USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 747 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 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc=-0.00911 X(o=-0.0091,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.54 K(o=1.5,f=-0.085) USER MOD Single : A 20 SER OG : rot 130:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0147 USER MOD Single : A 28 LYS NZ :NH3+ -174:sc= 0.649 (180deg=0.517) USER MOD Single : A 32 MET CE :methyl -127:sc= -1.15 (180deg=-1.54) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 73:sc= 1.26 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 CYS SG : rot 56:sc= -0.065 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc=-0.00675 X(o=-0.0068,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0881 X(o=-0.088,f=-0.032) USER MOD Single : A 60 ASN : amide:sc= 0.674 K(o=0.67,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 169:sc=-0.00361 (180deg=-0.169) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -174:sc=-0.00449 (180deg=-0.0607) USER MOD Single : A 72 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0454) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 1:sc= 0.336 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 165:sc= 1.49 (180deg=1.18) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.844 4.881 4.317 1.00 25.00 N ATOM 2 CA GLY A 1 4.090 5.685 4.190 1.00 25.00 C ATOM 3 C GLY A 1 4.860 5.504 2.888 1.00 25.00 C ATOM 4 O GLY A 1 4.770 4.510 2.196 1.00 25.00 O ATOM 0 H1 GLY A 1 2.397 5.076 5.236 1.00 25.00 H new ATOM 0 H2 GLY A 1 2.187 5.135 3.551 1.00 25.00 H new ATOM 0 H3 GLY A 1 3.076 3.869 4.253 1.00 25.00 H new ATOM 0 HA2 GLY A 1 3.833 6.739 4.296 1.00 25.00 H new ATOM 0 HA3 GLY A 1 4.750 5.433 5.020 1.00 25.00 H new ATOM 9 N SER A 2 5.637 6.529 2.528 1.00 25.00 N ATOM 10 CA SER A 2 6.422 6.505 1.296 1.00 25.00 C ATOM 11 C SER A 2 7.547 5.478 1.387 1.00 25.00 C ATOM 12 O SER A 2 8.444 5.598 2.221 1.00 25.00 O ATOM 13 CB SER A 2 7.021 7.885 1.038 1.00 25.00 C ATOM 14 OG SER A 2 6.002 8.873 1.053 1.00 25.00 O ATOM 0 H SER A 2 5.738 7.385 3.074 1.00 25.00 H new ATOM 0 HA SER A 2 5.760 6.228 0.476 1.00 25.00 H new ATOM 0 HB2 SER A 2 7.769 8.112 1.797 1.00 25.00 H new ATOM 0 HB3 SER A 2 7.532 7.893 0.075 1.00 25.00 H new ATOM 0 HG SER A 2 6.398 9.754 0.888 1.00 25.00 H new ATOM 20 N MET A 3 7.496 4.466 0.535 1.00 25.00 N ATOM 21 CA MET A 3 8.521 3.429 0.530 1.00 25.00 C ATOM 22 C MET A 3 9.831 3.990 -0.014 1.00 25.00 C ATOM 23 O MET A 3 9.848 4.693 -1.025 1.00 25.00 O ATOM 24 CB MET A 3 8.078 2.244 -0.329 1.00 25.00 C ATOM 25 CG MET A 3 6.809 1.572 0.174 1.00 25.00 C ATOM 26 SD MET A 3 6.369 0.164 -0.857 1.00 25.00 S ATOM 27 CE MET A 3 4.766 -0.287 -0.169 1.00 25.00 C ATOM 0 H MET A 3 6.760 4.339 -0.160 1.00 25.00 H new ATOM 0 HA MET A 3 8.671 3.089 1.555 1.00 25.00 H new ATOM 0 HB2 MET A 3 7.918 2.586 -1.351 1.00 25.00 H new ATOM 0 HB3 MET A 3 8.881 1.508 -0.361 1.00 25.00 H new ATOM 0 HG2 MET A 3 6.952 1.243 1.203 1.00 25.00 H new ATOM 0 HG3 MET A 3 5.991 2.292 0.180 1.00 25.00 H new ATOM 0 HE1 MET A 3 4.368 -1.147 -0.708 1.00 25.00 H new ATOM 0 HE2 MET A 3 4.881 -0.541 0.885 1.00 25.00 H new ATOM 0 HE3 MET A 3 4.079 0.553 -0.267 1.00 25.00 H new ATOM 37 N LYS A 4 10.926 3.671 0.663 1.00 25.00 N ATOM 38 CA LYS A 4 12.261 4.123 0.258 1.00 25.00 C ATOM 39 C LYS A 4 13.264 2.983 0.335 1.00 25.00 C ATOM 40 O LYS A 4 14.463 3.198 0.280 1.00 25.00 O ATOM 41 CB LYS A 4 12.704 5.284 1.168 1.00 25.00 C ATOM 42 CG LYS A 4 12.429 6.667 0.586 1.00 25.00 C ATOM 43 CD LYS A 4 13.353 6.953 -0.600 1.00 25.00 C ATOM 44 CE LYS A 4 13.161 8.364 -1.121 1.00 25.00 C ATOM 45 NZ LYS A 4 14.066 8.607 -2.296 1.00 25.00 N ATOM 0 H LYS A 4 10.920 3.095 1.505 1.00 25.00 H new ATOM 0 HA LYS A 4 12.219 4.466 -0.776 1.00 25.00 H new ATOM 0 HB2 LYS A 4 12.193 5.196 2.127 1.00 25.00 H new ATOM 0 HB3 LYS A 4 13.772 5.190 1.366 1.00 25.00 H new ATOM 0 HG2 LYS A 4 11.389 6.731 0.266 1.00 25.00 H new ATOM 0 HG3 LYS A 4 12.573 7.425 1.356 1.00 25.00 H new ATOM 0 HD2 LYS A 4 14.391 6.813 -0.297 1.00 25.00 H new ATOM 0 HD3 LYS A 4 13.155 6.238 -1.399 1.00 25.00 H new ATOM 0 HE2 LYS A 4 12.122 8.513 -1.415 1.00 25.00 H new ATOM 0 HE3 LYS A 4 13.376 9.084 -0.331 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 13.927 9.576 -2.646 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 15.056 8.483 -2.003 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 13.842 7.930 -3.053 1.00 25.00 H new ATOM 59 N TYR A 5 12.749 1.775 0.499 1.00 25.00 N ATOM 60 CA TYR A 5 13.578 0.606 0.752 1.00 25.00 C ATOM 61 C TYR A 5 13.130 -0.601 -0.053 1.00 25.00 C ATOM 62 O TYR A 5 12.052 -0.599 -0.641 1.00 25.00 O ATOM 63 CB TYR A 5 13.507 0.284 2.239 1.00 25.00 C ATOM 64 CG TYR A 5 14.274 1.272 3.087 1.00 25.00 C ATOM 65 CD1 TYR A 5 13.626 2.035 4.080 1.00 25.00 C ATOM 66 CD2 TYR A 5 15.664 1.448 2.906 1.00 25.00 C ATOM 67 CE1 TYR A 5 14.358 2.948 4.887 1.00 25.00 C ATOM 68 CE2 TYR A 5 16.394 2.355 3.707 1.00 25.00 C ATOM 69 CZ TYR A 5 15.738 3.093 4.694 1.00 25.00 C ATOM 70 OH TYR A 5 16.447 3.963 5.480 1.00 25.00 O ATOM 0 H TYR A 5 11.749 1.577 0.461 1.00 25.00 H new ATOM 0 HA TYR A 5 14.599 0.834 0.447 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.464 0.273 2.555 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.902 -0.718 2.409 1.00 25.00 H new ATOM 0 HD1 TYR A 5 12.562 1.925 4.229 1.00 25.00 H new ATOM 0 HD2 TYR A 5 16.177 0.880 2.144 1.00 25.00 H new ATOM 0 HE1 TYR A 5 13.853 3.527 5.646 1.00 25.00 H new ATOM 0 HE2 TYR A 5 17.456 2.477 3.556 1.00 25.00 H new ATOM 0 HH TYR A 5 17.391 3.945 5.219 1.00 25.00 H new ATOM 80 N LEU A 6 13.970 -1.630 -0.057 1.00 25.00 N ATOM 81 CA LEU A 6 13.709 -2.872 -0.789 1.00 25.00 C ATOM 82 C LEU A 6 12.506 -3.626 -0.212 1.00 25.00 C ATOM 83 O LEU A 6 11.710 -4.188 -0.954 1.00 25.00 O ATOM 84 CB LEU A 6 14.943 -3.788 -0.713 1.00 25.00 C ATOM 85 CG LEU A 6 16.298 -3.275 -1.224 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.379 -4.329 -0.922 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.274 -2.974 -2.715 1.00 25.00 C ATOM 0 H LEU A 6 14.856 -1.630 0.448 1.00 25.00 H new ATOM 0 HA LEU A 6 13.491 -2.604 -1.823 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.074 -4.073 0.331 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.709 -4.698 -1.265 1.00 25.00 H new ATOM 0 HG LEU A 6 16.521 -2.340 -0.710 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.345 -3.973 -1.281 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.432 -4.498 0.154 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.127 -5.263 -1.424 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.254 -2.614 -3.029 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.027 -3.882 -3.265 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.524 -2.210 -2.920 1.00 25.00 H new ATOM 99 N ASN A 7 12.406 -3.631 1.115 1.00 25.00 N ATOM 100 CA ASN A 7 11.321 -4.300 1.858 1.00 25.00 C ATOM 101 C ASN A 7 11.111 -5.771 1.469 1.00 25.00 C ATOM 102 O ASN A 7 9.992 -6.198 1.196 1.00 25.00 O ATOM 103 CB ASN A 7 10.013 -3.519 1.699 1.00 25.00 C ATOM 104 CG ASN A 7 10.122 -2.117 2.212 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.469 -1.889 3.358 1.00 25.00 O ATOM 106 ND2 ASN A 7 9.845 -1.168 1.372 1.00 25.00 N ATOM 0 H ASN A 7 13.082 -3.166 1.721 1.00 25.00 H new ATOM 0 HA ASN A 7 11.631 -4.307 2.903 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.731 -3.497 0.646 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.216 -4.037 2.232 1.00 25.00 H new ATOM 0 HD21 ASN A 7 9.915 -0.193 1.663 1.00 25.00 H new ATOM 0 HD22 ASN A 7 9.558 -1.397 0.420 1.00 25.00 H new ATOM 113 N VAL A 8 12.186 -6.547 1.468 1.00 25.00 N ATOM 114 CA VAL A 8 12.117 -7.972 1.128 1.00 25.00 C ATOM 115 C VAL A 8 12.256 -8.741 2.433 1.00 25.00 C ATOM 116 O VAL A 8 12.755 -8.205 3.406 1.00 25.00 O ATOM 117 CB VAL A 8 13.229 -8.382 0.083 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.766 -7.154 -0.646 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.399 -9.118 0.729 1.00 25.00 C ATOM 0 H VAL A 8 13.123 -6.217 1.699 1.00 25.00 H new ATOM 0 HA VAL A 8 11.168 -8.205 0.645 1.00 25.00 H new ATOM 0 HB VAL A 8 12.747 -9.058 -0.623 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.530 -7.460 -1.360 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.951 -6.660 -1.176 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.201 -6.463 0.076 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.133 -9.376 -0.035 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.864 -8.476 1.477 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.037 -10.029 1.206 1.00 25.00 H new ATOM 129 N LEU A 9 11.831 -9.990 2.471 1.00 25.00 N ATOM 130 CA LEU A 9 11.971 -10.792 3.687 1.00 25.00 C ATOM 131 C LEU A 9 13.220 -11.657 3.593 1.00 25.00 C ATOM 132 O LEU A 9 13.552 -12.161 2.523 1.00 25.00 O ATOM 133 CB LEU A 9 10.737 -11.675 3.888 1.00 25.00 C ATOM 134 CG LEU A 9 9.400 -10.931 4.052 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.276 -11.953 4.203 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.409 -9.989 5.260 1.00 25.00 C ATOM 0 H LEU A 9 11.390 -10.473 1.688 1.00 25.00 H new ATOM 0 HA LEU A 9 12.062 -10.122 4.542 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.654 -12.349 3.036 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.897 -12.295 4.770 1.00 25.00 H new ATOM 0 HG LEU A 9 9.243 -10.319 3.164 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.325 -11.433 4.320 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.238 -12.585 3.316 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.462 -12.571 5.081 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.445 -9.486 5.336 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.591 -10.564 6.168 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.197 -9.246 5.136 1.00 25.00 H new ATOM 148 N ALA A 10 13.904 -11.849 4.710 1.00 25.00 N ATOM 149 CA ALA A 10 15.080 -12.712 4.750 1.00 25.00 C ATOM 150 C ALA A 10 15.040 -13.575 6.010 1.00 25.00 C ATOM 151 O ALA A 10 14.607 -13.111 7.060 1.00 25.00 O ATOM 152 CB ALA A 10 16.343 -11.867 4.719 1.00 25.00 C ATOM 0 H ALA A 10 13.666 -11.419 5.604 1.00 25.00 H new ATOM 0 HA ALA A 10 15.081 -13.366 3.878 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.217 -12.518 4.749 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.363 -11.275 3.804 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.357 -11.201 5.582 1.00 25.00 H new ATOM 158 N LYS A 11 15.490 -14.821 5.898 1.00 25.00 N ATOM 159 CA LYS A 11 15.532 -15.744 7.035 1.00 25.00 C ATOM 160 C LYS A 11 16.946 -15.877 7.576 1.00 25.00 C ATOM 161 O LYS A 11 17.899 -16.034 6.809 1.00 25.00 O ATOM 162 CB LYS A 11 15.029 -17.132 6.629 1.00 25.00 C ATOM 163 CG LYS A 11 15.172 -18.181 7.745 1.00 25.00 C ATOM 164 CD LYS A 11 14.274 -19.395 7.564 1.00 25.00 C ATOM 165 CE LYS A 11 12.832 -19.062 7.956 1.00 25.00 C ATOM 166 NZ LYS A 11 12.016 -20.252 8.367 1.00 25.00 N ATOM 0 H LYS A 11 15.834 -15.220 5.025 1.00 25.00 H new ATOM 0 HA LYS A 11 14.884 -15.333 7.809 1.00 25.00 H new ATOM 0 HB2 LYS A 11 13.981 -17.061 6.339 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.580 -17.468 5.751 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.210 -18.512 7.790 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.945 -17.712 8.703 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.307 -19.727 6.526 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.641 -20.220 8.174 