USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 706 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 THR OG1 : rot 180:sc= -0.0851 USER MOD Set 1.2: B 379 SER OG : rot 100:sc= 0.901 USER MOD Set 2.1: B 362 SER OG : rot -170:sc= 1.06 USER MOD Set 2.2: B 365 SER OG : rot 180:sc= 0.0162 USER MOD Set 3.1: B 352 SER OG : rot -81:sc= -4.01! USER MOD Set 3.2: B 355 ASN : amide:sc= -4.8! C(o=-8.8!,f=-10!) USER MOD Set 4.1: B 333 THR OG1 : rot -147:sc= -2.14! USER MOD Set 4.2: B 336 CYS SG : rot 180:sc= -0.696! USER MOD Set 5.1: B 316 LYS NZ :NH3+ 161:sc= 0.099 (180deg=-1.16) USER MOD Set 5.2: B 381 GLN : amide:sc= 0.561 K(o=0.66,f=-8.6!) USER MOD Set 6.1: B 311 SER OG : rot -120:sc= -0.379 USER MOD Set 6.2: B 395 TYR OH : rot 180:sc= 0 USER MOD Single : B 334 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 338 MET CE :methyl -142:sc= -0.249 (180deg=-4.56!) USER MOD Single : B 343 LYS NZ :NH3+ -132:sc= -0.306 (180deg=-1.42!) USER MOD Single : B 344 THR OG1 : rot -150:sc= -0.682 USER MOD Single : B 345 LYS NZ :NH3+ -144:sc= -0.26 (180deg=-1.35!) USER MOD Single : B 349 GLN : amide:sc= -1.25 X(o=-1.2,f=-0.85) USER MOD Single : B 354 THR OG1 : rot 160:sc= -3.92! USER MOD Single : B 357 LYS NZ :NH3+ -109:sc= -1.14! (180deg=-2.98!) USER MOD Single : B 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 373 TYR OH : rot 180:sc= 0 USER MOD Single : B 374 GLN : amide:sc= -0.0749 X(o=-0.075,f=-0.075) USER MOD Single : B 377 TYR OH : rot 180:sc= -3.2! USER MOD Single : B 378 TYR OH : rot 180:sc= 0 USER MOD Single : B 382 THR OG1 : rot -138:sc= -2.32! USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0658 USER MOD Single : B 387 GLN : amide:sc= -1.18 K(o=-1.2,f=-2!) USER MOD Single : B 390 GLN : amide:sc= -7.61! C(o=-7.6!,f=-15!) USER MOD ----------------------------------------------------------------- ATOM 125 N LEU A 15 1.159 11.852 1.893 1.00 0.00 N ATOM 126 CA LEU A 15 0.474 10.592 1.624 1.00 0.00 C ATOM 127 C LEU A 15 -0.736 10.467 2.538 1.00 0.00 C ATOM 128 O LEU A 15 -1.815 10.060 2.112 1.00 0.00 O ATOM 129 CB LEU A 15 1.425 9.406 1.869 1.00 0.00 C ATOM 130 CG LEU A 15 2.385 9.176 0.682 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.618 8.870 -0.606 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.246 10.409 0.450 1.00 0.00 C ATOM 0 HA LEU A 15 0.152 10.580 0.583 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.005 9.588 2.774 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.840 8.503 2.042 1.00 0.00 H new ATOM 0 HG LEU A 15 3.012 8.321 0.936 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.324 8.713 -1.421 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.018 7.970 -0.467 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.964 9.708 -0.848 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.917 10.231 -0.390 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.606 11.263 0.229 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.832 10.617 1.345 1.00 0.00 H new ATOM 144 N LEU A 16 -0.552 10.837 3.794 1.00 0.00 N ATOM 145 CA LEU A 16 -1.640 10.781 4.755 1.00 0.00 C ATOM 146 C LEU A 16 -2.801 11.648 4.262 1.00 0.00 C ATOM 147 O LEU A 16 -3.965 11.262 4.368 1.00 0.00 O ATOM 148 CB LEU A 16 -1.143 11.264 6.120 1.00 0.00 C ATOM 149 CG LEU A 16 -1.607 10.310 7.229 1.00 0.00 C ATOM 150 CD1 LEU A 16 -3.126 10.145 7.174 1.00 0.00 C ATOM 151 CD2 LEU A 16 -0.934 8.938 7.057 1.00 0.00 C ATOM 0 H LEU A 16 0.333 11.177 4.170 1.00 0.00 H new ATOM 0 HA LEU A 16 -1.991 9.754 4.858 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.055 11.325 6.117 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.518 12.269 6.316 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.326 10.730 8.195 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.447 9.466 7.964 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.603 11.115 7.313 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.413 9.735 6.205 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.269 8.267 7.848 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.204 8.519 6.088 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.148 9.054 7.113 1.00 0.00 H new ATOM 163 N GLY A 17 -2.478 12.801 3.680 1.00 0.00 N ATOM 164 CA GLY A 17 -3.509 13.677 3.134 1.00 0.00 C ATOM 165 C GLY A 17 -4.228 12.957 2.003 1.00 0.00 C ATOM 166 O GLY A 17 -5.455 12.973 1.915 1.00 0.00 O ATOM 0 H GLY A 17 -1.524 13.146 3.576 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.218 13.954 3.914 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.062 14.601 2.767 1.00 0.00 H new ATOM 170 N GLU A 18 -3.446 12.301 1.153 1.00 0.00 N ATOM 171 CA GLU A 18 -4.003 11.542 0.045 1.00 0.00 C ATOM 172 C GLU A 18 -4.864 10.406 0.574 1.00 0.00 C ATOM 173 O GLU A 18 -5.908 10.094 0.009 1.00 0.00 O ATOM 174 CB GLU A 18 -2.859 10.989 -0.804 1.00 0.00 C ATOM 175 CG GLU A 18 -2.293 12.109 -1.675 1.00 0.00 C ATOM 176 CD GLU A 18 -1.220 11.560 -2.606 1.00 0.00 C ATOM 177 OE1 GLU A 18 -0.842 10.413 -2.432 1.00 0.00 O1- ATOM 178 OE2 GLU A 18 -0.792 12.295 -3.480 1.00 0.00 O ATOM 0 H GLU A 18 -2.428 12.281 1.211 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.628 12.191 -0.568 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.078 10.581 -0.162 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.217 10.171 -1.429 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.093 12.565 -2.259 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.872 12.892 -1.045 1.00 0.00 H new ATOM 394 N VAL B 310 9.431 -12.657 0.633 1.00 0.00 N ATOM 395 CA VAL B 310 8.149 -11.993 0.437 1.00 0.00 C ATOM 396 C VAL B 310 7.403 -11.851 1.762 1.00 0.00 C ATOM 397 O VAL B 310 7.319 -12.800 2.543 1.00 0.00 O ATOM 398 CB VAL B 310 7.298 -12.793 -0.551 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.897 -12.189 -0.627 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.942 -12.741 -1.937 1.00 0.00 C ATOM 0 HA VAL B 310 8.334 -10.997 0.036 1.00 0.00 H new ATOM 0 HB VAL B 310 7.233 -13.828 -0.214 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.292 -12.760 -1.331 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.433 -12.221 0.359 1.00 0.00 H new ATOM 0 HG13 VAL B 310 5.965 -11.154 -0.963 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.336 -13.311 -2.641 1.00 0.00 H new ATOM 0 HG22 VAL B 310 8.007 -11.705 -2.269 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.943 -13.170 -1.889 1.00 0.00 H new ATOM 410 N SER B 311 6.865 -10.658 2.006 1.00 0.00 N ATOM 411 CA SER B 311 6.127 -10.388 3.234 1.00 0.00 C ATOM 412 C SER B 311 4.645 -10.216 2.927 1.00 0.00 C ATOM 413 O SER B 311 4.287 -9.852 1.816 1.00 0.00 O ATOM 414 CB SER B 311 6.659 -9.121 3.881 1.00 0.00 C ATOM 415 OG SER B 311 7.791 -8.663 3.154 1.00 0.00 O ATOM 0 H SER B 311 6.927 -9.864 1.369 1.00 0.00 H new ATOM 0 HA SER B 311 6.256 -11.229 3.916 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.886 -8.353 3.894 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.933 -9.316 4.918 1.00 0.00 H new ATOM 0 HG SER B 311 8.572 -8.639 3.746 1.00 0.00 H new ATOM 421 N PHE B 312 3.791 -10.507 3.905 1.00 0.00 N ATOM 422 CA PHE B 312 2.347 -10.413 3.713 1.00 0.00 C ATOM 423 C PHE B 312 1.683 -9.596 4.825 1.00 0.00 C ATOM 424 O PHE B 312 1.989 -9.799 6.001 1.00 0.00 O ATOM 425 CB PHE B 312 1.785 -11.832 3.736 1.00 0.00 C ATOM 426 CG PHE B 312 2.109 -12.534 2.437 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.535 -12.093 1.238 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.984 -13.628 2.431 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.836 -12.744 0.036 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.283 -14.280 1.228 1.00 0.00 C ATOM 431 CZ PHE B 312 2.709 -13.837 0.030 1.00 0.00 C ATOM 0 H PHE B 312 4.074 -10.809 4.837 1.00 0.00 H new ATOM 0 HA PHE B 312 2.144 -9.913 2.766 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.207 -12.386 4.574 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.706 -11.803 3.884 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.860 -11.250 1.241 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.428 -13.969 3.355 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.394 -12.402 -0.888 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.956 -15.124 1.224 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.940 -14.339 -0.898 1.00 0.00 H new ATOM 441 N PHE B 313 0.758 -8.684 4.468 1.00 0.00 N ATOM 442 CA PHE B 313 0.077 -7.897 5.485 1.00 0.00 C ATOM 443 C PHE B 313 -1.393 -7.756 5.151 1.00 0.00 C ATOM 444 O PHE B 313 -1.758 -7.355 4.048 1.00 0.00 O ATOM 445 CB PHE B 313 0.689 -6.508 5.586 1.00 0.00 C ATOM 446 CG PHE B 313 2.002 -6.583 6.318 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.173 -6.905 5.623 1.00 0.00 C ATOM 448 CD2 PHE B 313 2.050 -6.323 7.690 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.394 -6.966 6.304 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.272 -6.382 8.371 1.00 0.00 C ATOM 451 CZ PHE B 313 4.444 -6.705 7.676 1.00 0.00 C ATOM 0 H PHE B 313 0.478 -8.485 3.507 1.00 0.00 H new ATOM 0 HA PHE B 313 0.189 -8.416 6.437 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.841 -6.094 4.589 1.00 0.00 H new ATOM 0 HB3 PHE B 313 0.008 -5.837 6.110 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.135 -7.106 4.563 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.145 -6.077 8.225 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.298 -7.215 5.769 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.311 -6.179 9.431 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.387 -6.752 8.200 1.00 0.00 H new ATOM 461 N LEU B 314 -2.230 -8.059 6.121 1.00 0.00 N ATOM 462 CA LEU B 314 -3.654 -7.932 5.940 1.00 0.00 C ATOM 463 C LEU B 314 -4.062 -6.497 6.166 1.00 0.00 C ATOM 464 O LEU B 314 -4.039 -5.948 7.255 1.00 0.00 O ATOM 465 CB LEU B 314 -4.432 -8.968 6.781 1.00 0.00 C ATOM 466 CG LEU B 314 -4.935 -8.454 8.142 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.804 -7.810 8.950 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.111 -7.477 7.965 1.00 0.00 C ATOM 0 H LEU B 314 -1.945 -8.395 7.041 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.923 -8.173 4.911 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.288 -9.315 6.202 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.790 -9.832 6.951 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.294 -9.315 8.705 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.194 -7.458 9.905 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.019 -8.545 9.127 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.393 -6.968 8.393 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.446 -7.130 8.942 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.789 -6.624 7.368 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.932 -7.984 7.459 1.00 0.00 H new ATOM 480 N VAL B 315 -4.343 -5.881 5.063 1.00 0.00 N ATOM 481 CA VAL B 315 -4.694 -4.479 5.036 1.00 0.00 C ATOM 482 C VAL B 315 -6.119 -4.305 4.524 1.00 0.00 C ATOM 483 O VAL B 315 -6.642 -5.202 3.891 1.00 0.00 O ATOM 484 CB VAL B 315 -3.715 -3.778 4.110 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.287 -3.955 4.625 