USER MOD reduce.3.24.130724 H: found=0, std=0, add=496, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 498 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 193 THR OG1 : rot -115:sc= -0.364 USER MOD Set 1.2: A 226 CYS SG : rot 16:sc= -0.466! USER MOD Single : A 183 LYS NZ :NH3+ -110:sc= -1.64 (180deg=-3!) USER MOD Single : A 197 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.156) USER MOD Single : A 201 TYR OH : rot 180:sc= -0.0322 USER MOD Single : A 210 SER OG : rot 22:sc= 0.667 USER MOD Single : A 229 THR OG1 : rot 180:sc= -0.0123 USER MOD Single : A 231 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 237 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 MET CE :methyl -144:sc= -0.501 (180deg=-2.61!) USER MOD Single : A 242 LYS NZ :NH3+ 149:sc= -0.22 (180deg=-1.47!) USER MOD Single : A 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 TYR OH : rot 180:sc= -4.09! USER MOD Single : A 245 HIS : no HE2:sc= -21.8! C(o=-22!,f=-26!) USER MOD Single : A 246 ASN : amide:sc= -0.0672 X(o=-0.067,f=-0.56) USER MOD Single : A 250 SER OG : rot 91:sc= 1.18 USER MOD Single : A 251 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 252 CYS SG : rot 4:sc= -8.49! USER MOD Single : A 255 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 183 -0.876 8.278 -5.063 1.00 0.00 N ATOM 2 CA LYS A 183 -0.682 7.095 -5.954 1.00 0.00 C ATOM 3 C LYS A 183 -1.122 5.870 -5.165 1.00 0.00 C ATOM 4 O LYS A 183 -1.179 5.907 -3.956 1.00 0.00 O ATOM 5 CB LYS A 183 0.811 7.077 -6.267 1.00 0.00 C ATOM 6 CG LYS A 183 1.335 5.634 -6.456 1.00 0.00 C ATOM 7 CD LYS A 183 1.827 5.489 -7.885 1.00 0.00 C ATOM 8 CE LYS A 183 3.353 5.601 -7.925 1.00 0.00 C ATOM 9 NZ LYS A 183 3.746 5.026 -9.242 1.00 0.00 N ATOM 0 HA LYS A 183 -1.253 7.120 -6.882 1.00 0.00 H new ATOM 0 HB2 LYS A 183 1.001 7.655 -7.171 1.00 0.00 H new ATOM 0 HB3 LYS A 183 1.359 7.561 -5.458 1.00 0.00 H new ATOM 0 HG2 LYS A 183 2.143 5.428 -5.754 1.00 0.00 H new ATOM 0 HG3 LYS A 183 0.544 4.913 -6.252 1.00 0.00 H new ATOM 0 HD2 LYS A 183 1.514 4.527 -8.291 1.00 0.00 H new ATOM 0 HD3 LYS A 183 1.381 6.260 -8.512 1.00 0.00 H new ATOM 0 HE2 LYS A 183 3.675 6.638 -7.835 1.00 0.00 H new ATOM 0 HE3 LYS A 183 3.811 5.052 -7.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 4.231 4.118 -9.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 2.896 4.874 -9.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 4.385 5.684 -9.731 1.00 0.00 H new ATOM 23 N ILE A 184 -1.429 4.785 -5.808 1.00 0.00 N ATOM 24 CA ILE A 184 -1.846 3.604 -5.029 1.00 0.00 C ATOM 25 C ILE A 184 -0.969 2.392 -5.372 1.00 0.00 C ATOM 26 O ILE A 184 -0.169 2.435 -6.286 1.00 0.00 O ATOM 27 CB ILE A 184 -3.303 3.352 -5.415 1.00 0.00 C ATOM 28 CG1 ILE A 184 -3.371 2.932 -6.885 1.00 0.00 C ATOM 29 CG2 ILE A 184 -4.116 4.632 -5.215 1.00 0.00 C ATOM 30 CD1 ILE A 184 -3.641 1.429 -6.975 1.00 0.00 C ATOM 0 H ILE A 184 -1.409 4.668 -6.821 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.740 3.768 -3.957 1.00 0.00 H new ATOM 0 HB ILE A 184 -3.713 2.561 -4.787 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.159 3.485 -7.396 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.434 3.175 -7.387 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -5.155 4.450 -5.491 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -4.066 4.935 -4.169 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -3.707 5.424 -5.842 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.689 1.130 -8.022 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.837 0.885 -6.479 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.589 1.200 -6.488 1.00 0.00 H new ATOM 42 N PHE A 185 -1.112 1.309 -4.649 1.00 0.00 N ATOM 43 CA PHE A 185 -0.283 0.101 -4.943 1.00 0.00 C ATOM 44 C PHE A 185 -1.131 -1.168 -4.821 1.00 0.00 C ATOM 45 O PHE A 185 -1.738 -1.420 -3.808 1.00 0.00 O ATOM 46 CB PHE A 185 0.863 0.157 -3.916 1.00 0.00 C ATOM 47 CG PHE A 185 1.088 -1.173 -3.222 1.00 0.00 C ATOM 48 CD1 PHE A 185 1.235 -2.348 -3.970 1.00 0.00 C ATOM 49 CD2 PHE A 185 1.171 -1.220 -1.826 1.00 0.00 C ATOM 50 CE1 PHE A 185 1.457 -3.568 -3.319 1.00 0.00 C ATOM 51 CE2 PHE A 185 1.395 -2.441 -1.178 1.00 0.00 C ATOM 52 CZ PHE A 185 1.538 -3.614 -1.924 1.00 0.00 C ATOM 0 H PHE A 185 -1.764 1.210 -3.871 1.00 0.00 H new ATOM 0 HA PHE A 185 0.110 0.084 -5.960 1.00 0.00 H new ATOM 0 HB2 PHE A 185 1.782 0.461 -4.418 1.00 0.00 H new ATOM 0 HB3 PHE A 185 0.640 0.919 -3.169 1.00 0.00 H new ATOM 0 HD1 PHE A 185 1.177 -2.313 -5.048 1.00 0.00 H new ATOM 0 HD2 PHE A 185 1.062 -0.314 -1.248 1.00 0.00 H new ATOM 0 HE1 PHE A 185 1.566 -4.475 -3.896 1.00 0.00 H new ATOM 0 HE2 PHE A 185 1.457 -2.476 -0.100 1.00 0.00 H new ATOM 0 HZ PHE A 185 1.711 -4.555 -1.423 1.00 0.00 H new ATOM 62 N VAL A 186 -1.177 -1.960 -5.859 1.00 0.00 N ATOM 63 CA VAL A 186 -1.994 -3.206 -5.815 1.00 0.00 C ATOM 64 C VAL A 186 -1.133 -4.425 -5.461 1.00 0.00 C ATOM 65 O VAL A 186 -0.350 -4.895 -6.262 1.00 0.00 O ATOM 66 CB VAL A 186 -2.568 -3.357 -7.225 1.00 0.00 C ATOM 67 CG1 VAL A 186 -3.617 -4.475 -7.226 1.00 0.00 C ATOM 68 CG2 VAL A 186 -3.230 -2.042 -7.648 1.00 0.00 C ATOM 0 H VAL A 186 -0.683 -1.797 -6.736 1.00 0.00 H new ATOM 0 HA VAL A 186 -2.771 -3.145 -5.053 1.00 0.00 H new ATOM 0 HB VAL A 186 -1.767 -3.603 -7.922 1.00 0.00 H new ATOM 0 HG11 VAL A 186 -4.029 -4.586 -8.229 1.00 0.00 H new ATOM 0 HG12 VAL A 186 -3.151 -5.411 -6.919 1.00 0.00 H new ATOM 0 HG13 VAL A 186 -4.418 -4.223 -6.531 1.00 0.00 H new ATOM 0 HG21 VAL A 186 -3.640 -2.148 -8.653 1.00 0.00 H new ATOM 0 HG22 VAL A 186 -4.033 -1.799 -6.952 1.00 0.00 H new ATOM 0 HG23 VAL A 186 -2.489 -1.243 -7.641 1.00 0.00 H new ATOM 78 N GLY A 187 -1.294 -4.945 -4.270 1.00 0.00 N ATOM 79 CA GLY A 187 -0.510 -6.145 -3.848 1.00 0.00 C ATOM 80 C GLY A 187 -1.025 -7.362 -4.594 1.00 0.00 C ATOM 81 O GLY A 187 -0.298 -8.278 -4.927 1.00 0.00 O ATOM 0 H GLY A 187 -1.940 -4.586 -3.567 1.00 0.00 H new ATOM 0 HA2 GLY A 187 0.549 -5.995 -4.058 1.00 0.00 H new ATOM 0 HA3 GLY A 187 -0.603 -6.296 -2.773 1.00 0.00 H new ATOM 148 N THR A 193 -1.008 -5.737 -15.431 1.00 0.00 N ATOM 149 CA THR A 193 -1.795 -4.508 -15.110 1.00 0.00 C ATOM 150 C THR A 193 -2.181 -3.751 -16.390 1.00 0.00 C ATOM 151 O THR A 193 -1.395 -2.988 -16.916 1.00 0.00 O ATOM 152 CB THR A 193 -0.855 -3.664 -14.246 1.00 0.00 C ATOM 153 OG1 THR A 193 -0.622 -4.335 -13.015 1.00 0.00 O ATOM 154 CG2 THR A 193 -1.495 -2.302 -13.971 1.00 0.00 C ATOM 0 HA THR A 193 -2.731 -4.741 -14.602 1.00 0.00 H new ATOM 0 HB THR A 193 0.090 -3.519 -14.770 1.00 0.00 H new ATOM 0 HG1 THR A 193 -0.998 -3.808 -12.279 1.00 0.00 H new ATOM 0 HG21 THR A 193 -0.824 -1.702 -13.356 1.00 0.00 H new ATOM 0 HG22 THR A 193 -1.678 -1.789 -14.915 1.00 0.00 H new ATOM 0 HG23 THR A 193 -2.440 -2.443 -13.446 1.00 0.00 H new ATOM 162 N PRO A 194 -3.387 -3.994 -16.854 1.00 0.00 N ATOM 163 CA PRO A 194 -3.887 -3.336 -18.087 1.00 0.00 C ATOM 164 C PRO A 194 -4.166 -1.847 -17.848 1.00 0.00 C ATOM 165 O PRO A 194 -5.279 -1.460 -17.573 1.00 0.00 O ATOM 166 CB PRO A 194 -5.195 -4.088 -18.357 1.00 0.00 C ATOM 167 CG PRO A 194 -5.398 -5.140 -17.250 1.00 0.00 C ATOM 168 CD PRO A 194 -4.313 -4.940 -16.185 1.00 0.00 C ATOM 0 HA PRO A 194 -3.176 -3.374 -18.912 1.00 0.00 H new ATOM 0 HB2 PRO A 194 -6.034 -3.392 -18.375 1.00 0.00 H new ATOM 0 HB3 PRO A 194 -5.159 -4.570 -19.334 1.00 0.00 H new ATOM 0 HG2 PRO A 194 -6.388 -5.037 -16.806 1.00 0.00 H new ATOM 0 HG3 PRO A 194 -5.339 -6.145 -17.667 1.00 0.00 H new ATOM 0 HD2 PRO A 194 -4.720 -4.527 -15.262 1.00 0.00 H new ATOM 0 HD3 PRO A 194 -3.820 -5.877 -15.925 1.00 0.00 H new ATOM 176 N GLU A 195 -3.159 -1.022 -17.942 1.00 0.00 N ATOM 177 CA GLU A 195 -3.347 0.449 -17.711 1.00 0.00 C ATOM 178 C GLU A 195 -4.679 0.918 -18.244 1.00 0.00 C ATOM 179 O GLU A 195 -5.504 1.406 -17.522 1.00 0.00 O ATOM 180 CB GLU A 195 -2.293 1.207 -18.531 1.00 0.00 C ATOM 181 CG GLU A 195 -1.132 0.302 -18.959 1.00 0.00 C ATOM 182 CD GLU A 195 0.005 1.157 -19.523 1.00 0.00 C ATOM 183 OE1 GLU A 195 -0.259 1.935 -20.425 1.00 0.00 O ATOM 184 OE2 GLU A 195 1.119 1.019 -19.045 1.00 0.00 O ATOM 0 H GLU A 195 -2.205 -1.301 -18.170 1.00 0.00 H new ATOM 0 HA GLU A 195 -3.274 0.630 -16.639 1.00 0.00 H new ATOM 0 HB2 GLU A 195 -2.763 1.635 -19.416 1.00 0.00 H new ATOM 0 HB3 GLU A 195 -1.906 2.038 -17.942 1.00 0.00 H new ATOM 0 HG2 GLU A 195 -0.776 -0.278 -18.107 1.00 0.00 H new ATOM 0 HG3 GLU A 195 -1.471 -0.411 -19.710 1.00 0.00 H new ATOM 191 N GLU A 196 -4.880 0.819 -19.519 1.00 0.00 N ATOM 192 CA GLU A 196 -6.148 1.323 -20.074 1.00 0.00 C ATOM 193 C GLU A 196 -7.304 0.804 -19.228 1.00 0.00 C ATOM 194 O GLU A 196 -8.205 1.533 -18.856 1.00 0.00 O ATOM 195 CB GLU A 196 -6.215 0.794 -21.507 1.00 0.00 C ATOM 196 CG GLU A 196 -6.804 1.869 -22.424 1.00 0.00 C ATOM 197 CD GLU A 196 -5.712 2.407 -23.347 1.00 0.00 C ATOM 198 OE1 GLU A 196 -4.930 1.609 -23.837 1.00 0.00 O ATOM 199 OE2 GLU A 196 -5.673 3.611 -23.549 1.00 0.00 O ATOM 0 H GLU A 196 -4.229 0.416 -20.192 1.00 0.00 H new ATOM 0 HA GLU A 196 -6.210 2.411 -20.069 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -5.218 0.516 -21.850 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -6.828 -0.106 -21.545 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -7.620 1.451 -23.014 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -7.223 2.680 -21.828 1.00 0.00 H new ATOM 206 N LYS A 197 -7.256 -0.448 -18.886 1.00 0.00 N ATOM 207 CA LYS A 197 -8.327 -1.017 -18.022 1.00 0.00 C ATOM 208 C LYS A 197 -8.090 -0.534 -16.594 1.00 0.00 C ATOM 209 O LYS A 197 -9.003 -0.390 -15.803 1.00 0.00 O ATOM 210 CB LYS A 197 -8.174 -2.534 -18.121 1.00 0.00 C ATOM 211 CG LYS A 197 -9.554 -3.192 -18.035 1.00 0.00 C ATOM 212 CD LYS A 197 -9.394 -4.686 -17.749 1.00 0.00 C ATOM 213 CE LYS A 197 -10.747 -5.383 -17.899 1.00 0.00 C ATOM 214 NZ LYS A 197 -11.501 -5.030 -16.664 1.00 0.00 N ATOM 0 H LYS A 197 -6.525 -1.103 -19.165 1.00 0.00 H new ATOM 0 HA LYS A 197 -9.330 -0.714 -18.321 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -7.690 -2.801 -19.060 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -7.534 -2.899 -17.318 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -10.144 -2.722 -17.248 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -10.096 -3.046 -18.969 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -8.670 -5.123 -18.437 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -9.006 -4.835 -16.741 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -11.270 -5.041 -18.792 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -10.627 -6.462 -17.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -12.097 -5.833 -16.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -10.831 -4.808 -15.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -12.102 -4.202 -16.849 1.00 0.00 H new ATOM 228 N ILE A 198 -6.858 -0.253 -16.272 1.00 0.00 N ATOM 229 CA ILE A 198 -6.538 0.254 -14.917 1.00 0.00 C ATOM 230 C ILE A 198 -7.211 1.615 -14.752 1.00 0.00 C ATOM 231 O ILE A 198 -7.943 1.857 -13.818 1.00 0.00 O ATOM 232 CB ILE A 198 -4.995 0.345 -14.881 1.00 0.00 C ATOM 233 CG1 ILE A 198 -4.504 -0.335 -13.608 1.00 0.00 C ATOM 234 CG2 ILE A 198 -4.521 1.807 -14.859 1.00 0.00 C ATOM 235 CD1 ILE A 198 -4.853 -1.824 -13.652 1.00 0.00 C ATOM 0 H ILE A 198 -6.057 -0.355 -16.896 1.00 0.00 H new ATOM 0 HA ILE A 198 -6.893 -0.378 -14.103 1.00 0.00 H new ATOM 0 HB ILE A 198 -4.598 -0.137 -15.774 1.00 0.00 H new ATOM 0 HG12 ILE A 198 -3.426 -0.207 -13.508 1.00 0.00 H new ATOM 0 HG13 ILE A 198 -4.962 0.130 -12.735 1.00 0.00 H new ATOM 0 HG21 ILE A 198 -3.432 1.836 -14.834 1.00 0.00 H new ATOM 0 HG22 ILE A 198 -4.877 2.318 -15.753 1.00 0.00 H new ATOM 0 HG23 ILE A 198 -4.918 2.305 -13.974 1.00 0.00 H new ATOM 0 HD11 ILE A 198 -4.501 -2.307 -12.741 1.00 0.00 H new ATOM 0 HD12 ILE A 198 -5.934 -1.942 -13.731 1.00 0.00 H new ATOM 0 HD13 ILE A 198 -4.374 -2.285 -14.516 1.00 0.00 H new ATOM 247 N ARG A 199 -6.978 2.489 -15.685 1.00 0.00 N ATOM 248 CA ARG A 199 -7.605 3.830 -15.636 1.00 0.00 C ATOM 249 C ARG A 199 -9.117 3.658 -15.505 1.00 0.00 C ATOM 250 O ARG A 199 -9.775 4.386 -14.792 1.00 0.00 O ATOM 251 CB ARG A 199 -7.238 4.482 -16.975 1.00 0.00 C ATOM 252 CG ARG A 199 -6.131 5.514 -16.750 1.00 0.00 C ATOM 253 CD ARG A 199 -5.192 5.532 -17.958 1.00 0.00 C ATOM 254 NE ARG A 199 -4.479 6.837 -17.872 1.00 0.00 N ATOM 255 CZ ARG A 199 -4.864 7.842 -18.610 1.00 0.00 C ATOM 256 NH1 ARG A 199 -6.047 8.364 -18.434 1.00 0.00 N ATOM 257 NH2 ARG A 199 -4.067 8.325 -19.523 1.00 0.00 N ATOM 0 H ARG A 199 -6.372 2.327 -16.489 1.00 0.00 H new ATOM 0 HA ARG A 199 -7.270 4.438 -14.795 1.00 0.00 H new ATOM 0 HB2 ARG A 199 -6.905 3.723 -17.683 1.00 0.00 H new ATOM 0 HB3 ARG A 199 -8.114 4.961 -17.411 1.00 0.00 H new ATOM 0 HG2 ARG A 199 -6.566 6.502 -16.600 1.00 0.00 H new ATOM 0 HG3 ARG A 199 -5.572 5.272 -15.846 1.00 0.00 H new ATOM 0 HD2 ARG A 199 -4.492 4.697 -17.926 1.00 0.00 H new ATOM 0 HD3 ARG A 199 -5.748 5.447 -18.892 1.00 0.00 H new ATOM 0 HE ARG A 199 -3.689 6.945 -17.236 1.00 0.00 H new ATOM 0 HH11 ARG A 199 -6.670 7.986 -17.720 1.00 0.00 H new ATOM 0 HH12 ARG A 199 -6.349 9.150 -19.010 1.00 0.00 H new ATOM 0 HH21 ARG A 199 -3.142 7.917 -19.660 1.00 0.00 H new ATOM 0 HH22 ARG A 199 -4.369 9.111 -20.099 1.00 0.00 H new ATOM 271 N GLU A 200 -9.668 2.683 -16.177 1.00 0.00 N ATOM 272 CA GLU A 200 -11.137 2.452 -16.072 1.00 0.00 C ATOM 273 C GLU A 200 -11.524 2.249 -14.629 1.00 0.00 C ATOM 274 O GLU A 200 -12.530 2.756 -14.175 1.00 0.00 O ATOM 275 CB GLU A 200 -11.419 1.194 -16.897 1.00 0.00 C ATOM 276 CG GLU A 200 -11.529 1.565 -18.377 1.00 0.00 C ATOM 277 CD GLU A 200 -12.289 0.466 -19.122 1.00 0.00 C ATOM 278 OE1 GLU A 200 -13.393 0.152 -18.708 1.00 0.00 O ATOM 279 OE2 GLU A 200 -11.754 -0.043 -20.093 1.00 0.00 O ATOM 0 H GLU A 200 -9.168 2.040 -16.791 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.713 3.301 -16.440 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -10.621 0.466 -16.753 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -12.343 0.725 -16.560 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -12.046 2.518 -18.487 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -10.535 1.690 -18.807 1.00 0.00 H new ATOM 286 N TYR A 201 -10.753 1.526 -13.887 1.00 0.00 N ATOM 287 CA TYR A 201 -11.141 1.344 -12.480 1.00 0.00 C ATOM 288 C TYR A 201 -10.510 2.432 -11.621 1.00 0.00 C ATOM 289 O TYR A 201 -11.179 3.311 -11.113 1.00 0.00 O ATOM 290 CB TYR A 201 -10.609 -0.023 -12.065 1.00 0.00 C ATOM 291 CG TYR A 201 -11.517 -0.634 -11.025 1.00 0.00 C ATOM 292 CD1 TYR A 201 -11.303 -0.367 -9.667 1.00 0.00 C ATOM 293 CD2 TYR A 201 -12.568 -1.470 -11.417 1.00 0.00 C ATOM 294 CE1 TYR A 201 -12.142 -0.936 -8.701 1.00 0.00 C ATOM 295 CE2 TYR A 201 -13.406 -2.039 -10.451 1.00 0.00 C ATOM 296 CZ TYR A 201 -13.194 -1.772 -9.093 1.00 0.00 C ATOM 297 OH TYR A 201 -14.019 -2.335 -8.142 1.00 0.00 O ATOM 0 H TYR A 201 -9.893 1.064 -14.184 1.00 0.00 H new ATOM 0 HA TYR A 201 -12.222 1.406 -12.353 1.00 0.00 H new ATOM 0 HB2 TYR A 201 -10.545 -0.677 -12.934 1.00 0.00 H new ATOM 0 HB3 TYR A 201 -9.599 0.076 -11.666 1.00 0.00 H new ATOM 0 HD1 TYR A 201 -10.491 0.278 -9.365 1.00 0.00 H new ATOM 0 HD2 TYR A 201 -12.733 -1.676 -12.464 1.00 0.00 H new ATOM 0 HE1 TYR A 201 -11.977 -0.730 -7.654 1.00 0.00 H new ATOM 0 HE2 TYR A 201 -14.217 -2.685 -10.753 1.00 0.00 H new ATOM 0 HH TYR A 201 -14.698 -2.887 -8.583 1.00 0.00 H new ATOM 307 N PHE A 202 -9.220 2.375 -11.455 1.00 0.00 N ATOM 308 CA PHE A 202 -8.540 3.398 -10.630 1.00 0.00 C ATOM 309 C PHE A 202 -8.825 4.784 -11.205 1.00 0.00 C ATOM 310 O PHE A 202 -9.320 5.662 -10.522 1.00 0.00 O ATOM 311 CB PHE A 202 -7.047 3.060 -10.711 1.00 0.00 C ATOM 312 CG PHE A 202 -6.822 1.629 -10.289 1.00 0.00 C ATOM 313 CD1 PHE A 202 -6.732 1.297 -8.932 1.00 0.00 C ATOM 314 CD2 PHE A 202 -6.692 0.631 -11.263 1.00 0.00 C ATOM 315 CE1 PHE A 202 -6.513 -0.034 -8.549 1.00 0.00 C ATOM 316 CE2 PHE A 202 -6.475 -0.698 -10.880 1.00 0.00 C ATOM 317 CZ PHE A 202 -6.386 -1.030 -9.523 1.00 0.00 C ATOM 0 H PHE A 202 -8.610 1.663 -11.857 1.00 0.00 H new ATOM 0 HA PHE A 202 -8.884 3.403 -9.596 1.00 0.00 H new ATOM 0 HB2 PHE A 202 -6.686 3.210 -11.729 1.00 0.00 H new ATOM 0 HB3 PHE A 202 -6.478 3.732 -10.069 1.00 0.00 H new ATOM 0 HD1 PHE A 202 -6.831 2.066 -8.180 1.00 0.00 H new ATOM 0 HD2 PHE A 202 -6.759 0.887 -12.310 1.00 0.00 H new ATOM 0 HE1 PHE A 202 -6.442 -0.290 -7.502 1.00 0.00 H new ATOM 0 HE2 PHE A 202 -6.376 -1.467 -11.632 1.00 0.00 H new ATOM 0 HZ PHE A 202 -6.219 -2.055 -9.228 1.00 0.00 H new ATOM 327 N GLY A 203 -8.552 4.984 -12.464 1.00 0.00 N ATOM 328 CA GLY A 203 -8.854 6.304 -13.067 1.00 0.00 C ATOM 329 C GLY A 203 -10.309 6.617 -12.749 1.00 0.00 C ATOM 330 O GLY A 203 -10.717 7.759 -12.680 1.00 0.00 O ATOM 0 H GLY A 203 -8.137 4.296 -13.093 1.00 0.00 H new ATOM 0 HA2 GLY A 203 -8.197 7.073 -12.661 1.00 0.00 H new ATOM 0 HA3 GLY A 203 -8.691 6.282 -14.145 1.00 0.00 H new ATOM 334 N GLY A 204 -11.089 5.592 -12.525 1.00 0.00 N ATOM 335 CA GLY A 204 -12.516 5.802 -12.176 1.00 0.00 C ATOM 336 C GLY A 204 -12.578 6.552 -10.849 1.00 0.00 C ATOM 337 O GLY A 204 -13.304 7.515 -10.703 1.00 0.00 O ATOM 0 H GLY A 204 -10.794 4.617 -12.570 1.00 0.00 H new ATOM 0 HA2 GLY A 204 -13.019 6.371 -12.958 1.00 0.00 H new ATOM 0 HA3 GLY A 204 -13.032 4.845 -12.096 1.00 0.00 H new ATOM 341 N PHE A 205 -11.801 6.134 -9.882 1.00 0.00 N ATOM 342 CA PHE A 205 -11.808 6.855 -8.576 1.00 0.00 C ATOM 343 C PHE A 205 -11.463 8.321 -8.825 1.00 0.00 C ATOM 344 O PHE A 205 -11.944 9.216 -8.158 1.00 0.00 O ATOM 345 CB PHE A 205 -10.719 6.185 -7.740 1.00 0.00 C ATOM 346 CG PHE A 205 -11.198 4.830 -7.292 1.00 0.00 C ATOM 347 CD1 PHE A 205 -11.059 3.725 -8.139 1.00 0.00 C ATOM 348 CD2 PHE A 205 -11.779 4.678 -6.029 1.00 0.00 C ATOM 349 CE1 PHE A 205 -11.505 2.465 -7.721 1.00 0.00 C ATOM 350 CE2 PHE A 205 -12.224 3.421 -5.610 1.00 0.00 C ATOM 351 CZ PHE A 205 -12.087 2.313 -6.455 1.00 0.00 C ATOM 0 H PHE A 205 -11.170 5.335 -9.939 1.00 0.00 H new ATOM 0 HA PHE A 205 -12.774 6.816 -8.073 1.00 0.00 H new ATOM 0 HB2 PHE A 205 -9.805 6.085 -8.325 1.00 0.00 H new ATOM 0 HB3 PHE A 205 -10.477 6.802 -6.875 1.00 0.00 H new ATOM 0 HD1 PHE A 205 -10.609 3.844 -9.113 1.00 0.00 H new ATOM 0 HD2 PHE A 205 -11.884 5.533 -5.377 1.00 0.00 H new ATOM 0 HE1 PHE A 205 -11.401 1.611 -8.374 1.00 0.00 H new ATOM 0 HE2 PHE A 205 -12.673 3.304 -4.635 1.00 0.00 H new ATOM 0 HZ PHE A 205 -12.430 1.341 -6.131 1.00 0.00 H new ATOM 361 N GLY A 206 -10.629 8.556 -9.794 1.00 0.00 N ATOM 362 CA GLY A 206 -10.222 9.946 -10.134 1.00 0.00 C ATOM 363 C GLY A 206 -9.293 9.880 -11.343 1.00 0.00 C ATOM 364 O GLY A 206 -8.474 8.988 -11.445 1.00 0.00 O ATOM 0 H GLY A 206 -10.205 7.833 -10.375 1.00 0.00 H new ATOM 0 HA2 GLY A 206 -11.097 10.556 -10.358 1.00 0.00 H new ATOM 0 HA3 GLY A 206 -9.716 10.413 -9.289 1.00 0.00 H new ATOM 368 N GLU A 207 -9.416 10.793 -12.266 1.00 0.00 N ATOM 369 CA GLU A 207 -8.532 10.740 -13.466 1.00 0.00 C ATOM 370 C GLU A 207 -7.103 10.401 -13.050 1.00 0.00 C ATOM 371 O GLU A 207 -6.624 10.828 -12.018 1.00 0.00 O ATOM 372 CB GLU A 207 -8.589 12.129 -14.092 1.00 0.00 C ATOM 373 CG GLU A 207 -8.256 13.182 -13.034 1.00 0.00 C ATOM 374 CD GLU A 207 -7.501 14.341 -13.688 1.00 0.00 C ATOM 375 OE1 GLU A 207 -7.484 14.398 -14.907 1.00 0.00 O ATOM 376 OE2 GLU A 207 -6.952 15.150 -12.960 1.00 0.00 O ATOM 0 H GLU A 207 -10.082 11.565 -12.244 1.00 0.00 H new ATOM 0 HA GLU A 207 -8.856 9.974 -14.171 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -7.883 12.195 -14.920 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -9.581 12.313 -14.503 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -9.171 13.547 -12.568 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -7.650 12.740 -12.243 1.00 0.00 H new ATOM 383 N VAL A 208 -6.430 9.619 -13.838 1.00 0.00 N ATOM 384 CA VAL A 208 -5.045 9.224 -13.496 1.00 0.00 C ATOM 385 C VAL A 208 -4.029 10.061 -14.265 1.00 0.00 C ATOM 386 O VAL A 208 -4.227 10.401 -15.415 1.00 0.00 O ATOM 387 CB VAL A 208 -4.954 7.766 -13.950 1.00 0.00 C ATOM 388 CG1 VAL A 208 -3.486 7.361 -14.134 1.00 0.00 C ATOM 389 CG2 VAL A 208 -5.604 6.868 -12.907 1.00 0.00 C ATOM 0 H VAL A 208 -6.785 9.233 -14.713 1.00 0.00 H new ATOM 0 HA VAL A 208 -4.830 9.365 -12.437 1.00 0.00 H new ATOM 0 HB VAL A 208 -5.474 7.657 -14.902 1.00 0.00 H new ATOM 0 HG11 VAL A 208 -3.433 6.321 -14.457 1.00 0.00 H new ATOM 0 HG12 VAL A 208 -3.024 7.999 -14.887 1.00 0.00 H new ATOM 0 HG13 VAL A 208 -2.956 7.474 -13.188 1.00 0.00 H new ATOM 0 HG21 VAL A 208 -5.539 5.829 -13.230 1.00 0.00 H new ATOM 0 HG22 VAL A 208 -5.088 6.984 -11.954 1.00 0.00 H new ATOM 0 HG23 VAL A 208 -6.651 7.147 -12.789 1.00 0.00 H new ATOM 399 N GLU A 209 -2.911 10.329 -13.660 1.00 0.00 N ATOM 400 CA GLU A 209 -1.851 11.069 -14.379 1.00 0.00 C ATOM 401 C GLU A 209 -1.014 10.011 -15.082 1.00 0.00 C ATOM 402 O GLU A 209 -0.872 10.005 -16.289 1.00 0.00 O ATOM 403 CB GLU A 209 -1.043 11.789 -13.300 1.00 0.00 C ATOM 404 CG GLU A 209 -0.163 12.858 -13.950 1.00 0.00 C ATOM 405 CD GLU A 209 -0.105 14.090 -13.045 1.00 0.00 C ATOM 406 OE1 GLU A 209 0.403 13.967 -11.943 1.00 0.00 O ATOM 407 OE2 GLU A 209 -0.570 15.135 -13.468 1.00 0.00 O ATOM 0 H GLU A 209 -2.688 10.067 -12.700 1.00 0.00 H new ATOM 0 HA GLU A 209 -2.213 11.793 -15.109 1.00 0.00 H new ATOM 0 HB2 GLU A 209 -1.714 12.247 -12.573 1.00 0.00 H new ATOM 0 HB3 GLU A 209 -0.425 11.075 -12.756 1.00 0.00 H new ATOM 0 HG2 GLU A 209 0.841 12.467 -14.115 1.00 0.00 H new ATOM 0 HG3 GLU A 209 -0.564 13.129 -14.927 1.00 0.00 H new ATOM 414 N SER A 210 -0.512 9.072 -14.327 1.00 0.00 N ATOM 415 CA SER A 210 0.254 7.961 -14.925 1.00 0.00 C ATOM 416 C SER A 210 0.126 6.764 -13.996 1.00 0.00 C ATOM 417 O SER A 210 -0.226 6.913 -12.846 1.00 0.00 O ATOM 418 CB SER A 210 1.699 8.448 -15.014 1.00 0.00 C ATOM 419 OG SER A 210 1.847 9.270 -16.165 1.00 0.00 O ATOM 0 H SER A 210 -0.605 9.034 -13.312 1.00 0.00 H new ATOM 0 HA SER A 210 -0.100 7.668 -15.913 1.00 0.00 H new ATOM 0 HB2 SER A 210 1.962 9.008 -14.117 1.00 0.00 H new ATOM 0 HB3 SER A 210 2.379 7.598 -15.070 1.00 0.00 H new ATOM 0 HG