USER MOD reduce.3.24.130724 H: found=0, std=0, add=536, rem=0, adj=13 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= 0.00199 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 THR OG1 : rot -17:sc= -2.94! USER MOD Single : A 238 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.11) USER MOD Single : A 242 CYS SG : rot 180:sc= -4.46! USER MOD Single : A 252 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 253 ASN : amide:sc= -1.05 K(o=-1,f=-5.2!) USER MOD Single : A 260 THR OG1 : rot -179:sc= 0.899 USER MOD Single : A 262 TYR OH : rot -30:sc= -1.07 USER MOD Single : A 264 GLN : amide:sc= -0.23 X(o=-0.23,f=-0.46) USER MOD Single : A 265 CYS SG : rot 80:sc= -4.48 USER MOD Single : A 266 GLN : amide:sc= -0.503 X(o=-0.5,f=-0.0057) USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 269 TYR OH : rot 180:sc= -1.31 USER MOD Single : A 276 HIS :FLIP no HD1:sc= -3.57 F(o=-4.2!,f=-3.6) USER MOD Single : A 277 LYS NZ :NH3+ 147:sc= -0.499 (180deg=-1.61!) USER MOD Single : A 279 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 LYS NZ :NH3+ 155:sc= -0.0107 (180deg=-0.181) USER MOD Single : B 451 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 80 N ILE A 214 6.015 2.152 -4.268 1.00 0.00 N ATOM 81 CA ILE A 214 5.073 1.051 -4.420 1.00 0.00 C ATOM 82 C ILE A 214 5.781 -0.216 -4.889 1.00 0.00 C ATOM 83 O ILE A 214 6.693 -0.161 -5.714 1.00 0.00 O ATOM 84 CB ILE A 214 3.952 1.402 -5.418 1.00 0.00 C ATOM 85 CG1 ILE A 214 3.303 2.735 -5.038 1.00 0.00 C ATOM 86 CG2 ILE A 214 2.911 0.292 -5.460 1.00 0.00 C ATOM 87 CD1 ILE A 214 2.168 3.138 -5.953 1.00 0.00 C ATOM 0 HA ILE A 214 4.631 0.875 -3.439 1.00 0.00 H new ATOM 0 HB ILE A 214 4.388 1.500 -6.412 1.00 0.00 H new ATOM 0 HG12 ILE A 214 2.929 2.669 -4.016 1.00 0.00 H new ATOM 0 HG13 ILE A 214 4.063 3.516 -5.050 1.00 0.00 H new ATOM 0 HG21 ILE A 214 2.127 0.556 -6.169 1.00 0.00 H new ATOM 0 HG22 ILE A 214 3.384 -0.639 -5.772 1.00 0.00 H new ATOM 0 HG23 ILE A 214 2.476 0.164 -4.469 1.00 0.00 H new ATOM 0 HD11 ILE A 214 1.756 4.092 -5.623 1.00 0.00 H new ATOM 0 HD12 ILE A 214 2.540 3.236 -6.973 1.00 0.00 H new ATOM 0 HD13 ILE A 214 1.389 2.377 -5.923 1.00 0.00 H new ATOM 99 N GLY A 215 5.355 -1.356 -4.356 1.00 0.00 N ATOM 100 CA GLY A 215 5.960 -2.622 -4.729 1.00 0.00 C ATOM 101 C GLY A 215 7.176 -2.961 -3.886 1.00 0.00 C ATOM 102 O GLY A 215 7.774 -4.024 -4.053 1.00 0.00 O ATOM 0 H GLY A 215 4.601 -1.426 -3.672 1.00 0.00 H new ATOM 0 HA2 GLY A 215 5.221 -3.417 -4.629 1.00 0.00 H new ATOM 0 HA3 GLY A 215 6.250 -2.586 -5.779 1.00 0.00 H new ATOM 106 N ASP A 216 7.548 -2.058 -2.981 1.00 0.00 N ATOM 107 CA ASP A 216 8.703 -2.273 -2.119 1.00 0.00 C ATOM 108 C ASP A 216 8.286 -2.885 -0.785 1.00 0.00 C ATOM 109 O ASP A 216 7.195 -2.617 -0.281 1.00 0.00 O ATOM 110 CB ASP A 216 9.440 -0.954 -1.878 1.00 0.00 C ATOM 111 CG ASP A 216 10.331 -0.570 -3.042 1.00 0.00 C ATOM 112 OD1 ASP A 216 9.801 -0.069 -4.056 1.00 0.00 O ATOM 113 OD2 ASP A 216 11.560 -0.770 -2.941 1.00 0.00 O ATOM 0 H ASP A 216 7.066 -1.172 -2.827 1.00 0.00 H new ATOM 0 HA ASP A 216 9.372 -2.970 -2.623 1.00 0.00 H new ATOM 0 HB2 ASP A 216 8.713 -0.161 -1.703 1.00 0.00 H new ATOM 0 HB3 ASP A 216 10.043 -1.038 -0.974 1.00 0.00 H new ATOM 118 N ARG A 217 9.163 -3.707 -0.219 1.00 0.00 N ATOM 119 CA ARG A 217 8.890 -4.355 1.057 1.00 0.00 C ATOM 120 C ARG A 217 9.070 -3.371 2.207 1.00 0.00 C ATOM 121 O ARG A 217 10.049 -2.626 2.251 1.00 0.00 O ATOM 122 CB ARG A 217 9.811 -5.561 1.251 1.00 0.00 C ATOM 123 CG ARG A 217 9.242 -6.619 2.181 1.00 0.00 C ATOM 124 CD ARG A 217 8.124 -7.402 1.515 1.00 0.00 C ATOM 125 NE ARG A 217 8.624 -8.277 0.456 1.00 0.00 N ATOM 126 CZ ARG A 217 9.183 -9.466 0.677 1.00 0.00 C ATOM 127 NH1 ARG A 217 9.318 -9.923 1.916 1.00 0.00 N ATOM 128 NH2 ARG A 217 9.609 -10.197 -0.344 1.00 0.00 N ATOM 0 H ARG A 217 10.069 -3.940 -0.625 1.00 0.00 H new ATOM 0 HA ARG A 217 7.856 -4.699 1.051 1.00 0.00 H new ATOM 0 HB2 ARG A 217 10.012 -6.013 0.280 1.00 0.00 H new ATOM 0 HB3 ARG A 217 10.767 -5.217 1.647 1.00 0.00 H new ATOM 0 HG2 ARG A 217 10.035 -7.302 2.485 1.00 0.00 H new ATOM 0 HG3 ARG A 217 8.865 -6.144 3.087 1.00 0.00 H new ATOM 0 HD2 ARG A 217 7.604 -8.000 2.264 1.00 0.00 H new ATOM 0 HD3 ARG A 217 7.394 -6.708 1.098 1.00 0.00 H new ATOM 0 HE ARG A 217 8.540 -7.958 -0.509 1.00 0.00 H new ATOM 0 HH11 ARG A 217 8.993 -9.363 2.704 1.00 0.00 H new ATOM 0 HH12 ARG A 217 9.747 -10.834 2.080 1.00 0.00 H new ATOM 0 HH21 ARG A 217 9.509 -9.849 -1.297 1.00 0.00 H new ATOM 0 HH22 ARG A 217 10.037 -11.107 -0.176 1.00 0.00 H new ATOM 142 N VAL A 218 8.116 -3.367 3.129 1.00 0.00 N ATOM 143 CA VAL A 218 8.166 -2.466 4.271 1.00 0.00 C ATOM 144 C VAL A 218 7.413 -3.037 5.465 1.00 0.00 C ATOM 145 O VAL A 218 6.900 -4.156 5.417 1.00 0.00 O ATOM 146 CB VAL A 218 7.568 -1.089 3.919 1.00 0.00 C ATOM 147 CG1 VAL A 218 8.196 -0.542 2.648 1.00 0.00 C ATOM 148 CG2 VAL A 218 6.052 -1.181 3.781 1.00 0.00 C ATOM 0 H VAL A 218 7.299 -3.977 3.108 1.00 0.00 H new ATOM 0 HA VAL A 218 9.218 -2.350 4.533 1.00 0.00 H new ATOM 0 HB VAL A 218 7.793 -0.399 4.732 1.00 0.00 H new ATOM 0 HG11 VAL A 218 7.761 0.430 2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 218 9.271 -0.434 2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 218 8.007 -1.230 1.824 1.00 0.00 H new ATOM 0 HG21 VAL A 218 5.649 -0.199 3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 218 5.801 -1.887 2.990 1.00 0.00 H new ATOM 0 HG23 VAL A 218 5.621 -1.522 4.722 1.00 0.00 H new ATOM 158 N LEU A 219 7.333 -2.244 6.527 1.00 0.00 N ATOM 159 CA LEU A 219 6.624 -2.648 7.732 1.00 0.00 C ATOM 160 C LEU A 219 5.565 -1.616 8.088 1.00 0.00 C ATOM 161 O LEU A 219 5.878 -0.449 8.309 1.00 0.00 O ATOM 162 CB LEU A 219 7.587 -2.808 8.907 1.00 0.00 C ATOM 163 CG LEU A 219 8.689 -3.850 8.720 1.00 0.00 C ATOM 164 CD1 LEU A 219 9.446 -4.053 10.025 1.00 0.00 C ATOM 165 CD2 LEU A 219 8.106 -5.167 8.231 1.00 0.00 C ATOM 0 H LEU A 219 7.752 -1.315 6.577 1.00 0.00 H new ATOM 0 HA LEU A 219 6.149 -3.609 7.534 1.00 0.00 H new ATOM 0 HB2 LEU A 219 8.054 -1.843 9.105 1.00 0.00 H new ATOM 0 HB3 LEU A 219 7.010 -3.071 9.794 1.00 0.00 H new ATOM 0 HG LEU A 219 9.386 -3.486 7.965 1.00 0.00 H new ATOM 0 HD11 LEU A 219 10.229 -4.798 9.880 1.00 0.00 H new ATOM 0 HD12 LEU A 219 9.896 -3.110 10.335 1.00 0.00 H new ATOM 0 HD13 LEU A 219 8.756 -4.397 10.796 1.00 0.00 H new ATOM 0 HD21 LEU A 219 8.907 -5.895 8.104 1.00 0.00 H new ATOM 0 HD22 LEU A 219 7.388 -5.541 8.961 1.00 0.00 H new ATOM 0 HD23 LEU A 219 7.604 -5.010 7.276 1.00 0.00 H new ATOM 177 N VAL A 220 4.316 -2.051 8.157 1.00 0.00 N ATOM 178 CA VAL A 220 3.223 -1.150 8.501 1.00 0.00 C ATOM 179 C VAL A 220 3.042 -1.098 10.013 1.00 0.00 C ATOM 180 O VAL A 220 2.647 -2.083 10.638 1.00 0.00 O ATOM 181 CB VAL A 220 1.885 -1.553 7.831 1.00 0.00 C ATOM 182 CG1 VAL A 220 1.321 -0.394 7.023 1.00 0.00 C ATOM 183 CG2 VAL A 220 2.054 -2.785 6.949 1.00 0.00 C ATOM 0 H VAL A 220 4.034 -3.015 7.981 1.00 0.00 H new ATOM 0 HA VAL A 220 3.494 -0.164 8.123 1.00 0.00 H new ATOM 0 HB VAL A 220 1.179 -1.803 8.623 1.00 0.00 H new ATOM 0 HG11 VAL A 220 0.382 -0.696 6.560 1.00 0.00 H new ATOM 0 HG12 VAL A 220 1.144 0.456 7.681 1.00 0.00 H new ATOM 0 HG13 VAL A 220 2.033 -0.111 6.248 1.00 0.00 H new ATOM 0 HG21 VAL A 220 1.097 -3.041 6.494 1.00 0.00 H new ATOM 0 HG22 VAL A 220 2.783 -2.575 6.166 1.00 0.00 H new ATOM 0 HG23 VAL A 220 2.403 -3.621 7.555 1.00 0.00 H new ATOM 193 N GLY A 221 3.352 0.055 10.596 1.00 0.00 N ATOM 194 CA GLY A 221 3.236 0.218 12.033 1.00 0.00 C ATOM 195 C GLY A 221 4.486 -0.230 12.771 1.00 0.00 C ATOM 196 O GLY A 221 4.595 -0.046 13.984 1.00 0.00 O ATOM 0 H GLY A 221 3.682 0.881 10.097 1.00 0.00 H new ATOM 0 HA2 GLY A 221 3.038 1.265 12.262 1.00 0.00 H new ATOM 0 HA3 GLY A 221 2.381 -0.354 12.393 1.00 0.00 H new