USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 912 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 Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -142:sc= 0.0374 (180deg=-1.2!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.0135 X(o=-0.013,f=-0.19) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot -5:sc= -3.32! USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= -1.63 USER MOD Single : A 24 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0726) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 130:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 MET CE :methyl 149:sc= -1.71 (180deg=-3.12!) USER MOD Single : A 33 THR OG1 : rot 34:sc= 0.193 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0483 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 HIS : no HD1:sc= -0.609 X(o=-0.61,f=-0.77) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -45:sc= 1.07 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -170:sc= -1.07 (180deg=-1.28) USER MOD Single : A 65 MET CE :methyl -113:sc= -0.255 (180deg=-2.97!) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 173:sc= -3.2 (180deg=-3.59) USER MOD Single : A 80 GLN : amide:sc= -0.56 K(o=-0.56,f=-2.6!) USER MOD Single : A 82 THR OG1 : rot -149:sc= -3.05! USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 MET CE :methyl -167:sc= -1.35 (180deg=-2.01!) USER MOD Single : A 100 ASN : amide:sc= -3.83! C(o=-3.8!,f=-6!) USER MOD Single : A 106 GLN : amide:sc= -0.294 K(o=-0.29,f=-1.5!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -1.536 16.557 -17.752 1.00 0.00 N ATOM 2 CA ALA A 1 -0.928 15.206 -17.869 1.00 0.00 C ATOM 3 C ALA A 1 0.213 15.032 -16.872 1.00 0.00 C ATOM 4 O ALA A 1 1.382 15.211 -17.214 1.00 0.00 O ATOM 5 CB ALA A 1 -0.431 14.973 -19.287 1.00 0.00 C ATOM 0 H1 ALA A 1 -2.310 16.650 -18.441 1.00 0.00 H new ATOM 0 H2 ALA A 1 -1.911 16.687 -16.791 1.00 0.00 H new ATOM 0 H3 ALA A 1 -0.814 17.280 -17.943 1.00 0.00 H new ATOM 0 HA ALA A 1 -1.695 14.467 -17.638 1.00 0.00 H new ATOM 0 HB1 ALA A 1 0.012 13.980 -19.359 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -1.267 15.049 -19.983 1.00 0.00 H new ATOM 0 HB3 ALA A 1 0.319 15.724 -19.538 1.00 0.00 H new ATOM 13 N THR A 2 -0.135 14.681 -15.639 1.00 0.00 N ATOM 14 CA THR A 2 0.858 14.482 -14.590 1.00 0.00 C ATOM 15 C THR A 2 0.881 13.027 -14.132 1.00 0.00 C ATOM 16 O THR A 2 -0.148 12.472 -13.746 1.00 0.00 O ATOM 17 CB THR A 2 0.565 15.399 -13.402 1.00 0.00 C ATOM 18 OG1 THR A 2 -0.144 16.551 -13.823 1.00 0.00 O ATOM 19 CG2 THR A 2 1.811 15.866 -12.681 1.00 0.00 C ATOM 0 H THR A 2 -1.099 14.528 -15.341 1.00 0.00 H new ATOM 0 HA THR A 2 1.837 14.730 -14.999 1.00 0.00 H new ATOM 0 HB THR A 2 -0.028 14.797 -12.713 1.00 0.00 H new ATOM 0 HG1 THR A 2 -0.324 17.125 -13.049 1.00 0.00 H new ATOM 0 HG21 THR A 2 1.530 16.512 -11.850 1.00 0.00 H new ATOM 0 HG22 THR A 2 2.356 15.002 -12.301 1.00 0.00 H new ATOM 0 HG23 THR A 2 2.446 16.420 -13.373 1.00 0.00 H new ATOM 27 N SER A 3 2.060 12.416 -14.177 1.00 0.00 N ATOM 28 CA SER A 3 2.215 11.025 -13.765 1.00 0.00 C ATOM 29 C SER A 3 2.894 10.931 -12.402 1.00 0.00 C ATOM 30 O SER A 3 3.891 11.606 -12.148 1.00 0.00 O ATOM 31 CB SER A 3 3.026 10.250 -14.807 1.00 0.00 C ATOM 32 OG SER A 3 2.176 9.651 -15.771 1.00 0.00 O ATOM 0 H SER A 3 2.921 12.861 -14.494 1.00 0.00 H new ATOM 0 HA SER A 3 1.221 10.584 -13.685 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.726 10.923 -15.302 1.00 0.00 H new ATOM 0 HB3 SER A 3 3.619 9.481 -14.312 1.00 0.00 H new ATOM 0 HG SER A 3 2.717 9.163 -16.426 1.00 0.00 H new ATOM 38 N THR A 4 2.350 10.088 -11.530 1.00 0.00 N ATOM 39 CA THR A 4 2.906 9.907 -10.195 1.00 0.00 C ATOM 40 C THR A 4 4.253 9.192 -10.259 1.00 0.00 C ATOM 41 O THR A 4 4.350 8.075 -10.767 1.00 0.00 O ATOM 42 CB THR A 4 1.935 9.115 -9.318 1.00 0.00 C ATOM 43 OG1 THR A 4 0.641 9.691 -9.354 1.00 0.00 O ATOM 44 CG2 THR A 4 2.363 9.040 -7.867 1.00 0.00 C ATOM 0 H THR A 4 1.525 9.520 -11.724 1.00 0.00 H new ATOM 0 HA THR A 4 3.059 10.893 -9.755 1.00 0.00 H new ATOM 0 HB THR A 4 1.930 8.107 -9.732 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.035 9.169 -8.788 1.00 0.00 H new ATOM 0 HG21 THR A 4 1.631 8.465 -7.301 1.00 0.00 H new ATOM 0 HG22 THR A 4 3.337 8.555 -7.799 1.00 0.00 H new ATOM 0 HG23 THR A 4 2.430 10.047 -7.455 1.00 0.00 H new ATOM 52 N LYS A 5 5.288 9.844 -9.741 1.00 0.00 N ATOM 53 CA LYS A 5 6.629 9.272 -9.740 1.00 0.00 C ATOM 54 C LYS A 5 6.739 8.139 -8.725 1.00 0.00 C ATOM 55 O LYS A 5 6.106 8.174 -7.669 1.00 0.00 O ATOM 56 CB LYS A 5 7.666 10.354 -9.428 1.00 0.00 C ATOM 57 CG LYS A 5 8.279 10.985 -10.668 1.00 0.00 C ATOM 58 CD LYS A 5 8.545 12.468 -10.465 1.00 0.00 C ATOM 59 CE LYS A 5 7.275 13.288 -10.624 1.00 0.00 C ATOM 60 NZ LYS A 5 6.522 12.913 -11.852 1.00 0.00 N ATOM 0 H LYS A 5 5.224 10.769 -9.316 1.00 0.00 H new ATOM 0 HA LYS A 5 6.824 8.865 -10.732 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.196 11.134 -8.828 1.00 0.00 H new ATOM 0 HB3 LYS A 5 8.460 9.920 -8.821 1.00 0.00 H new ATOM 0 HG2 LYS A 5 9.212 10.477 -10.913 1.00 0.00 H new ATOM 0 HG3 LYS A 5 7.609 10.847 -11.517 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.963 12.631 -9.472 1.00 0.00 H new ATOM 0 HD3 LYS A 5 9.291 12.807 -11.184 1.00 0.00 H new ATOM 0 HE2 LYS A 5 6.639 13.145 -9.750 1.00 0.00 H new ATOM 0 HE3 LYS A 5 7.529 14.347 -10.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 6.115 13.767 -12.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 7.167 12.457 -12.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 5.758 12.253 -11.603 1.00 0.00 H new ATOM 74 N LYS A 6 7.550 7.136 -9.049 1.00 0.00 N ATOM 75 CA LYS A 6 7.744 5.994 -8.165 1.00 0.00 C ATOM 76 C LYS A 6 8.543 6.397 -6.929 1.00 0.00 C ATOM 77 O LYS A 6 9.378 7.299 -6.987 1.00 0.00 O ATOM 78 CB LYS A 6 8.461 4.863 -8.905 1.00 0.00 C ATOM 79 CG LYS A 6 9.681 5.324 -9.687 1.00 0.00 C ATOM 80 CD LYS A 6 9.411 5.349 -11.183 1.00 0.00 C ATOM 81 CE LYS A 6 10.534 6.037 -11.942 1.00 0.00 C ATOM 82 NZ LYS A 6 11.699 5.134 -12.150 1.00 0.00 N ATOM 0 H LYS A 6 8.083 7.092 -9.918 1.00 0.00 H new ATOM 0 HA LYS A 6 6.763 5.642 -7.845 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.767 4.105 -8.184 1.00 0.00 H new ATOM 0 HB3 LYS A 6 7.760 4.386 -9.590 1.00 0.00 H new ATOM 0 HG2 LYS A 6 9.973 6.320 -9.353 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.519 4.659 -9.479 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.295 4.329 -11.550 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.471 5.866 -11.375 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.163 6.379 -12.908 1.00 0.00 H new ATOM 0 HE3 LYS A 6 10.854 6.922 -11.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 12.443 5.641 -12.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 12.070 4.828 -11.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.400 4.301 -12.697 1.00 0.00 H new ATOM 96 N LEU A 7 8.276 5.728 -5.812 1.00 0.00 N ATOM 97 CA LEU A 7 8.969 6.023 -4.562 1.00 0.00 C ATOM 98 C LEU A 7 9.725 4.803 -4.046 1.00 0.00 C ATOM 99 O LEU A 7 9.120 3.803 -3.660 1.00 0.00 O ATOM 100 CB LEU A 7 7.972 6.502 -3.506 1.00 0.00 C ATOM 101 CG LEU A 7 6.919 7.492 -4.008 1.00 0.00 C ATOM 102 CD1 LEU A 7 5.888 7.769 -2.925 1.00 0.00 C ATOM 103 CD2 LEU A 7 7.579 8.783 -4.466 1.00 0.00 C ATOM 0 H LEU A 7 7.586 4.979 -5.746 1.00 0.00 H new ATOM 0 HA LEU A 7 9.693 6.813 -4.760 1.00 0.00 H new ATOM 0 HB2 LEU A 7 7.462 5.633 -3.090 1.00 0.00 H new ATOM 0 HB3 LEU A 7 8.526 6.967 -2.691 1.00 0.00 H new ATOM 0 HG LEU A 7 6.406 7.048 -4.861 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.147 8.475 -3.300 1.00 0.00 H new ATOM 0 HD12 LEU A 7 5.394 6.838 -2.647 1.00 0.00 H new ATOM 0 HD13 LEU A 7 6.383 8.192 -2.051 1.00 0.00 H new ATOM 0 HD21 LEU A 7 6.816 9.476 -4.820 1.00 0.00 H new ATOM 0 HD22 LEU A 7 8.118 9.232 -3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 7 8.277 8.568 -5.275 1.00 0.00 H new ATOM 115 N HIS A 8 11.049 4.899 -4.032 1.00 0.00 N ATOM 116 CA HIS A 8 11.892 3.809 -3.551 1.00 0.00 C ATOM 117 C HIS A 8 11.780 3.680 -2.036 1.00 0.00 C ATOM 118 O HIS A 8 12.401 4.437 -1.291 1.00 0.00 O ATOM 119 CB HIS A 8 13.349 4.046 -3.950 1.00 0.00 C ATOM 120 CG HIS A 8 13.652 3.667 -5.367 1.00 0.00 C ATOM 121 ND1 HIS A 8 13.369 2.422 -5.889 1.00 0.00 N ATOM 122 CD2 HIS A 8 14.217 4.374 -6.374 1.00 0.00 C ATOM 123 CE1 HIS A 8 13.747 2.381 -7.156 1.00 0.00 C ATOM 124 NE2 HIS A 8 14.263 3.553 -7.472 1.00 0.00 N ATOM 0 H HIS A 8 11.563 5.721 -4.348 1.00 0.00 H new ATOM 0 HA HIS A 8 11.549 2.881 -4.009 1.00 0.00 H new ATOM 0 HB2 HIS A 8 13.590 5.099 -3.805 1.00 0.00 H new ATOM 0 HB3 HIS A 8 13.997 3.476 -3.284 1.00 0.00 H new ATOM 0 HD2 HIS A 8 14.566 5.395 -6.322 1.00 0.00 H new ATOM 0 HE1 HIS A 8 13.650 1.533 -7.818 1.00 0.00 H new ATOM 0 HE2 HIS A 8 14.636 3.808 -8.386 1.00 0.00 H new ATOM 133 N LYS A 9 10.974 2.724 -1.587 1.00 0.00 N ATOM 134 CA LYS A 9 10.769 2.504 -0.161 1.00 0.00 C ATOM 135 C LYS A 9 11.229 1.111 0.258 1.00 0.00 C ATOM 136 O LYS A 9 11.334 0.203 -0.566 1.00 0.00 O ATOM 137 CB LYS A 9 9.295 2.698 0.197 1.00 0.00 C ATOM 138 CG LYS A 9 8.778 4.096 -0.096 1.00 0.00 C ATOM 139 CD LYS A 9 8.899 5.001 1.120 1.00 0.00 C ATOM 140 CE LYS A 9 8.729 6.464 0.745 1.00 0.00 C ATOM 141 NZ LYS A 9 7.362 6.963 1.059 1.00 0.00 N ATOM 0 H LYS A 9 10.452 2.089 -2.191 1.00 0.00 H new ATOM 0 HA LYS A 9 11.370 3.235 0.380 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.697 1.975 -0.357 1.00 0.00 H new ATOM 0 HB3 LYS A 9 9.155 2.482 1.256 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.337 4.525 -0.927 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.735 4.041 -0.408 1.00 0.00 H new ATOM 0 HD2 LYS A 9 8.146 4.724 1.858 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.873 4.855 1.588 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.466 7.064 1.279 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.926 6.591 -0.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.287 7.964 0.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 6.660 6.408 0.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.183 6.866 2.079 1.00 0.00 H new ATOM 155 N GLU A 10 11.499 0.954 1.549 1.00 0.00 N ATOM 156 CA GLU A 10 11.947 -0.323 2.093 1.00 0.00 C ATOM 157 C GLU A 10 10.806 -1.007 2.843 1.00 0.00 C ATOM 158 O GLU A 10 9.794 -0.379 3.151 1.00 0.00 O ATOM 159 CB GLU A 10 13.143 -0.114 3.027 1.00 0.00 C ATOM 160 CG GLU A 10 14.411 -0.805 2.553 1.00 0.00 C ATOM 161 CD GLU A 10 15.276 0.089 1.688 1.00 0.00 C ATOM 162 OE1 GLU A 10 15.692 1.162 2.173 1.00 0.00 O ATOM 163 OE2 GLU A 10 15.537 -0.282 0.525 1.00 0.00 O ATOM 0 H GLU A 10 11.415 1.699 2.241 1.00 0.00 H new ATOM 0 HA GLU A 10 12.257 -0.963 1.267 1.00 0.00 H new ATOM 0 HB2 GLU A 10 13.336 0.954 3.124 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.887 -0.483 4.020 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.986 -1.133 3.419 1.00 0.00 H new ATOM 0 HG3 GLU A 10 14.144 -1.700 1.990 1.00 0.00 H new ATOM 170 N PRO A 11 10.944 -2.311 3.132 1.00 0.00 N ATOM 171 CA PRO A 11 9.906 -3.072 3.830 1.00 0.00 C ATOM 172 C PRO A 11 9.891 -2.813 5.332 1.00 0.00 C ATOM 173 O PRO A 11 10.759 -3.284 6.068 1.00 0.00 O ATOM 174 CB PRO A 11 10.289 -4.521 3.536 1.00 0.00 C ATOM 175 CG PRO A 11 11.771 -4.490 3.394 1.00 0.00 C ATOM 176 CD PRO A 11 12.108 -3.152 2.788 1.00 0.00 C ATOM 0 HA PRO A 11 8.905 -2.799 3.497 1.00 0.00 H new ATOM 0 HB2 PRO A 11 9.981 -5.185 4.343 1.00 0.00 H new ATOM 0 HB3 PRO A 11 9.810 -4.882 2.626 1.00 0.00 H new ATOM 0 HG2 PRO A 11 12.257 -4.612 4.362 1.00 0.00 H new ATOM 0 HG3 PRO A 11 12.118 -5.304 2.758 1.00 0.00 H new ATOM 0 HD2 PRO A 11 13.032 -2.746 3.201 1.00 0.00 H new ATOM 0 HD3 PRO A 11 12.246 -3.224 1.709 1.00 0.00 H new ATOM 184 N ALA A 12 8.889 -2.060 5.771 1.00 0.00 N ATOM 185 CA ALA A 12 8.729 -1.725 7.181 1.00 0.00 C ATOM 186 C ALA A 12 7.283 -1.341 7.475 1.00 0.00 C ATOM 187 O ALA A 12 6.738 -0.439 6.845 1.00 0.00 O ATOM 188 CB ALA A 12 9.671 -0.593 7.565 1.00 0.00 C ATOM 0 H ALA A 12 8.169 -1.667 5.164 1.00 0.00 H new ATOM 0 HA ALA A 12 8.980 -2.601 7.778 1.00 0.00 H new ATOM 0 HB1 ALA A 12 9.541 -0.353 8.620 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.701 -0.901 7.387 1.00 0.00 H new ATOM 0 HB3 ALA A 12 9.447 0.287 6.963 1.00 0.00 H new ATOM 194 N THR A 13 6.676 -2.033 8.439 1.00 0.00 N ATOM 195 CA THR A 13 5.293 -1.783 8.833 1.00 0.00 C ATOM 196 C THR A 13 4.873 -2.650 10.018 1.00 0.00 C ATOM 197 O THR A 13 3.685 -2.910 10.208 1.00 0.00 O ATOM 198 CB THR A 13 4.335 -2.019 7.659 1.00 0.00 C ATOM 199 OG1 THR A 13 4.678 -1.214 6.547 1.00 0.00 O ATOM 200 CG2 THR A 13 2.889 -1.720 7.993 1.00 0.00 C ATOM 0 H THR A 13 7.129 -2.780 8.966 1.00 0.00 H new ATOM 0 HA THR A 13 5.237 -0.738 9.137 1.00 0.00 H new ATOM 0 HB THR A 13 4.436 -3.079 7.428 1.00 0.00 H new ATOM 0 HG1 THR A 13 5.407 -0.608 6.794 1.00 0.00 H new ATOM 0 HG21 THR A 13 2.267 -1.908 7.118 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.565 -2.361 8.813 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.792 -0.675 8.289 1.00 0.00 H new ATOM 208 N LEU A 14 5.831 -3.087 10.830 1.00 0.00 N ATOM 209 CA LEU A 14 5.489 -3.899 11.989 1.00 0.00 C ATOM 210 C LEU A 14 5.432 -3.029 13.238 1.00 0.00 C ATOM 211 O LEU A 14 6.392 -2.948 14.003 1.00 0.00 O ATOM 212 CB LEU A 14 6.512 -5.022 12.177 1.00 0.00 C ATOM 213 CG LEU A 14 5.967 -6.291 12.835 1.00 0.00 C ATOM 214 CD1 LEU A 14 6.535 -7.531 12.163 1.00 