USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1011 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -164:sc= -0.0186 (180deg=-0.173) USER MOD Single : A 7 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.023) USER MOD Single : A 15 SER OG : rot 180:sc= 0.0139 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 169:sc= -0.776 (180deg=-0.972) USER MOD Single : A 23 ASN : amide:sc= -0.0475 X(o=-0.047,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.116 K(o=-0.12,f=-1.1) USER MOD Single : A 32 ASN : amide:sc= -0.333 K(o=-0.33,f=-3.2!) USER MOD Single : A 44 ASN : amide:sc= -0.0662 K(o=-0.066,f=-0.75) USER MOD Single : A 45 LYS NZ :NH3+ -162:sc= 0.834 (180deg=0.275) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 TYR OH : rot -152:sc= 1.23 USER MOD Single : A 56 SER OG : rot 180:sc= -0.158 USER MOD Single : A 59 ASN : amide:sc= 0.436 K(o=0.44,f=-0.64) USER MOD Single : A 60 MET CE :methyl -119:sc=-0.00501 (180deg=-0.398) USER MOD Single : A 62 ASN : amide:sc= -0.144 K(o=-0.14,f=-2.5!) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 81:sc= 1.14 USER MOD Single : A 78 MET CE :methyl -173:sc= 0 (180deg=-0.095) USER MOD Single : A 79 SER OG : rot 180:sc= -0.267 USER MOD Single : A 85 MET CE :methyl 165:sc= -0.466 (180deg=-0.897) USER MOD Single : A 87 THR OG1 : rot 59:sc= 1.42 USER MOD Single : A 91 LYS NZ :NH3+ 133:sc= -0.116 (180deg=-0.934) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -0.502 X(o=-0.5,f=-0.79) USER MOD Single : A 100 GLN : amide:sc= -0.0418 X(o=-0.042,f=-0.43) USER MOD Single : A 104 SER OG : rot -68:sc= 1.21 USER MOD Single : A 106 TYR OH : rot -14:sc= 1.22 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -145:sc= 0.203 (180deg=-1.9!) USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 LYS NZ :NH3+ -154:sc= 0.876 (180deg=-0.0359) USER MOD Single : A 126 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0785) USER MOD Single : A 129 MET CE :methyl 140:sc= -0.369 (180deg=-2.21!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.956 -18.556 -2.076 1.00 0.00 N ATOM 2 CA MET A 1 20.801 -18.398 -0.627 1.00 0.00 C ATOM 3 C MET A 1 20.600 -16.918 -0.336 1.00 0.00 C ATOM 4 O MET A 1 21.560 -16.145 -0.276 1.00 0.00 O ATOM 5 CB MET A 1 21.956 -19.041 0.149 1.00 0.00 C ATOM 6 CG MET A 1 21.694 -19.078 1.659 1.00 0.00 C ATOM 7 SD MET A 1 22.071 -17.535 2.529 1.00 0.00 S ATOM 8 CE MET A 1 22.215 -18.133 4.230 1.00 0.00 C ATOM 0 H1 MET A 1 21.095 -19.561 -2.303 1.00 0.00 H new ATOM 0 H2 MET A 1 20.102 -18.208 -2.557 1.00 0.00 H new ATOM 0 H3 MET A 1 21.781 -18.011 -2.398 1.00 0.00 H new ATOM 0 HA MET A 1 19.921 -18.937 -0.275 1.00 0.00 H new ATOM 0 HB2 MET A 1 22.114 -20.056 -0.215 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.874 -18.486 -0.045 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.646 -19.327 1.826 1.00 0.00 H new ATOM 0 HG3 MET A 1 22.287 -19.881 2.098 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.446 -17.298 4.891 1.00 0.00 H new ATOM 0 HE2 MET A 1 21.273 -18.588 4.536 1.00 0.00 H new ATOM 0 HE3 MET A 1 23.012 -18.874 4.289 1.00 0.00 H new ATOM 20 N ALA A 2 19.343 -16.512 -0.181 1.00 0.00 N ATOM 21 CA ALA A 2 18.920 -15.202 0.282 1.00 0.00 C ATOM 22 C ALA A 2 17.673 -15.406 1.146 1.00 0.00 C ATOM 23 O ALA A 2 17.187 -16.533 1.309 1.00 0.00 O ATOM 24 CB ALA A 2 18.616 -14.299 -0.923 1.00 0.00 C ATOM 0 H ALA A 2 18.553 -17.124 -0.387 1.00 0.00 H new ATOM 0 HA ALA A 2 19.702 -14.717 0.866 1.00 0.00 H new ATOM 0 HB1 ALA A 2 18.299 -13.317 -0.571 1.00 0.00 H new ATOM 0 HB2 ALA A 2 19.513 -14.193 -1.534 1.00 0.00 H new ATOM 0 HB3 ALA A 2 17.820 -14.745 -1.520 1.00 0.00 H new ATOM 30 N ASP A 3 17.135 -14.310 1.669 1.00 0.00 N ATOM 31 CA ASP A 3 15.757 -14.232 2.138 1.00 0.00 C ATOM 32 C ASP A 3 14.829 -14.369 0.918 1.00 0.00 C ATOM 33 O ASP A 3 15.276 -14.272 -0.230 1.00 0.00 O ATOM 34 CB ASP A 3 15.522 -12.875 2.831 1.00 0.00 C ATOM 35 CG ASP A 3 15.957 -12.821 4.292 1.00 0.00 C ATOM 36 OD1 ASP A 3 17.175 -12.813 4.586 1.00 0.00 O ATOM 37 OD2 ASP A 3 15.070 -12.674 5.162 1.00 0.00 O ATOM 0 H ASP A 3 17.652 -13.438 1.781 1.00 0.00 H new ATOM 0 HA ASP A 3 15.552 -15.027 2.855 1.00 0.00 H new ATOM 0 HB2 ASP A 3 16.057 -12.103 2.278 1.00 0.00 H new ATOM 0 HB3 ASP A 3 14.461 -12.632 2.773 1.00 0.00 H new ATOM 42 N LYS A 4 13.513 -14.478 1.128 1.00 0.00 N ATOM 43 CA LYS A 4 12.553 -14.160 0.063 1.00 0.00 C ATOM 44 C LYS A 4 12.655 -12.692 -0.365 1.00 0.00 C ATOM 45 O LYS A 4 12.072 -12.332 -1.386 1.00 0.00 O ATOM 46 CB LYS A 4 11.108 -14.446 0.500 1.00 0.00 C ATOM 47 CG LYS A 4 10.671 -15.903 0.321 1.00 0.00 C ATOM 48 CD LYS A 4 10.971 -16.766 1.548 1.00 0.00 C ATOM 49 CE LYS A 4 10.207 -18.089 1.461 1.00 0.00 C ATOM 50 NZ LYS A 4 8.757 -17.916 1.699 1.00 0.00 N ATOM 0 H LYS A 4 13.093 -14.778 2.008 1.00 0.00 H new ATOM 0 HA LYS A 4 12.807 -14.801 -0.781 1.00 0.00 H new ATOM 0 HB2 LYS A 4 10.997 -14.172 1.549 1.00 0.00 H new ATOM 0 HB3 LYS A 4 10.435 -13.805 -0.069 1.00 0.00 H new ATOM 0 HG2 LYS A 4 9.601 -15.934 0.113 1.00 0.00 H new ATOM 0 HG3 LYS A 4 11.177 -16.325 -0.547 1.00 0.00 H new ATOM 0 HD2 LYS A 4 12.042 -16.959 1.613 1.00 0.00 H new ATOM 0 HD3 LYS A 4 10.688 -16.233 2.455 1.00 0.00 H new ATOM 0 HE2 LYS A 4 10.361 -18.531 0.477 1.00 0.00 H new ATOM 0 HE3 LYS A 4 10.612 -18.789 2.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.325 -18.841 1.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 8.612 -17.283 2.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 8.313 -17.503 0.854 1.00 0.00 H new ATOM 64 N GLU A 5 13.359 -11.863 0.412 1.00 0.00 N ATOM 65 CA GLU A 5 13.513 -10.427 0.233 1.00 0.00 C ATOM 66 C GLU A 5 12.146 -9.807 -0.037 1.00 0.00 C ATOM 67 O GLU A 5 11.964 -9.118 -1.039 1.00 0.00 O ATOM 68 CB GLU A 5 14.573 -10.115 -0.841 1.00 0.00 C ATOM 69 CG GLU A 5 15.925 -10.735 -0.471 1.00 0.00 C ATOM 70 CD GLU A 5 17.096 -10.119 -1.225 1.00 0.00 C ATOM 71 OE1 GLU A 5 17.199 -10.258 -2.465 1.00 0.00 O ATOM 72 OE2 GLU A 5 17.975 -9.528 -0.551 1.00 0.00 O ATOM 0 H GLU A 5 13.865 -12.203 1.230 1.00 0.00 H new ATOM 0 HA GLU A 5 13.895 -9.968 1.145 1.00 0.00 H new ATOM 0 HB2 GLU A 5 14.243 -10.500 -1.806 1.00 0.00 H new ATOM 0 HB3 GLU A 5 14.681 -9.036 -0.949 1.00 0.00 H new ATOM 0 HG2 GLU A 5 16.090 -10.618 0.600 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.894 -11.806 -0.674 1.00 0.00 H new ATOM 79 N LEU A 6 11.164 -10.155 0.809 1.00 0.00 N ATOM 80 CA LEU A 6 9.759 -9.851 0.587 1.00 0.00 C ATOM 81 C LEU A 6 9.592 -8.352 0.371 1.00 0.00 C ATOM 82 O LEU A 6 9.732 -7.546 1.294 1.00 0.00 O ATOM 83 CB LEU A 6 8.885 -10.370 1.731 1.00 0.00 C ATOM 84 CG LEU A 6 7.404 -10.015 1.464 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.530 -11.257 1.372 1.00 0.00 C ATOM 86 CD2 LEU A 6 6.859 -9.081 2.539 1.00 0.00 C ATOM 0 H LEU A 6 11.336 -10.663 1.677 1.00 0.00 H new ATOM 0 HA LEU A 6 9.421 -10.367 -0.312 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.998 -11.450 1.825 1.00 0.00 H new ATOM 0 HB3 LEU A 6 9.209 -9.932 2.675 1.00 0.00 H new ATOM 0 HG LEU A 6 7.373 -9.505 0.501 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.498 -10.962 1.184 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.881 -11.889 0.557 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.584 -11.810 2.310 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.816 -8.849 2.325 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.930 -9.566 3.513 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.441 -8.159 2.549 1.00 0.00 H new ATOM 98 N LYS A 7 9.344 -7.999 -0.885 1.00 0.00 N ATOM 99 CA LYS A 7 9.510 -6.650 -1.363 1.00 0.00 C ATOM 100 C LYS A 7 8.213 -5.900 -1.160 1.00 0.00 C ATOM 101 O LYS A 7 7.171 -6.288 -1.695 1.00 0.00 O ATOM 102 CB LYS A 7 9.989 -6.702 -2.812 1.00 0.00 C ATOM 103 CG LYS A 7 10.421 -5.318 -3.293 1.00 0.00 C ATOM 104 CD LYS A 7 11.593 -5.377 -4.277 1.00 0.00 C ATOM 105 CE LYS A 7 11.342 -6.206 -5.545 1.00 0.00 C ATOM 106 NZ LYS A 7 12.054 -7.503 -5.512 1.00 0.00 N ATOM 0 H LYS A 7 9.020 -8.653 -1.598 1.00 0.00 H new ATOM 0 HA LYS A 7 10.271 -6.103 -0.806 1.00 0.00 H new ATOM 0 HB2 LYS A 7 10.823 -7.398 -2.899 1.00 0.00 H new ATOM 0 HB3 LYS A 7 9.190 -7.080 -3.450 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.575 -4.823 -3.770 1.00 0.00 H new ATOM 0 HG3 LYS A 7 10.703 -4.710 -2.433 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.850 -4.360 -4.572 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.460 -5.787 -3.760 1.00 0.00 H new ATOM 0 HE2 LYS A 7 10.272 -6.383 -5.656 1.00 0.00 H new ATOM 0 HE3 LYS A 7 11.664 -5.638 -6.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 11.492 -8.221 -6.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 12.979 -7.403 -5.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 12.192 -7.798 -4.524 1.00 0.00 H new ATOM 120 N PHE A 8 8.268 -4.860 -0.343 1.00 0.00 N ATOM 121 CA PHE A 8 7.170 -3.921 -0.214 1.00 0.00 C ATOM 122 C PHE A 8 7.160 -3.081 -1.486 1.00 0.00 C ATOM 123 O PHE A 8 8.217 -2.873 -2.086 1.00 0.00 O ATOM 124 CB PHE A 8 7.381 -3.048 1.033 1.00 0.00 C ATOM 125 CG PHE A 8 7.035 -3.733 2.342 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.736 -4.876 2.773 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.994 -3.224 3.137 1.00 0.00 C ATOM 128 CE1 PHE A 8 7.386 -5.508 3.977 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.649 -3.850 4.345 1.00 0.00 C ATOM 130 CZ PHE A 8 6.354 -4.983 4.775 1.00 0.00 C ATOM 0 H PHE A 8 9.072 -4.645 0.246 1.00 0.00 H new ATOM 0 HA PHE A 8 6.213 -4.429 -0.093 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.423 -2.730 1.067 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.776 -2.146 0.937 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.546 -5.268 2.175 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.455 -2.345 2.816 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.910 -6.399 4.291 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.840 -3.459 4.944 1.00 0.00 H new ATOM 0 HZ PHE A 8 6.105 -5.451 5.716 1.00 0.00 H new ATOM 140 N LEU A 9 5.997 -2.566 -1.875 1.00 0.00 N ATOM 141 CA LEU A 9 5.871 -1.575 -2.927 1.00 0.00 C ATOM 142 C LEU A 9 5.162 -0.366 -2.346 1.00 0.00 C ATOM 143 O LEU A 9 4.146 -0.520 -1.666 1.00 0.00 O ATOM 144 CB LEU A 9 5.076 -2.137 -4.110 1.00 0.00 C ATOM 145 CG LEU A 9 5.044 -1.156 -5.294 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.416 -1.021 -5.963 1.00 0.00 C ATOM 147 CD2 LEU A 9 4.023 -1.640 -6.312 1.00 0.00 C ATOM 0 H LEU A 9 5.105 -2.833 -1.459 1.00 0.00 H new ATOM 0 HA LEU A 9 6.858 -1.297 -3.296 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.519 -3.080 -4.431 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.057 -2.356 -3.792 1.00 0.00 H new ATOM 0 HG LEU A 9 4.767 -0.173 -4.913 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.348 -0.319 -6.794 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.141 -0.654 -5.236 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.737 -1.994 -6.335 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.994 -0.950 -7.155 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.304 -2.632 -6.665 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.038 -1.685 -5.846 1.00 0.00 H new ATOM 159 N VAL A 10 5.692 0.814 -2.649 1.00 0.00 N ATOM 160 CA VAL A 10 5.187 2.097 -2.174 1.00 0.00 C ATOM 161 C VAL A 10 4.815 2.946 -3.389 1.00 0.00 C ATOM 162 O VAL A 10 5.665 3.227 -4.231 1.00 0.00 O ATOM 163 CB VAL A 10 6.246 2.755 -1.261 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.807 4.141 -0.775 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.485 1.874 -0.017 1.00 0.00 C ATOM 0 H VAL A 10 6.510 0.907 -3.251 1.00 0.00 H new ATOM 0 HA VAL A 10 4.288 1.981 -1.569 1.00 0.00 H new ATOM 0 HB VAL A 10 7.155 2.858 -1.854 1.00 0.00 H new ATOM 0 HG11 VAL A 10 6.582 4.565 -0.137 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.646 4.794 -1.633 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.880 4.051 -0.209 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.233 2.343 0.623 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.552 1.764 0.536 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.840 0.892 -0.329 1.00 0.00 H new ATOM 175 N VAL A 11 3.551 3.341 -3.524 1.00 0.00 N ATOM 176 CA VAL A 11 3.088 4.161 -4.640 1.00 0.00 C ATOM 177 C VAL A 11 2.259 5.299 -4.059 1.00 0.00 C ATOM 178 O VAL A 11 1.057 5.426 -4.293 1.00 0.00 O ATOM 179 CB VAL A 11 2.367 3.320 -5.718 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.380 4.082 -7.049 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.001 1.925 -5.869 1.00 0.00 C ATOM 0 H VAL A 11 2.816 3.100 -2.859 1.00 0.00 H new ATOM 0 HA VAL A 11 3.928 4.595 -5.183 1.00 0.00 H new ATOM 0 HB VAL A 11 1.335 3.163 -5.405 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.872 3.491 -7.811 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.867 5.036 -6.927 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.411 4.261 -7.356 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.467 1.364 -6.636 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.047 2.030 -6.158 1.00 0.00 H new ATOM 0 HG23 VAL A 11 2.939 1.392 -4.920 1.00 0.00 H new ATOM 191 N ASP A 12 2.905 6.118 -3.235 1.00 0.00 N ATOM 192 CA ASP A 12 2.343 7.405 -2.875 1.00 0.00 C ATOM 193 C ASP A 12 2.353 8.299 -4.113 1.00 0.00 C ATOM 194 O ASP A 12 3.191 8.154 -5.009 1.00 0.00 O ATOM 195 CB ASP A 12 3.166 8.096 -1.791 1.00 0.00 C ATOM 196 CG ASP A 12 2.961 7.512 -0.398 1.00 0.00 C ATOM 197 OD1 ASP A 12 2.058 8.018 0.309 1.00 0.00 O ATOM 198 OD2 ASP A 12 3.738 6.603 -0.039 1.00 0.00 O ATOM 0 H ASP A 12 3.809 5.912 -2.810 1.00 0.00 H new ATOM 0 HA ASP A 12 1.333 7.242 -2.498 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.222 8.029 -2.051 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.909 9.155 -1.772 1.00 0.00 H new ATOM 203 N ASP A 13 1.474 9.296 -4.107 1.00 0.00 N ATOM 204 CA ASP A 13 1.439 10.378 -5.087 1.00 0.00 C ATOM 205 C ASP A 13 2.739 11.192 -5.035 1.00 0.00 C ATOM 206 O ASP A 13 3.346 11.533 -6.050 1.00 0.00 O ATOM 207 CB ASP A 13 0.240 11.275 -4.738 1.00 0.00 C ATOM 208 CG ASP A 13 -0.048 12.346 -5.794 1.00 0.00 C ATOM 209 OD1 ASP A 13 0.873 13.078 -6.208 1.00 0.00 O ATOM 210 OD2 ASP A 13 -1.218 12.503 -6.205 1.00 0.00 O ATOM 0 H ASP A 13 0.744 9.376 -3.399 1.00 0.00 H new ATOM 0 HA ASP A 13 1.340 9.975 -6.095 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.646 10.652 -4.613 1.00 0.00 H new ATOM 0 HB3 ASP A 13 0.426 11.761 -3.780 1.00 0.00 H new ATOM 215 N PHE A 14 3.187 11.503 -3.822 1.00 0.00 N ATOM 216 CA PHE A 14 4.105 12.586 -3.524 1.00 0.00 C ATOM 217 C PHE A 14 5.402 12.001 -2.970 1.00 0.00 C ATOM 218 O PHE A 14 5.369 11.156 -2.078 1.00 0.00 O ATOM 219 CB PHE A 14 3.368 13.529 -2.559 1.00 0.00 C ATOM 220 CG PHE A 14 4.180 14.565 -1.810 1.00 0.00 C ATOM 221 CD1 PHE A 14 5.019 15.455 -2.504 1.00 0.00 C ATOM 222 CD2 PHE A 14 4.005 14.716 -0.419 1.00 0.00 C ATOM 223 CE1 PHE A 14 5.657 16.497 -1.810 1.00 0.00 C ATOM 224 CE2 PHE A 14 4.635 15.763 0.268 1.00 0.00 C ATOM 225 CZ PHE A 14 5.450 16.664 -0.433 1.00 0.00 C ATOM 0 H PHE A 14 2.906 10.984 -2.990 1.00 0.00 H new ATOM 0 HA PHE A 14 4.399 13.163 -4.401 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.601 14.055 -3.128 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.852 12.914 -1.822 1.00 0.00 H new ATOM 0 HD1 PHE A 14 5.172 15.338 -3.567 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.381 14.020 0.121 1.00 0.00 H new ATOM 0 HE1 PHE A 14 6.311 17.174 -2.340 1.00 0.00 H new ATOM 0 HE2 PHE A 14 4.493 15.875 1.333 1.00 0.00 H new ATOM 0 HZ PHE A 14 5.918 17.486 0.088 1.00 0.00 H new ATOM 235 N SER A 15 6.550 12.452 -3.480 1.00 0.00 N ATOM 236 CA