ATOM 200 N GLY A 222 5.435 -0.817 12.040 1.00 0.00 N ATOM 201 CA GLY A 222 6.669 -1.279 12.652 1.00 0.00 C ATOM 202 C GLY A 222 6.586 -2.717 13.123 1.00 0.00 C ATOM 203 O GLY A 222 7.600 -3.409 13.203 1.00 0.00 O ATOM 0 H GLY A 222 5.369 -0.980 11.035 1.00 0.00 H new ATOM 0 HA2 GLY A 222 7.484 -1.183 11.934 1.00 0.00 H new ATOM 0 HA3 GLY A 222 6.912 -0.637 13.499 1.00 0.00 H new ATOM 207 N THR A 223 5.377 -3.167 13.437 1.00 0.00 N ATOM 208 CA THR A 223 5.168 -4.530 13.904 1.00 0.00 C ATOM 209 C THR A 223 4.674 -5.423 12.771 1.00 0.00 C ATOM 210 O THR A 223 4.899 -6.633 12.779 1.00 0.00 O ATOM 211 CB THR A 223 4.160 -4.541 15.053 1.00 0.00 C ATOM 212 OG1 THR A 223 2.980 -3.846 14.692 1.00 0.00 O ATOM 213 CG2 THR A 223 4.696 -3.908 16.319 1.00 0.00 C ATOM 0 H THR A 223 4.527 -2.607 13.376 1.00 0.00 H new ATOM 0 HA THR A 223 6.122 -4.920 14.259 1.00 0.00 H new ATOM 0 HB THR A 223 3.953 -5.593 15.248 1.00 0.00 H new ATOM 0 HG1 THR A 223 2.347 -3.866 15.440 1.00 0.00 H new ATOM 0 HG21 THR A 223 3.933 -3.947 17.097 1.00 0.00 H new ATOM 0 HG22 THR A 223 5.581 -4.451 16.651 1.00 0.00 H new ATOM 0 HG23 THR A 223 4.961 -2.869 16.122 1.00 0.00 H new ATOM 221 N LYS A 224 3.997 -4.818 11.801 1.00 0.00 N ATOM 222 CA LYS A 224 3.471 -5.559 10.663 1.00 0.00 C ATOM 223 C LYS A 224 4.385 -5.408 9.450 1.00 0.00 C ATOM 224 O LYS A 224 5.019 -4.370 9.267 1.00 0.00 O ATOM 225 CB LYS A 224 2.061 -5.068 10.320 1.00 0.00 C ATOM 226 CG LYS A 224 1.197 -4.780 11.538 1.00 0.00 C ATOM 227 CD LYS A 224 0.585 -6.052 12.103 1.00 0.00 C ATOM 228 CE LYS A 224 1.587 -6.824 12.945 1.00 0.00 C ATOM 229 NZ LYS A 224 0.952 -7.432 14.146 1.00 0.00 N ATOM 0 H LYS A 224 3.800 -3.817 11.781 1.00 0.00 H new ATOM 0 HA LYS A 224 3.426 -6.614 10.933 1.00 0.00 H new ATOM 0 HB2 LYS A 224 2.138 -4.162 9.719 1.00 0.00 H new ATOM 0 HB3 LYS A 224 1.565 -5.818 9.704 1.00 0.00 H new ATOM 0 HG2 LYS A 224 1.799 -4.293 12.305 1.00 0.00 H new ATOM 0 HG3 LYS A 224 0.404 -4.084 11.266 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -0.285 -5.800 12.710 1.00 0.00 H new ATOM 0 HD3 LYS A 224 0.232 -6.682 11.286 1.00 0.00 H new ATOM 0 HE2 LYS A 224 2.043 -7.608 12.339 1.00 0.00 H new ATOM 0 HE3 LYS A 224 2.389 -6.156 13.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 1.669 -7.950 14.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 0.539 -6.683 14.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 0.203 -8.089 13.848 1.00 0.00 H new ATOM 243 N ALA A 225 4.450 -6.450 8.626 1.00 0.00 N ATOM 244 CA ALA A 225 5.288 -6.428 7.432 1.00 0.00 C ATOM 245 C ALA A 225 4.454 -6.633 6.176 1.00 0.00 C ATOM 246 O ALA A 225 3.473 -7.374 6.186 1.00 0.00 O ATOM 247 CB ALA A 225 6.370 -7.490 7.518 1.00 0.00 C ATOM 0 H ALA A 225 3.933 -7.319 8.763 1.00 0.00 H new ATOM 0 HA ALA A 225 5.761 -5.448 7.375 1.00 0.00 H new ATOM 0 HB1 ALA A 225 6.984 -7.457 6.618 1.00 0.00 H new ATOM 0 HB2 ALA A 225 6.995 -7.303 8.391 1.00 0.00 H new ATOM 0 HB3 ALA A 225 5.908 -8.473 7.607 1.00 0.00 H new ATOM 253 N GLY A 226 4.851 -5.972 5.092 1.00 0.00 N ATOM 254 CA GLY A 226 4.124 -6.101 3.844 1.00 0.00 C ATOM 255 C GLY A 226 4.779 -5.350 2.703 1.00 0.00 C ATOM 256 O GLY A 226 5.920 -4.903 2.815 1.00 0.00 O ATOM 0 H GLY A 226 5.660 -5.352 5.057 1.00 0.00 H new ATOM 0 HA2 GLY A 226 4.046 -7.156 3.581 1.00 0.00 H new ATOM 0 HA3 GLY A 226 3.108 -5.731 3.981 1.00 0.00 H new ATOM 260 N VAL A 227 4.051 -5.213 1.599 1.00 0.00 N ATOM 261 CA VAL A 227 4.558 -4.514 0.425 1.00 0.00 C ATOM 262 C VAL A 227 3.697 -3.298 0.100 1.00 0.00 C ATOM 263 O VAL A 227 2.472 -3.389 0.044 1.00 0.00 O ATOM 264 CB VAL A 227 4.603 -5.447 -0.804 1.00 0.00 C ATOM 265 CG1 VAL A 227 4.956 -4.672 -2.066 1.00 0.00 C ATOM 266 CG2 VAL A 227 5.589 -6.581 -0.575 1.00 0.00 C ATOM 0 H VAL A 227 3.105 -5.579 1.494 1.00 0.00 H new ATOM 0 HA VAL A 227 5.571 -4.185 0.659 1.00 0.00 H new ATOM 0 HB VAL A 227 3.610 -5.875 -0.941 1.00 0.00 H new ATOM 0 HG11 VAL A 227 4.981 -5.353 -2.916 1.00 0.00 H new ATOM 0 HG12 VAL A 227 4.206 -3.901 -2.241 1.00 0.00 H new ATOM 0 HG13 VAL A 227 5.934 -4.206 -1.945 1.00 0.00 H new ATOM 0 HG21 VAL A 227 5.608 -7.229 -1.451 1.00 0.00 H new ATOM 0 HG22 VAL A 227 6.584 -6.169 -0.406 1.00 0.00 H new ATOM 0 HG23 VAL A 227 5.283 -7.159 0.297 1.00 0.00 H new ATOM 276 N VAL A 228 4.347 -2.162 -0.126 1.00 0.00 N ATOM 277 CA VAL A 228 3.635 -0.935 -0.457 1.00 0.00 C ATOM 278 C VAL A 228 2.842 -1.105 -1.747 1.00 0.00 C ATOM 279 O VAL A 228 3.351 -1.636 -2.733 1.00 0.00 O ATOM 280 CB VAL A 228 4.604 0.252 -0.607 1.00 0.00 C ATOM 281 CG1 VAL A 228 3.836 1.556 -0.758 1.00 0.00 C ATOM 282 CG2 VAL A 228 5.551 0.312 0.582 1.00 0.00 C ATOM 0 H VAL A 228 5.362 -2.066 -0.086 1.00 0.00 H new ATOM 0 HA VAL A 228 2.950 -0.725 0.365 1.00 0.00 H new ATOM 0 HB VAL A 228 5.197 0.106 -1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 228 4.539 2.382 -0.863 1.00 0.00 H new ATOM 0 HG12 VAL A 228 3.202 1.505 -1.643 1.00 0.00 H new ATOM 0 HG13 VAL A 228 3.216 1.717 0.124 1.00 0.00 H new ATOM 0 HG21 VAL A 228 6.231 1.156 0.463 1.00 0.00 H new ATOM 0 HG22 VAL A 228 4.976 0.436 1.499 1.00 0.00 H new ATOM 0 HG23 VAL A 228 6.126 -0.612 0.636 1.00 0.00 H new ATOM 292 N ARG A 229 1.589 -0.670 -1.728 1.00 0.00 N ATOM 293 CA ARG A 229 0.724 -0.793 -2.893 1.00 0.00 C ATOM 294 C ARG A 229 0.221 0.569 -3.361 1.00 0.00 C ATOM 295 O ARG A 229 0.170 0.843 -4.561 1.00 0.00 O ATOM 296 CB ARG A 229 -0.456 -1.710 -2.568 1.00 0.00 C ATOM 297 CG ARG A 229 -0.034 -3.078 -2.058 1.00 0.00 C ATOM 298 CD ARG A 229 0.965 -3.740 -2.995 1.00 0.00 C ATOM 299 NE ARG A 229 0.686 -5.162 -3.175 1.00 0.00 N ATOM 300 CZ ARG A 229 1.131 -5.882 -4.203 1.00 0.00 C ATOM 301 NH1 ARG A 229 1.882 -5.318 -5.142 1.00 0.00 N ATOM 302 NH2 ARG A 229 0.827 -7.168 -4.293 1.00 0.00 N ATOM 0 H ARG A 229 1.150 -0.229 -0.920 1.00 0.00 H new ATOM 0 HA ARG A 229 1.307 -1.227 -3.705 1.00 0.00 H new ATOM 0 HB2 ARG A 229 -1.085 -1.229 -1.819 1.00 0.00 H new ATOM 0 HB3 ARG A 229 -1.066 -1.836 -3.463 1.00 0.00 H new ATOM 0 HG2 ARG A 229 0.407 -2.977 -1.067 1.00 0.00 H new ATOM 0 HG3 ARG A 229 -0.912 -3.715 -1.953 1.00 0.00 H new ATOM 0 HD2 ARG A 229 0.940 -3.240 -3.963 1.00 0.00 H new ATOM 0 HD3 ARG A 229 1.972 -3.616 -2.598 1.00 0.00 H new ATOM 0 HE ARG A 229 0.116 -5.632 -2.471 1.00 0.00 H new ATOM 0 HH11 ARG A 229 2.121 -4.328 -5.078 1.00 0.00 H new ATOM 0 HH12 ARG A 229 2.220 -5.874 -5.927 1.00 0.00 H new ATOM 0 HH21 ARG A 229 0.252 -7.608 -3.575 1.00 0.00 H new ATOM 0 HH22 ARG A 229 1.168 -7.719 -5.081 1.00 0.00 H new ATOM 316 N PHE A 230 -0.149 1.421 -2.411 1.00 0.00 N ATOM 317 CA PHE A 230 -0.646 2.752 -2.735 1.00 0.00 C ATOM 318 C PHE A 230 -0.305 3.746 -1.630 1.00 0.00 C ATOM 319 O PHE A 230 -0.207 3.377 -0.466 1.00 0.00 O ATOM 320 CB PHE A 230 -2.160 2.715 -2.954 1.00 0.00 C ATOM 321 CG PHE A 230 -2.696 3.924 -3.665 1.00 0.00 C ATOM 322 CD1 PHE A 230 -2.209 4.285 -4.912 1.00 0.00 C ATOM 323 CD2 PHE A 230 -3.685 4.703 -3.087 1.00 0.00 C ATOM 324 CE1 PHE A 230 -2.700 5.397 -5.568 1.00 0.00 C ATOM 325 CE2 PHE A 230 -4.180 5.817 -3.737 1.00 0.00 C ATOM 326 CZ PHE A 230 -3.687 6.163 -4.981 1.00 0.00 C ATOM 0 H PHE A 230 -0.114 1.214 -1.413 1.00 0.00 H new ATOM 0 HA PHE A 230 -0.160 3.079 -3.654 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -2.414 1.824 -3.529 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -2.656 2.623 -1.988 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -1.437 3.690 -5.376 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -4.074 4.436 -2.116 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -2.312 5.667 -6.539 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -4.950 6.416 -3.274 1.00 0.00 H new ATOM 0 HZ PHE A 230 -4.074 7.032 -5.493 1.00 0.00 H new ATOM 336 N LEU A 231 -0.129 5.009 -2.002 1.00 0.00 N ATOM 337 CA LEU A 231 0.195 6.047 -1.031 1.00 0.00 C ATOM 338 C LEU A 231 -0.664 7.286 -1.254 1.00 0.00 C ATOM 339 O LEU A 231 -0.626 7.896 -2.323 1.00 0.00 O ATOM 340 CB LEU A 231 1.679 6.413 -1.111 1.00 0.00 C ATOM 341 CG LEU A 231 2.644 5.225 -1.036 1.00 0.00 C ATOM 342 CD1 LEU A 231 3.373 5.042 -2.358 1.00 0.00 C ATOM 343 CD2 LEU A 231 3.639 5.415 0.101 1.00 0.00 C ATOM 0 H LEU A 231 -0.205 5.338 -2.965 1.00 0.00 H new ATOM 0 HA LEU A 231 -0.016 5.656 -0.036 1.00 0.00 H new ATOM 0 HB2 LEU A 231 1.856 6.947 -2.044 1.00 0.00 H new ATOM 0 HB3 LEU A 231 1.912 7.103 -0.300 1.00 0.00 H new ATOM 0 HG LEU A 231 2.063 4.324 -0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 231 4.053 4.194 -2.284 1.00 0.00 H new ATOM 0 HD12 LEU A 231 2.648 4.858 -3.151 1.00 0.00 H new ATOM 0 HD13 LEU A 231 3.941 5.943 -2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 231 4.316 4.561 0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 231 4.213 6.326 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 231 3.101 5.493 1.046 1.00 0.00 H new ATOM 355 N GLY A 232 -1.441 7.652 -0.239 1.00 0.00 N ATOM 356 CA GLY A 232 -2.299 8.816 -0.344 1.00 0.00 C ATOM 357 C GLY A 232 -3.207 8.976 0.859 1.00 0.00 C ATOM 358 O GLY A 232 -3.071 8.255 1.848 1.00 0.00 O ATOM 0 H GLY A 232 -1.491 7.162 0.654 1.00 0.00 H new ATOM 0 HA2 GLY A 232 -1.683 9.709 -0.452 1.00 0.00 H new ATOM 0 HA3 GLY A 232 -2.906 8.736 -1.246 1.00 0.00 H new ATOM 362 N GLU A 233 -4.133 9.926 0.778 1.00 0.00 N ATOM 363 CA GLU A 233 -5.064 10.181 1.870 1.00 0.00 C ATOM 364 C GLU A 233 -6.204 9.167 1.863 1.00 0.00 C ATOM 365 O GLU A 233 -6.482 8.537 0.843 1.00 0.00 O ATOM 366 CB GLU A 233 -5.628 11.599 1.765 1.00 0.00 C ATOM 367 CG GLU A 233 -4.573 12.657 1.492 1.00 0.00 C ATOM 368 CD GLU A 233 -5.161 13.940 0.940 1.00 0.00 C ATOM 369 OE1 GLU A 233 -6.377 14.162 1.122 1.00 0.00 O ATOM 370 OE2 GLU A 233 -4.407 14.722 0.324 1.00 0.00 O ATOM 0 H GLU A 233 -4.258 10.532 -0.033 1.00 0.00 H new ATOM 0 HA GLU A 233 -4.519 10.081 2.809 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -6.372 11.627 0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -6.145 11.845 2.693 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -4.036 12.876 2.415 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -3.843 12.263 0.785 1.00 0.00 H new ATOM 377 N THR A 234 -6.861 9.016 3.009 1.00 0.00 N ATOM 378 CA THR A 234 -7.970 8.080 3.136 1.00 0.00 C ATOM 379 C THR A 234 -9.301 8.822 3.204 1.00 0.00 C ATOM 380 O THR A 234 -9.341 10.023 3.469 1.00 0.00 O ATOM 381 CB THR A 234 -7.794 7.213 4.383 1.00 0.00 C ATOM 382 OG1 THR A 234 -7.903 7.998 5.557 1.00 0.00 O ATOM 383 CG2 THR A 234 -6.463 6.496 4.432 1.00 0.00 C ATOM 0 H THR A 234 -6.644 9.531 3.862 1.00 0.00 H new ATOM 0 HA THR A 234 -7.974 7.439 2.254 1.00 0.00 H new ATOM 0 HB THR A 234 -8.587 6.467 4.330 1.00 0.00 H new ATOM 0 HG1 THR A 234 -7.795 8.945 5.329 1.00 0.00 H new ATOM 0 HG21 THR A 234 -6.404 5.899 5.342 1.00 0.00 H new ATOM 0 HG22 THR A 234 -6.369 5.844 3.564 1.00 0.00 H new ATOM 0 HG23 THR A 234 -5.655 7.228 4.425 1.00 0.00 H new ATOM 391 N ASP A 235 -10.388 8.098 2.962 1.00 0.00 N ATOM 392 CA ASP A 235 -11.721 8.688 2.995 1.00 0.00 C ATOM 393 C ASP A 235 -12.289 8.705 4.415 1.00 0.00 C ATOM 394 O ASP A 235 -13.371 9.244 4.650 1.00 0.00 O ATOM 395 CB ASP A 235 -12.664 7.918 2.069 1.00 0.00 C ATOM 396 CG ASP A 235 -12.317 8.105 0.605 1.00 0.00 C ATOM 397 OD1 ASP A 235 -11.726 9.151 0.264 1.00 0.00 O ATOM 398 OD2 ASP A 235 -12.634 7.204 -0.200 1.00 0.00 O ATOM 0 H ASP A 235 -10.372 7.102 2.741 1.00 0.00 H new ATOM 0 HA ASP A 235 -11.636 9.718 2.650 1.00 0.00 H new ATOM 0 HB2 ASP A 235 -12.625 6.857 2.316 1.00 0.00 H new ATOM 0 HB3 ASP A 235 -13.688 8.248 2.242 1.00 0.00 H new ATOM 403 N PHE A 236 -11.558 8.115 5.360 1.00 0.00 N ATOM 404 CA PHE A 236 -12.005 8.072 6.749 1.00 0.00 C ATOM 405 C PHE A 236 -10.964 8.677 7.693 1.00 0.00 C ATOM 406 O PHE A 236 -11.276 9.012 8.836 1.00 0.00 O ATOM 407 CB PHE A 236 -12.314 6.628 7.164 1.00 0.00 C ATOM 408 CG PHE A 236 -11.097 5.821 7.538 1.00 0.00 C ATOM 409 CD1 PHE A 236 -10.084 5.598 6.620 1.00 0.00 C ATOM 410 CD2 PHE A 236 -10.972 5.291 8.812 1.00 0.00 C ATOM 411 CE1 PHE A 236 -8.967 4.861 6.967 1.00 0.00 C ATOM 412 CE2 PHE A 236 -9.858 4.553 9.163 1.00 0.00 C ATOM 413 CZ PHE A 236 -8.854 4.337 8.239 1.00 0.00 C ATOM 0 H PHE A 236 -10.660 7.663 5.190 1.00 0.00 H new ATOM 0 HA PHE A 236 -12.914 8.670 6.823 1.00 0.00 H new ATOM 0 HB2 PHE A 236 -13.000 6.644 8.011 1.00 0.00 H new ATOM 0 HB3 PHE A 236 -12.830 6.128 6.344 1.00 0.00 H new ATOM 0 HD1 PHE A 236 -10.168 6.004 5.623 1.00 0.00 H new ATOM 0 HD2 PHE A 236 -11.754 5.457 9.539 1.00 0.00 H new ATOM 0 HE1 PHE A 236 -8.183 4.695 6.243 1.00 0.00 H new ATOM 0 HE2 PHE A 236 -9.772 4.145 10.159 1.00 0.00 H new ATOM 0 HZ PHE A 236 -7.983 3.760 8.511 1.00 0.00 H new ATOM 423 N ALA A 237 -9.730 8.815 7.217 1.00 0.00 N ATOM 424 CA ALA A 237 -8.658 9.377 8.030 1.00 0.00 C ATOM 425 C ALA A 237 -8.071 10.629 7.384 1.00 0.00 C ATOM 426 O ALA A 237 -7.951 10.710 6.162 1.00 0.00 O ATOM 427 CB ALA A 237 -7.569 8.338 8.257 1.00 0.00 C ATOM 0 H ALA A 237 -9.449 8.546 6.274 1.00 0.00 H new ATOM 0 HA ALA A 237 -9.080 9.664 8.993 1.00 0.00 H new ATOM 0 HB1 ALA A 237 -6.775 8.770 8.865 1.00 0.00 H new ATOM 0 HB2 ALA A 237 -7.991 7.475 8.772 1.00 0.00 H new ATOM 0 HB3 ALA A 237 -7.160 8.024 7.297 1.00 0.00 H new ATOM 433 N LYS A 238 -7.706 11.598 8.215 1.00 0.00 N ATOM 434 CA LYS A 238 -7.130 12.846 7.726 1.00 0.00 C ATOM 435 C LYS A 238 -5.619 12.718 7.563 1.00 0.00 C ATOM 436 O LYS A 238 -4.985 11.878 8.202 1.00 0.00 O ATOM 437 CB LYS A 238 -7.454 13.993 8.686 1.00 0.00 C ATOM 438 CG LYS A 238 -8.898 13.996 9.165 1.00 0.00 C ATOM 439 CD LYS A 238 -8.987 14.028 10.683 1.00 0.00 C ATOM 440 CE LYS A 238 -10.070 13.093 11.198 1.00 0.00 C ATOM 441 NZ LYS A 238 -9.619 11.674 11.213 1.00 0.00 N ATOM 0 H LYS A 238 -7.798 11.544 9.229 1.00 0.00 H new ATOM 0 HA LYS A 238 -7.568 13.062 6.751 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -6.793 13.930 9.551 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -7.242 14.941 8.191 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -9.417 14.861 8.752 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -9.408 13.109 8.789 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -8.026 13.743 11.111 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -9.195 15.045 11.015 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -10.359 13.393 12.205 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -10.957 13.185 10.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -10.127 11.156 11.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -9.818 11.237 10.