0.00 C ATOM 215 CD2 LEU A 14 6.281 -6.298 14.323 1.00 0.00 C ATOM 0 H LEU A 14 6.826 -2.898 10.711 1.00 0.00 H new ATOM 0 HA LEU A 14 4.509 -4.346 11.823 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.924 -5.284 11.203 1.00 0.00 H new ATOM 0 HB3 LEU A 14 7.337 -4.644 12.780 1.00 0.00 H new ATOM 0 HG LEU A 14 4.884 -6.302 12.712 1.00 0.00 H new ATOM 0 HD11 LEU A 14 6.135 -8.422 12.646 1.00 0.00 H new ATOM 0 HD12 LEU A 14 6.257 -7.533 11.109 1.00 0.00 H new ATOM 0 HD13 LEU A 14 7.621 -7.527 12.251 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.886 -7.208 14.774 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.361 -6.261 14.467 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.822 -5.430 14.796 1.00 0.00 H new ATOM 227 N ILE A 15 4.284 -2.393 13.438 1.00 0.00 N ATOM 228 CA ILE A 15 4.061 -1.536 14.593 1.00 0.00 C ATOM 229 C ILE A 15 2.785 -1.940 15.314 1.00 0.00 C ATOM 230 O ILE A 15 2.815 -2.494 16.413 1.00 0.00 O ATOM 231 CB ILE A 15 3.971 -0.048 14.192 1.00 0.00 C ATOM 232 CG1 ILE A 15 4.814 0.228 12.943 1.00 0.00 C ATOM 233 CG2 ILE A 15 4.419 0.838 15.345 1.00 0.00 C ATOM 234 CD1 ILE A 15 6.298 0.039 13.163 1.00 0.00 C ATOM 0 H ILE A 15 3.486 -2.457 12.807 1.00 0.00 H new ATOM 0 HA ILE A 15 4.916 -1.662 15.258 1.00 0.00 H new ATOM 0 HB ILE A 15 2.932 0.184 13.959 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.487 -0.433 12.140 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.631 1.250 12.610 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.350 1.884 15.048 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.777 0.663 16.209 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.451 0.602 15.606 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.833 0.251 12.237 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.640 0.719 13.944 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.493 -0.990 13.467 1.00 0.00 H new ATOM 246 N LYS A 16 1.659 -1.655 14.665 1.00 0.00 N ATOM 247 CA LYS A 16 0.344 -1.976 15.196 1.00 0.00 C ATOM 248 C LYS A 16 -0.601 -2.344 14.057 1.00 0.00 C ATOM 249 O LYS A 16 -0.554 -1.743 12.983 1.00 0.00 O ATOM 250 CB LYS A 16 -0.218 -0.791 15.984 1.00 0.00 C ATOM 251 CG LYS A 16 0.722 -0.276 17.061 1.00 0.00 C ATOM 252 CD LYS A 16 -0.044 0.238 18.269 1.00 0.00 C ATOM 253 CE LYS A 16 -0.479 1.683 18.080 1.00 0.00 C ATOM 254 NZ LYS A 16 -1.674 2.016 18.903 1.00 0.00 N ATOM 0 H LYS A 16 1.636 -1.194 13.755 1.00 0.00 H new ATOM 0 HA LYS A 16 0.437 -2.827 15.870 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.444 0.020 15.292 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.160 -1.087 16.446 1.00 0.00 H new ATOM 0 HG2 LYS A 16 1.396 -1.075 17.369 1.00 0.00 H new ATOM 0 HG3 LYS A 16 1.341 0.524 16.654 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -0.920 -0.388 18.439 1.00 0.00 H new ATOM 0 HD3 LYS A 16 0.581 0.159 19.158 1.00 0.00 H new ATOM 0 HE2 LYS A 16 0.343 2.347 18.348 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -0.702 1.860 17.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -1.938 3.009 18.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.466 1.400 18.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -1.454 1.872 19.909 1.00 0.00 H new ATOM 268 N ALA A 17 -1.446 -3.339 14.288 1.00 0.00 N ATOM 269 CA ALA A 17 -2.388 -3.790 13.272 1.00 0.00 C ATOM 270 C ALA A 17 -3.572 -2.840 13.143 1.00 0.00 C ATOM 271 O ALA A 17 -4.160 -2.422 14.140 1.00 0.00 O ATOM 272 CB ALA A 17 -2.869 -5.198 13.587 1.00 0.00 C ATOM 0 H ALA A 17 -1.499 -3.849 15.169 1.00 0.00 H new ATOM 0 HA ALA A 17 -1.866 -3.799 12.315 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.572 -5.522 12.820 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.017 -5.877 13.609 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.363 -5.205 14.558 1.00 0.00 H new ATOM 278 N ILE A 18 -3.917 -2.506 11.902 1.00 0.00 N ATOM 279 CA ILE A 18 -5.032 -1.607 11.630 1.00 0.00 C ATOM 280 C ILE A 18 -5.631 -1.888 10.255 1.00 0.00 C ATOM 281 O ILE A 18 -4.980 -2.483 9.394 1.00 0.00 O ATOM 282 CB ILE A 18 -4.601 -0.130 11.697 1.00 0.00 C ATOM 283 CG1 ILE A 18 -3.779 0.129 12.963 1.00 0.00 C ATOM 284 CG2 ILE A 18 -5.821 0.778 11.654 1.00 0.00 C ATOM 285 CD1 ILE A 18 -3.356 1.573 13.130 1.00 0.00 C ATOM 0 H ILE A 18 -3.438 -2.846 11.068 1.00 0.00 H new ATOM 0 HA ILE A 18 -5.781 -1.789 12.401 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.976 0.091 10.832 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.363 -0.172 13.833 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.890 -0.501 12.943 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.502 1.819 11.702 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -6.368 0.609 10.727 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.469 0.558 12.503 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.778 1.679 14.048 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.744 1.874 12.279 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.241 2.208 13.183 1.00 0.00 H new ATOM 297 N ASP A 19 -6.873 -1.462 10.053 1.00 0.00 N ATOM 298 CA ASP A 19 -7.556 -1.670 8.782 1.00 0.00 C ATOM 299 C ASP A 19 -6.910 -0.847 7.672 1.00 0.00 C ATOM 300 O ASP A 19 -6.036 -0.019 7.927 1.00 0.00 O ATOM 301 CB ASP A 19 -9.037 -1.307 8.907 1.00 0.00 C ATOM 302 CG ASP A 19 -9.904 -2.509 9.230 1.00 0.00 C ATOM 303 OD1 ASP A 19 -9.841 -2.993 10.378 1.00 0.00 O ATOM 304 OD2 ASP A 19 -10.645 -2.964 8.333 1.00 0.00 O ATOM 0 H ASP A 19 -7.427 -0.970 10.754 1.00 0.00 H new ATOM 0 HA ASP A 19 -7.469 -2.725 8.523 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -9.159 -0.555 9.687 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -9.378 -0.857 7.974 1.00 0.00 H new ATOM 309 N GLY A 20 -7.349 -1.079 6.437 1.00 0.00 N ATOM 310 CA GLY A 20 -6.805 -0.350 5.304 1.00 0.00 C ATOM 311 C GLY A 20 -7.214 1.111 5.304 1.00 0.00 C ATOM 312 O GLY A 20 -7.942 1.560 4.418 1.00 0.00 O ATOM 0 H GLY A 20 -8.072 -1.759 6.201 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.717 -0.420 5.319 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.141 -0.818 4.379 1.00 0.00 H new ATOM 316 N ASP A 21 -6.740 1.852 6.299 1.00 0.00 N ATOM 317 CA ASP A 21 -7.048 3.270 6.422 1.00 0.00 C ATOM 318 C ASP A 21 -5.879 4.007 7.062 1.00 0.00 C ATOM 319 O ASP A 21 -5.391 5.003 6.532 1.00 0.00 O ATOM 320 CB ASP A 21 -8.321 3.479 7.248 1.00 0.00 C ATOM 321 CG ASP A 21 -8.404 2.552 8.448 1.00 0.00 C ATOM 322 OD1 ASP A 21 -7.379 1.925 8.788 1.00 0.00 O ATOM 323 OD2 ASP A 21 -9.495 2.454 9.047 1.00 0.00 O ATOM 0 H ASP A 21 -6.136 1.490 7.037 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.217 3.673 5.424 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -8.361 4.513 7.590 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -9.192 3.320 6.611 1.00 0.00 H new ATOM 328 N THR A 22 -5.436 3.499 8.207 1.00 0.00 N ATOM 329 CA THR A 22 -4.322 4.094 8.930 1.00 0.00 C ATOM 330 C THR A 22 -3.456 3.016 9.574 1.00 0.00 C ATOM 331 O THR A 22 -3.840 2.408 10.571 1.00 0.00 O ATOM 332 CB THR A 22 -4.836 5.061 9.998 1.00 0.00 C ATOM 333 OG1 THR A 22 -3.816 5.369 10.931 1.00 0.00 O ATOM 334 CG2 THR A 22 -6.019 4.522 10.776 1.00 0.00 C ATOM 0 H THR A 22 -5.834 2.673 8.654 1.00 0.00 H new ATOM 0 HA THR A 22 -3.711 4.647 8.217 1.00 0.00 H new ATOM 0 HB THR A 22 -5.153 5.949 9.451 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.165 5.990 11.604 1.00 0.00 H new ATOM 0 HG21 THR A 22 -6.333 5.258 11.517 1.00 0.00 H new ATOM 0 HG22 THR A 22 -6.843 4.321 10.092 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.733 3.599 11.280 1.00 0.00 H new ATOM 342 N VAL A 23 -2.282 2.796 8.997 1.00 0.00 N ATOM 343 CA VAL A 23 -1.342 1.803 9.505 1.00 0.00 C ATOM 344 C VAL A 23 0.047 2.410 9.639 1.00 0.00 C ATOM 345 O VAL A 23 0.562 3.013 8.698 1.00 0.00 O ATOM 346 CB VAL A 23 -1.267 0.571 8.583 1.00 0.00 C ATOM 347 CG1 VAL A 23 -0.422 -0.521 9.219 1.00 0.00 C ATOM 348 CG2 VAL A 23 -2.663 0.059 8.262 1.00 0.00 C ATOM 0 H VAL A 23 -1.955 3.296 8.170 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.703 1.484 10.483 1.00 0.00 H new ATOM 0 HB VAL A 23 -0.791 0.867 7.648 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -0.381 -1.383 8.553 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.587 -0.146 9.391 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -0.866 -0.817 10.169 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.590 -0.811 7.610 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.169 -0.221 9.186 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.231 0.842 7.760 1.00 0.00 H new ATOM 358 N LYS A 24 0.647 2.267 10.816 1.00 0.00 N ATOM 359 CA LYS A 24 1.970 2.826 11.060 1.00 0.00 C ATOM 360 C LYS A 24 3.080 1.816 10.767 1.00 0.00 C ATOM 361 O LYS A 24 2.931 0.619 11.006 1.00 0.00 O ATOM 362 CB LYS A 24 2.078 3.333 12.499 1.00 0.00 C ATOM 363 CG LYS A 24 1.762 2.278 13.547 1.00 0.00 C ATOM 364 CD LYS A 24 0.618 2.709 14.451 1.00 0.00 C ATOM 365 CE LYS A 24 1.128 3.254 15.774 1.00 0.00 C ATOM 366 NZ LYS A 24 2.042 4.413 15.583 1.00 0.00 N ATOM 0 H LYS A 24 0.241 1.772 11.610 1.00 0.00 H new ATOM 0 HA LYS A 24 2.101 3.664 10.376 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.088 3.708 12.667 1.00 0.00 H new ATOM 0 HB3 LYS A 24 1.399 4.176 12.629 1.00 0.00 H new ATOM 0 HG2 LYS A 24 1.503 1.341 13.054 1.00 0.00 H new ATOM 0 HG3 LYS A 24 2.650 2.086 14.150 1.00 0.00 H new ATOM 0 HD2 LYS A 24 0.023 3.471 13.948 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -0.041 1.860 14.636 1.00 0.00 H new ATOM 0 HE2 LYS A 24 0.283 3.557 16.392 1.00 0.00 H new ATOM 0 HE3 LYS A 24 1.651 2.465 16.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 2.287 4.818 16.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 2.909 4.096 15.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 1.570 5.135 15.003 1.00 0.00 H new ATOM 380 N LEU A 25 4.192 2.328 10.246 1.00 0.00 N ATOM 381 CA LEU A 25 5.351 1.525 9.904 1.00 0.00 C ATOM 382 C LEU A 25 6.612 2.173 10.452 1.00 0.00 C ATOM 383 O LEU A 25 6.603 3.346 10.825 1.00 0.00 O ATOM 384 CB LEU A 25 5.478 1.379 8.380 1.00 0.00 C ATOM 385 CG LEU A 25 4.899 2.520 7.544 1.00 0.00 C ATOM 386 CD1 LEU A 25 3.377 2.477 7.567 1.00 0.00 C ATOM 387 CD2 LEU A 25 5.418 3.869 8.028 1.00 0.00 C ATOM 0 H LEU A 25 4.310 3.322 10.049 1.00 0.00 H new ATOM 0 HA LEU A 25 5.224 0.537 10.346 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.534 1.274 8.132 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.987 0.452 8.082 1.00 0.00 H new ATOM 0 HG LEU A 25 5.227 2.391 6.513 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.981 3.296 6.967 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.034 1.527 7.157 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.026 2.577 8.594 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.991 4.664 7.417 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.130 4.017 9.069 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.505 3.892 7.945 1.00 0.00 H new ATOM 399 N MET A 26 7.704 1.421 10.485 1.00 0.00 N ATOM 400 CA MET A 26 8.962 1.960 10.971 1.00 0.00 C ATOM 401 C MET A 26 9.589 2.844 9.900 1.00 0.00 C ATOM 402 O MET A 26 10.223 2.351 8.967 1.00 0.00 O ATOM 403 CB MET A 26 9.917 0.827 11.347 1.00 0.00 C ATOM 404 CG MET A 26 9.326 -0.166 12.335 1.00 0.00 C ATOM 405 SD MET A 26 10.557 -1.301 13.001 1.00 0.00 S ATOM 406 CE MET A 26 10.237 -1.154 14.757 1.00 0.00 C ATOM 0 H MET A 26 7.743 0.447 10.184 1.00 0.00 H new ATOM 0 HA MET A 26 8.771 2.559 11.862 1.00 0.00 H new ATOM 0 HB2 MET A 26 10.210 0.295 10.442 1.00 0.00 H new ATOM 0 HB3 MET A 26 10.824 1.255 11.774 1.00 0.00 H new ATOM 0 HG2 MET A 26 8.858 0.379 13.155 1.00 0.00 H new ATOM 0 HG3 MET A 26 8.539 -0.738 11.843 1.00 0.00 H new ATOM 0 HE1 MET A 26 10.922 -1.799 15.307 1.00 0.00 H new ATOM 0 HE2 MET A 26 10.384 -0.120 15.068 1.00 0.00 H new ATOM 0 HE3 MET A 26 9.210 -1.453 14.966 1.00 0.00 H new ATOM 416 N TYR A 27 9.400 4.154 10.032 1.00 0.00 N ATOM 417 CA TYR A 27 9.939 5.104 9.068 1.00 0.00 C ATOM 418 C TYR A 27 10.736 6.201 9.766 1.00 0.00 C ATOM 419 O TYR A 27 10.181 7.005 10.513 1.00 0.00 O ATOM 420 CB TYR A 27 8.804 5.723 8.252 1.00 0.00 C ATOM 421 CG TYR A 27 9.262 6.357 6.960 1.00 0.00 C ATOM 422 CD1 TYR A 27 10.024 7.516 6.966 1.00 0.00 C ATOM 423 CD2 TYR A 27 8.933 5.794 5.733 1.00 0.00 C ATOM 424 CE1 TYR A 27 10.447 8.098 5.788 1.00 0.00 C ATOM 425 CE2 TYR A 27 9.351 6.369 4.549 1.00 0.00 C ATOM 426 CZ TYR A 27 10.108 7.522 4.582 1.00 0.00 C ATOM 427 OH TYR A 27 10.526 8.099 3.405 1.00 0.00 O ATOM 0 H TYR A 27 8.878 4.580 10.797 1.00 0.00 H new ATOM 0 HA TYR A 27 10.612 4.566 8.400 1.00 0.00 H new ATOM 0 HB2 TYR A 27 8.067 4.952 8.027 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.301 6.477 8.858 1.00 0.00 H new ATOM 0 HD1 TYR A 27 10.291 7.971 7.908 1.00 0.00 H new ATOM 0 HD2 TYR A 27 8.340 4.892 5.705 1.00 0.00 H new ATOM 0 HE1 TYR A 27 11.041 9.000 5.811 1.00 0.00 H new ATOM 0 HE2 TYR A 27 9.087 5.919 3.603 1.00 0.00 H new ATOM 0 HH TYR A 27 10.945 7.419 2.838 1.00 0.00 H new ATOM 437 N LYS A 28 12.043 6.226 9.519 1.00 0.00 N ATOM 438 CA LYS A 28 12.919 7.223 10.124 1.00 0.00 C ATOM 439 C LYS A 28 12.737 7.262 11.639 1.00 0.00 C ATOM 440 O LYS A 28 12.979 8.286 12.278 1.00 0.00 O ATOM 441 CB LYS A 28 12.642 8.605 9.531 1.00 0.00 C ATOM 442 CG LYS A 28 13.873 9.492 9.454 1.00 0.00 C ATOM 443 CD LYS A 28 14.594 9.330 8.125 1.00 0.00 C ATOM 444 CE LYS A 28 15.032 10.673 7.561 1.00 0.00 C ATOM 445 NZ LYS A 28 16.248 10.548 6.710 1.00 0.00 N ATOM 0 H LYS A 28 12.518 5.566 8.903 1.00 0.00 H new ATOM 0 HA LYS A 28 13.949 6.942 9.907 1.00 0.00 H new ATOM 0 HB2 LYS A 28 12.228 8.485 8.530 1.00 0.00 H new ATOM 0 HB3 LYS A 28 11.882 9.104 10.133 1.00 0.00 H new ATOM 0 HG2 LYS A 28 13.581 10.534 9.586 1.00 0.00 H new ATOM 0 HG3 LYS A 28 14.552 9.245 10.270 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.465 8.689 8.258 1.00 0.00 H new ATOM 0 HD3 LYS A 28 13.937 8.831 7.412 1.00 0.00 H new ATOM 0 HE2 LYS A 28 14.220 11.102 6.974 1.00 0.00 H new ATOM 0 HE3 LYS A 28 15.232 11.363 8.