SER A 15 7.866 11.932 -3.121 1.00 0.00 C ATOM 237 C SER A 15 8.073 11.895 -1.605 1.00 0.00 C ATOM 238 O SER A 15 8.237 10.813 -1.038 1.00 0.00 O ATOM 239 CB SER A 15 8.953 12.737 -3.837 1.00 0.00 C ATOM 240 OG SER A 15 8.622 12.834 -5.206 1.00 0.00 O ATOM 0 H SER A 15 6.589 13.204 -4.168 1.00 0.00 H new ATOM 0 HA SER A 15 7.934 10.897 -3.455 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.037 13.731 -3.398 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.922 12.253 -3.717 1.00 0.00 H new ATOM 0 HG SER A 15 9.312 13.350 -5.674 1.00 0.00 H new ATOM 246 N THR A 16 8.012 13.050 -0.935 1.00 0.00 N ATOM 247 CA THR A 16 8.161 13.137 0.514 1.00 0.00 C ATOM 248 C THR A 16 7.222 12.151 1.222 1.00 0.00 C ATOM 249 O THR A 16 7.639 11.515 2.180 1.00 0.00 O ATOM 250 CB THR A 16 7.938 14.594 0.943 1.00 0.00 C ATOM 251 OG1 THR A 16 8.948 15.414 0.375 1.00 0.00 O ATOM 252 CG2 THR A 16 7.914 14.813 2.454 1.00 0.00 C ATOM 0 H THR A 16 7.857 13.951 -1.387 1.00 0.00 H new ATOM 0 HA THR A 16 9.169 12.847 0.810 1.00 0.00 H new ATOM 0 HB THR A 16 6.947 14.863 0.578 1.00 0.00 H new ATOM 0 HG1 THR A 16 8.805 16.345 0.647 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.752 15.870 2.666 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.107 14.227 2.894 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.866 14.499 2.882 1.00 0.00 H new ATOM 260 N MET A 17 6.006 11.943 0.720 1.00 0.00 N ATOM 261 CA MET A 17 5.082 10.949 1.246 1.00 0.00 C ATOM 262 C MET A 17 5.706 9.544 1.215 1.00 0.00 C ATOM 263 O MET A 17 5.717 8.886 2.255 1.00 0.00 O ATOM 264 CB MET A 17 3.766 11.041 0.464 1.00 0.00 C ATOM 265 CG MET A 17 2.506 11.222 1.304 1.00 0.00 C ATOM 266 SD MET A 17 1.160 12.096 0.436 1.00 0.00 S ATOM 267 CE MET A 17 0.779 10.994 -0.952 1.00 0.00 C ATOM 0 H MET A 17 5.634 12.467 -0.072 1.00 0.00 H new ATOM 0 HA MET A 17 4.867 11.150 2.296 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.838 11.875 -0.234 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.655 10.135 -0.132 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.147 10.242 1.618 1.00 0.00 H new ATOM 0 HG3 MET A 17 2.760 11.774 2.209 1.00 0.00 H new ATOM 0 HE1 MET A 17 -0.144 11.319 -1.432 1.00 0.00 H new ATOM 0 HE2 MET A 17 1.594 11.024 -1.675 1.00 0.00 H new ATOM 0 HE3 MET A 17 0.658 9.975 -0.585 1.00 0.00 H new ATOM 277 N ARG A 18 6.332 9.087 0.113 1.00 0.00 N ATOM 278 CA ARG A 18 6.943 7.768 0.117 1.00 0.00 C ATOM 279 C ARG A 18 8.217 7.745 0.948 1.00 0.00 C ATOM 280 O ARG A 18 8.562 6.709 1.508 1.00 0.00 O ATOM 281 CB ARG A 18 7.146 7.267 -1.314 1.00 0.00 C ATOM 282 CG ARG A 18 8.082 8.044 -2.232 1.00 0.00 C ATOM 283 CD ARG A 18 8.424 7.257 -3.502 1.00 0.00 C ATOM 284 NE ARG A 18 9.211 8.083 -4.436 1.00 0.00 N ATOM 285 CZ ARG A 18 10.536 8.087 -4.631 1.00 0.00 C ATOM 286 NH1 ARG A 18 11.340 7.241 -3.988 1.00 0.00 N ATOM 287 NH2 ARG A 18 11.058 8.969 -5.477 1.00 0.00 N ATOM 0 H ARG A 18 6.421 9.604 -0.762 1.00 0.00 H new ATOM 0 HA ARG A 18 6.262 7.069 0.602 1.00 0.00 H new ATOM 0 HB2 ARG A 18 7.513 6.242 -1.257 1.00 0.00 H new ATOM 0 HB3 ARG A 18 6.168 7.229 -1.794 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.617 8.991 -2.506 1.00 0.00 H new ATOM 0 HG3 ARG A 18 9.000 8.283 -1.695 1.00 0.00 H new ATOM 0 HD2 ARG A 18 8.987 6.361 -3.239 1.00 0.00 H new ATOM 0 HD3 ARG A 18 7.506 6.926 -3.988 1.00 0.00 H new ATOM 0 HE ARG A 18 8.677 8.737 -5.008 1.00 0.00 H new ATOM 0 HH11 ARG A 18 10.950 6.568 -3.328 1.00 0.00 H new ATOM 0 HH12 ARG A 18 12.346 7.266 -4.156 1.00 0.00 H new ATOM 0 HH21 ARG A 18 10.452 9.628 -5.965 1.00 0.00 H new ATOM 0 HH22 ARG A 18 12.065 8.987 -5.638 1.00 0.00 H new ATOM 301 N ARG A 19 8.916 8.877 1.082 1.00 0.00 N ATOM 302 CA ARG A 19 10.047 8.991 2.002 1.00 0.00 C ATOM 303 C ARG A 19 9.559 8.779 3.438 1.00 0.00 C ATOM 304 O ARG A 19 10.252 8.105 4.207 1.00 0.00 O ATOM 305 CB ARG A 19 10.750 10.352 1.856 1.00 0.00 C ATOM 306 CG ARG A 19 11.340 10.665 0.470 1.00 0.00 C ATOM 307 CD ARG A 19 12.773 10.141 0.328 1.00 0.00 C ATOM 308 NE ARG A 19 13.434 10.698 -0.863 1.00 0.00 N ATOM 309 CZ ARG A 19 14.222 11.781 -0.914 1.00 0.00 C ATOM 310 NH1 ARG A 19 14.432 12.552 0.148 1.00 0.00 N ATOM 311 NH2 ARG A 19 14.802 12.085 -2.062 1.00 0.00 N ATOM 0 H ARG A 19 8.715 9.730 0.561 1.00 0.00 H new ATOM 0 HA ARG A 19 10.779 8.221 1.756 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.036 11.136 2.110 1.00 0.00 H new ATOM 0 HB3 ARG A 19 11.554 10.403 2.590 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.712 10.219 -0.301 1.00 0.00 H new ATOM 0 HG3 ARG A 19 11.329 11.742 0.306 1.00 0.00 H new ATOM 0 HD2 ARG A 19 13.346 10.400 1.218 1.00 0.00 H new ATOM 0 HD3 ARG A 19 12.759 9.053 0.263 1.00 0.00 H new ATOM 0 HE ARG A 19 13.276 10.208 -1.743 1.00 0.00 H new ATOM 0 HH11 ARG A 19 13.987 12.327 1.038 1.00 0.00 H new ATOM 0 HH12 ARG A 19 15.038 13.369 0.073 1.00 0.00 H new ATOM 0 HH21 ARG A 19 14.645 11.501 -2.883 1.00 0.00 H new ATOM 0 HH22 ARG A 19 15.406 12.904 -2.127 1.00 0.00 H new ATOM 325 N ILE A 20 8.395 9.332 3.803 1.00 0.00 N ATOM 326 CA ILE A 20 7.732 9.071 5.071 1.00 0.00 C ATOM 327 C ILE A 20 7.461 7.571 5.138 1.00 0.00 C ATOM 328 O ILE A 20 8.008 6.934 6.028 1.00 0.00 O ATOM 329 CB ILE A 20 6.472 9.960 5.285 1.00 0.00 C ATOM 330 CG1 ILE A 20 6.793 11.298 5.984 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.410 9.278 6.176 1.00 0.00 C ATOM 332 CD1 ILE A 20 7.689 12.261 5.213 1.00 0.00 C ATOM 0 H ILE A 20 7.884 9.985 3.208 1.00 0.00 H new ATOM 0 HA ILE A 20 8.374 9.352 5.906 1.00 0.00 H new ATOM 0 HB ILE A 20 6.098 10.125 4.274 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.853 11.805 6.203 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.267 11.080 6.941 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.553 9.941 6.293 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.088 8.347 5.710 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.839 9.064 7.155 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.844 13.165 5.803 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.650 11.786 5.017 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.214 12.522 4.267 1.00 0.00 H new ATOM 344 N VAL A 21 6.640 7.004 4.249 1.00 0.00 N ATOM 345 CA VAL A 21 6.193 5.612 4.345 1.00 0.00 C ATOM 346 C VAL A 21 7.397 4.661 4.445 1.00 0.00 C ATOM 347 O VAL A 21 7.386 3.768 5.292 1.00 0.00 O ATOM 348 CB VAL A 21 5.234 5.280 3.175 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.853 3.789 3.127 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.933 6.094 3.306 1.00 0.00 C ATOM 0 H VAL A 21 6.266 7.500 3.440 1.00 0.00 H new ATOM 0 HA VAL A 21 5.623 5.470 5.263 1.00 0.00 H new ATOM 0 HB VAL A 21 5.769 5.535 2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.180 3.612 2.288 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.753 3.187 3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.356 3.510 4.056 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.267 5.852 2.478 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.444 5.849 4.249 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.166 7.159 3.285 1.00 0.00 H new ATOM 360 N ARG A 22 8.462 4.870 3.658 1.00 0.00 N ATOM 361 CA ARG A 22 9.682 4.077 3.773 1.00 0.00 C ATOM 362 C ARG A 22 10.300 4.221 5.157 1.00 0.00 C ATOM 363 O ARG A 22 10.632 3.197 5.742 1.00 0.00 O ATOM 364 CB ARG A 22 10.702 4.444 2.686 1.00 0.00 C ATOM 365 CG ARG A 22 11.812 3.378 2.626 1.00 0.00 C ATOM 366 CD ARG A 22 13.047 3.828 1.853 1.00 0.00 C ATOM 367 NE ARG A 22 12.704 4.302 0.507 1.00 0.00 N ATOM 368 CZ ARG A 22 13.214 5.362 -0.123 1.00 0.00 C ATOM 369 NH1 ARG A 22 14.033 6.209 0.493 1.00 0.00 N ATOM 370 NH2 ARG A 22 12.906 5.603 -1.388 1.00 0.00 N ATOM 0 H ARG A 22 8.497 5.587 2.933 1.00 0.00 H new ATOM 0 HA ARG A 22 9.403 3.033 3.628 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.205 4.518 1.719 1.00 0.00 H new ATOM 0 HB3 ARG A 22 11.136 5.421 2.897 1.00 0.00 H new ATOM 0 HG2 ARG A 22 12.106 3.113 3.642 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.413 2.475 2.164 1.00 0.00 H new ATOM 0 HD2 ARG A 22 13.549 4.625 2.402 1.00 0.00 H new ATOM 0 HD3 ARG A 22 13.751 2.999 1.778 1.00 0.00 H new ATOM 0 HE ARG A 22 12.001 3.764 -0.001 1.00 0.00 H new ATOM 0 HH11 ARG A 22 14.285 6.056 1.469 1.00 0.00 H new ATOM 0 HH12 ARG A 22 14.410 7.012 -0.011 1.00 0.00 H new ATOM 0 HH21 ARG A 22 12.275 4.976 -1.888 1.00 0.00 H new ATOM 0 HH22 ARG A 22 13.300 6.415 -1.863 1.00 0.00 H new ATOM 384 N ASN A 23 10.478 5.446 5.674 1.00 0.00 N ATOM 385 CA ASN A 23 10.951 5.639 7.049 1.00 0.00 C ATOM 386 C ASN A 23 10.102 4.808 8.005 1.00 0.00 C ATOM 387 O ASN A 23 10.655 3.980 8.719 1.00 0.00 O ATOM 388 CB ASN A 23 10.979 7.126 7.449 1.00 0.00 C ATOM 389 CG ASN A 23 11.005 7.342 8.964 1.00 0.00 C ATOM 390 OD1 ASN A 23 10.051 7.865 9.530 1.00 0.00 O ATOM 391 ND2 ASN A 23 12.066 6.970 9.647 1.00 0.00 N ATOM 0 H ASN A 23 10.302 6.311 5.163 1.00 0.00 H new ATOM 0 HA ASN A 23 11.983 5.293 7.110 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.856 7.598 7.006 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.104 7.624 7.032 1.00 0.00 H new ATOM 0 HD21 ASN A 23 12.100 7.116 10.656 1.00 0.00 H new ATOM 0 HD22 ASN A 23 12.855 6.536 9.168 1.00 0.00 H new ATOM 398 N LEU A 24 8.777 4.978 7.977 1.00 0.00 N ATOM 399 CA LEU A 24 7.846 4.314 8.888 1.00 0.00 C ATOM 400 C LEU A 24 8.002 2.793 8.840 1.00 0.00 C ATOM 401 O LEU A 24 7.981 2.144 9.881 1.00 0.00 O ATOM 402 CB LEU A 24 6.389 4.692 8.564 1.00 0.00 C ATOM 403 CG LEU A 24 6.060 6.194 8.622 1.00 0.00 C ATOM 404 CD1 LEU A 24 4.580 6.397 8.294 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.479 6.871 9.931 1.00 0.00 C ATOM 0 H LEU A 24 8.315 5.593 7.307 1.00 0.00 H new ATOM 0 HA LEU A 24 8.087 4.657 9.894 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.151 4.325 7.565 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.734 4.168 9.260 1.00 0.00 H new ATOM 0 HG LEU A 24 6.663 6.698 7.866 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.341 7.460 8.334 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.373 6.016 7.294 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.969 5.861 9.020 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.214 7.928 9.895 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.965 6.396 10.767 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.556 6.772 10.063 1.00 0.00 H new ATOM 417 N LEU A 25 8.150 2.226 7.642 1.00 0.00 N ATOM 418 CA LEU A 25 8.398 0.802 7.442 1.00 0.00 C ATOM 419 C LEU A 25 9.740 0.398 8.046 1.00 0.00 C ATOM 420 O LEU A 25 9.827 -0.605 8.756 1.00 0.00 O ATOM 421 CB LEU A 25 8.372 0.485 5.935 1.00 0.00 C ATOM 422 CG LEU A 25 6.936 0.347 5.406 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.891 0.484 3.883 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.365 -1.017 5.798 1.00 0.00 C ATOM 0 H LEU A 25 8.100 2.754 6.771 1.00 0.00 H new ATOM 0 HA LEU A 25 7.617 0.232 7.945 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.886 1.275 5.388 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.919 -0.439 5.748 1.00 0.00 H new ATOM 0 HG LEU A 25 6.340 1.145 5.849 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.862 0.382 3.539 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.275 1.462 3.594 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.504 -0.295 3.429 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.347 -1.108 5.420 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.983 -1.807 5.370 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.358 -1.110 6.884 1.00 0.00 H new ATOM 436 N LYS A 26 10.791 1.162 7.765 1.00 0.00 N ATOM 437 CA LYS A 26 12.147 0.847 8.189 1.00 0.00 C ATOM 438 C LYS A 26 12.333 0.987 9.696 1.00 0.00 C ATOM 439 O LYS A 26 13.257 0.362 10.217 1.00 0.00 O ATOM 440 CB LYS A 26 13.145 1.706 7.403 1.00 0.00 C ATOM 441 CG LYS A 26 13.239 1.267 5.928 1.00 0.00 C ATOM 442 CD LYS A 26 14.089 -0.001 5.725 1.00 0.00 C ATOM 443 CE LYS A 26 15.509 0.296 5.230 1.00 0.00 C ATOM 444 NZ LYS A 26 16.265 1.191 6.129 1.00 0.00 N ATOM 0 H LYS A 26 10.722 2.028 7.230 1.00 0.00 H new ATOM 0 HA LYS A 26 12.339 -0.203 7.966 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.843 2.752 7.453 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.129 1.636 7.867 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.235 1.088 5.544 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.665 2.080 5.340 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.146 -0.547 6.667 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.591 -0.654 5.008 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.052 -0.643 5.122 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.454 0.749 4.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.215 1.353 5.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 15.766 2.100 6.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.346 0.752 7.068 1.00 0.00 H new ATOM 458 N GLU A 27 11.470 1.711 10.415 1.00 0.00 N ATOM 459 CA GLU A 27 11.501 1.706 11.878 1.00 0.00 C ATOM 460 C GLU A 27 11.204 0.298 12.408 1.00 0.00 C ATOM 461 O GLU A 27 11.701 -0.102 13.466 1.00 0.00 O ATOM 462 CB GLU A 27 10.469 2.674 12.486 1.00 0.00 C ATOM 463 CG GLU A 27 10.467 4.116 11.970 1.00 0.00 C ATOM 464 CD GLU A 27 11.845 4.786 11.960 1.00 0.00 C ATOM 465 OE1 GLU A 27 12.745 4.389 11.183 1.00 0.00 O ATOM 466 OE2 GLU A 27 12.053 5.727 12.760 1.00 0.00 O ATOM 0 H GLU A 27 10.746 2.304 10.010 1.00 0.00 H new ATOM 0 HA GLU A 27 12.500 2.029 12.171 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.476 2.256 12.321 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.628 2.702 13.564 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.064 4.126 10.957 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.792 4.709 12.587 1.00 0.00 H new ATOM 473 N LEU A 28 10.360 -0.441 11.690 1.00 0.00 N ATOM 474 CA LEU A 28 9.877 -1.765 12.054 1.00 0.00 C ATOM 475 C LEU A 28 10.871 -2.808 11.543 1.00 0.00 C ATOM 476 O LEU A 28 11.329 -3.659 12.312 1.00 0.00 O ATOM 477 CB LEU A 28 8.468 -1.980 11.471 1.00 0.00 C ATOM 478 CG LEU A 28 7.455 -0.857 11.789 1.00 0.00 C ATOM 479 CD1 LEU A 28 6.175 -1.050 10.971 1.00 0.00 C ATOM 480 CD2 LEU A 28 7.130 -0.789 13.287 1.00 0.00 C ATOM 0 H LEU A 28 9.980 -0.116 10.801 1.00 0.00 H new ATOM 0 HA LEU A 28 9.802 -1.864 13.137 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.550 -2.080 10.389 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.074 -2.923 11.850 1.00 0.00 H new ATOM 0 HG LEU A 28 7.915 0.091 11.512 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.470 -0.252 11.205 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.415 -1.022 9.908 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.728 -2.013 11.217 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.415 0.013 13.468 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.701 -1.738 13.610 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.043 -0.594 13.849 1.00 0.00 H new ATOM 492 N GLY A 29 11.248 -2.728 10.266 1.00 0.00 N ATOM 493 CA GLY A 29 12.238 -3.600 9.660 1.00 0.00 C ATOM 494 C GLY A 29 12.215 -3.443 8.157 1.00 0.00 C ATOM 495 O GLY A 29 12.798 -2.501 7.631 1.00 0.00 O ATOM 0 H GLY A 29 10.863 -2.041 9.618 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.230 -3.360 10.044 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.035 -4.637 9.929 1.00 0.00 H new ATOM 499 N PHE A 30 11.501 -4.356 7.503 1.00 0.00 N ATOM 500 CA PHE A 30 11.106 -4.361 6.098 1.00 0.00 C ATOM 501 C PHE A 30 12.184 -3.770 5.190 1.00 0.00 C ATOM 502 O PHE A 30 12.023 -2.720 4.574 1.00 0.00 O ATOM 503 CB PHE A 30 9.715 -3.727 5.987 1.00 0.00 C ATOM 504 CG PHE A 30 8.734 -4.332 6.986 1.00 0.00 C ATOM 