USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 705 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: B 367 LYS NZ :NH3+ -167:sc= -0.0261 (180deg=-0.248) USER MOD Set 1.2: B 368 ASN :FLIP amide:sc= 0 F(o=-1,f=-0.026) USER MOD Set 2.1: B 339 GLN :FLIP amide:sc= -0.179 F(o=-1.3,f=-0.21) USER MOD Set 2.2: B 343 LYS NZ :NH3+ -168:sc= -0.0316 (180deg=-0.199) USER MOD Set 3.1: A 373 MET CE :methyl 168:sc= -0.192 (180deg=-1.01) USER MOD Set 3.2: B 335 TYR OH : rot -78:sc= 0.0482 USER MOD Single : A 368 TYR OH : rot 180:sc= 0 USER MOD Single : A 371 SER OG : rot 113:sc= -0.111 USER MOD Single : A 372 SER OG : rot 76:sc= 0.469 USER MOD Single : A 376 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.26) USER MOD Single : B 305 ASN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : B 306 HIS : no HD1:sc= -0.0332 K(o=-0.033,f=-0.83) USER MOD Single : B 309 ASN :FLIP amide:sc= -0.0665 F(o=-1.5,f=-0.067) USER MOD Single : B 310 TYR OH : rot 124:sc= 0.262 USER MOD Single : B 312 ASN : amide:sc= -0.171 X(o=-0.17,f=-0.0016) USER MOD Single : B 313 LYS NZ :NH3+ -162:sc= -2.11! (180deg=-2.87!) USER MOD Single : B 315 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 316 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : B 319 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : B 321 GLN : amide:sc= -1.92 K(o=-1.9,f=-5!) USER MOD Single : B 325 TYR OH : rot 180:sc= 0 USER MOD Single : B 326 LYS NZ :NH3+ -146:sc= -1.91! (180deg=-4.26!) USER MOD Single : B 333 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : B 334 THR OG1 : rot 180:sc= 0 USER MOD Single : B 336 GLN : amide:sc= -0.181 K(o=-0.18,f=-2.2!) USER MOD Single : B 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 341 ASN : amide:sc= -0.618 X(o=-0.62,f=-0.86!) USER MOD Single : B 354 THR OG1 : rot 180:sc= 0 USER MOD Single : B 356 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.23) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN :FLIP amide:sc= -0.345 F(o=-2.4,f=-0.34) USER MOD Single : B 369 GLN :FLIP amide:sc= -0.0512 F(o=-1.3,f=-0.051) USER MOD Single : B 374 SER OG : rot -36:sc= 0.784 USER MOD Single : B 378 GLN : amide:sc= -2 K(o=-2,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 114 N ALA A 366 -0.329 -2.287 8.455 1.00 0.00 N ATOM 115 CA ALA A 366 -0.067 -1.849 7.089 1.00 0.00 C ATOM 116 C ALA A 366 -0.562 -2.886 6.086 1.00 0.00 C ATOM 117 O ALA A 366 -1.033 -2.544 4.998 1.00 0.00 O ATOM 118 CB ALA A 366 1.418 -1.585 6.891 1.00 0.00 C ATOM 0 HA ALA A 366 -0.611 -0.920 6.917 1.00 0.00 H new ATOM 0 HB1 ALA A 366 1.596 -1.259 5.866 1.00 0.00 H new ATOM 0 HB2 ALA A 366 1.744 -0.807 7.581 1.00 0.00 H new ATOM 0 HB3 ALA A 366 1.979 -2.500 7.083 1.00 0.00 H new ATOM 124 N VAL A 367 -0.446 -4.157 6.464 1.00 0.00 N ATOM 125 CA VAL A 367 -0.888 -5.252 5.611 1.00 0.00 C ATOM 126 C VAL A 367 -2.355 -5.082 5.235 1.00 0.00 C ATOM 127 O VAL A 367 -2.767 -5.434 4.131 1.00 0.00 O ATOM 128 CB VAL A 367 -0.697 -6.618 6.299 1.00 0.00 C ATOM 129 CG1 VAL A 367 -1.046 -7.751 5.346 1.00 0.00 C ATOM 130 CG2 VAL A 367 0.727 -6.765 6.813 1.00 0.00 C ATOM 0 H VAL A 367 -0.049 -4.452 7.356 1.00 0.00 H new ATOM 0 HA VAL A 367 -0.274 -5.226 4.711 1.00 0.00 H new ATOM 0 HB VAL A 367 -1.374 -6.670 7.152 1.00 0.00 H new ATOM 0 HG11 VAL A 367 -0.905 -8.707 5.850 1.00 0.00 H new ATOM 0 HG12 VAL A 367 -2.086 -7.656 5.033 1.00 0.00 H new ATOM 0 HG13 VAL A 367 -0.398 -7.703 4.471 1.00 0.00 H new ATOM 0 HG21 VAL A 367 0.841 -7.736 7.295 1.00 0.00 H new ATOM 0 HG22 VAL A 367 1.425 -6.690 5.979 1.00 0.00 H new ATOM 0 HG23 VAL A 367 0.937 -5.975 7.534 1.00 0.00 H new ATOM 140 N TYR A 368 -3.138 -4.537 6.163 1.00 0.00 N ATOM 141 CA TYR A 368 -4.560 -4.313 5.930 1.00 0.00 C ATOM 142 C TYR A 368 -4.766 -3.274 4.831 1.00 0.00 C ATOM 143 O TYR A 368 -5.688 -3.386 4.024 1.00 0.00 O ATOM 144 CB TYR A 368 -5.246 -3.857 7.219 1.00 0.00 C ATOM 145 CG TYR A 368 -6.753 -3.770 7.109 1.00 0.00 C ATOM 146 CD1 TYR A 368 -7.549 -4.895 7.295 1.00 0.00 C ATOM 147 CD2 TYR A 368 -7.380 -2.565 6.819 1.00 0.00 C ATOM 148 CE1 TYR A 368 -8.925 -4.820 7.195 1.00 0.00 C ATOM 149 CE2 TYR A 368 -8.756 -2.482 6.719 1.00 0.00 C ATOM 150 CZ TYR A 368 -9.524 -3.611 6.907 1.00 0.00 C ATOM 151 OH TYR A 368 -10.894 -3.531 6.807 1.00 0.00 O ATOM 0 H TYR A 368 -2.810 -4.243 7.083 1.00 0.00 H new ATOM 0 HA TYR A 368 -5.007 -5.254 5.608 1.00 0.00 H new ATOM 0 HB2 TYR A 368 -4.989 -4.549 8.021 1.00 0.00 H new ATOM 0 HB3 TYR A 368 -4.854 -2.880 7.502 1.00 0.00 H new ATOM 0 HD1 TYR A 368 -7.084 -5.843 7.521 1.00 0.00 H new ATOM 0 HD2 TYR A 368 -6.782 -1.678 6.669 1.00 0.00 H new ATOM 0 HE1 TYR A 368 -9.529 -5.703 7.342 1.00 0.00 H new ATOM 0 HE2 TYR A 368 -9.227 -1.537 6.495 1.00 0.00 H new ATOM 0 HH TYR A 368 -11.154 -2.609 6.601 1.00 0.00 H new ATOM 161 N VAL A 369 -3.900 -2.263 4.809 1.00 0.00 N ATOM 162 CA VAL A 369 -3.985 -1.210 3.805 1.00 0.00 C ATOM 163 C VAL A 369 -3.701 -1.771 2.418 1.00 0.00 C ATOM 164 O VAL A 369 -4.519 -1.649 1.504 1.00 0.00 O ATOM 165 CB VAL A 369 -2.992 -0.065 4.093 1.00 0.00 C ATOM 166 CG1 VAL A 369 -3.301 1.142 3.221 1.00 0.00 C ATOM 167 CG2 VAL A 369 -3.015 0.309 5.566 1.00 0.00 C ATOM 0 H VAL A 369 -3.134 -2.153 5.474 1.00 0.00 H new ATOM 0 HA VAL A 369 -4.999 -0.812 3.845 1.00 0.00 H new ATOM 0 HB VAL A 369 -1.988 -0.412 3.849 1.00 0.00 H new ATOM 0 HG11 VAL A 369 -2.590 1.939 3.438 1.00 0.00 H new ATOM 0 HG12 VAL A 369 -3.222 0.862 2.171 1.00 0.00 H new ATOM 0 HG13 VAL A 369 -4.313 1.491 3.428 1.00 0.00 H new ATOM 0 HG21 VAL A 369 -2.308 1.118 5.747 1.00 0.00 H new ATOM 0 HG22 VAL A 369 -4.018 0.635 5.843 1.00 0.00 H new ATOM 0 HG23 VAL A 369 -2.736 -0.557 6.166 1.00 0.00 H new ATOM 177 N LEU A 370 -2.534 -2.391 2.272 1.00 0.00 N ATOM 178 CA LEU A 370 -2.136 -2.975 0.998 1.00 0.00 C ATOM 179 C LEU A 370 -3.107 -4.076 0.575 1.00 0.00 C ATOM 180 O LEU A 370 -3.338 -4.289 -0.616 1.00 0.00 O ATOM 181 CB LEU A 370 -0.714 -3.525 1.091 1.00 0.00 C ATOM 182 CG LEU A 370 0.381 -2.476 1.297 1.00 0.00 C ATOM 183 CD1 LEU A 370 1.732 -3.149 1.482 1.00 0.00 C ATOM 184 CD2 LEU A 370 0.424 -1.507 0.124 1.00 0.00 C ATOM 0 H LEU A 370 -1.849 -2.501 3.020 1.00 0.00 H new ATOM 0 HA LEU A 370 -2.162 -2.192 0.240 1.00 0.00 H new ATOM 0 HB2 LEU A 370 -0.671 -4.238 1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 370 -0.496 -4.079 0.178 1.00 0.00 H new ATOM 0 HG LEU A 370 0.149 -1.910 2.199 1.00 0.00 H new ATOM 0 HD11 LEU A 370 2.500 -2.389 1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 370 1.697 -3.801 2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 370 1.969 -3.739 0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 370 1.209 -0.769 0.290 1.00 0.00 H new ATOM 0 HD22 LEU A 370 0.631 -2.056 -0.794 1.00 0.00 H new ATOM 0 HD23 LEU A 370 -0.537 -1.000 0.035 1.00 0.00 H new ATOM 196 N SER A 371 -3.676 -4.769 1.557 1.00 0.00 N ATOM 197 CA SER A 371 -4.629 -5.839 1.281 1.00 0.00 C ATOM 198 C SER A 371 -5.881 -5.277 0.624 1.00 0.00 C ATOM 199 O SER A 371 -6.304 -5.745 -0.435 1.00 0.00 O ATOM 200 CB SER A 371 -5.002 -6.573 2.571 1.00 0.00 C ATOM 201 OG SER A 371 -5.980 -7.569 2.326 1.00 0.00 O ATOM 0 H SER A 371 -3.494 -4.610 2.548 1.00 0.00 H new ATOM 0 HA SER A 371 -4.159 -6.547 0.599 1.00 0.00 H new ATOM 0 HB2 SER A 371 -4.112 -7.031 3.003 1.00 0.00 H new ATOM 0 HB3 SER A 371 -5.380 -5.859 3.303 1.00 0.00 H new ATOM 0 HG SER A 371 -5.590 -8.455 2.478 1.00 0.00 H new ATOM 207 N SER A 372 -6.470 -4.269 1.259 1.00 0.00 N ATOM 208 CA SER A 372 -7.670 -3.631 0.735 1.00 0.00 C ATOM 209 C SER A 372 -7.392 -3.025 -0.637 1.00 0.00 C ATOM 210 O SER A 372 -8.272 -2.970 -1.495 1.00 0.00 O ATOM 211 CB SER A 372 -8.161 -2.546 1.696 1.00 0.00 C ATOM 212 OG SER A 372 -8.464 -3.091 2.970 1.00 0.00 O ATOM 0 H SER A 372 -6.134 -3.877 2.139 1.00 0.00 H new ATOM 0 HA SER A 372 -8.447 -4.389 0.635 1.00 0.00 H new ATOM 0 HB2 SER A 372 -7.398 -1.775 1.799 1.00 0.00 H new ATOM 0 HB3 SER A 372 -9.047 -2.064 1.283 1.00 0.00 H new ATOM 0 HG SER A 372 -7.632 -3.269 3.456 1.00 0.00 H new ATOM 218 N MET A 373 -6.156 -2.574 -0.831 1.00 0.00 N ATOM 219 CA MET A 373 -5.747 -1.977 -2.098 1.00 0.00 C ATOM 220 C MET A 373 -5.878 -2.982 -3.239 1.00 0.00 C ATOM 221 O MET A 373 -6.627 -2.761 -4.190 1.00 0.00 O ATOM 222 CB MET A 373 -4.301 -1.481 -2.004 1.00 0.00 C ATOM 223 CG MET A 373 -3.825 -0.750 -3.249 1.00 0.00 C ATOM 224 SD MET A 373 -4.549 0.893 -3.412 1.00 0.00 S ATOM 225 CE MET A 373 -3.714 1.761 -2.087 1.00 0.00 C ATOM 0 H MET A 373 -5.420 -2.611 -0.126 1.00 0.00 H new ATOM 0 HA MET A 373 -6.404 -1.132 -2.305 1.00 0.00 H new ATOM 0 HB2 MET A 373 -4.209 -0.816 -1.145 1.00 0.00 H new ATOM 0 HB3 MET A 373 -3.645 -2.332 -1.820 1.00 0.00 H new ATOM 0 HG2 MET A 373 -2.739 -0.663 -3.221 1.00 0.00 H new ATOM 0 HG3 MET A 373 -4.074 -1.341 -4.130 1.00 0.00 H new ATOM 0 HE1 MET A 373 -3.889 2.832 -2.187 1.00 0.00 H new ATOM 0 HE2 MET A 373 -4.101 1.418 -1.127 1.00 0.00 H new ATOM 0 HE3 MET A 373 -2.644 1.561 -2.139 1.00 0.00 H new ATOM 235 N ALA A 374 -5.146 -4.089 -3.135 1.00 0.00 N ATOM 236 CA ALA A 374 -5.174 -5.126 -4.162 1.00 0.00 C ATOM 237 C ALA A 374 -6.575 -5.701 -4.341 1.00 0.00 C ATOM 238 O ALA A 374 -6.967 -6.065 -5.450 1.00 0.00 O ATOM 239 CB ALA A 374 -4.194 -6.238 -3.817 1.00 0.00 C ATOM 0 H ALA A 374 -4.527 -4.290 -2.350 1.00 0.00 H new ATOM 0 HA ALA A 374 -4.878 -4.665 -5.104 1.00 0.00 H new ATOM 0 HB1 ALA A 374 -4.226 -7.004 -4.592 1.00 0.00 H new ATOM 0 HB2 ALA A 374 -3.186 -5.828 -3.753 1.00 0.00 H new ATOM 0 HB3 ALA A 374 -4.467 -6.679 -2.859 1.00 0.00 H new ATOM 245 N ARG A 375 -7.326 -5.782 -3.248 1.00 0.00 N ATOM 246 CA ARG A 375 -8.680 -6.321 -3.295 1.00 0.00 C ATOM 247 C ARG A 375 -9.647 -5.310 -3.904 1.00 0.00 C ATOM 248 O ARG A 375 -10.710 -5.678 -4.403 1.00 0.00 O ATOM 249 CB ARG A 375 -9.145 -6.718 -1.894 1.00 0.00 C ATOM 250 CG ARG A 375 -10.329 -7.673 -1.894 1.00 0.00 C ATOM 251 CD ARG A 375 -9.959 -9.020 -2.494 1.00 0.00 C ATOM 252 NE ARG A 375 -11.057 -9.980 -2.408 1.00 0.00 N ATOM 253 CZ ARG A 375 -10.925 -11.274 -2.682 1.00 0.00 C ATOM 254 NH1 ARG A 375 -9.750 -11.757 -3.066 1.00 0.00 N ATOM 255 NH2 ARG A 375 -11.967 -12.087 -2.575 1.00 0.00 N ATOM 0 H ARG A 375 -7.021 -5.482 -2.322 1.00 0.00 H new ATOM 0 HA ARG A 375 -8.669 -7.209 -3.927 1.00 0.00 H new ATOM 0 HB2 ARG A 375 -8.314 -7.182 -1.362 1.00 0.00 H