USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1053 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 657 HIS : no HE2:sc= -10! C(o=-18!,f=-19!) USER MOD Set 1.2: A 673 HIS : no HE2:sc= -8.36! C(o=-18!,f=-21!) USER MOD Set 2.1: A 597 GLN : amide:sc= -6.01! C(o=-9.2!,f=-15!) USER MOD Set 2.2: A 599 LYS NZ :NH3+ 155:sc= -3.24! (180deg=-0.95) USER MOD Single : A 543 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 547 SER OG : rot 44:sc= -1.21! USER MOD Single : A 549 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 550 TYR OH : rot -18:sc= -0.455 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 552 THR OG1 : rot 180:sc= -0.0462 USER MOD Single : A 553 GLN : amide:sc= -0.444 X(o=-0.44,f=-0.14) USER MOD Single : A 554 GLN : amide:sc= -1.48 K(o=-1.5,f=-0.33) USER MOD Single : A 564 CYS SG : rot -72:sc= -6.47! USER MOD Single : A 566 HIS : no HD1:sc= -0.389 X(o=-0.39,f=-0.16) USER MOD Single : A 570 MET CE :methyl -129:sc= -1.83 (180deg=-5.01!) USER MOD Single : A 573 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 575 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 SER OG : rot 154:sc= -1.34! USER MOD Single : A 581 LYS NZ :NH3+ -109:sc= 1.33 (180deg=-0.152!) USER MOD Single : A 585 LYS NZ :NH3+ 147:sc= 0 (180deg=-1.32) USER MOD Single : A 593 LYS NZ :NH3+ -163:sc= -0.216 (180deg=-0.843) USER MOD Single : A 594 HIS : no HD1:sc= -6.74! C(o=-6.7!,f=-6.9!) USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 123:sc= 2.54 USER MOD Single : A 600 LYS NZ :NH3+ -150:sc= -2.12! (180deg=-3.6!) USER MOD Single : A 601 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0 USER MOD Single : A 604 ASN : amide:sc= 0.968 K(o=0.97,f=-5.1!) USER MOD Single : A 608 ASN : amide:sc= 0.0135 X(o=0.013,f=0.26) USER MOD Single : A 613 TYR OH : rot -90:sc= 0 USER MOD Single : A 616 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.087) USER MOD Single : A 617 HIS : no HD1:sc= -2.13! C(o=-2.1!,f=-11!) USER MOD Single : A 618 SER OG : rot 84:sc= 0.105 USER MOD Single : A 622 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 623 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 624 SER OG : rot 180:sc= -0.518 USER MOD Single : A 628 SER OG : rot -170:sc= 0.492 USER MOD Single : A 632 TYR OH : rot 180:sc= 0 USER MOD Single : A 636 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -1.93! C(o=-1.9!,f=-8!) USER MOD Single : A 640 TYR OH : rot -15:sc= -0.803 USER MOD Single : A 644 CYS SG : rot 54:sc= -0.497 USER MOD Single : A 645 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 649 SER OG : rot -44:sc= 0.246 USER MOD Single : A 656 LYS NZ :NH3+ 158:sc= -0.148 (180deg=-0.532) USER MOD Single : A 659 TYR OH : rot 180:sc= 0 USER MOD Single : A 661 CYS SG : rot -26:sc= -2.77! USER MOD Single : A 663 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 664 ASN : amide:sc= -5.58! C(o=-5.6!,f=-12!) USER MOD Single : A 665 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0911) USER MOD Single : A 668 LYS NZ :NH3+ -154:sc= -1.2! (180deg=-1.84!) USER MOD Single : A 674 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 676 GLN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 677 ASN : amide:sc= -0.381 K(o=-0.38,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 27 N GLY A 542 -2.969 -9.779 9.228 1.00 0.00 N ATOM 28 CA GLY A 542 -4.023 -9.287 8.360 1.00 0.00 C ATOM 29 C GLY A 542 -3.570 -9.103 6.925 1.00 0.00 C ATOM 30 O GLY A 542 -2.380 -9.182 6.624 1.00 0.00 O ATOM 0 HA2 GLY A 542 -4.861 -9.984 8.384 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -4.389 -8.335 8.745 1.00 0.00 H new ATOM 34 N LYS A 543 -4.529 -8.851 6.040 1.00 0.00 N ATOM 35 CA LYS A 543 -4.239 -8.645 4.626 1.00 0.00 C ATOM 36 C LYS A 543 -4.874 -7.343 4.145 1.00 0.00 C ATOM 37 O LYS A 543 -6.009 -7.032 4.501 1.00 0.00 O ATOM 38 CB LYS A 543 -4.765 -9.821 3.801 1.00 0.00 C ATOM 39 CG LYS A 543 -4.460 -11.177 4.414 1.00 0.00 C ATOM 40 CD LYS A 543 -5.127 -12.302 3.639 1.00 0.00 C ATOM 41 CE LYS A 543 -6.641 -12.161 3.643 1.00 0.00 C ATOM 42 NZ LYS A 543 -7.305 -13.322 4.294 1.00 0.00 N ATOM 0 H LYS A 543 -5.518 -8.784 6.279 1.00 0.00 H new ATOM 0 HA LYS A 543 -3.159 -8.581 4.496 1.00 0.00 H new ATOM 0 HB2 LYS A 543 -5.844 -9.719 3.684 1.00 0.00 H new ATOM 0 HB3 LYS A 543 -4.331 -9.777 2.802 1.00 0.00 H new ATOM 0 HG2 LYS A 543 -3.382 -11.335 4.431 1.00 0.00 H new ATOM 0 HG3 LYS A 543 -4.801 -11.195 5.449 1.00 0.00 H new ATOM 0 HD2 LYS A 543 -4.763 -12.303 2.611 1.00 0.00 H new ATOM 0 HD3 LYS A 543 -4.849 -13.261 4.076 1.00 0.00 H new ATOM 0 HE2 LYS A 543 -6.919 -11.245 4.164 1.00 0.00 H new ATOM 0 HE3 LYS A 543 -6.999 -12.066 2.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 -8.336 -13.187 4.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 -7.061 -14.194 3.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 -6.983 -13.398 5.280 1.00 0.00 H new ATOM 56 N ILE A 544 -4.137 -6.582 3.344 1.00 0.00 N ATOM 57 CA ILE A 544 -4.645 -5.313 2.835 1.00 0.00 C ATOM 58 C ILE A 544 -4.829 -5.347 1.321 1.00 0.00 C ATOM 59 O ILE A 544 -3.915 -5.705 0.579 1.00 0.00 O ATOM 60 CB ILE A 544 -3.717 -4.139 3.212 1.00 0.00 C ATOM 61 CG1 ILE A 544 -4.503 -2.825 3.217 1.00 0.00 C ATOM 62 CG2 ILE A 544 -2.536 -4.050 2.257 1.00 0.00 C ATOM 63 CD1 ILE A 544 -4.588 -2.167 1.857 1.00 0.00 C ATOM 0 H ILE A 544 -3.194 -6.818 3.035 1.00 0.00 H new ATOM 0 HA ILE A 544 -5.617 -5.159 3.303 1.00 0.00 H new ATOM 0 HB ILE A 544 -3.327 -4.319 4.214 1.00 0.00 H new ATOM 0 HG12 ILE A 544 -5.512 -3.016 3.583 1.00 0.00 H new ATOM 0 HG13 ILE A 544 -4.035 -2.134 3.918 1.00 0.00 H new ATOM 0 HG21 ILE A 544 -1.898 -3.215 2.545 1.00 0.00 H new ATOM 0 HG22 ILE A 544 -1.963 -4.976 2.300 1.00 0.00 H new ATOM 0 HG23 ILE A 544 -2.900 -3.895 1.241 1.00 0.00 H new ATOM 0 HD11 ILE A 544 -5.159 -1.242 1.936 1.00 0.00 H new ATOM 0 HD12 ILE A 544 -3.583 -1.945 1.497 1.00 0.00 H new ATOM 0 HD13 ILE A 544 -5.083 -2.840 1.157 1.00 0.00 H new ATOM 75 N LEU A 545 -6.021 -4.966 0.876 1.00 0.00 N ATOM 76 CA LEU A 545 -6.340 -4.940 -0.545 1.00 0.00 C ATOM 77 C LEU A 545 -5.766 -3.691 -1.199 1.00 0.00 C ATOM 78 O LEU A 545 -6.058 -2.571 -0.781 1.00 0.00 O ATOM 79 CB LEU A 545 -7.855 -4.979 -0.750 1.00 0.00 C ATOM 80 CG LEU A 545 -8.311 -5.253 -2.185 1.00 0.00 C ATOM 81 CD1 LEU A 545 -8.067 -6.706 -2.556 1.00 0.00 C ATOM 82 CD2 LEU A 545 -9.781 -4.902 -2.352 1.00 0.00 C ATOM 0 H LEU A 545 -6.785 -4.670 1.483 1.00 0.00 H new ATOM 0 HA LEU A 545 -5.894 -5.819 -1.011 1.00 0.00 H new ATOM 0 HB2 LEU A 545 -8.274 -5.747 -0.100 1.00 0.00 H new ATOM 0 HB3 LEU A 545 -8.274 -4.025 -0.428 1.00 0.00 H new ATOM 0 HG LEU A 545 -7.726 -4.624 -2.856 1.00 0.00 H new ATOM 0 HD11 LEU A 545 -8.398 -6.881 -3.580 1.00 0.00 H new ATOM 0 HD12 LEU A 545 -7.003 -6.928 -2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 545 -8.625 -7.353 -1.879 1.00 0.00 H new ATOM 0 HD21 LEU A 545 -10.089 -5.103 -3.378 1.00 0.00 H new ATOM 0 HD22 LEU A 545 -10.379 -5.505 -1.669 1.00 0.00 H new ATOM 0 HD23 LEU A 545 -9.931 -3.846 -2.129 1.00 0.00 H new ATOM 94 N VAL A 546 -4.948 -3.887 -2.225 1.00 0.00 N ATOM 95 CA VAL A 546 -4.340 -2.770 -2.929 1.00 0.00 C ATOM 96 C VAL A 546 -4.689 -2.796 -4.412 1.00 0.00 C ATOM 97 O VAL A 546 -4.608 -3.839 -5.062 1.00 0.00 O ATOM 98 CB VAL A 546 -2.808 -2.776 -2.778 1.00 0.00 C ATOM 99 CG1 VAL A 546 -2.178 -1.740 -3.698 1.00 0.00 C ATOM 100 CG2 VAL A 546 -2.410 -2.526 -1.331 1.00 0.00 C ATOM 0 H VAL A 546 -4.692 -4.806 -2.586 1.00 0.00 H new ATOM 0 HA VAL A 546 -4.740 -1.861 -2.479 1.00 0.00 H new ATOM 0 HB VAL A 546 -2.438 -3.760 -3.066 1.00 0.00 H new ATOM 0 HG11 VAL A 546 -1.095 -1.758 -3.578 1.00 0.00 H new ATOM 0 HG12 VAL A 546 -2.433 -1.969 -4.733 1.00 0.00 H new ATOM 0 HG13 VAL A 546 -2.555 -0.750 -3.443 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -1.323 -2.534 -1.246 1.00 0.00 H new ATOM 0 HG22 VAL A 546 -2.792 -1.556 -1.011 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -2.829 -3.308 -0.698 1.00 0.00 H new ATOM 110 N SER A 547 -5.068 -1.641 -4.943 1.00 0.00 N ATOM 111 CA SER A 547 -5.422 -1.526 -6.351 1.00 0.00 C ATOM 112 C SER A 547 -4.456 -0.585 -7.064 1.00 0.00 C ATOM 113 O SER A 547 -4.443 0.619 -6.803 1.00 0.00 O ATOM 114 CB SER A 547 -6.856 -1.015 -6.500 1.00 0.00 C ATOM 115 OG SER A 547 -6.942 0.365 -6.188 1.00 0.00 O ATOM 0 H SER A 547 -5.138 -0.769 -4.418 1.00 0.00 H new ATOM 0 HA SER A 547 -5.353 -2.514 -6.806 1.00 0.00 H new ATOM 0 HB2 SER A 547 -7.201 -1.182 -7.521 1.00 0.00 H new ATOM 0 HB3 SER A 547 -7.517 -1.581 -5.844 1.00 0.00 H new ATOM 0 HG SER A 547 -6.194 0.842 -6.604 1.00 0.00 H new ATOM 121 N LEU A 548 -3.641 -1.137 -7.956 1.00 0.00 N ATOM 122 CA LEU A 548 -2.666 -0.338 -8.692 1.00 0.00 C ATOM 123 C LEU A 548 -3.206 0.089 -10.054 1.00 0.00 C ATOM 124 O LEU A 548 -4.170 -0.482 -10.563 1.00 0.00 O ATOM 125 CB LEU A 548 -1.364 -1.123 -8.876 1.00 0.00 C ATOM 126 CG LEU A 548 -0.577 -1.390 -7.592 1.00 0.00 C ATOM 127 CD1 LEU A 548 0.739 -2.081 -7.911 1.00 0.00 C ATOM 128 CD2 LEU A 548 -0.328 -0.093 -6.838 1.00 0.00 C ATOM 0 H LEU A 548 -3.635 -2.130 -8.187 1.00 0.00 H new ATOM 0 HA LEU A 548 -2.468 0.560 -8.107 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -1.598 -2.079 -9.345 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -0.724 -0.576 -9.568 1.00 0.00 H new ATOM 0 HG LEU A 548 -1.169 -2.048 -6.956 1.00 0.00 H new ATOM 0 HD11 LEU A 548 1.287 -2.264 -6.987 1.00 0.00 H new ATOM 0 HD12 LEU A 548 0.540 -3.030 -8.409 1.00 0.00 H new ATOM 0 HD13 LEU A 548 1.334 -1.445 -8.566 1.00 0.00 H new ATOM 0 HD21 LEU A 548 0.233 -0.303 -5.928 1.00 0.00 H new ATOM 0 HD22 LEU A 548 0.244 0.590 -7.467 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -1.282 0.366 -6.578 1.00 0.00 H new ATOM 140 N MET A 549 -2.566 1.099 -10.635 1.00 0.00 N ATOM 141 CA MET A 549 -2.956 1.623 -11.939 1.00 0.00 C ATOM 142 C MET A 549 -2.106 2.835 -12.295 1.00 0.00 C ATOM 143 O MET A 549 -2.032 3.796 -11.529 1.00 0.00 O ATOM 144 CB MET A 549 -4.436 2.007 -11.951 1.00 0.00 C ATOM 145 CG MET A 549 -5.047 2.024 -13.345 1.00 0.00 C ATOM 146 SD MET A 549 -6.841 2.203 -13.318 1.00 0.00 S ATOM 147 CE MET A 549 -7.004 3.961 -13.016 1.00 0.00 C ATOM 0 H MET A 549 -1.766 1.575 -10.217 1.00 0.00 H new ATOM 0 HA MET A 549 -2.794 0.841 -12.681 1.00 0.00 H new ATOM 0 HB2 MET A 549 -4.991 1.305 -11.328 1.00 0.00 H new ATOM 0 HB3 MET A 549 -4.551 2.993 -11.500 1.00 0.00 H new ATOM 0 HG2 MET A 549 -4.613 2.844 -13.917 1.00 0.00 H new ATOM 0 HG3 MET A 549 -4.786 1.101 -13.863 1.00 0.00 H new ATOM 0 HE1 MET A 549 -8.060 4.226 -12.973 1.00 0.00 H new ATOM 0 HE2 MET A 549 -6.527 4.213 -12.069 1.00 0.00 H new ATOM 0 HE3 MET A 549 -6.524 4.515 -13.823 1.00 0.00 H new ATOM 157 N TYR A 550 -1.458 2.787 -13.452 1.00 0.00 N ATOM 158 CA TYR A 550 -0.611 3.887 -13.891 1.00 0.00 C ATOM 159 C TYR A 550 -1.301 4.725 -14.959 1.00 0.00 C ATOM 160 O TYR A 550 -1.822 4.198 -15.941 1.00 0.00 O ATOM 161 CB TYR A 550 0.719 3.356 -14.428 1.00 0.00 C ATOM 162 CG TYR A 550 1.728 4.445 -14.708 1.00 0.00 C ATOM 163 CD1 TYR A 550 2.511 4.971 -13.689 1.00 0.00 C ATOM 164 CD2 TYR A 550 1.895 4.948 -15.991 1.00 0.00 C ATOM 165 CE1 TYR A 550 3.433 5.969 -13.940 1.00 0.00 C ATOM 166 CE2 TYR A 550 2.814 5.945 -16.251 1.00 0.00 C ATOM 167 CZ TYR A 550 3.581 6.453 -15.224 1.00 0.00 C ATOM 168 OH TYR A 550 4.498 7.447 -15.479 1.00 0.00 O ATOM 0 H TYR A 550 -1.503 2.001 -14.101 1.00 0.00 H new ATOM 0 HA TYR A 550 -0.421 4.523 -13.026 1.00 0.00 H new ATOM 0 HB2 TYR A 550 1.141 2.656 -13.706 1.00 0.00 H new ATOM 0 HB3 TYR A 550 0.535 2.796 -15.345 1.00 0.00 H new ATOM 0 HD1 TYR A 550 2.397 4.594 -12.683 1.00 0.00 H new ATOM 0 HD2 TYR A 550 1.297 4.553 -16.799 1.00 0.00 H new ATOM 0 HE1 TYR A 550 4.034 6.368 -13.136 1.00 0.00 H new ATOM 0 HE2 TYR A 550 2.932 6.325 -17.255 1.00 0.00 H new ATOM 0 HH TYR A 550 4.742 7.890 -14.640 1.00 0.00 H new ATOM 178 N SER A 551 -1.295 6.039 -14.760 1.00 0.00 N ATOM 179 CA SER A 551 -1.915 6.960 -15.706 1.00 0.00 C ATOM 180 C SER A 551 -0.865 7.591 -16.617 1.00 0.00 C ATOM 181 O SER A 551 -0.485 8.747 -16.432 1.00 0.00 O ATOM 182 CB SER A 551 -2.681 8.053 -14.959 1.00 0.00 C ATOM 183 OG SER A 551 -3.964 8.256 -15.525 1.00 0.00 O ATOM 0 H SER A 551 -0.867 6.490 -13.951 1.00 0.00 H new ATOM 0 HA SER A 551 -2.613 6.394 -16.322 1.00 0.00 H new ATOM 0 HB2 SER A 551 -2.783 7.777 -13.909 1.00 0.00 H new ATOM 0 HB3 SER A 551 -2.115 8.984 -14.990 1.00 0.00 H new ATOM 0 HG SER A 551 -4.433 8.958 -15.028 1.00 0.00 H new ATOM 189 N THR A 552 -0.400 6.825 -17.600 1.00 0.00 N ATOM 190 CA THR A 552 0.607 7.315 -18.539 1.00 0.00 C ATOM 191 C THR A 552 0.284 8.735 -18.975 1.00 0.00 C ATOM 192 O THR A 552 1.178 9.569 -19.126 1.00 0.00 O ATOM 193 CB THR A 552 0.695 6.408 -19.769 1.00 0.00 C ATOM 194 OG1 THR A 552 -0.198 6.844 -20.777 1.00 0.00 O ATOM 195 CG2 THR A 552 0.380 4.962 -19.471 1.00 0.00 C ATOM 0 H THR A 552 -0.703 5.865 -17.768 1.00 0.00 H new ATOM 0 HA THR A 552 1.570 7.308 -18.028 1.00 0.00 H new ATOM 0 HB THR A 552 1.731 6.474 -20.102 1.00 0.00 H new ATOM 0 HG1 THR A 552 -0.126 6.253 -21.556 1.00 0.00 H new ATOM 0 HG21 THR A 552 0.461 4.376 -20.386 1.00 0.00 H new ATOM 0 HG22 THR A 552 1.085 4.581 -18.732 1.00 0.00 H new ATOM 0 HG23 THR A 552 -0.634 4.884 -19.079 1.00 0.00 H new ATOM 203 N GLN A 553 -1.001 9.005 -19.164 1.00 0.00 N ATOM 204 CA GLN A 553 -1.451 10.322 -19.566 1.00 0.00 C ATOM 205 C GLN A 553 -0.906 11.362 -18.599 1.00 0.00 C ATOM 206 O GLN A 553 -0.243 12.320 -18.998 1.00 0.00 O ATOM 207 CB GLN A 553 -2.981 10.340 -19.591 1.00 0.00 C ATOM 208 CG GLN A 553 -3.601 11.650 -19.144 1.00 0.00 C ATOM 209 CD GLN A 553 -3.457 12.750 -20.177 1.00 0.00 C ATOM 210 OE1 GLN A 553 -4.270 12.866 -21.095 1.00 0.00 O ATOM 211 NE2 GLN A 553 -2.418 13.565 -20.033 1.00 0.00 N ATOM 0 H GLN A 553 -1.750 8.323 -19.043 1.00 0.00 H new ATOM 0 HA GLN A 553 -1.083 10.560 -20.564 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -3.318 10.120 -20.604 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -3.352 9.540 -18.951 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -4.659 11.493 -18.932 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -3.133 11.969 -18.212 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -1.769 13.432 -19.257 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -2.269 14.324 -20.698 1.00 0.00 H new ATOM 220 N GLN A 554 -1.187 11.150 -17.320 1.00 0.00 N ATOM 221 CA GLN A 554 -0.722 12.052 -16.273 1.00 0.00 C ATOM 222 C GLN A 554 0.763 11.838 -16.003 1.00 0.00 C ATOM 223 O GLN A 554 1.417 12.666 -15.370 1.00 0.00 O ATOM 224 CB GLN A 554 -1.523 11.834 -14.989 1.00 0.00 C ATOM 225 CG GLN A 554 -3.027 11.832 -15.204 1.00 0.00 C ATOM 226 CD GLN A 554 -3.801 11.766 -13.902 1.00 0.00 C ATOM 227 OE1 GLN A 554 -4.728 12.545 -13.677 1.00 0.00 O ATOM 228 NE2 GLN A 554 -3.424 10.834 -13.034 1.00 0.00 N ATOM 0 H GLN A 554 -1.736 10.360 -16.981 1.00 0.00 H new ATOM 0 HA GLN A 554 -0.871 13.077 -16.613 1.00 0.00 H new ATOM 0 HB2 GLN A 554 -1.227 10.885 -14.543 1.00 0.00 H new ATOM 0 HB3 GLN A 554 -1.268 12.616 -14.274 1.00 0.00 H new ATOM 0 HG2 GLN A 554 -3.314 12.732 -15.748 1.00 0.00 H new ATOM 0 HG3 GLN A 554 -3.300 10.981 -15.828 1.00 0.00 H new ATOM 0 HE21 GLN A 554 -2.650 10.209 -13.261 1.00 0.00 H new ATOM 0 HE22 GLN A 554 -3.908 10.743 -12.141 1.00 0.00 H