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -8.597 11.637 11.401 1.00 0.00 H new ATOM 455 N GLY A 239 -5.049 13.555 6.703 1.00 0.00 N ATOM 456 CA GLY A 239 -3.616 13.517 6.470 1.00 0.00 C ATOM 457 C GLY A 239 -3.233 12.556 5.363 1.00 0.00 C ATOM 458 O GLY A 239 -4.070 12.178 4.544 1.00 0.00 O ATOM 0 H GLY A 239 -5.553 14.259 6.163 1.00 0.00 H new ATOM 0 HA2 GLY A 239 -3.266 14.517 6.215 1.00 0.00 H new ATOM 0 HA3 GLY A 239 -3.109 13.227 7.390 1.00 0.00 H new ATOM 462 N GLU A 240 -1.964 12.161 5.337 1.00 0.00 N ATOM 463 CA GLU A 240 -1.471 11.238 4.320 1.00 0.00 C ATOM 464 C GLU A 240 -1.319 9.831 4.888 1.00 0.00 C ATOM 465 O GLU A 240 -0.846 9.650 6.010 1.00 0.00 O ATOM 466 CB GLU A 240 -0.132 11.724 3.764 1.00 0.00 C ATOM 467 CG GLU A 240 0.911 11.994 4.837 1.00 0.00 C ATOM 468 CD GLU A 240 2.259 12.369 4.257 1.00 0.00 C ATOM 469 OE1 GLU A 240 2.915 11.489 3.660 1.00 0.00 O ATOM 470 OE2 GLU A 240 2.661 13.542 4.398 1.00 0.00 O ATOM 0 H GLU A 240 -1.259 12.465 6.008 1.00 0.00 H new ATOM 0 HA GLU A 240 -2.201 11.206 3.511 1.00 0.00 H new ATOM 0 HB2 GLU A 240 0.257 10.978 3.071 1.00 0.00 H new ATOM 0 HB3 GLU A 240 -0.296 12.636 3.191 1.00 0.00 H new ATOM 0 HG2 GLU A 240 0.561 12.798 5.484 1.00 0.00 H new ATOM 0 HG3 GLU A 240 1.022 11.108 5.462 1.00 0.00 H new ATOM 477 N TRP A 241 -1.726 8.836 4.106 1.00 0.00 N ATOM 478 CA TRP A 241 -1.636 7.443 4.528 1.00 0.00 C ATOM 479 C TRP A 241 -1.003 6.585 3.438 1.00 0.00 C ATOM 480 O TRP A 241 -0.830 7.034 2.305 1.00 0.00 O ATOM 481 CB TRP A 241 -3.024 6.906 4.877 1.00 0.00 C ATOM 482 CG TRP A 241 -3.627 7.558 6.083 1.00 0.00 C ATOM 483 CD1 TRP A 241 -4.084 8.841 6.179 1.00 0.00 C ATOM 484 CD2 TRP A 241 -3.838 6.958 7.366 1.00 0.00 C ATOM 485 NE1 TRP A 241 -4.566 9.077 7.445 1.00 0.00 N ATOM 486 CE2 TRP A 241 -4.425 7.936 8.192 1.00 0.00 C ATOM 487 CE3 TRP A 241 -3.587 5.690 7.897 1.00 0.00 C ATOM 488 CZ2 TRP A 241 -4.765 7.683 9.519 1.00 0.00 C ATOM 489 CZ3 TRP A 241 -3.924 5.442 9.214 1.00 0.00 C ATOM 490 CH2 TRP A 241 -4.508 6.433 10.012 1.00 0.00 C ATOM 0 H TRP A 241 -2.122 8.969 3.175 1.00 0.00 H new ATOM 0 HA TRP A 241 -1.003 7.396 5.414 1.00 0.00 H new ATOM 0 HB2 TRP A 241 -3.687 7.052 4.024 1.00 0.00 H new ATOM 0 HB3 TRP A 241 -2.957 5.832 5.049 1.00 0.00 H new ATOM 0 HD1 TRP A 241 -4.069 9.565 5.378 1.00 0.00 H new ATOM 0 HE1 TRP A 241 -4.963 9.957 7.774 1.00 0.00 H new ATOM 0 HE3 TRP A 241 -3.138 4.918 7.289 1.00 0.00 H new ATOM 0 HZ2 TRP A 241 -5.215 8.446 10.136 1.00 0.00 H new ATOM 0 HZ3 TRP A 241 -3.733 4.466 9.635 1.00 0.00 H new ATOM 0 HH2 TRP A 241 -4.761 6.206 11.037 1.00 0.00 H new ATOM 501 N CYS A 242 -0.661 5.348 3.785 1.00 0.00 N ATOM 502 CA CYS A 242 -0.051 4.431 2.830 1.00 0.00 C ATOM 503 C CYS A 242 -0.678 3.042 2.923 1.00 0.00 C ATOM 504 O CYS A 242 -1.224 2.661 3.959 1.00 0.00 O ATOM 505 CB CYS A 242 1.462 4.344 3.062 1.00 0.00 C ATOM 506 SG CYS A 242 2.314 3.184 1.967 1.00 0.00 S ATOM 0 H CYS A 242 -0.796 4.959 4.718 1.00 0.00 H new ATOM 0 HA CYS A 242 -0.233 4.821 1.828 1.00 0.00 H new ATOM 0 HB2 CYS A 242 1.896 5.335 2.931 1.00 0.00 H new ATOM 0 HB3 CYS A 242 1.644 4.050 4.096 1.00 0.00 H new ATOM 0 HG CYS A 242 3.585 3.184 2.239 1.00 0.00 H new ATOM 512 N GLY A 243 -0.590 2.297 1.830 1.00 0.00 N ATOM 513 CA GLY A 243 -1.146 0.959 1.785 1.00 0.00 C ATOM 514 C GLY A 243 -0.074 -0.100 1.628 1.00 0.00 C ATOM 515 O GLY A 243 0.743 -0.030 0.713 1.00 0.00 O ATOM 0 H GLY A 243 -0.139 2.599 0.966 1.00 0.00 H new ATOM 0 HA2 GLY A 243 -1.710 0.771 2.699 1.00 0.00 H new ATOM 0 HA3 GLY A 243 -1.850 0.887 0.956 1.00 0.00 H new ATOM 519 N VAL A 244 -0.073 -1.079 2.525 1.00 0.00 N ATOM 520 CA VAL A 244 0.911 -2.151 2.477 1.00 0.00 C ATOM 521 C VAL A 244 0.238 -3.518 2.550 1.00 0.00 C ATOM 522 O VAL A 244 -0.621 -3.753 3.398 1.00 0.00 O ATOM 523 CB VAL A 244 1.929 -2.035 3.634 1.00 0.00 C ATOM 524 CG1 VAL A 244 3.142 -2.914 3.376 1.00 0.00 C ATOM 525 CG2 VAL A 244 2.350 -0.587 3.844 1.00 0.00 C ATOM 0 H VAL A 244 -0.741 -1.152 3.292 1.00 0.00 H new ATOM 0 HA VAL A 244 1.436 -2.054 1.527 1.00 0.00 H new ATOM 0 HB VAL A 244 1.443 -2.383 4.546 1.00 0.00 H new ATOM 0 HG11 VAL A 244 3.845 -2.816 4.203 1.00 0.00 H new ATOM 0 HG12 VAL A 244 2.826 -3.954 3.289 1.00 0.00 H new ATOM 0 HG13 VAL A 244 3.626 -2.603 2.450 1.00 0.00 H new ATOM 0 HG21 VAL A 244 3.067 -0.532 4.663 1.00 0.00 H new ATOM 0 HG22 VAL A 244 2.811 -0.206 2.933 1.00 0.00 H new ATOM 0 HG23 VAL A 244 1.474 0.015 4.087 1.00 0.00 H new ATOM 535 N GLU A 245 0.643 -4.419 1.659 1.00 0.00 N ATOM 536 CA GLU A 245 0.086 -5.763 1.630 1.00 0.00 C ATOM 537 C GLU A 245 0.815 -6.652 2.629 1.00 0.00 C ATOM 538 O GLU A 245 1.990 -6.968 2.450 1.00 0.00 O ATOM 539 CB GLU A 245 0.194 -6.358 0.224 1.00 0.00 C ATOM 540 CG GLU A 245 -0.417 -7.744 0.101 1.00 0.00 C ATOM 541 CD GLU A 245 -0.667 -8.147 -1.340 1.00 0.00 C ATOM 542 OE1 GLU A 245 -1.098 -7.283 -2.131 1.00 0.00 O ATOM 543 OE2 GLU A 245 -0.428 -9.326 -1.676 1.00 0.00 O ATOM 0 H GLU A 245 1.354 -4.241 0.950 1.00 0.00 H new ATOM 0 HA GLU A 245 -0.967 -5.708 1.904 1.00 0.00 H new ATOM 0 HB2 GLU A 245 -0.297 -5.690 -0.483 1.00 0.00 H new ATOM 0 HB3 GLU A 245 1.245 -6.407 -0.061 1.00 0.00 H new ATOM 0 HG2 GLU A 245 0.247 -8.472 0.568 1.00 0.00 H new ATOM 0 HG3 GLU A 245 -1.358 -7.772 0.650 1.00 0.00 H new ATOM 550 N LEU A 246 0.116 -7.038 3.688 1.00 0.00 N ATOM 551 CA LEU A 246 0.704 -7.871 4.728 1.00 0.00 C ATOM 552 C LEU A 246 1.013 -9.272 4.212 1.00 0.00 C ATOM 553 O LEU A 246 0.286 -9.818 3.382 1.00 0.00 O ATOM 554 CB LEU A 246 -0.234 -7.956 5.932 1.00 0.00 C ATOM 555 CG LEU A 246 -0.588 -6.612 6.572 1.00 0.00 C ATOM 556 CD1 LEU A 246 -1.694 -6.785 7.602 1.00 0.00 C ATOM 557 CD2 LEU A 246 0.644 -5.986 7.209 1.00 0.00 C ATOM 0 H LEU A 246 -0.859 -6.787 3.849 1.00 0.00 H new ATOM 0 HA LEU A 246 1.642 -7.407 5.033 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -1.156 -8.447 5.621 1.00 0.00 H new ATOM 0 HB3 LEU A 246 0.227 -8.591 6.688 1.00 0.00 H new ATOM 0 HG LEU A 246 -0.950 -5.943 5.791 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -1.932 -5.818 8.046 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -2.582 -7.190 7.117 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -1.361 -7.470 8.381 1.00 0.00 H new ATOM 0 HD21 LEU A 246 0.375 -5.031 7.660 1.00 0.00 H new ATOM 0 HD22 LEU A 246 1.035 -6.653 7.978 1.00 0.00 H new ATOM 0 HD23 LEU A 246 1.406 -5.826 6.446 1.00 0.00 H new ATOM 569 N ASP A 247 2.102 -9.844 4.714 1.00 0.00 N ATOM 570 CA ASP A 247 2.525 -11.180 4.316 1.00 0.00 C ATOM 571 C ASP A 247 1.626 -12.249 4.933 1.00 0.00 C ATOM 572 O ASP A 247 1.526 -13.362 4.415 1.00 0.00 O ATOM 573 CB ASP A 247 3.979 -11.413 4.734 1.00 0.00 C ATOM 574 CG ASP A 247 4.966 -10.786 3.767 1.00 0.00 C ATOM 575 OD1 ASP A 247 5.289 -11.429 2.747 1.00 0.00 O ATOM 576 OD2 ASP A 247 5.415 -9.650 4.031 1.00 0.00 O ATOM 0 H ASP A 247 2.710 -9.399 5.401 1.00 0.00 H new ATOM 0 HA ASP A 247 2.444 -11.254 3.232 1.00 0.00 H new ATOM 0 HB2 ASP A 247 4.138 -11.000 5.730 1.00 0.00 H new ATOM 0 HB3 ASP A 247 4.168 -12.484 4.799 1.00 0.00 H new ATOM 581 N GLU A 248 0.974 -11.907 6.038 1.00 0.00 N ATOM 582 CA GLU A 248 0.084 -12.840 6.724 1.00 0.00 C ATOM 583 C GLU A 248 -1.191 -12.135 7.182 1.00 0.00 C ATOM 584 O GLU A 248 -1.283 -10.910 7.128 1.00 0.00 O ATOM 585 CB GLU A 248 0.802 -13.467 7.923 1.00 0.00 C ATOM 586 CG GLU A 248 1.222 -14.909 7.693 1.00 0.00 C ATOM 587 CD GLU A 248 2.699 -15.044 7.383 1.00 0.00 C ATOM 588 OE1 GLU A 248 3.522 -14.734 8.269 1.00 0.00 O ATOM 589 OE2 GLU A 248 3.032 -15.460 6.253 1.00 0.00 O ATOM 0 H GLU A 248 1.044 -10.990 6.479 1.00 0.00 H new ATOM 0 HA GLU A 248 -0.194 -13.629 6.025 1.00 0.00 H new ATOM 0 HB2 GLU A 248 1.685 -12.873 8.159 1.00 0.00 H new ATOM 0 HB3 GLU A 248 0.147 -13.422 8.793 1.00 0.00 H new ATOM 0 HG2 GLU A 248 0.985 -15.498 8.579 1.00 0.00 H new ATOM 0 HG3 GLU A 248 0.642 -15.325 6.869 1.00 0.00 H new ATOM 596 N PRO A 249 -2.199 -12.904 7.638 1.00 0.00 N ATOM 597 CA PRO A 249 -3.471 -12.339 8.103 1.00 0.00 C ATOM 598 C PRO A 249 -3.302 -11.504 9.367 1.00 0.00 C ATOM 599 O PRO A 249 -3.755 -11.886 10.446 1.00 0.00 O ATOM 600 CB PRO A 249 -4.335 -13.574 8.386 1.00 0.00 C ATOM 601 CG PRO A 249 -3.362 -14.679 8.611 1.00 0.00 C ATOM 602 CD PRO A 249 -2.180 -14.375 7.734 1.00 0.00 C ATOM 0 HA PRO A 249 -3.908 -11.662 7.369 1.00 0.00 H new ATOM 0 HB2 PRO A 249 -4.968 -13.421 9.260 1.00 0.00 H new ATOM 0 HB3 PRO A 249 -4.996 -13.794 7.548 1.00 0.00 H new ATOM 0 HG2 PRO A 249 -3.067 -14.732 9.659 1.00 0.00 H new ATOM 0 HG3 PRO A 249 -3.801 -15.643 8.354 1.00 0.00 H new ATOM 0 HD2 PRO A 249 -1.250 -14.738 8.172 1.00 0.00 H new ATOM 0 HD3 PRO A 249 -2.275 -14.843 6.754 1.00 0.00 H new ATOM 610 N LEU A 250 -2.642 -10.359 9.223 1.00 0.00 N ATOM 611 CA LEU A 250 -2.405 -9.461 10.347 1.00 0.00 C ATOM 612 C LEU A 250 -2.891 -8.050 10.032 1.00 0.00 C ATOM 613 O LEU A 250 -2.362 -7.070 10.558 1.00 0.00 O ATOM 