SER A 210 0.971 9.615 -16.435 1.00 0.00 H new ATOM 425 N ILE A 211 0.400 5.585 -14.452 1.00 0.00 N ATOM 426 CA ILE A 211 0.279 4.431 -13.529 1.00 0.00 C ATOM 427 C ILE A 211 1.643 3.810 -13.282 1.00 0.00 C ATOM 428 O ILE A 211 2.666 4.343 -13.661 1.00 0.00 O ATOM 429 CB ILE A 211 -0.636 3.425 -14.205 1.00 0.00 C ATOM 430 CG1 ILE A 211 -0.037 2.999 -15.548 1.00 0.00 C ATOM 431 CG2 ILE A 211 -2.008 4.053 -14.429 1.00 0.00 C ATOM 432 CD1 ILE A 211 -0.384 1.535 -15.819 1.00 0.00 C ATOM 0 H ILE A 211 0.697 5.368 -15.403 1.00 0.00 H new ATOM 0 HA ILE A 211 -0.123 4.743 -12.565 1.00 0.00 H new ATOM 0 HB ILE A 211 -0.740 2.548 -13.567 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -0.425 3.630 -16.348 1.00 0.00 H new ATOM 0 HG13 ILE A 211 1.045 3.131 -15.534 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -2.664 3.330 -14.914 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -2.436 4.345 -13.470 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -1.906 4.934 -15.063 1.00 0.00 H new ATOM 0 HD11 ILE A 211 0.042 1.231 -16.775 1.00 0.00 H new ATOM 0 HD12 ILE A 211 0.025 0.911 -15.024 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -1.467 1.418 -15.851 1.00 0.00 H new ATOM 444 N GLU A 212 1.658 2.685 -12.642 1.00 0.00 N ATOM 445 CA GLU A 212 2.949 2.012 -12.353 1.00 0.00 C ATOM 446 C GLU A 212 2.748 0.498 -12.273 1.00 0.00 C ATOM 447 O GLU A 212 1.782 0.016 -11.723 1.00 0.00 O ATOM 448 CB GLU A 212 3.374 2.578 -11.001 1.00 0.00 C ATOM 449 CG GLU A 212 4.505 1.723 -10.422 1.00 0.00 C ATOM 450 CD GLU A 212 5.595 1.530 -11.478 1.00 0.00 C ATOM 451 OE1 GLU A 212 5.670 2.346 -12.381 1.00 0.00 O ATOM 452 OE2 GLU A 212 6.339 0.569 -11.364 1.00 0.00 O ATOM 0 H GLU A 212 0.829 2.197 -12.303 1.00 0.00 H new ATOM 0 HA GLU A 212 3.699 2.184 -13.125 1.00 0.00 H new ATOM 0 HB2 GLU A 212 3.706 3.610 -11.115 1.00 0.00 H new ATOM 0 HB3 GLU A 212 2.526 2.590 -10.317 1.00 0.00 H new ATOM 0 HG2 GLU A 212 4.922 2.205 -9.538 1.00 0.00 H new ATOM 0 HG3 GLU A 212 4.117 0.755 -10.104 1.00 0.00 H new ATOM 459 N LEU A 213 3.647 -0.261 -12.817 1.00 0.00 N ATOM 460 CA LEU A 213 3.487 -1.738 -12.764 1.00 0.00 C ATOM 461 C LEU A 213 4.526 -2.343 -11.846 1.00 0.00 C ATOM 462 O LEU A 213 5.411 -1.651 -11.382 1.00 0.00 O ATOM 463 CB LEU A 213 3.708 -2.203 -14.192 1.00 0.00 C ATOM 464 CG LEU A 213 2.608 -1.643 -15.104 1.00 0.00 C ATOM 465 CD1 LEU A 213 1.274 -1.587 -14.347 1.00 0.00 C ATOM 466 CD2 LEU A 213 2.991 -0.232 -15.554 1.00 0.00 C ATOM 0 H LEU A 213 4.484 0.072 -13.295 1.00 0.00 H new ATOM 0 HA LEU A 213 2.511 -2.036 -12.380 1.00 0.00 H new ATOM 0 HB2 LEU A 213 4.686 -1.873 -14.543 1.00 0.00 H new ATOM 0 HB3 LEU A 213 3.706 -3.292 -14.233 1.00 0.00 H new ATOM 0 HG LEU A 213 2.501 -2.293 -15.972 1.00 0.00 H new ATOM 0 HD11 LEU A 213 0.500 -1.188 -15.003 1.00 0.00 H new ATOM 0 HD12 LEU A 213 0.996 -2.591 -14.026 1.00 0.00 H new ATOM 0 HD13 LEU A 213 1.378 -0.942 -13.474 1.00 0.00 H new ATOM 0 HD21 LEU A 213 2.211 0.168 -16.202 1.00 0.00 H new ATOM 0 HD22 LEU A 213 3.102 0.411 -14.681 1.00 0.00 H new ATOM 0 HD23 LEU A 213 3.933 -0.268 -16.100 1.00 0.00 H new ATOM 478 N PRO A 214 4.398 -3.616 -11.590 1.00 0.00 N ATOM 479 CA PRO A 214 5.355 -4.267 -10.706 1.00 0.00 C ATOM 480 C PRO A 214 6.796 -3.954 -11.126 1.00 0.00 C ATOM 481 O PRO A 214 7.448 -3.109 -10.545 1.00 0.00 O ATOM 482 CB PRO A 214 5.014 -5.752 -10.856 1.00 0.00 C ATOM 483 CG PRO A 214 3.828 -5.879 -11.830 1.00 0.00 C ATOM 484 CD PRO A 214 3.315 -4.467 -12.148 1.00 0.00 C ATOM 0 HA PRO A 214 5.292 -3.930 -9.671 1.00 0.00 H new ATOM 0 HB2 PRO A 214 5.876 -6.303 -11.233 1.00 0.00 H new ATOM 0 HB3 PRO A 214 4.758 -6.183 -9.888 1.00 0.00 H new ATOM 0 HG2 PRO A 214 4.139 -6.385 -12.744 1.00 0.00 H new ATOM 0 HG3 PRO A 214 3.035 -6.481 -11.387 1.00 0.00 H new ATOM 0 HD2 PRO A 214 3.184 -4.311 -13.219 1.00 0.00 H new ATOM 0 HD3 PRO A 214 2.353 -4.266 -11.676 1.00 0.00 H new ATOM 662 N PHE A 225 3.558 -6.565 -7.329 1.00 0.00 N ATOM 663 CA PHE A 225 2.289 -5.771 -7.401 1.00 0.00 C ATOM 664 C PHE A 225 2.374 -4.724 -8.505 1.00 0.00 C ATOM 665 O PHE A 225 3.248 -4.751 -9.341 1.00 0.00 O ATOM 666 CB PHE A 225 2.172 -5.072 -6.044 1.00 0.00 C ATOM 667 CG PHE A 225 3.542 -4.771 -5.471 1.00 0.00 C ATOM 668 CD1 PHE A 225 4.449 -3.986 -6.193 1.00 0.00 C ATOM 669 CD2 PHE A 225 3.900 -5.279 -4.216 1.00 0.00 C ATOM 670 CE1 PHE A 225 5.714 -3.710 -5.659 1.00 0.00 C ATOM 671 CE2 PHE A 225 5.166 -5.003 -3.684 1.00 0.00 C ATOM 672 CZ PHE A 225 6.072 -4.219 -4.405 1.00 0.00 C ATOM 0 HA PHE A 225 1.432 -6.408 -7.619 1.00 0.00 H new ATOM 0 HB2 PHE A 225 1.608 -4.146 -6.155 1.00 0.00 H new ATOM 0 HB3 PHE A 225 1.615 -5.703 -5.352 1.00 0.00 H new ATOM 0 HD1 PHE A 225 4.173 -3.594 -7.161 1.00 0.00 H new ATOM 0 HD2 PHE A 225 3.200 -5.884 -3.658 1.00 0.00 H new ATOM 0 HE1 PHE A 225 6.414 -3.104 -6.215 1.00 0.00 H new ATOM 0 HE2 PHE A 225 5.442 -5.396 -2.717 1.00 0.00 H new ATOM 0 HZ PHE A 225 7.048 -4.006 -3.994 1.00 0.00 H new ATOM 682 N CYS A 226 1.467 -3.795 -8.501 1.00 0.00 N ATOM 683 CA CYS A 226 1.479 -2.727 -9.537 1.00 0.00 C ATOM 684 C CYS A 226 0.961 -1.424 -8.906 1.00 0.00 C ATOM 685 O CYS A 226 -0.094 -1.398 -8.311 1.00 0.00 O ATOM 686 CB CYS A 226 0.537 -3.245 -10.639 1.00 0.00 C ATOM 687 SG CYS A 226 -1.199 -2.885 -10.253 1.00 0.00 S ATOM 0 H CYS A 226 0.711 -3.727 -7.820 1.00 0.00 H new ATOM 0 HA CYS A 226 2.468 -2.513 -9.941 1.00 0.00 H new ATOM 0 HB2 CYS A 226 0.802 -2.786 -11.591 1.00 0.00 H new ATOM 0 HB3 CYS A 226 0.669 -4.321 -10.756 1.00 0.00 H new ATOM 0 HG CYS A 226 -1.258 -1.987 -9.315 1.00 0.00 H new ATOM 693 N PHE A 227 1.676 -0.343 -9.014 1.00 0.00 N ATOM 694 CA PHE A 227 1.164 0.915 -8.395 1.00 0.00 C ATOM 695 C PHE A 227 0.502 1.777 -9.464 1.00 0.00 C ATOM 696 O PHE A 227 0.358 1.384 -10.599 1.00 0.00 O ATOM 697 CB PHE A 227 2.378 1.665 -7.826 1.00 0.00 C ATOM 698 CG PHE A 227 2.912 1.014 -6.564 1.00 0.00 C ATOM 699 CD1 PHE A 227 3.006 -0.385 -6.445 1.00 0.00 C ATOM 700 CD2 PHE A 227 3.347 1.833 -5.511 1.00 0.00 C ATOM 701 CE1 PHE A 227 3.532 -0.953 -5.276 1.00 0.00 C ATOM 702 CE2 PHE A 227 3.867 1.261 -4.341 1.00 0.00 C ATOM 703 CZ PHE A 227 3.962 -0.132 -4.225 1.00 0.00 C ATOM 0 H PHE A 227 2.574 -0.271 -9.492 1.00 0.00 H new ATOM 0 HA PHE A 227 0.434 0.695 -7.616 1.00 0.00 H new ATOM 0 HB2 PHE A 227 3.167 1.699 -8.577 1.00 0.00 H new ATOM 0 HB3 PHE A 227 2.098 2.696 -7.611 1.00 0.00 H new ATOM 0 HD1 PHE A 227 2.674 -1.020 -7.253 1.00 0.00 H new ATOM 0 HD2 PHE A 227 3.281 2.907 -5.602 1.00 0.00 H new ATOM 0 HE1 PHE A 227 3.606 -2.027 -5.185 1.00 0.00 H new ATOM 0 HE2 PHE A 227 4.194 1.894 -3.530 1.00 0.00 H new ATOM 0 HZ PHE A 227 4.366 -0.573 -3.326 1.00 0.00 H new ATOM 713 N ILE A 228 0.121 2.959 -9.101 1.00 0.00 N ATOM 714 CA ILE A 228 -0.510 3.889 -10.073 1.00 0.00 C ATOM 715 C ILE A 228 -0.461 5.291 -9.466 1.00 0.00 C ATOM 716 O ILE A 228 -0.814 5.472 -8.319 1.00 0.00 O ATOM 717 CB ILE A 228 -1.961 3.424 -10.210 1.00 0.00 C ATOM 718 CG1 ILE A 228 -2.009 2.173 -11.101 1.00 0.00 C ATOM 719 CG2 ILE A 228 -2.793 4.556 -10.827 1.00 0.00 C ATOM 720 CD1 ILE A 228 -3.346 2.088 -11.840 1.00 0.00 C ATOM 0 H ILE A 228 0.220 3.331 -8.156 1.00 0.00 H new ATOM 0 HA ILE A 228 -0.014 3.902 -11.043 1.00 0.00 H new ATOM 0 HB ILE A 228 -2.372 3.175 -9.232 1.00 0.00 H new ATOM 0 HG12 ILE A 228 -1.191 2.201 -11.821 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -1.867 