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 240 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 280 GLN :FLIP amide:sc= 0 F(o=-1.9,f=0) USER MOD Single : A 239 THR OG1 : rot 135:sc= 0.506 USER MOD Single : A 242 TYR OH : rot 180:sc= 0 USER MOD Single : A 249 THR OG1 : rot -130:sc= -0.0261 USER MOD Single : A 251 THR OG1 : rot 180:sc= 0 USER MOD Single : A 253 THR OG1 : rot 180:sc= 0 USER MOD Single : A 257 ASN : amide:sc= -0.266 X(o=-0.27,f=-0.069) USER MOD Single : A 258 HIS : no HE2:sc= -4.21! C(o=-4.2!,f=-4.2!) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 261 GLN : amide:sc= -2.76! C(o=-2.8!,f=-4.1!) USER MOD Single : A 267 THR OG1 : rot 180:sc=-0.000697 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= -0.371 K(o=-0.37,f=-1.4) USER MOD Single : A 275 GLN : amide:sc= -1.88 K(o=-1.9,f=-3.9!) USER MOD Single : A 276 CYS SG : rot 180:sc= -2.72 USER MOD Single : A 283 THR OG1 : rot 39:sc= 0.28 USER MOD Single : A 285 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 293 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 SER OG : rot -27:sc= -2.84! USER MOD Single : A 296 ASN : amide:sc= -0.542 K(o=-0.54,f=-4.2!) USER MOD Single : A 297 LYS NZ :NH3+ -126:sc= -2.15! (180deg=-4.35!) USER MOD Single : A 301 ASN :FLIP amide:sc= -0.218 F(o=-0.92,f=-0.22) USER MOD Single : A 306 ASN : amide:sc= -0.122 X(o=-0.12,f=-0.34) USER MOD Single : A 308 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 129 N ILE A 238 4.917 11.458 0.987 1.00 0.00 N ATOM 130 CA ILE A 238 4.951 10.035 1.301 1.00 0.00 C ATOM 131 C ILE A 238 4.480 9.199 0.116 1.00 0.00 C ATOM 132 O ILE A 238 3.279 9.032 -0.103 1.00 0.00 O ATOM 133 CB ILE A 238 4.076 9.707 2.526 1.00 0.00 C ATOM 134 CG1 ILE A 238 4.501 10.558 3.724 1.00 0.00 C ATOM 135 CG2 ILE A 238 4.168 8.226 2.861 1.00 0.00 C ATOM 136 CD1 ILE A 238 3.684 10.296 4.970 1.00 0.00 C ATOM 0 HA ILE A 238 5.988 9.787 1.528 1.00 0.00 H new ATOM 0 HB ILE A 238 3.038 9.941 2.288 1.00 0.00 H new ATOM 0 HG12 ILE A 238 5.552 10.367 3.941 1.00 0.00 H new ATOM 0 HG13 ILE A 238 4.417 11.612 3.459 1.00 0.00 H new ATOM 0 HG21 ILE A 238 3.545 8.010 3.729 1.00 0.00 H new ATOM 0 HG22 ILE A 238 3.823 7.638 2.010 1.00 0.00 H new ATOM 0 HG23 ILE A 238 5.203 7.967 3.084 1.00 0.00 H new ATOM 0 HD11 ILE A 238 4.040 10.934 5.779 1.00 0.00 H new ATOM 0 HD12 ILE A 238 2.635 10.515 4.770 1.00 0.00 H new ATOM 0 HD13 ILE A 238 3.787 9.250 5.260 1.00 0.00 H new ATOM 148 N THR A 239 5.433 8.673 -0.647 1.00 0.00 N ATOM 149 CA THR A 239 5.116 7.853 -1.810 1.00 0.00 C ATOM 150 C THR A 239 4.920 6.394 -1.417 1.00 0.00 C ATOM 151 O THR A 239 5.188 5.486 -2.204 1.00 0.00 O ATOM 152 CB THR A 239 6.224 7.941 -2.877 1.00 0.00 C ATOM 153 OG1 THR A 239 7.417 7.310 -2.398 1.00 0.00 O ATOM 154 CG2 THR A 239 6.518 9.390 -3.234 1.00 0.00 C ATOM 0 H THR A 239 6.431 8.800 -0.480 1.00 0.00 H new ATOM 0 HA THR A 239 4.187 8.242 -2.227 1.00 0.00 H new ATOM 0 HB THR A 239 5.877 7.427 -3.773 1.00 0.00 H new ATOM 0 HG1 THR A 239 7.791 6.740 -3.102 1.00 0.00 H new ATOM 0 HG21 THR A 239 7.303 9.427 -3.989 1.00 0.00 H new ATOM 0 HG22 THR A 239 5.615 9.858 -3.626 1.00 0.00 H new ATOM 0 HG23 THR A 239 6.846 9.925 -2.343 1.00 0.00 H new ATOM 162 N THR A 240 4.448 6.173 -0.193 1.00 0.00 N ATOM 163 CA THR A 240 4.216 4.824 0.305 1.00 0.00 C ATOM 164 C THR A 240 2.789 4.665 0.818 1.00 0.00 C ATOM 165 O THR A 240 2.243 5.568 1.452 1.00 0.00 O ATOM 166 CB THR A 240 5.198 4.465 1.435 1.00 0.00 C ATOM 167 OG1 THR A 240 6.547 4.638 0.985 1.00 0.00 O ATOM 168 CG2 THR A 240 4.993 3.030 1.896 1.00 0.00 C ATOM 0 H THR A 240 4.219 6.913 0.471 1.00 0.00 H new ATOM 0 HA THR A 240 4.376 4.146 -0.534 1.00 0.00 H new ATOM 0 HB THR A 240 5.007 5.131 2.277 1.00 0.00 H new ATOM 0 HG1 THR A 240 7.166 4.409 1.710 1.00 0.00 H new ATOM 0 HG21 THR A 240 5.698 2.800 2.695 1.00 0.00 H new ATOM 0 HG22 THR A 240 3.975 2.908 2.265 1.00 0.00 H new ATOM 0 HG23 THR A 240 5.159 2.352 1.059 1.00 0.00 H new ATOM 176 N LEU A 241 2.190 3.512 0.540 1.00 0.00 N ATOM 177 CA LEU A 241 0.826 3.235 0.975 1.00 0.00 C ATOM 178 C LEU A 241 0.745 1.890 1.691 1.00 0.00 C ATOM 179 O LEU A 241 1.250 0.881 1.198 1.00 0.00 O ATOM 180 CB LEU A 241 -0.124 3.244 -0.224 1.00 0.00 C ATOM 181 CG LEU A 241 -0.532 4.622 -0.747 1.00 0.00 C ATOM 182 CD1 LEU A 241 -1.060 4.519 -2.169 1.00 0.00 C ATOM 183 CD2 LEU A 241 -1.574 5.252 0.166 1.00 0.00 C ATOM 0 H LEU A 241 2.628 2.754 0.016 1.00 0.00 H new ATOM 0 HA LEU A 241 0.528 4.017 1.674 1.00 0.00 H new ATOM 0 HB2 LEU A 241 0.346 2.693 -1.039 1.00 0.00 H new ATOM 0 HB3 LEU A 241 -1.028 2.699 0.050 1.00 0.00 H new ATOM 0 HG LEU A 241 0.350 5.262 -0.755 1.00 0.00 H new ATOM 0 HD11 LEU A 241 -1.345 5.509 -2.524 1.00 0.00 H new ATOM 0 HD12 LEU A 241 -0.284 4.111 -2.817 1.00 0.00 H new ATOM 0 HD13 LEU A 241 -1.930 3.863 -2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 241 -1.853 6.232 -0.222 1.00 0.00 H new ATOM 0 HD22 LEU A 241 -2.456 4.613 0.206 1.00 0.00 H new ATOM 0 HD23 LEU A 241 -1.160 5.362 1.168 1.00 0.00 H new ATOM 195 N TYR A 242 0.106 1.884 2.855 1.00 0.00 N ATOM 196 CA TYR A 242 -0.041 0.664 3.640 1.00 0.00 C ATOM 197 C TYR A 242 -1.289 -0.107 3.220 1.00 0.00 C ATOM 198 O TYR A 242 -2.303 0.484 2.851 1.00 0.00 O ATOM 199 CB TYR A 242 -0.112 0.997 5.131 1.00 0.00 C ATOM 200 CG TYR A 242 -0.862 -0.032 5.946 1.00 0.00 C ATOM 201 CD1 TYR A 242 -2.231 -0.211 5.786 1.00 0.00 C ATOM 202 CD2 TYR A 242 -0.203 -0.825 6.877 1.00 0.00 C ATOM 203 CE1 TYR A 242 -2.921 -1.149 6.529 1.00 0.00 C ATOM 204 CE2 TYR A 242 -0.884 -1.767 7.624 1.00 0.00 C ATOM 205 CZ TYR A 242 -2.243 -1.924 7.447 1.00 0.00 C ATOM 206 OH TYR A 242 -2.926 -2.861 8.188 1.00 0.00 O ATOM 0 H TYR A 242 -0.319 2.710 3.276 1.00 0.00 H new ATOM 0 HA TYR A 242 0.831 0.037 3.456 1.00 0.00 H new ATOM 0 HB2 TYR A 242 0.901 1.090 5.523 1.00 0.00 H new ATOM 0 HB3 TYR A 242 -0.593 1.967 5.256 1.00 0.00 H new ATOM 0 HD1 TYR A 242 -2.765 0.394 5.068 1.00 0.00 H new ATOM 0 HD2 TYR A 242 0.861 -0.703 7.019 1.00 0.00 H new ATOM 0 HE1 TYR A 242 -3.985 -1.275 6.392 1.00 0.00 H new ATOM 0 HE2 TYR A 242 -0.356 -2.377 8.342 1.00 0.00 H new ATOM 0 HH TYR A 242 -2.302 -3.322 8.787 1.00 0.00 H new ATOM 216 N VAL A 243 -1.205 -1.433 3.280 1.00 0.00 N ATOM 217 CA VAL A 243 -2.327 -2.287 2.908 1.00 0.00 C ATOM 218 C VAL A 243 -2.497 -3.433 3.898 1.00 0.00 C ATOM 219 O VAL A 243 -1.539 -4.134 4.224 1.00 0.00 O ATOM 220 CB VAL A 243 -2.145 -2.868 1.493 1.00 0.00 C ATOM 221 CG1 VAL A 243 -3.260 -3.851 1.172 1.00 0.00 C ATOM 222 CG2 VAL A 243 -2.095 -1.751 0.461 1.00 0.00 C ATOM 0 H VAL A 243 -0.372 -1.938 3.582 1.00 0.00 H new ATOM 0 HA VAL A 243 -3.220 -1.662 2.924 1.00 0.00 H new ATOM 0 HB VAL A 243 -1.198 -3.406 1.459 1.00 0.00 H new ATOM 0 HG11 VAL A 243 -3.115 -4.251 0.169 1.00 0.00 H new ATOM 0 HG12 VAL A 243 -3.244 -4.667 1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 243 -4.221 -3.340 1.223 1.00 0.00 H new ATOM 0 HG21 VAL A 243 -1.966 -2.179 -0.533 1.00 0.00 H new ATOM 0 HG22 VAL A 243 -3.025 -1.184 0.494 1.00 0.00 H new ATOM 0 HG23 VAL A 243 -1.258 -1.089 0.682 1.00 0.00 H new ATOM 232 N GLY A 244 -3.724 -3.619 4.375 1.00 0.00 N ATOM 233 CA GLY A 244 -3.998 -4.682 5.324 1.00 0.00 C ATOM 234 C GLY A 244 -5.057 -5.645 4.826 1.00 0.00 C ATOM 235 O GLY A 244 -5.611 -5.464 3.743 1.00 0.00 O ATOM 0 H GLY A 244 -4.533 -3.052 4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 244 -3.078 -5.231 5.526 1.00 0.00 H new ATOM 0 HA3 GLY A 244 -4.323 -4.246 6.269 1.00 0.00 H new ATOM 239 N GLY A 245 -5.339 -6.675 5.619 1.00 0.00 N ATOM 240 CA GLY A 245 -6.336 -7.657 5.234 1.00 0.00 C ATOM 241 C GLY A 245 -5.915 -8.468 4.024 1.00 0.00 C ATOM 242 O GLY A 245 -6.698 -8.658 3.092 1.00 0.00 O ATOM 0 H GLY A 245 -4.895 -6.847 6.521 1.00 0.00 H new ATOM 0 HA2 GLY A 245 -6.521 -8.330 6.072 1.00 0.00 H new ATOM 0 HA3 GLY A 245 -7.276 -7.150 5.018 1.00 0.00 H new ATOM 246 N LEU A 246 -4.676 -8.946 4.037 1.00 0.00 N ATOM 247 CA LEU A 246 -4.151 -9.740 2.932 1.00 0.00 C ATOM 248 C LEU A 246 -4.686 -11.167 2.985 1.00 0.00 C ATOM 249 O LEU A 246 -5.342 -11.631 2.053 1.00 0.00 O ATOM 250 CB LEU A 246 -2.622 -9.754 2.969 1.00 0.00 C ATOM 251 CG LEU A 246 -1.930 -8.435 2.625 1.00 0.00 C ATOM 252 CD1 LEU A 246 -0.419 -8.605 2.636 1.00 0.00 C ATOM 253 CD2 LEU A 246 -2.400 -7.923 1.271 1.00 0.00 C ATOM 0 H LEU A 246 -4.016 -8.798 4.800 1.00 0.00 H new ATOM 0 HA LEU A 246 -4.481 -9.283 1.999 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -2.306 -10.058 3.967 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -2.269 -10.518 2.276 1.00 0.00 H new ATOM 0 HG LEU A 246 -2.198 -7.699 3.383 1.00 0.00 H new ATOM 0 HD11 LEU A 246 0.056 -7.655 2.389 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -0.096 -8.925 3.627 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -0.132 -9.356 1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -1.897 -6.983 1.043 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -2.163 -8.658 0.502 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -3.477 -7.761 1.297 1.00 0.00 H new ATOM 265 N GLY A 247 -4.402 -11.860 4.084 1.00 0.00 N ATOM 266 CA GLY A 247 -4.863 -13.227 4.240 1.00 0.00 C ATOM 267 C GLY A 247 -4.317 -14.149 3.168 1.00 0.00 C ATOM 268 O GLY A 247 -4.087 -13.727 2.034 1.00 0.00 O ATOM 0 H GLY A 247 -3.861 -11.499 4.869 1.00 0.00 H new ATOM 0 HA2 GLY A 247 -4.565 -13.598 5.220 1.00 0.00 H new ATOM 0 HA3 GLY A 247 -5.952 -13.245 4.210 1.00 0.00 H new ATOM 272 N ASP A 248 -4.107 -15.411 3.526 1.00 0.00 N ATOM 273 CA ASP A 248 -3.582 -16.395 2.586 1.00 0.00 C ATOM 274 C ASP A 248 -4.241 -16.245 1.219 1.00 0.00 C ATOM 275 O ASP A 248 -3.661 -16.609 0.195 1.00 0.00 O ATOM 276 CB ASP A 248 -3.805 -17.811 3.121 1.00 0.00 C ATOM 277 CG ASP A 248 -2.678 -18.272 4.024 1.00 0.00 C ATOM 278 OD1 ASP A 248 -1.502 -18.100 3.641 1.00 0.00 O ATOM 279 OD2 ASP A 248 -2.973 -18.805 5.114 1.00 0.00 O ATOM 0 H ASP A 248 -4.292 -15.777 4.460 1.00 0.00 H new ATOM 0 HA ASP A 248 -2.512 -16.221 2.475 1.00 0.00 H new ATOM 0 HB2 ASP A 248 -4.745 -17.844 3.672 1.00 0.00 H new ATOM 0 HB3 ASP A 248 -3.902 -18.502 2.283 1.00 0.00 H new ATOM 284 N THR A 249 -5.457 -15.708 1.208 1.00 0.00 N ATOM 285 CA THR A 249 -6.196 -15.512 -0.032 1.00 0.00 C ATOM 286 C THR A 249 -5.455 -14.565 -0.969 1.00 0.00 C ATOM 287 O THR A 249 -5.324 -14.835 -2.164 1.00 0.00 O ATOM 288 CB THR A 249 -7.606 -14.953 0.235 1.00 0.00 C ATOM 289 OG1 THR A 249 -7.514 -13.711 0.943 1.00 0.00 O ATOM 290 CG2 THR A 249 -8.436 -15.941 1.040 1.00 0.00 C ATOM 0 H THR A 249 -5.951 -15.401 2.046 1.00 0.00 H new ATOM 0 HA THR A 249 -6.286 -16.490 -0.504 1.00 0.00 H new ATOM 0 HB THR A 249 -8.096 -14.789 -0.725 1.00 0.00 H new ATOM 0 HG1 THR A 249 -8.108 -13.734 1.722 1.00 0.00 H new ATOM 0 HG21 THR A 249 -9.428 -15.524 1.216 1.00 0.00 H new ATOM 0 HG22 THR A 249 -8.528 -16.875 0.486 1.00 0.00 H new ATOM 0 HG23 THR A 249 -7.948 -16.133 1.996 1.00 0.00 H new ATOM 298 N ILE A 250 -4.973 -13.454 -0.421 1.00 0.00 N ATOM 299 CA ILE A 250 -4.244 -12.468 -1.208 1.00 0.00 C ATOM 300 C ILE A 250 -2.737 -12.660 -1.071 1.00 0.00 C ATOM 301 O ILE A 250 -2.248 -13.097 -0.029 1.00 0.00 O ATOM 302 CB ILE A 250 -4.608 -11.032 -0.789 1.00 0.00 C ATOM 303 CG1 ILE A 250 -6.116 -10.807 -0.916 1.00 0.00 C ATOM 304 CG2 ILE A 250 -3.843 -10.023 -1.633 1.00 0.00 C ATOM 305 CD1 ILE A 250 -6.613 -9.600 -0.152 1.00 0.00 C ATOM 0 H ILE A 250 -5.075 -13.215 0.565 1.00 0.00 H new ATOM 0 HA ILE A 250 -4.534 -12.618 -2.248 1.00 0.00 H new ATOM 0 HB ILE A 250 -4.325 -10.891 0.254 1.00 0.00 H new ATOM 0 HG12 ILE A 250 -6.370 -10.690 -1.969 1.00 0.00 H new ATOM 0 HG13 ILE A 250 -6.639 -11.694 -0.558 1.00 0.00 H new ATOM 0 HG21 ILE A 250 -4.111 -9.013 -1.324 1.00 0.00 H new ATOM 0 HG22 ILE A 250 -2.772 -10.172 -1.496 1.00 0.00 H new ATOM 0 HG23 ILE A 250 -4.097 -10.161 -2.684 1.00 0.00 H new ATOM 0 HD11 ILE A 250 -7.690 -9.502 -0.287 1.00 0.00 H new ATOM 0 HD12 ILE A 250 -6.390 -9.723 0.908 1.00 0.00 H new ATOM 0 HD13 ILE A 250 -6.117 -8.704 -0.525 1.00 0.00 H new ATOM 317 N THR A 251 -2.005 -12.328 -2.129 1.00 0.00 N ATOM 318 CA THR A 251 -0.553 -12.462 -2.127 1.00 0.00 C ATOM 319 C THR A 251 0.119 -11.165 -2.563 1.00 0.00 C ATOM 320 O THR A 251 -0.548 -10.159 -2.799 1.00 0.00 O ATOM 321 CB THR A 251 -0.094 -13.603 -3.055 1.00 0.00 C ATOM 322 OG1 THR A 251 -0.319 -13.243 -4.422 1.00 0.00 O ATOM 323 CG2 THR A 251 -0.835 -14.892 -2.735 1.00 0.00 C ATOM 0 H THR A 251 -2.394 -11.964 -2.999 1.00 0.00 H new ATOM 0 HA THR A 251 -0.257 -12.694 -1.104 1.00 0.00 H new ATOM 0 HB THR A 251 0.972 -13.766 -2.894 1.00 0.00 H new ATOM 0 HG1 THR A 251 -0.023 -13.973 -5.005 1.00 0.00 H new ATOM 0 HG21 THR A 251 -0.494 -15.683 -3.403 1.00 0.00 H new ATOM 0 HG22 THR A 251 -0.637 -15.179 -1.702 1.00 0.00 H new ATOM 0 HG23 THR A 251 -1.906 -14.739 -2.870 1.00 0.00 H new ATOM 331 N GLU A 252 1.444 -11.198 -2.667 1.00 0.00 N ATOM 332 CA GLU A 252 2.207 -10.023 -3.075 1.00 0.00 C ATOM 333 C GLU A 252 1.908 -9.657 -4.526 1.00 0.00 C ATOM 334 O GLU A 252 1.442 -8.555 -4.817 1.00 0.00 O ATOM 335 CB GLU A 252 3.706 -10.275 -2.899 1.00 0.00 C ATOM 336 CG GLU A 252 4.579 -9.160 -3.451 1.00 0.00 C ATOM 337 CD GLU A 252 6.058 -9.420 -3.243 1.00 0.00 C ATOM 338 OE1 GLU A 252 6.523 -9.303 -2.090 1.00 0.00 O ATOM 339 OE2 GLU A 252 6.750 -9.740 -4.232 1.00 0.00 O ATOM 0 H GLU A 252 2.011 -12.024 -2.475 1.00 0.00 H new ATOM 0 HA GLU A 252 1.909 -9.189 -2.440 1.00 0.00 H new ATOM 0 HB2 GLU A 252 3.922 -10.403 -1.838 1.00 0.00 H new ATOM 0 HB3 GLU A 252 3.969 -11.210 -3.393 1.00 0.00 H new ATOM 0 HG2 GLU A 252 4.381 -9.042 -4.516 1.00 0.00 H new ATOM 0 HG3 GLU A 252 4.308 -8.220 -2.971 1.00 0.00 H new ATOM 346 N THR A 253 2.179 -10.590 -5.433 1.00 0.00 N ATOM 347 CA THR A 253 1.942 -10.366 -6.854 1.00 0.00 C ATOM 348 C THR A 253 0.611 -9.659 -7.084 1.00 0.00 C ATOM 349 O THR A 253 0.558 -8.605 -7.718 1.00 0.00 O ATOM 350 CB THR A 253 1.950 -11.690 -7.640 1.00 0.00 C ATOM 351 OG1 THR A 253 3.218 -12.340 -7.493 1.00 0.00 O ATOM 352 CG2 THR A 253 1.668 -11.446 -9.115 1.00 0.00 C ATOM 0 H THR A 253 2.563 -11.508 -5.209 1.00 0.00 H new ATOM 0 HA THR A 253 2.753 -9.734 -7.214 1.00 0.00 H new ATOM 0 HB THR A 253 1.165 -12.330 -7.237 1.00 0.00 H new ATOM 0 HG1 THR A 253 3.214 -13.182 -7.994 1.00 0.00 H new ATOM 0 HG21 THR A 253 1.679 -12.396 -9.650 1.00 0.00 H new ATOM 0 HG22 THR A 253 0.690 -10.978 -9.226 1.00 0.00 H new ATOM 0 HG23 THR A 253 2.433 -10.789 -9.528 1.00 0.00 H new ATOM 360 N ASP A 254 -0.462 -10.246 -6.565 1.00 0.00 N ATOM 361 CA ASP A 254 -1.795 -9.671 -6.712 1.00 0.00 C ATOM 362 C ASP A 254 -1.760 -8.159 -6.511 1.00 0.00 C ATOM 363 O ASP A 254 -2.329 -7.404 -7.300 1.00 0.00 O ATOM 364 CB ASP A 254 -2.762 -10.309 -5.714 1.00 0.00 C ATOM 365 CG ASP A 254 -3.433 -11.550 -6.270 1.00 0.00 C ATOM 366 OD1 ASP A 254 -3.957 -11.484 -7.402 1.00 0.00 O ATOM 367 OD2 ASP A 254 -3.435 -12.586 -5.573 1.00 0.00 O ATOM 0 H ASP A 254 -0.435 -11.119 -6.039 1.00 0.00 H new ATOM 0 HA ASP A 254 -2.143 -9.877 -7.724 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -2.221 -10.569 -4.804 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -3.524 -9.581 -5.435 1.00 0.00 H new ATOM 372 N LEU A 255 -1.089 -7.725 -5.450 1.00 0.00 N ATOM 373 CA LEU A 255 -0.980 -6.303 -5.144 1.00 0.00 C ATOM 374 C LEU A 255 -0.044 -5.604 -6.125 1.00 0.00 C ATOM 375 O LEU A 255 -0.414 -4.612 -6.752 1.00 0.00 O ATOM 376 CB LEU A 255 -0.476 -6.106 -3.713 1.00 0.00 C ATOM 377 CG LEU A 255 -1.161 -6.951 -2.638 1.00 0.00 C ATOM 378 CD1 LEU A 255 -0.423 -6.831 -1.314 1.00 0.00 C ATOM 379 CD2 LEU A 255 -2.616 -6.536 -2.480 1.00 0.00 C ATOM 0 H LEU A 255 -0.612 -8.337 -4.787 1.00 0.00 H new ATOM 0 HA LEU A 255 -1.971 -5.860 -5.238 1.00 0.00 H new ATOM 0 HB2 LEU A 255 0.592 -6.323 -3.692 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -0.592 -5.055 -3.450 1.00 0.00 H new ATOM 0 HG LEU A 255 -1.134 -7.995 -2.952 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -0.925 -7.439 -0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 255 0.603 -7.179 -1.436 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -0.417 -5.789 -0.994 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -3.087 -7.148 -1.711 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -2.666 -5.487 -2.190 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -3.139 -6.676 -3.426 1.00 0.00 H new ATOM 391 N ARG A 256 1.170 -6.130 -6.253 1.00 0.00 N ATOM 392 CA ARG A 256 2.159 -5.558 -7.159 1.00 0.00 C ATOM 393 C ARG A 256 1.516 -5.161 -8.485 1.00 0.00 C ATOM 394 O ARG A 256 1.758 -4.071 -9.001 1.00 0.00 O ATOM 395 CB ARG A 256 3.292 -6.556 -7.407 1.00 0.00 C ATOM 396 CG ARG A 256 4.310 -6.078 -8.430 1.00 0.00 C ATOM 397 CD ARG A 256 5.298 -7.178 -8.787 1.00 0.00 C ATOM 398 NE ARG A 256 6.423 -7.225 -7.856 1.00 0.00 N ATOM 399 CZ ARG A 256 7.375 -6.300 -7.806 1.00 0.00 C ATOM 400 NH1 ARG A 256 7.337 -5.260 -8.628 1.00 0.00 N ATOM 401 NH2 ARG A 256 8.366 -6.413 -6.931 1.00 0.00 N ATOM 0 H ARG A 256 1.492 -6.951 -5.741 1.00 0.00 H new ATOM 0 HA ARG A 256 2.569 -4.663 -6.692 1.00 0.00 H new ATOM 0 HB2 ARG A 256 3.802 -6.755 -6.465 1.00 0.00 H new ATOM 0 HB3 ARG A 256 2.866 -7.501 -7.745 1.00 0.00 H new ATOM 0 HG2 ARG A 256 3.794 -5.744 -9.330 1.00 0.00 H new ATOM 0 HG3 ARG A 256 4.849 -5.217 -8.034 1.00 0.00 H new ATOM 0 HD2 ARG A 256 4.786 -8.140 -8.786 1.00 0.00 H new ATOM 0 HD3 ARG A 256 5.671 -7.017 -9.799 1.00 0.00 H new ATOM 0 HE ARG A 256 6.481 -8.011 -7.209 1.00 0.00 H new ATOM 0 HH11 ARG A 256 6.576 -5.169 -9.301 1.00 0.00 H new ATOM 0 HH12 ARG A 256 8.069 -4.551 -8.588 1.00 0.00 H new ATOM 0 HH21 ARG A 256 8.397 -7.211 -6.296 1.00 0.00 H new ATOM 0 HH22 ARG A 256 9.097 -5.702 -6.893 1.00 0.00 H new ATOM 415 N ASN A 257 0.697 -6.054 -9.030 1.00 0.00 N ATOM 416 CA ASN A 257 0.020 -5.797 -10.296 1.00 0.00 C ATOM 417 C ASN A 257 -1.144 -4.830 -10.105 1.00 0.00 C ATOM 418 O ASN A 257 -1.347 -3.918 -10.907 1.00 0.00 O ATOM 419 CB ASN A 257 -0.485 -7.107 -10.904 1.00 0.00 C ATOM 420 CG ASN A 257 0.601 -7.854 -11.653 1.00 0.00 C ATOM 421 OD1 ASN A 257 1.221 -7.315 -12.570 1.00 0.00 O ATOM 422 ND2 ASN A 257 0.837 -9.102 -11.265 1.00 0.00 N ATOM 0 H ASN A 257 0.486 -6.962 -8.615 1.00 0.00 H new ATOM 0 HA ASN A 257 0.739 -5.342 -10.977 1.00 0.00 H new ATOM 0 HB2 ASN A 257 -0.880 -7.743 -10.112 1.00 0.00 H new ATOM 0 HB3 ASN A 257 -1.311 -6.894 -11.583 1.00 0.00 H new ATOM 0 HD21 ASN A 257 1.557 -9.654 -11.732 1.00 0.00 H new ATOM 0 HD22 ASN A 257 0.299 -9.509 -10.500 1.00 0.00 H new ATOM 429 N HIS A 258 -1.907 -5.035 -9.035 1.00 0.00 N ATOM 430 CA HIS A 258 -3.050 -4.180 -8.737 1.00 0.00 C ATOM 431 C HIS A 258 -2.624 -2.719 -8.629 1.00 0.00 C ATOM 432 O HIS A 258 -3.375 -1.814 -8.994 1.00 0.00 O ATOM 433 CB HIS A 258 -3.721 -4.625 -7.437 1.00 0.00 C ATOM 434 CG HIS A 258 -5.126 -4.130 -7.288 1.00 0.00 C ATOM 435 ND1 HIS A 258 -5.447 -2.792 -7.196 1.00 0.00 N ATOM 436 CD2 HIS A 258 -6.299 -4.802 -7.216 1.00 0.00 C ATOM 437 CE1 HIS A 258 -6.756 -2.663 -7.073 1.00 0.00 C ATOM 438 NE2 HIS A 258 -7.297 -3.868 -7.082 1.00 0.00 N ATOM 0 H HIS A 258 -1.754 -5.785 -8.361 1.00 0.00 H new ATOM 0 HA HIS A 258 -3.763 -4.272 -9.556 1.00 0.00 H new ATOM 0 HB2 HIS A 258 -3.722 -5.714 -7.393 1.00 0.00 H new ATOM 0 HB3 HIS A 258 -3.129 -4.272 -6.593 1.00 0.00 H new ATOM 0 HD1 HIS A 258 -4.778 -2.022 -7.219 1.00 0.00 H new ATOM 0 HD2 HIS A 258 -6.426 -5.874 -7.256 1.00 0.00 H new ATOM 0 HE1 HIS A 258 -7.293 -1.730 -6.981 1.00 0.00 H new ATOM 446 N PHE A 259 -1.414 -2.497 -8.125 1.00 0.00 N ATOM 447 CA PHE A 259 -0.889 -1.146 -7.967 1.00 0.00 C ATOM 448 C PHE A 259 -0.049 -0.745 -9.176 1.00 0.00 C ATOM 449 O PHE A 259 -0.167 0.370 -9.686 1.00 0.00 O ATOM 450 CB PHE A 259 -0.047 -1.049 -6.693 1.00 0.00 C ATOM 451 CG PHE A 259 -0.861 -1.106 -5.432 1.00 0.00 C ATOM 452 CD1 PHE A 259 -1.632 -0.023 -5.039 1.00 0.00 C ATOM 453 CD2 PHE A 259 -0.856 -2.242 -4.639 1.00 0.00 C ATOM 454 CE1 PHE A 259 -2.381 -0.073 -3.879 1.00 0.00 C ATOM 455 CE2 PHE A 259 -1.603 -2.297 -3.477 1.00 0.00 C ATOM 456 CZ PHE A 259 -2.368 -1.211 -3.098 1.00 0.00 C ATOM 0 H PHE A 259 -0.779 -3.235 -7.819 1.00 0.00 H new ATOM 0 HA PHE A 259 -1.734 -0.461 -7.889 1.00 0.00 H new ATOM 0 HB2 PHE A 259 0.680 -1.862 -6.684 1.00 0.00 H new ATOM 0 HB3 PHE A 259 0.518 -0.117 -6.710 1.00 0.00 H new ATOM 0 HD1 PHE A 259 -1.647 0.870 -5.646 1.00 0.00 H new ATOM 0 HD2 PHE A 259 -0.262 -3.095 -4.932 1.00 0.00 H new ATOM 0 HE1 PHE A 259 -2.976 0.778 -3.583 1.00 0.00 H new ATOM 0 HE2 PHE A 259 -1.588 -3.188 -2.866 1.00 0.00 H new ATOM 0 HZ PHE A 259 -2.955 -1.252 -2.192 1.00 0.00 H new ATOM 466 N TYR A 260 0.799 -1.660 -9.630 1.00 0.00 N ATOM 467 CA TYR A 260 1.662 -1.402 -10.777 1.00 0.00 C ATOM 468 C TYR A 260 0.915 -0.624 -11.856 1.00 0.00 C ATOM 469 O TYR A 260 1.487 0.238 -12.523 1.00 0.00 O ATOM 470 CB TYR A 260 2.187 -2.718 -11.353 1.00 0.00 C ATOM 471 CG TYR A 260 2.420 -2.675 -12.847 1.00 0.00 C ATOM 472 CD1 TYR A 260 3.494 -1.973 -13.382 1.00 0.00 C ATOM 473 CD2 TYR A 260 1.567 -3.335 -13.723 1.00 0.00 C ATOM 474 CE1 TYR A 260 3.711 -1.930 -14.745 1.00 0.00 C ATOM 475 CE2 TYR A 260 1.777 -3.298 -15.087 1.00 0.00 C ATOM 476 CZ TYR A 260 2.850 -2.594 -15.594 1.00 0.00 C ATOM 477 OH TYR A 260 3.062 -2.555 -16.953 1.00 0.00 O ATOM 0 H TYR A 260 0.908 -2.588 -9.221 1.00 0.00 H new ATOM 0 HA TYR A 260 2.505 -0.800 -10.437 1.00 0.00 H new ATOM 0 HB2 TYR A 260 3.122 -2.975 -10.855 1.00 0.00 H new ATOM 0 HB3 TYR A 260 1.476 -3.513 -11.127 1.00 0.00 H new ATOM 0 HD1 TYR A 260 4.170 -1.452 -12.720 1.00 0.00 H new ATOM 0 HD2 TYR A 260 0.725 -3.886 -13.330 1.00 0.00 H new ATOM 0 HE1 TYR A 260 4.550 -1.380 -15.144 1.00 0.00 H new ATOM 0 HE2 TYR A 260 1.105 -3.817 -15.754 1.00 0.00 H new ATOM 0 HH TYR A 260 2.366 -3.075 -17.408 1.00 0.00 H new ATOM 487 N GLN A 261 -0.367 -0.934 -12.020 1.00 0.00 N ATOM 488 CA GLN A 261 -1.193 -0.264 -13.017 1.00 0.00 C ATOM 489 C GLN A 261 -1.092 1.251 -12.879 1.00 0.00 C ATOM 490 O GLN A 261 -0.910 1.964 -13.867 1.00 0.00 O ATOM 491 CB GLN A 261 -2.652 -0.704 -12.881 1.00 0.00 C ATOM 492 CG GLN A 261 -3.280 -0.323 -11.550 1.00 0.00 C ATOM 493 CD GLN A 261 -4.561 -1.083 -11.270 1.00 0.00 C ATOM 494 OE1 GLN A 261 -4.922 -2.005 -12.003 1.00 0.00 O ATOM 495 NE2 GLN A 261 -5.256 -0.701 -10.205 1.00 0.00 N ATOM 0 H GLN A 261 -0.856 -1.645 -11.475 1.00 0.00 H new ATOM 0 HA GLN A 261 -0.826 -0.546 -14.004 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -3.234 -0.259 -13.688 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -2.710 -1.785 -13.004 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -2.567 -0.513 -10.748 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -3.488 0.747 -11.544 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -4.920 0.068 -9.625 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -6.126 -1.177 -9.966 1.00 0.00 H new ATOM 504 N PHE A 262 -1.210 1.738 -11.648 1.00 0.00 N ATOM 505 CA PHE A 262 -1.133 3.169 -11.381 1.00 0.00 C ATOM 506 C PHE A 262 0.195 3.742 -11.867 1.00 0.00 C ATOM 507 O PHE A 262 0.234 4.789 -12.511 1.00 0.00 O ATOM 508 CB PHE A 262 -1.302 3.440 -9.885 1.00 0.00 C ATOM 509 CG PHE A 262 -2.701 3.213 -9.389 1.00 0.00 C ATOM 510 CD1 PHE A 262 -3.712 4.111 -9.690 1.00 0.00 C ATOM 511 CD2 PHE A 262 -3.005 2.101 -8.620 1.00 0.00 C ATOM 512 CE1 PHE A 262 -5.001 3.904 -9.236 1.00 0.00 C ATOM 513 CE2 PHE A 262 -4.292 1.889 -8.163 1.00 0.00 C ATOM 514 CZ PHE A 262 -5.291 2.792 -8.470 1.00 0.00 C ATOM 0 H PHE A 262 -1.359 1.162 -10.820 1.00 0.00 H new ATOM 0 HA PHE A 262 -1.941 3.659 -11.925 1.00 0.00 H new ATOM 0 HB2 PHE A 262 -0.619 2.798 -9.328 1.00 0.00 H new ATOM 0 HB3 PHE A 262 -1.014 4.470 -9.676 1.00 0.00 H new ATOM 0 HD1 PHE A 262 -3.490 4.983 -10.287 1.00 0.00 H new ATOM 0 HD2 PHE A 262 -2.228 1.392 -8.375 1.00 0.00 H new ATOM 0 HE1 PHE A 262 -5.780 4.611 -9.480 1.00 0.00 H new ATOM 0 HE2 PHE A 262 -4.516 1.017 -7.566 1.00 0.00 H new ATOM 0 HZ PHE A 262 -6.297 2.629 -8.112 1.00 0.00 H new ATOM 524 N GLY A 263 1.284 3.047 -11.551 1.00 0.00 N ATOM 525 CA GLY A 263 2.599 3.501 -11.962 1.00 0.00 C ATOM 526 C GLY A 263 3.695 2.525 -11.580 1.00 0.00 C ATOM 527 O GLY A 263 3.435 1.340 -11.377 1.00 0.00 O ATOM 0 H GLY A 263 1.278 2.178 -11.018 1.00 0.00 H new ATOM 0 HA2 GLY A 263 2.608 3.648 -13.042 1.00 0.00 H new ATOM 0 HA3 GLY A 263 2.804 4.470 -11.506 1.00 0.00 H new ATOM 531 N GLU A 264 4.923 3.025 -11.485 1.00 0.00 N ATOM 532 CA GLU A 264 6.062 2.187 -11.128 1.00 0.00 C ATOM 533 C GLU A 264 6.128 1.973 -9.618 1.00 0.00 C ATOM 534 O GLU A 264 6.038 2.924 -8.841 1.00 0.00 O ATOM 535 CB GLU A 264 7.364 2.821 -11.621 1.00 0.00 C ATOM 536 CG GLU A 264 8.604 2.016 -11.270 1.00 0.00 C ATOM 537 CD GLU A 264 9.789 2.353 -12.155 1.00 0.00 C ATOM 538 OE1 GLU A 264 10.144 3.546 -12.244 1.00 0.00 O ATOM 539 OE2 GLU A 264 10.360 1.421 -12.760 1.00 0.00 O ATOM 0 H GLU A 264 5.154 4.005 -11.650 1.00 0.00 H new ATOM 0 HA GLU A 264 5.933 1.218 -11.610 1.00 0.00 H new ATOM 0 HB2 GLU A 264 7.313 2.941 -12.703 1.00 0.00 H new ATOM 0 HB3 GLU A 264 7.456 3.820 -11.194 1.00 0.00 H new ATOM 0 HG2 GLU A 264 8.869 2.200 -10.229 1.00 0.00 H new ATOM 0 HG3 GLU A 264 8.380 0.953 -11.359 1.00 0.00 H new ATOM 546 N ILE A 265 6.285 0.718 -9.211 1.00 0.00 N ATOM 547 CA ILE A 265 6.363 0.378 -7.796 1.00 0.00 C ATOM 548 C ILE A 265 7.812 0.232 -7.345 1.00 0.00 C ATOM 549 O ILE A 265 8.511 -0.694 -7.758 1.00 0.00 O ATOM 550 CB ILE A 265 5.607 -0.927 -7.488 1.00 0.00 C ATOM 551 CG1 ILE A 265 4.121 -0.772 -7.816 1.00 0.00 C ATOM 552 CG2 ILE A 265 5.794 -1.316 -6.029 1.00 0.00 C ATOM 553 CD1 ILE A 265 3.399 -2.090 -7.988 1.00 0.00 C ATOM 0 H ILE A 265 6.361 -0.080 -9.841 