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.846 -4.373 2.695 1.00 0.00 C ATOM 0 H VAL B 315 -4.338 -6.329 4.147 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.643 -4.053 6.038 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.942 -2.712 4.079 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.593 -3.449 3.954 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.205 -3.526 5.624 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -2.044 -5.017 4.665 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -3.146 -3.875 2.024 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.622 -5.439 2.726 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.863 -4.227 2.332 1.00 0.00 H new ATOM 496 N LYS B 316 -6.745 -3.152 4.786 1.00 0.00 N ATOM 497 CA LYS B 316 -8.098 -2.924 4.307 1.00 0.00 C ATOM 498 C LYS B 316 -8.057 -2.001 3.108 1.00 0.00 C ATOM 499 O LYS B 316 -7.214 -1.115 3.027 1.00 0.00 O ATOM 500 CB LYS B 316 -8.959 -2.297 5.390 1.00 0.00 C ATOM 501 CG LYS B 316 -8.684 -2.970 6.737 1.00 0.00 C ATOM 502 CD LYS B 316 -9.542 -2.315 7.822 1.00 0.00 C ATOM 503 CE LYS B 316 -8.867 -2.493 9.183 1.00 0.00 C ATOM 504 NZ LYS B 316 -7.968 -1.334 9.448 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.340 -2.381 5.317 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.532 -3.884 4.029 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.750 -1.229 5.459 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -10.013 -2.399 5.132 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -8.908 -4.035 6.675 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.628 -2.881 6.991 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -9.674 -1.255 7.606 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -10.535 -2.764 7.835 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -9.620 -2.569 9.967 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -8.296 -3.421 9.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -7.764 -1.279 10.466 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -7.079 -1.457 8.923 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -8.433 -0.456 9.140 1.00 0.00 H new ATOM 518 N GLU B 317 -8.956 -2.230 2.177 1.00 0.00 N ATOM 519 CA GLU B 317 -8.999 -1.438 0.962 1.00 0.00 C ATOM 520 C GLU B 317 -10.399 -0.965 0.624 1.00 0.00 C ATOM 521 O GLU B 317 -11.396 -1.596 0.951 1.00 0.00 O ATOM 522 CB GLU B 317 -8.480 -2.270 -0.194 1.00 0.00 C ATOM 523 CG GLU B 317 -8.083 -1.353 -1.359 1.00 0.00 C ATOM 524 CD GLU B 317 -7.421 -2.163 -2.468 1.00 0.00 C ATOM 525 OE1 GLU B 317 -6.444 -2.837 -2.182 1.00 0.00 O ATOM 526 OE2 GLU B 317 -7.898 -2.094 -3.588 1.00 0.00 O1- ATOM 0 H GLU B 317 -9.668 -2.958 2.235 1.00 0.00 H new ATOM 0 HA GLU B 317 -8.379 -0.557 1.129 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.620 -2.858 0.127 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -9.245 -2.975 -0.519 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -8.965 -0.845 -1.748 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -7.400 -0.580 -1.006 1.00 0.00 H new ATOM 678 N VAL B 326 -12.436 -2.775 2.779 1.00 0.00 N ATOM 679 CA VAL B 326 -12.612 -4.205 2.800 1.00 0.00 C ATOM 680 C VAL B 326 -11.313 -4.883 3.216 1.00 0.00 C ATOM 681 O VAL B 326 -10.283 -4.642 2.587 1.00 0.00 O ATOM 682 CB VAL B 326 -12.985 -4.641 1.397 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.663 -6.118 1.210 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.474 -4.388 1.183 1.00 0.00 C ATOM 0 HA VAL B 326 -13.390 -4.482 3.512 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.412 -4.071 0.665 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -12.934 -6.424 0.200 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.596 -6.280 1.365 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.228 -6.708 1.932 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.755 -4.698 0.176 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -15.049 -4.959 1.912 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.684 -3.326 1.307 1.00 0.00 H new ATOM 694 N PRO B 327 -11.312 -5.728 4.229 1.00 0.00 N ATOM 695 CA PRO B 327 -10.067 -6.418 4.630 1.00 0.00 C ATOM 696 C PRO B 327 -9.385 -6.917 3.378 1.00 0.00 C ATOM 697 O PRO B 327 -10.056 -7.262 2.406 1.00 0.00 O ATOM 698 CB PRO B 327 -10.543 -7.565 5.519 1.00 0.00 C ATOM 699 CG PRO B 327 -11.851 -7.112 6.081 1.00 0.00 C ATOM 700 CD PRO B 327 -12.451 -6.115 5.082 1.00 0.00 C ATOM 0 HA PRO B 327 -9.350 -5.790 5.159 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.659 -8.485 4.946 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.825 -7.772 6.312 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.521 -7.959 6.229 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.710 -6.643 7.055 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.250 -6.570 4.497 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.880 -5.251 5.590 1.00 0.00 H new ATOM 708 N ARG B 328 -8.073 -6.917 3.362 1.00 0.00 N ATOM 709 CA ARG B 328 -7.382 -7.327 2.177 1.00 0.00 C ATOM 710 C ARG B 328 -6.065 -7.922 2.569 1.00 0.00 C ATOM 711 O ARG B 328 -5.812 -8.146 3.749 1.00 0.00 O ATOM 712 CB ARG B 328 -7.197 -6.129 1.230 1.00 0.00 C ATOM 713 CG ARG B 328 -6.761 -6.609 -0.156 1.00 0.00 C ATOM 714 CD ARG B 328 -7.507 -5.812 -1.227 1.00 0.00 C ATOM 715 NE ARG B 328 -8.946 -6.002 -1.085 1.00 0.00 N ATOM 716 CZ ARG B 328 -9.766 -5.852 -2.120 1.00 0.00 C ATOM 717 NH1 ARG B 328 -9.288 -5.525 -3.290 1.00 0.00 N ATOM 718 NH2 ARG B 328 -11.050 -6.030 -1.966 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.478 -6.642 4.143 1.00 0.00 H new ATOM 0 HA ARG B 328 -7.964 -8.079 1.644 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -8.130 -5.571 1.152 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.451 -5.447 1.637 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -5.685 -6.481 -0.275 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -6.970 -7.673 -0.267 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -7.262 -4.753 -1.139 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -7.187 -6.132 -2.218 1.00 0.00 H new ATOM 0 HE ARG B 328 -9.330 -6.255 -0.175 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -8.285 -5.385 -3.410 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -9.918 -5.410 -4.084 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -11.424 -6.284 -1.052 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.680 -5.915 -2.760 1.00 0.00 H new ATOM 732 N LEU B 329 -5.252 -8.227 1.593 1.00 0.00 N ATOM 733 CA LEU B 329 -4.004 -8.857 1.873 1.00 0.00 C ATOM 734 C LEU B 329 -2.959 -8.332 0.915 1.00 0.00 C ATOM 735 O LEU B 329 -3.123 -8.400 -0.286 1.00 0.00 O ATOM 736 CB LEU B 329 -4.266 -10.364 1.765 1.00 0.00 C ATOM 737 CG LEU B 329 -3.161 -11.228 2.396 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.146 -12.609 1.728 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.783 -10.597 2.236 1.00 0.00 C ATOM 0 H LEU B 329 -5.436 -8.048 0.606 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.612 -8.643 2.867 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.216 -10.595 2.247 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.369 -10.632 0.713 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.380 -11.313 3.460 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.363 -13.221 2.175 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.112 -13.093 1.872 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -2.953 -12.495 0.661 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.033 -11.240 2.696 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.558 -10.478 1.176 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.771 -9.621 2.722 1.00 0.00 H new ATOM 751 N LEU B 330 -1.899 -7.773 1.473 1.00 0.00 N ATOM 752 CA LEU B 330 -0.831 -7.203 0.688 1.00 0.00 C ATOM 753 C LEU B 330 0.319 -8.166 0.658 1.00 0.00 C ATOM 754 O LEU B 330 0.451 -8.989 1.555 1.00 0.00 O ATOM 755 CB LEU B 330 -0.415 -5.885 1.349 1.00 0.00 C ATOM 756 CG LEU B 330 0.910 -5.351 0.784 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.724 -4.930 -0.668 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.334 -4.150 1.620 1.00 0.00 C ATOM 0 H LEU B 330 -1.760 -7.704 2.481 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.150 -7.014 -0.337 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.198 -5.142 1.200 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.317 -6.034 2.424 1.00 0.00 H new ATOM 0 HG LEU B 330 1.674 -6.127 0.824 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.668 -4.553 -1.061 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.403 -5.789 -1.258 1.00 0.00 H new ATOM 0 HD13 LEU B 330 -0.032 -4.147 -0.726 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.274 -3.753 1.237 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.566 -3.379 1.565 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.466 -4.457 2.657 1.00 0.00 H new ATOM 770 N GLY B 331 1.174 -8.036 -0.344 1.00 0.00 N ATOM 771 CA GLY B 331 2.322 -8.881 -0.420 1.00 0.00 C ATOM 772 C GLY B 331 3.522 -8.097 -0.910 1.00 0.00 C ATOM 773 O GLY B 331 3.624 -7.758 -2.082 1.00 0.00 O ATOM 0 H GLY B 331 1.084 -7.358 -1.100 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.534 -9.307 0.561 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.124 -9.715 -1.094 1.00 0.00 H new ATOM 777 N ILE B 332 4.445 -7.838 -0.010 1.00 0.00 N ATOM 778 CA ILE B 332 5.658 -7.147 -0.379 1.00 0.00 C ATOM 779 C ILE B 332 6.671 -8.174 -0.817 1.00 0.00 C ATOM 780 O ILE B 332 6.997 -9.093 -0.074 1.00 0.00 O ATOM 781 CB ILE B 332 6.240 -6.372 0.796 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.170 -5.463 1.401 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.432 -5.534 0.314 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.532 -4.614 0.301 1.00 0.00 C ATOM 0 H ILE B 332 4.379 -8.094 0.975 1.00 0.00 H new ATOM 0 HA ILE B 332 5.426 -6.442 -1.177 1.00 0.00 H new ATOM 0 HB ILE B 332 6.578 -7.072 1.560 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.408 -6.063 1.898 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.614 -4.818 2.160 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.850 -4.979 1.154 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.195 -6.192 -0.101 1.00 0.00 H new ATOM 0 HG23 ILE B 332 7.099 -4.835 -0.453 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.770 -3.968 0.736 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.297 -4.002 -0.176 1.00 0.00 H new ATOM 0 HD13 ILE B 332 4.073 -5.266 -0.442 1.00 0.00 H new ATOM 796 N THR B 333 7.163 -7.999 -2.015 1.00 0.00 N ATOM 797 CA THR B 333 8.136 -8.887 -2.574 1.00 0.00 C ATOM 798 C THR B 333 9.391 -8.103 -2.847 1.00 0.00 C ATOM 799 O THR B 333 9.326 -6.979 -3.331 1.00 0.00 O ATOM 800 CB THR B 333 7.581 -9.466 -3.870 1.00 0.00 C ATOM 801 OG1 THR B 333 7.827 -8.567 -4.935 1.00 0.00 O ATOM 802 CG2 THR B 333 6.073 -9.681 -3.717 1.00 0.00 C ATOM 0 H THR B 333 6.896 -7.231 -2.630 1.00 0.00 H new ATOM 0 HA THR B 333 8.361 -9.703 -1.887 1.00 0.00 H new ATOM 0 HB THR B 333 8.067 -10.417 -4.085 1.00 0.00 H new ATOM 0 HG1 THR B 333 7.097 -8.624 -5.587 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.669 -10.095 -4.641 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.886 -10.373 -2.896 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.589 -8.728 -3.505 1.00 0.00 H new ATOM 810 N LYS B 334 10.527 -8.688 -2.542 1.00 0.00 N ATOM 811 CA LYS B 334 11.803 -8.010 -2.767 1.00 0.00 C ATOM 812 C LYS B 334 11.969 -7.610 -4.232 1.00 0.00 C ATOM 813 O LYS B 334 13.060 -7.286 -4.673 1.00 0.00 O ATOM 814 CB LYS B 334 12.957 -8.921 -2.350 1.00 0.00 C ATOM 815 CG LYS B 334 13.815 -8.226 -1.289 1.00 0.00 C ATOM 816 CD LYS B 334 14.884 -9.200 -0.791 1.00 0.00 C ATOM 817 CE LYS B 334 14.540 -9.656 0.628 1.00 0.00 C ATOM 818 NZ LYS B 334 15.490 -10.725 1.050 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.604 -9.623 -2.141 1.00 0.00 H new ATOM 0 HA LYS B 334 11.813 -7.103 -2.162 1.00 0.00 H new ATOM 0 HB2 LYS B 334 12.567 -9.859 -1.956 1.00 0.00 H new ATOM 0 HB3 LYS B 334 13.568 -9.169 -3.218 1.00 0.00 H new ATOM 0 HG2 LYS B 334 14.284 -7.336 -1.709 1.00 0.00 H new ATOM 0 HG3 LYS B 334 13.191 -7.896 -0.458 1.00 0.00 H new ATOM 0 HD2 LYS B 334 14.944 -10.061 -1.456 1.00 0.00 H new ATOM 0 HD3 LYS B 334 15.862 -8.719 -0.803 1.00 0.00 H new ATOM 0 HE2 LYS B 334 14.596 -8.813 1.316 1.00 0.00 H new ATOM 0 HE3 LYS B 334 13.517 -10.029 0.664 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 15.257 -11.036 2.015 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 15.416 -11.532 0.399 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 16.461 -10.354 1.031 1.00 0.00 H new ATOM 832 N GLU B 335 10.879 -7.648 -4.974 1.00 0.00 N ATOM 833 CA GLU B 335 10.879 -7.266 -6.376 1.00 0.00 C ATOM 834 C GLU B 335 9.563 -6.597 -6.745 1.00 0.00 C ATOM 835 O GLU B 335 9.368 -6.199 -7.895 1.00 0.00 O ATOM 836 CB GLU B 335 11.090 -8.498 -7.254 1.00 0.00 C ATOM 837 CG GLU B 335 10.090 -9.587 -6.858 1.00 0.00 C ATOM 838 CD GLU B 335 10.279 -10.815 -7.743 1.00 0.00 C ATOM 839 OE1 GLU B 335 10.680 -10.645 -8.882 1.00 0.00 O1- ATOM 840 OE2 GLU B 335 10.019 -11.908 -7.268 1.00 0.00 O ATOM 0 H GLU B 335 9.968 -7.944 -4.624 1.00 0.00 H new ATOM 0 HA GLU B 335 11.693 -6.560 -6.541 1.00 0.00 H new ATOM 0 HB2 GLU B 335 10.961 -8.235 -8.304 1.00 0.00 H new ATOM 0 HB3 GLU B 335 12.109 -8.867 -7.141 1.00 0.00 H new ATOM 0 HG2 GLU B 335 10.230 -9.858 -5.811 1.00 0.00 H new ATOM 0 HG3 GLU B 335 9.072 -9.211 -6.957 1.00 0.00 H new ATOM 847 N CYS B 336 8.628 -6.519 -5.795 1.00 0.00 N ATOM 848 CA CYS B 336 7.328 -5.955 -6.105 1.00 0.00 C ATOM 849 C CYS B 336 6.444 -5.806 -4.893 1.00 0.00 C ATOM 850 O CYS B 336 6.809 -6.140 -3.769 1.00 0.00 O ATOM 851 CB CYS B 336 6.611 -6.826 -7.140 1.00 0.00 C ATOM 852 SG CYS B 336 5.289 -7.770 -6.340 1.00 0.00 S ATOM 0 H CYS B 336 8.748 -6.832 -4.832 1.00 0.00 H new ATOM 0 HA CYS B 336 7.512 -4.957 -6.502 1.00 0.00 H new ATOM 0 HB2 CYS B 336 6.196 -6.200 -7.930 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.321 -7.505 -7.611 1.00 0.00 H new ATOM 0 HG CYS B 336 4.684 -8.505 -7.225 1.00 0.00 H new ATOM 858 N VAL B 337 5.266 -5.288 -5.169 1.00 0.00 N ATOM 859 CA VAL B 337 4.263 -5.055 -4.159 1.00 0.00 C ATOM 860 C VAL B 337 2.957 -5.494 -4.746 1.00 0.00 C ATOM 861 O VAL B 337 2.799 -5.398 -5.956 1.00 0.00 O ATOM 862 CB VAL B 337 4.241 -3.571 -3.855 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.413 -3.294 -2.603 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.680 -3.134 -3.638 1.00 0.00 C ATOM 0 H VAL B 337 4.978 -5.016 -6.109 1.00 0.00 H new ATOM 0 HA VAL B 337 4.461 -5.599 -3.235 1.00 0.00 H new ATOM 0 HB VAL B 337 3.788 -3.019 -4.679 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.408 -2.223 -2.400 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.391 -3.638 -2.759 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.848 -3.822 -1.755 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.707 -2.067 -3.416 1.00 0.00 H new ATOM 0 HG22 VAL B 337 6.107 -3.689 -2.803 1.00 0.00 H new ATOM 0 HG23 VAL B 337 6.260 -3.331 -4.539 1.00 0.00 H new ATOM 874 N MET B 338 2.039 -6.026 -3.954 1.00 0.00 N ATOM 875 CA MET B 338 0.820 -6.503 -4.583 1.00 0.00 C ATOM 876 C MET B 338 -0.386 -6.531 -3.664 1.00 0.00 C ATOM 877 O MET B 338 -0.273 -6.791 -2.470 1.00 0.00 O ATOM 878 CB MET B 338 1.044 -7.912 -5.117 1.00 0.00 C ATOM 879 CG MET B 338 1.999 -8.689 -4.208 1.00 0.00 C ATOM 880 SD MET B 338 2.303 -10.331 -4.907 1.00 0.00 S ATOM 881 CE MET B 338 3.098 -11.059 -3.454 1.00 0.00 C ATOM 0 H MET B 338 2.103 -6.134 -2.942 1.00 0.00 H new ATOM 0 HA MET B 338 0.599 -5.792 -5.379 1.00 0.00 H new ATOM 0 HB2 MET B 338 0.091 -8.436 -5.185 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.453 -7.863 -6.126 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.939 -8.147 -4.104 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.572 -8.781 -3.209 1.00 0.00 H new ATOM 0 HE1 MET B 338 3.913 -11.709 -3.773 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.494 -10.266 -2.820 1.00 0.00 H new ATOM 0 HE3 MET B 338 2.367 -11.641 -2.893 1.00 0.00 H new ATOM 891 N ARG B 339 -1.554 -6.337 -4.268 1.00 0.00 N ATOM 892 CA ARG B 339 -2.805 -6.411 -3.535 1.00 0.00 C ATOM 893 C ARG B 339 -3.364 -7.812 -3.672 1.00 0.00 C ATOM 894 O ARG B 339 -3.817 -8.214 -4.747 1.00 0.00 O ATOM 895 CB ARG B 339 -3.813 -5.407 -4.081 1.00 0.00 C ATOM 896 CG ARG B 339 -3.186 -4.015 -4.108 1.00 0.00 C ATOM 897 CD ARG B 339 -4.130 -3.044 -4.819 1.00 0.00 C ATOM 898 NE ARG B 339 -5.512 -3.496 -4.685 1.00 0.00 N ATOM 899 CZ ARG B 339 -6.432 -3.189 -5.597 1.00 0.00 C ATOM 900 NH1 ARG B 339 -6.113 -2.463 -6.633 1.00 0.00 N ATOM 901 NH2 ARG B 339 -7.657 -3.617 -5.453 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.656 -6.128 -5.261 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.619 -6.175 -2.487 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.123 -5.697 -5.085 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.709 -5.401 -3.460 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -2.992 -3.672 -3.092 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -2.225 -4.047 -4.622 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.023 -2.046 -4.395 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -3.864 -2.973 -5.874 1.00 0.00 H new ATOM 0 HE ARG B 339 -5.778 -4.058 -3.876 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -5.156 -2.129 -6.746 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -6.821 -2.230 -7.330 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -7.907 -4.185 -4.643 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -8.364 -3.383 -6.150 1.00 0.00 H new ATOM 915 N VAL B 340 -3.290 -8.553 -2.584 1.00 0.00 N ATOM 916 CA VAL B 340 -3.753 -9.922 -2.557 1.00 0.00 C ATOM 917 C VAL B 340 -5.140 -10.020 -1.953 1.00 0.00 C ATOM 918 O VAL B 340 -5.527 -9.208 -1.120 1.00 0.00 O ATOM 919 CB VAL B 340 -2.760 -10.783 -1.795 1.00 0.00 C ATOM 920 CG1 VAL B 340 -2.979 -12.235 -2.159 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.350 -10.377 -2.182 1.00 0.00 C ATOM 0 H VAL B 340 -2.908 -8.222 -1.698 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.822 -10.289 -3.581 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.901 -10.648 -0.723 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.269 -12.858 -1.615 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -3.995 -12.527 -1.894 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.831 -12.368 -3.231 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.632 -10.991 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.211 -10.520 -3.254 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.192 -9.328 -1.932 1.00 0.00 H new ATOM 931 N ASP B 341 -5.893 -11.013 -2.411 1.00 0.00 N ATOM 932 CA ASP B 341 -7.255 -11.203 -1.945 1.00 0.00 C ATOM 933 C ASP B 341 -7.284 -12.101 -0.724 1.00 0.00 C ATOM 934 O ASP B 341 -7.362 -13.312 -0.842 1.00 0.00 O ATOM 935 CB ASP B 341 -8.107 -11.818 -3.056 1.00 0.00 C ATOM 936 CG ASP B 341 -9.586 -11.601 -2.758 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.891 -11.164 -1.661 1.00 0.00 O ATOM 938 OD2 ASP B 341 -10.393 -11.874 -3.633 1.00 0.00 O1- ATOM 0 H ASP B 341 -5.582 -11.695 -3.102 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.663 -10.230 -1.672 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.851 -11.367 -4.015 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.897 -12.884 -3.139 1.00 0.00 H new ATOM 943 N GLU B 342 -7.229 -11.483 0.441 1.00 0.00 N ATOM 944 CA GLU B 342 -7.254 -12.207 1.709 1.00 0.00 C ATOM 945 C GLU B 342 -8.156 -13.426 1.615 1.00 0.00 C ATOM 946 O GLU B 342 -7.950 -14.429 2.298 1.00 0.00 O ATOM 947 CB GLU B 342 -7.794 -11.259 2.789 1.00 0.00 C ATOM 948 CG GLU B 342 -7.134 -11.521 4.142 1.00 0.00 C ATOM 949 CD GLU B 342 -8.171 -11.406 5.253 1.00 0.00 C ATOM 950 OE1 GLU B 342 -8.613 -10.299 5.512 1.00 0.00 O ATOM 951 OE2 GLU B 342 -8.507 -12.427 5.830 1.00 0.00 O1- ATOM 0 H GLU B 342 -7.166 -10.470 0.541 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.247 -12.544 1.955 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.617 -10.226 2.490 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.873 -11.384 2.879 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.686 -12.514 4.152 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.328 -10.806 4.309 1.00 0.00 H new ATOM 958 N LYS B 343 -9.148 -13.319 0.759 1.00 0.00 N ATOM 959 CA LYS B 343 -10.098 -14.396 0.547 1.00 0.00 C ATOM 960 C LYS B 343 -9.495 -15.526 -0.280 1.00 0.00 C ATOM 961 O LYS B 343 -9.708 -16.702 0.017 1.00 0.00 O ATOM 962 CB LYS B 343 -11.313 -13.849 -0.190 1.00 0.00 C ATOM 963 CG LYS B 343 -11.989 -12.778 0.662 1.00 0.00 C ATOM 964 CD LYS B 343 -12.938 -11.959 -0.213 1.00 0.00 C ATOM 965 CE LYS B 343 -14.042 -11.353 0.655 1.00 0.00 C ATOM 966 NZ LYS B 343 -14.812 -12.444 1.315 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.321 -12.489 0.192 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.377 -14.795 1.522 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -11.010 -13.428 -1.149 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -12.015 -14.655 -0.403 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.540 -13.242 1.480 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.239 -12.128 1.112 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.387 -11.169 -0.723 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.375 -12.592 -0.985 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -13.607 -10.694 1.407 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -14.707 -10.743 0.043 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -15.831 -12.273 1.194 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -14.561 -13.356 0.884 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -14.583 -12.466 2.329 1.00 0.00 H new ATOM 980 N THR B 344 -8.778 -15.163 -1.340 1.00 0.00 N ATOM 981 CA THR B 344 -8.194 -16.153 -2.233 1.00 0.00 C ATOM 982 C THR B 344 -6.671 -16.222 -2.107 1.00 0.00 C ATOM 983 O THR B 344 -6.051 -17.149 -2.626 1.00 0.00 O ATOM 984 CB THR B 344 -8.571 -15.810 -3.672 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.597 -14.935 -4.221 1.00 0.00 O ATOM 986 CG2 THR B 344 -9.942 -15.132 -3.694 1.00 0.00 C ATOM 0 H THR B 344 -8.589 -14.195 -1.599 1.00 0.00 H new ATOM 0 HA THR B 344 -8.589 -17.130 -1.953 1.00 0.00 H new ATOM 0 HB THR B 344 -8.611 -16.724 -4.265 1.00 0.00 H new ATOM 0 HG1 THR B 344 -8.018 -14.355 -4.889 1.00 0.00 H new ATOM 0 HG21 THR B 344 -10.210 -14.887 -4.722 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.688 -15.807 -3.275 1.00 0.00 H new ATOM 0 HG23 THR B 344 -9.905 -14.218 -3.101 1.00 0.00 H new ATOM 994 N LYS B 345 -6.069 -15.245 -1.431 1.00 0.00 N ATOM 995 CA LYS B 345 -4.626 -15.228 -1.266 1.00 0.00 C ATOM 996 C LYS B 345 -3.952 -15.011 -2.612 1.00 0.00 C ATOM 997 O LYS B 345 -2.728 -14.920 -2.701 1.00 0.00 O ATOM 998 CB LYS B 345 -4.162 -16.545 -0.656 1.00 0.00 C ATOM 999 CG LYS B 345 -2.810 -16.353 0.034 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.373 -17.673 0.674 1.00 0.00 C ATOM 1001 CE LYS B 345 -2.773 -17.684 2.151 1.00 0.00 C ATOM 1002 NZ LYS B 345 -2.084 -16.569 2.861 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.557 -14.463 -0.994 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.352 -14.411 -0.599 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -4.899 -16.902 0.063 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -4.079 -17.306 -1.432 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -2.064 -16.022 -0.689 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -2.884 -15.575 0.794 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -2.837 -18.512 0.155 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.294 -17.796 0.578 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -3.854 -17.578 2.247 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -2.505 -18.638 2.604 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -1.830 -16.874 3.822 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -1.222 -16.307 2.342 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -2.719 -15.747 2.915 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.768 -14.904 -3.656 1.00 0.00 N ATOM 1017 CA GLU B 346 -4.251 -14.669 -4.991 1.00 0.00 C ATOM 1018 C GLU B 346 -4.034 -13.184 -5.191 1.00 0.00 C ATOM 1019 O GLU B 346 -4.674 -12.357 -4.540 1.00 0.00 O ATOM 1020 CB GLU B 346 -5.222 -15.190 -6.044 1.00 0.00 C ATOM 1021 CG GLU B 346 -5.551 -16.652 -5.749 1.00 0.00 C ATOM 1022 CD GLU B 346 -5.459 -17.476 -7.028 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -6.465 -17.591 -7.709 1.00 0.00 O1- ATOM 1024 OE2 GLU B 346 -4.385 -17.981 -7.309 1.00 0.00 O ATOM 0 H GLU B 346 -5.784 -14.976 -3.600 1.00 0.00 H new ATOM 0 HA GLU B 346 -3.305 -15.200 -5.099 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -6.134 -14.593 -6.042 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -4.783 -15.098 -7.037 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -4.860 -17.045 -5.003 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -6.553 -16.730 -5.328 1.00 0.00 H new ATOM 1031 N VAL B 347 -3.111 -12.850 -6.064 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.790 -11.453 -6.308 1.00 0.00 C ATOM 1033 C VAL B 347 -3.738 -10.811 -7.294 1.00 0.00 C ATOM 1034 O VAL B 347 -4.043 -11.368 -8.350 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.359 -11.305 -6.797 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.108 -9.841 -7.166 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.424 -11.702 -5.661 1.00 0.00 C ATOM 0 H VAL B 347 -2.571 -13.517 -6.615 1.00 0.00 H new ATOM 0 HA VAL B 347 -2.901 -10.935 -5.355 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.186 -11.936 -7.668 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.083 -9.725 -7.518 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.799 -9.541 -7.954 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.263 -9.213 -6.289 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.611 -11.603 -5.990 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.596 -11.051 -4.804 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.617 -12.736 -5.376 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.173 -9.611 -6.946 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.056 -8.855 -7.802 1.00 0.00 C ATOM 1049 C ILE B 348 -4.248 -7.773 -8.486 1.00 0.00 C ATOM 1050 O ILE B 348 -4.558 -7.358 -9.604 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.184 -8.222 -6.982 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -6.929 -9.317 -6.213 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.155 -7.506 -7.921 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.862 -8.676 -5.183 1.00 0.00 C ATOM 0 H ILE B 348 -3.925 -9.144 -6.074 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.504 -9.517 -8.543 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.765 -7.504 -6.277 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -7.503 -9.935 -6.904 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -6.217 -9.974 -5.714 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -7.958 -7.055 -7.339 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.624 -6.728 -8.470 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.576 -8.224 -8.625 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -8.392 -9.456 -4.636 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.277 -8.077 -4.485 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -8.583 -8.037 -5.693 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.205 -7.310 -7.797 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.366 -6.266 -8.343 1.00 0.00 C ATOM 1068 C GLN B 349 -0.908 -6.505 -8.036 1.00 0.00 C ATOM 1069 O GLN B 349 -0.562 -7.168 -7.059 1.00 0.00 O ATOM 1070 CB GLN B 349 -2.761 -4.960 -7.716 1.00 0.00 C ATOM 1071 CG GLN B 349 -1.921 -3.828 -8.294 1.00 0.00 C ATOM 1072 CD GLN B 349 -2.657 -2.503 -8.128 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -3.584 -2.208 -8.884 1.00 0.00 O ATOM 1074 NE2 GLN B 349 -2.304 -1.685 -7.174 1.00 0.00 N ATOM 0 H GLN B 349 -2.931 -7.642 -6.872 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.499 -6.255 -9.425 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -3.819 -4.767 -7.895 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.624 -5.010 -6.636 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -0.956 -3.784 -7.789 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -1.721 -4.014 -9.349 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -1.536 -1.931 -6.549 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -2.796 -0.800 -7.053 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.061 -5.921 -8.862 1.00 0.00 N ATOM 1084 CA GLU B 350 1.376 -6.026 -8.678 1.00 0.00 C ATOM 1085 C GLU B 350 2.084 -4.757 -9.101 1.00 0.00 C ATOM 1086 O GLU B 350 1.660 -4.067 -10.029 1.00 0.00 O ATOM 1087 CB GLU B 350 1.981 -7.153 -9.507 1.00 0.00 C ATOM 1088 CG GLU B 350 1.404 -8.496 -9.089 1.00 0.00 C ATOM 1089 CD GLU B 350 1.824 -9.591 -10.062 1.00 0.00 C ATOM 1090 OE1 GLU B 350 2.583 -9.294 -10.970 1.00 0.00 O ATOM 1091 OE2 GLU B 350 1.375 -10.711 -9.885 1.00 0.00 O1- ATOM 0 H GLU B 350 -0.344 -5.367 -9.670 1.00 0.00 H new ATOM 0 HA GLU B 350 1.516 -6.218 -7.614 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.783 -6.980 -10.565 1.00 0.00 H new ATOM 0 HB3 GLU B 350 3.064 -7.162 -9.383 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.744 -8.746 -8.084 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.316 -8.434 -9.051 1.00 0.00 H new ATOM 1098 N TRP B 351 3.197 -4.494 -8.447 1.00 0.00 N ATOM 1099 CA TRP B 351 4.014 -3.337 -8.789 1.00 0.00 C ATOM 1100 C TRP B 351 5.408 -3.476 -8.212 1.00 0.00 C ATOM 1101 O TRP B 351 5.572 -3.857 -7.065 1.00 0.00 O ATOM 1102 CB TRP B 351 3.376 -2.057 -8.298 1.00 0.00 C ATOM 1103 CG TRP B 351 4.133 -0.918 -8.873 1.00 0.00 C ATOM 1104 CD1 TRP B 351 5.078 -0.223 -8.224 1.00 0.00 C ATOM 1105 CD2 TRP B 351 4.057 -0.359 -10.213 1.00 0.00 C ATOM 1106 NE1 TRP B 351 5.571 0.748 -9.066 1.00 0.00 N ATOM 1107 CE2 TRP B 351 4.976 0.709 -10.304 1.00 0.00 C ATOM 1108 CE3 TRP B 351 3.282 -0.665 -11.337 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 5.125 1.457 -11.471 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 3.426 0.085 -12.524 1.00 0.00 C ATOM 1111 CH2 TRP B 351 4.345 1.148 -12.585 1.00 0.00 C ATOM 0 H TRP B 351 3.559 -5.059 -7.679 1.00 0.00 H new ATOM 0 HA TRP B 351 4.086 -3.292 -9.876 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.330 -2.012 -8.602 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.394 -2.016 -7.209 1.00 0.00 H new ATOM 0 HD1 TRP B 351 5.400 -0.396 -7.208 1.00 0.00 H new ATOM 0 HE1 TRP B 351 6.293 1.418 -8.802 1.00 0.00 H new ATOM 0 HE3 TRP B 351 2.572 -1.477 -11.296 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 5.837 2.268 -11.512 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 2.828 -0.159 -13.390 1.00 0.00 H new ATOM 0 HH2 TRP B 351 4.446 1.724 -13.493 1.00 0.00 H new ATOM 1122 N SER B 352 6.405 -3.173 -9.033 1.00 0.00 N ATOM 1123 CA SER B 352 7.788 -3.287 -8.622 1.00 0.00 C ATOM 1124 C SER B 352 8.046 -2.534 -7.337 1.00 0.00 C ATOM 1125 O SER B 352 7.578 -1.414 -7.144 1.00 0.00 O ATOM 1126 CB SER B 352 8.721 -2.751 -9.702 1.00 0.00 C ATOM 1127 OG SER B 352 7.957 -2.154 -10.740 1.00 0.00 O ATOM 0 H SER B 352 6.275 -2.846 -9.990 1.00 0.00 H new ATOM 0 HA SER B 352 7.985 -4.347 -8.460 1.00 0.00 H new ATOM 0 HB2 SER B 352 9.406 -2.019 -9.274 1.00 0.00 H new ATOM 0 HB3 SER B 352 9.330 -3.560 -10.105 1.00 0.00 H new ATOM 0 HG SER B 352 7.621 -2.851 -11.341 1.00 0.00 H new ATOM 1133 N LEU B 353 8.836 -3.148 -6.482 1.00 0.00 N ATOM 1134 CA LEU B 353 9.215 -2.537 -5.245 1.00 0.00 C ATOM 1135 C LEU B 353 10.312 -1.548 -5.584 1.00 0.00 C ATOM 1136 O LEU B 353 10.380 -0.445 -5.040 1.00 0.00 O ATOM 1137 CB LEU B 353 9.708 -3.640 -4.305 1.00 0.00 C ATOM 1138 CG LEU B 353 9.379 -3.328 -2.846 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.552 -4.579 -2.018 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.341 -2.289 -2.316 1.00 0.00 C ATOM 0 H LEU B 353 9.227 -4.078 -6.632 1.00 0.00 H new ATOM 0 HA LEU B 353 8.396 -2.018 -4.748 1.00 0.00 H new ATOM 0 HB2 LEU B 353 9.251 -4.589 -4.586 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.786 -3.759 -4.418 1.00 0.00 H new ATOM 0 HG LEU B 353 8.354 -2.962 -2.786 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.318 -4.361 -0.976 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.880 -5.355 -2.386 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.583 -4.926 -2.094 1.00 0.00 H new ATOM 0 HD21 LEU B 353 10.103 -2.070 -1.275 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.360 -2.669 -2.382 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.255 -1.378 -2.908 1.00 0.00 H new ATOM 1152 N THR B 354 11.139 -1.942 -6.551 1.00 0.00 N ATOM 1153 CA THR B 354 12.203 -1.081 -7.023 1.00 0.00 C ATOM 1154 C THR B 354 11.623 0.047 -7.859 1.00 0.00 C ATOM 1155 O THR B 354 12.356 0.801 -8.497 1.00 0.00 O ATOM 1156 CB THR B 354 13.183 -1.881 -7.877 1.00 0.00 C ATOM 1157 OG1 THR B 354 13.567 -3.055 -7.188 1.00 0.00 O ATOM 1158 CG2 THR B 354 14.411 -1.031 -8.177 1.00 0.00 C ATOM 0 H THR B 354 11.087 -2.848 -7.016 1.00 0.00 H new ATOM 0 HA THR B 354 12.725 -0.667 -6.161 1.00 0.00 H new ATOM 0 HB THR B 354 12.702 -2.159 -8.815 1.00 0.00 H new ATOM 0 