505 CD1 PHE A 30 8.558 -5.730 7.053 1.00 0.00 C ATOM 506 CD2 PHE A 30 8.087 -3.513 7.929 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.744 -6.302 8.043 1.00 0.00 C ATOM 508 CE2 PHE A 30 7.282 -4.090 8.927 1.00 0.00 C ATOM 509 CZ PHE A 30 7.112 -5.481 8.986 1.00 0.00 C ATOM 0 H PHE A 30 11.154 -5.184 7.986 1.00 0.00 H new ATOM 0 HA PHE A 30 11.019 -5.381 5.722 1.00 0.00 H new ATOM 0 HB2 PHE A 30 9.791 -2.653 6.157 1.00 0.00 H new ATOM 0 HB3 PHE A 30 9.333 -3.863 4.975 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.054 -6.366 6.335 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.209 -2.441 7.886 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.605 -7.372 8.078 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.792 -3.458 9.653 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.495 -5.918 9.757 1.00 0.00 H new ATOM 519 N ASN A 31 13.322 -4.464 5.148 1.00 0.00 N ATOM 520 CA ASN A 31 14.561 -4.006 4.526 1.00 0.00 C ATOM 521 C ASN A 31 14.521 -3.895 2.994 1.00 0.00 C ATOM 522 O ASN A 31 15.552 -3.528 2.418 1.00 0.00 O ATOM 523 CB ASN A 31 15.732 -4.899 4.973 1.00 0.00 C ATOM 524 CG ASN A 31 15.560 -6.350 4.538 1.00 0.00 C ATOM 525 OD1 ASN A 31 15.582 -6.662 3.350 1.00 0.00 O ATOM 526 ND2 ASN A 31 15.347 -7.256 5.476 1.00 0.00 N ATOM 0 H ASN A 31 13.407 -5.393 5.561 1.00 0.00 H new ATOM 0 HA ASN A 31 14.703 -2.983 4.875 1.00 0.00 H new ATOM 0 HB2 ASN A 31 16.662 -4.507 4.560 1.00 0.00 H new ATOM 0 HB3 ASN A 31 15.823 -4.857 6.058 1.00 0.00 H new ATOM 0 HD21 ASN A 31 15.198 -8.232 5.218 1.00 0.00 H new ATOM 0 HD22 ASN A 31 15.332 -6.980 6.458 1.00 0.00 H new ATOM 533 N ASN A 32 13.404 -4.176 2.314 1.00 0.00 N ATOM 534 CA ASN A 32 13.294 -4.020 0.863 1.00 0.00 C ATOM 535 C ASN A 32 11.982 -3.330 0.492 1.00 0.00 C ATOM 536 O ASN A 32 10.917 -3.954 0.492 1.00 0.00 O ATOM 537 CB ASN A 32 13.462 -5.365 0.146 1.00 0.00 C ATOM 538 CG ASN A 32 13.826 -5.122 -1.311 1.00 0.00 C ATOM 539 OD1 ASN A 32 13.267 -4.255 -1.978 1.00 0.00 O ATOM 540 ND2 ASN A 32 14.807 -5.840 -1.826 1.00 0.00 N ATOM 0 H ASN A 32 12.551 -4.518 2.756 1.00 0.00 H new ATOM 0 HA ASN A 32 14.107 -3.378 0.524 1.00 0.00 H new ATOM 0 HB2 ASN A 32 14.239 -5.954 0.633 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.539 -5.941 0.210 1.00 0.00 H new ATOM 0 HD21 ASN A 32 15.108 -5.677 -2.787 1.00 0.00 H new ATOM 0 HD22 ASN A 32 15.264 -6.557 -1.263 1.00 0.00 H new ATOM 547 N VAL A 33 12.058 -2.030 0.211 1.00 0.00 N ATOM 548 CA VAL A 33 10.936 -1.147 -0.017 1.00 0.00 C ATOM 549 C VAL A 33 11.096 -0.546 -1.412 1.00 0.00 C ATOM 550 O VAL A 33 11.754 0.483 -1.591 1.00 0.00 O ATOM 551 CB VAL A 33 10.878 -0.082 1.098 1.00 0.00 C ATOM 552 CG1 VAL A 33 9.485 0.548 1.116 1.00 0.00 C ATOM 553 CG2 VAL A 33 11.198 -0.625 2.497 1.00 0.00 C ATOM 0 H VAL A 33 12.954 -1.548 0.134 1.00 0.00 H new ATOM 0 HA VAL A 33 9.986 -1.680 0.020 1.00 0.00 H new ATOM 0 HB VAL A 33 11.650 0.652 0.865 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.437 1.302 1.902 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.285 1.015 0.152 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.739 -0.224 1.307 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.136 0.184 3.224 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.481 -1.403 2.758 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.205 -1.043 2.504 1.00 0.00 H new ATOM 563 N GLU A 34 10.514 -1.198 -2.410 1.00 0.00 N ATOM 564 CA GLU A 34 10.382 -0.656 -3.750 1.00 0.00 C ATOM 565 C GLU A 34 9.435 0.542 -3.726 1.00 0.00 C ATOM 566 O GLU A 34 8.618 0.699 -2.813 1.00 0.00 O ATOM 567 CB GLU A 34 9.761 -1.737 -4.643 1.00 0.00 C ATOM 568 CG GLU A 34 10.102 -1.631 -6.132 1.00 0.00 C ATOM 569 CD GLU A 34 11.421 -2.324 -6.439 1.00 0.00 C ATOM 570 OE1 GLU A 34 12.473 -1.882 -5.926 1.00 0.00 O ATOM 571 OE2 GLU A 34 11.401 -3.306 -7.220 1.00 0.00 O ATOM 0 H GLU A 34 10.116 -2.131 -2.307 1.00 0.00 H new ATOM 0 HA GLU A 34 11.359 -0.349 -4.123 1.00 0.00 H new ATOM 0 HB2 GLU A 34 10.084 -2.713 -4.282 1.00 0.00 H new ATOM 0 HB3 GLU A 34 8.677 -1.699 -4.532 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.305 -2.080 -6.724 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.162 -0.582 -6.421 1.00 0.00 H new ATOM 578 N GLU A 35 9.459 1.333 -4.790 1.00 0.00 N ATOM 579 CA GLU A 35 8.352 2.207 -5.121 1.00 0.00 C ATOM 580 C GLU A 35 8.040 2.078 -6.611 1.00 0.00 C ATOM 581 O GLU A 35 8.832 1.513 -7.374 1.00 0.00 O ATOM 582 CB GLU A 35 8.606 3.652 -4.666 1.00 0.00 C ATOM 583 CG GLU A 35 9.917 4.247 -5.175 1.00 0.00 C ATOM 584 CD GLU A 35 11.068 4.125 -4.179 1.00 0.00 C ATOM 585 OE1 GLU A 35 10.939 4.640 -3.043 1.00 0.00 O ATOM 586 OE2 GLU A 35 12.163 3.658 -4.564 1.00 0.00 O ATOM 0 H GLU A 35 10.242 1.384 -5.441 1.00 0.00 H new ATOM 0 HA GLU A 35 7.464 1.897 -4.569 1.00 0.00 H new ATOM 0 HB2 GLU A 35 7.780 4.278 -5.004 1.00 0.00 H new ATOM 0 HB3 GLU A 35 8.604 3.684 -3.576 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.196 3.749 -6.104 1.00 0.00 H new ATOM 0 HG3 GLU A 35 9.762 5.300 -5.412 1.00 0.00 H new ATOM 593 N ALA A 36 6.885 2.592 -7.020 1.00 0.00 N ATOM 594 CA ALA A 36 6.476 2.687 -8.412 1.00 0.00 C ATOM 595 C ALA A 36 6.404 4.163 -8.801 1.00 0.00 C ATOM 596 O ALA A 36 6.668 5.048 -7.980 1.00 0.00 O ATOM 597 CB ALA A 36 5.139 1.958 -8.616 1.00 0.00 C ATOM 0 H ALA A 36 6.190 2.964 -6.372 1.00 0.00 H new ATOM 0 HA ALA A 36 7.202 2.200 -9.063 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.839 2.034 -9.661 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.252 0.908 -8.346 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.376 2.414 -7.986 1.00 0.00 H new ATOM 603 N GLU A 37 6.071 4.434 -10.057 1.00 0.00 N ATOM 604 CA GLU A 37 5.804 5.793 -10.517 1.00 0.00 C ATOM 605 C GLU A 37 4.388 6.213 -10.116 1.00 0.00 C ATOM 606 O GLU A 37 4.178 7.348 -9.689 1.00 0.00 O ATOM 607 CB GLU A 37 5.976 5.913 -12.041 1.00 0.00 C ATOM 608 CG GLU A 37 7.295 5.302 -12.531 1.00 0.00 C ATOM 609 CD GLU A 37 7.779 5.912 -13.841 1.00 0.00 C ATOM 610 OE1 GLU A 37 8.564 6.889 -13.785 1.00 0.00 O ATOM 611 OE2 GLU A 37 7.481 5.363 -14.927 1.00 0.00 O ATOM 0 H GLU A 37 5.979 3.723 -10.783 1.00 0.00 H new ATOM 0 HA GLU A 37 6.527 6.457 -10.043 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.142 5.417 -12.538 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.938 6.964 -12.327 1.00 0.00 H new ATOM 0 HG2 GLU A 37 8.060 5.440 -11.767 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.166 4.228 -12.662 1.00 0.00 H new ATOM 618 N ASP A 38 3.420 5.312 -10.285 1.00 0.00 N ATOM 619 CA ASP A 38 1.984 5.585 -10.341 1.00 0.00 C ATOM 620 C ASP A 38 1.240 4.250 -10.224 1.00 0.00 C ATOM 621 O ASP A 38 1.868 3.215 -10.432 1.00 0.00 O ATOM 622 CB ASP A 38 1.653 6.208 -11.705 1.00 0.00 C ATOM 623 CG ASP A 38 0.150 6.414 -11.813 1.00 0.00 C ATOM 624 OD1 ASP A 38 -0.353 7.190 -10.978 1.00 0.00 O ATOM 625 OD2 ASP A 38 -0.504 5.684 -12.590 1.00 0.00 O ATOM 0 H ASP A 38 3.628 4.319 -10.392 1.00 0.00 H new ATOM 0 HA ASP A 38 1.693 6.262 -9.538 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.171 7.160 -11.818 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.001 5.559 -12.508 1.00 0.00 H new ATOM 630 N GLY A 39 -0.063 4.230 -9.929 1.00 0.00 N ATOM 631 CA GLY A 39 -0.916 3.039 -9.953 1.00 0.00 C ATOM 632 C GLY A 39 -0.755 2.180 -11.215 1.00 0.00 C ATOM 633 O GLY A 39 -0.727 0.944 -11.125 1.00 0.00 O ATOM 0 H GLY A 39 -0.570 5.072 -9.657 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.693 2.427 -9.079 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.957 3.349 -9.868 1.00 0.00 H new ATOM 637 N VAL A 40 -0.606 2.807 -12.387 1.00 0.00 N ATOM 638 CA VAL A 40 -0.374 2.072 -13.624 1.00 0.00 C ATOM 639 C VAL A 40 0.908 1.245 -13.489 1.00 0.00 C ATOM 640 O VAL A 40 0.891 0.032 -13.728 1.00 0.00 O ATOM 641 CB VAL A 40 -0.358 3.020 -14.839 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.022 2.272 -16.141 1.00 0.00 C ATOM 643 CG2 VAL A 40 -1.736 3.673 -15.009 1.00 0.00 C ATOM 0 H VAL A 40 -0.643 3.820 -12.499 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.197 1.379 -13.802 1.00 0.00 H new ATOM 0 HB VAL A 40 0.409 3.771 -14.652 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.021 2.975 -16.974 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.962 1.812 -16.053 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -0.769 1.499 -16.320 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.718 4.342 -15.869 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.488 2.900 -15.166 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.982 4.242 -14.112 1.00 0.00 H new ATOM 653 N ASP A 41 2.000 1.887 -13.068 1.00 0.00 N ATOM 654 CA ASP A 41 3.266 1.217 -12.803 1.00 0.00 C ATOM 655 C ASP A 41 3.151 0.283 -11.598 1.00 0.00 C ATOM 656 O ASP A 41 3.858 -0.713 -11.543 1.00 0.00 O ATOM 657 CB ASP A 41 4.394 2.233 -12.583 1.00 0.00 C ATOM 658 CG ASP A 41 5.761 1.555 -12.422 1.00 0.00 C ATOM 659 OD1 ASP A 41 6.113 0.647 -13.208 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.539 1.981 -11.541 1.00 0.00 O ATOM 0 H ASP A 41 2.026 2.893 -12.902 1.00 0.00 H new ATOM 0 HA ASP A 41 3.511 0.618 -13.680 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.429 2.922 -13.426 1.00 0.00 H new ATOM 0 HB3 ASP A 41 4.178 2.827 -11.695 1.00 0.00 H new ATOM 665 N ALA A 42 2.240 0.528 -10.653 1.00 0.00 N ATOM 666 CA ALA A 42 2.047 -0.336 -9.508 1.00 0.00 C ATOM 667 C ALA A 42 1.652 -1.715 -10.008 1.00 0.00 C ATOM 668 O ALA A 42 2.345 -2.676 -9.690 1.00 0.00 O ATOM 669 CB ALA A 42 1.009 0.227 -8.536 1.00 0.00 C ATOM 0 H ALA A 42 1.618 1.336 -10.669 1.00 0.00 H new ATOM 0 HA ALA A 42 2.979 -0.402 -8.947 1.00 0.00 H new ATOM 0 HB1 ALA A 42 0.895 -0.453 -7.691 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.339 1.201 -8.176 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.052 0.334 -9.047 1.00 0.00 H new ATOM 675 N LEU A 43 0.596 -1.817 -10.828 1.00 0.00 N ATOM 676 CA LEU A 43 0.170 -3.122 -11.351 1.00 0.00 C ATOM 677 C LEU A 43 1.296 -3.802 -12.150 1.00 0.00 C ATOM 678 O LEU A 43 1.505 -5.019 -12.060 1.00 0.00 O ATOM 679 CB LEU A 43 -1.077 -2.968 -12.230 1.00 0.00 C ATOM 680 CG LEU A 43 -1.864 -4.286 -12.347 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.805 -4.472 -11.152 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.688 -4.304 -13.637 1.00 0.00 C ATOM 0 H LEU A 43 0.031 -1.027 -11.139 1.00 0.00 H new ATOM 0 HA LEU A 43 -0.071 -3.756 -10.498 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.723 -2.196 -11.812 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.781 -2.632 -13.224 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.141 -5.101 -12.362 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.349 -5.411 -11.260 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.223 -4.493 -10.231 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.513 -3.644 -11.115 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.238 -5.243 -13.704 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.391 -3.471 -13.631 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.022 -4.211 -14.495 1.00 0.00 H new ATOM 694 N ASN A 44 2.028 -3.003 -12.935 1.00 0.00 N ATOM 695 CA ASN A 44 3.189 -3.440 -13.704 1.00 0.00 C ATOM 696 C ASN A 44 4.227 -4.086 -12.781 1.00 0.00 C ATOM 697 O ASN A 44 4.705 -5.183 -13.071 1.00 0.00 O ATOM 698 CB ASN A 44 3.777 -2.248 -14.476 1.00 0.00 C ATOM 699 CG ASN A 44 4.939 -2.646 -15.369 1.00 0.00 C ATOM 700 OD1 ASN A 44 6.017 -2.961 -14.887 1.00 0.00 O ATOM 701 ND2 ASN A 44 4.763 -2.636 -16.679 1.00 0.00 N ATOM 0 H ASN A 44 1.821 -2.011 -13.053 1.00 0.00 H new ATOM 0 HA ASN A 44 2.883 -4.195 -14.429 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.995 -1.793 -15.084 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.111 -1.490 -13.767 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.531 -2.893 -17.299 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.859 -2.371 -17.070 1.00 0.00 H new ATOM 708 N LYS A 45 4.542 -3.446 -11.650 1.00 0.00 N ATOM 709 CA LYS A 45 5.464 -3.948 -10.633 1.00 0.00 C ATOM 710 C LYS A 45 4.967 -5.279 -10.096 1.00 0.00 C ATOM 711 O LYS A 45 5.743 -6.226 -10.073 1.00 0.00 O ATOM 712 CB LYS A 45 5.645 -2.926 -9.494 1.00 0.00 C ATOM 713 CG LYS A 45 6.284 -1.613 -9.969 1.00 0.00 C ATOM 714 CD LYS A 45 7.791 -1.598 -9.749 1.00 0.00 C ATOM 715 CE LYS A 45 8.459 -0.456 -10.517 1.00 0.00 C ATOM 716 NZ LYS A 45 8.345 -0.571 -11.987 1.00 0.00 N ATOM 0 H LYS A 45 4.148 -2.536 -11.412 1.00 0.00 H new ATOM 0 HA LYS A 45 6.440 -4.099 -11.094 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.674 -2.711 -9.047 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.266 -3.365 -8.713 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.071 -1.469 -11.028 1.00 0.00 H new ATOM 0 HG3 LYS A 45 5.832 -0.776 -9.436 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.003 -1.495 -8.685 1.00 0.00 H new ATOM 0 HD3 LYS A 45 8.216 -2.550 -10.068 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.016 0.488 -10.201 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.514 -0.419 -10.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.055 0.040 -12.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 8.506 -1.558 -12.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.394 -0.275 -12.286 1.00 0.00 H new ATOM 730 N LEU A 46 3.692 -5.407 -9.710 1.00 0.00 N ATOM 731 CA LEU A 46 3.183 -6.672 -9.152 1.00 0.00 C ATOM 732 C LEU A 46 3.394 -7.800 -10.156 1.00 0.00 C ATOM 733 O LEU A 46 3.761 -8.915 -9.770 1.00 0.00 O ATOM 734 CB LEU A 46 1.691 -6.644 -8.759 1.00 0.00 C ATOM 735 CG LEU A 46 1.170 -5.289 -8.287 1.00 0.00 C ATOM 736 CD1 LEU A 46 -0.327 -5.298 -8.063 1.00 0.00 C ATOM 737 CD2 LEU A 46 1.869 -4.710 -7.053 1.00 0.00 C ATOM 0 H LEU A 46 2.999 -4.662 -9.771 1.00 0.00 H new ATOM 0 HA LEU A 46 3.749 -6.833 -8.235 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.099 -6.964 -9.617 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.526 -7.375 -7.967 1.00 0.00 H new ATOM 0 HG LEU A 46 1.416 -4.626 -9.116 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.651 -4.313 -7.728 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.833 -5.549 -8.995 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.577 -6.039 -7.304 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.424 -3.747 -6.801 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.751 -5.395 -6.213 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.930 -4.575 -7.265 1.00 0.00 H new ATOM 749 N GLN A 47 3.182 -7.505 -11.442 1.00 0.00 N ATOM 750 CA GLN A 47 3.396 -8.437 -12.544 1.00 0.00 C ATOM 751 C GLN A 47 4.879 -8.637 -12.910 1.00 0.00 C ATOM 752 O GLN A 47 5.174 -9.275 -13.919 1.00 0.00 O ATOM 753 CB GLN A 47 2.528 -8.014 -13.737 1.00 0.00 C ATOM 754 CG GLN A 47 1.043 -8.215 -13.392 1.00 0.00 C ATOM 755 CD GLN A 47 0.139 -7.838 -14.555 1.00 0.00 C ATOM 756 OE1 GLN A 47 -0.351 -8.701 -15.281 1.00 0.00 O ATOM 757 NE2 GLN A 47 -0.080 -6.551 -14.769 1.00 0.00 N ATOM 0 H GLN A 47 2.850 -6.591 -11.749 1.00 0.00 H new ATOM 0 HA GLN A 47 3.080 -9.427 -12.216 1.00 0.00 H new ATOM 0 HB2 GLN A 47 2.716 -6.969 -13.984 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.790 -8.602 -14.617 1.00 0.00 H new ATOM 0 HG2 GLN A 47 0.870 -9.256 -13.120 1.00 0.00 H new ATOM 0 HG3 GLN A 47 0.787 -7.611 -12.521 1.00 0.00 H new ATOM 0 HE21 GLN A 47 0.337 -5.853 -14.153 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -0.666 -6.256 -15.550 1.00 0.00 H new ATOM 766 N ALA A 48 5.836 -8.145 -12.113 1.00 0.00 N ATOM 767 CA ALA A 48 7.205 -8.655 -12.144 1.00 0.00 C ATOM 768 C ALA A 48 7.231 -10.106 -11.649 1.00 0.00 C ATOM 769 O ALA A 48 7.957 -10.920 -12.220 1.00 0.00 O ATOM 770 CB ALA A 