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.847 -18.345 8.777 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.342 -18.573 7.114 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.054 -19.944 8.617 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 11.969 -20.930 7.579 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.458 -20.708 9.190 1.00 25.00 H new ATOM 180 N ALA A 12 17.066 -15.866 8.891 1.00 25.00 N ATOM 181 CA ALA A 12 18.336 -16.066 9.569 1.00 25.00 C ATOM 182 C ALA A 12 18.752 -17.544 9.479 1.00 25.00 C ATOM 183 O ALA A 12 17.976 -18.424 9.848 1.00 25.00 O ATOM 184 CB ALA A 12 18.180 -15.633 11.030 1.00 25.00 C ATOM 0 H ALA A 12 16.280 -15.717 9.524 1.00 25.00 H new ATOM 0 HA ALA A 12 19.115 -15.469 9.095 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.125 -15.776 11.555 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.899 -14.581 11.070 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.405 -16.234 11.507 1.00 25.00 H new ATOM 190 N LEU A 13 19.960 -17.821 9.005 1.00 25.00 N ATOM 191 CA LEU A 13 20.466 -19.199 8.955 1.00 25.00 C ATOM 192 C LEU A 13 21.149 -19.542 10.258 1.00 25.00 C ATOM 193 O LEU A 13 21.367 -20.703 10.557 1.00 25.00 O ATOM 194 CB LEU A 13 21.513 -19.376 7.856 1.00 25.00 C ATOM 195 CG LEU A 13 21.140 -19.268 6.380 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.710 -19.735 6.075 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.348 -17.873 5.891 1.00 25.00 C ATOM 0 H LEU A 13 20.609 -17.119 8.650 1.00 25.00 H new ATOM 0 HA LEU A 13 19.608 -19.843 8.763 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.295 -18.640 8.041 1.00 25.00 H new ATOM 0 HB3 LEU A 13 21.961 -20.359 7.999 1.00 25.00 H new ATOM 0 HG LEU A 13 21.805 -19.947 5.845 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.513 -19.631 5.008 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.599 -20.780 6.364 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.001 -19.126 6.636 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.077 -17.813 4.837 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.723 -17.189 6.466 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.395 -17.597 6.013 1.00 25.00 H new ATOM 209 N TYR A 14 21.505 -18.513 11.004 1.00 25.00 N ATOM 210 CA TYR A 14 22.213 -18.650 12.267 1.00 25.00 C ATOM 211 C TYR A 14 21.627 -17.581 13.156 1.00 25.00 C ATOM 212 O TYR A 14 20.947 -16.693 12.659 1.00 25.00 O ATOM 213 CB TYR A 14 23.706 -18.390 12.082 1.00 25.00 C ATOM 214 CG TYR A 14 24.343 -19.253 11.017 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.433 -18.801 9.687 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.850 -20.530 11.325 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.007 -19.612 8.675 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.439 -21.340 10.321 1.00 25.00 C ATOM 219 CZ TYR A 14 25.505 -20.876 9.006 1.00 25.00 C ATOM 220 OH TYR A 14 26.067 -21.658 8.029 1.00 25.00 O ATOM 0 H TYR A 14 21.309 -17.545 10.748 1.00 25.00 H new ATOM 0 HA TYR A 14 22.107 -19.653 12.680 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.855 -17.341 11.825 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.216 -18.561 13.030 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.059 -17.820 9.433 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.790 -20.897 12.339 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.059 -19.256 7.657 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.835 -22.313 10.573 1.00 25.00 H new ATOM 0 HH TYR A 14 26.366 -22.505 8.420 1.00 25.00 H new ATOM 230 N ASP A 15 21.896 -17.633 14.446 1.00 25.00 N ATOM 231 CA ASP A 15 21.481 -16.565 15.345 1.00 25.00 C ATOM 232 C ASP A 15 22.465 -15.411 15.187 1.00 25.00 C ATOM 233 O ASP A 15 23.468 -15.527 14.474 1.00 25.00 O ATOM 234 CB ASP A 15 21.499 -17.060 16.790 1.00 25.00 C ATOM 235 CG ASP A 15 22.882 -17.472 17.233 1.00 25.00 C ATOM 236 OD1 ASP A 15 23.334 -18.551 16.794 1.00 25.00 O ATOM 237 OD2 ASP A 15 23.520 -16.723 17.996 1.00 25.00 O ATOM 0 H ASP A 15 22.398 -18.398 14.897 1.00 25.00 H new ATOM 0 HA ASP A 15 20.468 -16.242 15.103 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.128 -16.273 17.447 1.00 25.00 H new ATOM 0 HB3 ASP A 15 20.819 -17.906 16.891 1.00 25.00 H new ATOM 242 N ASN A 16 22.197 -14.304 15.857 1.00 25.00 N ATOM 243 CA ASN A 16 23.113 -13.179 15.864 1.00 25.00 C ATOM 244 C ASN A 16 22.993 -12.427 17.169 1.00 25.00 C ATOM 245 O ASN A 16 21.890 -12.204 17.669 1.00 25.00 O ATOM 246 CB ASN A 16 22.826 -12.224 14.711 1.00 25.00 C ATOM 247 CG ASN A 16 23.961 -11.262 14.484 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.091 -11.681 14.260 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.693 -9.996 14.579 1.00 25.00 N ATOM 0 H ASN A 16 21.349 -14.161 16.405 1.00 25.00 H new ATOM 0 HA ASN A 16 24.124 -13.571 15.749 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.648 -12.797 13.801 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.913 -11.666 14.920 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.437 -9.307 14.466 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.738 -9.689 14.767 1.00 25.00 H new ATOM 256 N VAL A 17 24.129 -11.999 17.687 1.00 25.00 N ATOM 257 CA VAL A 17 24.182 -11.198 18.893 1.00 25.00 C ATOM 258 C VAL A 17 24.612 -9.828 18.425 1.00 25.00 C ATOM 259 O VAL A 17 25.620 -9.687 17.731 1.00 25.00 O ATOM 260 CB VAL A 17 25.196 -11.771 19.922 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.277 -10.872 21.169 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.779 -13.196 20.334 1.00 25.00 C ATOM 0 H VAL A 17 25.043 -12.198 17.281 1.00 25.00 H new ATOM 0 HA VAL A 17 23.220 -11.183 19.406 1.00 25.00 H new ATOM 0 HB VAL A 17 26.179 -11.802 19.453 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.993 -11.293 21.875 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.600 -9.873 20.877 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.295 -10.813 21.639 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.495 -13.590 21.055 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.787 -13.169 20.785 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.760 -13.838 19.454 1.00 25.00 H new ATOM 272 N ALA A 18 23.809 -8.837 18.761 1.00 25.00 N ATOM 273 CA ALA A 18 24.089 -7.465 18.396 1.00 25.00 C ATOM 274 C ALA A 18 25.166 -6.941 19.339 1.00 25.00 C ATOM 275 O ALA A 18 24.936 -6.798 20.537 1.00 25.00 O ATOM 276 CB ALA A 18 22.829 -6.634 18.501 1.00 25.00 C ATOM 0 H ALA A 18 22.948 -8.961 19.293 1.00 25.00 H new ATOM 0 HA ALA A 18 24.439 -7.405 17.366 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.049 -5.603 18.225 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.071 -7.036 17.829 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.458 -6.664 19.525 1.00 25.00 H new ATOM 282 N GLU A 19 26.345 -6.700 18.793 1.00 25.00 N ATOM 283 CA GLU A 19 27.477 -6.213 19.578 1.00 25.00 C ATOM 284 C GLU A 19 27.581 -4.712 19.397 1.00 25.00 C ATOM 285 O GLU A 19 28.122 -3.997 20.236 1.00 25.00 O ATOM 286 CB GLU A 19 28.763 -6.894 19.113 1.00 25.00 C ATOM 287 CG GLU A 19 28.774 -8.381 19.418 1.00 25.00 C ATOM 288 CD GLU A 19 30.045 -9.066 18.944 1.00 25.00 C ATOM 289 OE1 GLU A 19 30.903 -9.402 19.782 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.155 -9.318 17.721 1.00 25.00 O ATOM 0 H GLU A 19 26.549 -6.833 17.802 1.00 25.00 H new ATOM 0 HA GLU A 19 27.328 -6.445 20.633 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.882 -6.745 18.040 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.617 -6.420 19.597 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.665 -8.528 20.493 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.913 -8.852 18.943 1.00 25.00 H new ATOM 297 N SER A 20 27.019 -4.235 18.300 1.00 25.00 N ATOM 298 CA SER A 20 26.987 -2.812 18.010 1.00 25.00 C ATOM 299 C SER A 20 25.605 -2.291 18.360 1.00 25.00 C ATOM 300 O SER A 20 24.616 -3.023 18.253 1.00 25.00 O ATOM 301 CB SER A 20 27.282 -2.587 16.531 1.00 25.00 C ATOM 302 OG SER A 20 28.461 -3.279 16.171 1.00 25.00 O ATOM 0 H SER A 20 26.575 -4.818 17.590 1.00 25.00 H new ATOM 0 HA SER A 20 27.740 -2.283 18.594 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.445 -2.935 15.926 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.398 -1.522 16.331 1.00 25.00 H new ATOM 0 HG SER A 20 28.294 -3.814 15.367 1.00 25.00 H new ATOM 308 N PRO A 21 25.499 -1.010 18.742 1.00 25.00 N ATOM 309 CA PRO A 21 24.180 -0.455 19.066 1.00 25.00 C ATOM 310 C PRO A 21 23.309 -0.276 17.826 1.00 25.00 C ATOM 311 O PRO A 21 22.122 0.030 17.925 1.00 25.00 O ATOM 312 CB PRO A 21 24.532 0.891 19.704 1.00 25.00 C ATOM 313 CG PRO A 21 25.806 1.277 19.046 1.00 25.00 C ATOM 314 CD PRO A 21 26.563 0.002 18.892 1.00 25.00 C ATOM 0 HA PRO A 21 23.593 -1.105 19.714 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.752 1.632 19.529 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.651 0.802 20.784 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.624 1.747 18.080 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.361 1.995 19.650 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.220 0.027 18.022 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.191 -0.200 19.760 1.00 25.00 H new ATOM 322 N ASP A 22 23.904 -0.488 16.663 1.00 25.00 N ATOM 323 CA ASP A 22 23.240 -0.320 15.390 1.00 25.00 C ATOM 324 C ASP A 22 22.872 -1.661 14.795 1.00 25.00 C ATOM 325 O ASP A 22 22.326 -1.719 13.717 1.00 25.00 O ATOM 326 CB ASP A 22 24.204 0.388 14.447 1.00 25.00 C ATOM 327 CG ASP A 22 24.575 1.760 14.945 1.00 25.00 C ATOM 328 OD1 ASP A 22 23.675 2.619 15.052 1.00 25.00 O ATOM 329 OD2 ASP A 22 25.745 1.947 15.335 1.00 25.00 O ATOM 0 H ASP A 22 24.876 -0.786 16.581 1.00 25.00 H new ATOM 0 HA ASP A 22 22.327 0.258 15.532 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.106 -0.213 14.333 1.00 25.00 H new ATOM 0 HB3 ASP A 22 23.750 0.471 13.460 1.00 25.00 H new ATOM 334 N GLU A 23 23.221 -2.739 15.477 1.00 25.00 N ATOM 335 CA GLU A 23 23.023 -4.096 14.966 1.00 25.00 C ATOM 336 C GLU A 23 21.756 -4.737 15.553 1.00 25.00 C ATOM 337 O GLU A 23 21.302 -4.362 16.634 1.00 25.00 O ATOM 338 CB GLU A 23 24.271 -4.926 15.313 1.00 25.00 C ATOM 339 CG GLU A 23 24.364 -6.270 14.607 1.00 25.00 C ATOM 340 CD GLU A 23 25.621 -7.042 14.956 1.00 25.00 C ATOM 341 OE1 GLU A 23 25.864 -8.078 14.302 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.342 -6.668 15.912 1.00 25.00 O ATOM 0 H GLU A 23 23.650 -2.704 16.402 1.00 25.00 H new ATOM 0 HA GLU A 23 22.885 -4.063 13.885 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.158 -4.341 15.068 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.289 -5.096 16.390 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.492 -6.871 14.867 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.331 -6.110 13.529 1.00 25.00 H new ATOM 349 N LEU A 24 21.195 -5.713 14.848 1.00 25.00 N ATOM 350 CA LEU A 24 20.039 -6.466 15.344 1.00 25.00 C ATOM 351 C LEU A 24 20.436 -7.824 15.893 1.00 25.00 C ATOM 352 O LEU A 24 21.292 -8.513 15.342 1.00 25.00 O ATOM 353 CB LEU A 24 19.017 -6.699 14.235 1.00 25.00 C ATOM 354 CG LEU A 24 18.232 -5.468 13.775 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.344 -5.854 12.608 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.392 -4.887 14.913 1.00 25.00 C ATOM 0 H LEU A 24 21.521 -6.005 13.927 1.00 25.00 H new ATOM 0 HA LEU A 24 19.608 -5.861 16.141 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.536 -7.117 13.372 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.306 -7.452 14.576 1.00 25.00 H new ATOM 0 HG LEU A 24 18.938 -4.698 13.463 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.781 -4.982 12.275 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.960 -6.223 11.788 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.651 -6.635 12.921 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.847 -4.014 14.554 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.684 -5.638 15.263 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.046 -4.594 15.735 1.00 25.00 H new ATOM 368 N SER A 25 19.754 -8.227 16.951 1.00 25.00 N ATOM 369 CA SER A 25 19.954 -9.524 17.566 1.00 25.00 C ATOM 370 C SER A 25 18.728 -10.362 17.265 1.00 25.00 C ATOM 371 O SER A 25 17.594 -9.906 17.406 1.00 25.00 O ATOM 372 CB SER A 25 20.140 -9.364 19.073 1.00 25.00 C ATOM 373 OG SER A 25 19.275 -8.355 19.576 1.00 25.00 O ATOM 0 H SER A 25 19.042 -7.658 17.409 1.00 25.00 H new ATOM 0 HA SER A 25 20.848 -10.008 17.172 1.00 25.00 H new ATOM 0 HB2 SER A 25 19.934 -10.310 19.573 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.176 -9.106 19.292 1.00 25.00 H new ATOM 0 HG SER A 25 19.405 -8.265 20.543 1.00 25.00 H new ATOM 379 N PHE A 26 18.970 -11.575 16.802 1.00 25.00 N ATOM 380 CA PHE A 26 17.899 -12.498 16.415 1.00 25.00 C ATOM 381 C PHE A 26 18.337 -13.951 16.530 1.00 25.00 C ATOM 382 O PHE A 26 19.502 -14.243 16.781 1.00 25.00 O ATOM 383 CB PHE A 26 17.447 -12.209 14.984 1.00 25.00 C ATOM 384 CG PHE A 26 18.562 -12.165 13.993 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.142 -13.350 13.498 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.024 -10.928 13.520 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.167 -13.297 12.529 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.032 -10.865 12.556 1.00 25.00 C ATOM 389 CZ PHE A 26 20.604 -12.059 12.049 1.00 25.00 C ATOM 0 H PHE A 26 19.909 -11.955 16.681 1.00 25.00 H new ATOM 0 HA PHE A 26 17.067 -12.342 17.102 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.733 -12.973 14.678 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.920 -11.255 14.966 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.799 -14.307 13.863 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.596 -10.015 13.906 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.612 -14.209 12.160 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.376 -9.906 12.196 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.375 -12.012 11.294 1.00 25.00 H new ATOM 399 N ARG A 27 17.394 -14.859 16.333 1.00 25.00 N ATOM 400 CA ARG A 27 17.628 -16.291 16.430 1.00 25.00 C ATOM 401 C ARG A 27 17.628 -16.912 15.034 1.00 25.00 C ATOM 402 O ARG A 27 17.014 -16.392 14.110 1.00 25.00 O ATOM 403 CB ARG A 27 16.486 -16.882 17.271 1.00 25.00 C ATOM 404 CG ARG A 27 16.694 -18.292 17.790 1.00 25.00 C ATOM 405 CD ARG A 27 17.698 -18.319 18.942 1.00 25.00 C ATOM 406 NE ARG A 27 17.814 -19.666 19.531 1.00 25.00 N ATOM 407 CZ ARG A 27 16.996 -20.176 20.447 1.00 25.00 C ATOM 408 NH1 ARG A 27 15.967 -19.515 20.921 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.219 -21.381 20.894 1.00 25.00 N ATOM 0 H ARG A 27 16.431 -14.618 16.098 1.00 25.00 H new ATOM 0 HA ARG A 27 18.593 -16.498 16.892 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.314 -16.225 18.124 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.577 -16.869 16.670 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.742 -18.702 18.126 1.00 25.00 H new ATOM 0 HG3 ARG A 27 17.049 -18.931 16.981 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.674 -17.994 18.582 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.389 -17.611 19.711 1.00 25.00 H new ATOM 0 HE ARG A 27 18.583 -20.254 19.210 1.00 25.00 H new ATOM 0 HH11 ARG A 27 15.769 -18.572 20.587 1.00 25.00 H new ATOM 0 HH12 ARG A 27 15.365 -19.944 21.623 1.00 25.00 H new ATOM 0 HH21 ARG A 27 18.011 -21.917 20.541 1.00 25.00 H new ATOM 0 HH22 ARG A 27 16.601 -21.787 21.597 1.00 25.00 H new ATOM 423 N LYS A 28 18.279 -18.056 14.898 1.00 25.00 N ATOM 424 CA LYS A 28 18.237 -18.828 13.660 1.00 25.00 C ATOM 425 C LYS A 28 16.784 -19.158 13.342 1.00 25.00 C ATOM 426 O LYS A 28 16.058 -19.658 14.194 1.00 25.00 O ATOM 427 CB LYS A 28 19.038 -20.122 13.853 1.00 25.00 C ATOM 428 CG LYS A 28 18.937 -21.109 12.706 1.00 25.00 C ATOM 429 CD LYS A 28 19.905 -22.267 12.917 1.00 25.00 C ATOM 430 CE LYS A 28 19.831 -23.272 11.775 1.00 25.00 C ATOM 431 NZ LYS A 28 20.881 -24.318 11.945 1.00 25.00 N ATOM 0 H LYS A 28 18.848 -18.475 15.634 1.00 25.00 H new ATOM 0 HA LYS A 28 18.670 -18.257 12.838 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.087 -19.865 14.001 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.697 -20.611 14.766 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.917 -21.487 12.632 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.160 -20.607 11.765 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.922 -21.882 12.999 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.676 -22.767 13.858 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.845 -23.736 11.752 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.966 -22.762 10.821 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.890 -24.940 11.111 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.811 -23.863 12.048 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 20.675 -24.881 12.795 1.00 25.00 H new ATOM 445 N GLY A 29 16.380 -18.887 12.110 1.00 25.00 N ATOM 446 CA GLY A 29 15.025 -19.160 11.668 1.00 25.00 C ATOM 447 C GLY A 29 14.123 -17.942 11.688 1.00 25.00 C ATOM 448 O GLY A 29 13.015 -18.007 11.149 1.00 25.00 O ATOM 0 H GLY A 29 16.979 -18.475 11.395 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.056 -19.562 10.655 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.593 -19.932 12.304 1.00 25.00 H new ATOM 452 N ASP A 30 14.585 -16.842 12.268 1.00 25.00 N ATOM 453 CA ASP A 30 13.777 -15.624 12.366 1.00 25.00 C ATOM 454 C ASP A 30 13.675 -14.968 11.003 1.00 25.00 C ATOM 455 O ASP A 30 14.502 -15.220 10.121 1.00 25.00 O ATOM 456 CB ASP A 30 14.404 -14.622 13.345 1.00 25.00 C ATOM 457 CG ASP A 30 14.217 -15.024 14.803 1.00 25.00 C ATOM 458 OD1 ASP A 30 14.737 -14.302 15.682 1.00 25.00 O ATOM 459 OD2 ASP A 30 13.567 -16.053 15.076 1.00 25.00 O ATOM 0 H ASP A 30 15.515 -16.764 12.679 1.00 25.00 H new ATOM 0 HA ASP A 30 12.789 -15.905 12.729 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.469 -14.531 13.132 1.00 25.00 H new ATOM 0 HB3 ASP A 30 13.962 -13.639 13.184 1.00 25.00 H new ATOM 464 N ILE A 31 12.674 -14.112 10.845 1.00 25.00 N ATOM 465 CA ILE A 31 12.464 -13.372 9.602 1.00 25.00 C ATOM 466 C ILE A 31 12.576 -11.891 9.898 1.00 25.00 C ATOM 467 O ILE A 31 11.914 -11.387 10.802 1.00 25.00 O ATOM 468 CB ILE A 31 11.048 -13.627 9.001 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.839 -15.123 8.700 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.846 -12.795 7.705 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.869 -15.744 7.772 1.00 25.00 C ATOM 0 H ILE A 31 11.986 -13.910 11.570 1.00 25.00 H new ATOM 0 HA ILE A 31 13.214 -13.707 8.885 1.00 25.00 H new ATOM 0 HB ILE A 31 10.311 -13.315 9.741 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.844 -15.671 9.642 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.850 -15.254 8.260 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.852 -12.987 7.301 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.946 -11.734 7.934 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.598 -13.080 6.969 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.635 -16.798 7.622 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.851 -15.228 6.812 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.861 -15.652 8.215 1.00 25.00 H new ATOM 483 N MET A 32 13.377 -11.193 9.110 1.00 25.00 N ATOM 484 CA MET A 32 13.501 -9.746 9.220 1.00 25.00 C ATOM 485 C MET A 32 13.298 -9.138 7.851 1.00 25.00 C ATOM 486 O MET A 32 13.503 -9.795 6.821 1.00 25.00 O ATOM 487 CB MET A 32 14.865 -9.356 9.784 1.00 25.00 C ATOM 488 CG MET A 32 16.045 -9.924 9.021 1.00 25.00 C ATOM 489 SD MET A 32 17.342 -10.390 10.172 1.00 25.00 S ATOM 490 CE MET A 32 16.621 -11.906 10.906 1.00 25.00 C ATOM 0 H MET A 32 13.956 -11.608 8.380 1.00 25.00 H new ATOM 0 HA MET A 32 12.744 -9.369 9.907 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.943 -8.269 9.793 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.924 -9.688 10.820 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.731 -10.792 8.441 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.422 -9.186 8.313 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.623 -11.820 11.993 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.597 -12.030 10.553 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.214 -12.771 10.609 1.00 25.00 H new ATOM 500 N THR A 33 12.865 -7.893 7.851 1.00 25.00 N ATOM 501 CA THR A 33 12.596 -7.165 6.616 1.00 25.00 C ATOM 502 C THR A 33 13.859 -6.452 6.174 1.00 25.00 C ATOM 503 O THR A 33 14.304 -5.541 6.844 1.00 25.00 O ATOM 504 CB THR A 33 11.489 -6.116 6.838 1.00 25.00 C ATOM 505 OG1 THR A 33 10.290 -6.781 7.243 1.00 25.00 O ATOM 506 CG2 THR A 33 11.201 -5.334 5.575 1.00 25.00 C ATOM 0 H THR A 33 12.689 -7.355 8.700 1.00 25.00 H new ATOM 0 HA THR A 33 12.270 -7.874 5.855 1.00 25.00 H new ATOM 0 HB THR A 33 11.832 -5.422 7.605 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.582 -6.119 7.388 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.415 -4.604 5.770 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.105 -4.817 5.253 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.875 -6.017 4.791 1.00 25.00 H new ATOM 514 N VAL A 34 14.440 -6.866 5.061 1.00 25.00 N ATOM 515 CA VAL A 34 15.647 -6.234 4.533 1.00 25.00 C ATOM 516 C VAL A 34 15.246 -4.946 3.858 1.00 25.00 C ATOM 517 O VAL A 34 14.439 -4.935 2.924 1.00 25.00 O ATOM 518 CB VAL A 34 16.373 -7.123 3.509 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.674 -6.469 3.022 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.669 -8.474 4.120 1.00 25.00 C ATOM 0 H VAL A 34 14.095 -7.644 4.498 1.00 25.00 H new ATOM 0 HA VAL A 34 16.332 -6.061 5.363 1.00 25.00 H new ATOM 0 HB VAL A 34 15.719 -7.249 2.647 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.162 -7.123 2.300 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.446 -5.513 2.550 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.339 -6.305 3.870 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.183 -9.099 3.390 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.302 -8.345 4.998 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.735 -8.953 4.414 1.00 25.00 H new ATOM 530 N LEU A 35 15.801 -3.863 4.353 1.00 25.00 N ATOM 531 CA LEU A 35 15.500 -2.542 3.858 1.00 25.00 C ATOM 532 C LEU A 35 16.517 -2.159 2.803 1.00 25.00 C ATOM 533 O LEU A 35 16.148 -1.724 1.723 1.00 25.00 O ATOM 534 CB LEU A 35 15.525 -1.564 5.021 1.00 25.00 C ATOM 535 CG LEU A 35 14.479 -1.859 6.106 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.740 -0.959 7.266 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.051 -1.665 5.607 1.00 25.00 C ATOM 0 H LEU A 35 16.478 -3.876 5.116 1.00 25.00 H new ATOM 0 HA LEU A 35 14.510 -2.521 3.403 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.517 -1.578 5.473 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.363 -0.556 4.639 1.00 25.00 H new ATOM 0 HG LEU A 35 14.570 -2.906 6.396 1.00 25.00 H new ATOM 0 HD11 LEU A 35 14.007 -1.153 8.049 