USER MOD reduce.3.24.130724 H: found=0, std=0, add=536, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 538 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 223 THR OG1 : rot 180:sc= 0.00607 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 THR OG1 : rot -23:sc= -1.83! USER MOD Single : A 238 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 CYS SG : rot 180:sc= -4.83! USER MOD Single : A 252 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 253 ASN : amide:sc= 0.679 K(o=0.68,f=-7.6!) USER MOD Single : A 260 THR OG1 : rot 180:sc= 0 USER MOD Single : A 262 TYR OH : rot 176:sc= -0.723 USER MOD Single : A 264 GLN : amide:sc= -0.395 K(o=-0.39,f=-0.97) USER MOD Single : A 265 CYS SG : rot -130:sc= -3.19 USER MOD Single : A 266 GLN : amide:sc= -2.97! C(o=-3!,f=-3!) USER MOD Single : A 268 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.206) USER MOD Single : A 269 TYR OH : rot 180:sc= -1.27 USER MOD Single : A 276 HIS :FLIP no HD1:sc= -4.6! C(o=-5.5!,f=-4.6!) USER MOD Single : A 277 LYS NZ :NH3+ -146:sc= -0.9 (180deg=-2.84!) USER MOD Single : A 279 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 451 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 80 N ILE A 214 5.927 2.079 -4.261 1.00 0.00 N ATOM 81 CA ILE A 214 5.018 0.948 -4.406 1.00 0.00 C ATOM 82 C ILE A 214 5.766 -0.307 -4.842 1.00 0.00 C ATOM 83 O ILE A 214 6.655 -0.247 -5.692 1.00 0.00 O ATOM 84 CB ILE A 214 3.901 1.249 -5.425 1.00 0.00 C ATOM 85 CG1 ILE A 214 3.211 2.572 -5.083 1.00 0.00 C ATOM 86 CG2 ILE A 214 2.890 0.111 -5.457 1.00 0.00 C ATOM 87 CD1 ILE A 214 2.070 2.919 -6.012 1.00 0.00 C ATOM 0 HA ILE A 214 4.569 0.778 -3.428 1.00 0.00 H new ATOM 0 HB ILE A 214 4.348 1.339 -6.415 1.00 0.00 H new ATOM 0 HG12 ILE A 214 2.834 2.522 -4.062 1.00 0.00 H new ATOM 0 HG13 ILE A 214 3.948 3.374 -5.112 1.00 0.00 H new ATOM 0 HG21 ILE A 214 2.108 0.339 -6.181 1.00 0.00 H new ATOM 0 HG22 ILE A 214 3.392 -0.813 -5.744 1.00 0.00 H new ATOM 0 HG23 ILE A 214 2.446 -0.009 -4.469 1.00 0.00 H new ATOM 0 HD11 ILE A 214 1.629 3.869 -5.708 1.00 0.00 H new ATOM 0 HD12 ILE A 214 2.444 3.002 -7.032 1.00 0.00 H new ATOM 0 HD13 ILE A 214 1.313 2.137 -5.966 1.00 0.00 H new ATOM 99 N GLY A 215 5.401 -1.441 -4.254 1.00 0.00 N ATOM 100 CA GLY A 215 6.047 -2.695 -4.592 1.00 0.00 C ATOM 101 C GLY A 215 7.261 -2.984 -3.728 1.00 0.00 C ATOM 102 O GLY A 215 7.900 -4.026 -3.876 1.00 0.00 O ATOM 0 H GLY A 215 4.668 -1.514 -3.548 1.00 0.00 H new ATOM 0 HA2 GLY A 215 5.329 -3.508 -4.485 1.00 0.00 H new ATOM 0 HA3 GLY A 215 6.349 -2.672 -5.639 1.00 0.00 H new ATOM 106 N ASP A 216 7.585 -2.061 -2.826 1.00 0.00 N ATOM 107 CA ASP A 216 8.732 -2.228 -1.942 1.00 0.00 C ATOM 108 C ASP A 216 8.316 -2.843 -0.612 1.00 0.00 C ATOM 109 O ASP A 216 7.219 -2.589 -0.114 1.00 0.00 O ATOM 110 CB ASP A 216 9.418 -0.881 -1.702 1.00 0.00 C ATOM 111 CG ASP A 216 10.327 -0.482 -2.849 1.00 0.00 C ATOM 112 OD1 ASP A 216 10.599 -1.336 -3.719 1.00 0.00 O ATOM 113 OD2 ASP A 216 10.768 0.687 -2.877 1.00 0.00 O ATOM 0 H ASP A 216 7.070 -1.192 -2.689 1.00 0.00 H new ATOM 0 HA ASP A 216 9.434 -2.906 -2.428 1.00 0.00 H new ATOM 0 HB2 ASP A 216 8.660 -0.111 -1.558 1.00 0.00 H new ATOM 0 HB3 ASP A 216 10.000 -0.932 -0.782 1.00 0.00 H new ATOM 118 N ARG A 217 9.202 -3.651 -0.037 1.00 0.00 N ATOM 119 CA ARG A 217 8.932 -4.300 1.238 1.00 0.00 C ATOM 120 C ARG A 217 9.091 -3.312 2.386 1.00 0.00 C ATOM 121 O ARG A 217 10.092 -2.602 2.470 1.00 0.00 O ATOM 122 CB ARG A 217 9.869 -5.491 1.441 1.00 0.00 C ATOM 123 CG ARG A 217 9.286 -6.583 2.323 1.00 0.00 C ATOM 124 CD ARG A 217 8.222 -7.383 1.592 1.00 0.00 C ATOM 125 NE ARG A 217 8.803 -8.324 0.636 1.00 0.00 N ATOM 126 CZ ARG A 217 8.089 -9.200 -0.068 1.00 0.00 C ATOM 127 NH1 ARG A 217 6.771 -9.258 0.072 1.00 0.00 N ATOM 128 NH2 ARG A 217 8.696 -10.019 -0.915 1.00 0.00 N ATOM 0 H ARG A 217 10.114 -3.871 -0.436 1.00 0.00 H new ATOM 0 HA ARG A 217 7.903 -4.660 1.226 1.00 0.00 H new ATOM 0 HB2 ARG A 217 10.118 -5.916 0.469 1.00 0.00 H new ATOM 0 HB3 ARG A 217 10.801 -5.138 1.883 1.00 0.00 H new ATOM 0 HG2 ARG A 217 10.083 -7.251 2.651 1.00 0.00 H new ATOM 0 HG3 ARG A 217 8.855 -6.136 3.219 1.00 0.00 H new ATOM 0 HD2 ARG A 217 7.618 -7.929 2.316 1.00 0.00 H new ATOM 0 HD3 ARG A 217 7.552 -6.701 1.068 1.00 0.00 H new ATOM 0 HE ARG A 217 9.814 -8.309 0.500 1.00 0.00 H new ATOM 0 HH11 ARG A 217 6.299 -8.629 0.722 1.00 0.00 H new ATOM 0 HH12 ARG A 217 6.230 -9.931 -0.470 1.00 0.00 H new ATOM 0 HH21 ARG A 217 9.709 -9.978 -1.027 1.00 0.00 H new ATOM 0 HH22 ARG A 217 8.150 -10.691 -1.455 1.00 0.00 H new ATOM 142 N VAL A 218 8.094 -3.267 3.258 1.00 0.00 N ATOM 143 CA VAL A 218 8.120 -2.357 4.394 1.00 0.00 C ATOM 144 C VAL A 218 7.382 -2.940 5.592 1.00 0.00 C ATOM 145 O VAL A 218 6.893 -4.069 5.548 1.00 0.00 O ATOM 146 CB VAL A 218 7.481 -1.002 4.033 1.00 0.00 C ATOM 147 CG1 VAL A 218 8.088 -0.446 2.754 1.00 0.00 C ATOM 148 CG2 VAL A 218 5.969 -1.140 3.898 1.00 0.00 C ATOM 0 H VAL A 218 7.258 -3.849 3.201 1.00 0.00 H new ATOM 0 HA VAL A 218 9.168 -2.210 4.655 1.00 0.00 H new ATOM 0 HB VAL A 218 7.688 -0.300 4.841 1.00 0.00 H new ATOM 0 HG11 VAL A 218 7.623 0.511 2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 218 9.160 -0.304 2.892 1.00 0.00 H new ATOM 0 HG13 VAL A 218 7.916 -1.145 1.936 1.00 0.00 H new ATOM 0 HG21 VAL A 218 5.537 -0.172 3.643 1.00 0.00 H new ATOM 0 HG22 VAL A 218 5.738 -1.859 3.112 1.00 0.00 H new ATOM 0 HG23 VAL A 218 5.550 -1.487 4.842 1.00 0.00 H new ATOM 158 N LEU A 219 7.286 -2.146 6.651 1.00 0.00 N ATOM 159 CA LEU A 219 6.586 -2.560 7.857 1.00 0.00 C ATOM 160 C LEU A 219 5.503 -1.553 8.204 1.00 0.00 C ATOM 161 O LEU A 219 5.786 -0.377 8.422 1.00 0.00 O ATOM 162 CB LEU A 219 7.552 -2.690 9.034 1.00 0.00 C ATOM 163 CG LEU A 219 8.649 -3.743 8.878 1.00 0.00 C ATOM 164 CD1 LEU A 219 9.370 -3.953 10.200 1.00 0.00 C ATOM 165 CD2 LEU A 219 8.067 -5.055 8.372 1.00 0.00 C ATOM 0 H LEU A 219 7.686 -1.209 6.697 1.00 0.00 H new ATOM 0 HA LEU A 219 6.134 -3.533 7.666 1.00 0.00 H new ATOM 0 HB2 LEU A 219 8.024 -1.722 9.201 1.00 0.00 H new ATOM 0 HB3 LEU A 219 6.976 -2.922 9.929 1.00 0.00 H new ATOM 0 HG LEU A 219 9.369 -3.385 8.143 1.00 0.00 H new ATOM 0 HD11 LEU A 219 10.149 -4.705 10.074 1.00 0.00 H new ATOM 0 HD12 LEU A 219 9.821 -3.014 10.522 1.00 0.00 H new ATOM 0 HD13 LEU A 219 8.658 -4.290 10.953 1.00 0.00 H new ATOM 0 HD21 LEU A 219 8.865 -5.791 8.268 1.00 0.00 H new ATOM 0 HD22 LEU A 219 7.325 -5.422 9.082 1.00 0.00 H new ATOM 0 HD23 LEU A 219 7.594 -4.894 7.403 1.00 0.00 H new ATOM 177 N VAL A 220 4.264 -2.015 8.265 1.00 0.00 N ATOM 178 CA VAL A 220 3.148 -1.139 8.598 1.00 0.00 C ATOM 179 C VAL A 220 2.939 -1.102 10.107 1.00 0.00 C ATOM 180 O VAL A 220 2.538 -2.095 10.716 1.00 0.00 O ATOM 181 CB VAL A 220 1.831 -1.562 7.897 1.00 0.00 C ATOM 182 CG1 VAL A 220 1.285 -0.419 7.054 1.00 0.00 C ATOM 183 CG2 VAL A 220 2.031 -2.807 7.046 1.00 0.00 C ATOM 0 H VAL A 220 4.005 -2.986 8.090 1.00 0.00 H new ATOM 0 HA VAL A 220 3.406 -0.144 8.235 1.00 0.00 H new ATOM 0 HB VAL A 220 1.103 -1.803 8.671 1.00 0.00 H new ATOM 0 HG11 VAL A 220 0.361 -0.734 6.569 1.00 0.00 H new ATOM 0 HG12 VAL A 220 1.085 0.441 7.693 1.00 0.00 H new ATOM 0 HG13 VAL A 220 2.017 -0.145 6.295 1.00 0.00 H new ATOM 0 HG21 VAL A 220 1.089 -3.077 6.569 1.00 0.00 H new ATOM 0 HG22 VAL A 220 2.782 -2.608 6.281 1.00 0.00 H new ATOM 0 HG23 VAL A 220 2.366 -3.630 7.678 1.00 0.00 H new ATOM 193 N GLY A 221 3.232 0.049 10.706 1.00 0.00 N ATOM 194 CA GLY A 221 3.089 0.198 12.141 1.00 0.00 C ATOM 195 C GLY A 221 4.336 -0.229 12.899 1.00 0.00 C ATOM 196 O GLY A 221 4.420 -0.053 14.114 1.00 0.00 O ATOM 0 H GLY A 221 3.566 0.882 10.221 1.00 0.00 H new ATOM 0 HA2 GLY A 221 2.865 1.239 12.374 1.00 0.00 H new ATOM 0 HA3 GLY A 221 2.240 -0.395 12.482 1.00 0.00 H new ATOM 