new ATOM 0 HB3 ARG A 375 -9.414 -5.818 -1.341 1.00 0.00 H new ATOM 0 HG2 ARG A 375 -10.684 -7.814 -0.873 1.00 0.00 H new ATOM 0 HG3 ARG A 375 -11.151 -7.235 -2.460 1.00 0.00 H new ATOM 0 HD2 ARG A 375 -9.676 -8.886 -3.538 1.00 0.00 H new ATOM 0 HD3 ARG A 375 -9.087 -9.420 -1.976 1.00 0.00 H new ATOM 0 HE ARG A 375 -11.975 -9.639 -2.122 1.00 0.00 H new ATOM 0 HH11 ARG A 375 -8.946 -11.135 -3.151 1.00 0.00 H new ATOM 0 HH12 ARG A 375 -9.651 -12.750 -3.276 1.00 0.00 H new ATOM 0 HH21 ARG A 375 -12.872 -11.720 -2.282 1.00 0.00 H new ATOM 0 HH22 ARG A 375 -11.863 -13.080 -2.786 1.00 0.00 H new ATOM 269 N GLN A 376 -9.273 -4.034 -3.855 1.00 0.00 N ATOM 270 CA GLN A 376 -10.105 -2.973 -4.411 1.00 0.00 C ATOM 271 C GLN A 376 -10.108 -3.042 -5.936 1.00 0.00 C ATOM 272 O GLN A 376 -10.881 -2.352 -6.601 1.00 0.00 O ATOM 273 CB GLN A 376 -9.600 -1.604 -3.945 1.00 0.00 C ATOM 274 CG GLN A 376 -10.512 -0.450 -4.331 1.00 0.00 C ATOM 275 CD GLN A 376 -11.886 -0.553 -3.698 1.00 0.00 C ATOM 276 OE1 GLN A 376 -12.794 -1.170 -4.256 1.00 0.00 O ATOM 277 NE2 GLN A 376 -12.047 0.057 -2.529 1.00 0.00 N ATOM 0 H GLN A 376 -8.401 -3.711 -3.437 1.00 0.00 H new ATOM 0 HA GLN A 376 -11.126 -3.111 -4.055 1.00 0.00 H new ATOM 0 HB2 GLN A 376 -9.487 -1.619 -2.861 1.00 0.00 H new ATOM 0 HB3 GLN A 376 -8.610 -1.429 -4.367 1.00 0.00 H new ATOM 0 HG2 GLN A 376 -10.048 0.490 -4.032 1.00 0.00 H new ATOM 0 HG3 GLN A 376 -10.617 -0.423 -5.416 1.00 0.00 H new ATOM 0 HE21 GLN A 376 -11.267 0.557 -2.103 1.00 0.00 H new ATOM 0 HE22 GLN A 376 -12.951 0.025 -2.058 1.00 0.00 H new ATOM 465 N VAL B 302 -3.819 -13.011 -3.237 1.00 0.00 N ATOM 466 CA VAL B 302 -3.153 -11.950 -3.983 1.00 0.00 C ATOM 467 C VAL B 302 -2.815 -10.761 -3.088 1.00 0.00 C ATOM 468 O VAL B 302 -1.737 -10.175 -3.197 1.00 0.00 O ATOM 469 CB VAL B 302 -4.022 -11.464 -5.160 1.00 0.00 C ATOM 470 CG1 VAL B 302 -4.216 -12.579 -6.176 1.00 0.00 C ATOM 471 CG2 VAL B 302 -5.368 -10.954 -4.660 1.00 0.00 C ATOM 0 HA VAL B 302 -2.227 -12.375 -4.371 1.00 0.00 H new ATOM 0 HB VAL B 302 -3.505 -10.639 -5.650 1.00 0.00 H new ATOM 0 HG11 VAL B 302 -4.832 -12.218 -7.000 1.00 0.00 H new ATOM 0 HG12 VAL B 302 -3.246 -12.895 -6.560 1.00 0.00 H new ATOM 0 HG13 VAL B 302 -4.710 -13.425 -5.698 1.00 0.00 H new ATOM 0 HG21 VAL B 302 -5.966 -10.616 -5.506 1.00 0.00 H new ATOM 0 HG22 VAL B 302 -5.892 -11.758 -4.143 1.00 0.00 H new ATOM 0 HG23 VAL B 302 -5.210 -10.123 -3.972 1.00 0.00 H new ATOM 481 N GLU B 303 -3.739 -10.415 -2.199 1.00 0.00 N ATOM 482 CA GLU B 303 -3.548 -9.290 -1.289 1.00 0.00 C ATOM 483 C GLU B 303 -2.473 -9.588 -0.248 1.00 0.00 C ATOM 484 O GLU B 303 -1.592 -8.765 -0.003 1.00 0.00 O ATOM 485 CB GLU B 303 -4.868 -8.944 -0.596 1.00 0.00 C ATOM 486 CG GLU B 303 -5.661 -10.164 -0.160 1.00 0.00 C ATOM 487 CD GLU B 303 -6.919 -9.802 0.605 1.00 0.00 C ATOM 488 OE1 GLU B 303 -7.884 -9.330 -0.030 1.00 0.00 O ATOM 489 OE2 GLU B 303 -6.938 -9.992 1.839 1.00 0.00 O ATOM 0 H GLU B 303 -4.630 -10.898 -2.088 1.00 0.00 H new ATOM 0 HA GLU B 303 -3.215 -8.436 -1.879 1.00 0.00 H new ATOM 0 HB2 GLU B 303 -4.660 -8.325 0.277 1.00 0.00 H new ATOM 0 HB3 GLU B 303 -5.479 -8.346 -1.273 1.00 0.00 H new ATOM 0 HG2 GLU B 303 -5.931 -10.750 -1.039 1.00 0.00 H new ATOM 0 HG3 GLU B 303 -5.031 -10.798 0.464 1.00 0.00 H new ATOM 496 N PHE B 304 -2.549 -10.766 0.363 1.00 0.00 N ATOM 497 CA PHE B 304 -1.583 -11.162 1.383 1.00 0.00 C ATOM 498 C PHE B 304 -0.180 -11.293 0.797 1.00 0.00 C ATOM 499 O PHE B 304 0.783 -10.756 1.343 1.00 0.00 O ATOM 500 CB PHE B 304 -2.002 -12.486 2.025 1.00 0.00 C ATOM 501 CG PHE B 304 -3.352 -12.435 2.681 1.00 0.00 C ATOM 502 CD1 PHE B 304 -3.513 -11.835 3.919 1.00 0.00 C ATOM 503 CD2 PHE B 304 -4.460 -12.985 2.056 1.00 0.00 C ATOM 504 CE1 PHE B 304 -4.755 -11.786 4.524 1.00 0.00 C ATOM 505 CE2 PHE B 304 -5.704 -12.938 2.656 1.00 0.00 C ATOM 506 CZ PHE B 304 -5.852 -12.338 3.892 1.00 0.00 C ATOM 0 H PHE B 304 -3.269 -11.463 0.170 1.00 0.00 H new ATOM 0 HA PHE B 304 -1.564 -10.382 2.144 1.00 0.00 H new ATOM 0 HB2 PHE B 304 -2.007 -13.265 1.262 1.00 0.00 H new ATOM 0 HB3 PHE B 304 -1.257 -12.772 2.767 1.00 0.00 H new ATOM 0 HD1 PHE B 304 -2.659 -11.401 4.417 1.00 0.00 H new ATOM 0 HD2 PHE B 304 -4.350 -13.455 1.090 1.00 0.00 H new ATOM 0 HE1 PHE B 304 -4.867 -11.316 5.490 1.00 0.00 H new ATOM 0 HE2 PHE B 304 -6.560 -13.370 2.159 1.00 0.00 H new ATOM 0 HZ PHE B 304 -6.823 -12.301 4.363 1.00 0.00 H new ATOM 516 N ASN B 305 -0.073 -12.011 -0.316 1.00 0.00 N ATOM 517 CA ASN B 305 1.213 -12.227 -0.971 1.00 0.00 C ATOM 518 C ASN B 305 1.862 -10.911 -1.392 1.00 0.00 C ATOM 519 O ASN B 305 3.014 -10.644 -1.051 1.00 0.00 O ATOM 520 CB ASN B 305 1.034 -13.132 -2.192 1.00 0.00 C ATOM 521 CG ASN B 305 2.351 -13.473 -2.861 1.00 0.00 C ATOM 522 OD1 ASN B 305 3.406 -13.603 -2.064 1.00 0.00 O flip ATOM 523 ND2 ASN B 305 2.419 -13.625 -4.081 1.00 0.00 N flip ATOM 0 H ASN B 305 -0.863 -12.454 -0.785 1.00 0.00 H new ATOM 0 HA ASN B 305 1.874 -12.710 -0.251 1.00 0.00 H new ATOM 0 HB2 ASN B 305 0.536 -14.053 -1.888 1.00 0.00 H new ATOM 0 HB3 ASN B 305 0.381 -12.639 -2.913 1.00 0.00 H new ATOM 0 HD21 ASN B 305 1.584 -13.516 -4.656 1.00 0.00 H new ATOM 0 HD22 ASN B 305 3.311 -13.860 -4.517 1.00 0.00 H new ATOM 530 N HIS B 306 1.121 -10.093 -2.133 1.00 0.00 N ATOM 531 CA HIS B 306 1.639 -8.812 -2.608 1.00 0.00 C ATOM 532 C HIS B 306 2.026 -7.893 -1.451 1.00 0.00 C ATOM 533 O HIS B 306 3.167 -7.439 -1.368 1.00 0.00 O ATOM 534 CB HIS B 306 0.609 -8.120 -3.503 1.00 0.00 C ATOM 535 CG HIS B 306 0.529 -8.698 -4.883 1.00 0.00 C ATOM 536 ND1 HIS B 306 0.518 -7.924 -6.025 1.00 0.00 N ATOM 537 CD2 HIS B 306 0.457 -9.985 -5.304 1.00 0.00 C ATOM 538 CE1 HIS B 306 0.444 -8.706 -7.087 1.00 0.00 C ATOM 539 NE2 HIS B 306 0.406 -9.961 -6.676 1.00 0.00 N ATOM 0 H HIS B 306 0.162 -10.293 -2.418 1.00 0.00 H new ATOM 0 HA HIS B 306 2.539 -9.018 -3.187 1.00 0.00 H new ATOM 0 HB2 HIS B 306 -0.372 -8.187 -3.033 1.00 0.00 H new ATOM 0 HB3 HIS B 306 0.856 -7.061 -3.575 1.00 0.00 H new ATOM 0 HD2 HIS B 306 0.442 -10.864 -4.677 1.00 0.00 H new ATOM 0 HE1 HIS B 306 0.419 -8.376 -8.115 1.00 0.00 H new ATOM 0 HE2 HIS B 306 0.348 -10.780 -7.281 1.00 0.00 H new ATOM 548 N ALA B 307 1.074 -7.624 -0.564 1.00 0.00 N ATOM 549 CA ALA B 307 1.311 -6.746 0.581 1.00 0.00 C ATOM 550 C ALA B 307 2.548 -7.160 1.379 1.00 0.00 C ATOM 551 O ALA B 307 3.499 -6.389 1.502 1.00 0.00 O ATOM 552 CB ALA B 307 0.088 -6.722 1.484 1.00 0.00 C ATOM 0 H ALA B 307 0.128 -8.002 -0.615 1.00 0.00 H new ATOM 0 HA ALA B 307 1.495 -5.745 0.192 1.00 0.00 H new ATOM 0 HB1 ALA B 307 0.276 -6.065 2.333 1.00 0.00 H new ATOM 0 HB2 ALA B 307 -0.771 -6.354 0.923 1.00 0.00 H new ATOM 0 HB3 ALA B 307 -0.119 -7.730 1.844 1.00 0.00 H new ATOM 558 N ILE B 308 2.526 -8.374 1.920 1.00 0.00 N ATOM 559 CA ILE B 308 3.640 -8.881 2.719 1.00 0.00 C ATOM 560 C ILE B 308 4.970 -8.770 1.975 1.00 0.00 C ATOM 561 O ILE B 308 5.915 -8.154 2.469 1.00 0.00 O ATOM 562 CB ILE B 308 3.413 -10.351 3.132 1.00 0.00 C ATOM 563 CG1 ILE B 308 2.159 -10.474 4.004 1.00 0.00 C ATOM 564 CG2 ILE B 308 4.633 -10.898 3.861 1.00 0.00 C ATOM 565 CD1 ILE B 308 2.237 -9.706 5.309 1.00 0.00 C ATOM 0 H ILE B 308 1.749 -9.027 1.820 1.00 0.00 H new ATOM 0 HA ILE B 308 3.685 -8.259 3.613 1.00 0.00 H new ATOM 0 HB ILE B 308 3.263 -10.944 2.230 1.00 0.00 H new ATOM 0 HG12 ILE B 308 1.298 -10.120 3.437 1.00 0.00 H new ATOM 0 HG13 ILE B 308 1.984 -11.527 4.224 1.00 0.00 H new ATOM 0 HG21 ILE B 308 4.453 -11.935 4.144 1.00 0.00 H new ATOM 0 HG22 ILE B 308 5.502 -10.846 3.205 1.00 0.00 H new ATOM 0 HG23 ILE B 308 4.818 -10.305 4.756 1.00 0.00 H new ATOM 0 HD11 ILE B 308 1.312 -9.844 5.868 1.00 0.00 H new ATOM 0 HD12 ILE B 308 3.076 -10.075 5.899 1.00 0.00 H new ATOM 0 HD13 ILE B 308 2.380 -8.646 5.099 1.00 0.00 H new ATOM 577 N ASN B 309 5.039 -9.371 0.791 1.00 0.00 N ATOM 578 CA ASN B 309 6.258 -9.345 -0.013 1.00 0.00 C ATOM 579 C ASN B 309 6.698 -7.915 -0.315 1.00 0.00 C ATOM 580 O ASN B 309 7.887 -7.645 -0.480 1.00 0.00 O ATOM 581 CB ASN B 309 6.045 -10.108 -1.321 1.00 0.00 C ATOM 582 CG ASN B 309 7.274 -10.093 -2.211 1.00 0.00 C ATOM 583 OD1 ASN B 309 8.452 -10.061 -1.597 1.00 0.00 O flip ATOM 584 ND2 ASN B 309 7.167 -10.114 -3.437 1.00 0.00 N flip ATOM 0 H ASN B 309 4.265 -9.882 0.366 1.00 0.00 H new ATOM 0 HA ASN B 309 7.046 -9.828 0.565 1.00 0.00 H new ATOM 0 HB2 ASN B 309 5.776 -11.140 -1.096 1.00 0.00 H new ATOM 0 HB3 ASN B 309 5.205 -9.670 -1.860 1.00 0.00 H new ATOM 0 HD21 ASN B 309 6.243 -10.138 -3.868 1.00 0.00 H new ATOM 0 HD22 ASN B 309 8.003 -10.107 -4.022 1.00 0.00 H new ATOM 591 N TYR B 310 5.735 -7.004 -0.383 1.00 0.00 N ATOM 592 CA TYR B 310 6.024 -5.602 -0.677 1.00 0.00 C ATOM 593 C TYR B 310 6.762 -4.934 0.481 1.00 0.00 C ATOM 594 O TYR B 310 7.884 -4.450 0.319 1.00 0.00 O ATOM 595 CB TYR B 310 4.722 -4.855 -0.973 1.00 0.00 C ATOM 596 CG TYR B 310 4.913 -3.540 -1.694 1.00 0.00 C ATOM 597 CD1 TYR B 310 5.586 -3.482 -2.909 1.00 0.00 C ATOM 598 CD2 TYR B 310 4.414 -2.358 -1.163 1.00 0.00 C ATOM 599 CE1 TYR B 310 5.755 -2.283 -3.573 1.00 0.00 C ATOM 600 CE2 TYR B 310 4.578 -1.156 -1.823 1.00 0.00 C ATOM 601 CZ TYR B 310 5.249 -1.122 -3.027 1.00 0.00 C ATOM 602 OH TYR B 310 5.415 0.074 -3.686 1.00 0.00 O ATOM 0 H TYR B 310 4.746 -7.209 -0.239 1.00 0.00 H new ATOM 0 HA TYR B 310 6.671 -5.563 -1.553 1.00 0.00 H new ATOM 0 HB2 TYR B 310 4.077 -5.496 -1.574 1.00 0.00 H new ATOM 0 HB3 TYR B 310 4.201 -4.669 -0.034 1.00 0.00 H new ATOM 0 HD1 TYR B 310 5.983 -4.389 -3.340 1.00 0.00 H new ATOM 0 HD2 TYR B 310 3.889 -2.379 -0.219 1.00 0.00 H new ATOM 0 HE1 TYR B 310 6.281 -2.255 -4.516 1.00 0.00 H new ATOM 0 HE2 TYR B 310 4.182 -0.246 -1.397 1.00 0.00 H new ATOM 0 HH TYR B 310 4.539 0.486 -3.842 1.00 0.00 H new ATOM 612 N VAL B 311 6.131 -4.915 1.650 1.00 0.00 N ATOM 613 CA VAL B 311 6.724 -4.297 2.831 1.00 0.00 C ATOM 614 C VAL B 311 8.021 -4.997 3.231 1.00 0.00 C ATOM 615 O VAL B 311 8.905 -4.390 3.834 1.00 0.00 O ATOM 616 CB VAL B 311 5.753 -4.320 4.029 1.00 0.00 C ATOM 617 CG1 VAL B 311 6.332 -3.550 5.208 1.00 0.00 C ATOM 618 CG2 VAL B 311 4.396 -3.754 3.635 1.00 0.00 C ATOM 0 H VAL B 311 5.208 -5.321 1.805 1.00 0.00 H new ATOM 0 HA VAL B 311 6.940 -3.262 2.566 1.00 0.00 H new ATOM 0 HB VAL B 311 5.615 -5.358 4.333 1.00 0.00 H new ATOM 0 HG11 VAL B 311 5.630 -3.579 6.042 