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.742 -1.145 7.653 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.662 0.080 6.945 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.351 -1.886 6.413 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.916 -0.633 5.282 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.864 -2.337 4.769 1.00 25.00 H new ATOM 549 N GLU A 36 17.789 -2.399 3.076 1.00 25.00 N ATOM 550 CA GLU A 36 18.831 -2.189 2.066 1.00 25.00 C ATOM 551 C GLU A 36 20.030 -3.085 2.354 1.00 25.00 C ATOM 552 O GLU A 36 20.072 -3.751 3.381 1.00 25.00 O ATOM 553 CB GLU A 36 19.233 -0.707 1.977 1.00 25.00 C ATOM 554 CG GLU A 36 20.113 -0.179 3.036 1.00 25.00 C ATOM 555 CD GLU A 36 20.272 1.339 2.958 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.935 1.909 3.852 1.00 25.00 O ATOM 557 OE2 GLU A 36 19.716 1.959 2.030 1.00 25.00 O ATOM 0 H GLU A 36 18.130 -2.736 3.976 1.00 25.00 H new ATOM 0 HA GLU A 36 18.430 -2.465 1.091 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.727 -0.549 1.018 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.321 -0.110 1.968 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.707 -0.449 4.011 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.093 -0.649 2.958 1.00 25.00 H new ATOM 564 N ARG A 37 20.985 -3.125 1.439 1.00 25.00 N ATOM 565 CA ARG A 37 22.186 -3.943 1.587 1.00 25.00 C ATOM 566 C ARG A 37 23.344 -3.015 1.322 1.00 25.00 C ATOM 567 O ARG A 37 23.161 -2.074 0.563 1.00 25.00 O ATOM 568 CB ARG A 37 22.177 -5.076 0.568 1.00 25.00 C ATOM 569 CG ARG A 37 20.962 -5.981 0.689 1.00 25.00 C ATOM 570 CD ARG A 37 21.049 -7.181 -0.248 1.00 25.00 C ATOM 571 NE ARG A 37 20.995 -6.772 -1.667 1.00 25.00 N ATOM 572 CZ ARG A 37 22.043 -6.646 -2.480 1.00 25.00 C ATOM 573 NH1 ARG A 37 23.272 -6.899 -2.098 1.00 25.00 N ATOM 574 NH2 ARG A 37 21.846 -6.249 -3.706 1.00 25.00 N ATOM 0 H ARG A 37 20.953 -2.592 0.570 1.00 25.00 H new ATOM 0 HA ARG A 37 22.249 -4.395 2.577 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.208 -4.653 -0.436 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.080 -5.673 0.691 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.871 -6.330 1.718 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.061 -5.410 0.465 1.00 25.00 H new ATOM 0 HD2 ARG A 37 21.976 -7.723 -0.060 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.230 -7.868 -0.036 1.00 25.00 H new ATOM 0 HE ARG A 37 20.075 -6.568 -2.058 1.00 25.00 H new ATOM 0 HH11 ARG A 37 23.456 -7.206 -1.143 1.00 25.00 H new ATOM 0 HH12 ARG A 37 24.044 -6.788 -2.756 1.00 25.00 H new ATOM 0 HH21 ARG A 37 20.901 -6.040 -4.029 1.00 25.00 H new ATOM 0 HH22 ARG A 37 22.637 -6.147 -4.342 1.00 25.00 H new ATOM 588 N ASP A 38 24.483 -3.267 1.963 1.00 25.00 N ATOM 589 CA ASP A 38 25.660 -2.370 1.891 1.00 25.00 C ATOM 590 C ASP A 38 25.199 -1.004 2.413 1.00 25.00 C ATOM 591 O ASP A 38 25.468 0.064 1.866 1.00 25.00 O ATOM 592 CB ASP A 38 26.259 -2.310 0.472 1.00 25.00 C ATOM 593 CG ASP A 38 27.499 -1.436 0.388 1.00 25.00 C ATOM 594 OD1 ASP A 38 27.824 -0.983 -0.733 1.00 25.00 O ATOM 595 OD2 ASP A 38 28.165 -1.235 1.419 1.00 25.00 O ATOM 0 H ASP A 38 24.627 -4.091 2.547 1.00 25.00 H new ATOM 0 HA ASP A 38 26.478 -2.745 2.506 1.00 25.00 H new ATOM 0 HB2 ASP A 38 26.510 -3.320 0.146 1.00 25.00 H new ATOM 0 HB3 ASP A 38 25.506 -1.930 -0.219 1.00 25.00 H new ATOM 600 N THR A 39 24.418 -1.083 3.476 1.00 25.00 N ATOM 601 CA THR A 39 23.846 0.094 4.103 1.00 25.00 C ATOM 602 C THR A 39 24.957 0.918 4.711 1.00 25.00 C ATOM 603 O THR A 39 25.896 0.378 5.263 1.00 25.00 O ATOM 604 CB THR A 39 22.820 -0.301 5.182 1.00 25.00 C ATOM 605 OG1 THR A 39 22.360 0.857 5.880 1.00 25.00 O ATOM 606 CG2 THR A 39 23.358 -1.282 6.163 1.00 25.00 C ATOM 0 H THR A 39 24.164 -1.962 3.927 1.00 25.00 H new ATOM 0 HA THR A 39 23.324 0.682 3.348 1.00 25.00 H new ATOM 0 HB THR A 39 21.993 -0.779 4.657 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.761 1.372 5.300 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.589 -1.521 6.898 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.657 -2.191 5.642 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.223 -0.853 6.669 1.00 25.00 H new ATOM 614 N GLN A 40 24.852 2.231 4.570 1.00 25.00 N ATOM 615 CA GLN A 40 25.859 3.188 5.053 1.00 25.00 C ATOM 616 C GLN A 40 27.268 2.939 4.480 1.00 25.00 C ATOM 617 O GLN A 40 28.252 3.438 5.015 1.00 25.00 O ATOM 618 CB GLN A 40 25.911 3.216 6.595 1.00 25.00 C ATOM 619 CG GLN A 40 24.571 2.941 7.277 1.00 25.00 C ATOM 620 CD GLN A 40 24.569 3.326 8.736 1.00 25.00 C ATOM 621 OE1 GLN A 40 24.604 4.494 9.080 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.501 2.346 9.600 1.00 25.00 N ATOM 0 H GLN A 40 24.057 2.676 4.112 1.00 25.00 H new ATOM 0 HA GLN A 40 25.536 4.162 4.686 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.636 2.477 6.935 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.275 4.192 6.916 1.00 25.00 H new ATOM 0 HG2 GLN A 40 23.785 3.491 6.759 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.332 1.882 7.185 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.473 1.380 9.274 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.476 2.548 10.599 1.00 25.00 H new ATOM 631 N GLY A 41 27.360 2.166 3.402 1.00 25.00 N ATOM 632 CA GLY A 41 28.652 1.837 2.816 1.00 25.00 C ATOM 633 C GLY A 41 29.338 0.714 3.569 1.00 25.00 C ATOM 634 O GLY A 41 30.547 0.504 3.440 1.00 25.00 O ATOM 0 H GLY A 41 26.559 1.758 2.920 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.516 1.547 1.774 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.290 2.721 2.820 1.00 25.00 H new ATOM 638 N LEU A 42 28.578 0.005 4.392 1.00 25.00 N ATOM 639 CA LEU A 42 29.103 -1.089 5.175 1.00 25.00 C ATOM 640 C LEU A 42 28.869 -2.369 4.388 1.00 25.00 C ATOM 641 O LEU A 42 27.840 -3.027 4.537 1.00 25.00 O ATOM 642 CB LEU A 42 28.378 -1.150 6.519 1.00 25.00 C ATOM 643 CG LEU A 42 28.415 0.118 7.376 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.365 -0.004 8.461 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.774 0.322 8.002 1.00 25.00 C ATOM 0 H LEU A 42 27.582 0.177 4.531 1.00 25.00 H new ATOM 0 HA LEU A 42 30.167 -0.956 5.368 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.335 -1.404 6.332 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.806 -1.967 7.100 1.00 25.00 H new ATOM 0 HG LEU A 42 28.212 0.980 6.740 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.377 0.892 9.082 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.381 -0.116 8.005 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.579 -0.876 9.078 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.765 1.231 8.603 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.014 -0.531 8.637 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.526 0.413 7.218 1.00 25.00 H new ATOM 657 N ASP A 43 29.809 -2.720 3.532 1.00 25.00 N ATOM 658 CA ASP A 43 29.671 -3.942 2.745 1.00 25.00 C ATOM 659 C ASP A 43 29.533 -5.119 3.685 1.00 25.00 C ATOM 660 O ASP A 43 30.121 -5.167 4.771 1.00 25.00 O ATOM 661 CB ASP A 43 30.858 -4.201 1.826 1.00 25.00 C ATOM 662 CG ASP A 43 30.537 -5.224 0.726 1.00 25.00 C ATOM 663 OD1 ASP A 43 29.347 -5.618 0.575 1.00 25.00 O ATOM 664 OD2 ASP A 43 31.485 -5.684 0.054 1.00 25.00 O ATOM 0 H ASP A 43 30.664 -2.191 3.361 1.00 25.00 H new ATOM 0 HA ASP A 43 28.789 -3.817 2.117 1.00 25.00 H new ATOM 0 HB2 ASP A 43 31.169 -3.263 1.366 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.700 -4.560 2.418 1.00 25.00 H new ATOM 669 N GLY A 44 28.725 -6.067 3.269 1.00 25.00 N ATOM 670 CA GLY A 44 28.464 -7.231 4.075 1.00 25.00 C ATOM 671 C GLY A 44 27.323 -7.013 5.052 1.00 25.00 C ATOM 672 O GLY A 44 26.659 -7.975 5.436 1.00 25.00 O ATOM 0 H GLY A 44 28.237 -6.052 2.373 1.00 25.00 H new ATOM 0 HA2 GLY A 44 28.227 -8.074 3.426 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.366 -7.497 4.627 1.00 25.00 H new ATOM 676 N TRP A 45 27.072 -5.772 5.453 1.00 25.00 N ATOM 677 CA TRP A 45 26.001 -5.450 6.372 1.00 25.00 C ATOM 678 C TRP A 45 24.733 -5.112 5.601 1.00 25.00 C ATOM 679 O TRP A 45 24.755 -4.370 4.619 1.00 25.00 O ATOM 680 CB TRP A 45 26.437 -4.252 7.208 1.00 25.00 C ATOM 681 CG TRP A 45 27.502 -4.601 8.204 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.824 -4.295 8.147 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.334 -5.327 9.429 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.494 -4.742 9.245 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.608 -5.391 10.065 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.231 -5.922 10.061 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.793 -6.031 11.309 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.409 -6.551 11.308 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.685 -6.600 11.919 1.00 25.00 C ATOM 0 H TRP A 45 27.611 -4.962 5.145 1.00 25.00 H new ATOM 0 HA TRP A 45 25.791 -6.304 7.017 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.806 -3.467 6.547 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.572 -3.846 7.733 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.288 -3.762 7.330 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.490 -4.615 9.427 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.257 -5.898 9.596 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.768 -6.076 11.772 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.562 -7.001 11.804 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.798 -7.088 12.876 1.00 25.00 H new ATOM 700 N TRP A 46 23.615 -5.674 6.030 1.00 25.00 N ATOM 701 CA TRP A 46 22.326 -5.407 5.401 1.00 25.00 C ATOM 702 C TRP A 46 21.431 -4.756 6.446 1.00 25.00 C ATOM 703 O TRP A 46 21.325 -5.251 7.560 1.00 25.00 O ATOM 704 CB TRP A 46 21.688 -6.711 4.903 1.00 25.00 C ATOM 705 CG TRP A 46 22.474 -7.424 3.815 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.609 -6.998 3.193 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.188 -8.714 3.229 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.056 -7.901 2.284 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.219 -8.982 2.279 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.166 -9.675 3.408 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.261 -10.172 1.524 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.220 -10.881 2.664 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.265 -11.113 1.728 1.00 25.00 C ATOM 0 H TRP A 46 23.571 -6.322 6.816 1.00 25.00 H new ATOM 0 HA TRP A 46 22.456 -4.751 4.541 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.568 -7.388 5.749 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.689 -6.491 4.527 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.094 -6.055 3.399 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.884 -7.791 1.698 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.357 -9.493 4.100 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.049 -10.345 0.806 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.458 -11.632 2.810 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.282 -12.036 1.168 1.00 25.00 H new ATOM 724 N LEU A 47 20.799 -3.649 6.095 1.00 25.00 N ATOM 725 CA LEU A 47 19.889 -2.961 7.004 1.00 25.00 C ATOM 726 C LEU A 47 18.604 -3.739 7.017 1.00 25.00 C ATOM 727 O LEU A 47 18.013 -3.960 5.968 1.00 25.00 O ATOM 728 CB LEU A 47 19.603 -1.544 6.507 1.00 25.00 C ATOM 729 CG LEU A 47 18.636 -0.690 7.334 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.105 -0.531 8.767 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.480 