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 -142:sc= 0.104 USER MOD Set 1.2: B 379 SER OG : rot 104:sc= 0.579 USER MOD Set 2.1: B 362 SER OG : rot 49:sc= -0.495! USER MOD Set 2.2: B 365 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 352 SER OG : rot -82:sc= -2.8! USER MOD Set 3.2: B 355 ASN :FLIP amide:sc= -4.06! C(o=-10!,f=-6.9!) USER MOD Set 4.1: B 333 THR OG1 : rot -132:sc= -2.14! USER MOD Set 4.2: B 336 CYS SG : rot 180:sc= -0.653! USER MOD Set 5.1: B 316 LYS NZ :NH3+ 160:sc= 0.193 (180deg=-0.79) USER MOD Set 5.2: B 381 GLN : amide:sc= 0.442 K(o=0.63,f=-8.1!) USER MOD Set 6.1: B 311 SER OG : rot -110:sc= -0.534 USER MOD Set 6.2: B 334 LYS NZ :NH3+ 153:sc= 0.704 (180deg=-1.55!) USER MOD Set 6.3: B 395 TYR OH : rot 180:sc= -0.0513 USER MOD Single : B 338 MET CE :methyl -164:sc= -0.1 (180deg=-1.19) USER MOD Single : B 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 344 THR OG1 : rot -141:sc= -0.72 USER MOD Single : B 345 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 349 GLN : amide:sc= -5.29! C(o=-5.3!,f=-7.4!) USER MOD Single : B 354 THR OG1 : rot 160:sc= -3.9! USER MOD Single : B 357 LYS NZ :NH3+ -107:sc= -2.11! (180deg=-3!) 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= -0.154 X(o=-0.15,f=-0.069) USER MOD Single : B 377 TYR OH : rot 180:sc= -3.09! USER MOD Single : B 378 TYR OH : rot 180:sc= 0 USER MOD Single : B 382 THR OG1 : rot 180:sc= 0.582 USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0637 USER MOD Single : B 387 GLN : amide:sc= -0.0682 X(o=-0.068,f=-0.4) USER MOD Single : B 390 GLN : amide:sc= -3.23! C(o=-3.2!,f=-5.3!) USER MOD ----------------------------------------------------------------- ATOM 125 N LEU A 15 1.229 11.896 2.001 1.00 0.00 N ATOM 126 CA LEU A 15 0.540 10.643 1.698 1.00 0.00 C ATOM 127 C LEU A 15 -0.684 10.509 2.592 1.00 0.00 C ATOM 128 O LEU A 15 -1.756 10.107 2.144 1.00 0.00 O ATOM 129 CB LEU A 15 1.482 9.449 1.934 1.00 0.00 C ATOM 130 CG LEU A 15 2.448 9.228 0.750 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.689 8.943 -0.545 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.317 10.462 0.542 1.00 0.00 C ATOM 0 HA LEU A 15 0.232 10.650 0.652 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.058 9.616 2.844 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.891 8.547 2.092 1.00 0.00 H new ATOM 0 HG LEU A 15 3.069 8.366 0.994 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.400 8.792 -1.358 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.083 8.045 -0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.042 9.788 -0.781 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.994 10.293 -0.296 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.682 11.322 0.328 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.897 10.655 1.444 1.00 0.00 H new ATOM 144 N LEU A 16 -0.520 10.868 3.853 1.00 0.00 N ATOM 145 CA LEU A 16 -1.625 10.803 4.795 1.00 0.00 C ATOM 146 C LEU A 16 -2.780 11.671 4.289 1.00 0.00 C ATOM 147 O LEU A 16 -3.947 11.287 4.380 1.00 0.00 O ATOM 148 CB LEU A 16 -1.149 11.277 6.171 1.00 0.00 C ATOM 149 CG LEU A 16 -1.614 10.304 7.265 1.00 0.00 C ATOM 150 CD1 LEU A 16 -3.131 10.121 7.189 1.00 0.00 C ATOM 151 CD2 LEU A 16 -0.922 8.943 7.086 1.00 0.00 C ATOM 0 H LEU A 16 0.359 11.205 4.247 1.00 0.00 H new ATOM 0 HA LEU A 16 -1.978 9.776 4.884 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.062 11.352 6.180 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.539 12.275 6.374 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.349 10.716 8.239 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.454 9.430 7.968 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.621 11.084 7.333 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.400 9.719 6.212 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.257 8.259 7.866 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.175 8.532 6.109 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.158 9.072 7.156 1.00 0.00 H new ATOM 163 N GLY A 17 -2.447 12.823 3.710 1.00 0.00 N ATOM 164 CA GLY A 17 -3.469 13.702 3.152 1.00 0.00 C ATOM 165 C GLY A 17 -4.167 12.989 2.002 1.00 0.00 C ATOM 166 O GLY A 17 -5.390 13.014 1.883 1.00 0.00 O ATOM 0 H GLY A 17 -1.491 13.165 3.616 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.193 13.973 3.921 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.016 14.629 2.800 1.00 0.00 H new ATOM 170 N GLU A 18 -3.370 12.331 1.168 1.00 0.00 N ATOM 171 CA GLU A 18 -3.905 11.578 0.047 1.00 0.00 C ATOM 172 C GLU A 18 -4.769 10.435 0.555 1.00 0.00 C ATOM 173 O GLU A 18 -5.793 10.109 -0.036 1.00 0.00 O ATOM 174 CB GLU A 18 -2.745 11.035 -0.786 1.00 0.00 C ATOM 175 CG GLU A 18 -2.165 12.164 -1.636 1.00 0.00 C ATOM 176 CD GLU A 18 -1.081 11.624 -2.559 1.00 0.00 C ATOM 177 OE1 GLU A 18 -0.693 10.482 -2.381 1.00 0.00 O1- ATOM 178 OE2 GLU A 18 -0.655 12.361 -3.433 1.00 0.00 O ATOM 0 H GLU A 18 -2.354 12.305 1.249 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.523 12.228 -0.572 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.975 10.622 -0.134 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.090 10.223 -1.426 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.956 12.629 -2.225 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.751 12.939 -0.991 1.00 0.00 H new ATOM 394 N VAL B 310 9.423 -12.705 0.761 1.00 0.00 N ATOM 395 CA VAL B 310 8.145 -12.036 0.553 1.00 0.00 C ATOM 396 C VAL B 310 7.408 -11.851 1.877 1.00 0.00 C ATOM 397 O VAL B 310 7.370 -12.759 2.708 1.00 0.00 O ATOM 398 CB VAL B 310 7.281 -12.858 -0.407 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.907 -12.207 -0.548 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.956 -12.908 -1.779 1.00 0.00 C ATOM 0 HA VAL B 310 8.336 -11.053 0.123 1.00 0.00 H new ATOM 0 HB VAL B 310 7.166 -13.868 -0.014 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.294 -12.794 -1.232 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.423 -12.165 0.428 1.00 0.00 H new ATOM 0 HG13 VAL B 310 6.022 -11.197 -0.940 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.343 -13.493 -2.465 1.00 0.00 H new ATOM 0 HG22 VAL B 310 8.069 -11.895 -2.166 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.938 -13.372 -1.685 1.00 0.00 H new ATOM 410 N SER B 311 6.825 -10.669 2.064 1.00 0.00 N ATOM 411 CA SER B 311 6.089 -10.364 3.286 1.00 0.00 C ATOM 412 C SER B 311 4.605 -10.214 2.982 1.00 0.00 C ATOM 413 O SER B 311 4.238 -9.890 1.863 1.00 0.00 O ATOM 414 CB SER B 311 6.613 -9.071 3.884 1.00 0.00 C ATOM 415 OG SER B 311 7.727 -8.622 3.125 1.00 0.00 O ATOM 0 H SER B 311 6.849 -9.908 1.385 1.00 0.00 H new ATOM 0 HA SER B 311 6.227 -11.181 3.995 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.829 -8.313 3.885 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.905 -9.229 4.922 1.00 0.00 H new ATOM 0 HG SER B 311 8.545 -8.720 3.655 1.00 0.00 H new ATOM 421 N PHE B 312 3.759 -10.481 3.975 1.00 0.00 N ATOM 422 CA PHE B 312 2.312 -10.404 3.786 1.00 0.00 C ATOM 423 C PHE B 312 1.647 -9.571 4.885 1.00 0.00 C ATOM 424 O PHE B 312 1.944 -9.762 6.065 1.00 0.00 O ATOM 425 CB PHE B 312 1.765 -11.827 3.841 1.00 0.00 C ATOM 426 CG PHE B 312 2.098 -12.555 2.559 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.532 -12.139 1.350 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.974 -13.649 2.582 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.840 -12.815 0.163 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.281 -14.325 1.395 1.00 0.00 C ATOM 431 CZ PHE B 312 2.712 -13.909 0.186 1.00 0.00 C ATOM 0 H PHE B 312 4.049 -10.751 4.915 1.00 0.00 H new ATOM 0 HA PHE B 312 2.098 -9.926 2.830 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.192 -12.357 4.692 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.685 -11.806 3.988 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.857 -11.296 1.332 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.412 -13.970 3.515 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.404 -12.492 -0.771 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.957 -15.167 1.412 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.946 -14.432 -0.729 1.00 0.00 H new ATOM 441 N PHE B 313 0.728 -8.658 4.512 1.00 0.00 N ATOM 442 CA PHE B 313 0.046 -7.855 5.516 1.00 0.00 C ATOM 443 C PHE B 313 -1.423 -7.718 5.177 1.00 0.00 C ATOM 444 O PHE B 313 -1.785 -7.328 4.070 1.00 0.00 O ATOM 445 CB PHE B 313 0.659 -6.466 5.600 1.00 0.00 C ATOM 446 CG PHE B 313 1.976 -6.536 6.325 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.144 -6.866 5.629 1.00 0.00 C ATOM 448 CD2 PHE B 313 2.031 -6.264 7.695 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.367 -6.924 6.304 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.254 -6.321 8.372 1.00 0.00 C ATOM 451 CZ PHE B 313 4.424 -6.652 7.674 1.00 0.00 C ATOM 0 H PHE B 313 0.454 -8.470 3.548 1.00 0.00 H new ATOM 0 HA PHE B 313 0.156 -8.360 6.475 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.805 -6.061 4.599 1.00 0.00 H new ATOM 0 HB3 PHE B 313 -0.019 -5.790 6.121 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.101 -7.076 4.570 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.129 -6.010 8.231 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.268 -7.179 5.767 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.297 -6.110 9.430 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.369 -6.697 8.195 1.00 0.00 H new ATOM 461 N LEU B 314 -2.262 -8.014 6.148 1.00 0.00 N ATOM 462 CA LEU B 314 -3.686 -7.891 5.958 1.00 0.00 C ATOM 463 C LEU B 314 -4.098 -6.455 6.165 1.00 0.00 C ATOM 464 O LEU B 314 -4.100 -5.898 7.252 1.00 0.00 O ATOM 465 CB LEU B 314 -4.467 -8.916 6.808 1.00 0.00 C ATOM 466 CG LEU B 314 -4.961 -8.395 8.172 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.829 -7.740 8.966 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.140 -7.422 7.999 1.00 0.00 C ATOM 0 H LEU B 314 -1.981 -8.340 7.073 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.947 -8.145 4.931 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.328 -9.259 6.234 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.830 -9.784 6.977 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.311 -9.256 8.742 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.214 -7.384 9.922 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.038 -8.469 9.142 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.428 -6.899 8.401 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.468 -7.070 8.977 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.824 -6.572 7.395 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.964 -7.934 7.502 1.00 0.00 H new ATOM 480 N VAL B 315 -4.361 -5.848 5.053 1.00 0.00 N ATOM 481 CA VAL B 315 -4.716 -4.447 5.009 1.00 0.00 C ATOM 482 C VAL B 315 -6.142 -4.284 4.498 1.00 0.00 C ATOM 483 O VAL B 315 -6.665 -5.189 3.874 1.00 0.00 O ATOM 484 CB VAL B 315 -3.740 -3.756 4.072 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.310 -3.932 4.585 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.878 -4.363 2.663 1.00 0.00 C ATOM 0 H VAL B 315 -4.338 -6.303 4.140 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.664 -4.007 6.005 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.964 -2.690 4.031 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.617 -3.434 3.908 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.224 -3.494 5.579 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -2.069 -4.994 4.634 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -3.180 -3.871 1.985 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.655 -5.429 2.703 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.897 -4.218 2.303 1.00 0.00 H new ATOM 496 N LYS B 316 -6.770 -3.131 4.751 1.00 0.00 N ATOM 497 CA LYS B 316 -8.124 -2.912 4.274 1.00 0.00 C ATOM 498 C LYS B 316 -8.089 -2.000 3.067 1.00 0.00 C ATOM 499 O LYS B 316 -7.246 -1.115 2.971 1.00 0.00 O ATOM 500 CB LYS B 316 -8.983 -2.275 5.354 1.00 0.00 C ATOM 501 CG LYS B 316 -8.719 -2.947 6.703 1.00 0.00 C ATOM 502 CD LYS B 316 -9.576 -2.284 7.784 1.00 0.00 C ATOM 503 CE LYS B 316 -8.914 -2.476 9.150 1.00 0.00 C ATOM 504 NZ LYS B 316 -8.014 -1.323 9.434 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.366 -2.354 5.273 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.556 -3.876 4.007 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.765 -1.209 5.421 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -10.037 -2.368 5.093 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -8.951 -4.010 6.642 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.663 -2.865 6.961 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -9.692 -1.221 7.570 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -10.575 -2.719 7.788 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -9.675 -2.557 9.926 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -8.346 -3.406 9.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -7.833 -1.267 10.457 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -7.114 -1.453 8.930 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -8.466 -0.443 9.114 1.00 0.00 H new ATOM 518 N GLU B 317 -8.996 -2.240 2.146 1.00 0.00 N ATOM 519 CA GLU B 317 -9.050 -1.459 0.923 1.00 0.00 C ATOM 520 C GLU B 317 -10.452 -0.985 0.596 1.00 0.00 C ATOM 521 O GLU B 317 -11.448 -1.623 0.922 1.00 0.00 O ATOM 522 CB GLU B 317 -8.543 -2.300 -0.234 1.00 0.00 C ATOM 523 CG GLU B 317 -8.133 -1.391 -1.401 1.00 0.00 C ATOM 524 CD GLU B 317 -7.450 -2.208 -2.491 1.00 0.00 C ATOM 525 OE1 GLU B 317 -6.466 -2.859 -2.185 1.00 0.00 O ATOM 526 OE2 GLU B 317 -7.918 -2.164 -3.616 1.00 0.00 O1- ATOM 0 H GLU B 317 -9.707 -2.968 2.217 1.00 0.00 H new ATOM 0 HA GLU B 317 -8.425 -0.579 1.076 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.692 -2.900 0.087 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -9.319 -2.994 -0.558 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -9.012 -0.891 -1.808 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -7.459 -0.612 -1.045 1.00 0.00 H new ATOM 678 N VAL B 326 -12.485 -2.831 2.740 1.00 0.00 N ATOM 679 CA VAL B 326 -12.645 -4.262 2.747 1.00 0.00 C ATOM 680 C VAL B 326 -11.343 -4.927 3.170 1.00 0.00 C ATOM 681 O VAL B 326 -10.317 -4.695 2.532 1.00 0.00 O ATOM 682 CB VAL B 326 -13.000 -4.690 1.336 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.668 -6.164 1.141 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.488 -4.441 1.104 1.00 0.00 C ATOM 0 HA VAL B 326 -13.426 -4.555 3.448 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.421 -4.112 0.616 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -12.926 -6.464 0.125 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.602 -6.322 1.306 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.238 -6.762 1.852 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.754 -4.745 0.092 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -15.070 -5.019 1.822 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.704 -3.380 1.233 1.00 0.00 H new ATOM 694 N PRO B 327 -11.334 -5.750 4.204 1.00 0.00 N ATOM 695 CA PRO B 327 -10.086 -6.426 4.616 1.00 0.00 C ATOM 696 C PRO B 327 -9.399 -6.942 3.373 1.00 0.00 C ATOM 697 O PRO B 327 -10.068 -7.313 2.408 1.00 0.00 O ATOM 698 CB PRO B 327 -10.554 -7.560 5.523 1.00 0.00 C ATOM 699 CG PRO B 327 -11.865 -7.105 6.079 1.00 0.00 C ATOM 700 CD PRO B 327 -12.470 -6.127 5.064 1.00 0.00 C ATOM 0 HA PRO B 327 -9.374 -5.784 5.134 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.665 -8.490 4.965 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.834 -7.750 6.319 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.530 -7.953 6.240 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.726 -6.620 7.045 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.268 -6.595 4.487 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.902 -5.257 5.558 1.00 0.00 H new ATOM 708 N ARG B 328 -8.086 -6.928 3.355 1.00 0.00 N ATOM 709 CA ARG B 328 -7.393 -7.354 2.178 1.00 0.00 C ATOM 710 C ARG B 328 -6.077 -7.940 2.583 1.00 0.00 C ATOM 711 O ARG B 328 -5.825 -8.141 3.767 1.00 0.00 O ATOM 712 CB ARG B 328 -7.209 -6.172 1.213 1.00 0.00 C ATOM 713 CG ARG B 328 -6.740 -6.669 -0.155 1.00 0.00 C ATOM 714 CD ARG B 328 -7.438 -5.863 -1.251 1.00 0.00 C ATOM 715 NE ARG B 328 -8.884 -6.042 -1.168 1.00 0.00 N ATOM 716 CZ ARG B 328 -9.452 -7.200 -1.484 1.00 0.00 C ATOM 717 NH1 ARG B 328 -8.716 -8.202 -1.880 1.00 0.00 N ATOM 718 NH2 ARG B 328 -10.748 -7.336 -1.398 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.492 -6.631 4.130 1.00 0.00 H new ATOM 0 HA ARG B 328 -7.973 -8.114 1.654 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -8.149 -5.631 1.108 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.481 -5.471 1.621 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -5.659 -6.563 -0.242 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -6.966 -7.729 -0.267 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -7.189 -4.807 -1.150 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -7.081 -6.182 -2.230 1.00 0.00 H new ATOM 0 HE ARG B 328 -9.469 -5.264 -0.862 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -7.704 -8.096 -1.947 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -9.153 -9.091 -2.123 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -11.324 -6.553 -1.088 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.185 -8.225 -1.641 1.00 0.00 H new ATOM 732 N LEU B 329 -5.260 -8.260 1.614 1.00 0.00 N ATOM 733 CA LEU B 329 -4.011 -8.882 1.906 1.00 0.00 C ATOM 734 C LEU B 329 -2.965 -8.365 0.944 1.00 0.00 C ATOM 735 O LEU B 329 -3.118 -8.462 -0.255 1.00 0.00 O ATOM 736 CB LEU B 329 -4.266 -10.392 1.818 1.00 0.00 C ATOM 737 CG LEU B 329 -3.159 -11.242 2.463 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.140 -12.633 1.817 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.781 -10.607 2.294 1.00 0.00 C ATOM 0 H LEU B 329 -5.442 -8.098 0.623 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.623 -8.654 2.899 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.216 -10.620 2.301 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.366 -10.675 0.770 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.377 -11.311 3.529 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.355 -13.236 2.274 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.105 -13.118 1.968 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -2.947 -12.535 0.749 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.029 -11.240 2.764 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.556 -10.503 1.233 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.773 -9.624 2.764 1.00 0.00 H new ATOM 751 N LEU B 330 -1.915 -7.782 1.499 1.00 0.00 N ATOM 752 CA LEU B 330 -0.847 -7.219 0.711 1.00 0.00 C ATOM 753 C LEU B 330 0.301 -8.188 0.681 1.00 0.00 C ATOM 754 O LEU B 330 0.430 -9.014 1.576 1.00 0.00 O ATOM 755 CB LEU B 330 -0.425 -5.900 1.367 1.00 0.00 C ATOM 756 CG LEU B 330 0.900 -5.370 0.797 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.711 -4.955 -0.656 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.331 -4.167 1.625 1.00 0.00 C ATOM 0 H LEU B 330 -1.785 -7.689 2.506 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.168 -7.032 -0.314 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.207 -5.155 1.219 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.324 -6.046 2.442 1.00 0.00 H new ATOM 0 HG LEU B 330 1.662 -6.148 0.840 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.654 -4.580 -1.053 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.387 -5.816 -1.241 1.00 0.00 H new ATOM 0 HD13 LEU B 330 -0.044 -4.171 -0.715 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.271 -3.775 1.236 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.565 -3.394 1.569 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.466 -4.470 2.663 1.00 0.00 H new ATOM 770 N GLY B 331 1.159 -8.057 -0.319 1.00 0.00 N ATOM 771 CA GLY B 331 2.307 -8.903 -0.393 1.00 0.00 C ATOM 772 C GLY B 331 3.504 -8.120 -0.891 1.00 0.00 C ATOM 773 O GLY B 331 3.598 -7.782 -2.062 1.00 0.00 O ATOM 0 H GLY B 331 1.072 -7.378 -1.075 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.522 -9.323 0.590 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.108 -9.741 -1.061 1.00 0.00 H new ATOM 777 N ILE B 332 4.434 -7.862 0.001 1.00 0.00 N ATOM 778 CA ILE B 332 5.646 -7.173 -0.378 1.00 0.00 C ATOM 779 C ILE B 332 6.657 -8.202 -0.819 1.00 0.00 C ATOM 780 O ILE B 332 6.982 -9.127 -0.079 1.00 0.00 O ATOM 781 CB ILE B 332 6.234 -6.393 0.791 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.170 -5.479 1.399 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.424 -5.557 0.301 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.525 -4.633 0.301 1.00 0.00 C ATOM 0 H ILE B 332 4.375 -8.117 0.987 1.00 0.00 H new ATOM 0 HA ILE B 332 5.410 -6.471 -1.178 1.00 0.00 H new ATOM 0 HB ILE B 332 6.574 -7.092 1.555 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.411 -6.076 1.904 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.620 -4.832 2.152 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.845 -4.999 1.137 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.185 -6.217 -0.115 1.00 0.00 H new ATOM 0 HG23 ILE B 332 7.088 -4.861 -0.468 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.768 -3.984 0.740 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.288 -4.024 -0.185 1.00 0.00 H new ATOM 0 HD13 ILE B 332 4.059 -5.287 -0.436 1.00 0.00 H new ATOM 796 N THR B 333 7.148 -8.021 -2.017 1.00 0.00 N ATOM 797 CA THR B 333 8.117 -8.907 -2.581 1.00 0.00 C ATOM 798 C THR B 333 9.369 -8.120 -2.862 1.00 0.00 C ATOM 799 O THR B 333 9.299 -6.997 -3.346 1.00 0.00 O ATOM 800 CB THR B 333 7.557 -9.486 -3.874 1.00 0.00 C ATOM 801 OG1 THR B 333 7.860 -8.618 -4.952 1.00 0.00 O ATOM 802 CG2 THR B 333 6.038 -9.634 -3.744 1.00 0.00 C ATOM 0 H THR B 333 6.882 -7.249 -2.628 1.00 0.00 H new ATOM 0 HA THR B 333 8.346 -9.723 -1.896 1.00 0.00 H new ATOM 0 HB THR B 333 8.004 -10.462 -4.062 1.00 0.00 H new ATOM 0 HG1 THR B 333 7.052 -8.462 -5.483 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.632 -10.048 -4.667 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.807 -10.302 -2.914 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.592 -8.657 -3.558 1.00 0.00 H new ATOM 810 N LYS B 334 10.510 -8.701 -2.563 1.00 0.00 N ATOM 811 CA LYS B 334 11.784 -8.023 -2.795 1.00 0.00 C ATOM 812 C LYS B 334 11.942 -7.625 -4.262 1.00 0.00 C ATOM 813 O LYS B 334 13.033 -7.305 -4.708 1.00 0.00 O ATOM 814 CB LYS B 334 12.940 -8.932 -2.382 1.00 0.00 C ATOM 815 CG LYS B 334 13.784 -8.248 -1.303 1.00 0.00 C ATOM 816 CD LYS B 334 14.856 -9.221 -0.811 1.00 0.00 C ATOM 817 CE LYS B 334 14.547 -9.640 0.627 1.00 0.00 C ATOM 818 NZ LYS B 334 13.132 -10.102 0.717 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.591 -9.635 -2.161 1.00 0.00 H new ATOM 0 HA LYS B 334 11.797 -7.115 -2.192 1.00 0.00 H new ATOM 0 HB2 LYS B 334 12.553 -9.879 -2.006 1.00 0.00 H new ATOM 0 HB3 LYS B 334 13.560 -9.162 -3.249 1.00 0.00 H new ATOM 0 HG2 LYS B 334 14.250 -7.348 -1.705 1.00 0.00 H new ATOM 0 HG3 LYS B 334 13.151 -7.936 -0.473 1.00 0.00 H new ATOM 0 HD2 LYS B 334 14.889 -10.098 -1.457 1.00 0.00 H new ATOM 0 HD3 LYS B 334 15.838 -8.751 -0.861 1.00 0.00 H new ATOM 0 HE2 LYS B 334 15.222 -10.438 0.938 1.00 0.00 H new ATOM 0 HE3 LYS B 334 14.711 -8.802 1.