48 8.145 -7.796 -11.291 1.00 0.00 C ATOM 0 H ALA A 48 5.683 -7.394 -11.440 1.00 0.00 H new ATOM 0 HA ALA A 48 7.556 -8.613 -13.175 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.154 -8.205 -11.338 1.00 0.00 H new ATOM 0 HB2 ALA A 48 8.149 -6.774 -11.671 1.00 0.00 H new ATOM 0 HB3 ALA A 48 7.801 -7.797 -10.257 1.00 0.00 H new ATOM 776 N GLY A 49 6.410 -10.449 -10.645 1.00 0.00 N ATOM 777 CA GLY A 49 6.157 -11.839 -10.281 1.00 0.00 C ATOM 778 C GLY A 49 5.762 -12.093 -8.826 1.00 0.00 C ATOM 779 O GLY A 49 5.194 -13.156 -8.554 1.00 0.00 O ATOM 0 H GLY A 49 5.909 -9.771 -10.070 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.365 -12.223 -10.923 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.054 -12.419 -10.499 1.00 0.00 H new ATOM 783 N GLY A 50 6.034 -11.184 -7.882 1.00 0.00 N ATOM 784 CA GLY A 50 5.750 -11.458 -6.473 1.00 0.00 C ATOM 785 C GLY A 50 6.212 -10.352 -5.533 1.00 0.00 C ATOM 786 O GLY A 50 7.337 -10.399 -5.032 1.00 0.00 O ATOM 0 H GLY A 50 6.443 -10.268 -8.066 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.677 -11.605 -6.349 1.00 0.00 H new ATOM 0 HA3 GLY A 50 6.234 -12.392 -6.188 1.00 0.00 H new ATOM 790 N TYR A 51 5.377 -9.336 -5.318 1.00 0.00 N ATOM 791 CA TYR A 51 5.560 -8.370 -4.233 1.00 0.00 C ATOM 792 C TYR A 51 4.812 -8.842 -2.982 1.00 0.00 C ATOM 793 O TYR A 51 3.932 -9.699 -3.061 1.00 0.00 O ATOM 794 CB TYR A 51 5.128 -6.972 -4.698 1.00 0.00 C ATOM 795 CG TYR A 51 6.179 -6.317 -5.579 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.413 -6.791 -6.884 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.984 -5.281 -5.068 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.453 -6.249 -7.655 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.985 -4.702 -5.867 1.00 0.00 C ATOM 800 CZ TYR A 51 8.235 -5.189 -7.164 1.00 0.00 C ATOM 801 OH TYR A 51 9.230 -4.687 -7.949 1.00 0.00 O ATOM 0 H TYR A 51 4.553 -9.158 -5.892 1.00 0.00 H new ATOM 0 HA TYR A 51 6.614 -8.302 -3.965 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.189 -7.046 -5.247 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.940 -6.342 -3.828 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.791 -7.573 -7.293 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.832 -4.930 -4.058 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.655 -6.651 -8.637 1.00 0.00 H new ATOM 0 HE2 TYR A 51 8.567 -3.877 -5.483 1.00 0.00 H new ATOM 0 HH TYR A 51 9.941 -4.321 -7.382 1.00 0.00 H new ATOM 811 N GLY A 52 5.140 -8.272 -1.820 1.00 0.00 N ATOM 812 CA GLY A 52 4.510 -8.612 -0.551 1.00 0.00 C ATOM 813 C GLY A 52 3.364 -7.679 -0.174 1.00 0.00 C ATOM 814 O GLY A 52 2.364 -8.142 0.369 1.00 0.00 O ATOM 0 H GLY A 52 5.859 -7.554 -1.738 1.00 0.00 H new ATOM 0 HA2 GLY A 52 4.135 -9.634 -0.603 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.262 -8.588 0.237 1.00 0.00 H new ATOM 818 N PHE A 53 3.493 -6.374 -0.434 1.00 0.00 N ATOM 819 CA PHE A 53 2.517 -5.366 -0.023 1.00 0.00 C ATOM 820 C PHE A 53 2.394 -4.319 -1.115 1.00 0.00 C ATOM 821 O PHE A 53 3.374 -4.048 -1.811 1.00 0.00 O ATOM 822 CB PHE A 53 2.956 -4.661 1.269 1.00 0.00 C ATOM 823 CG PHE A 53 3.049 -5.563 2.477 1.00 0.00 C ATOM 824 CD1 PHE A 53 4.241 -6.258 2.736 1.00 0.00 C ATOM 825 CD2 PHE A 53 1.950 -5.713 3.343 1.00 0.00 C ATOM 826 CE1 PHE A 53 4.322 -7.127 3.836 1.00 0.00 C ATOM 827 CE2 PHE A 53 2.028 -6.619 4.416 1.00 0.00 C ATOM 828 CZ PHE A 53 3.209 -7.334 4.658 1.00 0.00 C ATOM 0 H PHE A 53 4.288 -5.986 -0.942 1.00 0.00 H new ATOM 0 HA PHE A 53 1.565 -5.867 0.151 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.928 -4.198 1.102 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.253 -3.857 1.486 1.00 0.00 H new ATOM 0 HD1 PHE A 53 5.096 -6.124 2.089 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.051 -5.135 3.185 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.249 -7.639 4.049 1.00 0.00 H new ATOM 0 HE2 PHE A 53 1.172 -6.765 5.058 1.00 0.00 H new ATOM 0 HZ PHE A 53 3.259 -8.040 5.474 1.00 0.00 H new ATOM 838 N VAL A 54 1.215 -3.705 -1.214 1.00 0.00 N ATOM 839 CA VAL A 54 0.870 -2.785 -2.288 1.00 0.00 C ATOM 840 C VAL A 54 0.329 -1.529 -1.594 1.00 0.00 C ATOM 841 O VAL A 54 -0.873 -1.363 -1.383 1.00 0.00 O ATOM 842 CB VAL A 54 -0.121 -3.482 -3.249 1.00 0.00 C ATOM 843 CG1 VAL A 54 -0.151 -2.848 -4.644 1.00 0.00 C ATOM 844 CG2 VAL A 54 0.165 -4.968 -3.452 1.00 0.00 C ATOM 0 H VAL A 54 0.463 -3.838 -0.537 1.00 0.00 H new ATOM 0 HA VAL A 54 1.709 -2.492 -2.919 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.081 -3.353 -2.748 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.865 -3.382 -5.271 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.450 -1.803 -4.562 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.841 -2.908 -5.092 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.570 -5.390 -4.138 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.164 -5.093 -3.870 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.105 -5.484 -2.494 1.00 0.00 H new ATOM 854 N ILE A 55 1.234 -0.698 -1.092 1.00 0.00 N ATOM 855 CA ILE A 55 0.905 0.411 -0.210 1.00 0.00 C ATOM 856 C ILE A 55 0.842 1.624 -1.141 1.00 0.00 C ATOM 857 O ILE A 55 1.801 1.856 -1.883 1.00 0.00 O ATOM 858 CB ILE A 55 1.995 0.452 0.886 1.00 0.00 C ATOM 859 CG1 ILE A 55 1.718 -0.655 1.937 1.00 0.00 C ATOM 860 CG2 ILE A 55 2.009 1.799 1.612 1.00 0.00 C ATOM 861 CD1 ILE A 55 2.993 -1.253 2.541 1.00 0.00 C ATOM 0 H ILE A 55 2.231 -0.778 -1.290 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.041 0.351 0.328 1.00 0.00 H new ATOM 0 HB ILE A 55 2.957 0.298 0.398 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.105 -0.241 2.738 1.00 0.00 H new ATOM 0 HG13 ILE A 55 1.137 -1.451 1.471 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.787 1.793 2.375 1.00 0.00 H new ATOM 0 HG22 ILE A 55 2.210 2.596 0.896 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.040 1.969 2.082 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.726 -2.020 3.268 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.597 -1.697 1.750 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.564 -0.468 3.036 1.00 0.00 H new ATOM 873 N SER A 56 -0.286 2.334 -1.242 1.00 0.00 N ATOM 874 CA SER A 56 -0.462 3.346 -2.290 1.00 0.00 C ATOM 875 C SER A 56 -1.413 4.477 -1.884 1.00 0.00 C ATOM 876 O SER A 56 -2.278 4.286 -1.026 1.00 0.00 O ATOM 877 CB SER A 56 -0.972 2.660 -3.569 1.00 0.00 C ATOM 878 OG SER A 56 -0.128 1.584 -3.951 1.00 0.00 O ATOM 0 H SER A 56 -1.085 2.229 -0.617 1.00 0.00 H new ATOM 0 HA SER A 56 0.509 3.810 -2.462 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.984 2.290 -3.407 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.025 3.388 -4.378 1.00 0.00 H new ATOM 0 HG SER A 56 -0.478 1.167 -4.766 1.00 0.00 H new ATOM 884 N ASP A 57 -1.264 5.640 -2.530 1.00 0.00 N ATOM 885 CA ASP A 57 -2.208 6.757 -2.461 1.00 0.00 C ATOM 886 C ASP A 57 -3.449 6.454 -3.323 1.00 0.00 C ATOM 887 O ASP A 57 -3.479 5.484 -4.082 1.00 0.00 O ATOM 888 CB ASP A 57 -1.515 8.074 -2.871 1.00 0.00 C ATOM 889 CG ASP A 57 -2.496 9.246 -2.888 1.00 0.00 C ATOM 890 OD1 ASP A 57 -2.944 9.690 -1.805 1.00 0.00 O ATOM 891 OD2 ASP A 57 -2.907 9.634 -3.999 1.00 0.00 O ATOM 0 H ASP A 57 -0.462 5.833 -3.130 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.548 6.882 -1.433 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.702 8.289 -2.177 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -1.069 7.958 -3.859 1.00 0.00 H new ATOM 896 N TRP A 58 -4.504 7.257 -3.185 1.00 0.00 N ATOM 897 CA TRP A 58 -5.746 7.101 -3.919 1.00 0.00 C ATOM 898 C TRP A 58 -5.702 7.707 -5.326 1.00 0.00 C ATOM 899 O TRP A 58 -6.033 7.042 -6.309 1.00 0.00 O ATOM 900 CB TRP A 58 -6.872 7.768 -3.117 1.00 0.00 C ATOM 901 CG TRP A 58 -8.233 7.410 -3.613 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.852 7.895 -4.714 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.112 6.388 -3.080 1.00 0.00 C ATOM 904 NE1 TRP A 58 -10.055 7.240 -4.894 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.266 6.304 -3.910 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.027 5.505 -1.987 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.294 5.387 -3.665 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.036 4.559 -1.758 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.160 4.499 -2.589 1.00 0.00 C ATOM 0 H TRP A 58 -4.512 8.050 -2.544 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.918 6.032 -4.045 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.785 7.478 -2.070 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.749 8.850 -3.160 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -8.465 8.674 -5.354 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.703 7.427 -5.659 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.179 5.557 -1.320 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.173 5.364 -4.292 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -9.945 3.870 -0.932 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -11.929 3.764 -2.400 1.00 0.00 H new ATOM 920 N ASN A 59 -5.382 8.997 -5.421 1.00 0.00 N ATOM 921 CA ASN A 59 -5.720 9.834 -6.571 1.00 0.00 C ATOM 922 C ASN A 59 -4.615 9.861 -7.612 1.00 0.00 C ATOM 923 O ASN A 59 -3.994 10.897 -7.870 1.00 0.00 O ATOM 924 CB ASN A 59 -6.180 11.230 -6.120 1.00 0.00 C ATOM 925 CG ASN A 59 -5.295 11.864 -5.061 1.00 0.00 C ATOM 926 OD1 ASN A 59 -5.783 12.195 -3.989 1.00 0.00 O ATOM 927 ND2 ASN A 59 -4.002 11.998 -5.278 1.00 0.00 N ATOM 0 H ASN A 59 -4.874 9.497 -4.691 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.570 9.379 -7.079 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -6.216 11.887 -6.989 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -7.196 11.158 -5.733 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.399 12.380 -4.549 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.604 11.719 -6.175 1.00 0.00 H new ATOM 934 N MET A 60 -4.409 8.703 -8.235 1.00 0.00 N ATOM 935 CA MET A 60 -3.516 8.566 -9.375 1.00 0.00 C ATOM 936 C MET A 60 -4.109 9.342 -10.562 1.00 0.00 C ATOM 937 O MET A 60 -5.335 9.351 -10.714 1.00 0.00 O ATOM 938 CB MET A 60 -3.399 7.083 -9.741 1.00 0.00 C ATOM 939 CG MET A 60 -2.994 6.157 -8.579 1.00 0.00 C ATOM 940 SD MET A 60 -1.390 6.455 -7.800 1.00 0.00 S ATOM 941 CE MET A 60 -1.343 4.978 -6.754 1.00 0.00 C ATOM 0 H MET A 60 -4.861 7.831 -7.959 1.00 0.00 H new ATOM 0 HA MET A 60 -2.529 8.960 -9.132 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.356 6.745 -10.138 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.667 6.978 -10.542 1.00 0.00 H new ATOM 0 HG2 MET A 60 -3.761 6.228 -7.808 1.00 0.00 H new ATOM 0 HG3 MET A 60 -3.005 5.131 -8.946 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.295 5.275 -5.706 1.00 0.00 H new ATOM 0 HE2 MET A 60 -2.242 4.385 -6.922 1.00 0.00 H new ATOM 0 HE3 MET A 60 -0.464 4.383 -7.003 1.00 0.00 H new ATOM 951 N PRO A 61 -3.300 9.928 -11.460 1.00 0.00 N ATOM 952 CA PRO A 61 -3.790 10.584 -12.670 1.00 0.00 C ATOM 953 C PRO A 61 -4.433 9.627 -13.686 1.00 0.00 C ATOM 954 O PRO A 61 -4.937 10.105 -14.706 1.00 0.00 O ATOM 955 CB PRO A 61 -2.562 11.287 -13.270 1.00 0.00 C ATOM 956 CG PRO A 61 -1.385 10.464 -12.756 1.00 0.00 C ATOM 957 CD PRO A 61 -1.866 10.110 -11.352 1.00 0.00 C ATOM 0 HA PRO A 61 -4.595 11.275 -12.419 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -2.599 11.296 -14.359 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -2.497 12.325 -12.945 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -1.204 9.578 -13.365 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -0.457 11.036 -12.742 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -1.383 9.202 -10.990 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -1.625 10.903 -10.644 1.00 0.00 H new ATOM 965 N ASN A 62 -4.394 8.303 -13.483 1.00 0.00 N ATOM 966 CA ASN A 62 -4.855 7.338 -14.475 1.00 0.00 C ATOM 967 C ASN A 62 -5.616 6.180 -13.828 1.00 0.00 C ATOM 968 O ASN A 62 -6.836 6.247 -13.683 1.00 0.00 O ATOM 969 CB ASN A 62 -3.663 6.867 -15.327 1.00 0.00 C ATOM 970 CG ASN A 62 -4.106 6.110 -16.575 1.00 0.00 C ATOM 971 OD1 ASN A 62 -5.257 5.702 -16.712 1.00 0.00 O ATOM 972 ND2 ASN A 62 -3.214 5.905 -17.520 1.00 0.00 N ATOM 0 H ASN A 62 -4.041 7.877 -12.626 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.571 7.823 -15.139 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.066 7.730 -15.621 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -3.020 6.225 -14.725 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.477 5.406 -18.370 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.260 6.245 -17.403 1.00 0.00 H new ATOM 979 N MET A 63 -4.910 5.115 -13.453 1.00 0.00 N ATOM 980 CA MET A 63 -5.470 3.986 -12.718 1.00 0.00 C ATOM 981 C MET A 63 -5.496 4.395 -11.251 1.00 0.00 C ATOM 982 O MET A 63 -4.459 4.281 -10.602 1.00 0.00 O ATOM 983 CB MET A 63 -4.621 2.724 -12.973 1.00 0.00 C ATOM 984 CG MET A 63 -5.100 1.497 -12.184 1.00 0.00 C ATOM 985 SD MET A 63 -4.182 -0.037 -12.520 1.00 0.00 S ATOM 986 CE MET A 63 -4.968 -0.535 -14.077 1.00 0.00 C ATOM 0 H MET A 63 -3.916 5.012 -13.656 1.00 0.00 H new ATOM 0 HA MET A 63 -6.481 3.739 -13.042 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.639 2.492 -14.038 1.00 0.00 H new ATOM 0 HB3 MET A 63 -3.584 2.934 -12.710 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.031 1.719 -11.119 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.154 1.329 -12.407 1.00 0.00 H new ATOM 0 HE1 MET A 63 -4.522 -1.465 -14.429 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.036 -0.683 -13.915 1.00 0.00 H new ATOM 0 HE3 MET A 63 -4.820 0.244 -14.825 1.00 0.00 H new ATOM 996 N ASP A 64 -6.629 4.903 -10.741 1.00 0.00 N ATOM 997 CA ASP A 64 -6.765 5.270 -9.326 1.00 0.00 C ATOM 998 C ASP A 64 -6.307 4.093 -8.463 1.00 0.00 C ATOM 999 O ASP A 64 -6.453 2.931 -8.854 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.209 5.584 -8.887 1.00 0.00 C ATOM 1001 CG ASP A 64 -8.989 6.641 -9.666 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -9.310 6.384 -10.847 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.483 7.610 -9.038 1.00 0.00 O ATOM 0 H ASP A 64 -7.470 5.069 -11.294 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.164 6.170 -9.199 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.778 4.655 -8.926 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.179 5.895 -7.843 1.00 0.00 H new ATOM 1008 N GLY A 65 -5.884 4.361 -7.229 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.560 3.317 -6.269 1.00 0.00 C ATOM 1010 C GLY A 65 -6.741 2.368 -6.031 1.00 0.00 C ATOM 1011 O GLY A 65 -6.532 1.213 -5.656 1.00 0.00 O ATOM 0 H GLY A 65 -5.758 5.308 -6.871 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.704 2.747 -6.629 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.265 3.773 -5.324 1.00 0.00 H new ATOM 1015 N LEU A 66 -7.981 2.815 -6.269 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.160 1.965 -6.158 1.00 0.00 C ATOM 1017 C LEU A 66 -9.295 1.031 -7.365 1.00 0.00 C ATOM 1018 O LEU A 66 -9.679 -0.125 -7.197 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.409 2.846 -5.930 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.571 2.216 -5.139 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.508 1.313 -5.929 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.097 1.400 -3.937 1.00 0.00 C ATOM 0 H LEU A 66 -8.188 3.775 -6.543 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.054 1.309 -5.294 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.095 3.751 -5.409 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.789 3.154 -6.904 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.126 3.104 -4.835 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.285 