USER MOD reduce.3.24.130724 H: found=0, std=0, add=536, rem=0, adj=11 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=0.000658 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 THR OG1 : rot -22:sc= -3.05! USER MOD Single : A 238 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 CYS SG : rot 180:sc= -3.74! USER MOD Single : A 252 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 253 ASN : amide:sc= 0.199 K(o=0.2,f=-9!) USER MOD Single : A 260 THR OG1 : rot -139:sc= 0.0546 USER MOD Single : A 262 TYR OH : rot -15:sc= -1.01 USER MOD Single : A 264 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 265 CYS SG : rot -129:sc= -0.945 USER MOD Single : A 266 GLN : amide:sc= -0.534 X(o=-0.53,f=-0.22) USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 269 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 276 HIS :FLIP no HD1:sc= -4.52! C(o=-5.7!,f=-4.5!) USER MOD Single : A 277 LYS NZ :NH3+ -161:sc= -1.29 (180deg=-2.96!) 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 5.913 2.202 -4.390 1.00 0.00 N ATOM 81 CA ILE A 214 5.003 1.068 -4.470 1.00 0.00 C ATOM 82 C ILE A 214 5.737 -0.197 -4.905 1.00 0.00 C ATOM 83 O ILE A 214 6.642 -0.145 -5.738 1.00 0.00 O ATOM 84 CB ILE A 214 3.844 1.343 -5.449 1.00 0.00 C ATOM 85 CG1 ILE A 214 3.149 2.658 -5.088 1.00 0.00 C ATOM 86 CG2 ILE A 214 2.849 0.188 -5.441 1.00 0.00 C ATOM 87 CD1 ILE A 214 1.961 2.978 -5.968 1.00 0.00 C ATOM 0 HA ILE A 214 4.594 0.920 -3.471 1.00 0.00 H new ATOM 0 HB ILE A 214 4.252 1.431 -6.456 1.00 0.00 H new ATOM 0 HG12 ILE A 214 2.819 2.612 -4.050 1.00 0.00 H new ATOM 0 HG13 ILE A 214 3.871 3.472 -5.157 1.00 0.00 H new ATOM 0 HG21 ILE A 214 2.039 0.401 -6.138 1.00 0.00 H new ATOM 0 HG22 ILE A 214 3.354 -0.730 -5.742 1.00 0.00 H new ATOM 0 HG23 ILE A 214 2.442 0.066 -4.437 1.00 0.00 H new ATOM 0 HD11 ILE A 214 1.519 3.923 -5.653 1.00 0.00 H new ATOM 0 HD12 ILE A 214 2.287 3.057 -7.005 1.00 0.00 H new ATOM 0 HD13 ILE A 214 1.219 2.184 -5.881 1.00 0.00 H new ATOM 99 N GLY A 215 5.343 -1.328 -4.331 1.00 0.00 N ATOM 100 CA GLY A 215 5.977 -2.590 -4.668 1.00 0.00 C ATOM 101 C GLY A 215 7.200 -2.878 -3.816 1.00 0.00 C ATOM 102 O GLY A 215 7.844 -3.914 -3.978 1.00 0.00 O ATOM 0 H GLY A 215 4.597 -1.394 -3.639 1.00 0.00 H new ATOM 0 HA2 GLY A 215 5.256 -3.398 -4.546 1.00 0.00 H new ATOM 0 HA3 GLY A 215 6.266 -2.577 -5.719 1.00 0.00 H new ATOM 106 N ASP A 216 7.524 -1.961 -2.908 1.00 0.00 N ATOM 107 CA ASP A 216 8.679 -2.125 -2.034 1.00 0.00 C ATOM 108 C ASP A 216 8.277 -2.756 -0.705 1.00 0.00 C ATOM 109 O ASP A 216 7.181 -2.516 -0.199 1.00 0.00 O ATOM 110 CB ASP A 216 9.352 -0.774 -1.786 1.00 0.00 C ATOM 111 CG ASP A 216 9.958 -0.189 -3.046 1.00 0.00 C ATOM 112 OD1 ASP A 216 9.323 -0.298 -4.116 1.00 0.00 O ATOM 113 OD2 ASP A 216 11.068 0.379 -2.964 1.00 0.00 O ATOM 0 H ASP A 216 7.002 -1.097 -2.759 1.00 0.00 H new ATOM 0 HA ASP A 216 9.384 -2.791 -2.531 1.00 0.00 H new ATOM 0 HB2 ASP A 216 8.620 -0.076 -1.380 1.00 0.00 H new ATOM 0 HB3 ASP A 216 10.131 -0.892 -1.033 1.00 0.00 H new ATOM 118 N ARG A 217 9.175 -3.560 -0.144 1.00 0.00 N ATOM 119 CA ARG A 217 8.917 -4.221 1.130 1.00 0.00 C ATOM 120 C ARG A 217 9.074 -3.237 2.281 1.00 0.00 C ATOM 121 O ARG A 217 10.027 -2.458 2.319 1.00 0.00 O ATOM 122 CB ARG A 217 9.868 -5.404 1.318 1.00 0.00 C ATOM 123 CG ARG A 217 9.474 -6.327 2.459 1.00 0.00 C ATOM 124 CD ARG A 217 8.416 -7.328 2.025 1.00 0.00 C ATOM 125 NE ARG A 217 9.007 -8.575 1.544 1.00 0.00 N ATOM 126 CZ ARG A 217 8.337 -9.721 1.438 1.00 0.00 C ATOM 127 NH1 ARG A 217 7.056 -9.782 1.779 1.00 0.00 N ATOM 128 NH2 ARG A 217 8.950 -10.807 0.989 1.00 0.00 N ATOM 0 H ARG A 217 10.087 -3.769 -0.551 1.00 0.00 H new ATOM 0 HA ARG A 217 7.892 -4.592 1.124 1.00 0.00 H new ATOM 0 HB2 ARG A 217 9.906 -5.979 0.393 1.00 0.00 H new ATOM 0 HB3 ARG A 217 10.874 -5.025 1.499 1.00 0.00 H new ATOM 0 HG2 ARG A 217 10.355 -6.859 2.818 1.00 0.00 H new ATOM 0 HG3 ARG A 217 9.097 -5.736 3.293 1.00 0.00 H new ATOM 0 HD2 ARG A 217 7.753 -7.541 2.863 1.00 0.00 H new ATOM 0 HD3 ARG A 217 7.803 -6.890 1.237 1.00 0.00 H new ATOM 0 HE ARG A 217 9.990 -8.567 1.274 1.00 0.00 H new ATOM 0 HH11 ARG A 217 6.580 -8.949 2.124 1.00 0.00 H new ATOM 0 HH12 ARG A 217 6.547 -10.662 1.696 1.00 0.00 H new ATOM 0 HH21 ARG A 217 9.934 -10.765 0.725 1.00 0.00 H new ATOM 0 HH22 ARG A 217 8.437 -11.685 0.908 1.00 0.00 H new ATOM 142 N VAL A 218 8.129 -3.267 3.213 1.00 0.00 N ATOM 143 CA VAL A 218 8.164 -2.366 4.356 1.00 0.00 C ATOM 144 C VAL A 218 7.427 -2.952 5.554 1.00 0.00 C ATOM 145 O VAL A 218 6.940 -4.082 5.511 1.00 0.00 O ATOM 146 CB VAL A 218 7.531 -1.004 4.010 1.00 0.00 C ATOM 147 CG1 VAL A 218 8.146 -0.434 2.741 1.00 0.00 C ATOM 148 CG2 VAL A 218 6.017 -1.134 3.866 1.00 0.00 C ATOM 0 H VAL A 218 7.332 -3.903 3.199 1.00 0.00 H new ATOM 0 HA VAL A 218 9.215 -2.229 4.612 1.00 0.00 H new ATOM 0 HB VAL A 218 7.736 -0.314 4.828 1.00 0.00 H new ATOM 0 HG11 VAL A 218 7.686 0.528 2.514 1.00 0.00 H new ATOM 0 HG12 VAL A 218 9.218 -0.298 2.885 1.00 0.00 H new ATOM 0 HG13 VAL A 218 7.976 -1.122 1.913 1.00 0.00 H new ATOM 0 HG21 VAL A 218 5.590 -0.161 3.622 1.00 0.00 H new ATOM 0 HG22 VAL A 218 5.787 -1.842 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 218 5.592 -1.492 4.804 1.00 0.00 H new ATOM 158 N LEU A 219 7.332 -2.158 6.614 1.00 0.00 N ATOM 159 CA LEU A 219 6.637 -2.571 7.821 1.00 0.00 C ATOM 160 C LEU A 219 5.552 -1.567 8.172 1.00 0.00 C ATOM 161 O LEU A 219 5.833 -0.388 8.384 1.00 0.00 O ATOM 162 CB LEU A 219 7.610 -2.699 8.994 1.00 0.00 C ATOM 163 CG LEU A 219 8.729 -3.726 8.815 1.00 0.00 C ATOM 164 CD1 LEU A 219 9.496 -3.897 10.116 1.00 0.00 C ATOM 165 CD2 LEU A 219 8.163 -5.058 8.347 1.00 0.00 C ATOM 0 H LEU A 219 7.731 -1.220 6.659 1.00 0.00 H new ATOM 0 HA LEU A 219 6.184 -3.544 7.632 1.00 0.00 H new ATOM 0 HB2 LEU A 219 8.062 -1.724 9.176 1.00 0.00 H new ATOM 0 HB3 LEU A 219 7.042 -2.959 9.887 1.00 0.00 H new ATOM 0 HG LEU A 219 9.417 -3.363 8.051 1.00 0.00 H new ATOM 0 HD11 LEU A 219 10.290 -4.631 9.976 1.00 0.00 H new ATOM 0 HD12 LEU A 219 9.932 -2.942 10.410 1.00 0.00 H new ATOM 0 HD13 LEU A 219 8.817 -4.241 10.896 1.00 0.00 H new ATOM 0 HD21 LEU A 219 8.974 -5.776 8.225 1.00 0.00 H new ATOM 0 HD22 LEU A 219 7.455 -5.433 9.086 1.00 0.00 H new ATOM 0 HD23 LEU A 219 7.653 -4.922 7.393 1.00 0.00 H new ATOM 177 N VAL A 220 4.315 -2.032 8.244 1.00 0.00 N ATOM 178 CA VAL A 220 3.199 -1.160 8.580 1.00 0.00 C ATOM 179 C VAL A 220 3.025 -1.091 10.094 1.00 0.00 C ATOM 180 O VAL A 220 2.656 -2.076 10.736 1.00 0.00 O ATOM 181 CB VAL A 220 1.869 -1.613 7.924 1.00 0.00 C ATOM 182 CG1 VAL A 220 1.262 -0.477 7.114 1.00 0.00 C ATOM 183 CG2 VAL A 220 2.073 -2.843 7.049 1.00 0.00 C ATOM 0 H VAL A 220 4.058 -3.005 8.075 1.00 0.00 H new ATOM 0 HA VAL A 220 3.438 -0.173 8.185 1.00 0.00 H new ATOM 0 HB VAL A 220 1.177 -1.883 8.722 1.00 0.00 H new ATOM 0 HG11 VAL A 220 0.329 -0.812 6.660 1.00 0.00 H new ATOM 0 HG12 VAL A 220 1.063 0.371 7.769 1.00 0.00 H new ATOM 0 HG13 VAL A 220 1.958 -0.176 6.331 1.00 0.00 H new ATOM 0 HG21 VAL A 220 1.122 -3.135 6.604 1.00 0.00 H new ATOM 0 HG22 VAL A 220 2.788 -2.613 6.259 1.00 0.00 H new ATOM 0 HG23 VAL A 220 2.456 -3.663 7.657 1.00 0.00 H new ATOM 193 N GLY A 221 3.314 0.078 10.658 1.00 0.00 N ATOM 194 CA GLY A 221 3.203 0.259 12.093 1.00 0.00 C ATOM 195 C GLY A 221 4.468 -0.146 12.830 1.00 0.00 C ATOM 196 O GLY A 221 4.581 0.058 14.038 1.00 0.00 O ATOM 0 H GLY A 221 3.623 0.904 10.145 1.00 0.00 H new ATOM 0 HA2 GLY A 221 2.980 1.304 12.308 1.00 0.00 H new ATOM 0 HA3 GLY A 221 2.365 -0.329 12.466 1.00 0.00 H new ATOM 200 N GLY A 222 5.424 -0.722 12.102 1.00 0.00 N ATOM 201 CA GLY A 222 6.674 -1.144 12.710 1.00 0.00 C ATOM 202 C GLY A 222 6.629 -2.575 13.208 1.00 0.00 C ATOM 203 O GLY A 222 7.660 -3.243 