1.00 0.00 H new ATOM 0 HG12 VAL B 311 7.275 -4.004 5.511 1.00 0.00 H new ATOM 0 HG13 VAL B 311 6.506 -2.514 4.916 1.00 0.00 H new ATOM 0 HG21 VAL B 311 3.727 -3.780 4.495 1.00 0.00 H new ATOM 0 HG22 VAL B 311 4.515 -2.724 3.299 1.00 0.00 H new ATOM 0 HG23 VAL B 311 3.973 -4.352 2.828 1.00 0.00 H new ATOM 628 N ASN B 312 8.130 -6.275 2.884 1.00 0.00 N ATOM 629 CA ASN B 312 9.313 -7.062 3.214 1.00 0.00 C ATOM 630 C ASN B 312 10.512 -6.655 2.359 1.00 0.00 C ATOM 631 O ASN B 312 11.563 -6.285 2.886 1.00 0.00 O ATOM 632 CB ASN B 312 9.023 -8.552 3.027 1.00 0.00 C ATOM 633 CG ASN B 312 10.220 -9.425 3.350 1.00 0.00 C ATOM 634 OD1 ASN B 312 10.401 -9.855 4.488 1.00 0.00 O ATOM 635 ND2 ASN B 312 11.046 -9.691 2.344 1.00 0.00 N ATOM 0 H ASN B 312 7.412 -6.789 2.373 1.00 0.00 H new ATOM 0 HA ASN B 312 9.561 -6.869 4.258 1.00 0.00 H new ATOM 0 HB2 ASN B 312 8.187 -8.838 3.665 1.00 0.00 H new ATOM 0 HB3 ASN B 312 8.714 -8.732 1.997 1.00 0.00 H new ATOM 0 HD21 ASN B 312 11.869 -10.273 2.500 1.00 0.00 H new ATOM 0 HD22 ASN B 312 10.857 -9.313 1.416 1.00 0.00 H new ATOM 642 N LYS B 313 10.349 -6.725 1.042 1.00 0.00 N ATOM 643 CA LYS B 313 11.422 -6.375 0.115 1.00 0.00 C ATOM 644 C LYS B 313 11.845 -4.918 0.272 1.00 0.00 C ATOM 645 O LYS B 313 13.013 -4.580 0.080 1.00 0.00 O ATOM 646 CB LYS B 313 10.986 -6.644 -1.330 1.00 0.00 C ATOM 647 CG LYS B 313 9.851 -5.754 -1.811 1.00 0.00 C ATOM 648 CD LYS B 313 10.361 -4.604 -2.665 1.00 0.00 C ATOM 649 CE LYS B 313 10.642 -5.044 -4.096 1.00 0.00 C ATOM 650 NZ LYS B 313 11.797 -5.982 -4.178 1.00 0.00 N ATOM 0 H LYS B 313 9.483 -7.021 0.591 1.00 0.00 H new ATOM 0 HA LYS B 313 12.282 -7.001 0.353 1.00 0.00 H new ATOM 0 HB2 LYS B 313 11.844 -6.508 -1.988 1.00 0.00 H new ATOM 0 HB3 LYS B 313 10.679 -7.686 -1.418 1.00 0.00 H new ATOM 0 HG2 LYS B 313 9.142 -6.348 -2.387 1.00 0.00 H new ATOM 0 HG3 LYS B 313 9.310 -5.357 -0.952 1.00 0.00 H new ATOM 0 HD2 LYS B 313 9.625 -3.800 -2.670 1.00 0.00 H new ATOM 0 HD3 LYS B 313 11.272 -4.199 -2.224 1.00 0.00 H new ATOM 0 HE2 LYS B 313 9.755 -5.525 -4.508 1.00 0.00 H new ATOM 0 HE3 LYS B 313 10.843 -4.167 -4.711 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 12.146 -6.018 -5.157 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 12.558 -5.651 -3.551 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 11.494 -6.932 -3.884 1.00 0.00 H new ATOM 664 N ILE B 314 10.895 -4.058 0.625 1.00 0.00 N ATOM 665 CA ILE B 314 11.179 -2.638 0.800 1.00 0.00 C ATOM 666 C ILE B 314 11.890 -2.365 2.123 1.00 0.00 C ATOM 667 O ILE B 314 12.805 -1.542 2.186 1.00 0.00 O ATOM 668 CB ILE B 314 9.887 -1.801 0.728 1.00 0.00 C ATOM 669 CG1 ILE B 314 9.255 -1.934 -0.658 1.00 0.00 C ATOM 670 CG2 ILE B 314 10.175 -0.340 1.049 1.00 0.00 C ATOM 671 CD1 ILE B 314 7.875 -1.322 -0.759 1.00 0.00 C ATOM 0 H ILE B 314 9.924 -4.319 0.795 1.00 0.00 H new ATOM 0 HA ILE B 314 11.840 -2.345 -0.016 1.00 0.00 H new ATOM 0 HB ILE B 314 9.184 -2.178 1.471 1.00 0.00 H new ATOM 0 HG12 ILE B 314 9.907 -1.461 -1.392 1.00 0.00 H new ATOM 0 HG13 ILE B 314 9.194 -2.990 -0.920 1.00 0.00 H new ATOM 0 HG21 ILE B 314 9.250 0.234 0.993 1.00 0.00 H new ATOM 0 HG22 ILE B 314 10.589 -0.263 2.054 1.00 0.00 H new ATOM 0 HG23 ILE B 314 10.892 0.056 0.330 1.00 0.00 H new ATOM 0 HD11 ILE B 314 7.491 -1.455 -1.770 1.00 0.00 H new ATOM 0 HD12 ILE B 314 7.207 -1.811 -0.050 1.00 0.00 H new ATOM 0 HD13 ILE B 314 7.931 -0.258 -0.529 1.00 0.00 H new ATOM 683 N LYS B 315 11.472 -3.059 3.175 1.00 0.00 N ATOM 684 CA LYS B 315 12.073 -2.882 4.493 1.00 0.00 C ATOM 685 C LYS B 315 13.529 -3.342 4.495 1.00 0.00 C ATOM 686 O LYS B 315 14.384 -2.718 5.124 1.00 0.00 O ATOM 687 CB LYS B 315 11.271 -3.654 5.548 1.00 0.00 C ATOM 688 CG LYS B 315 11.677 -3.346 6.984 1.00 0.00 C ATOM 689 CD LYS B 315 12.833 -4.221 7.452 1.00 0.00 C ATOM 690 CE LYS B 315 12.431 -5.685 7.548 1.00 0.00 C ATOM 691 NZ LYS B 315 13.577 -6.549 7.945 1.00 0.00 N ATOM 0 H LYS B 315 10.721 -3.748 3.142 1.00 0.00 H new ATOM 0 HA LYS B 315 12.051 -1.820 4.738 1.00 0.00 H new ATOM 0 HB2 LYS B 315 10.213 -3.425 5.424 1.00 0.00 H new ATOM 0 HB3 LYS B 315 11.389 -4.723 5.369 1.00 0.00 H new ATOM 0 HG2 LYS B 315 11.962 -2.297 7.063 1.00 0.00 H new ATOM 0 HG3 LYS B 315 10.821 -3.494 7.642 1.00 0.00 H new ATOM 0 HD2 LYS B 315 13.669 -4.118 6.761 1.00 0.00 H new ATOM 0 HD3 LYS B 315 13.180 -3.875 8.426 1.00 0.00 H new ATOM 0 HE2 LYS B 315 11.625 -5.794 8.274 1.00 0.00 H new ATOM 0 HE3 LYS B 315 12.041 -6.018 6.586 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 13.263 -7.539 8.000 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 14.336 -6.465 7.239 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 13.934 -6.247 8.874 1.00 0.00 H new ATOM 705 N ASN B 316 13.804 -4.433 3.787 1.00 0.00 N ATOM 706 CA ASN B 316 15.156 -4.981 3.718 1.00 0.00 C ATOM 707 C ASN B 316 16.046 -4.161 2.786 1.00 0.00 C ATOM 708 O ASN B 316 17.141 -3.747 3.167 1.00 0.00 O ATOM 709 CB ASN B 316 15.111 -6.435 3.247 1.00 0.00 C ATOM 710 CG ASN B 316 16.490 -7.058 3.153 1.00 0.00 C ATOM 711 OD1 ASN B 316 17.399 -6.700 3.904 1.00 0.00 O ATOM 712 ND2 ASN B 316 16.654 -7.997 2.228 1.00 0.00 N ATOM 0 H ASN B 316 13.110 -4.955 3.253 1.00 0.00 H new ATOM 0 HA ASN B 316 15.584 -4.936 4.719 1.00 0.00 H new ATOM 0 HB2 ASN B 316 14.499 -7.018 3.935 1.00 0.00 H new ATOM 0 HB3 ASN B 316 14.627 -6.483 2.271 1.00 0.00 H new ATOM 0 HD21 ASN B 316 17.560 -8.452 2.118 1.00 0.00 H new ATOM 0 HD22 ASN B 316 15.874 -8.263 1.627 1.00 0.00 H new ATOM 719 N ARG B 317 15.570 -3.932 1.566 1.00 0.00 N ATOM 720 CA ARG B 317 16.329 -3.168 0.578 1.00 0.00 C ATOM 721 C ARG B 317 16.613 -1.752 1.069 1.00 0.00 C ATOM 722 O ARG B 317 17.770 -1.368 1.251 1.00 0.00 O ATOM 723 CB ARG B 317 15.566 -3.114 -0.748 1.00 0.00 C ATOM 724 CG ARG B 317 16.333 -2.426 -1.868 1.00 0.00 C ATOM 725 CD ARG B 317 17.551 -3.234 -2.285 1.00 0.00 C ATOM 726 NE ARG B 317 17.189 -4.581 -2.719 1.00 0.00 N ATOM 727 CZ ARG B 317 18.038 -5.423 -3.300 1.00 0.00 C ATOM 728 NH1 ARG B 317 19.294 -5.056 -3.522 1.00 0.00 N ATOM 729 NH2 ARG B 317 17.632 -6.633 -3.661 1.00 0.00 N ATOM 0 H ARG B 317 14.663 -4.264 1.237 1.00 0.00 H new ATOM 0 HA ARG B 317 17.283 -3.674 0.427 1.00 0.00 H new ATOM 0 HB2 ARG B 317 15.322 -4.130 -1.058 1.00 0.00 H new ATOM 0 HB3 ARG B 317 14.622 -2.592 -0.593 1.00 0.00 H new ATOM 0 HG2 ARG B 317 15.677 -2.285 -2.727 1.00 0.00 H new ATOM 0 HG3 ARG B 317 16.647 -1.435 -1.540 1.00 0.00 H new ATOM 0 HD2 ARG B 317 18.069 -2.719 -3.094 1.00 0.00 H new ATOM 0 HD3 ARG B 317 18.248 -3.297 -1.450 1.00 0.00 H new ATOM 0 HE ARG B 317 16.230 -4.893 -2.568 1.00 0.00 H new ATOM 0 HH11 ARG B 317 19.610 -4.126 -3.247 1.00 0.00 H new ATOM 0 HH12 ARG B 317 19.943 -5.704 -3.968 1.00 0.00 H new ATOM 0 HH21 ARG B 317 16.667 -6.918 -3.493 1.00 0.00 H new ATOM 0 HH22 ARG B 317 18.284 -7.278 -4.107 1.00 0.00 H new ATOM 743 N PHE B 318 15.553 -0.979 1.282 1.00 0.00 N ATOM 744 CA PHE B 318 15.690 0.399 1.746 1.00 0.00 C ATOM 745 C PHE B 318 15.775 0.463 3.267 1.00 0.00 C ATOM 746 O PHE B 318 15.230 1.373 3.894 1.00 0.00 O ATOM 747 CB PHE B 318 14.512 1.238 1.248 1.00 0.00 C ATOM 748 CG PHE B 318 14.470 1.371 -0.248 1.00 0.00 C ATOM 749 CD1 PHE B 318 13.984 0.340 -1.034 1.00 0.00 C ATOM 750 CD2 PHE B 318 14.921 2.527 -0.867 1.00 0.00 C ATOM 751 CE1 PHE B 318 13.947 0.457 -2.410 1.00 0.00 C ATOM 752 CE2 PHE B 318 14.885 2.650 -2.243 1.00 0.00 C ATOM 753 CZ PHE B 318 14.398 1.614 -3.016 1.00 0.00 C ATOM 0 H PHE B 318 14.589 -1.282 1.141 1.00 0.00 H new ATOM 0 HA PHE B 318 16.617 0.804 1.340 1.00 0.00 H new ATOM 0 HB2 PHE B 318 13.582 0.786 1.592 1.00 0.00 H new ATOM 0 HB3 PHE B 318 14.568 2.231 1.693 1.00 0.00 H new ATOM 0 HD1 PHE B 318 13.630 -0.566 -0.566 1.00 0.00 H new ATOM 0 HD2 PHE B 318 15.304 3.340 -0.268 1.00 0.00 H new ATOM 0 HE1 PHE B 318 13.566 -0.355 -3.011 1.00 0.00 H new ATOM 0 HE2 PHE B 318 15.238 3.556 -2.714 1.00 0.00 H new ATOM 0 HZ PHE B 318 14.370 1.708 -4.092 1.00 0.00 H new ATOM 763 N GLN B 319 16.472 -0.504 3.853 1.00 0.00 N ATOM 764 CA GLN B 319 16.635 -0.563 5.301 1.00 0.00 C ATOM 765 C GLN B 319 17.448 0.625 5.806 1.00 0.00 C ATOM 766 O GLN B 319 17.266 1.080 6.936 1.00 0.00 O ATOM 767 CB GLN B 319 17.324 -1.868 5.701 1.00 0.00 C ATOM 768 CG GLN B 319 17.381 -2.091 7.203 1.00 0.00 C ATOM 769 CD GLN B 319 18.183 -3.320 7.582 1.00 0.00 C ATOM 770 OE1 GLN B 319 19.125 -3.701 6.885 1.00 0.00 O ATOM 771 NE2 GLN B 319 17.812 -3.949 8.690 1.00 0.00 N ATOM 0 H GLN B 319 16.934 -1.259 3.346 1.00 0.00 H new ATOM 0 HA GLN B 319 15.645 -0.524 5.756 1.00 0.00 H new ATOM 0 HB2 GLN B 319 16.798 -2.703 5.238 1.00 0.00 H new ATOM 0 HB3 GLN B 319 18.339 -1.870 5.303 1.00 0.00 H new ATOM 0 HG2 GLN B 319 17.820 -1.215 7.680 1.00 0.00 H new ATOM 0 HG3 GLN B 319 16.367 -2.190 7.590 1.00 0.00 H new ATOM 0 HE21 GLN B 319 17.026 -3.598 9.237 1.00 0.00 H new ATOM 0 HE22 GLN B 319 18.313 -4.783 8.995 1.00 0.00 H new ATOM 780 N GLY B 320 18.344 1.124 4.959 1.00 0.00 N ATOM 781 CA GLY B 320 19.177 2.252 5.338 1.00 0.00 C ATOM 782 C GLY B 320 18.495 3.585 5.104 1.00 0.00 C ATOM 783 O GLY B 320 19.053 4.636 5.414 1.00 0.00 O ATOM 0 H GLY B 320 18.508 0.768 4.017 1.00 0.00 H new ATOM 0 HA2 GLY B 320 19.443 2.164 6.391 1.00 0.00 H new ATOM 0 HA3 GLY B 320 20.107 2.219 4.770 1.00 0.00 H new ATOM 787 N GLN B 321 17.284 3.541 4.555 1.00 0.00 N ATOM 788 CA GLN B 321 16.525 4.755 4.281 1.00 0.00 C ATOM 789 C GLN B 321 15.324 4.871 5.221 1.00 0.00 C ATOM 790 O GLN B 321 14.247 4.352 4.926 1.00 0.00 O ATOM 791 CB GLN B 321 16.050 4.767 2.825 1.00 0.00 C ATOM 792 CG GLN B 321 17.171 4.967 1.816 1.00 0.00 C ATOM 793 CD GLN B 321 18.157 3.815 1.794 1.00 0.00 C ATOM 794 OE1 GLN B 321 17.794 2.667 2.049 1.00 0.00 O ATOM 795 NE2 GLN B 321 19.414 4.118 1.491 1.00 0.00 N ATOM 0 H GLN B 321 16.809 2.678 4.292 1.00 0.00 H new ATOM 0 HA GLN B 321 17.180 5.609 4.450 1.00 0.00 H new ATOM 0 HB2 GLN B 321 15.544 3.826 2.610 1.00 0.00 H new ATOM 0 HB3 GLN B 321 15.314 5.561 2.699 1.00 0.00 H new ATOM 0 HG2 GLN B 321 16.741 5.090 0.822 1.00 0.00 H new ATOM 0 HG3 GLN B 321 17.703 5.889 2.049 1.00 0.00 H new ATOM 0 HE21 GLN B 321 19.671 5.084 1.286 1.00 0.00 H new ATOM 0 HE22 GLN B 321 20.123 3.385 1.463 1.00 0.00 H new ATOM 804 N PRO B 322 15.497 5.547 6.374 1.00 0.00 N ATOM 805 CA PRO B 322 14.420 5.720 7.352 1.00 0.00 C ATOM 