0.928 -5.269 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.968 1.883 -6.736 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.943 0.480 -6.348 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.960 0.981 -3.419 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.451 0.591 -4.278 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.542 2.045 -3.255 1.00 0.00 H new ATOM 1034 N GLU A 67 -8.924 1.481 -8.565 1.00 0.00 N ATOM 1035 CA GLU A 67 -8.903 0.662 -9.778 1.00 0.00 C ATOM 1036 C GLU A 67 -7.776 -0.369 -9.685 1.00 0.00 C ATOM 1037 O GLU A 67 -7.964 -1.530 -10.058 1.00 0.00 O ATOM 1038 CB GLU A 67 -8.681 1.543 -11.021 1.00 0.00 C ATOM 1039 CG GLU A 67 -9.746 2.623 -11.239 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.060 2.068 -11.788 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.723 1.230 -11.129 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -11.473 2.497 -12.888 1.00 0.00 O ATOM 0 H GLU A 67 -8.624 2.443 -8.724 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.863 0.154 -9.869 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.706 2.024 -10.939 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.647 0.902 -11.902 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.940 3.130 -10.294 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.359 3.373 -11.929 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.619 0.046 -9.156 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.479 -0.809 -8.854 1.00 0.00 C ATOM 1051 C LEU A 68 -5.926 -1.939 -7.927 1.00 0.00 C ATOM 1052 O LEU A 68 -5.761 -3.110 -8.265 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.360 0.046 -8.232 1.00 0.00 C ATOM 1054 CG LEU A 68 -3.130 -0.752 -7.761 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.387 -1.391 -8.940 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -2.187 0.180 -6.994 1.00 0.00 C ATOM 0 H LEU A 68 -6.451 1.024 -8.920 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.085 -1.265 -9.762 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.038 0.787 -8.964 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.769 0.593 -7.383 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.472 -1.557 -7.110 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.525 -1.946 -8.569 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.057 -2.071 -9.467 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.050 -0.611 -9.623 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.315 -0.381 -6.659 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.867 0.992 -7.647 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.707 0.593 -6.130 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.549 -1.589 -6.794 1.00 0.00 N ATOM 1069 CA LEU A 69 -7.140 -2.539 -5.858 1.00 0.00 C ATOM 1070 C LEU A 69 -8.092 -3.461 -6.597 1.00 0.00 C ATOM 1071 O LEU A 69 -7.894 -4.668 -6.559 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.821 -1.797 -4.695 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.969 -2.512 -3.948 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.810 -3.960 -3.454 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.260 -1.689 -2.694 1.00 0.00 C ATOM 0 H LEU A 69 -6.655 -0.618 -6.502 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.357 -3.158 -5.419 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -7.052 -1.547 -3.964 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.211 -0.856 -5.083 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.737 -2.582 -4.719 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.726 -4.277 -2.956 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.613 -4.615 -4.303 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.978 -4.016 -2.753 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.068 -2.157 -2.131 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.365 -1.642 -2.074 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.555 -0.680 -2.981 1.00 0.00 H new ATOM 1087 N LYS A 70 -9.119 -2.940 -7.266 1.00 0.00 N ATOM 1088 CA LYS A 70 -10.132 -3.803 -7.874 1.00 0.00 C ATOM 1089 C LYS A 70 -9.530 -4.733 -8.923 1.00 0.00 C ATOM 1090 O LYS A 70 -10.017 -5.857 -9.067 1.00 0.00 O ATOM 1091 CB LYS A 70 -11.274 -2.961 -8.450 1.00 0.00 C ATOM 1092 CG LYS A 70 -12.141 -2.386 -7.321 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.239 -1.455 -7.854 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.340 -1.245 -6.804 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.490 -2.149 -7.013 1.00 0.00 N ATOM 0 H LYS A 70 -9.272 -1.940 -7.400 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.543 -4.442 -7.093 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.867 -2.149 -9.053 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.887 -3.573 -9.111 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.598 -3.203 -6.763 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.509 -1.838 -6.622 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.804 -0.494 -8.128 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.672 -1.879 -8.760 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.927 -1.410 -5.809 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -14.682 -0.211 -6.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.208 -1.972 -6.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.902 -1.975 -7.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.170 -3.137 -6.953 1.00 0.00 H new ATOM 1109 N THR A 71 -8.482 -4.310 -9.624 1.00 0.00 N ATOM 1110 CA THR A 71 -7.730 -5.156 -10.533 1.00 0.00 C ATOM 1111 C THR A 71 -7.021 -6.274 -9.766 1.00 0.00 C ATOM 1112 O THR A 71 -7.172 -7.436 -10.129 1.00 0.00 O ATOM 1113 CB THR A 71 -6.789 -4.277 -11.368 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.562 -3.335 -12.098 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.997 -5.104 -12.373 1.00 0.00 C ATOM 0 H THR A 71 -8.129 -3.354 -9.573 1.00 0.00 H new ATOM 0 HA THR A 71 -8.397 -5.663 -11.230 1.00 0.00 H new ATOM 0 HB THR A 71 -6.097 -3.786 -10.684 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.796 -2.583 -11.515 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.341 -4.449 -12.947 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.397 -5.844 -11.843 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.685 -5.611 -13.049 1.00 0.00 H new ATOM 1123 N ILE A 72 -6.312 -5.967 -8.682 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.609 -6.958 -7.867 1.00 0.00 C ATOM 1125 C ILE A 72 -6.651 -7.970 -7.346 1.00 0.00 C ATOM 1126 O ILE A 72 -6.473 -9.189 -7.409 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.896 -6.191 -6.729 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.616 -5.549 -7.296 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -4.509 -7.099 -5.549 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -3.096 -4.430 -6.386 1.00 0.00 C ATOM 0 H ILE A 72 -6.208 -5.012 -8.340 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.858 -7.517 -8.425 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.592 -5.442 -6.352 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.846 -6.312 -7.412 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.819 -5.147 -8.289 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -4.012 -6.506 -4.781 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.407 -7.555 -5.131 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.834 -7.880 -5.897 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.192 -4.000 -6.818 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.857 -3.655 -6.291 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.869 -4.838 -5.401 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.780 -7.445 -6.864 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.907 -8.192 -6.328 1.00 0.00 C ATOM 1144 C ARG A 73 -9.620 -9.050 -7.368 1.00 0.00 C ATOM 1145 O ARG A 73 -10.489 -9.825 -6.964 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.909 -7.211 -5.688 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.884 -7.300 -4.161 1.00 0.00 C ATOM 1148 CD ARG A 73 -10.559 -8.569 -3.639 1.00 0.00 C ATOM 1149 NE ARG A 73 -9.584 -9.586 -3.229 1.00 0.00 N ATOM 1150 CZ ARG A 73 -9.584 -10.883 -3.540 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -10.268 -11.349 -4.580 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -8.883 -11.705 -2.775 1.00 0.00 N ATOM 0 H ARG A 73 -7.935 -6.437 -6.838 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.506 -8.880 -5.584 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.672 -6.193 -5.998 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.914 -7.428 -6.050 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.851 -7.273 -3.815 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -10.384 -6.427 -3.741 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.197 -8.317 -2.792 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -11.206 -8.980 -4.414 1.00 0.00 H new ATOM 0 HE ARG A 73 -8.818 -9.264 -2.638 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.810 -10.710 -5.162 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -10.251 -12.346 -4.796 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.364 -11.340 -1.976 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -8.861 -12.703 -2.985 1.00 0.00 H new ATOM 1166 N ALA A 74 -9.278 -8.951 -8.657 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.816 -9.827 -9.685 1.00 0.00 C ATOM 1168 C ALA A 74 -9.464 -11.290 -9.421 1.00 0.00 C ATOM 1169 O ALA A 74 -10.126 -12.162 -9.988 1.00 0.00 O ATOM 1170 CB ALA A 74 -9.295 -9.425 -11.065 1.00 0.00 C ATOM 0 H ALA A 74 -8.619 -8.258 -9.010 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.901 -9.721 -9.659 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.710 -10.093 -11.819 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.596 -8.400 -11.283 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.207 -9.494 -11.078 1.00 0.00 H new ATOM 1176 N ASP A 75 -8.478 -11.566 -8.555 1.00 0.00 N ATOM 1177 CA ASP A 75 -8.051 -12.904 -8.146 1.00 0.00 C ATOM 1178 C ASP A 75 -7.493 -13.706 -9.329 1.00 0.00 C ATOM 1179 O ASP A 75 -7.398 -13.201 -10.448 1.00 0.00 O ATOM 1180 CB ASP A 75 -9.155 -13.579 -7.298 1.00 0.00 C ATOM 1181 CG ASP A 75 -9.225 -15.112 -7.331 1.00 0.00 C ATOM 1182 OD1 ASP A 75 -8.383 -15.787 -6.697 1.00 0.00 O ATOM 1183 OD2 ASP A 75 -10.149 -15.656 -7.979 1.00 0.00 O ATOM 0 H ASP A 75 -7.936 -10.829 -8.104 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.194 -12.845 -7.475 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -9.022 -13.269 -6.262 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -10.119 -13.190 -7.626 1.00 0.00 H new ATOM 1188 N GLY A 76 -6.976 -14.905 -9.077 1.00 0.00 N ATOM 1189 CA GLY A 76 -6.354 -15.752 -10.079 1.00 0.00 C ATOM 1190 C GLY A 76 -4.938 -15.308 -10.438 1.00 0.00 C ATOM 1191 O GLY A 76 -4.244 -16.056 -11.129 1.00 0.00 O ATOM 0 H GLY A 76 -6.980 -15.321 -8.146 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.325 -16.778 -9.713 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.968 -15.752 -10.979 1.00 0.00 H new ATOM 1195 N ALA A 77 -4.485 -14.136 -9.975 1.00 0.00 N ATOM 1196 CA ALA A 77 -3.157 -13.614 -10.324 1.00 0.00 C ATOM 1197 C ALA A 77 -2.486 -12.769 -9.236 1.00 0.00 C ATOM 1198 O ALA A 77 -1.255 -12.688 -9.212 1.00 0.00 O ATOM 1199 CB ALA A 77 -3.266 -12.786 -11.612 1.00 0.00 C ATOM 0 H ALA A 77 -5.021 -13.529 -9.355 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.519 -14.488 -10.453 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -2.284 -12.395 -11.877 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -3.636 -13.417 -12.420 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -3.956 -11.957 -11.454 1.00 0.00 H new ATOM 1205 N MET A 78 -3.261 -12.102 -8.375 1.00 0.00 N ATOM 1206 CA MET A 78 -2.761 -11.121 -7.404 1.00 0.00 C ATOM 1207 C MET A 78 -3.567 -11.166 -6.098 1.00 0.00 C ATOM 1208 O MET A 78 -3.389 -10.318 -5.230 1.00 0.00 O ATOM 1209 CB MET A 78 -2.843 -9.708 -8.014 1.00 0.00 C ATOM 1210 CG MET A 78 -2.210 -9.583 -9.406 1.00 0.00 C ATOM 1211 SD MET A 78 -2.259 -7.916 -10.101 1.00 0.00 S ATOM 1212 CE MET A 78 -2.217 -8.343 -11.862 1.00 0.00 C ATOM 0 H MET A 78 -4.272 -12.230 -8.332 1.00 0.00 H new ATOM 0 HA MET A 78 -1.725 -11.368 -7.171 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.890 -9.412 -8.076 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.353 -9.005 -7.340 1.00 0.00 H new ATOM 0 HG2 MET A 78 -1.172 -9.910 -9.350 1.00 0.00 H new ATOM 0 HG3 MET A 78 -2.722 -10.263 -10.087 1.00 0.00 H new ATOM 0 HE1 MET A 78 -2.115 -7.434 -12.455 1.00 0.00 H new ATOM 0 HE2 MET A 78 -1.369 -9.000 -12.057 1.00 0.00 H new ATOM 0 HE3 MET A 78 -3.141 -8.852 -12.135 1.00 0.00 H new ATOM 1222 N SER A 79 -4.478 -12.130 -5.973 1.00 0.00 N ATOM 1223 CA SER A 79 -5.628 -12.170 -5.078 1.00 0.00 C ATOM 1224 C SER A 79 -5.302 -11.684 -3.666 1.00 0.00 C ATOM 1225 O SER A 79 -5.943 -10.759 -3.159 1.00 0.00 O ATOM 1226 CB SER A 79 -6.147 -13.620 -5.052 1.00 0.00 C ATOM 1227 OG SER A 79 -5.846 -14.307 -6.260 1.00 0.00 O ATOM 0 H SER A 79 -4.424 -12.973 -6.545 1.00 0.00 H new ATOM 0 HA SER A 79 -6.390 -11.487 -5.452 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.702 -14.151 -4.211 1.00 0.00 H new ATOM 0 HB3 SER A 79 -7.225 -13.618 -4.893 1.00 0.00 H new ATOM 0 HG SER A 79 -6.188 -15.224 -6.209 1.00 0.00 H new ATOM 1233 N ALA A 80 -4.321 -12.323 -3.025 1.00 0.00 N ATOM 1234 CA ALA A 80 -4.038 -12.119 -1.618 1.00 0.00 C ATOM 1235 C ALA A 80 -3.314 -10.805 -1.316 1.00 0.00 C ATOM 1236 O ALA A 80 -3.200 -10.483 -0.133 1.00 0.00 O ATOM 1237 CB ALA A 80 -3.218 -13.303 -1.102 1.00 0.00 C ATOM 0 H ALA A 80 -3.703 -12.997 -3.476 1.00 0.00 H new ATOM 0 HA ALA A 80 -4.997 -12.053 -1.104 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -2.999 -13.160 -0.044 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -3.786 -14.224 -1.234 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.284 -13.369 -1.660 1.00 0.00 H new ATOM 1243 N LEU A 81 -2.824 -10.062 -2.315 1.00 0.00 N ATOM 1244 CA LEU A 81 -1.990 -8.881 -2.088 1.00 0.00 C ATOM 1245 C LEU A 81 -2.721 -7.868 -1.198 1.00 0.00 C ATOM 1246 O LEU A 81 -3.765 -7.365 -1.621 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.611 -8.195 -3.410 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.329 -8.704 -4.086 1.00 0.00 C ATOM 1249 CD1 LEU A 81 -0.095 -7.931 -5.393 1.00 0.00 C ATOM 1250 CD2 LEU A 81 0.904 -8.522 -3.187 1.00 0.00 C ATOM 0 H LEU A 81 -2.995 -10.263 -3.300 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.081 -9.222 -1.593 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.439 -8.314 -4.109 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.501 -7.127 -3.224 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.463 -9.768 -4.281 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.815 -8.293 -5.872 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.942 -8.083 -6.062 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.008 -6.868 -5.174 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.789 -8.895 -3.703 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.035 -7.464 -2.959 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.764 -9.078 -2.260 1.00 0.00 H new ATOM 1262 N PRO A 82 -2.208 -7.539 0.000 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.772 -6.501 0.846 1.00 0.00 C ATOM 1264 C PRO A 82 -2.525 -5.135 0.196 1.00 0.00 C ATOM 1265 O PRO A 82 -1.417 -4.590 0.275 1.00 0.00 O ATOM 1266 CB PRO A 82 -2.083 -6.653 2.199 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.732 -7.276 1.857 1.00 0.00 C ATOM 1268 CD PRO A 82 -1.017 -8.112 0.616 1.00 0.00 C ATOM 0 HA PRO A 82 -3.851 -6.584 0.975 