0.681 6.684 1.00 25.00 C ATOM 0 H LEU A 47 20.898 -3.203 5.183 1.00 25.00 H new ATOM 0 HA LEU A 47 20.332 -2.895 7.998 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.552 -1.012 6.442 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.208 -1.615 5.494 1.00 25.00 H new ATOM 0 HG LEU A 47 17.674 -1.202 7.358 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.391 0.081 9.318 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.180 -1.512 9.236 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.082 -0.048 8.779 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.792 1.287 7.273 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.451 1.175 6.639 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.086 0.562 5.675 1.00 25.00 H new ATOM 743 N CYS A 48 18.163 -4.147 8.190 1.00 25.00 N ATOM 744 CA CYS A 48 16.916 -4.870 8.313 1.00 25.00 C ATOM 745 C CYS A 48 16.095 -4.337 9.462 1.00 25.00 C ATOM 746 O CYS A 48 16.572 -3.541 10.270 1.00 25.00 O ATOM 747 CB CYS A 48 17.181 -6.371 8.502 1.00 25.00 C ATOM 748 SG CYS A 48 18.380 -7.062 7.328 1.00 25.00 S ATOM 0 H CYS A 48 18.651 -3.989 9.072 1.00 25.00 H new ATOM 0 HA CYS A 48 16.351 -4.727 7.392 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.542 -6.541 9.516 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.239 -6.911 8.404 1.00 25.00 H new ATOM 0 HG CYS A 48 19.492 -6.393 7.399 1.00 25.00 H new ATOM 754 N SER A 49 14.856 -4.786 9.523 1.00 25.00 N ATOM 755 CA SER A 49 13.944 -4.413 10.582 1.00 25.00 C ATOM 756 C SER A 49 13.367 -5.685 11.189 1.00 25.00 C ATOM 757 O SER A 49 12.972 -6.613 10.474 1.00 25.00 O ATOM 758 CB SER A 49 12.870 -3.483 10.024 1.00 25.00 C ATOM 759 OG SER A 49 11.616 -4.126 9.876 1.00 25.00 O ATOM 0 H SER A 49 14.454 -5.423 8.835 1.00 25.00 H new ATOM 0 HA SER A 49 14.456 -3.865 11.373 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.758 -2.625 10.686 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.194 -3.099 9.057 1.00 25.00 H new ATOM 0 HG SER A 49 10.962 -3.490 9.518 1.00 25.00 H new ATOM 765 N LEU A 50 13.414 -5.755 12.510 1.00 25.00 N ATOM 766 CA LEU A 50 12.995 -6.929 13.267 1.00 25.00 C ATOM 767 C LEU A 50 12.487 -6.448 14.621 1.00 25.00 C ATOM 768 O LEU A 50 13.104 -5.584 15.225 1.00 25.00 O ATOM 769 CB LEU A 50 14.199 -7.847 13.477 1.00 25.00 C ATOM 770 CG LEU A 50 13.930 -9.148 14.239 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.968 -10.325 13.316 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.953 -9.294 15.346 1.00 25.00 C ATOM 0 H LEU A 50 13.748 -4.990 13.096 1.00 25.00 H new ATOM 0 HA LEU A 50 12.216 -7.475 12.735 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.612 -8.100 12.500 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.967 -7.289 14.012 1.00 25.00 H new ATOM 0 HG LEU A 50 12.932 -9.110 14.676 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.774 -11.237 13.881 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.207 -10.207 12.545 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.951 -10.390 12.849 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.768 -10.218 15.893 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.954 -9.322 14.915 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.875 -8.447 16.028 1.00 25.00 H new ATOM 784 N HIS A 51 11.353 -6.979 15.066 1.00 25.00 N ATOM 785 CA HIS A 51 10.743 -6.617 16.362 1.00 25.00 C ATOM 786 C HIS A 51 10.494 -5.104 16.493 1.00 25.00 C ATOM 787 O HIS A 51 10.560 -4.548 17.582 1.00 25.00 O ATOM 788 CB HIS A 51 11.625 -7.093 17.538 1.00 25.00 C ATOM 789 CG HIS A 51 11.883 -8.570 17.549 1.00 25.00 C ATOM 790 ND1 HIS A 51 12.910 -9.168 18.238 1.00 25.00 N ATOM 791 CD2 HIS A 51 11.220 -9.597 16.945 1.00 25.00 C ATOM 792 CE1 HIS A 51 12.838 -10.480 18.035 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.823 -10.798 17.257 1.00 25.00 N ATOM 0 H HIS A 51 10.821 -7.676 14.544 1.00 25.00 H new ATOM 0 HA HIS A 51 9.778 -7.122 16.398 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.580 -6.568 17.498 1.00 25.00 H new ATOM 0 HB3 HIS A 51 11.145 -6.811 18.475 1.00 25.00 H new ATOM 0 HD2 HIS A 51 10.350 -9.486 16.315 1.00 25.00 H new ATOM 0 HE1 HIS A 51 13.527 -11.197 18.456 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.544 -11.730 16.952 1.00 25.00 H new ATOM 801 N GLY A 52 10.219 -4.441 15.375 1.00 25.00 N ATOM 802 CA GLY A 52 9.974 -3.003 15.399 1.00 25.00 C ATOM 803 C GLY A 52 11.230 -2.169 15.605 1.00 25.00 C ATOM 804 O GLY A 52 11.147 -0.980 15.895 1.00 25.00 O ATOM 0 H GLY A 52 10.160 -4.869 14.451 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.503 -2.708 14.461 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.265 -2.778 16.196 1.00 25.00 H new ATOM 808 N ARG A 53 12.395 -2.784 15.451 1.00 25.00 N ATOM 809 CA ARG A 53 13.674 -2.113 15.638 1.00 25.00 C ATOM 810 C ARG A 53 14.412 -2.273 14.327 1.00 25.00 C ATOM 811 O ARG A 53 14.266 -3.285 13.657 1.00 25.00 O ATOM 812 CB ARG A 53 14.437 -2.792 16.787 1.00 25.00 C ATOM 813 CG ARG A 53 15.272 -1.858 17.669 1.00 25.00 C ATOM 814 CD ARG A 53 16.632 -1.531 17.059 1.00 25.00 C ATOM 815 NE ARG A 53 17.517 -0.892 18.046 1.00 25.00 N ATOM 816 CZ ARG A 53 18.782 -0.538 17.831 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.382 -0.699 16.681 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.458 -0.012 18.807 1.00 25.00 N ATOM 0 H ARG A 53 12.480 -3.767 15.192 1.00 25.00 H new ATOM 0 HA ARG A 53 13.563 -1.060 15.897 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.718 -3.313 17.419 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.097 -3.549 16.364 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.721 -0.932 17.835 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.418 -2.321 18.645 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.096 -2.445 16.688 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.500 -0.870 16.203 1.00 25.00 H new ATOM 0 HE ARG A 53 17.129 -0.705 18.971 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.878 -1.113 15.897 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.354 -0.411 16.568 1.00 25.00 H new ATOM 0 HH21 ARG A 53 19.018 0.123 19.717 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.429 0.266 18.663 1.00 25.00 H new ATOM 832 N GLN A 54 15.188 -1.276 13.957 1.00 25.00 N ATOM 833 CA GLN A 54 15.966 -1.317 12.725 1.00 25.00 C ATOM 834 C GLN A 54 17.435 -1.428 13.078 1.00 25.00 C ATOM 835 O GLN A 54 17.863 -0.909 14.108 1.00 25.00 O ATOM 836 CB GLN A 54 15.724 -0.042 11.921 1.00 25.00 C ATOM 837 CG GLN A 54 14.906 -0.265 10.683 1.00 25.00 C ATOM 838 CD GLN A 54 14.578 1.030 9.961 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.428 1.306 9.671 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.580 1.816 9.662 1.00 25.00 N ATOM 0 H GLN A 54 15.301 -0.416 14.494 1.00 25.00 H new ATOM 0 HA GLN A 54 15.664 -2.176 12.125 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.220 0.688 12.554 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.685 0.390 11.640 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.448 -0.926 10.007 1.00 25.00 H new ATOM 0 HG3 GLN A 54 13.979 -0.773 10.950 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.530 1.552 9.921 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.411 2.693 9.170 1.00 25.00 H new ATOM 849 N GLY A 55 18.205 -2.088 12.232 1.00 25.00 N ATOM 850 CA GLY A 55 19.631 -2.205 12.464 1.00 25.00 C ATOM 851 C GLY A 55 20.322 -3.030 11.403 1.00 25.00 C ATOM 852 O GLY A 55 19.661 -3.638 10.560 1.00 25.00 O ATOM 0 H GLY A 55 17.870 -2.547 11.385 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.074 -1.210 12.492 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.801 -2.658 13.441 1.00 25.00 H new ATOM 856 N ILE A 56 21.643 -3.036 11.422 1.00 25.00 N ATOM 857 CA ILE A 56 22.426 -3.782 10.445 1.00 25.00 C ATOM 858 C ILE A 56 22.506 -5.243 10.873 1.00 25.00 C ATOM 859 O ILE A 56 22.325 -5.583 12.046 1.00 25.00 O ATOM 860 CB ILE A 56 23.851 -3.170 10.265 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.648 -3.274 11.582 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.717 -1.696 9.844 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.038 -2.676 11.531 1.00 25.00 C ATOM 0 H ILE A 56 22.202 -2.529 12.108 1.00 25.00 H new ATOM 0 HA ILE A 56 21.930 -3.719 9.476 1.00 25.00 H new ATOM 0 HB ILE A 56 24.387 -3.723 9.494 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.083 -2.779 12.372 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.730 -4.325 11.859 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.709 -1.262 9.717 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.170 -1.635 8.903 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.177 -1.145 10.614 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.521 -2.796 12.501 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.625 -3.186 10.767 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.969 -1.616 11.288 1.00 25.00 H new ATOM 875 N VAL A 57 22.723 -6.105 9.897 1.00 25.00 N ATOM 876 CA VAL A 57 22.801 -7.549 10.109 1.00 25.00 C ATOM 877 C VAL A 57 23.884 -8.099 9.189 1.00 25.00 C ATOM 878 O VAL A 57 23.970 -7.684 8.030 1.00 25.00 O ATOM 879 CB VAL A 57 21.462 -8.231 9.718 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.539 -9.720 9.853 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.309 -7.667 10.543 1.00 25.00 C ATOM 0 H VAL A 57 22.852 -5.826 8.924 1.00 25.00 H new ATOM 0 HA VAL A 57 23.016 -7.746 11.159 1.00 25.00 H new ATOM 0 HB VAL A 57 21.274 -8.010 8.667 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.583 -10.161 9.570 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.323 -10.104 9.200 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.767 -9.980 10.887 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.380 -8.158 10.253 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.498 -7.844 11.602 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.224 -6.595 10.364 1.00 25.00 H new ATOM 891 N PRO A 58 24.705 -9.050 9.665 1.00 25.00 N ATOM 892 CA PRO A 58 25.684 -9.624 8.742 1.00 25.00 C ATOM 893 C PRO A 58 25.004 -10.491 7.676 1.00 25.00 C ATOM 894 O PRO A 58 24.333 -11.483 7.983 1.00 25.00 O ATOM 895 CB PRO A 58 26.580 -10.450 9.669 1.00 25.00 C ATOM 896 CG PRO A 58 25.695 -10.845 10.796 1.00 25.00 C ATOM 897 CD PRO A 58 24.776 -9.673 10.999 1.00 25.00 C ATOM 0 HA PRO A 58 26.238 -8.876 8.174 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.982 -11.324 9.156 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.431 -9.867 10.020 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.135 -11.749 10.559 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.272 -11.054 11.696 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.793 -9.991 11.346 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.168 -8.981 11.744 1.00 25.00 H new ATOM 905 N GLY A 59 25.192 -10.125 6.417 1.00 25.00 N ATOM 906 CA GLY A 59 24.584 -10.850 5.309 1.00 25.00 C ATOM 907 C GLY A 59 25.039 -12.293 5.244 1.00 25.00 C ATOM 908 O GLY A 59 24.321 -13.155 4.762 1.00 25.00 O ATOM 0 H GLY A 59 25.763 -9.328 6.136 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.499 -10.818 5.409 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.832 -10.351 4.372 1.00 25.00 H new ATOM 912 N ASN A 60 26.215 -12.569 5.794 1.00 25.00 N ATOM 913 CA ASN A 60 26.755 -13.930 5.834 1.00 25.00 C ATOM 914 C ASN A 60 25.891 -14.888 6.677 1.00 25.00 C ATOM 915 O ASN A 60 26.032 -16.106 6.573 1.00 25.00 O ATOM 916 CB ASN A 