614 CB LEU A 250 -0.916 -9.437 10.700 1.00 0.00 C ATOM 615 CG LEU A 250 0.037 -9.457 9.500 1.00 0.00 C ATOM 616 CD1 LEU A 250 0.995 -8.279 9.554 1.00 0.00 C ATOM 617 CD2 LEU A 250 0.807 -10.768 9.449 1.00 0.00 C ATOM 0 H LEU A 250 -2.261 -10.031 8.336 1.00 0.00 H new ATOM 0 HA LEU A 250 -2.968 -9.833 11.203 1.00 0.00 H new ATOM 0 HB2 LEU A 250 -0.713 -8.544 11.291 1.00 0.00 H new ATOM 0 HB3 LEU A 250 -0.695 -10.296 11.334 1.00 0.00 H new ATOM 0 HG LEU A 250 -0.559 -9.372 8.591 1.00 0.00 H new ATOM 0 HD11 LEU A 250 1.662 -8.313 8.693 1.00 0.00 H new ATOM 0 HD12 LEU A 250 0.428 -7.348 9.537 1.00 0.00 H new ATOM 0 HD13 LEU A 250 1.583 -8.330 10.471 1.00 0.00 H new ATOM 0 HD21 LEU A 250 1.478 -10.763 8.590 1.00 0.00 H new ATOM 0 HD22 LEU A 250 1.389 -10.884 10.363 1.00 0.00 H new ATOM 0 HD23 LEU A 250 0.107 -11.598 9.357 1.00 0.00 H new ATOM 629 N GLY A 251 -3.900 -7.950 9.172 1.00 0.00 N ATOM 630 CA GLY A 251 -4.436 -6.653 8.805 1.00 0.00 C ATOM 631 C GLY A 251 -5.842 -6.437 9.329 1.00 0.00 C ATOM 632 O GLY A 251 -6.362 -7.260 10.083 1.00 0.00 O ATOM 0 H GLY A 251 -4.356 -8.745 8.723 1.00 0.00 H new ATOM 0 HA2 GLY A 251 -3.783 -5.871 9.192 1.00 0.00 H new ATOM 0 HA3 GLY A 251 -4.438 -6.558 7.719 1.00 0.00 H new ATOM 636 N LYS A 252 -6.455 -5.325 8.936 1.00 0.00 N ATOM 637 CA LYS A 252 -7.807 -5.003 9.377 1.00 0.00 C ATOM 638 C LYS A 252 -8.783 -4.965 8.203 1.00 0.00 C ATOM 639 O LYS A 252 -9.978 -5.208 8.372 1.00 0.00 O ATOM 640 CB LYS A 252 -7.821 -3.654 10.102 1.00 0.00 C ATOM 641 CG LYS A 252 -6.665 -3.469 11.072 1.00 0.00 C ATOM 642 CD LYS A 252 -6.920 -4.188 12.386 1.00 0.00 C ATOM 643 CE LYS A 252 -5.654 -4.286 13.221 1.00 0.00 C ATOM 644 NZ LYS A 252 -5.943 -4.687 14.626 1.00 0.00 N ATOM 0 H LYS A 252 -6.038 -4.633 8.314 1.00 0.00 H new ATOM 0 HA LYS A 252 -8.127 -5.788 10.062 1.00 0.00 H new ATOM 0 HB2 LYS A 252 -7.795 -2.854 9.362 1.00 0.00 H new ATOM 0 HB3 LYS A 252 -8.760 -3.554 10.646 1.00 0.00 H new ATOM 0 HG2 LYS A 252 -5.747 -3.846 10.622 1.00 0.00 H new ATOM 0 HG3 LYS A 252 -6.514 -2.406 11.261 1.00 0.00 H new ATOM 0 HD2 LYS A 252 -7.688 -3.658 12.949 1.00 0.00 H new ATOM 0 HD3 LYS A 252 -7.304 -5.188 12.186 1.00 0.00 H new ATOM 0 HE2 LYS A 252 -4.977 -5.011 12.769 1.00 0.00 H new ATOM 0 HE3 LYS A 252 -5.141 -3.324 13.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 252 -5.053 -4.742 15.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 252 -6.569 -3.983 15.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 252 -6.409 -5.617 14.633 1.00 0.00 H new ATOM 658 N ASN A 253 -8.270 -4.656 7.015 1.00 0.00 N ATOM 659 CA ASN A 253 -9.106 -4.586 5.821 1.00 0.00 C ATOM 660 C ASN A 253 -8.578 -5.504 4.721 1.00 0.00 C ATOM 661 O ASN A 253 -7.466 -6.023 4.812 1.00 0.00 O ATOM 662 CB ASN A 253 -9.180 -3.146 5.309 1.00 0.00 C ATOM 663 CG ASN A 253 -7.837 -2.635 4.821 1.00 0.00 C ATOM 664 OD1 ASN A 253 -7.616 -2.486 3.620 1.00 0.00 O ATOM 665 ND2 ASN A 253 -6.932 -2.365 5.754 1.00 0.00 N ATOM 0 H ASN A 253 -7.284 -4.451 6.854 1.00 0.00 H new ATOM 0 HA ASN A 253 -10.107 -4.922 6.093 1.00 0.00 H new ATOM 0 HB2 ASN A 253 -9.904 -3.089 4.496 1.00 0.00 H new ATOM 0 HB3 ASN A 253 -9.544 -2.498 6.106 1.00 0.00 H new ATOM 0 HD21 ASN A 253 -6.011 -2.019 5.486 1.00 0.00 H new ATOM 0 HD22 ASN A 253 -7.158 -2.503 6.739 1.00 0.00 H new ATOM 672 N ASP A 254 -9.387 -5.695 3.683 1.00 0.00 N ATOM 673 CA ASP A 254 -9.008 -6.547 2.562 1.00 0.00 C ATOM 674 C ASP A 254 -8.557 -5.713 1.366 1.00 0.00 C ATOM 675 O ASP A 254 -8.643 -6.156 0.222 1.00 0.00 O ATOM 676 CB ASP A 254 -10.179 -7.445 2.158 1.00 0.00 C ATOM 677 CG ASP A 254 -11.385 -6.647 1.700 1.00 0.00 C ATOM 678 OD1 ASP A 254 -11.964 -5.916 2.531 1.00 0.00 O ATOM 679 OD2 ASP A 254 -11.751 -6.756 0.512 1.00 0.00 O ATOM 0 H ASP A 254 -10.310 -5.270 3.596 1.00 0.00 H new ATOM 0 HA ASP A 254 -8.172 -7.170 2.881 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -9.862 -8.113 1.357 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -10.461 -8.073 3.003 1.00 0.00 H new ATOM 684 N GLY A 255 -8.073 -4.504 1.638 1.00 0.00 N ATOM 685 CA GLY A 255 -7.614 -3.632 0.573 1.00 0.00 C ATOM 686 C GLY A 255 -8.590 -2.511 0.263 1.00 0.00 C ATOM 687 O GLY A 255 -8.452 -1.821 -0.746 1.00 0.00 O ATOM 0 H GLY A 255 -7.991 -4.114 2.577 1.00 0.00 H new ATOM 0 HA2 GLY A 255 -6.652 -3.202 0.852 1.00 0.00 H new ATOM 0 HA3 GLY A 255 -7.450 -4.223 -0.328 1.00 0.00 H new ATOM 691 N ALA A 256 -9.579 -2.326 1.134 1.00 0.00 N ATOM 692 CA ALA A 256 -10.576 -1.279 0.943 1.00 0.00 C ATOM 693 C ALA A 256 -10.873 -0.558 2.253 1.00 0.00 C ATOM 694 O ALA A 256 -10.661 -1.105 3.336 1.00 0.00 O ATOM 695 CB ALA A 256 -11.852 -1.867 0.359 1.00 0.00 C ATOM 0 H ALA A 256 -9.710 -2.886 1.976 1.00 0.00 H new ATOM 0 HA ALA A 256 -10.172 -0.549 0.242 1.00 0.00 H new ATOM 0 HB1 ALA A 256 -12.588 -1.075 0.221 1.00 0.00 H new ATOM 0 HB2 ALA A 256 -11.632 -2.329 -0.603 1.00 0.00 H new ATOM 0 HB3 ALA A 256 -12.251 -2.619 1.040 1.00 0.00 H new ATOM 701 N VAL A 257 -11.362 0.672 2.145 1.00 0.00 N ATOM 702 CA VAL A 257 -11.687 1.471 3.320 1.00 0.00 C ATOM 703 C VAL A 257 -12.961 2.278 3.098 1.00 0.00 C ATOM 704 O VAL A 257 -13.050 3.074 2.162 1.00 0.00 O ATOM 705 CB VAL A 257 -10.535 2.431 3.679 1.00 0.00 C ATOM 706 CG1 VAL A 257 -10.865 3.231 4.931 1.00 0.00 C ATOM 707 CG2 VAL A 257 -9.235 1.658 3.859 1.00 0.00 C ATOM 0 H VAL A 257 -11.542 1.138 1.255 1.00 0.00 H new ATOM 0 HA VAL A 257 -11.841 0.777 4.146 1.00 0.00 H new ATOM 0 HB VAL A 257 -10.407 3.134 2.856 1.00 0.00 H new ATOM 0 HG11 VAL A 257 -10.037 3.901 5.164 1.00 0.00 H new ATOM 0 HG12 VAL A 257 -11.769 3.816 4.761 1.00 0.00 H new ATOM 0 HG13 VAL A 257 -11.026 2.550 5.766 1.00 0.00 H new ATOM 0 HG21 VAL A 257 -8.432 2.350 4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 257 -9.353 0.930 4.662 1.00 0.00 H new ATOM 0 HG23 VAL A 257 -8.989 1.140 2.932 1.00 0.00 H new ATOM 717 N ALA A 258 -13.947 2.068 3.965 1.00 0.00 N ATOM 718 CA ALA A 258 -15.218 2.776 3.866 1.00 0.00 C ATOM 719 C ALA A 258 -15.881 2.535 2.514 1.00 0.00 C ATOM 720 O ALA A 258 -16.662 3.360 2.039 1.00 0.00 O ATOM 721 CB ALA A 258 -15.009 4.267 4.094 1.00 0.00 C ATOM 0 H ALA A 258 -13.890 1.413 4.744 1.00 0.00 H new ATOM 0 HA ALA A 258 -15.881 2.388 4.639 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -15.965 4.784 4.017 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -14.588 4.428 5.086 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -14.324 4.658 3.342 1.00 0.00 H new ATOM 727 N GLY A 259 -15.565 1.401 1.897 1.00 0.00 N ATOM 728 CA GLY A 259 -16.140 1.076 0.605 1.00 0.00 C ATOM 729 C GLY A 259 -15.283 1.553 -0.553 1.00 0.00 C ATOM 730 O GLY A 259 -15.719 1.534 -1.703 1.00 0.00 O ATOM 0 H GLY A 259 -14.922 0.702 2.268 1.00 0.00 H new ATOM 0 HA2 GLY A 259 -16.274 -0.003 0.532 1.00 0.00 H new ATOM 0 HA3 GLY A 259 -17.130 1.526 0.529 1.00 0.00 H new ATOM 734 N THR A 260 -14.059 1.982 -0.253 1.00 0.00 N ATOM 735 CA THR A 260 -13.144 2.464 -1.280 1.00 0.00 C ATOM 736 C THR A 260 -11.902 1.584 -1.355 1.00 0.00 C ATOM 737 O THR A 260 -11.117 1.518 -0.408 1.00 0.00 O ATOM 738 CB THR A 260 -12.741 3.911 -0.996 1.00 0.00 C ATOM 739 OG1 THR A 260 -13.870 4.685 -0.632 1.00 0.00 O ATOM 740 CG2 THR A 260 -12.079 4.591 -2.175 1.00 0.00 C ATOM 0 H THR A 260 -13.680 2.005 0.694 1.00 0.00 H new ATOM 0 HA THR A 260 -13.658 2.420 -2.240 1.00 0.00 H new ATOM 0 HB THR A 260 -12.022 3.854 -0.179 1.00 0.00 H new ATOM 0 HG1 THR A 260 -13.592 5.609 -0.462 1.00 0.00 H new ATOM 0 HG21 THR A 260 -11.819 5.615 -1.906 1.00 0.00 H new ATOM 0 HG22 THR A 260 -11.175 4.047 -2.448 1.00 0.00 H new ATOM 0 HG23 THR A 260 -12.766 4.602 -3.021 1.00 0.00 H new ATOM 748 N ARG A 261 -11.728 0.908 -2.486 1.00 0.00 N ATOM 749 CA ARG A 261 -10.578 0.031 -2.682 1.00 0.00 C ATOM 750 C ARG A 261 -9.394 0.812 -3.241 