USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 808 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 29 CYS SG : rot 140:sc= -0.101 USER MOD Set 1.2: A 32 CYS SG : rot 70:sc= -0.313 USER MOD Set 2.1: A 7 THR OG1 : rot 113:sc= 1.2 USER MOD Set 2.2: A 9 GLN : amide:sc= 0.7 K(o=1.9,f=-2.8!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0.714 (180deg=0.537) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -82:sc= 1.28 USER MOD Single : A 16 SER OG : rot 72:sc= 1.28 USER MOD Single : A 33 LYS NZ :NH3+ 137:sc= 1.13 (180deg=0.0605) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0.516 K(o=0.52,f=0) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 146:sc= 2.18 (180deg=1.3) USER MOD Single : A 51 LYS NZ :NH3+ -177:sc= 3.59 (180deg=3.57) USER MOD Single : A 54 LYS NZ :NH3+ 176:sc= 1.24 (180deg=1.09) USER MOD Single : A 60 ASN : amide:sc= 0.946 K(o=0.95,f=-7!) USER MOD Single : A 61 GLN : amide:sc= -0.731! C(o=-0.73!,f=-1.9!) USER MOD Single : A 63 THR OG1 : rot -33:sc= 0.869 USER MOD Single : A 66 LYS NZ :NH3+ -170:sc= 1.89 (180deg=1.62) USER MOD Single : A 67 TYR OH : rot -139:sc= 0.98 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 128:sc= 1.25 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -135:sc= 2.18 (180deg=0.114) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 2.44 (180deg=2.44) USER MOD Single : A 97 GLN : amide:sc= 0.0689 K(o=0.069,f=-0.59) USER MOD Single : A 101 ASN : amide:sc= 0.152 X(o=0.15,f=0) USER MOD Single : A 102 LYS NZ :NH3+ 151:sc= 1.3 (180deg=0.736) USER MOD Single : A 103 HIS : no HD1:sc=-0.00233 X(o=-0.0023,f=-0.0082) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.524 0.147 -2.576 1.00 0.00 N ATOM 2 CA MET A 1 2.525 -0.578 -1.287 1.00 0.00 C ATOM 3 C MET A 1 2.360 -2.079 -1.568 1.00 0.00 C ATOM 4 O MET A 1 3.363 -2.749 -1.825 1.00 0.00 O ATOM 5 CB MET A 1 1.497 0.019 -0.302 1.00 0.00 C ATOM 6 CG MET A 1 1.623 -0.570 1.110 1.00 0.00 C ATOM 7 SD MET A 1 0.497 0.179 2.320 1.00 0.00 S ATOM 8 CE MET A 1 0.960 -0.773 3.792 1.00 0.00 C ATOM 0 H1 MET A 1 2.803 1.136 -2.418 1.00 0.00 H new ATOM 0 H2 MET A 1 3.198 -0.303 -3.228 1.00 0.00 H new ATOM 0 H3 MET A 1 1.570 0.118 -2.990 1.00 0.00 H new ATOM 0 HA MET A 1 3.479 -0.454 -0.774 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.630 1.100 -0.254 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.490 -0.162 -0.679 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.431 -1.642 1.065 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.649 -0.444 1.456 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.362 -0.443 4.642 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.780 -1.833 3.611 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.017 -0.616 4.009 1.00 0.00 H new ATOM 20 N ALA A 2 1.135 -2.621 -1.533 1.00 0.00 N ATOM 21 CA ALA A 2 0.796 -3.958 -1.999 1.00 0.00 C ATOM 22 C ALA A 2 -0.704 -3.988 -2.283 1.00 0.00 C ATOM 23 O ALA A 2 -1.496 -3.375 -1.562 1.00 0.00 O ATOM 24 CB ALA A 2 1.136 -5.014 -0.938 1.00 0.00 C ATOM 0 H ALA A 2 0.329 -2.116 -1.165 1.00 0.00 H new ATOM 0 HA ALA A 2 1.370 -4.187 -2.897 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.873 -6.003 -1.312 1.00 0.00 H new ATOM 0 HB2 ALA A 2 2.204 -4.981 -0.720 1.00 0.00 H new ATOM 0 HB3 ALA A 2 0.573 -4.809 -0.027 1.00 0.00 H new ATOM 30 N ILE A 3 -1.083 -4.727 -3.322 1.00 0.00 N ATOM 31 CA ILE A 3 -2.470 -5.001 -3.676 1.00 0.00 C ATOM 32 C ILE A 3 -2.984 -6.096 -2.726 1.00 0.00 C ATOM 33 O ILE A 3 -2.204 -6.890 -2.190 1.00 0.00 O ATOM 34 CB ILE A 3 -2.526 -5.356 -5.183 1.00 0.00 C ATOM 35 CG1 ILE A 3 -1.998 -4.139 -5.989 1.00 0.00 C ATOM 36 CG2 ILE A 3 -3.941 -5.757 -5.642 1.00 0.00 C ATOM 37 CD1 ILE A 3 -1.878 -4.366 -7.490 1.00 0.00 C ATOM 0 H ILE A 3 -0.415 -5.163 -3.957 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.131 -4.144 -3.548 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.898 -6.228 -5.363 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.662 -3.292 -5.817 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.019 -3.861 -5.599 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.925 -5.996 -6.705 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.272 -6.630 -5.079 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.629 -4.930 -5.467 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.502 -3.461 -7.966 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.189 -5.189 -7.680 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.858 -4.611 -7.900 1.00 0.00 H new ATOM 49 N VAL A 4 -4.296 -6.135 -2.508 1.00 0.00 N ATOM 50 CA VAL A 4 -4.978 -6.986 -1.542 1.00 0.00 C ATOM 51 C VAL A 4 -6.029 -7.774 -2.336 1.00 0.00 C ATOM 52 O VAL A 4 -6.280 -7.479 -3.507 1.00 0.00 O ATOM 53 CB VAL A 4 -5.564 -6.095 -0.410 1.00 0.00 C ATOM 54 CG1 VAL A 4 -6.121 -6.901 0.774 1.00 0.00 C ATOM 55 CG2 VAL A 4 -4.516 -5.118 0.162 1.00 0.00 C ATOM 0 H VAL A 4 -4.944 -5.543 -3.028 1.00 0.00 H new ATOM 0 HA VAL A 4 -4.322 -7.698 -1.042 1.00 0.00 H new ATOM 0 HB VAL A 4 -6.376 -5.552 -0.894 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -6.514 -6.217 1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -6.920 -7.555 0.425 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -5.325 -7.503 1.211 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -4.971 -4.517 0.949 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -3.679 -5.682 0.574 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.157 -4.464 -0.632 1.00 0.00 H new ATOM 65 N LYS A 5 -6.656 -8.785 -1.738 1.00 0.00 N ATOM 66 CA LYS A 5 -7.790 -9.490 -2.318 1.00 0.00 C ATOM 67 C LYS A 5 -8.831 -9.736 -1.237 1.00 0.00 C ATOM 68 O LYS A 5 -8.474 -9.812 -0.058 1.00 0.00 O ATOM 69 CB LYS A 5 -7.328 -10.776 -3.023 1.00 0.00 C ATOM 70 CG LYS A 5 -6.913 -11.972 -2.141 1.00 0.00 C ATOM 71 CD LYS A 5 -5.675 -11.770 -1.246 1.00 0.00 C ATOM 72 CE LYS A 5 -4.412 -11.312 -1.998 1.00 0.00 C ATOM 73 NZ LYS A 5 -3.867 -12.356 -2.906 1.00 0.00 N ATOM 0 H LYS A 5 -6.383 -9.141 -0.822 1.00 0.00 H new ATOM 0 HA LYS A 5 -8.259 -8.880 -3.090 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -8.134 -11.107 -3.678 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -6.482 -10.522 -3.662 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -7.757 -12.234 -1.502 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.728 -12.827 -2.791 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.913 -11.033 -0.479 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.457 -12.706 -0.732 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -4.645 -10.419 -2.578 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -3.646 -11.032 -1.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -3.019 -11.991 -3.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -3.617 -13.201 -2.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.584 -12.607 -3.616 1.00 0.00 H new ATOM 87 N ALA A 6 -10.099 -9.851 -1.626 1.00 0.00 N ATOM 88 CA ALA A 6 -11.207 -10.088 -0.710 1.00 0.00 C ATOM 89 C ALA A 6 -12.286 -10.924 -1.398 1.00 0.00 C ATOM 90 O ALA A 6 -12.244 -11.134 -2.613 1.00 0.00 O ATOM 91 CB ALA A 6 -11.779 -8.744 -0.240 1.00 0.00 C ATOM 0 H ALA A 6 -10.387 -9.781 -2.602 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.849 -10.641 0.159 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.608 -8.921 0.445 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -11.001 -8.176 0.270 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -12.135 -8.179 -1.101 1.00 0.00 H new ATOM 97 N THR A 7 -13.270 -11.367 -0.617 1.00 0.00 N ATOM 98 CA THR A 7 -14.438 -12.103 -1.077 1.00 0.00 C ATOM 99 C THR A 7 -15.663 -11.487 -0.390 1.00 0.00 C ATOM 100 O THR A 7 -15.491 -10.647 0.498 1.00 0.00 O ATOM 101 CB THR A 7 -14.260 -13.604 -0.764 1.00 0.00 C ATOM 102 OG1 THR A 7 -14.062 -13.823 0.618 1.00 0.00 O ATOM 103 CG2 THR A 7 -13.071 -14.235 -1.495 1.00 0.00 C ATOM 0 H THR A 7 -13.272 -11.215 0.392 1.00 0.00 H new ATOM 0 HA THR A 7 -14.571 -12.030 -2.156 1.00 0.00 H new ATOM 0 HB THR A 7 -15.183 -14.071 -1.107 1.00 0.00 H new ATOM 0 HG1 THR A 7 -14.835 -14.299 0.988 1.00 0.00 H new ATOM 0 HG21 THR A 7 -13.001 -15.291 -1.232 1.00 0.00 H new ATOM 0 HG22 THR A 7 -13.212 -14.138 -2.571 1.00 0.00 H new ATOM 0 HG23 THR A 7 -12.152 -13.726 -1.202 1.00 0.00 H new ATOM 111 N ASP A 8 -16.888 -11.888 -0.740 1.00 0.00 N ATOM 112 CA ASP A 8 -18.124 -11.310 -0.187 1.00 0.00 C ATOM 113 C ASP A 8 -18.138 -11.282 1.347 1.00 0.00 C ATOM 114 O ASP A 8 -18.716 -10.386 1.961 1.00 0.00 O ATOM 115 CB ASP A 8 -19.354 -12.096 -0.663 1.00 0.00 C ATOM 116 CG ASP A 8 -20.634 -11.289 -0.394 1.00 0.00 C ATOM 117 OD1 ASP A 8 -20.845 -10.264 -1.090 1.00 0.00 O ATOM 118 OD2 ASP A 8 -21.432 -11.681 0.486 1.00 0.00 O ATOM 0 H ASP A 8 -17.055 -12.629 -1.421 1.00 0.00 H new ATOM 0 HA ASP A 8 -18.158 -10.283 -0.551 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -19.268 -12.311 -1.728 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -19.404 -13.055 -0.147 1.00 0.00 H new ATOM 123 N GLN A 9 -17.463 -12.262 1.954 1.00 0.00 N ATOM 124 CA GLN A 9 -17.322 -12.442 3.389 1.00 0.00 C ATOM 125 C GLN A 9 -16.596 -11.269 4.066 1.00 0.00 C ATOM 126 O GLN A 9 -16.911 -10.965 5.221 1.00 0.00 O ATOM 127 CB GLN A 9 -16.573 -13.761 3.660 1.00 0.00 C ATOM 128 CG GLN A 9 -17.348 -15.032 3.245 1.00 0.00 C ATOM 129 CD GLN A 9 -17.416 -15.272 1.732 1.00 0.00 C ATOM 130 OE1 GLN A 9 -16.544 -14.843 0.983 1.00 0.00 O ATOM 131 NE2 GLN A 9 -18.453 -15.926 1.232 1.00 0.00 N ATOM 0 H GLN A 9 -16.977 -12.985 1.424 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.323 -12.478 3.820 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -15.622 -13.740 3.128 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -16.342 -13.822 4.724 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -16.881 -15.897 3.716 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -18.364 -14.966 3.635 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -19.179 -16.283 1.854 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -18.526 -16.073 0.225 1.00 0.00 H new ATOM 140 N SER A 10 -15.659 -10.606 3.376 1.00 0.00 N ATOM 141 CA SER A 10 -14.763 -9.619 3.994 1.00 0.00 C ATOM 142 C SER A 10 -14.506 -8.374 3.141 1.00 0.00 C ATOM 143 O SER A 10 -13.855 -7.443 3.615 1.00 0.00 O ATOM 144 CB SER A 10 -13.432 -10.296 4.364 1.00 0.00 C ATOM 145 OG SER A 10 -13.633 -11.493 5.105 1.00 0.00 O ATOM 0 H SER A 10 -15.501 -10.738 2.377 1.00 0.00 H new ATOM 0 HA SER A 10 -15.275 -9.258 4.886 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.874 -10.521 3.455 1.00 0.00 H new ATOM 0 HB3 SER A 10 -12.824 -9.605 4.948 1.00 0.00 H new ATOM 0 HG SER A 10 -12.765 -11.894 5.320 1.00 0.00 H new ATOM 151 N PHE A 11 -15.043 -8.303 1.919 1.00 0.00 N ATOM 152 CA PHE A 11 -14.928 -7.141 1.045 1.00 0.00 C ATOM 153 C PHE A 11 -15.396 -5.875 1.762 1.00 0.00 C ATOM 154 O PHE A 11 -14.773 -4.821 1.625 1.00 0.00 O ATOM 155 CB PHE A 11 -15.748 -7.399 -0.229 1.00 0.00 C ATOM 156 CG PHE A 11 -15.635 -6.321 -1.287 1.00 0.00 C ATOM 157 CD1 PHE A 11 -16.513 -5.219 -1.287 1.00 0.00 C ATOM 158 CD2 PHE A 11 -14.659 -6.433 -2.294 1.00 0.00 C ATOM 159 CE1 PHE A 11 -16.418 -4.243 -2.296 1.00 0.00 C ATOM 160 CE2 PHE A 11 -14.574 -5.464 -3.307 1.00 0.00 C ATOM 161 CZ PHE A 11 -15.458 -4.372 -3.313 1.00 0.00 C ATOM 0 H PHE A 11 -15.578 -9.067 1.506 1.00 0.00 H new ATOM 0 HA PHE A 11 -13.884 -6.986 0.773 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -15.431 -8.348 -0.662 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -16.797 -7.509 0.047 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -17.259 -5.123 -0.512 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -13.973 -7.267 -2.288 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -17.084 -3.393 -2.288 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -13.828 -5.558 -4.082 1.00 0.00 H new ATOM 0 HZ PHE A 11 -15.399 -3.633 -4.098 1.00 0.00 H new ATOM 171 N SER A 12 -16.457 -5.977 2.567 1.00 0.00 N ATOM 172 CA SER A 12 -17.014 -4.839 3.280 1.00 0.00 C ATOM 173 C SER A 12 -16.038 -4.314 4.331 1.00 0.00 C ATOM 174 O SER A 12 -15.852 -3.105 4.449 1.00 0.00 O ATOM 175 CB SER A 12 -18.356 -5.240 3.911 1.00 0.00 C ATOM 176 OG SER A 12 -19.171 -5.935 2.975 1.00 0.00 O ATOM 0 H SER A 12 -16.949 -6.854 2.739 1.00 0.00 H new ATOM 0 HA SER A 12 -17.186 -4.027 2.574 1.00 0.00 H new ATOM 0 HB2 SER A 12 -18.178 -5.870 4.783 1.00 0.00 H new ATOM 0 HB3 SER A 12 -18.877 -4.350 4.262 1.00 0.00 H new ATOM 0 HG SER A 12 -20.019 -6.182 3.400 1.00 0.00 H new ATOM 182 N ALA A 13 -15.374 -5.211 5.064 1.00 0.00 N ATOM 183 CA ALA A 13 -14.374 -4.832 6.048 1.00 0.00 C ATOM 184 