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.964 -5.691 2.697 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.658 -7.291 2.871 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.021 -6.513 1.660 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -0.357 -7.891 2.675 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.172 -8.086 -0.073 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.181 -9.157 0.880 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.548 -4.583 -0.459 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.553 -3.182 -0.864 1.00 0.00 C ATOM 1278 C VAL A 83 -3.930 -2.345 0.351 1.00 0.00 C ATOM 1279 O VAL A 83 -4.902 -2.669 1.050 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.476 -2.894 -2.066 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -3.692 -2.906 -3.376 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.633 -3.880 -2.219 1.00 0.00 C ATOM 0 H VAL A 83 -4.391 -5.094 -0.721 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.556 -2.916 -1.215 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.892 -1.909 -1.856 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.368 -2.700 -4.206 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.915 -2.142 -3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.233 -3.884 -3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.232 -3.606 -3.087 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.238 -4.887 -2.354 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -6.256 -3.852 -1.325 1.00 0.00 H new ATOM 1292 N LEU A 84 -3.151 -1.298 0.628 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.273 -0.464 1.816 1.00 0.00 C ATOM 1294 C LEU A 84 -3.272 0.996 1.382 1.00 0.00 C ATOM 1295 O LEU A 84 -2.264 1.485 0.874 1.00 0.00 O ATOM 1296 CB LEU A 84 -2.129 -0.787 2.794 1.00 0.00 C ATOM 1297 CG LEU A 84 -2.155 0.046 4.090 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.534 0.044 4.760 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -1.128 -0.500 5.090 1.00 0.00 C ATOM 0 H LEU A 84 -2.396 -1.001 0.010 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.207 -0.663 2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.175 -1.845 3.054 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.177 -0.624 2.289 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.912 1.070 3.807 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.498 0.645 5.669 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.271 0.464 4.076 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.814 -0.979 5.012 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.155 0.096 6.002 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.367 -1.537 5.327 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.131 -0.448 4.652 1.00 0.00 H new ATOM 1311 N MET A 85 -4.414 1.664 1.551 1.00 0.00 N ATOM 1312 CA MET A 85 -4.628 3.013 1.041 1.00 0.00 C ATOM 1313 C MET A 85 -4.040 4.023 2.026 1.00 0.00 C ATOM 1314 O MET A 85 -4.690 4.339 3.021 1.00 0.00 O ATOM 1315 CB MET A 85 -6.127 3.272 0.782 1.00 0.00 C ATOM 1316 CG MET A 85 -6.780 2.254 -0.166 1.00 0.00 C ATOM 1317 SD MET A 85 -5.876 1.862 -1.694 1.00 0.00 S ATOM 1318 CE MET A 85 -5.617 3.512 -2.403 1.00 0.00 C ATOM 0 H MET A 85 -5.218 1.280 2.048 1.00 0.00 H new ATOM 0 HA MET A 85 -4.119 3.125 0.084 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.658 3.260 1.734 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.246 4.272 0.364 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.934 1.326 0.385 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.766 2.629 -0.441 1.00 0.00 H new ATOM 0 HE1 MET A 85 -4.860 3.457 -3.185 1.00 0.00 H new ATOM 0 HE2 MET A 85 -6.552 3.876 -2.828 1.00 0.00 H new ATOM 0 HE3 MET A 85 -5.283 4.195 -1.622 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.819 4.495 1.790 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.126 5.487 2.606 1.00 0.00 C ATOM 1330 C VAL A 86 -2.282 6.819 1.875 1.00 0.00 C ATOM 1331 O VAL A 86 -1.711 6.992 0.802 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.651 5.068 2.812 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.109 6.053 3.707 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.536 3.687 3.477 1.00 0.00 C ATOM 0 H VAL A 86 -2.263 4.184 0.993 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.543 5.574 3.609 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.218 5.051 1.812 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.140 5.718 3.823 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.098 7.043 3.250 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.370 6.100 4.685 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.516 3.431 3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.023 3.711 4.452 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.019 2.939 2.848 1.00 0.00 H new ATOM 1344 N THR A 87 -3.099 7.746 2.380 1.00 0.00 N ATOM 1345 CA THR A 87 -3.494 8.925 1.613 1.00 0.00 C ATOM 1346 C THR A 87 -3.869 10.087 2.539 1.00 0.00 C ATOM 1347 O THR A 87 -4.098 9.901 3.736 1.00 0.00 O ATOM 1348 CB THR A 87 -4.647 8.504 0.674 1.00 0.00 C ATOM 1349 OG1 THR A 87 -4.997 9.541 -0.216 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.908 8.068 1.433 1.00 0.00 C ATOM 0 H THR A 87 -3.499 7.701 3.317 1.00 0.00 H new ATOM 0 HA THR A 87 -2.664 9.295 1.012 1.00 0.00 H new ATOM 0 HB THR A 87 -4.265 7.649 0.117 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.217 9.784 -0.758 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.682 7.784 0.720 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.672 7.216 2.071 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.266 8.894 2.048 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.996 11.294 1.983 1.00 0.00 N ATOM 1359 CA ALA A 88 -4.642 12.415 2.652 1.00 0.00 C ATOM 1360 C ALA A 88 -6.169 12.320 2.579 1.00 0.00 C ATOM 1361 O ALA A 88 -6.859 12.984 3.356 1.00 0.00 O ATOM 1362 CB ALA A 88 -4.200 13.713 1.974 1.00 0.00 C ATOM 0 H ALA A 88 -3.650 11.518 1.050 1.00 0.00 H new ATOM 0 HA ALA A 88 -4.350 12.396 3.702 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.677 14.561 2.466 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.117 13.812 2.049 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.491 13.692 0.924 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.701 11.556 1.626 1.00 0.00 N ATOM 1369 CA GLU A 89 -8.093 11.601 1.204 1.00 0.00 C ATOM 1370 C GLU A 89 -8.991 10.905 2.226 1.00 0.00 C ATOM 1371 O GLU A 89 -9.188 9.693 2.180 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.220 10.978 -0.194 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.458 11.804 -1.245 1.00 0.00 C ATOM 1374 CD GLU A 89 -8.030 13.216 -1.415 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.270 13.381 -1.393 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -7.261 14.193 -1.567 1.00 0.00 O ATOM 0 H GLU A 89 -6.153 10.867 1.111 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.426 12.637 1.148 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.832 9.960 -0.177 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.272 10.914 -0.472 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.409 11.873 -0.956 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.491 11.285 -2.203 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.558 11.676 3.151 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.506 11.213 4.160 1.00 0.00 C ATOM 1385 C ALA A 90 -11.951 11.144 3.639 1.00 0.00 C ATOM 1386 O ALA A 90 -12.884 11.116 4.449 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.431 12.144 5.372 1.00 0.00 C ATOM 0 H ALA A 90 -9.363 12.675 3.221 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.227 10.196 4.435 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.135 11.808 6.133 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.421 12.129 5.781 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.684 13.159 5.067 1.00 0.00 H new ATOM 1393 N LYS A 91 -12.156 11.199 2.318 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.469 11.190 1.683 1.00 0.00 C ATOM 1395 C LYS A 91 -14.227 9.965 2.176 1.00 0.00 C ATOM 1396 O LYS A 91 -13.763 8.849 1.939 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.297 11.143 0.152 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.574 11.537 -0.597 1.00 0.00 C ATOM 1399 CD LYS A 91 -14.708 13.077 -0.636 1.00 0.00 C ATOM 1400 CE LYS A 91 -16.101 13.641 -0.327 1.00 0.00 C ATOM 1401 NZ LYS A 91 -17.126 13.225 -1.299 1.00 0.00 N ATOM 0 H LYS A 91 -11.389 11.252 1.647 1.00 0.00 H new ATOM 0 HA LYS A 91 -14.028 12.091 1.937 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.488 11.813 -0.140 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -13.001 10.137 -0.146 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.548 11.140 -1.612 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.443 11.100 -0.106 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -14.000 13.501 0.076 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -14.410 13.422 -1.626 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -16.403 13.319 0.670 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.049 14.730 -0.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -17.973 12.899 -0.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -17.375 14.031 -1.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.754 12.451 -1.886 1.00 0.00 H new ATOM 1415 N LYS A 92 -15.375 10.127 2.844 1.00 0.00 N ATOM 1416 CA LYS A 92 -16.088 8.948 3.337 1.00 0.00 C ATOM 1417 C LYS A 92 -16.403 8.009 2.182 1.00 0.00 C ATOM 1418 O LYS A 92 -16.155 6.819 2.323 1.00 0.00 O ATOM 1419 CB LYS A 92 -17.357 9.289 4.129 1.00 0.00 C ATOM 1420 CG LYS A 92 -17.102 9.428 5.635 1.00 0.00 C ATOM 1421 CD LYS A 92 -16.327 10.691 6.021 1.00 0.00 C ATOM 1422 CE LYS A 92 -16.273 10.811 7.549 1.00 0.00 C ATOM 1423 NZ LYS A 92 -15.742 12.126 7.962 1.00 0.00 N ATOM 0 H LYS A 92 -15.814 11.024 3.049 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.423 8.449 4.042 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -17.777 10.221 3.749 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -18.103 8.512 3.962 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -18.059 9.428 6.157 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -16.549 8.555 5.982 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -15.317 10.650 5.613 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -16.808 11.571 5.593 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -17.272 10.673 7.963 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -15.646 10.018 7.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -15.717 12.180 9.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -14.780 12.246 7.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -16.355 12.880 7.591 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.861 8.505 1.031 1.00 0.00 N ATOM 1438 CA GLU A 93 -17.159 7.615 -0.087 1.00 0.00 C ATOM 1439 C GLU A 93 -15.925 6.844 -0.553 1.00 0.00 C ATOM 1440 O GLU A 93 -16.084 5.717 -1.020 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.721 8.375 -1.290 1.00 0.00 C ATOM 1442 CG GLU A 93 -19.036 9.097 -0.987 1.00 0.00 C ATOM 1443 CD GLU A 93 -18.814 10.585 -0.755 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -18.070 10.971 0.174 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -19.367 11.412 -1.521 1.00 0.00 O ATOM 0 H GLU A 93 -17.030 9.495 0.852 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.906 6.917 0.290 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -16.984 9.103 -1.628 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -17.879 7.676 -2.112 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.729 8.956 -1.816 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.500 8.655 -0.105 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.718 7.408 -0.402 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.485 6.677 -0.681 1.00 0.00 C ATOM 1454 C ASN A 94 -13.304 5.559 0.347 1.00 0.00 C ATOM 1455 O ASN A 94 -12.961 4.441 -0.026 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.202 7.518 -0.658 1.00 0.00 C ATOM 1457 CG ASN A 94 -11.959 8.411 -1.863 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -12.819 8.612 -2.721 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -10.770 8.983 -1.910 1.00 0.00 N ATOM 0 H ASN A 94 -14.575 8.368 -0.088 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.613 6.309 -1.699 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -12.220 8.145 0.234 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.352 6.843 -0.556 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -10.538 9.616 -2.676 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -10.083 8.792 -1.181 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.513 5.834 1.644 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.448 4.802 2.685 1.00 0.00 C ATOM 1468 C ILE A 95 -14.421 3.665 2.333 1.00 0.00 C ATOM 1469 O ILE A 95 -14.011 2.499 2.387 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.671 5.379 4.113 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.407 6.064 4.691 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -14.072 4.258 5.100 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -12.152 7.493 4.196 1.00 0.00 C ATOM 0 H ILE A 95 -13.729 6.767 1.995 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.439 4.391 2.711 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.464 6.119 4.007 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.489 6.083 5.778 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.539 5.452 4.447 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.223 4.684 6.092 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.996 3.789 4.762 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.280 3.510 5.143 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.245 7.882 4.659 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.032 7.487 3.113 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.997 8.127 4.464 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.674 3.989 1.977 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.661 3.010 1.523 1.00 0.00 C ATOM 1487 C ILE A 96 -16.064 2.262 0.336 1.00 0.00 C ATOM 1488 O ILE A 96 -16.006 1.039 0.374 1.00 0.00 O ATOM 1489 CB ILE A 96 -18.036 3.658 1.186 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.890 3.947 2.441 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.905 2.737 0.309 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.541 5.252 3.141 1.00 0.00 C ATOM 0 H ILE A 96 -16.028 4.945 1.998 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.877 2.309 2.329 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.775 4.583 0.672 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.941 3.970 2.155 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.770 3.125 3.147 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.855 3.227 0.097 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.386 2.531 -0.627 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.089 1.801 0.836 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -19.184 5.381 4.011 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.499 5.226 3.461 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.689 6.085 2.453 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.630 2.974 -0.706 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.143 2.395 -1.944 1.00 0.00 C ATOM 1506 C ALA A 97 -14.043 1.383 -1.659 1.00 0.00 C ATOM 1507 O ALA A 97 -14.112 0.273 -2.168 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.650 3.491 -2.889 1.00 0.00 C ATOM 0 H ALA A 97 -15.610 3.994 -0.705 1.00 0.00 H new