176 1.00 0.00 N ATOM 0 H LYS A 663 2.071 -3.690 -16.499 1.00 0.00 H new ATOM 0 HA LYS A 663 2.301 -2.913 -19.292 1.00 0.00 H new ATOM 0 HB2 LYS A 663 2.344 -5.125 -19.582 1.00 0.00 H new ATOM 0 HB3 LYS A 663 2.345 -5.295 -17.838 1.00 0.00 H new ATOM 0 HG2 LYS A 663 -0.101 -5.490 -17.812 1.00 0.00 H new ATOM 0 HG3 LYS A 663 -0.174 -5.190 -19.537 1.00 0.00 H new ATOM 0 HD2 LYS A 663 1.525 -7.463 -18.509 1.00 0.00 H new ATOM 0 HD3 LYS A 663 -0.213 -7.667 -18.595 1.00 0.00 H new ATOM 0 HE2 LYS A 663 1.400 -6.673 -20.967 1.00 0.00 H new ATOM 0 HE3 LYS A 663 1.184 -8.383 -20.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 663 -0.496 -7.692 -22.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 663 -1.261 -7.971 -20.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 663 -0.951 -6.381 -21.176 1.00 0.00 H new ATOM 1997 N ASN A 664 -0.588 -3.077 -17.721 1.00 0.00 N ATOM 1998 CA ASN A 664 -1.983 -2.668 -17.783 1.00 0.00 C ATOM 1999 C ASN A 664 -2.189 -1.340 -17.060 1.00 0.00 C ATOM 2000 O ASN A 664 -3.192 -1.142 -16.373 1.00 0.00 O ATOM 2001 CB ASN A 664 -2.880 -3.745 -17.169 1.00 0.00 C ATOM 2002 CG ASN A 664 -3.724 -4.455 -18.208 1.00 0.00 C ATOM 2003 OD1 ASN A 664 -3.557 -4.246 -19.409 1.00 0.00 O ATOM 2004 ND2 ASN A 664 -4.639 -5.302 -17.749 1.00 0.00 N ATOM 0 H ASN A 664 -0.313 -3.504 -16.836 1.00 0.00 H new ATOM 0 HA ASN A 664 -2.254 -2.537 -18.831 1.00 0.00 H new ATOM 0 HB2 ASN A 664 -2.261 -4.475 -16.647 1.00 0.00 H new ATOM 0 HB3 ASN A 664 -3.533 -3.289 -16.424 1.00 0.00 H new ATOM 0 HD21 ASN A 664 -5.237 -5.809 -18.401 1.00 0.00 H new ATOM 0 HD22 ASN A 664 -4.743 -5.445 -16.744 1.00 0.00 H new ATOM 2011 N LYS A 665 -1.231 -0.433 -17.221 1.00 0.00 N ATOM 2012 CA LYS A 665 -1.297 0.879 -16.586 1.00 0.00 C ATOM 2013 C LYS A 665 -2.728 1.410 -16.563 1.00 0.00 C ATOM 2014 O LYS A 665 -3.386 1.403 -15.524 1.00 0.00 O ATOM 2015 CB LYS A 665 -0.388 1.866 -17.321 1.00 0.00 C ATOM 2016 CG LYS A 665 1.069 1.436 -17.365 1.00 0.00 C ATOM 2017 CD LYS A 665 1.722 1.807 -18.687 1.00 0.00 C ATOM 2018 CE LYS A 665 0.925 1.285 -19.870 1.00 0.00 C ATOM 2019 NZ LYS A 665 1.791 0.578 -20.854 1.00 0.00 N ATOM 0 H LYS A 665 -0.397 -0.583 -17.788 1.00 0.00 H new ATOM 0 HA LYS A 665 -0.956 0.772 -15.556 1.00 0.00 H new ATOM 0 HB2 LYS A 665 -0.752 1.992 -18.341 1.00 0.00 H new ATOM 0 HB3 LYS A 665 -0.456 2.840 -16.836 1.00 0.00 H new ATOM 0 HG2 LYS A 665 1.613 1.906 -16.545 1.00 0.00 H new ATOM 0 HG3 LYS A 665 1.136 0.358 -17.215 1.00 0.00 H new ATOM 0 HD2 LYS A 665 1.812 2.891 -18.758 1.00 0.00 H new ATOM 0 HD3 LYS A 665 2.733 1.401 -18.721 1.00 0.00 H new ATOM 0 HE2 LYS A 665 0.150 0.606 -19.514 1.00 0.00 H new ATOM 0 HE3 LYS A 665 0.419 2.116 -20.