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 13.038 -10.783 1.497 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 12.511 -9.286 0.893 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 12.859 -10.559 -0.176 1.00 0.00 H new ATOM 832 N GLU B 335 10.848 -7.662 -4.998 1.00 0.00 N ATOM 833 CA GLU B 335 10.838 -7.283 -6.400 1.00 0.00 C ATOM 834 C GLU B 335 9.523 -6.608 -6.760 1.00 0.00 C ATOM 835 O GLU B 335 9.329 -6.198 -7.905 1.00 0.00 O ATOM 836 CB GLU B 335 11.039 -8.517 -7.278 1.00 0.00 C ATOM 837 CG GLU B 335 10.034 -9.599 -6.873 1.00 0.00 C ATOM 838 CD GLU B 335 10.233 -10.843 -7.734 1.00 0.00 C ATOM 839 OE1 GLU B 335 11.298 -11.432 -7.650 1.00 0.00 O ATOM 840 OE2 GLU B 335 9.317 -11.189 -8.462 1.00 0.00 O1- ATOM 0 H GLU B 335 9.939 -7.956 -4.641 1.00 0.00 H new ATOM 0 HA GLU B 335 11.654 -6.581 -6.573 1.00 0.00 H new ATOM 0 HB2 GLU B 335 10.905 -8.256 -8.328 1.00 0.00 H new ATOM 0 HB3 GLU B 335 12.057 -8.892 -7.170 1.00 0.00 H new ATOM 0 HG2 GLU B 335 10.162 -9.851 -5.820 1.00 0.00 H new ATOM 0 HG3 GLU B 335 9.017 -9.225 -6.990 1.00 0.00 H new ATOM 847 N CYS B 336 8.591 -6.538 -5.806 1.00 0.00 N ATOM 848 CA CYS B 336 7.294 -5.966 -6.109 1.00 0.00 C ATOM 849 C CYS B 336 6.411 -5.825 -4.893 1.00 0.00 C ATOM 850 O CYS B 336 6.780 -6.164 -3.771 1.00 0.00 O ATOM 851 CB CYS B 336 6.575 -6.824 -7.156 1.00 0.00 C ATOM 852 SG CYS B 336 5.221 -7.743 -6.380 1.00 0.00 S ATOM 0 H CYS B 336 8.712 -6.862 -4.846 1.00 0.00 H new ATOM 0 HA CYS B 336 7.480 -4.964 -6.495 1.00 0.00 H new ATOM 0 HB2 CYS B 336 6.186 -6.190 -7.952 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.279 -7.517 -7.616 1.00 0.00 H new ATOM 0 HG CYS B 336 4.617 -8.465 -7.276 1.00 0.00 H new ATOM 858 N VAL B 337 5.233 -5.306 -5.163 1.00 0.00 N ATOM 859 CA VAL B 337 4.229 -5.078 -4.152 1.00 0.00 C ATOM 860 C VAL B 337 2.926 -5.530 -4.737 1.00 0.00 C ATOM 861 O VAL B 337 2.767 -5.449 -5.948 1.00 0.00 O ATOM 862 CB VAL B 337 4.199 -3.594 -3.853 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.372 -3.318 -2.600 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.638 -3.153 -3.641 1.00 0.00 C ATOM 0 H VAL B 337 4.944 -5.028 -6.101 1.00 0.00 H new ATOM 0 HA VAL B 337 4.430 -5.617 -3.226 1.00 0.00 H new ATOM 0 HB VAL B 337 3.741 -3.045 -4.676 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.361 -2.247 -2.400 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.351 -3.669 -2.753 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.812 -3.841 -1.751 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.663 -2.086 -3.422 1.00 0.00 H new ATOM 0 HG22 VAL B 337 6.068 -3.705 -2.805 1.00 0.00 H new ATOM 0 HG23 VAL B 337 6.216 -3.352 -4.543 1.00 0.00 H new ATOM 874 N MET B 338 2.015 -6.065 -3.940 1.00 0.00 N ATOM 875 CA MET B 338 0.799 -6.562 -4.564 1.00 0.00 C ATOM 876 C MET B 338 -0.406 -6.591 -3.646 1.00 0.00 C ATOM 877 O MET B 338 -0.292 -6.823 -2.447 1.00 0.00 O ATOM 878 CB MET B 338 1.039 -7.977 -5.081 1.00 0.00 C ATOM 879 CG MET B 338 2.019 -8.725 -4.175 1.00 0.00 C ATOM 880 SD MET B 338 2.352 -10.364 -4.863 1.00 0.00 S ATOM 881 CE MET B 338 2.839 -11.171 -3.319 1.00 0.00 C ATOM 0 H MET B 338 2.082 -6.164 -2.927 1.00 0.00 H new ATOM 0 HA MET B 338 0.570 -5.863 -5.368 1.00 0.00 H new ATOM 0 HB2 MET B 338 0.094 -8.518 -5.127 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.433 -7.937 -6.096 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.948 -8.162 -4.084 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.603 -8.818 -3.172 1.00 0.00 H new ATOM 0 HE1 MET B 338 3.355 -12.104 -3.543 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.504 -10.514 -2.759 1.00 0.00 H new ATOM 0 HE3 MET B 338 1.951 -11.382 -2.723 1.00 0.00 H new ATOM 891 N ARG B 339 -1.577 -6.430 -4.256 1.00 0.00 N ATOM 892 CA ARG B 339 -2.828 -6.512 -3.524 1.00 0.00 C ATOM 893 C ARG B 339 -3.367 -7.922 -3.647 1.00 0.00 C ATOM 894 O ARG B 339 -3.813 -8.341 -4.718 1.00 0.00 O ATOM 895 CB ARG B 339 -3.851 -5.530 -4.081 1.00 0.00 C ATOM 896 CG ARG B 339 -3.258 -4.122 -4.079 1.00 0.00 C ATOM 897 CD ARG B 339 -4.275 -3.135 -4.656 1.00 0.00 C ATOM 898 NE ARG B 339 -3.596 -2.119 -5.448 1.00 0.00 N ATOM 899 CZ ARG B 339 -2.717 -1.291 -4.897 1.00 0.00 C ATOM 900 NH1 ARG B 339 -2.466 -1.353 -3.618 1.00 0.00 N ATOM 901 NH2 ARG B 339 -2.106 -0.410 -5.634 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.681 -6.243 -5.253 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.646 -6.259 -2.479 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.132 -5.817 -5.094 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.760 -5.554 -3.479 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -2.990 -3.831 -3.063 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -2.342 -4.102 -4.669 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.998 -3.666 -5.275 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -4.834 -2.663 -3.848 1.00 0.00 H new ATOM 0 HE ARG B 339 -3.800 -2.042 -6.445 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -2.946 -2.040 -3.037 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -1.790 -0.714 -3.199 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -2.303 -0.356 -6.633 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -1.430 0.227 -5.212 1.00 0.00 H new ATOM 915 N VAL B 340 -3.289 -8.649 -2.551 1.00 0.00 N ATOM 916 CA VAL B 340 -3.735 -10.023 -2.510 1.00 0.00 C ATOM 917 C VAL B 340 -5.128 -10.132 -1.917 1.00 0.00 C ATOM 918 O VAL B 340 -5.536 -9.312 -1.098 1.00 0.00 O ATOM 919 CB VAL B 340 -2.737 -10.861 -1.727 1.00 0.00 C ATOM 920 CG1 VAL B 340 -2.935 -12.322 -2.070 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.328 -10.445 -2.108 1.00 0.00 C ATOM 0 H VAL B 340 -2.915 -8.303 -1.667 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.790 -10.404 -3.530 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.889 -10.710 -0.658 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.221 -12.927 -1.511 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -3.949 -12.623 -1.808 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.777 -12.470 -3.138 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.608 -11.043 -1.549 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.179 -10.602 -3.176 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.184 -9.391 -1.873 1.00 0.00 H new ATOM 931 N ASP B 341 -5.863 -11.138 -2.371 1.00 0.00 N ATOM 932 CA ASP B 341 -7.227 -11.339 -1.917 1.00 0.00 C ATOM 933 C ASP B 341 -7.257 -12.214 -0.679 1.00 0.00 C ATOM 934 O ASP B 341 -7.315 -13.428 -0.774 1.00 0.00 O ATOM 935 CB ASP B 341 -8.056 -11.989 -3.025 1.00 0.00 C ATOM 936 CG ASP B 341 -9.542 -11.776 -2.756 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.881 -11.470 -1.625 1.00 0.00 O1- ATOM 938 OD2 ASP B 341 -10.319 -11.922 -3.685 1.00 0.00 O ATOM 0 H ASP B 341 -5.536 -11.824 -3.051 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.652 -10.367 -1.668 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.788 -11.561 -3.991 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.836 -13.055 -3.077 1.00 0.00 H new ATOM 943 N GLU B 342 -7.222 -11.571 0.473 1.00 0.00 N ATOM 944 CA GLU B 342 -7.251 -12.268 1.756 1.00 0.00 C ATOM 945 C GLU B 342 -8.135 -13.502 1.677 1.00 0.00 C ATOM 946 O GLU B 342 -7.925 -14.488 2.385 1.00 0.00 O ATOM 947 CB GLU B 342 -7.818 -11.307 2.810 1.00 0.00 C ATOM 948 CG GLU B 342 -7.172 -11.535 4.175 1.00 0.00 C ATOM 949 CD GLU B 342 -8.224 -11.407 5.272 1.00 0.00 C ATOM 950 OE1 GLU B 342 -9.006 -10.473 5.209 1.00 0.00 O1- ATOM 951 OE2 GLU B 342 -8.229 -12.244 6.160 1.00 0.00 O ATOM 0 H GLU B 342 -7.173 -10.555 0.552 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.242 -12.584 2.020 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.651 -10.277 2.494 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.896 -11.445 2.888 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.715 -12.524 4.211 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.375 -10.809 4.336 1.00 0.00 H new ATOM 958 N LYS B 343 -9.117 -13.429 0.805 1.00 0.00 N ATOM 959 CA LYS B 343 -10.049 -14.523 0.604 1.00 0.00 C ATOM 960 C LYS B 343 -9.422 -15.660 -0.199 1.00 0.00 C ATOM 961 O LYS B 343 -9.620 -16.833 0.118 1.00 0.00 O ATOM 962 CB LYS B 343 -11.265 -14.008 -0.153 1.00 0.00 C ATOM 963 CG LYS B 343 -11.966 -12.935 0.677 1.00 0.00 C ATOM 964 CD LYS B 343 -12.923 -12.147 -0.218 1.00 0.00 C ATOM 965 CE LYS B 343 -14.050 -11.558 0.629 1.00 0.00 C ATOM 966 NZ LYS B 343 -14.535 -10.295 0.002 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.294 -12.615 0.217 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.330 -14.908 1.584 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -10.960 -13.597 -1.115 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -11.952 -14.829 -0.360 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.515 -13.396 1.499 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.230 -12.264 1.121 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.384 -11.349 -0.730 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.336 -12.798 -0.988 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -14.869 -12.273 0.712 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -13.695 -11.361 1.640 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -15.302 -9.894 0.578 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -13.752 -9.613 -0.055 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -14.890 -10.496 -0.955 1.00 0.00 H new ATOM 980 N THR B 344 -8.705 -15.305 -1.261 1.00 0.00 N ATOM 981 CA THR B 344 -8.099 -16.303 -2.132 1.00 0.00 C ATOM 982 C THR B 344 -6.577 -16.352 -1.989 1.00 0.00 C ATOM 983 O THR B 344 -5.944 -17.284 -2.482 1.00 0.00 O ATOM 984 CB THR B 344 -8.465 -15.986 -3.580 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.496 -15.107 -4.132 1.00 0.00 O ATOM 986 CG2 THR B 344 -9.845 -15.326 -3.627 1.00 0.00 C ATOM 0 H THR B 344 -8.531 -14.339 -1.537 1.00 0.00 H new ATOM 0 HA THR B 344 -8.484 -17.280 -1.840 1.00 0.00 H new ATOM 0 HB THR B 344 -8.487 -16.909 -4.159 1.00 0.00 H new ATOM 0 HG1 THR B 344 -7.941 -14.448 -4.705 1.00 0.00 H new ATOM 0 HG21 THR B 344 -10.105 -15.100 -4.661 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.587 -16.004 -3.206 1.00 0.00 H new ATOM 0 HG23 THR B 344 -9.827 -14.403 -3.048 1.00 0.00 H new ATOM 994 N LYS B 345 -5.994 -15.355 -1.329 1.00 0.00 N ATOM 995 CA LYS B 345 -4.552 -15.317 -1.152 1.00 0.00 C ATOM 996 C LYS B 345 -3.868 -15.114 -2.496 1.00 0.00 C ATOM 997 O LYS B 345 -2.643 -15.023 -2.577 1.00 0.00 O ATOM 998 CB LYS B 345 -4.078 -16.619 -0.517 1.00 0.00 C ATOM 999 CG LYS B 345 -2.738 -16.398 0.189 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.290 -17.704 0.849 1.00 0.00 C ATOM 1001 CE LYS B 345 -2.612 -17.659 2.345 1.00 0.00 C ATOM 1002 NZ LYS B 345 -2.302 -18.980 2.960 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.496 -14.571 -0.912 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.294 -14.485 -0.497 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -4.820 -16.977 0.197 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -3.973 -17.389 -1.281 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -1.988 -16.064 -0.527 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -2.835 -15.613 0.939 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -2.795 -18.551 0.383 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.220 -17.850 0.701 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -2.030 -16.875 2.830 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -3.664 -17.414 2.494 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -2.521 -18.950 3.976 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -2.876 -19.718 2.504 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -1.293 -19.196 2.829 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.675 -15.018 -3.547 1.00 0.00 N ATOM 1017 CA GLU B 346 -4.149 -14.797 -4.881 1.00 0.00 C ATOM 1018 C GLU B 346 -3.952 -13.312 -5.102 1.00 0.00 C ATOM 1019 O GLU B 346 -4.605 -12.485 -4.465 1.00 0.00 O ATOM 1020 CB GLU B 346 -5.102 -15.349 -5.934 1.00 0.00 C ATOM 1021 CG GLU B 346 -5.412 -16.810 -5.620 1.00 0.00 C ATOM 1022 CD GLU B 346 -5.312 -17.650 -6.889 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -4.204 -18.004 -7.255 1.00 0.00 O ATOM 1024 OE2 GLU B 346 -6.346 -17.925 -7.476 1.00 0.00 O1- ATOM 0 H GLU B 346 -5.691 -15.090 -3.497 1.00 0.00 H new ATOM 0 HA GLU B 346 -3.195 -15.316 -4.973 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -6.023 -14.765 -5.949 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -4.655 -15.265 -6.925 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -4.715 -17.185 -4.870 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -6.413 -16.895 -5.196 1.00 0.00 H new ATOM 1031 N VAL B 347 -3.029 -12.977 -5.976 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.727 -11.580 -6.239 1.00 0.00 C ATOM 1033 C VAL B 347 -3.677 -10.965 -7.241 1.00 0.00 C ATOM 1034 O VAL B 347 -3.955 -11.534 -8.297 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.296 -11.418 -6.719 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.065 -9.956 -7.110 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.365 -11.783 -5.568 1.00 0.00 C ATOM 0 H VAL B 347 -2.476 -13.644 -6.515 1.00 0.00 H new ATOM 0 HA VAL B 347 -2.853 -11.050 -5.295 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.105 -12.060 -7.579 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.039 -9.830 -7.456 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.754 -9.680 -7.908 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.237 -9.316 -6.244 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.671 -11.674 -5.889 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.554 -11.121 -4.723 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.545 -12.815 -5.268 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.144 -9.774 -6.904 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.033 -9.043 -7.777 1.00 0.00 C ATOM 1049 C ILE B 348 -4.235 -7.959 -8.470 1.00 0.00 C ATOM 1050 O ILE B 348 -4.544 -7.566 -9.597 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.175 -8.416 -6.973 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -6.910 -9.510 -6.193 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.151 -7.727 -7.929 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.844 -8.868 -5.165 1.00 0.00 C ATOM 0 H ILE B 348 -3.919 -9.297 -6.031 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.467 -9.721 -8.512 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.770 -7.683 -6.276 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -7.482 -10.137 -6.877 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -6.192 -10.158 -5.692 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -7.965 -7.280 -7.358 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.628 -6.949 -8.485 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.557 -8.460 -8.626 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -8.366 -9.648 -4.611 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.261 -8.260 -4.473 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -8.571 -8.238 -5.677 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.204 -7.471 -7.782 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.378 -6.422 -8.337 1.00 0.00 C ATOM 1068 C GLN B 349 -0.919 -6.638 -8.022 1.00 0.00 C ATOM 1069 O GLN B 349 -0.570 -7.288 -7.040 1.00 0.00 O ATOM 1070 CB GLN B 349 -2.792 -5.116 -7.726 1.00 0.00 C ATOM 1071 CG GLN B 349 -1.973 -3.977 -8.317 1.00 0.00 C ATOM 1072 CD GLN B 349 -2.701 -2.651 -8.110 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -3.925 -2.626 -7.982 1.00 0.00 O ATOM 1074 NE2 GLN B 349 -2.018 -1.541 -8.066 1.00 0.00 N ATOM 0 H GLN B 349 -2.930 -7.786 -6.851 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.508 -6.424 -9.419 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -3.853 -4.942 -7.905 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.653 -5.151 -6.645 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -0.991 -3.940 -7.845 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -1.809 -4.149 -9.381 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -1.004 -1.562 -8.172 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -2.498 -0.652 -7.925 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.076 -6.045 -8.848 1.00 0.00 N ATOM 1084 CA GLU B 350 1.362 -6.128 -8.655 1.00 0.00 C ATOM 1085 C GLU B 350 2.050 -4.846 -9.073 1.00 0.00 C ATOM 1086 O GLU B 350 1.620 -4.164 -10.003 1.00 0.00 O ATOM 1087 CB GLU B 350 1.988 -7.246 -9.479 1.00 0.00 C ATOM 1088 CG GLU B 350 1.432 -8.597 -9.060 1.00 0.00 C ATOM 1089 CD GLU B 350 1.883 -9.687 -10.026 1.00 0.00 C ATOM 1090 OE1 GLU B 350 2.997 -10.160 -9.877 1.00 0.00 O1- ATOM 1091 OE2 GLU B 350 1.103 -10.038 -10.897 1.00 0.00 O ATOM 0 H GLU B 350 -0.362 -5.499 -9.661 1.00 0.00 H new ATOM 0 HA GLU B 350 1.501 -6.319 -7.591 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.791 -7.078 -10.538 1.00 0.00 H new ATOM 0 HB3 GLU B 350 3.070 -7.237 -9.351 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.767 -8.837 -8.051 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.343 -8.555 -9.033 1.00 0.00 H new ATOM 1098 N TRP B 351 3.152 -4.562 -8.411 1.00 0.00 N ATOM 1099 CA TRP B 351 3.949 -3.389 -8.745 1.00 0.00 C ATOM 1100 C TRP B 351 5.354 -3.523 -8.197 1.00 0.00 C ATOM 1101 O TRP B 351 5.542 -3.933 -7.068 1.00 0.00 O ATOM 1102 CB TRP B 351 3.309 -2.125 -8.217 1.00 0.00 C ATOM 1103 CG TRP B 351 4.092 -0.978 -8.733 1.00 0.00 C ATOM 1104 CD1 TRP B 351 5.017 -0.306 -8.035 1.00 0.00 C ATOM 1105 CD2 TRP B 351 4.065 -0.384 -10.059 1.00 0.00 C ATOM 1106 NE1 TRP B 351 5.542 0.685 -8.833 1.00 0.00 N ATOM 1107 CE2 TRP B 351 4.991 0.680 -10.092 1.00 0.00 C ATOM 1108 CE3 TRP B 351 3.322 -0.653 -11.213 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 5.181 1.457 -11.232 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 3.513 0.123 -12.376 1.00 0.00 C ATOM 1111 CH2 TRP B 351 4.440 1.180 -12.379 1.00 0.00 C ATOM 0 H TRP B 351 3.519 -5.121 -7.641 1.00 0.00 H new ATOM 0 HA TRP B 351 3.998 -3.322 -9.832 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.271 -2.057 -8.542 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.303 -2.125 -7.127 1.00 0.00 H new ATOM 0 HD1 TRP B 351 5.304 -0.509 -7.014 1.00 0.00 H new ATOM 0 HE1 TRP B 351 6.256 1.345 -8.526 1.00 0.00 H new ATOM 0 HE3 TRP B 351 2.600 -1.457 -11.214 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 5.896 2.267 -11.227 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 2.945 -0.096 -13.268 1.00 0.00 H new ATOM 0 HH2 TRP B 351 4.578 1.776 -13.269 1.00 0.00 H new ATOM 1122 N SER B 352 6.334 -3.184 -9.022 1.00 0.00 N ATOM 1123 CA SER B 352 7.726 -3.291 -8.633 1.00 0.00 C ATOM 1124 C SER B 352 8.003 -2.536 -7.352 1.00 0.00 C ATOM 1125 O SER B 352 7.545 -1.411 -7.158 1.00 0.00 O ATOM 1126 CB SER B 352 8.638 -2.756 -9.731 1.00 0.00 C ATOM 1127 OG SER B 352 7.852 -2.158 -10.751 1.00 0.00 O ATOM 0 H SER B 352 6.186 -2.832 -9.968 1.00 0.00 H new ATOM 0 HA SER B 352 7.931 -4.349 -8.471 1.00 0.00 H new ATOM 0 HB2 SER B 352 9.333 -2.025 -9.317 1.00 0.00 H new ATOM 0 HB3 SER B 352 9.238 -3.566 -10.147 1.00 0.00 H new ATOM 0 HG SER B 352 7.516 -2.853 -11.355 1.00 0.00 H new ATOM 1133 N LEU B 353 8.796 -3.153 -6.502 1.00 0.00 N ATOM 1134 CA LEU B 353 9.190 -2.542 -5.270 1.00 0.00 C ATOM 1135 C LEU B 353 10.288 -1.557 -5.618 1.00 0.00 C ATOM 1136 O LEU B 353 10.368 -0.457 -5.072 1.00 0.00 O ATOM 1137 CB LEU B 353 9.684 -3.647 -4.333 1.00 0.00 C ATOM 1138 CG LEU B 353 9.357 -3.336 -2.873 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.528 -4.589 -2.048 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.319 -2.300 -2.345 1.00 0.00 C ATOM 0 H LEU B 353 9.179 -4.086 -6.653 1.00 0.00 H new ATOM 0 HA LEU B 353 8.378 -2.017 -4.766 1.00 0.00 H new ATOM 0 HB2 LEU B 353 9.226 -4.595 -4.615 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.761 -3.767 -4.447 1.00 0.00 H new ATOM 0 HG LEU B 353 8.333 -2.968 -2.810 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.296 -4.373 -1.005 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.854 -5.362 -2.417 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.558 -4.938 -2.126 1.00 0.00 H new ATOM 0 HD21 LEU B 353 10.082 -2.081 -1.304 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.338 -2.681 -2.413 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.232 -1.388 -2.936 1.00 0.00 H new ATOM 1152 N THR B 354 11.098 -1.951 -6.598 1.00 0.00 N ATOM 1153 CA THR B 354 12.159 -1.091 -7.083 1.00 0.00 C ATOM 1154 C THR B 354 11.571 0.035 -7.917 1.00 0.00 C ATOM 1155 O THR B 354 12.297 0.794 -8.555 1.00 0.00 O ATOM 1156 CB THR B 354 13.130 -1.895 -7.945 1.00 0.00 C ATOM 1157 OG1 THR B 354 13.520 -3.067 -7.256 1.00 0.00 O ATOM 1158 CG2 THR B 354 14.356 -1.048 -8.257 1.00 0.00 C ATOM 0 H THR B 354 11.036 -2.856 -7.065 1.00 0.00 H new ATOM 0 HA THR B 354 12.690 -0.675 -6.227 1.00 0.00 H new ATOM 0 HB THR B 354 12.640 -2.175 -8.877 1.00 0.00 H new ATOM 0 HG1 THR B 354 13.866 -3.723 -7.896 1.00 0.00 H new ATOM 0 HG21 THR B 354 15.048 -1.623 -8.872 1.00 0.00 H new ATOM 0 HG22 THR B 354 14.051 -0.151 -8.796 1.00 0.00 H new ATOM 0 HG23 THR B 354 14.848 -0.763 -7.327 1.00 0.00 H new ATOM 1166 N ASN B 355 10.249 0.139 -7.899 1.00 0.00 N ATOM 1167 CA ASN B 355 9.577 1.193 -8.656 1.00 0.00 C ATOM 1168 C ASN B 355 8.928 2.179 -7.712 1.00 0.00 C ATOM 1169 O ASN B 355 8.341 3.171 -8.142 1.00 0.00 O ATOM 1170 CB ASN B 355 8.512 0.609 -9.581 1.00 0.00 C ATOM 1171 CG ASN B 355 9.167 0.077 -10.853 1.00 0.00 C ATOM 1172 OD1 ASN B 355 10.372 -0.420 -10.796 1.00 0.00 O flip ATOM 1173 ND2 ASN B 355 8.563 0.115 -11.925 1.00 0.00 N flip ATOM 0 H ASN B 355 9.627 -0.480 -7.379 1.00 0.00 H new ATOM 0 HA ASN B 355 10.328 1.701 -9.260 1.00 0.00 H new ATOM 0 HB2 ASN B 355 7.977 -0.194 -9.073 1.00 0.00 H new ATOM 0 HB3 ASN B 355 7.777 1.373 -9.832 1.00 0.00 H new ATOM 0 HD21 ASN B 355 7.621 0.504 -11.966 1.00 0.00 H new ATOM 0 HD22 ASN B 355 9.004 -0.243 -12.772 1.00 0.00 H new ATOM 1180 N ILE B 356 9.030 1.907 -6.420 1.00 0.00 N ATOM 1181 CA ILE B 356 8.436 2.788 -5.441 1.00 0.00 C ATOM 1182 C ILE B 356 9.046 4.187 -5.514 1.00 0.00 C ATOM 1183 O ILE B 356 10.230 4.339 -5.815 1.00 0.00 O ATOM 1184 CB ILE B 356 8.633 2.183 -4.070 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.728 0.955 -3.952 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.259 3.214 -3.019 1.00 0.00 C ATOM 1187 CD1 ILE B 356 7.986 0.227 -2.633 1.00 0.00 C ATOM 0 H ILE B 356 9.512 1.095 -6.034 1.00 0.00 H new ATOM 0 HA ILE B 356 7.371 2.895 -5.647 1.00 0.00 H new ATOM 0 HB ILE B 356 9.671 1.887 -3.922 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.683 1.259 -4.008 1.00 0.00 H new ATOM 0 HG13 ILE B 356 7.909 0.280 -4.789 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.398 2.788 -2.025 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.895 4.093 -3.129 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.216 3.503 -3.148 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.334 -0.644 -2.565 1.00 0.00 H new ATOM 0 HD12 ILE B 356 9.027 -0.094 -2.592 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.781 0.900 -1.800 1.00 0.00 H new ATOM 1199 N LYS B 357 8.230 5.210 -5.231 1.00 0.00 N ATOM 1200 CA LYS B 357 8.710 6.593 -5.269 1.00 0.00 C ATOM 1201 C LYS B 357 8.853 7.112 -3.846 1.00 0.00 C ATOM 1202 O LYS B 357 9.869 7.701 -3.478 1.00 0.00 O ATOM 1203 CB LYS B 357 7.739 7.466 -6.077 1.00 0.00 C ATOM 1204 CG LYS B 357 8.509 8.618 -6.725 1.00 0.00 C ATOM 1205 CD LYS B 357 7.543 9.509 -7.509 1.00 0.00 C ATOM 1206 CE LYS B 357 7.965 9.549 -8.980 1.00 0.00 C ATOM 1207 NZ LYS B 357 7.098 10.509 -9.720 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.248 5.107 -4.977 1.00 0.00 H new ATOM 0 HA LYS B 357 9.683 6.632 -5.758 1.00 0.00 H new ATOM 0 HB2 LYS B 357 7.246 6.867 -6.843 1.00 0.00 H new ATOM 0 HB3 LYS B 357 6.957 7.857 -5.426 1.00 0.00 H new ATOM 0 HG2 LYS B 357 9.019 9.203 -5.960 1.00 0.00 H new ATOM 0 HG3 LYS B 357 9.278 8.225 -7.390 1.00 0.00 H new ATOM 0 HD2 LYS B 357 6.526 9.126 -7.422 1.00 0.00 H new ATOM 0 HD3 LYS B 357 7.541 10.516 -7.093 1.00 0.00 H new ATOM 0 HE2 LYS B 357 9.010 9.849 -9.062 1.00 0.00 H new ATOM 0 HE3 LYS B 357 7.883 8.555 -9.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 6.436 9.983 -10.326 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 6.562 11.087 -9.041 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 7.690 11.128 -10.310 1.00 0.00 H new ATOM 1221 N ARG B 358 7.838 6.838 -3.047 1.00 0.00 N ATOM 1222 CA ARG B 358 7.834 7.209 -1.646 1.00 0.00 C ATOM 1223 C ARG B 358 6.581 6.632 -1.004 1.00 0.00 C ATOM 1224 O ARG B 358 5.506 6.663 -1.580 1.00 0.00 O ATOM 1225 CB ARG B 358 7.888 8.728 -1.480 1.00 0.00 C ATOM 1226 CG ARG B 358 6.901 9.393 -2.430 1.00 0.00 C ATOM 1227 CD ARG B 358 7.160 10.893 -2.496 1.00 0.00 C ATOM 1228 NE ARG B 358 5.958 11.625 -2.120 1.00 0.00 N ATOM 1229 CZ ARG B 358 5.731 12.853 -2.573 1.00 0.00 C ATOM 1230 NH1 ARG B 358 6.597 13.430 -3.361 1.00 0.00 N ATOM 1231 NH2 ARG B 358 4.643 13.482 -2.229 1.00 0.00 N1+ ATOM 0 H ARG B 358 6.994 6.352 -3.352 1.00 0.00 H new ATOM 0 HA ARG B 358 8.719 6.805 -1.154 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.652 8.998 -0.451 1.00 0.00 H new ATOM 0 HB3 ARG B 358 8.897 9.088 -1.681 1.00 0.00 H new ATOM 0 HG2 ARG B 358 6.993 8.957 -3.425 1.00 0.00 H new ATOM 0 HG3 ARG B 358 5.881 9.208 -2.094 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.980 11.158 -1.829 1.00 0.00 H new ATOM 0 HD3 ARG B 358 7.466 11.173 -3.504 1.00 0.00 H new ATOM 0 HE ARG B 358 5.279 11.187 -1.498 1.00 0.00 H new ATOM 0 HH11 ARG B 358 7.449 12.938 -3.630 1.00 0.00 H new ATOM 0 HH12 ARG B 358 6.422 14.373 -3.708 1.00 0.00 H new ATOM 0 HH21 ARG B 358 3.967 13.031 -1.613 1.00 0.00 H new ATOM 0 HH22 ARG B 358 4.468 14.425 -2.576 1.00 0.00 H new ATOM 1245 N TRP B 359 6.735 6.065 0.163 1.00 0.00 N ATOM 1246 CA TRP B 359 5.627 5.437 0.850 1.00 0.00 C ATOM 1247 C TRP B 359 5.391 6.110 2.188 1.00 0.00 C ATOM 1248 O TRP B 359 6.137 7.012 2.566 1.00 0.00 O ATOM 1249 CB TRP B 359 5.944 3.954 1.009 1.00 0.00 C ATOM 1250 CG TRP B 359 7.251 3.779 1.702 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.396 3.350 2.967 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.587 4.017 1.194 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.745 3.294 3.270 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.521 3.715 2.211 1.00 0.00 C ATOM 1255 CE3 TRP B 359 9.069 4.460 -0.038 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.894 3.860 2.007 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.446 4.611 -0.249 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.358 4.316 0.776 1.00 0.00 C ATOM 0 H TRP B 359 7.622 6.023 0.665 1.00 0.00 H new ATOM 0 HA TRP B 359 4.708 5.543 0.274 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.154 3.465 1.578 1.00 0.00 H new ATOM 0 HB3 TRP B 359 5.976 3.474 0.031 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.591 3.091 3.638 1.00 0.00 H new ATOM 0 HE1 TRP B 359 9.119 2.980 4.166 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.376 4.688 -0.834 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.590 3.621 2.797 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.808 4.956 -1.206 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.418 4.442 0.610 1.00 0.00 H new ATOM 1269 N ALA B 360 4.344 5.708 2.899 1.00 0.00 N ATOM 1270 CA ALA B 360 4.059 6.353 4.170 1.00 0.00 C ATOM 1271 C ALA B 360 3.205 5.485 5.069 1.00 0.00 C ATOM 1272 O ALA B 360 1.985 5.419 4.929 1.00 0.00 O ATOM 1273 CB ALA B 360 3.352 7.677 3.931 1.00 0.00 C ATOM 0 H ALA B 360 3.700 4.965 2.628 1.00 0.00 H new ATOM 0 HA ALA B 360 5.013 6.520 4.671 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.141 8.155 4.888 1.00 0.00 H new ATOM 0 HB2 ALA B 360 3.990 8.328 3.333 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.417 7.499 3.401 1.00 0.00 H new ATOM 1279 N ALA B 361 3.869 4.840 6.000 1.00 0.00 N ATOM 1280 CA ALA B 361 3.207 3.987 6.954 1.00 0.00 C ATOM 1281 C ALA B 361 2.607 4.810 8.090 1.00 0.00 C ATOM 1282 O ALA B 361 3.189 5.810 8.513 1.00 0.00 O ATOM 1283 CB ALA B 361 4.195 2.988 7.525 1.00 0.00 C ATOM 0 H ALA B 361 4.881 4.893 6.116 1.00 0.00 H new ATOM 0 HA ALA B 361 2.404 3.458 6.441 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.688 2.346 8.246 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.602 2.378 6.719 1.00 0.00 H new ATOM 0 HB3 ALA B 361 5.006 3.521 8.021 1.00 0.00 H new ATOM 1289 N SER B 362 1.445 4.386 8.579 1.00 0.00 N ATOM 1290 CA SER B 362 0.782 5.085 9.664 1.00 0.00 C ATOM 1291 C SER B 362 0.372 4.084 10.747 1.00 0.00 C ATOM 1292 O SER B 362 0.530 2.877 10.568 1.00 0.00 O ATOM 1293 CB SER B 362 -0.437 5.819 9.111 1.00 0.00 C ATOM 1294 OG SER B 362 -0.411 5.770 7.690 1.00 0.00 O ATOM 0 H SER B 362 0.948 3.563 8.239 1.00 0.00 H new ATOM 0 HA SER B 362 1.459 5.813 10.111 1.00 0.00 H new ATOM 0 HB2 SER B 362 -1.352 5.361 9.485 1.00 0.00 H new ATOM 0 HB3 SER B 362 -0.437 6.855 9.451 1.00 0.00 H new ATOM 0 HG SER B 362 -0.248 4.849 7.397 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.136 4.549 11.862 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.549 3.653 12.975 1.00 0.00 C ATOM 1302 C PRO B 363 -1.881 2.971 12.695 1.00 0.00 C ATOM 1303 O PRO B 363 -2.301 2.081 13.428 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.671 4.583 14.179 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.844 5.965 13.637 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.377 5.964 12.181 1.00 0.00 C ATOM 0 HA PRO B 363 0.167 2.845 13.127 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.521 4.302 14.801 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.218 4.522 14.807 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.888 6.272 13.702 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.265 6.679 14.222 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.133 6.394 11.523 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.529 6.557 12.056 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.535 3.410 11.633 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.828 2.861 11.245 1.00 0.00 C ATOM 1316 C LYS B 364 -3.845 2.502 9.774 1.00 0.00 C ATOM 1317 O LYS B 364 -4.665 1.706 9.326 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.926 3.883 11.495 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.733 4.498 12.876 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.942 5.368 13.226 1.00 0.00 C ATOM 1321 CE LYS B 364 -5.469 6.780 13.574 1.00 0.00 C ATOM 1322 NZ LYS B 364 -6.649 7.640 13.868 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.191 4.149 11.020 1.00 0.00 H new ATOM 0 HA LYS B 364 -3.998 1.965 11.842 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.897 4.660 10.731 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.904 3.407 11.429 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.611 3.712 13.621 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.823 5.098 12.894 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -6.635 5.402 12.385 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.483 4.936 14.068 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -4.803 6.750 14.437 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -4.898 7.198 12.745 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -6.328 8.601 14.105 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -7.268 7.678 13.033 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -7.176 7.243 14.672 1.00 0.00 H new ATOM 1336 N SER B 365 -2.945 3.102 9.021 1.00 0.00 N ATOM 1337 CA SER B 365 -2.891 2.844 7.595 1.00 0.00 C ATOM 1338 C SER B 365 -1.494 2.978 7.054 1.00 0.00 C ATOM 1339 O SER B 365 -0.587 3.450 7.731 1.00 0.00 O ATOM 1340 CB SER B 365 -3.811 3.804 6.850 1.00 0.00 C ATOM 1341 OG SER B 365 -3.411 5.143 7.108 1.00 0.00 O ATOM 0 H SER B 365 -2.249 3.763 9.366 1.00 0.00 H new ATOM 0 HA SER B 365 -3.221 1.817 7.441 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.774 3.602 5.779 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.843 3.654 7.167 1.00 0.00 H new ATOM 0 HG SER B 365 -4.002 5.759 6.627 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.338 