13.290 1.00 0.00 O ATOM 0 H GLY A 222 5.354 -0.904 11.101 1.00 0.00 H new ATOM 0 HA2 GLY A 222 7.480 -1.042 11.983 1.00 0.00 H new ATOM 0 HA3 GLY A 222 6.910 -0.481 13.542 1.00 0.00 H new ATOM 207 N THR A 223 5.433 -3.048 13.539 1.00 0.00 N ATOM 208 CA THR A 223 5.258 -4.407 14.031 1.00 0.00 C ATOM 209 C THR A 223 4.782 -5.330 12.916 1.00 0.00 C ATOM 210 O THR A 223 5.049 -6.533 12.935 1.00 0.00 O ATOM 211 CB THR A 223 4.256 -4.423 15.186 1.00 0.00 C ATOM 212 OG1 THR A 223 3.049 -3.783 14.812 1.00 0.00 O ATOM 213 CG2 THR A 223 4.774 -3.739 16.431 1.00 0.00 C ATOM 0 H THR A 223 4.570 -2.509 13.475 1.00 0.00 H new ATOM 0 HA THR A 223 6.222 -4.768 14.389 1.00 0.00 H new ATOM 0 HB THR A 223 4.088 -5.476 15.412 1.00 0.00 H new ATOM 0 HG1 THR A 223 2.420 -3.805 15.564 1.00 0.00 H new ATOM 0 HG21 THR A 223 4.016 -3.785 17.213 1.00 0.00 H new ATOM 0 HG22 THR A 223 5.679 -4.242 16.773 1.00 0.00 H new ATOM 0 HG23 THR A 223 5.001 -2.697 16.206 1.00 0.00 H new ATOM 221 N LYS A 224 4.074 -4.762 11.947 1.00 0.00 N ATOM 222 CA LYS A 224 3.558 -5.534 10.824 1.00 0.00 C ATOM 223 C LYS A 224 4.450 -5.366 9.599 1.00 0.00 C ATOM 224 O LYS A 224 5.050 -4.310 9.399 1.00 0.00 O ATOM 225 CB LYS A 224 2.126 -5.100 10.493 1.00 0.00 C ATOM 226 CG LYS A 224 1.287 -4.756 11.717 1.00 0.00 C ATOM 227 CD LYS A 224 0.674 -5.997 12.344 1.00 0.00 C ATOM 228 CE LYS A 224 1.699 -6.775 13.154 1.00 0.00 C ATOM 229 NZ LYS A 224 1.111 -7.336 14.401 1.00 0.00 N ATOM 0 H LYS A 224 3.844 -3.769 11.917 1.00 0.00 H new ATOM 0 HA LYS A 224 3.553 -6.586 11.108 1.00 0.00 H new ATOM 0 HB2 LYS A 224 2.163 -4.232 9.834 1.00 0.00 H new ATOM 0 HB3 LYS A 224 1.633 -5.899 9.940 1.00 0.00 H new ATOM 0 HG2 LYS A 224 1.909 -4.246 12.453 1.00 0.00 H new ATOM 0 HG3 LYS A 224 0.495 -4.063 11.433 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -0.157 -5.708 12.988 1.00 0.00 H new ATOM 0 HD3 LYS A 224 0.265 -6.637 11.562 1.00 0.00 H new ATOM 0 HE2 LYS A 224 2.103 -7.585 12.547 1.00 0.00 H new ATOM 0 HE3 LYS A 224 2.533 -6.121 13.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 1.842 -7.859 14.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 0.748 -6.561 14.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 0.331 -7.980 14.158 1.00 0.00 H new ATOM 243 N ALA A 225 4.537 -6.411 8.782 1.00 0.00 N ATOM 244 CA ALA A 225 5.359 -6.371 7.577 1.00 0.00 C ATOM 245 C ALA A 225 4.514 -6.582 6.330 1.00 0.00 C ATOM 246 O ALA A 225 3.519 -7.303 6.358 1.00 0.00 O ATOM 247 CB ALA A 225 6.459 -7.417 7.647 1.00 0.00 C ATOM 0 H ALA A 225 4.050 -7.294 8.932 1.00 0.00 H new ATOM 0 HA ALA A 225 5.816 -5.383 7.517 1.00 0.00 H new ATOM 0 HB1 ALA A 225 7.062 -7.372 6.740 1.00 0.00 H new ATOM 0 HB2 ALA A 225 7.092 -7.222 8.513 1.00 0.00 H new ATOM 0 HB3 ALA A 225 6.014 -8.408 7.738 1.00 0.00 H new ATOM 253 N GLY A 226 4.922 -5.951 5.233 1.00 0.00 N ATOM 254 CA GLY A 226 4.188 -6.088 3.991 1.00 0.00 C ATOM 255 C GLY A 226 4.827 -5.321 2.849 1.00 0.00 C ATOM 256 O GLY A 226 5.951 -4.834 2.970 1.00 0.00 O ATOM 0 H GLY A 226 5.745 -5.350 5.183 1.00 0.00 H new ATOM 0 HA2 GLY A 226 4.125 -7.143 3.725 1.00 0.00 H new ATOM 0 HA3 GLY A 226 3.167 -5.734 4.135 1.00 0.00 H new ATOM 260 N VAL A 227 4.105 -5.215 1.740 1.00 0.00 N ATOM 261 CA VAL A 227 4.600 -4.505 0.567 1.00 0.00 C ATOM 262 C VAL A 227 3.697 -3.325 0.225 1.00 0.00 C ATOM 263 O VAL A 227 2.474 -3.450 0.211 1.00 0.00 O ATOM 264 CB VAL A 227 4.697 -5.446 -0.654 1.00 0.00 C ATOM 265 CG1 VAL A 227 5.001 -4.664 -1.924 1.00 0.00 C ATOM 266 CG2 VAL A 227 5.750 -6.517 -0.416 1.00 0.00 C ATOM 0 H VAL A 227 3.172 -5.613 1.628 1.00 0.00 H new ATOM 0 HA VAL A 227 5.597 -4.135 0.808 1.00 0.00 H new ATOM 0 HB VAL A 227 3.731 -5.934 -0.785 1.00 0.00 H new ATOM 0 HG11 VAL A 227 5.064 -5.351 -2.768 1.00 0.00 H new ATOM 0 HG12 VAL A 227 4.207 -3.940 -2.104 1.00 0.00 H new ATOM 0 HG13 VAL A 227 5.950 -4.141 -1.811 1.00 0.00 H new ATOM 0 HG21 VAL A 227 5.806 -7.172 -1.286 1.00 0.00 H new ATOM 0 HG22 VAL A 227 6.719 -6.045 -0.254 1.00 0.00 H new ATOM 0 HG23 VAL A 227 5.481 -7.103 0.463 1.00 0.00 H new ATOM 276 N VAL A 228 4.307 -2.182 -0.061 1.00 0.00 N ATOM 277 CA VAL A 228 3.553 -0.987 -0.413 1.00 0.00 C ATOM 278 C VAL A 228 2.763 -1.213 -1.697 1.00 0.00 C ATOM 279 O VAL A 228 3.322 -1.611 -2.718 1.00 0.00 O ATOM 280 CB VAL A 228 4.478 0.230 -0.592 1.00 0.00 C ATOM 281 CG1 VAL A 228 3.664 1.500 -0.796 1.00 0.00 C ATOM 282 CG2 VAL A 228 5.409 0.368 0.605 1.00 0.00 C ATOM 0 H VAL A 228 5.319 -2.058 -0.056 1.00 0.00 H new ATOM 0 HA VAL A 228 2.865 -0.783 0.408 1.00 0.00 H new ATOM 0 HB VAL A 228 5.086 0.074 -1.483 1.00 0.00 H new ATOM 0 HG11 VAL A 228 4.338 2.348 -0.920 1.00 0.00 H new ATOM 0 HG12 VAL A 228 3.044 1.396 -1.686 1.00 0.00 H new ATOM 0 HG13 VAL A 228 3.027 1.667 0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 228 6.057 1.233 0.464 1.00 0.00 H new ATOM 0 HG22 VAL A 228 4.819 0.501 1.512 1.00 0.00 H new ATOM 0 HG23 VAL A 228 6.019 -0.531 0.697 1.00 0.00 H new ATOM 292 N ARG A 229 1.459 -0.973 -1.637 1.00 0.00 N ATOM 293 CA ARG A 229 0.594 -1.166 -2.794 1.00 0.00 C ATOM 294 C ARG A 229 0.036 0.161 -3.300 1.00 0.00 C ATOM 295 O ARG A 229 -0.228 0.320 -4.492 1.00 0.00 O ATOM 296 CB ARG A 229 -0.550 -2.119 -2.440 1.00 0.00 C ATOM 297 CG ARG A 229 -0.114 -3.307 -1.599 1.00 0.00 C ATOM 298 CD ARG A 229 0.963 -4.119 -2.297 1.00 0.00 C ATOM 299 NE ARG A 229 0.400 -5.236 -3.049 1.00 0.00 N ATOM 300 CZ ARG A 229 -0.010 -5.155 -4.313 1.00 0.00 C ATOM 301 NH1 ARG A 229 0.071 -4.007 -4.975 1.00 0.00 N ATOM 302 NH2 ARG A 229 -0.505 -6.225 -4.918 1.00 0.00 N ATOM 0 H ARG A 229 0.977 -0.645 -0.800 1.00 0.00 H new ATOM 0 HA ARG A 229 1.193 -1.603 -3.593 1.00 0.00 H new ATOM 0 HB2 ARG A 229 -1.319 -1.566 -1.901 1.00 0.00 H new ATOM 0 HB3 ARG A 229 -1.006 -2.484 -3.360 1.00 0.00 H new ATOM 0 HG2 ARG A 229 0.260 -2.955 -0.637 1.00 0.00 H new ATOM 0 HG3 ARG A 229 -0.975 -3.943 -1.393 1.00 0.00 H new ATOM 0 HD2 ARG A 229 1.525 -3.473 -2.972 1.00 0.00 H new ATOM 0 HD3 ARG A 229 1.669 -4.498 -1.558 1.00 0.00 H new ATOM 0 HE ARG A 229 0.315 -6.136 -2.576 1.00 0.00 H new ATOM 0 HH11 ARG A 229 0.450 -3.179 -4.515 1.00 0.00 H new ATOM 0 HH12 ARG A 229 -0.245 -3.953 -5.943 1.00 0.00 H new ATOM 0 HH21 ARG A 229 -0.572 -7.110 -4.415 1.00 0.00 H new ATOM 0 HH22 ARG A 229 -0.819 -6.164 -5.886 1.00 0.00 H new ATOM 316 N PHE A 230 -0.141 1.113 -2.389 1.00 0.00 N ATOM 317 CA PHE A 230 -0.667 2.424 -2.748 1.00 0.00 C ATOM 318 C PHE A 230 -0.353 3.448 -1.664 1.00 0.00 C ATOM 319 O PHE A 230 -0.220 3.102 -0.497 1.00 0.00 O ATOM 320 CB PHE A 230 -2.178 2.346 -2.971 1.00 0.00 C ATOM 321 CG PHE A 230 -2.726 3.487 -3.779 1.00 0.00 C ATOM 322 CD1 PHE A 230 -2.266 3.728 -5.063 1.00 0.00 C ATOM 323 CD2 PHE A 230 -3.703 4.319 -3.254 1.00 0.00 C ATOM 324 CE1 PHE A 230 -2.769 4.778 -5.809 1.00 0.00 C ATOM 325 CE2 PHE A 230 -4.210 5.370 -3.995 1.00 0.00 C ATOM 326 CZ PHE A 230 -3.742 5.599 -5.274 1.00 0.00 C ATOM 0 H PHE A 230 0.072 1.001 -1.398 1.00 0.00 H new ATOM 0 HA PHE A 230 -0.187 2.742 -3.674 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -2.415 1.409 -3.474 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -2.679 2.323 -2.003 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -1.506 3.088 -5.486 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -4.072 4.144 -2.254 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -2.401 4.956 -6.809 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -4.971 6.011 -3.574 1.00 0.00 H new ATOM 0 HZ PHE A 230 -4.137 6.419 -5.855 1.00 0.00 H new ATOM 336 N LEU A 231 -0.237 4.712 -2.056 1.00 0.00 N ATOM 337 CA LEU A 231 0.055 5.776 -1.101 1.00 0.00 C ATOM 338 C LEU A 231 -0.856 6.978 -1.329 1.00 0.00 C ATOM 339 O LEU A 231 -0.959 7.490 -2.443 1.00 0.00 O ATOM 340 CB LEU A 231 1.521 6.201 -1.202 1.00 0.00 C ATOM 341 CG LEU A 231 2.531 5.049 -1.187 1.00 0.00 C ATOM 342 CD1 LEU A 231 3.198 4.903 -2.546 1.00 0.00 C ATOM 343 CD2 LEU A 231 3.573 5.265 -0.100 1.00 0.00 C ATOM 0 H LEU A 231 -0.340 5.024 -3.022 1.00 0.00 H new ATOM 0 HA LEU A 231 -0.130 5.388 -0.099 1.00 0.00 H new ATOM 0 HB2 LEU A 231 1.656 6.771 -2.121 1.00 0.00 H new ATOM 0 HB3 LEU A 231 1.747 6.873 -0.374 1.00 0.00 H new ATOM 0 HG LEU A 231 1.994 4.126 -0.969 1.00 0.00 H new ATOM 0 HD11 LEU A 231 3.912 4.080 -2.514 1.00 0.00 H new ATOM 0 HD12 LEU A 231 2.441 4.698 -3.303 1.00 0.00 H new ATOM 0 HD13 LEU A 231 3.720 5.826 -2.796 1.00 0.00 H new ATOM 0 HD21 LEU A 231 4.281 4.437 -0.105 1.00 0.00 H new ATOM 0 HD22 LEU A 231 4.105 6.198 -0.286 1.00 0.00 H new ATOM 0 HD23 LEU A 231 3.081 5.315 0.871 1.00 0.00 H new ATOM 355 N GLY A 232 -1.516 7.422 -0.264 1.00 0.00 N ATOM 356 CA GLY A 232 -2.411 8.559 -0.368 1.00 0.00 C ATOM 357 C GLY A 232 -3.279 8.729 0.863 1.00 0.00 C ATOM 358 O GLY A 232 -3.111 8.017 1.852 1.00 0.00 O ATOM 0 H GLY A 232 -1.447 7.015 0.669 1.00 0.00 H new ATOM 0 HA2 GLY A 232 -1.825 9.465 -0.524 1.00 0.00 H new ATOM 0 HA3 GLY A 232 -3.048 8.437 -1.244 1.00 0.00 H new ATOM 362 N GLU A 233 -4.210 9.675 0.802 1.00 0.00 N ATOM 363 CA GLU A 233 -5.107 9.937 1.922 1.00 0.00 C ATOM 364 C GLU A 233 -6.244 8.919 1.958 1.00 0.00 C ATOM 365 O GLU A 233 -6.460 8.182 0.996 1.00 0.00 O ATOM 366 CB GLU A 233 -5.678 11.352 1.824 1.00 0.00 C ATOM 367 CG GLU A 233 -4.624 12.417 1.567 1.00 0.00 C ATOM 368 CD GLU A 233 -5.025 13.381 0.466 1.00 0.00 C ATOM 369 OE1 GLU A 233 -5.900 14.237 0.717 1.00 0.00 O ATOM 370 OE2 GLU A 233 -4.464 13.279 -0.645 1.00 0.00 O ATOM 0 H GLU A 233 -4.363 10.273 -0.010 1.00 0.00 H new ATOM 0 HA GLU A 233 -4.533 9.847 2.844 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -6.416 11.382 1.022 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -6.203 11.588 2.750 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -4.445 12.975 2.486 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -3.684 11.935 1.298 1.00 0.00 H new ATOM 377 N THR A 234 -6.966 8.887 3.072 1.00 0.00 N ATOM 378 CA THR A 234 -8.081 7.961 3.235 1.00 0.00 C ATOM 379 C THR A 234 -9.404 8.713 3.315 1.00 0.00 C ATOM 380 O THR A 234 -9.430 9.921 3.551 1.00 0.00 O ATOM 381 CB THR A 234 -7.888 7.111 4.491 1.00 0.00 C ATOM 382 OG1 THR A 234 -8.030 7.902 5.658 1.00 0.00 O ATOM 383 CG2 THR A 234 -6.535 6.437 4.557 1.00 0.00 C ATOM 0 H THR A 234 -6.799 9.492 3.876 1.00 0.00 H new ATOM 0 HA THR A 234 -8.107 7.307 2.364 1.00 0.00 H new ATOM 0 HB THR A 234 -8.657 6.341 4.438 1.00 0.00 H new ATOM 0 HG1 THR A 234 -7.875 8.844 5.436 1.00 0.00 H new ATOM 0 HG21 THR A 234 -6.465 5.850 5.473 1.00 0.00 H new ATOM 0 HG22 THR A 234 -6.413 5.781 3.695 1.00 0.00 H new ATOM 0 HG23 THR A 234 -5.751 7.194 4.550 1.00 0.00 H new ATOM 391 N ASP A 235 -10.502 7.991 3.121 1.00 0.00 N ATOM 392 CA ASP A 235 -11.832 8.590 3.172 1.00 0.00 C ATOM 393 C ASP A 235 -12.373 8.618 4.600 1.00 0.00 C ATOM 394 O ASP A 235 -13.435 9.187 4.856 1.00 0.00 O ATOM 395 CB ASP A 235 -12.794 7.821 2.267 1.00 0.00 C ATOM 396 CG ASP A 235 -12.591 8.143 0.799 1.00 0.00 C ATOM 397 OD1 ASP A 235 -12.098 9.250 0.497 1.00 0.00 O ATOM 398 OD2 ASP A 235 -12.922 7.287 -0.048 1.00 0.00 O ATOM 0 H ASP A 235 -10.498 6.990 2.927 1.00 0.00 H new ATOM 0 HA ASP A 235 -11.749 9.618 2.819 1.00 0.00 H new ATOM 0 HB2 ASP A 235 -12.658 6.751 2.423 1.00 0.00 H new ATOM 0 HB3 ASP A 235 -13.820 8.057 2.549 1.00 0.00 H new ATOM 403 N PHE A 236 -11.643 8.005 5.531 1.00 0.00 N ATOM 404 CA PHE A 236 -12.064 7.970 6.929 1.00 0.00 C ATOM 405 C PHE A 236 -11.022 8.617 7.841 1.00 0.00 C ATOM 406 O PHE A 236 -11.317 8.958 8.987 1.00 0.00 O ATOM 407 CB PHE A 236 -12.326 6.524 7.370 1.00 0.00 C ATOM 408 CG PHE A 236 -11.081 5.757 7.738 1.00 0.00 C ATOM 409 CD1 PHE A 236 -10.084 5.534 6.803 1.00 0.00 C ATOM 410 CD2 PHE A 236 -10.914 5.265 9.021 1.00 0.00 C ATOM 411 CE1 PHE A 236 -8.942 4.833 7.142 1.00 0.00 C ATOM 412 CE2 PHE A 236 -9.773 4.563 9.367 1.00 0.00 C ATOM 413 CZ PHE A 236 -8.787 4.347 8.425 1.00 0.00 C ATOM 0 H PHE A 236 -10.761 7.528 5.343 1.00 0.00 H new ATOM 0 HA PHE A 236 -12.988 8.542 7.014 1.00 0.00 H new ATOM 0 HB2 PHE A 236 -13.000 6.533 8.226 1.00 0.00 H new ATOM 0 HB3 PHE A 236 -12.840 5.998 6.565 1.00 0.00 H new ATOM 0 HD1 PHE A 236 -10.200 5.912 5.798 1.00 0.00 H new ATOM 0 HD2 PHE A 236 -11.683 5.431 9.761 1.00 0.00 H new ATOM 0 HE1 PHE A 236 -8.172 4.666 6.404 1.00 0.00 H new ATOM 0 HE2 PHE A 236 -9.654 4.185 10.372 1.00 0.00 H new ATOM 0 HZ PHE A 236 -7.896 3.799 8.691 1.00 0.00 H new ATOM 423 N ALA A 237 -9.801 8.779 7.335 1.00 0.00 N ATOM 424 CA ALA A 237 -8.726 9.379 8.116 1.00 0.00 C ATOM 425 C ALA A 237 -8.190 10.638 7.441 1.00 0.00 C ATOM 426 O ALA A 237 -8.069 10.694 6.217 1.00 0.00 O ATOM 427 CB ALA A 237 -7.604 8.375 8.326 1.00 0.00 C ATOM 0 H ALA A 237 -9.534 8.503 6.390 1.00 0.00 H new ATOM 0 HA ALA A 237 -9.133 9.664 9.086 1.00 0.00 H new ATOM 0 HB1 ALA A 237 -6.808 8.836 8.911 1.00 0.00 H new ATOM 0 HB2 ALA A 237 -7.989 7.506 8.859 1.00 0.00 H new ATOM 0 HB3 ALA A 237 -7.210 8.062 7.359 1.00 0.00 H new ATOM 433 N LYS A 238 -7.867 11.642 8.247 1.00 0.00 N ATOM 434 CA LYS A 238 -7.341 12.900 7.729 1.00 0.00 C ATOM 435 C LYS A 238 -5.818 12.864 7.661 1.00 0.00 C ATOM 436 O LYS A 238 -5.157 12.383 8.582 1.00 0.00 O ATOM 437 CB LYS A 238 -7.795 14.068 8.607 1.00 0.00 C ATOM 438 CG LYS A 238 -7.509 15.432 8.000 1.00 0.00 C ATOM 439 CD LYS A 238 -8.096 16.552 8.844 1.00 0.00 C ATOM 440 CE LYS A 238 -7.041 17.193 9.730 1.00 0.00 C ATOM 441 NZ LYS A 238 -7.232 18.666 9.844 1.00 0.00 N ATOM 0 H LYS A 238 -7.960 11.610 9.262 1.00 0.00 H new ATOM 0 HA LYS A 238 -7.730 13.040 6.721 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -8.866 13.979 8.791 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -7.298 13.999 9.575 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -6.432 15.571 7.907 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -7.924 15.478 6.993 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -8.534 17.308 8.193 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -8.902 16.158 9.463 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -7.079 16.744 10.723 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -6.051 16.986 9.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -6.493 19.066 10.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -7.171 19.098 8.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -8.166 18.864 10.255 1.00 0.00 H new ATOM 455 N GLY A 239 -5.267 13.375 6.564 1.00 0.00 N ATOM 456 CA GLY A 239 -3.825 13.389 6.398 1.00 0.00 C ATOM 457 C GLY A 239 -3.358 12.440 5.311 1.00 0.00 C ATOM 458 O GLY A 239 -4.147 12.008 4.472 1.00 0.00 O ATOM 0 H GLY A 239 -5.792 13.779 5.789 1.00 0.00 H new ATOM 0 HA2 GLY A 239 -3.500 14.401 6.157 1.00 0.00 H new ATOM 0 HA3 GLY A 239 -3.351 13.118 7.341 1.00 0.00 H new ATOM 462 N GLU A 240 -2.068 12.118 5.325 1.00 0.00 N ATOM 463 CA GLU A 240 -1.495 11.215 4.332 1.00 0.00 C ATOM 464 C GLU A 240 -1.348 9.807 4.898 1.00 0.00 C ATOM 465 O GLU A 240 -0.847 9.620 6.007 1.00 0.00 O ATOM 466 CB GLU A 240 -0.134 11.734 3.865 1.00 0.00 C ATOM 467 CG GLU A 240 0.915 11.770 4.965 1.00 0.00 C ATOM 468 CD GLU A 240 2.162 12.528 4.557 1.00 0.00 C ATOM 469 OE1 GLU A 240 2.594 12.379 3.394 1.00 0.00 O ATOM 470 OE2 GLU A 240 2.707 13.272 5.399 1.00 0.00 O ATOM 0 H GLU A 240 -1.400 12.468 6.012 1.00 0.00 H new ATOM 0 HA GLU A 240 -2.173 11.176 3.479 1.00 0.00 H new ATOM 0 HB2 GLU A 240 0.226 11.104 3.052 1.00 0.00 H new ATOM 0 HB3 GLU A 240 -0.257 12.738 3.459 1.00 0.00 H new ATOM 0 HG2 GLU A 240 0.488 12.233 5.854 1.00 0.00 H new ATOM 0 HG3 GLU A 240 1.187 10.750 5.236 1.00 0.00 H new ATOM 