USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 590 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 306 ASN : amide:sc= -0.243 K(o=-0.31,f=-2.1!) USER MOD Set 1.2: A 308 LYS NZ :NH3+ -179:sc= -0.0632 (180deg=0) USER MOD Single : A 239 THR OG1 : rot 129:sc= 0.28 USER MOD Single : A 240 THR OG1 : rot 180:sc= 0 USER MOD Single : A 242 TYR OH : rot 180:sc= 0 USER MOD Single : A 249 THR OG1 : rot -94:sc= -1.66! USER MOD Single : A 251 THR OG1 : rot -58:sc= 0.0124 USER MOD Single : A 253 THR OG1 : rot 180:sc= 0 USER MOD Single : A 257 ASN :FLIP amide:sc= -0.0165 F(o=-1.3,f=-0.017) USER MOD Single : A 258 HIS :FLIP no HD1:sc= -5.78! C(o=-6.4!,f=-5.8!) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 261 GLN : amide:sc= 0.92 K(o=0.92,f=0) USER MOD Single : A 267 THR OG1 : rot 180:sc= -0.161 USER MOD Single : A 269 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 274 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 275 GLN : amide:sc= -0.121 K(o=-0.12,f=-1) USER MOD Single : A 276 CYS SG : rot 180:sc= -0.324 USER MOD Single : A 280 GLN : amide:sc= -0.109 K(o=-0.11,f=-1.6!) USER MOD Single : A 283 THR OG1 : rot 40:sc= 0.311 USER MOD Single : A 285 GLN : amide:sc= -2.87! C(o=-2.9!,f=-7!) USER MOD Single : A 293 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 SER OG : rot -29:sc= -0.0908 USER MOD Single : A 296 ASN : amide:sc= 0.152 X(o=0.15,f=-0.052) USER MOD Single : A 297 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 301 ASN :FLIP amide:sc= -0.612 F(o=-1.3,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 129 N ILE A 238 4.528 11.669 0.869 1.00 0.00 N ATOM 130 CA ILE A 238 4.657 10.242 1.138 1.00 0.00 C ATOM 131 C ILE A 238 4.270 9.415 -0.083 1.00 0.00 C ATOM 132 O ILE A 238 3.113 9.413 -0.505 1.00 0.00 O ATOM 133 CB ILE A 238 3.783 9.814 2.332 1.00 0.00 C ATOM 134 CG1 ILE A 238 4.183 10.589 3.589 1.00 0.00 C ATOM 135 CG2 ILE A 238 3.905 8.315 2.566 1.00 0.00 C ATOM 136 CD1 ILE A 238 3.231 10.394 4.748 1.00 0.00 C ATOM 0 HA ILE A 238 5.704 10.060 1.380 1.00 0.00 H new ATOM 0 HB ILE A 238 2.742 10.043 2.103 1.00 0.00 H new ATOM 0 HG12 ILE A 238 5.182 10.279 3.894 1.00 0.00 H new ATOM 0 HG13 ILE A 238 4.238 11.651 3.349 1.00 0.00 H new ATOM 0 HG21 ILE A 238 3.282 8.027 3.413 1.00 0.00 H new ATOM 0 HG22 ILE A 238 3.576 7.780 1.675 1.00 0.00 H new ATOM 0 HG23 ILE A 238 4.944 8.063 2.778 1.00 0.00 H new ATOM 0 HD11 ILE A 238 3.577 10.973 5.604 1.00 0.00 H new ATOM 0 HD12 ILE A 238 2.235 10.731 4.461 1.00 0.00 H new ATOM 0 HD13 ILE A 238 3.194 9.338 5.015 1.00 0.00 H new ATOM 148 N THR A 239 5.247 8.711 -0.647 1.00 0.00 N ATOM 149 CA THR A 239 5.010 7.878 -1.820 1.00 0.00 C ATOM 150 C THR A 239 4.824 6.417 -1.428 1.00 0.00 C ATOM 151 O THR A 239 5.100 5.512 -2.216 1.00 0.00 O ATOM 152 CB THR A 239 6.169 7.985 -2.828 1.00 0.00 C ATOM 153 OG1 THR A 239 7.364 7.435 -2.261 1.00 0.00 O ATOM 154 CG2 THR A 239 6.410 9.433 -3.225 1.00 0.00 C ATOM 0 H THR A 239 6.210 8.701 -0.310 1.00 0.00 H new ATOM 0 HA THR A 239 4.097 8.244 -2.289 1.00 0.00 H new ATOM 0 HB THR A 239 5.898 7.421 -3.720 1.00 0.00 H new ATOM 0 HG1 THR A 239 7.756 6.790 -2.886 1.00 0.00 H new ATOM 0 HG21 THR A 239 7.233 9.483 -3.938 1.00 0.00 H new ATOM 0 HG22 THR A 239 5.508 9.840 -3.683 1.00 0.00 H new ATOM 0 HG23 THR A 239 6.661 10.016 -2.339 1.00 0.00 H new ATOM 162 N THR A 240 4.354 6.192 -0.205 1.00 0.00 N ATOM 163 CA THR A 240 4.132 4.840 0.292 1.00 0.00 C ATOM 164 C THR A 240 2.702 4.665 0.789 1.00 0.00 C ATOM 165 O THR A 240 2.144 5.555 1.431 1.00 0.00 O ATOM 166 CB THR A 240 5.107 4.493 1.433 1.00 0.00 C ATOM 167 OG1 THR A 240 6.449 4.803 1.042 1.00 0.00 O ATOM 168 CG2 THR A 240 5.007 3.021 1.801 1.00 0.00 C ATOM 0 H THR A 240 4.120 6.929 0.460 1.00 0.00 H new ATOM 0 HA THR A 240 4.308 4.163 -0.544 1.00 0.00 H new ATOM 0 HB THR A 240 4.837 5.088 2.306 1.00 0.00 H new ATOM 0 HG1 THR A 240 7.062 4.581 1.773 1.00 0.00 H new ATOM 0 HG21 THR A 240 5.705 2.800 2.609 1.00 0.00 H new ATOM 0 HG22 THR A 240 3.992 2.796 2.127 1.00 0.00 H new ATOM 0 HG23 THR A 240 5.253 2.411 0.932 1.00 0.00 H new ATOM 176 N LEU A 241 2.113 3.512 0.490 1.00 0.00 N ATOM 177 CA LEU A 241 0.747 3.219 0.908 1.00 0.00 C ATOM 178 C LEU A 241 0.660 1.845 1.564 1.00 0.00 C ATOM 179 O LEU A 241 1.042 0.837 0.969 1.00 0.00 O ATOM 180 CB LEU A 241 -0.200 3.285 -0.291 1.00 0.00 C ATOM 181 CG LEU A 241 -0.504 4.683 -0.831 1.00 0.00 C ATOM 182 CD1 LEU A 241 -1.024 4.603 -2.258 1.00 0.00 C ATOM 183 CD2 LEU A 241 -1.506 5.395 0.066 1.00 0.00 C ATOM 0 H LEU A 241 2.561 2.765 -0.041 1.00 0.00 H new ATOM 0 HA LEU A 241 0.449 3.970 1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 241 0.227 2.690 -1.099 1.00 0.00 H new ATOM 0 HB3 LEU A 241 -1.142 2.813 -0.011 1.00 0.00 H new ATOM 0 HG LEU A 241 0.421 5.259 -0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 241 -1.235 5.607 -2.625 1.00 0.00 H new ATOM 0 HD12 LEU A 241 -0.272 4.135 -2.893 1.00 0.00 H new ATOM 0 HD13 LEU A 241 -1.938 4.010 -2.279 1.00 0.00 H new ATOM 0 HD21 LEU A 241 -1.710 6.388 -0.334 1.00 0.00 H new ATOM 0 HD22 LEU A 241 -2.432 4.821 0.104 1.00 0.00 H new ATOM 0 HD23 LEU A 241 -1.094 5.486 1.071 1.00 0.00 H new ATOM 195 N TYR A 242 0.155 1.812 2.792 1.00 0.00 N ATOM 196 CA TYR A 242 0.018 0.561 3.529 1.00 0.00 C ATOM 197 C TYR A 242 -1.245 -0.184 3.108 1.00 0.00 C ATOM 198 O TYR A 242 -2.208 0.420 2.635 1.00 0.00 O ATOM 199 CB TYR A 242 -0.014 0.833 5.034 1.00 0.00 C ATOM 200 CG TYR A 242 -0.762 -0.218 5.823 1.00 0.00 C ATOM 201 CD1 TYR A 242 -2.147 -0.311 5.757 1.00 0.00 C ATOM 202 CD2 TYR A 242 -0.083 -1.120 6.634 1.00 0.00 C ATOM 203 CE1 TYR A 242 -2.834 -1.270 6.476 1.00 0.00 C ATOM 204 CE2 TYR A 242 -0.762 -2.082 7.356 1.00 0.00 C ATOM 205 CZ TYR A 242 -2.137 -2.153 7.274 1.00 0.00 C ATOM 206 OH TYR A 242 -2.817 -3.110 7.992 1.00 0.00 O ATOM 0 H TYR A 242 -0.166 2.637 3.298 1.00 0.00 H new ATOM 0 HA TYR A 242 0.880 -0.064 3.298 1.00 0.00 H new ATOM 0 HB2 TYR A 242 1.009 0.895 5.405 1.00 0.00 H new ATOM 0 HB3 TYR A 242 -0.476 1.804 5.210 1.00 0.00 H new ATOM 0 HD1 TYR A 242 -2.696 0.378 5.133 1.00 0.00 H new ATOM 0 HD2 TYR A 242 0.994 -1.068 6.701 1.00 0.00 H new ATOM 0 HE1 TYR A 242 -3.911 -1.328 6.414 1.00 0.00 H new ATOM 0 HE2 TYR A 242 -0.219 -2.775 7.982 1.00 0.00 H new ATOM 0 HH TYR A 242 -2.179 -3.652 8.502 1.00 0.00 H new ATOM 216 N VAL A 243 -1.234 -1.501 3.285 1.00 0.00 N ATOM 217 CA VAL A 243 -2.378 -2.331 2.926 1.00 0.00 C ATOM 218 C VAL A 243 -2.619 -3.416 3.969 1.00 0.00 C ATOM 219 O VAL A 243 -1.685 -4.078 4.419 1.00 0.00 O ATOM 220 CB VAL A 243 -2.181 -2.993 1.549 1.00 0.00 C ATOM 221 CG1 VAL A 243 -3.313 -3.966 1.257 1.00 0.00 C ATOM 222 CG2 VAL A 243 -2.080 -1.937 0.459 1.00 0.00 C ATOM 0 H VAL A 243 -0.445 -2.017 3.675 1.00 0.00 H new ATOM 0 HA VAL A 243 -3.246 -1.673 2.884 1.00 0.00 H new ATOM 0 HB VAL A 243 -1.247 -3.554 1.566 1.00 0.00 H new ATOM 0 HG11 VAL A 243 -3.157 -4.424 0.280 1.00 0.00 H new ATOM 0 HG12 VAL A 243 -3.332 -4.742 2.022 1.00 0.00 H new ATOM 0 HG13 VAL A 243 -4.262 -3.431 1.259 1.00 0.00 H new ATOM 0 HG21 VAL A 243 -1.941 -2.423 -0.507 1.00 0.00 H new ATOM 0 HG22 VAL A 243 -2.995 -1.346 0.439 1.00 0.00 H new ATOM 0 HG23 VAL A 243 -1.231 -1.284 0.662 1.00 0.00 H new ATOM 232 N GLY A 244 -3.881 -3.592 4.350 1.00 0.00 N ATOM 233 CA GLY A 244 -4.223 -4.598 5.338 1.00 0.00 C ATOM 234 C GLY A 244 -5.244 -5.594 4.823 1.00 0.00 C ATOM 235 O GLY A 244 -5.685 -5.504 3.678 1.00 0.00 O ATOM 0 H GLY A 244 -4.672 -3.056 3.992 1.00 0.00 H new ATOM 0 HA2 GLY A 244 -3.320 -5.130 5.638 1.00 0.00 H new ATOM 0 HA3 GLY A 244 -4.615 -4.109 6.229 1.00 0.00 H new ATOM 239 N GLY A 245 -5.619 -6.548 5.670 1.00 0.00 N ATOM 240 CA GLY A 245 -6.589 -7.551 5.275 1.00 0.00 C ATOM 241 C GLY A 245 -6.150 -8.332 4.052 1.00 0.00 C ATOM 242 O GLY A 245 -6.944 -8.574 3.142 1.00 0.00 O ATOM 0 H GLY A 245 -5.268 -6.644 6.623 1.00 0.00 H new ATOM 0 HA2 GLY A 245 -6.752 -8.240 6.103 1.00 0.00 H new ATOM 0 HA3 GLY A 245 -7.544 -7.067 5.070 1.00 0.00 H new ATOM 246 N LEU A 246 -4.882 -8.727 4.028 1.00 0.00 N ATOM 247 CA LEU A 246 -4.337 -9.484 2.906 1.00 0.00 C ATOM 248 C LEU A 246 -4.636 -10.972 3.058 1.00 0.00 C ATOM 249 O LEU A 246 -5.252 -11.584 2.186 1.00 0.00 O ATOM 250 CB LEU A 246 -2.827 -9.263 2.802 1.00 0.00 C ATOM 251 CG LEU A 246 -2.377 -7.836 2.487 1.00 0.00 C ATOM 252 CD1 LEU A 246 -0.864 -7.771 2.348 1.00 0.00 C ATOM 253 CD2 LEU A 246 -3.053 -7.331 1.221 1.00 0.00 C ATOM 0 H LEU A 246 -4.212 -8.536 4.773 1.00 0.00 H new ATOM 0 HA LEU A 246 -4.813 -9.128 1.993 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -2.370 -9.567 3.744 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -2.436 -9.925 2.029 1.00 0.00 H new ATOM 0 HG LEU A 246 -2.673 -7.192 3.315 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -0.563 -6.748 2.124 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -0.399 -8.090 3.281 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -0.544 -8.429 1.540 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -2.721 -6.314 1.012 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -2.789 -7.978 0.385 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -4.134 -7.339 1.358 1.00 0.00 H new ATOM 265 N GLY A 247 -4.195 -11.549 4.172 1.00 0.00 N ATOM 266 CA GLY A 247 -4.427 -12.960 4.418 1.00 0.00 C ATOM 267 C GLY A 247 -3.781 -13.845 3.371 1.00 0.00 C ATOM 268 O GLY A 247 -3.393 -13.372 2.303 1.00 0.00 O ATOM 0 H GLY A 247 -3.681 -11.064 4.908 1.00 0.00 H new ATOM 0 HA2 GLY A 247 -4.038 -13.223 5.402 1.00 0.00 H new ATOM 0 HA3 GLY A 247 -5.500 -13.150 4.438 1.00 0.00 H new ATOM 272 N ASP A 248 -3.664 -15.132 3.677 1.00 0.00 N ATOM 273 CA ASP A 248 -3.059 -16.086 2.754 1.00 0.00 C ATOM 274 C ASP A 248 -3.755 -16.044 1.397 1.00 0.00 C ATOM 275 O ASP A 248 -3.134 -16.285 0.361 1.00 0.00 O ATOM 276 CB ASP A 248 -3.126 -17.500 3.333 1.00 0.00 C ATOM 277 CG ASP A 248 -2.208 -17.682 4.526 1.00 0.00 C ATOM 278 OD1 ASP A 248 -1.012 -17.975 4.316 1.00 0.00 O ATOM 279 OD2 ASP A 248 -2.686 -17.530 5.669 1.00 0.00 O ATOM 0 H ASP A 248 -3.980 -15.539 4.557 1.00 0.00 H new ATOM 0 HA ASP A 248 -2.014 -15.808 2.615 1.00 0.00 H new ATOM 0 HB2 ASP A 248 -4.151 -17.719 3.631 1.00 0.00 H new ATOM 0 HB3 ASP A 248 -2.858 -18.219 2.559 1.00 0.00 H new ATOM 284 N THR A 249 -5.048 -15.738 1.410 1.00 0.00 N ATOM 285 CA THR A 249 -5.829 -15.668 0.182 1.00 0.00 C ATOM 286 C THR A 249 -5.219 -14.675 -0.801 1.00 0.00 C ATOM 287 O THR A 249 -5.273 -14.876 -2.015 1.00 0.00 O ATOM 288 CB THR A 249 -7.288 -15.261 0.466 1.00 0.00 C ATOM 289 OG1 THR A 249 -7.318 -14.100 1.303 1.00 0.00 O ATOM 290 CG2 THR A 249 -8.045 -16.397 1.137 1.00 0.00 C ATOM 0 H THR A 249 -5.577 -15.535 2.258 1.00 0.00 H new ATOM 0 HA THR A 249 -5.817 -16.665 -0.258 1.00 0.00 H new ATOM 0 HB THR A 249 -7.772 -15.035 -0.484 1.00 0.00 H new ATOM 0 HG1 THR A 249 -7.396 -14.375 2.241 1.00 0.00 H new ATOM 0 HG21 THR A 249 -9.072 -16.087 1.328 1.00 0.00 H new ATOM 0 HG22 THR A 249 -8.045 -17.270 0.484 1.00 0.00 H new ATOM 0 HG23 THR A 249 -7.561 -16.649 2.080 1.00 0.00 H new ATOM 298 N ILE A 250 -4.638 -13.604 -0.270 1.00 0.00 N ATOM 299 CA ILE A 250 -4.016 -12.582 -1.102 1.00 0.00 C ATOM 300 C ILE A 250 -2.496 -12.688 -1.058 1.00 0.00 C ATOM 301 O ILE A 250 -1.908 -12.915 0.000 1.00 0.00 O ATOM 302 CB ILE A 250 -4.434 -11.167 -0.660 1.00 0.00 C ATOM 303 CG1 ILE A 250 -5.958 -11.032 -0.680 1.00 0.00 C ATOM 304 CG2 ILE A 250 -3.792 -10.120 -1.560 1.00 0.00 C ATOM 305 CD1 ILE A 250 -6.450 -9.673 -0.234 1.00 0.00 C ATOM 0 H ILE A 250 -4.585 -13.422 0.732 1.00 0.00 H new ATOM 0 HA ILE A 250 -4.360 -12.752 -2.122 1.00 0.00 H new ATOM 0 HB ILE A 250 -4.087 -11.003 0.360 1.00 0.00 H new ATOM 0 HG12 ILE A 250 -6.319 -11.227 -1.690 1.00 0.00 H new ATOM 0 HG13 ILE A 250 -6.391 -11.796 -0.034 1.00 0.00 H new ATOM 0 HG21 ILE A 250 -4.097 -9.125 -1.235 1.00 0.00 H new ATOM 0 HG22 ILE A 250 -2.707 -10.205 -1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 250 -4.112 -10.280 -2.590 1.00 0.00 H new ATOM 0 HD11 ILE A 250 -7.539 -9.649 -0.273 1.00 0.00 H new ATOM 0 HD12 ILE A 250 -6.120 -9.484 0.787 1.00 0.00 H new ATOM 0 HD13 ILE A 250 -6.046 -8.905 -0.894 1.00 0.00 H new ATOM 317 N THR A 251 -1.863 -12.519 -2.215 1.00 0.00 N ATOM 318 CA THR A 251 -0.410 -12.595 -2.309 1.00 0.00 C ATOM 319 C THR A 251 0.192 -11.232 -2.629 1.00 0.00 C ATOM 320 O THR A 251 -0.528 -10.245 -2.776 1.00 0.00 O ATOM 321 CB THR A 251 0.031 -13.604 -3.387 1.00 0.00 C ATOM 322 OG1 THR A 251 -0.353 -13.135 -4.684 1.00 0.00 O ATOM 323 CG2 THR A 251 -0.587 -14.971 -3.133 1.00 0.00 C ATOM 0 H THR A 251 -2.334 -12.329 -3.100 1.00 0.00 H new ATOM 0 HA THR A 251 -0.047 -12.930 -1.337 1.00 0.00 H new ATOM 0 HB THR A 251 1.116 -13.699 -3.342 1.00 0.00 H new ATOM 0 HG1 THR A 251 -1.324 -13.004 -4.710 1.00 0.00 H new ATOM 0 HG21 THR A 251 -0.262 -15.667 -3.906 1.00 0.00 H new ATOM 0 HG22 THR A 251 -0.269 -15.338 -2.157 1.00 0.00 H new ATOM 0 HG23 THR A 251 -1.674 -14.888 -3.153 1.00 0.00 H new ATOM 331 N GLU A 252 1.516 -11.185 -2.737 1.00 0.00 N ATOM 332 CA GLU A 252 2.214 -9.941 -3.040 1.00 0.00 C ATOM 333 C GLU A 252 1.936 -9.497 -4.473 1.00 0.00 C ATOM 334 O GLU A 252 1.540 -8.356 -4.717 1.00 0.00 O ATOM 335 CB GLU A 252 3.720 -10.111 -2.829 1.00 0.00 C ATOM 336 CG GLU A 252 4.529 -8.881 -3.205 1.00 0.00 C ATOM 337 CD GLU A 252 4.990 -8.904 -4.649 1.00 0.00 C ATOM 338 OE1 GLU A 252 5.279 -10.006 -5.161 1.00 0.00 O ATOM 339 OE2 GLU A 252 5.063 -7.821 -5.267 1.00 0.00 O ATOM 0 H GLU A 252 2.127 -11.994 -2.619 1.00 0.00 H new ATOM 0 HA GLU A 252 1.845 -9.172 -2.362 1.00 0.00 H new ATOM 0 HB2 GLU A 252 3.907 -10.353 -1.783 1.00 0.00 H new ATOM 0 HB3 GLU A 252 4.068 -10.959 -3.419 1.00 0.00 H new ATOM 0 HG2 GLU A 252 3.927 -7.989 -3.034 1.00 0.00 H new ATOM 0 HG3 GLU A 252 5.398 -8.809 -2.551 1.00 0.00 H new ATOM 346 N THR A 253 2.148 -10.406 -5.420 1.00 0.00 N ATOM 347 CA THR A 253 1.923 -10.108 -6.829 1.00 0.00 C ATOM 348 C THR A 253 0.548 -9.486 -7.047 1.00 0.00 C ATOM 349 O THR A 253 0.425 -8.436 -7.677 1.00 0.00 O ATOM 350 CB THR A 253 2.044 -11.375 -7.697 1.00 0.00 C ATOM 351 OG1 THR A 253 3.368 -11.911 -7.599 1.00 0.00 O ATOM 352 CG2 THR A 253 1.721 -11.068 -9.151 1.00 0.00 C ATOM 0 H THR A 253 2.475 -11.355 -5.236 1.00 0.00 H new ATOM 0 HA THR A 253 2.692 -9.396 -7.128 1.00 0.00 H new ATOM 0 HB THR A 253 1.327 -12.110 -7.330 1.00 0.00 H new ATOM 0 HG1 THR A 253 3.436 -12.717 -8.152 1.00 0.00 H new ATOM 0 HG21 THR A 253 1.813 -11.978 -9.744 1.00 0.00 H new ATOM 0 HG22 THR A 253 0.702 -10.688 -9.225 1.00 0.00 H new ATOM 0 HG23 THR A 253 2.416 -10.317 -9.527 1.00 0.00 H new ATOM 360 N ASP A 254 -0.482 -10.140 -6.521 1.00 0.00 N ATOM 361 CA ASP A 254 -1.848 -9.650 -6.657 1.00 0.00 C ATOM 362 C ASP A 254 -1.906 -8.138 -6.457 1.00 0.00 C ATOM 363 O ASP A 254 -2.601 -7.431 -7.187 1.00 0.00 O ATOM 364 CB ASP A 254 -2.765 -10.345 -5.649 1.00 0.00 C ATOM 365 CG ASP A 254 -3.371 -11.620 -6.202 1.00 0.00 C ATOM 366 OD1 ASP A 254 -3.702 -11.646 -7.405 1.00 0.00 O ATOM 367 OD2 ASP A 254 -3.515 -12.592 -5.430 1.00 0.00 O ATOM 0 H ASP A 254 -0.396 -11.011 -5.997 1.00 0.00 H new ATOM 0 HA ASP A 254 -2.190 -9.879 -7.666 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -2.199 -10.577 -4.747 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -3.564 -9.663 -5.358 1.00 0.00 H new ATOM 372 N LEU A 255 -1.171 -7.650 -5.463 1.00 0.00 N ATOM 373 CA LEU A 255 -1.139 -6.222 -5.166 1.00 0.00 C ATOM 374 C LEU A 255 -0.198 -5.489 -6.116 1.00 0.00 C ATOM 375 O LEU A 255 -0.570 -4.482 -6.719 1.00 0.00 O ATOM 376 CB LEU A 255 -0.701 -5.993 -3.718 1.00 0.00 C ATOM 377 CG LEU A 255 -1.392 -6.857 -2.663 1.00 0.00 C ATOM 378 CD1 LEU A 255 -0.607 -6.837 -1.360 1.00 0.00 C ATOM 379 CD2 LEU A 255 -2.819 -6.380 -2.435 1.00 0.00 C ATOM 0 H LEU A 255 -0.590 -8.222 -4.850 1.00 0.00 H new ATOM 0 HA LEU A 255 -2.145 -5.824 -5.303 1.00 0.00 H new ATOM 0 HB2 LEU A 255 0.373 -6.165 -3.653 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -0.871 -4.946 -3.469 1.00 0.00 H new ATOM 0 HG LEU A 255 -1.427 -7.884 -3.027 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -1.114 -7.457 -0.621 1.00 0.00 H new ATOM 0 HD12 LEU A 255 0.396 -7.226 -1.534 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -0.541 -5.814 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -3.296 -7.006 -1.681 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -2.806 -5.345 -2.092 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -3.378 -6.446 -3.368 1.00 0.00 H new ATOM 391 N ARG A 256 1.021 -6.003 -6.247 1.00 0.00 N ATOM 392 CA ARG A 256 2.014 -5.397 -7.125 1.00 0.00 C ATOM 393 C ARG A 256 1.398 -5.031 -8.473 1.00 0.00 C ATOM 394 O ARG A 256 1.676 -3.967 -9.024 1.00 0.00 O ATOM 395 CB ARG A 256 3.191 -6.352 -7.334 1.00 0.00 C ATOM 396 CG ARG A 256 4.383 -5.709 -8.023 1.00 0.00 C ATOM 397 CD ARG A 256 5.440 -6.740 -8.387 1.00 0.00 C ATOM 398 NE ARG A 256 6.584 -6.136 -9.064 1.00 0.00 N ATOM 399 CZ ARG A 256 7.596 -5.559 -8.425 1.00 0.00 C ATOM 400 NH1 ARG A 256 7.605 -5.508 -7.100 1.00 0.00 N ATOM 401 NH2 ARG A 256 8.601 -5.031 -9.112 1.00 0.00 N ATOM 0 H ARG A 256 1.344 -6.837 -5.756 