USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 594 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 272 LYS NZ :NH3+ -140:sc= -0.348 (180deg=-0.852) USER MOD Set 1.2: A 276 HIS : no HE2:sc= -4.06 K(o=-4.4,f=-6!) USER MOD Single : A 220 SER OG : rot 160:sc= 0 USER MOD Single : A 221 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0 USER MOD Single : A 227 LYS NZ :NH3+ -107:sc= -1.57 (180deg=-4.95!) USER MOD Single : A 228 ASN : amide:sc= -1.09 K(o=-1.1,f=-0.35) USER MOD Single : A 233 THR OG1 : rot -69:sc= 1.31 USER MOD Single : A 239 GLN : amide:sc= -0.0043 K(o=-0.0043,f=-0.97) USER MOD Single : A 241 THR OG1 : rot 83:sc= 1.23 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 247 SER OG : rot 180:sc= 0 USER MOD Single : A 259 THR OG1 : rot 44:sc= 0.0348 USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot 127:sc= 0.021 USER MOD Single : A 281 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 283 HIS : no HD1:sc= -11.1! C(o=-11!,f=-12!) USER MOD Single : A 284 HIS : no HD1:sc= -2.54! K(o=-2.5!,f=-1.3) USER MOD Single : A 288 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N SER A 220 -8.864 15.184 -0.691 1.00 0.00 N ATOM 91 CA SER A 220 -7.698 15.051 -1.556 1.00 0.00 C ATOM 92 C SER A 220 -7.903 13.936 -2.577 1.00 0.00 C ATOM 93 O SER A 220 -8.480 12.893 -2.267 1.00 0.00 O ATOM 94 CB SER A 220 -6.447 14.771 -0.722 1.00 0.00 C ATOM 95 OG SER A 220 -5.269 15.029 -1.467 1.00 0.00 O ATOM 0 HA SER A 220 -7.565 15.991 -2.092 1.00 0.00 H new ATOM 0 HB2 SER A 220 -6.457 15.391 0.174 1.00 0.00 H new ATOM 0 HB3 SER A 220 -6.452 13.732 -0.391 1.00 0.00 H new ATOM 0 HG SER A 220 -4.516 15.158 -0.854 1.00 0.00 H new ATOM 101 N LYS A 221 -7.427 14.163 -3.796 1.00 0.00 N ATOM 102 CA LYS A 221 -7.555 13.179 -4.864 1.00 0.00 C ATOM 103 C LYS A 221 -6.276 12.360 -5.006 1.00 0.00 C ATOM 104 O LYS A 221 -6.315 11.186 -5.375 1.00 0.00 O ATOM 105 CB LYS A 221 -7.879 13.873 -6.189 1.00 0.00 C ATOM 106 CG LYS A 221 -9.119 14.747 -6.131 1.00 0.00 C ATOM 107 CD LYS A 221 -9.047 15.885 -7.135 1.00 0.00 C ATOM 108 CE LYS A 221 -9.203 15.381 -8.561 1.00 0.00 C ATOM 109 NZ LYS A 221 -9.641 16.462 -9.487 1.00 0.00 N ATOM 0 H LYS A 221 -6.948 15.021 -4.069 1.00 0.00 H new ATOM 0 HA LYS A 221 -8.371 12.504 -4.606 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -7.027 14.485 -6.487 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -8.014 13.117 -6.962 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -10.002 14.140 -6.330 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -9.232 15.154 -5.126 1.00 0.00 H new ATOM 0 HD2 LYS A 221 -9.829 16.613 -6.918 1.00 0.00 H new ATOM 0 HD3 LYS A 221 -8.093 16.402 -7.033 1.00 0.00 H new ATOM 0 HE2 LYS A 221 -8.255 14.969 -8.906 1.00 0.00 H new ATOM 0 HE3 LYS A 221 -9.930 14.569 -8.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 -9.736 16.078 -10.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 -10.558 16.838 -9.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 -8.935 17.226 -9.487 1.00 0.00 H new ATOM 123 N THR A 222 -5.141 12.987 -4.710 1.00 0.00 N ATOM 124 CA THR A 222 -3.851 12.317 -4.804 1.00 0.00 C ATOM 125 C THR A 222 -3.498 11.616 -3.497 1.00 0.00 C ATOM 126 O THR A 222 -2.329 11.350 -3.219 1.00 0.00 O ATOM 127 CB THR A 222 -2.727 13.308 -5.161 1.00 0.00 C ATOM 128 OG1 THR A 222 -2.732 14.405 -4.240 1.00 0.00 O ATOM 129 CG2 THR A 222 -2.896 13.830 -6.580 1.00 0.00 C ATOM 0 H THR A 222 -5.090 13.958 -4.403 1.00 0.00 H new ATOM 0 HA THR A 222 -3.938 11.576 -5.599 1.00 0.00 H new ATOM 0 HB THR A 222 -1.774 12.783 -5.096 1.00 0.00 H new ATOM 0 HG1 THR A 222 -2.014 15.030 -4.472 1.00 0.00 H new ATOM 0 HG21 THR A 222 -2.091 14.528 -6.809 1.00 0.00 H new ATOM 0 HG22 THR A 222 -2.864 12.996 -7.281 1.00 0.00 H new ATOM 0 HG23 THR A 222 -3.855 14.341 -6.668 1.00 0.00 H new ATOM 137 N VAL A 223 -4.517 11.318 -2.697 1.00 0.00 N ATOM 138 CA VAL A 223 -4.315 10.645 -1.419 1.00 0.00 C ATOM 139 C VAL A 223 -5.418 9.628 -1.153 1.00 0.00 C ATOM 140 O VAL A 223 -6.595 9.981 -1.069 1.00 0.00 O ATOM 141 CB VAL A 223 -4.270 11.653 -0.256 1.00 0.00 C ATOM 142 CG1 VAL A 223 -4.063 10.933 1.068 1.00 0.00 C ATOM 143 CG2 VAL A 223 -3.176 12.685 -0.487 1.00 0.00 C ATOM 0 H VAL A 223 -5.491 11.532 -2.911 1.00 0.00 H new ATOM 0 HA VAL A 223 -3.357 10.129 -1.481 1.00 0.00 H new ATOM 0 HB VAL A 223 -5.227 12.174 -0.213 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -4.034 11.662 1.878 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -4.885 10.237 1.236 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -3.122 10.384 1.040 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -3.159 13.389 0.345 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -2.211 12.183 -0.557 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -3.373 13.223 -1.414 1.00 0.00 H new ATOM 153 N ILE A 224 -5.030 8.364 -1.021 1.00 0.00 N ATOM 154 CA ILE A 224 -5.987 7.294 -0.763 1.00 0.00 C ATOM 155 C ILE A 224 -5.663 6.570 0.539 1.00 0.00 C ATOM 156 O ILE A 224 -4.499 6.457 0.927 1.00 0.00 O ATOM 157 CB ILE A 224 -6.013 6.272 -1.914 1.00 0.00 C ATOM 158 CG1 ILE A 224 -6.289 6.975 -3.244 1.00 0.00 C ATOM 159 CG2 ILE A 224 -7.060 5.201 -1.648 1.00 0.00 C ATOM 160 CD1 ILE A 224 -5.797 6.204 -4.449 1.00 0.00 C ATOM 0 H ILE A 224 -4.060 8.055 -1.088 1.00 0.00 H new ATOM 0 HA ILE A 224 -6.969 7.761 -0.682 1.00 0.00 H new ATOM 0 HB ILE A 224 -5.037 5.791 -1.975 1.00 0.00 H new ATOM 0 HG12 ILE A 224 -7.362 7.141 -3.342 1.00 0.00 H new ATOM 0 HG13 ILE A 224 -5.815 7.956 -3.232 1.00 0.00 H new ATOM 0 HG21 ILE A 224 -7.066 4.486 -2.471 1.00 0.00 H new ATOM 0 HG22 ILE A 224 -6.823 4.683 -0.719 1.00 0.00 H new ATOM 0 HG23 ILE A 224 -8.042 5.666 -1.564 1.00 0.00 H new ATOM 0 HD11 ILE A 224 -6.027 6.762 -5.357 1.00 0.00 H new ATOM 0 HD12 ILE A 224 -4.719 6.061 -4.374 1.00 0.00 H new ATOM 0 HD13 ILE A 224 -6.290 5.233 -4.486 1.00 0.00 H new ATOM 172 N LEU A 225 -6.699 6.078 1.210 1.00 0.00 N ATOM 173 CA LEU A 225 -6.525 5.361 2.468 1.00 0.00 C ATOM 174 C LEU A 225 -7.162 3.977 2.399 1.00 0.00 C ATOM 175 O LEU A 225 -8.375 3.849 2.235 1.00 0.00 O ATOM 176 CB LEU A 225 -7.136 6.160 3.621 1.00 0.00 C ATOM 177 CG LEU A 225 -6.751 7.638 3.692 1.00 0.00 C ATOM 178 CD1 LEU A 225 -7.570 8.353 4.755 1.00 0.00 C ATOM 179 CD2 LEU A 225 -5.263 7.789 3.971 1.00 0.00 C ATOM 0 H LEU A 225 -7.668 6.163 0.904 1.00 0.00 H new ATOM 0 HA LEU A 225 -5.456 5.240 2.644 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -8.221 6.091 3.549 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -6.848 5.685 4.559 1.00 0.00 H new ATOM 0 HG LEU A 225 -6.967 8.096 2.727 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -7.282 9.404 4.791 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -8.630 8.275 4.511 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -7.386 7.893 5.726 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -5.007 8.848 4.018 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -5.021 7.315 4.922 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -4.693 7.313 3.173 1.00 0.00 H new ATOM 191 N ALA A 226 -6.336 2.944 2.528 1.00 0.00 N ATOM 192 CA ALA A 226 -6.820 1.570 2.484 1.00 0.00 C ATOM 193 C ALA A 226 -7.141 1.056 3.884 1.00 0.00 C ATOM 194 O ALA A 226 -6.398 1.306 4.834 1.00 0.00 O ATOM 195 CB ALA A 226 -5.793 0.670 1.812 1.00 0.00 C ATOM 0 H ALA A 226 -5.329 3.033 2.664 1.00 0.00 H new ATOM 0 HA ALA A 226 -7.740 1.553 1.899 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -6.168 -0.353 1.786 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -5.615 1.017 0.794 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -4.859 0.700 2.374 1.00 0.00 H new ATOM 201 N LYS A 227 -8.251 0.337 4.005 1.00 0.00 N ATOM 202 CA LYS A 227 -8.671 -0.213 5.289 1.00 0.00 C ATOM 203 C LYS A 227 -9.012 -1.694 5.160 1.00 0.00 C ATOM 204 O LYS A 227 -9.382 -2.165 4.086 1.00 0.00 O ATOM 205 CB LYS A 227 -9.881 0.556 5.825 1.00 0.00 C ATOM 206 CG LYS A 227 -9.588 2.013 6.135 1.00 0.00 C ATOM 207 CD LYS A 227 -10.824 2.880 5.962 1.00 0.00 C ATOM 208 CE LYS A 227 -10.558 4.319 6.376 1.00 0.00 C ATOM 209 NZ LYS A 227 -9.896 5.095 5.291 1.00 0.00 N ATOM 0 H LYS A 227 -8.877 0.121 3.229 1.00 0.00 H new ATOM 0 HA LYS A 227 -7.843 -0.109 5.990 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -10.687 0.504 5.093 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -10.240 0.066 6.730 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -9.221 2.102 7.157 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -8.795 2.373 5.479 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -11.146 2.853 4.921 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -11.641 2.474 6.558 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -11.499 4.800 6.644 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -9.929 4.330 7.