C ALA A 13 -13.187 -4.171 5.347 1.00 0.00 C ATOM 185 O ALA A 13 -12.717 -3.120 5.781 1.00 0.00 O ATOM 186 CB ALA A 13 -13.928 -6.060 6.849 1.00 0.00 C ATOM 0 H ALA A 13 -15.519 -6.218 4.987 1.00 0.00 H new ATOM 0 HA ALA A 13 -14.806 -4.115 6.746 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -13.179 -5.763 7.583 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.787 -6.492 7.362 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -13.500 -6.800 6.173 1.00 0.00 H new ATOM 192 N GLU A 14 -12.721 -4.762 4.243 1.00 0.00 N ATOM 193 CA GLU A 14 -11.550 -4.274 3.527 1.00 0.00 C ATOM 194 C GLU A 14 -11.804 -2.894 2.927 1.00 0.00 C ATOM 195 O GLU A 14 -10.910 -2.046 2.960 1.00 0.00 O ATOM 196 CB GLU A 14 -11.130 -5.272 2.435 1.00 0.00 C ATOM 197 CG GLU A 14 -10.482 -6.534 3.025 1.00 0.00 C ATOM 198 CD GLU A 14 -9.144 -6.286 3.754 1.00 0.00 C ATOM 199 OE1 GLU A 14 -8.515 -5.223 3.555 1.00 0.00 O ATOM 200 OE2 GLU A 14 -8.719 -7.166 4.539 1.00 0.00 O ATOM 0 H GLU A 14 -13.147 -5.589 3.825 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.734 -4.181 4.243 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.003 -5.554 1.847 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.429 -4.790 1.754 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -11.182 -6.994 3.723 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.316 -7.251 2.221 1.00 0.00 H new ATOM 207 N THR A 15 -13.011 -2.635 2.428 1.00 0.00 N ATOM 208 CA THR A 15 -13.359 -1.355 1.829 1.00 0.00 C ATOM 209 C THR A 15 -13.648 -0.268 2.879 1.00 0.00 C ATOM 210 O THR A 15 -13.909 0.876 2.502 1.00 0.00 O ATOM 211 CB THR A 15 -14.482 -1.543 0.792 1.00 0.00 C ATOM 212 OG1 THR A 15 -15.570 -2.286 1.297 1.00 0.00 O ATOM 213 CG2 THR A 15 -13.941 -2.259 -0.454 1.00 0.00 C ATOM 0 H THR A 15 -13.775 -3.311 2.429 1.00 0.00 H new ATOM 0 HA THR A 15 -12.490 -0.977 1.290 1.00 0.00 H new ATOM 0 HB THR A 15 -14.838 -0.544 0.540 1.00 0.00 H new ATOM 0 HG1 THR A 15 -15.365 -3.243 1.244 1.00 0.00 H new ATOM 0 HG21 THR A 15 -14.745 -2.385 -1.179 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.143 -1.664 -0.898 1.00 0.00 H new ATOM 0 HG23 THR A 15 -13.551 -3.237 -0.171 1.00 0.00 H new ATOM 221 N SER A 16 -13.548 -0.580 4.178 1.00 0.00 N ATOM 222 CA SER A 16 -13.930 0.311 5.273 1.00 0.00 C ATOM 223 C SER A 16 -12.716 0.838 6.044 1.00 0.00 C ATOM 224 O SER A 16 -12.800 1.076 7.250 1.00 0.00 O ATOM 225 CB SER A 16 -14.953 -0.381 6.188 1.00 0.00 C ATOM 226 OG SER A 16 -16.132 -0.717 5.487 1.00 0.00 O ATOM 0 H SER A 16 -13.191 -1.480 4.500 1.00 0.00 H new ATOM 0 HA SER A 16 -14.408 1.191 4.842 1.00 0.00 H new ATOM 0 HB2 SER A 16 -14.511 -1.283 6.612 1.00 0.00 H new ATOM 0 HB3 SER A 16 -15.199 0.276 7.022 1.00 0.00 H new ATOM 0 HG SER A 16 -15.950 -1.464 4.879 1.00 0.00 H new ATOM 232 N GLU A 17 -11.583 1.027 5.358 1.00 0.00 N ATOM 233 CA GLU A 17 -10.340 1.483 5.990 1.00 0.00 C ATOM 234 C GLU A 17 -9.655 2.630 5.234 1.00 0.00 C ATOM 235 O GLU A 17 -8.568 3.060 5.629 1.00 0.00 O ATOM 236 CB GLU A 17 -9.374 0.298 6.174 1.00 0.00 C ATOM 237 CG GLU A 17 -9.943 -0.834 7.041 1.00 0.00 C ATOM 238 CD GLU A 17 -8.871 -1.882 7.381 1.00 0.00 C ATOM 239 OE1 GLU A 17 -8.157 -2.341 6.460 1.00 0.00 O ATOM 240 OE2 GLU A 17 -8.739 -2.260 8.568 1.00 0.00 O ATOM 0 H GLU A 17 -11.502 0.869 4.354 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.614 1.887 6.965 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.114 -0.103 5.194 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.451 0.660 6.626 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.350 -0.417 7.962 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -10.769 -1.315 6.516 1.00 0.00 H new ATOM 247 N GLY A 18 -10.257 3.146 4.160 1.00 0.00 N ATOM 248 CA GLY A 18 -9.649 4.198 3.358 1.00 0.00 C ATOM 249 C GLY A 18 -10.371 4.367 2.043 1.00 0.00 C ATOM 250 O GLY A 18 -11.486 3.866 1.886 1.00 0.00 O ATOM 0 H GLY A 18 -11.173 2.846 3.827 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.669 5.138 3.910 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.602 3.959 3.173 1.00 0.00 H new ATOM 254 N VAL A 19 -9.760 5.096 1.111 1.00 0.00 N ATOM 255 CA VAL A 19 -10.221 5.112 -0.264 1.00 0.00 C ATOM 256 C VAL A 19 -9.730 3.776 -0.827 1.00 0.00 C ATOM 257 O VAL A 19 -8.593 3.373 -0.558 1.00 0.00 O ATOM 258 CB VAL A 19 -9.650 6.333 -1.015 1.00 0.00 C ATOM 259 CG1 VAL A 19 -10.458 6.601 -2.297 1.00 0.00 C ATOM 260 CG2 VAL A 19 -9.675 7.622 -0.176 1.00 0.00 C ATOM 0 H VAL A 19 -8.944 5.682 1.289 1.00 0.00 H new ATOM 0 HA VAL A 19 -11.302 5.211 -0.364 1.00 0.00 H new ATOM 0 HB VAL A 19 -8.614 6.082 -1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -10.042 7.465 -2.815 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -10.407 5.728 -2.948 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -11.498 6.799 -2.037 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -9.261 8.444 -0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -10.703 7.856 0.101 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -9.079 7.481 0.726 1.00 0.00 H new ATOM 270 N VAL A 20 -10.562 3.063 -1.577 1.00 0.00 N ATOM 271 CA VAL A 20 -10.258 1.721 -2.038 1.00 0.00 C ATOM 272 C VAL A 20 -10.689 1.619 -3.497 1.00 0.00 C ATOM 273 O VAL A 20 -11.747 2.123 -3.879 1.00 0.00 O ATOM 274 CB VAL A 20 -10.934 0.669 -1.127 1.00 0.00 C ATOM 275 CG1 VAL A 20 -10.519 -0.750 -1.539 1.00 0.00 C ATOM 276 CG2 VAL A 20 -10.592 0.882 0.363 1.00 0.00 C ATOM 0 H VAL A 20 -11.473 3.406 -1.883 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.189 1.516 -1.980 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.010 0.792 -1.252 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -11.005 -1.475 -0.886 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.820 -0.932 -2.571 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.437 -0.852 -1.453 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -11.089 0.120 0.963 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.514 0.808 0.503 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.931 1.869 0.677 1.00 0.00 H new ATOM 286 N LEU A 21 -9.869 0.952 -4.305 1.00 0.00 N ATOM 287 CA LEU A 21 -10.122 0.685 -5.709 1.00 0.00 C ATOM 288 C LEU A 21 -10.187 -0.832 -5.825 1.00 0.00 C ATOM 289 O LEU A 21 -9.167 -1.525 -5.829 1.00 0.00 O ATOM 290 CB LEU A 21 -9.006 1.336 -6.550 1.00 0.00 C ATOM 291 CG LEU A 21 -9.144 1.316 -8.083 1.00 0.00 C ATOM 292 CD1 LEU A 21 -8.896 -0.054 -8.707 1.00 0.00 C ATOM 293 CD2 LEU A 21 -10.489 1.877 -8.550 1.00 0.00 C ATOM 0 H LEU A 21 -8.979 0.571 -3.984 1.00 0.00 H new ATOM 0 HA LEU A 21 -11.053 1.109 -6.085 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.918 2.376 -6.237 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.067 0.845 -6.294 1.00 0.00 H new ATOM 0 HG LEU A 21 -8.350 1.972 -8.440 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -9.011 0.013 -9.789 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -7.885 -0.384 -8.470 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -9.614 -0.771 -8.309 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -10.540 1.842 -9.638 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -11.298 1.280 -8.130 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -10.589 2.909 -8.215 1.00 0.00 H new ATOM 305 N ALA A 22 -11.400 -1.368 -5.813 1.00 0.00 N ATOM 306 CA ALA A 22 -11.616 -2.775 -6.066 1.00 0.00 C ATOM 307 C ALA A 22 -11.567 -3.030 -7.572 1.00 0.00 C ATOM 308 O ALA A 22 -11.882 -2.149 -8.373 1.00 0.00 O ATOM 309 CB ALA A 22 -12.953 -3.211 -5.478 1.00 0.00 C ATOM 0 H ALA A 22 -12.252 -0.839 -5.628 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.832 -3.361 -5.587 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.108 -4.272 -5.673 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.952 -3.036 -4.402 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.757 -2.637 -5.938 1.00 0.00 H new ATOM 315 N ASP A 23 -11.232 -4.258 -7.946 1.00 0.00 N ATOM 316 CA ASP A 23 -11.116 -4.726 -9.319 1.00 0.00 C ATOM 317 C ASP A 23 -11.797 -6.088 -9.385 1.00 0.00 C ATOM 318 O ASP A 23 -11.245 -7.101 -8.935 1.00 0.00 O ATOM 319 CB ASP A 23 -9.642 -4.806 -9.737 1.00 0.00 C ATOM 320 CG ASP A 23 -9.458 -5.536 -11.079 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.297 -5.366 -11.990 1.00 0.00 O ATOM 322 OD2 ASP A 23 -8.435 -6.247 -11.220 1.00 0.00 O ATOM 0 H ASP A 23 -11.024 -4.989 -7.266 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.596 -4.036 -10.013 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -9.233 -3.799 -9.814 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -9.074 -5.323 -8.963 1.00 0.00 H new ATOM 327 N PHE A 24 -13.042 -6.077 -9.860 1.00 0.00 N ATOM 328 CA PHE A 24 -13.782 -7.273 -10.207 1.00 0.00 C ATOM 329 C PHE A 24 -13.194 -7.799 -11.512 1.00 0.00 C ATOM 330 O PHE A 24 -13.268 -7.120 -12.543 1.00 0.00 O ATOM 331 CB PHE A 24 -15.285 -6.981 -10.321 1.00 0.00 C ATOM 332 CG PHE A 24 -15.977 -6.938 -8.972 1.00 0.00 C ATOM 333 CD1 PHE A 24 -16.382 -8.140 -8.358 1.00 0.00 C ATOM 334 CD2 PHE A 24 -16.161 -5.715 -8.301 1.00 0.00 C ATOM 335 CE1 PHE A 24 -16.978 -8.120 -7.086 1.00 0.00 C ATOM 336 CE2 PHE A 24 -16.746 -5.697 -7.022 1.00 0.00 C ATOM 337 CZ PHE A 24 -17.154 -6.898 -6.416 1.00 0.00 C ATOM 0 H PHE A 24 -13.568 -5.217 -10.014 1.00 0.00 H new ATOM 0 HA PHE A 24 -13.689 -8.030 -9.428 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.428 -6.027 -10.829 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -15.753 -7.745 -10.941 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -16.234 -9.081 -8.867 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -15.853 -4.791 -8.768 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -17.300 -9.042 -6.624 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -16.882 -4.759 -6.505 1.00 0.00 H new ATOM 0 HZ PHE A 24 -17.603 -6.881 -5.434 1.00 0.00 H new ATOM 347 N TRP A 25 -12.613 -8.998 -11.463 1.00 0.00 N ATOM 348 CA TRP A 25 -11.862 -9.587 -12.567 1.00 0.00 C ATOM 349 C TRP A 25 -12.206 -11.070 -12.727 1.00 0.00 C ATOM 350 O TRP A 25 -12.953 -11.634 -11.921 1.00 0.00 O ATOM 351 CB TRP A 25 -10.352 -9.372 -12.350 1.00 0.00 C ATOM 352 CG TRP A 25 -9.702 -10.238 -11.312 1.00 0.00 C ATOM 353 CD1 TRP A 25 -9.909 -10.155 -9.982 1.00 0.00 C ATOM 354 CD2 TRP A 25 -8.748 -11.332 -11.493 1.00 0.00 C ATOM 355 NE1 TRP A 25 -9.199 -11.141 -9.330 1.00 0.00 N ATOM 356 CE2 TRP A 25 -8.448 -11.887 -10.212 1.00 0.00 C ATOM 357 CE3 TRP A 25 -8.093 -11.904 -12.605 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -7.558 -12.958 -10.045 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -7.189 -12.972 -12.447 1.00 0.00 C ATOM 360 CH2 TRP A 25 -6.932 -13.510 -11.174 1.00 0.00 C ATOM 0 H TRP A 25 -12.653 -9.597 -10.638 1.00 0.00 H new ATOM 0 HA TRP A 25 -12.144 -9.089 -13.495 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.843 -9.535 -13.300 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -10.190 -8.329 -12.076 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -10.539 -9.423 -9.498 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -9.226 -11.298 -8.323 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -8.289 -11.516 -13.594 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -7.357 -13.353 -9.