new ATOM 237 N GLY A 555 1.289 10.717 -16.491 1.00 0.00 N ATOM 238 CA GLY A 555 2.693 10.408 -16.297 1.00 0.00 C ATOM 239 C GLY A 555 3.014 10.049 -14.860 1.00 0.00 C ATOM 240 O GLY A 555 4.037 10.470 -14.321 1.00 0.00 O ATOM 0 H GLY A 555 0.766 10.017 -17.018 1.00 0.00 H new ATOM 0 HA2 GLY A 555 2.972 9.579 -16.947 1.00 0.00 H new ATOM 0 HA3 GLY A 555 3.295 11.265 -16.597 1.00 0.00 H new ATOM 244 N GLY A 556 2.136 9.269 -14.239 1.00 0.00 N ATOM 245 CA GLY A 556 2.348 8.867 -12.861 1.00 0.00 C ATOM 246 C GLY A 556 1.610 7.590 -12.507 1.00 0.00 C ATOM 247 O GLY A 556 0.760 7.126 -13.266 1.00 0.00 O ATOM 0 H GLY A 556 1.282 8.908 -14.665 1.00 0.00 H new ATOM 0 HA2 GLY A 556 3.415 8.726 -12.687 1.00 0.00 H new ATOM 0 HA3 GLY A 556 2.020 9.668 -12.198 1.00 0.00 H new ATOM 251 N LEU A 557 1.936 7.022 -11.350 1.00 0.00 N ATOM 252 CA LEU A 557 1.298 5.792 -10.893 1.00 0.00 C ATOM 253 C LEU A 557 0.140 6.104 -9.953 1.00 0.00 C ATOM 254 O LEU A 557 0.096 7.169 -9.341 1.00 0.00 O ATOM 255 CB LEU A 557 2.315 4.896 -10.184 1.00 0.00 C ATOM 256 CG LEU A 557 1.714 3.750 -9.366 1.00 0.00 C ATOM 257 CD1 LEU A 557 1.264 2.618 -10.277 1.00 0.00 C ATOM 258 CD2 LEU A 557 2.719 3.244 -8.343 1.00 0.00 C ATOM 0 H LEU A 557 2.639 7.394 -10.711 1.00 0.00 H new ATOM 0 HA LEU A 557 0.909 5.267 -11.765 1.00 0.00 H new ATOM 0 HB2 LEU A 557 2.987 4.474 -10.931 1.00 0.00 H new ATOM 0 HB3 LEU A 557 2.921 5.515 -9.522 1.00 0.00 H new ATOM 0 HG LEU A 557 0.841 4.129 -8.835 1.00 0.00 H new ATOM 0 HD11 LEU A 557 0.840 1.814 -9.676 1.00 0.00 H new ATOM 0 HD12 LEU A 557 0.510 2.988 -10.972 1.00 0.00 H new ATOM 0 HD13 LEU A 557 2.119 2.240 -10.837 1.00 0.00 H new ATOM 0 HD21 LEU A 557 2.276 2.430 -7.770 1.00 0.00 H new ATOM 0 HD22 LEU A 557 3.611 2.884 -8.856 1.00 0.00 H new ATOM 0 HD23 LEU A 557 2.992 4.056 -7.669 1.00 0.00 H new ATOM 270 N ILE A 558 -0.794 5.168 -9.840 1.00 0.00 N ATOM 271 CA ILE A 558 -1.945 5.347 -8.968 1.00 0.00 C ATOM 272 C ILE A 558 -2.079 4.183 -7.994 1.00 0.00 C ATOM 273 O ILE A 558 -2.242 3.034 -8.402 1.00 0.00 O ATOM 274 CB ILE A 558 -3.251 5.482 -9.773 1.00 0.00 C ATOM 275 CG1 ILE A 558 -2.994 6.209 -11.096 1.00 0.00 C ATOM 276 CG2 ILE A 558 -4.297 6.219 -8.950 1.00 0.00 C ATOM 277 CD1 ILE A 558 -2.968 7.715 -10.965 1.00 0.00 C ATOM 0 H ILE A 558 -0.776 4.279 -10.341 1.00 0.00 H new ATOM 0 HA ILE A 558 -1.778 6.269 -8.411 1.00 0.00 H new ATOM 0 HB ILE A 558 -3.627 4.485 -10.002 1.00 0.00 H new ATOM 0 HG12 ILE A 558 -2.042 5.872 -11.507 1.00 0.00 H new ATOM 0 HG13 ILE A 558 -3.767 5.928 -11.811 1.00 0.00 H new ATOM 0 HG21 ILE A 558 -5.217 6.310 -9.528 1.00 0.00 H new ATOM 0 HG22 ILE A 558 -4.497 5.663 -8.034 1.00 0.00 H new ATOM 0 HG23 ILE A 558 -3.928 7.213 -8.698 1.00 0.00 H new ATOM 0 HD11 ILE A 558 -2.781 8.162 -11.941 1.00 0.00 H new ATOM 0 HD12 ILE A 558 -3.928 8.064 -10.584 1.00 0.00 H new ATOM 0 HD13 ILE A 558 -2.176 8.007 -10.275 1.00 0.00 H new ATOM 289 N VAL A 559 -2.009 4.491 -6.703 1.00 0.00 N ATOM 290 CA VAL A 559 -2.125 3.471 -5.668 1.00 0.00 C ATOM 291 C VAL A 559 -3.482 3.554 -4.986 1.00 0.00 C ATOM 292 O VAL A 559 -3.823 4.569 -4.384 1.00 0.00 O ATOM 293 CB VAL A 559 -1.021 3.620 -4.609 1.00 0.00 C ATOM 294 CG1 VAL A 559 -0.802 2.310 -3.876 1.00 0.00 C ATOM 295 CG2 VAL A 559 0.271 4.104 -5.247 1.00 0.00 C ATOM 0 H VAL A 559 -1.873 5.438 -6.349 1.00 0.00 H new ATOM 0 HA VAL A 559 -2.018 2.502 -6.155 1.00 0.00 H new ATOM 0 HB VAL A 559 -1.342 4.366 -3.882 1.00 0.00 H new ATOM 0 HG11 VAL A 559 -0.017 2.437 -3.131 1.00 0.00 H new ATOM 0 HG12 VAL A 559 -1.726 2.011 -3.382 1.00 0.00 H new ATOM 0 HG13 VAL A 559 -0.506 1.540 -4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 559 1.040 4.203 -4.481 1.00 0.00 H new ATOM 0 HG22 VAL A 559 0.598 3.385 -5.998 1.00 0.00 H new ATOM 0 HG23 VAL A 559 0.103 5.072 -5.720 1.00 0.00 H new ATOM 305 N GLY A 560 -4.262 2.487 -5.094 1.00 0.00 N ATOM 306 CA GLY A 560 -5.580 2.479 -4.493 1.00 0.00 C ATOM 307 C GLY A 560 -5.676 1.614 -3.252 1.00 0.00 C ATOM 308 O GLY A 560 -5.634 0.387 -3.337 1.00 0.00 O ATOM 0 H GLY A 560 -4.007 1.630 -5.585 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -5.859 3.501 -4.236 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -6.303 2.126 -5.228 1.00 0.00 H new ATOM 312 N ILE A 561 -5.834 2.258 -2.102 1.00 0.00 N ATOM 313 CA ILE A 561 -5.969 1.546 -0.837 1.00 0.00 C ATOM 314 C ILE A 561 -7.440 1.265 -0.562 1.00 0.00 C ATOM 315 O ILE A 561 -8.174 2.147 -0.116 1.00 0.00 O ATOM 316 CB ILE A 561 -5.376 2.351 0.335 1.00 0.00 C ATOM 317 CG1 ILE A 561 -3.948 2.792 0.006 1.00 0.00 C ATOM 318 CG2 ILE A 561 -5.402 1.528 1.614 1.00 0.00 C ATOM 319 CD1 ILE A 561 -3.062 1.662 -0.473 1.00 0.00 C ATOM 0 H ILE A 561 -5.872 3.274 -2.019 1.00 0.00 H new ATOM 0 HA ILE A 561 -5.416 0.610 -0.920 1.00 0.00 H new ATOM 0 HB ILE A 561 -5.986 3.241 0.490 1.00 0.00 H new ATOM 0 HG12 ILE A 561 -3.983 3.566 -0.761 1.00 0.00 H new ATOM 0 HG13 ILE A 561 -3.502 3.242 0.893 1.00 0.00 H new ATOM 0 HG21 ILE A 561 -4.979 2.112 2.431 1.00 0.00 H new ATOM 0 HG22 ILE A 561 -6.431 1.260 1.854 1.00 0.00 H new ATOM 0 HG23 ILE A 561 -4.814 0.621 1.475 1.00 0.00 H new ATOM 0 HD11 ILE A 561 -2.065 2.047 -0.688 1.00 0.00 H new ATOM 0 HD12 ILE A 561 -2.997 0.898 0.301 1.00 0.00 H new ATOM 0 HD13 ILE A 561 -3.485 1.226 -1.378 1.00 0.00 H new ATOM 331 N ILE A 562 -7.873 0.047 -0.860 1.00 0.00 N ATOM 332 CA ILE A 562 -9.267 -0.326 -0.676 1.00 0.00 C ATOM 333 C ILE A 562 -9.598 -0.653 0.774 1.00 0.00 C ATOM 334 O ILE A 562 -10.277 0.120 1.449 1.00 0.00 O ATOM 335 CB ILE A 562 -9.651 -1.528 -1.559 1.00 0.00 C ATOM 336 CG1 ILE A 562 -9.041 -1.381 -2.954 1.00 0.00 C ATOM 337 CG2 ILE A 562 -11.164 -1.658 -1.648 1.00 0.00 C ATOM 338 CD1 ILE A 562 -7.854 -2.289 -3.193 1.00 0.00 C ATOM 0 H ILE A 562 -7.280 -0.697 -1.229 1.00 0.00 H new ATOM 0 HA ILE A 562 -9.848 0.547 -0.974 1.00 0.00 H new ATOM 0 HB ILE A 562 -9.254 -2.435 -1.104 1.00 0.00 H new ATOM 0 HG12 ILE A 562 -9.806 -1.593 -3.701 1.00 0.00 H new ATOM 0 HG13 ILE A 562 -8.732 -0.346 -3.099 1.00 0.00 H new ATOM 0 HG21 ILE A 562 -11.420 -2.512 -2.275 1.00 0.00 H new ATOM 0 HG22 ILE A 562 -11.576 -1.805 -0.650 1.00 0.00 H new ATOM 0 HG23 ILE A 562 -11.582 -0.750 -2.083 1.00 0.00 H new ATOM 0 HD11 ILE A 562 -7.473 -2.131 -4.202 1.00 0.00 H new ATOM 0 HD12 ILE A 562 -7.071 -2.062 -2.469 1.00 0.00 H new ATOM 0 HD13 ILE A 562 -8.162 -3.328 -3.080 1.00 0.00 H new ATOM 350 N ARG A 563 -9.145 -1.808 1.246 1.00 0.00 N ATOM 351 CA ARG A 563 -9.437 -2.216 2.615 1.00 0.00 C ATOM 352 C ARG A 563 -8.462 -3.276 3.117 1.00 0.00 C ATOM 353 O ARG A 563 -7.678 -3.834 2.353 1.00 0.00 O ATOM 354 CB ARG A 563 -10.873 -2.753 2.695 1.00 0.00 C ATOM 355 CG ARG A 563 -10.979 -4.263 2.524 1.00 0.00 C ATOM 356 CD ARG A 563 -12.279 -4.663 1.846 1.00 0.00 C ATOM 357 NE ARG A 563 -13.449 -4.240 2.609 1.00 0.00 N ATOM 358 CZ ARG A 563 -14.623 -4.859 2.560 1.00 0.00 C ATOM 359 NH1 ARG A 563 -14.785 -5.920 1.780 1.00 0.00 N ATOM 360 NH2 ARG A 563 -15.639 -4.417 3.291 1.00 0.00 N ATOM 0 H ARG A 563 -8.583 -2.470 0.711 1.00 0.00 H new ATOM 0 HA ARG A 563 -9.327 -1.340 3.254 1.00 0.00 H new ATOM 0 HB2 ARG A 563 -11.301 -2.476 3.658 1.00 0.00 H new ATOM 0 HB3 ARG A 563 -11.475 -2.267 1.927 1.00 0.00 H new ATOM 0 HG2 ARG A 563 -10.136 -4.622 1.934 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -10.914 -4.745 3.500 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -12.318 -4.223 0.850 1.00 0.00 H new ATOM 0 HD3 ARG A 563 -12.302 -5.745 1.718 1.00 0.00 H new ATOM 0 HE ARG A 563 -13.360 -3.423 3.214 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -14.007 -6.262 1.216 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -15.688 -6.394 1.744 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -15.519 -3.601 3.891 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -16.540 -4.893 3.253 1.00 0.00 H new ATOM 374 N CYS A 564 -8.546 -3.558 4.413 1.00 0.00 N ATOM 375 CA CYS A 564 -7.706 -4.562 5.044 1.00 0.00 C ATOM 376 C CYS A 564 -8.577 -5.550 5.812 1.00 0.00 C ATOM 377 O CYS A 564 -9.737 -5.262 6.103 1.00 0.00 O ATOM 378 CB CYS A 564 -6.700 -3.902 5.987 1.00 0.00 C ATOM 379 SG CYS A 564 -7.303 -2.386 6.763 1.00 0.00 S ATOM 0 H CYS A 564 -9.196 -3.098 5.050 1.00 0.00 H new ATOM 0 HA CYS A 564 -7.153 -5.096 4.271 1.00 0.00 H new ATOM 0 HB2 CYS A 564 -6.428 -4.613 6.767 1.00 0.00 H new ATOM 0 HB3 CYS A 564 -5.790 -3.676 5.430 1.00 0.00 H new ATOM 0 HG CYS A 564 -7.342 -1.433 5.880 1.00 0.00 H new ATOM 385 N VAL A 565 -8.028 -6.715 6.130 1.00 0.00 N ATOM 386 CA VAL A 565 -8.790 -7.725 6.852 1.00 0.00 C ATOM 387 C VAL A 565 -7.930 -8.494 7.846 1.00 0.00 C ATOM 388 O VAL A 565 -6.755 -8.765 7.595 1.00 0.00 O ATOM 389 CB VAL A 565 -9.445 -8.727 5.886 1.00 0.00 C ATOM 390 CG1 VAL A 565 -10.427 -8.019 4.968 1.00 0.00 C ATOM 391 CG2 VAL A 565 -8.384 -9.464 5.080 1.00 0.00 C ATOM 0 H VAL A 565 -7.070 -6.982 5.903 1.00 0.00 H new ATOM 0 HA VAL A 565 -9.562 -7.185 7.401 1.00 0.00 H new ATOM 0 HB VAL A 565 -9.997 -9.461 6.472 1.00 0.00 H new ATOM 0 HG11 VAL A 565 -10.880 -8.744 4.292 1.00 0.00 H new ATOM 0 HG12 VAL A 565 -11.205 -7.543 5.565 1.00 0.00 H new ATOM 0 HG13 VAL A 565 -9.901 -7.261 4.388 1.00 0.00 H new ATOM 0 HG21 VAL A 565 -8.866 -10.168 4.402 1.00 0.00 H new ATOM 0 HG22 VAL A 565 -7.801 -8.746 4.503 1.00 0.00 H new ATOM 0 HG23 VAL A 565 -7.724 -10.006 5.757 1.00 0.00 H new ATOM 401 N HIS A 566 -8.537 -8.848 8.973 1.00 0.00 N ATOM 402 CA HIS A 566 -7.849 -9.600 10.019 1.00 0.00 C ATOM 403 C HIS A 566 -6.575 -8.891 10.466 1.00 0.00 C ATOM 404 O HIS A 566 -5.492 -9.476 10.453 1.00 0.00 O ATOM 405 CB HIS A 566 -7.514 -11.008 9.524 1.00 0.00 C ATOM 406 CG HIS A 566 -7.049 -11.927 10.610 1.00 0.00 C ATOM 407 ND1 HIS A 566 -7.907 -12.531 11.505 1.00 0.00 N ATOM 408 CD2 HIS A 566 -5.805 -12.348 10.943 1.00 0.00 C ATOM 409 CE1 HIS A 566 -7.211 -13.282 12.342 1.00 0.00 C ATOM 410 NE2 HIS A 566 -5.935 -13.188 12.022 1.00 0.00 N ATOM 0 H HIS A 566 -9.509 -8.626 9.187 1.00 0.00 H new ATOM 0 HA HIS A 566 -8.519 -9.668 10.876 1.00 0.00 H new ATOM 0 HB2 HIS A 566 -8.396 -11.437 9.049 1.00 0.00 H new ATOM 0 HB3 HIS A 566 -6.740 -10.941 8.759 1.00 0.00 H new ATOM 0 HD2 HIS A 566 -4.883 -12.074 10.452 1.00 0.00 H new ATOM 0 HE1 HIS A 566 -7.618 -13.872 13.150 1.00 0.00 H new ATOM 0 HE2 HIS A 566 -5.168 -13.663 12.499 1.00 0.00 H new ATOM 419 N LEU A 567 -6.710 -7.632 10.866 1.00 0.00 N ATOM 420 CA LEU A 567 -5.568 -6.849 11.321 1.00 0.00 C ATOM 421 C LEU A 567 -5.273 -7.115 12.793 1.00 0.00 C ATOM 422 O LEU A 567 -6.124 -7.620 13.525 1.00 0.00 O ATOM 423 CB LEU A 567 -5.833 -5.359 11.117 1.00 0.00 C ATOM 424 CG LEU A 567 -5.873 -4.898 9.662 1.00 0.00 C ATOM 425 CD1 LEU A 567 -5.869 -3.381 9.595 1.00 0.00 C ATOM 426 CD2 LEU A 567 -4.700 -5.477 8.886 1.00 0.00 C ATOM 0 H LEU A 567 -7.599 -7.132 10.884 1.00 0.00 H new ATOM 0 HA LEU A 567 -4.702 -7.149 10.731 1.00 0.00 H new ATOM 0 HB2 LEU A 567 -6.784 -5.108 11.587 1.00 0.00 H new ATOM 0 HB3 LEU A 567 -5.061 -4.794 11.639 1.00 0.00 H new ATOM 0 HG LEU A 567 -6.793 -5.262 9.204 1.00 0.00 H new ATOM 0 HD11 LEU A 567 -5.898 -3.063 8.553 1.00 0.00 H new ATOM 0 HD12 LEU A 567 -6.743 -2.991 10.118 1.00 0.00 H new ATOM 0 HD13 LEU A 567 -4.964 -2.998 10.066 1.00 0.00 H new ATOM 0 HD21 LEU A 567 -4.745 -5.138 7.851 1.00 0.00 H new ATOM 0 HD22 LEU A 567 -3.765 -5.143 9.337 1.00 0.00 H new ATOM 0 HD23 LEU A 567 -4.748 -6.566 8.913 1.00 0.00 H new ATOM 438 N ALA A 568 -4.065 -6.767 13.223 1.00 0.00 N ATOM 439 CA ALA A 568 -3.665 -6.962 14.609 1.00 0.00 C ATOM 440 C ALA A 568 -4.416 -6.008 15.533 1.00 0.00 C ATOM 441 O ALA A 568 -4.783 -4.903 15.135 1.00 0.00 O ATOM 442 CB ALA A 568 -2.165 -6.771 14.760 1.00 0.00 C ATOM 0 H ALA A 568 -3.347 -6.349 12.631 1.00 0.00 H new ATOM 0 HA ALA A 568 -3.919 -7.983 14.894 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -1.882 -6.920 15.802 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -1.641 -7.494 14.135 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -1.894 -5.761 14.452 1.00 0.00 H new ATOM 448 N ALA A 569 -4.643 -6.444 16.766 1.00 0.00 N ATOM 449 CA ALA A 569 -5.352 -5.632 17.747 1.00 0.00 C ATOM 450 C ALA A 569 -4.428 -5.196 18.878 1.00 0.00 C ATOM 451 O ALA A 569 -3.922 -6.025 19.634 1.00 0.00 O ATOM 452 CB ALA A 569 -6.536 -6.404 18.306 1.00 0.00 C ATOM 0 H ALA A 569 -4.346 -7.357 17.111 1.00 0.00 H new ATOM 0 HA ALA A 569 -5.713 -4.735 17.244 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -7.059 -5.788 19.038 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -7.218 -6.662 17.495 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -6.182 -7.316 18.786 1.00 0.00 H new ATOM 458 N MET A 570 -4.219 -3.888 18.994 1.00 0.00 N ATOM 459 CA MET A 570 -3.364 -3.343 20.043 1.00 0.00 C ATOM 460 C MET A 570 -4.120 -3.278 21.363 1.00 0.00 C ATOM 461 O MET A 570 -3.525 -3.350 22.438 1.00 0.00 O ATOM 462 CB MET A 570 -2.884 -1.938 19.675 1.00 0.00 C ATOM 463 CG MET A 570 -1.769 -1.900 18.646 1.00 0.00 C ATOM 464 SD MET A 570 -0.549 -3.209 18.865 1.00 0.00 S ATOM 465 CE MET A 570 -0.271 -3.682 17.162 1.00 0.00 C ATOM 0 H MET A 570 -4.629 -3.187 18.376 1.00 0.00 H new ATOM 0 HA MET A 570 -2.502 -4.002 20.147 1.00 0.00 H new ATOM 0 HB2 MET A 570 -3.731 -1.367 19.295 1.00 0.00 H new ATOM 0 HB3 MET A 570 -2.542 -1.436 20.580 1.00 0.00 H new ATOM 0 HG2 MET A 570 -2.202 -1.980 17.649 1.00 0.00 H new ATOM 0 HG3 MET A 570 -1.268 -0.934 18.699 1.00 0.00 H new ATOM 0 HE1 MET A 570 -0.375 -4.762 17.063 1.00 0.00 H new ATOM 0 HE2 MET A 570 -1.002 -3.187 16.523 1.00 0.00 H new ATOM 0 HE3 MET A 570 0.734 -3.385 16.861 1.00 0.00 H new ATOM 475 N ASP A 571 -5.436 -3.125 21.270 1.00 0.00 N ATOM 476 CA ASP A 571 -6.283 -3.030 22.453 1.00 0.00 C ATOM 477 C ASP A 571 -6.653 -4.411 22.982 1.00 0.00 C ATOM 478 O ASP A 571 -6.493 -5.417 22.291 1.00 0.00 O ATOM 479 CB ASP A 571 -7.552 -2.240 22.133 1.00 0.00 C ATOM 480 CG ASP A 571 -7.252 -0.841 21.633 1.00 0.00 C ATOM 481 OD1 ASP A 571 -6.385 -0.170 22.230 1.00 0.00 O ATOM 482 OD2 ASP A 571 -7.885 -0.417 20.643 1.00 0.00 O ATOM 0 H ASP A 571 -5.940 -3.064 20.386 1.00 0.00 H new ATOM 0 HA ASP A 571 -5.718 -2.509 23.226 1.00 0.00 H new ATOM 0 HB2 ASP A 571 -8.130 -2.776 21.380 1.00 0.00 H new ATOM 0 HB3 ASP A 571 -8.173 -2.178 23.027 1.00 0.00 H new ATOM 487 N ALA A 572 -7.152 -4.448 24.213 1.00 0.00 N ATOM 488 CA ALA A 572 -7.552 -5.700 24.839 1.00 0.00 C ATOM 489 C ALA A 572 -8.920 -6.150 24.338 1.00 0.00 C ATOM 490 O ALA A 572 -9.383 -7.243 24.665 1.00 0.00 O ATOM 491 CB ALA A 572 -7.564 -5.553 26.353 1.00 0.00 C ATOM 0 H ALA A 572 -7.289 -3.623 24.797 1.00 0.00 H new ATOM 0 HA ALA A 572 -6.824 -6.464 24.566 1.00 0.00 H new ATOM 0 HB1 ALA A 572 -7.865 -6.497 26.808 1.00 0.00 H new ATOM 0 HB2 ALA A 572 -6.566 -5.285 26.700 1.00 0.00 H new ATOM 0 HB3 ALA A 572 -8.269 -4.772 26.637 1.00 0.00 H new ATOM 497 N ASN A 573 -9.563 -5.303 23.538 1.00 0.00 N ATOM 498 CA ASN A 573 -10.873 -5.620 22.987 1.00 0.00 C ATOM 499 C ASN A 573 -10.734 -6.503 21.753 1.00 0.00 C ATOM 500 O ASN A 573 -11.713 -7.071 21.268 1.00 0.00 O ATOM 501 CB ASN A 573 -11.627 -4.337 22.633 1.00 0.00 C ATOM 502 CG ASN A 573 -12.504 -3.850 23.770 1.00 0.00 C ATOM 503 OD1 ASN A 573 -13.566 -4.412 24.035 1.00 0.00 O ATOM 504 ND2 ASN A 573 -12.063 -2.797 24.450 1.00 0.00 N ATOM 0 H ASN A 573 -9.196 -4.393 