200 N GLY A 222 5.308 -0.792 12.179 1.00 0.00 N ATOM 201 CA GLY A 222 6.539 -1.236 12.808 1.00 0.00 C ATOM 202 C GLY A 222 6.473 -2.676 13.274 1.00 0.00 C ATOM 203 O GLY A 222 7.501 -3.345 13.392 1.00 0.00 O ATOM 0 H GLY A 222 5.262 -0.947 11.172 1.00 0.00 H new ATOM 0 HA2 GLY A 222 7.363 -1.124 12.103 1.00 0.00 H new ATOM 0 HA3 GLY A 222 6.759 -0.593 13.660 1.00 0.00 H new ATOM 207 N THR A 223 5.265 -3.157 13.540 1.00 0.00 N ATOM 208 CA THR A 223 5.070 -4.525 13.995 1.00 0.00 C ATOM 209 C THR A 223 4.591 -5.415 12.854 1.00 0.00 C ATOM 210 O THR A 223 4.816 -6.625 12.858 1.00 0.00 O ATOM 211 CB THR A 223 4.059 -4.556 15.140 1.00 0.00 C ATOM 212 OG1 THR A 223 2.905 -3.804 14.809 1.00 0.00 O ATOM 213 CG2 THR A 223 4.611 -4.000 16.434 1.00 0.00 C ATOM 0 H THR A 223 4.404 -2.617 13.448 1.00 0.00 H new ATOM 0 HA THR A 223 6.027 -4.907 14.350 1.00 0.00 H new ATOM 0 HB THR A 223 3.816 -5.608 15.286 1.00 0.00 H new ATOM 0 HG1 THR A 223 2.268 -3.837 15.553 1.00 0.00 H new ATOM 0 HG21 THR A 223 3.845 -4.050 17.208 1.00 0.00 H new ATOM 0 HG22 THR A 223 5.477 -4.587 16.742 1.00 0.00 H new ATOM 0 HG23 THR A 223 4.910 -2.962 16.286 1.00 0.00 H new ATOM 221 N LYS A 224 3.927 -4.805 11.877 1.00 0.00 N ATOM 222 CA LYS A 224 3.413 -5.540 10.728 1.00 0.00 C ATOM 223 C LYS A 224 4.345 -5.382 9.532 1.00 0.00 C ATOM 224 O LYS A 224 4.976 -4.339 9.363 1.00 0.00 O ATOM 225 CB LYS A 224 2.007 -5.048 10.367 1.00 0.00 C ATOM 226 CG LYS A 224 1.166 -4.635 11.568 1.00 0.00 C ATOM 227 CD LYS A 224 0.460 -5.825 12.196 1.00 0.00 C ATOM 228 CE LYS A 224 1.450 -6.793 12.824 1.00 0.00 C ATOM 229 NZ LYS A 224 0.843 -7.552 13.954 1.00 0.00 N ATOM 0 H LYS A 224 3.733 -3.804 11.859 1.00 0.00 H new ATOM 0 HA LYS A 224 3.360 -6.596 10.992 1.00 0.00 H new ATOM 0 HB2 LYS A 224 2.094 -4.199 9.688 1.00 0.00 H new ATOM 0 HB3 LYS A 224 1.485 -5.837 9.826 1.00 0.00 H new ATOM 0 HG2 LYS A 224 1.804 -4.156 12.311 1.00 0.00 H new ATOM 0 HG3 LYS A 224 0.427 -3.896 11.258 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -0.240 -5.475 12.955 1.00 0.00 H new ATOM 0 HD3 LYS A 224 -0.126 -6.344 11.437 1.00 0.00 H new ATOM 0 HE2 LYS A 224 1.805 -7.492 12.066 1.00 0.00 H new ATOM 0 HE3 LYS A 224 2.320 -6.242 13.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 1.550 -8.201 14.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 0.527 -6.887 14.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 0.029 -8.098 13.608 1.00 0.00 H new ATOM 243 N ALA A 225 4.430 -6.419 8.706 1.00 0.00 N ATOM 244 CA ALA A 225 5.290 -6.387 7.526 1.00 0.00 C ATOM 245 C ALA A 225 4.488 -6.621 6.256 1.00 0.00 C ATOM 246 O ALA A 225 3.557 -7.426 6.239 1.00 0.00 O ATOM 247 CB ALA A 225 6.395 -7.422 7.644 1.00 0.00 C ATOM 0 H ALA A 225 3.916 -7.291 8.830 1.00 0.00 H new ATOM 0 HA ALA A 225 5.740 -5.396 7.468 1.00 0.00 H new ATOM 0 HB1 ALA A 225 7.026 -7.384 6.756 1.00 0.00 H new ATOM 0 HB2 ALA A 225 6.998 -7.211 8.527 1.00 0.00 H new ATOM 0 HB3 ALA A 225 5.955 -8.415 7.734 1.00 0.00 H new ATOM 253 N GLY A 226 4.855 -5.916 5.192 1.00 0.00 N ATOM 254 CA GLY A 226 4.156 -6.068 3.933 1.00 0.00 C ATOM 255 C GLY A 226 4.815 -5.311 2.797 1.00 0.00 C ATOM 256 O GLY A 226 5.963 -4.880 2.910 1.00 0.00 O ATOM 0 H GLY A 226 5.622 -5.244 5.180 1.00 0.00 H new ATOM 0 HA2 GLY A 226 4.106 -7.126 3.677 1.00 0.00 H new ATOM 0 HA3 GLY A 226 3.130 -5.719 4.048 1.00 0.00 H new ATOM 260 N VAL A 227 4.084 -5.154 1.698 1.00 0.00 N ATOM 261 CA VAL A 227 4.593 -4.446 0.530 1.00 0.00 C ATOM 262 C VAL A 227 3.717 -3.245 0.191 1.00 0.00 C ATOM 263 O VAL A 227 2.494 -3.353 0.140 1.00 0.00 O ATOM 264 CB VAL A 227 4.663 -5.378 -0.699 1.00 0.00 C ATOM 265 CG1 VAL A 227 5.059 -4.603 -1.947 1.00 0.00 C ATOM 266 CG2 VAL A 227 5.629 -6.524 -0.444 1.00 0.00 C ATOM 0 H VAL A 227 3.134 -5.509 1.592 1.00 0.00 H new ATOM 0 HA VAL A 227 5.597 -4.101 0.778 1.00 0.00 H new ATOM 0 HB VAL A 227 3.671 -5.797 -0.866 1.00 0.00 H new ATOM 0 HG11 VAL A 227 5.101 -5.282 -2.799 1.00 0.00 H new ATOM 0 HG12 VAL A 227 4.322 -3.824 -2.140 1.00 0.00 H new ATOM 0 HG13 VAL A 227 6.038 -4.148 -1.797 1.00 0.00 H new ATOM 0 HG21 VAL A 227 5.666 -7.171 -1.321 1.00 0.00 H new ATOM 0 HG22 VAL A 227 6.624 -6.124 -0.246 1.00 0.00 H new ATOM 0 HG23 VAL A 227 5.291 -7.100 0.418 1.00 0.00 H new ATOM 276 N VAL A 228 4.351 -2.103 -0.055 1.00 0.00 N ATOM 277 CA VAL A 228 3.623 -0.891 -0.401 1.00 0.00 C ATOM 278 C VAL A 228 2.826 -1.095 -1.686 1.00 0.00 C ATOM 279 O VAL A 228 3.347 -1.616 -2.671 1.00 0.00 O ATOM 280 CB VAL A 228 4.576 0.305 -0.576 1.00 0.00 C ATOM 281 CG1 VAL A 228 3.791 1.593 -0.775 1.00 0.00 C ATOM 282 CG2 VAL A 228 5.512 0.417 0.619 1.00 0.00 C ATOM 0 H VAL A 228 5.364 -1.993 -0.021 1.00 0.00 H new ATOM 0 HA VAL A 228 2.940 -0.674 0.421 1.00 0.00 H new ATOM 0 HB VAL A 228 5.180 0.139 -1.468 1.00 0.00 H new ATOM 0 HG11 VAL A 228 4.483 2.426 -0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 228 3.168 1.506 -1.665 1.00 0.00 H new ATOM 0 HG13 VAL A 228 3.158 1.771 0.094 1.00 0.00 H new ATOM 0 HG21 VAL A 228 6.179 1.267 0.480 1.00 0.00 H new ATOM 0 HG22 VAL A 228 4.927 0.560 1.527 1.00 0.00 H new ATOM 0 HG23 VAL A 228 6.101 -0.496 0.707 1.00 0.00 H new ATOM 292 N ARG A 229 1.559 -0.700 -1.665 1.00 0.00 N ATOM 293 CA ARG A 229 0.694 -0.864 -2.828 1.00 0.00 C ATOM 294 C ARG A 229 0.141 0.477 -3.309 1.00 0.00 C ATOM 295 O ARG A 229 0.138 0.760 -4.508 1.00 0.00 O ATOM 296 CB ARG A 229 -0.453 -1.816 -2.490 1.00 0.00 C ATOM 297 CG ARG A 229 0.011 -3.145 -1.912 1.00 0.00 C ATOM 298 CD ARG A 229 1.083 -3.789 -2.779 1.00 0.00 C ATOM 299 NE ARG A 229 0.876 -5.228 -2.927 1.00 0.00 N ATOM 300 CZ ARG A 229 1.432 -5.961 -3.890 1.00 0.00 C ATOM 301 NH1 ARG A 229 2.228 -5.395 -4.789 1.00 0.00 N ATOM 302 NH2 ARG A 229 1.192 -7.263 -3.953 1.00 0.00 N ATOM 0 H ARG A 229 1.109 -0.266 -0.860 1.00 0.00 H new ATOM 0 HA ARG A 229 1.291 -1.286 -3.637 1.00 0.00 H new ATOM 0 HB2 ARG A 229 -1.119 -1.331 -1.776 1.00 0.00 H new ATOM 0 HB3 ARG A 229 -1.036 -2.005 -3.392 1.00 0.00 H new ATOM 0 HG2 ARG A 229 0.401 -2.989 -0.906 1.00 0.00 H new ATOM 0 HG3 ARG A 229 -0.840 -3.820 -1.823 1.00 0.00 H new ATOM 0 HD2 ARG A 229 1.084 -3.320 -3.763 1.00 0.00 H new ATOM 0 HD3 ARG A 229 2.063 -3.607 -2.338 1.00 0.00 H new ATOM 0 HE ARG A 229 0.271 -5.698 -2.254 1.00 0.00 H new ATOM 0 HH11 ARG A 229 2.417 -4.394 -4.745 1.00 0.00 H new ATOM 0 HH12 ARG A 229 2.651 -5.962 -5.524 1.00 0.00 H new ATOM 0 HH21 ARG A 229 0.582 -7.703 -3.264 1.00 0.00 H new ATOM 0 HH22 ARG A 229 1.617 -7.825 -4.690 1.00 0.00 H new ATOM 316 N PHE A 230 -0.328 1.296 -2.375 1.00 0.00 N ATOM 317 CA PHE A 230 -0.882 2.602 -2.715 1.00 0.00 C ATOM 318 C PHE A 230 -0.616 3.612 -1.605 1.00 0.00 C ATOM 319 O PHE A 230 -0.850 3.329 -0.434 1.00 0.00 O ATOM 320 CB PHE A 230 -2.386 2.491 -2.970 1.00 0.00 C ATOM 321 CG PHE A 230 -2.950 3.647 -3.748 1.00 0.00 C ATOM 322 CD1 PHE A 230 -2.791 3.719 -5.122 1.00 0.00 C ATOM 323 CD2 PHE A 230 -3.640 4.661 -3.102 1.00 0.00 C ATOM 324 CE1 PHE A 230 -3.309 4.781 -5.839 1.00 0.00 C ATOM 325 CE2 PHE A 230 -4.159 5.726 -3.813 1.00 0.00 C ATOM 326 CZ PHE A 230 -3.994 5.786 -5.183 1.00 0.00 C ATOM 0 H PHE A 230 -0.336 1.080 -1.378 1.00 0.00 H new ATOM 0 HA PHE A 230 -0.391 2.951 -3.624 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -2.587 1.567 -3.511 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -2.904 2.420 -2.014 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -2.256 2.936 -5.639 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -3.773 4.618 -2.031 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -3.179 4.825 -6.910 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -4.693 6.511 -3.298 1.00 0.00 H new ATOM 0 HZ PHE A 230 -4.400 6.617 -5.741 1.00 0.00 H new ATOM 336 N LEU A 231 -0.132 4.791 -1.980 1.00 0.00 N ATOM 337 CA LEU A 231 0.159 5.837 -1.005 