HG1 THR B 354 13.920 -3.709 -7.827 1.00 0.00 H new ATOM 0 HG21 THR B 354 15.110 -1.604 -8.787 1.00 0.00 H new ATOM 0 HG22 THR B 354 14.109 -0.134 -8.717 1.00 0.00 H new ATOM 0 HG23 THR B 354 14.894 -0.747 -7.242 1.00 0.00 H new ATOM 1166 N ASN B 355 10.302 0.156 -7.849 1.00 0.00 N ATOM 1167 CA ASN B 355 9.636 1.210 -8.610 1.00 0.00 C ATOM 1168 C ASN B 355 8.968 2.189 -7.670 1.00 0.00 C ATOM 1169 O ASN B 355 8.376 3.176 -8.104 1.00 0.00 O ATOM 1170 CB ASN B 355 8.587 0.623 -9.550 1.00 0.00 C ATOM 1171 CG ASN B 355 9.264 0.096 -10.812 1.00 0.00 C ATOM 1172 OD1 ASN B 355 10.468 -0.158 -10.809 1.00 0.00 O ATOM 1173 ND2 ASN B 355 8.558 -0.085 -11.894 1.00 0.00 N ATOM 0 H ASN B 355 9.676 -0.461 -7.332 1.00 0.00 H new ATOM 0 HA ASN B 355 10.392 1.726 -9.202 1.00 0.00 H new ATOM 0 HB2 ASN B 355 8.048 -0.183 -9.051 1.00 0.00 H new ATOM 0 HB3 ASN B 355 7.852 1.384 -9.811 1.00 0.00 H new ATOM 0 HD21 ASN B 355 9.004 -0.438 -12.741 1.00 0.00 H new ATOM 0 HD22 ASN B 355 7.560 0.126 -11.893 1.00 0.00 H new ATOM 1180 N ILE B 356 9.059 1.915 -6.378 1.00 0.00 N ATOM 1181 CA ILE B 356 8.444 2.789 -5.403 1.00 0.00 C ATOM 1182 C ILE B 356 9.038 4.196 -5.470 1.00 0.00 C ATOM 1183 O ILE B 356 10.228 4.363 -5.738 1.00 0.00 O ATOM 1184 CB ILE B 356 8.637 2.185 -4.030 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.741 0.950 -3.920 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.248 3.213 -2.982 1.00 0.00 C ATOM 1187 CD1 ILE B 356 7.995 0.227 -2.597 1.00 0.00 C ATOM 0 H ILE B 356 9.545 1.107 -5.989 1.00 0.00 H new ATOM 0 HA ILE B 356 7.380 2.883 -5.618 1.00 0.00 H new ATOM 0 HB ILE B 356 9.676 1.897 -3.874 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.694 1.245 -3.986 1.00 0.00 H new ATOM 0 HG13 ILE B 356 7.935 0.276 -4.754 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.383 2.788 -1.987 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.878 4.097 -3.088 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.203 3.493 -3.118 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.351 -0.650 -2.532 1.00 0.00 H new ATOM 0 HD12 ILE B 356 9.038 -0.085 -2.547 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.777 0.899 -1.767 1.00 0.00 H new ATOM 1199 N LYS B 357 8.200 5.211 -5.219 1.00 0.00 N ATOM 1200 CA LYS B 357 8.664 6.598 -5.254 1.00 0.00 C ATOM 1201 C LYS B 357 8.812 7.112 -3.831 1.00 0.00 C ATOM 1202 O LYS B 357 9.828 7.701 -3.462 1.00 0.00 O ATOM 1203 CB LYS B 357 7.676 7.464 -6.053 1.00 0.00 C ATOM 1204 CG LYS B 357 8.432 8.617 -6.714 1.00 0.00 C ATOM 1205 CD LYS B 357 7.448 9.506 -7.478 1.00 0.00 C ATOM 1206 CE LYS B 357 7.915 9.656 -8.927 1.00 0.00 C ATOM 1207 NZ LYS B 357 7.069 10.670 -9.620 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.212 5.098 -4.993 1.00 0.00 H new ATOM 0 HA LYS B 357 9.634 6.651 -5.749 1.00 0.00 H new ATOM 0 HB2 LYS B 357 7.176 6.860 -6.811 1.00 0.00 H new ATOM 0 HB3 LYS B 357 6.901 7.854 -5.393 1.00 0.00 H new ATOM 0 HG2 LYS B 357 8.955 9.203 -5.958 1.00 0.00 H new ATOM 0 HG3 LYS B 357 9.188 8.226 -7.395 1.00 0.00 H new ATOM 0 HD2 LYS B 357 6.450 9.069 -7.450 1.00 0.00 H new ATOM 0 HD3 LYS B 357 7.381 10.485 -7.003 1.00 0.00 H new ATOM 0 HE2 LYS B 357 8.961 9.961 -8.953 1.00 0.00 H new ATOM 0 HE3 LYS B 357 7.849 8.698 -9.443 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 6.451 10.195 -10.308 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 6.486 11.172 -8.920 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 7.679 11.351 -10.115 1.00 0.00 H new ATOM 1221 N ARG B 358 7.801 6.831 -3.030 1.00 0.00 N ATOM 1222 CA ARG B 358 7.803 7.196 -1.627 1.00 0.00 C ATOM 1223 C ARG B 358 6.553 6.613 -0.982 1.00 0.00 C ATOM 1224 O ARG B 358 5.476 6.647 -1.553 1.00 0.00 O ATOM 1225 CB ARG B 358 7.848 8.714 -1.453 1.00 0.00 C ATOM 1226 CG ARG B 358 6.854 9.378 -2.392 1.00 0.00 C ATOM 1227 CD ARG B 358 7.100 10.880 -2.425 1.00 0.00 C ATOM 1228 NE ARG B 358 5.831 11.590 -2.541 1.00 0.00 N ATOM 1229 CZ ARG B 358 5.763 12.797 -3.096 1.00 0.00 C ATOM 1230 NH1 ARG B 358 6.845 13.374 -3.542 1.00 0.00 N ATOM 1231 NH2 ARG B 358 4.612 13.403 -3.195 1.00 0.00 N1+ ATOM 0 H ARG B 358 6.957 6.344 -3.333 1.00 0.00 H new ATOM 0 HA ARG B 358 8.693 6.794 -1.144 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.616 8.976 -0.421 1.00 0.00 H new ATOM 0 HB3 ARG B 358 8.854 9.081 -1.657 1.00 0.00 H new ATOM 0 HG2 ARG B 358 6.953 8.962 -3.395 1.00 0.00 H new ATOM 0 HG3 ARG B 358 5.836 9.174 -2.061 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.619 11.192 -1.519 1.00 0.00 H new ATOM 0 HD3 ARG B 358 7.746 11.133 -3.266 1.00 0.00 H new ATOM 0 HE ARG B 358 4.979 11.152 -2.190 1.00 0.00 H new ATOM 0 HH11 ARG B 358 7.745 12.899 -3.465 1.00 0.00 H new ATOM 0 HH12 ARG B 358 6.791 14.300 -3.967 1.00 0.00 H new ATOM 0 HH21 ARG B 358 3.766 12.951 -2.847 1.00 0.00 H new ATOM 0 HH22 ARG B 358 4.558 14.329 -3.620 1.00 0.00 H new ATOM 1245 N TRP B 359 6.715 6.042 0.185 1.00 0.00 N ATOM 1246 CA TRP B 359 5.609 5.413 0.876 1.00 0.00 C ATOM 1247 C TRP B 359 5.367 6.095 2.207 1.00 0.00 C ATOM 1248 O TRP B 359 6.110 7.001 2.582 1.00 0.00 O ATOM 1249 CB TRP B 359 5.932 3.932 1.046 1.00 0.00 C ATOM 1250 CG TRP B 359 7.234 3.763 1.749 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.372 3.341 3.017 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.573 3.999 1.248 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.720 3.289 3.329 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.501 3.702 2.271 1.00 0.00 C ATOM 1255 CE3 TRP B 359 9.061 4.439 0.016 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.876 3.848 2.073 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.440 4.587 -0.190 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.347 4.295 0.840 1.00 0.00 C ATOM 0 H TRP B 359 7.605 5.998 0.681 1.00 0.00 H new ATOM 0 HA TRP B 359 4.690 5.510 0.298 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.139 3.443 1.612 1.00 0.00 H new ATOM 0 HB3 TRP B 359 5.972 3.448 0.070 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.563 3.084 3.685 1.00 0.00 H new ATOM 0 HE1 TRP B 359 9.089 2.983 4.229 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.372 4.667 -0.784 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.568 3.616 2.869 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.806 4.928 -1.147 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.408 4.416 0.678 1.00 0.00 H new ATOM 1269 N ALA B 360 4.314 5.701 2.913 1.00 0.00 N ATOM 1270 CA ALA B 360 4.019 6.357 4.175 1.00 0.00 C ATOM 1271 C ALA B 360 3.177 5.490 5.084 1.00 0.00 C ATOM 1272 O ALA B 360 1.956 5.412 4.951 1.00 0.00 O ATOM 1273 CB ALA B 360 3.294 7.670 3.917 1.00 0.00 C ATOM 0 H ALA B 360 3.671 4.956 2.644 1.00 0.00 H new ATOM 0 HA ALA B 360 4.969 6.543 4.676 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.075 8.158 4.867 1.00 0.00 H new ATOM 0 HB2 ALA B 360 3.925 8.321 3.312 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.362 7.473 3.387 1.00 0.00 H new ATOM 1279 N ALA B 361 3.852 4.857 6.015 1.00 0.00 N ATOM 1280 CA ALA B 361 3.202 4.003 6.979 1.00 0.00 C ATOM 1281 C ALA B 361 2.595 4.825 8.110 1.00 0.00 C ATOM 1282 O ALA B 361 3.137 5.862 8.491 1.00 0.00 O ATOM 1283 CB ALA B 361 4.197 3.014 7.552 1.00 0.00 C ATOM 0 H ALA B 361 4.864 4.920 6.125 1.00 0.00 H new ATOM 0 HA ALA B 361 2.403 3.464 6.470 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.697 2.374 8.279 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.605 2.401 6.748 1.00 0.00 H new ATOM 0 HB3 ALA B 361 5.007 3.555 8.042 1.00 0.00 H new ATOM 1289 N SER B 362 1.475 4.355 8.649 1.00 0.00 N ATOM 1290 CA SER B 362 0.813 5.056 9.739 1.00 0.00 C ATOM 1291 C SER B 362 0.396 4.053 10.817 1.00 0.00 C ATOM 1292 O SER B 362 0.547 2.846 10.631 1.00 0.00 O ATOM 1293 CB SER B 362 -0.404 5.806 9.191 1.00 0.00 C ATOM 1294 OG SER B 362 -1.592 5.193 9.671 1.00 0.00 O ATOM 0 H SER B 362 1.011 3.497 8.350 1.00 0.00 H new ATOM 0 HA SER B 362 1.496 5.777 10.188 1.00 0.00 H new ATOM 0 HB2 SER B 362 -0.370 6.851 9.500 1.00 0.00 H new ATOM 0 HB3 SER B 362 -0.391 5.795 8.101 1.00 0.00 H new ATOM 0 HG SER B 362 -2.366 5.567 9.201 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.103 4.514 11.937 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.522 3.612 13.044 1.00 0.00 C ATOM 1302 C PRO B 363 -1.860 2.943 12.766 1.00 0.00 C ATOM 1303 O PRO B 363 -2.293 2.064 13.504 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.632 4.534 14.255 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.799 5.921 13.723 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.334 5.928 12.265 1.00 0.00 C ATOM 0 HA PRO B 363 0.187 2.796 13.185 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.480 4.254 14.879 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.259 4.463 14.878 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.841 6.233 13.792 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.215 6.628 14.312 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.088 6.367 11.612 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.576 6.516 12.143 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.506 3.383 11.699 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.804 2.846 11.310 1.00 0.00 C ATOM 1316 C LYS B 364 -3.824 2.483 9.840 1.00 0.00 C ATOM 1317 O LYS B 364 -4.646 1.685 9.398 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.891 3.878 11.556 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.703 4.485 12.943 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.925 5.329 13.307 1.00 0.00 C ATOM 1321 CE LYS B 364 -5.470 6.598 14.028 1.00 0.00 C ATOM 1322 NZ LYS B 364 -6.662 7.400 14.423 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.152 4.114 11.082 1.00 0.00 H new ATOM 0 HA LYS B 364 -3.983 1.953 11.909 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.847 4.658 10.796 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.874 3.413 11.480 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.562 3.695 13.680 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.805 5.102 12.962 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -6.482 5.589 12.407 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.599 4.757 13.945 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -4.885 6.338 14.910 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -4.822 7.186 13.378 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -6.353 8.263 14.