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -8.899 5.257 5.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -9.949 4.561 4.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -10.377 6.010 5.175 1.00 0.00 H new ATOM 223 N ASN A 228 -8.887 -2.423 6.265 1.00 0.00 N ATOM 224 CA ASN A 228 -9.183 -3.851 6.275 1.00 0.00 C ATOM 225 C ASN A 228 -8.088 -4.639 5.562 1.00 0.00 C ATOM 226 O ASN A 228 -8.369 -5.476 4.703 1.00 0.00 O ATOM 227 CB ASN A 228 -10.534 -4.118 5.609 1.00 0.00 C ATOM 228 CG ASN A 228 -11.231 -5.337 6.183 1.00 0.00 C ATOM 229 OD1 ASN A 228 -11.965 -5.241 7.166 1.00 0.00 O ATOM 230 ND2 ASN A 228 -11.002 -6.492 5.569 1.00 0.00 N ATOM 0 H ASN A 228 -8.583 -2.049 7.164 1.00 0.00 H new ATOM 0 HA ASN A 228 -9.226 -4.180 7.313 1.00 0.00 H new ATOM 0 HB2 ASN A 228 -11.175 -3.245 5.731 1.00 0.00 H new ATOM 0 HB3 ASN A 228 -10.387 -4.258 4.538 1.00 0.00 H new ATOM 0 HD21 ASN A 228 -11.442 -7.347 5.910 1.00 0.00 H new ATOM 0 HD22 ASN A 228 -10.386 -6.524 4.757 1.00 0.00 H new ATOM 237 N LEU A 229 -6.839 -4.367 5.925 1.00 0.00 N ATOM 238 CA LEU A 229 -5.701 -5.051 5.321 1.00 0.00 C ATOM 239 C LEU A 229 -5.154 -6.126 6.254 1.00 0.00 C ATOM 240 O LEU A 229 -5.055 -5.939 7.467 1.00 0.00 O ATOM 241 CB LEU A 229 -4.599 -4.045 4.982 1.00 0.00 C ATOM 242 CG LEU A 229 -4.871 -3.127 3.790 1.00 0.00 C ATOM 243 CD1 LEU A 229 -3.936 -1.928 3.814 1.00 0.00 C ATOM 244 CD2 LEU A 229 -4.725 -3.893 2.483 1.00 0.00 C ATOM 0 H LEU A 229 -6.589 -3.678 6.634 1.00 0.00 H new ATOM 0 HA LEU A 229 -6.042 -5.532 4.404 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -4.419 -3.424 5.860 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -3.679 -4.596 4.788 1.00 0.00 H new ATOM 0 HG LEU A 229 -5.896 -2.763 3.863 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -4.145 -1.286 2.958 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -4.089 -1.365 4.735 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -2.903 -2.271 3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -4.922 -3.224 1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -3.711 -4.286 2.403 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -5.437 -4.718 2.464 1.00 0.00 H new ATOM 256 N PRO A 230 -4.788 -7.280 5.677 1.00 0.00 N ATOM 257 CA PRO A 230 -4.242 -8.408 6.438 1.00 0.00 C ATOM 258 C PRO A 230 -2.845 -8.121 6.977 1.00 0.00 C ATOM 259 O PRO A 230 -1.979 -7.629 6.254 1.00 0.00 O ATOM 260 CB PRO A 230 -4.196 -9.541 5.410 1.00 0.00 C ATOM 261 CG PRO A 230 -4.102 -8.853 4.092 1.00 0.00 C ATOM 262 CD PRO A 230 -4.878 -7.573 4.236 1.00 0.00 C ATOM 0 HA PRO A 230 -4.845 -8.636 7.317 1.00 0.00 H new ATOM 0 HB2 PRO A 230 -3.339 -10.193 5.578 1.00 0.00 H new ATOM 0 HB3 PRO A 230 -5.088 -10.165 5.468 1.00 0.00 H new ATOM 0 HG2 PRO A 230 -3.063 -8.652 3.830 1.00 0.00 H new ATOM 0 HG3 PRO A 230 -4.517 -9.473 3.298 1.00 0.00 H new ATOM 0 HD2 PRO A 230 -4.447 -6.772 3.635 1.00 0.00 H new ATOM 0 HD3 PRO A 230 -5.913 -7.692 3.914 1.00 0.00 H new ATOM 270 N ALA A 231 -2.632 -8.432 8.252 1.00 0.00 N ATOM 271 CA ALA A 231 -1.339 -8.210 8.887 1.00 0.00 C ATOM 272 C ALA A 231 -0.196 -8.615 7.962 1.00 0.00 C ATOM 273 O ALA A 231 0.924 -8.123 8.090 1.00 0.00 O ATOM 274 CB ALA A 231 -1.256 -8.977 10.198 1.00 0.00 C ATOM 0 H ALA A 231 -3.339 -8.838 8.865 1.00 0.00 H new ATOM 0 HA ALA A 231 -1.243 -7.144 9.095 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -0.285 -8.802 10.661 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -2.045 -8.637 10.869 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -1.379 -10.043 10.004 1.00 0.00 H new ATOM 280 N GLY A 232 -0.487 -9.518 7.030 1.00 0.00 N ATOM 281 CA GLY A 232 0.527 -9.975 6.098 1.00 0.00 C ATOM 282 C GLY A 232 1.092 -8.848 5.257 1.00 0.00 C ATOM 283 O GLY A 232 2.297 -8.791 5.008 1.00 0.00 O ATOM 0 H GLY A 232 -1.407 -9.941 6.904 1.00 0.00 H new ATOM 0 HA2 GLY A 232 1.336 -10.452 6.651 1.00 0.00 H new ATOM 0 HA3 GLY A 232 0.098 -10.733 5.443 1.00 0.00 H new ATOM 287 N THR A 233 0.219 -7.947 4.814 1.00 0.00 N ATOM 288 CA THR A 233 0.637 -6.818 3.994 1.00 0.00 C ATOM 289 C THR A 233 1.809 -6.079 4.630 1.00 0.00 C ATOM 290 O THR A 233 2.028 -6.166 5.839 1.00 0.00 O ATOM 291 CB THR A 233 -0.521 -5.826 3.772 1.00 0.00 C ATOM 292 OG1 THR A 233 -1.728 -6.539 3.480 1.00 0.00 O ATOM 293 CG2 THR A 233 -0.203 -4.868 2.634 1.00 0.00 C ATOM 0 H THR A 233 -0.781 -7.978 5.010 1.00 0.00 H new ATOM 0 HA THR A 233 0.947 -7.225 3.032 1.00 0.00 H new ATOM 0 HB THR A 233 -0.654 -5.247 4.686 1.00 0.00 H new ATOM 0 HG1 THR A 233 -1.657 -6.953 2.595 1.00 0.00 H new ATOM 0 HG21 THR A 233 -1.035 -4.178 2.496 1.00 0.00 H new ATOM 0 HG22 THR A 233 0.699 -4.305 2.873 1.00 0.00 H new ATOM 0 HG23 THR A 233 -0.045 -5.434 1.716 1.00 0.00 H new ATOM 301 N LEU A 234 2.560 -5.353 3.809 1.00 0.00 N ATOM 302 CA LEU A 234 3.711 -4.597 4.293 1.00 0.00 C ATOM 303 C LEU A 234 3.874 -3.296 3.514 1.00 0.00 C ATOM 304 O LEU A 234 3.466 -3.198 2.357 1.00 0.00 O ATOM 305 CB LEU A 234 4.983 -5.438 4.176 1.00 0.00 C ATOM 306 CG LEU A 234 5.026 -6.712 5.021 1.00 0.00 C ATOM 307 CD1 LEU A 234 6.165 -7.613 4.571 1.00 0.00 C ATOM 308 CD2 LEU A 234 5.167 -6.368 6.497 1.00 0.00 C ATOM 0 H LEU A 234 2.393 -5.272 2.806 1.00 0.00 H new ATOM 0 HA LEU A 234 3.540 -4.352 5.341 1.00 0.00 H new ATOM 0 HB2 LEU A 234 5.116 -5.715 3.130 1.00 0.00 H new ATOM 0 HB3 LEU A 234 5.833 -4.814 4.452 1.00 0.00 H new ATOM 0 HG LEU A 234 4.088 -7.250 4.881 1.00 0.00 H new ATOM 0 HD11 LEU A 234 6.180 -8.514 5.184 1.00 0.00 H new ATOM 0 HD12 LEU A 234 6.021 -7.887 3.526 1.00 0.00 H new ATOM 0 HD13 LEU A 234 7.112 -7.084 4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 234 5.196 -7.286 7.083 1.00 0.00 H new ATOM 0 HD22 LEU A 234 6.089 -5.808 6.654 1.00 0.00 H new ATOM 0 HD23 LEU A 234 4.317 -5.763 6.812 1.00 0.00 H new ATOM 320 N ALA A 235 4.476 -2.300 4.155 1.00 0.00 N ATOM 321 CA ALA A 235 4.698 -1.006 3.521 1.00 0.00 C ATOM 322 C ALA A 235 5.224 -1.175 2.100 1.00 0.00 C ATOM 323 O ALA A 235 4.801 -0.470 1.184 1.00 0.00 O ATOM 324 CB ALA A 235 5.664 -0.172 4.349 1.00 0.00 C ATOM 0 H ALA A 235 4.819 -2.364 5.113 1.00 0.00 H new ATOM 0 HA ALA A 235 3.742 -0.486 3.467 1.00 0.00 H new ATOM 0 HB1 ALA A 235 5.821 0.792 3.864 1.00 0.00 H new ATOM 0 HB2 ALA A 235 5.248 -0.014 5.344 1.00 0.00 H new ATOM 0 HB3 ALA A 235 6.617 -0.695 4.433 1.00 0.00 H new ATOM 330 N ALA A 236 6.149 -2.112 1.923 1.00 0.00 N ATOM 331 CA ALA A 236 6.731 -2.373 0.613 1.00 0.00 C ATOM 332 C ALA A 236 5.694 -2.952 -0.344 1.00 0.00 C ATOM 333 O ALA A 236 5.550 -2.484 -1.473 1.00 0.00 O ATOM 334 CB ALA A 236 7.918 -3.317 0.742 1.00 0.00 C ATOM 0 H ALA A 236 6.512 -2.703 2.671 1.00 0.00 H new ATOM 0 HA ALA A 236 7.077 -1.425 0.201 1.00 0.00 H new ATOM 0 HB1 ALA A 236 8.343 -3.504 -0.244 1.00 0.00 H new ATOM 0 HB2 ALA A 236 8.674 -2.865 1.384 1.00 0.00 H new ATOM 0 HB3 ALA A 236 7.588 -4.259 1.179 1.00 0.00 H new ATOM 340 N GLU A 237 4.975 -3.971 0.116 1.00 0.00 N ATOM 341 CA GLU A 237 3.952 -4.613 -0.701 1.00 0.00 C ATOM 342 C GLU A 237 2.979 -3.582 -1.264 1.00 0.00 C ATOM 343 O GLU A 237 2.815 -3.465 -2.479 1.00 0.00 O ATOM 344 CB GLU A 237 3.190 -5.654 0.122 1.00 0.00 C ATOM 345 CG GLU A 237 4.029 -6.864 0.500 1.00 0.00 C ATOM 346 CD GLU A 237 3.202 -8.128 0.636 1.00 0.00 C ATOM 347 OE1 GLU A 237 2.350 -8.183 1.547 1.00 0.00 O ATOM 348 OE2 GLU A 237 3.407 -9.061 -0.168 1.00 0.00 O ATOM 0 H GLU A 237 5.082 -4.369 1.049 1.00 0.00 H new ATOM 0 HA GLU A 237 4.448 -5.111 -1.534 1.00 0.00 H new ATOM 0 HB2 GLU A 237 2.816 -5.183 1.031 1.00 0.00 H new ATOM 0 HB3 GLU A 237 2.321 -5.988 -0.445 1.00 0.00 H new ATOM 0 HG2 GLU A 237 4.799 -7.018 -0.256 1.00 0.00 H new ATOM 0 HG3 GLU A 237 4.541 -6.666 1.442 1.00 0.00 H new ATOM 355 N ILE A 238 2.334 -2.837 -0.372 1.00 0.00 N ATOM 356 CA ILE A 238 1.378 -1.815 -0.779 1.00 0.00 C ATOM 357 C ILE A 238 2.004 -0.838 -1.768 1.00 0.00 C ATOM 358 O ILE A 238 1.562 -0.727 -2.911 1.00 0.00 O ATOM 359 CB ILE A 238 0.843 -1.030 0.433 1.00 0.00 C ATOM 360 CG1 ILE A 238 -0.019 -1.936 1.315 1.00 0.00 C ATOM 361 CG2 ILE A 238 0.046 0.180 -0.030 1.00 0.00 C ATOM 362 CD1 ILE A 238 -1.308 -2.373 0.656 1.00 0.00 C ATOM 0 H ILE A 238 2.456 -2.922 0.637 1.00 0.00 H new ATOM 0 HA ILE A 238 0.549 -2.333 -1.261 1.00 0.00 H new ATOM 0 HB ILE A 238 1.690 -0.679 1.023 1.00 0.00 H new ATOM 0 HG12 ILE A 238 0.558 -2.820 1.587 1.00 0.00 H new ATOM 0 HG13 ILE A 238 -0.254 -1.411 2.241 1.00 0.00 H new