1.00 0.00 C ATOM 751 O ARG A 261 -9.440 1.307 -4.368 1.00 0.00 O ATOM 752 CB ARG A 261 -10.940 -1.117 -3.624 1.00 0.00 C ATOM 753 CG ARG A 261 -9.840 -2.157 -3.766 1.00 0.00 C ATOM 754 CD ARG A 261 -10.310 -3.361 -4.564 1.00 0.00 C ATOM 755 NE ARG A 261 -11.499 -3.976 -3.980 1.00 0.00 N ATOM 756 CZ ARG A 261 -12.138 -5.013 -4.520 1.00 0.00 C ATOM 757 NH1 ARG A 261 -11.706 -5.552 -5.652 1.00 0.00 N ATOM 758 NH2 ARG A 261 -13.215 -5.509 -3.925 1.00 0.00 N ATOM 0 H ARG A 261 -12.367 0.950 -3.280 1.00 0.00 H new ATOM 0 HA ARG A 261 -10.295 -0.382 -1.714 1.00 0.00 H new ATOM 0 HB2 ARG A 261 -11.844 -1.604 -3.259 1.00 0.00 H new ATOM 0 HB3 ARG A 261 -11.172 -0.709 -4.608 1.00 0.00 H new ATOM 0 HG2 ARG A 261 -8.976 -1.709 -4.257 1.00 0.00 H new ATOM 0 HG3 ARG A 261 -9.513 -2.480 -2.777 1.00 0.00 H new ATOM 0 HD2 ARG A 261 -10.526 -3.055 -5.588 1.00 0.00 H new ATOM 0 HD3 ARG A 261 -9.508 -4.098 -4.614 1.00 0.00 H new ATOM 0 HE ARG A 261 -11.861 -3.589 -3.108 1.00 0.00 H new ATOM 0 HH11 ARG A 261 -10.880 -5.173 -6.115 1.00 0.00 H new ATOM 0 HH12 ARG A 261 -12.200 -6.346 -6.060 1.00 0.00 H new ATOM 0 HH21 ARG A 261 -13.553 -5.097 -3.055 1.00 0.00 H new ATOM 0 HH22 ARG A 261 -13.705 -6.303 -4.337 1.00 0.00 H new ATOM 772 N TYR A 262 -8.332 0.918 -2.447 1.00 0.00 N ATOM 773 CA TYR A 262 -7.137 1.640 -2.865 1.00 0.00 C ATOM 774 C TYR A 262 -6.189 0.726 -3.635 1.00 0.00 C ATOM 775 O TYR A 262 -5.491 1.164 -4.549 1.00 0.00 O ATOM 776 CB TYR A 262 -6.423 2.233 -1.649 1.00 0.00 C ATOM 777 CG TYR A 262 -7.201 3.344 -0.977 1.00 0.00 C ATOM 778 CD1 TYR A 262 -8.305 3.065 -0.181 1.00 0.00 C ATOM 779 CD2 TYR A 262 -6.832 4.674 -1.143 1.00 0.00 C ATOM 780 CE1 TYR A 262 -9.018 4.078 0.430 1.00 0.00 C ATOM 781 CE2 TYR A 262 -7.539 5.692 -0.534 1.00 0.00 C ATOM 782 CZ TYR A 262 -8.631 5.389 0.250 1.00 0.00 C ATOM 783 OH TYR A 262 -9.341 6.400 0.857 1.00 0.00 O ATOM 0 H TYR A 262 -8.276 0.513 -1.512 1.00 0.00 H new ATOM 0 HA TYR A 262 -7.444 2.450 -3.526 1.00 0.00 H new ATOM 0 HB2 TYR A 262 -6.237 1.440 -0.924 1.00 0.00 H new ATOM 0 HB3 TYR A 262 -5.451 2.616 -1.959 1.00 0.00 H new ATOM 0 HD1 TYR A 262 -8.611 2.039 -0.038 1.00 0.00 H new ATOM 0 HD2 TYR A 262 -5.978 4.915 -1.759 1.00 0.00 H new ATOM 0 HE1 TYR A 262 -9.874 3.844 1.045 1.00 0.00 H new ATOM 0 HE2 TYR A 262 -7.238 6.720 -0.671 1.00 0.00 H new ATOM 0 HH TYR A 262 -10.278 6.130 0.952 1.00 0.00 H new ATOM 793 N PHE A 263 -6.174 -0.550 -3.262 1.00 0.00 N ATOM 794 CA PHE A 263 -5.317 -1.530 -3.920 1.00 0.00 C ATOM 795 C PHE A 263 -5.877 -2.939 -3.753 1.00 0.00 C ATOM 796 O PHE A 263 -6.894 -3.137 -3.088 1.00 0.00 O ATOM 797 CB PHE A 263 -3.895 -1.461 -3.358 1.00 0.00 C ATOM 798 CG PHE A 263 -3.842 -1.371 -1.860 1.00 0.00 C ATOM 799 CD1 PHE A 263 -4.021 -0.155 -1.221 1.00 0.00 C ATOM 800 CD2 PHE A 263 -3.608 -2.499 -1.092 1.00 0.00 C ATOM 801 CE1 PHE A 263 -3.970 -0.066 0.157 1.00 0.00 C ATOM 802 CE2 PHE A 263 -3.556 -2.417 0.287 1.00 0.00 C ATOM 803 CZ PHE A 263 -3.737 -1.199 0.912 1.00 0.00 C ATOM 0 H PHE A 263 -6.746 -0.929 -2.507 1.00 0.00 H new ATOM 0 HA PHE A 263 -5.288 -1.293 -4.984 1.00 0.00 H new ATOM 0 HB2 PHE A 263 -3.343 -2.344 -3.680 1.00 0.00 H new ATOM 0 HB3 PHE A 263 -3.387 -0.595 -3.783 1.00 0.00 H new ATOM 0 HD1 PHE A 263 -4.203 0.734 -1.807 1.00 0.00 H new ATOM 0 HD2 PHE A 263 -3.464 -3.454 -1.576 1.00 0.00 H new ATOM 0 HE1 PHE A 263 -4.112 0.888 0.643 1.00 0.00 H new ATOM 0 HE2 PHE A 263 -3.374 -3.305 0.875 1.00 0.00 H new ATOM 0 HZ PHE A 263 -3.696 -1.132 1.989 1.00 0.00 H new ATOM 813 N GLN A 264 -5.213 -3.913 -4.364 1.00 0.00 N ATOM 814 CA GLN A 264 -5.652 -5.302 -4.284 1.00 0.00 C ATOM 815 C GLN A 264 -4.764 -6.103 -3.338 1.00 0.00 C ATOM 816 O GLN A 264 -3.540 -6.114 -3.476 1.00 0.00 O ATOM 817 CB GLN A 264 -5.643 -5.942 -5.673 1.00 0.00 C ATOM 818 CG GLN A 264 -6.303 -7.310 -5.715 1.00 0.00 C ATOM 819 CD GLN A 264 -7.744 -7.276 -5.243 1.00 0.00 C ATOM 820 OE1 GLN A 264 -8.574 -6.553 -5.795 1.00 0.00 O ATOM 821 NE2 GLN A 264 -8.047 -8.061 -4.216 1.00 0.00 N ATOM 0 H GLN A 264 -4.370 -3.768 -4.920 1.00 0.00 H new ATOM 0 HA GLN A 264 -6.669 -5.311 -3.892 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -6.153 -5.280 -6.373 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -4.612 -6.034 -6.015 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -6.267 -7.696 -6.734 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -5.737 -8.002 -5.092 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -7.327 -8.644 -3.789 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -9.000 -8.081 -3.854 1.00 0.00 H new ATOM 830 N CYS A 265 -5.389 -6.775 -2.376 1.00 0.00 N ATOM 831 CA CYS A 265 -4.659 -7.583 -1.407 1.00 0.00 C ATOM 832 C CYS A 265 -5.541 -8.699 -0.855 1.00 0.00 C ATOM 833 O CYS A 265 -6.769 -8.602 -0.877 1.00 0.00 O ATOM 834 CB CYS A 265 -4.146 -6.706 -0.263 1.00 0.00 C ATOM 835 SG CYS A 265 -5.453 -5.956 0.737 1.00 0.00 S ATOM 0 H CYS A 265 -6.401 -6.775 -2.247 1.00 0.00 H new ATOM 0 HA CYS A 265 -3.808 -8.036 -1.916 1.00 0.00 H new ATOM 0 HB2 CYS A 265 -3.509 -7.308 0.384 1.00 0.00 H new ATOM 0 HB3 CYS A 265 -3.522 -5.915 -0.678 1.00 0.00 H new ATOM 0 HG CYS A 265 -5.906 -6.830 1.586 1.00 0.00 H new ATOM 841 N GLN A 266 -4.906 -9.755 -0.360 1.00 0.00 N ATOM 842 CA GLN A 266 -5.632 -10.892 0.200 1.00 0.00 C ATOM 843 C GLN A 266 -6.484 -10.463 1.391 1.00 0.00 C ATOM 844 O GLN A 266 -6.310 -9.368 1.928 1.00 0.00 O ATOM 845 CB GLN A 266 -4.653 -11.988 0.625 1.00 0.00 C ATOM 846 CG GLN A 266 -4.296 -12.954 -0.493 1.00 0.00 C ATOM 847 CD GLN A 266 -3.804 -14.290 0.025 1.00 0.00 C ATOM 848 OE1 GLN A 266 -2.685 -14.709 -0.272 1.00 0.00 O ATOM 849 NE2 GLN A 266 -4.638 -14.967 0.805 1.00 0.00 N ATOM 0 H GLN A 266 -3.891 -9.849 -0.334 1.00 0.00 H new ATOM 0 HA GLN A 266 -6.294 -11.284 -0.572 1.00 0.00 H new ATOM 0 HB2 GLN A 266 -3.740 -11.523 0.997 1.00 0.00 H new ATOM 0 HB3 GLN A 266 -5.086 -12.549 1.453 1.00 0.00 H new ATOM 0 HG2 GLN A 266 -5.171 -13.113 -1.124 1.00 0.00 H new ATOM 0 HG3 GLN A 266 -3.526 -12.507 -1.122 1.00 0.00 H new ATOM 0 HE21 GLN A 266 -5.556 -14.582 1.025 1.00 0.00 H new ATOM 0 HE22 GLN A 266 -4.360 -15.872 1.184 1.00 0.00 H new ATOM 858 N PRO A 267 -7.422 -11.323 1.823 1.00 0.00 N ATOM 859 CA PRO A 267 -8.303 -11.027 2.958 1.00 0.00 C ATOM 860 C PRO A 267 -7.526 -10.853 4.259 1.00 0.00 C ATOM 861 O PRO A 267 -6.662 -11.665 4.591 1.00 0.00 O ATOM 862 CB PRO A 267 -9.218 -12.256 3.044 1.00 0.00 C ATOM 863 CG PRO A 267 -9.093 -12.933 1.722 1.00 0.00 C ATOM 864 CD PRO A 267 -7.701 -12.644 1.241 1.00 0.00 C ATOM 0 HA PRO A 267 -8.844 -10.091 2.816 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -8.913 -12.917 3.855 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -10.250 -11.965 3.241 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -9.259 -14.006 1.816 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -9.835 -12.556 1.019 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -6.990 -13.396 1.585 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -7.645 -12.626 0.153 1.00 0.00 H new ATOM 872 N LYS A 268 -7.840 -9.791 4.994 1.00 0.00 N ATOM 873 CA LYS A 268 -7.172 -9.511 6.260 1.00 0.00 C ATOM 874 C LYS A 268 -5.672 -9.313 6.063 1.00 0.00 C ATOM 875 O LYS A 268 -4.886 -9.494 6.994 1.00 0.00 O ATOM 876 CB LYS A 268 -7.421 -10.650 7.252 1.00 0.00 C ATOM 877 CG LYS A 268 -8.728 -10.519 8.016 1.00 0.00 C ATOM 878 CD LYS A 268 -8.657 -9.415 9.058 1.00 0.00 C ATOM 879 CE LYS A 268 -10.016 -9.149 9.682 1.00 0.00 C ATOM 880 NZ LYS A 268 -9.899 -8.493 11.012 1.00 0.00 N ATOM 0 H LYS A 268 -8.553 -9.110 4.734 1.00 0.00 H new ATOM 0 HA LYS A 268 -7.588 -8.586 6.660 1.00 0.00 H new ATOM 0 HB2 LYS A 268 -7.419 -11.597 6.712 1.00 0.00 H new ATOM 0 HB3 LYS A 268 -6.596 -10.687 7.964 1.00 0.00 H new ATOM 0 HG2 LYS A 268 -9.539 -10.310 7.318 1.00 0.00 H new ATOM 0 HG3 LYS A 268 -8.962 -11.466 8.503 1.00 0.00 H new ATOM 0 HD2 LYS A 268 -7.946 -9.693 9.836 1.00 0.00 H new ATOM 0 HD3 LYS A 268 -8.282 -8.501 8.596 1.00 0.00 H new ATOM 0 HE2 LYS A 268 -10.603 -8.517 9.016 1.00 0.00 H new ATOM 0 HE3 LYS A 268 -10.557 -10.089 9.