477 N TRP A 241 -1.789 8.817 4.128 1.00 0.00 N ATOM 478 CA TRP A 241 -1.707 7.423 4.551 1.00 0.00 C ATOM 479 C TRP A 241 -1.078 6.561 3.462 1.00 0.00 C ATOM 480 O TRP A 241 -0.898 7.009 2.329 1.00 0.00 O ATOM 481 CB TRP A 241 -3.099 6.892 4.902 1.00 0.00 C ATOM 482 CG TRP A 241 -3.681 7.525 6.130 1.00 0.00 C ATOM 483 CD1 TRP A 241 -4.120 8.810 6.260 1.00 0.00 C ATOM 484 CD2 TRP A 241 -3.883 6.900 7.402 1.00 0.00 C ATOM 485 NE1 TRP A 241 -4.583 9.024 7.536 1.00 0.00 N ATOM 486 CE2 TRP A 241 -4.449 7.866 8.256 1.00 0.00 C ATOM 487 CE3 TRP A 241 -3.643 5.617 7.903 1.00 0.00 C ATOM 488 CZ2 TRP A 241 -4.777 7.588 9.581 1.00 0.00 C ATOM 489 CZ3 TRP A 241 -3.967 5.344 9.218 1.00 0.00 C ATOM 490 CH2 TRP A 241 -4.529 6.324 10.044 1.00 0.00 C ATOM 0 H TRP A 241 -2.207 8.954 3.208 1.00 0.00 H new ATOM 0 HA TRP A 241 -1.074 7.374 5.437 1.00 0.00 H new ATOM 0 HB2 TRP A 241 -3.769 7.064 4.060 1.00 0.00 H new ATOM 0 HB3 TRP A 241 -3.043 5.813 5.049 1.00 0.00 H new ATOM 0 HD1 TRP A 241 -4.106 9.551 5.475 1.00 0.00 H new ATOM 0 HE1 TRP A 241 -4.964 9.902 7.889 1.00 0.00 H new ATOM 0 HE3 TRP A 241 -3.212 4.853 7.273 1.00 0.00 H new ATOM 0 HZ2 TRP A 241 -5.211 8.343 10.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 241 -3.783 4.357 9.616 1.00 0.00 H new ATOM 0 HH2 TRP A 241 -4.772 6.078 11.067 1.00 0.00 H new ATOM 501 N CYS A 242 -0.743 5.322 3.809 1.00 0.00 N ATOM 502 CA CYS A 242 -0.133 4.402 2.856 1.00 0.00 C ATOM 503 C CYS A 242 -0.746 3.008 2.968 1.00 0.00 C ATOM 504 O CYS A 242 -1.285 2.633 4.010 1.00 0.00 O ATOM 505 CB CYS A 242 1.382 4.334 3.076 1.00 0.00 C ATOM 506 SG CYS A 242 2.235 3.138 2.020 1.00 0.00 S ATOM 0 H CYS A 242 -0.883 4.933 4.741 1.00 0.00 H new ATOM 0 HA CYS A 242 -0.328 4.779 1.852 1.00 0.00 H new ATOM 0 HB2 CYS A 242 1.807 5.322 2.902 1.00 0.00 H new ATOM 0 HB3 CYS A 242 1.575 4.083 4.119 1.00 0.00 H new ATOM 0 HG CYS A 242 3.508 3.159 2.281 1.00 0.00 H new ATOM 512 N GLY A 243 -0.656 2.250 1.883 1.00 0.00 N ATOM 513 CA GLY A 243 -1.198 0.905 1.855 1.00 0.00 C ATOM 514 C GLY A 243 -0.116 -0.146 1.713 1.00 0.00 C ATOM 515 O GLY A 243 0.697 -0.088 0.791 1.00 0.00 O ATOM 0 H GLY A 243 -0.213 2.546 1.014 1.00 0.00 H new ATOM 0 HA2 GLY A 243 -1.761 0.723 2.771 1.00 0.00 H new ATOM 0 HA3 GLY A 243 -1.900 0.815 1.026 1.00 0.00 H new ATOM 519 N VAL A 244 -0.103 -1.107 2.628 1.00 0.00 N ATOM 520 CA VAL A 244 0.891 -2.173 2.599 1.00 0.00 C ATOM 521 C VAL A 244 0.228 -3.543 2.694 1.00 0.00 C ATOM 522 O VAL A 244 -0.625 -3.772 3.551 1.00 0.00 O ATOM 523 CB VAL A 244 1.908 -2.031 3.752 1.00 0.00 C ATOM 524 CG1 VAL A 244 3.137 -2.888 3.495 1.00 0.00 C ATOM 525 CG2 VAL A 244 2.303 -0.575 3.954 1.00 0.00 C ATOM 0 H VAL A 244 -0.768 -1.170 3.398 1.00 0.00 H new ATOM 0 HA VAL A 244 1.416 -2.087 1.648 1.00 0.00 H new ATOM 0 HB VAL A 244 1.430 -2.382 4.666 1.00 0.00 H new ATOM 0 HG11 VAL A 244 3.840 -2.772 4.320 1.00 0.00 H new ATOM 0 HG12 VAL A 244 2.841 -3.934 3.414 1.00 0.00 H new ATOM 0 HG13 VAL A 244 3.613 -2.573 2.566 1.00 0.00 H new ATOM 0 HG21 VAL A 244 3.020 -0.503 4.772 1.00 0.00 H new ATOM 0 HG22 VAL A 244 2.755 -0.190 3.040 1.00 0.00 H new ATOM 0 HG23 VAL A 244 1.417 0.012 4.195 1.00 0.00 H new ATOM 535 N GLU A 245 0.634 -4.454 1.816 1.00 0.00 N ATOM 536 CA GLU A 245 0.087 -5.803 1.808 1.00 0.00 C ATOM 537 C GLU A 245 0.829 -6.669 2.820 1.00 0.00 C ATOM 538 O GLU A 245 2.009 -6.969 2.645 1.00 0.00 O ATOM 539 CB GLU A 245 0.196 -6.418 0.413 1.00 0.00 C ATOM 540 CG GLU A 245 -0.400 -7.813 0.313 1.00 0.00 C ATOM 541 CD GLU A 245 -0.805 -8.175 -1.103 1.00 0.00 C ATOM 542 OE1 GLU A 245 -0.172 -7.664 -2.050 1.00 0.00 O ATOM 543 OE2 GLU A 245 -1.756 -8.968 -1.262 1.00 0.00 O ATOM 0 H GLU A 245 1.340 -4.281 1.101 1.00 0.00 H new ATOM 0 HA GLU A 245 -0.967 -5.754 2.083 1.00 0.00 H new ATOM 0 HB2 GLU A 245 -0.305 -5.766 -0.302 1.00 0.00 H new ATOM 0 HB3 GLU A 245 1.246 -6.460 0.125 1.00 0.00 H new ATOM 0 HG2 GLU A 245 0.325 -8.541 0.677 1.00 0.00 H new ATOM 0 HG3 GLU A 245 -1.272 -7.879 0.964 1.00 0.00 H new ATOM 550 N LEU A 246 0.136 -7.049 3.885 1.00 0.00 N ATOM 551 CA LEU A 246 0.739 -7.861 4.933 1.00 0.00 C ATOM 552 C LEU A 246 1.063 -9.264 4.434 1.00 0.00 C ATOM 553 O LEU A 246 0.368 -9.811 3.579 1.00 0.00 O ATOM 554 CB LEU A 246 -0.190 -7.935 6.143 1.00 0.00 C ATOM 555 CG LEU A 246 -0.472 -6.595 6.823 1.00 0.00 C ATOM 556 CD1 LEU A 246 -1.515 -6.759 7.915 1.00 0.00 C ATOM 557 CD2 LEU A 246 0.810 -6.007 7.392 1.00 0.00 C ATOM 0 H LEU A 246 -0.842 -6.809 4.046 1.00 0.00 H new ATOM 0 HA LEU A 246 1.675 -7.385 5.227 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -1.138 -8.372 5.829 1.00 0.00 H new ATOM 0 HB3 LEU A 246 0.246 -8.613 6.876 1.00 0.00 H new ATOM 0 HG LEU A 246 -0.865 -5.906 6.076 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -1.702 -5.795 8.387 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -2.441 -7.136 7.480 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -1.152 -7.464 8.662 1.00 0.00 H new ATOM 0 HD21 LEU A 246 0.591 -5.053 7.872 1.00 0.00 H new ATOM 0 HD22 LEU A 246 1.231 -6.694 8.125 1.00 0.00 H new ATOM 0 HD23 LEU A 246 1.528 -5.851 6.587 1.00 0.00 H new ATOM 569 N ASP A 247 2.132 -9.837 4.980 1.00 0.00 N ATOM 570 CA ASP A 247 2.569 -11.175 4.601 1.00 0.00 C ATOM 571 C ASP A 247 1.649 -12.243 5.187 1.00 0.00 C ATOM 572 O ASP A 247 1.507 -13.329 4.625 1.00 0.00 O ATOM 573 CB ASP A 247 4.007 -11.407 5.069 1.00 0.00 C ATOM 574 CG ASP A 247 5.027 -10.781 4.139 1.00 0.00 C ATOM 575 OD1 ASP A 247 5.262 -11.344 3.049 1.00 0.00 O ATOM 576 OD2 ASP A 247 5.589 -9.726 4.500 1.00 0.00 O ATOM 0 H ASP A 247 2.714 -9.392 5.690 1.00 0.00 H new ATOM 0 HA ASP A 247 2.526 -11.251 3.515 1.00 0.00 H new ATOM 0 HB2 ASP A 247 4.131 -10.994 6.070 1.00 0.00 H new ATOM 0 HB3 ASP A 247 4.194 -12.478 5.140 1.00 0.00 H new ATOM 581 N GLU A 248 1.028 -11.930 6.319 1.00 0.00 N ATOM 582 CA GLU A 248 0.122 -12.865 6.980 1.00 0.00 C ATOM 583 C GLU A 248 -1.174 -12.170 7.390 1.00 0.00 C ATOM 584 O GLU A 248 -1.278 -10.945 7.320 1.00 0.00 O ATOM 585 CB GLU A 248 0.798 -13.481 8.208 1.00 0.00 C ATOM 586 CG GLU A 248 1.409 -14.848 7.944 1.00 0.00 C ATOM 587 CD GLU A 248 2.925 -14.823 7.958 1.00 0.00 C ATOM 588 OE1 GLU A 248 3.505 -14.542 9.028 1.00 0.00 O ATOM 589 OE2 GLU A 248 3.533 -15.083 6.899 1.00 0.00 O ATOM 0 H GLU A 248 1.135 -11.036 6.799 1.00 0.00 H new ATOM 0 HA GLU A 248 -0.122 -13.658 6.273 1.00 0.00 H new ATOM 0 HB2 GLU A 248 1.578 -12.806 8.560 1.00 0.00 H new ATOM 0 HB3 GLU A 248 0.065 -13.568 9.010 1.00 0.00 H new ATOM 0 HG2 GLU A 248 1.054 -15.552 8.697 1.00 0.00 H new ATOM 0 HG3 GLU A 248 1.064 -15.215 6.977 1.00 0.00 H new ATOM 596 N PRO A 249 -2.184 -12.944 7.828 1.00 0.00 N ATOM 597 CA PRO A 249 -3.473 -12.394 8.252 1.00 0.00 C ATOM 598 C PRO A 249 -3.345 -11.557 9.522 1.00 0.00 C ATOM 599 O PRO A 249 -3.829 -11.941 10.588 1.00 0.00 O ATOM 600 CB PRO A 249 -4.345 -13.634 8.513 1.00 0.00 C ATOM 601 CG PRO A 249 -3.596 -14.792 7.937 1.00 0.00 C ATOM 602 CD PRO A 249 -2.144 -14.409 7.946 1.00 0.00 C ATOM 0 HA PRO A 249 -3.892 -11.725 7.500 1.00 0.00 H new ATOM 0 HB2 PRO A 249 -4.517 -13.772 9.580 1.00 0.00 H new ATOM 0 HB3 PRO A 249 -5.323 -13.529 8.043 1.00 0.00 H new ATOM 0 HG2 PRO A 249 -3.763 -15.694 8.526 1.00 0.00 H new ATOM 0 HG3 PRO A 249 -3.934 -15.007 6.923 1.00 0.00 H new ATOM 0 HD2 PRO A 249 -1.649 -14.726 8.864 1.00 0.00 H new ATOM 0 HD3 PRO A 249 -1.602 -14.865 7.118 1.00 0.00 H new ATOM 610 N LEU A 250 -2.686 -10.410 9.401 1.00 0.00 N ATOM 611 CA LEU A 250 -2.490 -9.516 10.536 1.00 0.00 C ATOM 612 C LEU A 250 -2.973 -8.104 10.218 1.00 0.00 C ATOM 613 O LEU A 250 -2.483 -7.128 10.786 1.00 0.00 O ATOM 614 CB LEU A 250 -1.013 -9.486 10.939 1.00 0.00 C ATOM 615 CG LEU A 250 -0.021 -9.497 9.771 1.00 0.00 C ATOM 616 CD1 LEU A 250 0.923 -8.307 9.853 1.00 0.00 C ATOM 617 CD2 LEU A 250 0.767 -10.799 9.750 1.00 0.00 C ATOM 0 H LEU A 250 -2.278 -10.077 8.527 1.00 0.00 H new ATOM 0 HA LEU A 250 -3.081 -9.898 11.369 1.00 0.00 H new ATOM 0 HB2 LEU A 250 -0.834 -8.594 11.539 1.00 0.00 H new ATOM 0 HB3 LEU A 250 -0.809 -10.346 11.577 1.00 0.00 H new ATOM 0 HG LEU A 250 -0.589 -9.421 8.844 1.00 0.00 H new ATOM 0 HD11 LEU A 250 1.618 -8.336 9.014 1.00 0.00 H new ATOM 0 HD12 LEU A 250 0.347 -7.382 9.816 1.00 0.00 H new ATOM 0 HD13 LEU A 250 1.481 -8.349 10.788 1.00 0.00 H new ATOM 0 HD21 LEU A 250 1.466 -10.788 8.914 1.00 0.00 H new ATOM 0 HD22 LEU A 250 1.320 -10.905 10.683 1.00 0.00 H new ATOM 0 HD23 LEU A 250 0.080 -11.638 9.638 1.00 0.00 H new ATOM 629 N GLY A 251 -3.936 -8.001 9.307 1.00 0.00 N ATOM 630 CA GLY A 251 -4.466 -6.702 8.933 1.00 0.00 C ATOM 631 C GLY A 251 -5.884 -6.491 9.426 1.00 0.00 C ATOM 632 O GLY A 251 -6.403 -7.293 10.200 1.00 0.00 O ATOM 0 H GLY A 251 -4.358 -8.793 8.822 1.00 0.00 H new ATOM 0 HA2 GLY A 251 -3.824 -5.920 9.338 1.00 0.00 H new ATOM 0 HA3 GLY A 251 -4.443 -6.602 7.848 1.00 0.00 H new ATOM 636 N LYS A 252 -6.509 -5.406 8.980 1.00 0.00 N ATOM 637 CA LYS A 252 -7.874 -5.093 9.386 1.00 0.00 C ATOM 638 C LYS A 252 -8.830 -5.146 8.197 1.00 0.00 C ATOM 639 O LYS A 252 -10.001 -5.495 8.348 1.00 0.00 O ATOM 640 CB LYS A 252 -7.928 -3.708 10.034 1.00 0.00 C ATOM 641 CG LYS A 252 -6.814 -3.464 11.039 1.00 0.00 C ATOM 642 CD LYS A 252 -7.044 -4.243 12.324 1.00 0.00 C ATOM 643 CE LYS A 252 -5.850 -4.140 13.261 1.00 0.00 C ATOM 644 NZ LYS A 252 -6.268 -3.877 14.666 1.00 0.00 N ATOM 0 H LYS A 252 -6.093 -4.730 8.339 1.00 0.00 H new ATOM 0 HA LYS A 252 -8.188 -5.844 10.111 1.00 0.00 H new ATOM 0 HB2 LYS A 252 -7.875 -2.949 9.254 1.00 0.00 H new ATOM 0 HB3 LYS A 252 -8.889 -3.586 10.533 1.00 0.00 H new ATOM 0 HG2 LYS A 252 -5.858 -3.754 10.602 1.00 0.00 H new ATOM 0 HG3 LYS A 252 -6.752 -2.399 11.264 1.00 0.00 H new ATOM 0 HD2 LYS A 252 -7.935 -3.865 12.825 1.00 0.00 H new ATOM 0 HD3 LYS A 252 -7.232 -5.290 12.087 1.00 0.00 H new ATOM 0 HE2 LYS A 252 -5.276 -5.065 13.220 1.00 0.00 H new ATOM 0 HE3 LYS A 252 -5.191 -3.341 12.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 252 -5.426 -3.814 15.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 252 -6.794 -2.981 14.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 252 -6.876 -4.652 14.998 1.00 0.00 H new ATOM 658 N ASN A 253 -8.328 -4.795 7.017 1.00 0.00 N ATOM 659 CA ASN A 253 -9.146 -4.804 5.809 1.00 0.00 C ATOM 660 C ASN A 253 -8.507 -5.658 4.718 1.00 0.00 C ATOM 661 O ASN A 253 -7.341 -6.040 4.815 1.00 0.00 O ATOM 662 CB ASN A 253 -9.358 -3.374 5.300 1.00 0.00 C ATOM 663 CG ASN A 253 -8.078 -2.743 4.786 1.00 0.00 C ATOM 664 OD1 ASN A 253 -7.896 -2.573 3.580 1.00 0.00 O ATOM 665 ND2 ASN A 253 -7.181 -2.393 5.701 1.00 0.00 N ATOM 0 H ASN A 253 -7.362 -4.502 6.872 1.00 0.00 H new ATOM 0 HA ASN A 253 -10.113 -5.240 6.061 1.00 0.00 H new ATOM 0 HB2 ASN A 253 -10.101 -3.382 4.502 1.00 0.00 H new ATOM 0 HB3 ASN A 253 -9.763 -2.762 6.106 1.00 0.00 H new ATOM 0 HD21 ASN A 253 -6.301 -1.965 5.415 1.00 0.00 H new ATOM 0 HD22 ASN A 253 -7.373 -2.552 6.690 1.00 0.00 H new ATOM 672 N ASP A 254 -9.283 -5.953 3.679 1.00 0.00 N ATOM 673 CA ASP A 254 -8.799 -6.761 2.567 1.00 0.00 C ATOM 674 C ASP A 254 -8.360 -5.880 1.399 1.00 0.00 C ATOM 675 O ASP A 254 -8.369 -6.312 0.245 1.00 0.00 O ATOM 676 CB ASP A 254 -9.886 -7.739 2.109 1.00 0.00 C ATOM 677 CG ASP A 254 -11.092 -7.032 1.520 1.00 0.00 C ATOM 678 OD1 ASP A 254 -10.925 -6.308 0.515 1.00 0.00 O ATOM 679 OD2 ASP A 254 -12.203 -7.204 2.063 1.00 0.00 O ATOM 0 H ASP A 254 -10.250 -5.644 3.585 1.00 0.00 H new ATOM 0 HA ASP A 254 -7.934 -7.327 2.912 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -9.469 -8.419 1.366 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -10.203 -8.347 2.956 1.00 0.00 H new ATOM 684 N GLY A 255 -7.971 -4.645 1.705 1.00 0.00 N ATOM 685 CA GLY A 255 -7.529 -3.729 0.670 1.00 0.00 C ATOM 686 C GLY A 255 -8.539 -2.630 0.383 1.00 0.00 C ATOM 687 O GLY A 255 -8.477 -1.980 -0.661 1.00 0.00 O ATOM 0 H GLY A 255 -7.954 -4.263 2.651 1.00 0.00 H new ATOM 0 HA2 GLY A 255 -6.584 -3.277 0.971 1.00 0.00 H new ATOM 0 HA3 GLY A 255 -7.338 -4.288 -0.246 1.00 0.00 H new ATOM 691 N ALA A 256 -9.472 -2.421 1.308 1.00 0.00 N ATOM 692 CA ALA A 256 -10.492 -1.393 1.142 1.00 0.00 C ATOM 693 C ALA A 256 -10.730 -0.636 2.443 1.00 0.00 C ATOM 694 O ALA A 256 -10.413 -1.127 3.527 1.00 0.00 O ATOM 695 CB ALA A 256 -11.788 -2.012 0.642 1.00 0.00 C ATOM 0 H ALA A 256 -9.542 -2.949 2.178 1.00 0.00 H new ATOM 0 HA ALA A 256 -10.134 -0.679 0.401 1.00 0.00 H new ATOM 0 HB1 ALA A 256 -12.541 -1.233 0.523 1.00 0.00 H new ATOM 0 HB2 ALA A 256 -11.613 -2.498 -0.318 1.00 0.00 H new ATOM 0 HB3 ALA A 256 -12.141 -2.750 1.363 1.00 0.00 H new ATOM 701 N VAL A 257 -11.290 0.565 2.329 1.00 0.00 N ATOM 702 CA VAL A 257 -11.570 1.394 3.495 1.00 0.00 C ATOM 703 C VAL A 257 -12.890 2.142 3.333 1.00 0.00 C ATOM 704 O VAL A 257 -13.060 2.928 2.401 1.00 0.00 O ATOM 705 CB VAL A 257 -10.440 2.411 3.742 1.00 0.00 C ATOM 706 CG1 VAL A 257 -10.713 3.228 4.999 1.00 0.00 C ATOM 707 CG2 VAL A 257 -9.097 1.703 3.838 1.00 0.00 C ATOM 0 H VAL A 257 -11.559 0.985 1.439 1.00 0.00 H new ATOM 0 HA VAL A 257 -11.640 0.725 4.353 1.00 0.00 H new ATOM 0 HB VAL A 257 -10.405 3.097 2.896 1.00 0.00 H new ATOM 0 HG11 VAL A 257 -9.902 3.940 5.154 1.00 0.00 H new ATOM 0 HG12 VAL A 257 -11.653 3.768 4.885 1.00 0.00 H new ATOM 0 HG13 VAL A 257 -10.780 2.561 5.859 1.00 0.00 H new ATOM 0 HG21 VAL A 257 -8.310 2.437 4.013 1.00 0.00 H new ATOM 0 HG22 VAL A 257 -9.119 0.991 4.663 1.00 0.00 H new ATOM 0 HG23 VAL A 257 -8.898 1.173 2.907 1.00 0.00 H new ATOM 717 N ALA A 258 -13.821 1.894 4.251 1.00 0.00 N ATOM 718 CA ALA A 258 -15.126 2.545 4.214 1.00 0.00 C ATOM 719 C ALA A 258 -15.833 2.298 2.886 1.00 0.00 C ATOM 720 O ALA A 258 -16.650 3.109 2.448 1.00 0.00 O ATOM 721 CB ALA A 258 -14.974 4.039 4.462 1.00 0.00 C ATOM 0 H ALA A 258 -13.695 1.247 5.029 1.00 0.00 H new ATOM 0 HA ALA A 258 -15.740 2.113 5.004 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -15.954 4.514 4.432 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -14.522 4.201 5.440 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -14.337 4.473 3.691 1.00 0.00 H new ATOM 727 N GLY A 259 -15.517 1.175 2.251 1.00 0.00 N ATOM 728 CA GLY A 259 -16.133 0.846 0.979 1.00 0.00 C ATOM 729 C GLY A 259 -15.318 1.322 -0.211 1.00 0.00 C ATOM 730 O GLY A 259 -15.752 1.193 -1.356 1.00 0.00 O ATOM 0 H GLY A 259 -14.846 0.487 2.594 1.00 0.00 H new ATOM 0 HA2 GLY A 259 -16.266 -0.234 0.914 1.00 0.00 H new ATOM 0 HA3 GLY A 259 -17.126 1.293 0.935 1.00 0.00 H new ATOM 734 N THR A 260 -14.136 1.870 0.055 1.00 0.00 N ATOM 735 CA THR A 260 -13.266 2.363 -1.007 1.00 0.00 C ATOM 736 C THR A 260 -12.008 1.508 -1.116 1.00 0.00 C ATOM 737 O THR A 260 -11.179 1.485 -0.206 1.00 0.00 O ATOM 738 CB THR A 260 -12.884 3.821 -0.746 1.00 0.00 C ATOM 739 OG1 THR A 260 -14.037 4.603 -0.488 1.00 0.00 O ATOM 740 CG2 THR A 260 -12.145 4.462 -1.901 1.00 0.00 C ATOM 0 H THR A 260 -13.759 1.984 0.996 1.00 0.00 H new ATOM 0 HA THR A 260 -13.811 2.301 -1.949 1.00 0.00 H new ATOM 0 HB THR A 260 -12.222 3.795 0.119 1.00 0.00 H new ATOM 0 HG1 THR A 260 -13.953 5.469 -0.940 1.00 0.00 H new ATOM 0 HG21 THR A 260 -11.904 5.495 -1.650 1.00 0.00 H new ATOM 0 HG22 THR A 260 -11.224 3.911 -2.094 1.00 0.00 H new ATOM 0 HG23 THR A 260 -12.774 4.442 -2.791 1.00 0.00 H new ATOM 748 N ARG A 261 -11.871 0.806 -2.237 1.00 0.00 N ATOM 749 CA ARG A 261 -10.714 -0.050 -2.465 1.00 0.00 C ATOM 750 C ARG A 261 -9.565 0.743 -3.078 1.00 0.00 C ATOM 751 O ARG A 261 -9.709 1.343 -4.142 1.00 0.00 O ATOM 752 CB ARG A 261 -11.087 -1.219 -3.377 1.00 