ATOM 0 HG21 ILE A 238 -0.326 0.725 0.838 1.00 0.00 H new ATOM 0 HG22 ILE A 238 0.687 0.834 -0.621 1.00 0.00 H new ATOM 0 HG23 ILE A 238 -0.796 -0.150 -0.639 1.00 0.00 H new ATOM 0 HD11 ILE A 238 -1.867 -3.012 1.339 1.00 0.00 H new ATOM 0 HD12 ILE A 238 -1.906 -1.496 0.409 1.00 0.00 H new ATOM 0 HD13 ILE A 238 -1.081 -2.926 -0.255 1.00 0.00 H new ATOM 374 N GLN A 239 3.038 -0.132 -1.320 1.00 0.00 N ATOM 375 CA GLN A 239 3.726 0.835 -2.166 1.00 0.00 C ATOM 376 C GLN A 239 3.900 0.294 -3.581 1.00 0.00 C ATOM 377 O GLN A 239 3.448 0.904 -4.549 1.00 0.00 O ATOM 378 CB GLN A 239 5.090 1.186 -1.570 1.00 0.00 C ATOM 379 CG GLN A 239 5.713 2.436 -2.170 1.00 0.00 C ATOM 380 CD GLN A 239 6.844 2.988 -1.324 1.00 0.00 C ATOM 381 OE1 GLN A 239 6.862 4.172 -0.988 1.00 0.00 O ATOM 382 NE2 GLN A 239 7.796 2.131 -0.976 1.00 0.00 N ATOM 0 H GLN A 239 3.417 -0.212 -0.376 1.00 0.00 H new ATOM 0 HA GLN A 239 3.116 1.737 -2.214 1.00 0.00 H new ATOM 0 HB2 GLN A 239 4.982 1.324 -0.494 1.00 0.00 H new ATOM 0 HB3 GLN A 239 5.768 0.346 -1.717 1.00 0.00 H new ATOM 0 HG2 GLN A 239 6.089 2.207 -3.167 1.00 0.00 H new ATOM 0 HG3 GLN A 239 4.945 3.200 -2.286 1.00 0.00 H new ATOM 0 HE21 GLN A 239 7.741 1.158 -1.277 1.00 0.00 H new ATOM 0 HE22 GLN A 239 8.583 2.446 -0.408 1.00 0.00 H new ATOM 391 N GLU A 240 4.559 -0.855 -3.693 1.00 0.00 N ATOM 392 CA GLU A 240 4.794 -1.477 -4.991 1.00 0.00 C ATOM 393 C GLU A 240 3.475 -1.774 -5.698 1.00 0.00 C ATOM 394 O GLU A 240 3.211 -1.261 -6.786 1.00 0.00 O ATOM 395 CB GLU A 240 5.598 -2.769 -4.824 1.00 0.00 C ATOM 396 CG GLU A 240 6.298 -3.218 -6.096 1.00 0.00 C ATOM 397 CD GLU A 240 7.514 -4.080 -5.819 1.00 0.00 C ATOM 398 OE1 GLU A 240 8.354 -3.671 -4.989 1.00 0.00 O ATOM 399 OE2 GLU A 240 7.627 -5.163 -6.431 1.00 0.00 O ATOM 0 H GLU A 240 4.939 -1.374 -2.901 1.00 0.00 H new ATOM 0 HA GLU A 240 5.365 -0.778 -5.602 1.00 0.00 H new ATOM 0 HB2 GLU A 240 6.342 -2.625 -4.041 1.00 0.00 H new ATOM 0 HB3 GLU A 240 4.930 -3.562 -4.487 1.00 0.00 H new ATOM 0 HG2 GLU A 240 5.596 -3.776 -6.715 1.00 0.00 H new ATOM 0 HG3 GLU A 240 6.601 -2.341 -6.668 1.00 0.00 H new ATOM 406 N THR A 241 2.649 -2.607 -5.072 1.00 0.00 N ATOM 407 CA THR A 241 1.358 -2.974 -5.641 1.00 0.00 C ATOM 408 C THR A 241 0.698 -1.781 -6.322 1.00 0.00 C ATOM 409 O THR A 241 0.309 -1.855 -7.488 1.00 0.00 O ATOM 410 CB THR A 241 0.407 -3.528 -4.564 1.00 0.00 C ATOM 411 OG1 THR A 241 0.955 -4.721 -3.992 1.00 0.00 O ATOM 412 CG2 THR A 241 -0.964 -3.825 -5.154 1.00 0.00 C ATOM 0 H THR A 241 2.851 -3.040 -4.171 1.00 0.00 H new ATOM 0 HA THR A 241 1.548 -3.751 -6.381 1.00 0.00 H new ATOM 0 HB THR A 241 0.295 -2.772 -3.787 1.00 0.00 H new ATOM 0 HG1 THR A 241 1.594 -4.483 -3.288 1.00 0.00 H new ATOM 0 HG21 THR A 241 -1.619 -4.215 -4.375 1.00 0.00 H new ATOM 0 HG22 THR A 241 -1.391 -2.909 -5.561 1.00 0.00 H new ATOM 0 HG23 THR A 241 -0.866 -4.564 -5.949 1.00 0.00 H new ATOM 420 N PHE A 242 0.573 -0.680 -5.587 1.00 0.00 N ATOM 421 CA PHE A 242 -0.041 0.530 -6.120 1.00 0.00 C ATOM 422 C PHE A 242 0.854 1.174 -7.175 1.00 0.00 C ATOM 423 O PHE A 242 0.377 1.628 -8.215 1.00 0.00 O ATOM 424 CB PHE A 242 -0.318 1.526 -4.992 1.00 0.00 C ATOM 425 CG PHE A 242 -1.489 1.147 -4.131 1.00 0.00 C ATOM 426 CD1 PHE A 242 -1.481 -0.037 -3.411 1.00 0.00 C ATOM 427 CD2 PHE A 242 -2.597 1.973 -4.043 1.00 0.00 C ATOM 428 CE1 PHE A 242 -2.557 -0.389 -2.617 1.00 0.00 C ATOM 429 CE2 PHE A 242 -3.676 1.627 -3.251 1.00 0.00 C ATOM 430 CZ PHE A 242 -3.656 0.444 -2.538 1.00 0.00 C ATOM 0 H PHE A 242 0.889 -0.602 -4.620 1.00 0.00 H new ATOM 0 HA PHE A 242 -0.985 0.253 -6.590 1.00 0.00 H new ATOM 0 HB2 PHE A 242 0.571 1.610 -4.366 1.00 0.00 H new ATOM 0 HB3 PHE A 242 -0.498 2.511 -5.424 1.00 0.00 H new ATOM 0 HD1 PHE A 242 -0.625 -0.692 -3.471 1.00 0.00 H new ATOM 0 HD2 PHE A 242 -2.618 2.898 -4.600 1.00 0.00 H new ATOM 0 HE1 PHE A 242 -2.538 -1.314 -2.060 1.00 0.00 H new ATOM 0 HE2 PHE A 242 -4.533 2.281 -3.190 1.00 0.00 H new ATOM 0 HZ PHE A 242 -4.498 0.171 -1.920 1.00 0.00 H new ATOM 440 N SER A 243 2.153 1.211 -6.898 1.00 0.00 N ATOM 441 CA SER A 243 3.115 1.803 -7.820 1.00 0.00 C ATOM 442 C SER A 243 2.921 1.257 -9.232 1.00 0.00 C ATOM 443 O SER A 243 2.975 2.003 -10.210 1.00 0.00 O ATOM 444 CB SER A 243 4.543 1.529 -7.347 1.00 0.00 C ATOM 445 OG SER A 243 5.463 2.417 -7.958 1.00 0.00 O ATOM 0 H SER A 243 2.564 0.838 -6.042 1.00 0.00 H new ATOM 0 HA SER A 243 2.947 2.880 -7.839 1.00 0.00 H new ATOM 0 HB2 SER A 243 4.597 1.634 -6.263 1.00 0.00 H new ATOM 0 HB3 SER A 243 4.816 0.500 -7.581 1.00 0.00 H new ATOM 0 HG SER A 243 6.368 2.222 -7.637 1.00 0.00 H new ATOM 451 N ARG A 244 2.696 -0.049 -9.328 1.00 0.00 N ATOM 452 CA ARG A 244 2.496 -0.696 -10.619 1.00 0.00 C ATOM 453 C ARG A 244 1.668 0.187 -11.548 1.00 0.00 C ATOM 454 O ARG A 244 2.021 0.386 -12.711 1.00 0.00 O ATOM 455 CB ARG A 244 1.805 -2.048 -10.434 1.00 0.00 C ATOM 456 CG ARG A 244 2.564 -3.001 -9.524 1.00 0.00 C ATOM 457 CD ARG A 244 2.235 -4.452 -9.838 1.00 0.00 C ATOM 458 NE ARG A 244 3.057 -4.977 -10.925 1.00 0.00 N ATOM 459 CZ ARG A 244 2.939 -6.210 -11.405 1.00 0.00 C ATOM 460 NH1 ARG A 244 2.038 -7.040 -10.898 1.00 0.00 N ATOM 461 NH2 ARG A 244 3.724 -6.615 -12.396 1.00 0.00 N ATOM 0 H ARG A 244 2.648 -0.680 -8.528 1.00 0.00 H new ATOM 0 HA ARG A 244 3.474 -0.854 -11.073 1.00 0.00 H new ATOM 0 HB2 ARG A 244 0.808 -1.884 -10.024 1.00 0.00 H new ATOM 0 HB3 ARG A 244 1.675 -2.517 -11.410 1.00 0.00 H new ATOM 0 HG2 ARG A 244 3.636 -2.837 -9.637 1.00 0.00 H new ATOM 0 HG3 ARG A 244 2.316 -2.787 -8.484 1.00 0.00 H new ATOM 0 HD2 ARG A 244 2.384 -5.059 -8.945 1.00 0.00 H new ATOM 0 HD3 ARG A 244 1.182 -4.535 -10.107 1.00 0.00 H new ATOM 0 HE ARG A 244 3.760 -4.364 -11.338 1.00 0.00 H new ATOM 0 HH11 ARG A 244 1.433 -6.733 -10.137 1.00 0.00 H new ATOM 0 HH12 ARG A 244 1.950 -7.986 -11.269 1.00 0.00 H new ATOM 0 HH21 ARG A 244 4.418 -5.979 -12.789 1.00 0.00 H new ATOM 0 HH22 ARG A 244 3.633 -7.562 -12.764 1.00 0.00 H new ATOM 475 N PHE A 245 0.565 0.714 -11.027 1.00 0.00 N ATOM 476 CA PHE A 245 -0.314 1.575 -11.809 1.00 0.00 C ATOM 477 C PHE A 245 0.390 2.876 -12.184 1.00 0.00 C ATOM 478 O PHE A 245 0.401 3.276 -13.347 1.00 0.00 O ATOM 479 CB PHE A 245 -1.592 1.882 -11.026 1.00 0.00 C ATOM 480 CG PHE A 245 -2.458 0.676 -10.795 1.00 0.00 C ATOM 481 CD1 PHE A 245 -2.124 -0.257 -9.826 1.00 0.00 C ATOM 482 CD2 PHE A 245 -3.605 0.476 -11.546 1.00 0.00 C ATOM 483 CE1 PHE A 245 -2.919 -1.368 -9.612 1.00 0.00 C ATOM 484 CE2 PHE A 245 -4.403 -0.633 -11.336 1.00 0.00 C ATOM 485 CZ PHE A 245 -4.060 -1.555 -10.367 1.00 0.00 C ATOM 0 H PHE A 245 0.259 0.560 -10.066 1.00 0.00 H new ATOM 0 HA PHE A 245 -0.575 1.046 -12.726 1.00 0.00 H new ATOM 0 HB2 PHE A 245 -1.323 2.316 -10.063 1.00 0.00 H new ATOM 0 HB3 PHE A 245 -2.167 2.634 -11.565 1.00 0.00 H new ATOM 0 HD1 PHE A 245 -1.233 -0.115 -9.232 1.00 0.00 H new ATOM 0 HD2 PHE A 245 -3.879 1.195 -12.304 1.00 0.00 H new ATOM 0 HE1 PHE A 245 -2.648 -2.089 -8.855 1.00 0.00 H new ATOM 0 HE2 PHE A 245 -5.294 -0.778 -11.929 1.00 0.00 H new ATOM 0 HZ PHE A 245 -4.683 -2.421 -10.200 1.00 0.00 H new ATOM 495 N GLY A 246 0.978 3.532 -11.188 1.00 0.00 N ATOM 496 CA GLY A 246 1.676 4.780 -11.432 1.00 0.00 C ATOM 497 C GLY A 246 2.596 5.163 -10.289 1.00 0.00 C ATOM 498 O GLY A 246 2.401 4.728 -9.154 1.00 0.00 O ATOM 0 H GLY A 246 0.983 3.221 -10.217 1.00 0.00 H new ATOM 0 HA2 GLY A 246 2.258 4.694 -12.350 1.00 0.00 H new ATOM 0 HA3 GLY A 246 0.948 5.575 -11.590 1.00 0.00 H new ATOM 502 N SER A 247 3.602 5.978 -10.589 1.00 0.00 N ATOM 503 CA SER A 247 4.559 6.415 -9.579 1.00 0.00 C ATOM 504 C SER A 247 3.840 6.919 -8.332 1.00 0.00 C ATOM 505 O SER A 247 2.877 7.681 -8.421 1.00 0.00 O ATOM 506 CB SER A 247 5.460 7.516 -10.142 1.00 0.00 C ATOM 507 OG SER A 247 6.183 7.056 -11.271 1.00 0.00 O ATOM 0 H SER A 247 3.776 6.349 -11.523 1.00 0.00 H new ATOM 0 HA SER A 247 5.174 5.559 -9.302 1.00 0.00 H new ATOM 0 HB2 SER A 247 4.855 8.379 -10.421 1.00 0.00 H new ATOM 0 HB3 SER A 247 6.156 7.850 -9.372 1.00 0.00 H new ATOM 0 HG SER A 247 6.750 7.779 -11.613 1.00 0.00 H new ATOM 513 N LEU A 248 4.315 6.487 -7.168 1.00 0.00 N ATOM 514 CA LEU A 248 3.718 6.893 -5.900 1.00 0.00 C ATOM 515 C LEU A 248 4.566 7.962 -5.217 1.00 0.00 C ATOM 516 O LEU A 248 5.659 8.289 -5.678 1.00 0.00 O ATOM 517 CB LEU A 248 3.561 5.684 -4.977 1.00 0.00 C ATOM 518 CG LEU A 248 2.360 4.779 -5.256 1.00 0.00 C ATOM 519 CD1 LEU A 248 2.468 3.489 -4.458 1.00 0.00 C ATOM 520 CD2 LEU A 248 1.061 5.502 -4.932 1.00 0.00 C ATOM 0 H LEU A 248 5.111 5.856 -7.076 1.00 0.00 H new ATOM 0 HA LEU A 248 2.734 7.313 -6.108 1.00 0.00 H new ATOM 