1.00 0.00 C ATOM 338 C LEU A 231 -0.723 7.058 -1.235 1.00 0.00 C ATOM 339 O LEU A 231 -0.715 7.647 -2.316 1.00 0.00 O ATOM 340 CB LEU A 231 1.635 6.235 -1.075 1.00 0.00 C ATOM 341 CG LEU A 231 2.622 5.064 -1.088 1.00 0.00 C ATOM 342 CD1 LEU A 231 3.298 4.947 -2.445 1.00 0.00 C ATOM 343 CD2 LEU A 231 3.661 5.227 0.012 1.00 0.00 C ATOM 0 H LEU A 231 0.067 5.046 -2.947 1.00 0.00 H new ATOM 0 HA LEU A 231 -0.055 5.441 -0.012 1.00 0.00 H new ATOM 0 HB2 LEU A 231 1.792 6.833 -1.973 1.00 0.00 H new ATOM 0 HB3 LEU A 231 1.864 6.874 -0.222 1.00 0.00 H new ATOM 0 HG LEU A 231 2.064 4.146 -0.902 1.00 0.00 H new ATOM 0 HD11 LEU A 231 3.995 4.109 -2.433 1.00 0.00 H new ATOM 0 HD12 LEU A 231 2.544 4.781 -3.214 1.00 0.00 H new ATOM 0 HD13 LEU A 231 3.840 5.867 -2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 231 4.353 4.385 -0.014 1.00 0.00 H new ATOM 0 HD22 LEU A 231 4.212 6.155 -0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 231 3.163 5.258 0.981 1.00 0.00 H new ATOM 355 N GLY A 232 -1.481 7.434 -0.211 1.00 0.00 N ATOM 356 CA GLY A 232 -2.360 8.584 -0.318 1.00 0.00 C ATOM 357 C GLY A 232 -3.241 8.756 0.903 1.00 0.00 C ATOM 358 O GLY A 232 -3.104 8.025 1.884 1.00 0.00 O ATOM 0 H GLY A 232 -1.502 6.962 0.693 1.00 0.00 H new ATOM 0 HA2 GLY A 232 -1.761 9.483 -0.459 1.00 0.00 H new ATOM 0 HA3 GLY A 232 -2.988 8.477 -1.203 1.00 0.00 H new ATOM 362 N GLU A 233 -4.146 9.727 0.847 1.00 0.00 N ATOM 363 CA GLU A 233 -5.051 9.993 1.958 1.00 0.00 C ATOM 364 C GLU A 233 -6.212 9.005 1.961 1.00 0.00 C ATOM 365 O GLU A 233 -6.506 8.373 0.947 1.00 0.00 O ATOM 366 CB GLU A 233 -5.585 11.425 1.877 1.00 0.00 C ATOM 367 CG GLU A 233 -4.491 12.480 1.842 1.00 0.00 C ATOM 368 CD GLU A 233 -4.257 13.029 0.447 1.00 0.00 C ATOM 369 OE1 GLU A 233 -3.880 12.241 -0.446 1.00 0.00 O ATOM 370 OE2 GLU A 233 -4.451 14.247 0.249 1.00 0.00 O ATOM 0 H GLU A 233 -4.272 10.343 0.044 1.00 0.00 H new ATOM 0 HA GLU A 233 -4.492 9.873 2.886 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -6.203 11.524 0.984 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -6.232 11.612 2.734 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -4.758 13.298 2.511 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -3.564 12.050 2.220 1.00 0.00 H new ATOM 377 N THR A 234 -6.870 8.878 3.109 1.00 0.00 N ATOM 378 CA THR A 234 -8.001 7.966 3.243 1.00 0.00 C ATOM 379 C THR A 234 -9.316 8.736 3.307 1.00 0.00 C ATOM 380 O THR A 234 -9.328 9.948 3.514 1.00 0.00 O ATOM 381 CB THR A 234 -7.840 7.105 4.498 1.00 0.00 C ATOM 382 OG1 THR A 234 -8.010 7.885 5.668 1.00 0.00 O ATOM 383 CG2 THR A 234 -6.492 6.426 4.590 1.00 0.00 C ATOM 0 H THR A 234 -6.640 9.394 3.958 1.00 0.00 H new ATOM 0 HA THR A 234 -8.022 7.320 2.366 1.00 0.00 H new ATOM 0 HB THR A 234 -8.610 6.337 4.421 1.00 0.00 H new ATOM 0 HG1 THR A 234 -7.836 8.827 5.461 1.00 0.00 H new ATOM 0 HG21 THR A 234 -6.445 5.832 5.503 1.00 0.00 H new ATOM 0 HG22 THR A 234 -6.353 5.776 3.726 1.00 0.00 H new ATOM 0 HG23 THR A 234 -5.705 7.180 4.607 1.00 0.00 H new ATOM 391 N ASP A 235 -10.421 8.022 3.123 1.00 0.00 N ATOM 392 CA ASP A 235 -11.744 8.638 3.157 1.00 0.00 C ATOM 393 C ASP A 235 -12.331 8.621 4.567 1.00 0.00 C ATOM 394 O ASP A 235 -13.440 9.109 4.789 1.00 0.00 O ATOM 395 CB ASP A 235 -12.685 7.919 2.188 1.00 0.00 C ATOM 396 CG ASP A 235 -13.374 8.875 1.234 1.00 0.00 C ATOM 397 OD1 ASP A 235 -14.316 9.571 1.668 1.00 0.00 O ATOM 398 OD2 ASP A 235 -12.971 8.927 0.053 1.00 0.00 O ATOM 0 H ASP A 235 -10.428 7.017 2.949 1.00 0.00 H new ATOM 0 HA ASP A 235 -11.637 9.678 2.850 1.00 0.00 H new ATOM 0 HB2 ASP A 235 -12.120 7.183 1.616 1.00 0.00 H new ATOM 0 HB3 ASP A 235 -13.437 7.371 2.756 1.00 0.00 H new ATOM 403 N PHE A 236 -11.590 8.059 5.520 1.00 0.00 N ATOM 404 CA PHE A 236 -12.054 7.986 6.901 1.00 0.00 C ATOM 405 C PHE A 236 -11.053 8.630 7.865 1.00 0.00 C ATOM 406 O PHE A 236 -11.395 8.942 9.006 1.00 0.00 O ATOM 407 CB PHE A 236 -12.308 6.527 7.303 1.00 0.00 C ATOM 408 CG PHE A 236 -11.064 5.771 7.687 1.00 0.00 C ATOM 409 CD1 PHE A 236 -10.030 5.598 6.782 1.00 0.00 C ATOM 410 CD2 PHE A 236 -10.932 5.234 8.958 1.00 0.00 C ATOM 411 CE1 PHE A 236 -8.887 4.906 7.136 1.00 0.00 C ATOM 412 CE2 PHE A 236 -9.793 4.540 9.318 1.00 0.00 C ATOM 413 CZ PHE A 236 -8.768 4.377 8.405 1.00 0.00 C ATOM 0 H PHE A 236 -10.670 7.649 5.361 1.00 0.00 H new ATOM 0 HA PHE A 236 -12.989 8.543 6.965 1.00 0.00 H new ATOM 0 HB2 PHE A 236 -13.005 6.508 8.141 1.00 0.00 H new ATOM 0 HB3 PHE A 236 -12.792 6.012 6.474 1.00 0.00 H new ATOM 0 HD1 PHE A 236 -10.118 6.009 5.787 1.00 0.00 H new ATOM 0 HD2 PHE A 236 -11.729 5.360 9.676 1.00 0.00 H new ATOM 0 HE1 PHE A 236 -8.088 4.779 6.420 1.00 0.00 H new ATOM 0 HE2 PHE A 236 -9.704 4.125 10.311 1.00 0.00 H new ATOM 0 HZ PHE A 236 -7.876 3.837 8.684 1.00 0.00 H new ATOM 423 N ALA A 237 -9.818 8.822 7.405 1.00 0.00 N ATOM 424 CA ALA A 237 -8.783 9.423 8.236 1.00 0.00 C ATOM 425 C ALA A 237 -8.242 10.701 7.606 1.00 0.00 C ATOM 426 O ALA A 237 -8.087 10.788 6.388 1.00 0.00 O ATOM 427 CB ALA A 237 -7.654 8.430 8.469 1.00 0.00 C ATOM 0 H ALA A 237 -9.513 8.570 6.465 1.00 0.00 H new ATOM 0 HA ALA A 237 -9.230 9.685 9.195 1.00 0.00 H new ATOM 0 HB1 ALA A 237 -6.887 8.891 9.091 1.00 0.00 H new ATOM 0 HB2 ALA A 237 -8.045 7.545 8.971 1.00 0.00 H new ATOM 0 HB3 ALA A 237 -7.220 8.142 7.512 1.00 0.00 H new ATOM 433 N LYS A 238 -7.955 11.692 8.444 1.00 0.00 N ATOM 434 CA LYS A 238 -7.428 12.966 7.970 1.00 0.00 C ATOM 435 C LYS A 238 -5.906 12.923 7.880 1.00 0.00 C ATOM 436 O LYS A 238 -5.234 12.429 8.783 1.00 0.00 O ATOM 437 CB LYS A 238 -7.865 14.100 8.899 1.00 0.00 C ATOM 438 CG LYS A 238 -7.613 15.485 8.325 1.00 0.00 C ATOM 439 CD LYS A 238 -8.792 16.413 8.568 1.00 0.00 C ATOM 440 CE LYS A 238 -10.044 15.920 7.861 1.00 0.00 C ATOM 441 NZ LYS A 238 -10.993 17.030 7.572 1.00 0.00 N ATOM 0 H LYS A 238 -8.079 11.637 9.455 1.00 0.00 H new ATOM 0 HA LYS A 238 -7.828 13.149 6.973 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -8.928 13.993 9.115 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -7.336 14.007 9.847 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -6.716 15.909 8.776 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -7.425 15.407 7.254 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -8.983 16.488 9.639 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -8.546 17.415 8.217 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -9.765 15.429 6.929 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -10.539 15.171 8.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -11.833 16.652 7.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -11.280 17.482 8.