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -7.203 7.659 13.573 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -7.264 6.838 15.058 1.00 0.00 H new ATOM 1336 N SER B 365 -2.928 3.084 9.082 1.00 0.00 N ATOM 1337 CA SER B 365 -2.878 2.829 7.656 1.00 0.00 C ATOM 1338 C SER B 365 -1.485 2.978 7.108 1.00 0.00 C ATOM 1339 O SER B 365 -0.580 3.471 7.776 1.00 0.00 O ATOM 1340 CB SER B 365 -3.811 3.778 6.917 1.00 0.00 C ATOM 1341 OG SER B 365 -3.421 5.122 7.171 1.00 0.00 O ATOM 0 H SER B 365 -2.231 3.746 9.425 1.00 0.00 H new ATOM 0 HA SER B 365 -3.198 1.798 7.502 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.779 3.575 5.846 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.839 3.619 7.241 1.00 0.00 H new ATOM 0 HG SER B 365 -4.021 5.732 6.694 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.330 2.539 5.875 1.00 0.00 N ATOM 1348 CA PHE B 366 -0.051 2.622 5.214 1.00 0.00 C ATOM 1349 C PHE B 366 -0.275 2.991 3.770 1.00 0.00 C ATOM 1350 O PHE B 366 -1.385 2.847 3.260 1.00 0.00 O ATOM 1351 CB PHE B 366 0.694 1.304 5.386 1.00 0.00 C ATOM 1352 CG PHE B 366 1.456 0.930 4.150 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.736 1.446 3.938 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.897 0.027 3.240 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.464 1.052 2.808 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.616 -0.358 2.109 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.898 0.149 1.894 1.00 0.00 C ATOM 0 H PHE B 366 -2.074 2.123 5.315 1.00 0.00 H new ATOM 0 HA PHE B 366 0.574 3.397 5.657 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.382 1.383 6.228 1.00 0.00 H new ATOM 0 HB3 PHE B 366 -0.017 0.514 5.628 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.163 2.145 4.642 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.091 -0.372 3.413 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.457 1.442 2.640 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.181 -1.048 1.401 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.457 -0.154 1.021 1.00 0.00 H new ATOM 1367 N THR B 367 0.735 3.563 3.139 1.00 0.00 N ATOM 1368 CA THR B 367 0.541 4.041 1.787 1.00 0.00 C ATOM 1369 C THR B 367 1.789 3.936 0.940 1.00 0.00 C ATOM 1370 O THR B 367 2.902 3.892 1.448 1.00 0.00 O ATOM 1371 CB THR B 367 0.091 5.496 1.859 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.202 5.564 2.445 1.00 0.00 O ATOM 1373 CG2 THR B 367 0.057 6.090 0.460 1.00 0.00 C ATOM 0 H THR B 367 1.668 3.704 3.527 1.00 0.00 H new ATOM 0 HA THR B 367 -0.211 3.413 1.310 1.00 0.00 H new ATOM 0 HB THR B 367 0.792 6.064 2.470 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.491 6.499 2.492 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.265 7.130 0.514 1.00 0.00 H new ATOM 0 HG22 THR B 367 1.053 6.041 0.020 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.641 5.526 -0.158 1.00 0.00 H new ATOM 1381 N LEU B 368 1.571 3.886 -0.364 1.00 0.00 N ATOM 1382 CA LEU B 368 2.649 3.770 -1.319 1.00 0.00 C ATOM 1383 C LEU B 368 2.541 4.809 -2.409 1.00 0.00 C ATOM 1384 O LEU B 368 1.443 5.057 -2.888 1.00 0.00 O ATOM 1385 CB LEU B 368 2.537 2.422 -1.990 1.00 0.00 C ATOM 1386 CG LEU B 368 3.354 1.423 -1.216 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.814 0.020 -1.489 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.819 1.530 -1.633 1.00 0.00 C ATOM 0 H LEU B 368 0.643 3.925 -0.785 1.00 0.00 H new ATOM 0 HA LEU B 368 3.590 3.901 -0.785 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.494 2.106 -2.030 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.891 2.482 -3.019 1.00 0.00 H new ATOM 0 HG LEU B 368 3.284 1.627 -0.148 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.401 -0.710 -0.932 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.772 -0.036 -1.175 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.884 -0.196 -2.555 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.411 0.806 -1.072 1.00 0.00 H new ATOM 0 HD22 LEU B 368 4.910 1.324 -2.700 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.184 2.536 -1.425 1.00 0.00 H new ATOM 1400 N ASP B 369 3.675 5.365 -2.856 1.00 0.00 N ATOM 1401 CA ASP B 369 3.626 6.311 -3.957 1.00 0.00 C ATOM 1402 C ASP B 369 4.412 5.793 -5.142 1.00 0.00 C ATOM 1403 O ASP B 369 5.622 5.988 -5.238 1.00 0.00 O ATOM 1404 CB ASP B 369 4.207 7.663 -3.579 1.00 0.00 C ATOM 1405 CG ASP B 369 3.782 8.708 -4.602 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.774 8.382 -5.778 1.00 0.00 O ATOM 1407 OD2 ASP B 369 3.470 9.815 -4.198 1.00 0.00 O1- ATOM 0 H ASP B 369 4.605 5.179 -2.481 1.00 0.00 H new ATOM 0 HA ASP B 369 2.572 6.428 -4.209 1.00 0.00 H new ATOM 0 HB2 ASP B 369 3.864 7.952 -2.586 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.295 7.603 -3.536 1.00 0.00 H new ATOM 1412 N PHE B 370 3.703 5.168 -6.049 1.00 0.00 N ATOM 1413 CA PHE B 370 4.322 4.671 -7.281 1.00 0.00 C ATOM 1414 C PHE B 370 3.469 4.972 -8.496 1.00 0.00 C ATOM 1415 O PHE B 370 2.581 4.195 -8.849 1.00 0.00 O ATOM 1416 CB PHE B 370 4.555 3.174 -7.245 1.00 0.00 C ATOM 1417 CG PHE B 370 3.266 2.461 -6.960 1.00 0.00 C ATOM 1418 CD1 PHE B 370 2.742 2.514 -5.685 1.00 0.00 C ATOM 1419 CD2 PHE B 370 2.618 1.727 -7.956 1.00 0.00 C ATOM 1420 CE1 PHE B 370 1.558 1.835 -5.375 1.00 0.00 C ATOM 1421 CE2 PHE B 370 1.430 1.046 -7.663 1.00 0.00 C ATOM 1422 CZ PHE B 370 0.898 1.098 -6.368 1.00 0.00 C ATOM 0 H PHE B 370 2.702 4.986 -5.971 1.00 0.00 H new ATOM 0 HA PHE B 370 5.279 5.189 -7.353 1.00 0.00 H new ATOM 0 HB2 PHE B 370 4.963 2.838 -8.198 1.00 0.00 H new ATOM 0 HB3 PHE B 370 5.292 2.931 -6.480 1.00 0.00 H new ATOM 0 HD1 PHE B 370 3.249 3.084 -4.920 1.00 0.00 H new ATOM 0 HD2 PHE B 370 3.033 1.685 -8.952 1.00 0.00 H new ATOM 0 HE1 PHE B 370 1.154 1.879 -4.374 1.00 0.00 H new ATOM 0 HE2 PHE B 370 0.925 0.482 -8.433 1.00 0.00 H new ATOM 0 HZ PHE B 370 -0.017 0.573 -6.136 1.00 0.00 H new ATOM 1432 N GLY B 371 3.759 6.086 -9.145 1.00 0.00 N ATOM 1433 CA GLY B 371 3.024 6.465 -10.346 1.00 0.00 C ATOM 1434 C GLY B 371 2.598 7.913 -10.278 1.00 0.00 C ATOM 1435 O GLY B 371 1.762 8.367 -11.052 1.00 0.00 O ATOM 0 H GLY B 371 4.490 6.740 -8.867 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.648 6.305 -11.225 1.00 0.00 H new ATOM 0 HA3 GLY B 371 2.147 5.828 -10.458 1.00 0.00 H new ATOM 1439 N ASP B 372 3.164 8.618 -9.320 1.00 0.00 N ATOM 1440 CA ASP B 372 2.843 10.021 -9.110 1.00 0.00 C ATOM 1441 C ASP B 372 2.734 10.775 -10.423 1.00 0.00 C ATOM 1442 O ASP B 372 2.169 11.868 -10.469 1.00 0.00 O ATOM 1443 CB ASP B 372 3.919 10.666 -8.240 1.00 0.00 C ATOM 1444 CG ASP B 372 3.404 11.968 -7.639 1.00 0.00 C ATOM 1445 OD1 ASP B 372 2.911 12.792 -8.394 1.00 0.00 O ATOM 1446 OD2 ASP B 372 3.507 12.124 -6.434 1.00 0.00 O1- ATOM 0 H ASP B 372 3.853 8.242 -8.669 1.00 0.00 H new ATOM 0 HA ASP B 372 1.875 10.072 -8.612 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.211 9.981 -7.444 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.810 10.861 -8.837 1.00 0.00 H new ATOM 1451 N TYR B 373 3.247 10.192 -11.491 1.00 0.00 N ATOM 1452 CA TYR B 373 3.156 10.837 -12.777 1.00 0.00 C ATOM 1453 C TYR B 373 1.702 11.150 -13.042 1.00 0.00 C ATOM 1454 O TYR B 373 1.348 12.211 -13.555 1.00 0.00 O ATOM 1455 CB TYR B 373 3.713 9.909 -13.842 1.00 0.00 C ATOM 1456 CG TYR B 373 4.814 9.081 -13.223 1.00 0.00 C ATOM 1457 CD1 TYR B 373 5.948 9.713 -12.710 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.703 7.690 -13.168 1.00 0.00 C ATOM 1459 CE1 TYR B 373 6.977 8.955 -12.140 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.735 6.927 -12.602 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.873 7.562 -12.088 1.00 0.00 C ATOM 1462 OH TYR B 373 7.890 6.814 -11.530 1.00 0.00 O ATOM 0 H TYR B 373 3.722 9.289 -11.490 1.00 0.00 H new ATOM 0 HA TYR B 373 3.734 11.761 -12.794 1.00 0.00 H new ATOM 0 HB2 TYR B 373 2.926 9.263 -14.232 1.00 0.00 H new ATOM 0 HB3 TYR B 373 4.099 10.485 -14.683 1.00 0.00 H new ATOM 0 HD1 TYR B 373 6.031 10.789 -12.753 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.823 7.202 -13.561 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.852 9.446 -11.740 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.652 5.851 -12.563 1.00 0.00 H new ATOM 0 HH TYR B 373 7.658 5.863 -11.573 1.00 0.00 H new ATOM 1472 N GLN B 374 0.870 10.226 -12.615 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.564 10.374 -12.717 1.00 0.00 C ATOM 1474 C GLN B 374 -1.134 10.172 -11.329 1.00 0.00 C ATOM 1475 O GLN B 374 -1.148 11.092 -10.511 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.138 9.332 -13.674 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.319 8.040 -13.584 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.213 6.841 -13.888 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -1.751 6.730 -14.991 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -1.407 5.934 -12.971 1.00 0.00 N ATOM 0 H GLN B 374 1.169 9.350 -12.187 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.821 11.360 -13.104 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.180 9.131 -13.425 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.122 9.714 -14.695 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.511 8.075 -14.289 1.00 0.00 H new ATOM 0 HG3 GLN B 374 0.113 7.941 -12.588 1.00 0.00 H new ATOM 0 HE21 GLN B 374 -0.961 6.028 -12.059 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -2.005 5.131 -13.166 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.500 8.938 -11.042 1.00 0.00 N ATOM 1490 CA ASP B 375 -1.948 8.582 -9.719 1.00 0.00 C ATOM 1491 C ASP B 375 -1.171 7.362 -9.279 1.00 0.00 C ATOM 1492 O ASP B 375 -1.508 6.231 -9.628 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.441 8.280 -9.730 1.00 0.00 C ATOM 1494 CG ASP B 375 -4.025 8.482 -8.335 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.632 7.753 -7.439 1.00 0.00 O1- ATOM 1496 OD2 ASP B 375 -4.855 9.363 -8.183 1.00 0.00 O ATOM 0 H ASP B 375 -1.494 8.168 -11.711 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.779 9.408 -9.028 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -3.947 8.931 -10.443 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.611 7.255 -10.059 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.118 7.608 -8.534 1.00 0.00 N ATOM 1502 CA GLY B 376 0.736 6.531 -8.062 1.00 0.00 C ATOM 1503 C GLY B 376 0.444 6.157 -6.623 1.00 0.00 C ATOM 1504 O GLY B 376 1.093 5.279 -6.059 1.00 0.00 O ATOM 0 H GLY B 376 0.171 8.541 -8.240 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.599 5.656 -8.698 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.780 6.831 -8.153 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.466 6.879 -6.009 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.752 6.664 -4.603 1.00 0.00 C ATOM 1510 C TYR B 377 -1.768 5.576 -4.338 1.00 0.00 C ATOM 1511 O TYR B 377 -2.972 5.779 -4.494 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.223 7.964 -3.978 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.665 9.105 -4.786 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.664 9.063 -5.215 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.477 10.191 -5.122 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.184 10.104 -5.981 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -0.957 11.240 -5.887 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.374 11.198 -6.319 1.00 0.00 C ATOM 1519 OH TYR B 377 0.881 12.231 -7.079 1.00 0.00 O ATOM 0 H TYR B 377 -1.017 7.614 -6.453 1.00 0.00 H new ATOM 0 HA TYR B 377 0.180 6.325 -4.150 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.312 8.006 -3.963 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -0.887 8.031 -2.943 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.289 8.222 -4.952 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.505 10.220 -4.792 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.211 10.069 -6.314 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.582 