1.00 0.00 H new ATOM 0 HA ARG A 256 2.374 -4.485 -6.649 1.00 0.00 H new ATOM 0 HB2 ARG A 256 3.508 -6.741 -6.367 1.00 0.00 H new ATOM 0 HB3 ARG A 256 2.856 -7.204 -7.926 1.00 0.00 H new ATOM 0 HG2 ARG A 256 4.050 -5.195 -8.924 1.00 0.00 H new ATOM 0 HG3 ARG A 256 4.819 -4.955 -7.368 1.00 0.00 H new ATOM 0 HD2 ARG A 256 5.779 -7.246 -7.483 1.00 0.00 H new ATOM 0 HD3 ARG A 256 4.998 -7.500 -9.031 1.00 0.00 H new ATOM 0 HE ARG A 256 6.608 -6.158 -10.083 1.00 0.00 H new ATOM 0 HH11 ARG A 256 6.834 -5.912 -6.569 1.00 0.00 H new ATOM 0 HH12 ARG A 256 8.383 -5.064 -6.612 1.00 0.00 H new ATOM 0 HH21 ARG A 256 8.597 -5.068 -10.131 1.00 0.00 H new ATOM 0 HH22 ARG A 256 9.378 -4.588 -8.621 1.00 0.00 H new ATOM 415 N ASN A 257 0.562 -5.921 -8.996 1.00 0.00 N ATOM 416 CA ASN A 257 -0.093 -5.692 -10.279 1.00 0.00 C ATOM 417 C ASN A 257 -1.249 -4.708 -10.132 1.00 0.00 C ATOM 418 O ASN A 257 -1.419 -3.805 -10.952 1.00 0.00 O ATOM 419 CB ASN A 257 -0.603 -7.013 -10.858 1.00 0.00 C ATOM 420 CG ASN A 257 0.458 -7.741 -11.660 1.00 0.00 C ATOM 421 OD1 ASN A 257 0.846 -8.922 -11.193 1.00 0.00 O flip ATOM 422 ND2 ASN A 257 0.922 -7.248 -12.688 1.00 0.00 N flip ATOM 0 H ASN A 257 0.322 -6.807 -8.552 1.00 0.00 H new ATOM 0 HA ASN A 257 0.641 -5.263 -10.962 1.00 0.00 H new ATOM 0 HB2 ASN A 257 -0.945 -7.655 -10.046 1.00 0.00 H new ATOM 0 HB3 ASN A 257 -1.466 -6.818 -11.495 1.00 0.00 H new ATOM 0 HD21 ASN A 257 0.594 -6.337 -13.010 1.00 0.00 H new ATOM 0 HD22 ASN A 257 1.634 -7.750 -13.218 1.00 0.00 H new ATOM 429 N HIS A 258 -2.042 -4.888 -9.081 1.00 0.00 N ATOM 430 CA HIS A 258 -3.183 -4.015 -8.824 1.00 0.00 C ATOM 431 C HIS A 258 -2.734 -2.565 -8.674 1.00 0.00 C ATOM 432 O HIS A 258 -3.458 -1.639 -9.040 1.00 0.00 O ATOM 433 CB HIS A 258 -3.923 -4.465 -7.565 1.00 0.00 C ATOM 434 CG HIS A 258 -5.327 -3.951 -7.480 1.00 0.00 C ATOM 435 ND1 HIS A 258 -6.512 -4.573 -7.682 1.00 0.00 N flip ATOM 436 CD2 HIS A 258 -5.632 -2.646 -7.154 1.00 0.00 C flip ATOM 437 CE1 HIS A 258 -7.501 -3.643 -7.475 1.00 0.00 C flip ATOM 438 NE2 HIS A 258 -6.944 -2.488 -7.157 1.00 0.00 N flip ATOM 0 H HIS A 258 -1.916 -5.630 -8.393 1.00 0.00 H new ATOM 0 HA HIS A 258 -3.859 -4.081 -9.676 1.00 0.00 H new ATOM 0 HB2 HIS A 258 -3.941 -5.554 -7.534 1.00 0.00 H new ATOM 0 HB3 HIS A 258 -3.369 -4.130 -6.688 1.00 0.00 H new ATOM 0 HD2 HIS A 258 -4.911 -1.874 -6.931 1.00 0.00 H new ATOM 0 HE1 HIS A 258 -8.562 -3.826 -7.559 1.00 0.00 H new ATOM 0 HE2 HIS A 258 -7.442 -1.622 -6.949 1.00 0.00 H new ATOM 446 N PHE A 259 -1.535 -2.375 -8.133 1.00 0.00 N ATOM 447 CA PHE A 259 -0.990 -1.037 -7.933 1.00 0.00 C ATOM 448 C PHE A 259 -0.114 -0.625 -9.111 1.00 0.00 C ATOM 449 O PHE A 259 -0.131 0.530 -9.538 1.00 0.00 O ATOM 450 CB PHE A 259 -0.179 -0.983 -6.636 1.00 0.00 C ATOM 451 CG PHE A 259 -1.027 -1.024 -5.397 1.00 0.00 C ATOM 452 CD1 PHE A 259 -1.800 0.067 -5.034 1.00 0.00 C ATOM 453 CD2 PHE A 259 -1.051 -2.154 -4.595 1.00 0.00 C ATOM 454 CE1 PHE A 259 -2.581 0.031 -3.893 1.00 0.00 C ATOM 455 CE2 PHE A 259 -1.830 -2.196 -3.454 1.00 0.00 C ATOM 456 CZ PHE A 259 -2.596 -1.102 -3.103 1.00 0.00 C ATOM 0 H PHE A 259 -0.922 -3.130 -7.825 1.00 0.00 H new ATOM 0 HA PHE A 259 -1.824 -0.339 -7.862 1.00 0.00 H new ATOM 0 HB2 PHE A 259 0.518 -1.821 -6.618 1.00 0.00 H new ATOM 0 HB3 PHE A 259 0.418 -0.071 -6.628 1.00 0.00 H new ATOM 0 HD1 PHE A 259 -1.793 0.955 -5.649 1.00 0.00 H new ATOM 0 HD2 PHE A 259 -0.454 -3.012 -4.865 1.00 0.00 H new ATOM 0 HE1 PHE A 259 -3.179 0.888 -3.620 1.00 0.00 H new ATOM 0 HE2 PHE A 259 -1.840 -3.083 -2.838 1.00 0.00 H new ATOM 0 HZ PHE A 259 -3.206 -1.132 -2.212 1.00 0.00 H new ATOM 466 N TYR A 260 0.652 -1.576 -9.633 1.00 0.00 N ATOM 467 CA TYR A 260 1.538 -1.313 -10.760 1.00 0.00 C ATOM 468 C TYR A 260 0.814 -0.528 -11.850 1.00 0.00 C ATOM 469 O TYR A 260 1.380 0.385 -12.452 1.00 0.00 O ATOM 470 CB TYR A 260 2.075 -2.626 -11.333 1.00 0.00 C ATOM 471 CG TYR A 260 2.319 -2.581 -12.824 1.00 0.00 C ATOM 472 CD1 TYR A 260 3.389 -1.868 -13.351 1.00 0.00 C ATOM 473 CD2 TYR A 260 1.481 -3.251 -13.706 1.00 0.00 C ATOM 474 CE1 TYR A 260 3.617 -1.824 -14.713 1.00 0.00 C ATOM 475 CE2 TYR A 260 1.701 -3.213 -15.069 1.00 0.00 C ATOM 476 CZ TYR A 260 2.770 -2.498 -15.568 1.00 0.00 C ATOM 477 OH TYR A 260 2.992 -2.457 -16.925 1.00 0.00 O ATOM 0 H TYR A 260 0.677 -2.537 -9.293 1.00 0.00 H new ATOM 0 HA TYR A 260 2.374 -0.714 -10.399 1.00 0.00 H new ATOM 0 HB2 TYR A 260 3.007 -2.878 -10.828 1.00 0.00 H new ATOM 0 HB3 TYR A 260 1.367 -3.425 -11.113 1.00 0.00 H new ATOM 0 HD1 TYR A 260 4.054 -1.339 -12.684 1.00 0.00 H new ATOM 0 HD2 TYR A 260 0.643 -3.811 -13.319 1.00 0.00 H new ATOM 0 HE1 TYR A 260 4.453 -1.265 -15.106 1.00 0.00 H new ATOM 0 HE2 TYR A 260 1.040 -3.740 -15.741 1.00 0.00 H new ATOM 0 HH TYR A 260 2.306 -2.984 -17.385 1.00 0.00 H new ATOM 487 N GLN A 261 -0.440 -0.891 -12.097 1.00 0.00 N ATOM 488 CA GLN A 261 -1.242 -0.221 -13.114 1.00 0.00 C ATOM 489 C GLN A 261 -1.163 1.294 -12.960 1.00 0.00 C ATOM 490 O GLN A 261 -1.108 2.027 -13.948 1.00 0.00 O ATOM 491 CB GLN A 261 -2.700 -0.678 -13.027 1.00 0.00 C ATOM 492 CG GLN A 261 -3.480 -0.013 -11.905 1.00 0.00 C ATOM 493 CD GLN A 261 -4.965 -0.312 -11.970 1.00 0.00 C ATOM 494 OE1 GLN A 261 -5.663 0.148 -12.874 1.00 0.00 O ATOM 495 NE2 GLN A 261 -5.456 -1.086 -11.010 1.00 0.00 N ATOM 0 H GLN A 261 -0.923 -1.645 -11.607 1.00 0.00 H new ATOM 0 HA GLN A 261 -0.841 -0.490 -14.091 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -3.195 -0.469 -13.976 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -2.726 -1.758 -12.885 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -3.087 -0.349 -10.946 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -3.328 1.065 -11.951 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -4.841 -1.445 -10.280 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -6.448 -1.321 -11.002 1.00 0.00 H new ATOM 504 N PHE A 262 -1.156 1.758 -11.715 1.00 0.00 N ATOM 505 CA PHE A 262 -1.085 3.186 -11.431 1.00 0.00 C ATOM 506 C PHE A 262 0.255 3.763 -11.879 1.00 0.00 C ATOM 507 O PHE A 262 0.314 4.843 -12.465 1.00 0.00 O ATOM 508 CB PHE A 262 -1.289 3.442 -9.936 1.00 0.00 C ATOM 509 CG PHE A 262 -2.676 3.122 -9.457 1.00 0.00 C ATOM 510 CD1 PHE A 262 -3.021 1.826 -9.111 1.00 0.00 C ATOM 511 CD2 PHE A 262 -3.634 4.117 -9.353 1.00 0.00 C ATOM 512 CE1 PHE A 262 -4.297 1.528 -8.671 1.00 0.00 C ATOM 513 CE2 PHE A 262 -4.912 3.826 -8.913 1.00 0.00 C ATOM 514 CZ PHE A 262 -5.243 2.530 -8.570 1.00 0.00 C ATOM 0 H PHE A 262 -1.199 1.165 -10.886 1.00 0.00 H new ATOM 0 HA PHE A 262 -1.880 3.682 -11.989 1.00 0.00 H new ATOM 0 HB2 PHE A 262 -0.572 2.845 -9.372 1.00 0.00 H new ATOM 0 HB3 PHE A 262 -1.072 4.488 -9.722 1.00 0.00 H new ATOM 0 HD1 PHE A 262 -2.285 1.039 -9.186 1.00 0.00 H new ATOM 0 HD2 PHE A 262 -3.380 5.132 -9.619 1.00 0.00 H new ATOM 0 HE1 PHE A 262 -4.554 0.513 -8.406 1.00 0.00 H new ATOM 0 HE2 PHE A 262 -5.650 4.611 -8.838 1.00 0.00 H new ATOM 0 HZ PHE A 262 -6.240 2.300 -8.223 1.00 0.00 H new ATOM 524 N GLY A 263 1.331 3.034 -11.597 1.00 0.00 N ATOM 525 CA GLY A 263 2.656 3.488 -11.977 1.00 0.00 C ATOM 526 C GLY A 263 3.746 2.533 -11.533 1.00 0.00 C ATOM 527 O GLY A 263 3.504 1.337 -11.373 1.00 0.00 O ATOM 0 H GLY A 263 1.308 2.137 -11.112 1.00 0.00 H new ATOM 0 HA2 GLY A 263 2.700 3.606 -13.060 1.00 0.00 H new ATOM 0 HA3 GLY A 263 2.839 4.470 -11.542 1.00 0.00 H new ATOM 531 N GLU A 264 4.949 3.062 -11.336 1.00 0.00 N ATOM 532 CA GLU A 264 6.081 2.246 -10.911 1.00 0.00 C ATOM 533 C GLU A 264 6.042 2.004 -9.404 1.00 0.00 C ATOM 534 O GLU A 264 5.690 2.896 -8.631 1.00 0.00 O ATOM 535 CB GLU A 264 7.398 2.921 -11.296 1.00 0.00 C ATOM 536 CG GLU A 264 8.615 2.028 -11.119 1.00 0.00 C ATOM 537 CD GLU A 264 8.935 1.224 -12.364 1.00 0.00 C ATOM 538 OE1 GLU A 264 8.225 0.230 -12.626 1.00 0.00 O ATOM 539 OE2 GLU A 264 9.894 1.587 -13.075 1.00 0.00 O ATOM 0 H GLU A 264 5.165 4.051 -11.464 1.00 0.00 H new ATOM 0 HA GLU A 264 6.013 1.284 -11.418 1.00 0.00 H new ATOM 0 HB2 GLU A 264 7.342 3.242 -12.336 1.00 0.00 H new ATOM 0 HB3 GLU A 264 7.526 3.819 -10.692 1.00 0.00 H new ATOM 0 HG2 GLU A 264 9.476 2.642 -10.856 1.00 0.00 H new ATOM 0 HG3 GLU A 264 8.443 1.347 -10.286 1.00 0.00 H new ATOM 546 N ILE A 265 6.404 0.793 -8.996 1.00 0.00 N ATOM 547 CA ILE A 265 6.411 0.434 -7.583 1.00 0.00 C ATOM 548 C ILE A 265 7.836 0.256 -7.068 1.00 0.00 C ATOM 549 O ILE A 265 8.529 -0.689 -7.445 1.00 0.00 O ATOM 550 CB ILE A 265 5.619 -0.861 -7.327 1.00 0.00 C ATOM 551 CG1 ILE A 265 4.159 -0.684 -7.750 1.00 0.00 C ATOM 552 CG2 ILE A 265 5.708 -1.256 -5.861 1.00 0.00 C ATOM 553 CD1 ILE A 265 3.424 -1.991 -7.946 1.00 0.00 C ATOM 0 H ILE A 265 6.696 0.044 -9.623 1.00 0.00 H new ATOM 0 HA ILE A 265 5.933 1.254 -7.047 1.00 0.00 H new ATOM 0 HB ILE A 265 6.056 -1.661 -7.925 1.00 0.00 H new ATOM 0 HG12 ILE A 265 3.639 -0.094 -6.995 1.00 0.00 H new ATOM 0 HG13 ILE A 265 4.125 -0.114 -8.679 1.00 0.00 H new ATOM 0 HG21 ILE A 265 5.143 -2.173 -5.696 1.00 0.00 H new ATOM 0 HG22 ILE A 265 6.751 -1.419 -5.591 1.00 0.00 H new ATOM 0 HG23 ILE A 265 5.294 -0.459 -5.244 1.00 0.00 H new ATOM 0 HD11 ILE A 265 2.395 -1.789 -8.245 1.00 0.00 H new ATOM 0 HD12 ILE A 265 3.919 -2.574 -8.722 1.00 0.00 H new ATOM 0 HD13 ILE A 265 3.427 -2.553 -7.012 1.00 0.00 H new ATOM 565 N ARG A 266 8.265 1.169 -6.204 1.00 0.00 N ATOM 566 CA ARG A 266 9.607 1.112 -5.636 1.00 0.00 C ATOM 567 C ARG A 266 9.868 -0.246 -4.992 1.00 0.00 C ATOM 568 O ARG A 266 10.890 -0.883 -5.250 1.00 0.00 O ATOM 569 CB ARG A 266 9.794 2.223 -4.602 1.00 0.00 C ATOM 570 CG ARG A 266 10.367 3.506 -5.182 1.00 0.00 C ATOM 571 CD ARG A 266 10.948 4.398 -4.096 1.00 0.00 C ATOM 572 NE ARG A 266 11.810 5.440 -4.647 1.00 0.00 N ATOM 573 CZ ARG A 266 13.083 5.244 -4.972 1.00 0.00 C ATOM 574 NH1 ARG A 266 13.639 4.052 -4.803 1.00 0.00 N ATOM 575 NH2 ARG A 266 13.803 6.242 -5.468 1.00 0.00 N ATOM 0 H ARG A 266 7.703 1.957 -5.882 1.00 0.00 H new ATOM 0 HA ARG A 266 10.323 1.254 -6.446 1.00 0.00 H new ATOM 0 HB2 ARG A 266 8.832 2.442 -4.139 1.00 0.00 H new ATOM 0 HB3 ARG A 266 10.454 1.865 -3.812 1.00 0.00 H new ATOM 0 HG2 ARG A 266 11.142 3.263 -5.909 1.00 0.00 H new ATOM 0 HG3 ARG A 266 9.586 4.045 -5.718 1.00 0.00 H new ATOM 0 HD2 ARG A 266 10.137 4.859 -3.533 1.00 0.00 H new ATOM 0 HD3 ARG A 266 11.518 3.790 -3.394 1.00 0.00 H new ATOM 0 HE ARG A 266 11.413 6.369 -4.790 1.00 0.00 H new ATOM 0 HH11 ARG A 266 13.089 3.282 -4.422 1.00 0.00 H new ATOM 0 HH12 ARG A 266 14.617 3.905 -5.054 1.00 0.00 H new ATOM 0 HH21 ARG A 266 13.379 7.160 -5.600 1.00 0.00 H new ATOM 0 HH22 ARG A 266 14.780 6.091 -5.717 1.00 0.00 H new ATOM 589 N THR A 267 8.936 -0.685 -4.151 1.00 0.00 N ATOM 590 CA THR A 267 9.065 -1.967 -3.468 1.00 0.00 C ATOM 591 C THR A 267 7.751 -2.376 -2.815 1.00 0.00 C ATOM 592 O THR A 267 6.817 -1.579 -2.725 1.00 0.00 O ATOM 593 CB THR A 267 10.168 -1.922 -2.393 1.00 0.00 C ATOM 594 OG1 THR A 267 10.434 -3.242 -1.908 1.00 0.00 O ATOM 595 CG2 THR A 267 9.758 -1.024 -1.235 1.00 0.00 C ATOM 0 H THR A 267 8.084 -0.172 -3.927 1.00 0.00 H new ATOM 0 HA THR A 267 9.336 -2.703 -4.225 1.00 0.00 H new ATOM 0 HB THR A 267 11.071 -1.514 -2.847 1.00 0.00 H new ATOM 0 HG1 THR A 267 11.137 -3.205 -1.227 1.00 0.00 H new ATOM 0 HG21 THR A 267 10.552 -1.008 -0.488 1.00 0.00 H new ATOM 0 HG22 THR A 267 9.585 -0.013 -1.603 1.00 0.00 H new ATOM 0 HG23 THR A 267 8.843 -1.408 -0.783 1.00 0.00 H new ATOM 603 N ILE A 268 7.685 -3.623 -2.360 1.00 0.00 N ATOM 604 CA ILE A 268 6.484 -4.137 -1.713 1.00 0.00 C ATOM 605 C ILE A 268 6.837 -5.112 -0.594 1.00 0.00 C ATOM 606 O ILE A 268 7.328 -6.213 -0.846 1.00 0.00 O ATOM 607 CB ILE A 268 5.560 -4.844 -2.721 1.00 0.00 C ATOM 608 CG1 ILE A 268 5.107 -3.863 -3.805 1.00 0.00 C ATOM 609 CG2 ILE A 268 4.358 -5.445 -2.008 1.00 0.00 C ATOM 610 CD1 ILE A 268 4.254 -4.501 -4.879 1.00 0.00 C ATOM 0 H ILE A 268 8.449 -4.296 -2.427 1.00 0.00 H new ATOM 0 HA ILE A 268 5.960 -3.278 -1.293 1.00 0.00 H new ATOM 0 HB ILE A 268 6.116 -5.652 -3.197 1.00 0.00 H new ATOM 0 HG12 ILE A 268 4.545 -3.053 -3.339 1.00 0.00 H new ATOM 0 HG13 ILE A 268 5.986 -3.415 -4.269 1.00 0.00 H new ATOM 0 HG21 ILE A 268 3.715 -5.941 -2.735 1.00 0.00 H new ATOM 0 HG22 ILE A 268 4.698 -6.171 -1.269 1.00 0.00 H new ATOM 0 HG23 ILE A 268 3.798 -4.654 -1.508 1.00 0.00 H new ATOM 0 HD11 ILE A 268 3.970 -3.747 -5.613 1.00 0.00 H new ATOM 0 HD12 ILE A 268 4.820 -5.292 -5.371 1.00 0.00 H new ATOM 0 HD13 ILE A 268 3.357 -4.924 -4.427 1.00 0.00 H new ATOM 622 N THR A 269 6.582 -4.701 0.644 1.00 0.00 N ATOM 623 CA THR A 269 6.871 -5.537 1.802 1.00 0.00 C ATOM 624 C THR A 269 5.593 -6.127 2.388 1.00 0.00 C ATOM 625 O THR A 269 4.879 -5.463 3.140 1.00 0.00 O ATOM 626 CB THR A 269 7.607 -4.744 2.898 1.00 0.00 C ATOM 627 OG1 THR A 269 8.741 -4.072 2.339 1.00 0.00 O ATOM 628 CG2 THR A 269 8.059 -5.665 4.021 1.00 0.00 C ATOM 0 H THR A 269 6.176 -3.793 0.870 1.00 0.00 H new ATOM 0 HA THR A 269 7.515 -6.345 1.455 1.00 0.00 H new ATOM 0 HB THR A 269 6.916 -4.008 3.309 1.00 0.00 H new ATOM 0 HG1 THR A 269 9.202 -3.569 3.042 1.00 0.00 H new ATOM 0 HG21 THR A 269 8.576 -5.082 4.783 1.00 0.00 H new ATOM 0 HG22 THR A 269 7.190 -6.152 4.464 1.00 0.00 H new ATOM 0 HG23 THR A 269 8.735 -6.421 3.622 1.00 0.00 H new ATOM 636 N VAL A 270 5.310 -7.378 2.040 1.00 0.00 N ATOM 637 CA VAL A 270 4.118 -8.058 2.533 1.00 0.00 C ATOM 638 C VAL A 270 4.415 -8.826 3.816 1.00 0.00 C ATOM 639 O VAL A 270 5.079 -9.863 3.792 1.00 0.00 O ATOM 640 CB VAL A 270 3.553 -9.033 1.483 1.00 0.00 C ATOM 641 CG1 VAL A 270 2.325 -9.748 2.025 1.00 0.00 C ATOM 642 CG2 VAL A 270 3.225 -8.295 0.194 1.00 0.00 C ATOM 0 H VAL A 270 5.890 -7.941 1.418 1.00 0.00 H new ATOM 0 HA VAL A 270 3.376 -7.287 2.738 1.00 0.00 H new ATOM 0 HB VAL A 270 4.313 -9.783 1.262 1.00 0.00 H new ATOM 0 HG11 VAL A 270 1.940 -10.433 1.269 1.00 0.00 H new ATOM 0 HG12 VAL A 270 2.596 -10.309 2.919 1.00 0.00 H new ATOM 0 HG13 VAL A 270 1.558 -9.015 2.275 1.00 0.00 H new ATOM 0 HG21 VAL A 270 2.827 -8.999 -0.537 1.00 0.00 H new ATOM 0 HG22 VAL A 270 2.483 -7.523 0.396 1.00 0.00 H new ATOM 0 HG23 VAL A 270 4.130 -7.834 -0.202 1.00 0.00 H new ATOM 652 N VAL A 271 3.919 -8.311 4.936 1.00 0.00 N ATOM 653 CA VAL A 271 4.129 -8.949 6.230 1.00 0.00 C ATOM 654 C VAL A 271 2.982 -9.894 6.569 1.00 0.00 C ATOM 655 O VAL A 271 1.922 -9.462 7.019 1.00 0.00 O ATOM 656 CB VAL A 271 4.270 -7.906 7.354 1.00 0.00 C ATOM 657 CG1 VAL A 271 4.409 -8.591 8.705 1.00 0.00 C ATOM 658 CG2 VAL A 271 5.456 -6.991 7.086 1.00 0.00 C ATOM 0 H VAL A 271 3.369 -7.453 4.973 1.00 0.00 H new ATOM 0 HA VAL A 271 5.055 -9.519 6.155 1.00 0.00 H new ATOM 0 HB VAL A 271 3.367 -7.296 7.375 1.00 0.00 H new ATOM 0 HG11 VAL A 271 4.508 -7.838 9.487 1.00 0.00 H new ATOM 0 HG12 VAL A 271 3.525 -9.200 8.897 1.00 0.00 H new ATOM 0 HG13 VAL A 271 5.294 -9.227 8.701 1.00 0.00 H new ATOM 0 HG21 VAL A 271 5.541 -6.260 7.890 1.00 0.00 H new ATOM 0 HG22 VAL A 271 6.369 -7.584 7.037 1.00 0.00 H new ATOM 0 HG23 VAL A 271 5.309 -6.473 6.139 1.00 0.00 H new ATOM 668 N GLN A 272 3.203 -11.187 6.351 1.00 0.00 N ATOM 669 CA GLN A 272 2.187 -12.193 6.634 1.00 0.00 C ATOM 670 C GLN A 272 1.796 -12.173 8.108 1.00 0.00 C ATOM 671 O GLN A 272 0.648 -12.445 8.460 1.00 0.00 O ATOM 672 CB GLN A 272 2.695 -13.584 6.248 1.00 0.00 C ATOM 673 CG GLN A 272 3.961 -13.994 6.982 1.00 0.00 C ATOM 674 CD GLN A 272 4.079 -15.497 7.146 1.00 0.00 C ATOM 675 OE1 GLN A 272 4.303 -16.223 6.178 1.00 0.00 O ATOM 676 NE2 GLN A 272 3.930 -15.971 8.378 1.00 0.00 N ATOM 0 H GLN A 272 4.076 -11.562 5.980 1.00 0.00 H new ATOM 0 HA GLN A 272 1.304 -11.958 6.040 1.00 0.00 H new ATOM 0 HB2 GLN A 272 1.914 -14.316 6.451 1.00 0.00 H new ATOM 0 HB3 GLN A 272 2.883 -13.608 5.175 1.00 0.00 H new ATOM 0 HG2 GLN A 272 4.829 -13.622 6.437 1.00 0.00 H new ATOM 0 HG3 GLN A 272 3.976 -13.523 7.965 1.00 0.00 H new ATOM 0 HE21 GLN A 272 3.745 -15.332 9.151 1.00 0.00 H new ATOM 0 HE22 GLN A 272 4.000 -16.974 8.551 1.00 0.00 H new ATOM 685 N ARG A 273 2.758 -11.850 8.966 1.00 0.00 N ATOM 686 CA ARG A 273 2.515 -11.796 10.402 1.00 0.00 C ATOM 687 C ARG A 273 1.426 -10.779 10.731 1.00 0.00 C ATOM 688 O ARG A 273 0.598 -11.006 11.612 1.00 0.00 O ATOM 689 CB ARG A 273 3.803 -11.438 11.146 1.00 0.00 C ATOM 690 CG ARG A 273 3.649 -11.425 12.658 1.00 0.00 C ATOM 691 CD ARG A 273 3.790 -12.820 13.245 1.00 0.00 C ATOM 692 NE ARG A 273 5.187 -13.188 13.454 1.00 0.00 N ATOM 693 CZ ARG A 273 5.898 -12.806 14.509 1.00 0.00 C ATOM 694 NH1 ARG A 273 5.345 -12.048 15.446 1.00 0.00 N ATOM 695 NH2 ARG A 273 7.165 -13.181 14.628 1.00 0.00 N ATOM 0 H ARG A 273 3.713 -11.622 8.691 1.00 0.00 H new ATOM 0 HA ARG A 273 2.179 -12.781 10.725 1.00 0.00 H new ATOM 0 HB2 ARG A 273 4.580 -12.153 10.874 1.00 0.00 H new ATOM 0 HB3 ARG A 273 4.143 -10.457 10.815 1.00 0.00 H new ATOM 0 HG2 ARG A 273 4.400 -10.768 13.096 1.00 0.00 H new ATOM 0 HG3 ARG A 273 2.674 -11.015 12.922 1.00 0.00 H new ATOM 0 HD2 ARG A 273 3.256 -12.869 14.194 1.00 0.00 H new ATOM 0 HD3 ARG A 273 3.321 -13.543 12.578 1.00 0.00 H new ATOM 0 HE ARG A 273 5.642 -13.771 12.751 1.00 0.00 H new ATOM 0 HH11 ARG A 273 4.371 -11.757 