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -10.530 17.732 6.961 1.00 0.00 H new ATOM 455 N GLY A 239 -5.368 13.446 6.782 1.00 0.00 N ATOM 456 CA GLY A 239 -3.929 13.458 6.593 1.00 0.00 C ATOM 457 C GLY A 239 -3.481 12.508 5.499 1.00 0.00 C ATOM 458 O GLY A 239 -4.284 12.086 4.668 1.00 0.00 O ATOM 0 H GLY A 239 -5.903 13.862 6.020 1.00 0.00 H new ATOM 0 HA2 GLY A 239 -3.606 14.470 6.347 1.00 0.00 H new ATOM 0 HA3 GLY A 239 -3.440 13.187 7.529 1.00 0.00 H new ATOM 462 N GLU A 240 -2.195 12.172 5.499 1.00 0.00 N ATOM 463 CA GLU A 240 -1.641 11.268 4.499 1.00 0.00 C ATOM 464 C GLU A 240 -1.499 9.856 5.060 1.00 0.00 C ATOM 465 O GLU A 240 -1.150 9.674 6.226 1.00 0.00 O ATOM 466 CB GLU A 240 -0.283 11.777 4.015 1.00 0.00 C ATOM 467 CG GLU A 240 0.731 11.961 5.133 1.00 0.00 C ATOM 468 CD GLU A 240 2.102 12.351 4.617 1.00 0.00 C ATOM 469 OE1 GLU A 240 2.626 11.644 3.730 1.00 0.00 O ATOM 470 OE2 GLU A 240 2.654 13.363 5.099 1.00 0.00 O ATOM 0 H GLU A 240 -1.517 12.513 6.181 1.00 0.00 H new ATOM 0 HA GLU A 240 -2.330 11.236 3.655 1.00 0.00 H new ATOM 0 HB2 GLU A 240 0.119 11.076 3.283 1.00 0.00 H new ATOM 0 HB3 GLU A 240 -0.423 12.729 3.502 1.00 0.00 H new ATOM 0 HG2 GLU A 240 0.374 12.728 5.820 1.00 0.00 H new ATOM 0 HG3 GLU A 240 0.811 11.035 5.702 1.00 0.00 H new ATOM 477 N TRP A 241 -1.772 8.860 4.223 1.00 0.00 N ATOM 478 CA TRP A 241 -1.675 7.466 4.637 1.00 0.00 C ATOM 479 C TRP A 241 -1.041 6.615 3.541 1.00 0.00 C ATOM 480 O TRP A 241 -0.870 7.069 2.409 1.00 0.00 O ATOM 481 CB TRP A 241 -3.062 6.921 4.986 1.00 0.00 C ATOM 482 CG TRP A 241 -3.663 7.565 6.198 1.00 0.00 C ATOM 483 CD1 TRP A 241 -4.147 8.840 6.293 1.00 0.00 C ATOM 484 CD2 TRP A 241 -3.842 6.970 7.487 1.00 0.00 C ATOM 485 NE1 TRP A 241 -4.616 9.071 7.564 1.00 0.00 N ATOM 486 CE2 TRP A 241 -4.439 7.939 8.316 1.00 0.00 C ATOM 487 CE3 TRP A 241 -3.554 5.710 8.021 1.00 0.00 C ATOM 488 CZ2 TRP A 241 -4.754 7.685 9.650 1.00 0.00 C ATOM 489 CZ3 TRP A 241 -3.868 5.463 9.344 1.00 0.00 C ATOM 490 CH2 TRP A 241 -4.462 6.445 10.145 1.00 0.00 C ATOM 0 H TRP A 241 -2.062 8.993 3.254 1.00 0.00 H new ATOM 0 HA TRP A 241 -1.039 7.417 5.521 1.00 0.00 H new ATOM 0 HB2 TRP A 241 -3.728 7.070 4.136 1.00 0.00 H new ATOM 0 HB3 TRP A 241 -2.991 5.846 5.151 1.00 0.00 H new ATOM 0 HD1 TRP A 241 -4.159 9.560 5.488 1.00 0.00 H new ATOM 0 HE1 TRP A 241 -5.029 9.943 7.894 1.00 0.00 H new ATOM 0 HE3 TRP A 241 -3.095 4.945 7.412 1.00 0.00 H new ATOM 0 HZ2 TRP A 241 -5.212 8.441 10.270 1.00 0.00 H new ATOM 0 HZ3 TRP A 241 -3.651 4.494 9.768 1.00 0.00 H new ATOM 0 HH2 TRP A 241 -4.694 6.218 11.175 1.00 0.00 H new ATOM 501 N CYS A 242 -0.693 5.378 3.883 1.00 0.00 N ATOM 502 CA CYS A 242 -0.077 4.466 2.924 1.00 0.00 C ATOM 503 C CYS A 242 -0.695 3.074 3.017 1.00 0.00 C ATOM 504 O CYS A 242 -1.247 2.694 4.049 1.00 0.00 O ATOM 505 CB CYS A 242 1.435 4.387 3.158 1.00 0.00 C ATOM 506 SG CYS A 242 2.296 3.228 2.069 1.00 0.00 S ATOM 0 H CYS A 242 -0.827 4.985 4.815 1.00 0.00 H new ATOM 0 HA CYS A 242 -0.261 4.856 1.923 1.00 0.00 H new ATOM 0 HB2 CYS A 242 1.864 5.380 3.025 1.00 0.00 H new ATOM 0 HB3 CYS A 242 1.616 4.098 4.193 1.00 0.00 H new ATOM 0 HG CYS A 242 3.567 3.236 2.344 1.00 0.00 H new ATOM 512 N GLY A 243 -0.596 2.322 1.926 1.00 0.00 N ATOM 513 CA GLY A 243 -1.144 0.981 1.889 1.00 0.00 C ATOM 514 C GLY A 243 -0.069 -0.073 1.720 1.00 0.00 C ATOM 515 O GLY A 243 0.740 0.000 0.794 1.00 0.00 O ATOM 0 H GLY A 243 -0.143 2.621 1.062 1.00 0.00 H new ATOM 0 HA2 GLY A 243 -1.696 0.790 2.810 1.00 0.00 H new ATOM 0 HA3 GLY A 243 -1.857 0.905 1.068 1.00 0.00 H new ATOM 519 N VAL A 244 -0.054 -1.050 2.617 1.00 0.00 N ATOM 520 CA VAL A 244 0.935 -2.118 2.563 1.00 0.00 C ATOM 521 C VAL A 244 0.268 -3.489 2.638 1.00 0.00 C ATOM 522 O VAL A 244 -0.585 -3.728 3.493 1.00 0.00 O ATOM 523 CB VAL A 244 1.956 -1.998 3.714 1.00 0.00 C ATOM 524 CG1 VAL A 244 3.176 -2.864 3.445 1.00 0.00 C ATOM 525 CG2 VAL A 244 2.366 -0.547 3.930 1.00 0.00 C ATOM 0 H VAL A 244 -0.715 -1.125 3.390 1.00 0.00 H new ATOM 0 HA VAL A 244 1.455 -2.018 1.610 1.00 0.00 H new ATOM 0 HB VAL A 244 1.477 -2.354 4.626 1.00 0.00 H new ATOM 0 HG11 VAL A 244 3.882 -2.764 4.269 1.00 0.00 H new ATOM 0 HG12 VAL A 244 2.870 -3.906 3.354 1.00 0.00 H new ATOM 0 HG13 VAL A 244 3.652 -2.544 2.518 1.00 0.00 H new ATOM 0 HG21 VAL A 244 3.086 -0.490 4.746 1.00 0.00 H new ATOM 0 HG22 VAL A 244 2.819 -0.157 3.019 1.00 0.00 H new ATOM 0 HG23 VAL A 244 1.486 0.046 4.180 1.00 0.00 H new ATOM 535 N GLU A 245 0.671 -4.386 1.745 1.00 0.00 N ATOM 536 CA GLU A 245 0.120 -5.736 1.720 1.00 0.00 C ATOM 537 C GLU A 245 0.860 -6.618 2.716 1.00 0.00 C ATOM 538 O GLU A 245 2.034 -6.928 2.528 1.00 0.00 O ATOM 539 CB GLU A 245 0.223 -6.330 0.314 1.00 0.00 C ATOM 540 CG GLU A 245 -0.350 -7.733 0.204 1.00 0.00 C ATOM 541 CD GLU A 245 -0.937 -8.018 -1.164 1.00 0.00 C ATOM 542 OE1 GLU A 245 -0.634 -7.262 -2.111 1.00 0.00 O ATOM 543 OE2 GLU A 245 -1.700 -8.999 -1.291 1.00 0.00 O ATOM 0 H GLU A 245 1.376 -4.204 1.030 1.00 0.00 H new ATOM 0 HA GLU A 245 -0.932 -5.689 2.000 1.00 0.00 H new ATOM 0 HB2 GLU A 245 -0.298 -5.677 -0.386 1.00 0.00 H new ATOM 0 HB3 GLU A 245 1.270 -6.349 0.012 1.00 0.00 H new ATOM 0 HG2 GLU A 245 0.434 -8.459 0.417 1.00 0.00 H new ATOM 0 HG3 GLU A 245 -1.122 -7.866 0.962 1.00 0.00 H new ATOM 550 N LEU A 246 0.171 -7.002 3.781 1.00 0.00 N ATOM 551 CA LEU A 246 0.770 -7.831 4.818 1.00 0.00 C ATOM 552 C LEU A 246 1.086 -9.229 4.302 1.00 0.00 C ATOM 553 O LEU A 246 0.347 -9.791 3.494 1.00 0.00 O ATOM 554 CB LEU A 246 -0.161 -7.917 6.028 1.00 0.00 C ATOM 555 CG LEU A 246 -0.452 -6.582 6.714 1.00 0.00 C ATOM 556 CD1 LEU A 246 -1.422 -6.775 7.869 1.00 0.00 C ATOM 557 CD2 LEU A 246 0.839 -5.941 7.200 1.00 0.00 C ATOM 0 H LEU A 246 -0.804 -6.753 3.950 1.00 0.00 H new ATOM 0 HA LEU A 246 1.708 -7.364 5.117 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -1.105 -8.359 5.710 1.00 0.00 H new ATOM 0 HB3 LEU A 246 0.279 -8.596 6.759 1.00 0.00 H new ATOM 0 HG LEU A 246 -0.915 -5.915 5.987 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -1.617 -5.814 8.345 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -2.357 -7.190 7.493 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -0.988 -7.459 8.598 1.00 0.00 H new ATOM 0 HD21 LEU A 246 0.613 -4.992 7.686 1.00 0.00 H new ATOM 0 HD22 LEU A 246 1.330 -6.605 7.912 1.00 0.00 H new ATOM 0 HD23 LEU A 246 1.500 -5.766 6.351 1.00 0.00 H new ATOM 569 N ASP A 247 2.198 -9.781 4.779 1.00 0.00 N ATOM 570 CA ASP A 247 2.633 -11.112 4.376 1.00 0.00 C ATOM 571 C ASP A 247 1.738 -12.194 4.978 1.00 0.00 C ATOM 572 O ASP A 247 1.619 -13.290 4.428 1.00 0.00 O ATOM 573 CB ASP A 247 4.085 -11.337 4.802 1.00 0.00 C ATOM 574 CG ASP A 247 5.073 -10.693 3.848 1.00 0.00 C ATOM 575 OD1 ASP A 247 4.782 -10.647 2.634 1.00 0.00 O ATOM 576 OD2 ASP A 247 6.138 -10.235 4.314 1.00 0.00 O ATOM 0 H ASP A 247 2.816 -9.323 5.449 1.00 0.00 H new ATOM 0 HA ASP A 247 2.559 -11.179 3.291 1.00 0.00 H new ATOM 0 HB2 ASP A 247 4.234 -10.932 5.803 1.00 0.00 H new ATOM 0 HB3 ASP A 247 4.283 -12.407 4.858 1.00 0.00 H new ATOM 581 N GLU A 248 1.113 -11.882 6.109 1.00 0.00 N ATOM 582 CA GLU A 248 0.233 -12.832 6.782 1.00 0.00 C ATOM 583 C GLU A 248 -1.047 -12.147 7.257 1.00 0.00 C ATOM 584 O GLU A 248 -1.154 -10.922 7.217 1.00 0.00 O ATOM 585 CB GLU A 248 0.960 -13.475 7.967 1.00 0.00 C ATOM 586 CG GLU A 248 1.373 -14.916 7.713 1.00 0.00 C ATOM 587 CD GLU A 248 2.852 -15.150 7.947 1.00 0.00 C ATOM 588 OE1 GLU A 248 3.423 -14.496 8.845 1.00 0.00 O ATOM 589 OE2 GLU A 248 3.442 -15.988 7.230 1.00 0.00 O ATOM 0 H GLU A 248 1.199 -10.980 6.578 1.00 0.00 H new ATOM 0 HA GLU A 248 -0.041 -13.609 6.069 1.00 0.00 H new ATOM 0 HB2 GLU A 248 1.847 -12.887 8.202 1.00 0.00 H new ATOM 0 HB3 GLU A 248 0.313 -13.440 8.843 1.00 0.00 H new ATOM 0 HG2 GLU A 248 0.798 -15.575 8.364 1.00 0.00 H new ATOM 0 HG3 GLU A 248 1.125 -15.185 6.686 1.00 0.00 H new ATOM 596 N PRO A 249 -2.043 -12.933 7.711 1.00 0.00 N ATOM 597 CA PRO A 249 -3.320 -12.391 8.189 1.00 0.00 C ATOM 598 C PRO A 249 -3.163 -11.572 9.467 1.00 0.00 C ATOM 599 O PRO A 249 -3.642 -11.961 10.532 1.00 0.00 O ATOM 600 CB PRO A 249 -4.169 -13.639 8.452 1.00 0.00 C ATOM 601 CG PRO A 249 -3.182 -14.734 8.665 1.00 0.00 C ATOM 602 CD PRO A 249 -2.006 -14.406 7.790 1.00 0.00 C ATOM 0 HA PRO A 249 -3.763 -11.706 7.466 1.00 0.00 H new ATOM 0 HB2 PRO A 249 -4.807 -13.506 9.326 1.00 0.00 H new ATOM 0 HB3 PRO A 249 -4.825 -13.856 7.609 1.00 0.00 H new ATOM 0 HG2 PRO A 249 -2.885 -14.794 9.712 1.00 0.00 H new ATOM 0 HG3 PRO A 249 -3.609 -15.701 8.399 1.00 0.00 H new ATOM 0 HD2 PRO A 249 -1.071 -14.762 8.222 1.00 0.00 H new ATOM 0 HD3 PRO A 249 -2.097 -14.864 6.805 1.00 0.00 H new ATOM 610 N LEU A 250 -2.489 -10.433 9.348 1.00 0.00 N ATOM 611 CA LEU A 250 -2.265 -9.551 10.486 1.00 0.00 C ATOM 612 C LEU A 250 -2.733 -8.133 10.177 1.00 0.00 C ATOM 613 O LEU A 250 -2.218 -7.164 10.732 1.00 0.00 O ATOM 614 CB LEU A 250 -0.782 -9.540 10.862 1.00 0.00 C ATOM 615 CG LEU A 250 0.187 -9.552 9.676 1.00 0.00 C ATOM 616 CD1 LEU A 250 1.263 -8.493 9.846 1.00 0.00 C ATOM 617 CD2 LEU A 250 0.814 -10.928 9.514 1.00 0.00 C ATOM 0 H LEU A 250 -2.088 -10.099 8.472 1.00 0.00 H new ATOM 0 HA LEU A 250 -2.845 -9.929 11.328 1.00 0.00 H new ATOM 0 HB2 LEU A 250 -0.582 -8.655 11.466 1.00 0.00 H new ATOM 0 HB3 LEU A 250 -0.575 -10.407 11.489 1.00 0.00 H new ATOM 0 HG LEU A 250 -0.378 -9.320 8.773 1.00 0.00 H new ATOM 0 HD11 LEU A 250 1.939 -8.521 8.992 1.00 0.00 H new ATOM 0 HD12 LEU A 250 0.798 -7.509 9.909 1.00 0.00 H new ATOM 0 HD13 LEU A 250 1.825 -8.688 10.760 1.00 0.00 H new ATOM 0 HD21 LEU A 250 1.500 -10.918 8.667 1.00 0.00 H new ATOM 0 HD22 LEU A 250 1.361 -11.188 10.420 1.00 0.00 H new ATOM 0 HD23 LEU A 250 0.031 -11.666 9.339 1.00 0.00 H new ATOM 629 N GLY A 251 -3.712 -8.019 9.284 1.00 0.00 N ATOM 630 CA GLY A 251 -4.231 -6.714 8.914 1.00 0.00 C ATOM 631 C GLY A 251 -5.634 -6.477 9.434 1.00 0.00 C ATOM 632 O GLY A 251 -6.075 -7.138 10.374 1.00 0.00 O ATOM 0 H GLY A 251 -4.155 -8.806 8.810 1.00 0.00 H new ATOM 0 HA2 GLY A 251 -3.568 -5.940 9.301 1.00 0.00 H new ATOM 0 HA3 GLY A 251 -4.229 -6.621 7.828 1.00 0.00 H new ATOM 636 N LYS A 252 -6.335 -5.527 8.824 1.00 0.00 N ATOM 637 CA LYS A 252 -7.696 -5.201 9.235 1.00 0.00 C ATOM 638 C LYS A 252 -8.663 -5.268 8.055 1.00 0.00 C ATOM 639 O LYS A 252 -9.786 -5.753 8.188 1.00 0.00 O ATOM 640 CB LYS A 252 -7.742 -3.807 9.865 1.00 0.00 C ATOM 641 CG LYS A 252 -6.600 -3.537 10.832 1.00 0.00 C ATOM 642 CD LYS A 252 -6.874 -4.144 12.199 1.00 0.00 C ATOM 643 CE LYS A 252 -5.625 -4.152 13.067 1.00 0.00 C ATOM 644 NZ LYS A 252 -5.914 -3.723 14.462 1.00 0.00 N ATOM 0 H LYS A 252 -5.984 -4.970 8.045 1.00 0.00 H new ATOM 0 HA LYS A 252 -8.006 -5.940 9.974 1.00 0.00 H new ATOM 0 HB2 LYS A 252 -7.720 -3.059 9.073 1.00 0.00 H new ATOM 0 HB3 LYS A 252 -8.689 -3.687 10.392 1.00 0.00 H new ATOM 0 HG2 LYS A 252 -5.675 -3.949 10.429 1.00 0.00 H new ATOM 0 HG3 LYS A 252 -6.453 -2.462 10.933 1.00 0.00 H new ATOM 0 HD2 LYS A 252 -7.661 -3.579 12.698 1.00 0.00 H new ATOM 0 HD3 LYS A 252 -7.241 -5.163 12.079 1.00 0.00 H new ATOM 0 HE2 LYS A 252 -5.197 -5.154 13.077 1.00 0.00 H new ATOM 0 HE3 LYS A 252 -4.876 -3.490 12.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 252 -5.037 -3.742 15.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 252 -6.299 -2.757 14.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 252 -6.609 -4.369 14.887 1.00 0.00 H new ATOM 658 N ASN A 253 -8.222 -4.773 6.902 1.00 0.00 N ATOM 659 CA ASN A 253 -9.054 -4.774 5.702 1.00 0.00 C ATOM 660 C ASN A 253 -8.438 -5.639 4.605 1.00 0.00 C ATOM 661 O ASN A 253 -7.312 -6.117 4.734 1.00 0.00 O ATOM 662 CB ASN A 253 -9.253 -3.345 5.192 1.00 0.00 C ATOM 663 CG ASN A 253 -7.958 -2.714 4.717 1.00 0.00 C ATOM 664 OD1 ASN A 253 -7.715 -2.597 3.516 1.00 0.00 O ATOM 665 ND2 ASN A 253 -7.120 -2.302 5.659 1.00 0.00 N ATOM 0 H ASN A 253 -7.295 -4.367 6.773 1.00 0.00 H new ATOM 0 HA ASN A 253 -10.023 -5.197 5.966 1.00 0.00 H new ATOM 0 HB2 ASN A 253 -9.972 -3.351 4.373 1.00 0.00 H new ATOM 0 HB3 ASN A 253 -9.681 -2.735 5.987 1.00 0.00 H new ATOM 0 HD21 ASN A 253 -6.234 -1.868 5.399 1.00 0.00 H new ATOM 0 HD22 ASN A 253 -7.362 -2.419 6.643 1.00 0.00 H new ATOM 672 N ASP A 254 -9.190 -5.833 3.526 1.00 0.00 N ATOM 673 CA ASP A 254 -8.726 -6.639 2.402 1.00 0.00 C ATOM 674 C ASP A 254 -8.259 -5.755 1.248 1.00 0.00 C ATOM 675 O ASP A 254 -8.276 -6.170 0.090 1.00 0.00 O ATOM 676 CB ASP A 254 -9.839 -7.572 1.924 1.00 0.00 C ATOM 677 CG ASP A 254 -11.107 -6.823 1.565 1.00 0.00 C ATOM 678 OD1 ASP A 254 -11.860 -6.451 2.490 1.00 0.00 O ATOM 679 OD2 ASP A 254 -11.348 -6.608 0.358 1.00 0.00 O ATOM 0 H ASP A 254 -10.125 -5.442 3.406 1.00 0.00 H new ATOM 0 HA ASP A 254 -7.879 -7.235 2.743 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -9.492 -8.131 1.055 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -10.059 -8.300 2.705 1.00 0.00 H new ATOM 684 N GLY A 255 -7.839 -4.534 1.571 1.00 0.00 N ATOM 685 CA GLY A 255 -7.372 -3.616 0.548 1.00 0.00 C ATOM 686 C GLY A 255 -8.383 -2.528 0.230 1.00 0.00 C ATOM 687 O GLY A 255 -8.272 -1.852 -0.793 1.00 0.00 O ATOM 0 H GLY A 255 -7.814 -4.165 2.522 1.00 0.00 H new ATOM 0 HA2 GLY A 255 -6.440 -3.156 0.877 1.00 0.00 H new ATOM 0 HA3 GLY A 255 -7.148 -4.175 -0.361 1.00 0.00 H new ATOM 691 N ALA A 256 -9.367 -2.356 1.107 1.00 0.00 N ATOM 692 CA ALA A 256 -10.394 -1.342 0.909 1.00 0.00 C ATOM 693 C ALA A 256 -10.691 -0.597 2.206 1.00 0.00 C ATOM 694 O ALA A 256 -10.408 -1.093 3.297 1.00 0.00 O ATOM 695 CB ALA A 256 -11.663 -1.975 0.357 1.00 0.00 C ATOM 0 H ALA A 256 -9.474 -2.905 1.960 1.00 0.00 H new ATOM 0 HA ALA A 256 -10.018 -0.619 0.185 1.00 0.00 H new ATOM 0 HB1 ALA A 256 -12.421 -1.205 0.214 1.00 0.00 H new ATOM 0 HB2 ALA A 256 -11.446 -2.452 -0.599 1.00 0.00 H new ATOM 0 HB3 ALA A 256 -12.032 -2.722 1.060 1.00 0.00 H new ATOM 701 N VAL A 257 -11.260 0.597 2.080 1.00 0.00 N ATOM 702 CA VAL A 257 -11.592 1.411 3.242 1.00 0.00 C ATOM 703 C VAL A 257 -12.877 2.200 3.009 1.00 0.00 C ATOM 704 O VAL A 257 -12.954 3.027 2.098 1.00 0.00 O ATOM 705 CB VAL A 257 -10.449 2.390 3.582 1.00 0.00 C ATOM 706 CG1 VAL A 257 -10.805 3.241 4.791 1.00 0.00 C ATOM 707 CG2 VAL A 257 -9.152 1.632 3.821 1.00 0.00 C ATOM 0 H VAL A 257 -11.501 1.022 1.185 1.00 0.00 H new ATOM 0 HA VAL A 257 -11.737 0.730 4.080 1.00 0.00 H new ATOM 0 HB VAL A 257 -10.307 3.056 2.731 1.00 0.00 H new ATOM 0 HG11 VAL A 257 -9.983 3.923 5.011 1.00 0.00 H new ATOM 0 HG12 VAL A 257 -11.707 3.816 4.579 1.00 0.00 H new ATOM 0 HG13 VAL A 257 -10.980 2.595 5.651 1.00 0.00 H new ATOM 0 HG21 VAL A 257 -8.357 2.338 4.060 1.00 0.00 H new ATOM 0 HG22 VAL A 257 -9.283 0.939 4.652 1.00 0.00 H new ATOM 0 HG23 VAL A 257 -8.885 1.075 2.923 1.00 0.00 H new ATOM 717 N ALA A 258 -13.885 1.941 3.837 1.00 0.00 N ATOM 718 CA ALA A 258 -15.166 2.626 3.722 1.00 0.00 C ATOM 719 C ALA A 258 -15.787 2.410 2.346 1.00 0.00 C ATOM 720 O ALA A 258 -16.537 3.254 1.853 1.00 0.00 O ATOM 721 CB ALA A 258 -14.997 4.112 3.998 1.00 0.00 C ATOM 0 H ALA A 258 -13.838 1.261 4.595 1.00 0.00 H new ATOM 0 HA ALA A 258 -15.841 2.203 4.466 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -15.962 4.611 3.908 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -14.608 4.253 5.006 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -14.300 4.539 3.277 1.00 0.00 H new ATOM 727 N GLY A 259 -15.469 1.276 1.729 1.00 0.00 N ATOM 728 CA GLY A 259 -16.003 0.973 0.414 1.00 0.00 C ATOM 729 C GLY A 259 -15.112 1.472 -0.709 1.00 0.00 C ATOM 730 O GLY A 259 -15.520 1.489 -1.870 1.00 0.00 O ATOM 0 H GLY A 259 -14.852 0.562 2.116 1.00 0.00 H new ATOM 0 HA2 GLY A 259 -16.132 -0.105 0.318 1.00 0.00 H new ATOM 0 HA3 GLY A 259 -16.991 1.422 0.315 1.00 0.00 H new ATOM 734 N THR A 260 -13.893 1.876 -0.365 1.00 0.00 N ATOM 735 CA THR A 260 -12.946 2.374 -1.357 1.00 0.00 C ATOM 736 C THR A 260 -11.712 1.480 -1.425 1.00 0.00 C ATOM 737 O THR A 260 -10.939 1.400 -0.470 1.00 0.00 O ATOM 738 CB THR A 260 -12.533 3.809 -1.024 1.00 0.00 C ATOM 739 OG1 THR A 260 -13.671 4.610 -0.761 1.00 0.00 O ATOM 740 CG2 THR A 260 -11.746 4.478 -2.130 1.00 0.00 C ATOM 0 H THR A 260 -13.538 1.868 0.591 1.00 0.00 H new ATOM 0 HA THR A 260 -13.437 2.362 -2.330 1.00 0.00 H new ATOM 0 HB THR A 260 -11.895 3.729 -0.144 1.00 0.00 H new ATOM 0 HG1 THR A 260 -13.386 5.523 -0.548 1.00 0.00 H new ATOM 0 HG21 THR A 260 -11.485 5.493 -1.829 1.00 0.00 H new ATOM 0 HG22 THR A 260 -10.835 3.911 -2.323 1.00 0.00 H new ATOM 0 HG23 THR A 260 -12.350 4.513 -3.037 1.00 0.00 H new ATOM 748 N ARG A 261 -11.533 0.812 -2.558 1.00 0.00 N ATOM 749 CA ARG A 261 -10.390 -0.075 -2.748 1.00 0.00 C ATOM 750 C ARG A 261 -9.207 0.685 -3.336 1.00 0.00 C ATOM 751 O ARG A 261 -9.237 