23.258 1.00 0.00 H new ATOM 0 HA ASN A 573 -11.440 -6.164 23.742 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -10.911 -3.558 22.371 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -12.244 -4.513 21.752 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -12.611 -2.425 25.225 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -11.176 -2.361 24.197 1.00 0.00 H new ATOM 511 N GLY A 574 -9.507 -6.615 21.252 1.00 0.00 N ATOM 512 CA GLY A 574 -9.255 -7.432 20.083 1.00 0.00 C ATOM 513 C GLY A 574 -9.283 -6.634 18.796 1.00 0.00 C ATOM 514 O GLY A 574 -9.388 -7.204 17.711 1.00 0.00 O ATOM 0 H GLY A 574 -8.683 -6.153 21.637 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -8.283 -7.915 20.185 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -10.001 -8.225 20.031 1.00 0.00 H new ATOM 518 N TYR A 575 -9.194 -5.310 18.909 1.00 0.00 N ATOM 519 CA TYR A 575 -9.216 -4.449 17.731 1.00 0.00 C ATOM 520 C TYR A 575 -7.992 -3.543 17.657 1.00 0.00 C ATOM 521 O TYR A 575 -7.053 -3.684 18.439 1.00 0.00 O ATOM 522 CB TYR A 575 -10.481 -3.603 17.719 1.00 0.00 C ATOM 523 CG TYR A 575 -11.598 -4.244 16.946 1.00 0.00 C ATOM 524 CD1 TYR A 575 -11.935 -5.567 17.169 1.00 0.00 C ATOM 525 CD2 TYR A 575 -12.309 -3.533 15.998 1.00 0.00 C ATOM 526 CE1 TYR A 575 -12.960 -6.171 16.466 1.00 0.00 C ATOM 527 CE2 TYR A 575 -13.337 -4.123 15.286 1.00 0.00 C ATOM 528 CZ TYR A 575 -13.659 -5.443 15.525 1.00 0.00 C ATOM 529 OH TYR A 575 -14.682 -6.037 14.821 1.00 0.00 O ATOM 0 H TYR A 575 -9.107 -4.815 19.796 1.00 0.00 H new ATOM 0 HA TYR A 575 -9.201 -5.101 16.857 1.00 0.00 H new ATOM 0 HB2 TYR A 575 -10.807 -3.429 18.744 1.00 0.00 H new ATOM 0 HB3 TYR A 575 -10.257 -2.628 17.286 1.00 0.00 H new ATOM 0 HD1 TYR A 575 -11.388 -6.137 17.905 1.00 0.00 H new ATOM 0 HD2 TYR A 575 -12.058 -2.500 15.810 1.00 0.00 H new ATOM 0 HE1 TYR A 575 -13.212 -7.205 16.652 1.00 0.00 H new ATOM 0 HE2 TYR A 575 -13.884 -3.555 14.548 1.00 0.00 H new ATOM 0 HH TYR A 575 -15.072 -5.387 14.199 1.00 0.00 H new ATOM 539 N SER A 576 -8.012 -2.611 16.703 1.00 0.00 N ATOM 540 CA SER A 576 -6.900 -1.681 16.518 1.00 0.00 C ATOM 541 C SER A 576 -7.319 -0.461 15.696 1.00 0.00 C ATOM 542 O SER A 576 -8.466 -0.353 15.260 1.00 0.00 O ATOM 543 CB SER A 576 -5.729 -2.388 15.827 1.00 0.00 C ATOM 544 OG SER A 576 -4.822 -2.920 16.777 1.00 0.00 O ATOM 0 H SER A 576 -8.784 -2.481 16.049 1.00 0.00 H new ATOM 0 HA SER A 576 -6.590 -1.337 17.505 1.00 0.00 H new ATOM 0 HB2 SER A 576 -6.107 -3.189 15.192 1.00 0.00 H new ATOM 0 HB3 SER A 576 -5.208 -1.685 15.177 1.00 0.00 H new ATOM 0 HG SER A 576 -4.344 -3.680 16.383 1.00 0.00 H new ATOM 550 N ASP A 577 -6.371 0.448 15.483 1.00 0.00 N ATOM 551 CA ASP A 577 -6.612 1.663 14.706 1.00 0.00 C ATOM 552 C ASP A 577 -5.617 1.734 13.553 1.00 0.00 C ATOM 553 O ASP A 577 -4.822 2.669 13.455 1.00 0.00 O ATOM 554 CB ASP A 577 -6.468 2.899 15.597 1.00 0.00 C ATOM 555 CG ASP A 577 -7.418 2.877 16.777 1.00 0.00 C ATOM 556 OD1 ASP A 577 -8.002 1.807 17.050 1.00 0.00 O ATOM 557 OD2 ASP A 577 -7.578 3.930 17.430 1.00 0.00 O ATOM 0 H ASP A 577 -5.420 0.365 15.841 1.00 0.00 H new ATOM 0 HA ASP A 577 -7.627 1.637 14.308 1.00 0.00 H new ATOM 0 HB2 ASP A 577 -5.443 2.963 15.961 1.00 0.00 H new ATOM 0 HB3 ASP A 577 -6.652 3.794 15.003 1.00 0.00 H new ATOM 562 N PRO A 578 -5.632 0.713 12.690 1.00 0.00 N ATOM 563 CA PRO A 578 -4.708 0.602 11.553 1.00 0.00 C ATOM 564 C PRO A 578 -4.928 1.607 10.428 1.00 0.00 C ATOM 565 O PRO A 578 -6.043 2.056 10.162 1.00 0.00 O ATOM 566 CB PRO A 578 -4.962 -0.809 11.026 1.00 0.00 C ATOM 567 CG PRO A 578 -6.343 -1.141 11.469 1.00 0.00 C ATOM 568 CD PRO A 578 -6.531 -0.448 12.787 1.00 0.00 C ATOM 0 HA PRO A 578 -3.691 0.807 11.888 1.00 0.00 H new ATOM 0 HB2 PRO A 578 -4.876 -0.846 9.940 1.00 0.00 H new ATOM 0 HB3 PRO A 578 -4.237 -1.517 11.428 1.00 0.00 H new ATOM 0 HG2 PRO A 578 -7.079 -0.801 10.741 1.00 0.00 H new ATOM 0 HG3 PRO A 578 -6.471 -2.218 11.573 1.00 0.00 H new ATOM 0 HD2 PRO A 578 -7.567 -0.143 12.937 1.00 0.00 H new ATOM 0 HD3 PRO A 578 -6.264 -1.095 13.623 1.00 0.00 H new ATOM 576 N PHE A 579 -3.825 1.894 9.747 1.00 0.00 N ATOM 577 CA PHE A 579 -3.795 2.780 8.593 1.00 0.00 C ATOM 578 C PHE A 579 -2.681 2.294 7.672 1.00 0.00 C ATOM 579 O PHE A 579 -1.825 1.521 8.103 1.00 0.00 O ATOM 580 CB PHE A 579 -3.582 4.242 9.000 1.00 0.00 C ATOM 581 CG PHE A 579 -2.296 4.513 9.727 1.00 0.00 C ATOM 582 CD1 PHE A 579 -2.104 4.060 11.023 1.00 0.00 C ATOM 583 CD2 PHE A 579 -1.286 5.241 9.119 1.00 0.00 C ATOM 584 CE1 PHE A 579 -0.925 4.324 11.696 1.00 0.00 C ATOM 585 CE2 PHE A 579 -0.109 5.510 9.787 1.00 0.00 C ATOM 586 CZ PHE A 579 0.073 5.051 11.076 1.00 0.00 C ATOM 0 H PHE A 579 -2.911 1.510 9.987 1.00 0.00 H new ATOM 0 HA PHE A 579 -4.756 2.750 8.079 1.00 0.00 H new ATOM 0 HB2 PHE A 579 -3.614 4.862 8.104 1.00 0.00 H new ATOM 0 HB3 PHE A 579 -4.413 4.553 9.633 1.00 0.00 H new ATOM 0 HD1 PHE A 579 -2.883 3.495 11.512 1.00 0.00 H new ATOM 0 HD2 PHE A 579 -1.422 5.602 8.110 1.00 0.00 H new ATOM 0 HE1 PHE A 579 -0.785 3.963 12.704 1.00 0.00 H new ATOM 0 HE2 PHE A 579 0.670 6.080 9.301 1.00 0.00 H new ATOM 0 HZ PHE A 579 0.994 5.260 11.599 1.00 0.00 H new ATOM 596 N VAL A 580 -2.691 2.697 6.411 1.00 0.00 N ATOM 597 CA VAL A 580 -1.666 2.222 5.487 1.00 0.00 C ATOM 598 C VAL A 580 -0.778 3.341 4.961 1.00 0.00 C ATOM 599 O VAL A 580 -1.259 4.376 4.504 1.00 0.00 O ATOM 600 CB VAL A 580 -2.286 1.475 4.291 1.00 0.00 C ATOM 601 CG1 VAL A 580 -1.195 0.842 3.441 1.00 0.00 C ATOM 602 CG2 VAL A 580 -3.273 0.422 4.769 1.00 0.00 C ATOM 0 H VAL A 580 -3.377 3.335 6.009 1.00 0.00 H new ATOM 0 HA VAL A 580 -1.047 1.538 6.068 1.00 0.00 H new ATOM 0 HB VAL A 580 -2.829 2.194 3.678 1.00 0.00 H new ATOM 0 HG11 VAL A 580 -1.648 0.317 2.600 1.00 0.00 H new ATOM 0 HG12 VAL A 580 -0.528 1.619 3.068 1.00 0.00 H new ATOM 0 HG13 VAL A 580 -0.627 0.135 4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 580 -3.700 -0.094 3.909 1.00 0.00 H new ATOM 0 HG22 VAL A 580 -2.758 -0.298 5.405 1.00 0.00 H new ATOM 0 HG23 VAL A 580 -4.071 0.902 5.336 1.00 0.00 H new ATOM 612 N LYS A 581 0.527 3.100 5.008 1.00 0.00 N ATOM 613 CA LYS A 581 1.508 4.058 4.518 1.00 0.00 C ATOM 614 C LYS A 581 2.237 3.478 3.314 1.00 0.00 C ATOM 615 O LYS A 581 2.696 2.336 3.346 1.00 0.00 O ATOM 616 CB LYS A 581 2.511 4.412 5.619 1.00 0.00 C ATOM 617 CG LYS A 581 1.873 4.623 6.981 1.00 0.00 C ATOM 618 CD LYS A 581 2.649 5.637 7.805 1.00 0.00 C ATOM 619 CE LYS A 581 2.811 5.185 9.247 1.00 0.00 C ATOM 620 NZ LYS A 581 4.208 4.771 9.547 1.00 0.00 N ATOM 0 H LYS A 581 0.931 2.242 5.384 1.00 0.00 H new ATOM 0 HA LYS A 581 0.989 4.969 4.219 1.00 0.00 H new ATOM 0 HB2 LYS A 581 3.251 3.615 5.694 1.00 0.00 H new ATOM 0 HB3 LYS A 581 3.046 5.318 5.334 1.00 0.00 H new ATOM 0 HG2 LYS A 581 0.846 4.964 6.854 1.00 0.00 H new ATOM 0 HG3 LYS A 581 1.830 3.674 7.515 1.00 0.00 H new ATOM 0 HD2 LYS A 581 3.632 5.792 7.360 1.00 0.00 H new ATOM 0 HD3 LYS A 581 2.133 6.597 7.780 1.00 0.00 H new ATOM 0 HE2 LYS A 581 2.521 5.996 9.916 1.00 0.00 H new ATOM 0 HE3 LYS A 581 2.136 4.352 9.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 4.246 3.739 9.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 4.829 5.050 8.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 4.527 5.234 10.422 1.00 0.00 H new ATOM 634 N LEU A 582 2.327 4.260 2.248 1.00 0.00 N ATOM 635 CA LEU A 582 2.983 3.806 1.030 1.00 0.00 C ATOM 636 C LEU A 582 4.164 4.694 0.667 1.00 0.00 C ATOM 637 O LEU A 582 4.124 5.909 0.858 1.00 0.00 O ATOM 638 CB LEU A 582 1.980 3.785 -0.117 1.00 0.00 C ATOM 639 CG LEU A 582 0.523 3.653 0.317 1.00 0.00 C ATOM 640 CD1 LEU A 582 -0.222 4.958 0.088 1.00 0.00 C ATOM 641 CD2 LEU A 582 -0.146 2.510 -0.424 1.00 0.00 C ATOM 0 H LEU A 582 1.956 5.209 2.201 1.00 0.00 H new ATOM 0 HA LEU A 582 3.363 2.800 1.207 1.00 0.00 H new ATOM 0 HB2 LEU A 582 2.091 4.701 -0.697 1.00 0.00 H new ATOM 0 HB3 LEU A 582 2.224 2.956 -0.781 1.00 0.00 H new ATOM 0 HG LEU A 582 0.495 3.431 1.384 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -1.259 4.845 0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 582 0.249 5.752 0.667 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -0.190 5.214 -0.971 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -1.185 2.428 -0.104 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -0.110 2.701 -1.496 1.00 0.00 H new ATOM 0 HD23 LEU A 582 0.376 1.579 -0.204 1.00 0.00 H new ATOM 653 N TRP A 583 5.211 4.077 0.133 1.00 0.00 N ATOM 654 CA TRP A 583 6.401 4.811 -0.269 1.00 0.00 C ATOM 655 C TRP A 583 7.114 4.112 -1.420 1.00 0.00 C ATOM 656 O TRP A 583 7.572 2.976 -1.287 1.00 0.00 O ATOM 657 CB TRP A 583 7.353 4.982 0.915 1.00 0.00 C ATOM 658 CG TRP A 583 8.732 5.378 0.500 1.00 0.00 C ATOM 659 CD1 TRP A 583 9.100 5.947 -0.684 1.00 0.00 C ATOM 660 CD2 TRP A 583 9.927 5.238 1.268 1.00 0.00 C ATOM 661 NE1 TRP A 583 10.454 6.152 -0.708 1.00 0.00 N ATOM 662 CE2 TRP A 583 10.986 5.732 0.484 1.00 0.00 C ATOM 663 CE3 TRP A 583 10.202 4.741 2.542 1.00 0.00 C ATOM 664 CZ2 TRP A 583 12.303 5.743 0.938 1.00 0.00 C ATOM 665 CZ3 TRP A 583 11.508 4.753 2.993 1.00 0.00 C ATOM 666 CH2 TRP A 583 12.544 5.252 2.192 1.00 0.00 C ATOM 0 H TRP A 583 5.259 3.071 -0.031 1.00 0.00 H new ATOM 0 HA TRP A 583 6.085 5.797 -0.611 1.00 0.00 H new ATOM 0 HB2 TRP A 583 6.952 5.737 1.591 1.00 0.00 H new ATOM 0 HB3 TRP A 583 7.402 4.047 1.474 1.00 0.00 H new ATOM 0 HD1 TRP A 583 8.422 6.199 -1.486 1.00 0.00 H new ATOM 0 HE1 TRP A 583 10.980 6.552 -1.485 1.00 0.00 H new ATOM 0 HE3 TRP A 583 9.409 4.354 3.164 1.00 0.00 H new ATOM 0 HZ2 TRP A 583 13.104 6.125 0.323 1.00 0.00 H new ATOM 0 HZ3 TRP A 583 11.734 4.372 3.978 1.00 0.00 H new ATOM 0 HH2 TRP A 583 13.555 5.249 2.573 1.00 0.00 H new ATOM 677 N LEU A 584 7.210 4.804 -2.551 1.00 0.00 N ATOM 678 CA LEU A 584 7.868 4.265 -3.732 1.00 0.00 C ATOM 679 C LEU A 584 9.352 4.620 -3.745 1.00 0.00 C ATOM 680 O LEU A 584 9.726 5.771 -3.973 1.00 0.00 O ATOM 681 CB LEU A 584 7.182 4.790 -4.997 1.00 0.00 C ATOM 682 CG LEU A 584 7.590 4.104 -6.301 1.00 0.00 C ATOM 683 CD1 LEU A 584 6.951 2.727 -6.398 1.00 0.00 C ATOM 684 CD2 LEU A 584 7.198 4.959 -7.497 1.00 0.00 C ATOM 0 H LEU A 584 6.837 5.746 -2.673 1.00 0.00 H new ATOM 0 HA LEU A 584 7.785 3.179 -3.706 1.00 0.00 H new ATOM 0 HB2 LEU A 584 6.104 4.686 -4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 584 7.391 5.856 -5.087 1.00 0.00 H new ATOM 0 HG LEU A 584 8.673 3.983 -6.305 1.00 0.00 H new ATOM 0 HD11 LEU A 584 7.251 2.252 -7.332 1.00 0.00 H new ATOM 0 HD12 LEU A 584 7.277 2.114 -5.558 1.00 0.00 H new ATOM 0 HD13 LEU A 584 5.866 2.827 -6.374 1.00 0.00 H new ATOM 0 HD21 LEU A 584 7.496 4.456 -8.417 1.00 0.00 H new ATOM 0 HD22 LEU A 584 6.118 5.109 -7.499 1.00 0.00 H new ATOM 0 HD23 LEU A 584 7.699 5.925 -7.433 1.00 0.00 H new ATOM 696 N LYS A 585 10.193 3.618 -3.497 1.00 0.00 N ATOM 697 CA LYS A 585 11.638 3.813 -3.476 1.00 0.00 C ATOM 698 C LYS A 585 12.249 3.478 -4.834 1.00 0.00 C ATOM 699 O LYS A 585 11.645 2.762 -5.634 1.00 0.00 O ATOM 700 CB LYS A 585 12.270 2.943 -2.386 1.00 0.00 C ATOM 701 CG LYS A 585 11.398 2.788 -1.152 1.00 0.00 C ATOM 702 CD LYS A 585 10.845 1.377 -1.032 1.00 0.00 C ATOM 703 CE LYS A 585 11.224 0.743 0.297 1.00 0.00 C ATOM 704 NZ LYS A 585 10.603 1.453 1.448 1.00 0.00 N ATOM 0 H LYS A 585 9.896 2.661 -3.307 1.00 0.00 H new ATOM 0 HA LYS A 585 11.840 4.861 -3.257 1.00 0.00 H new ATOM 0 HB2 LYS A 585 12.482 1.956 -2.797 1.00 0.00 H new ATOM 0 HB3 LYS A 585 13.226 3.378 -2.093 1.00 0.00 H new ATOM 0 HG2 LYS A 585 11.980 3.028 -0.262 1.00 0.00 H new ATOM 0 HG3 LYS A 585 10.574 3.500 -1.196 1.00 0.00 H new ATOM 0 HD2 LYS A 585 9.760 1.401 -1.129 1.00 0.00 H new ATOM 0 HD3 LYS A 585 11.225 0.765 -1.850 1.00 0.00 H new ATOM 0 HE2 LYS A 585 10.911 -0.301 0.303 1.00 0.00 H new ATOM 0 HE3 LYS A 585 12.308 0.752 0.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 585 10.391 0.771 2.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 585 11.261 2.174 1.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 585 9.722 1.911 1.139 1.00 0.00 H new ATOM 812 N ALA A 592 7.130 11.024 -1.487 1.00 0.00 N ATOM 813 CA ALA A 592 6.974 9.615 -1.822 1.00 0.00 C ATOM 814 C ALA A 592 6.267 8.864 -0.702 1.00 0.00 C ATOM 815 O ALA A 592 5.709 7.791 -0.919 1.00 0.00 O ATOM 816 CB ALA A 592 8.328 8.982 -2.109 1.00 0.00 C ATOM 0 HA ALA A 592 6.359 9.548 -2.719 1.00 0.00 H new ATOM 0 HB1 ALA A 592 8.192 7.929 -2.357 1.00 0.00 H new ATOM 0 HB2 ALA A 592 8.799 9.495 -2.948 1.00 0.00 H new ATOM 0 HB3 ALA A 592 8.964 9.068 -1.228 1.00 0.00 H new ATOM 822 N LYS A 593 6.292 9.439 0.496 1.00 0.00 N ATOM 823 CA LYS A 593 5.654 8.821 1.651 1.00 0.00 C ATOM 824 C LYS A 593 4.150 9.076 1.640 1.00 0.00 C ATOM 825 O LYS A 593 3.681 10.041 1.037 1.00 0.00 O ATOM 826 CB LYS A 593 6.271 9.361 2.940 1.00 0.00 C ATOM 827 CG LYS A 593 7.791 9.321 2.952 1.00 0.00 C ATOM 828 CD LYS A 593 8.320 7.901 2.821 1.00 0.00 C ATOM 829 CE LYS A 593 9.768 7.801 3.280 1.00 0.00 C ATOM 830 NZ LYS A 593 10.471 9.112 3.189 1.00 0.00 N ATOM 0 H LYS A 593 6.747 10.331 0.691 1.00 0.00 H new ATOM 0 HA LYS A 593 5.818 7.745 1.601 1.00 0.00 H new ATOM 0 HB2 LYS A 593 5.942 10.390 3.087 1.00 0.00 H new ATOM 0 HB3 LYS A 593 5.894 8.782 3.783 1.00 0.00 H new ATOM 0 HG2 LYS A 593 8.177 9.930 2.134 1.00 0.00 H new ATOM 0 HG3 LYS A 593 8.159 9.762 3.879 1.00 0.00 H new ATOM 0 HD2 LYS A 593 7.702 7.225 3.412 1.00 0.00 H new ATOM 0 HD3 LYS A 593 8.243 7.577 1.783 1.00 0.00 H new ATOM 0 HE2 LYS A 593 9.799 7.443 4.309 1.00 0.00 H new ATOM 0 HE3 LYS A 593 10.292 7.065 2.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 593 11.499 8.958 3.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 593 10.224 9.577 2.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 593 10.182 9.717 3.984 1.00 0.00 H new ATOM 844 N HIS A 594 3.396 8.205 2.305 1.00 0.00 N ATOM 845 CA HIS A 594 1.944 8.346 2.362 1.00 0.00 C ATOM 846 C HIS A 594 1.353 7.606 3.557 1.00 0.00 C ATOM 847 O HIS A 594 2.015 6.779 4.184 1.00 0.00 O ATOM 848 CB HIS A 594 1.306 7.819 1.076 1.00 0.00 C ATOM 849 CG HIS A 594 1.393 8.772 -0.076 1.00 0.00 C ATOM 850 ND1 HIS A 594 1.328 10.141 0.073 1.00 0.00 N ATOM 851 CD2 HIS A 594 1.542 8.545 -1.403 1.00 0.00 C ATOM 852 CE1 HIS A 594 1.433 10.716 -1.112 1.00 0.00 C ATOM 853 NE2 HIS A 594 1.564 9.770 -2.023 1.00 0.00 N ATOM 0 H HIS A 594 3.764 7.398 2.809 1.00 0.00 H new ATOM 0 HA HIS A 594 1.726 9.408 2.472 1.00 0.00 H new ATOM 0 HB2 HIS A 594 1.790 6.883 0.798 1.00 0.00 H new ATOM 0 HB3 HIS A 594 0.258 7.591 1.268 1.00 0.00 H new ATOM 0 HD2 HIS A 594 1.627 7.581 -1.883 1.00 0.00 H new ATOM 0 HE1 HIS A 594 1.415 11.779 -1.303 1.00 0.00 H new ATOM 0 HE2 HIS A 594 1.665 9.924 -3.026 1.00 0.00 H new ATOM 862 N LYS A 595 0.092 7.908 3.854 1.00 0.00 N ATOM 863 CA LYS A 595 -0.616 7.277 4.960 1.00 0.00 C ATOM 864 C LYS A 595 -2.127 7.430 4.778 1.00 0.00 C ATOM 865 O LYS A 595 -2.648 8.545 4.763 1.00 0.00 O ATOM 866 CB LYS A 595 -0.162 7.874 6.300 1.00 0.00 C ATOM 867 CG LYS A 595 -1.084 8.951 6.854 1.00 0.00 C ATOM 868 CD LYS A 595 -0.948 10.253 6.081 1.00 0.00 C ATOM 869 CE LYS A 595 -0.036 11.234 6.798 1.00 0.00 C ATOM 870 NZ LYS A 595 -0.159 12.612 6.248 1.00 0.00 N ATOM 0 H LYS A 595 -0.463 8.591 3.339 1.00 0.00 H new ATOM 0 HA LYS A 595 -0.378 6.213 4.966 1.00 0.00 H new ATOM 0 HB2 LYS A 595 -0.080 7.071 7.032 1.00 0.00 H new ATOM 0 HB3 LYS A 595 0.836 8.295 6.177 1.00 0.00 H new ATOM 0 HG2 LYS A 595 -2.117 8.606 6.808 1.00 0.00 H new ATOM 0 HG3 LYS A 595 -0.852 9.125 7.905 1.00 0.00 H new ATOM 0 HD2 LYS A 595 -0.552 10.047 5.086 1.00 0.00 H new ATOM 0 HD3 LYS A 595 -1.932 10.702 5.946 1.00 0.00 H new ATOM 0 HE2 LYS A 595 -0.278 11.245 7.861 1.00 0.00 H new ATOM 0 HE3 LYS A 595 0.998 10.899 6.