60 28.186 -13.907 6.393 1.00 25.00 C ATOM 917 CG ASN A 60 29.111 -14.867 5.672 1.00 25.00 C ATOM 918 OD1 ASN A 60 30.129 -14.470 5.145 1.00 25.00 O ATOM 919 ND2 ASN A 60 28.752 -16.120 5.632 1.00 25.00 N ATOM 0 H ASN A 60 26.819 -11.867 6.222 1.00 25.00 H new ATOM 0 HA ASN A 60 26.753 -14.304 4.810 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.586 -12.896 6.315 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.162 -14.159 7.453 1.00 25.00 H new ATOM 0 HD21 ASN A 60 29.334 -16.802 5.146 1.00 25.00 H new ATOM 0 HD22 ASN A 60 27.889 -16.418 6.087 1.00 25.00 H new ATOM 926 N ARG A 61 24.995 -14.348 7.497 1.00 25.00 N ATOM 927 CA ARG A 61 24.105 -15.169 8.322 1.00 25.00 C ATOM 928 C ARG A 61 22.652 -15.068 7.862 1.00 25.00 C ATOM 929 O ARG A 61 21.752 -15.584 8.529 1.00 25.00 O ATOM 930 CB ARG A 61 24.214 -14.751 9.795 1.00 25.00 C ATOM 931 CG ARG A 61 25.616 -14.920 10.380 1.00 25.00 C ATOM 932 CD ARG A 61 25.602 -14.710 11.886 1.00 25.00 C ATOM 933 NE ARG A 61 26.934 -14.917 12.480 1.00 25.00 N ATOM 934 CZ ARG A 61 27.193 -14.989 13.782 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.263 -14.912 14.696 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.424 -15.163 14.167 1.00 25.00 N ATOM 0 H ARG A 61 24.863 -13.343 7.611 1.00 25.00 H new ATOM 0 HA ARG A 61 24.420 -16.207 8.212 1.00 25.00 H new ATOM 0 HB2 ARG A 61 23.914 -13.708 9.890 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.511 -15.340 10.384 1.00 25.00 H new ATOM 0 HG2 ARG A 61 25.993 -15.917 10.151 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.297 -14.207 9.915 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.258 -13.700 12.109 1.00 25.00 H new ATOM 0 HD3 ARG A 61 24.890 -15.398 12.342 1.00 25.00 H new ATOM 0 HE ARG A 61 27.722 -15.013 11.840 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.288 -14.791 14.422 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.512 -14.973 15.683 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.169 -15.241 13.474 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.644 -15.221 15.161 1.00 25.00 H new ATOM 950 N LEU A 62 22.419 -14.425 6.724 1.00 25.00 N ATOM 951 CA LEU A 62 21.065 -14.241 6.204 1.00 25.00 C ATOM 952 C LEU A 62 20.840 -14.840 4.833 1.00 25.00 C ATOM 953 O LEU A 62 21.732 -14.900 3.997 1.00 25.00 O ATOM 954 CB LEU A 62 20.740 -12.756 6.094 1.00 25.00 C ATOM 955 CG LEU A 62 19.998 -12.140 7.279 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.764 -10.678 6.967 1.00 25.00 C ATOM 957 CD2 LEU A 62 18.669 -12.816 7.582 1.00 25.00 C ATOM 0 H LEU A 62 23.151 -14.020 6.140 1.00 25.00 H new ATOM 0 HA LEU A 62 20.421 -14.758 6.915 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.673 -12.210 5.952 1.00 25.00 H new ATOM 0 HB3 LEU A 62 20.141 -12.602 5.197 1.00 25.00 H new ATOM 0 HG LEU A 62 20.614 -12.275 8.168 1.00 25.00 H new ATOM 0 HD11 LEU A 62 19.235 -10.209 7.796 1.00 25.00 H new ATOM 0 HD12 LEU A 62 20.722 -10.179 6.820 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.166 -10.591 6.060 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.198 -12.327 8.435 1.00 25.00 H new ATOM 0 HD22 LEU A 62 18.015 -12.739 6.713 1.00 25.00 H new ATOM 0 HD23 LEU A 62 18.840 -13.867 7.816 1.00 25.00 H new ATOM 969 N LYS A 63 19.594 -15.216 4.592 1.00 25.00 N ATOM 970 CA LYS A 63 19.170 -15.678 3.267 1.00 25.00 C ATOM 971 C LYS A 63 17.969 -14.897 2.823 1.00 25.00 C ATOM 972 O LYS A 63 16.917 -14.960 3.449 1.00 25.00 O ATOM 973 CB LYS A 63 18.813 -17.174 3.257 1.00 25.00 C ATOM 974 CG LYS A 63 18.299 -17.643 1.887 1.00 25.00 C ATOM 975 CD LYS A 63 18.070 -19.149 1.786 1.00 25.00 C ATOM 976 CE LYS A 63 16.868 -19.611 2.595 1.00 25.00 C ATOM 977 NZ LYS A 63 16.444 -21.007 2.175 1.00 25.00 N ATOM 0 H LYS A 63 18.853 -15.213 5.293 1.00 25.00 H new ATOM 0 HA LYS A 63 20.009 -15.524 2.589 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.692 -17.757 3.531 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.053 -17.369 4.014 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.363 -17.129 1.667 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.014 -17.344 1.121 1.00 25.00 H new ATOM 0 HD2 LYS A 63 17.927 -19.422 0.741 1.00 25.00 H new ATOM 0 HD3 LYS A 63 18.961 -19.673 2.133 1.00 25.00 H new ATOM 0 HE2 LYS A 63 17.114 -19.604 3.657 1.00 25.00 H new ATOM 0 HE3 LYS A 63 16.040 -18.916 2.455 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 15.622 -21.305 2.739 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 16.189 -21.004 1.167 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 17.230 -21.670 2.332 1.00 25.00 H new ATOM 991 N ILE A 64 18.115 -14.212 1.706 1.00 25.00 N ATOM 992 CA ILE A 64 17.017 -13.471 1.111 1.00 25.00 C ATOM 993 C ILE A 64 15.978 -14.472 0.626 1.00 25.00 C ATOM 994 O ILE A 64 16.304 -15.423 -0.091 1.00 25.00 O ATOM 995 CB ILE A 64 17.506 -12.634 -0.100 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.632 -11.662 0.311 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.357 -11.847 -0.704 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.229 -10.557 1.309 1.00 25.00 C ATOM 0 H ILE A 64 18.991 -14.152 1.187 1.00 25.00 H new ATOM 0 HA ILE A 64 16.598 -12.793 1.855 1.00 25.00 H new ATOM 0 HB ILE A 64 17.898 -13.330 -0.842 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.446 -12.241 0.747 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.025 -11.188 -0.589 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.720 -11.266 -1.552 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.582 -12.535 -1.041 1.00 25.00 H new ATOM 0 HG23 ILE A 64 15.943 -11.173 0.046 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.094 -9.932 1.529 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.440 -9.944 0.874 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.868 -11.013 2.231 1.00 25.00 H new ATOM 1010 N LEU A 65 14.731 -14.274 1.018 1.00 25.00 N ATOM 1011 CA LEU A 65 13.648 -15.142 0.581 1.00 25.00 C ATOM 1012 C LEU A 65 13.039 -14.519 -0.666 1.00 25.00 C ATOM 1013 O LEU A 65 12.151 -13.683 -0.593 1.00 25.00 O ATOM 1014 CB LEU A 65 12.608 -15.307 1.693 1.00 25.00 C ATOM 1015 CG LEU A 65 13.170 -15.852 3.015 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.056 -15.930 4.044 1.00 25.00 C ATOM 1017 CD2 LEU A 65 13.830 -17.234 2.835 1.00 25.00 C ATOM 0 H LEU A 65 14.442 -13.519 1.639 1.00 25.00 H new ATOM 0 HA LEU A 65 14.020 -16.140 0.351 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.141 -14.341 1.882 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.823 -15.977 1.343 1.00 25.00 H new ATOM 0 HG LEU A 65 13.945 -15.168 3.361 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.454 -16.317 4.982 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.642 -14.935 4.208 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.272 -16.594 3.681 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.214 -17.582 3.794 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.092 -17.944 2.461 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.651 -17.155 2.123 1.00 25.00 H new ATOM 1029 N VAL A 66 13.579 -14.905 -1.812 1.00 25.00 N ATOM 1030 CA VAL A 66 13.178 -14.342 -3.105 1.00 25.00 C ATOM 1031 C VAL A 66 11.741 -14.757 -3.452 1.00 25.00 C ATOM 1032 O VAL A 66 11.034 -14.057 -4.170 1.00 25.00 O ATOM 1033 CB VAL A 66 14.169 -14.818 -4.217 1.00 25.00 C ATOM 1034 CG1 VAL A 66 13.850 -14.173 -5.576 1.00 25.00 C ATOM 1035 CG2 VAL A 66 15.624 -14.478 -3.821 1.00 25.00 C ATOM 0 H VAL A 66 14.307 -15.616 -1.879 1.00 25.00 H new ATOM 0 HA VAL A 66 13.210 -13.254 -3.042 1.00 25.00 H new ATOM 0 HB VAL A 66 14.055 -15.898 -4.313 1.00 25.00 H new ATOM 0 HG11 VAL A 66 14.560 -14.528 -6.323 1.00 25.00 H new ATOM 0 HG12 VAL A 66 12.839 -14.444 -5.879 1.00 25.00 H new ATOM 0 HG13 VAL A 66 13.925 -13.089 -5.491 1.00 25.00 H new ATOM 0 HG21 VAL A 66 16.303 -14.815 -4.604 1.00 25.00 H new ATOM 0 HG22 VAL A 66 15.724 -13.400 -3.694 1.00 25.00 H new ATOM 0 HG23 VAL A 66 15.873 -14.979 -2.885 1.00 25.00 H new ATOM 1045 N GLY A 67 11.307 -15.889 -2.912 1.00 25.00 N ATOM 1046 CA GLY A 67 9.946 -16.360 -3.122 1.00 25.00 C ATOM 1047 C GLY A 67 9.927 -17.715 -3.787 1.00 25.00 C ATOM 1048 O GLY A 67 10.177 -18.726 -3.147 1.00 25.00 O ATOM 0 H GLY A 67 11.879 -16.497 -2.326 1.00 25.00 H new ATOM 0 HA2 GLY A 67 9.427 -16.416 -2.165 1.00 25.00 H new ATOM 0 HA3 GLY A 67 9.403 -15.643 -3.738 1.00 25.00 H new ATOM 1052 N MET A 68 9.662 -17.735 -5.087 1.00 25.00 N ATOM 1053 CA MET A 68 9.606 -18.988 -5.849 1.00 25.00 C ATOM 1054 C MET A 68 10.992 -19.601 -6.054 1.00 25.00 C ATOM 1055 O MET A 68 11.117 -20.767 -6.407 1.00 25.00 O ATOM 1056 CB MET A 68 8.976 -18.736 -7.220 1.00 25.00 C ATOM 1057 CG MET A 68 7.517 -18.298 -7.154 1.00 25.00 C ATOM 1058 SD MET A 68 6.844 -17.943 -8.795 1.00 25.00 S ATOM 1059 CE MET A 68 6.767 -19.590 -9.537 1.00 25.00 C ATOM 0 H MET A 68 9.481 -16.899 -5.642 1.00 25.00 H new ATOM 0 HA MET A 68 9.003 -19.688 -5.270 1.00 25.00 H new ATOM 0 HB2 MET A 68 9.553 -17.971 -7.740 1.00 25.00 H new ATOM 0 HB3 MET A 68 9.046 -19.647 -7.815 1.00 25.00 H new ATOM 0 HG2 MET A 68 6.924 -19.080 -6.680 1.00 25.00 H new ATOM 0 HG3 MET A 68 7.433 -17.410 -6.527 1.00 25.00 H new ATOM 0 HE1 MET A 68 6.195 -19.545 -10.464 1.00 25.00 H new ATOM 0 HE2 MET A 68 7.777 -19.941 -9.750 1.00 25.00 H new ATOM 0 HE3 MET A 68 6.283 -20.279 -8.845 1.00 25.00 H new ATOM 1069 N TYR A 69 12.029 -18.807 -5.844 1.00 25.00 N ATOM 1070 CA TYR A 69 13.398 -19.279 -6.008 1.00 25.00 C ATOM 1071 C TYR A 69 13.938 -19.827 -4.688 1.00 25.00 C ATOM 1072 O TYR A 69 14.136 -19.080 -3.727 1.00 25.00 O ATOM 1073 CB TYR A 69 14.301 -18.136 -6.476 1.00 25.00 C ATOM 1074 CG TYR A 69 14.260 -17.867 -7.969 1.00 25.00 C ATOM 1075 CD1 TYR A 69 13.112 -17.324 -8.587 1.00 25.00 C ATOM 1076 CD2 TYR A 69 15.385 -18.147 -8.774 1.00 25.00 C ATOM 1077 CE1 TYR A 69 13.096 -17.057 -9.986 1.00 25.00 C ATOM 1078 CE2 TYR A 69 15.370 -17.880 -10.168 1.00 25.00 C ATOM 1079 CZ TYR A 69 14.230 -17.333 -10.758 1.00 25.00 C ATOM 1080 OH TYR A 69 14.231 -17.067 -12.103 1.00 25.00 O ATOM 0 H TYR A 69 11.951 -17.831 -5.559 1.00 25.00 H new ATOM 0 HA TYR A 69 13.393 -20.073 -6.755 1.00 25.00 H new ATOM 0 HB2 TYR A 69 14.015 -17.226 -5.949 1.00 25.00 H new ATOM 0 HB3 TYR A 69 15.328 -18.362 -6.189 1.00 25.00 H new ATOM 0 HD1 TYR A 69 12.237 -17.109 -7.992 1.00 25.00 H new ATOM 0 HD2 TYR A 69 16.270 -18.571 -8.323 1.00 25.00 H new ATOM 0 HE1 TYR A 69 12.212 -16.643 -10.449 1.00 25.00 H new ATOM 0 HE2 TYR A 69 16.239 -18.100 -10.771 1.00 25.00 H new ATOM 0 HH TYR A 69 15.098 -17.318 -12.485 1.00 25.00 H new ATOM 1090 N ASP A 70 14.241 -21.118 -4.677 1.00 25.00 N ATOM 1091 CA ASP A 70 14.919 -21.766 -3.553 1.00 25.00 C ATOM 1092 C ASP A 70 15.918 -22.736 -4.169 1.00 25.00 C ATOM 1093 O ASP A 70 15.765 -23.142 -5.318 1.00 25.00 O ATOM 1094 CB ASP A 70 13.939 -22.529 -2.648 1.00 25.00 C ATOM 1095 CG ASP A 70 14.613 -23.068 -1.381 1.00 25.00 C ATOM 1096 OD1 ASP A 70 15.637 -22.478 -0.934 1.00 25.00 O ATOM 1097 OD2 ASP A 70 14.179 -24.118 -0.868 1.00 25.00 O ATOM 0 H ASP A 70 14.025 -21.751 -5.447 1.00 25.00 H new ATOM 0 HA ASP A 70 15.400 -21.019 -2.922 1.00 25.00 H new ATOM 0 HB2 ASP A 70 13.119 -21.869 -2.367 1.00 25.00 H new ATOM 0 HB3 ASP A 70 13.504 -23.358 -3.206 1.00 25.00 H new ATOM 1102 N LYS A 71 16.947 -23.100 -3.418 1.00 25.00 N ATOM 1103 CA LYS A 71 17.989 -23.999 -3.925 1.00 25.00 C ATOM 1104 C LYS A 71 17.606 -25.470 -3.725 1.00 25.00 C ATOM 1105 O LYS A 71 18.385 -26.373 -4.031 1.00 25.00 O ATOM 1106 CB LYS A 71 19.328 -23.687 -3.244 1.00 25.00 C ATOM 1107 CG LYS A 71 20.545 -24.037 -4.112 1.00 25.00 C ATOM 1108 CD LYS A 71 21.856 -23.762 -3.385 1.00 25.00 C ATOM 1109 CE LYS A 71 23.066 -24.016 -4.297 1.00 25.00 C ATOM 1110 NZ LYS A 71 23.145 -25.449 -4.766 1.00 25.00 N ATOM 0 H LYS A 71 17.088 -22.791 -2.456 1.00 25.00 H new ATOM 0 HA LYS A 71 18.091 -23.832 -4.997 1.00 25.00 H new ATOM 0 HB2 LYS A 71 19.362 -22.627 -2.993 1.00 25.00 H new ATOM 0 HB3 LYS A 71 19.388 -24.239 -2.306 1.00 25.00 H new ATOM 0 HG2 LYS A 71 20.500 -25.089 -4.395 1.00 25.00 H new ATOM 0 HG3 LYS A 71 20.512 -23.457 -5.035 1.00 25.00 H new ATOM 0 HD2 LYS A 71 21.871 -22.729 -3.037 1.00 25.00 H new ATOM 0 HD3 LYS A 71 21.924 -24.397 -2.502 1.00 25.00 H new ATOM 0 HE2 LYS A 71 23.009 -23.356 -5.163 1.00 25.00 H new ATOM 0 HE3 LYS A 71 23.981 -23.761 -3.761 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 24.030 -25.594 -5.293 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 23.124 -26.085 -3.944 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 22.336 -25.657 -5.385 1.00 25.00 H new ATOM 1124 N LYS A 72 16.409 -25.712 -3.205 1.00 25.00 N ATOM 1125 CA LYS A 72 15.902 -27.073 -3.012 1.00 25.00 C ATOM 1126 C LYS A 72 14.588 -27.186 -3.778 1.00 25.00 C ATOM 1127 O LYS A 72 13.786 -26.265 -3.752 1.00 25.00 O ATOM 1128 CB LYS A 72 15.668 -27.356 -1.529 1.00 25.00 C ATOM 1129 CG LYS A 72 16.949 -27.408 -0.706 1.00 25.00 C ATOM 1130 CD LYS A 72 16.636 -27.679 0.762 1.00 25.00 C ATOM 1131 CE LYS A 72 17.903 -27.881 1.588 1.00 25.00 C ATOM 1132 NZ LYS A 72 18.567 -29.197 1.268 1.00 25.00 N ATOM 0 H LYS A 72 15.764 -24.980 -2.906 1.00 25.00 H new ATOM 0 HA LYS A 72 16.628 -27.800 -3.377 1.00 25.00 H new ATOM 0 HB2 LYS A 72 15.015 -26.585 -1.120 1.00 25.00 H new ATOM 0 HB3 LYS A 72 15.143 -28.306 -1.428 1.00 25.00 H new ATOM 0 HG2 LYS A 72 17.604 -28.188 -1.093 1.00 25.00 H new ATOM 0 HG3 LYS A 72 17.486 -26.464 -0.800 1.00 25.00 H new ATOM 0 HD2 LYS A 72 16.065 -26.845 1.171 1.00 25.00 H new ATOM 0 HD3 LYS A 72 16.006 -28.565 0.841 1.00 25.00 H new ATOM 0 HE2 LYS A 72 18.599 -27.065 1.395 1.00 25.00 H new ATOM 0 HE3 LYS A 72 17.656 -27.845 2.649 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 19.344 -29.366 1.938 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 17.870 -29.965 1.346 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 18.945 -29.169 0.299 1.00 25.00 H new ATOM 1146 N PRO A 73 14.354 -28.316 -4.469 1.00 25.00 N ATOM 1147 CA PRO A 73 13.134 -28.426 -5.282 1.00 25.00 C ATOM 1148 C PRO A 73 11.866 -28.765 -4.496 1.00 25.00 C ATOM 1149 O PRO A 73 10.795 -28.874 -5.074 1.00 25.00 O ATOM 1150 CB PRO A 73 13.484 -29.562 -6.244 1.00 25.00 C ATOM 1151 CG PRO A 73 14.335 -30.459 -5.430 1.00 25.00 C ATOM 1152 CD PRO A 73 15.191 -29.526 -4.598 1.00 25.00 C ATOM 0 HA PRO A 73 12.888 -27.473 -5.751 1.00 25.00 H new ATOM 0 HB2 PRO A 73 12.591 -30.073 -6.602 1.00 25.00 H new ATOM 0 HB3 PRO A 73 14.015 -29.194 -7.122 1.00 25.00 H new ATOM 0 HG2 PRO A 73 13.732 -31.112 -4.799 1.00 25.00 H new ATOM 0 HG3 PRO A 73 14.948 -31.103 -6.060 1.00 25.00 H new ATOM 0 HD2 PRO A 73 15.426 -29.957 -3.625 1.00 25.00 H new ATOM 0 HD3 PRO A 73 16.140 -29.308 -5.088 1.00 25.00 H new ATOM 1160 N ALA A 74 11.995 -28.960 -3.189 1.00 25.00 N ATOM 1161 CA ALA A 74 10.860 -29.337 -2.347 1.00 25.00 C ATOM 1162 C ALA A 74 10.900 -28.594 -1.007 1.00 25.00 C ATOM 1163 O ALA A 74 10.383 -29.073 -0.004 1.00 25.00 O ATOM 1164 CB ALA A 74 10.870 -30.859 -2.122 1.00 25.00 C ATOM 0 H ALA A 74 12.877 -28.863 -2.685 1.00 25.00 H new ATOM 0 HA ALA A 74 9.937 -29.055 -2.855 1.00 25.00 H new ATOM 0 HB1 ALA A 74 10.024 -31.140 -1.494 1.00 25.00 H new ATOM 0 HB2 ALA A 74 10.795 -31.369 -3.082 1.00 25.00 H new ATOM 0 HB3 ALA A 74 11.799 -31.148 -1.630 1.00 25.00 H new ATOM 1170 N GLY A 75 11.540 -27.433 -0.990 1.00 25.00 N ATOM 1171 CA GLY A 75 11.637 -26.662 0.239 1.00 25.00 C ATOM 1172 C GLY A 75 12.590 -27.267 1.259 1.00 25.00 C ATOM 1173 O GLY A 75 13.459 -28.075 0.926 1.00 25.00 O ATOM 0 H GLY A 75 11.993 -27.010 -1.800 1.00 25.00 H new ATOM 0 HA2 GLY A 75 11.967 -25.651 -0.000 1.00 25.00 H new ATOM 0 HA3 GLY A 75 10.646 -26.577 0.685 1.00 25.00 H new ATOM 1177 N SER A 76 12.449 -26.848 2.510 1.00 25.00 N ATOM 1178 CA SER A 76 13.321 -27.314 3.589 1.00 25.00 C ATOM 1179 C SER A 76 12.991 -28.739 4.025 1.00 25.00 C ATOM 1180 O SER A 76 11.850 -29.048 4.349 1.00 25.00 O ATOM 1181 CB SER A 76 13.172 -26.400 4.805 1.00 25.00 C ATOM 1182 OG SER A 76 13.466 -25.056 4.461 1.00 25.00 O ATOM 0 H SER A 76 11.736 -26.182 2.807 1.00 25.00 H new ATOM 0 HA SER A 76 14.340 -27.295 3.204 1.00 25.00 H new ATOM 0 HB2 SER A 76 12.156 -26.467 5.194 1.00 25.00 H new ATOM 0 HB3 SER A 76 13.840 -26.732 5.600 1.00 25.00 H new ATOM 0 HG SER A 76 13.363 -24.486 5.252 1.00 25.00 H new ATOM 1188 N GLY A 77 14.013 -29.579 4.104 1.00 25.00 N ATOM 1189 CA GLY A 77 13.843 -30.951 4.566 1.00 25.00 C ATOM 1190 C GLY A 77 13.879 -31.056 6.080 1.00 25.00 C ATOM 1191 O GLY A 77 14.755 -31.708 6.634 1.00 25.00 O ATOM 0 H GLY A 77 14.971 -29.335 3.854 1.00 25.00 H new ATOM 0 HA2 GLY A 77 12.894 -31.341 4.199 1.00 25.00 H new ATOM 0 HA3 GLY A 77 14.629 -31.575 4.142 1.00 25.00 H new ATOM 1195 N GLY A 78 12.955 -30.380 6.750 1.00 25.00 N ATOM 1196 CA GLY A 78 12.934 -30.383 8.204 1.00 25.00 C ATOM 1197 C GLY A 78 14.110 -29.618 8.785 1.00 25.00 C ATOM 1198 O GLY A 78 14.664 -28.723 8.138 1.00 25.00 O ATOM 0 H GLY A 78 12.217 -29.828 6.313 1.00 25.00 H new ATOM 0 HA2 GLY A 78 12.002 -29.940 8.555 1.00 25.00 H new ATOM 0 HA3 GLY A 78 12.954 -31.411 8.566 1.00 25.00 H new ATOM 1202 N SER A 79 14.488 -29.954 10.012 1.00 25.00 N ATOM 1203 CA SER A 79 15.639 -29.346 10.676 1.00 25.00 C ATOM 1204 C SER A 79 16.173 -30.350 11.689 1.00 25.00 C ATOM 1205 O SER A 79 15.403 -31.132 12.232 1.00 25.00 O ATOM 1206 CB SER A 79 15.227 -28.057 11.393 1.00 25.00 C ATOM 1207 OG SER A 79 14.787 -27.091 10.453 1.00 25.00 O ATOM 0 H SER A 79 14.007 -30.655 10.576 1.00 25.00 H new ATOM 0 HA SER A 79 16.403 -29.093 9.941 1.00 25.00 H new ATOM 0 HB2 SER A 79 14.431 -28.268 12.107 1.00 25.00 H new ATOM 0 HB3 SER A 79 16.070 -27.664 11.962 1.00 25.00 H new ATOM 0 HG SER A 79 14.831 -27.469 9.550 1.00 25.00 H new ATOM 1213 N GLY A 80 17.478 -30.319 11.936 1.00 25.00 N ATOM 1214 CA GLY A 80 18.103 -31.245 12.875 1.00 25.00 C ATOM 1215 C GLY A 80 18.991 -32.251 12.165 1.00 25.00 C ATOM 1216 O GLY A 80 18.556 -33.329 11.801 1.00 25.00 O ATOM 0 H GLY A 80 18.125 -29.662 11.499 1.00 25.00 H new ATOM 0 HA2 GLY A 80 18.695 -30.685 13.599 1.00 25.00 H new ATOM 0 HA3 GLY A 80 17.330 -31.773 13.434 1.00 25.00 H new ATOM 1220 N SER A 81 20.248 -31.883 11.957 1.00 25.00 N ATOM 1221 CA SER A 81 21.198 -32.726 11.225 1.00 25.00 C ATOM 1222 C SER A 81 21.927 -33.740 12.107 1.00 25.00 C ATOM 1223 O SER A 81 22.931 -34.300 11.702 1.00 25.00 O ATOM 1224 CB SER A 81 22.241 -31.832 10.555 1.00 25.00 C ATOM 1225 OG SER A 81 21.611 -30.739 9.905 1.00 25.00 O ATOM 0 H SER A 81 20.640 -31.001 12.286 1.00 25.00 H new ATOM 0 HA SER A 81 20.615 -33.292 10.498 1.00 25.00 H new ATOM 0 HB2 SER A 81 22.946 -31.463 11.300 1.00 25.00 H new ATOM 0 HB3 SER A 81 22.815 -32.411 9.832 1.00 25.00 H new ATOM 0 HG SER A 81 22.291 -30.174 9.482 1.00 25.00 H new ATOM 1231 N GLY A 82 21.467 -33.907 13.341 1.00 25.00 N ATOM 1232 CA GLY A 82 22.124 -34.811 14.281 1.00 25.00 C ATOM 1233 C GLY A 82 23.290 -34.174 15.018 1.00 25.00 C ATOM 1234 O GLY A 82 23.607 -34.556 16.135 1.00 25.00 O ATOM 0 H GLY A 82 20.646 -33.431 13.714 1.00 25.00 H new ATOM 0 HA2 GLY A 82 21.392 -35.161 15.009 1.00 25.00 H new ATOM 0 HA3 GLY A 82 22.481 -35.688 13.741 1.00 25.00 H new ATOM 1238 N LEU A 83 23.905 -33.174 14.399 1.00 25.00 N ATOM 1239 CA LEU A 83 25.057 -32.472 14.974 1.00 25.00 C ATOM 1240 C LEU A 83 24.722 -31.802 16.300 1.00 25.00 C ATOM 1241 O LEU A 83 25.554 -31.749 17.193 1.00 25.00 O ATOM 1242 CB LEU A 83 25.546 -31.392 14.001 1.00 25.00 C ATOM 1243 CG LEU A 83 25.994 -31.843 12.603 1.00 25.00 C ATOM 1244 CD1 LEU A 83 26.264 -30.609 11.742 1.00 25.00 C ATOM 1245 CD2 LEU A 83 27.246 -32.718 12.664 1.00 25.00 C ATOM 0 H LEU A 83 23.623 -32.823 13.484 1.00 25.00 H new ATOM 0 HA LEU A 83 25.830 -33.221 15.149 1.00 25.00 H new ATOM 0 HB2 LEU A 83 24.745 -30.663 13.878 1.00 25.00 H new ATOM 0 HB3 LEU A 83 26.381 -30.871 14.469 1.00 25.00 H new ATOM 0 HG LEU A 83 25.196 -32.442 12.164 1.00 25.00 H new ATOM 0 HD11 LEU A 83 26.583 -30.922 10.748 1.00 25.00 H new ATOM 0 HD12 LEU A 83 25.353 -30.015 11.661 1.00 25.00 H new ATOM 0 HD13 LEU A 83 27.049 -30.009 12.202 1.00 25.00 H new ATOM 0 HD21 LEU A 83 27.531 -33.016 11.655 1.00 25.00 H new ATOM 0 HD22 LEU A 83 28.061 -32.156 13.120 1.00 25.00 H new ATOM 0 HD23 LEU A 83 27.040 -33.607 13.261 1.00 25.00 H new ATOM 1257 N THR A 84 23.501 -31.278 16.389 1.00 25.00 N ATOM 1258 CA THR A 84 22.967 -30.581 17.579 1.00 25.00 C ATOM 1259 C THR A 84 23.609 -29.200 17.837 1.00 25.00 C ATOM 1260 O THR A 84 22.951 -28.304 18.365 1.00 25.00 O ATOM 1261 CB THR A 84 23.040 -31.491 18.845 1.00 25.00 C ATOM 1262 OG1 THR A 84 22.626 -32.814 18.487 1.00 25.00 O ATOM 1263 CG2 THR A 84 22.105 -31.003 19.944 1.00 25.00 C ATOM 0 H THR A 84 22.831 -31.322 15.621 1.00 25.00 H new ATOM 0 HA THR A 84 21.919 -30.377 17.358 1.00 25.00 H new ATOM 0 HB THR A 84 24.066 -31.469 19.212 1.00 25.00 H new ATOM 0 HG1 THR A 84 22.670 -33.395 19.275 1.00 25.00 H new ATOM 0 HG21 THR A 84 22.184 -31.662 20.808 1.00 25.00 H new ATOM 0 HG22 THR A 84 22.382 -29.989 20.234 1.00 25.00 H new ATOM 0 HG23 THR A 84 21.079 -31.008 19.577 1.00 25.00 H new ATOM 1271 N ASP A 85 24.832 -29.003 17.368 1.00 25.00 N ATOM 1272 CA ASP A 85 25.515 -27.707 17.417 1.00 25.00 C ATOM 1273 C ASP A 85 25.861 -27.294 15.984 1.00 25.00 C ATOM 1274 O ASP A 85 25.953 -28.147 15.095 1.00 25.00 O ATOM 1275 CB ASP A 85 26.795 -27.812 18.252 1.00 25.00 C ATOM 1276 CG ASP A 85 27.475 -26.463 18.445 1.00 25.00 C ATOM 1277 OD1 ASP A 85 28.718 -26.429 18.545 1.00 25.00 O ATOM 1278 OD2 ASP A 85 26.762 -25.433 18.465 1.00 25.00 O ATOM 0 H ASP A 85 25.388 -29.742 16.938 1.00 25.00 H new ATOM 0 HA ASP A 85 24.866 -26.963 17.879 1.00 25.00 H new ATOM 0 HB2 ASP A 85 26.556 -28.238 19.226 1.00 25.00 H new ATOM 0 HB3 ASP A 85 27.488 -28.499 17.765 1.00 25.00 H new ATOM 1283 N GLU A 86 26.020 -25.998 15.756 1.00 25.00 N ATOM 1284 CA GLU A 86 26.326 -25.460 14.430 1.00 25.00 C ATOM 1285 C GLU A 86 26.984 -24.080 14.577 1.00 25.00 C ATOM 1286 O GLU A 86 26.306 -23.084 14.826 1.00 25.00 O ATOM 1287 CB GLU A 86 25.035 -25.341 13.609 1.00 25.00 C ATOM 1288 CG GLU A 86 25.254 -25.031 12.135 1.00 25.00 C ATOM 1289 CD GLU A 86 23.940 -24.743 11.433 1.00 25.00 C ATOM 1290 OE1 GLU A 86 23.486 -23.582 11.491 1.00 25.00 O ATOM 1291 OE2 GLU A 86 23.288 -25.685 10.917 1.00 25.00 O ATOM 0 H GLU A 86 25.941 -25.286 16.483 1.00 25.00 H new ATOM 0 HA GLU A 86 27.013 -26.132 13.915 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.478 -26.274 13.693 1.00 25.00 H new ATOM 0 HB3 GLU A 86 24.413 -24.559 14.044 1.00 25.00 H new ATOM 0 HG2 GLU A 86 25.918 -24.172 12.036 1.00 25.00 H new ATOM 0 HG3 GLU A 86 25.749 -25.874 11.653 1.00 25.00 H new ATOM 1298 N LEU A 87 28.304 -24.023 14.464 1.00 25.00 N ATOM 1299 CA LEU A 87 29.019 -22.753 14.621 1.00 25.00 C ATOM 1300 C LEU A 87 28.723 -21.808 13.459 1.00 25.00 C ATOM 1301 O LEU A 87 28.796 -22.184 12.289 1.00 25.00 O ATOM 1302 CB LEU A 87 30.532 -22.981 14.724 1.00 25.00 C ATOM 1303 CG LEU A 87 31.032 -23.692 15.996 1.00 25.00 C ATOM 1304 CD1 LEU A 87 32.538 -23.938 15.878 1.00 25.00 C ATOM 1305 CD2 LEU A 87 30.743 -22.872 17.262 1.00 25.00 C ATOM 0 H LEU A 87 28.900 -24.827 14.267 1.00 25.00 H new ATOM 0 HA LEU A 87 28.667 -22.296 15.546 1.00 25.00 H new ATOM 0 HB2 LEU A 87 30.849 -23.564 13.859 1.00 25.00 H new ATOM 0 HB3 LEU A 87 31.029 -22.013 14.656 1.00 25.00 H new ATOM 0 HG LEU A 87 30.498 -24.638 16.085 1.00 25.00 H new ATOM 0 HD11 LEU A 87 32.896 -24.441 16.776 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.737 -24.564 15.008 1.00 25.00 H new ATOM 0 HD13 LEU A 87 33.055 -22.985 15.766 1.00 25.00 H new ATOM 0 HD21 LEU A 87 31.112 -23.409 18.136 1.00 25.00 H new ATOM 0 HD22 LEU A 87 31.244 -21.906 17.192 1.00 25.00 H new ATOM 0 HD23 LEU A 87 29.668 -22.717 17.358 1.00 25.00 H new ATOM 1317 N ALA A 88 28.373 -20.578 13.801 1.00 25.00 N ATOM 1318 CA ALA A 88 28.005 -19.570 12.816 1.00 25.00 C ATOM 1319 C ALA A 88 29.241 -18.881 12.201 1.00 25.00 C ATOM 1320 O ALA A 88 30.268 -18.726 12.866 1.00 25.00 O ATOM 1321 CB ALA A 88 27.100 -18.535 13.489 1.00 25.00 C ATOM 0 H ALA A 88 28.336 -20.250 14.766 1.00 25.00 H new ATOM 0 HA ALA A 88 27.478 -20.061 11.998 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.816 -17.773 12.763 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.204 -19.027 13.868 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.634 -18.067 14.316 1.00 25.00 H new ATOM 1327 N PRO A 89 29.139 -18.414 10.939 1.00 25.00 N ATOM 1328 CA PRO A 89 30.272 -17.709 10.324 1.00 25.00 C ATOM 1329 C PRO A 89 30.489 -16.312 10.918 1.00 25.00 C ATOM 1330 O PRO A 89 29.601 -15.767 11.589 1.00 25.00 O ATOM 1331 CB PRO A 89 29.855 -17.628 8.852 1.00 25.00 C ATOM 1332 CG PRO A 89 28.388 -17.554 8.901 1.00 25.00 C ATOM 1333 CD PRO A 89 27.998 -18.492 10.006 1.00 25.00 C ATOM 0 HA PRO A 89 31.222 -18.219 10.487 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.283 -16.752 8.364 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.192 -18.501 8.293 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.049 -16.538 9.105 1.00 25.00 H new ATOM 0 HG3 PRO A 89 27.944 -17.854 7.952 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.067 -18.186 10.483 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.849 -19.507 9.638 1.00 25.00 H new ATOM 1341 N PRO A 90 31.667 -15.709 10.681 1.00 25.00 N ATOM 1342 CA PRO A 90 31.913 -14.387 11.268 1.00 25.00 C ATOM 1343 C PRO A 90 31.106 -13.269 10.612 1.00 25.00 C ATOM 1344 O PRO A 90 30.518 -13.445 9.541 1.00 25.00 O ATOM 1345 CB PRO A 90 33.414 -14.189 11.037 1.00 25.00 C ATOM 1346 CG PRO A 90 33.683 -14.929 9.788 1.00 25.00 C ATOM 1347 CD PRO A 90 32.830 -16.169 9.895 1.00 25.00 C ATOM 0 HA PRO A 90 31.610 -14.345 12.314 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.667 -13.133 10.938 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.001 -14.581 11.868 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.417 -14.338 8.911 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.740 -15.180 9.695 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.532 -16.539 8.914 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.359 -16.980 10.395 1.00 25.00 H new ATOM 1355 N LYS A 91 31.096 -12.114 11.262 1.00 25.00 N ATOM 1356 CA LYS A 91 30.431 -10.920 10.739 1.00 25.00 C ATOM 1357 C LYS A 91 31.508 -10.021 10.120 1.00 25.00 C ATOM 1358 O LYS A 91 32.668 -10.083 10.531 1.00 25.00 O ATOM 1359 CB LYS A 91 29.678 -10.186 11.870 1.00 25.00 C ATOM 1360 CG LYS A 91 30.536 -9.856 13.106 1.00 25.00 C ATOM 1361 CD LYS A 91 29.766 -9.059 14.175 1.00 25.00 C ATOM 1362 CE LYS A 91 28.620 -9.860 14.815 1.00 25.00 C ATOM 1363 NZ LYS A 91 27.999 -9.086 15.936 1.00 25.00 N ATOM 0 H LYS A 91 31.547 -11.974 12.166 1.00 25.00 H new ATOM 0 HA LYS A 91 29.694 -11.191 9.983 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.267 -9.258 11.472 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.834 -10.800 12.184 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.903 -10.784 13.546 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.410 -9.284 12.793 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.460 -8.743 14.954 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.361 -8.154 13.723 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.865 -10.090 14.063 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.998 -10.812 15.189 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.085 -9.513 16.188 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.630 -9.106 16.763 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.851 -8.101 15.637 1.00 25.00 H new ATOM 1377 N PRO A 92 31.149 -9.202 9.113 1.00 25.00 N ATOM 1378 CA PRO A 92 32.147 -8.288 8.542 1.00 25.00 C ATOM 1379 C PRO A 92 32.524 -7.181 9.544 1.00 25.00 C ATOM 1380 O PRO A 92 31.820 -6.975 10.534 1.00 25.00 O ATOM 1381 CB PRO A 92 31.432 -7.736 7.301 1.00 25.00 C ATOM 1382 CG PRO A 92 30.009 -7.830 7.621 1.00 25.00 C ATOM 1383 CD PRO A 92 29.836 -9.042 8.462 1.00 25.00 C ATOM 0 HA PRO A 92 33.095 -8.768 8.299 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.726 -6.706 7.100 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.677 -8.316 6.412 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.673 -6.940 8.153 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.412 -7.902 6.712 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.039 -8.912 9.194 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.578 -9.914 7.861 1.00 25.00 H new ATOM 1391 N PRO A 93 33.657 -6.488 9.323 1.00 25.00 N ATOM 1392 CA PRO A 93 34.081 -5.469 10.292 1.00 25.00 C ATOM 1393 C PRO A 93 33.261 -4.182 10.225 1.00 25.00 C ATOM 1394 O PRO A 93 32.438 -4.000 9.327 1.00 25.00 O ATOM 1395 CB PRO A 93 35.533 -5.207 9.885 1.00 25.00 C ATOM 1396 CG PRO A 93 35.529 -5.404 8.429 1.00 25.00 C ATOM 1397 CD PRO A 93 34.621 -6.588 8.210 1.00 25.00 C ATOM 0 HA PRO A 93 33.950 -5.808 11.320 1.00 25.00 H new ATOM 0 HB2 PRO A 93 35.847 -4.198 10.151 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.218 -5.895 10.380 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.160 -4.519 7.910 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.533 -5.599 8.052 1.00 25.00 H new ATOM 0 HD2 PRO A 93 34.123 -6.539 7.241 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.172 -7.528 8.238 1.00 25.00 H new ATOM 1405 N LEU A 94 33.501 -3.297 11.182 1.00 25.00 N ATOM 1406 CA LEU A 94 32.828 -2.003 11.256 1.00 25.00 C ATOM 1407 C LEU A 94 33.831 -0.879 11.529 1.00 25.00 C ATOM 1408 O LEU A 94 34.899 -1.128 12.091 1.00 25.00 O ATOM 1409 CB LEU A 94 31.788 -2.024 12.383 1.00 25.00 C ATOM 1410 CG LEU A 94 30.450 -2.692 12.046 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.558 -2.626 13.237 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.748 -2.005 10.888 1.00 25.00 C ATOM 0 H LEU A 94 34.171 -3.455 11.934 1.00 25.00 H new ATOM 0 HA LEU A 94 32.342 -1.819 10.298 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.222 -2.536 13.242 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.592 -0.997 12.690 1.00 25.00 H new ATOM 0 HG LEU A 94 30.658 -3.723 11.762 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.604 -3.100 13.004 1.00 25.00 H new ATOM 0 HD12 LEU A 94 30.027 -3.146 14.072 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.389 -1.584 13.508 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.804 -2.511 10.683 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.553 -0.964 11.146 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.382 -2.046 10.002 1.00 25.00 H new ATOM 1424 N PRO A 95 33.490 0.369 11.149 1.00 25.00 N ATOM 1425 CA PRO A 95 34.333 1.536 11.436 1.00 25.00 C ATOM 1426 C PRO A 95 34.204 2.043 12.870 1.00 25.00 C ATOM 1427 O PRO A 95 33.293 1.665 13.604 1.00 25.00 O ATOM 1428 CB PRO A 95 33.790 2.586 10.470 1.00 25.00 C ATOM 1429 CG PRO A 95 32.339 2.279 10.397 1.00 25.00 C ATOM 1430 CD PRO A 95 32.259 0.768 10.437 1.00 25.00 C ATOM 0 HA PRO A 95 35.391 1.301 11.320 1.00 25.00 H new ATOM 0 HB2 PRO A 95 33.968 3.597 10.836 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.265 2.514 9.491 1.00 25.00 H new ATOM 0 HG2 PRO A 95 31.798 2.726 11.231 1.00 25.00 H new ATOM 0 HG3 PRO A 95 31.897 2.674 9.482 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.366 0.428 10.961 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.221 0.343 9.434 1.00 25.00 H new ATOM 1438 N GLU A 96 35.092 2.957 13.233 1.00 25.00 N ATOM 1439 CA GLU A 96 35.091 3.590 14.560 1.00 25.00 C ATOM 1440 C GLU A 96 34.149 4.806 14.590 1.00 25.00 C ATOM 1441 O GLU A 96 34.545 5.914 14.946 1.00 25.00 O ATOM 1442 CB GLU A 96 36.518 4.019 14.938 1.00 25.00 C ATOM 1443 CG GLU A 96 37.443 2.856 15.290 1.00 25.00 C ATOM 1444 CD GLU A 96 37.396 2.511 16.777 1.00 25.00 C ATOM 1445 OE1 GLU A 96 36.324 2.101 17.269 1.00 25.00 O ATOM 1446 OE2 GLU A 96 38.444 2.644 17.449 1.00 25.00 O ATOM 0 H GLU A 96 35.838 3.287 12.621 1.00 25.00 H new ATOM 0 HA GLU A 96 34.730 2.862 15.286 1.00 25.00 H new ATOM 0 HB2 GLU A 96 36.951 4.576 14.107 1.00 25.00 H new ATOM 0 HB3 GLU A 96 36.469 4.701 15.787 1.00 25.00 H new ATOM 0 HG2 GLU A 96 37.160 1.980 14.706 1.00 25.00 H new ATOM 0 HG3 GLU A 96 38.465 3.110 15.010 1.00 25.00 H new ATOM 1453 N GLY A 97 32.898 4.589 14.211 1.00 25.00 N ATOM 1454 CA GLY A 97 31.908 5.656 14.235 1.00 25.00 C ATOM 1455 C GLY A 97 31.827 6.488 12.966 1.00 25.00 C ATOM 1456 O GLY A 97 32.312 6.093 11.907 1.00 25.00 O ATOM 0 H GLY A 97 32.546 3.689 13.885 1.00 25.00 H new ATOM 0 HA2 GLY A 97 30.929 5.218 14.427 1.00 25.00 H new ATOM 0 HA3 GLY A 97 32.130 6.318 15.072 1.00 25.00 H new ATOM 1460 N GLU A 98 31.156 7.630 13.076 1.00 25.00 N ATOM 1461 CA GLU A 98 30.946 8.537 11.945 1.00 25.00 C ATOM 1462 C GLU A 98 32.255 9.201 11.515 1.00 25.00 C ATOM 1463 O GLU A 98 33.108 9.545 12.338 1.00 25.00 O ATOM 1464 CB GLU A 98 29.930 9.621 12.330 1.00 25.00 C ATOM 1465 CG GLU A 98 28.789 9.803 11.324 1.00 25.00 C ATOM 1466 CD GLU A 98 29.238 10.485 10.036 1.00 25.00 C ATOM 1467 OE1 GLU A 98 29.078 11.720 9.924 1.00 25.00 O ATOM 1468 OE2 GLU A 98 29.760 9.787 9.139 1.00 25.00 O ATOM 0 H GLU A 98 30.742 7.956 13.949 1.00 25.00 H new ATOM 0 HA GLU A 98 30.566 7.950 11.109 1.00 25.00 H new ATOM 0 HB2 GLU A 98 29.505 9.375 13.303 1.00 25.00 H new ATOM 0 HB3 GLU A 98 30.454 10.570 12.442 1.00 25.00 H new ATOM 0 HG2 GLU A 98 28.364 8.828 11.084 1.00 25.00 H new ATOM 0 HG3 GLU A 98 27.996 10.392 11.784 1.00 25.00 H new ATOM 1475 N VAL A 99 32.401 9.391 10.205 1.00 25.00 N ATOM 1476 CA VAL A 99 33.584 9.986 9.590 1.00 25.00 C ATOM 1477 C VAL A 99 33.216 10.763 8.315 1.00 25.00 C ATOM 1478 O VAL A 99 33.624 11.876 8.048 1.00 25.00 O ATOM 1479 CB VAL A 99 34.699 8.904 9.372 1.00 25.00 C ATOM 1480 CG1 VAL A 99 34.165 7.648 8.628 1.00 25.00 C ATOM 1481 CG2 VAL A 99 35.930 9.489 8.637 1.00 25.00 C ATOM 1482 OXT VAL A 99 32.375 10.156 7.538 1.00 25.00 O ATOM 0 H VAL A 99 31.684 9.130 9.528 1.00 25.00 H new ATOM 0 HA VAL A 99 34.007 10.724 10.272 1.00 25.00 H new ATOM 0 HB VAL A 99 35.015 8.587 10.366 1.00 25.00 H new ATOM 0 HG11 VAL A 99 34.974 6.929 8.501 1.00 25.00 H new ATOM 0 HG12 VAL A 99 33.363 7.194 9.210 1.00 25.00 H new ATOM 0 HG13 VAL A 99 33.782 7.940 7.650 1.00 25.00 H new ATOM 0 HG21 VAL A 99 36.680 8.709 8.505 1.00 25.00 H new ATOM 0 HG22 VAL A 99 35.625 9.868 7.662 1.00 25.00 H new ATOM 0 HG23 VAL A 99 36.353 10.303 9.226 1.00 25.00 H new TER 1493 VAL A 99