1.103 -4.493 1.00 0.00 O ATOM 752 CB ARG A 261 -10.770 -1.242 -3.662 1.00 0.00 C ATOM 753 CG ARG A 261 -9.641 -2.237 -3.876 1.00 0.00 C ATOM 754 CD ARG A 261 -10.094 -3.423 -4.715 1.00 0.00 C ATOM 755 NE ARG A 261 -11.392 -3.940 -4.283 1.00 0.00 N ATOM 756 CZ ARG A 261 -12.561 -3.493 -4.738 1.00 0.00 C ATOM 757 NH1 ARG A 261 -12.605 -2.516 -5.636 1.00 0.00 N ATOM 758 NH2 ARG A 261 -13.692 -4.023 -4.292 1.00 0.00 N ATOM 0 H ARG A 261 -12.163 0.867 -3.358 1.00 0.00 H new ATOM 0 HA ARG A 261 -10.098 -0.468 -1.774 1.00 0.00 H new ATOM 0 HB2 ARG A 261 -11.627 -1.763 -3.235 1.00 0.00 H new ATOM 0 HB3 ARG A 261 -11.085 -0.849 -4.628 1.00 0.00 H new ATOM 0 HG2 ARG A 261 -8.805 -1.740 -4.368 1.00 0.00 H new ATOM 0 HG3 ARG A 261 -9.278 -2.590 -2.911 1.00 0.00 H new ATOM 0 HD2 ARG A 261 -10.154 -3.124 -5.762 1.00 0.00 H new ATOM 0 HD3 ARG A 261 -9.349 -4.216 -4.652 1.00 0.00 H new ATOM 0 HE ARG A 261 -11.403 -4.689 -3.591 1.00 0.00 H new ATOM 0 HH11 ARG A 261 -11.739 -2.102 -5.982 1.00 0.00 H new ATOM 0 HH12 ARG A 261 -13.504 -2.179 -5.980 1.00 0.00 H new ATOM 0 HH21 ARG A 261 -13.666 -4.773 -3.601 1.00 0.00 H new ATOM 0 HH22 ARG A 261 -14.588 -3.681 -4.640 1.00 0.00 H new ATOM 772 N TYR A 262 -8.166 0.864 -2.528 1.00 0.00 N ATOM 773 CA TYR A 262 -6.972 1.575 -2.967 1.00 0.00 C ATOM 774 C TYR A 262 -6.018 0.638 -3.701 1.00 0.00 C ATOM 775 O TYR A 262 -5.327 1.046 -4.634 1.00 0.00 O ATOM 776 CB TYR A 262 -6.264 2.210 -1.770 1.00 0.00 C ATOM 777 CG TYR A 262 -7.052 3.326 -1.120 1.00 0.00 C ATOM 778 CD1 TYR A 262 -8.126 3.048 -0.283 1.00 0.00 C ATOM 779 CD2 TYR A 262 -6.725 4.656 -1.346 1.00 0.00 C ATOM 780 CE1 TYR A 262 -8.850 4.064 0.311 1.00 0.00 C ATOM 781 CE2 TYR A 262 -7.443 5.678 -0.756 1.00 0.00 C ATOM 782 CZ TYR A 262 -8.504 5.378 0.071 1.00 0.00 C ATOM 783 OH TYR A 262 -9.222 6.393 0.661 1.00 0.00 O ATOM 0 H TYR A 262 -8.126 0.526 -1.566 1.00 0.00 H new ATOM 0 HA TYR A 262 -7.280 2.361 -3.657 1.00 0.00 H new ATOM 0 HB2 TYR A 262 -6.063 1.438 -1.027 1.00 0.00 H new ATOM 0 HB3 TYR A 262 -5.299 2.600 -2.094 1.00 0.00 H new ATOM 0 HD1 TYR A 262 -8.399 2.020 -0.094 1.00 0.00 H new ATOM 0 HD2 TYR A 262 -5.895 4.896 -1.994 1.00 0.00 H new ATOM 0 HE1 TYR A 262 -9.682 3.831 0.959 1.00 0.00 H new ATOM 0 HE2 TYR A 262 -7.174 6.707 -0.942 1.00 0.00 H new ATOM 0 HH TYR A 262 -8.810 7.255 0.442 1.00 0.00 H new ATOM 793 N PHE A 263 -5.989 -0.619 -3.273 1.00 0.00 N ATOM 794 CA PHE A 263 -5.123 -1.617 -3.888 1.00 0.00 C ATOM 795 C PHE A 263 -5.703 -3.018 -3.717 1.00 0.00 C ATOM 796 O PHE A 263 -6.696 -3.207 -3.016 1.00 0.00 O ATOM 797 CB PHE A 263 -3.720 -1.551 -3.281 1.00 0.00 C ATOM 798 CG PHE A 263 -3.715 -1.437 -1.784 1.00 0.00 C ATOM 799 CD1 PHE A 263 -3.939 -0.213 -1.171 1.00 0.00 C ATOM 800 CD2 PHE A 263 -3.486 -2.548 -0.990 1.00 0.00 C ATOM 801 CE1 PHE A 263 -3.933 -0.101 0.205 1.00 0.00 C ATOM 802 CE2 PHE A 263 -3.480 -2.442 0.389 1.00 0.00 C ATOM 803 CZ PHE A 263 -3.704 -1.216 0.986 1.00 0.00 C ATOM 0 H PHE A 263 -6.556 -0.971 -2.502 1.00 0.00 H new ATOM 0 HA PHE A 263 -5.057 -1.399 -4.954 1.00 0.00 H new ATOM 0 HB2 PHE A 263 -3.166 -2.444 -3.570 1.00 0.00 H new ATOM 0 HB3 PHE A 263 -3.191 -0.697 -3.703 1.00 0.00 H new ATOM 0 HD1 PHE A 263 -4.120 0.662 -1.777 1.00 0.00 H new ATOM 0 HD2 PHE A 263 -3.310 -3.508 -1.453 1.00 0.00 H new ATOM 0 HE1 PHE A 263 -4.107 0.858 0.670 1.00 0.00 H new ATOM 0 HE2 PHE A 263 -3.301 -3.316 0.998 1.00 0.00 H new ATOM 0 HZ PHE A 263 -3.700 -1.130 2.063 1.00 0.00 H new ATOM 813 N GLN A 264 -5.078 -3.995 -4.364 1.00 0.00 N ATOM 814 CA GLN A 264 -5.536 -5.378 -4.284 1.00 0.00 C ATOM 815 C GLN A 264 -4.625 -6.202 -3.381 1.00 0.00 C ATOM 816 O GLN A 264 -3.407 -6.222 -3.562 1.00 0.00 O ATOM 817 CB GLN A 264 -5.590 -6.001 -5.679 1.00 0.00 C ATOM 818 CG GLN A 264 -6.482 -7.228 -5.764 1.00 0.00 C ATOM 819 CD GLN A 264 -7.916 -6.935 -5.365 1.00 0.00 C ATOM 820 OE1 GLN A 264 -8.601 -6.138 -6.009 1.00 0.00 O ATOM 821 NE2 GLN A 264 -8.377 -7.578 -4.298 1.00 0.00 N ATOM 0 H GLN A 264 -4.254 -3.856 -4.949 1.00 0.00 H new ATOM 0 HA GLN A 264 -6.538 -5.378 -3.855 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -5.946 -5.254 -6.388 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -4.580 -6.275 -5.985 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -6.464 -7.616 -6.782 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -6.081 -8.009 -5.118 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -7.774 -8.229 -3.795 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -9.334 -7.421 -3.982 1.00 0.00 H new ATOM 830 N CYS A 265 -5.223 -6.881 -2.408 1.00 0.00 N ATOM 831 CA CYS A 265 -4.467 -7.708 -1.477 1.00 0.00 C ATOM 832 C CYS A 265 -5.337 -8.824 -0.908 1.00 0.00 C ATOM 833 O CYS A 265 -6.564 -8.760 -0.966 1.00 0.00 O ATOM 834 CB CYS A 265 -3.907 -6.852 -0.340 1.00 0.00 C ATOM 835 SG CYS A 265 -5.159 -5.904 0.556 1.00 0.00 S ATOM 0 H CYS A 265 -6.230 -6.874 -2.244 1.00 0.00 H new ATOM 0 HA CYS A 265 -3.639 -8.161 -2.023 1.00 0.00 H new ATOM 0 HB2 CYS A 265 -3.384 -7.499 0.364 1.00 0.00 H new ATOM 0 HB3 CYS A 265 -3.168 -6.163 -0.749 1.00 0.00 H new ATOM 0 HG CYS A 265 -4.781 -4.663 0.646 1.00 0.00 H new ATOM 841 N GLN A 266 -4.690 -9.847 -0.356 1.00 0.00 N ATOM 842 CA GLN A 266 -5.402 -10.978 0.225 1.00 0.00 C ATOM 843 C GLN A 266 -6.296 -10.523 1.376 1.00 0.00 C ATOM 844 O GLN A 266 -6.157 -9.409 1.878 1.00 0.00 O ATOM 845 CB GLN A 266 -4.404 -12.027 0.723 1.00 0.00 C ATOM 846 CG GLN A 266 -4.037 -13.066 -0.324 1.00 0.00 C ATOM 847 CD GLN A 266 -5.250 -13.764 -0.905 1.00 0.00 C ATOM 848 OE1 GLN A 266 -5.728 -14.759 -0.360 1.00 0.00 O ATOM 849 NE2 GLN A 266 -5.757 -13.244 -2.017 1.00 0.00 N ATOM 0 H GLN A 266 -3.674 -9.915 -0.300 1.00 0.00 H new ATOM 0 HA GLN A 266 -6.032 -11.420 -0.547 1.00 0.00 H new ATOM 0 HB2 GLN A 266 -3.497 -11.523 1.056 1.00 0.00 H new ATOM 0 HB3 GLN A 266 -4.825 -12.533 1.592 1.00 0.00 H new ATOM 0 HG2 GLN A 266 -3.480 -12.585 -1.128 1.00 0.00 H new ATOM 0 HG3 GLN A 266 -3.375 -13.808 0.123 1.00 0.00 H new ATOM 0 HE21 GLN A 266 -5.329 -12.418 -2.435 1.00 0.00 H new ATOM 0 HE22 GLN A 266 -6.575 -13.671 -2.453 1.00 0.00 H new ATOM 858 N PRO A 267 -7.235 -11.383 1.812 1.00 0.00 N ATOM 859 CA PRO A 267 -8.148 -11.056 2.911 1.00 0.00 C ATOM 860 C PRO A 267 -7.414 -10.889 4.237 1.00 0.00 C ATOM 861 O PRO A 267 -6.558 -11.701 4.590 1.00 0.00 O ATOM 862 CB PRO A 267 -9.094 -12.261 2.969 1.00 0.00 C ATOM 863 CG PRO A 267 -8.336 -13.372 2.327 1.00 0.00 C ATOM 864 CD PRO A 267 -7.479 -12.733 1.274 1.00 0.00 C ATOM 0 HA PRO A 267 -8.661 -10.109 2.745 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -9.360 -12.506 3.997 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -10.025 -12.059 2.439 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -7.726 -13.902 3.058 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -9.014 -14.104 1.887 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -6.549 -13.281 1.125 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -7.986 -12.697 0.310 1.00 0.00 H new ATOM 872 N LYS A 268 -7.750 -9.829 4.966 1.00 0.00 N ATOM 873 CA LYS A 268 -7.120 -9.553 6.252 1.00 0.00 C ATOM 874 C LYS A 268 -5.617 -9.334 6.092 1.00 0.00 C ATOM 875 O LYS A 268 -4.853 -9.498 7.045 1.00 0.00 O ATOM 876 CB LYS A 268 -7.380 -10.702 7.229 1.00 0.00 C ATOM 877 CG LYS A 268 -8.839 -10.836 7.637 1.00 0.00 C ATOM 878 CD LYS A 268 -9.042 -10.501 9.106 1.00 0.00 C ATOM 879 CE LYS A 268 -10.112 -11.379 9.736 1.00 0.00 C ATOM 880 NZ LYS A 268 -11.368 -11.387 8.937 1.00 0.00 N ATOM 0 H LYS A 268 -8.455 -9.147 4.688 1.00 0.00 H new ATOM 0 HA LYS A 268 -7.559 -8.639 6.652 1.00 0.00 H new ATOM 0 HB2 LYS A 268 -7.051 -11.636 6.774 1.00 0.00 H new ATOM 0 HB3 LYS A 268 -6.774 -10.552 8.122 1.00 0.00 H new ATOM 0 HG2 LYS A 268 -9.451 -10.174 7.024 1.00 0.00 H new ATOM 0 HG3 LYS A 268 -9.179 -11.854 7.445 1.00 0.00 H new ATOM 0 HD2 LYS A 268 -8.102 -10.630 9.643 1.00 0.00 H new ATOM 0 HD3 LYS A 268 -9.325 -9.453 9.205 1.00 0.00 H new ATOM 0 HE2 LYS A 268 -9.736 -12.398 9.830 1.00 0.00 H new ATOM 0 HE3 LYS A 268 -10.326 -11.023 10.