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 0.479 13.250 6.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 0.097 12.608 5.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 -1.139 12.942 6.355 1.00 0.00 H new ATOM 884 N THR A 596 -2.821 6.306 4.630 1.00 0.00 N ATOM 885 CA THR A 596 -4.267 6.321 4.439 1.00 0.00 C ATOM 886 C THR A 596 -4.984 6.742 5.715 1.00 0.00 C ATOM 887 O THR A 596 -4.432 6.648 6.811 1.00 0.00 O ATOM 888 CB THR A 596 -4.763 4.943 3.999 1.00 0.00 C ATOM 889 OG1 THR A 596 -4.785 4.043 5.093 1.00 0.00 O ATOM 890 CG2 THR A 596 -3.916 4.321 2.912 1.00 0.00 C ATOM 0 H THR A 596 -2.406 5.374 4.639 1.00 0.00 H new ATOM 0 HA THR A 596 -4.492 7.048 3.659 1.00 0.00 H new ATOM 0 HB THR A 596 -5.766 5.111 3.606 1.00 0.00 H new ATOM 0 HG1 THR A 596 -5.690 3.684 5.203 1.00 0.00 H new ATOM 0 HG21 THR A 596 -4.323 3.345 2.647 1.00 0.00 H new ATOM 0 HG22 THR A 596 -3.920 4.967 2.034 1.00 0.00 H new ATOM 0 HG23 THR A 596 -2.894 4.202 3.271 1.00 0.00 H new ATOM 898 N GLN A 597 -6.221 7.202 5.565 1.00 0.00 N ATOM 899 CA GLN A 597 -7.016 7.633 6.705 1.00 0.00 C ATOM 900 C GLN A 597 -6.965 6.593 7.817 1.00 0.00 C ATOM 901 O GLN A 597 -7.021 5.389 7.559 1.00 0.00 O ATOM 902 CB GLN A 597 -8.465 7.881 6.284 1.00 0.00 C ATOM 903 CG GLN A 597 -9.169 6.638 5.764 1.00 0.00 C ATOM 904 CD GLN A 597 -10.678 6.783 5.762 1.00 0.00 C ATOM 905 OE1 GLN A 597 -11.249 7.471 6.608 1.00 0.00 O ATOM 906 NE2 GLN A 597 -11.334 6.131 4.809 1.00 0.00 N ATOM 0 H GLN A 597 -6.693 7.285 4.665 1.00 0.00 H new ATOM 0 HA GLN A 597 -6.596 8.566 7.081 1.00 0.00 H new ATOM 0 HB2 GLN A 597 -9.020 8.273 7.136 1.00 0.00 H new ATOM 0 HB3 GLN A 597 -8.484 8.649 5.511 1.00 0.00 H new ATOM 0 HG2 GLN A 597 -8.826 6.427 4.751 1.00 0.00 H new ATOM 0 HG3 GLN A 597 -8.890 5.782 6.379 1.00 0.00 H new ATOM 0 HE21 GLN A 597 -10.821 5.572 4.128 1.00 0.00 H new ATOM 0 HE22 GLN A 597 -12.351 6.189 4.758 1.00 0.00 H new ATOM 915 N ILE A 598 -6.858 7.062 9.053 1.00 0.00 N ATOM 916 CA ILE A 598 -6.797 6.174 10.207 1.00 0.00 C ATOM 917 C ILE A 598 -8.163 5.576 10.511 1.00 0.00 C ATOM 918 O ILE A 598 -9.137 6.303 10.711 1.00 0.00 O ATOM 919 CB ILE A 598 -6.310 6.917 11.466 1.00 0.00 C ATOM 920 CG1 ILE A 598 -5.141 7.852 11.133 1.00 0.00 C ATOM 921 CG2 ILE A 598 -5.923 5.922 12.550 1.00 0.00 C ATOM 922 CD1 ILE A 598 -3.786 7.183 11.169 1.00 0.00 C ATOM 0 H ILE A 598 -6.812 8.055 9.283 1.00 0.00 H new ATOM 0 HA ILE A 598 -6.091 5.383 9.952 1.00 0.00 H new ATOM 0 HB ILE A 598 -7.128 7.532 11.842 1.00 0.00 H new ATOM 0 HG12 ILE A 598 -5.299 8.275 10.141 1.00 0.00 H new ATOM 0 HG13 ILE A 598 -5.143 8.683 11.838 1.00 0.00 H new ATOM 0 HG21 ILE A 598 -5.581 6.461 13.433 1.00 0.00 H new ATOM 0 HG22 ILE A 598 -6.788 5.312 12.810 1.00 0.00 H new ATOM 0 HG23 ILE A 598 -5.122 5.279 12.185 1.00 0.00 H new ATOM 0 HD11 ILE A 598 -3.014 7.912 10.922 1.00 0.00 H new ATOM 0 HD12 ILE A 598 -3.603 6.785 12.167 1.00 0.00 H new ATOM 0 HD13 ILE A 598 -3.762 6.370 10.444 1.00 0.00 H new ATOM 934 N LYS A 599 -8.233 4.251 10.566 1.00 0.00 N ATOM 935 CA LYS A 599 -9.485 3.576 10.873 1.00 0.00 C ATOM 936 C LYS A 599 -9.457 3.058 12.305 1.00 0.00 C ATOM 937 O LYS A 599 -9.123 1.900 12.558 1.00 0.00 O ATOM 938 CB LYS A 599 -9.742 2.437 9.888 1.00 0.00 C ATOM 939 CG LYS A 599 -10.985 2.654 9.040 1.00 0.00 C ATOM 940 CD LYS A 599 -10.632 2.855 7.575 1.00 0.00 C ATOM 941 CE LYS A 599 -10.529 4.331 7.227 1.00 0.00 C ATOM 942 NZ LYS A 599 -11.809 5.051 7.475 1.00 0.00 N ATOM 0 H LYS A 599 -7.442 3.628 10.403 1.00 0.00 H new ATOM 0 HA LYS A 599 -10.302 4.291 10.776 1.00 0.00 H new ATOM 0 HB2 LYS A 599 -8.877 2.328 9.234 1.00 0.00 H new ATOM 0 HB3 LYS A 599 -9.844 1.503 10.440 1.00 0.00 H new ATOM 0 HG2 LYS A 599 -11.650 1.796 9.141 1.00 0.00 H new ATOM 0 HG3 LYS A 599 -11.530 3.524 9.407 1.00 0.00 H new ATOM 0 HD2 LYS A 599 -9.685 2.361 7.356 1.00 0.00 H new ATOM 0 HD3 LYS A 599 -11.390 2.384 6.949 1.00 0.00 H new ATOM 0 HE2 LYS A 599 -9.735 4.789 7.817 1.00 0.00 H new ATOM 0 HE3 LYS A 599 -10.249 4.438 6.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 -11.614 6.059 7.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 -12.430 4.951 6.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 -12.278 4.647 8.310 1.00 0.00 H new ATOM 956 N LYS A 600 -9.790 3.942 13.238 1.00 0.00 N ATOM 957 CA LYS A 600 -9.788 3.611 14.659 1.00 0.00 C ATOM 958 C LYS A 600 -10.671 2.403 14.968 1.00 0.00 C ATOM 959 O LYS A 600 -11.618 2.103 14.242 1.00 0.00 O ATOM 960 CB LYS A 600 -10.259 4.814 15.481 1.00 0.00 C ATOM 961 CG LYS A 600 -9.579 6.122 15.105 1.00 0.00 C ATOM 962 CD LYS A 600 -8.089 6.085 15.401 1.00 0.00 C ATOM 963 CE LYS A 600 -7.444 7.443 15.174 1.00 0.00 C ATOM 964 NZ LYS A 600 -7.473 8.284 16.403 1.00 0.00 N ATOM 0 H LYS A 600 -10.067 4.902 13.034 1.00 0.00 H new ATOM 0 HA LYS A 600 -8.764 3.355 14.930 1.00 0.00 H new ATOM 0 HB2 LYS A 600 -11.336 4.927 15.357 1.00 0.00 H new ATOM 0 HB3 LYS A 600 -10.079 4.613 16.537 1.00 0.00 H new ATOM 0 HG2 LYS A 600 -9.735 6.322 14.045 1.00 0.00 H new ATOM 0 HG3 LYS A 600 -10.039 6.943 15.655 1.00 0.00 H new ATOM 0 HD2 LYS A 600 -7.929 5.773 16.433 1.00 0.00 H new ATOM 0 HD3 LYS A 600 -7.609 5.342 14.765 1.00 0.00 H new ATOM 0 HE2 LYS A 600 -6.412 7.305 14.853 1.00 0.00 H new ATOM 0 HE3 LYS A 600 -7.963 7.961 14.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 600 -7.519 9.288 16.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 600 -8.308 8.039 16.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 600 -6.612 8.113 16.961 1.00 0.00 H new ATOM 978 N LYS A 601 -10.348 1.726 16.066 1.00 0.00 N ATOM 979 CA LYS A 601 -11.094 0.555 16.515 1.00 0.00 C ATOM 980 C LYS A 601 -11.656 -0.251 15.349 1.00 0.00 C ATOM 981 O LYS A 601 -12.851 -0.188 15.060 1.00 0.00 O ATOM 982 CB LYS A 601 -12.233 0.984 17.443 1.00 0.00 C ATOM 983 CG LYS A 601 -11.856 2.114 18.386 1.00 0.00 C ATOM 984 CD LYS A 601 -11.246 1.586 19.674 1.00 0.00 C ATOM 985 CE LYS A 601 -12.275 0.850 20.517 1.00 0.00 C ATOM 986 NZ LYS A 601 -11.643 -0.167 21.403 1.00 0.00 N ATOM 0 H LYS A 601 -9.563 1.973 16.669 1.00 0.00 H new ATOM 0 HA LYS A 601 -10.397 -0.087 17.055 1.00 0.00 H new ATOM 0 HB2 LYS A 601 -13.085 1.295 16.839 1.00 0.00 H new ATOM 0 HB3 LYS A 601 -12.556 0.124 18.030 1.00 0.00 H new ATOM 0 HG2 LYS A 601 -11.147 2.779 17.893 1.00 0.00 H new ATOM 0 HG3 LYS A 601 -12.741 2.706 18.618 1.00 0.00 H new ATOM 0 HD2 LYS A 601 -10.420 0.915 19.438 1.00 0.00 H new ATOM 0 HD3 LYS A 601 -10.830 2.415 20.247 1.00 0.00 H new ATOM 0 HE2 LYS A 601 -12.827 1.567 21.124 1.00 0.00 H new ATOM 0 HE3 LYS A 601 -12.998 0.363 19.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 601 -12.378 -0.646 21.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 601 -11.137 -0.867 20.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 601 -10.972 0.301 22.045 1.00 0.00 H new ATOM 1000 N THR A 602 -10.794 -1.019 14.692 1.00 0.00 N ATOM 1001 CA THR A 602 -11.217 -1.847 13.570 1.00 0.00 C ATOM 1002 C THR A 602 -10.039 -2.617 12.982 1.00 0.00 C ATOM 1003 O THR A 602 -8.937 -2.085 12.852 1.00 0.00 O ATOM 1004 CB THR A 602 -11.856 -0.984 12.493 1.00 0.00 C ATOM 1005 OG1 THR A 602 -12.661 -1.765 11.628 1.00 0.00 O ATOM 1006 CG2 THR A 602 -10.833 -0.270 11.651 1.00 0.00 C ATOM 0 H THR A 602 -9.801 -1.085 14.916 1.00 0.00 H new ATOM 0 HA THR A 602 -11.949 -2.566 13.939 1.00 0.00 H new ATOM 0 HB THR A 602 -12.463 -0.248 13.021 1.00 0.00 H new ATOM 0 HG1 THR A 602 -13.063 -1.188 10.945 1.00 0.00 H new ATOM 0 HG21 THR A 602 -11.339 0.333 10.897 1.00 0.00 H new ATOM 0 HG22 THR A 602 -10.227 0.377 12.285 1.00 0.00 H new ATOM 0 HG23 THR A 602 -10.191 -1.002 11.160 1.00 0.00 H new ATOM 1014 N LEU A 603 -10.284 -3.872 12.624 1.00 0.00 N ATOM 1015 CA LEU A 603 -9.249 -4.722 12.042 1.00 0.00 C ATOM 1016 C LEU A 603 -9.576 -5.060 10.592 1.00 0.00 C ATOM 1017 O LEU A 603 -8.740 -5.594 9.863 1.00 0.00 O ATOM 1018 CB LEU A 603 -9.115 -6.015 12.846 1.00 0.00 C ATOM 1019 CG LEU A 603 -8.960 -5.831 14.356 1.00 0.00 C ATOM 1020 CD1 LEU A 603 -8.337 -7.070 14.982 1.00 0.00 C ATOM 1021 CD2 LEU A 603 -8.122 -4.598 14.659 1.00 0.00 C ATOM 0 H LEU A 603 -11.192 -4.325 12.726 1.00 0.00 H new ATOM 0 HA LEU A 603 -8.307 -4.175 12.072 1.00 0.00 H new ATOM 0 HB2 LEU A 603 -9.994 -6.632 12.660 1.00 0.00 H new ATOM 0 HB3 LEU A 603 -8.253 -6.568 12.473 1.00 0.00 H new ATOM 0 HG LEU A 603 -9.949 -5.688 14.790 1.00 0.00 H new ATOM 0 HD11 LEU A 603 -8.234 -6.922 16.057 1.00 0.00 H new ATOM 0 HD12 LEU A 603 -8.976 -7.933 14.794 1.00 0.00 H new ATOM 0 HD13 LEU A 603 -7.354 -7.244 14.544 1.00 0.00 H new ATOM 0 HD21 LEU A 603 -8.022 -4.482 15.738 1.00 0.00 H new ATOM 0 HD22 LEU A 603 -7.134 -4.711 14.213 1.00 0.00 H new ATOM 0 HD23 LEU A 603 -8.609 -3.716 14.243 1.00 0.00 H new ATOM 1033 N ASN A 604 -10.799 -4.749 10.182 1.00 0.00 N ATOM 1034 CA ASN A 604 -11.244 -5.022 8.821 1.00 0.00 C ATOM 1035 C ASN A 604 -11.917 -3.793 8.217 1.00 0.00 C ATOM 1036 O ASN A 604 -13.021 -3.876 7.681 1.00 0.00 O ATOM 1037 CB ASN A 604 -12.214 -6.205 8.810 1.00 0.00 C ATOM 1038 CG ASN A 604 -11.943 -7.185 9.935 1.00 0.00 C ATOM 1039 OD1 ASN A 604 -10.926 -7.879 9.937 1.00 0.00 O ATOM 1040 ND2 ASN A 604 -12.854 -7.246 10.899 1.00 0.00 N ATOM 0 H ASN A 604 -11.502 -4.307 10.774 1.00 0.00 H new ATOM 0 HA ASN A 604 -10.370 -5.271 8.219 1.00 0.00 H new ATOM 0 HB2 ASN A 604 -13.236 -5.834 8.893 1.00 0.00 H new ATOM 0 HB3 ASN A 604 -12.140 -6.724 7.854 1.00 0.00 H new ATOM 0 HD21 ASN A 604 -12.726 -7.887 11.682 1.00 0.00 H new ATOM 0 HD22 ASN A 604 -13.682 -6.652 10.856 1.00 0.00 H new ATOM 1047 N PRO A 605 -11.256 -2.630 8.312 1.00 0.00 N ATOM 1048 CA PRO A 605 -11.786 -1.368 7.789 1.00 0.00 C ATOM 1049 C PRO A 605 -11.630 -1.234 6.281 1.00 0.00 C ATOM 1050 O PRO A 605 -10.951 -2.036 5.642 1.00 0.00 O ATOM 1051 CB PRO A 605 -10.931 -0.323 8.491 1.00 0.00 C ATOM 1052 CG PRO A 605 -9.623 -0.999 8.714 1.00 0.00 C ATOM 1053 CD PRO A 605 -9.939 -2.453 8.950 1.00 0.00 C ATOM 0 HA PRO A 605 -12.857 -1.278 7.969 1.00 0.00 H new ATOM 0 HB2 PRO A 605 -10.816 0.572 7.879 1.00 0.00 H new ATOM 0 HB3 PRO A 605 -11.381 -0.009 9.433 1.00 0.00 H new ATOM 0 HG2 PRO A 605 -8.969 -0.877 7.850 1.00 0.00 H new ATOM 0 HG3 PRO A 605 -9.103 -0.569 9.570 1.00 0.00 H new ATOM 0 HD2 PRO A 605 -9.187 -3.104 8.504 1.00 0.00 H new ATOM 0 HD3 PRO A 605 -9.974 -2.688 10.014 1.00 0.00 H new ATOM 1061 N GLU A 606 -12.257 -0.202 5.725 1.00 0.00 N ATOM 1062 CA GLU A 606 -12.190 0.064 4.294 1.00 0.00 C ATOM 1063 C GLU A 606 -11.613 1.451 4.036 1.00 0.00 C ATOM 1064 O GLU A 606 -12.230 2.462 4.372 1.00 0.00 O ATOM 1065 CB GLU A 606 -13.580 -0.050 3.665 1.00 0.00 C ATOM 1066 CG GLU A 606 -13.577 0.085 2.152 1.00 0.00 C ATOM 1067 CD GLU A 606 -14.698 0.968 1.643 1.00 0.00 C ATOM 1068 OE1 GLU A 606 -15.659 1.208 2.406 1.00 0.00 O ATOM 1069 OE2 GLU A 606 -14.618 1.421 0.481 1.00 0.00 O ATOM 0 H GLU A 606 -12.821 0.467 6.249 1.00 0.00 H new ATOM 0 HA GLU A 606 -11.535 -0.678 3.837 1.00 0.00 H new ATOM 0 HB2 GLU A 606 -14.013 -1.013 3.934 1.00 0.00 H new ATOM 0 HB3 GLU A 606 -14.225 0.720 4.089 1.00 0.00 H new ATOM 0 HG2 GLU A 606 -12.621 0.497 1.830 1.00 0.00 H new ATOM 0 HG3 GLU A 606 -13.666 -0.904 1.703 1.00 0.00 H new ATOM 1076 N PHE A 607 -10.424 1.493 3.446 1.00 0.00 N ATOM 1077 CA PHE A 607 -9.762 2.758 3.153 1.00 0.00 C ATOM 1078 C PHE A 607 -10.328 3.403 1.893 1.00 0.00 C ATOM 1079 O PHE A 607 -10.711 4.572 1.903 1.00 0.00 O ATOM 1080 CB PHE A 607 -8.256 2.545 2.986 1.00 0.00 C ATOM 1081 CG PHE A 607 -7.590 1.952 4.193 1.00 0.00 C ATOM 1082 CD1 PHE A 607 -7.493 2.673 5.373 1.00 0.00 C ATOM 1083 CD2 PHE A 607 -7.056 0.676 4.145 1.00 0.00 C ATOM 1084 CE1 PHE A 607 -6.874 2.131 6.484 1.00 0.00 C ATOM 1085 CE2 PHE A 607 -6.436 0.127 5.253 1.00 0.00 C ATOM 1086 CZ PHE A 607 -6.345 0.856 6.427 1.00 0.00 C ATOM 0 H PHE A 607 -9.899 0.666 3.161 1.00 0.00 H new ATOM 0 HA PHE A 607 -9.944 3.427 3.994 1.00 0.00 H new ATOM 0 HB2 PHE A 607 -8.084 1.892 2.130 1.00 0.00 H new ATOM 0 HB3 PHE A 607 -7.787 3.502 2.757 1.00 0.00 H new ATOM 0 HD1 PHE A 607 -7.906 3.670 5.425 1.00 0.00 H new ATOM 0 HD2 PHE A 607 -7.124 0.103 3.232 1.00 0.00 H new ATOM 0 HE1 PHE A 607 -6.804 2.704 7.397 1.00 0.00 H new ATOM 0 HE2 PHE A 607 -6.023 -0.870 5.203 1.00 0.00 H new ATOM 0 HZ PHE A 607 -5.863 0.430 7.294 1.00 0.00 H new ATOM 1096 N ASN A 608 -10.367 2.640 0.805 1.00 0.00 N ATOM 1097 CA ASN A 608 -10.875 3.154 -0.461 1.00 0.00 C ATOM 1098 C ASN A 608 -10.204 4.483 -0.790 1.00 0.00 C ATOM 1099 O ASN A 608 -10.872 5.468 -1.108 1.00 0.00 O ATOM 1100 CB ASN A 608 -12.393 3.332 -0.396 1.00 0.00 C ATOM 1101 CG ASN A 608 -13.037 3.307 -1.769 1.00 0.00 C ATOM 1102 OD1 ASN A 608 -13.083 4.321 -2.465 1.00 0.00 O ATOM 1103 ND2 ASN A 608 -13.539 2.143 -2.165 1.00 0.00 N ATOM 0 H ASN A 608 -10.055 1.669 0.775 1.00 0.00 H new ATOM 0 HA ASN A 608 -10.645 2.435 -1.247 1.00 0.00 H new ATOM 0 HB2 ASN A 608 -12.823 2.541 0.218 1.00 0.00 H new ATOM 0 HB3 ASN A 608 -12.625 4.278 0.094 1.00 0.00 H new ATOM 0 HD21 ASN A 608 -13.985 2.064 -3.079 1.00 0.00 H new ATOM 0 HD22 ASN A 608 -13.479 1.328 -1.555 1.00 0.00 H new ATOM 1110 N GLU A 609 -8.879 4.502 -0.695 1.00 0.00 N ATOM 1111 CA GLU A 609 -8.105 5.710 -0.966 1.00 0.00 C ATOM 1112 C GLU A 609 -7.338 5.594 -2.280 1.00 0.00 C ATOM 1113 O GLU A 609 -6.562 4.657 -2.477 1.00 0.00 O ATOM 1114 CB GLU A 609 -7.133 5.978 0.186 1.00 0.00 C ATOM 1115 CG GLU A 609 -7.575 7.099 1.110 1.00 0.00 C ATOM 1116 CD GLU A 609 -7.124 8.465 0.629 1.00 0.00 C ATOM 1117 OE1 GLU A 609 -7.487 8.846 -0.504 1.00 0.00 O ATOM 1118 OE2 GLU A 609 -6.409 9.154 1.386 1.00 0.00 O ATOM 0 H GLU A 609 -8.317 3.693 -0.432 1.00 0.00 H new ATOM 0 HA GLU A 609 -8.801 6.544 -1.054 1.00 0.00 H new ATOM 0 HB2 GLU A 609 -7.014 5.065 0.769 1.00 0.00 H new ATOM 0 HB3 GLU A 609 -6.154 6.223 -0.226 1.00 0.00 H new ATOM 0 HG2 GLU A 609 -8.662 7.088 1.194 1.00 0.00 H new ATOM 0 HG3 GLU A 609 -7.176 6.920 2.109 1.00 0.00 H new ATOM 1125 N GLU A 610 -7.554 6.556 -3.172 1.00 0.00 N ATOM 1126 CA GLU A 610 -6.878 6.568 -4.465 1.00 0.00 C ATOM 1127 C GLU A 610 -5.681 7.513 -4.435 1.00 0.00 C ATOM 1128 O GLU A 610 -5.838 8.732 -4.391 1.00 0.00 O ATOM 1129 CB GLU A 610 -7.849 6.989 -5.570 1.00 0.00 C ATOM 1130 CG GLU A 610 -9.161 6.220 -5.553 1.00 0.00 C ATOM 1131 CD GLU A 610 -10.246 6.903 -6.362 1.00 0.00 C ATOM 1132 OE1 GLU A 610 -10.013 8.038 -6.828 1.00 0.00 O ATOM 1133 OE2 GLU A 610 -11.328 6.303 -6.528 1.00 0.00 O ATOM 0 H GLU A 610 -8.192 7.338 -3.023 1.00 0.00 H new ATOM 0 HA GLU A 610 -6.522 5.559 -4.674 1.00 0.00 H new ATOM 0 HB2 GLU A 610 -8.060 8.054 -5.470 1.00 0.00 H new ATOM 0 HB3 GLU A 610 -7.368 6.849 -6.538 1.00 0.00 H new ATOM 0 HG2 GLU A 610 -8.996 5.217 -5.947 1.00 0.00 H new ATOM 0 HG3 GLU A 610 -9.498 6.106 -4.523 1.00 0.00 H new ATOM 1140 N PHE A 611 -4.485 6.936 -4.446 1.00 0.00 N ATOM 1141 CA PHE A 611 -3.253 