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 16.514 11.485 6.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 17.030 10.162 7.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 16.050 9.909 5.913 1.00 0.00 H new ATOM 459 N GLY A 29 12.307 6.138 12.207 1.00 0.00 N ATOM 460 CA GLY A 29 12.097 6.067 13.639 1.00 0.00 C ATOM 461 C GLY A 29 10.873 6.843 14.093 1.00 0.00 C ATOM 462 O GLY A 29 10.701 7.093 15.285 1.00 0.00 O ATOM 0 H GLY A 29 12.101 5.277 11.700 1.00 0.00 H new ATOM 0 HA2 GLY A 29 11.990 5.023 13.935 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.978 6.455 14.151 1.00 0.00 H new ATOM 466 N GLN A 30 10.021 7.226 13.143 1.00 0.00 N ATOM 467 CA GLN A 30 8.813 7.977 13.466 1.00 0.00 C ATOM 468 C GLN A 30 7.569 7.275 12.922 1.00 0.00 C ATOM 469 O GLN A 30 7.586 6.735 11.816 1.00 0.00 O ATOM 470 CB GLN A 30 8.904 9.395 12.897 1.00 0.00 C ATOM 471 CG GLN A 30 8.454 10.472 13.871 1.00 0.00 C ATOM 472 CD GLN A 30 8.892 11.860 13.448 1.00 0.00 C ATOM 473 OE1 GLN A 30 8.597 12.307 12.339 1.00 0.00 O ATOM 474 NE2 GLN A 30 9.602 12.552 14.333 1.00 0.00 N ATOM 0 H GLN A 30 10.145 7.029 12.150 1.00 0.00 H new ATOM 0 HA GLN A 30 8.729 8.032 14.551 1.00 0.00 H new ATOM 0 HB2 GLN A 30 9.934 9.593 12.600 1.00 0.00 H new ATOM 0 HB3 GLN A 30 8.295 9.455 11.995 1.00 0.00 H new ATOM 0 HG2 GLN A 30 7.368 10.448 13.957 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.857 10.254 14.860 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.824 12.143 15.241 1.00 0.00 H new ATOM 0 HE22 GLN A 30 9.925 13.492 14.105 1.00 0.00 H new ATOM 483 N PRO A 31 6.464 7.280 13.692 1.00 0.00 N ATOM 484 CA PRO A 31 5.210 6.645 13.274 1.00 0.00 C ATOM 485 C PRO A 31 4.564 7.375 12.102 1.00 0.00 C ATOM 486 O PRO A 31 4.500 8.603 12.085 1.00 0.00 O ATOM 487 CB PRO A 31 4.324 6.743 14.518 1.00 0.00 C ATOM 488 CG PRO A 31 4.868 7.900 15.282 1.00 0.00 C ATOM 489 CD PRO A 31 6.349 7.908 15.021 1.00 0.00 C ATOM 0 HA PRO A 31 5.365 5.623 12.929 1.00 0.00 H new ATOM 0 HB2 PRO A 31 3.280 6.903 14.249 1.00 0.00 H new ATOM 0 HB3 PRO A 31 4.365 5.826 15.106 1.00 0.00 H new ATOM 0 HG2 PRO A 31 4.409 8.833 14.956 1.00 0.00 H new ATOM 0 HG3 PRO A 31 4.660 7.797 16.347 1.00 0.00 H new ATOM 0 HD2 PRO A 31 6.752 8.921 15.023 1.00 0.00 H new ATOM 0 HD3 PRO A 31 6.894 7.346 15.780 1.00 0.00 H new ATOM 497 N MET A 32 4.093 6.614 11.119 1.00 0.00 N ATOM 498 CA MET A 32 3.463 7.200 9.943 1.00 0.00 C ATOM 499 C MET A 32 2.321 6.321 9.430 1.00 0.00 C ATOM 500 O MET A 32 2.549 5.228 8.917 1.00 0.00 O ATOM 501 CB MET A 32 4.513 7.408 8.849 1.00 0.00 C ATOM 502 CG MET A 32 4.968 8.852 8.707 1.00 0.00 C ATOM 503 SD MET A 32 3.606 9.983 8.368 1.00 0.00 S ATOM 504 CE MET A 32 3.304 10.647 10.005 1.00 0.00 C ATOM 0 H MET A 32 4.136 5.595 11.114 1.00 0.00 H new ATOM 0 HA MET A 32 3.037 8.164 10.222 1.00 0.00 H new ATOM 0 HB2 MET A 32 5.379 6.783 9.065 1.00 0.00 H new ATOM 0 HB3 MET A 32 4.105 7.069 7.897 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.472 9.161 9.623 1.00 0.00 H new ATOM 0 HG3 MET A 32 5.700 8.920 7.902 1.00 0.00 H new ATOM 0 HE1 MET A 32 2.940 11.671 9.921 1.00 0.00 H new ATOM 0 HE2 MET A 32 2.557 10.037 10.513 1.00 0.00 H new ATOM 0 HE3 MET A 32 4.231 10.638 10.578 1.00 0.00 H new ATOM 514 N THR A 33 1.091 6.807 9.585 1.00 0.00 N ATOM 515 CA THR A 33 -0.097 6.074 9.152 1.00 0.00 C ATOM 516 C THR A 33 -0.303 6.146 7.638 1.00 0.00 C ATOM 517 O THR A 33 -0.264 7.222 7.040 1.00 0.00 O ATOM 518 CB THR A 33 -1.335 6.618 9.866 1.00 0.00 C ATOM 519 OG1 THR A 33 -1.555 7.974 9.522 1.00 0.00 O ATOM 520 CG2 THR A 33 -1.242 6.534 11.374 1.00 0.00 C ATOM 0 H THR A 33 0.890 7.712 10.010 1.00 0.00 H new ATOM 0 HA THR A 33 0.055 5.027 9.414 1.00 0.00 H new ATOM 0 HB THR A 33 -2.161 5.988 9.535 1.00 0.00 H new ATOM 0 HG1 THR A 33 -1.279 8.125 8.594 1.00 0.00 H new ATOM 0 HG21 THR A 33 -2.153 6.936 11.818 1.00 0.00 H new ATOM 0 HG22 THR A 33 -1.122 5.493 11.674 1.00 0.00 H new ATOM 0 HG23 THR A 33 -0.384 7.112 11.718 1.00 0.00 H new ATOM 528 N PHE A 34 -0.530 4.981 7.034 1.00 0.00 N ATOM 529 CA PHE A 34 -0.760 4.863 5.596 1.00 0.00 C ATOM 530 C PHE A 34 -2.238 4.573 5.325 1.00 0.00 C ATOM 531 O PHE A 34 -2.952 4.083 6.201 1.00 0.00 O ATOM 532 CB PHE A 34 0.084 3.727 4.991 1.00 0.00 C ATOM 533 CG PHE A 34 1.584 3.908 5.070 1.00 0.00 C ATOM 534 CD1 PHE A 34 2.167 4.820 5.938 1.00 0.00 C ATOM 535 CD2 PHE A 34 2.415 3.149 4.261 1.00 0.00 C ATOM 536 CE1 PHE A 34 3.539 4.968 5.992 1.00 0.00 C ATOM 537 CE2 PHE A 34 3.788 3.297 4.313 1.00 0.00 C ATOM 538 CZ PHE A 34 4.348 4.207 5.178 1.00 0.00 C ATOM 0 H PHE A 34 -0.560 4.090 7.530 1.00 0.00 H new ATOM 0 HA PHE A 34 -0.470 5.807 5.134 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -0.178 2.797 5.495 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.194 3.611 3.944 1.00 0.00 H new ATOM 0 HD1 PHE A 34 1.540 5.422 6.579 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.983 2.431 3.580 1.00 0.00 H new ATOM 0 HE1 PHE A 34 3.978 5.682 6.674 1.00 0.00 H new ATOM 0 HE2 PHE A 34 4.421 2.698 3.675 1.00 0.00 H new ATOM 0 HZ PHE A 34 5.421 4.325 5.219 1.00 0.00 H new ATOM 548 N ARG A 35 -2.688 4.864 4.111 1.00 0.00 N ATOM 549 CA ARG A 35 -4.074 4.622 3.722 1.00 0.00 C ATOM 550 C ARG A 35 -4.139 3.575 2.614 1.00 0.00 C ATOM 551 O ARG A 35 -3.227 3.472 1.794 1.00 0.00 O ATOM 552 CB ARG A 35 -4.733 5.921 3.257 1.00 0.00 C ATOM 553 CG ARG A 35 -6.230 5.970 3.524 1.00 0.00 C ATOM 554 CD ARG A 35 -6.567 6.934 4.651 1.00 0.00 C ATOM 555 NE ARG A 35 -7.864 6.631 5.256 1.00 0.00 N ATOM 556 CZ ARG A 35 -8.236 7.051 6.463 1.00 0.00 C ATOM 557 NH1 ARG A 35 -7.417 7.795 7.197 1.00 0.00 N ATOM 558 NH2 ARG A 35 -9.432 6.727 6.937 1.00 0.00 N ATOM 0 H ARG A 35 -2.111 5.270 3.374 1.00 0.00 H new ATOM 0 HA ARG A 35 -4.615 4.248 4.591 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -4.255 6.762 3.759 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -4.558 6.046 2.188 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -6.752 6.274 2.617 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -6.587 4.972 3.779 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -5.790 6.887 5.414 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -6.575 7.954 4.267 1.00 0.00 H new ATOM 0 HE ARG A 35 -8.522 6.064 4.721 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -6.497 8.048 6.837 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -7.708 8.114 8.121 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -10.065 6.157 6.377 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -9.718 7.048 7.862 1.00 0.00 H new ATOM 572 N LEU A 36 -5.213 2.790 2.599 1.00 0.00 N ATOM 573 CA LEU A 36 -5.374 1.745 1.593 1.00 0.00 C ATOM 574 C LEU A 36 -6.387 2.143 0.524 1.00 0.00 C ATOM 575 O LEU A 36 -7.469 2.645 0.829 1.00 0.00 O ATOM 576 CB LEU A 36 -5.799 0.432 2.256 1.00 0.00 C ATOM 577 CG LEU A 36 -4.922 -0.777 1.924 1.00 0.00 C ATOM 578 CD1 LEU A 36 -4.740 -0.914 0.420 1.00 0.00 C ATOM 579 CD2 LEU A 36 -3.571 -0.659 2.618 1.00 0.00 C ATOM 0 H LEU A 36 -5.980 2.857 3.268 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.410 1.607 1.104 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -5.802 0.573 3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.824 0.209 1.961 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.422 -1.674 2.289 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.113 -1.780 0.207 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.713 -1.045 -0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.263 -0.016 0.028 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.959 -1.527 2.372 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.067 0.248 2.282 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.719 -0.614 3.697 1.00 0.00 H new ATOM 591 N LEU A 37 -6.024 1.907 -0.735 1.00 0.00 N ATOM 592 CA LEU A 37 -6.890 2.227 -1.862 1.00 0.00 C ATOM 593 C LEU A 37 -6.745 1.183 -2.964 1.00 0.00 C ATOM 594 O LEU A 37 -5.633 0.802 -3.327 1.00 0.00 O ATOM 595 CB LEU A 37 -6.557 3.616 -2.412 1.00 0.00 C ATOM 596 CG LEU A 37 -7.593 4.197 -3.374 1.00 0.00 C ATOM 597 CD1 LEU A 37 -8.744 4.825 -2.603 1.00 0.00 C ATOM 598 CD2 LEU A 37 -6.947 5.218 -4.298 1.00 0.00 C ATOM 0 H LEU A 37 -5.130 1.493 -0.999 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.922 2.223 -1.511 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.437 4.303 -1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.596 3.566 -2.924 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.991 3.386 -3.983 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.472 5.233 -3.304 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.223 4.067 -1.983 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.363 5.625 -1.968 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.699 5.622 -4.976 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.521 6.027 -3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.157 4.738 -4.876 1.00 0.00 H new ATOM 610 N LEU A 38 -7.873 0.720 -3.494 1.00 0.00 N ATOM 611 CA LEU A 38 -7.862 -0.283 -4.554 1.00 0.00 C ATOM 612 C LEU A 38 -7.986 0.369 -5.926 1.00 0.00 C ATOM 613 O LEU A 38 -8.622 1.413 -6.073 1.00 0.00 O ATOM 614 CB LEU A 38 -9.000 -1.285 -4.351 1.00 0.00 C ATOM 615 CG LEU A 38 -8.901 -2.557 -5.199 1.00 0.00 C ATOM 616 CD1 LEU A 38 -8.520 -3.750 -4.337 1.00 0.00 C ATOM 617 CD2 LEU A 38 -10.212 -2.819 -5.925 1.00 0.00 C ATOM 0 H LEU A 38 -8.804 1.022 -3.208 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.909 -0.810 -4.507 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -9.031 -1.569 -3.299 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.945 -0.789 -4.575 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.119 -2.410 -5.944 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.455 -4.643 -4.959 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.554 -3.565 -3.866 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -9.277 -3.899 -3.567 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -10.122 -3.726 -6.522 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -11.013 -2.942 -5.196 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -10.441 -1.977 -6.578 1.00 0.00 H new ATOM 629 N VAL A 39 -7.374 -0.253 -6.929 1.00 0.00 N ATOM 630 CA VAL A 39 -7.418 0.265 -8.289 1.00 0.00 C ATOM 631 C VAL A 39 -8.829 0.185 -8.863 1.00 0.00 C ATOM 632 O VAL A 39 -9.355 -0.904 -9.090 1.00 0.00 O ATOM 633 CB VAL A 39 -6.454 -0.501 -9.217 1.00 0.00 C ATOM 634 CG1 VAL A 39 -6.397 0.152 -10.589 1.00 0.00 C ATOM 635 CG2 VAL A 39 -5.065 -0.580 -8.599 1.00 0.00 C ATOM 0 H VAL A 39 -6.842 -1.117 -6.824 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.107 1.309 -8.238 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.831 -1.516 -9.340 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.711 -0.404 -11.228 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.392 0.149 -11.035 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.047 1.179 -10.489 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.399 -1.124 -9.269 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -4.679 0.427 -8.443 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.121 -1.100 -7.642 1.00 0.00 H new ATOM 645 N ASP A 40 -9.436 1.343 -9.091 1.00 0.00 N ATOM 646 CA ASP A 40 -10.787 1.406 -9.636 1.00 0.00 C ATOM 647 C ASP A 40 -10.819 0.903 -11.075 1.00 0.00 C ATOM 648 O ASP A 40 -9.791 0.863 -11.753 1.00 0.00 O ATOM 649 CB ASP A 40 -11.320 2.838 -9.570 1.00 0.00 C ATOM 650 CG ASP A 40 -11.313 3.393 -8.159 1.00 0.00 C ATOM 651 OD1 ASP A 40 -12.106 2.906 -7.326 1.00 0.00 O ATOM 652 OD2 ASP A 40 -10.516 4.315 -7.887 1.00 0.00 O ATOM 0 H ASP A 40 -9.014 2.253 -8.907 1.00 0.00 H new ATOM 0 HA ASP A 40 -11.425 0.761 -9.032 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.715 3.478 -10.212 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -12.337 2.863 -9.962 1.00 0.00 H new ATOM 657 N THR A 41 -12.005 0.522 -11.537 1.00 0.00 N ATOM 658 CA THR A 41 -12.172 0.023 -12.897 1.00 0.00 C ATOM 659 C THR A 41 -12.467 1.168 -13.866 1.00 0.00 C ATOM 660 O THR A 41 -13.562 1.729 -13.856 1.00 0.00 O ATOM 661 CB THR A 41 -13.303 -1.004 -12.948 1.00 0.00 C ATOM 662 OG1 THR A 41 -13.256 -1.859 -11.820 1.00 0.00 O ATOM 663 CG2 THR A 41 -13.265 -1.875 -14.185 1.00 0.00 C ATOM 0 H THR A 41 -12.865 0.549 -10.989 1.00 0.00 H new ATOM 0 HA THR A 41 -11.240 -0.455 -13.199 1.00 0.00 H new ATOM 0 HB THR A 41 -14.223 -0.419 -12.962 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.989 -2.508 -11.870 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.095 -2.581 -14.158 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.350 -1.249 -15.073 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.323 -2.423 -14.216 1.00 0.00 H new ATOM 671 N PRO A 42 -11.492 1.536 -14.719 1.00 0.00 N ATOM 672 CA PRO A 42 -11.664 2.620 -15.690 1.00 0.00 C ATOM 673 C PRO A 42 -12.663 2.264 -16.784 1.00 0.00 C ATOM 674 O PRO A 42 -12.772 1.105 -17.187 1.00 0.00 O ATOM 675 CB PRO A 42 -10.263 2.800 -16.281 1.00 0.00 C ATOM 676 CG PRO A 42 -9.597 1.482 -16.087 1.00 0.00 C ATOM 677 CD PRO A 42 -10.151 0.924 -14.804 1.00 0.00 C ATOM 0 HA PRO A 42 -12.061 3.522 -15.225 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -10.310 3.068 -17.336 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -9.719 3.597 -15.774 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -9.802 0.814 -16.924 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -8.515 1.596 -16.028 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -10.206 -0.164 -14.829 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -9.531 1.192 -13.948 1.00 0.00 H new ATOM 685 N GLU A 43 -13.391 3.268 -17.263 1.00 0.00 N ATOM 686 CA GLU A 43 -14.382 3.063 -18.313 1.00 0.00 C ATOM 687 C GLU A 43 -14.206 4.084 -19.431 1.00 0.00 C ATOM 688 O GLU A 43 -13.396 5.005 -19.323 1.00 0.00 O ATOM 689 CB GLU A 43 -15.794 3.159 -17.735 1.00 0.00 C ATOM 690 CG GLU A 43 -16.167 1.988 -16.841 1.00 0.00 C ATOM 691 CD GLU A 43 -17.112 1.014 -17.518 1.00 0.00 C ATOM 692 OE1 GLU A 43 -18.272 1.395 -17.777 1.00 0.00 O ATOM 693 OE2 GLU A 43 -16.691 -0.130 -17.788 1.00 0.00 O ATOM 0 H GLU A 43 -13.313 4.232 -16.940 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.235 2.066 -18.729 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -15.882 4.083 -17.164 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -16.510 3.222 -18.555 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.261 1.461 -16.542 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.631 2.365 -15.930 1.00 0.00 H new ATOM 700 N THR A 44 -14.972 3.918 -20.505 1.00 0.00 N ATOM 701 CA THR A 44 -14.900 4.828 -21.641 1.00 0.00 C ATOM 702 C THR A 44 -15.667 6.114 -21.355 1.00 0.00 C ATOM 703 O THR A 44 -16.894 6.151 -21.451 1.00 0.00 O ATOM 704 CB THR A 44 -15.457 4.155 -22.897 1.00 0.00 C ATOM 705 OG1 THR A 44 -16.551 3.315 -22.572 1.00 0.00 O ATOM 706 CG2 THR A 44 -14.435 3.316 -23.631 1.00 0.00 C ATOM 0 H THR A 44 -15.649 3.162 -20.612 1.00 0.00 H new ATOM 0 HA THR A 44 -13.853 5.080 -21.808 1.00 0.00 H new ATOM 0 HB THR A 44 -15.766 4.972 -23.549 1.00 0.00 H new ATOM 0 HG1 THR A 44 -16.895 2.895 -23.388 1.00 0.00 H new ATOM 0 HG21 THR A 44 -14.896 2.868 -24.511 1.00 0.00 H new ATOM 0 HG22 THR A 44 -13.601 3.946 -23.940 1.00 0.00 H new ATOM 0 HG23 THR A 44 -14.070 2.528 -22.972 1.00 0.00 H new ATOM 714 N LYS A 45 -14.938 7.166 -21.001 1.00 0.00 N ATOM 715 CA LYS A 45 -15.548 8.457 -20.699 1.00 0.00 C ATOM 716 C LYS A 45 -16.566 8.334 -19.566 1.00 0.00 C ATOM 717 O LYS A 45 -17.447 9.182 -19.420 1.00 0.00 O ATOM 718 CB LYS A 45 -16.223 9.027 -21.947 1.00 0.00 C ATOM 719 CG LYS A 45 -16.116 10.538 -22.061 1.00 0.00 C ATOM 720 CD LYS A 45 -17.408 11.223 -21.647 1.00 0.00 C ATOM 721 CE LYS A 45 -17.529 12.607 -22.266 1.00 0.00 C ATOM 722 NZ LYS A 45 -18.903 13.162 -22.124 1.00 0.00 N ATOM 0 H LYS A 45 -13.922 7.151 -20.916 1.00 0.00 H new ATOM 0 HA LYS A 45 -14.758 9.135 -20.376 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -15.776 8.572 -22.831 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -17.276 8.745 -21.941 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -15.298 10.894 -21.435 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -15.872 10.810 -23.088 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -18.258 10.612 -21.950 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -17.446 11.305 -20.561 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -16.815 13.280 -21.792 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -17.266 12.556 -23.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -18.943 14.106 -22.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -19.582 12.533 -22.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -19.145 13.235 -21.115 1.00 0.00 H new ATOM 736 N HIS A 46 -16.441 7.279 -18.766 1.00 0.00 N ATOM 737 CA HIS A 46 -17.352 7.055 -17.650 1.00 0.00 C ATOM 738 C HIS A 46 -16.590 6.994 -16.327 1.00 0.00 C ATOM 739 O HIS A 46 -15.396 6.697 -16.303 1.00 0.00 O ATOM 740 CB HIS A 46 -18.144 5.761 -17.860 1.00 0.00 C ATOM 741 CG HIS A 46 -19.626 5.965 -17.874 1.00 0.00 C ATOM 742 ND1 HIS A 46 -20.228 7.077 -18.421 1.00 0.00 N ATOM 743 CD2 HIS A 46 -20.632 5.190 -17.402 1.00 0.00 C ATOM 744 CE1 HIS A 46 -21.538 6.980 -18.285 1.00 0.00 C ATOM 745 NE2 HIS A 46 -21.809 5.843 -17.670 1.00 0.00 N ATOM 0 H HIS A 46 -15.718 6.567 -18.870 1.00 0.00 H new ATOM 0 HA HIS A 46 -18.047 7.893 -17.608 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -17.839 5.306 -18.802 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -17.890 5.056 -17.069 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -20.527 4.236 -16.907 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -22.264 7.706 -18.620 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -22.742 5.505 -17.433 1.00 0.00 H new ATOM 754 N PRO A 47 -17.275 7.274 -15.205 1.00 0.00 N ATOM 755 CA PRO A 47 -16.658 7.248 -13.876 1.00 0.00 C ATOM 756 C PRO A 47 -15.975 5.917 -13.583 1.00 0.00 C ATOM 757 O PRO A 47 -16.621 4.869 -13.557 1.00 0.00 O ATOM 758 CB PRO A 47 -17.839 7.463 -12.926 1.00 0.00 C ATOM 759 CG PRO A 47 -18.866 8.162 -13.746 1.00 0.00 C ATOM 760 CD PRO A 47 -18.703 7.637 -15.146 1.00 0.00 C ATOM 0 HA PRO A 47 -15.875 8.000 -13.777 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -18.217 6.515 -12.544 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -17.548 8.061 -12.063 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -19.869 7.963 -13.369 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -18.722 9.242 -13.715 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -19.345 6.776 -15.331 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -18.958 8.391 -15.891 1.00 0.00 H new ATOM 768 N LYS A 48 -14.664 5.964 -13.365 1.00 0.00 N ATOM 769 CA LYS A 48 -13.893 4.762 -13.075 1.00 0.00 C ATOM 770 C LYS A 48 -14.234 4.214 -11.694 1.00 0.00 C ATOM 771 O LYS A 48 -14.003 4.871 -10.679 1.00 0.00 O ATOM 772 CB LYS A 48 -12.395 5.058 -13.162 1.00 0.00 C ATOM 773 CG LYS A 48 -11.952 6.225 -12.293 1.00 0.00 C ATOM 774 CD LYS A 48 -11.149 5.754 -11.090 1.00 0.00 C ATOM 775 CE LYS A 48 -10.652 6.924 -10.257 1.00 0.00 C ATOM 776 NZ LYS A 48 -11.736 7.514 -9.425 1.00 0.00 N ATOM 0 H LYS A 48 -14.114 6.823 -13.384 1.00 0.00 H new ATOM 0 HA LYS A 48 -14.152 4.008 -13.819 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.840 4.167 -12.869 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -12.135 5.269 -14.199 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.350 6.913 -12.886 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.827 6.779 -11.953 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -11.767 5.103 -10.472 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -10.300 5.161 -11.428 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -9.840 6.591 -9.611 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -10.242 7.690 -10.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -11.356 8.309 -8.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -12.500 7.856 -10.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.110 6.790 -8.778 1.00 0.00 H new ATOM 790 N LYS A 49 -14.786 3.006 -11.662 1.00 0.00 N ATOM 791 CA LYS A 49 -15.159 2.366 -10.404 1.00 0.00 C ATOM 792 C LYS A 49 -15.632 0.935 -10.641 1.00 0.00 C ATOM 793 O LYS A 49 -15.937 0.551 -11.770 1.00 0.00 O ATOM 794 CB LYS A 49 -16.258 3.173 -9.705 1.00 0.00 C ATOM 795 CG LYS A 49 -15.756 3.980 -8.519 1.00 0.00 C ATOM 796 CD LYS A 49 -16.880 4.296 -7.544 1.00 0.00 C ATOM 797 CE LYS A 49 -16.855 3.367 -6.341 1.00 0.00 C ATOM 798 NZ LYS A 49 -17.134 4.095 -5.072 1.00 0.00 N ATOM 0 H LYS A 49 -14.986 2.449 -12.493 1.00 0.00 H new ATOM 0 HA LYS A 49 -14.278 2.335 -9.763 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -16.716 3.849 -10.427 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -17.039 2.492 -9.367 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -14.972 3.424 -8.005 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -15.308 4.909 -8.873 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -16.792 5.329 -7.208 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -17.840 4.207 -8.053 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -17.594 2.577 -6.477 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -15.880 2.884 -6.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -17.108 3.427 -4.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -16.414 4.832 -4.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -18.075 4.535 -5.124 1.00 0.00 H new ATOM 812 N GLY A 50 -15.689 0.152 -9.569 1.00 0.00 N ATOM 813 CA GLY A 50 -16.124 -1.228 -9.681 1.00 0.00 C ATOM 814 C GLY A 50 -16.589 -1.797 -8.355 1.00 0.00 C ATOM 815 O GLY A 50 -16.862 -1.054 -7.413 1.00 0.00 O ATOM 0 H GLY A 50 -15.442 0.448 -8.625 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -16.936 -1.293 -10.406 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -15.304 -1.834 -10.066 1.00 0.00 H new ATOM 819 N VAL A 51 -16.680 -3.123 -8.282 1.00 0.00 N ATOM 820 CA VAL A 51 -17.116 -3.791 -7.063 1.00 0.00 C ATOM 821 C VAL A 51 -16.049 -3.700 -5.975 1.00 0.00 C ATOM 822 O VAL A 51 -14.857 -3.828 -6.252 1.00 0.00 O ATOM 823 CB VAL A 51 -17.442 -5.275 -7.321 1.00 0.00 C ATOM 824 CG1 VAL A 51 -18.635 -5.405 -8.256 1.00 0.00 C ATOM 825 CG2 VAL A 51 -16.229 -5.998 -7.890 1.00 0.00 C ATOM 0 H VAL A 51 -16.458 -3.753 -9.052 1.00 0.00 H new ATOM 0 HA VAL A 51 -18.019 -3.280 -6.728 1.00 0.00 H new ATOM 0 HB VAL A 51 -17.701 -5.741 -6.370 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -18.850 -6.460 -8.427 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -19.504 -4.925 -7.806 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -18.406 -4.923 -9.207 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -16.478 -7.044 -8.066 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -15.936 -5.532 -8.831 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -15.403 -5.936 -7.182 1.00 0.00 H new ATOM 835 N GLU A 52 -16.487 -3.482 -4.740 1.00 0.00 N ATOM 836 CA GLU A 52 -15.570 -3.376 -3.612 1.00 0.00 C ATOM 837 C GLU A 52 -15.667 -4.608 -2.718 1.00 0.00 C ATOM 838 O GLU A 52 -16.721 -4.895 -2.153 1.00 0.00 O ATOM 839 CB GLU A 52 -15.869 -2.114 -2.800 1.00 0.00 C ATOM 840 CG GLU A 52 -14.622 -1.379 -2.336 1.00 0.00 C ATOM 841 CD GLU A 52 -14.280 -1.671 -0.888 1.00 0.00 C ATOM 842 OE1 GLU A 52 -14.428 -2.836 -0.466 1.00 0.00 O ATOM 843 OE2 GLU A 52 -13.863 -0.732 -0.177 1.00 0.00 O ATOM 0 H GLU A 52 -17.471 -3.375 -4.495 1.00 0.00 H new ATOM 0 HA GLU A 52 -14.555 -3.312 -4.004 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -16.475 -1.439 -3.404 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -16.466 -2.385 -1.929 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -13.781 -1.662 -2.969 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -14.769 -0.306 -2.462 1.00 0.00 H new ATOM 850 N LYS A 53 -14.558 -5.331 -2.592 1.00 0.00 N ATOM 851 CA LYS A 53 -14.519 -6.530 -1.764 1.00 0.00 C ATOM 852 C LYS A 53 -14.908 -6.209 -0.325 1.00 0.00 C ATOM 853 O LYS A 53 -14.063 -5.829 0.487 1.00 0.00 O ATOM 854 CB LYS A 53 -13.124 -7.157 -1.802 1.00 0.00 C ATOM 855 CG LYS A 53 -12.938 -8.161 -2.927 1.00 0.00 C ATOM 856 CD LYS A 53 -11.484 -8.244 -3.364 1.00 0.00 C ATOM 857 CE LYS A 53 -11.361 -8.346 -4.876 1.00 0.00 C ATOM 858 NZ LYS A 53 -10.188 -7.587 -5.389 1.00 0.00 N ATOM 0 H LYS A 53 -13.676 -5.107 -3.053 1.00 0.00 H new ATOM 0 HA LYS A 53 -15.239 -7.243 -2.165 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -12.382 -6.365 -1.907 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -12.931 -7.651 -0.850 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -13.277 -9.144 -2.599 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -13.559 -7.876 -3.777 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -10.947 -7.363 -3.013 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -11.013 -9.111 -2.900 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -11.270 -9.394 -5.163 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -12.271 -7.966 -5.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -10.139 -7.681 -6.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -10.287 -6.583 -5.