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 -12.146 -11.762 9.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 -11.595 -10.417 8.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 -11.242 -11.988 8.098 1.00 0.00 H new ATOM 894 N TYR A 269 -5.197 -8.962 4.886 1.00 0.00 N ATOM 895 CA TYR A 269 -3.786 -8.720 4.607 1.00 0.00 C ATOM 896 C TYR A 269 -3.523 -7.238 4.345 1.00 0.00 C ATOM 897 O TYR A 269 -2.387 -6.776 4.437 1.00 0.00 O ATOM 898 CB TYR A 269 -3.334 -9.541 3.396 1.00 0.00 C ATOM 899 CG TYR A 269 -2.834 -10.928 3.738 1.00 0.00 C ATOM 900 CD1 TYR A 269 -3.439 -11.683 4.736 1.00 0.00 C ATOM 901 CD2 TYR A 269 -1.761 -11.484 3.054 1.00 0.00 C ATOM 902 CE1 TYR A 269 -2.987 -12.952 5.042 1.00 0.00 C ATOM 903 CE2 TYR A 269 -1.303 -12.751 3.355 1.00 0.00 C ATOM 904 CZ TYR A 269 -1.917 -13.482 4.350 1.00 0.00 C ATOM 905 OH TYR A 269 -1.465 -14.747 4.651 1.00 0.00 O ATOM 0 H TYR A 269 -5.815 -8.822 4.086 1.00 0.00 H new ATOM 0 HA TYR A 269 -3.217 -9.025 5.485 1.00 0.00 H new ATOM 0 HB2 TYR A 269 -4.168 -9.629 2.699 1.00 0.00 H new ATOM 0 HB3 TYR A 269 -2.542 -8.999 2.879 1.00 0.00 H new ATOM 0 HD1 TYR A 269 -4.276 -11.271 5.281 1.00 0.00 H new ATOM 0 HD2 TYR A 269 -1.277 -10.916 2.274 1.00 0.00 H new ATOM 0 HE1 TYR A 269 -3.469 -13.527 5.819 1.00 0.00 H new ATOM 0 HE2 TYR A 269 -0.467 -13.168 2.813 1.00 0.00 H new ATOM 0 HH TYR A 269 -0.707 -14.970 4.072 1.00 0.00 H new ATOM 915 N GLY A 270 -4.577 -6.496 4.014 1.00 0.00 N ATOM 916 CA GLY A 270 -4.427 -5.078 3.740 1.00 0.00 C ATOM 917 C GLY A 270 -4.344 -4.240 5.001 1.00 0.00 C ATOM 918 O GLY A 270 -5.156 -4.398 5.914 1.00 0.00 O ATOM 0 H GLY A 270 -5.530 -6.851 3.931 1.00 0.00 H new ATOM 0 HA2 GLY A 270 -3.527 -4.921 3.145 1.00 0.00 H new ATOM 0 HA3 GLY A 270 -5.270 -4.738 3.138 1.00 0.00 H new ATOM 922 N LEU A 271 -3.364 -3.345 5.048 1.00 0.00 N ATOM 923 CA LEU A 271 -3.175 -2.476 6.202 1.00 0.00 C ATOM 924 C LEU A 271 -2.867 -1.048 5.757 1.00 0.00 C ATOM 925 O LEU A 271 -1.988 -0.822 4.926 1.00 0.00 O ATOM 926 CB LEU A 271 -2.046 -3.003 7.090 1.00 0.00 C ATOM 927 CG LEU A 271 -2.159 -2.637 8.571 1.00 0.00 C ATOM 928 CD1 LEU A 271 -3.407 -3.259 9.183 1.00 0.00 C ATOM 929 CD2 LEU A 271 -0.915 -3.080 9.327 1.00 0.00 C ATOM 0 H LEU A 271 -2.687 -3.202 4.298 1.00 0.00 H new ATOM 0 HA LEU A 271 -4.101 -2.469 6.777 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -2.012 -4.089 7.002 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -1.098 -2.623 6.709 1.00 0.00 H new ATOM 0 HG LEU A 271 -2.242 -1.553 8.651 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -3.470 -2.987 10.237 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -4.290 -2.892 8.660 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -3.356 -4.344 9.091 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -1.013 -2.811 10.379 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.800 -4.160 9.238 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -0.039 -2.586 8.907 1.00 0.00 H new ATOM 941 N PHE A 272 -3.602 -0.089 6.311 1.00 0.00 N ATOM 942 CA PHE A 272 -3.412 1.316 5.967 1.00 0.00 C ATOM 943 C PHE A 272 -2.714 2.070 7.095 1.00 0.00 C ATOM 944 O PHE A 272 -3.286 2.258 8.166 1.00 0.00 O ATOM 945 CB PHE A 272 -4.763 1.970 5.674 1.00 0.00 C ATOM 946 CG PHE A 272 -5.300 1.666 4.305 1.00 0.00 C ATOM 947 CD1 PHE A 272 -5.456 0.355 3.882 1.00 0.00 C ATOM 948 CD2 PHE A 272 -5.656 2.691 3.443 1.00 0.00 C ATOM 949 CE1 PHE A 272 -5.955 0.074 2.624 1.00 0.00 C ATOM 950 CE2 PHE A 272 -6.154 2.416 2.185 1.00 0.00 C ATOM 951 CZ PHE A 272 -6.304 1.105 1.774 1.00 0.00 C ATOM 0 H PHE A 272 -4.335 -0.259 7.000 1.00 0.00 H new ATOM 0 HA PHE A 272 -2.782 1.363 5.079 1.00 0.00 H new ATOM 0 HB2 PHE A 272 -5.486 1.638 6.419 1.00 0.00 H new ATOM 0 HB3 PHE A 272 -4.665 3.050 5.784 1.00 0.00 H new ATOM 0 HD1 PHE A 272 -5.185 -0.455 4.542 1.00 0.00 H new ATOM 0 HD2 PHE A 272 -5.543 3.717 3.759 1.00 0.00 H new ATOM 0 HE1 PHE A 272 -6.072 -0.951 2.306 1.00 0.00 H new ATOM 0 HE2 PHE A 272 -6.426 3.225 1.523 1.00 0.00 H new ATOM 0 HZ PHE A 272 -6.693 0.887 0.790 1.00 0.00 H new ATOM 961 N ALA A 273 -1.484 2.508 6.846 1.00 0.00 N ATOM 962 CA ALA A 273 -0.724 3.251 7.849 1.00 0.00 C ATOM 963 C ALA A 273 0.075 4.384 7.208 1.00 0.00 C ATOM 964 O ALA A 273 0.493 4.288 6.056 1.00 0.00 O ATOM 965 CB ALA A 273 0.204 2.323 8.620 1.00 0.00 C ATOM 0 H ALA A 273 -0.993 2.363 5.964 1.00 0.00 H new ATOM 0 HA ALA A 273 -1.437 3.689 8.547 1.00 0.00 H new ATOM 0 HB1 ALA A 273 0.760 2.898 9.361 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -0.384 1.555 9.123 1.00 0.00 H new ATOM 0 HB3 ALA A 273 0.902 1.851 7.929 1.00 0.00 H new ATOM 971 N PRO A 274 0.295 5.476 7.958 1.00 0.00 N ATOM 972 CA PRO A 274 1.046 6.638 7.471 1.00 0.00 C ATOM 973 C PRO A 274 2.418 6.262 6.926 1.00 0.00 C ATOM 974 O PRO A 274 2.930 5.177 7.199 1.00 0.00 O ATOM 975 CB PRO A 274 1.206 7.516 8.713 1.00 0.00 C ATOM 976 CG PRO A 274 0.112 7.105 9.634 1.00 0.00 C ATOM 977 CD PRO A 274 -0.176 5.660 9.340 1.00 0.00 C ATOM 0 HA PRO A 274 0.528 7.126 6.645 1.00 0.00 H new ATOM 0 HB2 PRO A 274 2.183 7.370 9.174 1.00 0.00 H new ATOM 0 HB3 PRO A 274 1.129 8.573 8.459 1.00 0.00 H new ATOM 0 HG2 PRO A 274 0.411 7.237 10.674 1.00 0.00 H new ATOM 0 HG3 PRO A 274 -0.776 7.717 9.478 1.00 0.00 H new ATOM 0 HD2 PRO A 274 0.348 5.000 10.031 1.00 0.00 H new ATOM 0 HD3 PRO A 274 -1.239 5.438 9.432 1.00 0.00 H new ATOM 985 N VAL A 275 3.012 7.172 6.164 1.00 0.00 N ATOM 986 CA VAL A 275 4.335 6.942 5.590 1.00 0.00 C ATOM 987 C VAL A 275 5.393 6.916 6.680 1.00 0.00 C ATOM 988 O VAL A 275 6.314 6.100 6.649 1.00 0.00 O ATOM 989 CB VAL A 275 4.736 8.022 4.556 1.00 0.00 C ATOM 990 CG1 VAL A 275 5.455 7.390 3.377 1.00 0.00 C ATOM 991 CG2 VAL A 275 3.531 8.819 4.084 1.00 0.00 C ATOM 0 H VAL A 275 2.601 8.075 5.929 1.00 0.00 H new ATOM 0 HA VAL A 275 4.278 5.979 5.082 1.00 0.00 H new ATOM 0 HB VAL A 275 5.417 8.716 5.049 1.00 0.00 H new ATOM 0 HG11 VAL A 275 5.729 8.164 2.660 1.00 0.00 H new ATOM 0 HG12 VAL A 275 6.355 6.885 3.728 1.00 0.00 H new ATOM 0 HG13 VAL A 275 4.797 6.666 2.895 1.00 0.00 H new ATOM 0 HG21 VAL A 275 3.851 9.568 3.359 1.00 0.00 H new ATOM 0 HG22 VAL A 275 2.810 8.147 3.618 1.00 0.00 H new ATOM 0 HG23 VAL A 275 3.066 9.315 4.936 1.00 0.00 H new ATOM 1001 N HIS A 276 5.261 7.826 7.639 1.00 0.00 N ATOM 1002 CA HIS A 276 6.214 7.916 8.733 1.00 0.00 C ATOM 1003 C HIS A 276 6.161 6.672 9.616 1.00 0.00 C ATOM 1004 O HIS A 276 7.147 6.319 10.263 1.00 0.00 O ATOM 1005 CB HIS A 276 5.956 9.173 9.568 1.00 0.00 C ATOM 1006 CG HIS A 276 4.537 9.328 10.016 1.00 0.00 C ATOM 1007 ND1 HIS A 276 3.694 8.458 10.623 1.00 0.00 N flip ATOM 1008 CD2 HIS A 276 3.825 10.500 9.861 1.00 0.00 C flip ATOM 1009 CE1 HIS A 276 2.505 9.115 10.822 1.00 0.00 C flip ATOM 1010 NE2 HIS A 276 2.610 10.345 10.354 1.00 0.00 N flip ATOM 0 H HIS A 276 4.504 8.509 7.679 1.00 0.00 H new ATOM 0 HA HIS A 276 7.213 7.981 8.301 1.00 0.00 H new ATOM 0 HB2 HIS A 276 6.603 9.152 10.445 1.00 0.00 H new ATOM 0 HB3 HIS A 276 6.239 10.049 8.984 1.00 0.00 H new ATOM 0 HD2 HIS A 276 4.203 11.404 9.407 1.00 0.00 H new ATOM 0 HE1 HIS A 276 1.626 8.694 11.286 1.00 0.00 H new ATOM 0 HE2 HIS A 276 1.877 11.055 10.370 1.00 0.00 H new ATOM 1019 N LYS A 277 5.010 6.006 9.634 1.00 0.00 N ATOM 1020 CA LYS A 277 4.842 4.798 10.435 1.00 0.00 C ATOM 1021 C LYS A 277 5.384 3.580 9.696 1.00 0.00 C ATOM 1022 O LYS A 277 5.673 2.550 10.305 1.00 0.00 O ATOM 1023 CB LYS A 277 3.369 4.580 10.782 1.00 0.00 C ATOM 1024 CG LYS A 277 2.890 5.401 11.968 1.00 0.00 C ATOM 1025 CD LYS A 277 2.315 4.515 13.065 1.00 0.00 C ATOM 1026 CE LYS A 277 3.383 4.082 14.058 1.00 0.00 C ATOM 1027 NZ LYS A 277 4.482 3.324 13.403 1.00 0.00 N ATOM 0 H LYS A 277 4.183 6.281 9.105 1.00 0.00 H new ATOM 0 HA LYS A 277 5.406 4.928 11.359 1.00 0.00 H new ATOM 0 HB2 LYS A 277 2.760 4.826 9.912 1.00 0.00 H new ATOM 0 HB3 LYS A 277 3.208 3.523 10.995 1.00 0.00 H new ATOM 0 HG2 LYS A 277 3.720 5.984 12.367 1.00 0.00 H new ATOM 0 HG3 LYS A 277 2.132 6.111 11.638 1.00 0.00 H new ATOM 0 HD2 LYS A 277 1.526 5.053 13.591 1.00 0.00 H new ATOM 0 HD3 LYS A 277 1.856 3.634 12.617 1.00 0.00 H new ATOM 0 HE2 LYS A 277 3.795 4.961 14.553 1.00 0.00 H new ATOM 0 HE3 LYS A 277 2.928 3.464 14.