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 665 1.210 0.237 -21.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 665 2.515 1.233 -21.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 665 2.254 -0.230 -20.391 1.00 0.00 H new ATOM 2033 N ASP A 666 -3.200 1.874 -17.716 1.00 0.00 N ATOM 2034 CA ASP A 666 -4.551 2.417 -17.835 1.00 0.00 C ATOM 2035 C ASP A 666 -5.578 1.514 -17.156 1.00 0.00 C ATOM 2036 O ASP A 666 -6.665 1.964 -16.791 1.00 0.00 O ATOM 2037 CB ASP A 666 -4.916 2.603 -19.309 1.00 0.00 C ATOM 2038 CG ASP A 666 -4.868 4.056 -19.739 1.00 0.00 C ATOM 2039 OD1 ASP A 666 -5.250 4.928 -18.930 1.00 0.00 O ATOM 2040 OD2 ASP A 666 -4.447 4.322 -20.884 1.00 0.00 O ATOM 0 H ASP A 666 -2.665 1.885 -18.585 1.00 0.00 H new ATOM 0 HA ASP A 666 -4.567 3.384 -17.332 1.00 0.00 H new ATOM 0 HB2 ASP A 666 -4.231 2.022 -19.926 1.00 0.00 H new ATOM 0 HB3 ASP A 666 -5.917 2.208 -19.485 1.00 0.00 H new ATOM 2045 N LYS A 667 -5.234 0.240 -16.991 1.00 0.00 N ATOM 2046 CA LYS A 667 -6.134 -0.717 -16.358 1.00 0.00 C ATOM 2047 C LYS A 667 -5.831 -0.841 -14.870 1.00 0.00 C ATOM 2048 O LYS A 667 -4.672 -0.801 -14.456 1.00 0.00 O ATOM 2049 CB LYS A 667 -6.014 -2.085 -17.032 1.00 0.00 C ATOM 2050 CG LYS A 667 -6.678 -2.151 -18.399 1.00 0.00 C ATOM 2051 CD LYS A 667 -7.978 -1.363 -18.428 1.00 0.00 C ATOM 2052 CE LYS A 667 -8.982 -1.981 -19.388 1.00 0.00 C ATOM 2053 NZ LYS A 667 -8.640 -1.695 -20.808 1.00 0.00 N ATOM 0 H LYS A 667 -4.340 -0.152 -17.286 1.00 0.00 H new ATOM 0 HA LYS A 667 -7.155 -0.353 -16.474 1.00 0.00 H new ATOM 0 HB2 LYS A 667 -4.959 -2.337 -17.137 1.00 0.00 H new ATOM 0 HB3 LYS A 667 -6.459 -2.840 -16.384 1.00 0.00 H new ATOM 0 HG2 LYS A 667 -5.997 -1.759 -19.154 1.00 0.00 H new ATOM 0 HG3 LYS A 667 -6.876 -3.191 -18.658 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -8.405 -1.327 -17.426 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -7.775 -0.334 -18.725 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -9.016 -3.059 -19.233 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -9.978 -1.596 -19.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -9.348 -2.133 -21.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -8.632 -0.667 -20.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -7.700 -2.085 -21.024 1.00 0.00 H new ATOM 2067 N LYS A 668 -6.880 -0.988 -14.069 1.00 0.00 N ATOM 2068 CA LYS A 668 -6.725 -1.110 -12.624 1.00 0.00 C ATOM 2069 C LYS A 668 -6.314 -2.525 -12.233 1.00 0.00 C ATOM 2070 O LYS A 668 -6.839 -3.507 -12.756 1.00 0.00 O ATOM 2071 CB LYS A 668 -8.026 -0.730 -11.914 1.00 0.00 C ATOM 2072 CG LYS A 668 -9.134 -1.759 -12.081 1.00 0.00 C ATOM 2073 CD LYS A 668 -9.698 -2.192 -10.738 1.00 0.00 C ATOM 2074 CE LYS A 668 -9.137 -3.538 -10.307 1.00 0.00 C ATOM 2075 NZ LYS A 668 -10.024 -4.665 -10.706 1.00 0.00 N ATOM 0 H LYS A 668 -7.846 -1.026 -14.395 1.00 0.00 H new ATOM 0 HA LYS A 668 -5.936 -0.425 -12.314 1.00 0.00 H new ATOM 0 HB2 LYS A 668 -7.824 -0.595 -10.851 1.00 0.00 H new ATOM 0 HB3 LYS A 668 -8.372 0.230 -12.297 1.00 0.00 H new ATOM 0 HG2 LYS A 668 -9.932 -1.340 -12.694 1.00 0.00 H new ATOM 0 HG3 LYS A 668 -8.747 -2.629 -12.612 1.00 0.00 H new ATOM 0 HD2 LYS A 668 -9.464 -1.440 -9.984 1.00 0.00 H new ATOM 0 HD3 LYS A 668 -10.785 -2.252 -10.801 1.00 0.00 H new ATOM 0 HE2 LYS A 668 -8.151 -3.678 -10.750 1.00 0.00 H new ATOM 0 HE3 LYS A 668 -9.005 -3.546 -9.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 668 -10.263 -5.232 -9.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 668 -10.896 -4.288 -11.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 668 -9.533 -5.264 -11.400 1.00 0.00 H new ATOM 2089 N ILE A 669 -5.370 -2.616 -11.302 1.00 0.00 N ATOM 2090 CA ILE A 669 -4.881 -3.902 -10.825 1.00 0.00 C ATOM 2091 C ILE A 669 -5.037 -4.004 -9.313 1.00 0.00 C ATOM 2092 O ILE A 669 -4.401 -3.264 -8.568 1.00 0.00 O ATOM 2093 CB ILE A 669 -3.399 -4.108 -11.196 1.00 0.00 C ATOM 2094 CG1 ILE A 669 -3.260 -4.317 -12.711 1.00 0.00 C ATOM 2095 CG2 ILE A 669 -2.816 -5.280 -10.414 1.00 0.00 C ATOM 2096 CD1 ILE A 669 -2.287 -5.411 -13.102 1.00 0.00 C ATOM 0 H ILE A 669 -4.927 -1.809 -10.862 1.00 0.00 H new ATOM 0 HA ILE A 669 -5.476 -4.678 -11.307 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.834 -3.216 -10.926 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -4.240 -4.553 -13.125 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -2.939 -3.381 -13.167 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -1.769 -5.414 -10.686 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -2.890 -5.077 -9.346 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -3.371 -6.188 -10.651 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -2.249 -5.493 -14.188 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -1.295 -5.169 -12.721 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -2.617 -6.360 -12.678 1.00 0.00 H new ATOM 2108 N GLU A 670 -5.887 -4.918 -8.862 1.00 0.00 N ATOM 2109 CA GLU A 670 -6.117 -5.092 -7.432 1.00 0.00 C ATOM 2110 C GLU A 670 -5.771 -6.503 -6.976 1.00 0.00 C ATOM 2111 O GLU A 670 -5.889 -7.463 -7.736 1.00 0.00 O ATOM 2112 CB GLU A 670 -7.572 -4.767 -7.080 1.00 0.00 C ATOM 2113 CG GLU A 670 -8.508 -5.960 -7.181 1.00 0.00 C ATOM 2114 CD GLU A 670 -8.644 -6.478 -8.599 1.00 0.00 C ATOM 2115 OE1 GLU A 670 -7.604 -6.776 -9.225 1.00 0.00 O ATOM 2116 OE2 GLU A 670 -9.789 -6.585 -9.085 1.00 0.00 O ATOM 0 H GLU A 670 -6.425 -5.546 -9.459 1.00 0.00 H new ATOM 0 HA GLU A 670 -5.459 -4.399 -6.907 1.00 0.00 H new ATOM 0 HB2 GLU A 670 -7.611 -4.371 -6.065 1.00 0.00 H new ATOM 0 HB3 GLU A 670 -7.929 -3.979 -7.743 1.00 0.00 H new ATOM 0 HG2 GLU A 670 -8.140 -6.761 -6.540 1.00 0.00 H new ATOM 0 HG3 GLU A 670 -9.492 -5.678 -6.806 1.00 0.00 H new ATOM 2123 N ARG A 671 -5.348 -6.613 -5.722 1.00 0.00 N ATOM 2124 CA ARG A 671 -4.984 -7.905 -5.147 1.00 0.00 C ATOM 2125 C ARG A 671 -4.721 -7.780 -3.648 1.00 0.00 C ATOM 2126 O ARG A 671 -4.218 -6.760 -3.178 1.00 0.00 O ATOM 2127 CB ARG A 671 -3.757 -8.478 -5.865 1.00 0.00 C ATOM 2128 CG ARG A 671 -2.431 -8.130 -5.203 1.00 0.00 C ATOM 2129 CD ARG A 671 -2.070 -9.130 -4.120 1.00 0.00 C ATOM 2130 NE ARG A 671 -2.447 -10.492 -4.484 1.00 0.00 N ATOM 2131 CZ ARG A 671 -1.777 -11.231 -5.363 1.00 0.00 C ATOM 2132 NH1 ARG A 671 -0.700 -10.739 -5.961 1.00 0.00 N ATOM 2133 NH2 ARG A 671 -2.182 -12.462 -5.644 1.00 0.00 N ATOM 0 H ARG A 671 -5.248 -5.824 -5.083 1.00 0.00 H new ATOM 0 HA ARG A 671 -5.820 -8.590 -5.285 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -3.852 -9.563 -5.915 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -3.746 -8.111 -6.891 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -1.643 -8.107 -5.955 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -2.490 -7.131 -4.772 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -0.997 -9.089 -3.932 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -2.567 -8.853 -3.190 1.00 0.00 H new ATOM 0 HE ARG A 671 -3.270 -10.899 -4.040 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -0.385 -9.793 -5.747 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -0.187 -11.307 -6.635 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -3.009 -12.844 -5.185 1.00 0.00 H new ATOM 0 HH22 ARG A 671 -1.666 -13.027 -6.319 1.00 0.00 H new ATOM 2147 N TRP A 672 -5.072 -8.824 -2.902 1.00 0.00 N ATOM 2148 CA TRP A 672 -4.883 -8.831 -1.454 1.00 0.00 C ATOM 2149 C TRP A 672 -3.449 -9.188 -1.082 1.00 0.00 C ATOM 2150 O TRP A 672 -2.892 -10.166 -1.580 1.00 0.00 O ATOM 2151 CB TRP A 672 -5.851 -9.816 -0.801 1.00 0.00 C ATOM 2152 CG TRP A 672 -7.267 -9.334 -0.804 1.00 0.00 C ATOM 2153 CD1 TRP A 672 -8.218 -9.584 -1.751 1.00 0.00 C ATOM 2154 CD2 TRP A 672 -7.891 -8.508 0.184 1.00 0.00 C ATOM 2155 NE1 TRP A 672 -9.395 -8.963 -1.412 1.00 0.00 N ATOM 2156 CE2 TRP A 672 -9.219 -8.296 -0.228 1.00 0.00 C ATOM 2157 CE3 TRP A 672 -7.454 -7.927 1.378 1.00 0.00 C ATOM 2158 CZ2 TRP A 672 -10.114 -7.527 0.511 1.00 0.00 C ATOM 2159 CZ3 TRP A 672 -8.343 -7.165 2.112 1.00 0.00 C ATOM 2160 CH2 TRP A 672 -9.661 -6.970 1.676 1.00 0.00 C ATOM 0 H