0 HB2 LEU A 248 4.467 5.082 -5.042 1.00 0.00 H new ATOM 0 HB3 LEU A 248 3.490 6.043 -3.950 1.00 0.00 H new ATOM 0 HG LEU A 248 2.357 4.527 -6.316 1.00 0.00 H new ATOM 0 HD11 LEU A 248 1.605 2.857 -4.669 1.00 0.00 H new ATOM 0 HD12 LEU A 248 3.380 2.963 -4.739 1.00 0.00 H new ATOM 0 HD13 LEU A 248 2.496 3.721 -3.393 1.00 0.00 H new ATOM 0 HD21 LEU A 248 0.217 4.843 -5.137 1.00 0.00 H new ATOM 0 HD22 LEU A 248 1.054 5.784 -3.879 1.00 0.00 H new ATOM 0 HD23 LEU A 248 0.980 6.398 -5.548 1.00 0.00 H new ATOM 532 N GLY A 249 4.055 8.500 -4.114 1.00 0.00 N ATOM 533 CA GLY A 249 4.780 9.524 -3.384 1.00 0.00 C ATOM 534 C GLY A 249 4.968 9.170 -1.922 1.00 0.00 C ATOM 535 O GLY A 249 5.906 8.459 -1.564 1.00 0.00 O ATOM 0 H GLY A 249 3.152 8.245 -3.713 1.00 0.00 H new ATOM 0 HA2 GLY A 249 5.755 9.674 -3.847 1.00 0.00 H new ATOM 0 HA3 GLY A 249 4.243 10.469 -3.460 1.00 0.00 H new ATOM 539 N ARG A 250 4.073 9.669 -1.075 1.00 0.00 N ATOM 540 CA ARG A 250 4.147 9.404 0.357 1.00 0.00 C ATOM 541 C ARG A 250 3.411 8.115 0.710 1.00 0.00 C ATOM 542 O ARG A 250 2.248 7.933 0.348 1.00 0.00 O ATOM 543 CB ARG A 250 3.555 10.574 1.145 1.00 0.00 C ATOM 544 CG ARG A 250 4.195 10.776 2.508 1.00 0.00 C ATOM 545 CD ARG A 250 5.612 11.314 2.385 1.00 0.00 C ATOM 546 NE ARG A 250 5.639 12.773 2.320 1.00 0.00 N ATOM 547 CZ ARG A 250 6.691 13.505 2.670 1.00 0.00 C ATOM 548 NH1 ARG A 250 7.795 12.916 3.108 1.00 0.00 N ATOM 549 NH2 ARG A 250 6.639 14.828 2.583 1.00 0.00 N ATOM 0 H ARG A 250 3.289 10.258 -1.355 1.00 0.00 H new ATOM 0 HA ARG A 250 5.197 9.288 0.626 1.00 0.00 H new ATOM 0 HB2 ARG A 250 3.667 11.488 0.561 1.00 0.00 H new ATOM 0 HB3 ARG A 250 2.486 10.409 1.276 1.00 0.00 H new ATOM 0 HG2 ARG A 250 3.592 11.468 3.095 1.00 0.00 H new ATOM 0 HG3 ARG A 250 4.210 9.829 3.048 1.00 0.00 H new ATOM 0 HD2 ARG A 250 6.203 10.978 3.237 1.00 0.00 H new ATOM 0 HD3 ARG A 250 6.080 10.902 1.491 1.00 0.00 H new ATOM 0 HE ARG A 250 4.804 13.256 1.988 1.00 0.00 H new ATOM 0 HH11 ARG A 250 7.838 11.899 3.177 1.00 0.00 H new ATOM 0 HH12 ARG A 250 8.602 13.480 3.376 1.00 0.00 H new ATOM 0 HH21 ARG A 250 5.791 15.284 2.247 1.00 0.00 H new ATOM 0 HH22 ARG A 250 7.447 15.389 2.852 1.00 0.00 H new ATOM 563 N VAL A 251 4.096 7.223 1.417 1.00 0.00 N ATOM 564 CA VAL A 251 3.508 5.951 1.819 1.00 0.00 C ATOM 565 C VAL A 251 3.724 5.691 3.306 1.00 0.00 C ATOM 566 O VAL A 251 4.857 5.525 3.761 1.00 0.00 O ATOM 567 CB VAL A 251 4.100 4.779 1.014 1.00 0.00 C ATOM 568 CG1 VAL A 251 3.528 3.455 1.498 1.00 0.00 C ATOM 569 CG2 VAL A 251 3.839 4.970 -0.473 1.00 0.00 C ATOM 0 H VAL A 251 5.059 7.358 1.724 1.00 0.00 H new ATOM 0 HA VAL A 251 2.439 6.019 1.616 1.00 0.00 H new ATOM 0 HB VAL A 251 5.178 4.760 1.172 1.00 0.00 H new ATOM 0 HG11 VAL A 251 3.958 2.639 0.917 1.00 0.00 H new ATOM 0 HG12 VAL A 251 3.770 3.318 2.552 1.00 0.00 H new ATOM 0 HG13 VAL A 251 2.445 3.459 1.372 1.00 0.00 H new ATOM 0 HG21 VAL A 251 4.264 4.133 -1.027 1.00 0.00 H new ATOM 0 HG22 VAL A 251 2.765 5.015 -0.651 1.00 0.00 H new ATOM 0 HG23 VAL A 251 4.301 5.899 -0.807 1.00 0.00 H new ATOM 579 N LEU A 252 2.631 5.656 4.060 1.00 0.00 N ATOM 580 CA LEU A 252 2.700 5.415 5.497 1.00 0.00 C ATOM 581 C LEU A 252 1.757 4.288 5.906 1.00 0.00 C ATOM 582 O LEU A 252 0.540 4.394 5.749 1.00 0.00 O ATOM 583 CB LEU A 252 2.351 6.691 6.265 1.00 0.00 C ATOM 584 CG LEU A 252 3.099 7.956 5.841 1.00 0.00 C ATOM 585 CD1 LEU A 252 2.450 9.189 6.449 1.00 0.00 C ATOM 586 CD2 LEU A 252 4.564 7.868 6.244 1.00 0.00 C ATOM 0 H LEU A 252 1.686 5.791 3.700 1.00 0.00 H new ATOM 0 HA LEU A 252 3.720 5.118 5.742 1.00 0.00 H new ATOM 0 HB2 LEU A 252 1.281 6.873 6.160 1.00 0.00 H new ATOM 0 HB3 LEU A 252 2.542 6.518 7.324 1.00 0.00 H new ATOM 0 HG LEU A 252 3.045 8.041 4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 252 2.996 10.079 6.136 1.00 0.00 H new ATOM 0 HD12 LEU A 252 1.416 9.260 6.111 1.00 0.00 H new ATOM 0 HD13 LEU A 252 2.472 9.113 7.536 1.00 0.00 H new ATOM 0 HD21 LEU A 252 5.082 8.776 5.935 1.00 0.00 H new ATOM 0 HD22 LEU A 252 4.638 7.759 7.326 1.00 0.00 H new ATOM 0 HD23 LEU A 252 5.023 7.006 5.760 1.00 0.00 H new ATOM 598 N LEU A 253 2.326 3.210 6.433 1.00 0.00 N ATOM 599 CA LEU A 253 1.537 2.063 6.868 1.00 0.00 C ATOM 600 C LEU A 253 1.982 1.586 8.247 1.00 0.00 C ATOM 601 O LEU A 253 2.961 0.853 8.391 1.00 0.00 O ATOM 602 CB LEU A 253 1.659 0.922 5.857 1.00 0.00 C ATOM 603 CG LEU A 253 1.302 -0.473 6.372 1.00 0.00 C ATOM 604 CD1 LEU A 253 -0.123 -0.497 6.904 1.00 0.00 C ATOM 605 CD2 LEU A 253 1.479 -1.510 5.272 1.00 0.00 C ATOM 0 H LEU A 253 3.331 3.106 6.570 1.00 0.00 H new ATOM 0 HA LEU A 253 0.494 2.374 6.931 1.00 0.00 H new ATOM 0 HB2 LEU A 253 1.017 1.148 5.005 1.00 0.00 H new ATOM 0 HB3 LEU A 253 2.684 0.899 5.487 1.00 0.00 H new ATOM 0 HG LEU A 253 1.978 -0.721 7.190 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -0.359 -1.498 7.266 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -0.218 0.217 7.722 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -0.814 -0.228 6.105 1.00 0.00 H new ATOM 0 HD21 LEU A 253 1.220 -2.496 5.657 1.00 0.00 H new ATOM 0 HD22 LEU A 253 0.827 -1.265 4.433 1.00 0.00 H new ATOM 0 HD23 LEU A 253 2.516 -1.512 4.937 1.00 0.00 H new ATOM 617 N PRO A 254 1.247 2.009 9.286 1.00 0.00 N ATOM 618 CA PRO A 254 1.546 1.635 10.671 1.00 0.00 C ATOM 619 C PRO A 254 1.266 0.162 10.947 1.00 0.00 C ATOM 620 O PRO A 254 0.376 -0.434 10.342 1.00 0.00 O ATOM 621 CB PRO A 254 0.603 2.521 11.489 1.00 0.00 C ATOM 622 CG PRO A 254 -0.528 2.822 10.567 1.00 0.00 C ATOM 623 CD PRO A 254 0.067 2.884 9.188 1.00 0.00 C ATOM 0 HA PRO A 254 2.600 1.774 10.912 1.00 0.00 H new ATOM 0 HB2 PRO A 254 0.257 2.008 12.386 1.00 0.00 H new ATOM 0 HB3 PRO A 254 1.101 3.434 11.816 1.00 0.00 H new ATOM 0 HG2 PRO A 254 -1.296 2.051 10.626 1.00 0.00 H new ATOM 0 HG3 PRO A 254 -1.004 3.767 10.829 1.00 0.00 H new ATOM 0 HD2 PRO A 254 -0.634 2.530 8.432 1.00 0.00 H new ATOM 0 HD3 PRO A 254 0.343 3.902 8.915 1.00 0.00 H new ATOM 631 N GLU A 255 2.032 -0.420 11.866 1.00 0.00 N ATOM 632 CA GLU A 255 1.866 -1.824 12.221 1.00 0.00 C ATOM 633 C GLU A 255 0.646 -2.018 13.118 1.00 0.00 C ATOM 634 O GLU A 255 -0.071 -3.011 13.003 1.00 0.00 O ATOM 635 CB GLU A 255 3.119 -2.347 12.925 1.00 0.00 C ATOM 636 CG GLU A 255 3.427 -1.632 14.230 1.00 0.00 C ATOM 637 CD GLU A 255 4.476 -2.350 15.056 1.00 0.00 C ATOM 638 OE1 GLU A 255 4.100 -3.236 15.852 1.00 0.00 O ATOM 639 OE2 GLU A 255 5.673 -2.028 14.906 1.00 0.00 O ATOM 0 H GLU A 255 2.773 0.060 12.377 1.00 0.00 H new ATOM 0 HA GLU A 255 1.713 -2.389 11.301 1.00 0.00 H new ATOM 0 HB2 GLU A 255 2.996 -3.412 13.124 1.00 0.00 H new ATOM 0 HB3 GLU A 255 3.972 -2.244 12.254 1.00 0.00 H new ATOM 0 HG2 GLU A 255 3.771 -0.621 14.013 1.00 0.00 H new ATOM 0 HG3 GLU A 255 2.511 -1.539 14.814 1.00 0.00 H new ATOM 646 N GLY A 256 0.419 -1.060 14.012 1.00 0.00 N ATOM 647 CA GLY A 256 -0.713 -1.144 14.916 1.00 0.00 C ATOM 648 C GLY A 256 -2.040 -1.178 14.183 1.00 0.00 C ATOM 649 O GLY A 256 -2.971 -1.864 14.602 1.00 0.00 O ATOM 0 H GLY A 256 0.998 -0.228 14.126 1.00 0.00 H new ATOM 0 HA2 GLY A 256 -0.618 -2.039 15.530 1.00 0.00 H new ATOM 0 HA3 GLY A 256 -0.697 -0.290 15.593 1.00 0.00 H new ATOM 653 N GLY A 257 -2.127 -0.434 13.084 1.00 0.00 N ATOM 654 CA GLY A 257 -3.353 -0.394 12.310 1.00 0.00 C ATOM 655 C GLY A 257 -3.141 -0.806 10.867 1.00 0.00 C ATOM 656 O GLY A 257 -2.427 -0.134 10.122 1.00 0.00 O ATOM 0 H GLY A 257 -1.369 0.142 12.716 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -4.090 -1.053 12.768 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -3.765 0.615 12.340 1.00 0.00 H new ATOM 660 N ILE A 258 -3.762 -1.912 10.471 1.00 0.00 N ATOM 661 CA ILE A 258 -3.636 -2.411 9.107 1.00 0.00 C ATOM 662 C ILE A 258 -3.783 -1.282 8.093 1.00 0.00 C ATOM 663 O ILE A 258 -3.186 -1.318 7.016 1.00 0.00 O ATOM 664 CB ILE A 258 -4.687 -3.496 8.806 1.00 0.00 C ATOM 665 CG1 ILE A 258 -6.099 -2.918 8.930 1.00 0.00 C ATOM 666 CG2 ILE A 258 -4.510 -4.680 9.745 1.00 0.00 C ATOM 667 CD1 ILE A 258 -6.533 -2.683 10.360 1.00 0.00 C ATOM 0 H ILE A 258 -4.357 -2.479 11.075 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.640 -2.846 9.021 1.00 0.00 H new ATOM 0 HB ILE A 258 -4.545 -3.844 7.783 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -6.146 -1.975 8.385 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -6.804 -3.598 8.452 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.260 -5.438 9.520 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -3.514 -5.104 9.613 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -4.629 -4.347 10.776 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -7.543 -2.273 10.371 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -6.519 -3.627 10.904 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -5.850 -1.979 10.836 1.00 0.00 H new ATOM 679 N THR A 259 -4.580 -0.278 8.444 1.00 0.00 N ATOM 680 CA THR A 259 -4.805 0.863 7.565 1.00 0.00 C ATOM 681 C THR A 259 -3.497 1.352 6.954 1.00 0.00 C ATOM 682 O THR A 259 -2.554 1.687 7.669 1.00 0.00 O ATOM 683 CB THR A 259 -5.474 2.029 8.318 1.00 0.00 C ATOM 684 OG1 THR A 259 -4.849 2.212 9.593 1.00 0.00 O ATOM 685 CG2 THR A 259 -6.960 1.767 8.509 1.00 0.00 C ATOM 0 H THR A 259 -5.081 -0.232 9.331 1.00 0.00 H new ATOM 0 HA THR A 259 -5.470 0.524 6.771 1.00 0.00 H new ATOM 0 HB THR A 259 -5.354 2.934 7.722 1.00 0.00 H new ATOM 0 HG1 THR A 259 -3.876 2.150 9.492 1.00 0.00 H new ATOM 0 HG21 THR A 259 -7.411 2.603 9.043 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.438 1.657 7.536 1.00 0.00 H new ATOM 0 HG23 THR A 259 -7.097 0.852 9.086 1.00 0.00 H new ATOM 693 N ALA A 260 -3.448 1.391 5.626 1.00 0.00 N ATOM 694 CA ALA A 260 -2.256 1.841 4.918 1.00 0.00 C ATOM 695 C ALA A 260 -2.530 3.127 4.145 1.00 0.00 C ATOM 696 O ALA A 260 -3.377 3.156 3.251 1.00 0.00 O ATOM 697 CB ALA A 260 -1.758 0.754 3.978 1.00 0.00 C ATOM 0 H ALA A 260 -4.220 1.116 5.019 1.00 0.00 H new ATOM 0 HA ALA A 260 -1.482 2.049 5.656 1.00 0.00 H new ATOM 0 HB1 ALA A 260 -0.867 1.104 3.456 1.00 0.00 H new ATOM 0 HB2 ALA A 260 -1.514 -0.140 4.552 1.00 0.00 H new ATOM 0 HB3 ALA A 260 -2.535 0.518 3.251 1.00 0.00 H new ATOM 703 N ILE A 261 -1.810 4.187 4.495 1.00 0.00 N ATOM 704 CA ILE A 261 -1.977 5.475 3.833 1.00 0.00 C ATOM 705 C ILE A 261 -1.074 5.584 2.609 1.00 0.00 C ATOM 706 O ILE A 261 0.082 5.161 2.636 1.00 0.00 O ATOM 707 CB ILE A 261 -1.670 6.643 4.789 1.00 0.00 C ATOM 708 CG1 ILE A 261 -2.575 6.574 6.021 1.00 0.00 C ATOM 709 CG2 ILE A 261 -1.843 7.974 4.072 1.00 0.00 C ATOM 710 CD1 ILE A 261 -2.025 5.700 7.126 1.00 0.00 C ATOM 0 H ILE A 261 -1.106 4.180 5.233 1.00 0.00 H new ATOM 0 HA ILE A 261 -3.019 5.537 3.520 1.00 0.00 H new ATOM 0 HB ILE A 261 -0.634 6.561 5.118 1.00 0.00 H new ATOM 0 HG12 ILE A 261 -2.727 7.582 6.407 1.00 0.00 H new ATOM 0 HG13 ILE A 261 -3.553 6.196 5.723 1.00 0.00 H new ATOM 0 HG21 ILE A 261 -1.623 8.790 4.761 1.00 0.00 H new ATOM 0 HG22 ILE A 261 -1.161 8.021 3.223 1.00 0.00 H new ATOM 0 HG23 ILE A 261 -2.870 8.066 3.718 1.00 0.00 H new ATOM 0 HD11 ILE A 261 -2.718 5.698 7.967 1.00 0.00 H new ATOM 0 HD12 ILE A 261 -1.899 4.682 6.757 1.00 0.00 H new ATOM 0 HD13 ILE A 261 -1.060 6.089 7.452 1.00 0.00 H new ATOM 722 N VAL A 262 -1.610 6.157 1.535 1.00 0.00 N ATOM 723 CA VAL A 262 -0.852 6.325 0.301 1.00 0.00 C ATOM 724 C VAL A 262 -1.121 7.687 -0.328 1.00 0.00 C ATOM 725 O VAL A 262 -2.261 8.150 -0.365 1.00 0.00 O ATOM 726 CB VAL A 262 -1.193 5.224 -0.721 1.00 0.00 C ATOM 727 CG1 VAL A 262 -0.419 5.437 -2.014 1.00 0.00 C ATOM 728 CG2 VAL A 262 -0.904 3.849 -0.138 1.00 0.00 C ATOM 0 H VAL A 262 -2.565 6.512 1.495 1.00 0.00 H new ATOM 0 HA VAL A 262 0.203 6.252 0.565 1.00 0.00 H new ATOM 0 HB VAL A 262 -2.257 5.281 -0.949 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -0.673 4.650 -2.724 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -0.680 6.406 -2.439 1.00 0.00 H new ATOM 0 HG13 VAL A 262 0.651 5.408 -1.807 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -1.151 3.083 -0.873 1.00 0.00 H new ATOM 0 HG22 VAL A 262 0.153 3.778 0.120 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -1.507 3.700 0.758 1.00 0.00 H new ATOM 738 N GLU A 263 -0.064 8.324 -0.822 1.00 0.00 N ATOM 739 CA GLU A 263 -0.188 9.635 -1.450 1.00 0.00 C ATOM 740 C GLU A 263 0.340 9.605 -2.881 1.00 0.00 C ATOM 741 O GLU A 263 1.528 9.826 -3.121 1.00 0.00 O ATOM 742 CB GLU A 263 0.570 10.687 -0.637 1.00 0.00 C ATOM 743 CG GLU A 263 0.616 12.053 -1.302 1.00 0.00 C ATOM 744 CD GLU A 263 1.402 13.068 -0.496 1.00 0.00 C ATOM 745 OE1 GLU A 263 1.090 13.247 0.700 1.00 0.00 O ATOM 746 OE2 GLU A 263 2.330 13.683 -1.062 1.00 0.00 O ATOM 0 H GLU A 263 0.886 7.955 -0.800 1.00 0.00 H new ATOM 0 HA GLU A 263 -1.245 9.899 -1.477 1.00 0.00 H new ATOM 0 HB2 GLU A 263 0.101 10.784 0.342 1.00 0.00 H new ATOM 0 HB3 GLU A 263 1.589 10.339 -0.469 1.00 0.00 H new ATOM 0 HG2 GLU A 263 1.062 11.956 -2.292 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -0.401 12.418 -1.445 1.00 0.00 H new ATOM 753 N PHE A 264 -0.550 9.329 -3.828 1.00 0.00 N ATOM 754 CA PHE A 264 -0.175 9.268 -5.236 1.00 0.00 C ATOM 755 C PHE A 264 0.426 10.593 -5.696 1.00 0.00 C ATOM 756 O PHE A 264 0.101 11.654 -5.163 1.00 0.00 O ATOM 757 CB PHE A 264 -1.392 8.921 -6.096 1.00 0.00 C ATOM 758 CG PHE A 264 -1.659 7.446 -6.189 1.00 0.00 C ATOM 759 CD1 PHE A 264 -2.185 6.754 -5.110 1.00 0.00 C ATOM 760 CD2 PHE A 264 -1.384 6.752 -7.356 1.00 0.00 C ATOM 761 CE1 PHE A 264 -2.430 5.397 -5.193 1.00 0.00 C ATOM 762 CE2 PHE A 264 -1.628 5.394 -7.445 1.00 0.00 C ATOM 763 CZ PHE A 264 -2.153 4.716 -6.363 1.00 0.00 C ATOM 0 H PHE A 264 -1.536 9.144 -3.646 1.00 0.00 H new ATOM 0 HA PHE A 264 0.577 8.488 -5.352 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -2.271 9.416 -5.684 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -1.243 9.319 -7.100 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -2.406 7.281 -4.194 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -0.974 7.278 -8.206 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -2.838 4.869 -4.344 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -1.408 4.864 -8.360 1.00 0.00 H new ATOM 0 HZ PHE A 264 -2.347 3.656 -6.431 1.00 0.00 H new ATOM 773 N LEU A 265 1.305 10.523 -6.690 1.00 0.00 N ATOM 774 CA LEU A 265 1.953 11.716 -7.224 1.00 0.00 C ATOM 775 C LEU A 265 1.045 12.430 -8.221 1.00 0.00 C ATOM 776 O LEU A 265 0.994 13.658 -8.258 1.00 0.00 O ATOM 777 CB LEU A 265 3.276 11.345 -7.896 1.00 0.00 C ATOM 778 CG LEU A 265 4.399 10.890 -6.963 1.00 0.00 C ATOM 779 CD1 LEU A 265 5.592 10.396 -7.766 1.00 0.00 C ATOM 780 CD2 LEU A 265 4.811 12.022 -6.033 1.00 0.00 C ATOM 0 H LEU A 265 1.585 9.653 -7.142 1.00 0.00 H new ATOM 0 HA LEU A 265 2.152 12.393 -6.393 1.00 0.00 H new ATOM 0 HB2 LEU A 265 3.084 10.549 -8.616 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.628 12.208 -8.461 1.00 0.00 H new ATOM 0 HG LEU A 265 4.029 10.064 -6.355 1.00 0.00 H new ATOM 0 HD11 LEU A 265 6.381 10.076 -7.086 1.00 0.00 H new ATOM 0 HD12 LEU A 265 5.288 9.555 -8.390 1.00 0.00 H new ATOM 0 HD13 LEU A 265 5.963 11.202 -8.399 1.00 0.00 H new ATOM 0 HD21 LEU A 265 5.611 11.680 -5.376 1.00 0.00 H new ATOM 0 HD22 LEU A 265 5.163 12.868 -6.623 1.00 0.00 H new ATOM 0 HD23 LEU A 265 3.955 12.329 -5.432 1.00 0.00 H new ATOM 792 N GLU A 266 0.329 11.649 -9.025 1.00 0.00 N ATOM 793 CA GLU A 266 -0.578 12.208 -10.021 1.00 0.00 C ATOM 794 C GLU A 266 -2.031 11.913 -9.659 1.00 0.00 C ATOM 795 O GLU A 266 -2.376 10.820 -9.212 1.00 0.00 O ATOM 796 CB GLU A 266 -0.261 11.640 -11.406 1.00 0.00 C ATOM 797 CG GLU A 266 -0.517 12.621 -12.538 1.00 0.00 C ATOM 798 CD GLU A 266 0.119 13.975 -12.292 1.00 0.00 C ATOM 799 OE1 GLU A 266 1.212 14.016 -11.690 1.00 0.00 O ATOM 800 OE2 GLU A 266 -0.476 14.994 -12.702 1.00 0.00 O ATOM 0 H GLU A 266 0.359 10.630 -9.006 1.00 0.00 H new ATOM 0 HA GLU A 266 -0.438 13.289 -10.038 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.784 11.332 -11.433 1.00 0.00 H new ATOM 0 HB3 GLU A 266 -0.862 10.745 -11.569 1.00 0.00 H new ATOM 0 HG2 GLU A 266 -0.130 12.206 -13.468 1.00 0.00 H new ATOM 0 HG3 GLU A 266 -1.592 12.747 -12.668 1.00 0.00 H new ATOM 807 N PRO A 267 -2.903 12.913 -9.855 1.00 0.00 N ATOM 808 CA PRO A 267 -4.332 12.787 -9.557 1.00 0.00 C ATOM 809 C PRO A 267 -5.045 11.844 -10.521 1.00 0.00 C ATOM 810 O PRO A 267 -5.852 11.011 -10.107 1.00 0.00 O ATOM 811 CB PRO A 267 -4.857 14.216 -9.720 1.00 0.00 C ATOM 812 CG PRO A 267 -3.902 14.864 -10.663 1.00 0.00 C ATOM 813 CD PRO A 267 -2.561 14.244 -10.385 1.00 0.00 C ATOM 0 HA PRO A 267 -4.505 12.365 -8.567 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -5.872 14.222 -10.118 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -4.886 14.739 -8.764 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -4.202 14.698 -11.698 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -3.873 15.943 -10.509 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -1.956 14.173 -11.289 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -1.990 14.829 -9.664 1.00 0.00 H new ATOM 821 N LEU A 268 -4.742 11.981 -11.807 1.00 0.00 N ATOM 822 CA LEU A 268 -5.353 11.141 -12.831 1.00 0.00 C ATOM 823 C LEU A 268 -5.049 9.668 -12.579 1.00 0.00 C ATOM 824 O LEU A 268 -5.956 8.839 -12.518 1.00 0.00 O ATOM 825 CB LEU A 268 -4.853 11.547 -14.218 1.00 0.00 C ATOM 826 CG LEU A 268 -5.390 12.871 -14.764 1.00 0.00 C ATOM 827 CD1 LEU A 268 -6.887 12.777 -15.014 1.00 0.00 C ATOM 828 CD2 LEU A 268 -5.077 14.010 -13.805 1.00 0.00 C ATOM 0 H LEU A 268 -4.077 12.666 -12.166 1.00 0.00 H new ATOM 0 HA LEU A 268 -6.433 11.283 -12.786 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -3.765 11.604 -14.188 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -5.111 10.755 -14.921 1.00 0.00 H new ATOM 0 HG LEU A 268 -4.896 13.077 -15.714 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -7.251 13.728 -15.402 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -7.086 11.989 -15.740 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -7.398 12.547 -14.079 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -5.467 14.944 -14.210 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -5.542 13.811 -12.840 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -3.998 14.092 -13.677 1.00 0.00 H new ATOM 840 N GLU A 269 -3.767 9.350 -12.432 1.00 0.00 N ATOM 841 CA GLU A 269 -3.344 7.977 -12.185 1.00 0.00 C ATOM 842 C GLU A 269 -3.938 7.450 -10.882 1.00 0.00 C ATOM 843 O GLU A 269 -4.313 6.282 -10.785 1.00 0.00 O ATOM 844 CB GLU A 269 -1.817 7.891 -12.134 1.00 0.00 C ATOM 845 CG GLU A 269 -1.239 8.153 -10.753 1.00 0.00 C ATOM 846 CD GLU A 269 0.255 7.901 -10.689 1.00 0.00 C ATOM 847 OE1 GLU A 269 0.915 7.971 -11.747 1.00 0.00 O ATOM 848 OE2 GLU A 269 0.764 7.633 -9.580 1.00 0.00 O ATOM 0 H GLU A 269 -3.003 10.025 -12.480 1.00 0.00 H new ATOM 0 HA GLU A 269 -3.708 7.359 -13.006 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -1.506 6.901 -12.467 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -1.397 8.610 -12.837 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -1.442 9.185 -10.468 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -1.743 7.516 -10.026 1.00 0.00 H new ATOM 855 N ALA A 270 -4.019 8.321 -9.881 1.00 0.00 N ATOM 856 CA ALA A 270 -4.567 7.946 -8.584 1.00 0.00 C ATOM 857 C ALA A 270 -5.986 7.403 -8.724 1.00 0.00 C ATOM 858 O ALA A 270 -6.310 6.342 -8.192 1.00 0.00 O ATOM 859 CB ALA A 270 -4.547 9.136 -7.637 1.00 0.00 C ATOM 0 H ALA A 270 -3.712 9.292 -9.944 1.00 0.00 H new ATOM 0 HA ALA A 270 -3.942 7.155 -8.169 1.00 0.00 H new ATOM 0 HB1 ALA A 270 -4.959 8.840 -6.672 1.00 0.00 H new ATOM 0 HB2 ALA A 270 -3.521 9.478 -7.503 1.00 0.00 H new ATOM 0 HB3 ALA A 270 -5.147 9.944 -8.056 1.00 0.00 H new ATOM 865 N ARG A 271 -6.827 8.139 -9.443 1.00 0.00 N ATOM 866 CA ARG A 271 -8.212 7.733 -9.652 1.00 0.00 C ATOM 867 C ARG A 271 -8.282 6.400 -10.391 1.00 0.00 C ATOM 868 O ARG A 271 -9.048 5.511 -10.020 1.00 0.00 O ATOM 869 CB ARG A 271 -8.968 8.805 -10.438 1.00 0.00 C ATOM 870 CG ARG A 271 -9.549 9.905 -9.565 1.00 0.00 C ATOM 871 CD ARG A 271 -9.977 11.106 -10.393 1.00 0.00 C ATOM 872 NE ARG A 271 -10.745 12.068 -9.606 1.00 0.00 N ATOM 873 CZ ARG A 271 -12.055 11.973 -9.405 1.00 0.00 C ATOM 874 NH1 ARG A 271 -12.738 10.965 -9.930 1.00 0.00 N ATOM 875 NH2 ARG A 271 -12.683 12.887 -8.677 1.00 0.00 N ATOM 0 H ARG A 271 -6.574 9.020 -9.891 1.00 0.00 H new ATOM 0 HA ARG A 271 -8.680 7.612 -8.675 1.00 0.00 H new ATOM 0 HB2 ARG A 271 -8.293 9.251 -11.169 1.00 0.00 H new ATOM 0 HB3 ARG A 271 -9.775 8.332 -10.997 1.00 0.00 H new ATOM 0 HG2 ARG A 271 -10.406 9.518 -9.013 1.00 0.00 H new ATOM 0 HG3 ARG A 271 -8.808 10.215 -8.828 1.00 0.00 H new ATOM 0 HD2 ARG A 271 -9.094 11.596 -10.804 1.00 0.00 H new ATOM 0 HD3 ARG A 271 -10.577 10.768 -11.238 1.00 0.00 H new ATOM 0 HE ARG A 271 -10.249 12.855 -9.188 1.00 0.00 H new ATOM 0 HH11 ARG A 271 -12.258 10.260 -10.490 1.00 0.00 H new ATOM 0 HH12 ARG A 271 -13.744 10.894 -9.774 1.00 0.00 H new ATOM 0 HH21 ARG A 271 -12.160 13.663 -8.271 1.00 0.00 H new ATOM 0 HH22 ARG A 271 -13.689 12.814 -8.523 1.00 0.00 H new ATOM 889 N LYS A 272 -7.477 6.269 -11.441 1.00 0.00 N ATOM 890 CA LYS A 272 -7.446 5.046 -12.234 1.00 0.00 C ATOM 891 C LYS A 272 -7.206 3.828 -11.346 1.00 0.00 C ATOM 892 O LYS A 272 -8.019 2.906 -11.309 1.00 0.00 O ATOM 893 CB LYS A 272 -6.354 5.134 -13.303 1.00 0.00 C ATOM 894 CG LYS A 272 -6.261 3.898 -14.180 1.00 0.00 C ATOM 895 CD LYS A 272 -5.049 3.954 -15.095 1.00 0.00 C ATOM 896 CE LYS A 272 -4.676 2.572 -15.611 1.00 0.00 C ATOM 897 NZ LYS A 272 -3.965 1.769 -14.579 1.00 0.00 N ATOM 0 H LYS A 272 -6.837 6.996 -11.762 1.00 0.00 H new ATOM 0 HA LYS A 272 -8.415 4.934 -12.721 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -6.543 6.003 -13.933 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -5.393 5.297 -12.816 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -6.203 3.009 -13.552 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -7.167 3.807 -14.779 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -5.258 4.614 -15.937 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -4.204 4.383 -14.556 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -5.578 2.045 -15.924 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -4.043 2.672 -16.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -3.193 1.235 -15.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -3.573 2.404 -13.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -4.632 1.107 -14.134 1.00 0.00 H new ATOM 911 N ALA A 273 -6.085 3.834 -10.632 1.00 0.00 N ATOM 912 CA ALA A 273 -5.740 2.732 -9.743 1.00 0.00 C ATOM 913 C ALA A 273 -6.833 2.502 -8.705 1.00 0.00 C ATOM 914 O ALA A 273 -7.249 1.367 -8.468 1.00 0.00 O ATOM 915 CB ALA A 273 -4.408 3.003 -9.058 1.00 0.00 C ATOM 0 H ALA A 273 -5.400 4.590 -10.652 1.00 0.00 H new ATOM 0 HA ALA A 273 -5.649 1.827 -10.344 1.00 0.00 H new ATOM 0 HB1 ALA A 273 -4.163 2.172 -8.397 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -3.627 3.110 -9.811 1.00 0.00 H new ATOM 0 HB3 ALA A 273 -4.479 3.921 -8.475 1.00 0.00 H new ATOM 921 N PHE A 274 -7.294 3.585 -8.088 1.00 0.00 N ATOM 922 CA PHE A 274 -8.338 3.500 -7.073 1.00 0.00 C ATOM 923 C PHE A 274 -9.503 2.645 -7.562 1.00 0.00 C ATOM 924 O PHE A 274 -9.877 1.662 -6.922 1.00 0.00 O ATOM 925 CB PHE A 274 -8.837 4.899 -6.706 1.00 0.00 C ATOM 926 CG PHE A 274 -9.934 4.895 -5.681 1.00 0.00 C ATOM 927 CD1 PHE A 274 -11.244 4.632 -6.049 1.00 0.00 C ATOM 928 CD2 PHE A 274 -9.657 5.154 -4.348 1.00 0.00 C ATOM 929 CE1 PHE A 274 -12.256 4.627 -5.108 1.00 0.00 C ATOM 930 CE2 PHE A 274 -10.665 5.150 -3.403 1.00 0.00 C ATOM 931 CZ PHE A 274 -11.966 4.887 -3.783 1.00 0.00 C ATOM 0 H PHE A 274 -6.961 4.531 -8.273 1.00 0.00 H new ATOM 0 HA PHE A 274 -7.911 3.030 -6.187 1.00 0.00 H new ATOM 0 HB2 PHE A 274 -8.000 5.487 -6.329 1.00 0.00 H new ATOM 0 HB3 PHE A 274 -9.195 5.396 -7.607 1.00 0.00 H new ATOM 0 HD1 PHE A 274 -11.477 4.428 -7.084 1.00 0.00 H new ATOM 0 HD2 PHE A 274 -8.642 5.361 -4.044 1.00 0.00 H new ATOM 0 HE1 PHE A 274 -13.273 4.420 -5.408 1.00 0.00 H new ATOM 0 HE2 PHE A 274 -10.435 5.353 -2.367 1.00 0.00 H new ATOM 0 HZ PHE A 274 -12.755 4.885 -3.046 1.00 0.00 H new ATOM 941 N ARG A 275 -10.073 3.026 -8.700 1.00 0.00 N ATOM 942 CA ARG A 275 -11.197 2.296 -9.275 1.00 0.00 C ATOM 943 C ARG A 275 -10.865 0.814 -9.419 1.00 0.00 C ATOM 944 O ARG A 275 -11.573 -0.045 -8.891 1.00 0.00 O ATOM 945 CB ARG A 275 -11.569 2.882 -10.638 1.00 0.00 C ATOM 946 CG ARG A 275 -12.573 4.021 -10.559 1.00 0.00 C ATOM 947 CD ARG A 275 -13.149 4.352 -11.926 1.00 0.00 C ATOM 948 NE ARG A 275 -12.327 5.319 -12.648 1.00 0.00 N ATOM 949 CZ ARG A 275 -12.767 6.037 -13.674 1.00 0.00 C ATOM 950 NH1 ARG A 275 -14.016 5.898 -14.098 1.00 0.00 N ATOM 951 NH2 ARG A 275 -11.958 6.897 -14.280 1.00 0.00 N ATOM 0 H ARG A 275 -9.775 3.837 -9.243 1.00 0.00 H new ATOM 0 HA ARG A 275 -12.047 2.396 -8.600 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -10.664 3.240 -11.129 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -11.979 2.090 -11.264 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -13.380 3.749 -9.879 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -12.090 4.905 -10.143 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -13.234 3.438 -12.514 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -14.157 4.750 -11.808 1.00 0.00 H new ATOM 0 HE ARG A 275 -11.361 5.450 -12.347 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -14.641 5.238 -13.635 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -14.351 6.451 -14.887 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -10.997 7.007 -13.957 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -12.298 7.448 -15.068 1.00 0.00 H new ATOM 965 N HIS A 276 -9.786 0.521 -10.137 1.00 0.00 N ATOM 966 CA HIS A 276 -9.360 -0.857 -10.351 1.00 0.00 