ATOM 0 HA ALA A 97 -15.965 1.873 -2.433 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.288 3.039 -3.813 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.470 4.172 -3.115 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -13.840 4.044 -2.414 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.058 1.732 -0.828 1.00 0.00 N ATOM 1515 CA ALA A 98 -12.004 0.826 -0.400 1.00 0.00 C ATOM 1516 C ALA A 98 -12.592 -0.408 0.269 1.00 0.00 C ATOM 1517 O ALA A 98 -12.245 -1.521 -0.117 1.00 0.00 O ATOM 1518 CB ALA A 98 -11.046 1.543 0.551 1.00 0.00 C ATOM 0 H ALA A 98 -12.974 2.668 -0.431 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.448 0.503 -1.280 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.261 0.854 0.865 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.598 2.396 0.041 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.595 1.891 1.426 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.445 -0.234 1.278 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.979 -1.351 2.041 1.00 0.00 C ATOM 1526 C ALA A 99 -14.767 -2.300 1.125 1.00 0.00 C ATOM 1527 O ALA A 99 -14.543 -3.511 1.162 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.828 -0.802 3.200 1.00 0.00 C ATOM 0 H ALA A 99 -13.780 0.679 1.584 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.168 -1.941 2.468 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.233 -1.632 3.779 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.206 -0.180 3.844 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.647 -0.204 2.800 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.621 -1.743 0.265 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.411 -2.427 -0.755 1.00 0.00 C ATOM 1536 C GLN A 100 -15.513 -3.161 -1.753 1.00 0.00 C ATOM 1537 O GLN A 100 -15.737 -4.338 -2.052 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.276 -1.385 -1.487 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.417 -0.814 -0.627 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.480 -1.852 -0.298 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -19.856 -2.663 -1.140 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -20.039 -1.835 0.894 1.00 0.00 N ATOM 0 H GLN A 100 -15.789 -0.737 0.264 1.00 0.00 H new ATOM 0 HA GLN A 100 -17.045 -3.172 -0.274 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.639 -0.566 -1.819 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.700 -1.842 -2.381 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -18.004 -0.417 0.300 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.880 0.021 -1.153 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.727 -1.162 1.594 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.784 -2.495 1.117 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.504 -2.471 -2.290 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.543 -3.018 -3.224 1.00 0.00 C ATOM 1553 C ALA A 101 -12.746 -4.163 -2.603 1.00 0.00 C ATOM 1554 O ALA A 101 -12.372 -5.073 -3.335 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.605 -1.904 -3.673 1.00 0.00 C ATOM 0 H ALA A 101 -14.337 -1.488 -2.074 1.00 0.00 H new ATOM 0 HA ALA A 101 -14.079 -3.425 -4.082 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.876 -2.304 -4.377 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -13.182 -1.115 -4.156 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -12.086 -1.494 -2.807 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.507 -4.131 -1.290 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.811 -5.179 -0.556 1.00 0.00 C ATOM 1563 C GLY A 102 -10.481 -4.731 0.038 1.00 0.00 C ATOM 1564 O GLY A 102 -9.681 -5.595 0.394 1.00 0.00 O ATOM 0 H GLY A 102 -12.801 -3.355 -0.697 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.455 -5.537 0.247 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.635 -6.022 -1.224 1.00 0.00 H new ATOM 1568 N ALA A 103 -10.207 -3.424 0.142 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.880 -2.926 0.496 1.00 0.00 C ATOM 1570 C ALA A 103 -8.519 -3.451 1.870 1.00 0.00 C ATOM 1571 O ALA A 103 -9.359 -3.394 2.779 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.808 -1.393 0.515 1.00 0.00 C ATOM 0 H ALA A 103 -10.897 -2.690 -0.017 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.181 -3.275 -0.264 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.799 -1.079 0.784 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -9.057 -1.005 -0.473 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.516 -1.005 1.247 1.00 0.00 H new ATOM 1578 N SER A 104 -7.282 -3.907 2.046 1.00 0.00 N ATOM 1579 CA SER A 104 -6.871 -4.484 3.310 1.00 0.00 C ATOM 1580 C SER A 104 -6.857 -3.423 4.419 1.00 0.00 C ATOM 1581 O SER A 104 -6.978 -3.749 5.609 1.00 0.00 O ATOM 1582 CB SER A 104 -5.537 -5.198 3.127 1.00 0.00 C ATOM 1583 OG SER A 104 -4.441 -4.306 3.078 1.00 0.00 O ATOM 0 H SER A 104 -6.555 -3.886 1.331 1.00 0.00 H new ATOM 0 HA SER A 104 -7.594 -5.232 3.635 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.391 -5.901 3.947 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.566 -5.782 2.207 1.00 0.00 H new ATOM 0 HG SER A 104 -4.491 -3.772 2.258 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.808 -2.138 4.055 1.00 0.00 N ATOM 1590 CA GLY A 105 -7.075 -1.081 4.995 1.00 0.00 C ATOM 1591 C GLY A 105 -7.025 0.297 4.372 1.00 0.00 C ATOM 1592 O GLY A 105 -6.670 0.457 3.201 1.00 0.00 O ATOM 0 H GLY A 105 -6.584 -1.819 3.112 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -8.059 -1.237 5.438 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -6.349 -1.133 5.806 1.00 0.00 H new ATOM 1596 N TYR A 106 -7.334 1.278 5.214 1.00 0.00 N ATOM 1597 CA TYR A 106 -7.297 2.690 4.907 1.00 0.00 C ATOM 1598 C TYR A 106 -6.484 3.372 6.002 1.00 0.00 C ATOM 1599 O TYR A 106 -6.630 3.056 7.185 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.731 3.234 4.845 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.913 4.342 3.831 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.284 5.587 4.002 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.714 4.117 2.700 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.453 6.598 3.043 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.898 5.130 1.745 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.263 6.377 1.910 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.447 7.366 0.997 1.00 0.00 O ATOM 0 H TYR A 106 -7.630 1.093 6.172 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.833 2.880 3.939 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.411 2.417 4.604 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -9.014 3.604 5.830 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.670 5.766 4.872 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -10.192 3.158 2.564 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -7.960 7.550 3.174 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.526 4.953 0.884 1.00 0.00 H new ATOM 0 HH TYR A 106 -9.152 8.220 1.376 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.626 4.302 5.608 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.710 5.064 6.433 1.00 0.00 C ATOM 1619 C VAL A 107 -4.809 6.496 5.912 1.00 0.00 C ATOM 1620 O VAL A 107 -4.061 6.911 5.031 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.309 4.415 6.368 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.215 5.254 7.021 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -3.289 3.082 7.122 1.00 0.00 C ATOM 0 H VAL A 107 -5.549 4.561 4.624 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.944 5.073 7.497 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.114 4.305 5.301 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.260 4.736 6.937 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.149 6.220 6.520 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.453 5.407 8.074 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -2.292 2.645 7.062 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.548 3.251 8.167 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.012 2.400 6.675 1.00 0.00 H new ATOM 1633 N VAL A 108 -5.792 7.241 6.423 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.822 8.680 6.213 1.00 0.00 C ATOM 1635 C VAL A 108 -4.681 9.267 7.049 1.00 0.00 C ATOM 1636 O VAL A 108 -4.414 8.782 8.157 1.00 0.00 O ATOM 1637 CB VAL A 108 -7.175 9.286 6.627 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -7.277 10.766 6.246 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -8.376 8.589 5.970 1.00 0.00 C ATOM 0 H VAL A 108 -6.565 6.873 6.977 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.697 8.914 5.156 1.00 0.00 H new ATOM 0 HB VAL A 108 -7.210 9.150 7.708 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -8.247 11.155 6.556 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.485 11.325 6.744 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.171 10.872 5.166 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -9.299 9.064 6.303 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -8.296 8.671 4.886 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -8.386 7.537 6.254 1.00 0.00 H new ATOM 1649 N LYS A 109 -4.041 10.322 6.543 1.00 0.00 N ATOM 1650 CA LYS A 109 -3.101 11.145 7.291 1.00 0.00 C ATOM 1651 C LYS A 109 -3.749 11.659 8.590 1.00 0.00 C ATOM 1652 O LYS A 109 -4.960 11.897 8.601 1.00 0.00 O ATOM 1653 CB LYS A 109 -2.577 12.270 6.366 1.00 0.00 C ATOM 1654 CG LYS A 109 -3.482 13.508 6.200 1.00 0.00 C ATOM 1655 CD LYS A 109 -3.252 14.562 7.297 1.00 0.00 C ATOM 1656 CE LYS A 109 -3.981 15.868 6.982 1.00 0.00 C ATOM 1657 NZ LYS A 109 -3.693 16.902 7.999 1.00 0.00 N ATOM 0 H LYS A 109 -4.167 10.632 5.579 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.239 10.558 7.608 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.612 12.603 6.748 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.399 11.844 5.379 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -3.299 13.959 5.225 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -4.526 13.195 6.216 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -3.598 14.173 8.255 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.184 14.756 7.399 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -3.679 16.228 5.999 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -5.055 15.686 6.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.202 17.777 7.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -4.004 16.566 8.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -2.671 17.091 8.022 1.00 0.00 H new ATOM 1671 N PRO A 110 -2.969 11.986 9.633 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.549 11.708 9.752 1.00 0.00 C ATOM 1673 C PRO A 110 -1.344 10.222 10.059 1.00 0.00 C ATOM 1674 O PRO A 110 -2.132 9.605 10.786 1.00 0.00 O ATOM 1675 CB PRO A 110 -1.069 12.597 10.896 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.287 12.637 11.818 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.463 12.624 10.843 1.00 0.00 C ATOM 0 HA PRO A 110 -0.992 11.915 8.838 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.195 12.179 11.396 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.791 13.592 10.548 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.312 11.779 12.490 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.291 13.531 12.442 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.308 12.074 11.257 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.811 13.636 10.637 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.265 9.656 9.531 1.00 0.00 N ATOM 1686 CA PHE A 111 0.103 8.262 9.715 1.00 0.00 C ATOM 1687 C PHE A 111 1.574 8.156 10.096 1.00 0.00 C ATOM 1688 O PHE A 111 2.399 9.000 9.740 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.258 7.446 8.465 1.00 0.00 C ATOM 1690 CG PHE A 111 0.120 8.062 7.128 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.464 8.125 6.711 1.00 0.00 C ATOM 1692 CD2 PHE A 111 -0.887 8.587 6.296 1.00 0.00 C ATOM 1693 CE1 PHE A 111 1.793 8.742 5.491 1.00 0.00 C ATOM 1694 CE2 PHE A 111 -0.558 9.207 5.081 1.00 0.00 C ATOM 1695 CZ PHE A 111 0.787 9.297 4.686 1.00 0.00 C ATOM 0 H PHE A 111 0.395 10.171 8.947 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.467 7.834 10.540 1.00 0.00 H new ATOM 0 HB2 PHE A 111 0.224 6.471 8.541 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.334 7.271 8.469 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.242 7.700 7.328 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.922 8.512 6.596 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.824 8.789 5.173 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -1.336 9.614 4.452 1.00 0.00 H new ATOM 0 HZ PHE A 111 1.047 9.793 3.763 1.00 0.00 H new ATOM 1705 N THR A 112 1.874 7.108 10.848 1.00 0.00 N ATOM 1706 CA THR A 112 3.087 6.900 11.621 1.00 0.00 C ATOM 1707 C THR A 112 3.398 5.398 11.636 1.00 0.00 C ATOM 1708 O THR A 112 2.558 4.595 11.217 1.00 0.00 O ATOM 1709 CB THR A 112 2.864 7.500 13.027 1.00 0.00 C ATOM 1710 OG1 THR A 112 1.540 7.264 13.491 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.131 9.003 13.025 1.00 0.00 C ATOM 0 H THR A 112 1.228 6.324 10.940 1.00 0.00 H new ATOM 0 HA THR A 112 3.953 7.400 11.188 1.00 0.00 H new ATOM 0 HB THR A 112 3.566 7.006 13.699 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.432 7.654 14.383 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.967 9.403 14.026 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.162 9.189 12.724 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.454 9.492 12.324 1.00 0.00 H new ATOM 1719 N ALA A 113 4.581 4.991 12.106 1.00 0.00 N ATOM 1720 CA ALA A 113 4.944 3.580 12.198 1.00 0.00 C ATOM 1721 C ALA A 113 3.977 2.894 13.158 1.00 0.00 C ATOM 1722 O ALA A 113 3.555 1.774 12.889 1.00 0.00 O ATOM 1723 CB ALA A 113 6.399 3.406 12.642 1.00 0.00 C ATOM 0 H ALA A 113 5.308 5.629 12.431 1.00 0.00 H new ATOM 0 HA ALA A 113 4.866 3.117 11.214 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.637 2.344 12.700 1.00 0.00 H new ATOM 0 HB2 ALA A 113 7.060 3.887 11.920 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.538 3.863 13.622 1.00 0.00 H new ATOM 1729 N ALA A 114 3.519 3.623 14.181 1.00 0.00 N ATOM 1730 CA ALA A 114 2.485 3.198 15.112 1.00 0.00 C ATOM 1731 C ALA A 114 1.141 2.854 14.451 1.00 0.00 C ATOM 1732 O ALA A 114 0.319 2.200 15.097 1.00 0.00 O ATOM 1733 CB ALA A 114 2.274 4.315 16.131 1.00 0.00 C ATOM 0 H ALA A 114 3.875 4.557 14.385 1.00 0.00 H new ATOM 0 HA ALA A 114 2.833 2.275 15.576 1.00 0.00 H new ATOM 0 HB1 ALA A 114 1.502 4.019 16.841 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.206 4.501 16.665 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.964 5.224 15.616 1.00 0.00 H new ATOM 1739 N THR A 115 0.889 3.268 13.202 1.00 0.00 N ATOM 1740 CA THR A 115 -0.324 2.907 12.473 1.00 0.00 C ATOM 1741 C THR A 115 0.006 2.009 11.271 1.00 0.00 C ATOM 1742 O THR A 115 -0.844 1.223 10.851 1.00 0.00 O ATOM 1743 CB THR A 115 -1.131 4.174 12.116 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.505 3.939 12.315 1.00 0.00 O ATOM 1745 CG2 THR A 115 -0.996 4.650 10.666 1.00 0.00 C ATOM 0 H THR A 115 1.525 3.864 12.672 1.00 0.00 H new ATOM 0 HA THR A 115 -0.973 2.307 13.112 1.00 0.00 H new ATOM 0 HB THR A 115 -0.716 4.943 12.768 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.011 4.747 12.088 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.601 5.545 10.519 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.048 4.879 10.454 1.00 0.00 H new ATOM 0 HG23 THR A 115 -1.339 3.865 9.992 1.00 0.00 H new ATOM 1753 N LEU A 116 1.230 2.094 10.733 1.00 0.00 N ATOM 1754 CA LEU A 116 1.736 1.174 9.726 1.00 0.00 C ATOM 1755 C LEU A 116 1.713 -0.224 10.357 1.00 0.00 C ATOM 1756 O LEU A 116 