7.715 -4.406 1.00 0.00 C ATOM 1142 C PHE A 611 -2.742 8.046 -5.803 1.00 0.00 C ATOM 1143 O PHE A 611 -3.247 7.535 -6.803 1.00 0.00 O ATOM 1144 CB PHE A 611 -2.185 6.944 -3.649 1.00 0.00 C ATOM 1145 CG PHE A 611 -2.301 7.080 -2.165 1.00 0.00 C ATOM 1146 CD1 PHE A 611 -3.254 6.363 -1.466 1.00 0.00 C ATOM 1147 CD2 PHE A 611 -1.455 7.922 -1.473 1.00 0.00 C ATOM 1148 CE1 PHE A 611 -3.360 6.483 -0.094 1.00 0.00 C ATOM 1149 CE2 PHE A 611 -1.553 8.050 -0.102 1.00 0.00 C ATOM 1150 CZ PHE A 611 -2.506 7.327 0.590 1.00 0.00 C ATOM 0 H PHE A 611 -4.342 5.927 -4.482 1.00 0.00 H new ATOM 0 HA PHE A 611 -3.473 8.654 -3.898 1.00 0.00 H new ATOM 0 HB2 PHE A 611 -2.249 5.889 -3.917 1.00 0.00 H new ATOM 0 HB3 PHE A 611 -1.202 7.294 -3.964 1.00 0.00 H new ATOM 0 HD1 PHE A 611 -3.922 5.702 -1.998 1.00 0.00 H new ATOM 0 HD2 PHE A 611 -0.708 8.487 -2.010 1.00 0.00 H new ATOM 0 HE1 PHE A 611 -4.108 5.919 0.443 1.00 0.00 H new ATOM 0 HE2 PHE A 611 -0.886 8.714 0.429 1.00 0.00 H new ATOM 0 HZ PHE A 611 -2.583 7.421 1.663 1.00 0.00 H new ATOM 1160 N PHE A 612 -1.722 8.897 -5.854 1.00 0.00 N ATOM 1161 CA PHE A 612 -1.113 9.305 -7.115 1.00 0.00 C ATOM 1162 C PHE A 612 0.391 9.501 -6.946 1.00 0.00 C ATOM 1163 O PHE A 612 0.833 10.285 -6.106 1.00 0.00 O ATOM 1164 CB PHE A 612 -1.753 10.599 -7.621 1.00 0.00 C ATOM 1165 CG PHE A 612 -1.425 10.912 -9.054 1.00 0.00 C ATOM 1166 CD1 PHE A 612 -1.279 9.894 -9.983 1.00 0.00 C ATOM 1167 CD2 PHE A 612 -1.262 12.223 -9.471 1.00 0.00 C ATOM 1168 CE1 PHE A 612 -0.978 10.178 -11.301 1.00 0.00 C ATOM 1169 CE2 PHE A 612 -0.960 12.514 -10.788 1.00 0.00 C ATOM 1170 CZ PHE A 612 -0.818 11.489 -11.705 1.00 0.00 C ATOM 0 H PHE A 612 -1.297 9.320 -5.029 1.00 0.00 H new ATOM 0 HA PHE A 612 -1.283 8.516 -7.847 1.00 0.00 H new ATOM 0 HB2 PHE A 612 -2.835 10.526 -7.512 1.00 0.00 H new ATOM 0 HB3 PHE A 612 -1.425 11.427 -6.993 1.00 0.00 H new ATOM 0 HD1 PHE A 612 -1.402 8.867 -9.673 1.00 0.00 H new ATOM 0 HD2 PHE A 612 -1.372 13.027 -8.759 1.00 0.00 H new ATOM 0 HE1 PHE A 612 -0.868 9.375 -12.015 1.00 0.00 H new ATOM 0 HE2 PHE A 612 -0.835 13.540 -11.100 1.00 0.00 H new ATOM 0 HZ PHE A 612 -0.582 11.713 -12.735 1.00 0.00 H new ATOM 1180 N TYR A 613 1.171 8.783 -7.747 1.00 0.00 N ATOM 1181 CA TYR A 613 2.622 8.877 -7.684 1.00 0.00 C ATOM 1182 C TYR A 613 3.160 9.697 -8.849 1.00 0.00 C ATOM 1183 O TYR A 613 2.542 9.761 -9.912 1.00 0.00 O ATOM 1184 CB TYR A 613 3.243 7.481 -7.688 1.00 0.00 C ATOM 1185 CG TYR A 613 3.484 6.944 -6.300 1.00 0.00 C ATOM 1186 CD1 TYR A 613 2.477 6.291 -5.602 1.00 0.00 C ATOM 1187 CD2 TYR A 613 4.717 7.100 -5.688 1.00 0.00 C ATOM 1188 CE1 TYR A 613 2.693 5.804 -4.326 1.00 0.00 C ATOM 1189 CE2 TYR A 613 4.945 6.620 -4.412 1.00 0.00 C ATOM 1190 CZ TYR A 613 3.930 5.971 -3.736 1.00 0.00 C ATOM 1191 OH TYR A 613 4.153 5.490 -2.465 1.00 0.00 O ATOM 0 H TYR A 613 0.821 8.129 -8.447 1.00 0.00 H new ATOM 0 HA TYR A 613 2.893 9.380 -6.756 1.00 0.00 H new ATOM 0 HB2 TYR A 613 2.587 6.798 -8.228 1.00 0.00 H new ATOM 0 HB3 TYR A 613 4.188 7.510 -8.230 1.00 0.00 H new ATOM 0 HD1 TYR A 613 1.509 6.161 -6.063 1.00 0.00 H new ATOM 0 HD2 TYR A 613 5.513 7.605 -6.216 1.00 0.00 H new ATOM 0 HE1 TYR A 613 1.901 5.297 -3.795 1.00 0.00 H new ATOM 0 HE2 TYR A 613 5.911 6.752 -3.946 1.00 0.00 H new ATOM 0 HH TYR A 613 3.926 6.182 -1.809 1.00 0.00 H new ATOM 1201 N ASP A 614 4.306 10.331 -8.640 1.00 0.00 N ATOM 1202 CA ASP A 614 4.914 11.154 -9.676 1.00 0.00 C ATOM 1203 C ASP A 614 6.133 10.467 -10.280 1.00 0.00 C ATOM 1204 O ASP A 614 7.237 11.011 -10.262 1.00 0.00 O ATOM 1205 CB ASP A 614 5.311 12.516 -9.107 1.00 0.00 C ATOM 1206 CG ASP A 614 6.069 13.363 -10.110 1.00 0.00 C ATOM 1207 OD1 ASP A 614 5.951 13.093 -11.324 1.00 0.00 O ATOM 1208 OD2 ASP A 614 6.781 14.296 -9.683 1.00 0.00 O ATOM 0 H ASP A 614 4.831 10.292 -7.766 1.00 0.00 H new ATOM 0 HA ASP A 614 4.176 11.298 -10.466 1.00 0.00 H new ATOM 0 HB2 ASP A 614 4.415 13.049 -8.789 1.00 0.00 H new ATOM 0 HB3 ASP A 614 5.927 12.370 -8.220 1.00 0.00 H new ATOM 1213 N ILE A 615 5.925 9.271 -10.820 1.00 0.00 N ATOM 1214 CA ILE A 615 7.007 8.514 -11.436 1.00 0.00 C ATOM 1215 C ILE A 615 6.665 8.161 -12.879 1.00 0.00 C ATOM 1216 O ILE A 615 5.508 7.903 -13.209 1.00 0.00 O ATOM 1217 CB ILE A 615 7.317 7.224 -10.643 1.00 0.00 C ATOM 1218 CG1 ILE A 615 8.172 6.255 -11.469 1.00 0.00 C ATOM 1219 CG2 ILE A 615 6.032 6.553 -10.183 1.00 0.00 C ATOM 1220 CD1 ILE A 615 9.652 6.546 -11.405 1.00 0.00 C ATOM 0 H ILE A 615 5.018 8.806 -10.843 1.00 0.00 H new ATOM 0 HA ILE A 615 7.894 9.147 -11.423 1.00 0.00 H new ATOM 0 HB ILE A 615 7.892 7.505 -9.761 1.00 0.00 H new ATOM 0 HG12 ILE A 615 7.995 5.238 -11.118 1.00 0.00 H new ATOM 0 HG13 ILE A 615 7.848 6.294 -12.509 1.00 0.00 H new ATOM 0 HG21 ILE A 615 6.273 5.647 -9.627 1.00 0.00 H new ATOM 0 HG22 ILE A 615 5.475 7.235 -9.541 1.00 0.00 H new ATOM 0 HG23 ILE A 615 5.425 6.295 -11.051 1.00 0.00 H new ATOM 0 HD11 ILE A 615 10.192 5.820 -12.013 1.00 0.00 H new ATOM 0 HD12 ILE A 615 9.842 7.550 -11.784 1.00 0.00 H new ATOM 0 HD13 ILE A 615 9.992 6.478 -10.372 1.00 0.00 H new ATOM 1232 N LYS A 616 7.683 8.146 -13.732 1.00 0.00 N ATOM 1233 CA LYS A 616 7.495 7.820 -15.139 1.00 0.00 C ATOM 1234 C LYS A 616 7.397 6.311 -15.333 1.00 0.00 C ATOM 1235 O LYS A 616 8.153 5.547 -14.732 1.00 0.00 O ATOM 1236 CB LYS A 616 8.648 8.381 -15.974 1.00 0.00 C ATOM 1237 CG LYS A 616 8.330 9.712 -16.635 1.00 0.00 C ATOM 1238 CD LYS A 616 8.179 9.564 -18.139 1.00 0.00 C ATOM 1239 CE LYS A 616 7.737 10.867 -18.786 1.00 0.00 C ATOM 1240 NZ LYS A 616 6.325 11.201 -18.453 1.00 0.00 N ATOM 0 H LYS A 616 8.647 8.356 -13.473 1.00 0.00 H new ATOM 0 HA LYS A 616 6.563 8.275 -15.473 1.00 0.00 H new ATOM 0 HB2 LYS A 616 9.523 8.502 -15.335 1.00 0.00 H new ATOM 0 HB3 LYS A 616 8.914 7.657 -16.744 1.00 0.00 H new ATOM 0 HG2 LYS A 616 7.410 10.118 -16.214 1.00 0.00 H new ATOM 0 HG3 LYS A 616 9.123 10.427 -16.416 1.00 0.00 H new ATOM 0 HD2 LYS A 616 9.128 9.245 -18.571 1.00 0.00 H new ATOM 0 HD3 LYS A 616 7.451 8.783 -18.357 1.00 0.00 H new ATOM 0 HE2 LYS A 616 8.389 11.676 -18.456 1.00 0.00 H new ATOM 0 HE3 LYS A 616 7.847 10.791 -19.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 616 6.008 11.997 -19.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 616 5.721 10.374 -18.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 616 6.258 11.465 -17.449 1.00 0.00 H new ATOM 1254 N HIS A 617 6.460 5.888 -16.172 1.00 0.00 N ATOM 1255 CA HIS A 617 6.258 4.470 -16.443 1.00 0.00 C ATOM 1256 C HIS A 617 7.590 3.759 -16.664 1.00 0.00 C ATOM 1257 O HIS A 617 7.865 2.729 -16.049 1.00 0.00 O ATOM 1258 CB HIS A 617 5.361 4.283 -17.666 1.00 0.00 C ATOM 1259 CG HIS A 617 5.100 2.848 -18.000 1.00 0.00 C ATOM 1260 ND1 HIS A 617 5.805 2.159 -18.964 1.00 0.00 N ATOM 1261 CD2 HIS A 617 4.209 1.967 -17.486 1.00 0.00 C ATOM 1262 CE1 HIS A 617 5.358 0.918 -19.030 1.00 0.00 C ATOM 1263 NE2 HIS A 617 4.391 0.776 -18.144 1.00 0.00 N ATOM 0 H HIS A 617 5.827 6.508 -16.677 1.00 0.00 H new ATOM 0 HA HIS A 617 5.771 4.029 -15.573 1.00 0.00 H new ATOM 0 HB2 HIS A 617 4.410 4.786 -17.490 1.00 0.00 H new ATOM 0 HB3 HIS A 617 5.824 4.769 -18.524 1.00 0.00 H new ATOM 0 HD2 HIS A 617 3.490 2.164 -16.705 1.00 0.00 H new ATOM 0 HE1 HIS A 617 5.722 0.150 -19.696 1.00 0.00 H new ATOM 0 HE2 HIS A 617 3.864 -0.081 -17.975 1.00 0.00 H new ATOM 1272 N SER A 618 8.409 4.312 -17.552 1.00 0.00 N ATOM 1273 CA SER A 618 9.708 3.728 -17.862 1.00 0.00 C ATOM 1274 C SER A 618 10.539 3.527 -16.599 1.00 0.00 C ATOM 1275 O SER A 618 11.505 2.764 -16.598 1.00 0.00 O ATOM 1276 CB SER A 618 10.466 4.618 -18.848 1.00 0.00 C ATOM 1277 OG SER A 618 9.606 5.580 -19.434 1.00 0.00 O ATOM 0 H SER A 618 8.196 5.164 -18.070 1.00 0.00 H new ATOM 0 HA SER A 618 9.537 2.752 -18.316 1.00 0.00 H new ATOM 0 HB2 SER A 618 11.283 5.123 -18.333 1.00 0.00 H new ATOM 0 HB3 SER A 618 10.913 4.002 -19.628 1.00 0.00 H new ATOM 0 HG SER A 618 9.526 6.354 -18.838 1.00 0.00 H new ATOM 1283 N ASP A 619 10.161 4.212 -15.525 1.00 0.00 N ATOM 1284 CA ASP A 619 10.879 4.098 -14.262 1.00 0.00 C ATOM 1285 C ASP A 619 10.081 3.267 -13.260 1.00 0.00 C ATOM 1286 O ASP A 619 10.652 2.604 -12.395 1.00 0.00 O ATOM 1287 CB ASP A 619 11.168 5.487 -13.691 1.00 0.00 C ATOM 1288 CG ASP A 619 12.100 6.292 -14.575 1.00 0.00 C ATOM 1289 OD1 ASP A 619 12.276 5.912 -15.752 1.00 0.00 O ATOM 1290 OD2 ASP A 619 12.654 7.301 -14.090 1.00 0.00 O ATOM 0 H ASP A 619 9.365 4.849 -15.504 1.00 0.00 H new ATOM 0 HA ASP A 619 11.826 3.591 -14.449 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.230 6.029 -13.568 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.610 5.385 -12.700 1.00 0.00 H new ATOM 1295 N LEU A 620 8.759 3.305 -13.393 1.00 0.00 N ATOM 1296 CA LEU A 620 7.874 2.550 -12.511 1.00 0.00 C ATOM 1297 C LEU A 620 8.508 1.217 -12.126 1.00 0.00 C ATOM 1298 O LEU A 620 8.831 0.982 -10.964 1.00 0.00 O ATOM 1299 CB LEU A 620 6.531 2.294 -13.207 1.00 0.00 C ATOM 1300 CG LEU A 620 5.354 3.202 -12.812 1.00 0.00 C ATOM 1301 CD1 LEU A 620 4.144 2.354 -12.463 1.00 0.00 C ATOM 1302 CD2 LEU A 620 5.703 4.122 -11.650 1.00 0.00 C ATOM 0 H LEU A 620 8.275 3.852 -14.105 1.00 0.00 H new ATOM 0 HA LEU A 620 7.710 3.137 -11.608 1.00 0.00 H new ATOM 0 HB2 LEU A 620 6.684 2.387 -14.282 1.00 0.00 H new ATOM 0 HB3 LEU A 620 6.241 1.261 -13.014 1.00 0.00 H new ATOM 0 HG LEU A 620 5.124 3.836 -13.669 1.00 0.00 H new ATOM 0 HD11 LEU A 620 3.313 3.002 -12.184 1.00 0.00 H new ATOM 0 HD12 LEU A 620 3.860 1.752 -13.326 1.00 0.00 H new ATOM 0 HD13 LEU A 620 4.388 1.698 -11.628 1.00 0.00 H new ATOM 0 HD21 LEU A 620 4.841 4.744 -11.407 1.00 0.00 H new ATOM 0 HD22 LEU A 620 5.975 3.523 -10.781 1.00 0.00 H new ATOM 0 HD23 LEU A 620 6.543 4.758 -11.929 1.00 0.00 H new ATOM 1314 N ALA A 621 8.679 0.349 -13.116 1.00 0.00 N ATOM 1315 CA ALA A 621 9.272 -0.967 -12.903 1.00 0.00 C ATOM 1316 C ALA A 621 10.425 -0.917 -11.897 1.00 0.00 C ATOM 1317 O ALA A 621 10.442 -1.668 -10.923 1.00 0.00 O ATOM 1318 CB ALA A 621 9.764 -1.521 -14.232 1.00 0.00 C ATOM 0 H ALA A 621 8.413 0.535 -14.083 1.00 0.00 H new ATOM 0 HA ALA A 621 8.505 -1.620 -12.488 1.00 0.00 H new ATOM 0 HB1 ALA A 621 10.207 -2.504 -14.075 1.00 0.00 H new ATOM 0 HB2 ALA A 621 8.925 -1.607 -14.923 1.00 0.00 H new ATOM 0 HB3 ALA A 621 10.512 -0.849 -14.652 1.00 0.00 H new ATOM 1324 N LYS A 622 11.391 -0.034 -12.143 1.00 0.00 N ATOM 1325 CA LYS A 622 12.551 0.098 -11.268 1.00 0.00 C ATOM 1326 C LYS A 622 12.141 0.551 -9.878 1.00 0.00 C ATOM 1327 O LYS A 622 12.926 0.476 -8.932 1.00 0.00 O ATOM 1328 CB LYS A 622 13.550 1.092 -11.863 1.00 0.00 C ATOM 1329 CG LYS A 622 14.379 0.513 -12.999 1.00 0.00 C ATOM 1330 CD LYS A 622 14.786 1.588 -13.995 1.00 0.00 C ATOM 1331 CE LYS A 622 14.080 1.407 -15.328 1.00 0.00 C ATOM 1332 NZ LYS A 622 14.979 1.704 -16.477 1.00 0.00 N ATOM 0 H LYS A 622 11.392 0.600 -12.942 1.00 0.00 H new ATOM 0 HA LYS A 622 13.022 -0.882 -11.184 1.00 0.00 H new ATOM 0 HB2 LYS A 622 13.008 1.965 -12.227 1.00 0.00 H new ATOM 0 HB3 LYS A 622 14.219 1.438 -11.075 1.00 0.00 H new ATOM 0 HG2 LYS A 622 15.271 0.035 -12.593 1.00 0.00 H new ATOM 0 HG3 LYS A 622 13.807 -0.261 -13.511 1.00 0.00 H new ATOM 0 HD2 LYS A 622 14.550 2.571 -13.588 1.00 0.00 H new ATOM 0 HD3 LYS A 622 15.865 1.556 -14.146 1.00 0.00 H new ATOM 0 HE2 LYS A 622 13.714 0.384 -15.409 1.00 0.00 H new ATOM 0 HE3 LYS A 622 13.209 2.061 -15.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 622 14.460 1.569 -17.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 622 15.309 2.688 -16.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 622 15.797 1.063 -16.452 1.00 0.00 H new ATOM 1346 N LYS A 623 10.911 1.024 -9.760 1.00 0.00 N ATOM 1347 CA LYS A 623 10.402 1.493 -8.484 1.00 0.00 C ATOM 1348 C LYS A 623 10.058 0.328 -7.564 1.00 0.00 C ATOM 1349 O LYS A 623 10.210 -0.837 -7.931 1.00 0.00 O ATOM 1350 CB LYS A 623 9.165 2.364 -8.686 1.00 0.00 C ATOM 1351 CG LYS A 623 9.371 3.509 -9.660 1.00 0.00 C ATOM 1352 CD LYS A 623 10.004 4.711 -8.982 1.00 0.00 C ATOM 1353 CE LYS A 623 11.444 4.905 -9.427 1.00 0.00 C ATOM 1354 NZ LYS A 623 12.310 5.379 -8.313 1.00 0.00 N ATOM 0 H LYS A 623 10.248 1.093 -10.532 1.00 0.00 H new ATOM 0 HA LYS A 623 11.188 2.086 -8.017 1.00 0.00 H new ATOM 0 HB2 LYS A 623 8.347 1.739 -9.044 1.00 0.00 H new ATOM 0 HB3 LYS A 623 8.858 2.771 -7.722 1.00 0.00 H new ATOM 0 HG2 LYS A 623 10.005 3.178 -10.483 1.00 0.00 H new ATOM 0 HG3 LYS A 623 8.413 3.797 -10.092 1.00 0.00 H new ATOM 0 HD2 LYS A 623 9.427 5.606 -9.213 1.00 0.00 H new ATOM 0 HD3 LYS A 623 9.970 4.580 -7.900 1.00 0.00 H new ATOM 0 HE2 LYS A 623 11.834 3.964 -9.815 1.00 0.00 H new ATOM 0 HE3 LYS A 623 11.477 5.625 -10.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 623 13.284 5.499 -8.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 623 11.953 6.290 -7.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 623 12.299 4.680 -7.543 1.00 0.00 H new ATOM 1368 N SER A 624 9.585 0.658 -6.368 1.00 0.00 N ATOM 1369 CA SER A 624 9.204 -0.344 -5.385 1.00 0.00 C ATOM 1370 C SER A 624 8.253 0.257 -4.357 1.00 0.00 C ATOM 1371 O SER A 624 8.668 1.018 -3.482 1.00 0.00 O ATOM 1372 CB SER A 624 10.444 -0.904 -4.691 1.00 0.00 C ATOM 1373 OG SER A 624 11.599 -0.740 -5.497 1.00 0.00 O ATOM 0 H SER A 624 9.456 1.620 -6.056 1.00 0.00 H new ATOM 0 HA SER A 624 8.693 -1.158 -5.900 1.00 0.00 H new ATOM 0 HB2 SER A 624 10.589 -0.399 -3.736 1.00 0.00 H new ATOM 0 HB3 SER A 624 10.296 -1.962 -4.473 1.00 0.00 H new ATOM 0 HG SER A 624 12.379 -1.105 -5.029 1.00 0.00 H new ATOM 1379 N LEU A 625 6.973 -0.078 -4.474 1.00 0.00 N ATOM 1380 CA LEU A 625 5.959 0.439 -3.562 1.00 0.00 C ATOM 1381 C LEU A 625 5.966 -0.320 -2.241 1.00 0.00 C ATOM 1382 O LEU A 625 5.651 -1.508 -2.193 1.00 0.00 O ATOM 1383 CB LEU A 625 4.574 0.349 -4.206 1.00 0.00 C ATOM 1384 CG LEU A 625 3.431 0.913 -3.362 1.00 0.00 C ATOM 1385 CD1 LEU A 625 3.605 2.411 -3.167 1.00 0.00 C ATOM 1386 CD2 LEU A 625 2.091 0.609 -4.013 1.00 0.00 C ATOM 0 H LEU A 625 6.612 -0.706 -5.192 1.00 0.00 H new ATOM 0 HA LEU A 625 6.194 1.483 -3.357 1.00 0.00 H new ATOM 0 HB2 LEU A 625 4.598 0.878 -5.159 1.00 0.00 H new ATOM 0 HB3 LEU A 625 4.360 -0.697 -4.428 1.00 0.00 H new ATOM 0 HG LEU A 625 3.453 0.435 -2.383 1.00 0.00 H new ATOM 0 HD11 LEU A 625 2.783 2.797 -2.564 1.00 0.00 H new ATOM 0 HD12 LEU A 625 4.550 2.604 -2.659 1.00 0.00 H new ATOM 0 HD13 LEU A 625 3.607 2.907 -4.138 1.00 0.00 H new ATOM 0 HD21 LEU A 625 1.288 1.017 -3.400 1.00 0.00 H new ATOM 0 HD22 LEU A 625 2.057 1.062 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 625 1.967 -0.470 -4.103 1.00 0.00 H new ATOM 1398 N ASP A 626 6.322 0.377 -1.168 1.00 0.00 N ATOM 1399 CA ASP A 626 6.366 -0.230 0.156 1.00 0.00 C ATOM 1400 C ASP A 626 5.088 0.069 0.933 1.00 0.00 C ATOM 1401 O ASP A 626 4.952 1.135 1.534 1.00 0.00 O ATOM 1402 CB ASP A 626 7.580 0.279 0.934 1.00 0.00 C ATOM 1403 CG ASP A 626 7.731 -0.402 2.281 1.00 0.00 C ATOM 1404 OD1 ASP A 626 7.042 0.012 3.236 1.00 0.00 O ATOM 1405 OD2 ASP A 626 8.540 -1.349 2.380 1.00 0.00 O ATOM 0 H ASP A 626 6.584 1.362 -1.189 1.00 0.00 H new ATOM 0 HA ASP A 626 6.451 -1.309 0.031 1.00 0.00 H new ATOM 0 HB2 ASP A 626 8.481 0.114 0.344 1.00 0.00 H new ATOM 0 HB3 ASP A 626 7.488 1.355 1.082 1.00 0.00 H new ATOM 1410 N ILE A 627 4.156 -0.877 0.917 1.00 0.00 N ATOM 1411 