1.280 -10.492 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -3.829 4.233 -10.928 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -2.748 5.434 -10.182 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -2.394 4.807 -11.810 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -3.360 1.195 -12.465 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -4.159 2.037 -11.116 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -3.473 2.971 -12.466 1.00 0.00 H new ATOM 732 N THR A 229 -0.035 6.294 -10.181 1.00 0.00 N ATOM 733 CA THR A 229 0.000 7.636 -9.547 1.00 0.00 C ATOM 734 C THR A 229 -1.102 8.487 -10.125 1.00 0.00 C ATOM 735 O THR A 229 -1.376 8.458 -11.308 1.00 0.00 O ATOM 736 CB THR A 229 1.380 8.219 -9.856 1.00 0.00 C ATOM 737 OG1 THR A 229 1.631 9.310 -8.981 1.00 0.00 O ATOM 738 CG2 THR A 229 1.428 8.707 -11.303 1.00 0.00 C ATOM 0 H THR A 229 0.282 6.246 -11.149 1.00 0.00 H new ATOM 0 HA THR A 229 -0.157 7.592 -8.469 1.00 0.00 H new ATOM 0 HB THR A 229 2.138 7.448 -9.715 1.00 0.00 H new ATOM 0 HG1 THR A 229 2.515 9.687 -9.173 1.00 0.00 H new ATOM 0 HG21 THR A 229 2.414 9.121 -11.515 1.00 0.00 H new ATOM 0 HG22 THR A 229 1.233 7.872 -11.975 1.00 0.00 H new ATOM 0 HG23 THR A 229 0.672 9.477 -11.452 1.00 0.00 H new ATOM 746 N PHE A 230 -1.742 9.241 -9.302 1.00 0.00 N ATOM 747 CA PHE A 230 -2.846 10.093 -9.835 1.00 0.00 C ATOM 748 C PHE A 230 -2.411 11.563 -9.900 1.00 0.00 C ATOM 749 O PHE A 230 -1.360 11.878 -10.419 1.00 0.00 O ATOM 750 CB PHE A 230 -4.012 9.900 -8.876 1.00 0.00 C ATOM 751 CG PHE A 230 -4.442 8.453 -8.847 1.00 0.00 C ATOM 752 CD1 PHE A 230 -4.530 7.716 -10.033 1.00 0.00 C ATOM 753 CD2 PHE A 230 -4.753 7.849 -7.623 1.00 0.00 C ATOM 754 CE1 PHE A 230 -4.931 6.373 -9.993 1.00 0.00 C ATOM 755 CE2 PHE A 230 -5.153 6.509 -7.583 1.00 0.00 C ATOM 756 CZ PHE A 230 -5.242 5.772 -8.768 1.00 0.00 C ATOM 0 H PHE A 230 -1.564 9.314 -8.300 1.00 0.00 H new ATOM 0 HA PHE A 230 -3.122 9.813 -10.851 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -3.723 10.219 -7.875 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -4.849 10.528 -9.182 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -4.289 8.181 -10.978 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -4.684 8.418 -6.708 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -5.000 5.802 -10.907 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -5.393 6.044 -6.638 1.00 0.00 H new ATOM 0 HZ PHE A 230 -5.551 4.738 -8.738 1.00 0.00 H new ATOM 766 N LYS A 231 -3.212 12.470 -9.403 1.00 0.00 N ATOM 767 CA LYS A 231 -2.824 13.910 -9.478 1.00 0.00 C ATOM 768 C LYS A 231 -3.013 14.653 -8.138 1.00 0.00 C ATOM 769 O LYS A 231 -2.065 15.145 -7.559 1.00 0.00 O ATOM 770 CB LYS A 231 -3.761 14.484 -10.536 1.00 0.00 C ATOM 771 CG LYS A 231 -2.940 15.044 -11.701 1.00 0.00 C ATOM 772 CD LYS A 231 -3.717 16.176 -12.374 1.00 0.00 C ATOM 773 CE LYS A 231 -3.389 17.502 -11.684 1.00 0.00 C ATOM 774 NZ LYS A 231 -4.439 18.449 -12.153 1.00 0.00 N ATOM 0 H LYS A 231 -4.108 12.279 -8.954 1.00 0.00 H new ATOM 0 HA LYS A 231 -1.766 14.023 -9.716 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -4.439 13.709 -10.895 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -4.378 15.271 -10.102 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -1.980 15.412 -11.339 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -2.728 14.255 -12.423 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -3.458 16.230 -13.431 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -4.788 15.980 -12.318 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -3.407 17.398 -10.599 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -2.393 17.852 -11.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -4.282 19.383 -11.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -4.393 18.533 -13.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -5.376 18.093 -11.876 1.00 0.00 H new ATOM 788 N GLU A 232 -4.229 14.782 -7.671 1.00 0.00 N ATOM 789 CA GLU A 232 -4.479 15.546 -6.401 1.00 0.00 C ATOM 790 C GLU A 232 -4.123 14.755 -5.129 1.00 0.00 C ATOM 791 O GLU A 232 -3.086 14.972 -4.536 1.00 0.00 O ATOM 792 CB GLU A 232 -5.976 15.860 -6.426 1.00 0.00 C ATOM 793 CG GLU A 232 -6.369 16.363 -7.810 1.00 0.00 C ATOM 794 CD GLU A 232 -7.089 17.708 -7.683 1.00 0.00 C ATOM 795 OE1 GLU A 232 -8.283 17.698 -7.435 1.00 0.00 O ATOM 796 OE2 GLU A 232 -6.431 18.725 -7.834 1.00 0.00 O ATOM 0 H GLU A 232 -5.063 14.393 -8.111 1.00 0.00 H new ATOM 0 HA GLU A 232 -3.848 16.434 -6.363 1.00 0.00 H new ATOM 0 HB2 GLU A 232 -6.549 14.967 -6.176 1.00 0.00 H new ATOM 0 HB3 GLU A 232 -6.213 16.612 -5.674 1.00 0.00 H new ATOM 0 HG2 GLU A 232 -5.482 16.472 -8.434 1.00 0.00 H new ATOM 0 HG3 GLU A 232 -7.017 15.637 -8.301 1.00 0.00 H new ATOM 803 N GLU A 233 -4.995 13.873 -4.689 1.00 0.00 N ATOM 804 CA GLU A 233 -4.755 13.082 -3.423 1.00 0.00 C ATOM 805 C GLU A 233 -6.096 12.479 -2.953 1.00 0.00 C ATOM 806 O GLU A 233 -6.145 11.481 -2.254 1.00 0.00 O ATOM 807 CB GLU A 233 -4.272 14.102 -2.383 1.00 0.00 C ATOM 808 CG GLU A 233 -5.177 15.339 -2.399 1.00 0.00 C ATOM 809 CD GLU A 233 -4.428 16.527 -1.795 1.00 0.00 C ATOM 810 OE1 GLU A 233 -3.388 16.881 -2.329 1.00 0.00 O ATOM 811 OE2 GLU A 233 -4.905 17.064 -0.809 1.00 0.00 O ATOM 0 H GLU A 233 -5.876 13.662 -5.157 1.00 0.00 H new ATOM 0 HA GLU A 233 -4.035 12.277 -3.569 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -4.277 13.651 -1.391 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -3.243 14.392 -2.597 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -5.480 15.568 -3.421 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -6.088 15.144 -1.833 1.00 0.00 H new ATOM 818 N GLU A 234 -7.181 13.121 -3.319 1.00 0.00 N ATOM 819 CA GLU A 234 -8.548 12.667 -2.898 1.00 0.00 C ATOM 820 C GLU A 234 -8.848 11.206 -3.278 1.00 0.00 C ATOM 821 O GLU A 234 -9.099 10.392 -2.410 1.00 0.00 O ATOM 822 CB GLU A 234 -9.506 13.610 -3.630 1.00 0.00 C ATOM 823 CG GLU A 234 -9.845 14.800 -2.730 1.00 0.00 C ATOM 824 CD GLU A 234 -11.360 15.005 -2.704 1.00 0.00 C ATOM 825 OE1 GLU A 234 -11.857 15.713 -3.563 1.00 0.00 O ATOM 826 OE2 GLU A 234 -11.997 14.450 -1.823 1.00 0.00 O ATOM 0 H GLU A 234 -7.177 13.957 -3.903 1.00 0.00 H new ATOM 0 HA GLU A 234 -8.645 12.700 -1.813 1.00 0.00 H new ATOM 0 HB2 GLU A 234 -9.050 13.960 -4.556 1.00 0.00 H new ATOM 0 HB3 GLU A 234 -10.417 13.078 -3.904 1.00 0.00 H new ATOM 0 HG2 GLU A 234 -9.474 14.623 -1.720 1.00 0.00 H new ATOM 0 HG3 GLU A 234 -9.352 15.700 -3.098 1.00 0.00 H new ATOM 833 N PRO A 235 -8.849 10.911 -4.554 1.00 0.00 N ATOM 834 CA PRO A 235 -9.164 9.537 -5.007 1.00 0.00 C ATOM 835 C PRO A 235 -8.383 8.508 -4.191 1.00 0.00 C ATOM 836 O PRO A 235 -8.916 7.486 -3.808 1.00 0.00 O ATOM 837 CB PRO A 235 -8.767 9.570 -6.483 1.00 0.00 C ATOM 838 CG PRO A 235 -8.275 10.990 -6.821 1.00 0.00 C ATOM 839 CD PRO A 235 -8.518 11.897 -5.601 1.00 0.00 C ATOM 0 HA PRO A 235 -10.206 9.245 -4.874 1.00 0.00 H new ATOM 0 HB2 PRO A 235 -7.983 8.839 -6.681 1.00 0.00 H new ATOM 0 HB3 PRO A 235 -9.617 9.303 -7.111 1.00 0.00 H new ATOM 0 HG2 PRO A 235 -7.215 10.973 -7.075 1.00 0.00 H new ATOM 0 HG3 PRO A 235 -8.805 11.377 -7.692 1.00 0.00 H new ATOM 0 HD2 PRO A 235 -7.636 12.484 -5.346 1.00 0.00 H new ATOM 0 HD3 PRO A 235 -9.332 12.602 -5.771 1.00 0.00 H new ATOM 847 N VAL A 236 -7.145 8.772 -3.880 1.00 0.00 N ATOM 848 CA