TRP A 672 -5.489 -9.676 -3.276 1.00 0.00 H new ATOM 0 HA TRP A 672 -5.088 -7.826 -1.086 1.00 0.00 H new ATOM 0 HB2 TRP A 672 -5.797 -10.771 -1.324 1.00 0.00 H new ATOM 0 HB3 TRP A 672 -5.537 -9.998 0.227 1.00 0.00 H new ATOM 0 HD1 TRP A 672 -8.067 -10.183 -2.637 1.00 0.00 H new ATOM 0 HE1 TRP A 672 -10.259 -8.993 -1.953 1.00 0.00 H new ATOM 0 HE3 TRP A 672 -6.440 -8.071 1.721 1.00 0.00 H new ATOM 0 HZ2 TRP A 672 -11.130 -7.375 0.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 672 -8.017 -6.712 3.037 1.00 0.00 H new ATOM 0 HH2 TRP A 672 -10.332 -6.368 2.271 1.00 0.00 H new ATOM 2171 N HIS A 673 -2.859 -8.389 -0.200 1.00 0.00 N ATOM 2172 CA HIS A 673 -1.491 -8.620 0.245 1.00 0.00 C ATOM 2173 C HIS A 673 -1.466 -9.061 1.704 1.00 0.00 C ATOM 2174 O HIS A 673 -2.082 -8.432 2.564 1.00 0.00 O ATOM 2175 CB HIS A 673 -0.651 -7.355 0.074 1.00 0.00 C ATOM 2176 CG HIS A 673 -0.382 -7.002 -1.356 1.00 0.00 C ATOM 2177 ND1 HIS A 673 0.209 -7.857 -2.260 1.00 0.00 N ATOM 2178 CD2 HIS A 673 -0.633 -5.855 -2.037 1.00 0.00 C ATOM 2179 CE1 HIS A 673 0.296 -7.218 -3.435 1.00 0.00 C ATOM 2180 NE2 HIS A 673 -0.203 -5.999 -3.351 1.00 0.00 N ATOM 0 H HIS A 673 -3.308 -7.575 0.221 1.00 0.00 H new ATOM 0 HA HIS A 673 -1.066 -9.414 -0.370 1.00 0.00 H new ATOM 0 HB2 HIS A 673 -1.163 -6.521 0.555 1.00 0.00 H new ATOM 0 HB3 HIS A 673 0.299 -7.487 0.592 1.00 0.00 H new ATOM 0 HD1 HIS A 673 0.525 -8.808 -2.069 1.00 0.00 H new ATOM 0 HD2 HIS A 673 -1.094 -4.970 -1.623 1.00 0.00 H new ATOM 0 HE1 HIS A 673 0.719 -7.645 -4.333 1.00 0.00 H new ATOM 2188 N GLN A 674 -0.746 -10.143 1.977 1.00 0.00 N ATOM 2189 CA GLN A 674 -0.641 -10.662 3.334 1.00 0.00 C ATOM 2190 C GLN A 674 0.350 -9.838 4.147 1.00 0.00 C ATOM 2191 O GLN A 674 1.560 -9.914 3.934 1.00 0.00 O ATOM 2192 CB GLN A 674 -0.207 -12.128 3.315 1.00 0.00 C ATOM 2193 CG GLN A 674 -1.364 -13.101 3.161 1.00 0.00 C ATOM 2194 CD GLN A 674 -1.033 -14.259 2.240 1.00 0.00 C ATOM 2195 OE1 GLN A 674 -1.095 -14.133 1.017 1.00 0.00 O ATOM 2196 NE2 GLN A 674 -0.680 -15.398 2.826 1.00 0.00 N ATOM 0 H GLN A 674 -0.228 -10.676 1.278 1.00 0.00 H new ATOM 0 HA GLN A 674 -1.623 -10.592 3.802 1.00 0.00 H new ATOM 0 HB2 GLN A 674 0.496 -12.280 2.496 1.00 0.00 H new ATOM 0 HB3 GLN A 674 0.326 -12.353 4.239 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -1.641 -13.489 4.141 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -2.232 -12.569 2.772 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -0.642 -15.458 3.844 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -0.447 -16.213 2.258 1.00 0.00 H new ATOM 2205 N LEU A 675 -0.174 -9.046 5.074 1.00 0.00 N ATOM 2206 CA LEU A 675 0.661 -8.200 5.916 1.00 0.00 C ATOM 2207 