15.358 1.00 0.00 H new ATOM 0 HH12 ARG A 273 5.893 -11.756 16.255 1.00 0.00 H new ATOM 0 HH21 ARG A 273 7.594 -13.763 13.909 1.00 0.00 H new ATOM 0 HH22 ARG A 273 7.710 -12.887 15.439 1.00 0.00 H new ATOM 709 N GLN A 274 1.435 -9.658 10.017 1.00 0.00 N ATOM 710 CA GLN A 274 0.449 -8.606 10.235 1.00 0.00 C ATOM 711 C GLN A 274 -0.509 -8.505 9.052 1.00 0.00 C ATOM 712 O GLN A 274 -1.169 -7.484 8.863 1.00 0.00 O ATOM 713 CB GLN A 274 1.146 -7.263 10.458 1.00 0.00 C ATOM 714 CG GLN A 274 1.846 -7.157 11.803 1.00 0.00 C ATOM 715 CD GLN A 274 1.887 -5.735 12.329 1.00 0.00 C ATOM 716 OE1 GLN A 274 1.234 -5.409 13.321 1.00 0.00 O ATOM 717 NE2 GLN A 274 2.658 -4.881 11.667 1.00 0.00 N ATOM 0 H GLN A 274 2.114 -9.455 9.283 1.00 0.00 H new ATOM 0 HA GLN A 274 -0.127 -8.861 11.125 1.00 0.00 H new ATOM 0 HB2 GLN A 274 1.876 -7.106 9.664 1.00 0.00 H new ATOM 0 HB3 GLN A 274 0.410 -6.463 10.377 1.00 0.00 H new ATOM 0 HG2 GLN A 274 1.335 -7.793 12.526 1.00 0.00 H new ATOM 0 HG3 GLN A 274 2.864 -7.535 11.709 1.00 0.00 H new ATOM 0 HE21 GLN A 274 3.182 -5.195 10.850 1.00 0.00 H new ATOM 0 HE22 GLN A 274 2.727 -3.911 11.975 1.00 0.00 H new ATOM 726 N GLN A 275 -0.579 -9.570 8.261 1.00 0.00 N ATOM 727 CA GLN A 275 -1.455 -9.600 7.096 1.00 0.00 C ATOM 728 C GLN A 275 -1.553 -8.221 6.453 1.00 0.00 C ATOM 729 O GLN A 275 -2.649 -7.701 6.240 1.00 0.00 O ATOM 730 CB GLN A 275 -2.849 -10.091 7.493 1.00 0.00 C ATOM 731 CG GLN A 275 -2.862 -11.511 8.037 1.00 0.00 C ATOM 732 CD GLN A 275 -4.072 -11.792 8.905 1.00 0.00 C ATOM 733 OE1 GLN A 275 -4.520 -10.932 9.663 1.00 0.00 O ATOM 734 NE2 GLN A 275 -4.610 -13.002 8.798 1.00 0.00 N ATOM 0 H GLN A 275 -0.040 -10.424 8.405 1.00 0.00 H new ATOM 0 HA GLN A 275 -1.027 -10.290 6.369 1.00 0.00 H new ATOM 0 HB2 GLN A 275 -3.261 -9.419 8.245 1.00 0.00 H new ATOM 0 HB3 GLN A 275 -3.505 -10.038 6.624 1.00 0.00 H new ATOM 0 HG2 GLN A 275 -2.845 -12.215 7.205 1.00 0.00 H new ATOM 0 HG3 GLN A 275 -1.955 -11.682 8.618 1.00 0.00 H new ATOM 0 HE21 GLN A 275 -4.206 -13.685 8.157 1.00 0.00 H new ATOM 0 HE22 GLN A 275 -5.427 -13.248 9.357 1.00 0.00 H new ATOM 743 N CYS A 276 -0.402 -7.634 6.146 1.00 0.00 N ATOM 744 CA CYS A 276 -0.358 -6.313 5.528 1.00 0.00 C ATOM 745 C CYS A 276 0.782 -6.223 4.519 1.00 0.00 C ATOM 746 O CYS A 276 1.672 -7.073 4.495 1.00 0.00 O ATOM 747 CB CYS A 276 -0.195 -5.232 6.597 1.00 0.00 C ATOM 748 SG CYS A 276 1.381 -5.299 7.481 1.00 0.00 S ATOM 0 H CYS A 276 0.513 -8.051 6.315 1.00 0.00 H new ATOM 0 HA CYS A 276 -1.299 -6.154 5.001 1.00 0.00 H new ATOM 0 HB2 CYS A 276 -0.294 -4.254 6.127 1.00 0.00 H new ATOM 0 HB3 CYS A 276 -1.008 -5.323 7.318 1.00 0.00 H new ATOM 0 HG CYS A 276 1.425 -4.344 8.362 1.00 0.00 H new ATOM 754 N ALA A 277 0.747 -5.188 3.686 1.00 0.00 N ATOM 755 CA ALA A 277 1.777 -4.987 2.674 1.00 0.00 C ATOM 756 C ALA A 277 2.040 -3.502 2.446 1.00 0.00 C ATOM 757 O ALA A 277 1.106 -2.710 2.310 1.00 0.00 O ATOM 758 CB ALA A 277 1.376 -5.661 1.371 1.00 0.00 C ATOM 0 H ALA A 277 0.017 -4.476 3.692 1.00 0.00 H new ATOM 0 HA ALA A 277 2.700 -5.441 3.035 1.00 0.00 H new ATOM 0 HB1 ALA A 277 2.155 -5.502 0.625 1.00 0.00 H new ATOM 0 HB2 ALA A 277 1.247 -6.730 1.539 1.00 0.00 H new ATOM 0 HB3 ALA A 277 0.439 -5.234 1.014 1.00 0.00 H new ATOM 764 N PHE A 278 3.315 -3.131 2.405 1.00 0.00 N ATOM 765 CA PHE A 278 3.700 -1.740 2.195 1.00 0.00 C ATOM 766 C PHE A 278 4.084 -1.496 0.738 1.00 0.00 C ATOM 767 O PHE A 278 5.135 -1.945 0.280 1.00 0.00 O ATOM 768 CB PHE A 278 4.866 -1.367 3.112 1.00 0.00 C ATOM 769 CG PHE A 278 4.435 -0.905 4.474 1.00 0.00 C ATOM 770 CD1 PHE A 278 3.848 0.338 4.645 1.00 0.00 C ATOM 771 CD2 PHE A 278 4.616 -1.715 5.584 1.00 0.00 C ATOM 772 CE1 PHE A 278 3.449 0.766 5.897 1.00 0.00 C ATOM 773 CE2 PHE A 278 4.219 -1.292 6.839 1.00 0.00 C ATOM 774 CZ PHE A 278 3.636 -0.050 6.996 1.00 0.00 C ATOM 0 H PHE A 278 4.099 -3.774 2.514 1.00 0.00 H new ATOM 0 HA PHE A 278 2.843 -1.111 2.436 1.00 0.00 H new ATOM 0 HB2 PHE A 278 5.522 -2.230 3.221 1.00 0.00 H new ATOM 0 HB3 PHE A 278 5.452 -0.579 2.639 1.00 0.00 H new ATOM 0 HD1 PHE A 278 3.700 0.980 3.790 1.00 0.00 H new ATOM 0 HD2 PHE A 278 5.072 -2.687 5.467 1.00 0.00 H new ATOM 0 HE1 PHE A 278 2.992 1.737 6.016 1.00 0.00 H new ATOM 0 HE2 PHE A 278 4.365 -1.933 7.696 1.00 0.00 H new ATOM 0 HZ PHE A 278 3.327 0.283 7.976 1.00 0.00 H new ATOM 784 N ILE A 279 3.226 -0.784 0.017 1.00 0.00 N ATOM 785 CA ILE A 279 3.475 -0.480 -1.386 1.00 0.00 C ATOM 786 C ILE A 279 4.177 0.865 -1.542 1.00 0.00 C ATOM 787 O ILE A 279 3.622 1.908 -1.199 1.00 0.00 O ATOM 788 CB ILE A 279 2.167 -0.461 -2.199 1.00 0.00 C ATOM 789 CG1 ILE A 279 1.218 -1.555 -1.706 1.00 0.00 C ATOM 790 CG2 ILE A 279 2.462 -0.636 -3.682 1.00 0.00 C ATOM 791 CD1 ILE A 279 1.645 -2.950 -2.106 1.00 0.00 C ATOM 0 H ILE A 279 2.351 -0.406 0.381 1.00 0.00 H new ATOM 0 HA ILE A 279 4.120 -1.270 -1.770 1.00 0.00 H new ATOM 0 HB ILE A 279 1.682 0.505 -2.057 1.00 0.00 H new ATOM 0 HG12 ILE A 279 1.149 -1.502 -0.619 1.00 0.00 H new ATOM 0 HG13 ILE A 279 0.219 -1.363 -2.099 1.00 0.00 H new ATOM 0 HG21 ILE A 279 1.528 -0.620 -4.243 1.00 0.00 H new ATOM 0 HG22 ILE A 279 3.104 0.176 -4.024 1.00 0.00 H new ATOM 0 HG23 ILE A 279 2.966 -1.589 -3.843 1.00 0.00 H new ATOM 0 HD11 ILE A 279 0.926 -3.674 -1.723 1.00 0.00 H new ATOM 0 HD12 ILE A 279 1.687 -3.020 -3.193 1.00 0.00 H new ATOM 0 HD13 ILE A 279 2.630 -3.162 -1.691 1.00 0.00 H new ATOM 803 N GLN A 280 5.400 0.831 -2.061 1.00 0.00 N ATOM 804 CA GLN A 280 6.177 2.048 -2.263 1.00 0.00 C ATOM 805 C GLN A 280 6.247 2.411 -3.743 1.00 0.00 C ATOM 806 O GLN A 280 6.460 1.548 -4.595 1.00 0.00 O ATOM 807 CB GLN A 280 7.590 1.875 -1.701 1.00 0.00 C ATOM 808 CG GLN A 280 8.334 3.187 -1.512 1.00 0.00 C ATOM 809 CD GLN A 280 9.520 3.056 -0.578 1.00 0.00 C ATOM 810 OE1 GLN A 280 9.572 2.150 0.255 1.00 0.00 O ATOM 811 NE2 GLN A 280 10.482 3.962 -0.710 1.00 0.00 N ATOM 0 H GLN A 280 5.874 -0.025 -2.349 1.00 0.00 H new ATOM 0 HA GLN A 280 5.679 2.859 -1.732 1.00 0.00 H new ATOM 0 HB2 GLN A 280 7.530 1.359 -0.743 1.00 0.00 H new ATOM 0 HB3 GLN A 280 8.163 1.235 -2.372 1.00 0.00 H new ATOM 0 HG2 GLN A 280 8.678 3.548 -2.481 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.647 3.936 -1.118 1.00 0.00 H new ATOM 0 HE21 GLN A 280 10.398 4.696 -1.413 1.00 0.00 H new ATOM 0 HE22 GLN A 280 11.304 3.924 -0.108 1.00 0.00 H new ATOM 820 N PHE A 281 6.066 3.693 -4.042 1.00 0.00 N ATOM 821 CA PHE A 281 6.106 4.170 -5.419 1.00 0.00 C ATOM 822 C PHE A 281 7.304 5.089 -5.641 1.00 0.00 C ATOM 823 O PHE A 281 7.787 5.732 -4.710 1.00 0.00 O ATOM 824 CB PHE A 281 4.811 4.908 -5.764 1.00 0.00 C ATOM 825 CG PHE A 281 3.599 4.021 -5.772 1.00 0.00 C ATOM 826 CD1 PHE A 281 2.892 3.782 -4.605 1.00 0.00 C ATOM 827 CD2 PHE A 281 3.168 3.425 -6.946 1.00 0.00 C ATOM 828 CE1 PHE A 281 1.776 2.967 -4.609 1.00 0.00 C ATOM 829 CE2 PHE A 281 2.053 2.609 -6.956 1.00 0.00 C ATOM 830 CZ PHE A 281 1.357 2.379 -5.786 1.00 0.00 C ATOM 0 H PHE A 281 5.890 4.420 -3.349 1.00 0.00 H new ATOM 0 HA PHE A 281 6.208 3.305 -6.074 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.658 5.712 -5.044 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.917 5.373 -6.744 1.00 0.00 H new ATOM 0 HD1 PHE A 281 3.217 4.238 -3.681 1.00 0.00 H new ATOM 0 HD2 PHE A 281 3.710 3.600 -7.864 1.00 0.00 H new ATOM 0 HE1 PHE A 281 1.232 2.790 -3.693 1.00 0.00 H new ATOM 0 HE2 PHE A 281 1.726 2.152 -7.878 1.00 0.00 H new ATOM 0 HZ PHE A 281 0.486 1.740 -5.791 1.00 0.00 H new ATOM 840 N ALA A 282 7.777 5.145 -6.882 1.00 0.00 N ATOM 841 CA ALA A 282 8.917 5.986 -7.227 1.00 0.00 C ATOM 842 C ALA A 282 8.503 7.448 -7.348 1.00 0.00 C ATOM 843 O ALA A 282 9.275 8.352 -7.024 1.00 0.00 O ATOM 844 CB ALA A 282 9.552 5.506 -8.524 1.00 0.00 C ATOM 0 H ALA A 282 7.389 4.618 -7.665 1.00 0.00 H new ATOM 0 HA ALA A 282 9.651 5.909 -6.425 1.00 0.00 H new ATOM 0 HB1 ALA A 282 10.402 6.142 -8.770 1.00 0.00 H new ATOM 0 HB2 ALA A 282 9.892 4.477 -8.404 1.00 0.00 H new ATOM 0 HB3 ALA A 282 8.818 5.554 -9.328 1.00 0.00 H new ATOM 850 N THR A 283 7.280 7.676 -7.817 1.00 0.00 N ATOM 851 CA THR A 283 6.765 9.029 -7.982 1.00 0.00 C ATOM 852 C THR A 283 5.401 9.183 -7.317 1.00 0.00 C ATOM 853 O THR A 283 4.441 8.508 -7.686 1.00 0.00 O ATOM 854 CB THR A 283 6.643 9.407 -9.470 1.00 0.00 C ATOM 855 OG1 THR A 283 5.899 8.404 -10.171 1.00 0.00 O ATOM 856 CG2 THR A 283 8.018 9.560 -10.103 1.00 0.00 C ATOM 0 H THR A 283 6.628 6.940 -8.089 1.00 0.00 H new ATOM 0 HA THR A 283 7.479 9.699 -7.502 1.00 0.00 H new ATOM 0 HB THR A 283 6.120 10.361 -9.538 1.00 0.00 H new