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 -10.849 -8.329 11.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 -9.361 -9.107 11.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 -9.406 -7.583 10.908 1.00 0.00 H new ATOM 894 N TYR A 269 -5.279 -8.936 4.849 1.00 0.00 N ATOM 895 CA TYR A 269 -3.869 -8.712 4.540 1.00 0.00 C ATOM 896 C TYR A 269 -3.594 -7.233 4.272 1.00 0.00 C ATOM 897 O TYR A 269 -2.450 -6.787 4.336 1.00 0.00 O ATOM 898 CB TYR A 269 -3.451 -9.542 3.323 1.00 0.00 C ATOM 899 CG TYR A 269 -2.950 -10.928 3.668 1.00 0.00 C ATOM 900 CD1 TYR A 269 -3.564 -11.687 4.655 1.00 0.00 C ATOM 901 CD2 TYR A 269 -1.860 -11.475 3.001 1.00 0.00 C ATOM 902 CE1 TYR A 269 -3.108 -12.954 4.968 1.00 0.00 C ATOM 903 CE2 TYR A 269 -1.398 -12.742 3.309 1.00 0.00 C ATOM 904 CZ TYR A 269 -2.026 -13.476 4.292 1.00 0.00 C ATOM 905 OH TYR A 269 -1.569 -14.736 4.602 1.00 0.00 O ATOM 0 H TYR A 269 -5.914 -8.780 4.066 1.00 0.00 H new ATOM 0 HA TYR A 269 -3.284 -9.023 5.406 1.00 0.00 H new ATOM 0 HB2 TYR A 269 -4.302 -9.632 2.647 1.00 0.00 H new ATOM 0 HB3 TYR A 269 -2.669 -9.008 2.783 1.00 0.00 H new ATOM 0 HD1 TYR A 269 -4.412 -11.281 5.187 1.00 0.00 H new ATOM 0 HD2 TYR A 269 -1.366 -10.902 2.230 1.00 0.00 H new ATOM 0 HE1 TYR A 269 -3.597 -13.532 5.738 1.00 0.00 H new ATOM 0 HE2 TYR A 269 -0.550 -13.154 2.782 1.00 0.00 H new ATOM 0 HH TYR A 269 -0.801 -14.954 4.034 1.00 0.00 H new ATOM 915 N GLY A 270 -4.645 -6.477 3.966 1.00 0.00 N ATOM 916 CA GLY A 270 -4.484 -5.062 3.691 1.00 0.00 C ATOM 917 C GLY A 270 -4.375 -4.226 4.953 1.00 0.00 C ATOM 918 O GLY A 270 -5.225 -4.317 5.839 1.00 0.00 O ATOM 0 H GLY A 270 -5.604 -6.820 3.904 1.00 0.00 H new ATOM 0 HA2 GLY A 270 -3.591 -4.914 3.084 1.00 0.00 H new ATOM 0 HA3 GLY A 270 -5.331 -4.712 3.101 1.00 0.00 H new ATOM 922 N LEU A 271 -3.329 -3.412 5.028 1.00 0.00 N ATOM 923 CA LEU A 271 -3.109 -2.551 6.186 1.00 0.00 C ATOM 924 C LEU A 271 -2.810 -1.121 5.743 1.00 0.00 C ATOM 925 O LEU A 271 -1.948 -0.893 4.896 1.00 0.00 O ATOM 926 CB LEU A 271 -1.960 -3.091 7.039 1.00 0.00 C ATOM 927 CG LEU A 271 -2.034 -2.741 8.525 1.00 0.00 C ATOM 928 CD1 LEU A 271 -3.272 -3.360 9.161 1.00 0.00 C ATOM 929 CD2 LEU A 271 -0.774 -3.203 9.245 1.00 0.00 C ATOM 0 H LEU A 271 -2.619 -3.329 4.301 1.00 0.00 H new ATOM 0 HA LEU A 271 -4.019 -2.544 6.787 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -1.932 -4.176 6.938 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -1.021 -2.710 6.638 1.00 0.00 H new ATOM 0 HG LEU A 271 -2.107 -1.658 8.620 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -3.307 -3.099 10.219 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -4.165 -2.980 8.664 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -3.232 -4.444 9.056 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -0.844 -2.946 10.302 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.671 -4.283 9.141 1.00 0.00 H new ATOM 0 HD23 LEU A 271 0.095 -2.711 8.809 1.00 0.00 H new ATOM 941 N PHE A 272 -3.534 -0.165 6.314 1.00 0.00 N ATOM 942 CA PHE A 272 -3.354 1.241 5.969 1.00 0.00 C ATOM 943 C PHE A 272 -2.667 2.006 7.096 1.00 0.00 C ATOM 944 O PHE A 272 -3.243 2.199 8.164 1.00 0.00 O ATOM 945 CB PHE A 272 -4.710 1.885 5.670 1.00 0.00 C ATOM 946 CG PHE A 272 -5.261 1.540 4.318 1.00 0.00 C ATOM 947 CD1 PHE A 272 -5.379 0.218 3.919 1.00 0.00 C ATOM 948 CD2 PHE A 272 -5.666 2.538 3.445 1.00 0.00 C ATOM 949 CE1 PHE A 272 -5.892 -0.101 2.676 1.00 0.00 C ATOM 950 CE2 PHE A 272 -6.179 2.224 2.201 1.00 0.00 C ATOM 951 CZ PHE A 272 -6.292 0.902 1.816 1.00 0.00 C ATOM 0 H PHE A 272 -4.251 -0.338 7.018 1.00 0.00 H new ATOM 0 HA PHE A 272 -2.720 1.288 5.084 1.00 0.00 H new ATOM 0 HB2 PHE A 272 -5.425 1.575 6.433 1.00 0.00 H new ATOM 0 HB3 PHE A 272 -4.612 2.968 5.746 1.00 0.00 H new ATOM 0 HD1 PHE A 272 -5.067 -0.571 4.587 1.00 0.00 H new ATOM 0 HD2 PHE A 272 -5.580 3.573 3.741 1.00 0.00 H new ATOM 0 HE1 PHE A 272 -5.980 -1.135 2.377 1.00 0.00 H new ATOM 0 HE2 PHE A 272 -6.491 3.011 1.531 1.00 0.00 H new ATOM 0 HZ PHE A 272 -6.692 0.654 0.844 1.00 0.00 H new ATOM 961 N ALA A 273 -1.439 2.457 6.846 1.00 0.00 N ATOM 962 CA ALA A 273 -0.689 3.219 7.841 1.00 0.00 C ATOM 963 C ALA A 273 0.118 4.334 7.180 1.00 0.00 C ATOM 964 O ALA A 273 0.577 4.197 6.047 1.00 0.00 O ATOM 965 CB ALA A 273 0.231 2.309 8.645 1.00 0.00 C ATOM 0 H ALA A 273 -0.944 2.308 5.966 1.00 0.00 H new ATOM 0 HA ALA A 273 -1.409 3.671 8.523 1.00 0.00 H new ATOM 0 HB1 ALA A 273 0.778 2.901 9.379 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -0.363 1.553 9.159 1.00 0.00 H new ATOM 0 HB3 ALA A 273 0.937 1.821 7.974 1.00 0.00 H new ATOM 971 N PRO A 274 0.302 5.460 7.890 1.00 0.00 N ATOM 972 CA PRO A 274 1.055 6.609 7.382 1.00 0.00 C ATOM 973 C PRO A 274 2.395 6.211 6.775 1.00 0.00 C ATOM 974 O PRO A 274 2.899 5.115 7.022 1.00 0.00 O ATOM 975 CB PRO A 274 1.279 7.466 8.626 1.00 0.00 C ATOM 976 CG PRO A 274 0.146 7.132 9.531 1.00 0.00 C ATOM 977 CD PRO A 274 -0.216 5.697 9.250 1.00 0.00 C ATOM 0 HA PRO A 274 0.518 7.117 6.581 1.00 0.00 H new ATOM 0 HB2 PRO A 274 2.238 7.241 9.093 1.00 0.00 H new ATOM 0 HB3 PRO A 274 1.287 8.527 8.378 1.00 0.00 H new ATOM 0 HG2 PRO A 274 0.431 7.263 10.575 1.00 0.00 H new ATOM 0 HG3 PRO A 274 -0.704 7.790 9.348 1.00 0.00 H new ATOM 0 HD2 PRO A 274 0.239 5.021 9.974 1.00 0.00 H new ATOM 0 HD3 PRO A 274 -1.293 5.540 9.300 1.00 0.00 H new ATOM 985 N VAL A 275 2.971 7.114 5.990 1.00 0.00 N ATOM 986 CA VAL A 275 4.261 6.860 5.354 1.00 0.00 C ATOM 987 C VAL A 275 5.364 6.805 6.401 1.00 0.00 C ATOM 988 O VAL A 275 6.236 5.936 6.356 1.00 0.00 O ATOM 989 CB VAL A 275 4.641 7.938 4.310 1.00 0.00 C ATOM 990 CG1 VAL A 275 5.232 7.289 3.069 1.00 0.00 C ATOM 991 CG2 VAL A 275 3.448 8.806 3.943 1.00 0.00 C ATOM 0 H VAL A 275 2.568 8.027 5.778 1.00 0.00 H new ATOM 0 HA VAL A 275 4.161 5.904 4.839 1.00 0.00 H new ATOM 0 HB VAL A 275 5.393 8.586 4.760 1.00 0.00 H new ATOM 0 HG11 VAL A 275 5.494 8.060 2.345 1.00 0.00 H new ATOM 0 HG12 VAL A 275 6.126 6.729 3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 275 4.500 6.612 2.629 1.00 0.00 H new ATOM 0 HG21 VAL A 275 3.753 9.551 3.208 1.00 0.00 H new ATOM 0 HG22 VAL A 275 2.660 8.182 3.522 1.00 0.00 H new ATOM 0 HG23 VAL A 275 3.075 9.308 4.836 1.00 0.00 H new ATOM 1001 N HIS A 276 5.324 7.747 7.334 1.00 0.00 N ATOM 1002 CA HIS A 276 6.327 7.814 8.387 1.00 0.00 C ATOM 1003 C HIS A 276 6.201 6.630 9.343 1.00 0.00 C ATOM 1004 O HIS A 276 7.176 6.235 9.982 1.00 0.00 O ATOM 1005 CB HIS A 276 6.219 9.134 9.154 1.00 0.00 C ATOM 1006 CG HIS A 276 4.815 9.533 9.492 1.00 0.00 C ATOM 1007 ND1 HIS A 276 3.784 8.815 10.001 1.00 0.00 N flip ATOM 1008 CD2 HIS A 276 4.334 10.813 9.315 1.00 0.00 C flip ATOM 1009 CE1 HIS A 276 2.713 9.667 10.119 1.00 0.00 C flip ATOM 1010 NE2 HIS A 276 3.072 10.865 9.699 1.00 0.00 N flip ATOM 0 H HIS A 276 4.609 8.473 7.383 1.00 0.00 H new ATOM 0 HA HIS A 276 7.309 7.766 7.916 1.00 0.00 H new ATOM 0 HB2 HIS A 276 6.794 9.054 10.076 1.00 0.00 H new ATOM 0 HB3 HIS A 276 6.677 9.925 8.560 1.00 0.00 H new ATOM 0 HD2 HIS A 276 4.902 11.644 8.923 1.00 0.00 H new ATOM 0 HE1 HIS A 276 1.736 9.400 10.494 1.00 0.00 H new ATOM 0 HE2 HIS A 276 2.475 11.692 9.675 1.00 0.00 H new ATOM 1019 N LYS A 277 5.002 6.061 9.430 1.00 0.00 N ATOM 1020 CA LYS A 277 4.767 4.915 10.303 1.00 0.00 C ATOM 1021 C LYS A 277 5.298 3.636 9.673 1.00 0.00 C ATOM 1022 O LYS A 277 5.546 2.649 10.365 1.00 0.00 O ATOM 1023 CB LYS A 277 3.275 4.761 10.602 1.00 0.00 C ATOM 1024 CG LYS A 277 2.775 5.672 11.710 1.00 0.00 C ATOM 1025 CD LYS A 277 2.393 4.877 12.950 1.00 0.00 C ATOM 1026 CE LYS A 277 3.524 4.846 13.966 1.00 0.00 C ATOM 1027 NZ LYS A 277 4.059 6.207 14.245 1.00 0.00 N ATOM 0 H LYS A 277 4.182 6.373 8.910 1.00 0.00 H new ATOM 0 HA LYS A 277 5.299 5.094 11.237 1.00 0.00 H new ATOM 0 HB2 LYS A 277 2.709 4.965 9.693 1.00 0.00 H new ATOM 0 HB3 LYS A 277 3.074 3.726 10.877 1.00 0.00 H new ATOM 0 HG2 LYS A 277 3.548 6.397 11.964 1.00 0.00 H new ATOM 0 HG3 LYS A 277 1.912 6.237 11.358 1.00 0.00 H new ATOM 0 HD2 LYS A 277 1.506 5.317 13.406 1.00 0.00 H new ATOM 0 HD3 LYS A 277 2.132 3.858 12.664 1.00 0.00 H new ATOM 0 HE2 LYS A 277 3.166 4.400 14.894 1.00 0.00 H new ATOM 0 HE3 LYS A 277 4.327 4.209 13.