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -6.688 -13.382 -13.312 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -6.256 -14.345 -11.065 1.00 0.00 H new ATOM 371 N ALA A 26 -11.658 -11.697 -13.771 1.00 0.00 N ATOM 372 CA ALA A 26 -11.675 -13.137 -13.976 1.00 0.00 C ATOM 373 C ALA A 26 -10.427 -13.499 -14.798 1.00 0.00 C ATOM 374 O ALA A 26 -10.019 -12.703 -15.649 1.00 0.00 O ATOM 375 CB ALA A 26 -12.951 -13.555 -14.714 1.00 0.00 C ATOM 0 H ALA A 26 -11.176 -11.195 -14.517 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.665 -13.662 -13.021 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -12.949 -14.635 -14.860 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -13.822 -13.270 -14.124 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.990 -13.058 -15.683 1.00 0.00 H new ATOM 381 N PRO A 27 -9.818 -14.679 -14.591 1.00 0.00 N ATOM 382 CA PRO A 27 -8.515 -15.008 -15.161 1.00 0.00 C ATOM 383 C PRO A 27 -8.560 -15.309 -16.661 1.00 0.00 C ATOM 384 O PRO A 27 -7.516 -15.277 -17.314 1.00 0.00 O ATOM 385 CB PRO A 27 -8.018 -16.213 -14.356 1.00 0.00 C ATOM 386 CG PRO A 27 -9.305 -16.905 -13.912 1.00 0.00 C ATOM 387 CD PRO A 27 -10.280 -15.745 -13.716 1.00 0.00 C ATOM 0 HA PRO A 27 -7.842 -14.154 -15.089 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -7.397 -16.872 -14.963 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -7.414 -15.904 -13.503 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -9.663 -17.608 -14.664 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -9.161 -17.469 -12.991 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -11.297 -16.044 -13.969 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -10.293 -15.418 -12.676 1.00 0.00 H new ATOM 395 N TRP A 28 -9.738 -15.590 -17.224 1.00 0.00 N ATOM 396 CA TRP A 28 -9.903 -15.852 -18.649 1.00 0.00 C ATOM 397 C TRP A 28 -10.068 -14.562 -19.469 1.00 0.00 C ATOM 398 O TRP A 28 -10.108 -14.628 -20.699 1.00 0.00 O ATOM 399 CB TRP A 28 -11.076 -16.830 -18.839 1.00 0.00 C ATOM 400 CG TRP A 28 -12.328 -16.609 -18.031 1.00 0.00 C ATOM 401 CD1 TRP A 28 -12.957 -15.429 -17.822 1.00 0.00 C ATOM 402 CD2 TRP A 28 -13.126 -17.605 -17.313 1.00 0.00 C ATOM 403 NE1 TRP A 28 -14.095 -15.629 -17.068 1.00 0.00 N ATOM 404 CE2 TRP A 28 -14.239 -16.948 -16.705 1.00 0.00 C ATOM 405 CE3 TRP A 28 -13.020 -18.998 -17.109 1.00 0.00 C ATOM 406 CZ2 TRP A 28 -15.191 -17.636 -15.935 1.00 0.00 C ATOM 407 CZ3 TRP A 28 -13.969 -19.699 -16.339 1.00 0.00 C ATOM 408 CH2 TRP A 28 -15.053 -19.020 -15.751 1.00 0.00 C ATOM 0 H TRP A 28 -10.609 -15.642 -16.696 1.00 0.00 H new ATOM 0 HA TRP A 28 -8.993 -16.313 -19.034 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -11.354 -16.815 -19.893 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -10.711 -17.833 -18.619 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -12.618 -14.472 -18.191 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -14.749 -14.890 -16.811 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -12.195 -19.537 -17.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -16.020 -17.106 -15.490 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -13.864 -20.765 -16.199 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -15.776 -19.563 -15.160 1.00 0.00 H new ATOM 419 N CYS A 29 -10.178 -13.393 -18.825 1.00 0.00 N ATOM 420 CA CYS A 29 -10.413 -12.128 -19.508 1.00 0.00 C ATOM 421 C CYS A 29 -9.065 -11.479 -19.837 1.00 0.00 C ATOM 422 O CYS A 29 -8.306 -11.134 -18.929 1.00 0.00 O ATOM 423 CB CYS A 29 -11.271 -11.233 -18.607 1.00 0.00 C ATOM 424 SG CYS A 29 -11.687 -9.694 -19.472 1.00 0.00 S ATOM 0 H CYS A 29 -10.105 -13.305 -17.811 1.00 0.00 H new ATOM 0 HA CYS A 29 -10.949 -12.283 -20.445 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -12.183 -11.758 -18.323 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -10.733 -11.008 -17.686 1.00 0.00 H new ATOM 0 HG CYS A 29 -12.920 -9.372 -19.215 1.00 0.00 H new ATOM 430 N GLY A 30 -8.776 -11.285 -21.127 1.00 0.00 N ATOM 431 CA GLY A 30 -7.570 -10.606 -21.597 1.00 0.00 C ATOM 432 C GLY A 30 -7.435 -9.192 -21.024 1.00 0.00 C ATOM 433 O GLY A 30 -6.415 -8.899 -20.404 1.00 0.00 O ATOM 0 H GLY A 30 -9.383 -11.601 -21.883 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.694 -11.193 -21.319 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -7.587 -10.554 -22.686 1.00 0.00 H new ATOM 437 N PRO A 31 -8.438 -8.305 -21.160 1.00 0.00 N ATOM 438 CA PRO A 31 -8.424 -6.982 -20.543 1.00 0.00 C ATOM 439 C PRO A 31 -8.100 -6.962 -19.041 1.00 0.00 C ATOM 440 O PRO A 31 -7.377 -6.064 -18.608 1.00 0.00 O ATOM 441 CB PRO A 31 -9.790 -6.377 -20.870 1.00 0.00 C ATOM 442 CG PRO A 31 -10.123 -6.996 -22.224 1.00 0.00 C ATOM 443 CD PRO A 31 -9.534 -8.402 -22.118 1.00 0.00 C ATOM 0 HA PRO A 31 -7.602 -6.391 -20.948 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.535 -6.631 -20.116 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -9.748 -5.289 -20.923 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.198 -7.022 -22.402 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -9.678 -6.433 -23.045 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -10.285 -9.116 -21.781 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -9.176 -8.750 -23.087 1.00 0.00 H new ATOM 451 N CYS A 32 -8.546 -7.945 -18.245 1.00 0.00 N ATOM 452 CA CYS A 32 -8.140 -8.045 -16.839 1.00 0.00 C ATOM 453 C CYS A 32 -6.620 -8.216 -16.694 1.00 0.00 C ATOM 454 O CYS A 32 -6.026 -7.655 -15.772 1.00 0.00 O ATOM 455 CB CYS A 32 -8.858 -9.202 -16.127 1.00 0.00 C ATOM 456 SG CYS A 32 -10.643 -8.895 -16.026 1.00 0.00 S ATOM 0 H CYS A 32 -9.185 -8.678 -18.551 1.00 0.00 H new ATOM 0 HA CYS A 32 -8.429 -7.106 -16.366 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -8.675 -10.133 -16.663 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -8.449 -9.326 -15.124 1.00 0.00 H new ATOM 0 HG CYS A 32 -11.167 -8.985 -17.212 1.00 0.00 H new ATOM 462 N LYS A 33 -5.970 -8.956 -17.599 1.00 0.00 N ATOM 463 CA LYS A 33 -4.511 -9.071 -17.616 1.00 0.00 C ATOM 464 C LYS A 33 -3.898 -7.742 -18.048 1.00 0.00 C ATOM 465 O LYS A 33 -2.931 -7.299 -17.436 1.00 0.00 O ATOM 466 CB LYS A 33 -4.042 -10.197 -18.556 1.00 0.00 C ATOM 467 CG LYS A 33 -4.688 -11.553 -18.238 1.00 0.00 C ATOM 468 CD LYS A 33 -4.258 -12.628 -19.247 1.00 0.00 C ATOM 469 CE LYS A 33 -5.104 -13.899 -19.092 1.00 0.00 C ATOM 470 NZ LYS A 33 -4.838 -14.625 -17.827 1.00 0.00 N ATOM 0 H LYS A 33 -6.437 -9.487 -18.334 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.179 -9.320 -16.608 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.273 -9.923 -19.585 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.958 -10.292 -18.487 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.409 -11.864 -17.231 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.773 -11.453 -18.251 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.359 -12.241 -20.261 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.205 -12.868 -19.101 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.160 -13.633 -19.136 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.908 -14.564 -19.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -5.738 -14.936 -17.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.242 -15.455 -18.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.347 -13.995 -17.162 1.00 0.00 H new ATOM 484 N MET A 34 -4.459 -7.087 -19.069 1.00 0.00 N ATOM 485 CA MET A 34 -3.902 -5.845 -19.603 1.00 0.00 C ATOM 486 C MET A 34 -3.951 -4.713 -18.575 1.00 0.00 C ATOM 487 O MET A 34 -3.029 -3.899 -18.540 1.00 0.00 O ATOM 488 CB MET A 34 -4.608 -5.423 -20.903 1.00 0.00 C ATOM 489 CG MET A 34 -4.378 -6.432 -22.038 1.00 0.00 C ATOM 490 SD MET A 34 -4.822 -5.846 -23.700 1.00 0.00 S ATOM 491 CE MET A 34 -6.628 -5.741 -23.572 1.00 0.00 C ATOM 0 H MET A 34 -5.305 -7.401 -19.544 1.00 0.00 H new ATOM 0 HA MET A 34 -2.855 -6.043 -19.834 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.678 -5.323 -20.718 1.00 0.00 H new ATOM 0 HB3 MET A 34 -4.245 -4.443 -21.211 1.00 0.00 H new ATOM 0 HG2 MET A 34 -3.326 -6.718 -22.040 1.00 0.00 H new ATOM 0 HG3 MET A 34 -4.952 -7.333 -21.823 1.00 0.00 H new ATOM 0 HE1 MET A 34 -7.040 -5.394 -24.519 1.00 0.00 H new ATOM 0 HE2 MET A 34 -7.034 -6.725 -23.338 1.00 0.00 H new ATOM 0 HE3 MET A 34 -6.897 -5.041 -22.781 1.00 0.00 H new ATOM 501 N ILE A 35 -4.985 -4.648 -17.727 1.00 0.00 N ATOM 502 CA ILE A 35 -5.087 -3.602 -16.707 1.00 0.00 C ATOM 503 C ILE A 35 -4.234 -3.928 -15.465 1.00 0.00 C ATOM 504 O ILE A 35 -3.942 -3.024 -14.686 1.00 0.00 O ATOM 505 CB ILE A 35 -6.573 -3.285 -16.404 1.00 0.00 C ATOM 506 CG1 ILE A 35 -6.714 -1.872 -15.793 1.00 0.00 C ATOM 507 CG2 ILE A 35 -7.249 -4.361 -15.541 1.00 0.00 C ATOM 508 CD1 ILE A 35 -8.166 -1.411 -15.622 1.00 0.00 C ATOM 0 H ILE A 35 -5.762 -5.309 -17.729 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.657 -2.679 -17.097 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.107 -3.296 -17.354 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.221 -1.856 -14.821 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -6.189 -1.158 -16.428 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.288 -4.084 -15.362 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.213 -5.319 -16.060 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -6.726 -4.444 -14.588 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.182 -0.411 -15.188 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.659 -1.392 -16.594 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.692 -2.101 -14.962 1.00 0.00 H new ATOM 520 N ALA A 36 -3.791 -5.178 -15.270 1.00 0.00 N ATOM 521 CA ALA A 36 -2.989 -5.563 -14.109 1.00 0.00 C ATOM 522 C ALA A 36 -1.733 -4.689 -13.907 1.00 0.00 C ATOM 523 O ALA A 36 -1.566 -4.181 -12.799 1.00 0.00 O ATOM 524 CB ALA A 36 -2.650 -7.057 -14.150 1.00 0.00 C ATOM 0 H ALA A 36 -3.980 -5.946 -15.914 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.608 -5.378 -13.231 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.053 -7.319 -13.276 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.571 -7.639 -14.148 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.084 -7.277 -15.055 1.00 0.00 H new ATOM 530 N PRO A 37 -0.876 -4.423 -14.915 1.00 0.00 N ATOM 531 CA PRO A 37 0.267 -3.536 -14.717 1.00 0.00 C ATOM 532 C PRO A 37 -0.153 -2.085 -14.450 1.00 0.00 C ATOM 533 O PRO A 37 0.569 -1.369 -13.759 1.00 0.00 O ATOM 534 CB PRO A 37 1.132 -3.665 -15.976 1.00 0.00 C ATOM 535 CG PRO A 37 0.152 -4.151 -17.041 1.00 0.00 C ATOM 536 CD PRO A 37 -0.813 -5.022 -16.241 1.00 0.00 C ATOM 0 HA PRO A 37 0.826 -3.825 -13.827 1.00 0.00 H new ATOM 0 HB2 PRO A 37 1.582 -2.711 -16.252 1.00 0.00 H new ATOM 0 HB3 PRO A 37 1.948 -4.373 -15.830 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -0.361 -3.321 -17.528 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.655 -4.718 -17.824 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.798 -5.046 -16.707 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -0.460 -6.052 -16.189 1.00 0.00 H new ATOM 544 N VAL A 38 -1.316 -1.640 -14.942 1.00 0.00 N ATOM 545 CA VAL A 38 -1.845 -0.318 -14.627 1.00 0.00 C ATOM 546 C VAL A 38 -2.208 -0.262 -13.136 1.00 0.00 C ATOM 547 O VAL A 38 -1.922 0.729 -12.468 1.00 0.00 O ATOM 548 CB VAL A 38 -3.049 0.033 -15.532 1.00 0.00 C ATOM 549 CG1 VAL A 38 -3.377 1.527 -15.422 1.00 0.00 C ATOM 550 CG2 VAL A 38 -2.791 -0.280 -17.017 1.00 0.00 C ATOM 0 H VAL A 38 -1.910 -2.187 -15.566 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.082 0.435 -14.826 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.878 -0.583 -15.184 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -4.226 1.761 -16.064 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.625 1.770 -14.389 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -2.513 2.113 -15.735 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.670 -0.013 -17.603 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.934 0.295 -17.366 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.586 -1.344 -17.134 1.00 0.00 H new ATOM 560 N LEU A 39 -2.792 -1.333 -12.589 1.00 0.00 N ATOM 561 CA LEU A 39 -3.100 -1.430 -11.169 1.00 0.00 C ATOM 562 C LEU A 39 -1.819 -1.488 -10.336 1.00 0.00 C ATOM 563 O LEU A 39 -1.785 -0.903 -9.258 1.00 0.00 O ATOM 564 CB LEU A 39 -4.009 -2.638 -10.889 1.00 0.00 C ATOM 565 CG LEU A 39 -5.432 -2.462 -11.458 1.00 0.00 C ATOM 566 CD1 LEU A 39 -6.154 -3.810 -11.488 1.00 0.00 C ATOM 567 CD2 LEU A 39 -6.263 -1.475 -10.633 1.00 0.00 C ATOM 0 H LEU A 39 -3.063 -2.157 -13.125 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.643 -0.532 -10.875 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -3.559 -3.533 -11.319 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -4.071 -2.798 -9.813 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.327 -2.063 -12.467 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.158 -3.676 -11.891 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.600 -4.506 -12.118 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.220 -4.210 -10.476 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.257 -1.382 -11.070 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.349 -1.839 -9.609 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.775 -0.500 -10.632 1.00 0.00 H new ATOM 579 N GLU A 40 -0.754 -2.136 -10.819 1.00 0.00 N ATOM 580 CA GLU A 40 0.537 -2.126 -10.134 1.00 0.00 C ATOM 581 C GLU A 40 1.182 -0.734 -10.174 1.00 0.00 C ATOM 582 O GLU A 40 1.813 -0.316 -9.202 1.00 0.00 O ATOM 583 CB GLU A 40 1.484 -3.184 -10.719 1.00 0.00 C ATOM 584 CG GLU A 40 1.044 -4.611 -10.360 1.00 0.00 C ATOM 585 CD GLU A 40 2.049 -5.656 -10.876 1.00 0.00 C ATOM 586 OE1 GLU A 40 1.904 -6.142 -12.021 1.00 0.00 O ATOM 587 OE2 GLU A 40 2.989 -6.020 -10.132 1.00 0.00 O ATOM 0 H GLU A 40 -0.764 -2.675 -11.685 1.00 0.00 H new ATOM 0 HA GLU A 40 0.354 -2.378 -9.089 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.521 -3.078 -11.803 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.494 -3.012 -10.347 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.946 -4.702 -9.278 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.061 -4.808 -10.787 1.00 0.00 H new ATOM 594 N GLU A 41 1.027 0.012 -11.267 1.00 0.00 N ATOM 595 CA GLU A 41 1.439 1.408 -11.333 1.00 0.00 C ATOM 596 C GLU A 41 0.654 2.231 -10.312 1.00 0.00 C ATOM 597 O GLU A 41 1.241 3.038 -9.596 1.00 0.00 O ATOM 598 CB GLU A 41 1.247 1.972 -12.751 1.00 0.00 C ATOM 599 CG GLU A 41 2.465 1.745 -13.656 1.00 0.00 C ATOM 600 CD GLU A 41 3.708 2.528 -13.193 1.00 0.00 C ATOM 601 OE1 GLU A 41 3.600 3.748 -12.930 1.00 0.00 O ATOM 602 OE2 GLU A 41 4.805 1.930 -13.115 1.00 0.00 O ATOM 0 H GLU A 41 0.612 -0.337 -12.131 1.00 0.00 H new ATOM 0 HA GLU A 41 2.500 1.469 -11.093 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.372 1.508 -13.205 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.043 3.041 -12.687 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.700 0.681 -13.681 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.215 2.040 -14.675 1.00 0.00 H new ATOM 609 N LEU A 42 -0.655 2.005 -10.194 1.00 0.00 N ATOM 610 CA LEU A 42 -1.485 2.680 -9.207 1.00 0.00 C ATOM 611 C LEU A 42 -1.090 2.294 -7.787 1.00 0.00 C ATOM 612 O LEU A 42 -1.137 3.139 -6.900 1.00 0.00 O ATOM 613 CB LEU A 42 -2.972 2.374 -9.450 1.00 0.00 C ATOM 614 CG LEU A 42 -3.771 3.526 -10.074 1.00 0.00 C ATOM 615 CD1 LEU A 42 -3.870 4.732 -9.133 1.00 0.00 C ATOM 616 CD2 LEU A 42 -3.211 3.977 -11.430 1.00 0.00 C ATOM 0 H LEU A 42 -1.166 1.347 -10.783 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.324 3.752 -9.319 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.048 1.503 -10.101 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.433 2.103 -8.500 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.770 3.124 -10.241 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.444 5.524 -9.615 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.368 4.434 -8.210 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.869 5.098 -8.904 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.818 4.794 -11.821 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.183 4.317 -11.304 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -3.234 3.141 -12.129 1.00 0.00 H new ATOM 628 N ASP A 43 -0.675 1.054 -7.547 1.00 0.00 N ATOM 629 CA ASP A 43 -0.181 0.628 -6.243 1.00 0.00 C ATOM 630 C ASP A 43 1.123 1.355 -5.904 1.00 0.00 C ATOM 631 O ASP A 43 1.333 1.769 -4.764 1.00 0.00 O ATOM 632 CB ASP A 43 0.031 -0.888 -6.197 1.00 0.00 C ATOM 633 CG ASP A 43 0.732 -1.284 -4.893 1.00 0.00 C ATOM 634 OD1 ASP A 43 0.221 -0.947 -3.802 1.00 0.00 O ATOM 635 OD2 ASP A 43 1.832 -1.872 -4.950 1.00 0.00 O ATOM 0 H ASP A 43 -0.672 0.316 -8.252 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.935 0.886 -5.499 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.929 -1.399 -6.273 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.629 -1.205 -7.051 1.00 0.00 H new ATOM 640 N GLN A 44 1.997 1.562 -6.888 1.00 0.00 N ATOM 641 CA GLN A 44 3.225 2.324 -6.700 1.00 0.00 C ATOM 642 C GLN A 44 2.939 3.817 -6.469 1.00 0.00 C ATOM 643 O GLN A 44 3.615 4.457 -5.662 1.00 0.00 O ATOM 644 CB GLN A 44 4.136 2.101 -7.915 1.00 0.00 C ATOM 645 CG GLN A 44 4.779 0.705 -7.888 1.00 0.00 C ATOM 646 CD GLN A 44 5.372 0.343 -9.248 1.00 0.00 C ATOM 647 OE1 GLN A 44 6.556 0.544 -9.511 1.00 0.00 O ATOM 648 NE2 GLN A 44 4.554 -0.192 -10.138 1.00 0.00 N ATOM 0 H GLN A 44 1.872 1.206 -7.836 1.00 0.00 H new ATOM 0 HA GLN A 44 3.732 1.971 -5.802 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.558 2.219 -8.831 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.916 2.862 -7.931 1.00 0.00 H new ATOM 0 HG2 GLN A 44 5.560 0.676 -7.129 1.00 0.00 H new ATOM 0 HG3 GLN A 44 4.032 -0.037 -7.605 1.00 0.00 H new ATOM 0 HE21 GLN A 44 3.575 -0.351 -9.900 1.00 0.00 H new ATOM 0 HE22 GLN A 44 4.902 -0.446 -11.063 1.00 0.00 H new ATOM 657 N GLU A 45 1.948 4.376 -7.165 1.00 0.00 N ATOM 658 CA GLU A 45 1.670 5.812 -7.194 1.00 0.00 C ATOM 659 C GLU A 45 0.770 6.250 -6.026 1.00 0.00 C ATOM 660 O GLU A 45 0.944 7.335 -5.465 1.00 0.00 O ATOM 661 CB GLU A 45 0.991 6.117 -8.542 1.00 0.00 C ATOM 662 CG GLU A 45 0.937 7.606 -8.903 1.00 0.00 C ATOM 663 CD GLU A 45 2.324 8.144 -9.292 1.00 0.00 C ATOM 664 OE1 GLU A 45 2.821 7.785 -10.385 1.00 0.00 O ATOM 665 OE2 GLU A 45 2.921 8.929 -8.520 1.00 0.00 O ATOM 0 H GLU A 45 1.303 3.831 -7.737 1.00 0.00 H new ATOM 0 HA GLU A 45 2.602 6.368 -7.087 1.00 0.00 H new ATOM 0 HB2 GLU A 45 1.522 5.584 -9.331 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.026 5.724 -8.520 1.00 0.00 H new ATOM 0 HG2 GLU A 45 0.243 7.756 -9.730 1.00 0.00 H new ATOM 0 HG3 GLU A 45 0.551 8.173 -8.056 1.00 0.00 H new ATOM 672 N MET A 46 -0.185 5.398 -5.643 1.00 0.00 N ATOM 673 CA MET A 46 -1.285 5.719 -4.737 1.00 0.00 C ATOM 674 C MET A 46 -1.521 4.628 -3.686 1.00 0.00 C ATOM 675 O MET A 46 -2.302 4.859 -2.768 1.00 0.00 O ATOM 676 CB MET A 46 -2.584 5.924 -5.544 1.00 0.00 C ATOM 677 CG MET A 46 -2.524 6.974 -6.665 1.00 0.00 C ATOM 678 SD MET A 46 -2.357 8.694 -6.123 1.00 0.00 S ATOM 679 CE MET A 46 -2.666 9.550 -7.692 1.00 0.00 C ATOM 0 H MET A 46 -0.212 4.432 -5.968 1.00 0.00 H new ATOM 0 HA MET A 46 -1.007 6.633 -4.213 1.00 0.00 H new ATOM 0 HB2 MET A 46 -2.869 4.968 -5.984 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.377 6.206 -4.852 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.684 6.735 -7.317 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.429 6.888 -7.267 1.00 0.00 H new ATOM 0 HE1 MET A 46 -2.601 10.627 -7.538 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.922 9.243 -8.427 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.661 9.295 -8.056 1.00 0.00 H new ATOM 689 N GLY A 47 -0.874 3.460 -3.768 1.00 0.00 N ATOM 690 CA GLY A 47 -1.171 2.303 -2.919 1.00 0.00 C ATOM 691 C GLY A 47 -1.007 2.556 -1.417 1.00 0.00 C ATOM 692 O GLY A 47 -1.556 1.837 -0.585 1.00 0.00 O ATOM 0 H GLY A 47 -0.120 3.291 -4.434 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.195 1.982 -3.110 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.519 1.479 -3.209 1.00 0.00 H new ATOM 696 N ASP A 48 -0.226 3.576 -1.073 1.00 0.00 N ATOM 697 CA ASP A 48 0.090 4.011 0.282 1.00 0.00 C ATOM 698 C ASP A 48 -1.065 4.789 0.923 1.00 0.00 C ATOM 699 O ASP A 48 -1.113 4.923 2.147 1.00 0.00 O ATOM 700 CB ASP A 48 1.349 4.891 0.256 1.00 0.00 C ATOM 701 CG ASP A 48 1.089 6.272 -0.367 1.00 0.00 C ATOM 702 OD1 ASP A 48 0.687 6.319 -1.553 1.00 0.00 O ATOM 703 OD2 ASP A 48 1.298 7.300 0.314 1.00 0.00 O ATOM 0 H ASP A 48 0.231 4.156 -1.777 1.00 0.00 H new ATOM 0 HA ASP A 48 0.262 3.119 0.885 1.00 0.00 H new ATOM 0 HB2 ASP A 48 1.720 5.019 1.273 1.00 0.00 H new ATOM 0 HB3 ASP A 48 2.132 4.383 -0.308 1.00 0.00 H new ATOM 708 N LYS A 49 -1.997 5.294 0.110 1.00 0.00 N ATOM 709 CA LYS A 49 -3.099 6.163 0.490 1.00 0.00 C ATOM 710 C LYS A 49 -4.429 5.719 -0.131 1.00 0.00 C ATOM 711 O LYS A 49 -5.467 6.308 0.168 1.00 0.00 O ATOM 712 CB LYS A 49 -2.708 7.610 0.144 1.00 0.00 C ATOM 713 CG LYS A 49 -2.407 7.866 -1.345 1.00 0.00 C ATOM 714 CD LYS A 49 -1.747 9.236 -1.569 1.00 0.00 C ATOM 715 CE LYS A 49 -1.077 9.302 -2.950 1.00 0.00 C ATOM 716 NZ LYS A 49 0.256 8.643 -2.981 1.00 0.00 N ATOM 0 H LYS A 49 -1.997 5.091 -0.890 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.274 6.099 1.564 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.516 8.273 0.455 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.829 7.882 0.729 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.752 7.081 -1.723 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.333 7.811 -1.917 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.496 10.023 -1.486 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.005 9.418 -0.791 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.727 8.829 -3.686 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.967 10.346 -3.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.405 8.206 -3.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.998 9.351 -2.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.298 7.911 -2.244 1.00 0.00 H new ATOM 730 N LEU A 50 -4.413 4.661 -0.946 1.00 0.00 N ATOM 731 CA LEU A 50 -5.574 4.027 -1.544 1.00 0.00 C ATOM 732 C LEU A 50 -5.289 2.532 -1.620 1.00 0.00 C ATOM 733 O LEU A 50 -4.331 2.121 -2.267 1.00 0.00 O ATOM 734 CB LEU A 50 -5.848 4.648 -2.926 1.00 0.00 C ATOM 735 CG LEU A 50 -6.738 3.800 -3.870 1.00 0.00 C ATOM 736 CD1 LEU A 50 -8.088 4.483 -4.081 1.00 0.00 C ATOM 737 CD2 LEU A 50 -6.032 3.543 -5.205 1.00 0.00 C ATOM 0 H LEU A 50 -3.541 4.206 -1.216 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.473 4.184 -0.949 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -6.322 5.619 -2.782 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.893 4.830 -3.420 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.915 2.832 -3.401 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -8.703 3.876 -4.746 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.593 4.595 -3.122 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.933 5.466 -4.526 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.678 2.946 -5.849 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -5.815 4.494 -5.691 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.101 3.006 -5.027 1.00 0.00 H new ATOM 749 N LYS A 51 -6.118 1.715 -0.970 1.00 0.00 N ATOM 750 CA LYS A 51 -5.996 0.257 -1.038 1.00 0.00 C ATOM 751 C LYS A 51 -6.466 -0.214 -2.419 1.00 0.00 C ATOM 752 O LYS A 51 -7.371 0.393 -2.991 1.00 0.00 O ATOM 753 CB LYS A 51 -6.829 -0.344 0.106 1.00 0.00 C ATOM 754 CG LYS A 51 -6.631 -1.855 0.299 1.00 0.00 C ATOM 755 CD LYS A 51 -7.589 -2.430 1.351 1.00 0.00 C ATOM 756 CE LYS A 51 -7.358 -1.856 2.758 1.00 0.00 C ATOM 757 NZ LYS A 51 -8.256 -2.504 3.733 1.00 0.00 N ATOM 0 H LYS A 51 -6.888 2.041 -0.385 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.964 -0.072 -0.916 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.573 0.167 1.034 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.884 -0.148 -0.085 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.787 -2.366 -0.651 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.602 -2.050 0.600 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.616 -2.228 1.047 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.474 -3.513 1.384 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.320 -2.008 3.054 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.533 -0.780 2.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -8.124 -2.070 4.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -9.243 -2.381 3.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -8.035 -3.519 3.788 1.00 0.00 H new ATOM 771 N ILE A 52 -5.937 -1.326 -2.931 1.00 0.00 N ATOM 772 CA ILE A 52 -6.403 -1.936 -4.179 1.00 0.00 C ATOM 773 C ILE A 52 -6.824 -3.355 -3.818 1.00 0.00 C ATOM 774 O ILE A 52 -6.076 -4.029 -3.110 1.00 0.00 O ATOM 775 CB ILE A 52 -5.319 -1.861 -5.285 1.00 0.00 C ATOM 776 CG1 ILE A 52 -4.880 -0.386 -5.471 1.00 0.00 C ATOM 777 CG2 ILE A 52 -5.827 -2.485 -6.603 1.00 0.00 C ATOM 778 CD1 ILE A 52 -3.972 -0.102 -6.667 1.00 0.00 C ATOM 0 H ILE A 52 -5.169 -1.832 -2.490 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.251 -1.402 -4.608 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.449 -2.444 -4.981 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -5.775 0.229 -5.565 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.366 -0.064 -4.565 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.047 -2.419 -7.361 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.082 -3.531 -6.435 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.711 -1.946 -6.944 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.730 0.960 -6.696 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.053 -0.681 -6.572 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.484 -0.383 -7.587 1.00 0.00 H new ATOM 790 N VAL A 53 -8.002 -3.808 -4.262 1.00 0.00 N ATOM 791 CA VAL A 53 -8.580 -5.081 -3.811 1.00 0.00 C ATOM 792 C VAL A 53 -9.053 -5.887 -5.026 1.00 0.00 C ATOM 793 O VAL A 53 -10.025 -5.527 -5.690 1.00 0.00 O ATOM 794 CB VAL A 53 -9.730 -4.841 -2.800 1.00 0.00 C ATOM 795 CG1 VAL A 53 -10.307 -6.157 -2.257 1.00 0.00 C ATOM 796 CG2 VAL A 53 -9.295 -4.009 -1.584 1.00 0.00 C ATOM 0 H VAL A 53 -8.578 -3.308 -4.939 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.815 -5.658 -3.290 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.482 -4.297 -3.371 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.110 -5.939 -1.553 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.700 -6.750 -3.083 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.521 -6.717 -1.750 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -10.143 -3.875 -0.913 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.493 -4.527 -1.057 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.939 -3.034 -1.918 1.00 0.00 H new ATOM 806 N LYS A 54 -8.388 -7.002 -5.314 1.00 0.00 N ATOM 807 CA LYS A 54 -8.834 -7.964 -6.315 1.00 0.00 C ATOM 808 C LYS A 54 -10.039 -8.731 -5.782 1.00 0.00 C ATOM 809 O LYS A 54 -10.054 -9.103 -4.605 1.00 0.00 O ATOM 810 CB LYS A 54 -7.683 -8.945 -6.604 1.00 0.00 C ATOM 811 CG LYS A 54 -6.473 -8.310 -7.294 1.00 0.00 C ATOM 812 CD LYS A 54 -6.866 -7.776 -8.673 1.00 0.00 C ATOM 813 CE LYS A 54 -5.621 -7.411 -9.474 1.00 0.00 C ATOM 814 NZ LYS A 54 -5.931 -7.324 -10.922 1.00 0.00 N ATOM 0 H LYS A 54 -7.516 -7.265 -4.854 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.118 -7.445 -7.231 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.358 -9.392 -5.665 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.060 -9.755 -7.229 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.081 -7.499 -6.681 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.676 -9.047 -7.396 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -7.445 -8.527 -9.210 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.505 -6.900 -8.563 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -5.225 -6.457 -9.125 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -4.845 -8.158 -9.