C ATOM 967 C HIS A 276 -9.289 -1.615 -9.028 1.00 0.00 C ATOM 968 O HIS A 276 -10.045 -2.561 -8.801 1.00 0.00 O ATOM 969 CB HIS A 276 -7.999 -0.892 -11.046 1.00 0.00 C ATOM 970 CG HIS A 276 -7.963 -0.121 -12.330 1.00 0.00 C ATOM 971 ND1 HIS A 276 -8.967 -0.182 -13.273 1.00 0.00 N ATOM 972 CD2 HIS A 276 -7.036 0.733 -12.824 1.00 0.00 C ATOM 973 CE1 HIS A 276 -8.659 0.599 -14.292 1.00 0.00 C ATOM 974 NE2 HIS A 276 -7.492 1.166 -14.044 1.00 0.00 N ATOM 0 H HIS A 276 -9.190 1.220 -10.581 1.00 0.00 H new ATOM 0 HA HIS A 276 -10.097 -1.344 -10.990 1.00 0.00 H new ATOM 0 HB2 HIS A 276 -7.244 -0.491 -10.370 1.00 0.00 H new ATOM 0 HB3 HIS A 276 -7.729 -1.929 -11.246 1.00 0.00 H new ATOM 0 HD1 HIS A 276 -9.815 -0.743 -13.195 1.00 0.00 H new ATOM 0 HD2 HIS A 276 -6.110 1.020 -12.347 1.00 0.00 H new ATOM 0 HE1 HIS A 276 -9.259 0.749 -15.177 1.00 0.00 H new ATOM 983 N LEU A 277 -8.375 -1.195 -8.160 1.00 0.00 N ATOM 984 CA LEU A 277 -8.204 -1.834 -6.860 1.00 0.00 C ATOM 985 C LEU A 277 -9.530 -1.906 -6.110 1.00 0.00 C ATOM 986 O LEU A 277 -9.776 -2.844 -5.352 1.00 0.00 O ATOM 987 CB LEU A 277 -7.174 -1.070 -6.026 1.00 0.00 C ATOM 988 CG LEU A 277 -5.824 -0.816 -6.696 1.00 0.00 C ATOM 989 CD1 LEU A 277 -4.871 -0.124 -5.732 1.00 0.00 C ATOM 990 CD2 LEU A 277 -5.223 -2.121 -7.198 1.00 0.00 C ATOM 0 H LEU A 277 -7.741 -0.415 -8.333 1.00 0.00 H new ATOM 0 HA LEU A 277 -7.846 -2.850 -7.026 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -7.604 -0.109 -5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -7.001 -1.623 -5.103 1.00 0.00 H new ATOM 0 HG LEU A 277 -5.983 -0.160 -7.552 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -3.915 0.049 -6.227 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -5.297 0.830 -5.422 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -4.718 -0.755 -4.856 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -4.262 -1.920 -7.672 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -5.079 -2.802 -6.359 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -5.897 -2.577 -7.923 1.00 0.00 H new ATOM 1002 N ALA A 278 -10.383 -0.909 -6.328 1.00 0.00 N ATOM 1003 CA ALA A 278 -11.685 -0.862 -5.676 1.00 0.00 C ATOM 1004 C ALA A 278 -12.505 -2.108 -5.995 1.00 0.00 C ATOM 1005 O ALA A 278 -12.516 -2.581 -7.132 1.00 0.00 O ATOM 1006 CB ALA A 278 -12.440 0.390 -6.095 1.00 0.00 C ATOM 0 H ALA A 278 -10.195 -0.124 -6.951 1.00 0.00 H new ATOM 0 HA ALA A 278 -11.523 -0.832 -4.599 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -13.411 0.412 -5.600 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -11.867 1.273 -5.810 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -12.583 0.384 -7.176 1.00 0.00 H new ATOM 1012 N TYR A 279 -13.188 -2.635 -4.985 1.00 0.00 N ATOM 1013 CA TYR A 279 -14.008 -3.829 -5.158 1.00 0.00 C ATOM 1014 C TYR A 279 -13.151 -5.024 -5.565 1.00 0.00 C ATOM 1015 O TYR A 279 -13.511 -5.782 -6.466 1.00 0.00 O ATOM 1016 CB TYR A 279 -15.090 -3.581 -6.211 1.00 0.00 C ATOM 1017 CG TYR A 279 -16.173 -2.630 -5.754 1.00 0.00 C ATOM 1018 CD1 TYR A 279 -17.309 -3.098 -5.106 1.00 0.00 C ATOM 1019 CD2 TYR A 279 -16.058 -1.262 -5.970 1.00 0.00 C ATOM 1020 CE1 TYR A 279 -18.301 -2.232 -4.688 1.00 0.00 C ATOM 1021 CE2 TYR A 279 -17.044 -0.388 -5.554 1.00 0.00 C ATOM 1022 CZ TYR A 279 -18.164 -0.878 -4.914 1.00 0.00 C ATOM 1023 OH TYR A 279 -19.149 -0.012 -4.498 1.00 0.00 O ATOM 0 H TYR A 279 -13.190 -2.255 -4.038 1.00 0.00 H new ATOM 0 HA TYR A 279 -14.484 -4.054 -4.203 1.00 0.00 H new ATOM 0 HB2 TYR A 279 -14.624 -3.182 -7.112 1.00 0.00 H new ATOM 0 HB3 TYR A 279 -15.545 -4.533 -6.483 1.00 0.00 H new ATOM 0 HD1 TYR A 279 -17.419 -4.157 -4.926 1.00 0.00 H new ATOM 0 HD2 TYR A 279 -15.183 -0.875 -6.472 1.00 0.00 H new ATOM 0 HE1 TYR A 279 -19.179 -2.613 -4.187 1.00 0.00 H new ATOM 0 HE2 TYR A 279 -16.939 0.673 -5.729 1.00 0.00 H new ATOM 0 HH TYR A 279 -18.898 0.906 -4.732 1.00 0.00 H new ATOM 1033 N SER A 280 -12.016 -5.186 -4.892 1.00 0.00 N ATOM 1034 CA SER A 280 -11.105 -6.287 -5.184 1.00 0.00 C ATOM 1035 C SER A 280 -10.467 -6.818 -3.904 1.00 0.00 C ATOM 1036 O SER A 280 -10.270 -6.077 -2.941 1.00 0.00 O ATOM 1037 CB SER A 280 -10.018 -5.832 -6.159 1.00 0.00 C ATOM 1038 OG SER A 280 -10.575 -5.457 -7.407 1.00 0.00 O ATOM 0 H SER A 280 -11.705 -4.569 -4.141 1.00 0.00 H new ATOM 0 HA SER A 280 -11.681 -7.091 -5.643 1.00 0.00 H new ATOM 0 HB2 SER A 280 -9.473 -4.990 -5.733 1.00 0.00 H new ATOM 0 HB3 SER A 280 -9.297 -6.637 -6.306 1.00 0.00 H new ATOM 0 HG SER A 280 -10.274 -4.554 -7.641 1.00 0.00 H new ATOM 1044 N LYS A 281 -10.146 -8.107 -3.901 1.00 0.00 N ATOM 1045 CA LYS A 281 -9.529 -8.740 -2.742 1.00 0.00 C ATOM 1046 C LYS A 281 -8.011 -8.770 -2.882 1.00 0.00 C ATOM 1047 O LYS A 281 -7.480 -9.227 -3.895 1.00 0.00 O ATOM 1048 CB LYS A 281 -10.064 -10.163 -2.566 1.00 0.00 C ATOM 1049 CG LYS A 281 -11.300 -10.244 -1.687 1.00 0.00 C ATOM 1050 CD LYS A 281 -12.114 -11.493 -1.983 1.00 0.00 C ATOM 1051 CE LYS A 281 -12.974 -11.893 -0.794 1.00 0.00 C ATOM 1052 NZ LYS A 281 -13.586 -13.237 -0.980 1.00 0.00 N ATOM 0 H LYS A 281 -10.303 -8.735 -4.690 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.783 -8.152 -1.860 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -10.298 -10.578 -3.546 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -9.280 -10.786 -2.135 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -11.003 -10.242 -0.638 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -11.918 -9.360 -1.844 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -12.750 -11.317 -2.850 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -11.444 -12.313 -2.241 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -12.366 -11.893 0.111 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -13.761 -11.153 -0.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -14.164 -13.473 -0.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -14.187 -13.230 -1.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -12.835 -13.948 -1.093 1.00 0.00 H new ATOM 1066 N PHE A 282 -7.317 -8.281 -1.859 1.00 0.00 N ATOM 1067 CA PHE A 282 -5.859 -8.253 -1.869 1.00 0.00 C ATOM 1068 C PHE A 282 -5.286 -9.658 -1.705 1.00 0.00 C ATOM 1069 O PHE A 282 -4.702 -10.215 -2.634 1.00 0.00 O ATOM 1070 CB PHE A 282 -5.338 -7.344 -0.754 1.00 0.00 C ATOM 1071 CG PHE A 282 -3.888 -7.564 -0.430 1.00 0.00 C ATOM 1072 CD1 PHE A 282 -2.898 -7.170 -1.316 1.00 0.00 C ATOM 1073 CD2 PHE A 282 -3.514 -8.164 0.762 1.00 0.00 C ATOM 1074 CE1 PHE A 282 -1.563 -7.371 -1.021 1.00 0.00 C ATOM 1075 CE2 PHE A 282 -2.180 -8.367 1.063 1.00 0.00 C ATOM 1076 CZ PHE A 282 -1.204 -7.971 0.170 1.00 0.00 C ATOM 0 H PHE A 282 -7.741 -7.899 -1.013 1.00 0.00 H new ATOM 0 HA PHE A 282 -5.535 -7.858 -2.832 1.00 0.00 H new ATOM 0 HB2 PHE A 282 -5.483 -6.304 -1.046 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -5.932 -7.508 0.145 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -3.173 -6.700 -2.249 1.00 0.00 H new ATOM 0 HD2 PHE A 282 -4.273 -8.477 1.464 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.802 -7.059 -1.721 1.00 0.00 H new ATOM 0 HE2 PHE A 282 -1.901 -8.835 1.996 1.00 0.00 H new ATOM 0 HZ PHE A 282 -0.161 -8.130 0.403 1.00 0.00 H new ATOM 1086 N HIS A 283 -5.458 -10.225 -0.515 1.00 0.00 N ATOM 1087 CA HIS A 283 -4.958 -11.565 -0.227 1.00 0.00 C ATOM 1088 C HIS A 283 -6.098 -12.493 0.180 1.00 0.00 C ATOM 1089 O HIS A 283 -6.354 -13.504 -0.476 1.00 0.00 O ATOM 1090 CB HIS A 283 -3.907 -11.513 0.882 1.00 0.00 C ATOM 1091 CG HIS A 283 -2.537 -11.156 0.392 1.00 0.00 C ATOM 1092 ND1 HIS A 283 -1.408 -11.251 1.179 1.00 0.00 N ATOM 1093 CD2 HIS A 283 -2.117 -10.705 -0.813 1.00 0.00 C ATOM 1094 CE1 HIS A 283 -0.354 -10.871 0.479 1.00 0.00 C ATOM 1095 NE2 HIS A 283 -0.757 -10.535 -0.733 1.00 0.00 N ATOM 0 H HIS A 283 -5.940 -9.778 0.265 1.00 0.00 H new ATOM 0 HA HIS A 283 -4.498 -11.958 -1.134 1.00 0.00 H new ATOM 0 HB2 HIS A 283 -4.217 -10.785 1.631 1.00 0.00 H new ATOM 0 HB3 HIS A 283 -3.865 -12.483 1.378 1.00 0.00 H new ATOM 0 HD2 HIS A 283 -2.737 -10.514 -1.677 1.00 0.00 H new ATOM 0 HE1 HIS A 283 0.664 -10.840 0.837 1.00 0.00 H new ATOM 0 HE2 HIS A 283 -0.156 -10.203 -1.487 1.00 0.00 H new ATOM 1104 N HIS A 284 -6.780 -12.145 1.266 1.00 0.00 N ATOM 1105 CA HIS A 284 -7.893 -12.948 1.761 1.00 0.00 C ATOM 1106 C HIS A 284 -9.080 -12.062 2.131 1.00 0.00 C ATOM 1107 O HIS A 284 -10.235 -12.463 1.989 1.00 0.00 O ATOM 1108 CB HIS A 284 -7.457 -13.770 2.974 1.00 0.00 C ATOM 1109 CG HIS A 284 -6.127 -14.436 2.799 1.00 0.00 C ATOM 1110 ND1 HIS A 284 -5.991 -15.762 2.444 1.00 0.00 N ATOM 1111 CD2 HIS A 284 -4.870 -13.952 2.931 1.00 0.00 C