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 277 4.370 6.261 15.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 277 4.866 6.398 13.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 277 3.315 6.914 14.077 1.00 0.00 H new ATOM 1041 N VAL A 278 5.476 3.656 8.356 1.00 0.00 N ATOM 1042 CA VAL A 278 5.985 2.494 7.644 1.00 0.00 C ATOM 1043 C VAL A 278 7.498 2.572 7.478 1.00 0.00 C ATOM 1044 O VAL A 278 8.048 3.636 7.194 1.00 0.00 O ATOM 1045 CB VAL A 278 5.334 2.338 6.257 1.00 0.00 C ATOM 1046 CG1 VAL A 278 5.732 1.014 5.627 1.00 0.00 C ATOM 1047 CG2 VAL A 278 3.820 2.448 6.355 1.00 0.00 C ATOM 0 H VAL A 278 5.276 4.462 7.764 1.00 0.00 H new ATOM 0 HA VAL A 278 5.729 1.624 8.248 1.00 0.00 H new ATOM 0 HB VAL A 278 5.694 3.146 5.620 1.00 0.00 H new ATOM 0 HG11 VAL A 278 5.263 0.921 4.648 1.00 0.00 H new ATOM 0 HG12 VAL A 278 6.816 0.975 5.515 1.00 0.00 H new ATOM 0 HG13 VAL A 278 5.404 0.194 6.266 1.00 0.00 H new ATOM 0 HG21 VAL A 278 3.382 2.335 5.363 1.00 0.00 H new ATOM 0 HG22 VAL A 278 3.440 1.665 7.011 1.00 0.00 H new ATOM 0 HG23 VAL A 278 3.552 3.423 6.761 1.00 0.00 H new ATOM 1057 N THR A 279 8.164 1.437 7.662 1.00 0.00 N ATOM 1058 CA THR A 279 9.615 1.374 7.538 1.00 0.00 C ATOM 1059 C THR A 279 10.037 0.217 6.641 1.00 0.00 C ATOM 1060 O THR A 279 9.512 -0.891 6.753 1.00 0.00 O ATOM 1061 CB THR A 279 10.256 1.226 8.919 1.00 0.00 C ATOM 1062 OG1 THR A 279 9.338 1.575 9.940 1.00 0.00 O ATOM 1063 CG2 THR A 279 11.490 2.081 9.103 1.00 0.00 C ATOM 0 H THR A 279 7.722 0.549 7.897 1.00 0.00 H new ATOM 0 HA THR A 279 9.957 2.303 7.082 1.00 0.00 H new ATOM 0 HB THR A 279 10.546 0.178 8.989 1.00 0.00 H new ATOM 0 HG1 THR A 279 9.767 1.472 10.815 1.00 0.00 H new ATOM 0 HG21 THR A 279 11.893 1.927 10.104 1.00 0.00 H new ATOM 0 HG22 THR A 279 12.240 1.802 8.363 1.00 0.00 H new ATOM 0 HG23 THR A 279 11.227 3.131 8.975 1.00 0.00 H new ATOM 1071 N LYS A 280 10.989 0.478 5.751 1.00 0.00 N ATOM 1072 CA LYS A 280 11.481 -0.546 4.836 1.00 0.00 C ATOM 1073 C LYS A 280 12.116 -1.702 5.604 1.00 0.00 C ATOM 1074 O LYS A 280 12.880 -1.489 6.546 1.00 0.00 O ATOM 1075 CB LYS A 280 12.497 0.060 3.862 1.00 0.00 C ATOM 1076 CG LYS A 280 12.196 -0.245 2.403 1.00 0.00 C ATOM 1077 CD LYS A 280 13.393 0.051 1.514 1.00 0.00 C ATOM 1078 CE LYS A 280 13.743 1.529 1.528 1.00 0.00 C ATOM 1079 NZ LYS A 280 14.835 1.832 2.496 1.00 0.00 N ATOM 0 H LYS A 280 11.435 1.389 5.644 1.00 0.00 H new ATOM 0 HA LYS A 280 10.634 -0.934 4.271 1.00 0.00 H new ATOM 0 HB2 LYS A 280 12.522 1.141 4.001 1.00 0.00 H new ATOM 0 HB3 LYS A 280 13.491 -0.316 4.106 1.00 0.00 H new ATOM 0 HG2 LYS A 280 11.915 -1.293 2.300 1.00 0.00 H new ATOM 0 HG3 LYS A 280 11.342 0.348 2.075 1.00 0.00 H new ATOM 0 HD2 LYS A 280 14.251 -0.531 1.851 1.00 0.00 H new ATOM 0 HD3 LYS A 280 13.176 -0.263 0.493 1.00 0.00 H new ATOM 0 HE2 LYS A 280 14.047 1.840 0.528 1.00 0.00 H new ATOM 0 HE3 LYS A 280 12.857 2.109 1.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 15.330 2.698 2.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 14.430 1.970 3.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 15.508 1.040 2.519 1.00 0.00 H new ATOM 1093 N ILE A 281 11.796 -2.925 5.193 1.00 0.00 N ATOM 1094 CA ILE A 281 12.337 -4.114 5.841 1.00 0.00 C ATOM 1095 C ILE A 281 13.580 -4.616 5.113 1.00 0.00 C ATOM 1096 O ILE A 281 14.471 -5.209 5.722 1.00 0.00 O ATOM 1097 CB ILE A 281 11.289 -5.245 5.901 1.00 0.00 C ATOM 1098 CG1 ILE A 281 11.845 -6.447 6.668 1.00 0.00 C ATOM 1099 CG2 ILE A 281 10.864 -5.654 4.499 1.00 0.00 C ATOM 1100 CD1 ILE A 281 10.771 -7.335 7.260 1.00 0.00 C ATOM 0 H ILE A 281 11.165 -3.118 4.415 1.00 0.00 H new ATOM 0 HA ILE A 281 12.608 -3.830 6.858 1.00 0.00 H new ATOM 0 HB ILE A 281 10.411 -4.875 6.430 1.00 0.00 H new ATOM 0 HG12 ILE A 281 12.467 -7.040 5.997 1.00 0.00 H new ATOM 0 HG13 ILE A 281 12.492 -6.089 7.469 1.00 0.00 H new ATOM 0 HG21 ILE A 281 10.125 -6.453 4.561 1.00 0.00 H new ATOM 0 HG22 ILE A 281 10.429 -4.796 3.986 1.00 0.00 H new ATOM 0 HG23 ILE A 281 11.733 -6.007 3.944 1.00 0.00 H new ATOM 0 HD11 ILE A 281 11.237 -8.166 7.789 1.00 0.00 H new ATOM 0 HD12 ILE A 281 10.164 -6.757 7.956 1.00 0.00 H new ATOM 0 HD13 ILE A 281 10.138 -7.722 6.462 1.00 0.00 H new ATOM 1198 N GLU B 449 -2.119 4.149 14.554 1.00 0.00 N ATOM 1199 CA GLU B 449 -2.228 5.003 13.377 1.00 0.00 C ATOM 1200 C GLU B 449 -2.373 4.177 12.107 1.00 0.00 C ATOM 1201 O GLU B 449 -1.990 4.621 11.028 1.00 0.00 O ATOM 1202 CB GLU B 449 -0.998 5.905 13.248 1.00 0.00 C ATOM 1203 CG GLU B 449 -0.424 6.362 14.580 1.00 0.00 C ATOM 1204 CD GLU B 449 -1.283 7.415 15.255 1.00 0.00 C ATOM 1205 OE1 GLU B 449 -2.194 7.037 16.020 1.00 0.00 O ATOM 1206 OE2 GLU B 449 -1.044 8.617 15.016 1.00 0.00 O ATOM 0 HA GLU B 449 -3.120 5.617 13.504 1.00 0.00 H new ATOM 0 HB2 GLU B 449 -0.225 5.371 12.695 1.00 0.00 H new ATOM 0 HB3 GLU B 449 -1.264 6.782 12.658 1.00 0.00 H new ATOM 0 HG2 GLU B 449 -0.323 5.502 15.242 1.00 0.00 H new ATOM 0 HG3 GLU B 449 0.577 6.762 14.422 1.00 0.00 H new ATOM 1213 N GLU B 450 -2.920 2.975 12.232 1.00 0.00 N ATOM 1214 CA GLU B 450 -3.095 2.112 11.074 1.00 0.00 C ATOM 1215 C GLU B 450 -4.463 1.435 11.090 1.00 0.00 C ATOM 1216 O GLU B 450 -5.065 1.246 12.147 1.00 0.00 O ATOM 1217 CB GLU B 450 -1.974 1.068 11.016 1.00 0.00 C ATOM 1218 CG GLU B 450 -2.192 -0.131 11.928 1.00 0.00 C ATOM 1219 CD GLU B 450 -0.944 -0.513 12.699 1.00 0.00 C ATOM 1220 OE1 GLU B 450 -0.161 0.396 13.050 1.00 0.00 O ATOM 1221 OE2 GLU B 450 -0.749 -1.720 12.952 1.00 0.00 O ATOM 0 H GLU B 450 -3.247 2.580 13.114 1.00 0.00 H new ATOM 0 HA GLU B 450 -3.043 2.731 10.178 1.00 0.00 H new ATOM 0 HB2 GLU B 450 -1.873 0.716 9.989 1.00 0.00 H new ATOM 0 HB3 GLU B 450 -1.032 1.547 11.283 1.00 0.00 H new ATOM 0 HG2 GLU B 450 -2.994 0.093 12.631 1.00 0.00 H new ATOM 0 HG3 GLU B 450 -2.520 -0.982 11.331 1.00 0.00 H new ATOM 1228 N TYR B 451 -4.949 1.075 9.906 1.00 0.00 N ATOM 1229 CA TYR B 451 -6.245 0.423 9.772 1.00 0.00 C ATOM 1230 C TYR B 451 -6.185 -0.709 8.754 1.00 0.00 C ATOM 1231 O TYR B 451 -5.081 -1.247 8.533 1.00 0.00 O ATOM 1232 CB TYR B 451 -7.307 1.442 9.355 1.00 0.00 C ATOM 1233 CG TYR B 451 -7.829 2.277 10.502 1.00 0.00 C ATOM 1234 CD1 TYR B 451 -7.143 3.403 10.936 1.00 0.00 C ATOM 1235 CD2 TYR B 451 -9.010 1.937 11.150 1.00 0.00 C ATOM 1236 CE1 TYR B 451 -7.618 4.167 11.986 1.00 0.00 C ATOM 1237 CE2 TYR B 451 -9.491 2.697 12.200 1.00 0.00 C ATOM 1238 CZ TYR B 451 -8.792 3.810 12.613 1.00 0.00 C ATOM 1239 OH TYR B 451 -9.269 4.569 13.657 1.00 0.00 O ATOM 1240 OXT TYR B 451 -7.244 -1.050 8.187 1.00 0.00 O ATOM 0 H TYR B 451 -4.461 1.225 9.023 1.00 0.00 H new ATOM 0 HA TYR B 451 -6.513 0.000 10.740 1.00 0.00 H new ATOM 0 HB2 TYR B 451 -6.886 2.103 8.597 1.00 0.00 H new ATOM 0 HB3 TYR B 451 -8.141 0.916 8.891 1.00 0.00 H new ATOM 0 HD1 TYR B 451 -6.224 3.687 10.446 1.00 0.00 H new ATOM 0 HD2 TYR B 451 -9.561 1.065 10.829 1.00 0.00 H new ATOM 0 HE1 TYR B 451 -7.072 5.039 12.313 1.00 0.00 H new ATOM 0 HE2 TYR B 451 -10.410 2.419 12.694 1.00 0.00 H new ATOM 0 HH TYR B 451 -10.107 4.182 13.987 1.00 0.00 H new