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.086 -7.009 -11.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -6.222 -8.259 -11.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -6.703 -6.643 -11.072 1.00 0.00 H new ATOM 828 N ILE A 55 -11.010 -9.031 -6.643 1.00 0.00 N ATOM 829 CA ILE A 55 -12.119 -9.918 -6.302 1.00 0.00 C ATOM 830 C ILE A 55 -12.610 -10.614 -7.584 1.00 0.00 C ATOM 831 O ILE A 55 -12.783 -9.980 -8.625 1.00 0.00 O ATOM 832 CB ILE A 55 -13.192 -9.126 -5.508 1.00 0.00 C ATOM 833 CG1 ILE A 55 -14.401 -10.025 -5.181 1.00 0.00 C ATOM 834 CG2 ILE A 55 -13.595 -7.802 -6.186 1.00 0.00 C ATOM 835 CD1 ILE A 55 -15.280 -9.487 -4.042 1.00 0.00 C ATOM 0 H ILE A 55 -11.049 -8.666 -7.595 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.816 -10.722 -5.632 1.00 0.00 H new ATOM 0 HB ILE A 55 -12.739 -8.827 -4.563 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -15.011 -10.138 -6.077 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -14.042 -11.019 -4.913 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -14.348 -7.297 -5.580 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -12.718 -7.161 -6.283 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -14.004 -8.009 -7.175 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -16.110 -10.172 -3.869 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -14.685 -9.401 -3.133 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -15.670 -8.506 -4.315 1.00 0.00 H new ATOM 847 N ASP A 56 -12.775 -11.938 -7.541 1.00 0.00 N ATOM 848 CA ASP A 56 -13.192 -12.734 -8.700 1.00 0.00 C ATOM 849 C ASP A 56 -14.721 -12.775 -8.771 1.00 0.00 C ATOM 850 O ASP A 56 -15.358 -13.070 -7.758 1.00 0.00 O ATOM 851 CB ASP A 56 -12.628 -14.152 -8.583 1.00 0.00 C ATOM 852 CG ASP A 56 -13.121 -15.035 -9.738 1.00 0.00 C ATOM 853 OD1 ASP A 56 -14.259 -15.545 -9.656 1.00 0.00 O ATOM 854 OD2 ASP A 56 -12.363 -15.219 -10.717 1.00 0.00 O ATOM 0 H ASP A 56 -12.623 -12.492 -6.698 1.00 0.00 H new ATOM 0 HA ASP A 56 -12.808 -12.278 -9.612 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.539 -14.116 -8.587 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.929 -14.590 -7.631 1.00 0.00 H new ATOM 859 N VAL A 57 -15.318 -12.472 -9.929 1.00 0.00 N ATOM 860 CA VAL A 57 -16.778 -12.371 -10.057 1.00 0.00 C ATOM 861 C VAL A 57 -17.511 -13.700 -9.861 1.00 0.00 C ATOM 862 O VAL A 57 -18.608 -13.706 -9.302 1.00 0.00 O ATOM 863 CB VAL A 57 -17.196 -11.743 -11.407 1.00 0.00 C ATOM 864 CG1 VAL A 57 -16.914 -10.239 -11.409 1.00 0.00 C ATOM 865 CG2 VAL A 57 -16.538 -12.393 -12.637 1.00 0.00 C ATOM 0 H VAL A 57 -14.811 -12.292 -10.795 1.00 0.00 H new ATOM 0 HA VAL A 57 -17.081 -11.713 -9.242 1.00 0.00 H new ATOM 0 HB VAL A 57 -18.266 -11.930 -11.495 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.214 -9.814 -12.367 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -17.478 -9.762 -10.607 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -15.849 -10.068 -11.254 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -16.885 -11.894 -13.542 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -15.455 -12.298 -12.563 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -16.808 -13.448 -12.679 1.00 0.00 H new ATOM 875 N ASP A 58 -16.950 -14.823 -10.309 1.00 0.00 N ATOM 876 CA ASP A 58 -17.653 -16.104 -10.284 1.00 0.00 C ATOM 877 C ASP A 58 -17.692 -16.643 -8.858 1.00 0.00 C ATOM 878 O ASP A 58 -18.703 -17.195 -8.425 1.00 0.00 O ATOM 879 CB ASP A 58 -16.991 -17.120 -11.220 1.00 0.00 C ATOM 880 CG ASP A 58 -17.735 -18.464 -11.172 1.00 0.00 C ATOM 881 OD1 ASP A 58 -18.872 -18.548 -11.690 1.00 0.00 O ATOM 882 OD2 ASP A 58 -17.175 -19.456 -10.655 1.00 0.00 O ATOM 0 H ASP A 58 -16.007 -14.871 -10.695 1.00 0.00 H new ATOM 0 HA ASP A 58 -18.672 -15.943 -10.636 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -16.989 -16.736 -12.240 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -15.950 -17.264 -10.931 1.00 0.00 H new ATOM 887 N GLU A 59 -16.627 -16.408 -8.092 1.00 0.00 N ATOM 888 CA GLU A 59 -16.565 -16.731 -6.673 1.00 0.00 C ATOM 889 C GLU A 59 -17.397 -15.756 -5.822 1.00 0.00 C ATOM 890 O GLU A 59 -17.685 -16.072 -4.667 1.00 0.00 O ATOM 891 CB GLU A 59 -15.095 -16.706 -6.215 1.00 0.00 C ATOM 892 CG GLU A 59 -14.251 -17.869 -6.760 1.00 0.00 C ATOM 893 CD GLU A 59 -14.632 -19.218 -6.121 1.00 0.00 C ATOM 894 OE1 GLU A 59 -14.124 -19.541 -5.023 1.00 0.00 O ATOM 895 OE2 GLU A 59 -15.424 -19.983 -6.716 1.00 0.00 O ATOM 0 H GLU A 59 -15.772 -15.981 -8.448 1.00 0.00 H new ATOM 0 HA GLU A 59 -16.989 -17.725 -6.532 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -14.643 -15.765 -6.528 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -15.064 -16.727 -5.126 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -14.379 -17.932 -7.841 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -13.196 -17.667 -6.575 1.00 0.00 H new ATOM 902 N ASN A 60 -17.801 -14.591 -6.355 1.00 0.00 N ATOM 903 CA ASN A 60 -18.371 -13.490 -5.569 1.00 0.00 C ATOM 904 C ASN A 60 -19.518 -12.808 -6.309 1.00 0.00 C ATOM 905 O ASN A 60 -19.565 -11.580 -6.427 1.00 0.00 O ATOM 906 CB ASN A 60 -17.282 -12.480 -5.181 1.00 0.00 C ATOM 907 CG ASN A 60 -16.191 -13.124 -4.347 1.00 0.00 C ATOM 908 OD1 ASN A 60 -16.358 -13.338 -3.154 1.00 0.00 O ATOM 909 ND2 ASN A 60 -15.073 -13.470 -4.963 1.00 0.00 N ATOM 0 H ASN A 60 -17.740 -14.388 -7.353 1.00 0.00 H new ATOM 0 HA ASN A 60 -18.784 -13.913 -4.653 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -16.845 -12.051 -6.083 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -17.730 -11.658 -4.622 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -14.324 -13.927 -4.442 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -14.960 -13.280 -5.959 1.00 0.00 H new ATOM 916 N GLN A 61 -20.458 -13.614 -6.807 1.00 0.00 N ATOM 917 CA GLN A 61 -21.628 -13.146 -7.533 1.00 0.00 C ATOM 918 C GLN A 61 -22.412 -12.158 -6.658 1.00 0.00 C ATOM 919 O GLN A 61 -22.904 -11.142 -7.141 1.00 0.00 O ATOM 920 CB GLN A 61 -22.538 -14.323 -7.953 1.00 0.00 C ATOM 921 CG GLN A 61 -21.928 -15.740 -8.021 1.00 0.00 C ATOM 922 CD GLN A 61 -21.731 -16.359 -6.629 1.00 0.00 C ATOM 923 OE1 GLN A 61 -22.619 -16.344 -5.783 1.00 0.00 O ATOM 924 NE2 GLN A 61 -20.541 -16.851 -6.328 1.00 0.00 N ATOM 0 H GLN A 61 -20.421 -14.629 -6.712 1.00 0.00 H new ATOM 0 HA GLN A 61 -21.292 -12.645 -8.441 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -23.377 -14.357 -7.259 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -22.947 -14.091 -8.936 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -22.577 -16.384 -8.614 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -20.968 -15.695 -8.535 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -19.802 -16.864 -7.031 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -20.362 -17.218 -5.393 1.00 0.00 H new ATOM 933 N GLU A 62 -22.489 -12.450 -5.356 1.00 0.00 N ATOM 934 CA GLU A 62 -23.212 -11.666 -4.365 1.00 0.00 C ATOM 935 C GLU A 62 -22.604 -10.278 -4.157 1.00 0.00 C ATOM 936 O GLU A 62 -23.324 -9.348 -3.788 1.00 0.00 O ATOM 937 CB GLU A 62 -23.205 -12.429 -3.032 1.00 0.00 C ATOM 938 CG GLU A 62 -24.060 -13.704 -3.086 1.00 0.00 C ATOM 939 CD GLU A 62 -24.113 -14.409 -1.719 1.00 0.00 C ATOM 940 OE1 GLU A 62 -23.236 -15.253 -1.426 1.00 0.00 O ATOM 941 OE2 GLU A 62 -25.053 -14.150 -0.932 1.00 0.00 O ATOM 0 H GLU A 62 -22.032 -13.269 -4.955 1.00 0.00 H new ATOM 0 HA GLU A 62 -24.229 -11.521 -4.731 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -22.180 -12.692 -2.772 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -23.577 -11.778 -2.241 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -25.071 -13.451 -3.405 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -23.651 -14.386 -3.832 1.00 0.00 H new ATOM 948 N THR A 63 -21.297 -10.112 -4.374 1.00 0.00 N ATOM 949 CA THR A 63 -20.636 -8.826 -4.222 1.00 0.00 C ATOM 950 C THR A 63 -20.702 -8.054 -5.533 1.00 0.00 C ATOM 951 O THR A 63 -21.042 -6.880 -5.519 1.00 0.00 O ATOM 952 CB THR A 63 -19.184 -8.978 -3.759 1.00 0.00 C ATOM 953 OG1 THR A 63 -19.012 -10.176 -3.049 1.00 0.00 O ATOM 954 CG2 THR A 63 -18.717 -7.836 -2.855 1.00 0.00 C ATOM 0 H THR A 63 -20.674 -10.867 -4.659 1.00 0.00 H new ATOM 0 HA THR A 63 -21.162 -8.269 -3.447 1.00 0.00 H new ATOM 0 HB THR A 63 -18.587 -8.969 -4.671 1.00 0.00 H new ATOM 0 HG1 THR A 63 -19.833 -10.385 -2.556 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.681 -8.004 -2.562 1.00 0.00 H new ATOM 0 HG22 THR A 63 -18.793 -6.891 -3.393 1.00 0.00 H new ATOM 0 HG23 THR A 63 -19.344 -7.798 -1.964 1.00 0.00 H new ATOM 962 N ALA A 64 -20.443 -8.693 -6.673 1.00 0.00 N ATOM 963 CA ALA A 64 -20.522 -8.007 -7.955 1.00 0.00 C ATOM 964 C ALA A 64 -21.966 -7.540 -8.206 1.00 0.00 C ATOM 965 O ALA A 64 -22.213 -6.368 -8.502 1.00 0.00 O ATOM 966 CB ALA A 64 -20.016 -8.959 -9.043 1.00 0.00 C ATOM 0 H ALA A 64 -20.179 -9.676 -6.732 1.00 0.00 H new ATOM 0 HA ALA A 64 -19.896 -7.115 -7.963 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -20.067 -8.464 -10.013 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.984 -9.237 -8.832 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.637 -9.855 -9.060 1.00 0.00 H new ATOM 972 N GLY A 65 -22.938 -8.429 -7.978 1.00 0.00 N ATOM 973 CA GLY A 65 -24.360 -8.131 -8.082 1.00 0.00 C ATOM 974 C GLY A 65 -24.801 -7.038 -7.107 1.00 0.00 C ATOM 975 O GLY A 65 -25.758 -6.320 -7.393 1.00 0.00 O ATOM 0 H GLY A 65 -22.748 -9.395 -7.711 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -24.589 -7.819 -9.101 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -24.933 -9.038 -7.890 1.00 0.00 H new ATOM 979 N LYS A 66 -24.068 -6.842 -6.001 1.00 0.00 N ATOM 980 CA LYS A 66 -24.307 -5.771 -5.032 1.00 0.00 C ATOM 981 C LYS A 66 -24.231 -4.382 -5.681 1.00 0.00 C ATOM 982 O LYS A 66 -24.826 -3.444 -5.148 1.00 0.00 O ATOM 983 CB LYS A 66 -23.299 -5.892 -3.872 1.00 0.00 C ATOM 984 CG LYS A 66 -23.930 -5.635 -2.500 1.00 0.00 C ATOM 985 CD LYS A 66 -22.893 -5.636 -1.363 1.00 0.00 C ATOM 986 CE LYS A 66 -21.980 -6.873 -1.258 1.00 0.00 C ATOM 987 NZ LYS A 66 -22.698 -8.175 -1.183 1.00 0.00 N ATOM 0 H LYS A 66 -23.278 -7.437 -5.753 1.00 0.00 H new ATOM 0 HA LYS A 66 -25.320 -5.882 -4.644 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -22.860 -6.890 -3.882 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -22.485 -5.184 -4.030 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -24.446 -4.675 -2.515 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -24.682 -6.398 -2.301 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -22.261 -4.756 -1.479 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -23.425 -5.525 -0.418 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -21.315 -6.890 -2.121 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -21.352 -6.769 -0.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -22.024 -8.930 -0.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -23.433 -8.124 -0.