ATOM 0 HG1 THR A 283 5.155 8.098 -9.611 1.00 0.00 H new ATOM 0 HG21 THR A 283 7.907 9.827 -11.154 1.00 0.00 H new ATOM 0 HG22 THR A 283 8.571 10.344 -9.586 1.00 0.00 H new ATOM 0 HG23 THR A 283 8.562 8.619 -10.023 1.00 0.00 H new ATOM 864 N ARG A 284 5.324 10.077 -6.336 1.00 0.00 N ATOM 865 CA ARG A 284 4.077 10.319 -5.620 1.00 0.00 C ATOM 866 C ARG A 284 2.880 10.209 -6.560 1.00 0.00 C ATOM 867 O ARG A 284 1.840 9.663 -6.193 1.00 0.00 O ATOM 868 CB ARG A 284 4.100 11.701 -4.966 1.00 0.00 C ATOM 869 CG ARG A 284 2.819 12.046 -4.225 1.00 0.00 C ATOM 870 CD ARG A 284 2.664 11.215 -2.961 1.00 0.00 C ATOM 871 NE ARG A 284 1.354 11.398 -2.342 1.00 0.00 N ATOM 872 CZ ARG A 284 1.014 12.477 -1.648 1.00 0.00 C ATOM 873 NH1 ARG A 284 1.883 13.466 -1.485 1.00 0.00 N ATOM 874 NH2 ARG A 284 -0.198 12.570 -1.115 1.00 0.00 N ATOM 0 H ARG A 284 6.110 10.645 -6.019 1.00 0.00 H new ATOM 0 HA ARG A 284 3.979 9.559 -4.845 1.00 0.00 H new ATOM 0 HB2 ARG A 284 4.937 11.750 -4.269 1.00 0.00 H new ATOM 0 HB3 ARG A 284 4.280 12.454 -5.734 1.00 0.00 H new ATOM 0 HG2 ARG A 284 2.821 13.105 -3.967 1.00 0.00 H new ATOM 0 HG3 ARG A 284 1.963 11.879 -4.879 1.00 0.00 H new ATOM 0 HD2 ARG A 284 2.808 10.161 -3.200 1.00 0.00 H new ATOM 0 HD3 ARG A 284 3.443 11.489 -2.249 1.00 0.00 H new ATOM 0 HE ARG A 284 0.662 10.656 -2.449 1.00 0.00 H new ATOM 0 HH11 ARG A 284 2.815 13.398 -1.894 1.00 0.00 H new ATOM 0 HH12 ARG A 284 1.619 14.294 -0.951 1.00 0.00 H new ATOM 0 HH21 ARG A 284 -0.869 11.812 -1.239 1.00 0.00 H new ATOM 0 HH22 ARG A 284 -0.458 13.400 -0.582 1.00 0.00 H new ATOM 888 N GLN A 285 3.036 10.731 -7.772 1.00 0.00 N ATOM 889 CA GLN A 285 1.967 10.692 -8.763 1.00 0.00 C ATOM 890 C GLN A 285 1.155 9.408 -8.638 1.00 0.00 C ATOM 891 O GLN A 285 -0.043 9.444 -8.357 1.00 0.00 O ATOM 892 CB GLN A 285 2.547 10.807 -10.174 1.00 0.00 C ATOM 893 CG GLN A 285 1.522 11.209 -11.222 1.00 0.00 C ATOM 894 CD GLN A 285 0.415 10.186 -11.378 1.00 0.00 C ATOM 895 OE1 GLN A 285 -0.740 10.447 -11.038 1.00 0.00 O ATOM 896 NE2 GLN A 285 0.761 9.013 -11.895 1.00 0.00 N ATOM 0 H GLN A 285 3.891 11.186 -8.091 1.00 0.00 H new ATOM 0 HA GLN A 285 1.305 11.538 -8.579 1.00 0.00 H new ATOM 0 HB2 GLN A 285 3.354 11.539 -10.167 1.00 0.00 H new ATOM 0 HB3 GLN A 285 2.987 9.850 -10.456 1.00 0.00 H new ATOM 0 HG2 GLN A 285 1.087 12.171 -10.949 1.00 0.00 H new ATOM 0 HG3 GLN A 285 2.023 11.346 -12.181 1.00 0.00 H new ATOM 0 HE21 GLN A 285 1.730 8.840 -12.163 1.00 0.00 H new ATOM 0 HE22 GLN A 285 0.058 8.285 -12.024 1.00 0.00 H new ATOM 905 N ALA A 286 1.814 8.273 -8.847 1.00 0.00 N ATOM 906 CA ALA A 286 1.153 6.977 -8.756 1.00 0.00 C ATOM 907 C ALA A 286 0.582 6.749 -7.360 1.00 0.00 C ATOM 908 O ALA A 286 -0.534 6.254 -7.210 1.00 0.00 O ATOM 909 CB ALA A 286 2.124 5.863 -9.119 1.00 0.00 C ATOM 0 H ALA A 286 2.806 8.225 -9.081 1.00 0.00 H new ATOM 0 HA ALA A 286 0.325 6.968 -9.465 1.00 0.00 H new ATOM 0 HB1 ALA A 286 1.617 4.901 -9.047 1.00 0.00 H new ATOM 0 HB2 ALA A 286 2.481 6.009 -10.138 1.00 0.00 H new ATOM 0 HB3 ALA A 286 2.970 5.880 -8.432 1.00 0.00 H new ATOM 915 N ALA A 287 1.355 7.114 -6.343 1.00 0.00 N ATOM 916 CA ALA A 287 0.925 6.950 -4.960 1.00 0.00 C ATOM 917 C ALA A 287 -0.414 7.638 -4.716 1.00 0.00 C ATOM 918 O ALA A 287 -1.408 6.985 -4.400 1.00 0.00 O ATOM 919 CB ALA A 287 1.981 7.496 -4.010 1.00 0.00 C ATOM 0 H ALA A 287 2.282 7.525 -6.451 1.00 0.00 H new ATOM 0 HA ALA A 287 0.797 5.884 -4.770 1.00 0.00 H new ATOM 0 HB1 ALA A 287 1.646 7.367 -2.981 1.00 0.00 H new ATOM 0 HB2 ALA A 287 2.917 6.957 -4.158 1.00 0.00 H new ATOM 0 HB3 ALA A 287 2.137 8.556 -4.210 1.00 0.00 H new ATOM 925 N GLU A 288 -0.432 8.959 -4.866 1.00 0.00 N ATOM 926 CA GLU A 288 -1.649 9.734 -4.660 1.00 0.00 C ATOM 927 C GLU A 288 -2.839 9.070 -5.348 1.00 0.00 C ATOM 928 O GLU A 288 -3.864 8.802 -4.719 1.00 0.00 O ATOM 929 CB GLU A 288 -1.470 11.158 -5.190 1.00 0.00 C ATOM 930 CG GLU A 288 -0.938 12.131 -4.151 1.00 0.00 C ATOM 931 CD GLU A 288 -1.308 13.570 -4.456 1.00 0.00 C ATOM 932 OE1 GLU A 288 -0.569 14.224 -5.221 1.00 0.00 O ATOM 933 OE2 GLU A 288 -2.338 14.041 -3.929 1.00 0.00 O ATOM 0 H GLU A 288 0.382 9.514 -5.129 1.00 0.00 H new ATOM 0 HA GLU A 288 -1.846 9.775 -3.589 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -0.787 11.137 -6.040 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -2.428 11.522 -5.560 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -1.329 11.859 -3.170 1.00 0.00 H new ATOM 0 HG3 GLU A 288 0.147 12.042 -4.097 1.00 0.00 H new ATOM 940 N VAL A 289 -2.696 8.808 -6.643 1.00 0.00 N ATOM 941 CA VAL A 289 -3.758 8.175 -7.417 1.00 0.00 C ATOM 942 C VAL A 289 -4.264 6.914 -6.726 1.00 0.00 C ATOM 943 O VAL A 289 -5.401 6.864 -6.259 1.00 0.00 O ATOM 944 CB VAL A 289 -3.279 7.814 -8.835 1.00 0.00 C ATOM 945 CG1 VAL A 289 -4.432 7.273 -9.667 1.00 0.00 C ATOM 946 CG2 VAL A 289 -2.647 9.023 -9.508 1.00 0.00 C ATOM 0 H VAL A 289 -1.855 9.024 -7.179 1.00 0.00 H new ATOM 0 HA VAL A 289 -4.571 8.897 -7.489 1.00 0.00 H new ATOM 0 HB VAL A 289 -2.522 7.034 -8.756 1.00 0.00 H new ATOM 0 HG11 VAL A 289 -4.074 7.023 -10.666 1.00 0.00 H new ATOM 0 HG12 VAL A 289 -4.835 6.379 -9.192 1.00 0.00 H new ATOM 0 HG13 VAL A 289 -5.214 8.029 -9.740 1.00 0.00 H new ATOM 0 HG21 VAL A 289 -2.314 8.749 -10.509 1.00 0.00 H new ATOM 0 HG22 VAL A 289 -3.381 9.826 -9.576 1.00 0.00 H new ATOM 0 HG23 VAL A 289 -1.793 9.361 -8.921 1.00 0.00 H new ATOM 956 N ALA A 290 -3.412 5.896 -6.665 1.00 0.00 N ATOM 957 CA ALA A 290 -3.772 4.635 -6.030 1.00 0.00 C ATOM 958 C ALA A 290 -4.282 4.862 -4.610 1.00 0.00 C ATOM 959 O ALA A 290 -5.101 4.095 -4.105 1.00 0.00 O ATOM 960 CB ALA A 290 -2.579 3.690 -6.019 1.00 0.00 C ATOM 0 H ALA A 290 -2.467 5.920 -7.048 1.00 0.00 H new ATOM 0 HA ALA A 290 -4.576 4.181 -6.609 1.00 0.00 H new ATOM 0 HB1 ALA A 290 -2.862 2.752 -5.542 1.00 0.00 H new ATOM 0 HB2 ALA A 290 -2.260 3.494 -7.043 1.00 0.00 H new ATOM 0 HB3 ALA A 290 -1.759 4.146 -5.465 1.00 0.00 H new ATOM 966 N ALA A 291 -3.791 5.919 -3.972 1.00 0.00 N ATOM 967 CA ALA A 291 -4.199 6.247 -2.612 1.00 0.00 C ATOM 968 C ALA A 291 -5.714 6.380 -2.509 1.00 0.00 C ATOM 969 O ALA A 291 -6.347 5.744 -1.667 1.00 0.00 O ATOM 970 CB ALA A 291 -3.522 7.530 -2.153 1.00 0.00 C ATOM 0 H ALA A 291 -3.110 6.563 -4.375 1.00 0.00 H new ATOM 0 HA ALA A 291 -3.888 5.431 -1.960 1.00 0.00 H new ATOM 0 HB1 ALA A 291 -3.836 7.763 -1.136 1.00 0.00 H new ATOM 0 HB2 ALA A 291 -2.440 7.400 -2.178 1.00 0.00 H new ATOM 0 HB3 ALA A 291 -3.804 8.348 -2.816 1.00 0.00 H new ATOM 976 N GLU A 292 -6.290 7.212 -3.372 1.00 0.00 N ATOM 977 CA GLU A 292 -7.732 7.429 -3.377 1.00 0.00 C ATOM 978 C GLU A 292 -8.464 6.213 -3.940 1.00 0.00 C ATOM 979 O GLU A 292 -9.624 5.965 -3.611 1.00 0.00 O ATOM 980 CB GLU A 292 -8.081 8.672 -4.197 1.00 0.00 C ATOM 981 CG GLU A 292 -9.559 9.022 -4.175 1.00 0.00 C ATOM 982 CD GLU A 292 -9.819 10.479 -4.503 1.00 0.00 C ATOM 983 OE1 GLU A 292 -9.657 11.328 -3.601 1.00 0.00 O ATOM 984 OE2 GLU A 292 -10.184 10.771 -5.661 1.00 0.00 O ATOM 0 H GLU A 292 -5.780 7.746 -4.076 1.00 0.00 H new ATOM 0 HA GLU A 292 -8.054 7.580 -2.347 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -7.510 9.519 -3.817 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -7.769 8.515 -5.230 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -10.088 8.393 -4.890 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -9.967 8.797 -3.190 1.00 0.00 H new ATOM 991 N LYS A 293 -7.777 5.458 -4.791 1.00 0.00 N ATOM 992 CA LYS A 293 -8.358 4.268 -5.400 1.00 0.00 C ATOM 993 C LYS A 293 -8.092 3.034 -4.545 1.00 0.00 C ATOM 994 O LYS A 293 -8.420 1.913 -4.936 1.00 0.00 O ATOM 995 CB LYS A 293 -7.790 4.060 -6.806 1.00 0.00 C ATOM 996 CG LYS A 293 -8.481 4.895 -7.870 1.00 0.00 C ATOM 997 CD LYS A 293 -8.459 4.203 -9.223 1.00 0.00 C ATOM 998 CE LYS A 293 -8.494 5.208 -10.364 1.00 0.00 C ATOM 999 NZ LYS A 293 -9.857 5.777 -10.559 1.00 0.00 N ATOM 0 H LYS A 293 -6.816 5.650 -5.075 1.00 0.00 H new ATOM 0 HA LYS A 293 -9.436 4.415 -5.469 1.00 0.00 H new ATOM 0 HB2 LYS A 293 -6.727 4.302 -6.799 1.00 0.00 H new ATOM 0 HB3 LYS A 293 -7.875 3.006 -7.071 1.00 0.00 H new ATOM 0 HG2 LYS A 293 -9.513 5.083 -7.573 1.00 0.00 H new ATOM 0 HG3 LYS A 293 -7.990 5.865 -7.948 1.00 0.00 H new ATOM 0 HD2 LYS A 293 -7.562 3.590 -9.305 1.00 0.00 H new ATOM 0 HD3 LYS A 293 -9.313 3.531 -9.303 1.00 0.00 H new ATOM 0 HE2 LYS A 293 -7.789 6.014 -10.160 1.00 0.00 H new ATOM 0 HE3 LYS A 293 -8.167 4.724 -11.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 293 -9.840 6.457 -11.