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 277 4.839 2.597 14.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 277 4.123 2.868 12.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 277 5.253 3.976 13.155 1.00 0.00 H new ATOM 1041 N VAL A 278 5.518 3.701 8.380 1.00 0.00 N ATOM 1042 CA VAL A 278 6.027 2.606 7.567 1.00 0.00 C ATOM 1043 C VAL A 278 7.510 2.775 7.272 1.00 0.00 C ATOM 1044 O VAL A 278 7.984 3.883 7.021 1.00 0.00 O ATOM 1045 CB VAL A 278 5.263 2.479 6.236 1.00 0.00 C ATOM 1046 CG1 VAL A 278 5.672 1.210 5.506 1.00 0.00 C ATOM 1047 CG2 VAL A 278 3.761 2.497 6.475 1.00 0.00 C ATOM 0 H VAL A 278 5.282 4.544 7.856 1.00 0.00 H new ATOM 0 HA VAL A 278 5.877 1.697 8.149 1.00 0.00 H new ATOM 0 HB VAL A 278 5.520 3.334 5.611 1.00 0.00 H new ATOM 0 HG11 VAL A 278 5.122 1.137 4.568 1.00 0.00 H new ATOM 0 HG12 VAL A 278 6.742 1.238 5.298 1.00 0.00 H new ATOM 0 HG13 VAL A 278 5.446 0.344 6.128 1.00 0.00 H new ATOM 0 HG21 VAL A 278 3.240 2.406 5.522 1.00 0.00 H new ATOM 0 HG22 VAL A 278 3.485 1.663 7.120 1.00 0.00 H new ATOM 0 HG23 VAL A 278 3.480 3.435 6.954 1.00 0.00 H new ATOM 1057 N THR A 279 8.237 1.665 7.305 1.00 0.00 N ATOM 1058 CA THR A 279 9.668 1.678 7.043 1.00 0.00 C ATOM 1059 C THR A 279 10.076 0.476 6.198 1.00 0.00 C ATOM 1060 O THR A 279 9.492 -0.601 6.313 1.00 0.00 O ATOM 1061 CB THR A 279 10.443 1.676 8.361 1.00 0.00 C ATOM 1062 OG1 THR A 279 9.614 2.085 9.433 1.00 0.00 O ATOM 1063 CG2 THR A 279 11.653 2.585 8.345 1.00 0.00 C ATOM 0 H THR A 279 7.856 0.742 7.512 1.00 0.00 H new ATOM 0 HA THR A 279 9.906 2.586 6.488 1.00 0.00 H new ATOM 0 HB THR A 279 10.781 0.648 8.494 1.00 0.00 H new ATOM 0 HG1 THR A 279 10.129 2.075 10.267 1.00 0.00 H new ATOM 0 HG21 THR A 279 12.157 2.536 9.310 1.00 0.00 H new ATOM 0 HG22 THR A 279 12.339 2.264 7.561 1.00 0.00 H new ATOM 0 HG23 THR A 279 11.336 3.610 8.153 1.00 0.00 H new ATOM 1071 N LYS A 280 11.079 0.668 5.348 1.00 0.00 N ATOM 1072 CA LYS A 280 11.561 -0.402 4.486 1.00 0.00 C ATOM 1073 C LYS A 280 12.259 -1.486 5.304 1.00 0.00 C ATOM 1074 O LYS A 280 13.131 -1.194 6.123 1.00 0.00 O ATOM 1075 CB LYS A 280 12.517 0.157 3.428 1.00 0.00 C ATOM 1076 CG LYS A 280 12.002 0.010 2.005 1.00 0.00 C ATOM 1077 CD LYS A 280 13.108 -0.405 1.046 1.00 0.00 C ATOM 1078 CE LYS A 280 12.692 -1.592 0.193 1.00 0.00 C ATOM 1079 NZ LYS A 280 13.789 -2.590 0.059 1.00 0.00 N ATOM 0 H LYS A 280 11.573 1.554 5.238 1.00 0.00 H new ATOM 0 HA LYS A 280 10.702 -0.848 3.986 1.00 0.00 H new ATOM 0 HB2 LYS A 280 12.696 1.212 3.634 1.00 0.00 H new ATOM 0 HB3 LYS A 280 13.477 -0.352 3.513 1.00 0.00 H new ATOM 0 HG2 LYS A 280 11.203 -0.731 1.982 1.00 0.00 H new ATOM 0 HG3 LYS A 280 11.570 0.955 1.675 1.00 0.00 H new ATOM 0 HD2 LYS A 280 13.365 0.435 0.401 1.00 0.00 H new ATOM 0 HD3 LYS A 280 14.005 -0.659 1.612 1.00 0.00 H new ATOM 0 HE2 LYS A 280 11.819 -2.070 0.637 1.00 0.00 H new ATOM 0 HE3 LYS A 280 12.396 -1.243 -0.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 13.466 -3.384 -0.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 14.614 -2.141 -0.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 14.054 -2.943 1.001 1.00 0.00 H new ATOM 1093 N ILE A 281 11.873 -2.735 5.073 1.00 0.00 N ATOM 1094 CA ILE A 281 12.463 -3.862 5.785 1.00 0.00 C ATOM 1095 C ILE A 281 13.814 -4.247 5.187 1.00 0.00 C ATOM 1096 O ILE A 281 14.607 -4.944 5.821 1.00 0.00 O ATOM 1097 CB ILE A 281 11.528 -5.089 5.767 1.00 0.00 C ATOM 1098 CG1 ILE A 281 12.132 -6.236 6.581 1.00 0.00 C ATOM 1099 CG2 ILE A 281 11.258 -5.532 4.337 1.00 0.00 C ATOM 1100 CD1 ILE A 281 11.097 -7.151 7.199 1.00 0.00 C ATOM 0 H ILE A 281 11.153 -2.993 4.398 1.00 0.00 H new ATOM 0 HA ILE A 281 12.609 -3.544 6.817 1.00 0.00 H new ATOM 0 HB ILE A 281 10.580 -4.806 6.224 1.00 0.00 H new ATOM 0 HG12 ILE A 281 12.785 -6.824 5.936 1.00 0.00 H new ATOM 0 HG13 ILE A 281 12.756 -5.820 7.372 1.00 0.00 H new ATOM 0 HG21 ILE A 281 10.597 -6.399 4.343 1.00 0.00 H new ATOM 0 HG22 ILE A 281 10.785 -4.718 3.787 1.00 0.00 H new ATOM 0 HG23 ILE A 281 12.199 -5.797 3.854 1.00 0.00 H new ATOM 0 HD11 ILE A 281 11.598 -7.940 7.761 1.00 0.00 H new ATOM 0 HD12 ILE A 281 10.458 -6.577 7.870 1.00 0.00 H new ATOM 0 HD13 ILE A 281 10.489 -7.596 6.412 1.00 0.00 H new ATOM 1198 N GLU B 449 -2.091 3.944 14.634 1.00 0.00 N ATOM 1199 CA GLU B 449 -2.180 4.839 13.485 1.00 0.00 C ATOM 1200 C GLU B 449 -2.320 4.054 12.189 1.00 0.00 C ATOM 1201 O GLU B 449 -1.893 4.512 11.134 1.00 0.00 O ATOM 1202 CB GLU B 449 -0.939 5.730 13.395 1.00 0.00 C ATOM 1203 CG GLU B 449 -0.368 6.131 14.747 1.00 0.00 C ATOM 1204 CD GLU B 449 0.432 7.417 14.682 1.00 0.00 C ATOM 1205 OE1 GLU B 449 -0.179 8.488 14.483 1.00 0.00 O ATOM 1206 OE2 GLU B 449 1.671 7.355 14.830 1.00 0.00 O ATOM 0 HA GLU B 449 -3.065 5.460 13.625 1.00 0.00 H new ATOM 0 HB2 GLU B 449 -0.169 5.208 12.827 1.00 0.00 H new ATOM 0 HB3 GLU B 449 -1.191 6.631 12.836 1.00 0.00 H new ATOM 0 HG2 GLU B 449 -1.183 6.250 15.461 1.00 0.00 H new ATOM 0 HG3 GLU B 449 0.269 5.329 15.121 1.00 0.00 H new ATOM 1213 N GLU B 450 -2.913 2.871 12.265 1.00 0.00 N ATOM 1214 CA GLU B 450 -3.088 2.048 11.076 1.00 0.00 C ATOM 1215 C GLU B 450 -4.440 1.342 11.084 1.00 0.00 C ATOM 1216 O GLU B 450 -5.006 1.067 12.142 1.00 0.00 O ATOM 1217 CB GLU B 450 -1.947 1.033 10.961 1.00 0.00 C ATOM 1218 CG GLU B 450 -2.026 -0.106 11.968 1.00 0.00 C ATOM 1219 CD GLU B 450 -1.622 0.323 13.363 1.00 0.00 C ATOM 1220 OE1 GLU B 450 -0.418 0.570 13.584 1.00 0.00 O ATOM 1221 OE2 GLU B 450 -2.510 0.412 14.238 1.00 0.00 O ATOM 0 H GLU B 450 -3.277 2.463 13.126 1.00 0.00 H new ATOM 0 HA GLU B 450 -3.063 2.702 10.205 1.00 0.00 H new ATOM 0 HB2 GLU B 450 -1.947 0.615 9.954 1.00 0.00 H new ATOM 0 HB3 GLU B 450 -0.998 1.553 11.090 1.00 0.00 H new ATOM 0 HG2 GLU B 450 -3.044 -0.495 11.992 1.00 0.00 H new ATOM 0 HG3 GLU B 450 -1.380 -0.921 11.641 1.00 0.00 H new ATOM 1228 N TYR B 451 -4.952 1.053 9.891 1.00 0.00 N ATOM 1229 CA TYR B 451 -6.239 0.384 9.748 1.00 0.00 C ATOM 1230 C TYR B 451 -6.167 -0.714 8.693 1.00 0.00 C ATOM 1231 O TYR B 451 -5.045 -1.181 8.399 1.00 0.00 O ATOM 1232 CB TYR B 451 -7.320 1.396 9.371 1.00 0.00 C ATOM 1233 CG TYR B 451 -7.847 2.187 10.547 1.00 0.00 C ATOM 1234 CD1 TYR B 451 -7.168 3.305 11.018 1.00 0.00 C ATOM 1235 CD2 TYR B 451 -9.022 1.816 11.189 1.00 0.00 C ATOM 1236 CE1 TYR B 451 -7.644 4.030 12.092 1.00 0.00 C ATOM 1237 CE2 TYR B 451 -9.505 2.537 12.265 1.00 0.00 C ATOM 1238 CZ TYR B 451 -8.813 3.642 12.713 1.00 0.00 C ATOM 1239 OH TYR B 451 -9.291 4.362 13.783 1.00 0.00 O ATOM 1240 OXT TYR B 451 -7.233 -1.099 8.168 1.00 0.00 O ATOM 0 H TYR B 451 -4.493 1.273 9.007 1.00 0.00 H new ATOM 0 HA TYR B 451 -6.493 -0.072 10.705 1.00 0.00 H new ATOM 0 HB2 TYR B 451 -6.916 2.087 8.631 1.00 0.00 H new ATOM 0 HB3 TYR B 451 -8.149 0.870 8.897 1.00 0.00 H new ATOM 0 HD1 TYR B 451 -6.252 3.612 10.535 1.00 0.00 H new ATOM 0 HD2 TYR B 451 -9.567 0.950 10.842 1.00 0.00 H new ATOM 0 HE1 TYR B 451 -7.104 4.896 12.444 1.00 0.00 H new ATOM 0 HE2 TYR B 451 -10.420 2.236 12.753 1.00 0.00 H new ATOM 0 HH TYR B 451 -10.124 3.957 14.104 1.00 0.00 H new