1.00 0.00 H new ATOM 0 HA ILE A 265 5.895 1.196 -7.249 1.00 0.00 H new ATOM 0 HB ILE A 265 6.017 -1.722 -8.112 1.00 0.00 H new ATOM 0 HG12 ILE A 265 3.639 -0.204 -7.020 1.00 0.00 H new ATOM 0 HG13 ILE A 265 4.018 -0.189 -8.731 1.00 0.00 H new ATOM 0 HG21 ILE A 265 5.253 -2.241 -5.827 1.00 0.00 H new ATOM 0 HG22 ILE A 265 6.854 -1.464 -5.825 1.00 0.00 H new ATOM 0 HG23 ILE A 265 5.408 -0.523 -5.389 1.00 0.00 H new ATOM 0 HD11 ILE A 265 2.350 -1.903 -8.219 1.00 0.00 H new ATOM 0 HD12 ILE A 265 3.855 -2.651 -8.803 1.00 0.00 H new ATOM 0 HD13 ILE A 265 3.470 -2.667 -7.066 1.00 0.00 H new ATOM 565 N ARG A 266 8.257 1.151 -6.494 1.00 0.00 N ATOM 566 CA ARG A 266 9.624 1.124 -5.986 1.00 0.00 C ATOM 567 C ARG A 266 9.914 -0.196 -5.277 1.00 0.00 C ATOM 568 O ARG A 266 10.919 -0.853 -5.550 1.00 0.00 O ATOM 569 CB ARG A 266 9.857 2.293 -5.027 1.00 0.00 C ATOM 570 CG ARG A 266 10.404 3.537 -5.707 1.00 0.00 C ATOM 571 CD ARG A 266 11.112 4.448 -4.715 1.00 0.00 C ATOM 572 NE ARG A 266 11.848 5.517 -5.383 1.00 0.00 N ATOM 573 CZ ARG A 266 12.721 6.306 -4.765 1.00 0.00 C ATOM 574 NH1 ARG A 266 12.965 6.145 -3.472 1.00 0.00 N ATOM 575 NH2 ARG A 266 13.352 7.257 -5.441 1.00 0.00 N ATOM 0 H ARG A 266 7.691 1.923 -6.142 1.00 0.00 H new ATOM 0 HA ARG A 266 10.303 1.218 -6.834 1.00 0.00 H new ATOM 0 HB2 ARG A 266 8.917 2.542 -4.535 1.00 0.00 H new ATOM 0 HB3 ARG A 266 10.552 1.980 -4.247 1.00 0.00 H new ATOM 0 HG2 ARG A 266 11.098 3.247 -6.496 1.00 0.00 H new ATOM 0 HG3 ARG A 266 9.589 4.081 -6.184 1.00 0.00 H new ATOM 0 HD2 ARG A 266 10.379 4.882 -4.035 1.00 0.00 H new ATOM 0 HD3 ARG A 266 11.800 3.859 -4.108 1.00 0.00 H new ATOM 0 HE ARG A 266 11.683 5.667 -6.378 1.00 0.00 H new ATOM 0 HH11 ARG A 266 12.482 5.414 -2.949 1.00 0.00 H new ATOM 0 HH12 ARG A 266 13.635 6.752 -3.000 1.00 0.00 H new ATOM 0 HH21 ARG A 266 13.167 7.383 -6.436 1.00 0.00 H new ATOM 0 HH22 ARG A 266 14.022 7.862 -4.966 1.00 0.00 H new ATOM 589 N THR A 267 9.027 -0.578 -4.362 1.00 0.00 N ATOM 590 CA THR A 267 9.189 -1.817 -3.612 1.00 0.00 C ATOM 591 C THR A 267 7.883 -2.228 -2.942 1.00 0.00 C ATOM 592 O THR A 267 6.929 -1.450 -2.891 1.00 0.00 O ATOM 593 CB THR A 267 10.284 -1.684 -2.538 1.00 0.00 C ATOM 594 OG1 THR A 267 10.741 -2.982 -2.141 1.00 0.00 O ATOM 595 CG2 THR A 267 9.763 -0.931 -1.323 1.00 0.00 C ATOM 0 H THR A 267 8.190 -0.047 -4.123 1.00 0.00 H new ATOM 0 HA THR A 267 9.484 -2.584 -4.328 1.00 0.00 H new ATOM 0 HB THR A 267 11.114 -1.122 -2.965 1.00 0.00 H new ATOM 0 HG1 THR A 267 11.439 -2.889 -1.459 1.00 0.00 H new ATOM 0 HG21 THR A 267 10.555 -0.850 -0.578 1.00 0.00 H new ATOM 0 HG22 THR A 267 9.443 0.067 -1.623 1.00 0.00 H new ATOM 0 HG23 THR A 267 8.917 -1.470 -0.896 1.00 0.00 H new ATOM 603 N ILE A 268 7.846 -3.453 -2.430 1.00 0.00 N ATOM 604 CA ILE A 268 6.657 -3.966 -1.762 1.00 0.00 C ATOM 605 C ILE A 268 7.030 -4.894 -0.611 1.00 0.00 C ATOM 606 O ILE A 268 7.547 -5.992 -0.825 1.00 0.00 O ATOM 607 CB ILE A 268 5.743 -4.725 -2.742 1.00 0.00 C ATOM 608 CG1 ILE A 268 5.271 -3.792 -3.859 1.00 0.00 C ATOM 609 CG2 ILE A 268 4.554 -5.321 -2.004 1.00 0.00 C ATOM 610 CD1 ILE A 268 4.458 -4.491 -4.926 1.00 0.00 C ATOM 0 H ILE A 268 8.626 -4.109 -2.465 1.00 0.00 H new ATOM 0 HA ILE A 268 6.119 -3.103 -1.370 1.00 0.00 H new ATOM 0 HB ILE A 268 6.312 -5.539 -3.190 1.00 0.00 H new ATOM 0 HG12 ILE A 268 4.673 -2.991 -3.424 1.00 0.00 H new ATOM 0 HG13 ILE A 268 6.140 -3.325 -4.323 1.00 0.00 H new ATOM 0 HG21 ILE A 268 3.917 -5.854 -2.710 1.00 0.00 H new ATOM 0 HG22 ILE A 268 4.909 -6.014 -1.241 1.00 0.00 H new ATOM 0 HG23 ILE A 268 3.982 -4.523 -1.531 1.00 0.00 H new ATOM 0 HD11 ILE A 268 4.157 -3.769 -5.685 1.00 0.00 H new ATOM 0 HD12 ILE A 268 5.060 -5.274 -5.388 1.00 0.00 H new ATOM 0 HD13 ILE A 268 3.570 -4.934 -4.475 1.00 0.00 H new ATOM 622 N THR A 269 6.765 -4.447 0.613 1.00 0.00 N ATOM 623 CA THR A 269 7.072 -5.237 1.799 1.00 0.00 C ATOM 624 C THR A 269 5.818 -5.897 2.360 1.00 0.00 C ATOM 625 O THR A 269 5.011 -5.252 3.031 1.00 0.00 O ATOM 626 CB THR A 269 7.718 -4.373 2.898 1.00 0.00 C ATOM 627 OG1 THR A 269 8.906 -3.749 2.395 1.00 0.00 O ATOM 628 CG2 THR A 269 8.059 -5.214 4.118 1.00 0.00 C ATOM 0 H THR A 269 6.338 -3.541 0.809 1.00 0.00 H new ATOM 0 HA THR A 269 7.778 -6.008 1.491 1.00 0.00 H new ATOM 0 HB THR A 269 7.002 -3.606 3.194 1.00 0.00 H new ATOM 0 HG1 THR A 269 9.310 -3.200 3.099 1.00 0.00 H new ATOM 0 HG21 THR A 269 8.514 -4.582 4.880 1.00 0.00 H new ATOM 0 HG22 THR A 269 7.149 -5.664 4.516 1.00 0.00 H new ATOM 0 HG23 THR A 269 8.759 -6.000 3.834 1.00 0.00 H new ATOM 636 N VAL A 270 5.659 -7.187 2.082 1.00 0.00 N ATOM 637 CA VAL A 270 4.502 -7.936 2.560 1.00 0.00 C ATOM 638 C VAL A 270 4.788 -8.584 3.910 1.00 0.00 C ATOM 639 O VAL A 270 5.637 -9.469 4.019 1.00 0.00 O ATOM 640 CB VAL A 270 4.086 -9.027 1.557 1.00 0.00 C ATOM 641 CG1 VAL A 270 2.862 -9.777 2.060 1.00 0.00 C ATOM 642 CG2 VAL A 270 3.823 -8.419 0.187 1.00 0.00 C ATOM 0 H VAL A 270 6.317 -7.736 1.528 1.00 0.00 H new ATOM 0 HA VAL A 270 3.685 -7.223 2.668 1.00 0.00 H new ATOM 0 HB VAL A 270 4.905 -9.740 1.462 1.00 0.00 H new ATOM 0 HG11 VAL A 270 2.583 -10.544 1.338 1.00 0.00 H new ATOM 0 HG12 VAL A 270 3.090 -10.246 3.017 1.00 0.00 H new ATOM 0 HG13 VAL A 270 2.034 -9.079 2.186 1.00 0.00 H new ATOM 0 HG21 VAL A 270 3.530 -9.205 -0.510 1.00 0.00 H new ATOM 0 HG22 VAL A 270 3.022 -7.684 0.263 1.00 0.00 H new ATOM 0 HG23 VAL A 270 4.729 -7.932 -0.175 1.00 0.00 H new ATOM 652 N VAL A 271 4.073 -8.138 4.938 1.00 0.00 N ATOM 653 CA VAL A 271 4.248 -8.676 6.282 1.00 0.00 C ATOM 654 C VAL A 271 3.138 -9.662 6.628 1.00 0.00 C ATOM 655 O VAL A 271 2.032 -9.263 6.992 1.00 0.00 O ATOM 656 CB VAL A 271 4.271 -7.554 7.337 1.00 0.00 C ATOM 657 CG1 VAL A 271 4.747 -8.092 8.678 1.00 0.00 C ATOM 658 CG2 VAL A 271 5.152 -6.404 6.872 1.00 0.00 C ATOM 0 H VAL A 271 3.367 -7.405 4.866 1.00 0.00 H new ATOM 0 HA VAL A 271 5.207 -9.194 6.293 1.00 0.00 H new ATOM 0 HB VAL A 271 3.256 -7.177 7.463 1.00 0.00 H new ATOM 0 HG11 VAL A 271 4.757 -7.285 9.411 1.00 0.00 H new ATOM 0 HG12 VAL A 271 4.073 -8.880 9.014 1.00 0.00 H new ATOM 0 HG13 VAL A 271 5.753 -8.497 8.571 1.00 0.00 H new ATOM 0 HG21 VAL A 271 5.157 -5.620 7.629 1.00 0.00 H new ATOM 0 HG22 VAL A 271 6.169 -6.765 6.716 1.00 0.00 H new ATOM 0 HG23 VAL A 271 4.762 -6.002 5.937 1.00 0.00 H new ATOM 668 N GLN A 272 3.441 -10.951 6.513 1.00 0.00 N ATOM 669 CA GLN A 272 2.468 -11.994 6.814 1.00 0.00 C ATOM 670 C GLN A 272 2.003 -11.902 8.263 1.00 0.00 C ATOM 671 O GLN A 272 0.810 -12.011 8.551 1.00 0.00 O ATOM 672 CB GLN A 272 3.069 -13.374 6.545 1.00 0.00 C ATOM 673 CG GLN A 272 4.470 -13.548 7.110 1.00 0.00 C ATOM 674 CD GLN A 272 4.983 -14.968 6.970 1.00 0.00 C ATOM 675 OE1 GLN A 272 4.812 -15.793 7.868 1.00 0.00 O ATOM 676 NE2 GLN A 272 5.616 -15.261 5.840 1.00 0.00 N ATOM 0 H GLN A 272 4.352 -11.298 6.214 1.00 0.00 H new ATOM 0 HA GLN A 272 1.605 -11.849 6.165 1.00 0.00 H new ATOM 0 HB2 GLN A 272 2.416 -14.135 6.973 1.00 0.00 H new ATOM 0 HB3 GLN A 272 3.096 -13.546 5.469 1.00 0.00 H new ATOM 0 HG2 GLN A 272 5.151 -12.868 6.599 1.00 0.00 H new ATOM 0 HG3 GLN A 272 4.470 -13.268 8.163 1.00 0.00 H new ATOM 0 HE21 GLN A 272 5.735 -14.546 5.122 1.00 0.00 H new ATOM 0 HE22 GLN A 272 5.983 -16.201 5.690 1.00 0.00 H new ATOM 685 N ARG A 273 2.951 -11.701 9.173 1.00 0.00 N ATOM 686 CA ARG A 273 2.638 -11.597 10.593 1.00 0.00 C ATOM 687 C ARG A 273 1.557 -10.547 10.835 1.00 0.00 C ATOM 688 O ARG A 273 0.743 -10.681 11.748 1.00 0.00 O ATOM 689 CB ARG A 273 3.895 -11.243 11.389 1.00 0.00 C ATOM 690 CG ARG A 273 4.112 -9.748 11.553 1.00 0.00 C ATOM 691 CD ARG A 273 5.591 -9.408 11.656 1.00 0.00 C ATOM 692 NE ARG A 273 6.095 -9.567 13.017 1.00 0.00 N ATOM 693 CZ ARG A 273 7.375 -9.777 13.307 1.00 0.00 C ATOM 694 NH1 ARG A 273 8.274 -9.851 12.336 1.00 0.00 N ATOM 695 NH2 ARG A 273 7.757 -9.912 14.571 1.00 0.00 N ATOM 0 H ARG A 273 3.942 -11.607 8.952 1.00 0.00 H new ATOM 0 HA ARG A 273 2.264 -12.564 10.929 1.00 0.00 H new ATOM 0 HB2 ARG A 273 3.831 -11.703 12.375 1.00 0.00 H new ATOM 0 HB3 ARG A 273 4.763 -11.675 10.892 1.00 0.00 H new ATOM 0 HG2 ARG A 273 3.674 -9.221 10.705 1.00 0.00 H new ATOM 0 HG3 ARG A 273 3.594 -9.400 12.447 1.00 0.00 H new ATOM 0 HD2 ARG A 273 6.158 -10.050 10.982 1.00 0.00 H new ATOM 0 HD3 ARG A 273 5.751 -8.381 11.328 1.00 0.00 H new ATOM 0 HE ARG A 273 5.428 -9.514 13.787 1.00 0.00 H new ATOM 0 HH11 ARG A 273 7.984 -9.747 11.364 1.00 0.00 H new ATOM 0 HH12 ARG A 273 9.256 -10.012 12.561 1.00 0.00 H new ATOM 0 HH21 ARG A 273 7.068 -9.855 