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -23.140 -8.381 -2.102 1.00 0.00 H new ATOM 1001 N TYR A 67 -23.552 -4.251 -6.828 1.00 0.00 N ATOM 1002 CA TYR A 67 -23.393 -2.994 -7.563 1.00 0.00 C ATOM 1003 C TYR A 67 -23.933 -3.126 -8.996 1.00 0.00 C ATOM 1004 O TYR A 67 -23.683 -2.256 -9.832 1.00 0.00 O ATOM 1005 CB TYR A 67 -21.915 -2.555 -7.540 1.00 0.00 C ATOM 1006 CG TYR A 67 -21.190 -2.861 -6.241 1.00 0.00 C ATOM 1007 CD1 TYR A 67 -21.523 -2.183 -5.052 1.00 0.00 C ATOM 1008 CD2 TYR A 67 -20.262 -3.917 -6.208 1.00 0.00 C ATOM 1009 CE1 TYR A 67 -20.952 -2.579 -3.831 1.00 0.00 C ATOM 1010 CE2 TYR A 67 -19.690 -4.322 -4.994 1.00 0.00 C ATOM 1011 CZ TYR A 67 -20.048 -3.665 -3.792 1.00 0.00 C ATOM 1012 OH TYR A 67 -19.576 -4.092 -2.589 1.00 0.00 O ATOM 0 H TYR A 67 -23.087 -5.038 -7.280 1.00 0.00 H new ATOM 0 HA TYR A 67 -23.980 -2.217 -7.073 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -21.390 -3.046 -8.359 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -21.864 -1.482 -7.726 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -22.219 -1.357 -5.079 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -19.988 -4.419 -7.124 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -21.204 -2.053 -2.922 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -18.978 -5.134 -4.976 1.00 0.00 H new ATOM 0 HH TYR A 67 -18.622 -4.304 -2.668 1.00 0.00 H new ATOM 1022 N GLY A 68 -24.666 -4.206 -9.298 1.00 0.00 N ATOM 1023 CA GLY A 68 -25.208 -4.472 -10.626 1.00 0.00 C ATOM 1024 C GLY A 68 -24.123 -4.850 -11.639 1.00 0.00 C ATOM 1025 O GLY A 68 -24.253 -4.526 -12.821 1.00 0.00 O ATOM 0 H GLY A 68 -24.899 -4.926 -8.614 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -25.937 -5.279 -10.562 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -25.740 -3.589 -10.981 1.00 0.00 H new ATOM 1029 N VAL A 69 -23.050 -5.509 -11.193 1.00 0.00 N ATOM 1030 CA VAL A 69 -21.920 -5.922 -12.018 1.00 0.00 C ATOM 1031 C VAL A 69 -21.947 -7.449 -12.119 1.00 0.00 C ATOM 1032 O VAL A 69 -22.212 -8.139 -11.136 1.00 0.00 O ATOM 1033 CB VAL A 69 -20.611 -5.397 -11.375 1.00 0.00 C ATOM 1034 CG1 VAL A 69 -19.352 -5.868 -12.119 1.00 0.00 C ATOM 1035 CG2 VAL A 69 -20.598 -3.858 -11.316 1.00 0.00 C ATOM 0 H VAL A 69 -22.944 -5.777 -10.215 1.00 0.00 H new ATOM 0 HA VAL A 69 -21.978 -5.508 -13.025 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.592 -5.811 -10.367 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -18.466 -5.470 -11.624 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -19.312 -6.957 -12.113 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -19.383 -5.512 -13.149 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -19.668 -3.519 -10.860 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.675 -3.455 -12.326 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -21.442 -3.510 -10.720 1.00 0.00 H new ATOM 1045 N MET A 70 -21.664 -7.975 -13.312 1.00 0.00 N ATOM 1046 CA MET A 70 -21.380 -9.392 -13.544 1.00 0.00 C ATOM 1047 C MET A 70 -20.524 -9.525 -14.819 1.00 0.00 C ATOM 1048 O MET A 70 -20.607 -10.514 -15.549 1.00 0.00 O ATOM 1049 CB MET A 70 -22.679 -10.226 -13.572 1.00 0.00 C ATOM 1050 CG MET A 70 -22.420 -11.697 -13.203 1.00 0.00 C ATOM 1051 SD MET A 70 -21.775 -11.964 -11.521 1.00 0.00 S ATOM 1052 CE MET A 70 -21.377 -13.730 -11.606 1.00 0.00 C ATOM 0 H MET A 70 -21.625 -7.414 -14.163 1.00 0.00 H new ATOM 0 HA MET A 70 -20.802 -9.804 -12.717 1.00 0.00 H new ATOM 0 HB2 MET A 70 -23.401 -9.798 -12.876 1.00 0.00 H new ATOM 0 HB3 MET A 70 -23.124 -10.173 -14.566 1.00 0.00 H new ATOM 0 HG2 MET A 70 -23.351 -12.253 -13.312 1.00 0.00 H new ATOM 0 HG3 MET A 70 -21.713 -12.117 -13.918 1.00 0.00 H new ATOM 0 HE1 MET A 70 -20.968 -14.057 -10.650 1.00 0.00 H new ATOM 0 HE2 MET A 70 -22.282 -14.297 -11.827 1.00 0.00 H new ATOM 0 HE3 MET A 70 -20.642 -13.900 -12.392 1.00 0.00 H new ATOM 1062 N SER A 71 -19.712 -8.498 -15.095 1.00 0.00 N ATOM 1063 CA SER A 71 -18.848 -8.371 -16.258 1.00 0.00 C ATOM 1064 C SER A 71 -17.514 -7.798 -15.778 1.00 0.00 C ATOM 1065 O SER A 71 -17.461 -7.172 -14.714 1.00 0.00 O ATOM 1066 CB SER A 71 -19.505 -7.454 -17.302 1.00 0.00 C ATOM 1067 OG SER A 71 -20.819 -7.889 -17.627 1.00 0.00 O ATOM 0 H SER A 71 -19.642 -7.692 -14.474 1.00 0.00 H new ATOM 0 HA SER A 71 -18.685 -9.338 -16.733 1.00 0.00 H new ATOM 0 HB2 SER A 71 -19.543 -6.434 -16.919 1.00 0.00 H new ATOM 0 HB3 SER A 71 -18.894 -7.433 -18.205 1.00 0.00 H new ATOM 0 HG SER A 71 -21.209 -7.284 -18.292 1.00 0.00 H new ATOM 1073 N ILE A 72 -16.435 -8.022 -16.532 1.00 0.00 N ATOM 1074 CA ILE A 72 -15.073 -7.727 -16.098 1.00 0.00 C ATOM 1075 C ILE A 72 -14.217 -7.236 -17.280 1.00 0.00 C ATOM 1076 O ILE A 72 -14.536 -7.582 -18.421 1.00 0.00 O ATOM 1077 CB ILE A 72 -14.429 -8.969 -15.430 1.00 0.00 C ATOM 1078 CG1 ILE A 72 -14.105 -10.172 -16.346 1.00 0.00 C ATOM 1079 CG2 ILE A 72 -15.213 -9.420 -14.190 1.00 0.00 C ATOM 1080 CD1 ILE A 72 -15.278 -11.000 -16.889 1.00 0.00 C ATOM 0 H ILE A 72 -16.486 -8.418 -17.471 1.00 0.00 H new ATOM 0 HA ILE A 72 -15.118 -6.928 -15.358 1.00 0.00 H new ATOM 0 HB ILE A 72 -13.447 -8.598 -15.135 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -13.536 -9.799 -17.198 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -13.448 -10.845 -15.794 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -14.729 -10.293 -13.751 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -15.235 -8.611 -13.459 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -16.233 -9.677 -14.478 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -14.895 -11.807 -17.514 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -15.842 -11.422 -16.057 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -15.931 -10.360 -17.482 1.00 0.00 H new ATOM 1092 N PRO A 73 -13.116 -6.495 -17.042 1.00 0.00 N ATOM 1093 CA PRO A 73 -12.737 -5.891 -15.770 1.00 0.00 C ATOM 1094 C PRO A 73 -13.741 -4.799 -15.410 1.00 0.00 C ATOM 1095 O PRO A 73 -14.150 -4.023 -16.279 1.00 0.00 O ATOM 1096 CB PRO A 73 -11.331 -5.310 -15.967 1.00 0.00 C ATOM 1097 CG PRO A 73 -11.205 -5.119 -17.476 1.00 0.00 C ATOM 1098 CD PRO A 73 -12.135 -6.177 -18.064 1.00 0.00 C ATOM 0 HA PRO A 73 -12.736 -6.615 -14.955 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -11.214 -4.365 -15.436 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -10.565 -5.986 -15.587 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -11.503 -4.115 -17.777 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -10.178 -5.261 -17.811 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -12.623 -5.804 -18.964 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -11.574 -7.067 -18.351 1.00 0.00 H new ATOM 1106 N THR A 74 -14.101 -4.720 -14.133 1.00 0.00 N ATOM 1107 CA THR A 74 -14.948 -3.666 -13.613 1.00 0.00 C ATOM 1108 C THR A 74 -14.290 -3.171 -12.336 1.00 0.00 C ATOM 1109 O THR A 74 -14.114 -3.918 -11.372 1.00 0.00 O ATOM 1110 CB THR A 74 -16.388 -4.158 -13.407 1.00 0.00 C ATOM 1111 OG1 THR A 74 -16.948 -4.541 -14.646 1.00 0.00 O ATOM 1112 CG2 THR A 74 -17.264 -3.055 -12.804 1.00 0.00 C ATOM 0 H THR A 74 -13.807 -5.395 -13.427 1.00 0.00 H new ATOM 0 HA THR A 74 -15.040 -2.839 -14.318 1.00 0.00 H new ATOM 0 HB THR A 74 -16.354 -5.007 -12.725 1.00 0.00 H new ATOM 0 HG1 THR A 74 -17.312 -5.448 -14.574 1.00 0.00 H new ATOM 0 HG21 THR A 74 -18.279 -3.430 -12.668 1.00 0.00 H new ATOM 0 HG22 THR A 74 -16.856 -2.753 -11.839 1.00 0.00 H new ATOM 0 HG23 THR A 74 -17.281 -2.196 -13.475 1.00 0.00 H new ATOM 1120 N LEU A 75 -13.876 -1.911 -12.356 1.00 0.00 N ATOM 1121 CA LEU A 75 -13.311 -1.256 -11.197 1.00 0.00 C ATOM 1122 C LEU A 75 -14.468 -0.686 -10.392 1.00 0.00 C ATOM 1123 O LEU A 75 -15.457 -0.208 -10.953 1.00 0.00 O ATOM 1124 CB LEU A 75 -12.320 -0.161 -11.614 1.00 0.00 C ATOM 1125 CG LEU A 75 -11.142 -0.671 -12.468 1.00 0.00 C ATOM 1126 CD1 LEU A 75 -10.187 0.490 -12.748 1.00 0.00 C ATOM 1127 CD2 LEU A 75 -10.375 -1.827 -11.818 1.00 0.00 C ATOM 0 H LEU A 75 -13.925 -1.317 -13.184 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.747 -1.965 -10.591 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -12.856 0.605 -12.174 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -11.925 0.317 -10.718 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.563 -1.062 -13.394 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.351 0.136 -13.352 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -10.717 1.275 -13.287 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -9.811 0.887 -11.805 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -9.560 -2.136 -12.472 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.968 -1.501 -10.861 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -11.051 -2.667 -11.658 1.00 0.00 H new ATOM 1139 N LEU A 76 -14.321 -0.712 -9.076 1.00 0.00 N ATOM 1140 CA LEU A 76 -15.305 -0.262 -8.109 1.00 0.00 C ATOM 1141 C LEU A 76 -14.532 0.672 -7.196 1.00 0.00 C ATOM 1142 O LEU A 76 -13.481 0.281 -6.686 1.00 0.00 O ATOM 1143 CB LEU A 76 -15.866 -1.479 -7.335 1.00 0.00 C ATOM 1144 CG LEU A 76 -17.377 -1.733 -7.450 1.00 0.00 C ATOM 1145 CD1 LEU A 76 -18.181 -0.599 -6.818 1.00 0.00 C ATOM 1146 CD2 LEU A 76 -17.802 -1.982 -8.898 1.00 0.00 C ATOM 0 H LEU A 76 -13.472 -1.064 -8.635 1.00 0.00 H new ATOM 0 HA LEU A 76 -16.162 0.238 -8.561 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.344 -2.372 -7.680 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -15.621 -1.354 -6.280 1.00 0.00 H new ATOM 0 HG LEU A 76 -17.596 -2.643 -6.891 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -19.246 -0.809 -6.916 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -17.924 -0.515 -5.762 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -17.948 0.338 -7.324 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -18.877 -2.157 -8.937 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -17.554 -1.111 -9.505 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -17.278 -2.855 -9.286 1.00 0.00 H new ATOM 1158 N VAL A 77 -15.006 1.895 -6.997 1.00 0.00 N ATOM 1159 CA VAL A 77 -14.290 2.886 -6.213 1.00 0.00 C ATOM 1160 C VAL A 77 -15.135 3.063 -4.969 1.00 0.00 C ATOM 1161 O VAL A 77 -16.331 3.353 -5.072 1.00 0.00 O ATOM 1162 CB VAL A 77 -14.086 4.202 -6.992 1.00 0.00 C ATOM 1163 CG1 VAL A 77 -12.973 5.028 -6.327 1.00 0.00 C ATOM 1164 CG2 VAL A 77 -13.725 3.992 -8.472 1.00 0.00 C ATOM 0 H VAL A 77 -15.895 2.225 -7.374 1.00 0.00 H new ATOM 0 HA VAL A 77 -13.277 2.569 -5.967 1.00 0.00 H new ATOM 0 HB VAL A 77 -15.042 4.725 -6.963 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -12.830 5.957 -6.879 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -13.254 5.256 -5.299 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -12.044 4.457 -6.331 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -13.597 4.960 -8.956 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.797 3.425 -8.543 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -14.525 3.442 -8.967 1.00 0.00 H new ATOM 1174 N LEU A 78 -14.527 2.852 -3.806 1.00 0.00 N ATOM 1175 CA LEU A 78 -15.182 2.926 -2.506 1.00 0.00 C ATOM 1176 C LEU A 78 -14.346 3.824 -1.601 1.00 0.00 C ATOM 1177 O LEU A 78 -13.167 4.064 -1.869 1.00 0.00 O ATOM 1178 CB LEU A 78 -15.366 1.523 -1.887 1.00 0.00 C ATOM 1179 CG LEU A 78 -16.283 0.590 -2.711 1.00 0.00 C ATOM 1180 CD1 LEU A 78 -15.481 -0.395 -3.564 1.00 0.00 C ATOM 1181 CD2 LEU A 78 -17.256 -0.192 -1.822 1.00 0.00 C ATOM 0 H LEU A 78 -13.536 2.618 -3.741 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.181 3.347 -2.623 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -14.388 1.053 -1.779 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -15.780 1.630 -0.884 1.00 0.00 H new ATOM 0 HG LEU A 78 -16.855 1.243 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.165 -1.031 -4.126 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.846 0.157 -4.257 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.859 -1.014 -2.917 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.880 -0.834 -2.443 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -16.693 -0.804 -1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -17.888 0.506 -1.272 1.00 0.00 H new ATOM 1193 N LYS A 79 -14.936 4.321 -0.518 1.00 0.00 N ATOM 1194 CA LYS A 79 -14.244 5.122 0.478 1.00 0.00 C ATOM 1195 C LYS A 79 -14.905 4.860 1.817 1.00 0.00 C ATOM 1196 O LYS A 79 -16.123 4.996 1.914 1.00 0.00 O ATOM 1197 CB LYS A 79 -14.309 6.605 0.073 1.00 0.00 C ATOM 1198 CG LYS A 79 -13.587 7.519 1.074 1.00 0.00 C ATOM 1199 CD LYS A 79 -13.480 8.947 0.516 1.00 0.00 C ATOM 1200 CE LYS A 79 -12.699 9.897 1.439 1.00 0.00 C ATOM 1201 NZ LYS A 79 -13.424 10.222 2.695 1.00 0.00 N ATOM 0 H LYS A 79 -15.923 4.175 -0.308 1.00 0.00 H new ATOM 0 HA LYS A 79 -13.189 4.857 0.550 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.864 6.729 -0.914 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.352 6.911 -0.007 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -14.128 7.531 2.020 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.591 7.127 1.281 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.993 8.915 -0.459 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.482 9.345 0.358 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -11.740 9.444 1.688 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -12.485 10.821 0.