C LEU A 675 1.801 -8.997 6.539 1.00 0.00 C ATOM 2208 O LEU A 675 1.583 -10.051 7.136 1.00 0.00 O ATOM 2209 CB LEU A 675 -0.178 -7.549 7.014 1.00 0.00 C ATOM 2210 CG LEU A 675 -1.263 -6.596 6.518 1.00 0.00 C ATOM 2211 CD1 LEU A 675 -2.165 -6.172 7.666 1.00 0.00 C ATOM 2212 CD2 LEU A 675 -0.637 -5.381 5.851 1.00 0.00 C ATOM 0 H LEU A 675 -1.174 -8.972 5.262 1.00 0.00 H new ATOM 0 HA LEU A 675 1.091 -7.422 5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 675 -0.648 -8.335 7.605 1.00 0.00 H new ATOM 0 HB3 LEU A 675 0.487 -7.002 7.682 1.00 0.00 H new ATOM 0 HG LEU A 675 -1.872 -7.118 5.780 1.00 0.00 H new ATOM 0 HD11 LEU A 675 -2.932 -5.493 7.294 1.00 0.00 H new ATOM 0 HD12 LEU A 675 -2.639 -7.052 8.101 1.00 0.00 H new ATOM 0 HD13 LEU A 675 -1.571 -5.666 8.428 1.00 0.00 H new ATOM 0 HD21 LEU A 675 -1.424 -4.711 5.503 1.00 0.00 H new ATOM 0 HD22 LEU A 675 -0.006 -4.857 6.569 1.00 0.00 H new ATOM 0 HD23 LEU A 675 -0.033 -5.703 5.003 1.00 0.00 H new ATOM 2224 N GLN A 676 3.014 -8.480 6.398 1.00 0.00 N ATOM 2225 CA GLN A 676 4.195 -9.133 6.947 1.00 0.00 C ATOM 2226 C GLN A 676 4.866 -8.244 7.990 1.00 0.00 C ATOM 2227 O GLN A 676 4.582 -7.049 8.075 1.00 0.00 O ATOM 2228 CB GLN A 676 5.187 -9.469 5.832 1.00 0.00 C ATOM 2229 CG GLN A 676 4.901 -10.792 5.142 1.00 0.00 C ATOM 2230 CD GLN A 676 5.603 -11.960 5.807 1.00 0.00 C ATOM 2231 OE1 GLN A 676 4.961 -12.892 6.291 1.00 0.00 O ATOM 2232 NE2 GLN A 676 6.931 -11.914 5.835 1.00 0.00 N ATOM 0 H GLN A 676 3.206 -7.607 5.906 1.00 0.00 H new ATOM 0 HA GLN A 676 3.878 -10.058 7.429 1.00 0.00 H new ATOM 0 HB2 GLN A 676 5.171 -8.671 5.090 1.00 0.00 H new ATOM 0 HB3 GLN A 676 6.194 -9.496 6.249 1.00 0.00 H new ATOM 0 HG2 GLN A 676 3.826 -10.972 5.141 1.00 0.00 H new ATOM 0 HG3 GLN A 676 5.215 -10.730 4.100 1.00 0.00 H new ATOM 0 HE21 GLN A 676 7.423 -11.122 5.421 1.00 0.00 H new ATOM 0 HE22 GLN A 676 7.458 -12.671 6.270 1.00 0.00 H new ATOM 2241 N ASN A 677 5.756 -8.833 8.781 1.00 0.00 N ATOM 2242 CA ASN A 677 6.465 -8.090 9.816 1.00 0.00 C ATOM 2243 C ASN A 677 7.892 -7.774 9.380 1.00 0.00 C ATOM 2244 O ASN A 677 8.720 -8.673 9.231 1.00 0.00 O ATOM 2245 CB ASN A 677 6.483 -8.884 11.124 1.00 0.00 C ATOM 2246 CG ASN A 677 6.086 -8.038 12.317 1.00 0.00 C ATOM 2247 OD1 ASN A 677 5.940 -6.821 12.209 1.00 0.00 O ATOM 2248 ND2 ASN A 677 5.910 -8.681 13.466 1.00 0.00 N ATOM 0 H ASN A 677 6.003 -9.821 8.725 1.00 0.00 H new ATOM 0 HA ASN A 677 5.937 -7.150 9.977 1.00 0.00 H new ATOM 0 HB2 ASN A 677 5.803 -9.732 11.041 1.00 0.00 H new ATOM 0 HB3 ASN A 677 7.481 -9.290 11.286 1.00 0.00 H new ATOM 0 HD21 ASN A 677 5.643 -8.164 14.304 1.00 0.00 H new ATOM 0 HD22 ASN A 677 6.042 -9.691 13.510 1.00 0.00 H new