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -9.317 -7.966 -4.965 1.00 0.00 H new ATOM 872 N TYR A 54 -16.190 -6.364 -0.017 1.00 0.00 N ATOM 873 CA TYR A 54 -16.695 -6.088 1.325 1.00 0.00 C ATOM 874 C TYR A 54 -16.701 -7.351 2.182 1.00 0.00 C ATOM 875 O TYR A 54 -17.596 -7.551 3.004 1.00 0.00 O ATOM 876 CB TYR A 54 -18.107 -5.499 1.247 1.00 0.00 C ATOM 877 CG TYR A 54 -18.213 -4.106 1.824 1.00 0.00 C ATOM 878 CD1 TYR A 54 -17.428 -3.070 1.334 1.00 0.00 C ATOM 879 CD2 TYR A 54 -19.099 -3.826 2.856 1.00 0.00 C ATOM 880 CE1 TYR A 54 -17.522 -1.795 1.859 1.00 0.00 C ATOM 881 CE2 TYR A 54 -19.199 -2.554 3.387 1.00 0.00 C ATOM 882 CZ TYR A 54 -18.409 -1.541 2.885 1.00 0.00 C ATOM 883 OH TYR A 54 -18.505 -0.274 3.409 1.00 0.00 O ATOM 0 H TYR A 54 -16.900 -6.679 -0.678 1.00 0.00 H new ATOM 0 HA TYR A 54 -16.030 -5.363 1.794 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -18.426 -5.477 0.205 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -18.796 -6.157 1.777 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -16.733 -3.264 0.530 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -19.721 -4.616 3.251 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -16.904 -1.001 1.468 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -19.892 -2.354 4.191 1.00 0.00 H new ATOM 0 HH TYR A 54 -19.176 -0.265 4.123 1.00 0.00 H new ATOM 893 N GLY A 55 -15.696 -8.202 1.991 1.00 0.00 N ATOM 894 CA GLY A 55 -15.610 -9.430 2.757 1.00 0.00 C ATOM 895 C GLY A 55 -14.551 -9.362 3.843 1.00 0.00 C ATOM 896 O GLY A 55 -13.629 -8.550 3.765 1.00 0.00 O ATOM 0 H GLY A 55 -14.941 -8.062 1.320 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -16.579 -9.641 3.211 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -15.385 -10.259 2.086 1.00 0.00 H new ATOM 900 N PRO A 56 -14.657 -10.213 4.879 1.00 0.00 N ATOM 901 CA PRO A 56 -13.693 -10.235 5.985 1.00 0.00 C ATOM 902 C PRO A 56 -12.328 -10.773 5.559 1.00 0.00 C ATOM 903 O PRO A 56 -11.336 -10.599 6.265 1.00 0.00 O ATOM 904 CB PRO A 56 -14.340 -11.173 7.004 1.00 0.00 C ATOM 905 CG PRO A 56 -15.223 -12.059 6.196 1.00 0.00 C ATOM 906 CD PRO A 56 -15.724 -11.216 5.056 1.00 0.00 C ATOM 0 HA PRO A 56 -13.496 -9.234 6.370 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -13.589 -11.749 7.544 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -14.911 -10.617 7.747 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -14.675 -12.926 5.828 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -16.051 -12.436 6.796 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.873 -11.808 4.153 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -16.680 -10.749 5.292 1.00 0.00 H new ATOM 914 N GLU A 57 -12.284 -11.428 4.401 1.00 0.00 N ATOM 915 CA GLU A 57 -11.040 -11.990 3.887 1.00 0.00 C ATOM 916 C GLU A 57 -9.957 -10.921 3.772 1.00 0.00 C ATOM 917 O GLU A 57 -8.767 -11.218 3.852 1.00 0.00 O ATOM 918 CB GLU A 57 -11.277 -12.637 2.520 1.00 0.00 C ATOM 919 CG GLU A 57 -11.857 -11.685 1.488 1.00 0.00 C ATOM 920 CD GLU A 57 -13.275 -12.044 1.093 1.00 0.00 C ATOM 921 OE1 GLU A 57 -14.091 -12.327 1.996 1.00 0.00 O ATOM 922 OE2 GLU A 57 -13.572 -12.041 -0.121 1.00 0.00 O ATOM 0 H GLU A 57 -13.095 -11.582 3.802 1.00 0.00 H new ATOM 0 HA GLU A 57 -10.699 -12.749 4.592 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -10.333 -13.033 2.146 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.952 -13.484 2.641 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -11.841 -10.670 1.886 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -11.225 -11.689 0.600 1.00 0.00 H new ATOM 929 N ALA A 58 -10.379 -9.673 3.585 1.00 0.00 N ATOM 930 CA ALA A 58 -9.444 -8.561 3.459 1.00 0.00 C ATOM 931 C ALA A 58 -8.555 -8.447 4.694 1.00 0.00 C ATOM 932 O ALA A 58 -7.342 -8.635 4.618 1.00 0.00 O ATOM 933 CB ALA A 58 -10.199 -7.260 3.228 1.00 0.00 C ATOM 0 H ALA A 58 -11.362 -9.408 3.518 1.00 0.00 H new ATOM 0 HA ALA A 58 -8.803 -8.754 2.599 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.489 -6.438 3.136 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.785 -7.337 2.312 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -10.865 -7.071 4.070 1.00 0.00 H new ATOM 939 N SER A 59 -9.169 -8.140 5.831 1.00 0.00 N ATOM 940 CA SER A 59 -8.432 -8.003 7.082 1.00 0.00 C ATOM 941 C SER A 59 -7.769 -9.321 7.468 1.00 0.00 C ATOM 942 O SER A 59 -6.645 -9.338 7.970 1.00 0.00 O ATOM 943 CB SER A 59 -9.368 -7.542 8.201 1.00 0.00 C ATOM 944 OG SER A 59 -8.715 -6.633 9.071 1.00 0.00 O ATOM 0 H SER A 59 -10.173 -7.981 5.913 1.00 0.00 H new ATOM 0 HA SER A 59 -7.654 -7.254 6.937 1.00 0.00 H new ATOM 0 HB2 SER A 59 -10.249 -7.068 7.770 1.00 0.00 H new ATOM 0 HB3 SER A 59 -9.716 -8.406 8.767 1.00 0.00 H new ATOM 0 HG SER A 59 -9.335 -6.352 9.776 1.00 0.00 H new ATOM 950 N ALA A 60 -8.472 -10.423 7.230 1.00 0.00 N ATOM 951 CA ALA A 60 -7.951 -11.747 7.553 1.00 0.00 C ATOM 952 C ALA A 60 -6.718 -12.069 6.715 1.00 0.00 C ATOM 953 O ALA A 60 -5.816 -12.773 7.168 1.00 0.00 O ATOM 954 CB ALA A 60 -9.027 -12.801 7.339 1.00 0.00 C ATOM 0 H ALA A 60 -9.404 -10.426 6.815 1.00 0.00 H new ATOM 0 HA ALA A 60 -7.656 -11.751 8.602 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -8.626 -13.785 7.583 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -9.880 -12.586 7.983 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -9.347 -12.788 6.297 1.00 0.00 H new ATOM 960 N PHE A 61 -6.686 -11.547 5.493 1.00 0.00 N ATOM 961 CA PHE A 61 -5.562 -11.777 4.591 1.00 0.00 C ATOM 962 C PHE A 61 -4.260 -11.267 5.211 1.00 0.00 C ATOM 963 O PHE A 61 -3.269 -11.995 5.281 1.00 0.00 O ATOM 964 CB PHE A 61 -5.832 -11.100 3.238 1.00 0.00 C ATOM 965 CG PHE A 61 -4.616 -10.496 2.586 1.00 0.00 C ATOM 966 CD1 PHE A 61 -3.788 -11.262 1.784 1.00 0.00 C ATOM 967 CD2 PHE A 61 -4.309 -9.158 2.778 1.00 0.00 C ATOM 968 CE1 PHE A 61 -2.674 -10.706 1.184 1.00 0.00 C ATOM 969 CE2 PHE A 61 -3.197 -8.597 2.180 1.00 0.00 C ATOM 970 CZ PHE A 61 -2.378 -9.371 1.383 1.00 0.00 C ATOM 0 H PHE A 61 -7.425 -10.962 5.104 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.453 -12.849 4.426 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -6.265 -11.834 2.559 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -6.578 -10.318 3.380 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.015 -12.306 1.625 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -4.946 -8.548 3.401 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.036 -11.314 0.560 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -2.969 -7.553 2.336 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.508 -8.934 0.916 1.00 0.00 H new ATOM 980 N THR A 62 -4.271 -10.016 5.658 1.00 0.00 N ATOM 981 CA THR A 62 -3.093 -9.411 6.271 1.00 0.00 C ATOM 982 C THR A 62 -2.639 -10.218 7.484 1.00 0.00 C ATOM 983 O THR A 62 -1.452 -10.495 7.651 1.00 0.00 O ATOM 984 CB THR A 62 -3.394 -7.970 6.684 1.00 0.00 C ATOM 985 OG1 THR A 62 -4.367 -7.936 7.715 1.00 0.00 O ATOM 986 CG2 THR A 62 -3.903 -7.115 5.543 1.00 0.00 C ATOM 0 H THR A 62 -5.083 -9.400 5.608 1.00 0.00 H new ATOM 0 HA THR A 62 -2.288 -9.410 5.536 1.00 0.00 H new ATOM 0 HB THR A 62 -2.443 -7.562 7.026 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.100 -8.548 7.494 1.00 0.00 H new ATOM 0 HG21 THR A 62 -4.097 -6.105 5.904 1.00 0.00 H new ATOM 0 HG22 THR A 62 -3.154 -7.080 4.752 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.825 -7.543 5.151 1.00 0.00 H new ATOM 994 N LYS A 63 -3.595 -10.595 8.327 1.00 0.00 N ATOM 995 CA LYS A 63 -3.301 -11.374 9.525 1.00 0.00 C ATOM 996 C LYS A 63 -2.539 -12.654 9.183 1.00 0.00 C ATOM 997 O LYS A 63 -1.899 -13.253 10.049 1.00 0.00 O ATOM 998 CB LYS A 63 -4.598 -11.720 10.261 1.00 0.00 C ATOM 999 CG LYS A 63 -4.438 -11.795 11.771 1.00 0.00 C ATOM 1000 CD LYS A 63 -5.463 -10.927 12.486 1.00 0.00 C ATOM 1001 CE LYS A 63 -5.295 -10.996 13.996 1.00 0.00 C ATOM 1002 NZ LYS A 63 -5.916 -12.221 14.567 1.00 0.00 N ATOM 0 H LYS A 63 -4.583 -10.373 8.202 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.669 -10.766 10.173 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -5.353 -10.972 10.021 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.970 -12.677 9.895 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -4.545 -12.829 12.098 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -3.433 -11.475 12.047 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.361 -9.894 12.154 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.468 -11.251 12.215 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -4.234 -10.977 14.245 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -5.745 -10.114 14.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -5.780 -12.231 15.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.933 -12.227 14.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -5.469 -13.063 14.151 1.00 0.00 H new ATOM 1016 N LYS A 64 -2.616 -13.074 7.924 1.00 0.00 N ATOM 1017 CA LYS A 64 -1.936 -14.286 7.480 1.00 0.00 C ATOM 1018 C LYS A 64 -0.512 -13.985 7.028 1.00 0.00 C ATOM 1019 O LYS A 64 0.454 -14.471 7.615 1.00 0.00 O ATOM 1020 CB LYS A 64 -2.716 -14.941 6.339 1.00 0.00 C ATOM 1021 CG LYS A 64 -2.201 -16.320 5.964 1.00 0.00 C ATOM 1022 CD LYS A 64 -2.730 -17.387 6.908 1.00 0.00 C ATOM 1023 CE LYS A 64 -4.027 -17.992 6.393 1.00 0.00 C ATOM 1024 NZ LYS A 64 -5.082 -16.959 6.202 1.00 0.00 N ATOM 0 H LYS A 64 -3.142 -12.594 7.194 1.00 0.00 H new ATOM 0 HA LYS A 64 -1.888 -14.973 8.325 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -3.765 -15.019 6.625 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -2.672 -14.295 5.462 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -2.500 -16.556 4.943 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.111 -16.321 5.986 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -1.983 -18.172 7.027 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.896 -16.953 7.894 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -3.840 -18.500 5.447 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.380 -18.747 7.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -5.993 -17.424 6.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.159 -16.379 7.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -4.831 -16.352 5.396 1.00 0.00 H new ATOM 1038 N MET A 65 -0.389 -13.185 5.974 1.00 0.00 N ATOM 1039 CA MET A 65 0.916 -12.823 5.433 1.00 0.00 C ATOM 1040 C MET A 65 1.477 -11.586 6.126 1.00 0.00 C ATOM 1041 O MET A 65 2.562 -11.623 6.703 1.00 0.00 O ATOM 1042 CB MET A 65 0.819 -12.576 3.928 1.00 0.00 C ATOM 1043 CG MET A 65 -0.084 -13.562 3.204 1.00 0.00 C ATOM 1044 SD MET A 65 0.458 -13.894 1.517 1.00 0.00 S ATOM 1045 CE MET A 65 -1.102 -13.837 0.641 1.00 0.00 C ATOM 0 H MET A 65 -1.179 -12.774 5.477 1.00 0.00 H new ATOM 0 HA MET A 65 1.595 -13.656 5.616 1.00 0.00 H new ATOM 0 HB2 MET A 65 0.449 -11.565 3.758 1.00 0.00 H new ATOM 0 HB3 MET A 65 1.818 -12.627 3.495 1.00 0.00 H new ATOM 0 HG2 MET A 65 -0.114 -14.498 3.762 1.00 0.00 H new ATOM 0 HG3 MET A 65 -1.101 -13.170 3.184 1.00 0.00 H new ATOM 0 HE1 MET A 65 -1.344 -14.831 0.264 1.00 0.00 H new ATOM 0 HE2 MET A 65 -1.888 -13.505 1.319 1.00 0.00 H new ATOM 0 HE3 MET A 65 -1.025 -13.141 -0.194 1.00 0.00 H new ATOM 1055 N TRP A 66 0.743 -10.484 6.056 1.00 0.00 N ATOM 1056 CA TRP A 66 1.181 -9.235 6.669 1.00 0.00 C ATOM 1057 C TRP A 66 1.574 -9.426 8.136 1.00 0.00 C ATOM 1058 O TRP A 66 2.450 -8.727 8.645 1.00 0.00 O ATOM 1059 CB TRP A 66 0.083 -8.174 6.555 1.00 0.00 C ATOM 1060 CG TRP A 66 0.467 -6.851 7.150 1.00 0.00 C ATOM 1061 CD1 TRP A 66 0.982 -5.773 6.490 1.00 0.00 C ATOM 1062 CD2 TRP A 66 0.364 -6.469 8.526 1.00 0.00 C ATOM 1063 NE1 TRP A 66 1.206 -4.744 7.372 1.00 0.00 N ATOM 1064 CE2 TRP A 66 0.834 -5.147 8.628 1.00 0.00 C ATOM 1065 CE3 TRP A 66 -0.083 -7.117 9.682 1.00 0.00 C ATOM 1066 CZ2 TRP A 66 0.873 -4.462 9.839 1.00 0.00 C ATOM 1067 CZ3 TRP A 66 -0.044 -6.435 10.884 1.00 0.00 C ATOM 1068 CH2 TRP A 66 0.430 -5.119 10.955 1.00 0.00 C ATOM 0 H TRP A 66 -0.158 -10.428 5.581 1.00 0.00 H new ATOM 0 HA TRP A 66 2.067 -8.900 6.129 1.00 0.00 H new ATOM 0 HB2 TRP A 66 -0.167 -8.032 5.504 1.00 0.00 H new ATOM 0 HB3 TRP A 66 -0.817 -8.539 7.050 1.00 0.00 H new ATOM 0 HD1 TRP A 66 1.184 -5.735 5.430 1.00 0.00 H new ATOM 0 HE1 TRP A 66 1.587 -3.829 7.131 1.00 0.00 H new ATOM 0 HE3 TRP A 66 -0.452 -8.131 9.637 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 1.240 -3.448 9.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 -0.385 -6.926 11.784 1.00 0.00 H new ATOM 0 HH2 TRP A 66 0.446 -4.613 11.909 1.00 0.00 H new ATOM 1079 N GLU A 67 0.915 -10.358 8.818 1.00 0.00 N ATOM 1080 CA GLU A 67 1.198 -10.611 10.231 1.00 0.00 C ATOM 1081 C GLU A 67 2.206 -11.745 10.428 1.00 0.00 C ATOM 1082 O GLU A 67 3.200 -11.581 11.136 1.00 0.00 O ATOM 1083 CB GLU A 67 -0.097 -10.930 10.980 1.00 0.00 C ATOM 1084 CG GLU A 67 -0.701 -9.727 11.687 1.00 0.00 C ATOM 1085 CD GLU A 67 -1.104 -10.031 13.116 1.00 0.00 C ATOM 1086 OE1 GLU A 67 -0.445 -10.880 13.752 1.00 0.00 O ATOM 1087 OE2 GLU A 67 -2.078 -9.418 13.602 1.00 0.00 O ATOM 0 H GLU A 67 0.185 -10.949 8.420 1.00 0.00 H new ATOM 0 HA GLU A 67 1.644 -9.703 10.637 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.826 -11.331 10.275 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.100 -11.712 11.714 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.019 -8.909 11.683 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.575 -9.385 11.132 1.00 0.00 H new ATOM 1094 N ASN A 68 1.939 -12.899 9.822 1.00 0.00 N ATOM 1095 CA ASN A 68 2.824 -14.055 9.961 1.00 0.00 C ATOM 1096 C ASN A 68 4.044 -13.942 9.051 1.00 0.00 C ATOM 1097 O ASN A 68 5.110 -14.474 9.359 1.00 0.00 O ATOM 1098 CB ASN A 68 2.061 -15.346 9.653 1.00 0.00 C ATOM 1099 CG ASN A 68 2.370 -16.451 10.644 1.00 0.00 C ATOM 1100 OD1 ASN A 68 3.426 -17.080 10.581 1.00 0.00 O ATOM 1101 ND2 ASN A 68 1.446 -16.693 11.567 1.00 0.00 N ATOM 0 H ASN A 68 1.122 -13.060 9.233 1.00 0.00 H new ATOM 0 HA ASN A 68 3.176 -14.079 10.992 1.00 0.00 H new ATOM 0 HB2 ASN A 68 0.990 -15.143 9.662 1.00 0.00 H new ATOM 0 HB3 ASN A 68 2.313 -15.683 8.647 1.00 0.00 H new ATOM 0 HD21 ASN A 68 1.598 -17.425 12.261 1.00 0.00 H new ATOM 0 HD22 ASN A 68 0.585 -16.147 11.582 1.00 0.00 H new ATOM 1108 N ALA A 69 3.881 -13.243 7.938 1.00 0.00 N ATOM 1109 CA ALA A 69 4.969 -13.052 6.987 1.00 0.00 C ATOM 1110 C ALA A 69 5.482 -11.614 7.039 1.00 0.00 C ATOM 1111 O ALA A 69 4.737 -10.694 7.378 1.00 0.00 O ATOM 1112 CB ALA A 69 4.514 -13.413 5.582 1.00 0.00 C ATOM 0 H ALA A 69 3.004 -12.797 7.669 1.00 0.00 H new ATOM 0 HA ALA A 69 5.790 -13.714 7.262 1.00 0.00 H new ATOM 0 HB1 ALA A 69 5.338 -13.265 4.884 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.201 -14.457 5.558 1.00 0.00 H new ATOM 0 HB3 ALA A 69 3.677 -12.776 5.296 1.00 0.00 H new ATOM 1118 N LYS A 70 6.758 -11.426 6.723 1.00 0.00 N ATOM 1119 CA LYS A 70 7.359 -10.097 6.760 1.00 0.00 C ATOM 1120 C LYS A 70 7.526 -9.507 5.361 1.00 0.00 C ATOM 1121 O LYS A 70 8.507 -9.785 4.672 1.00 0.00 O ATOM 1122 CB LYS A 70 8.717 -10.154 7.461 1.00 0.00 C ATOM 1123 CG LYS A 70 8.618 -10.410 8.957 1.00 0.00 C ATOM 1124 CD LYS A 70 9.793 -11.235 9.465 1.00 0.00 C ATOM 1125 CE LYS A 70 9.337 -12.575 10.020 1.00 0.00 C ATOM 1126 NZ LYS A 70 10.268 -13.087 11.064 1.00 0.00 N ATOM 0 H LYS A 70 7.394 -12.172 6.440 1.00 0.00 H new ATOM 0 HA LYS A 70 6.683 -9.448 7.317 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.319 -10.940 7.005 1.00 0.00 H new ATOM 0 HB3 LYS A 70 9.242 -9.213 7.295 1.00 0.00 H new ATOM 0 HG2 LYS A 70 8.585 -9.459 9.488 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.686 -10.930 9.176 1.00 0.00 H new ATOM 0 HD2 LYS A 70 10.501 -11.399 8.653 1.00 0.00 H new ATOM 0 HD3 LYS A 70 10.320 -10.680 10.241 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.338 -12.472 10.443 1.00 0.00 H new ATOM 0 HE3 LYS A 70 9.267 -13.300 9.