CA ILE A 627 2.892 -0.715 1.624 1.00 0.00 C ATOM 1412 C ILE A 627 2.998 -1.248 3.047 1.00 0.00 C ATOM 1413 O ILE A 627 3.044 -2.459 3.266 1.00 0.00 O ATOM 1414 CB ILE A 627 1.741 -1.441 0.900 1.00 0.00 C ATOM 1415 CG1 ILE A 627 1.597 -0.914 -0.529 1.00 0.00 C ATOM 1416 CG2 ILE A 627 0.440 -1.270 1.668 1.00 0.00 C ATOM 1417 CD1 ILE A 627 2.149 -1.855 -1.578 1.00 0.00 C ATOM 0 H ILE A 627 4.252 -1.764 0.422 1.00 0.00 H new ATOM 0 HA ILE A 627 2.674 0.353 1.648 1.00 0.00 H new ATOM 0 HB ILE A 627 1.974 -2.505 0.853 1.00 0.00 H new ATOM 0 HG12 ILE A 627 0.543 -0.731 -0.736 1.00 0.00 H new ATOM 0 HG13 ILE A 627 2.109 0.045 -0.607 1.00 0.00 H new ATOM 0 HG21 ILE A 627 -0.363 -1.788 1.144 1.00 0.00 H new ATOM 0 HG22 ILE A 627 0.550 -1.689 2.668 1.00 0.00 H new ATOM 0 HG23 ILE A 627 0.199 -0.210 1.743 1.00 0.00 H new ATOM 0 HD11 ILE A 627 2.013 -1.417 -2.567 1.00 0.00 H new ATOM 0 HD12 ILE A 627 3.211 -2.019 -1.397 1.00 0.00 H new ATOM 0 HD13 ILE A 627 1.621 -2.807 -1.527 1.00 0.00 H new ATOM 1429 N SER A 628 3.043 -0.337 4.012 1.00 0.00 N ATOM 1430 CA SER A 628 3.154 -0.722 5.415 1.00 0.00 C ATOM 1431 C SER A 628 1.939 -0.259 6.211 1.00 0.00 C ATOM 1432 O SER A 628 1.477 0.872 6.063 1.00 0.00 O ATOM 1433 CB SER A 628 4.432 -0.144 6.026 1.00 0.00 C ATOM 1434 OG SER A 628 4.420 1.273 5.992 1.00 0.00 O ATOM 0 H SER A 628 3.005 0.669 3.851 1.00 0.00 H new ATOM 0 HA SER A 628 3.197 -1.810 5.461 1.00 0.00 H new ATOM 0 HB2 SER A 628 4.532 -0.485 7.056 1.00 0.00 H new ATOM 0 HB3 SER A 628 5.300 -0.516 5.481 1.00 0.00 H new ATOM 0 HG SER A 628 5.305 1.614 6.240 1.00 0.00 H new ATOM 1440 N VAL A 629 1.430 -1.147 7.059 1.00 0.00 N ATOM 1441 CA VAL A 629 0.272 -0.840 7.885 1.00 0.00 C ATOM 1442 C VAL A 629 0.675 -0.671 9.344 1.00 0.00 C ATOM 1443 O VAL A 629 1.367 -1.517 9.910 1.00 0.00 O ATOM 1444 CB VAL A 629 -0.796 -1.941 7.781 1.00 0.00 C ATOM 1445 CG1 VAL A 629 -2.078 -1.516 8.482 1.00 0.00 C ATOM 1446 CG2 VAL A 629 -1.059 -2.281 6.323 1.00 0.00 C ATOM 0 H VAL A 629 1.804 -2.087 7.191 1.00 0.00 H new ATOM 0 HA VAL A 629 -0.147 0.096 7.515 1.00 0.00 H new ATOM 0 HB VAL A 629 -0.424 -2.836 8.280 1.00 0.00 H new ATOM 0 HG11 VAL A 629 -2.820 -2.310 8.396 1.00 0.00 H new ATOM 0 HG12 VAL A 629 -1.871 -1.325 9.535 1.00 0.00 H new ATOM 0 HG13 VAL A 629 -2.463 -0.608 8.018 1.00 0.00 H new ATOM 0 HG21 VAL A 629 -1.817 -3.062 6.263 1.00 0.00 H new ATOM 0 HG22 VAL A 629 -1.411 -1.392 5.800 1.00 0.00 H new ATOM 0 HG23 VAL A 629 -0.137 -2.633 5.860 1.00 0.00 H new ATOM 1456 N TRP A 630 0.247 0.431 9.946 1.00 0.00 N ATOM 1457 CA TRP A 630 0.571 0.718 11.335 1.00 0.00 C ATOM 1458 C TRP A 630 -0.698 0.878 12.164 1.00 0.00 C ATOM 1459 O TRP A 630 -1.712 1.368 11.668 1.00 0.00 O ATOM 1460 CB TRP A 630 1.385 2.004 11.414 1.00 0.00 C ATOM 1461 CG TRP A 630 2.607 2.012 10.548 1.00 0.00 C ATOM 1462 CD1 TRP A 630 2.645 2.088 9.186 1.00 0.00 C ATOM 1463 CD2 TRP A 630 3.968 1.955 10.987 1.00 0.00 C ATOM 1464 NE1 TRP A 630 3.948 2.089 8.751 1.00 0.00 N ATOM 1465 CE2 TRP A 630 4.779 2.005 9.837 1.00 0.00 C ATOM 1466 CE3 TRP A 630 4.580 1.868 12.240 1.00 0.00 C ATOM 1467 CZ2 TRP A 630 6.170 1.972 9.905 1.00 0.00 C ATOM 1468 CZ3 TRP A 630 5.959 1.833 12.307 1.00 0.00 C ATOM 1469 CH2 TRP A 630 6.742 1.885 11.146 1.00 0.00 C ATOM 0 H TRP A 630 -0.327 1.142 9.492 1.00 0.00 H new ATOM 0 HA TRP A 630 1.149 -0.116 11.733 1.00 0.00 H new ATOM 0 HB2 TRP A 630 0.748 2.842 11.131 1.00 0.00 H new ATOM 0 HB3 TRP A 630 1.686 2.167 12.449 1.00 0.00 H new ATOM 0 HD1 TRP A 630 1.778 2.140 8.544 1.00 0.00 H new ATOM 0 HE1 TRP A 630 4.248 2.143 7.778 1.00 0.00 H new ATOM 0 HE3 TRP A 630 3.985 1.829 13.140 1.00 0.00 H new ATOM 0 HZ2 TRP A 630 6.775 2.014 9.011 1.00 0.00 H new ATOM 0 HZ3 TRP A 630 6.442 1.764 13.270 1.00 0.00 H new ATOM 0 HH2 TRP A 630 7.818 1.856 11.232 1.00 0.00 H new ATOM 1480 N ASP A 631 -0.635 0.486 13.433 1.00 0.00 N ATOM 1481 CA ASP A 631 -1.786 0.621 14.316 1.00 0.00 C ATOM 1482 C ASP A 631 -1.742 1.970 15.023 1.00 0.00 C ATOM 1483 O ASP A 631 -0.779 2.290 15.719 1.00 0.00 O ATOM 1484 CB ASP A 631 -1.830 -0.517 15.334 1.00 0.00 C ATOM 1485 CG ASP A 631 -0.936 -0.271 16.528 1.00 0.00 C ATOM 1486 OD1 ASP A 631 -1.219 0.666 17.303 1.00 0.00 O ATOM 1487 OD2 ASP A 631 0.041 -1.028 16.698 1.00 0.00 O ATOM 0 H ASP A 631 0.192 0.077 13.868 1.00 0.00 H new ATOM 0 HA ASP A 631 -2.693 0.566 13.714 1.00 0.00 H new ATOM 0 HB2 ASP A 631 -2.856 -0.653 15.676 1.00 0.00 H new ATOM 0 HB3 ASP A 631 -1.531 -1.445 14.847 1.00 0.00 H new ATOM 1492 N TYR A 632 -2.781 2.766 14.820 1.00 0.00 N ATOM 1493 CA TYR A 632 -2.861 4.091 15.420 1.00 0.00 C ATOM 1494 C TYR A 632 -3.162 4.003 16.911 1.00 0.00 C ATOM 1495 O TYR A 632 -3.575 2.957 17.412 1.00 0.00 O ATOM 1496 CB TYR A 632 -3.935 4.921 14.719 1.00 0.00 C ATOM 1497 CG TYR A 632 -4.013 6.345 15.210 1.00 0.00 C ATOM 1498 CD1 TYR A 632 -4.725 6.665 16.358 1.00 0.00 C ATOM 1499 CD2 TYR A 632 -3.375 7.369 14.525 1.00 0.00 C ATOM 1500 CE1 TYR A 632 -4.801 7.967 16.809 1.00 0.00 C ATOM 1501 CE2 TYR A 632 -3.444 8.673 14.967 1.00 0.00 C ATOM 1502 CZ TYR A 632 -4.159 8.971 16.110 1.00 0.00 C ATOM 1503 OH TYR A 632 -4.232 10.270 16.556 1.00 0.00 O ATOM 0 H TYR A 632 -3.584 2.517 14.242 1.00 0.00 H new ATOM 0 HA TYR A 632 -1.893 4.576 15.297 1.00 0.00 H new ATOM 0 HB2 TYR A 632 -3.737 4.925 13.647 1.00 0.00 H new ATOM 0 HB3 TYR A 632 -4.904 4.442 14.862 1.00 0.00 H new ATOM 0 HD1 TYR A 632 -5.228 5.882 16.907 1.00 0.00 H new ATOM 0 HD2 TYR A 632 -2.815 7.141 13.630 1.00 0.00 H new ATOM 0 HE1 TYR A 632 -5.359 8.200 17.704 1.00 0.00 H new ATOM 0 HE2 TYR A 632 -2.941 9.458 14.422 1.00 0.00 H new ATOM 0 HH TYR A 632 -3.725 10.852 15.952 1.00 0.00 H new ATOM 1513 N ASP A 633 -2.954 5.112 17.614 1.00 0.00 N ATOM 1514 CA ASP A 633 -3.203 5.167 19.050 1.00 0.00 C ATOM 1515 C ASP A 633 -3.369 6.610 19.517 1.00 0.00 C ATOM 1516 O ASP A 633 -2.454 7.424 19.386 1.00 0.00 O ATOM 1517 CB ASP A 633 -2.058 4.499 19.813 1.00 0.00 C ATOM 1518 CG ASP A 633 -2.173 2.987 19.823 1.00 0.00 C ATOM 1519 OD1 ASP A 633 -1.803 2.357 18.809 1.00 0.00 O ATOM 1520 OD2 ASP A 633 -2.632 2.434 20.843 1.00 0.00 O ATOM 0 H ASP A 633 -2.613 5.985 17.212 1.00 0.00 H new ATOM 0 HA ASP A 633 -4.128 4.629 19.255 1.00 0.00 H new ATOM 0 HB2 ASP A 633 -1.108 4.785 19.361 1.00 0.00 H new ATOM 0 HB3 ASP A 633 -2.046 4.866 20.839 1.00 0.00 H new ATOM 1525 N ILE A 634 -4.540 6.918 20.065 1.00 0.00 N ATOM 1526 CA ILE A 634 -4.820 8.266 20.556 1.00 0.00 C ATOM 1527 C ILE A 634 -4.154 8.505 21.904 1.00 0.00 C ATOM 1528 O ILE A 634 -4.269 7.689 22.819 1.00 0.00 O ATOM 1529 CB ILE A 634 -6.336 8.547 20.693 1.00 0.00 C ATOM 1530 CG1 ILE A 634 -7.136 7.245 20.809 1.00 0.00 C ATOM 1531 CG2 ILE A 634 -6.828 9.377 19.517 1.00 0.00 C ATOM 1532 CD1 ILE A 634 -7.422 6.584 19.478 1.00 0.00 C ATOM 0 H ILE A 634 -5.308 6.257 20.181 1.00 0.00 H new ATOM 0 HA ILE A 634 -4.411 8.948 19.811 1.00 0.00 H new ATOM 0 HB ILE A 634 -6.492 9.114 21.611 1.00 0.00 H new ATOM 0 HG12 ILE A 634 -6.587 6.547 21.440 1.00 0.00 H new ATOM 0 HG13 ILE A 634 -8.081 7.453 21.311 1.00 0.00 H new ATOM 0 HG21 ILE A 634 -7.896 9.567 19.627 1.00 0.00 H new ATOM 0 HG22 ILE A 634 -6.292 10.326 19.491 1.00 0.00 H new ATOM 0 HG23 ILE A 634 -6.650 8.834 18.589 1.00 0.00 H new ATOM 0 HD11 ILE A 634 -7.991 5.669 19.641 1.00 0.00 H new ATOM 0 HD12 ILE A 634 -7.999 7.264 18.851 1.00 0.00 H new ATOM 0 HD13 ILE A 634 -6.482 6.343 18.982 1.00 0.00 H new ATOM 1544 N GLY A 635 -3.453 9.629 22.020 1.00 0.00 N ATOM 1545 CA GLY A 635 -2.776 9.956 23.260 1.00 0.00 C ATOM 1546 C GLY A 635 -1.501 9.158 23.452 1.00 0.00 C ATOM 1547 O GLY A 635 -0.777 9.356 24.426 1.00 0.00 O ATOM 0 H GLY A 635 -3.342 10.319 21.277 1.00 0.00 H new ATOM 0 HA2 GLY A 635 -2.540 11.020 23.272 1.00 0.00 H new ATOM 0 HA3 GLY A 635 -3.448 9.769 24.098 1.00 0.00 H new ATOM 1551 N LYS A 636 -1.228 8.253 22.518 1.00 0.00 N ATOM 1552 CA LYS A 636 -0.032 7.419 22.588 1.00 0.00 C ATOM 1553 C LYS A 636 0.667 7.358 21.233 1.00 0.00 C ATOM 1554 O LYS A 636 0.355 8.130 20.327 1.00 0.00 O ATOM 1555 CB LYS A 636 -0.389 6.006 23.054 1.00 0.00 C ATOM 1556 CG LYS A 636 -1.852 5.838 23.434 1.00 0.00 C ATOM 1557 CD LYS A 636 -2.156 4.410 23.859 1.00 0.00 C ATOM 1558 CE LYS A 636 -3.368 4.349 24.774 1.00 0.00 C ATOM 1559 NZ LYS A 636 -3.862 2.956 24.951 1.00 0.00 N ATOM 0 H LYS A 636 -1.818 8.078 21.704 1.00 0.00 H new ATOM 0 HA LYS A 636 0.649 7.868 23.311 1.00 0.00 H new ATOM 0 HB2 LYS A 636 -0.146 5.299 22.261 1.00 0.00 H new ATOM 0 HB3 LYS A 636 0.232 5.748 23.912 1.00 0.00 H new ATOM 0 HG2 LYS A 636 -2.099 6.521 24.247 1.00 0.00 H new ATOM 0 HG3 LYS A 636 -2.483 6.109 22.587 1.00 0.00 H new ATOM 0 HD2 LYS A 636 -2.334 3.796 22.976 1.00 0.00 H new ATOM 0 HD3 LYS A 636 -1.290 3.989 24.371 1.00 0.00 H new ATOM 0 HE2 LYS A 636 -3.110 4.769 25.746 1.00 0.00 H new ATOM 0 HE3 LYS A 636 -4.165 4.967 24.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 636 -4.689 2.958 25.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 636 -4.133 2.564 24.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 636 -3.110 2.371 25.369 1.00 0.00 H new ATOM 1573 N SER A 637 1.615 6.435 21.103 1.00 0.00 N ATOM 1574 CA SER A 637 2.357 6.273 19.859 1.00 0.00 C ATOM 1575 C SER A 637 1.765 5.149 19.014 1.00 0.00 C ATOM 1576 O SER A 637 1.122 4.239 19.539 1.00 0.00 O ATOM 1577 CB SER A 637 3.830 5.984 20.153 1.00 0.00 C ATOM 1578 OG SER A 637 4.402 7.005 20.952 1.00 0.00 O ATOM 0 H SER A 637 1.887 5.789 21.844 1.00 0.00 H new ATOM 0 HA SER A 637 2.282 7.204 19.297 1.00 0.00 H new ATOM 0 HB2 SER A 637 3.921 5.025 20.663 1.00 0.00 H new ATOM 0 HB3 SER A 637 4.381 5.900 19.216 1.00 0.00 H new ATOM 0 HG SER A 637 5.343 6.795 21.127 1.00 0.00 H new ATOM 1584 N ASN A 638 1.986 5.218 17.705 1.00 0.00 N ATOM 1585 CA ASN A 638 1.473 4.205 16.789 1.00 0.00 C ATOM 1586 C ASN A 638 2.365 2.969 16.790 1.00 0.00 C ATOM 1587 O ASN A 638 3.267 2.841 17.619 1.00 0.00 O ATOM 1588 CB ASN A 638 1.373 4.774 15.372 1.00 0.00 C ATOM 1589 CG ASN A 638 2.734 4.982 14.737 1.00 0.00 C ATOM 1590 OD1 ASN A 638 3.598 4.107 14.792 1.00 0.00 O ATOM 1591 ND2 ASN A 638 2.931 6.145 14.128 1.00 0.00 N ATOM 0 H ASN A 638 2.516 5.964 17.255 1.00 0.00 H new ATOM 0 HA ASN A 638 0.479 3.914 17.128 1.00 0.00 H new ATOM 0 HB2 ASN A 638 0.785 4.097 14.752 1.00 0.00 H new ATOM 0 HB3 ASN A 638 0.839 5.724 15.401 1.00 0.00 H new ATOM 0 HD21 ASN A 638 3.827 6.342 13.681 1.00 0.00 H new ATOM 0 HD22 ASN A 638 2.187 6.842 14.107 1.00 0.00 H new ATOM 1598 N ASP A 639 2.108 2.058 15.856 1.00 0.00 N ATOM 1599 CA ASP A 639 2.888 0.831 15.751 1.00 0.00 C ATOM 1600 C ASP A 639 2.748 0.206 14.371 1.00 0.00 C ATOM 1601 O ASP A 639 1.781 0.464 13.654 1.00 0.00 O ATOM 1602 CB ASP A 639 2.442 -0.177 16.808 1.00 0.00 C ATOM 1603 CG ASP A 639 3.534 -0.487 17.813 1.00 0.00 C ATOM 1604 OD1 ASP A 639 4.604 -0.977 17.394 1.00 0.00 O ATOM 1605 OD2 ASP A 639 3.318 -0.243 19.019 1.00 0.00 O ATOM 0 H ASP A 639 1.366 2.147 15.162 1.00 0.00 H new ATOM 0 HA ASP A 639 3.934 1.092 15.914 1.00 0.00 H new ATOM 0 HB2 ASP A 639 1.570 0.214 17.333 1.00 0.00 H new ATOM 0 HB3 ASP A 639 2.132 -1.100 16.317 1.00 0.00 H new ATOM 1610 N TYR A 640 3.714 -0.628 14.008 1.00 0.00 N ATOM 1611 CA TYR A 640 3.696 -1.303 12.719 1.00 0.00 C ATOM 1612 C TYR A 640 2.963 -2.637 12.822 1.00 0.00 C ATOM 1613 O TYR A 640 3.432 -3.565 13.478 1.00 0.00 O ATOM 1614 CB TYR A 640 5.125 -1.528 12.219 1.00 0.00 C ATOM 1615 CG TYR A 640 5.208 -1.840 10.741 1.00 0.00 C ATOM 1616 CD1 TYR A 640 4.471 -2.879 10.191 1.00 0.00 C ATOM 1617 CD2 TYR A 640 6.021 -1.094 9.900 1.00 0.00 C ATOM 1618 CE1 TYR A 640 4.544 -3.168 8.843 1.00 0.00 C ATOM 1619 CE2 TYR A 640 6.098 -1.376 8.549 1.00 0.00 C ATOM 1620 CZ TYR A 640 5.360 -2.414 8.026 1.00 0.00 C ATOM 1621 OH TYR A 640 5.436 -2.700 6.682 1.00 0.00 O ATOM 0 H TYR A 640 4.521 -0.853 14.590 1.00 0.00 H new ATOM 0 HA TYR A 640 3.167 -0.670 12.007 1.00 0.00 H new ATOM 0 HB2 TYR A 640 5.718 -0.638 12.428 1.00 0.00 H new ATOM 0 HB3 TYR A 640 5.572 -2.348 12.781 1.00 0.00 H new ATOM 0 HD1 TYR A 640 3.830 -3.471 10.828 1.00 0.00 H new ATOM 0 HD2 TYR A 640 6.603 -0.280 10.307 1.00 0.00 H new ATOM 0 HE1 TYR A 640 3.965 -3.981 8.430 1.00 0.00 H new ATOM 0 HE2 TYR A 640 6.734 -0.785 7.907 1.00 0.00 H new ATOM 0 HH TYR A 640 5.056 -3.588 6.514 1.00 0.00 H new ATOM 1631 N ILE A 641 1.810 -2.723 12.168 1.00 0.00 N ATOM 1632 CA ILE A 641 1.014 -3.944 12.184 1.00 0.00 C ATOM 1633 C ILE A 641 1.517 -4.932 11.138 1.00 0.00 C ATOM 1634 O ILE A 641 1.872 -6.066 11.461 1.00 0.00 O ATOM 1635 CB ILE A 641 -0.478 -3.648 11.928 1.00 0.00 C ATOM 1636 CG1 ILE A 641 -1.090 -2.936 13.135 1.00 0.00 C ATOM 1637 CG2 ILE A 641 -1.236 -4.934 11.629 1.00 0.00 C ATOM 1638 CD1 ILE A 641 -2.543 -2.554 12.944 1.00 0.00 C ATOM 0 H ILE A 641 1.406 -1.963 11.621 1.00 0.00 H new ATOM 0 HA ILE A 641 1.119 -4.382 13.176 1.00 0.00 H new ATOM 0 HB ILE A 641 -0.557 -2.994 11.059 1.00 0.00 H new ATOM 0 HG12 ILE A 641 -1.005 -3.582 14.008 1.00 0.00 H new ATOM 0 HG13 ILE A 641 -0.512 -2.037 13.347 1.00 0.00 H new ATOM 0 HG21 ILE A 641 -2.287 -4.704 11.451 1.00 0.00 H new ATOM 0 HG22 ILE A 641 -0.813 -5.408 10.743 1.00 0.00 H new ATOM 0 HG23 ILE A 641 -1.152 -5.612 12.478 1.00 0.00 H new ATOM 0 HD11 ILE A 641 -2.909 -2.054 13.841 1.00 0.00 H new ATOM 0 HD12 ILE A 641 -2.633 -1.882 12.091 1.00 0.00 H new ATOM 0 HD13 ILE A 641 -3.134 -3.452 12.763 1.00 0.00 H new ATOM 1650 N GLY A 642 1.550 -4.495 9.883 1.00 0.00 N ATOM 1651 CA GLY A 642 2.017 -5.356 8.813 1.00 0.00 C ATOM 1652 C GLY A 642 1.977 -4.681 7.455 1.00 0.00 C ATOM 1653 O GLY A 642 1.221 -3.734 7.243 1.00 0.00 O ATOM 0 H GLY A 642 1.262 -3.562 9.589 1.00 0.00 H new ATOM 0 HA2 GLY A 642 3.038 -5.672 9.027 1.00 0.00 H new ATOM 0 HA3 GLY A 642 1.404 -6.257 8.784 1.00 0.00 H new ATOM 1657 N GLY A 643 2.799 -5.177 6.536 1.00 0.00 N ATOM 1658 CA GLY A 643 2.854 -4.615 5.199 1.00 0.00 C ATOM 1659 C GLY A 643 3.642 -5.484 4.238 1.00 0.00 C ATOM 1660 O GLY A 643 3.690 -6.705 4.393 1.00 0.00 O ATOM 0 H GLY A 643 3.431 -5.962 6.695 1.00 0.00 H new ATOM 0 HA2 GLY A 643 1.840 -4.486 4.820 1.00 0.00 H new ATOM 0 HA3 GLY A 643 3.306 -3.624 5.243 1.00 0.00 H new ATOM 1664 N CYS A 644 4.262 -4.856 3.245 1.00 0.00 N ATOM 1665 CA CYS A 644 5.052 -5.582 2.257 1.00 0.00 C ATOM 1666 C CYS A 644 5.622 -4.630 1.210 1.00 0.00 C ATOM 1667 O CYS A 644 5.282 -3.448 1.180 1.00 0.00 O ATOM 1668 CB CYS A 644 4.198 -6.655 1.580 1.00 0.00 C ATOM 1669 SG CYS A 644 4.594 -8.344 2.091 1.00 0.00 S ATOM 0 H CYS A 644 4.233 -3.846 3.103 1.00 0.00 H new ATOM 0 HA CYS A 644 5.883 -6.063 2.774 1.00 0.00 H new ATOM 0 HB2 CYS A 644 3.148 -6.458 1.796 1.00 0.00 H new ATOM 0 HB3 CYS A 644 4.322 -6.575 0.500 1.00 0.00 H new ATOM 0 HG CYS A 644 4.538 -8.430 3.387 1.00 0.00 H new ATOM 1675 N GLN A 645 6.490 -5.156 0.350 1.00 0.00 N ATOM 1676 CA GLN A 645 7.107 -4.353 -0.700 1.00 0.00 C ATOM 1677 C GLN A 645 6.564 -4.740 -2.072 1.00 0.00 C ATOM 1678 O GLN A 645 6.397 -5.921 -2.373 1.00 0.00 O ATOM 1679 CB GLN A 645 8.626 -4.524 -0.674 1.00 0.00 C ATOM 1680 CG GLN A 645 9.341 -3.492 0.183 1.00 0.00 C ATOM 1681 CD GLN A 645 10.817 -3.793 0.350 1.00 0.00 C ATOM 1682 OE1 GLN A 645 11.426 -4.450 -0.495 1.00 0.00 O ATOM 1683 NE2 GLN A 645 11.400 -3.313 1.441 1.00 0.00 N ATOM 0 H GLN A 645 6.781 -6.133 0.360 1.00 0.00 