15.321 1.00 0.00 H new ATOM 0 HH22 ARG A 273 8.740 -10.073 14.792 1.00 0.00 H new ATOM 709 N GLN A 274 1.559 -9.503 10.013 1.00 0.00 N ATOM 710 CA GLN A 274 0.579 -8.430 10.139 1.00 0.00 C ATOM 711 C GLN A 274 -0.370 -8.416 8.945 1.00 0.00 C ATOM 712 O GLN A 274 -1.082 -7.438 8.719 1.00 0.00 O ATOM 713 CB GLN A 274 1.285 -7.078 10.261 1.00 0.00 C ATOM 714 CG GLN A 274 1.944 -6.856 11.613 1.00 0.00 C ATOM 715 CD GLN A 274 0.952 -6.898 12.759 1.00 0.00 C ATOM 716 OE1 GLN A 274 -0.250 -6.718 12.562 1.00 0.00 O ATOM 717 NE2 GLN A 274 1.452 -7.137 13.966 1.00 0.00 N ATOM 0 H GLN A 274 2.228 -9.377 9.253 1.00 0.00 H new ATOM 0 HA GLN A 274 -0.005 -8.610 11.041 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.042 -7.001 9.480 1.00 0.00 H new ATOM 0 HB3 GLN A 274 0.561 -6.282 10.084 1.00 0.00 H new ATOM 0 HG2 GLN A 274 2.708 -7.618 11.770 1.00 0.00 H new ATOM 0 HG3 GLN A 274 2.451 -5.891 11.612 1.00 0.00 H new ATOM 0 HE21 GLN A 274 2.455 -7.280 14.083 1.00 0.00 H new ATOM 0 HE22 GLN A 274 0.833 -7.177 14.776 1.00 0.00 H new ATOM 726 N GLN A 275 -0.373 -9.506 8.185 1.00 0.00 N ATOM 727 CA GLN A 275 -1.235 -9.618 7.014 1.00 0.00 C ATOM 728 C GLN A 275 -1.394 -8.266 6.325 1.00 0.00 C ATOM 729 O GLN A 275 -2.512 -7.812 6.079 1.00 0.00 O ATOM 730 CB GLN A 275 -2.606 -10.164 7.414 1.00 0.00 C ATOM 731 CG GLN A 275 -2.599 -11.650 7.733 1.00 0.00 C ATOM 732 CD GLN A 275 -1.742 -12.450 6.772 1.00 0.00 C ATOM 733 OE1 GLN A 275 -1.721 -12.183 5.570 1.00 0.00 O ATOM 734 NE2 GLN A 275 -1.027 -13.438 7.298 1.00 0.00 N ATOM 0 H GLN A 275 0.211 -10.324 8.359 1.00 0.00 H new ATOM 0 HA GLN A 275 -0.767 -10.310 6.314 1.00 0.00 H new ATOM 0 HB2 GLN A 275 -2.966 -9.616 8.284 1.00 0.00 H new ATOM 0 HB3 GLN A 275 -3.312 -9.978 6.605 1.00 0.00 H new ATOM 0 HG2 GLN A 275 -2.233 -11.798 8.749 1.00 0.00 H new ATOM 0 HG3 GLN A 275 -3.621 -12.029 7.704 1.00 0.00 H new ATOM 0 HE21 GLN A 275 -1.074 -13.625 8.300 1.00 0.00 H new ATOM 0 HE22 GLN A 275 -0.431 -14.010 6.700 1.00 0.00 H new ATOM 743 N CYS A 276 -0.270 -7.630 6.016 1.00 0.00 N ATOM 744 CA CYS A 276 -0.284 -6.329 5.356 1.00 0.00 C ATOM 745 C CYS A 276 0.846 -6.223 4.338 1.00 0.00 C ATOM 746 O CYS A 276 1.686 -7.117 4.233 1.00 0.00 O ATOM 747 CB CYS A 276 -0.163 -5.208 6.389 1.00 0.00 C ATOM 748 SG CYS A 276 1.222 -5.406 7.534 1.00 0.00 S ATOM 0 H CYS A 276 0.663 -7.994 6.212 1.00 0.00 H new ATOM 0 HA CYS A 276 -1.233 -6.227 4.830 1.00 0.00 H new ATOM 0 HB2 CYS A 276 -0.056 -4.257 5.867 1.00 0.00 H new ATOM 0 HB3 CYS A 276 -1.089 -5.154 6.961 1.00 0.00 H new ATOM 0 HG CYS A 276 1.242 -4.408 8.367 1.00 0.00 H new ATOM 754 N ALA A 277 0.860 -5.126 3.589 1.00 0.00 N ATOM 755 CA ALA A 277 1.888 -4.903 2.579 1.00 0.00 C ATOM 756 C ALA A 277 2.114 -3.413 2.345 1.00 0.00 C ATOM 757 O ALA A 277 1.162 -2.640 2.236 1.00 0.00 O ATOM 758 CB ALA A 277 1.506 -5.592 1.277 1.00 0.00 C ATOM 0 H ALA A 277 0.171 -4.377 3.662 1.00 0.00 H new ATOM 0 HA ALA A 277 2.821 -5.332 2.944 1.00 0.00 H new ATOM 0 HB1 ALA A 277 2.282 -5.417 0.532 1.00 0.00 H new ATOM 0 HB2 ALA A 277 1.402 -6.663 1.449 1.00 0.00 H new ATOM 0 HB3 ALA A 277 0.559 -5.189 0.916 1.00 0.00 H new ATOM 764 N PHE A 278 3.380 -3.016 2.270 1.00 0.00 N ATOM 765 CA PHE A 278 3.731 -1.618 2.050 1.00 0.00 C ATOM 766 C PHE A 278 4.126 -1.378 0.596 1.00 0.00 C ATOM 767 O PHE A 278 5.183 -1.822 0.148 1.00 0.00 O ATOM 768 CB PHE A 278 4.877 -1.207 2.977 1.00 0.00 C ATOM 769 CG PHE A 278 4.424 -0.818 4.355 1.00 0.00 C ATOM 770 CD1 PHE A 278 3.740 0.368 4.564 1.00 0.00 C ATOM 771 CD2 PHE A 278 4.684 -1.638 5.441 1.00 0.00 C ATOM 772 CE1 PHE A 278 3.321 0.729 5.831 1.00 0.00 C ATOM 773 CE2 PHE A 278 4.267 -1.283 6.710 1.00 0.00 C ATOM 774 CZ PHE A 278 3.586 -0.097 6.906 1.00 0.00 C ATOM 0 H PHE A 278 4.180 -3.643 2.358 1.00 0.00 H new ATOM 0 HA PHE A 278 2.855 -1.009 2.274 1.00 0.00 H new ATOM 0 HB2 PHE A 278 5.584 -2.033 3.055 1.00 0.00 H new ATOM 0 HB3 PHE A 278 5.413 -0.370 2.530 1.00 0.00 H new ATOM 0 HD1 PHE A 278 3.532 1.018 3.727 1.00 0.00 H new ATOM 0 HD2 PHE A 278 5.218 -2.565 5.294 1.00 0.00 H new ATOM 0 HE1 PHE A 278 2.787 1.656 5.980 1.00 0.00 H new ATOM 0 HE2 PHE A 278 4.473 -1.932 7.548 1.00 0.00 H new ATOM 0 HZ PHE A 278 3.262 0.184 7.897 1.00 0.00 H new ATOM 784 N ILE A 279 3.269 -0.673 -0.135 1.00 0.00 N ATOM 785 CA ILE A 279 3.528 -0.373 -1.537 1.00 0.00 C ATOM 786 C ILE A 279 4.207 0.983 -1.693 1.00 0.00 C ATOM 787 O ILE A 279 3.665 2.010 -1.284 1.00 0.00 O ATOM 788 CB ILE A 279 2.229 -0.383 -2.364 1.00 0.00 C ATOM 789 CG1 ILE A 279 1.293 -1.488 -1.871 1.00 0.00 C ATOM 790 CG2 ILE A 279 2.543 -0.567 -3.842 1.00 0.00 C ATOM 791 CD1 ILE A 279 1.730 -2.877 -2.278 1.00 0.00 C ATOM 0 H ILE A 279 2.389 -0.299 0.221 1.00 0.00 H new ATOM 0 HA ILE A 279 4.192 -1.153 -1.909 1.00 0.00 H new ATOM 0 HB ILE A 279 1.727 0.576 -2.236 1.00 0.00 H new ATOM 0 HG12 ILE A 279 1.229 -1.440 -0.784 1.00 0.00 H new ATOM 0 HG13 ILE A 279 0.291 -1.303 -2.258 1.00 0.00 H new ATOM 0 HG21 ILE A 279 1.615 -0.572 -4.413 1.00 0.00 H new ATOM 0 HG22 ILE A 279 3.175 0.252 -4.184 1.00 0.00 H new ATOM 0 HG23 ILE A 279 3.064 -1.513 -3.988 1.00 0.00 H new ATOM 0 HD11 ILE A 279 1.020 -3.609 -1.894 1.00 0.00 H new ATOM 0 HD12 ILE A 279 1.767 -2.943 -3.365 1.00 0.00 H new ATOM 0 HD13 ILE A 279 2.719 -3.082 -1.868 1.00 0.00 H new ATOM 803 N GLN A 280 5.395 0.979 -2.290 1.00 0.00 N ATOM 804 CA GLN A 280 6.147 2.210 -2.501 1.00 0.00 C ATOM 805 C GLN A 280 6.184 2.579 -3.980 1.00 0.00 C ATOM 806 O GLN A 280 6.345 1.715 -4.842 1.00 0.00 O ATOM 807 CB GLN A 280 7.572 2.061 -1.965 1.00 0.00 C ATOM 808 CG GLN A 280 8.332 3.375 -1.881 1.00 0.00 C ATOM 809 CD GLN A 280 9.562 3.282 -1.001 1.00 0.00 C ATOM 810 OE1 GLN A 280 10.736 3.416 -1.608 1.00 0.00 O flip ATOM 811 NE2 GLN A 280 9.460 3.093 0.211 1.00 0.00 N flip ATOM 0 H GLN A 280 5.857 0.138 -2.636 1.00 0.00 H new ATOM 0 HA GLN A 280 5.644 3.010 -1.958 1.00 0.00 H new ATOM 0 HB2 GLN A 280 7.533 1.610 -0.974 1.00 0.00 H new ATOM 0 HB3 GLN A 280 8.122 1.373 -2.607 1.00 0.00 H new ATOM 0 HG2 GLN A 280 8.629 3.683 -2.883 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.670 4.149 -1.493 1.00 0.00 H new ATOM 0 HE21 GLN A 280 8.538 2.996 0.636 1.00 0.00 H new ATOM 0 HE22 GLN A 280 10.298 3.034 0.790 1.00 0.00 H new ATOM 820 N PHE A 281 6.032 3.867 -4.268 1.00 0.00 N ATOM 821 CA PHE A 281 6.047 4.350 -5.644 1.00 0.00 C ATOM 822 C PHE A 281 7.214 5.307 -5.872 1.00 0.00 C ATOM 823 O PHE A 281 7.584 6.074 -4.985 1.00 0.00 O ATOM 824 CB PHE A 281 4.727 5.050 -5.975 1.00 0.00 C ATOM 825 CG PHE A 281 3.543 4.125 -5.980 1.00 0.00 C ATOM 826 CD1 PHE A 281 3.189 3.439 -7.131 1.00 0.00 C ATOM 827 CD2 PHE A 281 2.785 3.942 -4.835 1.00 0.00 C ATOM 828 CE1 PHE A 281 2.100 2.588 -7.138 1.00 0.00 C ATOM 829 CE2 PHE A 281 1.695 3.092 -4.837 1.00 0.00 C ATOM 830 CZ PHE A 281 1.353 2.414 -5.990 1.00 0.00 C ATOM 0 H PHE A 281 5.897 4.595 -3.567 1.00 0.00 H new ATOM 0 HA PHE A 281 6.171 3.491 -6.303 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.554 5.845 -5.249 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.812 5.524 -6.953 1.00 0.00 H new ATOM 0 HD1 PHE A 281 3.770 3.571 -8.032 1.00 0.00 H new ATOM 0 HD2 PHE A 281 3.049 4.470 -3.930 1.00 0.00 H new ATOM 0 HE1 PHE A 281 1.833 2.059 -8.041 1.00 0.00 H new ATOM 0 HE2 PHE A 281 1.112 2.958 -3.938 1.00 0.00 H new ATOM 0 HZ PHE A 281 0.502 1.749 -5.994 1.00 0.00 H new ATOM 840 N ALA A 282 7.789 5.254 -7.069 1.00 0.00 N ATOM 841 CA ALA A 282 8.912 6.115 -7.416 1.00 0.00 C ATOM 842 C ALA A 282 8.478 7.575 -7.502 1.00 0.00 C ATOM 843 O ALA A 282 9.235 8.481 -7.150 1.00 0.00 O ATOM 844 CB ALA A 282 9.534 5.669 -8.731 1.00 0.00 C ATOM 0 H ALA A 282 7.495 4.623 -7.815 1.00 0.00 H new ATOM 0 HA ALA A 282 9.659 6.031 -6.627 1.00 0.00 H new ATOM 0 HB1 ALA A 282 10.372 6.322 -8.977 1.00 0.00 H new ATOM 0 HB2 ALA A 282 9.889 4.643 -8.636 1.00 0.00 H new ATOM 0 HB3 ALA A 282 8.787 5.723 -9.523 1.00 0.00 H new ATOM 850 N THR A 283 7.255 7.797 -7.974 1.00 0.00 N ATOM 851 CA THR A 283 6.722 9.147 -8.108 1.00 0.00 C ATOM 852 C THR A 283 5.394 9.288 -7.374 1.00 0.00 C ATOM 853 O THR A 283 4.420 8.606 -7.694 1.00 0.00 O ATOM 854 CB THR A 283 6.520 9.526 -9.588 1.00 0.00 C ATOM 855 OG1 THR A 283 5.764 8.510 -10.256 1.00 0.00 O ATOM 856 CG2 THR A 283 7.859 9.712 -10.286 1.00 0.00 C ATOM 0 H THR A 283 6.615 7.059 -8.270 1.00 0.00 H new ATOM 0 HA THR A 283 7.453 9.822 -7.664 1.00 0.00 H new ATOM 0 HB THR A 283 5.974 10.468 -9.628 1.00 0.00 H new ATOM 0 HG1 THR A 283 5.060 8.180 -9.659 1.00 0.00 H new ATOM 0 HG21 THR A 283 7.691 9.979 -11.329 1.00 0.00 H new ATOM 0 HG22 THR A 283 8.419 10.507 -9.793 1.00 0.00 H new ATOM 0 HG23 THR A 283 8.427 8.783 -10.236 1.00 0.00 H new ATOM 864 N ARG A 284 5.361 10.179 -6.387 1.00 0.00 N ATOM 865 CA ARG A 284 4.151 10.409 -5.607 1.00 0.00 C ATOM 866 C ARG A 284 2.911 10.340 -6.492 1.00 0.00 C ATOM 867 O ARG A 284 1.843 9.919 -6.048 1.00 0.00 O ATOM 868 CB ARG A 284 4.219 11.770 -4.912 1.00 0.00 C ATOM 869 CG ARG A 284 2.956 12.126 -4.145 1.00 0.00 C ATOM 870 CD ARG A 284 2.852 11.342 -2.846 1.00 0.00 C ATOM 871 NE ARG A 284 1.617 11.637 -2.126 1.00 0.00 N ATOM 872 CZ ARG A 284 1.418 12.753 -1.434 1.00 0.00 C ATOM 873 NH1 ARG A 284 2.369 13.675 -1.370 1.00 0.00 N ATOM 874 NH2 ARG A 284 0.267 12.949 -0.804 1.00 0.00 N ATOM 0 H ARG A 284 6.158 10.752 -6.109 1.00 0.00 H new ATOM 0 HA ARG A 284 4.081 9.625 -4.853 1.00 0.00 H new ATOM 0 HB2 ARG A 284 5.065 11.776 -4.225 1.00 0.00 H new ATOM 0 HB3 ARG A 284 4.410 12.541 -5.659 1.00 0.00 H new ATOM 0 HG2 ARG A 284 2.950 13.194 -3.928 1.00 0.00 H new ATOM 0 HG3 ARG A 284 2.083 11.922 -4.765 1.00 0.00 H new ATOM 0 HD2 ARG A 284 2.899 10.275 -3.062 1.00 0.00 H new ATOM 0 HD3 ARG A 284 3.706 11.577 -2.211 1.00 0.00 H new ATOM 0 HE ARG A 284 0.865 10.948 -2.156 1.00 0.00 H new ATOM 0 HH11 ARG A 284 3.255 13.528 -1.853 1.00 0.00 H new ATOM 0 HH12 ARG A 284 2.214 14.531 -0.838 1.00 0.00 H new ATOM 0 HH21 ARG A 284 -0.467 12.242 -0.851 1.00 0.00 H new ATOM 0 HH22 ARG A 284 0.116 13.807 -0.273 1.00 0.00 H new ATOM 888 N GLN A 285 3.061 10.755 -7.746 1.00 0.00 N ATOM 889 CA GLN A 285 1.952 10.741 -8.693 1.00 0.00 C ATOM 890 C GLN A 285 1.116 9.475 -8.533 1.00 0.00 C ATOM 891 O GLN A 285 -0.036 9.531 -8.104 1.00 0.00 O ATOM 892 CB GLN A 285 2.477 10.842 -10.126 1.00 0.00 C ATOM 893 CG GLN A 285 1.463 11.408 -11.107 1.00 0.00 C ATOM 894 CD GLN A 285 1.696 10.933 -12.527 1.00 0.00 C ATOM 895 OE1 GLN A 285 2.819 10.977 -13.032 1.00 0.00 O ATOM 896 NE2 GLN A 285 0.635 10.475 -13.181 1.00 0.00 N ATOM 0 H GLN A 285 3.939 11.105 -8.130 1.00 0.00 H new ATOM 0 HA GLN A 285 1.317 11.602 -8.484 1.00 0.00 H new ATOM 0 HB2 GLN A 285 3.368 11.470 -10.134 1.00 0.00 H new ATOM 0 HB3 GLN A 285 2.782 9.851 -10.463 1.00 0.00 H new ATOM 0 HG2 GLN A 285 0.460 11.121 -10.792 1.00 0.00 H new ATOM 0 HG3 GLN A 285 1.506 12.497 -11.081 1.00 0.00 H new ATOM 0 HE21 GLN A 285 -0.277 10.456 -12.724 1.00 0.00 H new ATOM 0 HE22 GLN A 285 0.732 10.142 -14.140 1.00 0.00 H new ATOM 905 N ALA A 286 1.704 8.335 -8.882 1.00 0.00 N ATOM 906 CA ALA A 286 1.014 7.056 -8.775 1.00 0.00 C ATOM 907 C ALA A 286 0.523 6.814 -7.352 1.00 0.00 C ATOM 908 O ALA A 286 -0.574 6.296 -7.144 1.00 0.00 O ATOM 909 CB ALA A 286 1.929 5.924 -9.220 1.00 0.00 C ATOM 0 H ALA A 286 2.657 8.272 -9.241 1.00 0.00 H new ATOM 0 HA ALA A 286 0.144 7.085 -9.431 1.00 0.00 H new ATOM 0 HB1 ALA A 286 1.401 4.974 -9.135 1.00 0.00 H new ATOM 0 HB2 ALA A 286 2.226 6.082 -10.257 1.00 0.00 H new ATOM 0 HB3 ALA A 286 2.816 5.903 -8.587 1.00 0.00 H new ATOM 915 N ALA A 287 1.342 7.191 -6.376 1.00 0.00 N ATOM 916 CA ALA A 287 0.990 7.015 -4.973 1.00 0.00 C ATOM 917 C ALA A 287 -0.367 7.639 -4.665 1.00 0.00 C ATOM 918 O ALA A 287 -1.305 6.944 -4.275 1.00 0.00 O ATOM 919 CB ALA A 287 2.064 7.618 -4.079 1.00 0.00 C ATOM 0 H ALA A 287 2.254 7.620 -6.531 1.00 0.00 H new ATOM 0 HA ALA A 287 0.924 5.946 -4.773 1.00 0.00 H new ATOM 0 HB1 ALA A 287 1.788 7.479 -3.034 1.00 0.00 H new ATOM 0 HB2 ALA A 287 3.017 7.124 -4.271 1.00 0.00 H new ATOM 0 HB3 ALA A 287 2.158 8.683 -4.291 1.00 0.00 H new ATOM 925 N GLU A 288 -0.464 8.953 -4.843 1.00 0.00 N ATOM 926 CA GLU A 288 -1.707 9.669 -4.583 1.00 0.00 C ATOM 927 C GLU A 288 -2.884 8.982 -5.268 1.00 0.00 C ATOM 928 O GLU A 288 -3.916 8.727 -4.647 1.00 0.00 O ATOM 929 CB GLU A 288 -1.597 11.118 -5.063 1.00 0.00 C ATOM 930 CG GLU A 288 -1.048 12.068 -4.012 1.00 0.00 C ATOM 931 CD GLU A 288 -1.433 13.511 -4.273 1.00 0.00 C ATOM 932 OE1 GLU A 288 -1.580 13.882 -5.456 1.00 0.00 O ATOM 933 OE2 GLU A 288 -1.586 14.270 -3.292 1.00 0.00 O ATOM 0 H GLU A 288 0.303 9.543 -5.166 1.00 0.00 H new ATOM 0 HA GLU A 288 -1.882 9.663 -3.507 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -0.954 11.153 -5.943 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -2.582 11.464 -5.374 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -1.416 11.770 -3.030 1.00 0.00 H new ATOM 0 HG3 GLU A 288 0.038 11.985 -3.984 1.00 0.00 H new ATOM 940 N VAL A 289 -2.722 8.685 -6.554 1.00 0.00 N ATOM 941 CA VAL A 289 -3.770 8.028 -7.325 1.00 0.00 C ATOM 942 C VAL A 289 -4.246 6.755 -6.632 1.00 0.00 C ATOM 943 O VAL A 289 -5.401 6.655 -6.220 1.00 0.00 O ATOM 944 CB VAL A 289 -3.286 7.676 -8.744 1.00 0.00 C ATOM 945 CG1 VAL A 289 -4.452 7.217 -9.607 1.00 0.00 C ATOM 946 CG2 VAL A 289 -2.581 8.867 -9.376 1.00 0.00 C ATOM 0 H VAL A 289 -1.874 8.889 -7.083 1.00 0.00 H new ATOM 0 HA VAL A 289 -4.599 8.732 -7.396 1.00 0.00 H new ATOM 0 HB VAL A 289 -2.572 6.855 -8.673 1.00 0.00 H new ATOM 0 HG11 VAL A 289 -4.091 6.973 -10.606 1.00 0.00 H new ATOM 0 HG12 VAL A 289 -4.910 6.334 -9.160 1.00 0.00 H new ATOM 0 HG13 VAL A 289 -5.192 8.015 -9.674 1.00 0.00 H new ATOM 0 HG21 VAL A 289 -2.245 8.601 -10.378 1.00 0.00 H new ATOM 0 HG22 VAL A 289 -3.271 9.709 -9.436 1.00 0.00 H new ATOM 0 HG23 VAL A 289 -1.721 9.146 -8.767 1.00 0.00 H new ATOM 956 N ALA A 290 -3.346 5.785 -6.508 1.00 0.00 N ATOM 957 CA ALA A 290 -3.673 4.519 -5.863 1.00 0.00 C ATOM 958 C ALA A 290 -4.266 4.746 -4.476 1.00 0.00 C ATOM 959 O ALA A 290 -5.225 4.082 -4.085 1.00 0.00 O ATOM 960 CB ALA A 290 -2.435 3.639 -5.771 1.00 0.00 C ATOM 0 H ALA A 290 -2.386 5.851 -6.845 1.00 0.00 H new ATOM 0 HA ALA A 290 -4.422 4.013 -6.472 1.00 0.00 H new ATOM 0 HB1 ALA A 290 -2.693 2.697 -5.287 1.00 0.00 H new ATOM 0 HB2 ALA A 290 -2.055 3.440 -6.773 1.00 0.00 H new ATOM 0 HB3 ALA A 290 -1.669 4.149 -5.187 1.00 0.00 H new ATOM 966 N ALA A 291 -3.689 5.689 -3.738 1.00 0.00 N ATOM 967 CA ALA A 291 -4.162 6.004 -2.396 1.00 0.00 C ATOM 968 C ALA A 291 -5.666 6.257 -2.389 1.00 0.00 C ATOM 969 O ALA A 291 -6.407 5.625 -1.637 1.00 0.00 O ATOM 970 CB ALA A 291 -3.419 7.212 -1.845 1.00 0.00 C ATOM 0 H ALA A 291 -2.894 6.248 -4.047 1.00 0.00 H new ATOM 0 HA ALA A 291 -3.962 5.145 -1.756 1.00 0.00 H new ATOM 0 HB1 ALA A 291 -3.782 7.436 -0.842 1.00 0.00 H new ATOM 0 HB2 ALA A 291 -2.352 6.995 -1.804 1.00 0.00 H new ATOM 0 HB3 ALA A 291 -3.590 8.071 -2.493 1.00 0.00 H new ATOM 976 N GLU A 292 -6.109 7.186 -3.231 1.00 0.00 N ATOM 977 CA GLU A 292 -7.525 7.523 -3.319 1.00 0.00 C ATOM 978 C GLU A 292 -8.325 6.360 -3.900 1.00 0.00 C ATOM 979 O GLU A 292 -9.517 6.214 -3.627 1.00 0.00 O ATOM 980 CB GLU A 292 -7.722 8.772 -4.180 1.00 0.00 C ATOM 981 CG GLU A 292 -9.102 9.393 -4.045 1.00 0.00 C ATOM 982 CD GLU A 292 -10.182 8.565 -4.715 1.00 0.00 C ATOM 983 OE1 GLU A 292 -9.900 7.969 -5.776 1.00 0.00 O ATOM 984 OE2 GLU A 292 -11.309 8.515 -4.180 1.00 0.00 O ATOM 0 H GLU A 292 -5.508 7.718 -3.861 1.00 0.00 H new ATOM 0 HA GLU A 292 -7.888 7.724 -2.311 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -6.971 9.513 -3.907 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -7.550 8.514 -5.225 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -9.342 9.510 -2.988 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -9.091 10.392 -4.482 1.00 0.00 H new ATOM 991 N LYS A 293 -7.662 5.535 -4.702 1.00 0.00 N ATOM 992 CA LYS A 293 -8.309 4.384 -5.321 1.00 0.00 C ATOM 993 C LYS A 293 -8.092 3.125 -4.489 1.00 0.00 C ATOM 994 O LYS A 293 -8.490 2.030 -4.887 1.00 0.00 O ATOM 995 CB LYS A 293 -7.770 4.172 -6.738 1.00 0.00 C ATOM 996 CG LYS A 293 -8.393 5.094 -7.771 1.00 0.00 C ATOM 997 CD LYS A 293 -8.437 4.444 -9.144 1.00 0.00 C ATOM 998 CE LYS A 293 -8.342 5.480 -10.254 1.00 0.00 C ATOM 999 NZ LYS A 293 -9.595 6.275 -10.380 1.00 0.00 N ATOM 0 H LYS A 293 -6.676 5.642 -4.939 1.00 0.00 H new ATOM 0 HA LYS A 293 -9.379 4.584 -5.372 1.00 0.00 H new ATOM 0 HB2 LYS A 293 -6.690 4.323 -6.733 1.00 0.00 H new ATOM 0 HB3 LYS A 293 -7.946 3.138 -7.034 1.00 0.00 H new ATOM 0 HG2 LYS A 293 -9.404 5.360 -7.461 1.00 0.00 H new ATOM 0 HG3 LYS A 293 -7.822 6.021 -7.824 1.00 0.00 H new ATOM 0 HD2 LYS A 293 -7.616 3.733 -9.238 1.00 0.00 H new ATOM 0 HD3 LYS A 293 -9.363 3.879 -9.251 1.00 0.00 H new ATOM 0 HE2 LYS A 293 -7.505 6.150 -10.055 1.00 0.00 H new ATOM 0 HE3 LYS A 293 -8.132 4.981 -11.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 293 -9.490 6.970 -11.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 293 -10.389 5.639 -10.