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.923 -14.002 11.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 11.216 -13.209 10.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 10.316 -12.408 11.850 1.00 0.00 H new ATOM 1140 N LYS A 71 6.572 -8.670 4.959 1.00 0.00 N ATOM 1141 CA LYS A 71 6.625 -8.017 3.654 1.00 0.00 C ATOM 1142 C LYS A 71 5.617 -6.875 3.581 1.00 0.00 C ATOM 1143 O LYS A 71 4.440 -7.091 3.292 1.00 0.00 O ATOM 1144 CB LYS A 71 6.328 -9.028 2.548 1.00 0.00 C ATOM 1145 CG LYS A 71 5.142 -9.925 2.863 1.00 0.00 C ATOM 1146 CD LYS A 71 5.592 -11.250 3.459 1.00 0.00 C ATOM 1147 CE LYS A 71 5.224 -12.426 2.565 1.00 0.00 C ATOM 1148 NZ LYS A 71 6.428 -13.177 2.111 1.00 0.00 N ATOM 0 H LYS A 71 5.754 -8.428 5.518 1.00 0.00 H new ATOM 0 HA LYS A 71 7.628 -7.612 3.517 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.135 -8.494 1.618 1.00 0.00 H new ATOM 0 HB3 LYS A 71 7.210 -9.647 2.383 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.475 -9.418 3.561 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.571 -10.109 1.953 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.671 -11.232 3.611 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.134 -11.382 4.440 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.559 -13.099 3.106 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.673 -12.064 1.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.135 -13.970 1.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.051 -12.542 1.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.940 -13.545 2.938 1.00 0.00 H new ATOM 1162 N ILE A 72 6.087 -5.659 3.832 1.00 0.00 N ATOM 1163 CA ILE A 72 5.227 -4.484 3.781 1.00 0.00 C ATOM 1164 C ILE A 72 5.960 -3.291 3.173 1.00 0.00 C ATOM 1165 O ILE A 72 6.795 -2.672 3.832 1.00 0.00 O ATOM 1166 CB ILE A 72 4.706 -4.104 5.180 1.00 0.00 C ATOM 1167 CG1 ILE A 72 4.389 -5.360 5.997 1.00 0.00 C ATOM 1168 CG2 ILE A 72 3.473 -3.226 5.058 1.00 0.00 C ATOM 1169 CD1 ILE A 72 5.589 -5.924 6.725 1.00 0.00 C ATOM 0 H ILE A 72 7.058 -5.461 4.073 1.00 0.00 H new ATOM 0 HA ILE A 72 4.377 -4.741 3.149 1.00 0.00 H new ATOM 0 HB ILE A 72 5.484 -3.545 5.700 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.611 -5.125 6.723 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.985 -6.124 5.333 1.00 0.00 H new ATOM 0 HG21 ILE A 72 3.113 -2.964 6.053 1.00 0.00 H new ATOM 0 HG22 ILE A 72 3.726 -2.317 4.512 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.693 -3.766 4.521 1.00 0.00 H new ATOM 0 HD11 ILE A 72 5.292 -6.812 7.283 1.00 0.00 H new ATOM 0 HD12 ILE A 72 6.361 -6.191 6.003 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.981 -5.176 7.415 1.00 0.00 H new ATOM 1181 N GLU A 73 5.657 -2.969 1.919 1.00 0.00 N ATOM 1182 CA GLU A 73 6.314 -1.846 1.251 1.00 0.00 C ATOM 1183 C GLU A 73 5.319 -0.996 0.457 1.00 0.00 C ATOM 1184 O GLU A 73 4.295 -1.494 -0.009 1.00 0.00 O ATOM 1185 CB GLU A 73 7.422 -2.361 0.335 1.00 0.00 C ATOM 1186 CG GLU A 73 8.488 -3.156 1.071 1.00 0.00 C ATOM 1187 CD GLU A 73 9.219 -4.132 0.169 1.00 0.00 C ATOM 1188 OE1 GLU A 73 10.157 -3.702 -0.534 1.00 0.00 O ATOM 1189 OE2 GLU A 73 8.851 -5.325 0.167 1.00 0.00 O ATOM 0 H GLU A 73 4.970 -3.462 1.349 1.00 0.00 H new ATOM 0 HA GLU A 73 6.748 -1.207 2.020 1.00 0.00 H new ATOM 0 HB2 GLU A 73 6.981 -2.988 -0.440 1.00 0.00 H new ATOM 0 HB3 GLU A 73 7.891 -1.515 -0.168 1.00 0.00 H new ATOM 0 HG2 GLU A 73 9.208 -2.467 1.513 1.00 0.00 H new ATOM 0 HG3 GLU A 73 8.025 -3.704 1.892 1.00 0.00 H new ATOM 1196 N VAL A 74 5.635 0.292 0.318 1.00 0.00 N ATOM 1197 CA VAL A 74 4.774 1.228 -0.408 1.00 0.00 C ATOM 1198 C VAL A 74 5.328 1.550 -1.792 1.00 0.00 C ATOM 1199 O VAL A 74 6.534 1.480 -2.025 1.00 0.00 O ATOM 1200 CB VAL A 74 4.591 2.552 0.360 1.00 0.00 C ATOM 1201 CG1 VAL A 74 3.533 2.403 1.434 1.00 0.00 C ATOM 1202 CG2 VAL A 74 5.910 3.014 0.962 1.00 0.00 C ATOM 0 H VAL A 74 6.483 0.712 0.699 1.00 0.00 H new ATOM 0 HA VAL A 74 3.810 0.729 -0.508 1.00 0.00 H new ATOM 0 HB VAL A 74 4.257 3.313 -0.346 1.00 0.00 H new ATOM 0 HG11 VAL A 74 3.418 3.348 1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.584 2.128 0.974 1.00 0.00 H new ATOM 0 HG13 VAL A 74 3.835 1.626 2.137 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.757 3.950 1.499 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.280 2.256 1.652 1.00 0.00 H new ATOM 0 HG23 VAL A 74 6.639 3.167 0.166 1.00 0.00 H new ATOM 1212 N GLU A 75 4.429 1.912 -2.706 1.00 0.00 N ATOM 1213 CA GLU A 75 4.815 2.257 -4.069 1.00 0.00 C ATOM 1214 C GLU A 75 4.789 3.772 -4.279 1.00 0.00 C ATOM 1215 O GLU A 75 5.836 4.417 -4.323 1.00 0.00 O ATOM 1216 CB GLU A 75 3.886 1.568 -5.072 1.00 0.00 C ATOM 1217 CG GLU A 75 4.610 0.980 -6.272 1.00 0.00 C ATOM 1218 CD GLU A 75 5.200 2.046 -7.176 1.00 0.00 C ATOM 1219 OE1 GLU A 75 6.126 2.756 -6.732 1.00 0.00 O ATOM 1220 OE2 GLU A 75 4.734 2.170 -8.328 1.00 0.00 O ATOM 0 H GLU A 75 3.427 1.973 -2.525 1.00 0.00 H new ATOM 0 HA GLU A 75 5.835 1.908 -4.232 1.00 0.00 H new ATOM 0 HB2 GLU A 75 3.341 0.773 -4.562 1.00 0.00 H new ATOM 0 HB3 GLU A 75 3.146 2.288 -5.422 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.406 0.322 -5.925 1.00 0.00 H new ATOM 0 HG3 GLU A 75 3.916 0.366 -6.846 1.00 0.00 H new ATOM 1227 N PHE A 76 3.589 4.336 -4.405 1.00 0.00 N ATOM 1228 CA PHE A 76 3.439 5.775 -4.607 1.00 0.00 C ATOM 1229 C PHE A 76 2.211 6.306 -3.871 1.00 0.00 C ATOM 1230 O PHE A 76 1.200 5.617 -3.753 1.00 0.00 O ATOM 1231 CB PHE A 76 3.330 6.097 -6.097 1.00 0.00 C ATOM 1232 CG PHE A 76 2.194 5.393 -6.783 1.00 0.00 C ATOM 1233 CD1 PHE A 76 0.918 5.931 -6.768 1.00 0.00 C ATOM 1234 CD2 PHE A 76 2.404 4.193 -7.444 1.00 0.00 C ATOM 1235 CE1 PHE A 76 -0.129 5.286 -7.399 1.00 0.00 C ATOM 1236 CE2 PHE A 76 1.362 3.543 -8.076 1.00 0.00 C ATOM 1237 CZ PHE A 76 0.094 4.090 -8.054 1.00 0.00 C ATOM 0 H PHE A 76 2.710 3.820 -4.371 1.00 0.00 H new ATOM 0 HA PHE A 76 4.324 6.264 -4.201 1.00 0.00 H new ATOM 0 HB2 PHE A 76 3.207 7.173 -6.220 1.00 0.00 H new ATOM 0 HB3 PHE A 76 4.264 5.825 -6.588 1.00 0.00 H new ATOM 0 HD1 PHE A 76 0.739 6.866 -6.257 1.00 0.00 H new ATOM 0 HD2 PHE A 76 3.394 3.761 -7.465 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.120 5.716 -7.380 1.00 0.00 H new ATOM 0 HE2 PHE A 76 1.539 2.608 -8.587 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.722 3.584 -8.548 1.00 0.00 H new ATOM 1247 N ASP A 77 2.308 7.540 -3.383 1.00 0.00 N ATOM 1248 CA ASP A 77 1.209 8.170 -2.660 1.00 0.00 C ATOM 1249 C ASP A 77 -0.043 8.255 -3.529 1.00 0.00 C ATOM 1250 O ASP A 77 0.042 8.393 -4.749 1.00 0.00 O ATOM 1251 CB ASP A 77 1.613 9.569 -2.194 1.00 0.00 C ATOM 1252 CG ASP A 77 2.136 10.429 -3.329 1.00 0.00 C ATOM 1253 OD1 ASP A 77 1.317 10.891 -4.151 1.00 0.00 O ATOM 1254 OD2 ASP A 77 3.365 10.641 -3.396 1.00 0.00 O ATOM 0 H ASP A 77 3.139 8.124 -3.476 1.00 0.00 H new ATOM 0 HA ASP A 77 0.983 7.553 -1.790 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.753 10.059 -1.737 1.00 0.00 H new ATOM 0 HB3 ASP A 77 2.379 9.485 -1.423 1.00 0.00 H new ATOM 1259 N LYS A 78 -1.204 8.174 -2.889 1.00 0.00 N ATOM 1260 CA LYS A 78 -2.480 8.244 -3.599 1.00 0.00 C ATOM 1261 C LYS A 78 -3.100 9.633 -3.466 1.00 0.00 C ATOM 1262 O LYS A 78 -3.306 10.327 -4.461 1.00 0.00 O ATOM 1263 CB LYS A 78 -3.458 7.180 -3.082 1.00 0.00 C ATOM 1264 CG LYS A 78 -3.171 6.700 -1.667 1.00 0.00 C ATOM 1265 CD LYS A 78 -4.369 5.981 -1.070 1.00 0.00 C ATOM 1266 CE LYS A 78 -5.278 6.938 -0.318 1.00 0.00 C ATOM 1267 NZ LYS A 78 -6.454 6.241 0.270 1.00 0.00 N ATOM 0 H LYS A 78 -1.290 8.060 -1.879 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.283 8.049 -4.653 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -4.469 7.585 -3.118 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -3.434 6.323 -3.756 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.311 6.031 -1.676 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.906 7.551 -1.040 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -4.933 5.491 -1.864 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -4.025 5.198 -0.394 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -4.713 7.428 0.475 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -5.621 7.720 -0.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.985 6.903 0.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -7.071 5.897 -0.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -6.130 5.436 0.843 1.00 0.00 H new ATOM 1281 N GLY A 79 -3.393 10.032 -2.233 1.00 0.00 N ATOM 1282 CA GLY A 79 -3.985 11.337 -1.998 1.00 0.00 C ATOM 1283 C GLY A 79 -5.482 11.272 -1.764 1.00 0.00 C ATOM 1284 O GLY A 79 -6.230 12.114 -2.261 1.00 0.00 O ATOM 0 H GLY A 79 -3.232 9.476 -1.393 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -3.507 11.797 -1.133 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -3.784 11.981 -2.854 1.00 0.00 H new ATOM 1288 N GLN A 80 -5.923 10.274 -1.002 1.00 0.00 N ATOM 1289 CA GLN A 80 -7.343 10.112 -0.705 1.00 0.00 C ATOM 1290 C GLN A 80 -7.585 10.084 0.802 1.00 0.00 C ATOM 1291 O GLN A 80 -6.719 9.670 1.573 1.00 0.00 O ATOM 1292 CB GLN A 80 -7.882 8.831 -1.346 1.00 0.00 C ATOM 1293 CG GLN A 80 -7.386 8.604 -2.765 1.00 0.00 C ATOM 1294 CD GLN A 80 -8.481 8.123 -3.696 1.00 0.00 C ATOM 1295 OE1 GLN A 80 -9.534 7.665 -3.250 1.00 0.00 O ATOM 1296 NE2 GLN A 80 -8.239 8.223 -4.998 1.00 0.00 N ATOM 0 H GLN A 80 -5.320 9.568 -0.581 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.874 10.967 -1.124 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -7.596 7.979 -0.730 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.971 8.869 -1.353 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -6.967 9.533 -3.152 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -6.579 7.872 -2.751 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -7.353 8.609 -5.324 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -8.939 7.914 -5.672 1.00 0.00 H new ATOM 1305 N ARG A 81 -8.766 10.536 1.216 1.00 0.00 N ATOM 1306 CA ARG A 81 -9.128 10.574 2.633 1.00 0.00 C ATOM 1307 C ARG A 81 -8.306 11.624 3.388 1.00 0.00 C ATOM 1308 O ARG A 81 -8.340 11.685 4.616 1.00 0.00 O ATOM 1309 CB ARG A 81 -8.933 9.197 3.273 1.00 0.00 C ATOM 1310 CG ARG A 81 -10.069 8.788 4.195 1.00 0.00 C ATOM 1311 CD ARG A 81 -11.357 8.549 3.424 1.00 0.00 C ATOM 1312 NE ARG A 81 -12.488 8.290 4.313 1.00 0.00 N ATOM 1313 CZ ARG A 81 -13.763 8.386 3.940 1.00 0.00 C ATOM 1314 NH1 ARG A 81 -14.074 8.730 2.697 1.00 0.00 N ATOM 1315 NH2 ARG A 81 -14.728 8.133 4.814 1.00 0.00 N ATOM 0 H ARG A 81 -9.492 10.883 0.589 1.00 0.00 H new ATOM 0 HA ARG A 81 -10.180 10.851 2.700 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -8.829 8.451 2.485 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.000 9.197 3.837 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -9.793 7.881 4.733 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.230 9.565 4.942 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -11.575 9.419 2.804 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -11.224 7.703 2.750 1.00 0.00 H new ATOM 0 HE ARG A 81 -12.289 8.020 5.276 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -13.335 8.923 2.021 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -15.052 8.802 2.417 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -14.493 7.865 5.770 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -15.705 8.206 4.530 1.00 0.00 H new ATOM 1329 N THR A 82 -7.578 12.449 2.641 1.00 0.00 N ATOM 1330 CA THR A 82 -6.752 13.503 3.228 1.00 0.00 C ATOM 1331 C THR A 82 -7.374 14.872 2.927 1.00 0.00 C ATOM 1332 O THR A 82 -8.001 15.053 1.883 1.00 0.00 O ATOM 1333 CB THR A 82 -5.313 13.429 2.672 1.00 0.00 C ATOM 1334 OG1 THR A 82 -4.908 14.692 2.168 1.00 0.00 O ATOM 1335 CG2 THR A 82 -5.146 12.428 1.546 1.00 0.00 C ATOM 0 H THR A 82 -7.543 12.408 1.622 1.00 0.00 H new ATOM 0 HA THR A 82 -6.708 13.363 4.308 1.00 0.00 H new ATOM 0 HB THR A 82 -4.700 13.112 3.516 1.00 0.00 H new ATOM 0 HG1 THR A 82 -4.282 14.562 1.425 1.00 0.00 H new ATOM 0 HG21 THR A 82 -4.110 12.432 1.207 1.00 0.00 H new ATOM 0 HG22 THR A 82 -5.407 11.432 1.903 1.00 0.00 H new ATOM 0 HG23 THR A 82 -5.800 12.700 0.718 1.00 0.00 H new ATOM 1343 N ASP A 83 -7.200 15.837 3.834 1.00 0.00 N ATOM 1344 CA ASP A 83 -7.756 17.177 3.622 1.00 0.00 C ATOM 1345 C ASP A 83 -6.800 18.013 2.777 1.00 0.00 C ATOM 1346 O ASP A 83 -7.175 18.545 1.732 1.00 0.00 O ATOM 1347 CB ASP A 83 -8.006 17.867 4.966 1.00 0.00 C ATOM 1348 CG ASP A 83 -9.432 17.687 5.452 1.00 0.00 C ATOM 1349 OD1 ASP A 83 -10.354 17.721 4.610 1.00 0.00 O ATOM 1350 OD2 ASP A 83 -9.625 17.513 6.672 1.00 0.00 O ATOM 0 H ASP A 83 -6.688 15.720 4.708 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.705 17.082 3.095 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -7.318 17.466 5.711 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -7.789 18.931 4.871 1.00 0.00 H new ATOM 1355 N LYS A 84 -5.551 18.068 3.215 1.00 0.00 N ATOM 1356 CA LYS A 84 -4.501 18.771 2.491 1.00 0.00 C ATOM 1357 C LYS A 84 -3.561 17.713 1.949 1.00 0.00 C ATOM 1358 O LYS A 84 -3.366 17.572 0.742 1.00 0.00 O ATOM 1359 CB LYS A 84 -3.754 19.738 3.413 1.00 0.00 C ATOM 1360 CG LYS A 84 -4.304 21.156 3.382 1.00 0.00 C ATOM 1361 CD LYS A 84 -4.739 21.620 4.764 1.00 0.00 C ATOM 1362 CE LYS A 84 -5.260 23.048 4.735 1.00 0.00 C ATOM 1363 NZ LYS A 84 -5.198 23.689 6.078 1.00 0.00 N ATOM 0 H LYS A 84 -5.237 17.628 4.080 1.00 0.00 H new ATOM 0 HA LYS A 84 -4.923 19.369 1.683 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.800 19.361 4.435 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.702 19.759 3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -3.543 21.833 2.993 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -5.152 21.203 2.699 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -5.516 20.956 5.144 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -3.897 21.553 5.453 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -4.675 23.634 4.026 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -6.290 23.052 4.