806 C PRO B 322 13.434 6.814 6.951 1.00 0.00 C ATOM 807 O PRO B 322 12.258 6.759 7.306 1.00 0.00 O ATOM 808 CB PRO B 322 15.172 6.122 8.618 1.00 0.00 C ATOM 809 CG PRO B 322 16.371 6.850 8.119 1.00 0.00 C ATOM 810 CD PRO B 322 16.752 6.188 6.821 1.00 0.00 C ATOM 0 HA PRO B 322 13.813 4.821 7.457 1.00 0.00 H new ATOM 0 HB2 PRO B 322 14.560 6.756 9.259 1.00 0.00 H new ATOM 0 HB3 PRO B 322 15.453 5.249 9.207 1.00 0.00 H new ATOM 0 HG2 PRO B 322 16.150 7.907 7.967 1.00 0.00 H new ATOM 0 HG3 PRO B 322 17.188 6.795 8.839 1.00 0.00 H new ATOM 0 HD2 PRO B 322 17.113 6.914 6.092 1.00 0.00 H new ATOM 0 HD3 PRO B 322 17.547 5.456 6.963 1.00 0.00 H new ATOM 818 N ASP B 323 13.920 7.806 6.211 1.00 0.00 N ATOM 819 CA ASP B 323 13.076 8.911 5.769 1.00 0.00 C ATOM 820 C ASP B 323 12.058 8.443 4.735 1.00 0.00 C ATOM 821 O ASP B 323 10.877 8.779 4.817 1.00 0.00 O ATOM 822 CB ASP B 323 13.934 10.036 5.186 1.00 0.00 C ATOM 823 CG ASP B 323 13.097 11.179 4.644 1.00 0.00 C ATOM 824 OD1 ASP B 323 12.633 12.010 5.454 1.00 0.00 O ATOM 825 OD2 ASP B 323 12.905 11.244 3.412 1.00 0.00 O ATOM 0 H ASP B 323 14.891 7.867 5.905 1.00 0.00 H new ATOM 0 HA ASP B 323 12.535 9.289 6.637 1.00 0.00 H new ATOM 0 HB2 ASP B 323 14.605 10.414 5.957 1.00 0.00 H new ATOM 0 HB3 ASP B 323 14.559 9.636 4.387 1.00 0.00 H new ATOM 830 N ILE B 324 12.523 7.668 3.762 1.00 0.00 N ATOM 831 CA ILE B 324 11.653 7.153 2.713 1.00 0.00 C ATOM 832 C ILE B 324 10.708 6.088 3.260 1.00 0.00 C ATOM 833 O ILE B 324 9.525 6.061 2.924 1.00 0.00 O ATOM 834 CB ILE B 324 12.471 6.563 1.545 1.00 0.00 C ATOM 835 CG1 ILE B 324 13.237 7.678 0.825 1.00 0.00 C ATOM 836 CG2 ILE B 324 11.562 5.818 0.577 1.00 0.00 C ATOM 837 CD1 ILE B 324 14.132 7.183 -0.292 1.00 0.00 C ATOM 0 H ILE B 324 13.499 7.383 3.678 1.00 0.00 H new ATOM 0 HA ILE B 324 11.066 7.993 2.341 1.00 0.00 H new ATOM 0 HB ILE B 324 13.192 5.850 1.946 1.00 0.00 H new ATOM 0 HG12 ILE B 324 12.522 8.391 0.416 1.00 0.00 H new ATOM 0 HG13 ILE B 324 13.844 8.217 1.552 1.00 0.00 H new ATOM 0 HG21 ILE B 324 12.157 5.409 -0.240 1.00 0.00 H new ATOM 0 HG22 ILE B 324 11.060 5.005 1.102 1.00 0.00 H new ATOM 0 HG23 ILE B 324 10.818 6.505 0.175 1.00 0.00 H new ATOM 0 HD11 ILE B 324 14.640 8.030 -0.753 1.00 0.00 H new ATOM 0 HD12 ILE B 324 14.872 6.493 0.113 1.00 0.00 H new ATOM 0 HD13 ILE B 324 13.529 6.670 -1.041 1.00 0.00 H new ATOM 849 N TYR B 325 11.242 5.213 4.106 1.00 0.00 N ATOM 850 CA TYR B 325 10.451 4.144 4.704 1.00 0.00 C ATOM 851 C TYR B 325 9.338 4.714 5.580 1.00 0.00 C ATOM 852 O TYR B 325 8.173 4.342 5.439 1.00 0.00 O ATOM 853 CB TYR B 325 11.356 3.227 5.529 1.00 0.00 C ATOM 854 CG TYR B 325 10.674 1.967 6.015 1.00 0.00 C ATOM 855 CD1 TYR B 325 10.222 1.008 5.118 1.00 0.00 C ATOM 856 CD2 TYR B 325 10.487 1.735 7.372 1.00 0.00 C ATOM 857 CE1 TYR B 325 9.602 -0.147 5.558 1.00 0.00 C ATOM 858 CE2 TYR B 325 9.869 0.583 7.821 1.00 0.00 C ATOM 859 CZ TYR B 325 9.429 -0.354 6.911 1.00 0.00 C ATOM 860 OH TYR B 325 8.815 -1.503 7.354 1.00 0.00 O ATOM 0 H TYR B 325 12.221 5.224 4.393 1.00 0.00 H new ATOM 0 HA TYR B 325 9.990 3.566 3.903 1.00 0.00 H new ATOM 0 HB2 TYR B 325 12.222 2.951 4.927 1.00 0.00 H new ATOM 0 HB3 TYR B 325 11.730 3.781 6.390 1.00 0.00 H new ATOM 0 HD1 TYR B 325 10.357 1.167 4.058 1.00 0.00 H new ATOM 0 HD2 TYR B 325 10.830 2.467 8.088 1.00 0.00 H new ATOM 0 HE1 TYR B 325 9.255 -0.882 4.847 1.00 0.00 H new ATOM 0 HE2 TYR B 325 9.732 0.418 8.879 1.00 0.00 H new ATOM 0 HH TYR B 325 8.773 -1.495 8.333 1.00 0.00 H new ATOM 870 N LYS B 326 9.705 5.623 6.478 1.00 0.00 N ATOM 871 CA LYS B 326 8.741 6.245 7.380 1.00 0.00 C ATOM 872 C LYS B 326 7.682 7.021 6.602 1.00 0.00 C ATOM 873 O LYS B 326 6.485 6.853 6.834 1.00 0.00 O ATOM 874 CB LYS B 326 9.457 7.175 8.361 1.00 0.00 C ATOM 875 CG LYS B 326 8.523 7.865 9.343 1.00 0.00 C ATOM 876 CD LYS B 326 9.289 8.665 10.389 1.00 0.00 C ATOM 877 CE LYS B 326 9.800 9.988 9.836 1.00 0.00 C ATOM 878 NZ LYS B 326 10.856 9.796 8.804 1.00 0.00 N ATOM 0 H LYS B 326 10.665 5.946 6.601 1.00 0.00 H new ATOM 0 HA LYS B 326 8.242 5.453 7.938 1.00 0.00 H new ATOM 0 HB2 LYS B 326 10.196 6.600 8.919 1.00 0.00 H new ATOM 0 HB3 LYS B 326 10.002 7.933 7.798 1.00 0.00 H new ATOM 0 HG2 LYS B 326 7.850 8.528 8.799 1.00 0.00 H new ATOM 0 HG3 LYS B 326 7.902 7.119 9.839 1.00 0.00 H new ATOM 0 HD2 LYS B 326 8.641 8.856 11.245 1.00 0.00 H new ATOM 0 HD3 LYS B 326 10.131 8.075 10.752 1.00 0.00 H new ATOM 0 HE2 LYS B 326 8.969 10.544 9.403 1.00 0.00 H new ATOM 0 HE3 LYS B 326 10.197 10.592 10.652 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 11.546 10.572 8.865 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 11.339 8.889 8.966 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 10.421 9.793 7.859 1.00 0.00 H new ATOM 892 N ALA B 327 8.130 7.871 5.680 1.00 0.00 N ATOM 893 CA ALA B 327 7.220 8.672 4.867 1.00 0.00 C ATOM 894 C ALA B 327 6.197 7.788 4.160 1.00 0.00 C ATOM 895 O ALA B 327 4.999 8.073 4.174 1.00 0.00 O ATOM 896 CB ALA B 327 8.001 9.492 3.852 1.00 0.00 C ATOM 0 H ALA B 327 9.118 8.022 5.478 1.00 0.00 H new ATOM 0 HA ALA B 327 6.682 9.351 5.529 1.00 0.00 H new ATOM 0 HB1 ALA B 327 7.309 10.084 3.253 1.00 0.00 H new ATOM 0 HB2 ALA B 327 8.690 10.156 4.374 1.00 0.00 H new ATOM 0 HB3 ALA B 327 8.565 8.824 3.201 1.00 0.00 H new ATOM 902 N PHE B 328 6.682 6.714 3.545 1.00 0.00 N ATOM 903 CA PHE B 328 5.817 5.782 2.833 1.00 0.00 C ATOM 904 C PHE B 328 4.732 5.241 3.759 1.00 0.00 C ATOM 905 O PHE B 328 3.541 5.274 3.431 1.00 0.00 O ATOM 906 CB PHE B 328 6.645 4.630 2.264 1.00 0.00 C ATOM 907 CG PHE B 328 5.884 3.757 1.309 1.00 0.00 C ATOM 908 CD1 PHE B 328 5.726 4.135 -0.014 1.00 0.00 C ATOM 909 CD2 PHE B 328 5.329 2.561 1.733 1.00 0.00 C ATOM 910 CE1 PHE B 328 5.028 3.336 -0.897 1.00 0.00 C ATOM 911 CE2 PHE B 328 4.629 1.759 0.854 1.00 0.00 C ATOM 912 CZ PHE B 328 4.479 2.146 -0.463 1.00 0.00 C ATOM 0 H PHE B 328 7.672 6.468 3.526 1.00 0.00 H new ATOM 0 HA PHE B 328 5.336 6.314 2.012 1.00 0.00 H new ATOM 0 HB2 PHE B 328 7.517 5.038 1.754 1.00 0.00 H new ATOM 0 HB3 PHE B 328 7.014 4.018 3.087 1.00 0.00 H new ATOM 0 HD1 PHE B 328 6.154 5.065 -0.359 1.00 0.00 H new ATOM 0 HD2 PHE B 328 5.445 2.253 2.762 1.00 0.00 H new ATOM 0 HE1 PHE B 328 4.911 3.641 -1.926 1.00 0.00 H new ATOM 0 HE2 PHE B 328 4.199 0.829 1.196 1.00 0.00 H new ATOM 0 HZ PHE B 328 3.933 1.519 -1.152 1.00 0.00 H new ATOM 922 N LEU B 329 5.154 4.744 4.919 1.00 0.00 N ATOM 923 CA LEU B 329 4.225 4.203 5.903 1.00 0.00 C ATOM 924 C LEU B 329 3.180 5.246 6.282 1.00 0.00 C ATOM 925 O LEU B 329 2.023 4.915 6.540 1.00 0.00 O ATOM 926 CB LEU B 329 4.983 3.742 7.150 1.00 0.00 C ATOM 927 CG LEU B 329 5.993 2.615 6.918 1.00 0.00 C ATOM 928 CD1 LEU B 329 6.799 2.355 8.180 1.00 0.00 C ATOM 929 CD2 LEU B 329 5.285 1.347 6.464 1.00 0.00 C ATOM 0 H LEU B 329 6.134 4.705 5.199 1.00 0.00 H new ATOM 0 HA LEU B 329 3.717 3.346 5.462 1.00 0.00 H new ATOM 0 HB2 LEU B 329 5.508 4.598 7.574 1.00 0.00 H new ATOM 0 HB3 LEU B 329 4.259 3.412 7.895 1.00 0.00 H new ATOM 0 HG LEU B 329 6.679 2.925 6.130 1.00 0.00 H new ATOM 0 HD11 LEU B 329 7.512 1.551 7.997 1.00 0.00 H new ATOM 0 HD12 LEU B 329 7.337 3.260 8.461 1.00 0.00 H new ATOM 0 HD13 LEU B 329 6.127 2.067 8.988 1.00 0.00 H new ATOM 0 HD21 LEU B 329 6.019 0.558 6.304 1.00 0.00 H new ATOM 0 HD22 LEU B 329 4.575 1.033 7.229 1.00 0.00 H new ATOM 0 HD23 LEU B 329 4.753 1.541 5.533 1.00 0.00 H new ATOM 941 N GLU B 330 3.598 6.509 6.309 1.00 0.00 N ATOM 942 CA GLU B 330 2.696 7.604 6.649 1.00 0.00 C ATOM 943 C GLU B 330 1.640 7.787 5.568 1.00 0.00 C ATOM 944 O GLU B 330 0.481 8.078 5.864 1.00 0.00 O ATOM 945 CB GLU B 330 3.477 8.906 6.844 1.00 0.00 C ATOM 946 CG GLU B 330 4.390 8.893 8.059 1.00 0.00 C ATOM 947 CD GLU B 330 5.188 10.175 8.200 1.00 0.00 C ATOM 948 OE1 GLU B 330 4.653 11.145 8.777 1.00 0.00 O ATOM 949 OE2 GLU B 330 6.345 10.208 7.732 1.00 0.00 O ATOM 0 H GLU B 330 4.554 6.798 6.100 1.00 0.00 H new ATOM 0 HA GLU B 330 2.197 7.351 7.585 1.00 0.00 H new ATOM 0 HB2 GLU B 330 4.075 9.098 5.953 1.00 0.00 H new ATOM 0 HB3 GLU B 330 2.772 9.732 6.939 1.00 0.00 H new ATOM 0 HG2 GLU B 330 3.792 8.741 8.957 1.00 0.00 H new ATOM 0 HG3 GLU B 330 5.075 8.049 7.985 1.00 0.00 H new ATOM 956 N ILE B 331 2.044 7.616 4.310 1.00 0.00 N ATOM 957 CA ILE B 331 1.119 7.756 3.193 1.00 0.00 C ATOM 958 C ILE B 331 0.020 6.705 3.278 1.00 0.00 C ATOM 959 O ILE B 331 -1.166 7.028 3.213 1.00 0.00 O ATOM 960 CB ILE B 331 1.837 7.628 1.833 1.00 0.00 C ATOM 961 CG1 ILE B 331 2.937 8.686 1.709 1.00 0.00 C ATOM 962 CG2 ILE B 331 0.835 7.762 0.693 1.00 0.00 C ATOM 963 CD1 ILE B 331 3.820 8.504 0.493 1.00 0.00 C ATOM 0 H ILE B 331 3.000 7.382 4.043 1.00 0.00 H new ATOM 0 HA ILE B 331 0.685 8.753 3.261 1.00 0.00 H new ATOM 0 HB ILE B 331 2.299 6.643 1.773 1.00 0.00 H new ATOM 0 HG12 ILE B 331 2.477 9.673 1.669 1.00 0.00 H new ATOM 0 HG13 ILE B 331 3.557 8.660 2.605 1.00 0.00 H new ATOM 0 HG21 ILE B 331 1.355 7.670 -0.261 1.00 0.00 H new ATOM 0 HG22 ILE B 331 0.084 6.976 0.774 1.00 0.00 H new ATOM 0 HG23 ILE B 331 0.349 8.736 0.749 1.00 0.00 H new ATOM 0 HD11 ILE B 331 4.576 9.289 0.471 1.00 0.00 H new ATOM 0 HD12 ILE B 331 4.309 7.531 0.541 1.00 0.00 H new ATOM 0 HD13 ILE B 331 3.212 8.560 -0.410 1.00 0.00 H new ATOM 975 N LEU B 332 0.421 5.444 3.426 1.00 0.00 N ATOM 976 CA LEU B 332 -0.540 4.351 3.524 1.00 0.00 C ATOM 977 C LEU B 332 -1.348 4.456 4.815 1.00 0.00 C ATOM 978 O LEU B 332 -2.483 3.984 4.886 1.00 0.00 O ATOM 979 CB LEU B 332 0.172 2.997 3.449 1.00 0.00 C ATOM 980 CG LEU B 332 1.051 2.781 2.209 1.00 0.00 C ATOM 981 CD1 LEU B 332 1.421 1.311 2.071 1.00 0.00 C ATOM 982 CD2 LEU B 332 0.353 3.276 0.947 1.00 0.00 C ATOM 0 H LEU B 332 1.398 5.156 3.480 1.00 0.00 H new ATOM 0 HA LEU B 332 -1.227 4.427 2.681 1.00 0.00 H new ATOM 0 HB2 LEU B 332 0.793 2.883 4.338 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -0.580 2.208 3.482 1.00 0.00 H new ATOM 0 HG LEU B 332 1.964 3.362 2.337 1.00 0.00 H new ATOM 0 HD11 LEU B 332 2.044 1.174 1.187 1.00 0.00 H new ATOM 0 HD12 LEU B 332 1.970 0.989 2.956 1.00 0.00 H new ATOM 0 HD13 LEU B 332 0.514 0.715 1.971 1.00 0.00 H new ATOM 0 HD21 LEU B 332 0.999 3.110 0.085 1.00 0.00 H new ATOM 0 HD22 LEU B 332 -0.581 2.731 0.810 1.00 0.00 H new ATOM 0 HD23 LEU B 332 0.141 4.341 1.042 1.00 0.00 H new ATOM 994 N HIS B 333 -0.757 5.079 