0.00 C ATOM 753 CG ARG A 261 -9.962 -2.223 -3.570 1.00 0.00 C ATOM 754 CD ARG A 261 -9.863 -2.687 -5.015 1.00 0.00 C ATOM 755 NE ARG A 261 -9.454 -1.608 -5.911 1.00 0.00 N ATOM 756 CZ ARG A 261 -10.293 -0.899 -6.665 1.00 0.00 C ATOM 757 NH1 ARG A 261 -11.600 -1.136 -6.631 1.00 0.00 N ATOM 758 NH2 ARG A 261 -9.826 0.060 -7.454 1.00 0.00 N ATOM 0 H ARG A 261 -12.547 0.814 -3.001 1.00 0.00 H new ATOM 0 HA ARG A 261 -10.389 -0.442 -1.502 1.00 0.00 H new ATOM 0 HB2 ARG A 261 -11.953 -1.732 -2.960 1.00 0.00 H new ATOM 0 HB3 ARG A 261 -11.386 -0.829 -4.350 1.00 0.00 H new ATOM 0 HG2 ARG A 261 -9.017 -1.773 -3.267 1.00 0.00 H new ATOM 0 HG3 ARG A 261 -10.127 -3.084 -2.922 1.00 0.00 H new ATOM 0 HD2 ARG A 261 -9.147 -3.506 -5.084 1.00 0.00 H new ATOM 0 HD3 ARG A 261 -10.828 -3.079 -5.337 1.00 0.00 H new ATOM 0 HE ARG A 261 -8.461 -1.383 -5.963 1.00 0.00 H new ATOM 0 HH11 ARG A 261 -11.970 -1.867 -6.023 1.00 0.00 H new ATOM 0 HH12 ARG A 261 -12.233 -0.587 -7.213 1.00 0.00 H new ATOM 0 HH21 ARG A 261 -8.825 0.254 -7.483 1.00 0.00 H new ATOM 0 HH22 ARG A 261 -10.468 0.603 -8.031 1.00 0.00 H new ATOM 772 N TYR A 262 -8.422 0.743 -2.398 1.00 0.00 N ATOM 773 CA TYR A 262 -7.248 1.465 -2.876 1.00 0.00 C ATOM 774 C TYR A 262 -6.320 0.537 -3.653 1.00 0.00 C ATOM 775 O TYR A 262 -5.733 0.931 -4.661 1.00 0.00 O ATOM 776 CB TYR A 262 -6.498 2.096 -1.702 1.00 0.00 C ATOM 777 CG TYR A 262 -7.255 3.224 -1.038 1.00 0.00 C ATOM 778 CD1 TYR A 262 -8.322 2.965 -0.186 1.00 0.00 C ATOM 779 CD2 TYR A 262 -6.903 4.549 -1.265 1.00 0.00 C ATOM 780 CE1 TYR A 262 -9.016 3.995 0.422 1.00 0.00 C ATOM 781 CE2 TYR A 262 -7.592 5.584 -0.661 1.00 0.00 C ATOM 782 CZ TYR A 262 -8.647 5.302 0.180 1.00 0.00 C ATOM 783 OH TYR A 262 -9.336 6.330 0.783 1.00 0.00 O ATOM 0 H TYR A 262 -8.284 0.251 -1.515 1.00 0.00 H new ATOM 0 HA TYR A 262 -7.585 2.256 -3.547 1.00 0.00 H new ATOM 0 HB2 TYR A 262 -6.286 1.326 -0.961 1.00 0.00 H new ATOM 0 HB3 TYR A 262 -5.538 2.472 -2.055 1.00 0.00 H new ATOM 0 HD1 TYR A 262 -8.614 1.943 0.004 1.00 0.00 H new ATOM 0 HD2 TYR A 262 -6.078 4.774 -1.924 1.00 0.00 H new ATOM 0 HE1 TYR A 262 -9.842 3.777 1.083 1.00 0.00 H new ATOM 0 HE2 TYR A 262 -7.305 6.608 -0.847 1.00 0.00 H new ATOM 0 HH TYR A 262 -10.181 5.990 1.144 1.00 0.00 H new ATOM 793 N PHE A 263 -6.196 -0.697 -3.179 1.00 0.00 N ATOM 794 CA PHE A 263 -5.342 -1.685 -3.829 1.00 0.00 C ATOM 795 C PHE A 263 -5.907 -3.091 -3.650 1.00 0.00 C ATOM 796 O PHE A 263 -6.860 -3.295 -2.897 1.00 0.00 O ATOM 797 CB PHE A 263 -3.920 -1.613 -3.269 1.00 0.00 C ATOM 798 CG PHE A 263 -3.865 -1.506 -1.771 1.00 0.00 C ATOM 799 CD1 PHE A 263 -4.053 -0.285 -1.145 1.00 0.00 C ATOM 800 CD2 PHE A 263 -3.621 -2.625 -0.992 1.00 0.00 C ATOM 801 CE1 PHE A 263 -4.001 -0.181 0.231 1.00 0.00 C ATOM 802 CE2 PHE A 263 -3.567 -2.527 0.387 1.00 0.00 C ATOM 803 CZ PHE A 263 -3.756 -1.304 0.999 1.00 0.00 C ATOM 0 H PHE A 263 -6.676 -1.038 -2.346 1.00 0.00 H new ATOM 0 HA PHE A 263 -5.312 -1.459 -4.895 1.00 0.00 H new ATOM 0 HB2 PHE A 263 -3.371 -2.501 -3.581 1.00 0.00 H new ATOM 0 HB3 PHE A 263 -3.411 -0.754 -3.705 1.00 0.00 H new ATOM 0 HD1 PHE A 263 -4.243 0.596 -1.740 1.00 0.00 H new ATOM 0 HD2 PHE A 263 -3.471 -3.584 -1.466 1.00 0.00 H new ATOM 0 HE1 PHE A 263 -4.152 0.777 0.707 1.00 0.00 H new ATOM 0 HE2 PHE A 263 -3.377 -3.407 0.984 1.00 0.00 H new ATOM 0 HZ PHE A 263 -3.713 -1.225 2.075 1.00 0.00 H new ATOM 813 N GLN A 264 -5.316 -4.055 -4.347 1.00 0.00 N ATOM 814 CA GLN A 264 -5.767 -5.441 -4.264 1.00 0.00 C ATOM 815 C GLN A 264 -4.806 -6.278 -3.427 1.00 0.00 C ATOM 816 O GLN A 264 -3.596 -6.269 -3.655 1.00 0.00 O ATOM 817 CB GLN A 264 -5.898 -6.041 -5.666 1.00 0.00 C ATOM 818 CG GLN A 264 -6.579 -7.399 -5.683 1.00 0.00 C ATOM 819 CD GLN A 264 -8.086 -7.297 -5.558 1.00 0.00 C ATOM 820 OE1 GLN A 264 -8.772 -6.888 -6.495 1.00 0.00 O ATOM 821 NE2 GLN A 264 -8.610 -7.668 -4.396 1.00 0.00 N ATOM 0 H GLN A 264 -4.526 -3.904 -4.974 1.00 0.00 H new ATOM 0 HA GLN A 264 -6.743 -5.451 -3.779 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -6.462 -5.353 -6.296 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -4.905 -6.136 -6.106 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -6.329 -7.915 -6.610 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -6.191 -8.006 -4.865 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -8.004 -8.001 -3.646 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -9.619 -7.620 -4.253 1.00 0.00 H new ATOM 830 N CYS A 265 -5.355 -7.002 -2.458 1.00 0.00 N ATOM 831 CA CYS A 265 -4.551 -7.848 -1.585 1.00 0.00 C ATOM 832 C CYS A 265 -5.382 -8.998 -1.026 1.00 0.00 C ATOM 833 O CYS A 265 -6.612 -8.952 -1.041 1.00 0.00 O ATOM 834 CB CYS A 265 -3.963 -7.023 -0.439 1.00 0.00 C ATOM 835 SG CYS A 265 -5.183 -6.042 0.465 1.00 0.00 S ATOM 0 H CYS A 265 -6.355 -7.020 -2.257 1.00 0.00 H new ATOM 0 HA CYS A 265 -3.736 -8.266 -2.176 1.00 0.00 H new ATOM 0 HB2 CYS A 265 -3.463 -7.695 0.259 1.00 0.00 H new ATOM 0 HB3 CYS A 265 -3.201 -6.355 -0.840 1.00 0.00 H new ATOM 0 HG CYS A 265 -4.773 -4.811 0.551 1.00 0.00 H new ATOM 841 N GLN A 266 -4.701 -10.027 -0.532 1.00 0.00 N ATOM 842 CA GLN A 266 -5.380 -11.188 0.032 1.00 0.00 C ATOM 843 C GLN A 266 -6.242 -10.785 1.227 1.00 0.00 C ATOM 844 O GLN A 266 -6.099 -9.687 1.764 1.00 0.00 O ATOM 845 CB GLN A 266 -4.358 -12.243 0.461 1.00 0.00 C ATOM 846 CG GLN A 266 -3.861 -13.110 -0.683 1.00 0.00 C ATOM 847 CD GLN A 266 -4.969 -13.932 -1.314 1.00 0.00 C ATOM 848 OE1 GLN A 266 -5.289 -15.025 -0.848 1.00 0.00 O ATOM 849 NE2 GLN A 266 -5.558 -13.409 -2.383 1.00 0.00 N ATOM 0 H GLN A 266 -3.683 -10.081 -0.511 1.00 0.00 H new ATOM 0 HA GLN A 266 -6.027 -11.609 -0.737 1.00 0.00 H new ATOM 0 HB2 GLN A 266 -3.507 -11.744 0.924 1.00 0.00 H new ATOM 0 HB3 GLN A 266 -4.806 -12.882 1.222 1.00 0.00 H new ATOM 0 HG2 GLN A 266 -3.405 -12.476 -1.444 1.00 0.00 H new ATOM 0 HG3 GLN A 266 -3.082 -13.778 -0.316 1.00 0.00 H new ATOM 0 HE21 GLN A 266 -5.260 -12.499 -2.735 1.00 0.00 H new ATOM 0 HE22 GLN A 266 -6.308 -13.917 -2.852 1.00 0.00 H new ATOM 858 N PRO A 267 -7.154 -11.673 1.657 1.00 0.00 N ATOM 859 CA PRO A 267 -8.041 -11.402 2.793 1.00 0.00 C ATOM 860 C PRO A 267 -7.266 -11.156 4.083 1.00 0.00 C ATOM 861 O PRO A 267 -6.405 -11.952 4.462 1.00 0.00 O ATOM 862 CB PRO A 267 -8.884 -12.677 2.912 1.00 0.00 C ATOM 863 CG PRO A 267 -8.761 -13.352 1.590 1.00 0.00 C ATOM 864 CD PRO A 267 -7.394 -13.003 1.075 1.00 0.00 C ATOM 0 HA PRO A 267 -8.634 -10.501 2.636 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -8.519 -13.316 3.716 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -9.924 -12.442 3.139 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -8.877 -14.431 1.690 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -9.536 -13.011 0.904 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -6.644 -13.726 1.396 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -7.367 -12.978 -0.014 1.00 0.00 H new ATOM 872 N LYS A 268 -7.574 -10.052 4.753 1.00 0.00 N ATOM 873 CA LYS A 268 -6.908 -9.701 6.002 1.00 0.00 C ATOM 874 C LYS A 268 -5.416 -9.456 5.784 1.00 0.00 C ATOM 875 O LYS A 268 -4.624 -9.525 6.725 1.00 0.00 O ATOM 876 CB LYS A 268 -7.108 -10.807 7.042 1.00 0.00 C ATOM 877 CG LYS A 268 -8.536 -11.321 7.116 1.00 0.00 C ATOM 878 CD LYS A 268 -9.457 -10.308 7.776 1.00 0.00 C ATOM 879 CE LYS A 268 -10.910 -10.749 7.705 1.00 0.00 C ATOM 880 NZ LYS A 268 -11.281 -11.620 8.854 1.00 0.00 N ATOM 0 H LYS A 268 -8.282 -9.383 4.452 1.00 0.00 H new ATOM 0 HA LYS A 268 -7.356 -8.778 6.370 1.00 0.00 H new ATOM 0 HB2 LYS A 268 -6.443 -11.638 6.808 1.00 0.00 H new ATOM 0 HB3 LYS A 268 -6.815 -10.430 8.022 1.00 0.00 H new ATOM 0 HG2 LYS A 268 -8.897 -11.543 6.112 1.00 0.00 H new ATOM 0 HG3 LYS A 268 -8.559 -12.255 7.677 1.00 0.00 H new ATOM 0 HD2 LYS A 268 -9.166 -10.175 8.818 1.00 0.00 H new ATOM 0 HD3 LYS A 268 -9.345 -9.340 7.288 1.00 0.00 H new ATOM 0 HE2 LYS A 268 -11.556 -9.871 7.691 1.00 0.00 H new ATOM 0 HE3 LYS A 268 -11.082 -11.286 6.