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -5.562 24.661 6.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -5.777 23.145 6.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -4.212 23.709 6.408 1.00 0.00 H new ATOM 1377 N TYR A 85 -3.046 16.925 2.881 1.00 0.00 N ATOM 1378 CA TYR A 85 -2.187 15.799 2.572 1.00 0.00 C ATOM 1379 C TYR A 85 -2.674 14.599 3.380 1.00 0.00 C ATOM 1380 O TYR A 85 -2.696 13.477 2.884 1.00 0.00 O ATOM 1381 CB TYR A 85 -0.730 16.116 2.913 1.00 0.00 C ATOM 1382 CG TYR A 85 -0.147 17.247 2.095 1.00 0.00 C ATOM 1383 CD1 TYR A 85 0.029 17.121 0.722 1.00 0.00 C ATOM 1384 CD2 TYR A 85 0.231 18.441 2.699 1.00 0.00 C ATOM 1385 CE1 TYR A 85 0.564 18.153 -0.024 1.00 0.00 C ATOM 1386 CE2 TYR A 85 0.765 19.477 1.956 1.00 0.00 C ATOM 1387 CZ TYR A 85 0.929 19.328 0.596 1.00 0.00 C ATOM 1388 OH TYR A 85 1.464 20.357 -0.147 1.00 0.00 O ATOM 0 H TYR A 85 -3.215 17.052 3.879 1.00 0.00 H new ATOM 0 HA TYR A 85 -2.232 15.580 1.505 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -0.661 16.371 3.971 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -0.127 15.221 2.761 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -0.257 16.202 0.231 1.00 0.00 H new ATOM 0 HD2 TYR A 85 0.105 18.561 3.765 1.00 0.00 H new ATOM 0 HE1 TYR A 85 0.696 18.039 -1.090 1.00 0.00 H new ATOM 0 HE2 TYR A 85 1.052 20.399 2.439 1.00 0.00 H new ATOM 0 HH TYR A 85 1.666 21.114 0.441 1.00 0.00 H new ATOM 1398 N GLY A 86 -3.101 14.893 4.621 1.00 0.00 N ATOM 1399 CA GLY A 86 -3.662 13.924 5.577 1.00 0.00 C ATOM 1400 C GLY A 86 -2.919 12.604 5.688 1.00 0.00 C ATOM 1401 O GLY A 86 -2.765 12.068 6.786 1.00 0.00 O ATOM 0 H GLY A 86 -3.064 15.840 4.997 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.690 14.388 6.563 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -4.694 13.717 5.293 1.00 0.00 H new ATOM 1405 N ARG A 87 -2.408 12.108 4.576 1.00 0.00 N ATOM 1406 CA ARG A 87 -1.625 10.893 4.571 1.00 0.00 C ATOM 1407 C ARG A 87 -0.501 11.041 3.564 1.00 0.00 C ATOM 1408 O ARG A 87 -0.677 10.796 2.371 1.00 0.00 O ATOM 1409 CB ARG A 87 -2.478 9.656 4.245 1.00 0.00 C ATOM 1410 CG ARG A 87 -3.902 9.725 4.779 1.00 0.00 C ATOM 1411 CD ARG A 87 -3.993 9.186 6.199 1.00 0.00 C ATOM 1412 NE ARG A 87 -4.523 10.178 7.131 1.00 0.00 N ATOM 1413 CZ ARG A 87 -4.866 9.904 8.387 1.00 0.00 C ATOM 1414 NH1 ARG A 87 -4.740 8.672 8.864 1.00 0.00 N ATOM 1415 NH2 ARG A 87 -5.339 10.866 9.170 1.00 0.00 N ATOM 0 H ARG A 87 -2.525 12.536 3.657 1.00 0.00 H new ATOM 0 HA ARG A 87 -1.218 10.740 5.571 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.513 9.527 3.163 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.990 8.772 4.656 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -4.250 10.758 4.758 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -4.564 9.153 4.129 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -4.630 8.302 6.210 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.004 8.870 6.530 1.00 0.00 H new ATOM 0 HE ARG A 87 -4.637 11.136 6.800 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -4.378 7.928 8.267 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -5.005 8.469 9.828 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -5.439 11.815 8.809 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -5.602 10.657 10.133 1.00 0.00 H new ATOM 1429 N GLY A 88 0.651 11.429 4.059 1.00 0.00 N ATOM 1430 CA GLY A 88 1.814 11.595 3.201 1.00 0.00 C ATOM 1431 C GLY A 88 2.453 10.266 2.838 1.00 0.00 C ATOM 1432 O GLY A 88 3.576 10.222 2.336 1.00 0.00 O ATOM 0 H GLY A 88 0.814 11.636 5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 88 1.520 12.116 2.290 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.548 12.224 3.705 1.00 0.00 H new ATOM 1436 N LEU A 89 1.733 9.182 3.110 1.00 0.00 N ATOM 1437 CA LEU A 89 2.207 7.834 2.841 1.00 0.00 C ATOM 1438 C LEU A 89 1.166 7.059 2.036 1.00 0.00 C ATOM 1439 O LEU A 89 -0.032 7.321 2.150 1.00 0.00 O ATOM 1440 CB LEU A 89 2.504 7.112 4.153 1.00 0.00 C ATOM 1441 CG LEU A 89 3.014 8.003 5.294 1.00 0.00 C ATOM 1442 CD1 LEU A 89 4.165 8.881 4.823 1.00 0.00 C ATOM 1443 CD2 LEU A 89 1.881 8.852 5.860 1.00 0.00 C ATOM 0 H LEU A 89 0.802 9.217 3.525 1.00 0.00 H new ATOM 0 HA LEU A 89 3.125 7.894 2.257 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.596 6.610 4.485 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.245 6.336 3.961 1.00 0.00 H new ATOM 0 HG LEU A 89 3.387 7.358 6.089 1.00 0.00 H new ATOM 0 HD11 LEU A 89 4.509 9.503 5.649 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.985 8.252 4.477 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.826 9.518 4.006 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.263 9.477 6.668 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.473 9.486 5.073 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.096 8.201 6.245 1.00 0.00 H new ATOM 1455 N ALA A 90 1.620 6.122 1.209 1.00 0.00 N ATOM 1456 CA ALA A 90 0.709 5.342 0.382 1.00 0.00 C ATOM 1457 C ALA A 90 0.464 3.952 0.962 1.00 0.00 C ATOM 1458 O ALA A 90 0.963 3.616 2.032 1.00 0.00 O ATOM 1459 CB ALA A 90 1.250 5.230 -1.035 1.00 0.00 C ATOM 0 H ALA A 90 2.606 5.886 1.095 1.00 0.00 H new ATOM 0 HA ALA A 90 -0.247 5.865 0.363 1.00 0.00 H new ATOM 0 HB1 ALA A 90 0.560 4.645 -1.643 1.00 0.00 H new ATOM 0 HB2 ALA A 90 1.356 6.226 -1.464 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.223 4.738 -1.015 1.00 0.00 H new ATOM 1465 N TYR A 91 -0.331 3.160 0.248 1.00 0.00 N ATOM 1466 CA TYR A 91 -0.677 1.807 0.685 1.00 0.00 C ATOM 1467 C TYR A 91 0.502 0.853 0.560 1.00 0.00 C ATOM 1468 O TYR A 91 1.314 0.961 -0.358 1.00 0.00 O ATOM 1469 CB TYR A 91 -1.868 1.256 -0.112 1.00 0.00 C ATOM 1470 CG TYR A 91 -2.056 1.887 -1.475 1.00 0.00 C ATOM 1471 CD1 TYR A 91 -1.402 1.385 -2.593 1.00 0.00 C ATOM 1472 CD2 TYR A 91 -2.885 2.988 -1.639 1.00 0.00 C ATOM 1473 CE1 TYR A 91 -1.570 1.963 -3.837 1.00 0.00 C ATOM 1474 CE2 TYR A 91 -3.060 3.571 -2.878 1.00 0.00 C ATOM 1475 CZ TYR A 91 -2.400 3.056 -3.974 1.00 0.00 C ATOM 1476 OH TYR A 91 -2.571 3.635 -5.211 1.00 0.00 O ATOM 0 H TYR A 91 -0.751 3.432 -0.641 1.00 0.00 H new ATOM 0 HA TYR A 91 -0.952 1.879 1.737 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -1.739 0.181 -0.238 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -2.778 1.402 0.471 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -0.752 0.529 -2.488 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -3.402 3.396 -0.783 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -1.054 1.561 -4.697 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -3.710 4.426 -2.989 1.00 0.00 H new ATOM 0 HH TYR A 91 -3.187 4.393 -5.135 1.00 0.00 H new ATOM 1486 N ILE A 92 0.578 -0.090 1.494 1.00 0.00 N ATOM 1487 CA ILE A 92 1.646 -1.081 1.502 1.00 0.00 C ATOM 1488 C ILE A 92 1.194 -2.376 0.838 1.00 0.00 C ATOM 1489 O ILE A 92 -0.004 -2.633 0.704 1.00 0.00 O ATOM 1490 CB ILE A 92 2.134 -1.387 2.934 1.00 0.00 C ATOM 1491 CG1 ILE A 92 0.953 -1.539 3.900 1.00 0.00 C ATOM 1492 CG2 ILE A 92 3.070 -0.289 3.413 1.00 0.00 C ATOM 1493 CD1 ILE A 92 -0.064 -2.573 3.465 1.00 0.00 C ATOM 0 H ILE A 92 -0.091 -0.188 2.258 1.00 0.00 H new ATOM 0 HA ILE A 92 2.474 -0.654 0.937 1.00 0.00 H new ATOM 0 HB ILE A 92 2.676 -2.333 2.914 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.334 -1.810 4.885 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.455 -0.575 4.005 1.00 0.00 H new ATOM 0 HG21 ILE A 92 3.408 -0.515 4.424 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.931 -0.229 2.747 1.00 0.00 H new ATOM 0 HG23 ILE A 92 2.543 0.665 3.411 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.869 -2.623 4.199 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.474 -2.294 2.495 1.00 0.00 H new ATOM 0 HD13 ILE A 92 0.418 -3.548 3.388 1.00 0.00 H new ATOM 1505 N TYR A 93 2.157 -3.191 0.421 1.00 0.00 N ATOM 1506 CA TYR A 93 1.853 -4.460 -0.230 1.00 0.00 C ATOM 1507 C TYR A 93 2.235 -5.638 0.662 1.00 0.00 C ATOM 1508 O TYR A 93 3.400 -5.808 1.018 1.00 0.00 O ATOM 1509 CB TYR A 93 2.588 -4.558 -1.568 1.00 0.00 C ATOM 1510 CG TYR A 93 2.117 -3.550 -2.593 1.00 0.00 C ATOM 1511 CD1 TYR A 93 0.765 -3.278 -2.758 1.00 0.00 C ATOM 1512 CD2 TYR A 93 3.026 -2.870 -3.394 1.00 0.00 C ATOM 1513 CE1 TYR A 93 0.331 -2.357 -3.693 1.00 0.00 C ATOM 1514 CE2 TYR A 93 2.600 -1.948 -4.331 1.00 0.00 C ATOM 1515 CZ TYR A 93 1.252 -1.695 -4.477 1.00 0.00 C ATOM 1516 OH TYR A 93 0.824 -0.777 -5.407 1.00 0.00 O ATOM 0 H TYR A 93 3.153 -2.996 0.522 1.00 0.00 H new ATOM 0 HA TYR A 93 0.778 -4.499 -0.409 1.00 0.00 H new ATOM 0 HB2 TYR A 93 3.656 -4.419 -1.398 1.00 0.00 H new ATOM 0 HB3 TYR A 93 2.458 -5.562 -1.972 1.00 0.00 H new ATOM 0 HD1 TYR A 93 0.041 -3.795 -2.146 1.00 0.00 H new ATOM 0 HD2 TYR A 93 4.082 -3.065 -3.283 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -0.724 -2.157 -3.809 1.00 0.00 H new ATOM 0 HE2 TYR A 93 3.319 -1.428 -4.946 1.00 0.00 H new ATOM 0 HH TYR A 93 1.598 -0.400 -5.875 1.00 0.00 H new ATOM 1526 N ALA A 94 1.242 -6.447 1.018 1.00 0.00 N ATOM 1527 CA ALA A 94 1.474 -7.609 1.867 1.00 0.00 C ATOM 1528 C ALA A 94 1.615 -8.877 1.034 1.00 0.00 C ATOM 1529 O ALA A 94 0.624 -9.526 0.698 1.00 0.00 O ATOM 1530 CB ALA A 94 0.345 -7.758 2.876 1.00 0.00 C ATOM 0 H ALA A 94 0.271 -6.319 0.732 1.00 0.00 H new ATOM 0 HA ALA A 94 2.409 -7.455 2.406 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.531 -8.630 3.504 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.294 -6.866 3.500 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.600 -7.886 2.348 1.00 0.00 H new ATOM 1536 N ASP A 95 2.854 -9.226 0.704 1.00 0.00 N ATOM 1537 CA ASP A 95 3.131 -10.418 -0.090 1.00 0.00 C ATOM 1538 C ASP A 95 2.597 -10.261 -1.511 1.00 0.00 C ATOM 1539 O ASP A 95 1.862 -11.113 -2.009 1.00 0.00 O ATOM 1540 CB ASP A 95 2.513 -11.655 0.568 1.00 0.00 C ATOM 1541 CG ASP A 95 3.088 -12.947 0.020 1.00 0.00 C ATOM 1542 OD1 ASP A 95 3.160 -13.088 -1.218 1.00 0.00 O ATOM 1543 OD2 ASP A 95 3.467 -13.818 0.831 1.00 0.00 O ATOM 0 H ASP A 95 3.684 -8.699 0.975 1.00 0.00 H new ATOM 0 HA ASP A 95 4.212 -10.547 -0.139 1.00 0.00 H new ATOM 0 HB2 ASP A 95 2.681 -11.613 1.644 1.00 0.00 H new ATOM 0 HB3 ASP A 95 1.434 -11.646 0.413 1.00 0.00 H new ATOM 1548 N GLY A 96 2.975 -9.164 -2.160 1.00 0.00 N ATOM 1549 CA GLY A 96 2.528 -8.917 -3.517 1.00 0.00 C ATOM 1550 C GLY A 96 1.457 -7.845 -3.592 1.00 0.00 C ATOM 1551 O GLY A 96 1.750 -6.685 -3.883 1.00 0.00 O ATOM 0 H GLY A 96 3.582 -8.443 -1.770 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.380 -8.618 -4.127 1.00 0.00 H new ATOM 0 HA3 GLY A 96 2.141 -9.843 -3.942 1.00 0.00 H new ATOM 1555 N LYS A 97 0.212 -8.232 -3.332 1.00 0.00 N ATOM 1556 CA LYS A 97 -0.905 -7.297 -3.375 1.00 0.00 C ATOM 1557 C LYS A 97 -1.673 -7.299 -2.058 1.00 0.00 C ATOM 1558 O LYS A 97 -1.950 -8.356 -1.491 1.00 0.00 O ATOM 1559 CB LYS A 97 -1.845 -7.647 -4.528 1.00 0.00 C ATOM 1560 CG LYS A 97 -2.298 -9.100 -4.524 1.00 0.00 C ATOM 1561 CD LYS A 97 -3.803 -9.217 -4.343 1.00 0.00 C ATOM 1562 CE LYS A 97 -4.503 -9.494 -5.663 1.00 0.00 C ATOM 1563 NZ LYS A 97 -4.544 -10.948 -5.977 1.00 0.00 N ATOM 0 H LYS A 97 -0.048 -9.188 -3.089 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.501 -6.297 -3.534 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -2.722 -7.001 -4.480 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -1.344 -7.434 -5.472 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -2.006 -9.575 -5.460 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -1.792 -9.637 -3.722 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -4.024 -10.018 -3.638 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -4.191 -8.295 -3.911 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -5.520 -9.103 -5.624 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -3.988 -8.964 -6.