12.082 -6.144 1.00 0.00 H new ATOM 0 HH TYR B 377 0.184 12.906 -7.220 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.266 4.443 -3.856 1.00 0.00 N ATOM 1530 CA TYR B 378 -2.145 3.341 -3.471 1.00 0.00 C ATOM 1531 C TYR B 378 -1.982 3.083 -1.987 1.00 0.00 C ATOM 1532 O TYR B 378 -0.863 2.940 -1.493 1.00 0.00 O ATOM 1533 CB TYR B 378 -1.839 2.081 -4.260 1.00 0.00 C ATOM 1534 CG TYR B 378 -3.058 1.702 -5.056 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -4.116 1.023 -4.442 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -3.129 2.038 -6.409 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -5.250 0.677 -5.187 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -4.263 1.693 -7.157 1.00 0.00 C ATOM 1539 CZ TYR B 378 -5.323 1.011 -6.545 1.00 0.00 C ATOM 1540 OH TYR B 378 -6.441 0.670 -7.279 1.00 0.00 O ATOM 0 H TYR B 378 -0.271 4.264 -3.724 1.00 0.00 H new ATOM 0 HA TYR B 378 -3.175 3.620 -3.693 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -0.991 2.248 -4.924 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.561 1.271 -3.586 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -4.058 0.766 -3.395 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -2.311 2.563 -6.879 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -6.068 0.153 -4.715 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -4.320 1.953 -8.204 1.00 0.00 H new ATOM 0 HH TYR B 378 -6.331 0.976 -8.204 1.00 0.00 H new ATOM 1550 N SER B 379 -3.095 3.081 -1.267 1.00 0.00 N ATOM 1551 CA SER B 379 -3.044 2.902 0.168 1.00 0.00 C ATOM 1552 C SER B 379 -4.131 1.992 0.679 1.00 0.00 C ATOM 1553 O SER B 379 -5.120 1.722 -0.003 1.00 0.00 O ATOM 1554 CB SER B 379 -3.189 4.246 0.855 1.00 0.00 C ATOM 1555 OG SER B 379 -3.132 4.048 2.255 1.00 0.00 O ATOM 0 H SER B 379 -4.032 3.200 -1.652 1.00 0.00 H new ATOM 0 HA SER B 379 -2.081 2.443 0.393 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.395 4.921 0.536 1.00 0.00 H new ATOM 0 HB3 SER B 379 -4.134 4.712 0.577 1.00 0.00 H new ATOM 0 HG SER B 379 -2.233 4.263 2.579 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.937 1.547 1.908 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.891 0.686 2.554 1.00 0.00 C ATOM 1563 C VAL B 380 -4.866 0.919 4.062 1.00 0.00 C ATOM 1564 O VAL B 380 -4.021 1.664 4.557 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.513 -0.744 2.262 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -5.022 -1.158 0.888 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -2.990 -0.858 2.301 1.00 0.00 C ATOM 0 H VAL B 380 -3.120 1.774 2.475 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.893 0.898 2.182 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.962 -1.401 3.007 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.741 -2.193 0.692 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -6.108 -1.065 0.859 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.582 -0.513 0.127 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.697 -1.887 2.092 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.556 -0.197 1.550 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.629 -0.571 3.289 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.783 0.279 4.794 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.816 0.445 6.243 1.00 0.00 C ATOM 1579 C GLN B 381 -5.174 -0.732 6.941 1.00 0.00 C ATOM 1580 O GLN B 381 -5.547 -1.885 6.746 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.239 0.587 6.729 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.357 1.747 7.713 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.824 1.987 8.059 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.420 1.211 8.806 1.00 0.00 O ATOM 1585 NE2 GLN B 381 -9.443 3.019 7.556 1.00 0.00 N ATOM 0 H GLN B 381 -6.496 -0.344 4.415 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.256 1.349 6.480 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.904 0.753 5.881 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.559 -0.338 7.209 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -6.792 1.526 8.619 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.924 2.649 7.279 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.946 3.660 6.937 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.424 3.185 7.781 1.00 0.00 H new ATOM 1594 N THR B 382 -4.214 -0.403 7.762 1.00 0.00 N ATOM 1595 CA THR B 382 -3.489 -1.391 8.541 1.00 0.00 C ATOM 1596 C THR B 382 -2.908 -0.742 9.782 1.00 0.00 C ATOM 1597 O THR B 382 -2.364 0.358 9.710 1.00 0.00 O ATOM 1598 CB THR B 382 -2.378 -2.012 7.705 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.377 -2.533 8.567 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.765 -0.957 6.792 1.00 0.00 C ATOM 0 H THR B 382 -3.906 0.557 7.916 1.00 0.00 H new ATOM 0 HA THR B 382 -4.179 -2.179 8.841 1.00 0.00 H new ATOM 0 HB THR B 382 -2.792 -2.815 7.095 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.491 -2.319 8.206 1.00 0.00 H new ATOM 0 HG21 THR B 382 -0.971 -1.408 6.197 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.533 -0.558 6.130 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.352 -0.149 7.396 1.00 0.00 H new ATOM 1608 N THR B 383 -3.000 -1.412 10.914 1.00 0.00 N ATOM 1609 CA THR B 383 -2.454 -0.843 12.130 1.00 0.00 C ATOM 1610 C THR B 383 -0.976 -1.146 12.254 1.00 0.00 C ATOM 1611 O THR B 383 -0.310 -0.660 13.170 1.00 0.00 O ATOM 1612 CB THR B 383 -3.242 -1.307 13.341 1.00 0.00 C ATOM 1613 OG1 THR B 383 -3.745 -2.617 13.113 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.396 -0.326 13.520 1.00 0.00 C ATOM 0 H THR B 383 -3.436 -2.328 11.018 1.00 0.00 H new ATOM 0 HA THR B 383 -2.551 0.242 12.081 1.00 0.00 H new ATOM 0 HB THR B 383 -2.615 -1.336 14.232 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.252 -2.914 13.898 1.00 0.00 H new ATOM 0 HG21 THR B 383 -4.993 -0.620 14.383 1.00 0.00 H new ATOM 0 HG22 THR B 383 -4.000 0.677 13.678 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.021 -0.332 12.627 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.455 -1.876 11.275 1.00 0.00 N ATOM 1623 CA GLU B 384 0.972 -2.142 11.225 1.00 0.00 C ATOM 1624 C GLU B 384 1.511 -1.668 9.880 1.00 0.00 C ATOM 1625 O GLU B 384 1.679 -2.438 8.937 1.00 0.00 O ATOM 1626 CB GLU B 384 1.254 -3.639 11.398 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.049 -4.381 11.701 1.00 0.00 C ATOM 1628 CD GLU B 384 -0.969 -4.355 10.484 1.00 0.00 C ATOM 1629 OE1 GLU B 384 -0.626 -4.976 9.492 1.00 0.00 O ATOM 1630 OE2 GLU B 384 -2.005 -3.716 10.564 1.00 0.00 O1- ATOM 0 H GLU B 384 -0.995 -2.289 10.514 1.00 0.00 H new ATOM 0 HA GLU B 384 1.464 -1.608 12.038 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.709 -4.040 10.492 1.00 0.00 H new ATOM 0 HB3 GLU B 384 1.967 -3.793 12.208 1.00 0.00 H new ATOM 0 HG2 GLU B 384 0.168 -5.412 11.979 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.549 -3.920 12.553 1.00 0.00 H new ATOM 1637 N GLY B 385 1.809 -0.385 9.822 1.00 0.00 N ATOM 1638 CA GLY B 385 2.370 0.210 8.625 1.00 0.00 C ATOM 1639 C GLY B 385 3.880 0.057 8.627 1.00 0.00 C ATOM 1640 O GLY B 385 4.467 -0.518 7.716 1.00 0.00 O ATOM 0 H GLY B 385 1.671 0.268 10.593 1.00 0.00 H new ATOM 0 HA2 GLY B 385 1.949 -0.268 7.740 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.103 1.266 8.575 1.00 0.00 H new ATOM 1644 N GLU B 386 4.491 0.602 9.671 1.00 0.00 N ATOM 1645 CA GLU B 386 5.940 0.568 9.830 1.00 0.00 C ATOM 1646 C GLU B 386 6.480 -0.816 9.567 1.00 0.00 C ATOM 1647 O GLU B 386 7.648 -0.991 9.266 1.00 0.00 O ATOM 1648 CB GLU B 386 6.306 0.986 11.245 1.00 0.00 C ATOM 1649 CG GLU B 386 5.438 0.220 12.240 1.00 0.00 C ATOM 1650 CD GLU B 386 5.832 0.595 13.666 1.00 0.00 C ATOM 1651 OE1 GLU B 386 5.763 1.770 13.989 1.00 0.00 O1- ATOM 1652 OE2 GLU B 386 6.200 -0.297 14.413 1.00 0.00 O ATOM 0 H GLU B 386 4.000 1.078 10.428 1.00 0.00 H new ATOM 0 HA GLU B 386 6.380 1.257 9.109 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.360 0.784 11.434 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.160 2.059 11.368 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.386 0.450 12.071 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.558 -0.853 12.090 1.00 0.00 H new ATOM 1659 N GLN B 387 5.618 -1.789 9.666 1.00 0.00 N ATOM 1660 CA GLN B 387 6.029 -3.163 9.425 1.00 0.00 C ATOM 1661 C GLN B 387 6.058 -3.414 7.938 1.00 0.00 C ATOM 1662 O GLN B 387 6.953 -4.069 7.417 1.00 0.00 O ATOM 1663 CB GLN B 387 5.068 -4.137 10.100 1.00 0.00 C ATOM 1664 CG GLN B 387 5.111 -3.938 11.617 1.00 0.00 C ATOM 1665 CD GLN B 387 4.332 -5.054 12.306 1.00 0.00 C ATOM 1666 OE1 GLN B 387 4.258 -6.169 11.792 1.00 0.00 O ATOM 1667 NE2 GLN B 387 3.743 -4.819 13.446 1.00 0.00 N ATOM 0 H GLN B 387 4.635 -1.669 9.909 1.00 0.00 H new ATOM 0 HA GLN B 387 7.023 -3.319 9.845 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.055 -3.977 9.731 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.340 -5.163 9.850 1.00 0.00 H new ATOM 0 HG2 GLN B 387 6.144 -3.936 11.964 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.685 -2.969 11.878 1.00 0.00 H new ATOM 0 HE21 GLN B 387 3.805 -3.894 13.871 1.00 0.00 H new ATOM 0 HE22 GLN B 387 3.220 -5.560 13.912 1.00 0.00 H new ATOM 1676 N ILE B 388 5.080 -2.853 7.269 1.00 0.00 N ATOM 1677 CA ILE B 388 4.980 -2.962 5.830 1.00 0.00 C ATOM 1678 C ILE B 388 5.975 -2.016 5.176 1.00 0.00 C ATOM 1679 O ILE B 388 6.618 -2.340 4.178 1.00 0.00 O ATOM 1680 CB ILE B 388 3.579 -2.541 5.409 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.569 -3.622 5.769 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.545 -2.304 3.904 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.169 -3.008 5.760 1.00 0.00 C ATOM 0 H ILE B 388 4.333 -2.310 7.702 1.00 0.00 H new ATOM 0 HA ILE B 388 5.187 -3.988 5.526 1.00 0.00 H new ATOM 0 HB ILE B 388 3.319 -1.622 5.934 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.625 -4.444 5.056 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.793 -4.036 6.752 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.541 -2.003 3.606 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.252 -1.517 3.644 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.817 -3.223 3.385 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.435 -3.772 6.016 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.122 -2.200 6.490 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.951 -2.614 4.767 1.00 0.00 H new ATOM 1695 N ALA B 389 6.042 -0.821 5.740 1.00 0.00 N ATOM 1696 CA ALA B 389 6.895 0.244 5.222 1.00 0.00 C ATOM 1697 C ALA B 389 8.372 0.029 5.505 1.00 0.00 C ATOM 1698 O ALA B 389 9.202 0.291 4.644 1.00 0.00 O ATOM 1699 CB ALA B 389 6.471 1.557 5.854 1.00 0.00 C ATOM 0 H ALA B 389 5.509 -0.559 6.569 1.00 0.00 H new ATOM 0 HA ALA B 389 6.772 0.251 4.139 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.100 2.363 5.476 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.430 1.762 5.604 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.578 1.491 6.937 1.00 0.00 H new ATOM 1705 N GLN B 390 8.714 -0.409 6.707 1.00 0.00 N ATOM 1706 CA GLN B 390 10.132 -0.576 7.037 1.00 0.00 C ATOM 1707 C GLN B 390 10.770 -1.626 6.166 1.00 0.00 C ATOM 1708 