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -12.846 10.865 3.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -14.328 10.681 2.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -13.606 9.347 3.227 1.00 0.00 H new ATOM 1215 N ASP A 80 -14.112 4.497 2.832 1.00 0.00 N ATOM 1216 CA ASP A 80 -14.548 4.275 4.213 1.00 0.00 C ATOM 1217 C ASP A 80 -15.866 3.477 4.327 1.00 0.00 C ATOM 1218 O ASP A 80 -16.697 3.731 5.202 1.00 0.00 O ATOM 1219 CB ASP A 80 -14.570 5.620 4.960 1.00 0.00 C ATOM 1220 CG ASP A 80 -14.784 5.460 6.477 1.00 0.00 C ATOM 1221 OD1 ASP A 80 -14.112 4.612 7.104 1.00 0.00 O ATOM 1222 OD2 ASP A 80 -15.579 6.230 7.063 1.00 0.00 O ATOM 0 H ASP A 80 -13.111 4.344 2.708 1.00 0.00 H new ATOM 0 HA ASP A 80 -13.821 3.626 4.702 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -13.630 6.143 4.784 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -15.364 6.245 4.550 1.00 0.00 H new ATOM 1227 N GLY A 81 -16.076 2.515 3.420 1.00 0.00 N ATOM 1228 CA GLY A 81 -17.143 1.529 3.506 1.00 0.00 C ATOM 1229 C GLY A 81 -18.314 1.753 2.553 1.00 0.00 C ATOM 1230 O GLY A 81 -19.257 0.960 2.595 1.00 0.00 O ATOM 0 H GLY A 81 -15.492 2.404 2.591 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.721 0.543 3.312 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.524 1.517 4.527 1.00 0.00 H new ATOM 1234 N GLU A 82 -18.292 2.779 1.694 1.00 0.00 N ATOM 1235 CA GLU A 82 -19.372 3.053 0.754 1.00 0.00 C ATOM 1236 C GLU A 82 -18.807 3.253 -0.650 1.00 0.00 C ATOM 1237 O GLU A 82 -17.696 3.759 -0.810 1.00 0.00 O ATOM 1238 CB GLU A 82 -20.198 4.249 1.256 1.00 0.00 C ATOM 1239 CG GLU A 82 -19.575 5.637 1.038 1.00 0.00 C ATOM 1240 CD GLU A 82 -20.467 6.746 1.622 1.00 0.00 C ATOM 1241 OE1 GLU A 82 -21.360 7.259 0.910 1.00 0.00 O ATOM 1242 OE2 GLU A 82 -20.283 7.132 2.800 1.00 0.00 O ATOM 0 H GLU A 82 -17.519 3.442 1.635 1.00 0.00 H new ATOM 0 HA GLU A 82 -20.050 2.202 0.693 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -21.169 4.227 0.762 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -20.380 4.118 2.323 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -18.591 5.674 1.506 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -19.428 5.809 -0.028 1.00 0.00 H new ATOM 1249 N VAL A 83 -19.555 2.827 -1.667 1.00 0.00 N ATOM 1250 CA VAL A 83 -19.217 3.035 -3.066 1.00 0.00 C ATOM 1251 C VAL A 83 -19.354 4.516 -3.403 1.00 0.00 C ATOM 1252 O VAL A 83 -20.273 5.205 -2.948 1.00 0.00 O ATOM 1253 CB VAL A 83 -20.048 2.074 -3.946 1.00 0.00 C ATOM 1254 CG1 VAL A 83 -21.566 2.300 -3.875 1.00 0.00 C ATOM 1255 CG2 VAL A 83 -19.580 2.104 -5.402 1.00 0.00 C ATOM 0 H VAL A 83 -20.429 2.318 -1.534 1.00 0.00 H new ATOM 0 HA VAL A 83 -18.176 2.785 -3.274 1.00 0.00 H new ATOM 0 HB VAL A 83 -19.867 1.085 -3.524 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -22.071 1.583 -4.522 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -21.906 2.165 -2.848 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -21.799 3.313 -4.204 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -20.186 1.417 -5.993 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -19.687 3.114 -5.798 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -18.534 1.802 -5.454 1.00 0.00 H new ATOM 1265 N VAL A 84 -18.421 4.985 -4.225 1.00 0.00 N ATOM 1266 CA VAL A 84 -18.336 6.343 -4.720 1.00 0.00 C ATOM 1267 C VAL A 84 -18.182 6.355 -6.247 1.00 0.00 C ATOM 1268 O VAL A 84 -18.513 7.380 -6.842 1.00 0.00 O ATOM 1269 CB VAL A 84 -17.234 7.137 -3.977 1.00 0.00 C ATOM 1270 CG1 VAL A 84 -17.534 7.259 -2.473 1.00 0.00 C ATOM 1271 CG2 VAL A 84 -15.825 6.546 -4.136 1.00 0.00 C ATOM 0 H VAL A 84 -17.669 4.394 -4.578 1.00 0.00 H new ATOM 0 HA VAL A 84 -19.271 6.861 -4.505 1.00 0.00 H new ATOM 0 HB VAL A 84 -17.246 8.119 -4.450 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -16.737 7.823 -1.988 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -18.483 7.777 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -17.595 6.264 -2.032 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -15.110 7.158 -3.587 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -15.810 5.530 -3.742 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -15.554 6.530 -5.192 1.00 0.00 H new ATOM 1281 N GLU A 85 -17.778 5.250 -6.903 1.00 0.00 N ATOM 1282 CA GLU A 85 -17.826 5.165 -8.374 1.00 0.00 C ATOM 1283 C GLU A 85 -17.772 3.709 -8.860 1.00 0.00 C ATOM 1284 O GLU A 85 -17.488 2.794 -8.087 1.00 0.00 O ATOM 1285 CB GLU A 85 -16.683 5.996 -9.018 1.00 0.00 C ATOM 1286 CG GLU A 85 -17.163 7.185 -9.872 1.00 0.00 C ATOM 1287 CD GLU A 85 -17.862 6.773 -11.180 1.00 0.00 C ATOM 1288 OE1 GLU A 85 -18.885 6.055 -11.126 1.00 0.00 O ATOM 1289 OE2 GLU A 85 -17.419 7.205 -12.269 1.00 0.00 O ATOM 0 H GLU A 85 -17.419 4.413 -6.443 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.780 5.587 -8.691 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -16.033 6.371 -8.227 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -16.078 5.337 -9.641 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -17.849 7.791 -9.280 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.307 7.816 -10.112 1.00 0.00 H new ATOM 1296 N THR A 86 -18.024 3.484 -10.151 1.00 0.00 N ATOM 1297 CA THR A 86 -17.827 2.220 -10.859 1.00 0.00 C ATOM 1298 C THR A 86 -17.397 2.544 -12.300 1.00 0.00 C ATOM 1299 O THR A 86 -17.880 3.520 -12.883 1.00 0.00 O ATOM 1300 CB THR A 86 -19.138 1.411 -10.809 1.00 0.00 C ATOM 1301 OG1 THR A 86 -19.429 1.072 -9.468 1.00 0.00 O ATOM 1302 CG2 THR A 86 -19.132 0.132 -11.658 1.00 0.00 C ATOM 0 H THR A 86 -18.389 4.216 -10.760 1.00 0.00 H new ATOM 0 HA THR A 86 -17.049 1.613 -10.396 1.00 0.00 H new ATOM 0 HB THR A 86 -19.903 2.058 -11.238 1.00 0.00 H new ATOM 0 HG1 THR A 86 -20.263 0.559 -9.434 1.00 0.00 H new ATOM 0 HG21 THR A 86 -20.093 -0.373 -11.563 1.00 0.00 H new ATOM 0 HG22 THR A 86 -18.960 0.390 -12.703 1.00 0.00 H new ATOM 0 HG23 THR A 86 -18.339 -0.531 -11.312 1.00 0.00 H new ATOM 1310 N SER A 87 -16.519 1.727 -12.886 1.00 0.00 N ATOM 1311 CA SER A 87 -15.988 1.908 -14.239 1.00 0.00 C ATOM 1312 C SER A 87 -15.739 0.530 -14.861 1.00 0.00 C ATOM 1313 O SER A 87 -15.430 -0.410 -14.134 1.00 0.00 O ATOM 1314 CB SER A 87 -14.672 2.704 -14.174 1.00 0.00 C ATOM 1315 OG SER A 87 -14.805 3.909 -13.435 1.00 0.00 O ATOM 0 H SER A 87 -16.148 0.899 -12.420 1.00 0.00 H new ATOM 0 HA SER A 87 -16.702 2.460 -14.850 1.00 0.00 H new ATOM 0 HB2 SER A 87 -13.898 2.085 -13.719 1.00 0.00 H new ATOM 0 HB3 SER A 87 -14.340 2.936 -15.186 1.00 0.00 H new ATOM 0 HG SER A 87 -13.946 4.380 -13.419 1.00 0.00 H new ATOM 1321 N VAL A 88 -15.842 0.389 -16.185 1.00 0.00 N ATOM 1322 CA VAL A 88 -15.806 -0.912 -16.859 1.00 0.00 C ATOM 1323 C VAL A 88 -14.783 -0.846 -17.997 1.00 0.00 C ATOM 1324 O VAL A 88 -14.591 0.209 -18.610 1.00 0.00 O ATOM 1325 CB VAL A 88 -17.228 -1.286 -17.354 1.00 0.00 C ATOM 1326 CG1 VAL A 88 -17.283 -2.697 -17.963 1.00 0.00 C ATOM 1327 CG2 VAL A 88 -18.280 -1.232 -16.230 1.00 0.00 C ATOM 0 H VAL A 88 -15.953 1.177 -16.823 1.00 0.00 H new ATOM 0 HA VAL A 88 -15.494 -1.699 -16.172 1.00 0.00 H new ATOM 0 HB VAL A 88 -17.458 -0.539 -18.114 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -18.299 -2.911 -18.294 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -16.605 -2.753 -18.814 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -16.984 -3.429 -17.213 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -19.256 -1.503 -16.632 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -18.006 -1.932 -15.441 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -18.323 -0.223 -15.820 1.00 0.00 H new ATOM 1337 N GLY A 89 -14.134 -1.973 -18.288 1.00 0.00 N ATOM 1338 CA GLY A 89 -13.151 -2.094 -19.353 1.00 0.00 C ATOM 1339 C GLY A 89 -11.791 -1.541 -18.932 1.00 0.00 C ATOM 1340 O GLY A 89 -11.608 -1.061 -17.810 1.00 0.00 O ATOM 0 H GLY A 89 -14.283 -2.843 -17.777 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -13.046 -3.142 -19.634 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -13.503 -1.560 -20.236 1.00 0.00 H new ATOM 1344 N PHE A 90 -10.822 -1.630 -19.845 1.00 0.00 N ATOM 1345 CA PHE A 90 -9.481 -1.093 -19.651 1.00 0.00 C ATOM 1346 C PHE A 90 -9.529 0.432 -19.477 1.00 0.00 C ATOM 1347 O PHE A 90 -10.407 1.104 -20.031 1.00 0.00 O ATOM 1348 CB PHE A 90 -8.608 -1.488 -20.856 1.00 0.00 C ATOM 1349 CG PHE A 90 -7.179 -0.977 -20.795 1.00 0.00 C ATOM 1350 CD1 PHE A 90 -6.199 -1.696 -20.084 1.00 0.00 C ATOM 1351 CD2 PHE A 90 -6.834 0.236 -21.426 1.00 0.00 C ATOM 1352 CE1 PHE A 90 -4.886 -1.200 -19.999 1.00 0.00 C ATOM 1353 CE2 PHE A 90 -5.521 0.732 -21.336 1.00 0.00 C ATOM 1354 CZ PHE A 90 -4.547 0.015 -20.620 1.00 0.00 C ATOM 0 H PHE A 90 -10.952 -2.083 -20.750 1.00 0.00 H new ATOM 0 HA PHE A 90 -9.046 -1.510 -18.743 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -8.588 -2.575 -20.933 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -9.076 -1.112 -21.766 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.456 -2.629 -19.604 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -7.580 0.786 -21.980 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.135 -1.754 -19.455 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -5.261 1.663 -21.817 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.539 0.397 -20.547 1.00 0.00 H new ATOM 1364 N LYS A 91 -8.559 0.985 -18.743 1.00 0.00 N ATOM 1365 CA LYS A 91 -8.286 2.417 -18.674 1.00 0.00 C ATOM 1366 C LYS A 91 -6.769 2.593 -18.581 1.00 0.00 C ATOM 1367 O LYS A 91 -6.115 1.760 -17.948 1.00 0.00 O ATOM 1368 CB LYS A 91 -8.955 3.097 -17.459 1.00 0.00 C ATOM 1369 CG LYS A 91 -10.367 3.612 -17.775 1.00 0.00 C ATOM 1370 CD LYS A 91 -11.486 2.667 -17.310 1.00 0.00 C ATOM 1371 CE LYS A 91 -12.797 3.013 -18.031 1.00 0.00 C ATOM 1372 NZ LYS A 91 -12.906 2.341 -19.348 1.00 0.00 N ATOM 0 H LYS A 91 -7.927 0.431 -18.166 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.699 2.891 -19.564 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.007 2.387 -16.633 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.335 3.929 -17.126 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.504 4.584 -17.302 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.456 3.766 -18.850 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -11.210 1.633 -17.516 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.621 2.752 -16.232 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -13.641 2.722 -17.406 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -12.860 4.092 -18.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -13.241 3.022 -20.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.974 1.976 -19.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.580 1.552 -19.280 1.00 0.00 H new ATOM 1386 N PRO A 92 -6.213 3.662 -19.173 1.00 0.00 N ATOM 1387 CA PRO A 92 -4.806 3.999 -19.023 1.00 0.00 C ATOM 1388 C PRO A 92 -4.532 4.504 -17.602 1.00 0.00 C ATOM 1389 O PRO A 92 -5.452 4.925 -16.890 1.00 0.00 O ATOM 1390 CB PRO A 92 -4.549 5.078 -20.080 1.00 0.00 C ATOM 1391 CG PRO A 92 -5.891 5.798 -20.191 1.00 0.00 C ATOM 1392 CD PRO A 92 -6.898 4.670 -19.974 1.00 0.00 C ATOM 0 HA PRO A 92 -4.145 3.144 -19.166 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -3.753 5.757 -19.774 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -4.248 4.642 -21.033 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.993 6.582 -19.440 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -6.017 6.271 -21.165 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.788 5.036 -19.462 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -7.227 4.253 -20.926 1.00 0.00 H new ATOM 1400 N LYS A 93 -3.251 4.529 -17.211 1.00 0.00 N ATOM 1401 CA LYS A 93 -2.834 5.003 -15.891 1.00 0.00 C ATOM 1402 C LYS A 93 -3.356 6.408 -15.635 1.00 0.00 C ATOM 1403 O LYS A 93 -3.848 6.660 -14.543 1.00 0.00 O ATOM 1404 CB LYS A 93 -1.297 4.966 -15.754 1.00 0.00 C ATOM 1405 CG LYS A 93 -0.832 5.398 -14.353 1.00 0.00 C ATOM 1406 CD LYS A 93 0.689 5.563 -14.281 1.00 0.00 C ATOM 1407 CE LYS A 93 1.037 6.162 -12.914 1.00 0.00 C ATOM 1408 NZ LYS A 93 2.497 6.284 -12.704 1.00 0.00 N ATOM 0 H LYS A 93 -2.478 4.221 -17.802 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.260 4.335 -15.143 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.939 3.957 -15.960 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.851 5.621 -16.502 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.312 6.339 -14.085 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.152 4.657 -13.620 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.183 4.600 -14.412 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.040 6.213 -15.082 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.577 7.146 -12.824 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.611 5.538 -12.