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 -12.279 -11.900 8.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 -10.682 -12.470 8.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 -11.142 -11.099 9.743 1.00 0.00 H new ATOM 894 N TYR A 269 -5.036 -9.167 4.543 1.00 0.00 N ATOM 895 CA TYR A 269 -3.637 -8.908 4.214 1.00 0.00 C ATOM 896 C TYR A 269 -3.427 -7.445 3.830 1.00 0.00 C ATOM 897 O TYR A 269 -2.451 -7.106 3.162 1.00 0.00 O ATOM 898 CB TYR A 269 -3.181 -9.810 3.066 1.00 0.00 C ATOM 899 CG TYR A 269 -2.655 -11.154 3.516 1.00 0.00 C ATOM 900 CD1 TYR A 269 -3.298 -11.875 4.512 1.00 0.00 C ATOM 901 CD2 TYR A 269 -1.515 -11.702 2.941 1.00 0.00 C ATOM 902 CE1 TYR A 269 -2.822 -13.103 4.927 1.00 0.00 C ATOM 903 CE2 TYR A 269 -1.031 -12.931 3.349 1.00 0.00 C ATOM 904 CZ TYR A 269 -1.688 -13.627 4.341 1.00 0.00 C ATOM 905 OH TYR A 269 -1.210 -14.851 4.749 1.00 0.00 O ATOM 0 H TYR A 269 -5.675 -9.106 3.750 1.00 0.00 H new ATOM 0 HA TYR A 269 -3.041 -9.126 5.100 1.00 0.00 H new ATOM 0 HB2 TYR A 269 -4.018 -9.967 2.386 1.00 0.00 H new ATOM 0 HB3 TYR A 269 -2.403 -9.297 2.501 1.00 0.00 H new ATOM 0 HD1 TYR A 269 -4.187 -11.468 4.971 1.00 0.00 H new ATOM 0 HD2 TYR A 269 -0.999 -11.159 2.163 1.00 0.00 H new ATOM 0 HE1 TYR A 269 -3.334 -13.650 5.705 1.00 0.00 H new ATOM 0 HE2 TYR A 269 -0.143 -13.344 2.893 1.00 0.00 H new ATOM 0 HH TYR A 269 -0.406 -15.076 4.236 1.00 0.00 H new ATOM 915 N GLY A 270 -4.349 -6.583 4.250 1.00 0.00 N ATOM 916 CA GLY A 270 -4.240 -5.173 3.931 1.00 0.00 C ATOM 917 C GLY A 270 -4.249 -4.292 5.166 1.00 0.00 C ATOM 918 O GLY A 270 -5.179 -4.349 5.970 1.00 0.00 O ATOM 0 H GLY A 270 -5.167 -6.836 4.804 1.00 0.00 H new ATOM 0 HA2 GLY A 270 -3.319 -5.001 3.373 1.00 0.00 H new ATOM 0 HA3 GLY A 270 -5.066 -4.887 3.279 1.00 0.00 H new ATOM 922 N LEU A 271 -3.213 -3.475 5.313 1.00 0.00 N ATOM 923 CA LEU A 271 -3.104 -2.576 6.454 1.00 0.00 C ATOM 924 C LEU A 271 -2.786 -1.157 5.993 1.00 0.00 C ATOM 925 O LEU A 271 -1.822 -0.933 5.262 1.00 0.00 O ATOM 926 CB LEU A 271 -2.024 -3.068 7.419 1.00 0.00 C ATOM 927 CG LEU A 271 -2.249 -2.703 8.887 1.00 0.00 C ATOM 928 CD1 LEU A 271 -3.512 -3.366 9.417 1.00 0.00 C ATOM 929 CD2 LEU A 271 -1.042 -3.100 9.724 1.00 0.00 C ATOM 0 H LEU A 271 -2.436 -3.417 4.655 1.00 0.00 H new ATOM 0 HA LEU A 271 -4.063 -2.566 6.973 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -1.953 -4.153 7.337 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -1.064 -2.661 7.103 1.00 0.00 H new ATOM 0 HG LEU A 271 -2.377 -1.623 8.958 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -3.654 -3.094 10.463 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -4.370 -3.031 8.835 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -3.417 -4.449 9.333 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -1.218 -2.833 10.766 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.883 -4.176 9.646 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -0.158 -2.576 9.360 1.00 0.00 H new ATOM 941 N PHE A 272 -3.610 -0.205 6.418 1.00 0.00 N ATOM 942 CA PHE A 272 -3.422 1.193 6.043 1.00 0.00 C ATOM 943 C PHE A 272 -2.730 1.972 7.156 1.00 0.00 C ATOM 944 O PHE A 272 -3.308 2.188 8.219 1.00 0.00 O ATOM 945 CB PHE A 272 -4.774 1.838 5.729 1.00 0.00 C ATOM 946 CG PHE A 272 -5.317 1.478 4.375 1.00 0.00 C ATOM 947 CD1 PHE A 272 -5.414 0.154 3.981 1.00 0.00 C ATOM 948 CD2 PHE A 272 -5.734 2.468 3.498 1.00 0.00 C ATOM 949 CE1 PHE A 272 -5.920 -0.179 2.738 1.00 0.00 C ATOM 950 CE2 PHE A 272 -6.239 2.142 2.254 1.00 0.00 C ATOM 951 CZ PHE A 272 -6.332 0.818 1.873 1.00 0.00 C ATOM 0 H PHE A 272 -4.414 -0.375 7.022 1.00 0.00 H new ATOM 0 HA PHE A 272 -2.789 1.222 5.156 1.00 0.00 H new ATOM 0 HB2 PHE A 272 -5.494 1.539 6.490 1.00 0.00 H new ATOM 0 HB3 PHE A 272 -4.673 2.921 5.794 1.00 0.00 H new ATOM 0 HD1 PHE A 272 -5.091 -0.628 4.652 1.00 0.00 H new ATOM 0 HD2 PHE A 272 -5.663 3.505 3.791 1.00 0.00 H new ATOM 0 HE1 PHE A 272 -5.993 -1.215 2.443 1.00 0.00 H new ATOM 0 HE2 PHE A 272 -6.561 2.922 1.580 1.00 0.00 H new ATOM 0 HZ PHE A 272 -6.726 0.562 0.901 1.00 0.00 H new ATOM 961 N ALA A 273 -1.498 2.404 6.904 1.00 0.00 N ATOM 962 CA ALA A 273 -0.741 3.170 7.888 1.00 0.00 C ATOM 963 C ALA A 273 0.025 4.314 7.227 1.00 0.00 C ATOM 964 O ALA A 273 0.426 4.218 6.067 1.00 0.00 O ATOM 965 CB ALA A 273 0.213 2.271 8.661 1.00 0.00 C ATOM 0 H ALA A 273 -1.003 2.237 6.028 1.00 0.00 H new ATOM 0 HA ALA A 273 -1.455 3.600 8.590 1.00 0.00 H new ATOM 0 HB1 ALA A 273 0.765 2.866 9.388 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -0.355 1.499 9.180 1.00 0.00 H new ATOM 0 HB3 ALA A 273 0.913 1.803 7.969 1.00 0.00 H new ATOM 971 N PRO A 274 0.236 5.416 7.965 1.00 0.00 N ATOM 972 CA PRO A 274 0.954 6.589 7.458 1.00 0.00 C ATOM 973 C PRO A 274 2.305 6.233 6.849 1.00 0.00 C ATOM 974 O PRO A 274 2.842 5.152 7.093 1.00 0.00 O ATOM 975 CB PRO A 274 1.156 7.452 8.702 1.00 0.00 C ATOM 976 CG PRO A 274 0.069 7.049 9.636 1.00 0.00 C ATOM 977 CD PRO A 274 -0.217 5.601 9.354 1.00 0.00 C ATOM 0 HA PRO A 274 0.399 7.081 6.659 1.00 0.00 H new ATOM 0 HB2 PRO A 274 2.138 7.283 9.144 1.00 0.00 H new ATOM 0 HB3 PRO A 274 1.094 8.513 8.460 1.00 0.00 H new ATOM 0 HG2 PRO A 274 0.375 7.190 10.673 1.00 0.00 H new ATOM 0 HG3 PRO A 274 -0.822 7.658 9.481 1.00 0.00 H new ATOM 0 HD2 PRO A 274 0.320 4.946 10.040 1.00 0.00 H new ATOM 0 HD3 PRO A 274 -1.278 5.375 9.462 1.00 0.00 H new ATOM 985 N VAL A 275 2.850 7.153 6.062 1.00 0.00 N ATOM 986 CA VAL A 275 4.142 6.943 5.424 1.00 0.00 C ATOM 987 C VAL A 275 5.270 6.991 6.451 1.00 0.00 C ATOM 988 O VAL A 275 6.285 6.310 6.304 1.00 0.00 O ATOM 989 CB VAL A 275 4.407 7.998 4.329 1.00 0.00 C ATOM 990 CG1 VAL A 275 4.426 9.397 4.926 1.00 0.00 C ATOM 991 CG2 VAL A 275 5.711 7.700 3.604 1.00 0.00 C ATOM 0 H VAL A 275 2.416 8.052 5.851 1.00 0.00 H new ATOM 0 HA VAL A 275 4.115 5.956 4.963 1.00 0.00 H new ATOM 0 HB VAL A 275 3.596 7.951 3.602 1.00 0.00 H new ATOM 0 HG11 VAL A 275 4.614 10.126 4.138 1.00 0.00 H new ATOM 0 HG12 VAL A 275 3.463 9.607 5.392 1.00 0.00 H new ATOM 0 HG13 VAL A 275 5.214 9.462 5.676 1.00 0.00 H new ATOM 0 HG21 VAL A 275 5.881 8.454 2.836 1.00 0.00 H new ATOM 0 HG22 VAL A 275 6.535 7.716 4.317 1.00 0.00 H new ATOM 0 HG23 VAL A 275 5.652 6.716 3.139 1.00 0.00 H new ATOM 1001 N HIS A 276 5.084 7.798 7.493 1.00 0.00 N ATOM 1002 CA HIS A 276 6.087 7.930 8.543 1.00 0.00 C ATOM 1003 C HIS A 276 6.070 6.717 9.468 1.00 0.00 C ATOM 1004 O HIS A 276 7.080 6.383 10.088 1.00 0.00 O ATOM 1005 CB HIS A 276 5.861 9.210 9.350 1.00 0.00 C ATOM 1006 CG HIS A 276 4.450 9.393 9.819 1.00 0.00 C ATOM 1007 ND1 HIS A 276 3.612 8.548 10.467 1.00 0.00 N flip ATOM 1008 CD2 HIS A 276 3.745 10.565 9.642 1.00 0.00 C flip ATOM 1009 CE1 HIS A 276 2.432 9.220 10.668 1.00 0.00 C flip ATOM 1010 NE2 HIS A 276 2.537 10.434 10.162 1.00 0.00 N flip ATOM 0 H HIS A 276 4.250 8.368 7.631 1.00 0.00 H new ATOM 0 HA HIS A 276 7.065 7.987 8.065 1.00 0.00 H new ATOM 0 HB2 HIS A 276 6.523 9.203 10.216 1.00 0.00 H new ATOM 0 HB3 HIS A 276 6.144 10.067 8.739 1.00 0.00 H new ATOM 0 HD2 HIS A 276 4.122 11.452 9.154 1.00 0.00 H new ATOM 0 HE1 HIS A 276 1.558 8.820 11.161 1.00 0.00 H new ATOM 0 HE2 HIS A 276 1.810 11.149 10.171 1.00 0.00 H new ATOM 1019 N LYS A 277 4.920 6.053 9.551 1.00 0.00 N ATOM 1020 CA LYS A 277 4.781 4.873 10.396 1.00 0.00 C ATOM 1021 C LYS A 277 5.358 3.643 9.706 1.00 0.00 C ATOM 1022 O LYS A 277 5.676 2.647 10.355 1.00 0.00 O ATOM 1023 CB LYS A 277 3.312 4.627 10.743 1.00 0.00 C ATOM 1024 CG LYS A 277 2.800 5.487 11.887 1.00 0.00 C ATOM 1025 CD LYS A 277 2.382 4.638 13.078 1.00 0.00 C ATOM 1026 CE LYS A 277 3.463 4.594 14.145 1.00 0.00 C ATOM 1027 NZ LYS A 277 4.819 4.405 13.560 1.00 0.00 N ATOM 0 H LYS A 277 4.074 6.312 9.044 1.00 0.00 H new ATOM 0 HA LYS A 277 5.337 5.054 11.316 1.00 0.00 H new ATOM 0 HB2 LYS A 277 2.703 4.815 9.859 1.00 0.00 H new ATOM 0 HB3 LYS A 277 3.181 3.577 11.003 1.00 0.00 H new ATOM 0 HG2 LYS A 277 3.577 6.188 12.193 1.00 0.00 H new ATOM 0 HG3 LYS A 277 1.952 6.081 11.546 1.00 0.00 H new ATOM 0 HD2 LYS A 277 1.464 5.040 13.507 1.00 0.00 H new ATOM 0 HD3 LYS A 277 2.160 3.625 12.743 1.00 0.00 H new ATOM 0 HE2 LYS A 277 3.442 5.520 14.720 1.00 0.00 H new ATOM 0 HE3 LYS A 277 3.252 3.782 14.