VAL A 236 -6.392 7.800 -3.043 1.00 0.00 C ATOM 849 C VAL A 236 -7.161 7.612 -1.746 1.00 0.00 C ATOM 850 O VAL A 236 -7.423 6.512 -1.314 1.00 0.00 O ATOM 851 CB VAL A 236 -5.030 8.449 -2.789 1.00 0.00 C ATOM 852 CG1 VAL A 236 -4.476 8.020 -1.430 1.00 0.00 C ATOM 853 CG2 VAL A 236 -4.066 7.992 -3.870 1.00 0.00 C ATOM 0 H VAL A 236 -6.629 9.605 -4.164 1.00 0.00 H new ATOM 0 HA VAL A 236 -6.267 6.823 -3.511 1.00 0.00 H new ATOM 0 HB VAL A 236 -5.145 9.533 -2.801 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -3.507 8.491 -1.267 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -5.165 8.326 -0.643 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -4.360 6.936 -1.410 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -3.090 8.447 -3.703 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -3.971 6.907 -3.838 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -4.444 8.294 -4.846 1.00 0.00 H new ATOM 863 N LYS A 237 -7.549 8.692 -1.135 1.00 0.00 N ATOM 864 CA LYS A 237 -8.334 8.581 0.124 1.00 0.00 C ATOM 865 C LYS A 237 -9.414 7.535 -0.072 1.00 0.00 C ATOM 866 O LYS A 237 -9.706 6.738 0.798 1.00 0.00 O ATOM 867 CB LYS A 237 -9.005 9.933 0.313 1.00 0.00 C ATOM 868 CG LYS A 237 -8.776 10.431 1.740 1.00 0.00 C ATOM 869 CD LYS A 237 -9.526 9.528 2.721 1.00 0.00 C ATOM 870 CE LYS A 237 -9.463 10.133 4.125 1.00 0.00 C ATOM 871 NZ LYS A 237 -10.693 10.966 4.239 1.00 0.00 N ATOM 0 H LYS A 237 -7.359 9.643 -1.450 1.00 0.00 H new ATOM 0 HA LYS A 237 -7.709 8.308 0.974 1.00 0.00 H new ATOM 0 HB2 LYS A 237 -8.603 10.652 -0.401 1.00 0.00 H new ATOM 0 HB3 LYS A 237 -10.074 9.850 0.114 1.00 0.00 H new ATOM 0 HG2 LYS A 237 -7.711 10.431 1.970 1.00 0.00 H new ATOM 0 HG3 LYS A 237 -9.123 11.460 1.838 1.00 0.00 H new ATOM 0 HD2 LYS A 237 -10.564 9.417 2.408 1.00 0.00 H new ATOM 0 HD3 LYS A 237 -9.085 8.531 2.723 1.00 0.00 H new ATOM 0 HE2 LYS A 237 -9.440 9.356 4.889 1.00 0.00 H new ATOM 0 HE3 LYS A 237 -8.564 10.736 4.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 -10.722 11.415 5.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 -10.684 11.701 3.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 -11.532 10.364 4.117 1.00 0.00 H new ATOM 885 N LYS A 238 -10.015 7.547 -1.226 1.00 0.00 N ATOM 886 CA LYS A 238 -11.092 6.570 -1.502 1.00 0.00 C ATOM 887 C LYS A 238 -10.490 5.189 -1.686 1.00 0.00 C ATOM 888 O LYS A 238 -10.738 4.274 -0.927 1.00 0.00 O ATOM 889 CB LYS A 238 -11.732 7.017 -2.813 1.00 0.00 C ATOM 890 CG LYS A 238 -13.256 7.022 -2.669 1.00 0.00 C ATOM 891 CD LYS A 238 -13.862 7.994 -3.686 1.00 0.00 C ATOM 892 CE LYS A 238 -15.358 7.708 -3.841 1.00 0.00 C ATOM 893 NZ LYS A 238 -15.780 8.485 -5.042 1.00 0.00 N ATOM 0 H LYS A 238 -9.805 8.192 -1.988 1.00 0.00 H new ATOM 0 HA LYS A 238 -11.815 6.526 -0.688 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -11.379 8.013 -3.080 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -11.436 6.347 -3.620 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -13.650 6.019 -2.829 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -13.535 7.316 -1.657 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -13.710 9.022 -3.357 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -13.360 7.890 -4.648 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -15.544 6.642 -3.976 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -15.913 8.019 -2.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -16.796 8.338 -5.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -15.598 9.496 -4.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -15.241 8.163 -5.871 1.00 0.00 H new ATOM 907 N ILE A 239 -9.697 5.043 -2.704 1.00 0.00 N ATOM 908 CA ILE A 239 -9.066 3.728 -2.962 1.00 0.00 C ATOM 909 C ILE A 239 -8.524 3.171 -1.641 1.00 0.00 C ATOM 910 O ILE A 239 -8.994 2.172 -1.135 1.00 0.00 O ATOM 911 CB ILE A 239 -7.946 4.020 -3.976 1.00 0.00 C ATOM 912 CG1 ILE A 239 -8.467 3.751 -5.392 1.00 0.00 C ATOM 913 CG2 ILE A 239 -6.728 3.128 -3.714 1.00 0.00 C ATOM 914 CD1 ILE A 239 -8.619 2.244 -5.602 1.00 0.00 C ATOM 0 H ILE A 239 -9.459 5.779 -3.369 1.00 0.00 H new ATOM 0 HA ILE A 239 -9.753 2.980 -3.357 1.00 0.00 H new ATOM 0 HB ILE A 239 -7.646 5.063 -3.873 1.00 0.00 H new ATOM 0 HG12 ILE A 239 -9.426 4.248 -5.539 1.00 0.00 H new ATOM 0 HG13 ILE A 239 -7.778 4.164 -6.129 1.00 0.00 H new ATOM 0 HG21 ILE A 239 -5.949 3.352 -4.443 1.00 0.00 H new ATOM 0 HG22 ILE A 239 -6.349 3.315 -2.709 1.00 0.00 H new ATOM 0 HG23 ILE A 239 -7.018 2.081 -3.803 1.00 0.00 H new ATOM 0 HD11 ILE A 239 -8.990 2.053 -6.609 1.00 0.00 H new ATOM 0 HD12 ILE A 239 -7.651 1.759 -5.473 1.00 0.00 H new ATOM 0 HD13 ILE A 239 -9.325 1.844 -4.874 1.00 0.00 H new ATOM 926 N MET A 240 -7.549 3.822 -1.070 1.00 0.00 N ATOM 927 CA MET A 240 -6.994 3.335 0.225 1.00 0.00 C ATOM 928 C MET A 240 -8.132 2.914 1.164 1.00 0.00 C ATOM 929 O MET A 240 -8.030 1.932 1.873 1.00 0.00 O ATOM 930 CB MET A 240 -6.235 4.529 0.805 1.00 0.00 C ATOM 931 CG MET A 240 -4.983 4.034 1.528 1.00 0.00 C ATOM 932 SD MET A 240 -5.445 3.366 3.145 1.00 0.00 S ATOM 933 CE MET A 240 -6.147 4.888 3.826 1.00 0.00 C ATOM 0 H MET A 240 -7.114 4.666 -1.441 1.00 0.00 H new ATOM 0 HA MET A 240 -6.349 2.465 0.097 1.00 0.00 H new ATOM 0 HB2 MET A 240 -5.959 5.220 0.008 1.00 0.00 H new ATOM 0 HB3 MET A 240 -6.874 5.079 1.496 1.00 0.00 H new ATOM 0 HG2 MET A 240 -4.486 3.267 0.934 1.00 0.00 H new ATOM 0 HG3 MET A 240 -4.273 4.852 1.650 1.00 0.00 H new ATOM 0 HE1 MET A 240 -5.919 4.949 4.890 1.00 0.00 H new ATOM 0 HE2 MET A 240 -5.717 5.748 3.313 1.00 0.00 H new ATOM 0 HE3 MET A 240 -7.228 4.885 3.686 1.00 0.00 H new ATOM 943 N GLU A 241 -9.214 3.648 1.176 1.00 0.00 N ATOM 944 CA GLU A 241 -10.354 3.286 2.073 1.00 0.00 C ATOM 945 C GLU A 241 -10.913 1.906 1.704 1.00 0.00 C ATOM 946 O GLU A 241 -11.640 1.299 2.465 1.00 0.00 O ATOM 947 CB GLU A 241 -11.405 4.370 1.835 1.00 0.00 C ATOM 948 CG GLU A 241 -12.494 4.270 2.906 1.00 0.00 C ATOM 949 CD GLU A 241 -13.751 4.997 2.427 1.00 0.00 C ATOM 950 OE1 GLU A 241 -13.719 5.536 1.333 1.00 0.00 O ATOM 951 OE2 GLU A 241 -14.725 5.001 3.161 1.00 0.00 O ATOM 0 H GLU A 241 -9.358 4.481 0.605 1.00 0.00 H new ATOM 0 HA GLU A 241 -10.050 3.232 3.118 1.00 0.00 H new ATOM 0 HB2 GLU A 241 -10.940 5.355 1.865 1.00 0.00 H new ATOM 0 HB3 GLU A 241 -11.843 4.255 0.844 1.00 0.00 H new ATOM 0 HG2 GLU A 241 -12.722 3.224 3.111 1.00 0.00 H new ATOM 0 HG3 GLU A 241 -12.142 4.708 3.840 1.00 0.00 H new ATOM 958 N LYS A 242 -10.580 1.406 0.546 1.00 0.00 N ATOM 959 CA LYS A 242 -11.090 0.064 0.135 1.00 0.00 C ATOM 960 C LYS A 242 -9.965 -0.736 -0.522 1.00 0.00 C ATOM 961 O LYS A 242 -10.133 -1.315 -1.575 1.00 0.00 O ATOM 962 CB LYS A 242 -12.209 0.354 -0.870 1.00 0.00 C ATOM 963 CG LYS A 242 -13.391 -0.579 -0.606 1.00 0.00 C ATOM 964 CD LYS A 242 -14.054 -0.202 0.721 1.00 0.00 C ATOM 965 CE LYS A 242 -14.824 1.111 0.554 1.00 0.00 C ATOM 966 NZ LYS A 242 -15.923 0.793 -0.399 1.00 0.00 N ATOM 0 H LYS A 242 -9.977 1.868 -0.135 1.00 0.00 H new ATOM 0 HA LYS A 242 -11.451 -0.524 0.979 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -12.527 1.393 -0.785 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -11.843 0.215 -1.887 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -14.113 -0.507 -1.419 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -13.051 -1.614 -0.573 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -14.731 -0.995 1.039 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -13.299 -0.096 1.500 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -15.218 1.462 1.508 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -14.180 1.900 0.