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.680 6.694 -11.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.936 5.343 -12.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.903 6.901 -13.436 1.00 0.00 H new ATOM 1422 N GLU A 94 -3.254 7.319 -16.604 1.00 0.00 N ATOM 1423 CA GLU A 94 -3.529 8.732 -16.356 1.00 0.00 C ATOM 1424 C GLU A 94 -4.987 8.953 -15.965 1.00 0.00 C ATOM 1425 O GLU A 94 -5.266 9.688 -15.016 1.00 0.00 O ATOM 1426 CB GLU A 94 -3.144 9.585 -17.575 1.00 0.00 C ATOM 1427 CG GLU A 94 -1.631 9.565 -17.844 1.00 0.00 C ATOM 1428 CD GLU A 94 -1.255 10.477 -19.025 1.00 0.00 C ATOM 1429 OE1 GLU A 94 -1.233 10.005 -20.184 1.00 0.00 O ATOM 1430 OE2 GLU A 94 -0.958 11.675 -18.807 1.00 0.00 O ATOM 0 H GLU A 94 -2.984 7.103 -17.564 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.914 9.050 -15.515 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -3.672 9.218 -18.455 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.469 10.613 -17.414 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.097 9.887 -16.950 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.312 8.544 -18.055 1.00 0.00 H new ATOM 1437 N ALA A 95 -5.906 8.266 -16.642 1.00 0.00 N ATOM 1438 CA ALA A 95 -7.323 8.320 -16.337 1.00 0.00 C ATOM 1439 C ALA A 95 -7.613 7.679 -14.983 1.00 0.00 C ATOM 1440 O ALA A 95 -8.396 8.212 -14.199 1.00 0.00 O ATOM 1441 CB ALA A 95 -8.077 7.569 -17.430 1.00 0.00 C ATOM 0 H ALA A 95 -5.679 7.652 -17.424 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.644 9.361 -16.294 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -9.146 7.597 -17.220 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.884 8.039 -18.394 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -7.740 6.533 -17.458 1.00 0.00 H new ATOM 1447 N LEU A 96 -6.989 6.536 -14.695 1.00 0.00 N ATOM 1448 CA LEU A 96 -7.239 5.812 -13.463 1.00 0.00 C ATOM 1449 C LEU A 96 -6.686 6.579 -12.260 1.00 0.00 C ATOM 1450 O LEU A 96 -7.354 6.655 -11.231 1.00 0.00 O ATOM 1451 CB LEU A 96 -6.657 4.397 -13.572 1.00 0.00 C ATOM 1452 CG LEU A 96 -6.902 3.542 -12.316 1.00 0.00 C ATOM 1453 CD1 LEU A 96 -8.381 3.434 -11.929 1.00 0.00 C ATOM 1454 CD2 LEU A 96 -6.333 2.138 -12.551 1.00 0.00 C ATOM 0 H LEU A 96 -6.303 6.095 -15.308 1.00 0.00 H new ATOM 0 HA LEU A 96 -8.314 5.720 -13.305 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -7.095 3.896 -14.435 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -5.584 4.465 -13.754 1.00 0.00 H new ATOM 0 HG LEU A 96 -6.399 4.040 -11.487 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -8.479 2.817 -11.036 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -8.778 4.429 -11.729 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -8.939 2.979 -12.747 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.502 1.524 -11.666 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -6.829 1.683 -13.408 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.263 2.207 -12.746 1.00 0.00 H new ATOM 1466 N GLN A 97 -5.503 7.192 -12.373 1.00 0.00 N ATOM 1467 CA GLN A 97 -4.963 7.991 -11.283 1.00 0.00 C ATOM 1468 C GLN A 97 -5.752 9.289 -11.145 1.00 0.00 C ATOM 1469 O GLN A 97 -5.883 9.792 -10.032 1.00 0.00 O ATOM 1470 CB GLN A 97 -3.441 8.198 -11.391 1.00 0.00 C ATOM 1471 CG GLN A 97 -2.967 9.125 -12.517 1.00 0.00 C ATOM 1472 CD GLN A 97 -3.095 10.620 -12.223 1.00 0.00 C ATOM 1473 OE1 GLN A 97 -2.531 11.141 -11.265 1.00 0.00 O ATOM 1474 NE2 GLN A 97 -3.830 11.340 -13.056 1.00 0.00 N ATOM 0 H GLN A 97 -4.911 7.148 -13.202 1.00 0.00 H new ATOM 0 HA GLN A 97 -5.091 7.435 -10.354 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -3.080 8.597 -10.443 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.971 7.224 -11.527 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -1.923 8.901 -12.735 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.537 8.898 -13.418 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -4.292 10.891 -13.847 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -3.934 12.344 -12.907 1.00 0.00 H new ATOM 1483 N GLU A 98 -6.323 9.814 -12.237 1.00 0.00 N ATOM 1484 CA GLU A 98 -7.189 10.980 -12.171 1.00 0.00 C ATOM 1485 C GLU A 98 -8.423 10.602 -11.351 1.00 0.00 C ATOM 1486 O GLU A 98 -8.748 11.293 -10.388 1.00 0.00 O ATOM 1487 CB GLU A 98 -7.551 11.480 -13.580 1.00 0.00 C ATOM 1488 CG GLU A 98 -8.451 12.719 -13.529 1.00 0.00 C ATOM 1489 CD GLU A 98 -8.963 13.127 -14.919 1.00 0.00 C ATOM 1490 OE1 GLU A 98 -8.169 13.608 -15.759 1.00 0.00 O ATOM 1491 OE2 GLU A 98 -10.187 13.006 -15.156 1.00 0.00 O ATOM 0 H GLU A 98 -6.195 9.441 -13.178 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.677 11.810 -11.684 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.639 11.716 -14.128 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -8.056 10.686 -14.129 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -9.300 12.521 -12.875 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.898 13.549 -13.090 1.00 0.00 H new ATOM 1498 N LEU A 99 -9.046 9.470 -11.681 1.00 0.00 N ATOM 1499 CA LEU A 99 -10.223 8.958 -10.983 1.00 0.00 C ATOM 1500 C LEU A 99 -9.923 8.766 -9.497 1.00 0.00 C ATOM 1501 O LEU A 99 -10.720 9.172 -8.655 1.00 0.00 O ATOM 1502 CB LEU A 99 -10.681 7.648 -11.652 1.00 0.00 C ATOM 1503 CG LEU A 99 -11.857 6.935 -10.955 1.00 0.00 C ATOM 1504 CD1 LEU A 99 -13.121 7.802 -10.895 1.00 0.00 C ATOM 1505 CD2 LEU A 99 -12.165 5.636 -11.709 1.00 0.00 C ATOM 0 H LEU A 99 -8.742 8.875 -12.452 1.00 0.00 H new ATOM 0 HA LEU A 99 -11.036 9.680 -11.053 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -10.966 7.864 -12.682 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.834 6.963 -11.693 1.00 0.00 H new ATOM 0 HG LEU A 99 -11.559 6.730 -9.927 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -13.917 7.251 -10.394 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.909 8.716 -10.341 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.437 8.056 -11.907 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -12.996 5.123 -11.225 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -12.433 5.868 -12.740 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -11.285 4.992 -11.699 1.00 0.00 H new ATOM 1517 N VAL A 100 -8.764 8.195 -9.161 1.00 0.00 N ATOM 1518 CA VAL A 100 -8.346 8.021 -7.778 1.00 0.00 C ATOM 1519 C VAL A 100 -8.197 9.385 -7.107 1.00 0.00 C ATOM 1520 O VAL A 100 -8.800 9.609 -6.060 1.00 0.00 O ATOM 1521 CB VAL A 100 -7.068 7.155 -7.731 1.00 0.00 C ATOM 1522 CG1 VAL A 100 -6.285 7.295 -6.418 1.00 0.00 C ATOM 1523 CG2 VAL A 100 -7.447 5.682 -7.955 1.00 0.00 C ATOM 0 H VAL A 100 -8.093 7.842 -9.843 1.00 0.00 H new ATOM 0 HA VAL A 100 -9.104 7.484 -7.207 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.410 7.512 -8.523 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.400 6.660 -6.453 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -5.982 8.333 -6.284 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -6.917 6.991 -5.583 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.548 5.066 -7.923 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.135 5.361 -7.173 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.926 5.574 -8.928 1.00 0.00 H new ATOM 1533 N ASN A 101 -7.444 10.321 -7.696 1.00 0.00 N ATOM 1534 CA ASN A 101 -7.186 11.615 -7.059 1.00 0.00 C ATOM 1535 C ASN A 101 -8.462 12.448 -6.896 1.00 0.00 C ATOM 1536 O ASN A 101 -8.544 13.261 -5.978 1.00 0.00 O ATOM 1537 CB ASN A 101 -6.046 12.383 -7.752 1.00 0.00 C ATOM 1538 CG ASN A 101 -6.483 13.634 -8.509 1.00 0.00 C ATOM 1539 OD1 ASN A 101 -6.260 14.756 -8.066 1.00 0.00 O ATOM 1540 ND2 ASN A 101 -7.096 13.470 -9.668 1.00 0.00 N ATOM 0 H ASN A 101 -7.005 10.206 -8.609 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.838 11.408 -6.047 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.310 12.669 -7.000 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.545 11.711 -8.449 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -7.391 14.283 -10.208 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.274 12.530 -10.022 1.00 0.00 H new ATOM 1547 N LYS A 102 -9.477 12.215 -7.735 1.00 0.00 N ATOM 1548 CA LYS A 102 -10.805 12.806 -7.582 1.00 0.00 C ATOM 1549 C LYS A 102 -11.556 12.284 -6.347 1.00 0.00 C ATOM 1550 O LYS A 102 -12.500 12.952 -5.920 1.00 0.00 O ATOM 1551 CB LYS A 102 -11.624 12.600 -8.871 1.00 0.00 C ATOM 1552 CG LYS A 102 -11.207 13.602 -9.960 1.00 0.00 C ATOM 1553 CD LYS A 102 -11.888 13.308 -11.305 1.00 0.00 C ATOM 1554 CE LYS A 102 -11.653 14.482 -12.267 1.00 0.00 C ATOM 1555 NZ LYS A 102 -12.172 14.222 -13.632 1.00 0.00 N ATOM 0 H LYS A 102 -9.396 11.604 -8.547 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.669 13.874 -7.415 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.483 11.583 -9.236 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.686 12.716 -8.653 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -11.460 14.612 -9.639 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -10.125 13.570 -10.087 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.489 12.388 -11.733 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -12.957 13.154 -11.157 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -12.132 15.375 -11.866 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -10.585 14.691 -12.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -12.444 15.122 -14.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -11.434 13.763 -14.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -13.003 13.599 -13.575 1.00 0.00 H new ATOM 1569 N HIS A 103 -11.153 11.157 -5.744 1.00 0.00 N ATOM 1570 CA HIS A 103 -11.763 10.618 -4.525 1.00 0.00 C ATOM 1571 C HIS A 103 -10.813 10.631 -3.316 1.00 0.00 C ATOM 1572 O HIS A 103 -11.288 10.491 -2.187 1.00 0.00 O ATOM 1573 CB HIS A 103 -12.312 9.207 -4.793 1.00 0.00 C ATOM 1574 CG HIS A 103 -13.490 9.201 -5.737 1.00 0.00 C ATOM 1575 ND1 HIS A 103 -14.758 9.671 -5.469 1.00 0.00 N ATOM 1576 CD2 HIS A 103 -13.501 8.732 -7.022 1.00 0.00 C ATOM 1577 CE1 HIS A 103 -15.511 9.485 -6.566 1.00 0.00 C ATOM 1578 NE2 HIS A 103 -14.786 8.915 -7.546 1.00 0.00 N ATOM 0 H HIS A 103 -10.383 10.588 -6.096 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.588 11.278 -4.257 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -11.518 8.587 -5.208 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -12.609 8.753 -3.848 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -12.662 8.295 -7.543 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -16.553 9.755 -6.650 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -15.108 8.667 -8.481 1.00 0.00 H new ATOM 1586 N LEU A 104 -9.499 10.814 -3.513 1.00 0.00 N ATOM 1587 CA LEU A 104 -8.558 11.065 -2.421 1.00 0.00 C ATOM 1588 C LEU A 104 -8.997 12.304 -1.645 1.00 0.00 C ATOM 1589 O LEU A 104 -9.381 13.314 -2.272 1.00 0.00 O ATOM 1590 CB LEU A 104 -7.108 11.236 -2.914 1.00 0.00 C ATOM 1591 CG LEU A 104 -6.422 9.965 -3.447 1.00 0.00 C ATOM 1592 CD1 LEU A 104 -4.979 10.295 -3.839 1.00 0.00 C ATOM 1593 CD2 LEU A 104 -6.412 8.812 -2.436 1.00 0.00 C ATOM 1594 OXT LEU A 104 -8.914 12.279 -0.400 1.00 0.00 O ATOM 0 H LEU A 104 -9.063 10.791 -4.435 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.570 10.190 -1.771 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -7.100 11.988 -3.703 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.510 11.630 -2.092 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.001 9.632 -4.309 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.490 9.397 -4.217 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.979 11.062 -4.614 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.439 10.662 -2.966 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.914 7.947 -2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.878 9.121 -1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.437 8.547 -2.176 1.00 0.00 H new TER 1606 LEU A 104