1.025 -1.112 9.859 1.00 0.00 O ATOM 1757 CB LEU A 116 3.149 1.618 9.267 1.00 0.00 C ATOM 1758 CG LEU A 116 3.664 1.083 7.914 1.00 0.00 C ATOM 1759 CD1 LEU A 116 3.394 -0.404 7.749 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.097 1.825 6.699 1.00 0.00 C ATOM 0 H LEU A 116 1.900 2.817 10.994 1.00 0.00 H new ATOM 0 HA LEU A 116 1.124 1.166 8.824 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.161 2.707 9.224 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.861 1.322 10.038 1.00 0.00 H new ATOM 0 HG LEU A 116 4.739 1.263 7.944 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.773 -0.738 6.783 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.894 -0.955 8.545 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.321 -0.587 7.800 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.505 1.392 5.786 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.011 1.733 6.691 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.371 2.878 6.755 1.00 0.00 H new ATOM 1772 N GLU A 117 2.402 -0.401 11.486 1.00 0.00 N ATOM 1773 CA GLU A 117 2.523 -1.669 12.198 1.00 0.00 C ATOM 1774 C GLU A 117 1.163 -2.191 12.658 1.00 0.00 C ATOM 1775 O GLU A 117 0.946 -3.395 12.697 1.00 0.00 O ATOM 1776 CB GLU A 117 3.516 -1.523 13.364 1.00 0.00 C ATOM 1777 CG GLU A 117 2.969 -0.891 14.655 1.00 0.00 C ATOM 1778 CD GLU A 117 2.230 -1.892 15.548 1.00 0.00 C ATOM 1779 OE1 GLU A 117 2.826 -2.922 15.949 1.00 0.00 O ATOM 1780 OE2 GLU A 117 1.081 -1.619 15.955 1.00 0.00 O ATOM 0 H GLU A 117 2.906 0.360 11.942 1.00 0.00 H new ATOM 0 HA GLU A 117 2.917 -2.418 11.511 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.906 -2.512 13.606 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.359 -0.923 13.021 1.00 0.00 H new ATOM 0 HG2 GLU A 117 3.795 -0.453 15.216 1.00 0.00 H new ATOM 0 HG3 GLU A 117 2.293 -0.077 14.395 1.00 0.00 H new ATOM 1787 N GLU A 118 0.238 -1.291 12.978 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.111 -1.620 13.403 1.00 0.00 C ATOM 1789 C GLU A 118 -1.864 -2.268 12.245 1.00 0.00 C ATOM 1790 O GLU A 118 -2.515 -3.304 12.399 1.00 0.00 O ATOM 1791 CB GLU A 118 -1.767 -0.317 13.854 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.236 -0.448 14.229 1.00 0.00 C ATOM 1793 CD GLU A 118 -3.479 -1.100 15.587 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -3.029 -0.537 16.608 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -4.253 -2.088 15.629 1.00 0.00 O ATOM 0 H GLU A 118 0.415 -0.287 12.947 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.117 -2.334 14.227 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.219 0.073 14.712 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.673 0.418 13.055 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -3.689 0.543 14.228 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.745 -1.032 13.462 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.815 -1.642 11.068 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.474 -2.192 9.897 1.00 0.00 C ATOM 1804 C LYS A 119 -1.772 -3.467 9.446 1.00 0.00 C ATOM 1805 O LYS A 119 -2.491 -4.389 9.065 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.559 -1.136 8.789 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.639 -0.075 9.069 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.992 -0.401 8.405 1.00 0.00 C ATOM 1809 CE LYS A 119 -5.582 -1.753 8.840 1.00 0.00 C ATOM 1810 NZ LYS A 119 -6.861 -2.062 8.165 1.00 0.00 N ATOM 0 H LYS A 119 -1.328 -0.760 10.907 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.498 -2.467 10.150 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.591 -0.646 8.683 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.773 -1.626 7.839 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.782 0.015 10.146 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.290 0.894 8.712 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.704 0.390 8.643 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.865 -0.401 7.322 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.863 -2.544 8.626 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.738 -1.746 9.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -7.485 -2.574 8.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.320 -1.177 7.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.678 -2.653 7.329 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.435 -3.546 9.531 1.00 0.00 N ATOM 1825 CA LEU A 120 0.321 -4.772 9.289 1.00 0.00 C ATOM 1826 C LEU A 120 -0.197 -5.864 10.208 1.00 0.00 C ATOM 1827 O LEU A 120 -0.659 -6.881 9.709 1.00 0.00 O ATOM 1828 CB LEU A 120 1.837 -4.614 9.493 1.00 0.00 C ATOM 1829 CG LEU A 120 2.580 -3.819 8.409 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.057 -3.739 8.794 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.493 -4.445 7.016 1.00 0.00 C ATOM 0 H LEU A 120 0.153 -2.748 9.773 1.00 0.00 H new ATOM 0 HA LEU A 120 0.174 -5.031 8.240 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.006 -4.127 10.454 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.281 -5.607 9.556 1.00 0.00 H new ATOM 0 HG LEU A 120 2.103 -2.840 8.356 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.601 -3.177 8.035 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.155 -3.237 9.757 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.469 -4.745 8.866 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.041 -3.827 6.305 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.927 -5.445 7.039 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.449 -4.510 6.711 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.182 -5.654 11.525 1.00 0.00 N ATOM 1844 CA ASN A 121 -0.661 -6.616 12.511 1.00 0.00 C ATOM 1845 C ASN A 121 -2.059 -7.112 12.152 1.00 0.00 C ATOM 1846 O ASN A 121 -2.314 -8.314 12.150 1.00 0.00 O ATOM 1847 CB ASN A 121 -0.632 -6.002 13.916 1.00 0.00 C ATOM 1848 CG ASN A 121 -1.270 -6.942 14.931 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -0.870 -8.095 15.054 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -2.264 -6.481 15.672 1.00 0.00 N ATOM 0 H ASN A 121 0.171 -4.792 11.942 1.00 0.00 H new ATOM 0 HA ASN A 121 0.006 -7.478 12.505 1.00 0.00 H new ATOM 0 HB2 ASN A 121 0.398 -5.793 14.205 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.162 -5.050 13.912 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -2.711 -7.087 16.360 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -2.583 -5.519 15.556 1.00 0.00 H new ATOM 1857 N LYS A 122 -2.960 -6.200 11.777 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.291 -6.586 11.334 1.00 0.00 C ATOM 1859 C LYS A 122 -4.260 -7.507 10.112 1.00 0.00 C ATOM 1860 O LYS A 122 -4.968 -8.505 10.137 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.175 -5.353 11.126 1.00 0.00 C ATOM 1862 CG LYS A 122 -5.632 -4.803 12.487 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.634 -3.655 12.334 1.00 0.00 C ATOM 1864 CE LYS A 122 -5.946 -2.289 12.403 1.00 0.00 C ATOM 1865 NZ LYS A 122 -6.191 -1.625 13.698 1.00 0.00 N ATOM 0 H LYS A 122 -2.788 -5.195 11.773 1.00 0.00 H new ATOM 0 HA LYS A 122 -4.743 -7.178 12.130 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.624 -4.587 10.581 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -6.042 -5.614 10.519 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.086 -5.605 13.069 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -4.764 -4.455 13.047 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -7.156 -3.752 11.382 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.388 -3.723 13.119 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -4.873 -2.413 12.253 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -6.310 -1.656 11.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.118 -0.594 13.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.144 -1.868 14.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -5.484 -1.944 14.391 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.514 -7.231 9.039 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.511 -8.134 7.873 1.00 0.00 C ATOM 1881 C ILE A 123 -2.707 -9.423 8.105 1.00 0.00 C ATOM 1882 O ILE A 123 -3.070 -10.483 7.584 1.00 0.00 O ATOM 1883 CB ILE A 123 -3.042 -7.416 6.589 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.671 -6.727 6.730 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -4.120 -6.417 6.156 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -1.247 -5.861 5.545 1.00 0.00 C ATOM 0 H ILE A 123 -2.915 -6.410 8.948 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.550 -8.434 7.734 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.901 -8.176 5.821 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.686 -6.105 7.625 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.913 -7.494 6.887 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.798 -5.904 5.250 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.051 -6.949 5.961 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.279 -5.686 6.949 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.269 -5.423 5.746 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.192 -6.476 4.647 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.977 -5.066 5.396 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.650 -9.348 8.909 1.00 0.00 N ATOM 1899 CA PHE A 124 -0.869 -10.486 9.363 1.00 0.00 C ATOM 1900 C PHE A 124 -1.796 -11.479 10.032 1.00 0.00 C ATOM 1901 O PHE A 124 -1.759 -12.663 9.722 1.00 0.00 O ATOM 1902 CB PHE A 124 0.159 -10.033 10.399 1.00 0.00 C ATOM 1903 CG PHE A 124 1.529 -9.603 9.904 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.671 -8.696 8.837 1.00 0.00 C ATOM 1905 CD2 PHE A 124 2.683 -10.074 10.564 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.943 -8.233 8.461 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.954 -9.608 10.185 1.00 0.00 C ATOM 1908 CZ PHE A 124 4.086 -8.681 9.140 1.00 0.00 C ATOM 0 H PHE A 124 -1.305 -8.460 9.273 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.364 -10.935 8.508 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.272 -9.200 10.955 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.301 -10.849 11.107 1.00 0.00 H new ATOM 0 HD1 PHE A 124 0.796 -8.354 8.304 1.00 0.00 H new ATOM 0 HD2 PHE A 124 2.590 -10.795 11.363 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.041 -7.530 7.647 1.00 0.00 H new ATOM 0 HE2 PHE A 124 4.833 -9.965 10.701 1.00 0.00 H new ATOM 0 HZ PHE A 124 5.062 -8.314 8.860 1.00 0.00 H new ATOM 1918 N GLU A 125 -2.610 -10.995 10.966 1.00 0.00 N ATOM 1919 CA GLU A 125 -3.555 -11.816 11.686 1.00 0.00 C ATOM 1920 C GLU A 125 -4.687 -12.234 10.762 1.00 0.00 C ATOM 1921 O GLU A 125 -4.996 -13.417 10.636 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.114 -11.017 12.875 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.106 -10.843 14.015 1.00 0.00 C ATOM 1924 CD GLU A 125 -2.945 -12.142 14.793 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -2.201 -13.037 14.329 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -3.598 -12.294 15.853 1.00 0.00 O ATOM 0 H GLU A 125 -2.626 -10.013 11.240 1.00 0.00 H new ATOM 0 HA GLU A 125 -3.055 -12.712 12.053 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.431 -10.034 12.526 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.001 -11.521 13.258 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.142 -10.533 13.611 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -3.440 -10.051 14.685 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.379 -11.256 10.183 1.00 0.00 N ATOM 1934 CA LYS A 126 -6.712 -11.456 9.649 1.00 0.00 C ATOM 1935 C LYS A 126 -6.598 -12.235 8.354 1.00 0.00 C ATOM 1936 O LYS A 126 -7.229 -13.278 8.215 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.440 -10.100 9.537 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.962 -10.252 9.381 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.375 -10.583 7.942 1.00 0.00 C ATOM 1940 CE LYS A 126 -9.848 -9.416 7.059 1.00 0.00 C ATOM 1941 NZ LYS A 126 -9.089 -8.165 7.259 1.00 0.00 N ATOM 0 H LYS A 126 -5.027 -10.305 10.074 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.334 -12.054 10.314 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.228 -9.505 10.425 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -7.045 -9.550 8.683 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -9.315 -11.039 10.047 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.450 -9.328 9.692 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.527 -11.058 7.448 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -10.175 -11.322 7.982 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -9.772 -9.712 6.013 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.902 -9.225 7.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -9.359 -7.475 6.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -9.302 -7.776 8.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -8.070 -8.362 7.188 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.860 -11.693 7.380 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.678 -12.360 6.100 1.00 0.00 C ATOM 1957 C LEU A 127 -4.767 -13.577 6.281 1.00 0.00 C ATOM 1958 O LEU A 127 -4.826 -14.523 5.491 1.00 0.00 O ATOM 1959 CB LEU A 127 -5.047 -11.421 5.058 1.00 0.00 C ATOM 1960 CG LEU A 127 -5.468 -9.938 5.038 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.838 -9.204 3.851 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.985 -9.743 5.051 1.00 0.00 C ATOM 0 H LEU A 127 -5.382 -10.795 7.459 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.661 -12.666 5.742 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.966 -11.455 5.196 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.255 -11.836 4.072 1.00 0.00 H new ATOM 0 HG LEU A 127 -5.091 -9.502 5.963 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -5.151 -8.160 3.861 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.752 -9.257 3.925 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -5.162 -9.671 2.921 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -7.215 -8.678 5.036 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.421 -10.221 4.174 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.402 -10.191 5.953 1.00 0.00 H new ATOM 1974 N GLY A 128 -3.900 -13.542 7.295 1.00 0.00 N ATOM 1975 CA GLY A 128 -2.831 -14.503 7.452 1.00 0.00 C ATOM 1976 C GLY A 128 -1.653 -14.065 6.598 1.00 0.00 C ATOM 1977 O GLY A 128 -1.092 -14.908 5.902 1.00 0.00 O ATOM 0 H GLY A 128 -3.929 -12.836 8.031 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.534 -14.571 8.499 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.168 -15.495 7.151 1.00 0.00 H new ATOM 1981 N MET A 129 -1.335 -12.762 6.551 1.00 0.00 N ATOM 1982 CA MET A 129 -0.103 -12.315 5.901 1.00 0.00 C ATOM 1983 C MET A 129 1.058 -12.599 6.841 1.00 0.00 C ATOM 1984 O MET A 129 1.313 -13.793 7.121 1.00 0.00 O ATOM 1985 CB MET A 129 -0.190 -10.840 5.481 1.00 0.00 C ATOM 1986 CG MET A 129 -1.252 -10.516 4.430 1.00 0.00 C ATOM 1987 SD MET A 129 -1.228 -11.374 2.821 1.00 0.00 S ATOM 1988 CE MET A 129 -1.932 -13.015 3.167 1.00 0.00 C ATOM 1989 OXT MET A 129 1.734 -11.648 7.272 1.00 0.00 O ATOM 0 H MET A 129 -1.905 -12.015 6.949 1.00 0.00 H new ATOM 0 HA MET A 129 0.056 -12.865 4.973 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.387 -10.239 6.369 1.00 0.00 H new ATOM 0 HB3 MET A 129 0.782 -10.532 5.097 1.00 0.00 H new ATOM 0 HG2 MET A 129 -2.225 -10.703 4.883 1.00 0.00 H new ATOM 0 HG3 MET A 129 -1.194 -9.446 4.229 1.00 0.00 H new ATOM 0 HE1 MET A 129 -2.587 -13.310 2.347 1.00 0.00 H new ATOM 0 HE2 MET A 129 -1.127 -13.743 3.268 1.00 0.00 H new ATOM 0 HE3 MET A 129 -2.505 -12.977 4.094 1.00 0.00 H new TER 1999 MET A 129