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -16.750 1.386 -0.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -15.604 0.980 -1.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -16.183 -0.210 -0.307 1.00 0.00 H new ATOM 980 N LYS A 243 -8.821 -0.752 0.103 1.00 0.00 N ATOM 981 CA LYS A 243 -7.637 -1.486 -0.446 1.00 0.00 C ATOM 982 C LYS A 243 -8.035 -2.722 -1.262 1.00 0.00 C ATOM 983 O LYS A 243 -7.364 -3.088 -2.201 1.00 0.00 O ATOM 984 CB LYS A 243 -6.841 -1.912 0.789 1.00 0.00 C ATOM 985 CG LYS A 243 -6.332 -0.670 1.524 1.00 0.00 C ATOM 986 CD LYS A 243 -6.438 -0.887 3.036 1.00 0.00 C ATOM 987 CE LYS A 243 -5.525 -2.044 3.450 1.00 0.00 C ATOM 988 NZ LYS A 243 -5.894 -2.338 4.864 1.00 0.00 N ATOM 0 H LYS A 243 -8.650 -0.278 0.990 1.00 0.00 H new ATOM 0 HA LYS A 243 -7.072 -0.853 -1.130 1.00 0.00 H new ATOM 0 HB2 LYS A 243 -7.469 -2.507 1.452 1.00 0.00 H new ATOM 0 HB3 LYS A 243 -6.002 -2.542 0.494 1.00 0.00 H new ATOM 0 HG2 LYS A 243 -5.297 -0.470 1.247 1.00 0.00 H new ATOM 0 HG3 LYS A 243 -6.915 0.203 1.230 1.00 0.00 H new ATOM 0 HD2 LYS A 243 -6.154 0.022 3.566 1.00 0.00 H new ATOM 0 HD3 LYS A 243 -7.469 -1.107 3.311 1.00 0.00 H new ATOM 0 HE2 LYS A 243 -5.678 -2.915 2.813 1.00 0.00 H new ATOM 0 HE3 LYS A 243 -4.474 -1.767 3.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 -5.310 -3.122 5.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 -5.732 -1.493 5.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 -6.898 -2.605 4.912 1.00 0.00 H new ATOM 1002 N TYR A 244 -9.095 -3.386 -0.913 1.00 0.00 N ATOM 1003 CA TYR A 244 -9.480 -4.608 -1.681 1.00 0.00 C ATOM 1004 C TYR A 244 -10.600 -4.267 -2.677 1.00 0.00 C ATOM 1005 O TYR A 244 -11.767 -4.436 -2.389 1.00 0.00 O ATOM 1006 CB TYR A 244 -9.975 -5.570 -0.594 1.00 0.00 C ATOM 1007 CG TYR A 244 -9.659 -7.026 -0.909 1.00 0.00 C ATOM 1008 CD1 TYR A 244 -8.563 -7.388 -1.715 1.00 0.00 C ATOM 1009 CD2 TYR A 244 -10.456 -8.028 -0.338 1.00 0.00 C ATOM 1010 CE1 TYR A 244 -8.280 -8.735 -1.946 1.00 0.00 C ATOM 1011 CE2 TYR A 244 -10.163 -9.377 -0.567 1.00 0.00 C ATOM 1012 CZ TYR A 244 -9.076 -9.731 -1.369 1.00 0.00 C ATOM 1013 OH TYR A 244 -8.785 -11.061 -1.588 1.00 0.00 O ATOM 0 H TYR A 244 -9.711 -3.143 -0.137 1.00 0.00 H new ATOM 0 HA TYR A 244 -8.666 -5.031 -2.270 1.00 0.00 H new ATOM 0 HB2 TYR A 244 -9.518 -5.301 0.359 1.00 0.00 H new ATOM 0 HB3 TYR A 244 -11.052 -5.454 -0.475 1.00 0.00 H new ATOM 0 HD1 TYR A 244 -7.941 -6.623 -2.155 1.00 0.00 H new ATOM 0 HD2 TYR A 244 -11.299 -7.758 0.281 1.00 0.00 H new ATOM 0 HE1 TYR A 244 -7.444 -9.010 -2.572 1.00 0.00 H new ATOM 0 HE2 TYR A 244 -10.778 -10.145 -0.123 1.00 0.00 H new ATOM 0 HH TYR A 244 -9.435 -11.620 -1.114 1.00 0.00 H new ATOM 1023 N HIS A 245 -10.253 -3.785 -3.846 1.00 0.00 N ATOM 1024 CA HIS A 245 -11.306 -3.431 -4.849 1.00 0.00 C ATOM 1025 C HIS A 245 -11.632 -4.641 -5.731 1.00 0.00 C ATOM 1026 O HIS A 245 -11.547 -5.776 -5.308 1.00 0.00 O ATOM 1027 CB HIS A 245 -10.717 -2.320 -5.732 1.00 0.00 C ATOM 1028 CG HIS A 245 -9.802 -1.417 -4.947 1.00 0.00 C ATOM 1029 ND1 HIS A 245 -10.253 -0.625 -3.905 1.00 0.00 N ATOM 1030 CD2 HIS A 245 -8.464 -1.136 -5.075 1.00 0.00 C ATOM 1031 CE1 HIS A 245 -9.202 0.087 -3.456 1.00 0.00 C ATOM 1032 NE2 HIS A 245 -8.089 -0.187 -4.135 1.00 0.00 N ATOM 0 H HIS A 245 -9.292 -3.622 -4.148 1.00 0.00 H new ATOM 0 HA HIS A 245 -12.220 -3.114 -4.347 1.00 0.00 H new ATOM 0 HB2 HIS A 245 -10.167 -2.766 -6.561 1.00 0.00 H new ATOM 0 HB3 HIS A 245 -11.526 -1.732 -6.166 1.00 0.00 H new ATOM 0 HD1 HIS A 245 -11.206 -0.588 -3.544 1.00 0.00 H new ATOM 0 HD2 HIS A 245 -7.802 -1.587 -5.800 1.00 0.00 H new ATOM 0 HE1 HIS A 245 -9.255 0.796 -2.643 1.00 0.00 H new ATOM 1040 N ASN A 246 -11.997 -4.393 -6.961 1.00 0.00 N ATOM 1041 CA ASN A 246 -12.324 -5.506 -7.898 1.00 0.00 C ATOM 1042 C ASN A 246 -11.778 -5.179 -9.292 1.00 0.00 C ATOM 1043 O ASN A 246 -12.003 -4.106 -9.815 1.00 0.00 O ATOM 1044 CB ASN A 246 -13.852 -5.572 -7.919 1.00 0.00 C ATOM 1045 CG ASN A 246 -14.315 -6.876 -7.267 1.00 0.00 C ATOM 1046 OD1 ASN A 246 -13.712 -7.342 -6.321 1.00 0.00 O ATOM 1047 ND2 ASN A 246 -15.368 -7.488 -7.736 1.00 0.00 N ATOM 0 H ASN A 246 -12.083 -3.458 -7.359 1.00 0.00 H new ATOM 0 HA ASN A 246 -11.885 -6.456 -7.592 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -14.271 -4.718 -7.387 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -14.215 -5.517 -8.945 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -15.685 -8.358 -7.308 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -15.874 -7.096 -8.530 1.00 0.00 H new ATOM 1054 N VAL A 247 -11.057 -6.085 -9.898 1.00 0.00 N ATOM 1055 CA VAL A 247 -10.501 -5.800 -11.253 1.00 0.00 C ATOM 1056 C VAL A 247 -10.363 -7.094 -12.062 1.00 0.00 C ATOM 1057 O VAL A 247 -9.795 -8.065 -11.606 1.00 0.00 O ATOM 1058 CB VAL A 247 -9.125 -5.181 -10.995 1.00 0.00 C ATOM 1059 CG1 VAL A 247 -8.296 -5.216 -12.282 1.00 0.00 C ATOM 1060 CG2 VAL A 247 -9.295 -3.727 -10.544 1.00 0.00 C ATOM 0 H VAL A 247 -10.830 -7.004 -9.517 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.148 -5.138 -11.829 1.00 0.00 H new ATOM 0 HB VAL A 247 -8.615 -5.749 -10.217 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -7.317 -4.775 -12.096 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -8.173 -6.249 -12.607 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -8.808 -4.649 -13.060 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -8.315 -3.286 -10.360 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -9.807 -3.162 -11.323 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -9.884 -3.697 -9.627 1.00 0.00 H new ATOM 1070 N GLY A 248 -10.876 -7.103 -13.264 1.00 0.00 N ATOM 1071 CA GLY A 248 -10.773 -8.322 -14.118 1.00 0.00 C ATOM 1072 C GLY A 248 -11.020 -9.574 -13.275 1.00 0.00 C ATOM 1073 O GLY A 248 -10.124 -10.358 -13.036 1.00 0.00 O ATOM 0 H GLY A 248 -11.363 -6.316 -13.692 1.00 0.00 H new ATOM 0 HA2 GLY A 248 -11.500 -8.270 -14.929 1.00 0.00 H new ATOM 0 HA3 GLY A 248 -9.786 -8.372 -14.577 1.00 0.00 H new ATOM 1077 N LEU A 249 -12.230 -9.773 -12.828 1.00 0.00 N ATOM 1078 CA LEU A 249 -12.527 -10.980 -12.007 1.00 0.00 C ATOM 1079 C LEU A 249 -11.435 -11.186 -10.952 1.00 0.00 C ATOM 1080 O LEU A 249 -11.206 -12.286 -10.489 1.00 0.00 O ATOM 1081 CB LEU A 249 -12.538 -12.139 -13.004 1.00 0.00 C ATOM 1082 CG LEU A 249 -13.531 -13.204 -12.541 1.00 0.00 C ATOM 1083 CD1 LEU A 249 -14.153 -13.887 -13.760 1.00 0.00 C ATOM 1084 CD2 LEU A 249 -12.801 -14.247 -11.691 1.00 0.00 C ATOM 0 H LEU A 249 -13.023 -9.154 -12.995 1.00 0.00 H new ATOM 0 HA LEU A 249 -13.471 -10.894 -11.470 1.00 0.00 H new ATOM 0 HB2 LEU A 249 -12.813 -11.777 -13.995 1.00 0.00 H new ATOM 0 HB3 LEU A 249 -11.540 -12.570 -13.088 1.00 0.00 H new ATOM 0 HG LEU A 249 -14.316 -12.735 -11.948 1.00 0.00 H new ATOM 0 HD11 LEU A 249 -14.861 -14.647 -13.429 1.00 0.00 H new ATOM 0 HD12 LEU A 249 -14.673 -13.146 -14.367 1.00 0.00 H new ATOM 0 HD13 LEU A 249 -13.369 -14.356 -14.354 1.00 0.00 H new ATOM 0 HD21 LEU A 249 -13.509 -15.007 -11.360 1.00 0.00 H new ATOM 0 HD22 LEU A 249 -12.016 -14.716 -12.285 1.00 0.00 H new ATOM 0 HD23 LEU A 249 -12.357 -13.762 -10.822 1.00 0.00 H new ATOM 1096 N SER A 250 -10.762 -10.136 -10.566 1.00 0.00 N ATOM 1097 CA SER A 250 -9.690 -10.268 -9.539 1.00 0.00 C ATOM 1098 C SER A 250 -9.762 -9.088 -8.570 1.00 0.00 C ATOM 1099 O SER A 250 -9.636 -7.946 -8.963 1.00 0.00 O ATOM 1100 CB SER A 250 -8.381 -10.236 -10.327 1.00 0.00 C ATOM 1101 OG SER A 250 -8.427 -11.221 -11.352 1.00 0.00 O ATOM 0 H SER A 250 -10.909 -9.190 -10.919 1.00 0.00 H new ATOM 0 HA SER A 250 -9.783 -11.180 -8.949 1.00 0.00 H new ATOM 0 HB2 SER A 250 -8.229 -9.248 -10.762 1.00 0.00 H new ATOM 0 HB3 SER A 250 -7.538 -10.425 -9.662 1.00 0.00 H new ATOM 0 HG SER A 250 -8.787 -10.823 -12.172 1.00 0.00 H new ATOM 1107 N LYS A 251 -9.985 -9.348 -7.311 1.00 0.00 N ATOM 1108 CA LYS A 251 -10.086 -8.219 -6.340 1.00 0.00 C ATOM 1109 C LYS A 251 -8.712 -7.882 -5.749 1.00 0.00 C ATOM 1110 O LYS A 251 -8.573 -7.668 -4.562 1.00 0.00 O ATOM 1111 CB LYS A 251 -11.095 -8.688 -5.269 1.00 0.00 C ATOM 1112 CG LYS A 251 -10.417 -9.354 -4.055 1.00 0.00 C ATOM 1113 CD LYS A 251 -9.200 -10.191 -4.461 1.00 0.00 C ATOM 1114 CE LYS A 251 -9.388 -11.637 -3.998 1.00 0.00 C ATOM 1115 NZ LYS A 251 -9.975 -12.344 -5.169 1.00 0.00 N ATOM 0 H LYS A 251 -10.101 -10.281 -6.915 1.00 0.00 H new ATOM 0 HA LYS A 251 -10.427 -7.297 -6.810 1.00 0.00 H new ATOM 0 HB2 LYS A 251 -11.679 -7.833 -4.928 1.00 0.00 H new ATOM 0 HB3 LYS A 251 -11.794 -9.392 -5.720 1.00 0.00 H new ATOM 0 HG2 LYS A 251 -10.108 -8.586 -3.347 1.00 0.00 H new ATOM 0 HG3 LYS A 251 -11.138 -9.990 -3.541 1.00 0.00 H new ATOM 0 HD2 LYS A 251 -9.070 -10.160 -5.543 1.00 0.00 H new ATOM 0 HD3 LYS A 251 -8.296 -9.773 -4.019 1.00 0.00 H new ATOM 0 HE2 LYS A 251 -8.438 -12.083 -3.703 1.00 0.00 H new ATOM 0 HE3 LYS A 251 -10.048 -11.691 -3.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 251 -10.133 -13.343 -4.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 251 -10.881 -11.902 -5.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 251 -9.321 -12.282 -5.976 1.00 0.00 H new ATOM 1129 N CYS A 252 -7.708 -7.827 -6.591 1.00 0.00 N ATOM 1130 CA CYS A 252 -6.319 -7.489 -6.131 1.00 0.00 C ATOM 1131 C CYS A 252 -6.368 -6.584 -4.902 1.00 0.00 C ATOM 1132 O CYS A 252 -7.258 -5.767 -4.769 1.00 0.00 O ATOM 1133 CB CYS A 252 -5.722 -6.728 -7.312 1.00 0.00 C ATOM 1134 SG CYS A 252 -6.648 -5.196 -7.576 1.00 0.00 S ATOM 0 H CYS A 252 -7.791 -8.004 -7.592 1.00 0.00 H new ATOM 0 HA CYS A 252 -5.743 -8.371 -5.851 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -4.673 -6.502 -7.120 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -5.756 -7.345 -8.210 1.00 0.00 H new ATOM 0 HG CYS A 252 -7.542 -5.063 -6.642 1.00 0.00 H new ATOM 1140 N GLU A 253 -5.415 -6.679 -4.016 1.00 0.00 N ATOM 1141 CA GLU A 253 -5.458 -5.762 -2.842 1.00 0.00 C ATOM 1142 C GLU A 253 -4.776 -4.479 -3.233 1.00 0.00 C ATOM 1143 O GLU A 253 -4.073 -4.417 -4.218 1.00 0.00 O ATOM 1144 CB GLU A 253 -4.739 -6.416 -1.658 1.00 0.00 C ATOM 1145 CG GLU A 253 -3.660 -7.395 -2.126 1.00 0.00 C ATOM 1146 CD GLU A 253 -2.875 -7.901 -0.915 1.00 0.00 C ATOM 1147 OE1 GLU A 253 -3.492 -8.463 -0.025 1.00 0.00 O ATOM 1148 OE2 GLU A 253 -1.669 -7.718 -0.898 1.00 0.00 O ATOM 0 H GLU A 253 -4.631 -7.330 -4.050 1.00 0.00 H new ATOM 0 HA GLU A 253 -6.487 -5.557 -2.545 1.00 0.00 H new ATOM 0 HB2 GLU A 253 -4.286 -5.645 -1.035 1.00 0.00 H new ATOM 0 HB3 GLU A 253 -5.464 -6.942 -1.037 1.00 0.00 H new ATOM 0 HG2 GLU A 253 -4.117 -8.233 -2.653 1.00 0.00 H new ATOM 0 HG3 GLU A 253 -2.988 -6.904 -2.830 1.00 0.00 H new ATOM 1155 N ILE A 254 -5.014 -3.439 -2.511 1.00 0.00 N ATOM 1156 CA ILE A 254 -4.406 -2.149 -2.918 1.00 0.00 C ATOM 1157 C ILE A 254 -4.038 -1.265 -1.726 1.00 0.00 C ATOM 1158 O ILE A 254 -4.878 -0.625 -1.125 1.00 0.00 O ATOM 1159 CB ILE A 254 -5.483 -1.470 -3.776 1.00 0.00 C ATOM 1160 CG1 ILE A 254 -5.525 -2.117 -5.167 1.00 0.00 C ATOM 1161 CG2 ILE A 254 -5.158 0.018 -3.928 1.00 0.00 C ATOM 1162 CD1 ILE A 254 -6.439 -3.349 -5.155 1.00 0.00 C ATOM 0 H ILE A 254 -5.591 -3.417 -1.670 1.00 0.00 H new ATOM 0 HA ILE A 254 -3.469 -2.311 -3.451 1.00 0.00 H new ATOM 0 HB ILE A 254 -6.451 -1.588 -3.288 1.00 0.00 H new ATOM 0 HG12 ILE A 254 -5.886 -1.396 -5.900 1.00 0.00 H new ATOM 0 HG13 ILE A 254 -4.519 -2.405 -5.472 1.00 0.00 H new ATOM 0 HG21 ILE A 254 -5.924 0.497 -4.537 1.00 0.00 H new ATOM 0 HG22 ILE A 254 -5.131 0.487 -2.944 1.00 0.00 H new ATOM 0 HG23 ILE A 254 -4.187 0.131 -4.411 1.00 0.00 H new ATOM 0 HD11 ILE A 254 -6.459 -3.797 -6.148 1.00 0.00 H new ATOM 0 HD12 ILE A 254 -6.060 -4.076 -4.436 1.00 0.00 H new ATOM 0 HD13 ILE A 254 -7.448 -3.051 -4.872 1.00 0.00 H new ATOM 1174 N LYS A 255 -2.775 -1.176 -1.432 1.00 0.00 N ATOM 1175 CA LYS A 255 -2.321 -0.279 -0.341 1.00 0.00 C ATOM 1176 C LYS A 255 -1.822 0.999 -1.011 1.00 0.00 C ATOM 1177 O LYS A 255 -0.892 0.969 -1.789 1.00 0.00 O ATOM 1178 CB LYS A 255 -1.183 -1.032 0.350 1.00 0.00 C ATOM 1179 CG LYS A 255 -0.282 -0.043 1.092 1.00 0.00 C ATOM 1180 CD LYS A 255 0.874 -0.801 1.749 1.00 0.00 C ATOM 1181 CE LYS A 255 1.360 -0.030 2.978 1.00 0.00 C ATOM 1182 NZ LYS A 255 2.839 -0.208 2.983 1.00 0.00 N ATOM 0 H LYS A 255 -2.032 -1.691 -1.905 1.00 0.00 H new ATOM 0 HA LYS A 255 -3.090 -0.018 0.386 1.00 0.00 H new ATOM 0 HB2 LYS A 255 -1.590 -1.762 1.049 1.00 0.00 H new ATOM 0 HB3 LYS A 255 -0.601 -1.586 -0.387 1.00 0.00 H new ATOM 0 HG2 LYS A 255 0.106 0.703 0.399 1.00 0.00 H new ATOM 0 HG3 LYS A 255 -0.856 0.492 1.848 1.00 0.00 H new ATOM 0 HD2 LYS A 255 0.549 -1.800 2.039 1.00 0.00 H new ATOM 0 HD3 LYS A 255 1.691 -0.925 1.038 1.00 0.00 H new ATOM 0 HE2 LYS A 255 1.089 1.024 2.915 1.00 0.00 H new ATOM 0 HE3 LYS A 255 0.912 -0.421 3.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 255 3.246 0.293 3.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 255 3.067 -1.221 3.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 255 3.238 0.179 2.104 1.00 0.00 H new ATOM 1196 N VAL A 256 -2.469 2.106 -0.770 1.00 0.00 N ATOM 1197 CA VAL A 256 -2.062 3.373 -1.448 1.00 0.00 C ATOM 1198 C VAL A 256 -0.542 3.483 -1.591 1.00 0.00 C ATOM 1199 O VAL A 256 0.213 2.791 -0.937 1.00 0.00 O ATOM 1200 CB VAL A 256 -2.610 4.491 -0.581 1.00 0.00 C ATOM 1201 CG1 VAL A 256 -2.170 4.291 0.870 1.00 0.00 C ATOM 1202 CG2 VAL A 256 -2.088 5.828 -1.099 1.00 0.00 C ATOM 0 H VAL A 256 -3.262 2.190 -0.134 1.00 0.00 H new ATOM 0 HA VAL A 256 -2.454 3.416 -2.464 1.00 0.00 H new ATOM 0 HB VAL A 256 -3.699 4.482 -0.623 1.00 0.00 H new ATOM 0 HG11 VAL A 256 -2.568 5.098 1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 256 -2.547 3.336 1.236 1.00 0.00 H new ATOM 0 HG13 VAL A 256 -1.081 4.296 0.924 1.00 0.00 H new ATOM 0 HG21 VAL A 256 -2.479 6.636 -0.480 1.00 0.00 H new ATOM 0 HG22 VAL A 256 -0.999 5.834 -1.058 1.00 0.00 H new ATOM 0 HG23 VAL A 256 -2.413 5.971 -2.129 1.00 0.00 H new ATOM 1212 N ALA A 257 -0.095 4.347 -2.462 1.00 0.00 N ATOM 1213 CA ALA A 257 1.367 4.505 -2.684 1.00 0.00 C ATOM 1214 C ALA A 257 1.739 5.985 -2.787 1.00 0.00 C ATOM 1215 O ALA A 257 0.915 6.825 -3.096 1.00 0.00 O ATOM 1216 CB ALA A 257 1.621 3.800 -4.018 1.00 0.00 C ATOM 0 H ALA A 257 -0.685 4.953 -3.032 1.00 0.00 H new ATOM 0 HA ALA A 257 1.960 4.091 -1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 257 2.680 3.864 -4.268 1.00 0.00 H new ATOM 0 HB2 ALA A 257 1.330 2.753 -3.937 1.00 0.00 H new ATOM 0 HB3 ALA A 257 1.034 4.280 -4.801 1.00 0.00 H new