O GLN B 390 11.942 -1.545 5.797 1.00 0.00 O ATOM 1709 CB GLN B 390 10.310 -0.994 8.488 1.00 0.00 C ATOM 1710 CG GLN B 390 9.744 -2.400 8.695 1.00 0.00 C ATOM 1711 CD GLN B 390 10.819 -3.444 8.415 1.00 0.00 C ATOM 1712 OE1 GLN B 390 10.611 -4.349 7.606 1.00 0.00 O ATOM 1713 NE2 GLN B 390 11.964 -3.374 9.038 1.00 0.00 N ATOM 0 H GLN B 390 8.059 -0.650 7.451 1.00 0.00 H new ATOM 0 HA GLN B 390 10.612 0.388 6.868 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.367 -0.974 8.755 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.802 -0.287 9.145 1.00 0.00 H new ATOM 0 HG2 GLN B 390 9.380 -2.507 9.717 1.00 0.00 H new ATOM 0 HG3 GLN B 390 8.892 -2.558 8.034 1.00 0.00 H new ATOM 0 HE21 GLN B 390 12.135 -2.624 9.708 1.00 0.00 H new ATOM 0 HE22 GLN B 390 12.688 -4.069 8.855 1.00 0.00 H new ATOM 1722 N LEU B 391 9.978 -2.611 5.863 1.00 0.00 N ATOM 1723 CA LEU B 391 10.409 -3.719 5.048 1.00 0.00 C ATOM 1724 C LEU B 391 10.526 -3.252 3.610 1.00 0.00 C ATOM 1725 O LEU B 391 11.583 -3.356 2.996 1.00 0.00 O ATOM 1726 CB LEU B 391 9.396 -4.839 5.265 1.00 0.00 C ATOM 1727 CG LEU B 391 8.577 -5.180 4.015 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.439 -5.926 2.986 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.413 -6.059 4.454 1.00 0.00 C ATOM 0 H LEU B 391 9.008 -2.673 6.174 1.00 0.00 H new ATOM 0 HA LEU B 391 11.395 -4.100 5.316 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.922 -5.733 5.599 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.716 -4.551 6.067 1.00 0.00 H new ATOM 0 HG LEU B 391 8.216 -4.266 3.543 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.837 -6.158 2.107 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.281 -5.299 2.694 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.811 -6.851 3.426 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.808 -6.321 3.586 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.798 -6.968 4.916 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.800 -5.518 5.174 1.00 0.00 H new ATOM 1741 N ILE B 392 9.453 -2.669 3.108 1.00 0.00 N ATOM 1742 CA ILE B 392 9.453 -2.108 1.791 1.00 0.00 C ATOM 1743 C ILE B 392 10.683 -1.259 1.712 1.00 0.00 C ATOM 1744 O ILE B 392 11.554 -1.458 0.878 1.00 0.00 O ATOM 1745 CB ILE B 392 8.208 -1.237 1.651 1.00 0.00 C ATOM 1746 CG1 ILE B 392 7.077 -2.062 1.039 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.497 -0.004 0.783 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.773 -1.273 1.099 1.00 0.00 C ATOM 0 H ILE B 392 8.568 -2.577 3.606 1.00 0.00 H new ATOM 0 HA ILE B 392 9.447 -2.864 1.006 1.00 0.00 H new ATOM 0 HB ILE B 392 7.909 -0.889 2.640 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.315 -2.312 0.005 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.968 -3.004 1.577 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.594 0.601 0.698 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.288 0.588 1.243 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.814 -0.324 -0.210 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.969 -1.865 0.662 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.533 -1.046 2.138 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.884 -0.343 0.541 1.00 0.00 H new ATOM 1760 N ALA B 393 10.735 -0.347 2.664 1.00 0.00 N ATOM 1761 CA ALA B 393 11.853 0.565 2.817 1.00 0.00 C ATOM 1762 C ALA B 393 13.162 -0.199 2.879 1.00 0.00 C ATOM 1763 O ALA B 393 14.202 0.281 2.429 1.00 0.00 O ATOM 1764 CB ALA B 393 11.710 1.321 4.119 1.00 0.00 C ATOM 0 H ALA B 393 9.998 -0.217 3.357 1.00 0.00 H new ATOM 0 HA ALA B 393 11.855 1.243 1.963 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.549 2.007 4.236 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.778 1.886 4.111 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.700 0.616 4.950 1.00 0.00 H new ATOM 1770 N GLY B 394 13.105 -1.385 3.473 1.00 0.00 N ATOM 1771 CA GLY B 394 14.301 -2.197 3.628 1.00 0.00 C ATOM 1772 C GLY B 394 14.556 -3.016 2.391 1.00 0.00 C ATOM 1773 O GLY B 394 15.653 -3.519 2.178 1.00 0.00 O ATOM 0 H GLY B 394 12.253 -1.800 3.850 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.159 -1.555 3.827 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.189 -2.856 4.489 1.00 0.00 H new ATOM 1777 N TYR B 395 13.528 -3.143 1.586 1.00 0.00 N ATOM 1778 CA TYR B 395 13.615 -3.896 0.364 1.00 0.00 C ATOM 1779 C TYR B 395 14.116 -2.989 -0.746 1.00 0.00 C ATOM 1780 O TYR B 395 14.936 -3.400 -1.560 1.00 0.00 O ATOM 1781 CB TYR B 395 12.241 -4.482 0.074 1.00 0.00 C ATOM 1782 CG TYR B 395 12.021 -5.781 0.858 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.781 -6.104 2.010 1.00 0.00 C ATOM 1784 CD2 TYR B 395 11.052 -6.685 0.406 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.558 -7.317 2.678 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.841 -7.897 1.076 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.593 -8.213 2.209 1.00 0.00 C ATOM 1788 OH TYR B 395 11.383 -9.408 2.865 1.00 0.00 O ATOM 0 H TYR B 395 12.613 -2.728 1.761 1.00 0.00 H new ATOM 0 HA TYR B 395 14.324 -4.720 0.444 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.470 -3.758 0.338 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.143 -4.677 -0.994 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.531 -5.417 2.373 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.462 -6.446 -0.467 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.134 -7.560 3.559 1.00 0.00 H new ATOM 0 HE2 TYR B 395 10.094 -8.589 0.715 1.00 0.00 H new ATOM 0 HH TYR B 395 10.677 -9.912 2.409 1.00 0.00 H new ATOM 1798 N ILE B 396 13.689 -1.733 -0.737 1.00 0.00 N ATOM 1799 CA ILE B 396 14.202 -0.790 -1.732 1.00 0.00 C ATOM 1800 C ILE B 396 15.652 -0.519 -1.455 1.00 0.00 C ATOM 1801 O ILE B 396 16.381 0.041 -2.274 1.00 0.00 O ATOM 1802 CB ILE B 396 13.450 0.537 -1.774 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.241 0.477 -0.870 1.00 0.00 C ATOM 1804 CG2 ILE B 396 13.005 0.803 -3.210 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.420 1.759 -1.014 1.00 0.00 C ATOM 0 H ILE B 396 13.012 -1.349 -0.078 1.00 0.00 H new ATOM 0 HA ILE B 396 14.059 -1.262 -2.704 1.00 0.00 H new ATOM 0 HB ILE B 396 14.103 1.339 -1.431 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.628 -0.388 -1.124 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.556 0.351 0.166 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.466 1.749 -3.254 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.880 0.853 -3.859 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.351 -0.003 -3.544 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.550 1.709 -0.360 1.00 0.00 H new ATOM 0 HD12 ILE B 396 12.033 2.617 -0.738 1.00 0.00 H new ATOM 0 HD13 ILE B 396 11.091 1.866 -2.048 1.00 0.00 H new ATOM 1817 N ASP B 397 16.051 -0.936 -0.286 1.00 0.00 N ATOM 1818 CA ASP B 397 17.418 -0.745 0.164 1.00 0.00 C ATOM 1819 C ASP B 397 18.305 -1.785 -0.467 1.00 0.00 C ATOM 1820 O ASP B 397 19.523 -1.632 -0.561 1.00 0.00 O ATOM 1821 CB ASP B 397 17.469 -0.875 1.681 1.00 0.00 C ATOM 1822 CG ASP B 397 18.409 0.170 2.269 1.00 0.00 C ATOM 1823 OD1 ASP B 397 19.566 0.184 1.880 1.00 0.00 O1- ATOM 1824 OD2 ASP B 397 17.960 0.942 3.100 1.00 0.00 O ATOM 0 H ASP B 397 15.449 -1.415 0.384 1.00 0.00 H new ATOM 0 HA ASP B 397 17.766 0.246 -0.127 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.469 -0.751 2.097 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.807 -1.874 1.956 1.00 0.00 H new ATOM 1829 N ILE B 398 17.669 -2.860 -0.860 1.00 0.00 N ATOM 1830 CA ILE B 398 18.339 -3.981 -1.452 1.00 0.00 C ATOM 1831 C ILE B 398 18.396 -3.877 -2.959 1.00 0.00 C ATOM 1832 O ILE B 398 19.462 -3.872 -3.575 1.00 0.00 O ATOM 1833 CB ILE B 398 17.536 -5.202 -1.074 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.520 -5.329 0.451 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.153 -6.430 -1.710 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.415 -6.284 0.917 1.00 0.00 C ATOM 0 H ILE B 398 16.659 -2.979 -0.775 1.00 0.00 H new ATOM 0 HA ILE B 398 19.368 -4.026 -1.095 1.00 0.00 H new ATOM 0 HB ILE B 398 16.511 -5.108 -1.434 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.488 -5.691 0.798 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.368 -4.347 0.899 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.573 -7.312 -1.437 1.00 0.00 H new ATOM 0 HG22 ILE B 398 18.153 -6.317 -2.794 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.178 -6.546 -1.357 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.429 -6.353 2.005 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.446 -5.907 0.590 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.583 -7.272 0.488 1.00 0.00 H new ATOM 1848 N ILE B 399 17.210 -3.860 -3.527 1.00 0.00 N ATOM 1849 CA ILE B 399 17.034 -3.832 -4.962 1.00 0.00 C ATOM 1850 C ILE B 399 17.566 -2.550 -5.586 1.00 0.00 C ATOM 1851 O ILE B 399 17.819 -2.509 -6.790 1.00 0.00 O ATOM 1852 CB ILE B 399 15.553 -3.954 -5.243 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.882 -2.666 -4.784 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.986 -5.124 -4.443 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.433 -2.946 -4.347 1.00 0.00 C ATOM 0 H ILE B 399 16.335 -3.865 -3.002 1.00 0.00 H new ATOM 0 HA ILE B 399 17.597 -4.655 -5.402 1.00 0.00 H new ATOM 0 HB ILE B 399 15.377 -4.122 -6.306 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.442 -2.231 -3.956 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.891 -1.935 -5.593 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.918 -5.217 -4.641 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.491 -6.044 -4.736 1.00 0.00 H new ATOM 0 HG23 ILE B 399 15.143 -4.947 -3.379 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.965 -2.017 -4.021 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.873 -3.359 -5.186 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.433 -3.660 -3.524 1.00 0.00 H new ATOM 1867 N LEU B 400 17.714 -1.497 -4.788 1.00 0.00 N ATOM 1868 CA LEU B 400 18.203 -0.234 -5.353 1.00 0.00 C ATOM 1869 C LEU B 400 19.442 -0.469 -6.215 1.00 0.00 C ATOM 1870 O LEU B 400 19.912 -1.596 -6.257 1.00 0.00 O ATOM 1871 CB LEU B 400 18.531 0.786 -4.261 1.00 0.00 C ATOM 1872 CG LEU B 400 19.294 0.119 -3.116 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.664 -0.370 -3.599 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.493 1.137 -1.991 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.904 0.483 -6.822 1.00 0.00 O ATOM 0 H LEU B 400 17.513 -1.484 -3.788 1.00 0.00 H new ATOM 0 HA LEU B 400 17.401 0.169 -5.972 1.00 0.00 H new ATOM 0 HB2 LEU B 400 19.128 1.596 -4.680 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.611 1.230 -3.882 1.00 0.00 H new ATOM 0 HG LEU B 400 18.721 -0.736 -2.757 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.194 -0.842 -2.772 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.529 -1.093 -4.404 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.244 0.477 -3.965 1.00 0.00 H new ATOM 0 HD21 LEU B 400 20.037 0.670 -1.170 1.00 0.00 H new ATOM 0 HD22 LEU B 400 20.063 1.987 -2.366 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.522 1.480 -1.635 1.00 0.00 H new