5.831 1.00 0.00 N ATOM 995 CA HIS B 333 -1.429 5.254 7.114 1.00 0.00 C ATOM 996 C HIS B 333 -2.658 6.142 6.948 1.00 0.00 C ATOM 997 O HIS B 333 -3.784 5.723 7.229 1.00 0.00 O ATOM 998 CB HIS B 333 -0.474 5.869 8.139 1.00 0.00 C ATOM 999 CG HIS B 333 -1.045 5.942 9.522 1.00 0.00 C ATOM 1000 ND1 HIS B 333 -1.663 7.069 10.024 1.00 0.00 N ATOM 1001 CD2 HIS B 333 -1.087 5.020 10.513 1.00 0.00 C ATOM 1002 CE1 HIS B 333 -2.059 6.837 11.263 1.00 0.00 C ATOM 1003 NE2 HIS B 333 -1.722 5.602 11.582 1.00 0.00 N ATOM 0 H HIS B 333 0.184 5.470 5.790 1.00 0.00 H new ATOM 0 HA HIS B 333 -1.745 4.275 7.475 1.00 0.00 H new ATOM 0 HB2 HIS B 333 0.445 5.283 8.165 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -0.202 6.873 7.814 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -0.694 4.015 10.470 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -2.571 7.539 11.905 1.00 0.00 H new ATOM 0 HE2 HIS B 333 -1.904 5.152 12.479 1.00 0.00 H new ATOM 1012 N THR B 334 -2.434 7.371 6.490 1.00 0.00 N ATOM 1013 CA THR B 334 -3.521 8.315 6.271 1.00 0.00 C ATOM 1014 C THR B 334 -4.520 7.746 5.274 1.00 0.00 C ATOM 1015 O THR B 334 -5.729 7.940 5.410 1.00 0.00 O ATOM 1016 CB THR B 334 -3.001 9.667 5.749 1.00 0.00 C ATOM 1017 OG1 THR B 334 -2.044 10.211 6.665 1.00 0.00 O ATOM 1018 CG2 THR B 334 -4.144 10.653 5.560 1.00 0.00 C ATOM 0 H THR B 334 -1.508 7.735 6.264 1.00 0.00 H new ATOM 0 HA THR B 334 -4.008 8.479 7.232 1.00 0.00 H new ATOM 0 HB THR B 334 -2.525 9.498 4.783 1.00 0.00 H new ATOM 0 HG1 THR B 334 -1.717 11.070 6.325 1.00 0.00 H new ATOM 0 HG21 THR B 334 -3.750 11.600 5.191 1.00 0.00 H new ATOM 0 HG22 THR B 334 -4.856 10.251 4.840 1.00 0.00 H new ATOM 0 HG23 THR B 334 -4.645 10.816 6.514 1.00 0.00 H new ATOM 1026 N TYR B 335 -4.002 7.040 4.271 1.00 0.00 N ATOM 1027 CA TYR B 335 -4.846 6.427 3.255 1.00 0.00 C ATOM 1028 C TYR B 335 -5.799 5.425 3.900 1.00 0.00 C ATOM 1029 O TYR B 335 -6.953 5.294 3.491 1.00 0.00 O ATOM 1030 CB TYR B 335 -3.980 5.735 2.193 1.00 0.00 C ATOM 1031 CG TYR B 335 -4.780 5.032 1.119 1.00 0.00 C ATOM 1032 CD1 TYR B 335 -5.200 3.719 1.284 1.00 0.00 C ATOM 1033 CD2 TYR B 335 -5.117 5.685 -0.059 1.00 0.00 C ATOM 1034 CE1 TYR B 335 -5.935 3.076 0.305 1.00 0.00 C ATOM 1035 CE2 TYR B 335 -5.850 5.050 -1.043 1.00 0.00 C ATOM 1036 CZ TYR B 335 -6.258 3.746 -0.856 1.00 0.00 C ATOM 1037 OH TYR B 335 -6.989 3.110 -1.831 1.00 0.00 O ATOM 0 H TYR B 335 -3.003 6.880 4.143 1.00 0.00 H new ATOM 0 HA TYR B 335 -5.435 7.205 2.769 1.00 0.00 H new ATOM 0 HB2 TYR B 335 -3.333 6.477 1.725 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -3.330 5.010 2.683 1.00 0.00 H new ATOM 0 HD1 TYR B 335 -4.948 3.191 2.192 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -4.801 6.707 -0.209 1.00 0.00 H new ATOM 0 HE1 TYR B 335 -6.254 2.054 0.449 1.00 0.00 H new ATOM 0 HE2 TYR B 335 -6.102 5.572 -1.954 1.00 0.00 H new ATOM 0 HH TYR B 335 -6.404 2.509 -2.338 1.00 0.00 H new ATOM 1047 N GLN B 336 -5.304 4.722 4.916 1.00 0.00 N ATOM 1048 CA GLN B 336 -6.109 3.734 5.625 1.00 0.00 C ATOM 1049 C GLN B 336 -7.227 4.410 6.410 1.00 0.00 C ATOM 1050 O GLN B 336 -8.392 4.036 6.291 1.00 0.00 O ATOM 1051 CB GLN B 336 -5.235 2.915 6.578 1.00 0.00 C ATOM 1052 CG GLN B 336 -6.012 1.874 7.370 1.00 0.00 C ATOM 1053 CD GLN B 336 -5.168 1.195 8.432 1.00 0.00 C ATOM 1054 OE1 GLN B 336 -4.546 0.164 8.181 1.00 0.00 O ATOM 1055 NE2 GLN B 336 -5.144 1.773 9.627 1.00 0.00 N ATOM 0 H GLN B 336 -4.351 4.819 5.265 1.00 0.00 H new ATOM 0 HA GLN B 336 -6.552 3.068 4.884 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -4.455 2.415 6.004 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -4.736 3.591 7.273 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -6.870 2.350 7.844 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -6.403 1.121 6.686 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -5.676 2.628 9.791 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -4.594 1.362 10.381 1.00 0.00 H new ATOM 1064 N LYS B 337 -6.860 5.407 7.211 1.00 0.00 N ATOM 1065 CA LYS B 337 -7.827 6.139 8.023 1.00 0.00 C ATOM 1066 C LYS B 337 -8.991 6.640 7.174 1.00 0.00 C ATOM 1067 O LYS B 337 -10.157 6.409 7.501 1.00 0.00 O ATOM 1068 CB LYS B 337 -7.141 7.316 8.720 1.00 0.00 C ATOM 1069 CG LYS B 337 -8.046 8.074 9.678 1.00 0.00 C ATOM 1070 CD LYS B 337 -7.318 9.240 10.329 1.00 0.00 C ATOM 1071 CE LYS B 337 -6.962 10.319 9.317 1.00 0.00 C ATOM 1072 NZ LYS B 337 -6.237 11.456 9.947 1.00 0.00 N ATOM 0 H LYS B 337 -5.897 5.727 7.315 1.00 0.00 H new ATOM 0 HA LYS B 337 -8.225 5.457 8.775 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -6.275 6.946 9.269 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -6.768 8.007 7.964 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -8.919 8.444 9.140 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -8.411 7.395 10.449 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -7.944 9.668 11.112 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -6.409 8.878 10.810 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -6.345 9.888 8.529 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -7.872 10.687 8.844 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -6.013 12.169 9.223 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -6.835 11.885 10.682 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -5.355 11.110 10.377 1.00 0.00 H new ATOM 1086 N GLU B 338 -8.669 7.325 6.081 1.00 0.00 N ATOM 1087 CA GLU B 338 -9.688 7.860 5.187 1.00 0.00 C ATOM 1088 C GLU B 338 -10.514 6.739 4.568 1.00 0.00 C ATOM 1089 O GLU B 338 -11.731 6.861 4.422 1.00 0.00 O ATOM 1090 CB GLU B 338 -9.041 8.702 4.087 1.00 0.00 C ATOM 1091 CG GLU B 338 -8.259 9.892 4.617 1.00 0.00 C ATOM 1092 CD GLU B 338 -9.114 10.830 5.448 1.00 0.00 C ATOM 1093 OE1 GLU B 338 -9.868 11.629 4.855 1.00 0.00 O ATOM 1094 OE2 GLU B 338 -9.029 10.763 6.693 1.00 0.00 O ATOM 0 H GLU B 338 -7.710 7.522 5.794 1.00 0.00 H new ATOM 0 HA GLU B 338 -10.353 8.493 5.774 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -8.373 8.070 3.502 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -9.817 9.059 3.410 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -7.426 9.534 5.222 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -7.831 10.443 3.779 1.00 0.00 H new ATOM 1101 N GLN B 339 -9.848 5.647 4.203 1.00 0.00 N ATOM 1102 CA GLN B 339 -10.527 4.504 3.605 1.00 0.00 C ATOM 1103 C GLN B 339 -11.552 3.921 4.572 1.00 0.00 C ATOM 1104 O GLN B 339 -12.648 3.526 4.173 1.00 0.00 O ATOM 1105 CB GLN B 339 -9.512 3.431 3.207 1.00 0.00 C ATOM 1106 CG GLN B 339 -10.115 2.293 2.398 1.00 0.00 C ATOM 1107 CD GLN B 339 -10.653 2.751 1.056 1.00 0.00 C ATOM 1108 OE1 GLN B 339 -10.031 3.777 0.486 1.00 0.00 O flip ATOM 1109 NE2 GLN B 339 -11.617 2.188 0.535 1.00 0.00 N flip ATOM 0 H GLN B 339 -8.840 5.531 4.311 1.00 0.00 H new ATOM 0 HA GLN B 339 -11.048 4.846 2.711 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -8.714 3.895 2.627 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -9.055 3.023 4.108 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -9.358 1.525 2.239 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -10.921 1.833 2.970 1.00 0.00 H new ATOM 0 HE21 GLN B 339 -12.066 1.403 1.007 1.00 0.00 H new ATOM 0 HE22 GLN B 339 -11.966 2.507 -0.369 1.00 0.00 H new ATOM 1118 N ARG B 340 -11.186 3.877 5.850 1.00 0.00 N ATOM 1119 CA ARG B 340 -12.067 3.350 6.885 1.00 0.00 C ATOM 1120 C ARG B 340 -13.316 4.213 7.016 1.00 0.00 C ATOM 1121 O ARG B 340 -14.439 3.712 6.938 1.00 0.00 O ATOM 1122 CB ARG B 340 -11.329 3.284 8.223 1.00 0.00 C ATOM 1123 CG ARG B 340 -10.196 2.285 8.240 1.00 0.00 C ATOM 1124 CD ARG B 340 -9.510 2.245 9.594 1.00 0.00 C ATOM 1125 NE ARG B 340 -10.383 1.719 10.638 1.00 0.00 N ATOM 1126 CZ ARG B 340 -9.954 1.355 11.843 1.00 0.00 C ATOM 1127 NH1 ARG B 340 -8.667 1.461 12.150 1.00 0.00 N ATOM 1128 NH2 ARG B 340 -10.808 0.886 12.740 1.00 0.00 N ATOM 0 H ARG B 340 -10.282 4.201 6.193 1.00 0.00 H new ATOM 0 HA ARG B 340 -12.371 2.343 6.600 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -10.935 4.272 8.460 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -12.040 3.028 9.008 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -10.579 1.294 7.996 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -9.469 2.544 7.470 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -8.614 1.628 9.527 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -9.186 3.250 9.865 1.00 0.00 H new ATOM 0 HE ARG B 340 -11.378 1.625 10.432 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -8.007 1.822 11.462 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -8.339 1.182 13.074 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -11.798 0.803 12.507 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -10.476 0.608 13.663 1.00 0.00 H new ATOM 1142 N ASN B 341 -13.113 5.512 7.219 1.00 0.00 N ATOM 1143 CA ASN B 341 -14.224 6.448 7.352 1.00 0.00 C ATOM 1144 C ASN B 341 -15.124 6.381 6.123 1.00 0.00 C ATOM 1145 O ASN B 341 -16.338 6.569 6.216 1.00 0.00 O ATOM 1146 CB ASN B 341 -13.694 7.873 7.541 1.00 0.00 C ATOM 1147 CG ASN B 341 -14.766 8.842 8.004 1.00 0.00 C ATOM 1148 OD1 ASN B 341 -15.945 8.684 7.685 1.00 0.00 O ATOM 1149 ND2 ASN B 341 -14.361 9.854 8.762 1.00 0.00 N ATOM 0 H ASN B 341 -12.190 5.939 7.295 1.00 0.00 H new ATOM 0 HA ASN B 341 -14.810 6.171 8.228 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -12.883 7.861 8.269 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -13.273 8.227 6.600 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -15.037 10.538 9.103 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -13.374 9.948 9.003 1.00 0.00 H new ATOM 1156 N ALA B 342 -14.519 6.105 4.972 1.00 0.00 N ATOM 1157 CA ALA B 342 -15.259 6.005 3.719 1.00 0.00 C ATOM 1158 C ALA B 342 -16.203 4.809 3.742 1.00 0.00 C ATOM 1159 O ALA B 342 -17.371 4.920 3.367 1.00 0.00 O ATOM 1160 CB ALA B 342 -14.298 5.898 2.545 1.00 0.00 C ATOM 0 H ALA B 342 -13.516 5.946 4.881 1.00 0.00 H new ATOM 0 HA ALA B 342 -15.856 6.909 3.602 1.00 0.00 H new ATOM 0 HB1 ALA B 342 -14.864 5.824 1.617 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -13.663 6.783 2.513 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -13.677 5.010 2.663 1.00 0.00 H new ATOM 1166 N LYS B 343 -15.688 3.664 4.179 1.00 0.00 N ATOM 1167 CA LYS B 343 -16.485 2.446 4.256 1.00 0.00 C ATOM 1168 C LYS B 343 -17.585 2.582 5.306 1.00 0.00 C ATOM 1169 O LYS B 343 -18.646 1.969 5.191 1.00 0.00 O ATOM 1170 CB LYS B 343 -15.593 1.247 4.588 1.00 0.00 C ATOM 1171 CG LYS B 343 -14.563 0.940 3.513 1.00 0.00 C ATOM 1172 CD LYS B 343 -13.720 -0.269 3.878 1.00 0.00 C ATOM 1173 CE LYS B 343 -12.654 -0.541 2.830 1.00 0.00 C ATOM 1174 NZ LYS B 343 -13.248 -0.815 1.493 1.00 0.00 N ATOM 0 H LYS B 343 -14.721 3.555 4.485 1.00 0.00 H new ATOM 0 HA LYS B 343 -16.952 2.285 3.284 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -15.078 1.437 5.529 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -16.220 0.369 4.740 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -15.069 0.759 2.564 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -13.916 1.806 3.370 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -13.247 -0.105 4.846 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -14.362 -1.144 3.981 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -11.985 0.317 2.761 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -12.049 -1.393 3.140 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -12.515 -1.192 0.858 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -14.014 -1.512 1.590 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -13.630 0.067 1.096 1.00 0.00 H new ATOM 1188 N GLU B 344 -17.321 3.391 6.328 1.00 0.00 N ATOM 1189 CA GLU B 344 -18.282 3.613 7.399 1.00 0.00 C ATOM 1190 C GLU B 344 -19.477 4.422 6.905 1.00 0.00 C ATOM 1191 O GLU B 344 -20.612 3.944 6.927 1.00 0.00 O ATOM 1192 CB GLU B 344 -17.608 4.334 8.566 1.00 0.00 C ATOM 1193 CG GLU B 344 -16.586 3.482 9.301 1.00 0.00 C ATOM 1194 CD GLU B 344 -17.199 2.243 9.923 1.00 0.00 C ATOM 1195 OE1 GLU B 344 -17.747 2.347 11.040 1.00 0.00 O ATOM 1196 OE2 GLU B 344 -17.132 1.167 9.290 1.00 0.00 O ATOM 0 H GLU B 344 -16.446 3.904 6.435 1.00 0.00 H new ATOM 0 HA GLU B 344 -18.645 2.642 7.737 1.00 0.00 H new ATOM 0 HB2 GLU B 344 -17.117 5.233 8.192 1.00 0.00 H new ATOM 0 HB3 GLU B 344 -18.373 4.658 9.272 1.00 0.00 H new ATOM 0 HG2 GLU B 344 -15.800 3.185 8.607 1.00 0.00 H new ATOM 0 HG3 GLU B 344 -16.114 4.080 10.081 1.00 0.00 H new ATOM 1203 N ALA B 345 -19.215 5.648 6.464 1.00 0.00 N ATOM 1204 CA ALA B 345 -20.270 6.522 5.964 1.00 0.00 C ATOM 1205 C ALA B 345 -21.011 5.874 4.801 1.00 0.00 C ATOM 1206 O ALA B 345 -22.239 5.945 4.721 1.00 0.00 O ATOM 1207 CB ALA B 345 -19.689 7.863 5.538 1.00 0.00 C ATOM 0 H ALA B 345 -18.282 6.059 6.443 1.00 0.00 H new ATOM 0 HA ALA B 345 -20.983 6.688 6.771 1.00 0.00 H new ATOM 0 HB1 ALA B 345 -20.488 8.505 5.167 1.00 0.00 H new ATOM 0 HB2 ALA B 345 -19.208 8.339 6.393 1.00 0.00 H new ATOM 0 HB3 ALA B 345 -18.954 7.707 4.749 1.00 0.00 H new ATOM 1276 N PRO B 351 -12.997 10.252 0.196 1.00 0.00 N ATOM 1277 CA PRO B 351 -11.686 10.062 0.830 1.00 0.00 C ATOM 1278 C PRO B 351 -10.691 11.145 0.425 1.00 0.00 C ATOM 1279 O PRO B 351 -10.880 11.828 -0.581 1.00 0.00 O ATOM 1280 CB PRO B 351 -11.224 8.694 0.316 1.00 0.00 C ATOM 1281 CG PRO B 351 -12.470 8.000 -0.112 1.00 0.00 C ATOM 1282 CD PRO B 351 -13.398 9.077 -0.599 1.00 0.00 C ATOM 0 HA PRO B 351 -11.750 10.118 1.917 1.00 0.00 H new ATOM 0 HB2 PRO B 351 -10.526 8.800 -0.515 1.00 0.00 H new ATOM 0 HB3 PRO B 351 -10.708 8.133 1.096 1.00 0.00 H new ATOM 0 HG2 PRO B 351 -12.263 7.277 -0.901 1.00 0.00 H new ATOM 0 HG3 PRO B 351 -12.914 7.448 0.717 1.00 0.00 H new ATOM 0 HD2 PRO B 351 -13.282 9.255 -1.668 1.00 0.00 H new ATOM 0 HD3 PRO B 351 -14.443 8.815 -0.431 1.00 0.00 H new ATOM 1290 N ALA B 352 -9.633 11.294 1.213 1.00 0.00 N ATOM 1291 CA ALA B 352 -8.609 12.295 0.934 1.00 0.00 C ATOM 1292 C ALA B 352 -7.556 11.754 -0.027 1.00 0.00 C ATOM 1293 O ALA B 352 -7.306 12.340 -1.080 1.00 0.00 O ATOM 1294 CB ALA B 352 -7.957 12.762 2.227 1.00 0.00 C ATOM 0 H ALA B 352 -9.461 10.736 2.049 1.00 0.00 H new ATOM 0 HA ALA B 352 -9.093 13.147 0.457 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -7.195 13.509 2.002 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -8.713 13.200 2.878 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -7.495 11.912 2.729 1.00 0.00 H new ATOM 1300 N LEU B 353 -6.943 10.632 0.340 1.00 0.00 N ATOM 1301 CA LEU B 353 -5.915 10.019 -0.494 1.00 0.00 C ATOM 1302 C LEU B 353 -6.517 9.002 -1.453 1.00 0.00 C ATOM 1303 O LEU B 353 -7.214 8.075 -1.038 1.00 0.00 O ATOM 1304 CB LEU B 353 -4.850 9.343 0.372 1.00 0.00 C ATOM 1305 CG LEU B 353 -4.209 10.224 1.450 1.00 0.00 C ATOM 1306 CD1 LEU B 353 -2.930 9.580 1.955 1.00 0.00 C ATOM 1307 CD2 LEU B 353 -3.920 11.620 0.916 1.00 0.00 C ATOM 0 H LEU B 353 -7.140 10.131 1.206 1.00 0.00 H new ATOM 0 HA LEU B 353 -5.450 10.813 -1.078 1.00 0.00 H new ATOM 0 HB2 LEU B 353 -5.300 8.477 0.857 1.00 0.00 H new ATOM 0 HB3 LEU B 353 -4.061 8.969 -0.281 1.00 0.00 H new ATOM 0 HG LEU B 353 -4.913 10.318 2.277 1.00 0.00 H new ATOM 0 HD11 LEU B 353 -2.482 10.213 2.721 1.00 0.00 H new ATOM 0 HD12 LEU B 353 -3.158 8.603 2.380 1.00 0.00 H new ATOM 0 HD13 LEU B 353 -2.231 9.461 1.127 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -3.466 12.223 1.702 1.00 0.00 H new ATOM 0 HD22 LEU B 353 -3.236 11.552 0.070 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -4.851 12.086 0.593 1.00 0.00 H new ATOM 1319 N THR B 354 -6.240 9.184 -2.739 1.00 0.00 N ATOM 1320 CA THR B 354 -6.743 8.284 -3.768 1.00 0.00 C ATOM 1321 C THR B 354 -5.597 7.517 -4.416 1.00 0.00 C ATOM 1322 O THR B 354 -4.453 7.605 -3.972 1.00 0.00 O ATOM 1323 CB THR B 354 -7.512 9.056 -4.856 1.00 0.00 C ATOM 1324 OG1 THR B 354 -6.639 9.987 -5.507 1.00 0.00 O ATOM 1325 CG2 THR B 354 -8.694 9.799 -4.255 1.00 0.00 C ATOM 0 H THR B 354 -5.668 9.950 -3.094 1.00 0.00 H new ATOM 0 HA THR B 354 -7.423 7.583 -3.284 1.00 0.00 H new ATOM 0 HB THR B 354 -7.885 8.338 -5.586 1.00 0.00 H new ATOM 0 HG1 THR B 354 -7.136 10.472 -6.199 1.00 0.00 H new ATOM 0 HG21 THR B 354 -9.223 10.338 -5.041 1.00 0.00 H new ATOM 0 HG22 THR B 354 -9.371 9.086 -3.785 1.00 0.00 H new ATOM 0 HG23 THR B 354 -8.337 10.507 -3.507 1.00 0.00 H new ATOM 1333 N GLU B 355 -5.907 6.761 -5.463 1.00 0.00 N ATOM 1334 CA GLU B 355 -4.892 5.990 -6.168 1.00 0.00 C ATOM 1335 C GLU B 355 -3.823 6.911 -6.745 1.00 0.00 C ATOM 1336 O GLU B 355 -2.630 6.611 -6.687 1.00 0.00 O ATOM 1337 CB GLU B 355 -5.528 5.165 -7.288 1.00 0.00 C ATOM 1338 CG GLU B 355 -6.487 5.960 -8.160 1.00 0.00 C ATOM 1339 CD GLU B 355 -7.075 5.132 -9.285 1.00 0.00 C ATOM 1340 OE1 GLU B 355 -8.125 4.491 -9.063 1.00 0.00 O ATOM 1341 OE2 GLU B 355 -6.488 5.123 -10.387 1.00 0.00 O ATOM 0 H GLU B 355 -6.850 6.666 -5.841 1.00 0.00 H new ATOM 0 HA GLU B 355 -4.423 5.313 -5.454 1.00 0.00 H new ATOM 0 HB2 GLU B 355 -4.739 4.750 -7.915 1.00 0.00 H new ATOM 0 HB3 GLU B 355 -6.063 4.323 -6.849 1.00 0.00 H new ATOM 0 HG2 GLU B 355 -7.295 6.352 -7.542 1.00 0.00 H new ATOM 0 HG3 GLU B 355 -5.963 6.818 -8.581 1.00 0.00 H new ATOM 1348 N GLN B 356 -4.264 8.036 -7.298 1.00 0.00 N ATOM 1349 CA GLN B 356 -3.354 9.009 -7.889 1.00 0.00 C ATOM 1350 C GLN B 356 -2.557 9.742 -6.816 1.00 0.00 C ATOM 1351 O GLN B 356 -1.371 10.018 -6.995 1.00 0.00 O ATOM 1352 CB GLN B 356 -4.133 10.017 -8.735 1.00 0.00 C ATOM 1353 CG GLN B 356 -4.875 9.386 -9.900 1.00 0.00 C ATOM 1354 CD GLN B 356 -3.949 8.642 -10.844 1.00 0.00 C ATOM 1355 OE1 GLN B 356 -3.697 7.450 -10.673 1.00 0.00 O ATOM 1356 NE2 GLN B 356 -3.433 9.347 -11.844 1.00 0.00 N ATOM 0 H GLN B 356 -5.249 8.296 -7.349 1.00 0.00 H new ATOM 0 HA GLN B 356 -2.654 8.468 -8.526 1.00 0.00 H new ATOM 0 HB2 GLN B 356 -4.848 10.538 -8.098 1.00 0.00 H new ATOM 0 HB3 GLN B 356 -3.442 10.768 -9.119 1.00 0.00 H new ATOM 0 HG2 GLN B 356 -5.628 8.697 -9.517 1.00 0.00 H new ATOM 0 HG3 GLN B 356 -5.405 10.162 -10.452 1.00 0.00 H new ATOM 0 HE21 GLN B 356 -3.670 10.334 -11.948 1.00 0.00 H new ATOM 0 HE22 GLN B 356 -2.800 8.902 -12.508 1.00 0.00 H new ATOM 1365 N GLU B 357 -3.212 10.059 -5.702 1.00 0.00 N ATOM 1366 CA GLU B 357 -2.554 10.764 -4.607 1.00 0.00 C ATOM 1367 C GLU B 357 -1.385 9.950 -4.062 1.00 0.00 C ATOM 1368 O GLU B 357 -0.259 10.443 -3.981 1.00 0.00 O ATOM 1369 CB GLU B 357 -3.549 11.066 -3.483 1.00 0.00 C ATOM 1370 CG GLU B 357 -2.979 11.949 -2.386 1.00 0.00 C ATOM 1371 CD GLU B 357 -2.477 13.281 -2.909 1.00 0.00 C ATOM 1372 OE1 GLU B 357 -1.303 13.350 -3.330 1.00 0.00 O ATOM 1373 OE2 GLU B 357 -3.258 14.256 -2.896 1.00 0.00 O ATOM 0 H GLU B 357 -4.194 9.840 -5.535 1.00 0.00 H new ATOM 0 HA GLU B 357 -2.170 11.706 -4.999 1.00 0.00 H new ATOM 0 HB2 GLU B 357 -4.428 11.551 -3.908 1.00 0.00 H new ATOM 0 HB3 GLU B 357 -3.884 10.126 -3.044 1.00 0.00 H new ATOM 0 HG2 GLU B 357 -3.746 12.125 -1.632 1.00 0.00 H new ATOM 0 HG3 GLU B 357 -2.160 11.425 -1.892 1.00 0.00 H new ATOM 1380 N VAL B 358 -1.660 8.704 -3.692 1.00 0.00 N ATOM 1381 CA VAL B 358 -0.629 7.825 -3.154 1.00 0.00 C ATOM 1382 C VAL B 358 0.466 7.569 -4.183 1.00 0.00 C ATOM 1383 O VAL B 358 1.647 7.732 -3.890 1.00 0.00 O ATOM 1384 CB VAL B 358 -1.214 6.476 -2.691 1.00 0.00 C ATOM 1385 CG1 VAL B 358 -0.123 5.578 -2.128 1.00 0.00 C ATOM 1386 CG2 VAL B 358 -2.298 6.694 -1.653 1.00 0.00 C ATOM 0 H VAL B 358 -2.586 8.281 -3.755 1.00 0.00 H new ATOM 0 HA VAL B 358 -0.202 8.336 -2.291 1.00 0.00 H new ATOM 0 HB VAL B 358 -1.653 5.983 -3.558 1.00 0.00 H new ATOM 0 HG11 VAL B 358 -0.560 4.632 -1.808 1.00 0.00 H new ATOM 0 HG12 VAL B 358 0.626 5.390 -2.897 1.00 0.00 H new ATOM 0 HG13 VAL B 358 0.347 6.068 -1.275 1.00 0.00 H new ATOM 0 HG21 VAL B 358 -2.699 5.731 -1.338 1.00 0.00 H new ATOM 0 HG22 VAL B 358 -1.877 7.211 -0.791 1.00 0.00 H new ATOM 0 HG23 VAL B 358 -3.098 7.297 -2.083 1.00 0.00 H new ATOM 1396 N TYR B 359 0.071 7.177 -5.391 1.00 0.00 N ATOM 1397 CA TYR B 359 1.036 6.898 -6.451 1.00 0.00 C ATOM 1398 C TYR B 359 1.905 8.119 -6.741 1.00 0.00 C ATOM 1399 O TYR B 359 3.066 7.985 -7.127 1.00 0.00 O ATOM 1400 CB TYR B 359 0.324 6.454 -7.730 1.00 0.00 C ATOM 1401 CG TYR B 359 1.271 5.976 -8.807 1.00 0.00 C ATOM 1402 CD1 TYR B 359 1.798 4.691 -8.773 1.00 0.00 C ATOM 1403 CD2 TYR B 359 1.645 6.811 -9.852 1.00 0.00 C ATOM 1404 CE1 TYR B 359 2.669 4.251 -9.750 1.00 0.00 C ATOM 1405 CE2 TYR B 359 2.516 6.378 -10.835 1.00 0.00 C ATOM 1406 CZ TYR B 359 3.026 5.098 -10.779 1.00 0.00 C ATOM 1407 OH TYR B 359 3.895 4.664 -11.754 1.00 0.00 O ATOM 0 H TYR B 359 -0.904 7.046 -5.660 1.00 0.00 H new