2.549 5.819 1.00 0.00 N ATOM 1348 CA PHE B 366 -0.053 2.621 5.164 1.00 0.00 C ATOM 1349 C PHE B 366 -0.269 3.006 3.725 1.00 0.00 C ATOM 1350 O PHE B 366 -1.376 2.868 3.208 1.00 0.00 O ATOM 1351 CB PHE B 366 0.673 1.293 5.326 1.00 0.00 C ATOM 1352 CG PHE B 366 1.443 0.923 4.095 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.723 1.444 3.890 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.893 0.017 3.182 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.458 1.052 2.764 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.621 -0.365 2.055 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.902 0.147 1.848 1.00 0.00 C ATOM 0 H PHE B 366 -2.084 2.148 5.251 1.00 0.00 H new ATOM 0 HA PHE B 366 0.582 3.382 5.616 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.353 1.353 6.175 1.00 0.00 H new ATOM 0 HB3 PHE B 366 -0.050 0.509 5.551 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.143 2.145 4.596 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.095 -0.387 3.350 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.450 1.446 2.601 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.193 -1.056 1.344 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.468 -0.155 0.979 1.00 0.00 H new ATOM 1367 N THR B 367 0.746 3.580 3.103 1.00 0.00 N ATOM 1368 CA THR B 367 0.559 4.076 1.757 1.00 0.00 C ATOM 1369 C THR B 367 1.802 3.946 0.904 1.00 0.00 C ATOM 1370 O THR B 367 2.914 3.864 1.408 1.00 0.00 O ATOM 1371 CB THR B 367 0.155 5.542 1.845 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.118 5.649 2.468 1.00 0.00 O ATOM 1373 CG2 THR B 367 0.100 6.144 0.449 1.00 0.00 C ATOM 0 H THR B 367 1.679 3.710 3.495 1.00 0.00 H new ATOM 0 HA THR B 367 -0.214 3.474 1.278 1.00 0.00 H new ATOM 0 HB THR B 367 0.891 6.085 2.438 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.635 6.360 2.035 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.189 7.193 0.516 1.00 0.00 H new ATOM 0 HG22 THR B 367 1.081 6.068 -0.019 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.632 5.604 -0.152 1.00 0.00 H new ATOM 1381 N LEU B 368 1.580 3.921 -0.401 1.00 0.00 N ATOM 1382 CA LEU B 368 2.652 3.788 -1.359 1.00 0.00 C ATOM 1383 C LEU B 368 2.553 4.828 -2.450 1.00 0.00 C ATOM 1384 O LEU B 368 1.462 5.059 -2.953 1.00 0.00 O ATOM 1385 CB LEU B 368 2.521 2.440 -2.025 1.00 0.00 C ATOM 1386 CG LEU B 368 3.339 1.438 -1.258 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.798 0.034 -1.536 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.806 1.547 -1.675 1.00 0.00 C ATOM 0 H LEU B 368 0.652 3.993 -0.819 1.00 0.00 H new ATOM 0 HA LEU B 368 3.598 3.907 -0.830 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.476 2.132 -2.052 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.864 2.495 -3.058 1.00 0.00 H new ATOM 0 HG LEU B 368 3.270 1.638 -0.189 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.386 -0.699 -0.983 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.756 -0.024 -1.220 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.866 -0.177 -2.603 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.397 0.820 -1.118 1.00 0.00 H new ATOM 0 HD22 LEU B 368 4.897 1.347 -2.743 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.171 2.552 -1.462 1.00 0.00 H new ATOM 1400 N ASP B 369 3.687 5.401 -2.872 1.00 0.00 N ATOM 1401 CA ASP B 369 3.646 6.348 -3.973 1.00 0.00 C ATOM 1402 C ASP B 369 4.430 5.829 -5.156 1.00 0.00 C ATOM 1403 O ASP B 369 5.641 6.017 -5.249 1.00 0.00 O ATOM 1404 CB ASP B 369 4.235 7.695 -3.593 1.00 0.00 C ATOM 1405 CG ASP B 369 3.834 8.743 -4.623 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.832 8.414 -5.797 1.00 0.00 O ATOM 1407 OD2 ASP B 369 3.530 9.855 -4.224 1.00 0.00 O1- ATOM 0 H ASP B 369 4.612 5.228 -2.478 1.00 0.00 H new ATOM 0 HA ASP B 369 2.593 6.470 -4.227 1.00 0.00 H new ATOM 0 HB2 ASP B 369 3.883 7.990 -2.605 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.321 7.624 -3.537 1.00 0.00 H new ATOM 1412 N PHE B 370 3.718 5.214 -6.068 1.00 0.00 N ATOM 1413 CA PHE B 370 4.338 4.720 -7.302 1.00 0.00 C ATOM 1414 C PHE B 370 3.491 5.042 -8.518 1.00 0.00 C ATOM 1415 O PHE B 370 2.596 4.281 -8.882 1.00 0.00 O ATOM 1416 CB PHE B 370 4.550 3.219 -7.278 1.00 0.00 C ATOM 1417 CG PHE B 370 3.248 2.525 -7.002 1.00 0.00 C ATOM 1418 CD1 PHE B 370 2.721 2.576 -5.725 1.00 0.00 C ATOM 1419 CD2 PHE B 370 2.586 1.816 -8.007 1.00 0.00 C ATOM 1420 CE1 PHE B 370 1.524 1.914 -5.429 1.00 0.00 C ATOM 1421 CE2 PHE B 370 1.386 1.158 -7.724 1.00 0.00 C ATOM 1422 CZ PHE B 370 0.856 1.204 -6.432 1.00 0.00 C ATOM 0 H PHE B 370 2.716 5.038 -5.993 1.00 0.00 H new ATOM 0 HA PHE B 370 5.302 5.225 -7.365 1.00 0.00 H new ATOM 0 HB2 PHE B 370 4.955 2.885 -8.233 1.00 0.00 H new ATOM 0 HB3 PHE B 370 5.281 2.958 -6.513 1.00 0.00 H new ATOM 0 HD1 PHE B 370 3.235 3.129 -4.953 1.00 0.00 H new ATOM 0 HD2 PHE B 370 3.002 1.776 -9.003 1.00 0.00 H new ATOM 0 HE1 PHE B 370 1.117 1.951 -4.429 1.00 0.00 H new ATOM 0 HE2 PHE B 370 0.870 0.615 -8.502 1.00 0.00 H new ATOM 0 HZ PHE B 370 -0.068 0.692 -6.208 1.00 0.00 H new ATOM 1432 N GLY B 371 3.797 6.159 -9.155 1.00 0.00 N ATOM 1433 CA GLY B 371 3.072 6.557 -10.355 1.00 0.00 C ATOM 1434 C GLY B 371 2.668 8.013 -10.277 1.00 0.00 C ATOM 1435 O GLY B 371 1.842 8.485 -11.049 1.00 0.00 O ATOM 0 H GLY B 371 4.534 6.802 -8.867 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.696 6.394 -11.234 1.00 0.00 H new ATOM 0 HA3 GLY B 371 2.185 5.934 -10.474 1.00 0.00 H new ATOM 1439 N ASP B 372 3.244 8.701 -9.312 1.00 0.00 N ATOM 1440 CA ASP B 372 2.944 10.109 -9.094 1.00 0.00 C ATOM 1441 C ASP B 372 2.849 10.873 -10.401 1.00 0.00 C ATOM 1442 O ASP B 372 2.301 11.975 -10.441 1.00 0.00 O ATOM 1443 CB ASP B 372 4.029 10.731 -8.217 1.00 0.00 C ATOM 1444 CG ASP B 372 3.532 12.035 -7.605 1.00 0.00 C ATOM 1445 OD1 ASP B 372 3.100 12.892 -8.358 1.00 0.00 O ATOM 1446 OD2 ASP B 372 3.589 12.156 -6.393 1.00 0.00 O1- ATOM 0 H ASP B 372 3.926 8.310 -8.662 1.00 0.00 H new ATOM 0 HA ASP B 372 1.975 10.173 -8.598 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.311 10.035 -7.427 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.923 10.918 -8.811 1.00 0.00 H new ATOM 1451 N TYR B 373 3.354 10.290 -11.472 1.00 0.00 N ATOM 1452 CA TYR B 373 3.275 10.943 -12.754 1.00 0.00 C ATOM 1453 C TYR B 373 1.826 11.281 -13.018 1.00 0.00 C ATOM 1454 O TYR B 373 1.490 12.349 -13.528 1.00 0.00 O ATOM 1455 CB TYR B 373 3.818 10.012 -13.825 1.00 0.00 C ATOM 1456 CG TYR B 373 4.905 9.164 -13.211 1.00 0.00 C ATOM 1457 CD1 TYR B 373 6.049 9.775 -12.695 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.773 7.775 -13.163 1.00 0.00 C ATOM 1459 CE1 TYR B 373 7.068 8.999 -12.130 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.793 6.993 -12.602 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.941 7.606 -12.086 1.00 0.00 C ATOM 1462 OH TYR B 373 7.946 6.839 -11.534 1.00 0.00 O ATOM 0 H TYR B 373 3.815 9.380 -11.476 1.00 0.00 H new ATOM 0 HA TYR B 373 3.868 11.857 -12.765 1.00 0.00 H new ATOM 0 HB2 TYR B 373 3.021 9.381 -14.219 1.00 0.00 H new ATOM 0 HB3 TYR B 373 4.213 10.587 -14.663 1.00 0.00 H new ATOM 0 HD1 TYR B 373 6.148 10.850 -12.732 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.886 7.303 -13.558 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.951 9.475 -11.729 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.693 5.918 -12.568 1.00 0.00 H new ATOM 0 HH TYR B 373 7.699 5.892 -11.582 1.00 0.00 H new ATOM 1472 N GLN B 374 0.979 10.368 -12.594 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.452 10.541 -12.694 1.00 0.00 C ATOM 1474 C GLN B 374 -1.025 10.337 -11.308 1.00 0.00 C ATOM 1475 O GLN B 374 -1.027 11.250 -10.483 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.042 9.517 -13.660 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.245 8.212 -13.583 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.157 7.031 -13.900 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -1.535 6.828 -15.055 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -1.538 6.235 -12.939 1.00 0.00 N ATOM 0 H GLN B 374 1.264 9.485 -12.170 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.694 11.534 -13.072 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.087 9.331 -13.413 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.020 9.908 -14.677 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.586 8.241 -14.287 1.00 0.00 H new ATOM 0 HG3 GLN B 374 0.184 8.095 -12.588 1.00 0.00 H new ATOM 0 HE21 GLN B 374 -1.225 6.403 -11.983 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -2.149 5.444 -13.144 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.410 9.105 -11.030 1.00 0.00 N ATOM 1490 CA ASP B 375 -1.864 8.746 -9.711 1.00 0.00 C ATOM 1491 C ASP B 375 -1.106 7.511 -9.282 1.00 0.00 C ATOM 1492 O ASP B 375 -1.461 6.387 -9.637 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.361 8.468 -9.725 1.00 0.00 C ATOM 1494 CG ASP B 375 -3.941 8.665 -8.328 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.369 8.137 -7.390 1.00 0.00 O ATOM 1496 OD2 ASP B 375 -4.950 9.343 -8.217 1.00 0.00 O1- ATOM 0 H ASP B 375 -1.415 8.340 -11.705 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.683 9.563 -9.013 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -3.856 9.135 -10.431 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.547 7.449 -10.065 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.052 7.735 -8.534 1.00 0.00 N ATOM 1502 CA GLY B 376 0.787 6.642 -8.068 1.00 0.00 C ATOM 1503 C GLY B 376 0.482 6.259 -6.634 1.00 0.00 C ATOM 1504 O GLY B 376 1.110 5.361 -6.078 1.00 0.00 O ATOM 0 H GLY B 376 0.250 8.661 -8.232 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.643 5.775 -8.713 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.835 6.930 -8.151 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.416 6.993 -6.015 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.712 6.770 -4.613 1.00 0.00 C ATOM 1510 C TYR B 377 -1.752 5.703 -4.363 1.00 0.00 C ATOM 1511 O TYR B 377 -2.950 5.931 -4.531 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.157 8.073 -3.976 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.584 9.212 -4.775 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.744 9.150 -5.210 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.376 10.314 -5.097 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.282 10.190 -5.966 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -0.839 11.362 -5.853 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.490 11.301 -6.290 1.00 0.00 C ATOM 1519 OH TYR B 377 1.015 12.333 -7.038 1.00 0.00 O ATOM 0 H TYR B 377 -0.951 7.743 -6.453 1.00 0.00 H new ATOM 0 HA TYR B 377 0.211 6.406 -4.160 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.245 8.133 -3.956 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -0.816 8.126 -2.942 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.354 8.294 -4.960 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.402 10.358 -4.763 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.307 10.140 -6.302 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.450 12.218 -6.099 1.00 0.00 H