H new ATOM 0 HA GLN A 645 6.862 -3.307 -0.514 1.00 0.00 H new ATOM 0 HB2 GLN A 645 8.865 -5.521 -0.302 1.00 0.00 H new ATOM 0 HB3 GLN A 645 9.007 -4.464 -1.693 1.00 0.00 H new ATOM 0 HG2 GLN A 645 9.224 -2.507 -0.268 1.00 0.00 H new ATOM 0 HG3 GLN A 645 8.869 -3.451 1.165 1.00 0.00 H new ATOM 0 HE21 GLN A 645 10.856 -2.774 2.115 1.00 0.00 H new ATOM 0 HE22 GLN A 645 12.392 -3.483 1.606 1.00 0.00 H new ATOM 1692 N LEU A 646 6.285 -3.736 -2.897 1.00 0.00 N ATOM 1693 CA LEU A 646 5.757 -3.971 -4.234 1.00 0.00 C ATOM 1694 C LEU A 646 6.624 -3.306 -5.297 1.00 0.00 C ATOM 1695 O LEU A 646 6.395 -2.157 -5.674 1.00 0.00 O ATOM 1696 CB LEU A 646 4.322 -3.455 -4.334 1.00 0.00 C ATOM 1697 CG LEU A 646 3.260 -4.406 -3.786 1.00 0.00 C ATOM 1698 CD1 LEU A 646 1.874 -3.989 -4.259 1.00 0.00 C ATOM 1699 CD2 LEU A 646 3.564 -5.838 -4.207 1.00 0.00 C ATOM 0 H LEU A 646 6.416 -2.752 -2.662 1.00 0.00 H new ATOM 0 HA LEU A 646 5.766 -5.046 -4.412 1.00 0.00 H new ATOM 0 HB2 LEU A 646 4.253 -2.508 -3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 646 4.098 -3.246 -5.380 1.00 0.00 H new ATOM 0 HG LEU A 646 3.278 -4.356 -2.697 1.00 0.00 H new ATOM 0 HD11 LEU A 646 1.130 -4.678 -3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 646 1.659 -2.979 -3.909 1.00 0.00 H new ATOM 0 HD13 LEU A 646 1.839 -4.011 -5.348 1.00 0.00 H new ATOM 0 HD21 LEU A 646 2.799 -6.504 -3.809 1.00 0.00 H new ATOM 0 HD22 LEU A 646 3.572 -5.903 -5.295 1.00 0.00 H new ATOM 0 HD23 LEU A 646 4.539 -6.132 -3.818 1.00 0.00 H new ATOM 1711 N GLY A 647 7.614 -4.045 -5.783 1.00 0.00 N ATOM 1712 CA GLY A 647 8.502 -3.528 -6.807 1.00 0.00 C ATOM 1713 C GLY A 647 8.821 -4.578 -7.848 1.00 0.00 C ATOM 1714 O GLY A 647 8.854 -5.770 -7.541 1.00 0.00 O ATOM 0 H GLY A 647 7.818 -4.999 -5.484 1.00 0.00 H new ATOM 0 HA2 GLY A 647 8.041 -2.666 -7.288 1.00 0.00 H new ATOM 0 HA3 GLY A 647 9.426 -3.179 -6.346 1.00 0.00 H new ATOM 1718 N ILE A 648 9.043 -4.149 -9.085 1.00 0.00 N ATOM 1719 CA ILE A 648 9.339 -5.072 -10.156 1.00 0.00 C ATOM 1720 C ILE A 648 10.617 -5.864 -9.879 1.00 0.00 C ATOM 1721 O ILE A 648 10.906 -6.853 -10.550 1.00 0.00 O ATOM 1722 CB ILE A 648 9.427 -4.334 -11.503 1.00 0.00 C ATOM 1723 CG1 ILE A 648 8.770 -5.164 -12.588 1.00 0.00 C ATOM 1724 CG2 ILE A 648 10.860 -3.989 -11.868 1.00 0.00 C ATOM 1725 CD1 ILE A 648 9.056 -4.675 -13.988 1.00 0.00 C ATOM 0 H ILE A 648 9.022 -3.168 -9.363 1.00 0.00 H new ATOM 0 HA ILE A 648 8.519 -5.788 -10.212 1.00 0.00 H new ATOM 0 HB ILE A 648 8.892 -3.389 -11.408 1.00 0.00 H new ATOM 0 HG12 ILE A 648 9.108 -6.196 -12.498 1.00 0.00 H new ATOM 0 HG13 ILE A 648 7.692 -5.167 -12.427 1.00 0.00 H new ATOM 0 HG21 ILE A 648 10.876 -3.469 -12.826 1.00 0.00 H new ATOM 0 HG22 ILE A 648 11.287 -3.346 -11.098 1.00 0.00 H new ATOM 0 HG23 ILE A 648 11.447 -4.904 -11.942 1.00 0.00 H new ATOM 0 HD11 ILE A 648 8.552 -5.319 -14.708 1.00 0.00 H new ATOM 0 HD12 ILE A 648 8.692 -3.653 -14.098 1.00 0.00 H new ATOM 0 HD13 ILE A 648 10.131 -4.699 -14.169 1.00 0.00 H new ATOM 1737 N SER A 649 11.368 -5.435 -8.870 1.00 0.00 N ATOM 1738 CA SER A 649 12.593 -6.124 -8.491 1.00 0.00 C ATOM 1739 C SER A 649 12.276 -7.224 -7.484 1.00 0.00 C ATOM 1740 O SER A 649 13.166 -7.757 -6.822 1.00 0.00 O ATOM 1741 CB SER A 649 13.599 -5.138 -7.895 1.00 0.00 C ATOM 1742 OG SER A 649 14.897 -5.705 -7.835 1.00 0.00 O ATOM 0 H SER A 649 11.150 -4.616 -8.303 1.00 0.00 H new ATOM 0 HA SER A 649 13.035 -6.571 -9.382 1.00 0.00 H new ATOM 0 HB2 SER A 649 13.623 -4.230 -8.498 1.00 0.00 H new ATOM 0 HB3 SER A 649 13.279 -4.848 -6.894 1.00 0.00 H new ATOM 0 HG SER A 649 14.837 -6.625 -7.503 1.00 0.00 H new ATOM 1748 N ALA A 650 10.988 -7.549 -7.370 1.00 0.00 N ATOM 1749 CA ALA A 650 10.524 -8.573 -6.446 1.00 0.00 C ATOM 1750 C ALA A 650 10.378 -9.922 -7.138 1.00 0.00 C ATOM 1751 O ALA A 650 10.211 -9.994 -8.356 1.00 0.00 O ATOM 1752 CB ALA A 650 9.192 -8.155 -5.842 1.00 0.00 C ATOM 0 H ALA A 650 10.245 -7.111 -7.914 1.00 0.00 H new ATOM 0 HA ALA A 650 11.268 -8.679 -5.657 1.00 0.00 H new ATOM 0 HB1 ALA A 650 8.848 -8.925 -5.151 1.00 0.00 H new ATOM 0 HB2 ALA A 650 9.315 -7.214 -5.305 1.00 0.00 H new ATOM 0 HB3 ALA A 650 8.457 -8.026 -6.636 1.00 0.00 H new ATOM 1802 N ARG A 654 4.510 -10.480 -5.749 1.00 0.00 N ATOM 1803 CA ARG A 654 4.421 -9.026 -5.747 1.00 0.00 C ATOM 1804 C ARG A 654 4.795 -8.457 -7.111 1.00 0.00 C ATOM 1805 O ARG A 654 4.234 -7.453 -7.550 1.00 0.00 O ATOM 1806 CB ARG A 654 5.325 -8.439 -4.668 1.00 0.00 C ATOM 1807 CG ARG A 654 4.878 -8.778 -3.257 1.00 0.00 C ATOM 1808 CD ARG A 654 6.035 -8.689 -2.282 1.00 0.00 C ATOM 1809 NE ARG A 654 6.188 -9.911 -1.495 1.00 0.00 N ATOM 1810 CZ ARG A 654 6.944 -10.940 -1.868 1.00 0.00 C ATOM 1811 NH1 ARG A 654 7.604 -10.903 -3.018 1.00 0.00 N ATOM 1812 NH2 ARG A 654 7.039 -12.010 -1.091 1.00 0.00 N ATOM 0 HA ARG A 654 3.389 -8.750 -5.530 1.00 0.00 H new ATOM 0 HB2 ARG A 654 6.341 -8.805 -4.817 1.00 0.00 H new ATOM 0 HB3 ARG A 654 5.357 -7.355 -4.781 1.00 0.00 H new ATOM 0 HG2 ARG A 654 4.086 -8.095 -2.949 1.00 0.00 H new ATOM 0 HG3 ARG A 654 4.458 -9.784 -3.237 1.00 0.00 H new ATOM 0 HD2 ARG A 654 6.956 -8.494 -2.831 1.00 0.00 H new ATOM 0 HD3 ARG A 654 5.879 -7.844 -1.611 1.00 0.00 H new ATOM 0 HE ARG A 654 5.687 -9.979 -0.609 1.00 0.00 H new ATOM 0 HH11 ARG A 654 7.533 -10.083 -3.621 1.00 0.00 H new ATOM 0 HH12 ARG A 654 8.182 -11.694 -3.300 1.00 0.00 H new ATOM 0 HH21 ARG A 654 6.532 -12.045 -0.207 1.00 0.00 H new ATOM 0 HH22 ARG A 654 7.619 -12.799 -1.378 1.00 0.00 H new ATOM 1826 N LEU A 655 5.739 -9.108 -7.780 1.00 0.00 N ATOM 1827 CA LEU A 655 6.176 -8.668 -9.098 1.00 0.00 C ATOM 1828 C LEU A 655 5.028 -8.744 -10.093 1.00 0.00 C ATOM 1829 O LEU A 655 4.933 -7.934 -11.013 1.00 0.00 O ATOM 1830 CB LEU A 655 7.346 -9.523 -9.590 1.00 0.00 C ATOM 1831 CG LEU A 655 7.834 -9.192 -11.001 1.00 0.00 C ATOM 1832 CD1 LEU A 655 8.621 -7.892 -10.995 1.00 0.00 C ATOM 1833 CD2 LEU A 655 8.680 -10.327 -11.557 1.00 0.00 C ATOM 0 H LEU A 655 6.215 -9.940 -7.432 1.00 0.00 H new ATOM 0 HA LEU A 655 6.506 -7.632 -9.017 1.00 0.00 H new ATOM 0 HB2 LEU A 655 8.179 -9.408 -8.896 1.00 0.00 H new ATOM 0 HB3 LEU A 655 7.049 -10.571 -9.560 1.00 0.00 H new ATOM 0 HG LEU A 655 6.965 -9.068 -11.647 1.00 0.00 H new ATOM 0 HD11 LEU A 655 8.962 -7.669 -12.006 1.00 0.00 H new ATOM 0 HD12 LEU A 655 7.983 -7.082 -10.640 1.00 0.00 H new ATOM 0 HD13 LEU A 655 9.483 -7.991 -10.335 1.00 0.00 H new ATOM 0 HD21 LEU A 655 9.017 -10.071 -12.562 1.00 0.00 H new ATOM 0 HD22 LEU A 655 9.545 -10.485 -10.913 1.00 0.00 H new ATOM 0 HD23 LEU A 655 8.085 -11.239 -11.595 1.00 0.00 H new ATOM 1845 N LYS A 656 4.158 -9.730 -9.902 1.00 0.00 N ATOM 1846 CA LYS A 656 3.013 -9.921 -10.781 1.00 0.00 C ATOM 1847 C LYS A 656 2.047 -8.744 -10.689 1.00 0.00 C ATOM 1848 O LYS A 656 1.775 -8.077 -11.684 1.00 0.00 O ATOM 1849 CB LYS A 656 2.289 -11.223 -10.431 1.00 0.00 C ATOM 1850 CG LYS A 656 2.912 -12.452 -11.071 1.00 0.00 C ATOM 1851 CD LYS A 656 2.675 -13.697 -10.232 1.00 0.00 C ATOM 1852 CE LYS A 656 1.227 -14.150 -10.304 1.00 0.00 C ATOM 1853 NZ LYS A 656 0.818 -14.484 -11.697 1.00 0.00 N ATOM 0 H LYS A 656 4.225 -10.410 -9.144 1.00 0.00 H new ATOM 0 HA LYS A 656 3.380 -9.981 -11.806 1.00 0.00 H new ATOM 0 HB2 LYS A 656 2.286 -11.349 -9.348 1.00 0.00 H new ATOM 0 HB3 LYS A 656 1.248 -11.147 -10.746 1.00 0.00 H new ATOM 0 HG2 LYS A 656 2.492 -12.597 -12.066 1.00 0.00 H new ATOM 0 HG3 LYS A 656 3.983 -12.295 -11.196 1.00 0.00 H new ATOM 0 HD2 LYS A 656 3.326 -14.500 -10.578 1.00 0.00 H new ATOM 0 HD3 LYS A 656 2.943 -13.494 -9.195 1.00 0.00 H new ATOM 0 HE2 LYS A 656 1.087 -15.022 -9.666 1.00 0.00 H new ATOM 0 HE3 LYS A 656 0.581 -13.363 -9.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 656 -0.005 -15.120 -11.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 656 0.567 -13.611 -12.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 656 1.606 -14.955 -12.187 1.00 0.00 H new ATOM 1867 N HIS A 657 1.533 -8.491 -9.491 1.00 0.00 N ATOM 1868 CA HIS A 657 0.598 -7.393 -9.279 1.00 0.00 C ATOM 1869 C HIS A 657 1.217 -6.068 -9.705 1.00 0.00 C ATOM 1870 O HIS A 657 0.645 -5.324 -10.501 1.00 0.00 O ATOM 1871 CB HIS A 657 0.183 -7.324 -7.808 1.00 0.00 C ATOM 1872 CG HIS A 657 -1.029 -6.481 -7.566 1.00 0.00 C ATOM 1873 ND1 HIS A 657 -1.156 -5.636 -6.481 1.00 0.00 N ATOM 1874 CD2 HIS A 657 -2.179 -6.358 -8.271 1.00 0.00 C ATOM 1875 CE1 HIS A 657 -2.330 -5.032 -6.531 1.00 0.00 C ATOM 1876 NE2 HIS A 657 -2.969 -5.453 -7.606 1.00 0.00 N ATOM 0 H HIS A 657 1.748 -9.031 -8.653 1.00 0.00 H new ATOM 0 HA HIS A 657 -0.286 -7.577 -9.890 1.00 0.00 H new ATOM 0 HB2 HIS A 657 -0.009 -8.334 -7.446 1.00 0.00 H new ATOM 0 HB3 HIS A 657 1.013 -6.928 -7.223 1.00 0.00 H new ATOM 0 HD1 HIS A 657 -0.453 -5.500 -5.754 1.00 0.00 H new ATOM 0 HD2 HIS A 657 -2.428 -6.875 -9.186 1.00 0.00 H new ATOM 0 HE1 HIS A 657 -2.703 -4.316 -5.814 1.00 0.00 H new ATOM 1885 N TRP A 658 2.396 -5.784 -9.168 1.00 0.00 N ATOM 1886 CA TRP A 658 3.108 -4.554 -9.484 1.00 0.00 C ATOM 1887 C TRP A 658 3.411 -4.466 -10.977 1.00 0.00 C ATOM 1888 O TRP A 658 2.720 -3.776 -11.726 1.00 0.00 O ATOM 1889 CB TRP A 658 4.410 -4.488 -8.685 1.00 0.00 C ATOM 1890 CG TRP A 658 5.308 -3.366 -9.104 1.00 0.00 C ATOM 1891 CD1 TRP A 658 6.504 -3.471 -9.755 1.00 0.00 C ATOM 1892 CD2 TRP A 658 5.081 -1.970 -8.899 1.00 0.00 C ATOM 1893 NE1 TRP A 658 7.035 -2.221 -9.969 1.00 0.00 N ATOM 1894 CE2 TRP A 658 6.177 -1.282 -9.452 1.00 0.00 C ATOM 1895 CE3 TRP A 658 4.053 -1.234 -8.302 1.00 0.00 C ATOM 1896 CZ2 TRP A 658 6.272 0.106 -9.426 1.00 0.00 C ATOM 1897 CZ3 TRP A 658 4.150 0.144 -8.275 1.00 0.00 C ATOM 1898 CH2 TRP A 658 5.251 0.802 -8.835 1.00 0.00 C ATOM 0 H TRP A 658 2.881 -6.392 -8.508 1.00 0.00 H new ATOM 0 HA TRP A 658 2.472 -3.711 -9.213 1.00 0.00 H new ATOM 0 HB2 TRP A 658 4.173 -4.378 -7.627 1.00 0.00 H new ATOM 0 HB3 TRP A 658 4.944 -5.432 -8.796 1.00 0.00 H new ATOM 0 HD1 TRP A 658 6.965 -4.400 -10.057 1.00 0.00 H new ATOM 0 HE1 TRP A 658 7.921 -2.024 -10.435 1.00 0.00 H new ATOM 0 HE3 TRP A 658 3.199 -1.734 -7.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 658 7.121 0.616 -9.857 1.00 0.00 H new ATOM 0 HZ3 TRP A 658 3.363 0.723 -7.814 1.00 0.00 H new ATOM 0 HH2 TRP A 658 5.296 1.880 -8.800 1.00 0.00 H new ATOM 1909 N TYR A 659 4.452 -5.172 -11.395 1.00 0.00 N ATOM 1910 CA TYR A 659 4.873 -5.193 -12.790 1.00 0.00 C ATOM 1911 C TYR A 659 3.681 -5.232 -13.746 1.00 0.00 C ATOM 1912 O TYR A 659 3.500 -4.323 -14.556 1.00 0.00 O ATOM 1913 CB TYR A 659 5.777 -6.405 -13.017 1.00 0.00 C ATOM 1914 CG TYR A 659 6.555 -6.403 -14.318 1.00 0.00 C ATOM 1915 CD1 TYR A 659 6.151 -5.648 -15.415 1.00 0.00 C ATOM 1916 CD2 TYR A 659 7.700 -7.178 -14.447 1.00 0.00 C ATOM 1917 CE1 TYR A 659 6.864 -5.667 -16.595 1.00 0.00 C ATOM 1918 CE2 TYR A 659 8.418 -7.204 -15.625 1.00 0.00 C ATOM 1919 CZ TYR A 659 7.996 -6.448 -16.698 1.00 0.00 C ATOM 1920 OH TYR A 659 8.707 -6.470 -17.875 1.00 0.00 O ATOM 0 H TYR A 659 5.028 -5.745 -10.779 1.00 0.00 H new ATOM 0 HA TYR A 659 5.419 -4.273 -13.000 1.00 0.00 H new ATOM 0 HB2 TYR A 659 6.485 -6.469 -12.191 1.00 0.00 H new ATOM 0 HB3 TYR A 659 5.164 -7.306 -12.982 1.00 0.00 H new ATOM 0 HD1 TYR A 659 5.264 -5.037 -15.341 1.00 0.00 H new ATOM 0 HD2 TYR A 659 8.035 -7.772 -13.609 1.00 0.00 H new ATOM 0 HE1 TYR A 659 6.537 -5.073 -17.435 1.00 0.00 H new ATOM 0 HE2 TYR A 659 9.306 -7.813 -15.706 1.00 0.00 H new ATOM 0 HH TYR A 659 9.477 -7.069 -17.781 1.00 0.00 H new ATOM 1930 N GLU A 660 2.875 -6.284 -13.670 1.00 0.00 N ATOM 1931 CA GLU A 660 1.728 -6.404 -14.557 1.00 0.00 C ATOM 1932 C GLU A 660 1.015 -5.066 -14.673 1.00 0.00 C ATOM 1933 O GLU A 660 0.487 -4.721 -15.731 1.00 0.00 O ATOM 1934 CB GLU A 660 0.761 -7.486 -14.071 1.00 0.00 C ATOM 1935 CG GLU A 660 -0.174 -7.017 -12.969 1.00 0.00 C ATOM 1936 CD GLU A 660 -0.965 -8.154 -12.352 1.00 0.00 C ATOM 1937 OE1 GLU A 660 -0.341 -9.062 -11.765 1.00 0.00 O ATOM 1938 OE2 GLU A 660 -2.210 -8.135 -12.457 1.00 0.00 O ATOM 0 H GLU A 660 2.992 -7.055 -13.013 1.00 0.00 H new ATOM 0 HA GLU A 660 2.090 -6.700 -15.542 1.00 0.00 H new ATOM 0 HB2 GLU A 660 0.167 -7.836 -14.915 1.00 0.00 H new ATOM 0 HB3 GLU A 660 1.335 -8.339 -13.710 1.00 0.00 H new ATOM 0 HG2 GLU A 660 0.407 -6.520 -12.192 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -0.864 -6.277 -13.374 1.00 0.00 H new ATOM 1945 N CYS A 661 1.019 -4.303 -13.584 1.00 0.00 N ATOM 1946 CA CYS A 661 0.389 -2.989 -13.582 1.00 0.00 C ATOM 1947 C CYS A 661 1.034 -2.115 -14.649 1.00 0.00 C ATOM 1948 O CYS A 661 0.353 -1.391 -15.375 1.00 0.00 O ATOM 1949 CB CYS A 661 0.519 -2.325 -12.211 1.00 0.00 C ATOM 1950 SG CYS A 661 -0.467 -0.822 -12.028 1.00 0.00 S ATOM 0 H CYS A 661 1.448 -4.570 -12.698 1.00 0.00 H new ATOM 0 HA CYS A 661 -0.672 -3.109 -13.801 1.00 0.00 H new ATOM 0 HB2 CYS A 661 0.221 -3.039 -11.443 1.00 0.00 H new ATOM 0 HB3 CYS A 661 1.567 -2.084 -12.033 1.00 0.00 H new ATOM 0 HG CYS A 661 -0.652 -0.280 -13.195 1.00 0.00 H new ATOM 1956 N LEU A 662 2.357 -2.211 -14.746 1.00 0.00 N ATOM 1957 CA LEU A 662 3.111 -1.456 -15.735 1.00 0.00 C ATOM 1958 C LEU A 662 2.641 -1.823 -17.135 1.00 0.00 C ATOM 1959 O LEU A 662 2.776 -1.044 -18.076 1.00 0.00 O ATOM 1960 CB LEU A 662 4.603 -1.742 -15.589 1.00 0.00 C ATOM 1961 CG LEU A 662 5.348 -0.808 -14.637 1.00 0.00 C ATOM 1962 CD1 LEU A 662 5.611 -1.497 -13.306 1.00 0.00 C ATOM 1963 CD2 LEU A 662 6.649 -0.348 -15.267 1.00 0.00 C ATOM 0 H LEU A 662 2.929 -2.808 -14.148 1.00 0.00 H new ATOM 0 HA LEU A 662 2.942 -0.392 -15.573 1.00 0.00 H new ATOM 0 HB2 LEU A 662 4.729 -2.767 -15.241 1.00 0.00 H new ATOM 0 HB3 LEU A 662 5.068 -1.680 -16.573 1.00 0.00 H new ATOM 0 HG LEU A 662 4.725 0.066 -14.449 1.00 0.00 H new ATOM 0 HD11 LEU A 662 6.142 -0.815 -12.642 1.00 0.00 H new ATOM 0 HD12 LEU A 662 4.663 -1.782 -12.850 1.00 0.00 H new ATOM 0 HD13 LEU A 662 6.216 -2.388 -13.471 1.00 0.00 H new ATOM 0 HD21 LEU A 662 7.171 0.317 -14.579 1.00 0.00 H new ATOM 0 HD22 LEU A 662 7.276 -1.214 -15.481 1.00 0.00 H new ATOM 0 HD23 LEU A 662 6.436 0.184 -16.194 1.00 0.00 H new ATOM 1975 N LYS A 663 2.079 -3.019 -17.257 1.00 0.00 N ATOM 1976 CA LYS A 663 1.570 -3.500 -18.534 1.00 0.00 C ATOM 1977 C LYS A 663 0.130 -3.032 -18.729 1.00 0.00 C ATOM 1978 O LYS A 663 -0.273 -2.655 -19.829 1.00 0.00 O ATOM 1979 CB LYS A 663 1.666 -5.034 -18.590 1.00 0.00 C ATOM 1980 CG LYS A 663 0.327 -5.757 -18.656 1.00 0.00 C ATOM 1981 CD LYS A 663 0.502 -7.222 -19.022 1.00 0.00 C ATOM 1982 CE LYS A 663 -0.530 -8.099 -18.332 1.00 0.00 C ATOM 1983 NZ LYS A 663 -0.040 -9.493 -18.147 1.00 0.00 N ATOM 0 H LYS A 663 1.964 -3.675 -16.484 1.00 0.00 H new ATOM 0 HA LYS A 663 2.174 -3.090 -19.344 1.00 0.00 H new ATOM 0 HB2 LYS A 663 2.258 -5.315 -19.461 1.00 0.00 H new ATOM 0 HB3 LYS A 663 2.208 -5.382 -17.711 1.00 0.00 H new ATOM 0 HG2 LYS A 663 -0.177 -5.679 -17.693 1.00 0.00 H new ATOM 0 HG3 LYS A 663 -0.314 -5.271 -19.392 1.00 0.00 H new ATOM 0 HD2 LYS A 663 0.417 -7.340 -20.102 1.00 0.00 H new ATOM 0 HD3 LYS A 663 1.503 -7.550 -18.743 1.00 0.00 H new ATOM 0 HE2 LYS A 663 -0.780 -7.670 -17.362 1.00 0.00 H new ATOM 0 HE3 LYS A 663 -1.447 -8.112 -18.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 663 -0.773 -10.059 -17.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 663 0.175 -9.912 -19.