ATOM 0 HA TYR B 359 1.679 6.089 -6.104 1.00 0.00 H new ATOM 0 HB2 TYR B 359 -0.375 5.653 -7.489 1.00 0.00 H new ATOM 0 HB3 TYR B 359 -0.265 7.285 -8.117 1.00 0.00 H new ATOM 0 HD1 TYR B 359 1.522 4.025 -7.969 1.00 0.00 H new ATOM 0 HD2 TYR B 359 1.249 7.815 -9.898 1.00 0.00 H new ATOM 0 HE1 TYR B 359 3.069 3.249 -9.709 1.00 0.00 H new ATOM 0 HE2 TYR B 359 2.795 7.039 -11.642 1.00 0.00 H new ATOM 0 HH TYR B 359 4.041 5.382 -12.405 1.00 0.00 H new ATOM 1417 N ALA B 360 1.337 9.306 -6.553 1.00 0.00 N ATOM 1418 CA ALA B 360 2.066 10.547 -6.797 1.00 0.00 C ATOM 1419 C ALA B 360 3.161 10.752 -5.757 1.00 0.00 C ATOM 1420 O ALA B 360 4.341 10.845 -6.094 1.00 0.00 O ATOM 1421 CB ALA B 360 1.111 11.731 -6.798 1.00 0.00 C ATOM 0 H ALA B 360 0.377 9.435 -6.233 1.00 0.00 H new ATOM 0 HA ALA B 360 2.538 10.475 -7.777 1.00 0.00 H new ATOM 0 HB1 ALA B 360 1.670 12.649 -6.981 1.00 0.00 H new ATOM 0 HB2 ALA B 360 0.366 11.597 -7.582 1.00 0.00 H new ATOM 0 HB3 ALA B 360 0.612 11.797 -5.831 1.00 0.00 H new ATOM 1427 N GLN B 361 2.759 10.822 -4.492 1.00 0.00 N ATOM 1428 CA GLN B 361 3.702 11.013 -3.398 1.00 0.00 C ATOM 1429 C GLN B 361 4.760 9.914 -3.404 1.00 0.00 C ATOM 1430 O GLN B 361 5.941 10.172 -3.176 1.00 0.00 O ATOM 1431 CB GLN B 361 2.964 11.025 -2.058 1.00 0.00 C ATOM 1432 CG GLN B 361 1.894 12.101 -1.967 1.00 0.00 C ATOM 1433 CD GLN B 361 1.127 12.061 -0.658 1.00 0.00 C ATOM 1434 OE1 GLN B 361 0.971 10.869 -0.095 1.00 0.00 O flip ATOM 1435 NE2 GLN B 361 0.675 13.092 -0.160 1.00 0.00 N flip ATOM 0 H GLN B 361 1.784 10.749 -4.200 1.00 0.00 H new ATOM 0 HA GLN B 361 4.199 11.973 -3.536 1.00 0.00 H new ATOM 0 HB2 GLN B 361 2.503 10.050 -1.897 1.00 0.00 H new ATOM 0 HB3 GLN B 361 3.686 11.173 -1.255 1.00 0.00 H new ATOM 0 HG2 GLN B 361 2.360 13.080 -2.080 1.00 0.00 H new ATOM 0 HG3 GLN B 361 1.196 11.983 -2.795 1.00 0.00 H new ATOM 0 HE21 GLN B 361 0.818 13.988 -0.626 1.00 0.00 H new ATOM 0 HE22 GLN B 361 0.158 13.050 0.718 1.00 0.00 H new ATOM 1444 N VAL B 362 4.322 8.688 -3.673 1.00 0.00 N ATOM 1445 CA VAL B 362 5.221 7.541 -3.719 1.00 0.00 C ATOM 1446 C VAL B 362 6.187 7.663 -4.893 1.00 0.00 C ATOM 1447 O VAL B 362 7.348 7.260 -4.800 1.00 0.00 O ATOM 1448 CB VAL B 362 4.434 6.220 -3.839 1.00 0.00 C ATOM 1449 CG1 VAL B 362 5.366 5.045 -4.082 1.00 0.00 C ATOM 1450 CG2 VAL B 362 3.608 5.978 -2.590 1.00 0.00 C ATOM 0 H VAL B 362 3.345 8.463 -3.863 1.00 0.00 H new ATOM 0 HA VAL B 362 5.785 7.529 -2.786 1.00 0.00 H new ATOM 0 HB VAL B 362 3.765 6.308 -4.695 1.00 0.00 H new ATOM 0 HG11 VAL B 362 4.782 4.128 -4.162 1.00 0.00 H new ATOM 0 HG12 VAL B 362 5.919 5.205 -5.007 1.00 0.00 H new ATOM 0 HG13 VAL B 362 6.066 4.958 -3.251 1.00 0.00 H new ATOM 0 HG21 VAL B 362 3.059 5.042 -2.692 1.00 0.00 H new ATOM 0 HG22 VAL B 362 4.267 5.920 -1.724 1.00 0.00 H new ATOM 0 HG23 VAL B 362 2.903 6.799 -2.455 1.00 0.00 H new ATOM 1460 N ALA B 363 5.699 8.220 -5.996 1.00 0.00 N ATOM 1461 CA ALA B 363 6.520 8.400 -7.186 1.00 0.00 C ATOM 1462 C ALA B 363 7.692 9.329 -6.898 1.00 0.00 C ATOM 1463 O ALA B 363 8.841 9.008 -7.199 1.00 0.00 O ATOM 1464 CB ALA B 363 5.679 8.944 -8.333 1.00 0.00 C ATOM 0 H ALA B 363 4.740 8.554 -6.090 1.00 0.00 H new ATOM 0 HA ALA B 363 6.919 7.428 -7.477 1.00 0.00 H new ATOM 0 HB1 ALA B 363 6.306 9.073 -9.215 1.00 0.00 H new ATOM 0 HB2 ALA B 363 4.875 8.243 -8.559 1.00 0.00 H new ATOM 0 HB3 ALA B 363 5.253 9.906 -8.047 1.00 0.00 H new ATOM 1470 N ARG B 364 7.391 10.482 -6.309 1.00 0.00 N ATOM 1471 CA ARG B 364 8.421 11.457 -5.972 1.00 0.00 C ATOM 1472 C ARG B 364 9.235 10.982 -4.774 1.00 0.00 C ATOM 1473 O ARG B 364 10.367 11.417 -4.566 1.00 0.00 O ATOM 1474 CB ARG B 364 7.789 12.816 -5.664 1.00 0.00 C ATOM 1475 CG ARG B 364 6.864 13.319 -6.757 1.00 0.00 C ATOM 1476 CD ARG B 364 6.224 14.644 -6.380 1.00 0.00 C ATOM 1477 NE ARG B 364 7.217 15.693 -6.171 1.00 0.00 N ATOM 1478 CZ ARG B 364 6.913 16.981 -6.041 1.00 0.00 C ATOM 1479 NH1 ARG B 364 5.648 17.376 -6.093 1.00 0.00 N ATOM 1480 NH2 ARG B 364 7.875 17.875 -5.859 1.00 0.00 N ATOM 0 H ARG B 364 6.444 10.763 -6.056 1.00 0.00 H new ATOM 0 HA ARG B 364 9.085 11.562 -6.830 1.00 0.00 H new ATOM 0 HB2 ARG B 364 7.230 12.744 -4.731 1.00 0.00 H new ATOM 0 HB3 ARG B 364 8.581 13.548 -5.505 1.00 0.00 H new ATOM 0 HG2 ARG B 364 7.425 13.436 -7.684 1.00 0.00 H new ATOM 0 HG3 ARG B 364 6.086 12.579 -6.946 1.00 0.00 H new ATOM 0 HD2 ARG B 364 5.534 14.950 -7.167 1.00 0.00 H new ATOM 0 HD3 ARG B 364 5.635 14.516 -5.472 1.00 0.00 H new ATOM 0 HE ARG B 364 8.199 15.423 -6.122 1.00 0.00 H new ATOM 0 HH11 ARG B 364 4.905 16.691 -6.233 1.00 0.00 H new ATOM 0 HH12 ARG B 364 5.418 18.365 -5.993 1.00 0.00 H new ATOM 0 HH21 ARG B 364 8.849 17.575 -5.819 1.00 0.00 H new ATOM 0 HH22 ARG B 364 7.641 18.863 -5.759 1.00 0.00 H new ATOM 1494 N LEU B 365 8.645 10.085 -3.990 1.00 0.00 N ATOM 1495 CA LEU B 365 9.306 9.543 -2.810 1.00 0.00 C ATOM 1496 C LEU B 365 10.586 8.808 -3.194 1.00 0.00 C ATOM 1497 O LEU B 365 11.679 9.177 -2.763 1.00 0.00 O ATOM 1498 CB LEU B 365 8.366 8.594 -2.069 1.00 0.00 C ATOM 1499 CG LEU B 365 8.835 8.171 -0.677 1.00 0.00 C ATOM 1500 CD1 LEU B 365 8.574 9.278 0.331 1.00 0.00 C ATOM 1501 CD2 LEU B 365 8.146 6.884 -0.252 1.00 0.00 C ATOM 0 H LEU B 365 7.707 9.718 -4.152 1.00 0.00 H new ATOM 0 HA LEU B 365 9.567 10.374 -2.155 1.00 0.00 H new ATOM 0 HB2 LEU B 365 7.391 9.072 -1.977 1.00 0.00 H new ATOM 0 HB3 LEU B 365 8.226 7.699 -2.676 1.00 0.00 H new ATOM 0 HG LEU B 365 9.909 7.988 -0.714 1.00 0.00 H new ATOM 0 HD11 LEU B 365 8.914 8.960 1.317 1.00 0.00 H new ATOM 0 HD12 LEU B 365 9.115 10.176 0.033 1.00 0.00 H new ATOM 0 HD13 LEU B 365 7.506 9.493 0.367 1.00 0.00 H new ATOM 0 HD21 LEU B 365 8.491 6.597 0.741 1.00 0.00 H new ATOM 0 HD22 LEU B 365 7.067 7.039 -0.230 1.00 0.00 H new ATOM 0 HD23 LEU B 365 8.385 6.092 -0.962 1.00 0.00 H new ATOM 1513 N PHE B 366 10.442 7.764 -4.005 1.00 0.00 N ATOM 1514 CA PHE B 366 11.585 6.973 -4.448 1.00 0.00 C ATOM 1515 C PHE B 366 12.398 7.727 -5.498 1.00 0.00 C ATOM 1516 O PHE B 366 13.626 7.754 -5.436 1.00 0.00 O ATOM 1517 CB PHE B 366 11.116 5.627 -5.002 1.00 0.00 C ATOM 1518 CG PHE B 366 10.392 4.782 -3.993 1.00 0.00 C ATOM 1519 CD1 PHE B 366 11.017 4.397 -2.816 1.00 0.00 C ATOM 1520 CD2 PHE B 366 9.087 4.375 -4.218 1.00 0.00 C ATOM 1521 CE1 PHE B 366 10.354 3.621 -1.885 1.00 0.00 C ATOM 1522 CE2 PHE B 366 8.419 3.599 -3.290 1.00 0.00 C ATOM 1523 CZ PHE B 366 9.053 3.222 -2.122 1.00 0.00 C ATOM 0 H PHE B 366 9.544 7.446 -4.369 1.00 0.00 H new ATOM 0 HA PHE B 366 12.229 6.793 -3.587 1.00 0.00 H new ATOM 0 HB2 PHE B 366 10.460 5.803 -5.854 1.00 0.00 H new ATOM 0 HB3 PHE B 366 11.980 5.075 -5.373 1.00 0.00 H new ATOM 0 HD1 PHE B 366 12.034 4.707 -2.625 1.00 0.00 H new ATOM 0 HD2 PHE B 366 8.586 4.668 -5.129 1.00 0.00 H new ATOM 0 HE1 PHE B 366 10.852 3.327 -0.973 1.00 0.00 H new ATOM 0 HE2 PHE B 366 7.402 3.288 -3.478 1.00 0.00 H new ATOM 0 HZ PHE B 366 8.532 2.616 -1.395 1.00 0.00 H new ATOM 1533 N LYS B 367 11.700 8.330 -6.461 1.00 0.00 N ATOM 1534 CA LYS B 367 12.348 9.100 -7.525 1.00 0.00 C ATOM 1535 C LYS B 367 13.202 8.214 -8.421 1.00 0.00 C ATOM 1536 O LYS B 367 14.146 7.577 -7.953 1.00 0.00 O ATOM 1537 CB LYS B 367 13.231 10.187 -6.929 1.00 0.00 C ATOM 1538 CG LYS B 367 13.650 11.250 -7.932 1.00 0.00 C ATOM 1539 CD LYS B 367 14.456 12.356 -7.269 1.00 0.00 C ATOM 1540 CE LYS B 367 14.920 13.391 -8.281 1.00 0.00 C ATOM 1541 NZ LYS B 367 15.836 12.804 -9.299 1.00 0.00 N ATOM 0 H LYS B 367 10.683 8.300 -6.527 1.00 0.00 H new ATOM 0 HA LYS B 367 11.555 9.546 -8.126 1.00 0.00 H new ATOM 0 HB2 LYS B 367 12.699 10.665 -6.107 1.00 0.00 H new ATOM 0 HB3 LYS B 367 14.124 9.727 -6.506 1.00 0.00 H new ATOM 0 HG2 LYS B 367 14.243 10.791 -8.724 1.00 0.00 H new ATOM 0 HG3 LYS B 367 12.764 11.676 -8.403 1.00 0.00 H new ATOM 0 HD2 LYS B 367 13.850 12.840 -6.504 1.00 0.00 H new ATOM 0 HD3 LYS B 367 15.321 11.925 -6.765 1.00 0.00 H new ATOM 0 HE2 LYS B 367 14.053 13.824 -8.780 1.00 0.00 H new ATOM 0 HE3 LYS B 367 15.428 14.204 -7.762 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 16.300 13.568 -9.830 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 16.558 12.225 -8.824 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 15.291 12.208 -9.954 1.00 0.00 H new ATOM 1555 N ASN B 368 12.876 8.201 -9.713 1.00 0.00 N ATOM 1556 CA ASN B 368 13.607 7.404 -10.698 1.00 0.00 C ATOM 1557 C ASN B 368 13.348 5.913 -10.507 1.00 0.00 C ATOM 1558 O ASN B 368 13.311 5.155 -11.477 1.00 0.00 O ATOM 1559 CB ASN B 368 15.111 7.690 -10.629 1.00 0.00 C ATOM 1560 CG ASN B 368 15.434 9.158 -10.842 1.00 0.00 C ATOM 1561 OD1 ASN B 368 14.609 9.842 -11.627 1.00 0.00 O flip ATOM 1562 ND2 ASN B 368 16.418 9.671 -10.307 1.00 0.00 N flip ATOM 0 H ASN B 368 12.103 8.739 -10.105 1.00 0.00 H new ATOM 0 HA ASN B 368 13.242 7.692 -11.684 1.00 0.00 H new ATOM 0 HB2 ASN B 368 15.493 7.374 -9.658 1.00 0.00 H new ATOM 0 HB3 ASN B 368 15.626 7.095 -11.383 1.00 0.00 H new ATOM 0 HD21 ASN B 368 17.026 9.109 -9.711 1.00 0.00 H new ATOM 0 HD22 ASN B 368 16.625 10.658 -10.460 1.00 0.00 H new ATOM 1569 N GLN B 369 13.172 5.494 -9.257 1.00 0.00 N ATOM 1570 CA GLN B 369 12.910 4.091 -8.959 1.00 0.00 C ATOM 1571 C GLN B 369 11.553 3.671 -9.513 1.00 0.00 C ATOM 1572 O GLN B 369 10.530 3.793 -8.839 1.00 0.00 O ATOM 1573 CB GLN B 369 12.958 3.845 -7.453 1.00 0.00 C ATOM 1574 CG GLN B 369 14.324 4.098 -6.838 1.00 0.00 C ATOM 1575 CD GLN B 369 15.371 3.099 -7.294 1.00 0.00 C ATOM 1576 OE1 GLN B 369 14.942 1.868 -7.556 1.00 0.00 O flip ATOM 1577 NE2 GLN B 369 16.552 3.427 -7.404 1.00 0.00 N flip ATOM 0 H GLN B 369 13.206 6.103 -8.439 1.00 0.00 H new ATOM 0 HA GLN B 369 13.685 3.491 -9.437 1.00 0.00 H new ATOM 0 HB2 GLN B 369 12.225 4.487 -6.965 1.00 0.00 H new ATOM 0 HB3 GLN B 369 12.664 2.815 -7.252 1.00 0.00 H new ATOM 0 HG2 GLN B 369 14.653 5.105 -7.097 1.00 0.00 H new ATOM 0 HG3 GLN B 369 14.241 4.059 -5.752 1.00 0.00 H new ATOM 0 HE21 GLN B 369 16.838 4.383 -7.193 1.00 0.00 H new ATOM 0 HE22 GLN B 369 17.245 2.743 -7.707 1.00 0.00 H new ATOM 1586 N GLU B 370 11.554 3.185 -10.748 1.00 0.00 N ATOM 1587 CA GLU B 370 10.324 2.753 -11.400 1.00 0.00 C ATOM 1588 C GLU B 370 10.050 1.278 -11.128 1.00 0.00 C ATOM 1589 O GLU B 370 9.002 0.755 -11.503 1.00 0.00 O ATOM 1590 CB GLU B 370 10.406 3.003 -12.905 1.00 0.00 C ATOM 1591 CG GLU B 370 