new ATOM 0 HH TYR B 377 0.330 13.022 -7.171 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.279 4.557 -3.880 1.00 0.00 N ATOM 1530 CA TYR B 378 -2.185 3.472 -3.511 1.00 0.00 C ATOM 1531 C TYR B 378 -2.002 3.161 -2.039 1.00 0.00 C ATOM 1532 O TYR B 378 -0.878 2.984 -1.571 1.00 0.00 O ATOM 1533 CB TYR B 378 -1.938 2.228 -4.347 1.00 0.00 C ATOM 1534 CG TYR B 378 -3.152 1.978 -5.206 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -4.285 1.366 -4.658 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -3.140 2.362 -6.548 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -5.410 1.138 -5.458 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -4.264 2.134 -7.350 1.00 0.00 C ATOM 1539 CZ TYR B 378 -5.400 1.521 -6.805 1.00 0.00 C ATOM 1540 OH TYR B 378 -6.509 1.295 -7.595 1.00 0.00 O ATOM 0 H TYR B 378 -0.289 4.357 -3.736 1.00 0.00 H new ATOM 0 HA TYR B 378 -3.210 3.791 -3.702 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -1.054 2.360 -4.971 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.748 1.370 -3.702 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -4.291 1.070 -3.619 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -2.264 2.835 -6.967 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -6.286 0.667 -5.037 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -4.256 2.430 -8.388 1.00 0.00 H new ATOM 0 HH TYR B 378 -6.336 1.622 -8.503 1.00 0.00 H new ATOM 1550 N SER B 379 -3.102 3.156 -1.299 1.00 0.00 N ATOM 1551 CA SER B 379 -3.026 2.930 0.128 1.00 0.00 C ATOM 1552 C SER B 379 -4.123 2.026 0.631 1.00 0.00 C ATOM 1553 O SER B 379 -5.114 1.773 -0.052 1.00 0.00 O ATOM 1554 CB SER B 379 -3.137 4.256 0.857 1.00 0.00 C ATOM 1555 OG SER B 379 -3.171 4.009 2.250 1.00 0.00 O ATOM 0 H SER B 379 -4.044 3.304 -1.662 1.00 0.00 H new ATOM 0 HA SER B 379 -2.068 2.447 0.321 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.290 4.896 0.608 1.00 0.00 H new ATOM 0 HB3 SER B 379 -4.038 4.784 0.545 1.00 0.00 H new ATOM 0 HG SER B 379 -2.299 4.226 2.642 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.935 1.569 1.858 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.899 0.714 2.497 1.00 0.00 C ATOM 1563 C VAL B 380 -4.879 0.945 4.004 1.00 0.00 C ATOM 1564 O VAL B 380 -4.032 1.686 4.503 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.533 -0.716 2.204 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -5.048 -1.128 0.833 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -3.011 -0.840 2.237 1.00 0.00 C ATOM 0 H VAL B 380 -3.116 1.782 2.427 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.898 0.934 2.120 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.985 -1.368 2.951 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.774 -2.165 0.638 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -6.133 -1.028 0.807 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.606 -0.487 0.071 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.725 -1.871 2.027 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.576 -0.182 1.485 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.644 -0.556 3.223 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.802 0.310 4.732 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.838 0.477 6.181 1.00 0.00 C ATOM 1579 C GLN B 381 -5.210 -0.705 6.880 1.00 0.00 C ATOM 1580 O GLN B 381 -5.590 -1.856 6.680 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.263 0.632 6.659 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.377 1.805 7.629 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.844 2.057 7.966 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.490 1.220 8.596 1.00 0.00 O ATOM 1585 NE2 GLN B 381 -9.410 3.168 7.582 1.00 0.00 N ATOM 0 H GLN B 381 -6.517 -0.309 4.350 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.270 1.375 6.423 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.923 0.792 5.807 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.590 -0.285 7.148 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -6.817 1.592 8.539 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.937 2.699 7.186 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.873 3.860 7.060 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.390 3.344 7.804 1.00 0.00 H new ATOM 1594 N THR B 382 -4.253 -0.386 7.708 1.00 0.00 N ATOM 1595 CA THR B 382 -3.540 -1.382 8.488 1.00 0.00 C ATOM 1596 C THR B 382 -2.974 -0.745 9.742 1.00 0.00 C ATOM 1597 O THR B 382 -2.415 0.349 9.685 1.00 0.00 O ATOM 1598 CB THR B 382 -2.418 -1.999 7.663 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.428 -2.525 8.536 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.793 -0.938 6.762 1.00 0.00 C ATOM 0 H THR B 382 -3.939 0.571 7.867 1.00 0.00 H new ATOM 0 HA THR B 382 -4.237 -2.171 8.771 1.00 0.00 H new ATOM 0 HB THR B 382 -2.823 -2.799 7.043 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.705 -2.924 8.008 1.00 0.00 H new ATOM 0 HG21 THR B 382 -0.991 -1.386 6.175 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.553 -0.536 6.092 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.388 -0.133 7.375 1.00 0.00 H new ATOM 1608 N THR B 383 -3.094 -1.420 10.869 1.00 0.00 N ATOM 1609 CA THR B 383 -2.565 -0.863 12.100 1.00 0.00 C ATOM 1610 C THR B 383 -1.108 -1.229 12.285 1.00 0.00 C ATOM 1611 O THR B 383 -0.532 -1.043 13.358 1.00 0.00 O ATOM 1612 CB THR B 383 -3.416 -1.280 13.286 1.00 0.00 C ATOM 1613 OG1 THR B 383 -3.971 -2.567 13.052 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.526 -0.244 13.420 1.00 0.00 C ATOM 0 H THR B 383 -3.541 -2.332 10.959 1.00 0.00 H new ATOM 0 HA THR B 383 -2.610 0.224 12.033 1.00 0.00 H new ATOM 0 HB THR B 383 -2.822 -1.332 14.199 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.518 -2.832 13.821 1.00 0.00 H new ATOM 0 HG21 THR B 383 -5.166 -0.503 14.263 1.00 0.00 H new ATOM 0 HG22 THR B 383 -4.087 0.740 13.587 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.120 -0.227 12.506 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.496 -1.656 11.192 1.00 0.00 N ATOM 1623 CA GLU B 384 0.931 -1.938 11.192 1.00 0.00 C ATOM 1624 C GLU B 384 1.516 -1.538 9.844 1.00 0.00 C ATOM 1625 O GLU B 384 1.707 -2.357 8.947 1.00 0.00 O ATOM 1626 CB GLU B 384 1.206 -3.427 11.459 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.087 -4.132 11.878 1.00 0.00 C ATOM 1628 CD GLU B 384 0.176 -5.617 12.102 1.00 0.00 C ATOM 1629 OE1 GLU B 384 0.968 -5.934 12.974 1.00 0.00 O1- ATOM 1630 OE2 GLU B 384 -0.421 -6.416 11.399 1.00 0.00 O ATOM 0 H GLU B 384 -0.961 -1.814 10.298 1.00 0.00 H new ATOM 0 HA GLU B 384 1.400 -1.363 11.991 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.612 -3.897 10.563 1.00 0.00 H new ATOM 0 HB3 GLU B 384 1.957 -3.532 12.242 1.00 0.00 H new ATOM 0 HG2 GLU B 384 -0.477 -3.682 12.791 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.848 -4.001 11.108 1.00 0.00 H new ATOM 1637 N GLY B 385 1.830 -0.263 9.730 1.00 0.00 N ATOM 1638 CA GLY B 385 2.434 0.261 8.522 1.00 0.00 C ATOM 1639 C GLY B 385 3.941 0.097 8.578 1.00 0.00 C ATOM 1640 O GLY B 385 4.551 -0.510 7.707 1.00 0.00 O ATOM 0 H GLY B 385 1.676 0.431 10.462 1.00 0.00 H new ATOM 0 HA2 GLY B 385 2.036 -0.261 7.652 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.179 1.314 8.406 1.00 0.00 H new ATOM 1644 N GLU B 386 4.525 0.673 9.619 1.00 0.00 N ATOM 1645 CA GLU B 386 5.968 0.635 9.821 1.00 0.00 C ATOM 1646 C GLU B 386 6.513 -0.749 9.580 1.00 0.00 C ATOM 1647 O GLU B 386 7.690 -0.928 9.323 1.00 0.00 O ATOM 1648 CB GLU B 386 6.293 1.060 11.244 1.00 0.00 C ATOM 1649 CG GLU B 386 5.389 0.303 12.215 1.00 0.00 C ATOM 1650 CD GLU B 386 5.744 0.676 13.651 1.00 0.00 C ATOM 1651 OE1 GLU B 386 6.812 0.289 14.096 1.00 0.00 O1- ATOM 1652 OE2 GLU B 386 4.945 1.346 14.284 1.00 0.00 O ATOM 0 H GLU B 386 4.016 1.178 10.345 1.00 0.00 H new ATOM 0 HA GLU B 386 6.431 1.319 9.110 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.340 0.854 11.467 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.149 2.134 11.357 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.345 0.542 12.015 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.503 -0.771 12.070 1.00 0.00 H new ATOM 1659 N GLN B 387 5.644 -1.720 9.649 1.00 0.00 N ATOM 1660 CA GLN B 387 6.056 -3.095 9.420 1.00 0.00 C ATOM 1661 C GLN B 387 6.083 -3.360 7.936 1.00 0.00 C ATOM 1662 O GLN B 387 6.980 -4.015 7.417 1.00 0.00 O ATOM 1663 CB GLN B 387 5.099 -4.064 10.109 1.00 0.00 C ATOM 1664 CG GLN B 387 5.219 -3.918 11.627 1.00 0.00 C ATOM 1665 CD GLN B 387 5.686 -5.234 12.238 1.00 0.00 C ATOM 1666 OE1 GLN B 387 6.577 -5.889 11.696 1.00 0.00 O ATOM 1667 NE2 GLN B 387 5.132 -5.665 13.338 1.00 0.00 N ATOM 0 H GLN B 387 4.654 -1.596 9.859 1.00 0.00 H new ATOM 0 HA GLN B 387 7.051 -3.246 9.838 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.075 -3.863 9.795 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.328 -5.088 9.814 1.00 0.00 H new ATOM 0 HG2 GLN B 387 5.924 -3.123 11.870 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.257 -3.631 12.051 1.00 0.00 H new ATOM 0 HE21 GLN B 387 4.394 -5.120 13.785 1.00 0.00 H new ATOM 0 HE22 GLN B 387 5.437 -6.546 13.751 1.00 0.00 H new ATOM 1676 N ILE B 388 5.100 -2.806 7.263 1.00 0.00 N ATOM 1677 CA ILE B 388 5.000 -2.926 5.824 1.00 0.00 C ATOM 1678 C ILE B 388 6.000 -1.989 5.162 1.00 0.00 C ATOM 1679 O ILE B 388 6.643 -2.325 4.168 1.00 0.00 O ATOM 1680 CB ILE B 388 3.601 -2.502 5.401 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.586 -3.575 5.775 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.565 -2.281 3.892 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.189 -2.954 5.773 1.00 0.00 C ATOM 0 H ILE B 388 4.351 -2.263 7.693 1.00 0.00 H new ATOM 0 HA ILE B 388 5.203 -3.955 5.528 1.00 0.00 H new ATOM 0 HB ILE B 388 3.347 -1.575 5.916 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.632 -4.402 5.066 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.815 -3.985 6.759 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.562 -1.978 3.593 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.276 -1.500 3.622 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.831 -3.207 3.382 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.453 -3.713 6.039 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.151 -2.141 6.498 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.965 -2.565 4.780 1.00 0.00 H new ATOM 1695 N ALA B 389 6.070 -0.790 5.714 1.00 0.00 N ATOM 1696 CA ALA B 389 6.925 0.267 5.190 1.00 0.00 C ATOM 1697 C ALA B 389 8.403 0.047 5.466 1.00 0.00 C ATOM 1698 O ALA B 389 9.229 0.302 4.600 1.00 0.00 O ATOM 1699 CB ALA B 389 6.513 1.587 5.816 1.00 0.00 C ATOM 0 H ALA B 389 5.536 -0.519 6.540 1.00 0.00 H new ATOM 0 HA ALA B 389 6.795 0.268 4.108 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.147 2.386 5.431 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.473 1.798 5.569 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.623 1.526 6.899 1.00 0.00 H new ATOM 1705 N GLN B 390 8.751 -0.386 6.668 1.00 0.00 N ATOM 1706 CA GLN B 390 10.169 -0.555 6.990 1.00 0.00 C ATOM 1707 C GLN B 390 10.799 -1.611 6.120 1.00 0.00 C ATOM 1708 O GLN B 390 11.969 -1.534 5.744 1.00 0.00 O ATOM 1709 CB GLN B 390 10.351 -0.964 8.442 1.00 0.00 C ATOM 1710 CG GLN B 390 9.801 -2.375 8.652 1.00 0.00 C ATOM 1711 CD GLN B 390 9.555 -2.623 10.137 1.00 0.00 C ATOM 1712 OE1 GLN B 390 9.619 -1.694 10.943 1.00 0.00 O ATOM 1713 NE2 GLN B 390 9.276 -3.830 10.550 1.00 0.00 N ATOM 0 H GLN B 390 8.100 -0.621 7.417 1.00 0.00 H new ATOM 0 HA GLN B 390 10.653 0.405 6.812 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.407 -0.931 8.710 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.835 -0.261 9.096 1.00 0.00 H new ATOM 0 HG2 GLN B 390 8.872 -2.499 8.095 1.00 0.00 H new ATOM 0 HG3 GLN B 390 10.506 -3.110 8.264 1.00 0.00 H new ATOM 0 HE21 GLN B 390 9.223 -4.598 9.881 1.00 0.00 H new ATOM 0 HE22 GLN B 390 9.111 -4.004 11.541 1.00 0.00 H new ATOM 1722 N LEU B 391 10.002 -2.594 5.827 1.00 0.00 N ATOM 1723 CA LEU B 391 10.426 -3.706 5.014 1.00 0.00 C ATOM 1724 C LEU B 391 10.534 -3.246 3.572 1.00 0.00 C ATOM 1725 O LEU B 391 11.589 -3.355 2.952 1.00 0.00 O ATOM 1726 CB LEU B 391 9.410 -4.823 5.243 1.00 0.00 C ATOM 1727 CG LEU B 391 8.588 -5.172 3.997 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.448 -5.925 2.972 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.427 -6.048 4.445 1.00 0.00 C ATOM 0 H LEU B 391 9.034 -2.652 6.144 1.00 0.00 H new ATOM 0 HA LEU B 391 11.413 -4.087 5.276 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.935 -5.716 5.583 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.732 -4.527 6.044 1.00 0.00 H new ATOM 0 HG LEU B 391 8.226 -4.261 3.520 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.845 -6.163 2.096 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.290 -5.300 2.674 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.821 -6.847 3.417 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.819 -6.316 3.581 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.814 -6.954 4.912 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.816 -5.502 5.164 1.00 0.00 H new ATOM 1741 N ILE B 392 9.459 -2.666 3.072 1.00 0.00 N ATOM 1742 CA ILE B 392 9.450 -2.115 1.752 1.00 0.00 C ATOM 1743 C ILE B 392 10.679 -1.266 1.660 1.00 0.00 C ATOM 1744 O ILE B 392 11.544 -1.467 0.819 1.00 0.00 O ATOM 1745 CB ILE B 392 8.202 -1.247 1.612 1.00 0.00 C ATOM 1746 CG1 ILE B 392 7.076 -2.073 0.996 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.489 -0.011 0.747 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.770 -1.290 1.062 1.00 0.00 C ATOM 0 H ILE B 392 8.577 -2.569 3.575 1.00 0.00 H new ATOM 0 HA ILE B 392 9.440 -2.876 0.972 1.00 0.00 H new ATOM 0 HB ILE B 392 7.901 -0.902 2.601 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.314 -2.315 -0.040 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.972 -3.018 1.529 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.585 0.592 0.662 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.278 0.582 1.210 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.808 -0.328 -0.246 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.968 -1.882 0.621 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.530 -1.070 2.102 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.877 -0.356 0.510 1.00 0.00 H new ATOM 1760 N ALA B 393 10.739 -0.351 2.610 1.00 0.00 N ATOM 1761 CA ALA B 393 11.859 0.560 2.750 1.00 0.00 C ATOM 1762 C ALA B 393 13.166 -0.204 2.810 1.00 0.00 C ATOM 1763 O ALA B 393 14.207 0.277 2.358 1.00 0.00 O ATOM 1764 CB ALA B 393 11.722 1.326 4.047 1.00 0.00 C ATOM 0 H ALA B 393 10.008 -0.219 3.309 1.00 0.00 H new ATOM 0 HA ALA B 393 11.859 1.231 1.891 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.562 2.012 4.155 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.791 1.892 4.039 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.714 0.627 4.883 1.00 0.00 H new ATOM 1770 N GLY B 394 13.110 -1.389 3.404 1.00 0.00 N ATOM 1771 CA GLY B 394 14.305 -2.202 3.557 1.00 0.00 C ATOM 1772 C GLY B 394 14.554 -3.023 2.320 1.00 0.00 C ATOM 1773 O GLY B 394 15.650 -3.526 2.103 1.00 0.00 O ATOM 0 H GLY B 394 12.259 -1.804 3.783 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.164 -1.561 3.752 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.195 -2.859 4.419 1.00 0.00 H new ATOM 1777 N TYR B 395 13.522 -3.151 1.521 1.00 0.00 N ATOM 1778 CA TYR B 395 13.603 -3.906 0.299 1.00 0.00 C ATOM 1779 C TYR B 395 14.100 -3.002 -0.817 1.00 0.00 C ATOM 1780 O TYR B 395 14.915 -3.416 -1.633 1.00 0.00 O ATOM 1781 CB TYR B 395 12.227 -4.489 0.016 1.00 0.00 C ATOM 1782 CG TYR B 395 12.006 -5.785 0.806 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.770 -6.106 1.957 1.00 0.00 C ATOM 1784 CD2 TYR B 395 11.032 -6.690 0.365 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.545 -7.315 2.632 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.819 -7.895 1.040 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.574 -8.209 2.171 1.00 0.00 C ATOM 1788 OH TYR B 395 11.361 -9.400 2.835 1.00 0.00 O ATOM 0 H TYR B 395 12.608 -2.736 1.700 1.00 0.00 H new ATOM 0 HA TYR B 395 14.312 -4.730 0.378 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.459 -3.762 0.280 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.125 -4.687 -1.051 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.524 -5.420 2.313 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.439 -6.454 -0.506 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.124 -7.556 3.511 1.00 0.00 H new ATOM 0 HE2 TYR B 395 10.068 -8.585 0.685 1.00 0.00 H new ATOM 0 HH TYR B 395 10.651 -9.903 2.384 1.00 0.00 H new ATOM 1798 N ILE B 396 13.675 -1.746 -0.808 1.00 0.00 N ATOM 1799 CA ILE B 396 14.185 -0.805 -1.806 1.00 0.00 C ATOM 1800 C ILE B 396 15.636 -0.532 -1.537 1.00 0.00 C ATOM 1801 O ILE B 396 16.363 0.022 -2.361 1.00 0.00 O ATOM 1802 CB ILE B 396 13.433 0.522 -1.849 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.231 0.467 -0.934 1.00 0.00 C ATOM 1804 CG2 ILE B 396 12.974 0.784 -3.282 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.423 1.756 -1.066 1.00 0.00 C ATOM 0 H ILE B 396 13.001 -1.360 -0.146 1.00 0.00 H new ATOM 0 HA ILE B 396 14.039 -1.281 -2.776 1.00 0.00 H new ATOM 0 HB ILE B 396 14.091 1.324 -1.516 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.608 -0.391 -1.187 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.554 0.333 0.098 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.435 1.731 -3.324 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.842 0.831 -3.939 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.317 -0.023 -3.607 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.558 1.712 -0.405 1.00 0.00 H new ATOM 0 HD12 ILE B 396 12.047 2.606 -0.791 1.00 0.00 H new ATOM 0 HD13 ILE B 396 11.087 1.871 -2.097 1.00 0.00 H new ATOM 1817 N ASP B 397 16.038 -0.944 -0.365 1.00 0.00 N ATOM 1818 CA ASP B 397 17.405 -0.750 0.079 1.00 0.00 C ATOM 1819 C ASP B 397 18.293 -1.790 -0.555 1.00 0.00 C ATOM 1820 O ASP B 397 19.510 -1.636 -0.654 1.00 0.00 O ATOM 1821 CB ASP B 397 17.462 -0.879 1.597 1.00 0.00 C ATOM 1822 CG ASP B 397 18.410 0.164 2.179 1.00 0.00 C ATOM 1823 OD1 ASP B 397 17.997 1.305 2.306 1.00 0.00 O ATOM 1824 OD2 ASP B 397 19.534 -0.194 2.491 1.00 0.00 O1- ATOM 0 H ASP B 397 15.438 -1.420 0.309 1.00 0.00 H new ATOM 0 HA ASP B 397 17.750 0.241 -0.215 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.465 -0.750 2.018 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.797 -1.879 1.872 1.00 0.00 H new ATOM 1829 N ILE B 398 17.654 -2.866 -0.946 1.00 0.00 N ATOM 1830 CA ILE B 398 18.323 -3.987 -1.539 1.00 0.00 C ATOM 1831 C ILE B 398 18.373 -3.884 -3.047 1.00 0.00 C ATOM 1832 O ILE B 398 19.436 -3.875 -3.668 1.00 0.00 O ATOM 1833 CB ILE B 398 17.521 -5.208 -1.155 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.514 -5.331 0.371 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.136 -6.437 -1.790 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.412 -6.286 0.844 1.00 0.00 C ATOM 0 H ILE B 398 16.645 -2.984 -0.858 1.00 0.00 H new ATOM 0 HA ILE B 398 19.354 -4.031 -1.187 1.00 0.00 H new ATOM 0 HB ILE B 398 16.495 -5.116 -1.511 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.484 -5.692 0.714 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.364 -4.348 0.817 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.557 -7.318 -1.513 1.00 0.00 H new ATOM 0 HG22 ILE B 398 18.132 -6.327 -2.874 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.162 -6.552 -1.441 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.431 -6.354 1.932 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.441 -5.910 0.521 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.579 -7.275 0.416 1.00 0.00 H new ATOM 1848 N ILE B 399 17.185 -3.874 -3.609 1.00 0.00 N ATOM 1849 CA ILE B 399 17.000 -3.848 -5.044 1.00 0.00 C ATOM 1850 C ILE B 399 17.531 -2.568 -5.672 1.00 0.00 C ATOM 1851 O ILE B 399 17.779 -2.530 -6.878 1.00 0.00 O ATOM 1852 CB ILE B 399 15.517 -3.970 -5.318 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.850 -2.682 -4.857 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.956 -5.140 -4.513 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.402 -2.961 -4.416 1.00 0.00 C ATOM 0 H ILE B 399 16.313 -3.884 -3.080 1.00 0.00 H new ATOM 0 HA ILE B 399 17.559 -4.673 -5.486 1.00 0.00 H new ATOM 0 HB ILE B 399 15.334 -4.139 -6.379 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.412 -2.249 -4.030 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.857 -1.951 -5.665 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.887 -5.235 -4.705 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.461 -6.060 -4.808 1.00 0.00 H new ATOM 0 HG23 ILE B 399 15.119 -4.962 -3.450 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.936 -2.032 -4.089 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.840 -3.373 -5.254 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.404 -3.676 -3.593 1.00 0.00 H new ATOM 1867 N LEU B 400 17.682 -1.512 -4.878 1.00 0.00 N ATOM 1868 CA LEU B 400 18.171 -0.252 -5.447 1.00 0.00 C ATOM 1869 C LEU B 400 19.409 -0.491 -6.310 1.00 0.00 C ATOM 1870 O LEU B 400 19.873 0.459 -6.917 1.00 0.00 O ATOM 1871 CB LEU B 400 18.501 0.772 -4.358 1.00 0.00 C ATOM 1872 CG LEU B 400 19.266 0.109 -3.214 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.635 -0.383 -3.697 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.468 1.129 -2.092 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.875 -1.618 -6.352 1.00 0.00 O ATOM 0 H LEU B 400 17.483 -1.495 -3.878 1.00 0.00 H new ATOM 0 HA LEU B 400 17.369 0.150 -6.066 1.00 0.00 H new ATOM 0 HB2 LEU B 400 19.096 1.582 -4.780 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.581 1.217 -3.978 1.00 0.00 H new ATOM 0 HG LEU B 400 18.692 -0.744 -2.852 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.166 -0.852 -2.869 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.499 -1.109 -4.499 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.215 0.462 -4.067 1.00 0.00 H new ATOM 0 HD21 LEU B 400 20.014 0.664 -1.271 1.00 0.00 H new ATOM 0 HD22 LEU B 400 20.037 1.978 -2.470 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.498 1.473 -1.734 1.00 0.00 H new