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 293 -10.525 5.011 -10.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 293 -10.159 6.261 -9.689 1.00 0.00 H new ATOM 1013 N SER A 294 -7.496 3.246 -3.375 1.00 0.00 N ATOM 1014 CA SER A 294 -7.184 2.150 -2.466 1.00 0.00 C ATOM 1015 C SER A 294 -7.945 2.300 -1.152 1.00 0.00 C ATOM 1016 O SER A 294 -8.422 1.319 -0.582 1.00 0.00 O ATOM 1017 CB SER A 294 -5.679 2.099 -2.193 1.00 0.00 C ATOM 1018 OG SER A 294 -5.250 3.249 -1.487 1.00 0.00 O ATOM 0 H SER A 294 -7.220 4.167 -3.035 1.00 0.00 H new ATOM 0 HA SER A 294 -7.493 1.218 -2.940 1.00 0.00 H new ATOM 0 HB2 SER A 294 -5.441 1.205 -1.617 1.00 0.00 H new ATOM 0 HB3 SER A 294 -5.137 2.024 -3.136 1.00 0.00 H new ATOM 0 HG SER A 294 -5.831 4.006 -1.710 1.00 0.00 H new ATOM 1024 N PHE A 295 -8.056 3.537 -0.678 1.00 0.00 N ATOM 1025 CA PHE A 295 -8.758 3.817 0.569 1.00 0.00 C ATOM 1026 C PHE A 295 -10.096 3.084 0.616 1.00 0.00 C ATOM 1027 O PHE A 295 -11.043 3.454 -0.076 1.00 0.00 O ATOM 1028 CB PHE A 295 -8.983 5.322 0.725 1.00 0.00 C ATOM 1029 CG PHE A 295 -7.828 6.038 1.366 1.00 0.00 C ATOM 1030 CD1 PHE A 295 -6.523 5.681 1.067 1.00 0.00 C ATOM 1031 CD2 PHE A 295 -8.048 7.067 2.267 1.00 0.00 C ATOM 1032 CE1 PHE A 295 -5.458 6.337 1.655 1.00 0.00 C ATOM 1033 CE2 PHE A 295 -6.987 7.727 2.858 1.00 0.00 C ATOM 1034 CZ PHE A 295 -5.690 7.361 2.552 1.00 0.00 C ATOM 0 H PHE A 295 -7.669 4.361 -1.138 1.00 0.00 H new ATOM 0 HA PHE A 295 -8.139 3.462 1.393 1.00 0.00 H new ATOM 0 HB2 PHE A 295 -9.170 5.757 -0.257 1.00 0.00 H new ATOM 0 HB3 PHE A 295 -9.879 5.487 1.323 1.00 0.00 H new ATOM 0 HD1 PHE A 295 -6.336 4.881 0.366 1.00 0.00 H new ATOM 0 HD2 PHE A 295 -9.060 7.357 2.510 1.00 0.00 H new ATOM 0 HE1 PHE A 295 -4.446 6.049 1.413 1.00 0.00 H new ATOM 0 HE2 PHE A 295 -7.171 8.528 3.558 1.00 0.00 H new ATOM 0 HZ PHE A 295 -4.860 7.875 3.013 1.00 0.00 H new ATOM 1044 N ASN A 296 -10.164 2.042 1.438 1.00 0.00 N ATOM 1045 CA ASN A 296 -11.384 1.255 1.576 1.00 0.00 C ATOM 1046 C ASN A 296 -12.055 1.050 0.221 1.00 0.00 C ATOM 1047 O ASN A 296 -13.272 0.884 0.137 1.00 0.00 O ATOM 1048 CB ASN A 296 -12.354 1.944 2.538 1.00 0.00 C ATOM 1049 CG ASN A 296 -13.254 0.958 3.257 1.00 0.00 C ATOM 1050 OD1 ASN A 296 -12.953 0.522 4.369 1.00 0.00 O ATOM 1051 ND2 ASN A 296 -14.365 0.600 2.623 1.00 0.00 N ATOM 0 H ASN A 296 -9.389 1.723 2.019 1.00 0.00 H new ATOM 0 HA ASN A 296 -11.114 0.279 1.980 1.00 0.00 H new ATOM 0 HB2 ASN A 296 -11.788 2.517 3.272 1.00 0.00 H new ATOM 0 HB3 ASN A 296 -12.968 2.654 1.984 1.00 0.00 H new ATOM 0 HD21 ASN A 296 -15.009 -0.062 3.057 1.00 0.00 H new ATOM 0 HD22 ASN A 296 -14.574 0.987 1.703 1.00 0.00 H new ATOM 1058 N LYS A 297 -11.252 1.061 -0.838 1.00 0.00 N ATOM 1059 CA LYS A 297 -11.765 0.874 -2.190 1.00 0.00 C ATOM 1060 C LYS A 297 -11.089 -0.312 -2.869 1.00 0.00 C ATOM 1061 O LYS A 297 -11.702 -1.010 -3.678 1.00 0.00 O ATOM 1062 CB LYS A 297 -11.550 2.142 -3.019 1.00 0.00 C ATOM 1063 CG LYS A 297 -12.357 2.172 -4.305 1.00 0.00 C ATOM 1064 CD LYS A 297 -11.617 1.492 -5.444 1.00 0.00 C ATOM 1065 CE LYS A 297 -12.155 1.928 -6.798 1.00 0.00 C ATOM 1066 NZ LYS A 297 -11.850 0.933 -7.863 1.00 0.00 N ATOM 0 H LYS A 297 -10.243 1.198 -0.786 1.00 0.00 H new ATOM 0 HA LYS A 297 -12.833 0.670 -2.122 1.00 0.00 H new ATOM 0 HB2 LYS A 297 -11.813 3.010 -2.415 1.00 0.00 H new ATOM 0 HB3 LYS A 297 -10.491 2.232 -3.262 1.00 0.00 H new ATOM 0 HG2 LYS A 297 -13.315 1.677 -4.146 1.00 0.00 H new ATOM 0 HG3 LYS A 297 -12.573 3.205 -4.576 1.00 0.00 H new ATOM 0 HD2 LYS A 297 -10.555 1.727 -5.381 1.00 0.00 H new ATOM 0 HD3 LYS A 297 -11.710 0.410 -5.345 1.00 0.00 H new ATOM 0 HE2 LYS A 297 -13.234 2.070 -6.732 1.00 0.00 H new ATOM 0 HE3 LYS A 297 -11.723 2.892 -7.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 297 -12.233 1.267 -8.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 297 -10.820 0.816 -7.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 297 -12.284 0.020 -7.619 1.00 0.00 H new ATOM 1080 N LEU A 298 -9.823 -0.536 -2.536 1.00 0.00 N ATOM 1081 CA LEU A 298 -9.063 -1.639 -3.113 1.00 0.00 C ATOM 1082 C LEU A 298 -9.573 -2.981 -2.597 1.00 0.00 C ATOM 1083 O LEU A 298 -9.250 -3.391 -1.482 1.00 0.00 O ATOM 1084 CB LEU A 298 -7.576 -1.486 -2.787 1.00 0.00 C ATOM 1085 CG LEU A 298 -6.734 -2.759 -2.880 1.00 0.00 C ATOM 1086 CD1 LEU A 298 -6.423 -3.088 -4.332 1.00 0.00 C ATOM 1087 CD2 LEU A 298 -5.450 -2.609 -2.078 1.00 0.00 C ATOM 0 H LEU A 298 -9.301 0.032 -1.869 1.00 0.00 H new ATOM 0 HA LEU A 298 -9.196 -1.612 -4.195 1.00 0.00 H new ATOM 0 HB2 LEU A 298 -7.151 -0.743 -3.462 1.00 0.00 H new ATOM 0 HB3 LEU A 298 -7.485 -1.087 -1.777 1.00 0.00 H new ATOM 0 HG LEU A 298 -7.308 -3.583 -2.457 1.00 0.00 H new ATOM 0 HD11 LEU A 298 -5.823 -3.997 -4.379 1.00 0.00 H new ATOM 0 HD12 LEU A 298 -7.354 -3.239 -4.878 1.00 0.00 H new ATOM 0 HD13 LEU A 298 -5.869 -2.264 -4.781 1.00 0.00 H new ATOM 0 HD21 LEU A 298 -4.863 -3.524 -2.156 1.00 0.00 H new ATOM 0 HD22 LEU A 298 -4.871 -1.773 -2.471 1.00 0.00 H new ATOM 0 HD23 LEU A 298 -5.694 -2.422 -1.032 1.00 0.00 H new ATOM 1099 N ILE A 299 -10.370 -3.659 -3.415 1.00 0.00 N ATOM 1100 CA ILE A 299 -10.922 -4.956 -3.042 1.00 0.00 C ATOM 1101 C ILE A 299 -10.487 -6.041 -4.021 1.00 0.00 C ATOM 1102 O ILE A 299 -11.129 -6.259 -5.049 1.00 0.00 O ATOM 1103 CB ILE A 299 -12.461 -4.917 -2.987 1.00 0.00 C ATOM 1104 CG1 ILE A 299 -12.931 -3.821 -2.029 1.00 0.00 C ATOM 1105 CG2 ILE A 299 -13.009 -6.271 -2.562 1.00 0.00 C ATOM 1106 CD1 ILE A 299 -14.434 -3.650 -1.998 1.00 0.00 C ATOM 0 H ILE A 299 -10.648 -3.332 -4.340 1.00 0.00 H new ATOM 0 HA ILE A 299 -10.536 -5.190 -2.050 1.00 0.00 H new ATOM 0 HB ILE A 299 -12.841 -4.689 -3.983 1.00 0.00 H new ATOM 0 HG12 ILE A 299 -12.579 -4.053 -1.024 1.00 0.00 H new ATOM 0 HG13 ILE A 299 -12.472 -2.876 -2.318 1.00 0.00 H new ATOM 0 HG21 ILE A 299 -14.098 -6.228 -2.528 1.00 0.00 H new ATOM 0 HG22 ILE A 299 -12.698 -7.031 -3.279 1.00 0.00 H new ATOM 0 HG23 ILE A 299 -12.624 -6.525 -1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 299 -14.696 -2.857 -1.298 1.00 0.00 H new ATOM 0 HD12 ILE A 299 -14.791 -3.387 -2.994 1.00 0.00 H new ATOM 0 HD13 ILE A 299 -14.900 -4.583 -1.680 1.00 0.00 H new ATOM 1118 N VAL A 300 -9.391 -6.719 -3.695 1.00 0.00 N ATOM 1119 CA VAL A 300 -8.871 -7.784 -4.544 1.00 0.00 C ATOM 1120 C VAL A 300 -9.348 -9.151 -4.065 1.00 0.00 C ATOM 1121 O VAL A 300 -9.445 -9.400 -2.865 1.00 0.00 O ATOM 1122 CB VAL A 300 -7.331 -7.773 -4.578 1.00 0.00 C ATOM 1123 CG1 VAL A 300 -6.808 -8.887 -5.473 1.00 0.00 C ATOM 1124 CG2 VAL A 300 -6.819 -6.419 -5.045 1.00 0.00 C ATOM 0 H VAL A 300 -8.846 -6.550 -2.849 1.00 0.00 H new ATOM 0 HA VAL A 300 -9.251 -7.601 -5.549 1.00 0.00 H new ATOM 0 HB VAL A 300 -6.961 -7.948 -3.568 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -5.718 -8.863 -5.484 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -7.146 -9.850 -5.090 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -7.185 -8.747 -6.486 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -5.729 -6.429 -5.063 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -7.197 -6.213 -6.046 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -7.164 -5.644 -4.361 1.00 0.00 H new ATOM 1134 N ASN A 301 -9.643 -10.034 -5.014 1.00 0.00 N ATOM 1135 CA ASN A 301 -10.110 -11.377 -4.689 1.00 0.00 C ATOM 1136 C ASN A 301 -11.274 -11.325 -3.703 1.00 0.00 C ATOM 1137 O ASN A 301 -11.229 -11.943 -2.641 1.00 0.00 O ATOM 1138 CB ASN A 301 -8.967 -12.209 -4.103 1.00 0.00 C ATOM 1139 CG ASN A 301 -7.868 -12.475 -5.113 1.00 0.00 C ATOM 1140 OD1 ASN A 301 -6.638 -12.129 -4.753 1.00 0.00 O flip ATOM 1141 ND2 ASN A 301 -8.123 -12.985 -6.204 1.00 0.00 N flip ATOM 0 H ASN A 301 -9.567 -9.844 -6.013 1.00 0.00 H new ATOM 0 HA ASN A 301 -10.458 -11.846 -5.609 1.00 0.00 H new ATOM 0 HB2 ASN A 301 -8.547 -11.689 -3.242 1.00 0.00 H new ATOM 0 HB3 ASN A 301 -9.361 -13.158 -3.741 1.00 0.00 H new ATOM 0 HD21 ASN A 301 -9.084 -13.235 -6.438 1.00 0.00 H new ATOM 0 HD22 ASN A 301 -7.373 -13.158 -6.874 1.00 0.00 H new ATOM 1148 N GLY A 302 -12.316 -10.583 -4.066 1.00 0.00 N ATOM 1149 CA GLY A 302 -13.477 -10.464 -3.203 1.00 0.00 C ATOM 1150 C GLY A 302 -13.102 -10.331 -1.741 1.00 0.00 C ATOM 1151 O GLY A 302 -13.822 -10.806 -0.862 1.00 0.00 O ATOM 0 H GLY A 302 -12.377 -10.063 -4.941 1.00 0.00 H new ATOM 0 HA2 GLY A 302 -14.063 -9.596 -3.505 1.00 0.00 H new ATOM 0 HA3 GLY A 302 -14.114 -11.339 -3.333 1.00 0.00 H new ATOM 1155 N ARG A 303 -11.971 -9.684 -1.478 1.00 0.00 N ATOM 1156 CA ARG A 303 -11.500 -9.492 -0.112 1.00 0.00 C ATOM 