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 277 5.470 4.063 14.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 277 4.771 3.708 12.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 277 5.165 5.312 13.186 1.00 0.00 H new ATOM 1041 N VAL A 278 5.496 3.720 8.385 1.00 0.00 N ATOM 1042 CA VAL A 278 6.037 2.611 7.615 1.00 0.00 C ATOM 1043 C VAL A 278 7.519 2.810 7.331 1.00 0.00 C ATOM 1044 O VAL A 278 7.967 3.922 7.055 1.00 0.00 O ATOM 1045 CB VAL A 278 5.292 2.423 6.282 1.00 0.00 C ATOM 1046 CG1 VAL A 278 5.714 1.122 5.618 1.00 0.00 C ATOM 1047 CG2 VAL A 278 3.786 2.451 6.496 1.00 0.00 C ATOM 0 H VAL A 278 5.241 4.537 7.830 1.00 0.00 H new ATOM 0 HA VAL A 278 5.901 1.716 8.223 1.00 0.00 H new ATOM 0 HB VAL A 278 5.556 3.250 5.623 1.00 0.00 H new ATOM 0 HG11 VAL A 278 5.178 1.004 4.676 1.00 0.00 H new ATOM 0 HG12 VAL A 278 6.787 1.143 5.425 1.00 0.00 H new ATOM 0 HG13 VAL A 278 5.480 0.285 6.276 1.00 0.00 H new ATOM 0 HG21 VAL A 278 3.280 2.316 5.540 1.00 0.00 H new ATOM 0 HG22 VAL A 278 3.500 1.647 7.174 1.00 0.00 H new ATOM 0 HG23 VAL A 278 3.498 3.410 6.927 1.00 0.00 H new ATOM 1057 N THR A 279 8.274 1.721 7.404 1.00 0.00 N ATOM 1058 CA THR A 279 9.708 1.766 7.158 1.00 0.00 C ATOM 1059 C THR A 279 10.159 0.557 6.348 1.00 0.00 C ATOM 1060 O THR A 279 9.668 -0.555 6.549 1.00 0.00 O ATOM 1061 CB THR A 279 10.465 1.820 8.484 1.00 0.00 C ATOM 1062 OG1 THR A 279 9.612 2.248 9.533 1.00 0.00 O ATOM 1063 CG2 THR A 279 11.658 2.748 8.457 1.00 0.00 C ATOM 0 H THR A 279 7.915 0.794 7.632 1.00 0.00 H new ATOM 0 HA THR A 279 9.929 2.665 6.582 1.00 0.00 H new ATOM 0 HB THR A 279 10.820 0.803 8.653 1.00 0.00 H new ATOM 0 HG1 THR A 279 10.115 2.274 10.374 1.00 0.00 H new ATOM 0 HG21 THR A 279 12.149 2.738 9.430 1.00 0.00 H new ATOM 0 HG22 THR A 279 12.360 2.415 7.693 1.00 0.00 H new ATOM 0 HG23 THR A 279 11.326 3.761 8.229 1.00 0.00 H new ATOM 1071 N LYS A 280 11.099 0.776 5.436 1.00 0.00 N ATOM 1072 CA LYS A 280 11.616 -0.299 4.600 1.00 0.00 C ATOM 1073 C LYS A 280 12.352 -1.334 5.445 1.00 0.00 C ATOM 1074 O LYS A 280 13.247 -0.993 6.219 1.00 0.00 O ATOM 1075 CB LYS A 280 12.547 0.265 3.524 1.00 0.00 C ATOM 1076 CG LYS A 280 12.110 -0.066 2.106 1.00 0.00 C ATOM 1077 CD LYS A 280 13.207 0.241 1.100 1.00 0.00 C ATOM 1078 CE LYS A 280 14.069 -0.980 0.825 1.00 0.00 C ATOM 1079 NZ LYS A 280 15.370 -0.613 0.203 1.00 0.00 N ATOM 0 H LYS A 280 11.518 1.689 5.257 1.00 0.00 H new ATOM 0 HA LYS A 280 10.773 -0.789 4.113 1.00 0.00 H new ATOM 0 HB2 LYS A 280 12.602 1.348 3.635 1.00 0.00 H new ATOM 0 HB3 LYS A 280 13.552 -0.124 3.685 1.00 0.00 H new ATOM 0 HG2 LYS A 280 11.842 -1.121 2.043 1.00 0.00 H new ATOM 0 HG3 LYS A 280 11.216 0.505 1.857 1.00 0.00 H new ATOM 0 HD2 LYS A 280 12.761 0.590 0.169 1.00 0.00 H new ATOM 0 HD3 LYS A 280 13.831 1.051 1.477 1.00 0.00 H new ATOM 0 HE2 LYS A 280 14.251 -1.514 1.758 1.00 0.00 H new ATOM 0 HE3 LYS A 280 13.532 -1.663 0.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 15.928 -1.474 0.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 15.198 -0.126 -0.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 15.895 0.018 0.842 1.00 0.00 H new ATOM 1093 N ILE A 281 11.971 -2.596 5.292 1.00 0.00 N ATOM 1094 CA ILE A 281 12.596 -3.680 6.042 1.00 0.00 C ATOM 1095 C ILE A 281 14.037 -3.903 5.592 1.00 0.00 C ATOM 1096 O ILE A 281 14.865 -4.401 6.354 1.00 0.00 O ATOM 1097 CB ILE A 281 11.804 -4.995 5.889 1.00 0.00 C ATOM 1098 CG1 ILE A 281 12.435 -6.103 6.735 1.00 0.00 C ATOM 1099 CG2 ILE A 281 11.738 -5.410 4.427 1.00 0.00 C ATOM 1100 CD1 ILE A 281 11.422 -6.989 7.424 1.00 0.00 C ATOM 0 H ILE A 281 11.232 -2.895 4.655 1.00 0.00 H new ATOM 0 HA ILE A 281 12.593 -3.385 7.091 1.00 0.00 H new ATOM 0 HB ILE A 281 10.787 -4.829 6.245 1.00 0.00 H new ATOM 0 HG12 ILE A 281 13.070 -6.719 6.098 1.00 0.00 H new ATOM 0 HG13 ILE A 281 13.081 -5.651 7.487 1.00 0.00 H new ATOM 0 HG21 ILE A 281 11.176 -6.340 4.338 1.00 0.00 H new ATOM 0 HG22 ILE A 281 11.243 -4.629 3.849 1.00 0.00 H new ATOM 0 HG23 ILE A 281 12.748 -5.559 4.045 1.00 0.00 H new ATOM 0 HD11 ILE A 281 11.941 -7.751 8.005 1.00 0.00 H new ATOM 0 HD12 ILE A 281 10.803 -6.386 8.088 1.00 0.00 H new ATOM 0 HD13 ILE A 281 10.791 -7.470 6.676 1.00 0.00 H new ATOM 1198 N GLU B 449 -2.292 3.956 14.654 1.00 0.00 N ATOM 1199 CA GLU B 449 -2.333 4.844 13.496 1.00 0.00 C ATOM 1200 C GLU B 449 -2.487 4.054 12.203 1.00 0.00 C ATOM 1201 O GLU B 449 -2.165 4.553 11.128 1.00 0.00 O ATOM 1202 CB GLU B 449 -1.056 5.683 13.417 1.00 0.00 C ATOM 1203 CG GLU B 449 -0.489 6.070 14.774 1.00 0.00 C ATOM 1204 CD GLU B 449 0.148 7.447 14.769 1.00 0.00 C ATOM 1205 OE1 GLU B 449 1.128 7.645 14.020 1.00 0.00 O ATOM 1206 OE2 GLU B 449 -0.335 8.326 15.513 1.00 0.00 O ATOM 0 HA GLU B 449 -3.196 5.499 13.618 1.00 0.00 H new ATOM 0 HB2 GLU B 449 -0.300 5.126 12.864 1.00 0.00 H new ATOM 0 HB3 GLU B 449 -1.263 6.590 12.849 1.00 0.00 H new ATOM 0 HG2 GLU B 449 -1.286 6.045 15.517 1.00 0.00 H new ATOM 0 HG3 GLU B 449 0.253 5.332 15.078 1.00 0.00 H new ATOM 1213 N GLU B 450 -2.975 2.823 12.303 1.00 0.00 N ATOM 1214 CA GLU B 450 -3.152 1.993 11.121 1.00 0.00 C ATOM 1215 C GLU B 450 -4.513 1.304 11.125 1.00 0.00 C ATOM 1216 O GLU B 450 -5.097 1.063 12.182 1.00 0.00 O ATOM 1217 CB GLU B 450 -2.026 0.961 11.023 1.00 0.00 C ATOM 1218 CG GLU B 450 -2.158 -0.193 12.003 1.00 0.00 C ATOM 1219 CD GLU B 450 -2.015 0.249 13.447 1.00 0.00 C ATOM 1220 OE1 GLU B 450 -2.974 0.841 13.984 1.00 0.00 O ATOM 1221 OE2 GLU B 450 -0.944 0.002 14.040 1.00 0.00 O ATOM 0 H GLU B 450 -3.252 2.383 13.180 1.00 0.00 H new ATOM 0 HA GLU B 450 -3.111 2.641 10.245 1.00 0.00 H new ATOM 0 HB2 GLU B 450 -2.000 0.562 10.009 1.00 0.00 H new ATOM 0 HB3 GLU B 450 -1.073 1.461 11.193 1.00 0.00 H new ATOM 0 HG2 GLU B 450 -3.128 -0.671 11.867 1.00 0.00 H new ATOM 0 HG3 GLU B 450 -1.399 -0.943 11.780 1.00 0.00 H new ATOM 1228 N TYR B 451 -5.012 0.994 9.934 1.00 0.00 N ATOM 1229 CA TYR B 451 -6.305 0.336 9.790 1.00 0.00 C ATOM 1230 C TYR B 451 -6.239 -0.773 8.747 1.00 0.00 C ATOM 1231 O TYR B 451 -5.134 -1.309 8.521 1.00 0.00 O ATOM 1232 CB TYR B 451 -7.373 1.358 9.397 1.00 0.00 C ATOM 1233 CG TYR B 451 -7.898 2.163 10.565 1.00 0.00 C ATOM 1234 CD1 TYR B 451 -7.209 3.274 11.034 1.00 0.00 C ATOM 1235 CD2 TYR B 451 -9.085 1.812 11.198 1.00 0.00 C ATOM 1236 CE1 TYR B 451 -7.687 4.013 12.100 1.00 0.00 C ATOM 1237 CE2 TYR B 451 -9.568 2.546 12.264 1.00 0.00 C ATOM 1238 CZ TYR B 451 -8.866 3.645 12.711 1.00 0.00 C ATOM 1239 OH TYR B 451 -9.345 4.378 13.773 1.00 0.00 O ATOM 1240 OXT TYR B 451 -7.295 -1.097 8.163 1.00 0.00 O ATOM 0 H TYR B 451 -4.539 1.189 9.052 1.00 0.00 H new ATOM 0 HA TYR B 451 -6.569 -0.110 10.749 1.00 0.00 H new ATOM 0 HB2 TYR B 451 -6.957 2.039 8.655 1.00 0.00 H new ATOM 0 HB3 TYR B 451 -8.205 0.838 8.922 1.00 0.00 H new ATOM 0 HD1 TYR B 451 -6.284 3.565 10.558 1.00 0.00 H new ATOM 0 HD2 TYR B 451 -9.638 0.952 10.851 1.00 0.00 H new ATOM 0 HE1 TYR B 451 -7.139 4.874 12.452 1.00 0.00 H new ATOM 0 HE2 TYR B 451 -10.492 2.260 12.745 1.00 0.00 H new ATOM 0 HH TYR B 451 -10.186 3.986 14.088 1.00 0.00 H new