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -5.030 -11.093 -6.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -3.574 -11.317 -6.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -5.057 -11.451 -5.225 1.00 0.00 H new ATOM 1577 N MET A 98 -2.014 -6.108 -1.577 1.00 0.00 N ATOM 1578 CA MET A 98 -2.753 -5.970 -0.326 1.00 0.00 C ATOM 1579 C MET A 98 -4.239 -5.756 -0.594 1.00 0.00 C ATOM 1580 O MET A 98 -4.616 -5.031 -1.515 1.00 0.00 O ATOM 1581 CB MET A 98 -2.195 -4.802 0.492 1.00 0.00 C ATOM 1582 CG MET A 98 -2.030 -5.120 1.969 1.00 0.00 C ATOM 1583 SD MET A 98 -3.579 -5.000 2.883 1.00 0.00 S ATOM 1584 CE MET A 98 -3.048 -4.083 4.327 1.00 0.00 C ATOM 0 H MET A 98 -1.791 -5.224 -2.034 1.00 0.00 H new ATOM 0 HA MET A 98 -2.635 -6.892 0.243 1.00 0.00 H new ATOM 0 HB2 MET A 98 -1.228 -4.510 0.081 1.00 0.00 H new ATOM 0 HB3 MET A 98 -2.859 -3.944 0.385 1.00 0.00 H new ATOM 0 HG2 MET A 98 -1.626 -6.127 2.077 1.00 0.00 H new ATOM 0 HG3 MET A 98 -1.302 -4.436 2.405 1.00 0.00 H new ATOM 0 HE1 MET A 98 -3.824 -4.126 5.091 1.00 0.00 H new ATOM 0 HE2 MET A 98 -2.130 -4.520 4.718 1.00 0.00 H new ATOM 0 HE3 MET A 98 -2.866 -3.044 4.052 1.00 0.00 H new ATOM 1594 N VAL A 99 -5.080 -6.391 0.216 1.00 0.00 N ATOM 1595 CA VAL A 99 -6.525 -6.268 0.065 1.00 0.00 C ATOM 1596 C VAL A 99 -7.041 -4.995 0.728 1.00 0.00 C ATOM 1597 O VAL A 99 -6.410 -4.458 1.639 1.00 0.00 O ATOM 1598 CB VAL A 99 -7.259 -7.481 0.667 1.00 0.00 C ATOM 1599 CG1 VAL A 99 -8.743 -7.426 0.338 1.00 0.00 C ATOM 1600 CG2 VAL A 99 -6.642 -8.779 0.169 1.00 0.00 C ATOM 0 H VAL A 99 -4.786 -6.995 0.983 1.00 0.00 H new ATOM 0 HA VAL A 99 -6.728 -6.225 -1.005 1.00 0.00 H new ATOM 0 HB VAL A 99 -7.151 -7.447 1.751 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -9.244 -8.291 0.772 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -9.173 -6.513 0.750 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -8.876 -7.434 -0.744 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -7.173 -9.625 0.605 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.717 -8.824 -0.917 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.593 -8.819 0.462 1.00 0.00 H new ATOM 1610 N ASN A 100 -8.191 -4.516 0.264 1.00 0.00 N ATOM 1611 CA ASN A 100 -8.793 -3.306 0.813 1.00 0.00 C ATOM 1612 C ASN A 100 -9.837 -3.650 1.872 1.00 0.00 C ATOM 1613 O ASN A 100 -10.242 -4.803 2.006 1.00 0.00 O ATOM 1614 CB ASN A 100 -9.431 -2.478 -0.306 1.00 0.00 C ATOM 1615 CG ASN A 100 -8.768 -1.124 -0.475 1.00 0.00 C ATOM 1616 OD1 ASN A 100 -7.542 -1.023 -0.517 1.00 0.00 O ATOM 1617 ND2 ASN A 100 -9.578 -0.077 -0.571 1.00 0.00 N ATOM 0 H ASN A 100 -8.725 -4.947 -0.491 1.00 0.00 H new ATOM 0 HA ASN A 100 -8.006 -2.718 1.286 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -9.368 -3.030 -1.244 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -10.490 -2.336 -0.091 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -9.190 0.859 -0.685 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -10.589 -0.209 -0.531 1.00 0.00 H new ATOM 1624 N GLU A 101 -10.266 -2.639 2.623 1.00 0.00 N ATOM 1625 CA GLU A 101 -11.263 -2.837 3.670 1.00 0.00 C ATOM 1626 C GLU A 101 -11.623 -1.510 4.334 1.00 0.00 C ATOM 1627 O GLU A 101 -10.826 -0.571 4.340 1.00 0.00 O ATOM 1628 CB GLU A 101 -10.743 -3.822 4.719 1.00 0.00 C ATOM 1629 CG GLU A 101 -11.778 -4.842 5.163 1.00 0.00 C ATOM 1630 CD GLU A 101 -12.548 -4.394 6.389 1.00 0.00 C ATOM 1631 OE1 GLU A 101 -13.551 -3.666 6.228 1.00 0.00 O ATOM 1632 OE2 GLU A 101 -12.151 -4.773 7.510 1.00 0.00 O ATOM 0 H GLU A 101 -9.940 -1.677 2.526 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.161 -3.249 3.210 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.878 -4.347 4.314 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.398 -3.264 5.590 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -12.476 -5.025 4.346 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.282 -5.789 5.376 1.00 0.00 H new ATOM 1639 N ALA A 102 -12.828 -1.441 4.893 1.00 0.00 N ATOM 1640 CA ALA A 102 -13.291 -0.231 5.560 1.00 0.00 C ATOM 1641 C ALA A 102 -13.818 -0.540 6.957 1.00 0.00 C ATOM 1642 O ALA A 102 -14.773 0.083 7.422 1.00 0.00 O ATOM 1643 CB ALA A 102 -14.366 0.452 4.726 1.00 0.00 C ATOM 0 H ALA A 102 -13.500 -2.209 4.897 1.00 0.00 H new ATOM 0 HA ALA A 102 -12.442 0.445 5.663 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -14.703 1.355 5.236 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -13.957 0.717 3.751 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -15.209 -0.226 4.593 1.00 0.00 H new ATOM 1649 N LEU A 103 -13.190 -1.504 7.620 1.00 0.00 N ATOM 1650 CA LEU A 103 -13.594 -1.895 8.967 1.00 0.00 C ATOM 1651 C LEU A 103 -15.045 -2.369 8.987 1.00 0.00 C ATOM 1652 O LEU A 103 -15.727 -2.257 10.006 1.00 0.00 O ATOM 1653 CB LEU A 103 -13.412 -0.725 9.935 1.00 0.00 C ATOM 1654 CG LEU A 103 -12.829 -1.101 11.302 1.00 0.00 C ATOM 1655 CD1 LEU A 103 -11.470 -0.448 11.503 1.00 0.00 C ATOM 1656 CD2 LEU A 103 -13.782 -0.704 12.420 1.00 0.00 C ATOM 0 H LEU A 103 -12.399 -2.030 7.248 1.00 0.00 H new ATOM 0 HA LEU A 103 -12.959 -2.722 9.284 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.760 0.014 9.470 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -14.379 -0.246 10.088 1.00 0.00 H new ATOM 0 HG LEU A 103 -12.698 -2.183 11.331 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -11.073 -0.727 12.479 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -10.786 -0.784 10.724 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -11.576 0.636 11.451 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.349 -0.980 13.382 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -13.947 0.373 12.392 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -14.733 -1.221 12.288 1.00 0.00 H new ATOM 1668 N VAL A 104 -15.509 -2.900 7.859 1.00 0.00 N ATOM 1669 CA VAL A 104 -16.879 -3.391 7.748 1.00 0.00 C ATOM 1670 C VAL A 104 -17.883 -2.246 7.805 1.00 0.00 C ATOM 1671 O VAL A 104 -18.553 -1.944 6.816 1.00 0.00 O ATOM 1672 CB VAL A 104 -17.209 -4.405 8.862 1.00 0.00 C ATOM 1673 CG1 VAL A 104 -18.575 -5.033 8.624 1.00 0.00 C ATOM 1674 CG2 VAL A 104 -16.131 -5.474 8.952 1.00 0.00 C ATOM 0 H VAL A 104 -14.956 -3.001 7.008 1.00 0.00 H new ATOM 0 HA VAL A 104 -16.955 -3.889 6.781 1.00 0.00 H new ATOM 0 HB VAL A 104 -17.238 -3.874 9.813 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -18.791 -5.746 9.420 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -19.337 -4.254 8.618 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -18.576 -5.549 7.664 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -16.383 -6.179 9.744 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -16.064 -6.004 8.002 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -15.172 -5.006 9.175 1.00 0.00 H new ATOM 1684 N ARG A 105 -17.983 -1.609 8.967 1.00 0.00 N ATOM 1685 CA ARG A 105 -18.908 -0.497 9.153 1.00 0.00 C ATOM 1686 C ARG A 105 -20.351 -0.948 8.957 1.00 0.00 C ATOM 1687 O ARG A 105 -21.191 -0.188 8.477 1.00 0.00 O ATOM 1688 CB ARG A 105 -18.580 0.635 8.176 1.00 0.00 C ATOM 1689 CG ARG A 105 -18.823 2.022 8.748 1.00 0.00 C ATOM 1690 CD ARG A 105 -17.819 3.029 8.213 1.00 0.00 C ATOM 1691 NE ARG A 105 -18.273 4.405 8.395 1.00 0.00 N ATOM 1692 CZ ARG A 105 -19.192 4.990 7.630 1.00 0.00 C ATOM 1693 NH1 ARG A 105 -19.756 4.322 6.631 1.00 0.00 N ATOM 1694 NH2 ARG A 105 -19.549 6.246 7.864 1.00 0.00 N ATOM 0 H ARG A 105 -17.435 -1.844 9.794 1.00 0.00 H new ATOM 0 HA ARG A 105 -18.796 -0.133 10.174 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -17.535 0.553 7.875 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -19.181 0.512 7.275 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -19.833 2.347 8.500 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -18.758 1.985 9.835 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -16.864 2.893 8.720 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -17.647 2.841 7.153 1.00 0.00 H new ATOM 0 HE ARG A 105 -17.862 4.950 9.153 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -19.486 3.356 6.447 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -20.460 4.775 6.048 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -19.119 6.764 8.630 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -20.253 6.694 7.277 1.00 0.00 H new ATOM 1708 N GLN A 106 -20.631 -2.193 9.334 1.00 0.00 N ATOM 1709 CA GLN A 106 -21.974 -2.746 9.198 1.00 0.00 C ATOM 1710 C GLN A 106 -22.063 -4.125 9.845 1.00 0.00 C ATOM 1711 O GLN A 106 -21.987 -5.147 9.164 1.00 0.00 O ATOM 1712 CB GLN A 106 -22.364 -2.835 7.722 1.00 0.00 C ATOM 1713 CG GLN A 106 -23.196 -1.659 7.241 1.00 0.00 C ATOM 1714 CD GLN A 106 -24.339 -2.083 6.339 1.00 0.00 C ATOM 1715 OE1 GLN A 106 -24.862 -3.191 6.460 1.00 0.00 O ATOM 1716 NE2 GLN A 106 -24.733 -1.202 5.427 1.00 0.00 N ATOM 0 H GLN A 106 -19.948 -2.836 9.735 1.00 0.00 H new ATOM 0 HA GLN A 106 -22.668 -2.080 9.710 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -21.458 -2.899 7.119 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -22.923 -3.756 7.557 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -23.597 -1.126 8.103 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -22.554 -0.960 6.704 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -24.271 -0.295 5.361 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -25.497 -1.432 4.792 1.00 0.00 H new ATOM 1725 N GLY A 107 -22.224 -4.146 11.164 1.00 0.00 N ATOM 1726 CA GLY A 107 -22.322 -5.405 11.879 1.00 0.00 C ATOM 1727 C GLY A 107 -21.909 -5.281 13.333 1.00 0.00 C ATOM 1728 O GLY A 107 -22.380 -6.031 14.186 1.00 0.00 O ATOM 0 H GLY A 107 -22.288 -3.314 11.750 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -23.348 -5.770 11.826 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -21.693 -6.148 11.388 1.00 0.00 H new ATOM 1732 N LEU A 108 -21.023 -4.331 13.614 1.00 0.00 N ATOM 1733 CA LEU A 108 -20.545 -4.111 14.974 1.00 0.00 C ATOM 1734 C LEU A 108 -21.107 -2.812 15.544 1.00 0.00 C ATOM 1735 O LEU A 108 -21.717 -2.804 16.613 1.00 0.00 O ATOM 1736 CB LEU A 108 -19.015 -4.076 15.000 1.00 0.00 C ATOM 1737 CG LEU A 108 -18.334 -5.412 14.701 1.00 0.00 C ATOM 1738 CD1 LEU A 108 -16.923 -5.189 14.181 1.00 0.00 C ATOM 1739 CD2 LEU A 108 -18.315 -6.288 15.944 1.00 0.00 C ATOM 0 H LEU A 108 -20.622 -3.702 12.919 1.00 0.00 H new ATOM 0 HA LEU A 108 -20.892 -4.938 15.594 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -18.671 -3.339 14.274 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -18.691 -3.732 15.982 1.00 0.00 H new ATOM 0 HG LEU A 108 -18.905 -5.925 13.927 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -16.455 -6.151 13.974 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -16.962 -4.600 13.265 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -16.339 -4.655 14.931 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -17.827 -7.235 15.714 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -17.767 -5.781 16.738 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -19.337 -6.477 16.272 1.00 0.00 H new ATOM 1751 N ALA A 109 -20.898 -1.716 14.822 1.00 0.00 N ATOM 1752 CA ALA A 109 -21.387 -0.413 15.253 1.00 0.00 C ATOM 1753 C ALA A 109 -22.546 0.053 14.379 1.00 0.00 C ATOM 1754 O ALA A 109 -23.068 -0.709 13.566 1.00 0.00 O ATOM 1755 CB ALA A 109 -20.258 0.608 15.227 1.00 0.00 C ATOM 0 H ALA A 109 -20.393 -1.705 13.936 1.00 0.00 H new ATOM 0 HA ALA A 109 -21.753 -0.508 16.275 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -20.637 1.577 15.551 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -19.461 0.287 15.898 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -19.867 0.692 14.213 1.00 0.00 H new ATOM 1761 N LYS A 110 -22.945 1.310 14.552 1.00 0.00 N ATOM 1762 CA LYS A 110 -24.044 1.876 13.777 1.00 0.00 C ATOM 1763 C LYS A 110 -23.549 2.997 12.871 1.00 0.00 C ATOM 1764 O LYS A 110 -23.876 2.972 11.665 1.00 0.00 O ATOM 1765 CB LYS A 110 -25.136 2.401 14.710 1.00 0.00 C ATOM 1766 CG LYS A 110 -26.538 2.274 14.137 1.00 0.00 C ATOM 1767 CD LYS A 110 -27.082 3.619 13.685 1.00 0.00 C ATOM 1768 CE LYS A 110 -27.404 4.517 14.870 1.00 0.00 C ATOM 1769 NZ LYS A 110 -27.747 5.901 14.441 1.00 0.00 N ATOM 1770 OXT LYS A 110 -22.838 3.893 13.374 1.00 0.00 O ATOM 0 H LYS A 110 -22.524 1.955 15.221 1.00 0.00 H new ATOM 0 HA LYS A 110 -24.460 1.086 13.152 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -25.088 1.858 15.654 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -24.938 3.449 14.934 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -26.526 1.584 13.293 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -27.202 1.847 14.889 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -26.352 4.111 13.042 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -27.981 3.467 13.088 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -28.238 4.094 15.430 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -26.549 4.548 15.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -27.960 6.481 15.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -26.942 6.315 13.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -28.579 5.875 13.817 1.00 0.00 H new TER 1784 LYS A 110