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 663 0.821 -9.484 -17.564 1.00 0.00 H new ATOM 1997 N ASN A 664 -0.631 -3.058 -17.641 1.00 0.00 N ATOM 1998 CA ASN A 664 -2.028 -2.637 -17.664 1.00 0.00 C ATOM 1999 C ASN A 664 -2.194 -1.285 -16.975 1.00 0.00 C ATOM 2000 O ASN A 664 -2.935 -1.161 -16.000 1.00 0.00 O ATOM 2001 CB ASN A 664 -2.902 -3.684 -16.971 1.00 0.00 C ATOM 2002 CG ASN A 664 -3.935 -4.288 -17.901 1.00 0.00 C ATOM 2003 OD1 ASN A 664 -3.982 -3.968 -19.089 1.00 0.00 O ATOM 2004 ND2 ASN A 664 -4.770 -5.167 -17.362 1.00 0.00 N ATOM 0 H ASN A 664 -0.302 -3.368 -16.727 1.00 0.00 H new ATOM 0 HA ASN A 664 -2.341 -2.538 -18.703 1.00 0.00 H new ATOM 0 HB2 ASN A 664 -2.268 -4.477 -16.575 1.00 0.00 H new ATOM 0 HB3 ASN A 664 -3.407 -3.225 -16.121 1.00 0.00 H new ATOM 0 HD21 ASN A 664 -5.488 -5.608 -17.937 1.00 0.00 H new ATOM 0 HD22 ASN A 664 -4.694 -5.402 -16.372 1.00 0.00 H new ATOM 2011 N LYS A 665 -1.497 -0.276 -17.487 1.00 0.00 N ATOM 2012 CA LYS A 665 -1.560 1.068 -16.922 1.00 0.00 C ATOM 2013 C LYS A 665 -3.005 1.521 -16.735 1.00 0.00 C ATOM 2014 O LYS A 665 -3.556 1.435 -15.636 1.00 0.00 O ATOM 2015 CB LYS A 665 -0.823 2.055 -17.828 1.00 0.00 C ATOM 2016 CG LYS A 665 0.690 1.928 -17.765 1.00 0.00 C ATOM 2017 CD LYS A 665 1.200 0.861 -18.719 1.00 0.00 C ATOM 2018 CE LYS A 665 0.631 1.042 -20.116 1.00 0.00 C ATOM 2019 NZ LYS A 665 1.641 0.753 -21.170 1.00 0.00 N ATOM 0 H LYS A 665 -0.880 -0.364 -18.295 1.00 0.00 H new ATOM 0 HA LYS A 665 -1.079 1.044 -15.944 1.00 0.00 H new ATOM 0 HB2 LYS A 665 -1.149 1.903 -18.857 1.00 0.00 H new ATOM 0 HB3 LYS A 665 -1.106 3.070 -17.550 1.00 0.00 H new ATOM 0 HG2 LYS A 665 1.147 2.886 -18.012 1.00 0.00 H new ATOM 0 HG3 LYS A 665 0.993 1.683 -16.747 1.00 0.00 H new ATOM 0 HD2 LYS A 665 2.288 0.900 -18.761 1.00 0.00 H new ATOM 0 HD3 LYS A 665 0.931 -0.125 -18.341 1.00 0.00 H new ATOM 0 HE2 LYS A 665 -0.228 0.383 -20.246 1.00 0.00 H new ATOM 0 HE3 LYS A 665 0.269 2.064 -20.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 665 1.212 0.888 -22.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 665 2.449 1.398 -21.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 665 1.968 -0.230 -21.077 1.00 0.00 H new ATOM 2033 N ASP A 666 -3.610 2.008 -17.813 1.00 0.00 N ATOM 2034 CA ASP A 666 -4.989 2.482 -17.772 1.00 0.00 C ATOM 2035 C ASP A 666 -5.897 1.479 -17.066 1.00 0.00 C ATOM 2036 O ASP A 666 -6.962 1.839 -16.567 1.00 0.00 O ATOM 2037 CB ASP A 666 -5.502 2.741 -19.189 1.00 0.00 C ATOM 2038 CG ASP A 666 -5.303 4.181 -19.622 1.00 0.00 C ATOM 2039 OD1 ASP A 666 -4.493 4.886 -18.983 1.00 0.00 O ATOM 2040 OD2 ASP A 666 -5.957 4.603 -20.598 1.00 0.00 O ATOM 0 H ASP A 666 -3.166 2.085 -18.728 1.00 0.00 H new ATOM 0 HA ASP A 666 -5.006 3.414 -17.207 1.00 0.00 H new ATOM 0 HB2 ASP A 666 -4.986 2.080 -19.886 1.00 0.00 H new ATOM 0 HB3 ASP A 666 -6.562 2.492 -19.240 1.00 0.00 H new ATOM 2045 N LYS A 667 -5.469 0.222 -17.028 1.00 0.00 N ATOM 2046 CA LYS A 667 -6.246 -0.828 -16.382 1.00 0.00 C ATOM 2047 C LYS A 667 -5.996 -0.836 -14.878 1.00 0.00 C ATOM 2048 O LYS A 667 -4.853 -0.916 -14.430 1.00 0.00 O ATOM 2049 CB LYS A 667 -5.898 -2.192 -16.981 1.00 0.00 C ATOM 2050 CG LYS A 667 -6.380 -2.367 -18.412 1.00 0.00 C ATOM 2051 CD LYS A 667 -7.337 -3.541 -18.538 1.00 0.00 C ATOM 2052 CE LYS A 667 -7.221 -4.213 -19.898 1.00 0.00 C ATOM 2053 NZ LYS A 667 -7.400 -3.244 -21.014 1.00 0.00 N ATOM 0 H LYS A 667 -4.589 -0.094 -17.436 1.00 0.00 H new ATOM 0 HA LYS A 667 -7.303 -0.626 -16.555 1.00 0.00 H new ATOM 0 HB2 LYS A 667 -4.817 -2.328 -16.951 1.00 0.00 H new ATOM 0 HB3 LYS A 667 -6.335 -2.975 -16.361 1.00 0.00 H new ATOM 0 HG2 LYS A 667 -6.876 -1.455 -18.744 1.00 0.00 H new ATOM 0 HG3 LYS A 667 -5.524 -2.522 -19.069 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -7.128 -4.268 -17.753 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -8.360 -3.195 -18.388 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -6.245 -4.690 -19.985 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -7.970 -5.001 -19.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -7.517 -3.762 -21.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -8.244 -2.663 -20.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -6.564 -2.629 -21.077 1.00 0.00 H new ATOM 2067 N LYS A 668 -7.073 -0.748 -14.106 1.00 0.00 N ATOM 2068 CA LYS A 668 -6.972 -0.739 -12.651 1.00 0.00 C ATOM 2069 C LYS A 668 -6.782 -2.150 -12.105 1.00 0.00 C ATOM 2070 O LYS A 668 -7.638 -3.017 -12.282 1.00 0.00 O ATOM 2071 CB LYS A 668 -8.223 -0.106 -12.040 1.00 0.00 C ATOM 2072 CG LYS A 668 -7.942 0.729 -10.801 1.00 0.00 C ATOM 2073 CD LYS A 668 -7.705 -0.146 -9.582 1.00 0.00 C ATOM 2074 CE LYS A 668 -8.752 -1.241 -9.469 1.00 0.00 C ATOM 2075 NZ LYS A 668 -10.125 -0.732 -9.742 1.00 0.00 N ATOM 0 H LYS A 668 -8.026 -0.682 -14.463 1.00 0.00 H new ATOM 0 HA LYS A 668 -6.099 -0.147 -12.376 1.00 0.00 H new ATOM 0 HB2 LYS A 668 -8.705 0.522 -12.789 1.00 0.00 H new ATOM 0 HB3 LYS A 668 -8.930 -0.895 -11.783 1.00 0.00 H new ATOM 0 HG2 LYS A 668 -7.068 1.357 -10.975 1.00 0.00 H new ATOM 0 HG3 LYS A 668 -8.782 1.397 -10.613 1.00 0.00 H new ATOM 0 HD2 LYS A 668 -6.713 -0.594 -9.642 1.00 0.00 H new ATOM 0 HD3 LYS A 668 -7.722 0.469 -8.682 1.00 0.00 H new ATOM 0 HE2 LYS A 668 -8.516 -2.041 -10.170 1.00 0.00 H new ATOM 0 HE3 LYS A 668 -8.718 -1.673 -8.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 668 -10.821 -1.330 -9.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 668 -10.207 0.246 -9.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 668 -10.307 -0.756 -10.766 1.00 0.00 H new ATOM 2089 N ILE A 669 -5.654 -2.370 -11.437 1.00 0.00 N ATOM 2090 CA ILE A 669 -5.349 -3.673 -10.859 1.00 0.00 C ATOM 2091 C ILE A 669 -5.834 -3.752 -9.415 1.00 0.00 C ATOM 2092 O ILE A 669 -6.034 -2.728 -8.762 1.00 0.00 O ATOM 2093 CB ILE A 669 -3.839 -3.970 -10.897 1.00 0.00 C ATOM 2094 CG1 ILE A 669 -3.248 -3.532 -12.247 1.00 0.00 C ATOM 2095 CG2 ILE A 669 -3.592 -5.450 -10.629 1.00 0.00 C ATOM 2096 CD1 ILE A 669 -2.299 -4.537 -12.873 1.00 0.00 C ATOM 0 H ILE A 669 -4.936 -1.662 -11.283 1.00 0.00 H new ATOM 0 HA ILE A 669 -5.869 -4.417 -11.462 1.00 0.00 H new ATOM 0 HB ILE A 669 -3.337 -3.401 -10.115 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -4.065 -3.341 -12.942 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -2.719 -2.589 -12.109 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -2.521 -5.651 -10.658 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.984 -5.712 -9.646 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -4.094 -6.046 -11.391 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -1.930 -4.147 -13.821 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -1.459 -4.712 -12.201 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -2.826 -5.475 -13.047 1.00 0.00 H new ATOM 2108 N GLU A 670 -6.022 -4.972 -8.921 1.00 0.00 N ATOM 2109 CA GLU A 670 -6.484 -5.177 -7.554 1.00 0.00 C ATOM 2110 C GLU A 670 -6.074 -6.550 -7.038 1.00 0.00 C ATOM 2111 O GLU A 670 -6.225 -7.555 -7.731 1.00 0.00 O ATOM 2112 CB GLU A 670 -8.005 -5.031 -7.479 1.00 0.00 C ATOM 2113 CG GLU A 670 -8.460 -3.677 -6.966 1.00 0.00 C ATOM 2114 CD GLU A 670 -9.914 -3.391 -7.285 1.00 0.00 C ATOM 2115 OE1 GLU A 670 -10.366 -3.774 -8.385 1.00 0.00 O ATOM 2116 OE2 GLU A 670 -10.601 -2.786 -6.436 1.00 0.00 O ATOM 0 H GLU A 670 -5.862 -5.831 -9.446 1.00 0.00 H new ATOM 0 HA GLU A 670 -6.018 -4.417 -6.926 1.00 0.00 H new ATOM 0 HB2 GLU A 670 -8.427 -5.195 -8.471 1.00 0.00 H new ATOM 0 HB3 GLU A 670 -8.405 -5.810 -6.829 1.00 0.00 H new ATOM 0 HG2 GLU A 670 -8.313 -3.634 -5.887 1.00 0.00 H new ATOM 0 HG3 GLU A 670 -7.836 -2.898 -7.404 1.00 0.00 H new ATOM 2123 N ARG A 671 -5.559 -6.587 -5.814 1.00 0.00 N ATOM 2124 CA ARG A 671 -5.134 -7.843 -5.207 1.00 0.00 C ATOM 2125 C ARG A 671 -4.913 -7.684 -3.705 1.00 0.00 C ATOM 2126 O ARG A 671 -4.698 -6.577 -3.212 1.00 0.00 O ATOM 2127 CB ARG A 671 -3.857 -8.358 -5.888 1.00 0.00 C ATOM 2128 CG ARG A 671 -2.573 -8.037 -5.136 1.00 0.00 C ATOM 2129 CD ARG A 671 -2.169 -9.177 -4.217 1.00 0.00 C ATOM 2130 NE ARG A 671 -1.491 -10.248 -4.939 1.00 0.00 N ATOM 2131 CZ ARG A 671 -0.751 -11.181 -4.348 1.00 0.00 C ATOM 2132 NH1 ARG A 671 -0.594 -11.170 -3.032 1.00 0.00 N ATOM 2133 NH2 ARG A 671 -0.166 -12.124 -5.074 1.00 0.00 N ATOM 0 H ARG A 671 -5.426 -5.765 -5.225 1.00 0.00 H new ATOM 0 HA ARG A 671 -5.929 -8.575 -5.351 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -3.934 -9.439 -6.008 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -3.795 -7.930 -6.889 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -1.772 -7.841 -5.848 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -2.710 -7.127 -4.551 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -1.513 -8.796 -3.434 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -3.055 -9.577 -3.724 1.00 0.00 H new ATOM 0 HE ARG A 671 -1.590 -10.283 -5.954 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -1.041 -10.445 -2.471 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -0.026 -11.887 -2.580 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -0.284 -12.134 -6.087 1.00 0.00 H new ATOM 0 HH22 ARG A 671 0.402 -12.839 -4.619 1.00 0.00 H new ATOM 2147 N TRP A 672 -4.965 -8.801 -2.984 1.00 0.00 N ATOM 2148 CA TRP A 672 -4.768 -8.790 -1.540 1.00 0.00 C ATOM 2149 C TRP A 672 -3.328 -9.145 -1.187 1.00 0.00 C ATOM 2150 O TRP A 672 -2.775 -10.119 -1.695 1.00 0.00 O ATOM 2151 CB TRP A 672 -5.723 -9.777 -0.865 1.00 0.00 C ATOM 2152 CG TRP A 672 -7.137 -9.287 -0.808 1.00 0.00 C ATOM 2153 CD1 TRP A 672 -8.116 -9.505 -1.733 1.00 0.00 C ATOM 2154 CD2 TRP A 672 -7.729 -8.494 0.227 1.00 0.00 C ATOM 2155 NE1 TRP A 672 -9.282 -8.894 -1.338 1.00 0.00 N ATOM 2156 CE2 TRP A 672 -9.070 -8.268 -0.139 1.00 0.00 C ATOM 2157 CE3 TRP A 672 -7.257 -7.954 1.428 1.00 0.00 C ATOM 2158 CZ2 TRP A 672 -9.941 -7.525 0.652 1.00 0.00 C ATOM 2159 CZ3 TRP A 672 -8.125 -7.217 2.212 1.00 0.00 C ATOM 2160 CH2 TRP A 672 -9.454 -7.008 1.822 1.00 0.00 C ATOM 0 H TRP A 672 -5.142 -9.725 -3.378 1.00 0.00 H new ATOM 0 HA TRP A 672 -4.979 -7.784 -1.178 1.00 0.00 H new ATOM 0 HB2 TRP A 672 -5.695 -10.725 -1.403 1.00 0.00 H new ATOM 0 HB3 TRP A 672 -5.373 -9.975 0.148 1.00 0.00 H new ATOM 0 HD1 TRP A 672 -7.993 -10.074 -2.642 1.00 0.00 H new ATOM 0 HE1 TRP A 672 -10.162 -8.905 -1.854 1.00 0.00 H new ATOM 0 HE3 TRP A 672 -6.234 -8.110 1.737 1.00 0.00 H new ATOM 0 HZ2 TRP A 672 -10.966 -7.362 0.353 1.00 0.00 H new ATOM 0 HZ3 TRP A 672 -7.772 -6.795 3.141 1.00 0.00 H new ATOM 0 HH2 TRP A 672 -10.107 -6.428 2.457 1.00 0.00 H new ATOM 2171 N HIS A 673 -2.729 -8.349 -0.308 1.00 0.00 N ATOM 2172 CA HIS A 673 -1.354 -8.580 0.116 1.00 0.00 C ATOM 2173 C HIS A 673 -1.306 -9.033 1.570 1.00 0.00 C ATOM 2174 O HIS A 673 -1.898 -8.403 2.447 1.00 0.00 O ATOM 2175 CB HIS A 673 -0.519 -7.312 -0.057 1.00 0.00 C ATOM 2176 CG HIS A 673 -0.407 -6.856 -1.479 1.00 0.00 C ATOM 2177 ND1 HIS A 673 0.095 -7.635 -2.497 1.00 0.00 N ATOM 2178 CD2 HIS A 673 -0.746 -5.670 -2.046 1.00 0.00 C ATOM 2179 CE1 HIS A 673 0.048 -6.915 -3.626 1.00 0.00 C ATOM 2180 NE2 HIS A 673 -0.455 -5.715 -3.406 1.00 0.00 N ATOM 0 H HIS A 673 -3.174 -7.539 0.124 1.00 0.00 H new ATOM 0 HA HIS A 673 -0.937 -9.368 -0.511 1.00 0.00 H new ATOM 0 HB2 HIS A 673 -0.960 -6.513 0.538 1.00 0.00 H new ATOM 0 HB3 HIS A 673 0.481 -7.489 0.339 1.00 0.00 H new ATOM 0 HD1 HIS A 673 0.441 -8.590 -2.408 1.00 0.00 H new ATOM 0 HD2 HIS A 673 -1.173 -4.826 -1.525 1.00 0.00 H new ATOM 0 HE1 HIS A 673 0.379 -7.271 -4.591 1.00 0.00 H new ATOM 2188 N GLN A 674 -0.594 -10.126 1.822 1.00 0.00 N ATOM 2189 CA GLN A 674 -0.466 -10.654 3.174 1.00 0.00 C ATOM 2190 C GLN A 674 0.463 -9.776 4.000 1.00 0.00 C ATOM 2191 O GLN A 674 1.682 -9.805 3.826 1.00 0.00 O ATOM 2192 CB GLN A 674 0.063 -12.089 3.141 1.00 0.00 C ATOM 2193 CG GLN A 674 -0.927 -13.090 2.566 1.00 0.00 C ATOM 2194 CD GLN A 674 -0.496 -14.527 2.789 1.00 0.00 C ATOM 2195 OE1 GLN A 674 -1.146 -15.275 3.518 1.00 0.00 O ATOM 2196 NE2 GLN A 674 0.606 -14.917 2.161 1.00 0.00 N ATOM 0 H GLN A 674 -0.098 -10.662 1.110 1.00 0.00 H new ATOM 0 HA GLN A 674 -1.453 -10.655 3.636 1.00 0.00 H new ATOM 0 HB2 GLN A 674 0.979 -12.116 2.550 1.00 0.00 H new ATOM 0 HB3 GLN A 674 0.328 -12.393 4.154 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -1.904 -12.932 3.022 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -1.041 -12.910 1.497 1.00 0.00 H new ATOM 0 HE21 GLN A 674 1.113 -14.262 1.566 1.00 0.00 H new ATOM 0 HE22 GLN A 674 0.946 -15.872 2.273 1.00 0.00 H new ATOM 2205 N LEU A 675 -0.121 -8.986 4.891 1.00 0.00 N ATOM 2206 CA LEU A 675 0.652 -8.086 5.736 1.00 0.00 C ATOM 2207 C LEU A 675 1.743 -8.831 6.490 1.00 0.00 C ATOM 2208 O LEU A 675 1.489 -9.840 7.148 1.00 0.00 O ATOM 2209 CB LEU A 675 -0.264 -7.363 6.721 1.00 0.00 C ATOM 2210 CG LEU A 675 -1.350 -6.513 6.069 1.00 0.00 C ATOM 2211 CD1 LEU A 675 -2.245 -5.884 7.124 1.00 0.00 C ATOM 2212 CD2 LEU A 675 -0.724 -5.446 5.189 1.00 0.00 C ATOM 0 H LEU A 675 -1.128 -8.950 5.047 1.00 0.00 H new ATOM 0 HA LEU A 675 1.130 -7.352 5.087 1.00 0.00 H new ATOM 0 HB2 LEU A 675 -0.738 -8.102 7.367 1.00 0.00 H new ATOM 0 HB3 LEU A 675 0.344 -6.724 7.361 1.00 0.00 H new ATOM 0 HG LEU A 675 -1.967 -7.158 5.444 1.00 0.00 H new ATOM 0 HD11 LEU A 675 -3.013 -5.282 6.638 1.00 0.00 H new ATOM 0 HD12 LEU A 675 -2.719 -6.669 7.714 1.00 0.00 H new ATOM 0 HD13 LEU A 675 -1.646 -5.250 7.778 1.00 0.00 H new ATOM 0 HD21 LEU A 675 -1.510 -4.846 4.730 1.00 0.00 H new ATOM 0 HD22 LEU A 675 -0.085 -4.804 5.795 1.00 0.00 H new ATOM 0 HD23 LEU A 675 -0.128 -5.921 4.410 1.00 0.00 H new ATOM 2224 N GLN A 676 2.959 -8.315 6.387 1.00 0.00 N ATOM 2225 CA GLN A 676 4.108 -8.913 7.057 1.00 0.00 C ATOM 2226 C GLN A 676 4.743 -7.920 8.025 1.00 0.00 C ATOM 2227 O GLN A 676 4.547 -6.710 7.905 1.00 0.00 O ATOM 2228 CB GLN A 676 5.144 -9.374 6.030 1.00 0.00 C ATOM 2229 CG GLN A 676 4.703 -10.586 5.224 1.00 0.00 C ATOM 2230 CD GLN A 676 5.823 -11.587 5.021 1.00 0.00 C ATOM 2231 OE1 GLN A 676 5.624 -12.794 5.161 1.00 0.00 O ATOM 2232 NE2 GLN A 676 7.008 -11.091 4.689 1.00 0.00 N ATOM 0 H GLN A 676 3.178 -7.480 5.844 1.00 0.00 H new ATOM 0 HA GLN A 676 3.760 -9.778 7.622 1.00 0.00 H new ATOM 0 HB2 GLN A 676 5.357 -8.552 5.347 1.00 0.00 H new ATOM 0 HB3 GLN A 676 6.075 -9.610 6.546 1.00 0.00 H new ATOM 0 HG2 GLN A 676 3.872 -11.074 5.733 1.00 0.00 H new ATOM 0 HG3 GLN A 676 4.333 -10.257 4.253 1.00 0.00 H new ATOM 0 HE21 GLN A 676 7.128 -10.084 4.584 1.00 0.00 H new ATOM 0 HE22 GLN A 676 7.799 -11.717 4.539 1.00 0.00 H new ATOM 2241 N ASN A 677 5.503 -8.436 8.985 1.00 0.00 N ATOM 2242 CA ASN A 677 6.162 -7.592 9.972 1.00 0.00 C ATOM 2243 C ASN A 677 7.490 -7.063 9.441 1.00 0.00 C ATOM 2244 O ASN A 677 8.446 -7.818 9.266 1.00 0.00 O ATOM 2245 CB ASN A 677 6.394 -8.372 11.267 1.00 0.00 C ATOM 2246 CG ASN A 677 5.939 -7.605 12.494 1.00 0.00 C ATOM 2247 OD1 ASN A 677 5.154 -6.662 12.394 1.00 0.00 O ATOM 2248 ND2 ASN A 677 6.434 -8.005 13.658 1.00 0.00 N ATOM 0 H ASN A 677 5.677 -9.434 9.100 1.00 0.00 H new ATOM 0 HA ASN A 677 5.510 -6.743 10.177 1.00 0.00 H new ATOM 0 HB2 ASN A 677 5.860 -9.321 11.217 1.00 0.00 H new ATOM 0 HB3 ASN A 677 7.454 -8.607 11.361 1.00 0.00 H new ATOM 0 HD21 ASN A 677 6.166 -7.526 14.518 1.00 0.00 H new ATOM 0 HD22 ASN A 677 7.082 -8.792 13.693 1.00 0.00 H new