1157 C ARG A 303 -11.093 -8.041 0.125 1.00 0.00 C ATOM 1158 O ARG A 303 -10.025 -7.607 -0.307 1.00 0.00 O ATOM 1159 CB ARG A 303 -10.317 -10.418 0.177 1.00 0.00 C ATOM 1160 CG ARG A 303 -9.961 -10.509 1.652 1.00 0.00 C ATOM 1161 CD ARG A 303 -8.838 -11.506 1.893 1.00 0.00 C ATOM 1162 NE ARG A 303 -9.346 -12.851 2.150 1.00 0.00 N ATOM 1163 CZ ARG A 303 -9.717 -13.280 3.352 1.00 0.00 C ATOM 1164 NH1 ARG A 303 -9.637 -12.473 4.401 1.00 0.00 N ATOM 1165 NH2 ARG A 303 -10.169 -14.518 3.505 1.00 0.00 N ATOM 0 H ARG A 303 -11.364 -9.284 -2.193 1.00 0.00 H new ATOM 0 HA ARG A 303 -12.319 -9.737 0.565 1.00 0.00 H new ATOM 0 HB2 ARG A 303 -10.549 -11.416 -0.194 1.00 0.00 H new ATOM 0 HB3 ARG A 303 -9.447 -10.066 -0.377 1.00 0.00 H new ATOM 0 HG2 ARG A 303 -9.661 -9.526 2.016 1.00 0.00 H new ATOM 0 HG3 ARG A 303 -10.841 -10.806 2.222 1.00 0.00 H new ATOM 0 HD2 ARG A 303 -8.179 -11.527 1.025 1.00 0.00 H new ATOM 0 HD3 ARG A 303 -8.237 -11.177 2.741 1.00 0.00 H new ATOM 0 HE ARG A 303 -9.420 -13.497 1.364 1.00 0.00 H new ATOM 0 HH11 ARG A 303 -9.290 -11.521 4.287 1.00 0.00 H new ATOM 0 HH12 ARG A 303 -9.922 -12.805 5.322 1.00 0.00 H new ATOM 0 HH21 ARG A 303 -10.232 -15.141 2.700 1.00 0.00 H new ATOM 0 HH22 ARG A 303 -10.454 -14.847 4.428 1.00 0.00 H new ATOM 1179 N ARG A 304 -11.952 -7.295 0.812 1.00 0.00 N ATOM 1180 CA ARG A 304 -11.683 -5.892 1.104 1.00 0.00 C ATOM 1181 C ARG A 304 -10.330 -5.730 1.792 1.00 0.00 C ATOM 1182 O ARG A 304 -9.918 -6.580 2.583 1.00 0.00 O ATOM 1183 CB ARG A 304 -12.789 -5.312 1.987 1.00 0.00 C ATOM 1184 CG ARG A 304 -12.831 -3.792 1.991 1.00 0.00 C ATOM 1185 CD ARG A 304 -13.764 -3.264 3.069 1.00 0.00 C ATOM 1186 NE ARG A 304 -13.393 -3.743 4.398 1.00 0.00 N ATOM 1187 CZ ARG A 304 -12.296 -3.356 5.039 1.00 0.00 C ATOM 1188 NH1 ARG A 304 -11.466 -2.488 4.476 1.00 0.00 N ATOM 1189 NH2 ARG A 304 -12.027 -3.837 6.246 1.00 0.00 N ATOM 0 H ARG A 304 -12.840 -7.639 1.177 1.00 0.00 H new ATOM 0 HA ARG A 304 -11.659 -5.348 0.160 1.00 0.00 H new ATOM 0 HB2 ARG A 304 -13.752 -5.693 1.646 1.00 0.00 H new ATOM 0 HB3 ARG A 304 -12.650 -5.666 3.009 1.00 0.00 H new ATOM 0 HG2 ARG A 304 -11.827 -3.400 2.153 1.00 0.00 H new ATOM 0 HG3 ARG A 304 -13.160 -3.433 1.016 1.00 0.00 H new ATOM 0 HD2 ARG A 304 -13.749 -2.174 3.059 1.00 0.00 H new ATOM 0 HD3 ARG A 304 -14.786 -3.570 2.846 1.00 0.00 H new ATOM 0 HE ARG A 304 -14.010 -4.411 4.859 1.00 0.00 H new ATOM 0 HH11 ARG A 304 -11.669 -2.116 3.548 1.00 0.00 H new ATOM 0 HH12 ARG A 304 -10.624 -2.193 4.971 1.00 0.00 H new ATOM 0 HH21 ARG A 304 -12.663 -4.505 6.682 1.00 0.00 H new ATOM 0 HH22 ARG A 304 -11.184 -3.539 6.737 1.00 0.00 H new ATOM 1203 N LEU A 305 -9.645 -4.634 1.486 1.00 0.00 N ATOM 1204 CA LEU A 305 -8.338 -4.360 2.075 1.00 0.00 C ATOM 1205 C LEU A 305 -8.282 -2.945 2.641 1.00 0.00 C ATOM 1206 O LEU A 305 -8.671 -1.985 1.978 1.00 0.00 O ATOM 1207 CB LEU A 305 -7.237 -4.547 1.029 1.00 0.00 C ATOM 1208 CG LEU A 305 -7.326 -5.816 0.180 1.00 0.00 C ATOM 1209 CD1 LEU A 305 -6.189 -5.864 -0.829 1.00 0.00 C ATOM 1210 CD2 LEU A 305 -7.308 -7.053 1.066 1.00 0.00 C ATOM 0 H LEU A 305 -9.972 -3.921 0.834 1.00 0.00 H new ATOM 0 HA LEU A 305 -8.179 -5.065 2.891 1.00 0.00 H new ATOM 0 HB2 LEU A 305 -7.248 -3.686 0.361 1.00 0.00 H new ATOM 0 HB3 LEU A 305 -6.274 -4.542 1.540 1.00 0.00 H new ATOM 0 HG LEU A 305 -8.269 -5.799 -0.367 1.00 0.00 H new ATOM 0 HD11 LEU A 305 -6.269 -6.774 -1.424 1.00 0.00 H new ATOM 0 HD12 LEU A 305 -6.248 -4.995 -1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 305 -5.235 -5.857 -0.302 1.00 0.00 H new ATOM 0 HD21 LEU A 305 -7.372 -7.946 0.445 1.00 0.00 H new ATOM 0 HD22 LEU A 305 -6.382 -7.076 1.640 1.00 0.00 H new ATOM 0 HD23 LEU A 305 -8.157 -7.024 1.749 1.00 0.00 H new ATOM 1222 N ASN A 306 -7.793 -2.824 3.871 1.00 0.00 N ATOM 1223 CA ASN A 306 -7.684 -1.526 4.526 1.00 0.00 C ATOM 1224 C ASN A 306 -6.359 -0.853 4.183 1.00 0.00 C ATOM 1225 O ASN A 306 -5.312 -1.206 4.726 1.00 0.00 O ATOM 1226 CB ASN A 306 -7.811 -1.685 6.043 1.00 0.00 C ATOM 1227 CG ASN A 306 -8.419 -0.463 6.703 1.00 0.00 C ATOM 1228 OD1 ASN A 306 -8.866 0.464 6.027 1.00 0.00 O ATOM 1229 ND2 ASN A 306 -8.440 -0.456 8.031 1.00 0.00 N ATOM 0 H ASN A 306 -7.466 -3.609 4.434 1.00 0.00 H new ATOM 0 HA ASN A 306 -8.496 -0.895 4.164 1.00 0.00 H new ATOM 0 HB2 ASN A 306 -8.426 -2.558 6.264 1.00 0.00 H new ATOM 0 HB3 ASN A 306 -6.826 -1.873 6.470 1.00 0.00 H new ATOM 0 HD21 ASN A 306 -8.838 0.339 8.531 1.00 0.00 H new ATOM 0 HD22 ASN A 306 -8.058 -1.246 8.551 1.00 0.00 H new ATOM 1236 N VAL A 307 -6.412 0.119 3.278 1.00 0.00 N ATOM 1237 CA VAL A 307 -5.216 0.844 2.863 1.00 0.00 C ATOM 1238 C VAL A 307 -5.127 2.199 3.555 1.00 0.00 C ATOM 1239 O VAL A 307 -6.119 2.920 3.663 1.00 0.00 O ATOM 1240 CB VAL A 307 -5.189 1.056 1.338 1.00 0.00 C ATOM 1241 CG1 VAL A 307 -3.988 1.897 0.937 1.00 0.00 C ATOM 1242 CG2 VAL A 307 -5.178 -0.283 0.615 1.00 0.00 C ATOM 0 H VAL A 307 -7.270 0.423 2.818 1.00 0.00 H new ATOM 0 HA VAL A 307 -4.360 0.234 3.153 1.00 0.00 H new ATOM 0 HB VAL A 307 -6.092 1.593 1.047 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -3.986 2.036 -0.144 1.00 0.00 H new ATOM 0 HG12 VAL A 307 -4.044 2.869 1.428 1.00 0.00 H new ATOM 0 HG13 VAL A 307 -3.072 1.390 1.239 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -5.159 -0.115 -0.462 1.00 0.00 H new ATOM 0 HG22 VAL A 307 -4.294 -0.848 0.910 1.00 0.00 H new ATOM 0 HG23 VAL A 307 -6.073 -0.846 0.878 1.00 0.00 H new ATOM 1252 N LYS A 308 -3.931 2.541 4.023 1.00 0.00 N ATOM 1253 CA LYS A 308 -3.710 3.811 4.704 1.00 0.00 C ATOM 1254 C LYS A 308 -2.307 4.340 4.427 1.00 0.00 C ATOM 1255 O LYS A 308 -1.358 3.567 4.290 1.00 0.00 O ATOM 1256 CB LYS A 308 -3.916 3.648 6.212 1.00 0.00 C ATOM 1257 CG LYS A 308 -3.670 2.234 6.710 1.00 0.00 C ATOM 1258 CD LYS A 308 -3.768 2.151 8.224 1.00 0.00 C ATOM 1259 CE LYS A 308 -4.328 0.810 8.674 1.00 0.00 C ATOM 1260 NZ LYS A 308 -5.813 0.839 8.786 1.00 0.00 N ATOM 0 H LYS A 308 -3.100 1.956 3.943 1.00 0.00 H new ATOM 0 HA LYS A 308 -4.433 4.531 4.320 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -3.248 4.331 6.737 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -4.935 3.941 6.465 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -4.396 1.557 6.260 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -2.683 1.901 6.390 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -2.781 2.300 8.662 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -4.405 2.955 8.593 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -4.032 0.037 7.965 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -3.896 0.541 9.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -6.155 -0.088 9.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -6.095 1.571 9.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -6.227 1.054 7.857 1.00 0.00 H new ATOM 1274 N TRP A 309 -2.182 5.660 4.346 1.00 0.00 N ATOM 1275 CA TRP A 309 -0.893 6.291 4.086 1.00 0.00 C ATOM 1276 C TRP A 309 0.162 5.801 5.072 1.00 0.00 C ATOM 1277 O TRP A 309 -0.083 5.735 6.276 1.00 0.00 O ATOM 1278 CB TRP A 309 -1.021 7.813 4.172 1.00 0.00 C ATOM 1279 CG TRP A 309 -1.586 8.432 2.929 1.00 0.00 C ATOM 1280 CD1 TRP A 309 -2.782 9.080 2.807 1.00 0.00 C ATOM 1281 CD2 TRP A 309 -0.978 8.460 1.633 1.00 0.00 C ATOM 1282 NE1 TRP A 309 -2.954 9.509 1.513 1.00 0.00 N ATOM 1283 CE2 TRP A 309 -1.862 9.142 0.774 1.00 0.00 C ATOM 1284 CE3 TRP A 309 0.227 7.978 1.116 1.00 0.00 C ATOM 1285 CZ2 TRP A 309 -1.576 9.351 -0.573 1.00 0.00 C ATOM 1286 CZ3 TRP A 309 0.508 8.185 -0.221 1.00 0.00 C ATOM 1287 CH2 TRP A 309 -0.389 8.867 -1.053 1.00 0.00 C ATOM 0 H TRP A 309 -2.957 6.314 4.457 1.00 0.00 H new ATOM 0 HA TRP A 309 -0.578 6.016 3.079 1.00 0.00 H new ATOM 0 HB2 TRP A 309 -1.657 8.070 5.019 1.00 0.00 H new ATOM 0 HB3 TRP A 309 -0.039 8.243 4.369 1.00 0.00 H new ATOM 0 HD1 TRP A 309 -3.489 9.233 3.609 1.00 0.00 H new ATOM 0 HE1 TRP A 309 -3.764 10.018 1.160 1.00 0.00 H new ATOM 0 HE3 TRP A 309 0.926 7.453 1.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 309 -2.266 9.876 -1.216 1.00 0.00 H new ATOM 0 HZ3 TRP A 309 1.436 7.814 -0.632 1.00 0.00 H new ATOM 0 HH2 TRP A 309 -0.139 9.014 -2.093 1.00 0.00 H new ATOM 1298 N GLY A 310 1.337 5.458 4.553 1.00 0.00 N ATOM 1299 CA GLY A 310 2.411 4.979 5.403 1.00 0.00 C ATOM 1300 C GLY A 310 3.259 6.106 5.958 1.00 0.00 C ATOM 1301 O GLY A 310 2.732 7.115 6.427 1.00 0.00 O ATOM 0 H GLY A 310 1.564 5.503 3.560 1.00 0.00 H new ATOM 0 HA2 GLY A 310 1.989 4.406 6.229 1.00 0.00 H new ATOM 0 HA3 GLY A 310 3.044 4.298 4.834 1.00 0.00 H new