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 293 -9.782 6.772 -9.486 1.00 0.00 H new ATOM 1013 N SER A 294 -7.459 3.288 -3.331 1.00 0.00 N ATOM 1014 CA SER A 294 -7.188 2.163 -2.444 1.00 0.00 C ATOM 1015 C SER A 294 -7.923 2.328 -1.117 1.00 0.00 C ATOM 1016 O SER A 294 -8.245 1.347 -0.446 1.00 0.00 O ATOM 1017 CB SER A 294 -5.684 2.035 -2.194 1.00 0.00 C ATOM 1018 OG SER A 294 -5.208 3.101 -1.391 1.00 0.00 O ATOM 0 H SER A 294 -7.125 4.188 -2.986 1.00 0.00 H new ATOM 0 HA SER A 294 -7.548 1.255 -2.928 1.00 0.00 H new ATOM 0 HB2 SER A 294 -5.473 1.084 -1.704 1.00 0.00 H new ATOM 0 HB3 SER A 294 -5.153 2.028 -3.146 1.00 0.00 H new ATOM 0 HG SER A 294 -5.780 3.887 -1.518 1.00 0.00 H new ATOM 1024 N PHE A 295 -8.186 3.576 -0.745 1.00 0.00 N ATOM 1025 CA PHE A 295 -8.882 3.871 0.502 1.00 0.00 C ATOM 1026 C PHE A 295 -10.255 3.206 0.529 1.00 0.00 C ATOM 1027 O PHE A 295 -11.189 3.658 -0.133 1.00 0.00 O ATOM 1028 CB PHE A 295 -9.033 5.384 0.681 1.00 0.00 C ATOM 1029 CG PHE A 295 -7.834 6.035 1.309 1.00 0.00 C ATOM 1030 CD1 PHE A 295 -6.558 5.558 1.055 1.00 0.00 C ATOM 1031 CD2 PHE A 295 -7.983 7.124 2.153 1.00 0.00 C ATOM 1032 CE1 PHE A 295 -5.452 6.156 1.631 1.00 0.00 C ATOM 1033 CE2 PHE A 295 -6.881 7.726 2.731 1.00 0.00 C ATOM 1034 CZ PHE A 295 -5.614 7.240 2.471 1.00 0.00 C ATOM 0 H PHE A 295 -7.928 4.399 -1.289 1.00 0.00 H new ATOM 0 HA PHE A 295 -8.288 3.472 1.324 1.00 0.00 H new ATOM 0 HB2 PHE A 295 -9.217 5.840 -0.292 1.00 0.00 H new ATOM 0 HB3 PHE A 295 -9.910 5.583 1.297 1.00 0.00 H new ATOM 0 HD1 PHE A 295 -6.426 4.710 0.400 1.00 0.00 H new ATOM 0 HD2 PHE A 295 -8.971 7.507 2.362 1.00 0.00 H new ATOM 0 HE1 PHE A 295 -4.463 5.776 1.424 1.00 0.00 H new ATOM 0 HE2 PHE A 295 -7.010 8.575 3.385 1.00 0.00 H new ATOM 0 HZ PHE A 295 -4.752 7.707 2.924 1.00 0.00 H new ATOM 1044 N ASN A 296 -10.369 2.128 1.299 1.00 0.00 N ATOM 1045 CA ASN A 296 -11.626 1.399 1.412 1.00 0.00 C ATOM 1046 C ASN A 296 -12.226 1.132 0.035 1.00 0.00 C ATOM 1047 O ASN A 296 -13.444 1.034 -0.116 1.00 0.00 O ATOM 1048 CB ASN A 296 -12.620 2.184 2.270 1.00 0.00 C ATOM 1049 CG ASN A 296 -11.966 2.808 3.488 1.00 0.00 C ATOM 1050 OD1 ASN A 296 -11.083 3.657 3.365 1.00 0.00 O ATOM 1051 ND2 ASN A 296 -12.397 2.388 4.671 1.00 0.00 N ATOM 0 H ASN A 296 -9.606 1.741 1.854 1.00 0.00 H new ATOM 0 HA ASN A 296 -11.420 0.442 1.891 1.00 0.00 H new ATOM 0 HB2 ASN A 296 -13.078 2.967 1.666 1.00 0.00 H new ATOM 0 HB3 ASN A 296 -13.422 1.520 2.592 1.00 0.00 H new ATOM 0 HD21 ASN A 296 -11.994 2.771 5.526 1.00 0.00 H new ATOM 0 HD22 ASN A 296 -13.131 1.682 4.725 1.00 0.00 H new ATOM 1058 N LYS A 297 -11.362 1.015 -0.968 1.00 0.00 N ATOM 1059 CA LYS A 297 -11.805 0.757 -2.333 1.00 0.00 C ATOM 1060 C LYS A 297 -11.071 -0.442 -2.926 1.00 0.00 C ATOM 1061 O LYS A 297 -11.642 -1.211 -3.700 1.00 0.00 O ATOM 1062 CB LYS A 297 -11.575 1.992 -3.207 1.00 0.00 C ATOM 1063 CG LYS A 297 -12.362 1.973 -4.506 1.00 0.00 C ATOM 1064 CD LYS A 297 -11.660 2.767 -5.595 1.00 0.00 C ATOM 1065 CE LYS A 297 -12.102 4.222 -5.598 1.00 0.00 C ATOM 1066 NZ LYS A 297 -11.528 4.978 -4.451 1.00 0.00 N ATOM 0 H LYS A 297 -10.351 1.095 -0.861 1.00 0.00 H new ATOM 0 HA LYS A 297 -12.871 0.531 -2.306 1.00 0.00 H new ATOM 0 HB2 LYS A 297 -11.846 2.883 -2.641 1.00 0.00 H new ATOM 0 HB3 LYS A 297 -10.512 2.071 -3.437 1.00 0.00 H new ATOM 0 HG2 LYS A 297 -12.497 0.943 -4.835 1.00 0.00 H new ATOM 0 HG3 LYS A 297 -13.356 2.387 -4.336 1.00 0.00 H new ATOM 0 HD2 LYS A 297 -10.581 2.714 -5.447 1.00 0.00 H new ATOM 0 HD3 LYS A 297 -11.871 2.320 -6.566 1.00 0.00 H new ATOM 0 HE2 LYS A 297 -11.796 4.693 -6.533 1.00 0.00 H new ATOM 0 HE3 LYS A 297 -13.190 4.271 -5.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 297 -12.295 5.440 -3.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 297 -11.019 4.323 -3.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 297 -10.869 5.700 -4.806 1.00 0.00 H new ATOM 1080 N LEU A 298 -9.805 -0.596 -2.557 1.00 0.00 N ATOM 1081 CA LEU A 298 -8.993 -1.703 -3.051 1.00 0.00 C ATOM 1082 C LEU A 298 -9.496 -3.034 -2.502 1.00 0.00 C ATOM 1083 O LEU A 298 -9.157 -3.424 -1.384 1.00 0.00 O ATOM 1084 CB LEU A 298 -7.528 -1.499 -2.663 1.00 0.00 C ATOM 1085 CG LEU A 298 -6.639 -2.743 -2.719 1.00 0.00 C ATOM 1086 CD1 LEU A 298 -6.188 -3.012 -4.147 1.00 0.00 C ATOM 1087 CD2 LEU A 298 -5.438 -2.583 -1.800 1.00 0.00 C ATOM 0 H LEU A 298 -9.318 0.032 -1.917 1.00 0.00 H new ATOM 0 HA LEU A 298 -9.075 -1.725 -4.138 1.00 0.00 H new ATOM 0 HB2 LEU A 298 -7.101 -0.742 -3.321 1.00 0.00 H new ATOM 0 HB3 LEU A 298 -7.494 -1.098 -1.650 1.00 0.00 H new ATOM 0 HG LEU A 298 -7.221 -3.598 -2.376 1.00 0.00 H new ATOM 0 HD11 LEU A 298 -5.557 -3.900 -4.168 1.00 0.00 H new ATOM 0 HD12 LEU A 298 -7.061 -3.172 -4.780 1.00 0.00 H new ATOM 0 HD13 LEU A 298 -5.623 -2.157 -4.517 1.00 0.00 H new ATOM 0 HD21 LEU A 298 -4.817 -3.478 -1.853 1.00 0.00 H new ATOM 0 HD22 LEU A 298 -4.854 -1.717 -2.112 1.00 0.00 H new ATOM 0 HD23 LEU A 298 -5.781 -2.440 -0.775 1.00 0.00 H new ATOM 1099 N ILE A 299 -10.304 -3.728 -3.296 1.00 0.00 N ATOM 1100 CA ILE A 299 -10.851 -5.017 -2.891 1.00 0.00 C ATOM 1101 C ILE A 299 -10.323 -6.141 -3.777 1.00 0.00 C ATOM 1102 O ILE A 299 -10.826 -6.366 -4.878 1.00 0.00 O ATOM 1103 CB ILE A 299 -12.390 -5.017 -2.943 1.00 0.00 C ATOM 1104 CG1 ILE A 299 -12.948 -3.806 -2.193 1.00 0.00 C ATOM 1105 CG2 ILE A 299 -12.940 -6.309 -2.357 1.00 0.00 C ATOM 1106 CD1 ILE A 299 -14.448 -3.658 -2.314 1.00 0.00 C ATOM 0 H ILE A 299 -10.594 -3.419 -4.224 1.00 0.00 H new ATOM 0 HA ILE A 299 -10.531 -5.187 -1.863 1.00 0.00 H new ATOM 0 HB ILE A 299 -12.703 -4.951 -3.985 1.00 0.00 H new ATOM 0 HG12 ILE A 299 -12.683 -3.888 -1.139 1.00 0.00 H new ATOM 0 HG13 ILE A 299 -12.470 -2.903 -2.572 1.00 0.00 H new ATOM 0 HG21 ILE A 299 -14.029 -6.294 -2.401 1.00 0.00 H new ATOM 0 HG22 ILE A 299 -12.566 -7.157 -2.930 1.00 0.00 H new ATOM 0 HG23 ILE A 299 -12.620 -6.403 -1.319 1.00 0.00 H new ATOM 0 HD11 ILE A 299 -14.773 -2.779 -1.758 1.00 0.00 H new ATOM 0 HD12 ILE A 299 -14.719 -3.544 -3.364 1.00 0.00 H new ATOM 0 HD13 ILE A 299 -14.935 -4.545 -1.908 1.00 0.00 H new ATOM 1118 N VAL A 300 -9.308 -6.845 -3.288 1.00 0.00 N ATOM 1119 CA VAL A 300 -8.713 -7.948 -4.033 1.00 0.00 C ATOM 1120 C VAL A 300 -9.350 -9.279 -3.647 1.00 0.00 C ATOM 1121 O VAL A 300 -9.746 -9.479 -2.500 1.00 0.00 O ATOM 1122 CB VAL A 300 -7.194 -8.031 -3.797 1.00 0.00 C ATOM 1123 CG1 VAL A 300 -6.592 -9.183 -4.587 1.00 0.00 C ATOM 1124 CG2 VAL A 300 -6.525 -6.715 -4.164 1.00 0.00 C ATOM 0 H VAL A 300 -8.880 -6.671 -2.379 1.00 0.00 H new ATOM 0 HA VAL A 300 -8.898 -7.752 -5.089 1.00 0.00 H new ATOM 0 HB VAL A 300 -7.019 -8.218 -2.738 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -5.518 -9.225 -4.407 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -7.050 -10.120 -4.270 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -6.776 -9.030 -5.650 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -5.452 -6.792 -3.991 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -6.708 -6.495 -5.216 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -6.935 -5.914 -3.549 1.00 0.00 H new ATOM 1134 N ASN A 301 -9.444 -10.186 -4.614 1.00 0.00 N ATOM 1135 CA ASN A 301 -10.033 -11.499 -4.375 1.00 0.00 C ATOM 1136 C ASN A 301 -11.336 -11.376 -3.591 1.00 0.00 C ATOM 1137 O ASN A 301 -11.556 -12.094 -2.617 1.00 0.00 O ATOM 1138 CB ASN A 301 -9.050 -12.391 -3.616 1.00 0.00 C ATOM 1139 CG ASN A 301 -7.869 -12.809 -4.471 1.00 0.00 C ATOM 1140 OD1 ASN A 301 -6.664 -12.640 -3.939 1.00 0.00 O flip ATOM 1141 ND2 ASN A 301 -8.038 -13.278 -5.597 1.00 0.00 N flip ATOM 0 H ASN A 301 -9.120 -10.036 -5.570 1.00 0.00 H new ATOM 0 HA ASN A 301 -10.253 -11.953 -5.341 1.00 0.00 H new ATOM 0 HB2 ASN A 301 -8.688 -11.860 -2.735 1.00 0.00 H new ATOM 0 HB3 ASN A 301 -9.571 -13.280 -3.261 1.00 0.00 H new ATOM 0 HD21 ASN A 301 -8.982 -13.390 -5.966 1.00 0.00 H new ATOM 0 HD22 ASN A 301 -7.234 -13.554 -6.160 1.00 0.00 H new ATOM 1148 N GLY A 302 -12.197 -10.460 -4.024 1.00 0.00 N ATOM 1149 CA GLY A 302 -13.468 -10.260 -3.351 1.00 0.00 C ATOM 1150 C GLY A 302 -13.315 -10.133 -1.849 1.00 0.00 C ATOM 1151 O GLY A 302 -14.187 -10.558 -1.091 1.00 0.00 O ATOM 0 H GLY A 302 -12.038 -9.853 -4.828 1.00 0.00 H new ATOM 0 HA2 GLY A 302 -13.945 -9.361 -3.742 1.00 0.00 H new ATOM 0 HA3 GLY A 302 -14.130 -11.096 -3.576 1.00 0.00 H new ATOM 1155 N ARG A 303 -12.202 -9.548 -1.416 1.00 0.00 N ATOM 1156 CA ARG A 303 -11.937 -9.369 0.006 1.00 0.00 C ATOM 1157 C ARG A 303 -11.445 -7.953 0.294 1.00 0.00 C ATOM 1158 O ARG A 303 -10.279 -7.632 0.064 1.00 0.00 O ATOM 1159 CB ARG A 303 -10.900 -10.387 0.485 1.00 0.00 C ATOM 1160 CG ARG A 303 -10.545 -10.248 1.956 1.00 0.00 C ATOM 1161 CD ARG A 303 -9.171 -10.830 2.255 1.00 0.00 C ATOM 1162 NE ARG A 303 -9.064 -11.301 3.633 1.00 0.00 N ATOM 1163 CZ ARG A 303 -9.573 -12.452 4.058 1.00 0.00 C ATOM 1164 NH1 ARG A 303 -10.221 -13.245 3.216 1.00 0.00 N ATOM 1165 NH2 ARG A 303 -9.434 -12.812 5.328 1.00 0.00 N ATOM 0 H ARG A 303 -11.470 -9.190 -2.030 1.00 0.00 H new ATOM 0 HA ARG A 303 -12.870 -9.528 0.546 1.00 0.00 H new ATOM 0 HB2 ARG A 303 -11.280 -11.393 0.305 1.00 0.00 H new ATOM 0 HB3 ARG A 303 -9.994 -10.278 -0.111 1.00 0.00 H new ATOM 0 HG2 ARG A 303 -10.565 -9.195 2.238 1.00 0.00 H new ATOM 0 HG3 ARG A 303 -11.296 -10.755 2.562 1.00 0.00 H new ATOM 0 HD2 ARG A 303 -8.971 -11.656 1.573 1.00 0.00 H new ATOM 0 HD3 ARG A 303 -8.409 -10.073 2.070 1.00 0.00 H new ATOM 0 HE ARG A 303 -8.571 -10.714 4.306 1.00 0.00 H new ATOM 0 HH11 ARG A 303 -10.330 -12.972 2.239 1.00 0.00 H new ATOM 0 HH12 ARG A 303 -10.611 -14.128 3.545 1.00 0.00 H new ATOM 0 HH21 ARG A 303 -8.936 -12.205 5.979 1.00 0.00 H new ATOM 0 HH22 ARG A 303 -9.825 -13.696 5.653 1.00 0.00 H new ATOM 1179 N ARG A 304 -12.342 -7.112 0.797 1.00 0.00 N ATOM 1180 CA ARG A 304 -12.001 -5.731 1.114 1.00 0.00 C ATOM 1181 C ARG A 304 -10.647 -5.652 1.815 1.00 0.00 C ATOM 1182 O ARG A 304 -10.280 -6.544 2.581 1.00 0.00 O ATOM 1183 CB ARG A 304 -13.081 -5.106 1.998 1.00 0.00 C ATOM 1184 CG ARG A 304 -13.235 -3.606 1.804 1.00 0.00 C ATOM 1185 CD ARG A 304 -14.274 -3.025 2.750 1.00 0.00 C ATOM 1186 NE ARG A 304 -15.633 -3.208 2.248 1.00 0.00 N ATOM 1187 CZ ARG A 304 -16.717 -2.789 2.892 1.00 0.00 C ATOM 1188 NH1 ARG A 304 -16.601 -2.168 4.057 1.00 0.00 N ATOM 1189 NH2 ARG A 304 -17.920 -2.992 2.370 1.00 0.00 N ATOM 0 H ARG A 304 -13.311 -7.363 0.994 1.00 0.00 H new ATOM 0 HA ARG A 304 -11.940 -5.175 0.178 1.00 0.00 H new ATOM 0 HB2 ARG A 304 -14.035 -5.591 1.789 1.00 0.00 H new ATOM 0 HB3 ARG A 304 -12.844 -5.306 3.043 1.00 0.00 H new ATOM 0 HG2 ARG A 304 -12.276 -3.116 1.971 1.00 0.00 H new ATOM 0 HG3 ARG A 304 -13.524 -3.399 0.773 1.00 0.00 H new ATOM 0 HD2 ARG A 304 -14.181 -3.500 3.727 1.00 0.00 H new ATOM 0 HD3 ARG A 304 -14.080 -1.962 2.893 1.00 0.00 H new ATOM 0 HE ARG A 304 -15.757 -3.683 1.354 1.00 0.00 H new ATOM 0 HH11 ARG A 304 -15.678 -2.011 4.461 1.00 0.00 H new ATOM 0 HH12 ARG A 304 -17.435 -1.847 4.549 1.00 0.00 H new ATOM 0 HH21 ARG A 304 -18.013 -3.470 1.474 1.00 0.00 H new ATOM 0 HH22 ARG A 304 -18.752 -2.670 2.865 1.00 0.00 H new ATOM 1203 N LEU A 305 -9.909 -4.581 1.546 1.00 0.00 N ATOM 1204 CA LEU A 305 -8.595 -4.386 2.150 1.00 0.00 C ATOM 1205 C LEU A 305 -8.480 -2.995 2.766 1.00 0.00 C ATOM 1206 O LEU A 305 -8.855 -2.000 2.148 1.00 0.00 O ATOM 1207 CB LEU A 305 -7.497 -4.586 1.104 1.00 0.00 C ATOM 1208 CG LEU A 305 -7.621 -5.834 0.230 1.00 0.00 C ATOM 1209 CD1 LEU A 305 -6.565 -5.827 -0.864 1.00 0.00 C ATOM 1210 CD2 LEU A 305 -7.505 -7.093 1.078 1.00 0.00 C ATOM 0 H LEU A 305 -10.198 -3.834 0.914 1.00 0.00 H new ATOM 0 HA LEU A 305 -8.473 -5.125 2.942 1.00 0.00 H new ATOM 0 HB2 LEU A 305 -7.479 -3.712 0.453 1.00 0.00 H new ATOM 0 HB3 LEU A 305 -6.536 -4.621 1.617 1.00 0.00 H new ATOM 0 HG LEU A 305 -8.603 -5.827 -0.242 1.00 0.00 H new ATOM 0 HD11 LEU A 305 -6.669 -6.723 -1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 305 -6.695 -4.944 -1.489 1.00 0.00 H new ATOM 0 HD13 LEU A 305 -5.573 -5.809 -0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 305 -7.596 -7.972 0.439 1.00 0.00 H new ATOM 0 HD22 LEU A 305 -6.537 -7.107 1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 305 -8.299 -7.104 1.824 1.00 0.00 H new ATOM 1222 N ASN A 306 -7.958 -2.936 3.986 1.00 0.00 N ATOM 1223 CA ASN A 306 -7.791 -1.667 4.685 1.00 0.00 C ATOM 1224 C ASN A 306 -6.498 -0.978 4.261 1.00 0.00 C ATOM 1225 O ASN A 306 -5.412 -1.336 4.718 1.00 0.00 O ATOM 1226 CB ASN A 306 -7.791 -1.891 6.199 1.00 0.00 C ATOM 1227 CG ASN A 306 -8.333 -0.697 6.960 1.00 0.00 C ATOM 1228 OD1 ASN A 306 -7.668 -0.155 7.844 1.00 0.00 O ATOM 1229 ND2 ASN A 306 -9.547 -0.280 6.620 1.00 0.00 N ATOM 0 H ASN A 306 -7.643 -3.752 4.511 1.00 0.00 H new ATOM 0 HA ASN A 306 -8.629 -1.022 4.420 1.00 0.00 H new ATOM 0 HB2 ASN A 306 -8.391 -2.770 6.433 1.00 0.00 H new ATOM 0 HB3 ASN A 306 -6.775 -2.100 6.533 1.00 0.00 H new ATOM 0 HD21 ASN A 306 -9.964 0.519 7.097 1.00 0.00 H new ATOM 0 HD22 ASN A 306 -10.063 -0.759 5.882 1.00 0.00 H new ATOM 1236 N VAL A 307 -6.622 0.014 3.385 1.00 0.00 N ATOM 1237 CA VAL A 307 -5.463 0.755 2.900 1.00 0.00 C ATOM 1238 C VAL A 307 -5.371 2.125 3.562 1.00 0.00 C ATOM 1239 O VAL A 307 -6.361 2.851 3.653 1.00 0.00 O ATOM 1240 CB VAL A 307 -5.514 0.938 1.372 1.00 0.00 C ATOM 1241 CG1 VAL A 307 -4.381 1.840 0.904 1.00 0.00 C ATOM 1242 CG2 VAL A 307 -5.455 -0.411 0.672 1.00 0.00 C ATOM 0 H VAL A 307 -7.513 0.323 2.997 1.00 0.00 H new ATOM 0 HA VAL A 307 -4.581 0.169 3.159 1.00 0.00 H new ATOM 0 HB VAL A 307 -6.459 1.416 1.112 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -4.433 1.958 -0.178 1.00 0.00 H new ATOM 0 HG12 VAL A 307 -4.473 2.816 1.380 1.00 0.00 H new ATOM 0 HG13 VAL A 307 -3.424 1.393 1.175 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -5.492 -0.263 -0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 307 -4.527 -0.918 0.937 1.00 0.00 H new ATOM 0 HG23 VAL A 307 -6.303 -1.020 0.984 1.00 0.00 H new ATOM 1252 N LYS A 308 -4.175 2.474 4.024 1.00 0.00 N ATOM 1253 CA LYS A 308 -3.951 3.758 4.677 1.00 0.00 C ATOM 1254 C LYS A 308 -2.557 4.292 4.364 1.00 0.00 C ATOM 1255 O LYS A 308 -1.632 3.522 4.103 1.00 0.00 O ATOM 1256 CB LYS A 308 -4.127 3.621 6.191 1.00 0.00 C ATOM 1257 CG LYS A 308 -3.759 2.248 6.725 1.00 0.00 C ATOM 1258 CD LYS A 308 -3.778 2.216 8.244 1.00 0.00 C ATOM 1259 CE LYS A 308 -4.129 0.832 8.768 1.00 0.00 C ATOM 1260 NZ LYS A 308 -4.208 0.806 10.255 1.00 0.00 N ATOM 0 H LYS A 308 -3.345 1.885 3.958 1.00 0.00 H new ATOM 0 HA LYS A 308 -4.687 4.465 4.294 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -3.513 4.372 6.689 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -5.164 3.836 6.448 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -4.457 1.506 6.336 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -2.767 1.971 6.367 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -2.802 2.515 8.627 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -4.502 2.941 8.615 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -5.084 0.516 8.348 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -3.380 0.115 8.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -4.449 -0.154 10.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -3.289 1.083 10.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -4.941 1.471 10.575 1.00 0.00 H new ATOM 1274 N TRP A 309 -2.414 5.612 4.391 1.00 0.00 N ATOM 1275 CA TRP A 309 -1.131 6.248 4.111 1.00 0.00 C ATOM 1276 C TRP A 309 -0.045 5.714 5.039 1.00 0.00 C ATOM 1277 O TRP A 309 -0.225 5.663 6.255 1.00 0.00 O ATOM 1278 CB TRP A 309 -1.248 7.765 4.261 1.00 0.00 C ATOM 1279 CG TRP A 309 -1.720 8.451 3.015 1.00 0.00 C ATOM 1280 CD1 TRP A 309 -2.876 9.162 2.858 1.00 0.00 C ATOM 1281 CD2 TRP A 309 -1.049 8.488 1.751 1.00 0.00 C ATOM 1282 NE1 TRP A 309 -2.964 9.639 1.573 1.00 0.00 N ATOM 1283 CE2 TRP A 309 -1.855 9.240 0.874 1.00 0.00 C ATOM 1284 CE3 TRP A 309 0.154 7.962 1.275 1.00 0.00 C ATOM 1285 CZ2 TRP A 309 -1.495 9.476 -0.450 1.00 0.00 C ATOM 1286 CZ3 TRP A 309 0.511 8.196 -0.040 1.00 0.00 C ATOM 1287 CH2 TRP A 309 -0.311 8.948 -0.890 1.00 0.00 C ATOM 0 H TRP A 309 -3.170 6.263 4.604 1.00 0.00 H new ATOM 0 HA TRP A 309 -0.852 6.012 3.084 1.00 0.00 H new ATOM 0 HB2 TRP A 309 -1.938 7.990 5.074 1.00 0.00 H new ATOM 0 HB3 TRP A 309 -0.277 8.171 4.545 1.00 0.00 H new ATOM 0 HD1 TRP A 309 -3.613 9.325 3.631 1.00 0.00 H new ATOM 0 HE1 TRP A 309 -3.730 10.199 1.200 1.00 0.00 H new ATOM 0 HE3 TRP A 309 0.795 7.382 1.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 309 -2.127 10.055 -1.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 309 1.439 7.793 -0.418 1.00 0.00 H new ATOM 0 HH2 TRP A 309 -0.005 9.114 -1.912 1.00 0.00 H new ATOM 1298 N GLY A 310 1.083 5.319 4.457 1.00 0.00 N ATOM 1299 CA GLY A 310 2.181 4.795 5.248 1.00 0.00 C ATOM 1300 C GLY A 310 2.676 5.787 6.281 1.00 0.00 C ATOM 1301 O GLY A 310 1.932 6.181 7.179 1.00 0.00 O ATOM 0 H GLY A 310 1.256 5.352 3.452 1.00 0.00 H new ATOM 0 HA2 GLY A 310 1.860 3.882 5.750 1.00 0.00 H new ATOM 0 HA3 GLY A 310 3.004 4.523 4.587 1.00 0.00 H new