ATOM 1112 CE1 HIS A 284 -4.707 -16.064 2.367 1.00 0.00 C ATOM 1113 NE2 HIS A 284 -4.006 -14.983 2.657 1.00 0.00 N ATOM 0 H HIS A 284 -6.582 -11.312 1.821 1.00 0.00 H new ATOM 0 HA HIS A 284 -8.202 -13.626 0.965 1.00 0.00 H new ATOM 0 HB2 HIS A 284 -7.416 -13.120 3.848 1.00 0.00 H new ATOM 0 HB3 HIS A 284 -8.211 -14.530 3.177 1.00 0.00 H new ATOM 0 HD2 HIS A 284 -4.597 -12.943 3.202 1.00 0.00 H new ATOM 0 HE1 HIS A 284 -4.300 -17.031 2.110 1.00 0.00 H new ATOM 0 HE2 HIS A 284 -2.988 -14.924 2.675 1.00 0.00 H new ATOM 1122 N VAL A 285 -8.786 -10.856 2.607 1.00 0.00 N ATOM 1123 CA VAL A 285 -9.828 -9.914 2.997 1.00 0.00 C ATOM 1124 C VAL A 285 -10.056 -8.867 1.913 1.00 0.00 C ATOM 1125 O VAL A 285 -9.161 -8.540 1.133 1.00 0.00 O ATOM 1126 CB VAL A 285 -9.475 -9.203 4.317 1.00 0.00 C ATOM 1127 CG1 VAL A 285 -9.317 -10.214 5.443 1.00 0.00 C ATOM 1128 CG2 VAL A 285 -8.212 -8.372 4.153 1.00 0.00 C ATOM 0 H VAL A 285 -7.835 -10.509 2.732 1.00 0.00 H new ATOM 0 HA VAL A 285 -10.742 -10.492 3.137 1.00 0.00 H new ATOM 0 HB VAL A 285 -10.293 -8.531 4.578 1.00 0.00 H new ATOM 0 HG11 VAL A 285 -9.068 -9.693 6.367 1.00 0.00 H new ATOM 0 HG12 VAL A 285 -10.251 -10.761 5.575 1.00 0.00 H new ATOM 0 HG13 VAL A 285 -8.519 -10.914 5.194 1.00 0.00 H new ATOM 0 HG21 VAL A 285 -7.977 -7.877 5.095 1.00 0.00 H new ATOM 0 HG22 VAL A 285 -7.384 -9.021 3.868 1.00 0.00 H new ATOM 0 HG23 VAL A 285 -8.368 -7.622 3.378 1.00 0.00 H new ATOM 1138 N PRO A 286 -11.282 -8.325 1.862 1.00 0.00 N ATOM 1139 CA PRO A 286 -11.657 -7.305 0.878 1.00 0.00 C ATOM 1140 C PRO A 286 -10.971 -5.969 1.139 1.00 0.00 C ATOM 1141 O PRO A 286 -10.903 -5.506 2.279 1.00 0.00 O ATOM 1142 CB PRO A 286 -13.170 -7.174 1.062 1.00 0.00 C ATOM 1143 CG PRO A 286 -13.421 -7.606 2.466 1.00 0.00 C ATOM 1144 CD PRO A 286 -12.397 -8.667 2.761 1.00 0.00 C ATOM 0 HA PRO A 286 -11.360 -7.585 -0.133 1.00 0.00 H new ATOM 0 HB2 PRO A 286 -13.501 -6.148 0.898 1.00 0.00 H new ATOM 0 HB3 PRO A 286 -13.711 -7.801 0.353 1.00 0.00 H new ATOM 0 HG2 PRO A 286 -13.324 -6.768 3.156 1.00 0.00 H new ATOM 0 HG3 PRO A 286 -14.432 -7.997 2.579 1.00 0.00 H new ATOM 0 HD2 PRO A 286 -12.090 -8.649 3.807 1.00 0.00 H new ATOM 0 HD3 PRO A 286 -12.784 -9.666 2.559 1.00 0.00 H new ATOM 1152 N LEU A 287 -10.464 -5.352 0.078 1.00 0.00 N ATOM 1153 CA LEU A 287 -9.783 -4.067 0.192 1.00 0.00 C ATOM 1154 C LEU A 287 -10.788 -2.920 0.230 1.00 0.00 C ATOM 1155 O LEU A 287 -11.602 -2.764 -0.680 1.00 0.00 O ATOM 1156 CB LEU A 287 -8.816 -3.874 -0.978 1.00 0.00 C ATOM 1157 CG LEU A 287 -7.612 -4.815 -1.015 1.00 0.00 C ATOM 1158 CD1 LEU A 287 -7.025 -4.875 -2.417 1.00 0.00 C ATOM 1159 CD2 LEU A 287 -6.557 -4.373 -0.012 1.00 0.00 C ATOM 0 H LEU A 287 -10.511 -5.721 -0.872 1.00 0.00 H new ATOM 0 HA LEU A 287 -9.220 -4.064 1.125 1.00 0.00 H new ATOM 0 HB2 LEU A 287 -9.373 -3.993 -1.907 1.00 0.00 H new ATOM 0 HB3 LEU A 287 -8.449 -2.848 -0.955 1.00 0.00 H new ATOM 0 HG LEU A 287 -7.948 -5.815 -0.740 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -6.169 -5.550 -2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -7.781 -5.240 -3.113 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -6.704 -3.878 -2.720 1.00 0.00 H new ATOM 0 HD21 LEU A 287 -5.708 -5.055 -0.053 1.00 0.00 H new ATOM 0 HD22 LEU A 287 -6.224 -3.364 -0.255 1.00 0.00 H new ATOM 0 HD23 LEU A 287 -6.982 -4.383 0.992 1.00 0.00 H new ATOM 1171 N TYR A 288 -10.723 -2.119 1.288 1.00 0.00 N ATOM 1172 CA TYR A 288 -11.627 -0.986 1.445 1.00 0.00 C ATOM 1173 C TYR A 288 -10.870 0.334 1.340 1.00 0.00 C ATOM 1174 O TYR A 288 -10.229 0.774 2.296 1.00 0.00 O ATOM 1175 CB TYR A 288 -12.350 -1.066 2.791 1.00 0.00 C ATOM 1176 CG TYR A 288 -13.443 -2.110 2.830 1.00 0.00 C ATOM 1177 CD1 TYR A 288 -14.621 -1.937 2.113 1.00 0.00 C ATOM 1178 CD2 TYR A 288 -13.299 -3.268 3.584 1.00 0.00 C ATOM 1179 CE1 TYR A 288 -15.623 -2.888 2.146 1.00 0.00 C ATOM 1180 CE2 TYR A 288 -14.294 -4.225 3.621 1.00 0.00 C ATOM 1181 CZ TYR A 288 -15.455 -4.030 2.901 1.00 0.00 C ATOM 1182 OH TYR A 288 -16.450 -4.980 2.938 1.00 0.00 O ATOM 0 H TYR A 288 -10.054 -2.233 2.049 1.00 0.00 H new ATOM 0 HA TYR A 288 -12.363 -1.027 0.642 1.00 0.00 H new ATOM 0 HB2 TYR A 288 -11.622 -1.285 3.572 1.00 0.00 H new ATOM 0 HB3 TYR A 288 -12.781 -0.092 3.021 1.00 0.00 H new ATOM 0 HD1 TYR A 288 -14.755 -1.044 1.520 1.00 0.00 H new ATOM 0 HD2 TYR A 288 -12.393 -3.423 4.151 1.00 0.00 H new ATOM 0 HE1 TYR A 288 -16.533 -2.738 1.584 1.00 0.00 H new ATOM 0 HE2 TYR A 288 -14.164 -5.121 4.210 1.00 0.00 H new ATOM 0 HH TYR A 288 -16.173 -5.722 3.515 1.00 0.00 H new ATOM 1192 N LEU A 289 -10.948 0.962 0.172 1.00 0.00 N ATOM 1193 CA LEU A 289 -10.272 2.233 -0.060 1.00 0.00 C ATOM 1194 C LEU A 289 -11.180 3.407 0.293 1.00 0.00 C ATOM 1195 O LEU A 289 -12.379 3.380 0.018 1.00 0.00 O ATOM 1196 CB LEU A 289 -9.829 2.339 -1.521 1.00 0.00 C ATOM 1197 CG LEU A 289 -8.887 1.241 -2.017 1.00 0.00 C ATOM 1198 CD1 LEU A 289 -8.694 1.344 -3.522 1.00 0.00 C ATOM 1199 CD2 LEU A 289 -7.548 1.323 -1.299 1.00 0.00 C ATOM 0 H LEU A 289 -11.473 0.611 -0.629 1.00 0.00 H new ATOM 0 HA LEU A 289 -9.394 2.270 0.584 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -10.719 2.339 -2.151 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -9.339 3.302 -1.662 1.00 0.00 H new ATOM 0 HG LEU A 289 -9.337 0.274 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -8.021 0.555 -3.857 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -9.657 1.236 -4.021 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -8.265 2.315 -3.768 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -6.890 0.534 -1.664 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -7.091 2.294 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -7.702 1.199 -0.227 1.00 0.00 H new ATOM 1211 N GLU A 290 -10.599 4.435 0.903 1.00 0.00 N ATOM 1212 CA GLU A 290 -11.357 5.618 1.293 1.00 0.00 C ATOM 1213 C GLU A 290 -10.558 6.890 1.021 1.00 0.00 C ATOM 1214 O GLU A 290 -9.483 7.092 1.584 1.00 0.00 O ATOM 1215 CB GLU A 290 -11.732 5.546 2.775 1.00 0.00 C ATOM 1216 CG GLU A 290 -13.033 6.257 3.108 1.00 0.00 C ATOM 1217 CD GLU A 290 -13.615 5.814 4.437 1.00 0.00 C ATOM 1218 OE1 GLU A 290 -13.004 6.117 5.482 1.00 0.00 O ATOM 1219 OE2 GLU A 290 -14.682 5.165 4.431 1.00 0.00 O ATOM 0 H GLU A 290 -9.607 4.473 1.138 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.269 5.647 0.696 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -11.813 4.500 3.070 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -10.927 5.983 3.367 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -12.859 7.333 3.132 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -13.759 6.069 2.317 1.00 0.00 H new ATOM 1226 N TRP A 291 -11.093 7.743 0.154 1.00 0.00 N ATOM 1227 CA TRP A 291 -10.430 8.994 -0.194 1.00 0.00 C ATOM 1228 C TRP A 291 -10.083 9.793 1.057 1.00 0.00 C ATOM 1229 O TRP A 291 -10.914 9.960 1.949 1.00 0.00 O ATOM 1230 CB TRP A 291 -11.322 9.829 -1.115 1.00 0.00 C ATOM 1231 CG TRP A 291 -11.324 9.349 -2.535 1.00 0.00 C ATOM 1232 CD1 TRP A 291 -12.408 8.952 -3.264 1.00 0.00 C ATOM 1233 CD2 TRP A 291 -10.188 9.213 -3.395 1.00 0.00 C ATOM 1234 NE1 TRP A 291 -12.014 8.578 -4.526 1.00 0.00 N ATOM 1235 CE2 TRP A 291 -10.657 8.730 -4.632 1.00 0.00 C ATOM 1236 CE3 TRP A 291 -8.820 9.455 -3.242 1.00 0.00 C ATOM 1237 CZ2 TRP A 291 -9.806 8.484 -5.706 1.00 0.00 C ATOM 1238 CZ3 TRP A 291 -7.977 9.210 -4.309 1.00 0.00 C ATOM 1239 CH2 TRP A 291 -8.472 8.729 -5.528 1.00 0.00 C ATOM 0 H TRP A 291 -11.983 7.591 -0.320 1.00 0.00 H new ATOM 0 HA TRP A 291 -9.505 8.752 -0.717 1.00 0.00 H new ATOM 0 HB2 TRP A 291 -12.343 9.814 -0.732 1.00 0.00 H new ATOM 0 HB3 TRP A 291 -10.988 10.866 -1.090 1.00 0.00 H new ATOM 0 HD1 TRP A 291 -13.425 8.935 -2.902 1.00 0.00 H new ATOM 0 HE1 TRP A 291 -12.632 8.242 -5.264 1.00 0.00 H new ATOM 0 HE3 TRP A 291 -8.429 9.827 -2.307 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 -10.186 8.113 -6.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 -6.918 9.393 -4.201 1.00 0.00 H new ATOM 0 HH2 TRP A 291 -7.787 8.548 -6.343 1.00 0.00 H new ATOM 1250 N ALA A 292 -8.849 10.284 1.118 1.00 0.00 N ATOM 1251 CA ALA A 292 -8.393 11.066 2.260 1.00 0.00 C ATOM 1252 C ALA A 292 -8.772 12.535 2.105 1.00 0.00 C ATOM 1253 O ALA A 292 -8.700 13.109 1.017 1.00 0.00 O ATOM 1254 CB ALA A 292 -6.888 10.922 2.431 1.00 0.00 C ATOM 0 H ALA A 292 -8.147 10.154 0.389 1.00 0.00 H new ATOM 0 HA ALA A 292 -8.887 10.683 3.153 1.00 0.00 H new ATOM 0 HB1 ALA A 292 -6.561 11.511 3.288 1.00 0.00 H new ATOM 0 HB2 ALA A 292 -6.639 9.874 2.596 1.00 0.00 H new ATOM 0 HB3 ALA A 292 -6.384 11.278 1.532 1.00 0.00 H new