10.564 4.471 -13.267 1.00 0.00 C ATOM 1592 CD GLU B 370 10.689 4.694 -14.761 1.00 0.00 C ATOM 1593 OE1 GLU B 370 9.646 4.863 -15.426 1.00 0.00 O ATOM 1594 OE2 GLU B 370 11.832 4.698 -15.267 1.00 0.00 O ATOM 0 H GLU B 370 12.393 3.080 -11.318 1.00 0.00 H new ATOM 0 HA GLU B 370 9.500 3.335 -10.988 1.00 0.00 H new ATOM 0 HB2 GLU B 370 11.248 2.443 -13.313 1.00 0.00 H new ATOM 0 HB3 GLU B 370 9.505 2.615 -13.380 1.00 0.00 H new ATOM 0 HG2 GLU B 370 9.706 5.028 -12.891 1.00 0.00 H new ATOM 0 HG3 GLU B 370 11.447 4.871 -12.769 1.00 0.00 H new ATOM 1601 N ASP B 371 10.999 0.612 -10.480 1.00 0.00 N ATOM 1602 CA ASP B 371 10.850 -0.802 -10.151 1.00 0.00 C ATOM 1603 C ASP B 371 9.738 -0.991 -9.124 1.00 0.00 C ATOM 1604 O ASP B 371 8.872 -1.854 -9.276 1.00 0.00 O ATOM 1605 CB ASP B 371 12.167 -1.367 -9.616 1.00 0.00 C ATOM 1606 CG ASP B 371 12.056 -2.830 -9.238 1.00 0.00 C ATOM 1607 OD1 ASP B 371 12.208 -3.688 -10.134 1.00 0.00 O ATOM 1608 OD2 ASP B 371 11.817 -3.120 -8.047 1.00 0.00 O ATOM 0 H ASP B 371 11.878 1.027 -10.172 1.00 0.00 H new ATOM 0 HA ASP B 371 10.584 -1.343 -11.059 1.00 0.00 H new ATOM 0 HB2 ASP B 371 12.944 -1.247 -10.371 1.00 0.00 H new ATOM 0 HB3 ASP B 371 12.479 -0.792 -8.744 1.00 0.00 H new ATOM 1613 N LEU B 372 9.772 -0.172 -8.078 1.00 0.00 N ATOM 1614 CA LEU B 372 8.767 -0.229 -7.027 1.00 0.00 C ATOM 1615 C LEU B 372 7.448 0.337 -7.533 1.00 0.00 C ATOM 1616 O LEU B 372 6.377 -0.194 -7.241 1.00 0.00 O ATOM 1617 CB LEU B 372 9.233 0.561 -5.802 1.00 0.00 C ATOM 1618 CG LEU B 372 10.483 0.019 -5.107 1.00 0.00 C ATOM 1619 CD1 LEU B 372 11.739 0.339 -5.906 1.00 0.00 C ATOM 1620 CD2 LEU B 372 10.588 0.586 -3.703 1.00 0.00 C ATOM 0 H LEU B 372 10.488 0.541 -7.937 1.00 0.00 H new ATOM 0 HA LEU B 372 8.623 -1.271 -6.741 1.00 0.00 H new ATOM 0 HB2 LEU B 372 9.425 1.590 -6.106 1.00 0.00 H new ATOM 0 HB3 LEU B 372 8.419 0.589 -5.078 1.00 0.00 H new ATOM 0 HG LEU B 372 10.394 -1.066 -5.044 1.00 0.00 H new ATOM 0 HD11 LEU B 372 12.611 -0.059 -5.387 1.00 0.00 H new ATOM 0 HD12 LEU B 372 11.667 -0.114 -6.895 1.00 0.00 H new ATOM 0 HD13 LEU B 372 11.839 1.419 -6.009 1.00 0.00 H new ATOM 0 HD21 LEU B 372 11.482 0.193 -3.218 1.00 0.00 H new ATOM 0 HD22 LEU B 372 10.651 1.673 -3.753 1.00 0.00 H new ATOM 0 HD23 LEU B 372 9.707 0.299 -3.128 1.00 0.00 H new ATOM 1632 N LEU B 373 7.543 1.422 -8.294 1.00 0.00 N ATOM 1633 CA LEU B 373 6.369 2.073 -8.858 1.00 0.00 C ATOM 1634 C LEU B 373 5.636 1.130 -9.807 1.00 0.00 C ATOM 1635 O LEU B 373 4.406 1.135 -9.876 1.00 0.00 O ATOM 1636 CB LEU B 373 6.782 3.350 -9.593 1.00 0.00 C ATOM 1637 CG LEU B 373 6.441 4.667 -8.884 1.00 0.00 C ATOM 1638 CD1 LEU B 373 6.779 4.602 -7.397 1.00 0.00 C ATOM 1639 CD2 LEU B 373 7.177 5.822 -9.545 1.00 0.00 C ATOM 0 H LEU B 373 8.427 1.870 -8.535 1.00 0.00 H new ATOM 0 HA LEU B 373 5.692 2.335 -8.045 1.00 0.00 H new ATOM 0 HB2 LEU B 373 7.858 3.318 -9.762 1.00 0.00 H new ATOM 0 HB3 LEU B 373 6.306 3.353 -10.573 1.00 0.00 H new ATOM 0 HG LEU B 373 5.367 4.831 -8.974 1.00 0.00 H new ATOM 0 HD11 LEU B 373 6.525 5.551 -6.924 1.00 0.00 H new ATOM 0 HD12 LEU B 373 6.209 3.800 -6.929 1.00 0.00 H new ATOM 0 HD13 LEU B 373 7.845 4.409 -7.274 1.00 0.00 H new ATOM 0 HD21 LEU B 373 6.928 6.752 -9.034 1.00 0.00 H new ATOM 0 HD22 LEU B 373 8.252 5.651 -9.484 1.00 0.00 H new ATOM 0 HD23 LEU B 373 6.879 5.892 -10.591 1.00 0.00 H new ATOM 1651 N SER B 374 6.398 0.318 -10.536 1.00 0.00 N ATOM 1652 CA SER B 374 5.814 -0.637 -11.470 1.00 0.00 C ATOM 1653 C SER B 374 5.128 -1.762 -10.707 1.00 0.00 C ATOM 1654 O SER B 374 3.980 -2.110 -10.992 1.00 0.00 O ATOM 1655 CB SER B 374 6.887 -1.208 -12.400 1.00 0.00 C ATOM 1656 OG SER B 374 7.862 -1.933 -11.672 1.00 0.00 O ATOM 0 H SER B 374 7.417 0.303 -10.497 1.00 0.00 H new ATOM 0 HA SER B 374 5.073 -0.117 -12.078 1.00 0.00 H new ATOM 0 HB2 SER B 374 6.422 -1.860 -13.139 1.00 0.00 H new ATOM 0 HB3 SER B 374 7.367 -0.397 -12.948 1.00 0.00 H new ATOM 0 HG SER B 374 8.020 -1.494 -10.810 1.00 0.00 H new ATOM 1662 N GLU B 375 5.838 -2.329 -9.735 1.00 0.00 N ATOM 1663 CA GLU B 375 5.285 -3.402 -8.918 1.00 0.00 C ATOM 1664 C GLU B 375 4.084 -2.896 -8.131 1.00 0.00 C ATOM 1665 O GLU B 375 3.221 -3.672 -7.720 1.00 0.00 O ATOM 1666 CB GLU B 375 6.344 -3.952 -7.960 1.00 0.00 C ATOM 1667 CG GLU B 375 7.436 -4.751 -8.650 1.00 0.00 C ATOM 1668 CD GLU B 375 8.473 -5.277 -7.676 1.00 0.00 C ATOM 1669 OE1 GLU B 375 8.186 -6.278 -6.987 1.00 0.00 O ATOM 1670 OE2 GLU B 375 9.571 -4.688 -7.604 1.00 0.00 O ATOM 0 H GLU B 375 6.793 -2.064 -9.496 1.00 0.00 H new ATOM 0 HA GLU B 375 4.964 -4.207 -9.579 1.00 0.00 H new ATOM 0 HB2 GLU B 375 6.799 -3.122 -7.421 1.00 0.00 H new ATOM 0 HB3 GLU B 375 5.857 -4.585 -7.218 1.00 0.00 H new ATOM 0 HG2 GLU B 375 6.987 -5.588 -9.185 1.00 0.00 H new ATOM 0 HG3 GLU B 375 7.926 -4.123 -9.394 1.00 0.00 H new ATOM 1677 N PHE B 376 4.040 -1.582 -7.927 1.00 0.00 N ATOM 1678 CA PHE B 376 2.945 -0.955 -7.199 1.00 0.00 C ATOM 1679 C PHE B 376 1.781 -0.672 -8.142 1.00 0.00 C ATOM 1680 O PHE B 376 0.623 -0.658 -7.726 1.00 0.00 O ATOM 1681 CB PHE B 376 3.418 0.343 -6.541 1.00 0.00 C ATOM 1682 CG PHE B 376 2.367 1.014 -5.702 1.00 0.00 C ATOM 1683 CD1 PHE B 376 2.146 0.616 -4.393 1.00 0.00 C ATOM 1684 CD2 PHE B 376 1.601 2.043 -6.224 1.00 0.00 C ATOM 1685 CE1 PHE B 376 1.181 1.234 -3.621 1.00 0.00 C ATOM 1686 CE2 PHE B 376 0.634 2.665 -5.457 1.00 0.00 C ATOM 1687 CZ PHE B 376 0.424 2.259 -4.153 1.00 0.00 C ATOM 0 H PHE B 376 4.753 -0.931 -8.257 1.00 0.00 H new ATOM 0 HA PHE B 376 2.608 -1.638 -6.419 1.00 0.00 H new ATOM 0 HB2 PHE B 376 4.286 0.128 -5.917 1.00 0.00 H new ATOM 0 HB3 PHE B 376 3.747 1.034 -7.317 1.00 0.00 H new ATOM 0 HD1 PHE B 376 2.734 -0.186 -3.972 1.00 0.00 H new ATOM 0 HD2 PHE B 376 1.761 2.363 -7.243 1.00 0.00 H new ATOM 0 HE1 PHE B 376 1.019 0.915 -2.602 1.00 0.00 H new ATOM 0 HE2 PHE B 376 0.044 3.467 -5.876 1.00 0.00 H new ATOM 0 HZ PHE B 376 -0.331 2.743 -3.551 1.00 0.00 H new ATOM 1697 N GLY B 377 2.101 -0.448 -9.414 1.00 0.00 N ATOM 1698 CA GLY B 377 1.073 -0.179 -10.404 1.00 0.00 C ATOM 1699 C GLY B 377 0.261 -1.415 -10.729 1.00 0.00 C ATOM 1700 O GLY B 377 -0.962 -1.346 -10.859 1.00 0.00 O ATOM 0 H GLY B 377 3.054 -0.448 -9.776 1.00 0.00 H new ATOM 0 HA2 GLY B 377 0.410 0.604 -10.035 1.00 0.00 H new ATOM 0 HA3 GLY B 377 1.537 0.200 -11.315 1.00 0.00 H new ATOM 1704 N GLN B 378 0.941 -2.552 -10.862 1.00 0.00 N ATOM 1705 CA GLN B 378 0.266 -3.811 -11.158 1.00 0.00 C ATOM 1706 C GLN B 378 -0.522 -4.256 -9.936 1.00 0.00 C ATOM 1707 O GLN B 378 -1.536 -4.946 -10.043 1.00 0.00 O ATOM 1708 CB GLN B 378 1.278 -4.888 -11.557 1.00 0.00 C ATOM 1709 CG GLN B 378 2.355 -5.134 -10.512 1.00 0.00 C ATOM 1710 CD GLN B 378 3.327 -6.225 -10.919 1.00 0.00 C ATOM 1711 OE1 GLN B 378 4.502 -6.193 -10.550 1.00 0.00 O ATOM 1712 NE2 GLN B 378 2.843 -7.200 -11.680 1.00 0.00 N ATOM 0 H GLN B 378 1.954 -2.626 -10.770 1.00 0.00 H new ATOM 0 HA GLN B 378 -0.415 -3.661 -11.996 1.00 0.00 H new ATOM 0 HB2 GLN B 378 0.747 -5.821 -11.745 1.00 0.00 H new ATOM 0 HB3 GLN B 378 1.753 -4.598 -12.494 1.00 0.00 H new ATOM 0 HG2 GLN B 378 2.905 -4.209 -10.338 1.00 0.00 H new ATOM 0 HG3 GLN B 378 1.884 -5.407 -9.568 1.00 0.00 H new ATOM 0 HE21 GLN B 378 1.863 -7.187 -11.963 1.00 0.00 H new ATOM 0 HE22 GLN B 378 3.451 -7.961 -11.982 1.00 0.00 H new ATOM 1721 N PHE B 379 -0.033 -3.843 -8.775 1.00 0.00 N ATOM 1722 CA PHE B 379 -0.667 -4.156 -7.505 1.00 0.00 C ATOM 1723 C PHE B 379 -1.807 -3.175 -7.242 1.00 0.00 C ATOM 1724 O PHE B 379 -2.731 -3.458 -6.479 1.00 0.00 O ATOM 1725 CB PHE B 379 0.387 -4.101 -6.391 1.00 0.00 C ATOM 1726 CG PHE B 379 -0.156 -3.785 -5.028 1.00 0.00 C ATOM 1727 CD1 PHE B 379 -0.676 -4.784 -4.223 1.00 0.00 C ATOM 1728 CD2 PHE B 379 -0.134 -2.485 -4.551 1.00 0.00 C ATOM 1729 CE1 PHE B 379 -1.169 -4.491 -2.966 1.00 0.00 C ATOM 1730 CE2 PHE B 379 -0.625 -2.186 -3.296 1.00 0.00 C ATOM 1731 CZ PHE B 379 -1.143 -3.191 -2.502 1.00 0.00 C ATOM 0 H PHE B 379 0.814 -3.282 -8.689 1.00 0.00 H new ATOM 0 HA PHE B 379 -1.090 -5.160 -7.532 1.00 0.00 H new ATOM 0 HB2 PHE B 379 0.901 -5.061 -6.349 1.00 0.00 H new ATOM 0 HB3 PHE B 379 1.133 -3.351 -6.653 1.00 0.00 H new ATOM 0 HD1 PHE B 379 -0.697 -5.803 -4.581 1.00 0.00 H new ATOM 0 HD2 PHE B 379 0.272 -1.697 -5.168 1.00 0.00 H new ATOM 0 HE1 PHE B 379 -1.574 -5.278 -2.347 1.00 0.00 H new ATOM 0 HE2 PHE B 379 -0.604 -1.168 -2.935 1.00 0.00 H new ATOM 0 HZ PHE B 379 -1.527 -2.960 -1.519 1.00 0.00 H new ATOM 1741 N LEU B 380 -1.727 -2.022 -7.898 1.00 0.00 N ATOM 1742 CA LEU B 380 -2.739 -0.979 -7.769 1.00 0.00 C ATOM 1743 C LEU B 380 -4.059 -1.440 -8.388 1.00 0.00 C ATOM 1744 O LEU B 380 -4.054 -2.112 -9.420 1.00 0.00 O ATOM 1745 CB LEU B 380 -2.250 0.296 -8.465 1.00 0.00 C ATOM 1746 CG LEU B 380 -3.023 1.573 -8.135 1.00 0.00 C ATOM 1747 CD1 LEU B 380 -2.791 1.982 -6.688 1.00 0.00 C ATOM 1748 CD2 LEU B 380 -2.617 2.694 -9.081 1.00 0.00 C ATOM 0 H LEU B 380 -0.963 -1.785 -8.531 1.00 0.00 H new ATOM 0 HA LEU B 380 -2.906 -0.773 -6.712 1.00 0.00 H new ATOM 0 HB2 LEU B 380 -1.203 0.450 -8.205 1.00 0.00 H new ATOM 0 HB3 LEU B 380 -2.291 0.137 -9.543 1.00 0.00 H new ATOM 0 HG LEU B 380 -4.087 1.377 -8.266 1.00 0.00 H new ATOM 0 HD11 LEU B 380 -3.350 2.893 -6.473 1.00 0.00 H new ATOM 0 HD12 LEU B 380 -3.129 1.185 -6.026 1.00 0.00 H new ATOM 0 HD13 LEU B 380 -1.728 2.162 -6.527 1.00 0.00 H new ATOM 0 HD21 LEU B 380 -3.175 3.598 -8.835 1.00 0.00 H new ATOM 0 HD22 LEU B 380 -1.549 2.888 -8.979 1.00 0.00 H new ATOM 0 HD23 LEU B 380 -2.836 2.401 -10.108 1.00 0.00 H new ATOM 1760 N PRO B 381 -5.209 -1.096 -7.770 1.00 0.00 N ATOM 1761 CA PRO B 381 -6.523 -1.490 -8.289 1.00 0.00 C ATOM 1762 C PRO B 381 -6.662 -1.200 -9.780 1.00 0.00 C ATOM 1763 O PRO B 381 -6.066 -0.254 -10.295 1.00 0.00 O ATOM 1764 CB PRO B 381 -7.495 -0.624 -7.487 1.00 0.00 C ATOM 1765 CG PRO B 381 -6.791 -0.350 -6.204 1.00 0.00 C ATOM 1766 CD PRO B 381 -5.322 -0.309 -6.526 1.00 0.00 C ATOM 0 HA PRO B 381 -6.700 -2.561 -8.185 1.00 0.00 H new ATOM 0 HB2 PRO B 381 -7.729 0.300 -8.015 1.00 0.00 H new ATOM 0 HB3 PRO B 381 -8.439 -1.142 -7.317 1.00 0.00 H new ATOM 0 HG2 PRO B 381 -7.121 0.596 -5.774 1.00 0.00 H new ATOM 0 HG3 PRO B 381 -7.006 -1.126 -5.470 1.00 0.00 H new ATOM 0 HD2 PRO B 381 -4.972 0.714 -6.667 1.00 0.00 H new ATOM 0 HD3 PRO B 381 -4.725 -0.742 -5.724 1.00 0.00 H new