USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=20 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= -0.893! USER MOD Set 1.2: B 379 SER OG : rot 85:sc= 0.615 USER MOD Set 2.1: B 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 373 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: B 352 SER OG : rot -129:sc= -4.02! USER MOD Set 3.2: B 355 ASN : amide:sc= -4.96! C(o=-9!,f=-9.8!) USER MOD Set 4.1: B 349 GLN :FLIP amide:sc= -4.81! C(o=-8.3!,f=-4.8!) USER MOD Set 4.2: B 378 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: B 333 THR OG1 : rot -128:sc= -2.2! USER MOD Set 5.2: B 336 CYS SG : rot 180:sc= -0.375! USER MOD Set 6.1: B 311 SER OG : rot -118:sc= -0.625 USER MOD Set 6.2: B 395 TYR OH : rot 180:sc= 0 USER MOD Single : B 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 334 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 338 MET CE :methyl -166:sc= -0.131 (180deg=-0.954) USER MOD Single : B 343 LYS NZ :NH3+ 158:sc= -0.405 (180deg=-1.62!) USER MOD Single : B 344 THR OG1 : rot -119:sc= -3.75! USER MOD Single : B 345 LYS NZ :NH3+ -153:sc=-0.00517 (180deg=-0.356) USER MOD Single : B 354 THR OG1 : rot 160:sc= -2.45 USER MOD Single : B 362 SER OG : rot 180:sc= -1.07 USER MOD Single : B 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 374 GLN : amide:sc= -0.229 K(o=-0.23,f=-1.3) USER MOD Single : B 377 TYR OH : rot 180:sc= -2.94! USER MOD Single : B 381 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : B 382 THR OG1 : rot -132:sc= 0.582 USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0581 USER MOD Single : B 387 GLN : amide:sc=-0.00916 K(o=-0.0092,f=-2.4!) USER MOD Single : B 390 GLN : amide:sc= -3.64! C(o=-3.6!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 125 N LEU A 15 1.218 11.958 2.060 1.00 0.00 N ATOM 126 CA LEU A 15 0.563 10.695 1.724 1.00 0.00 C ATOM 127 C LEU A 15 -0.680 10.525 2.584 1.00 0.00 C ATOM 128 O LEU A 15 -1.728 10.099 2.106 1.00 0.00 O ATOM 129 CB LEU A 15 1.520 9.516 1.968 1.00 0.00 C ATOM 130 CG LEU A 15 2.481 9.290 0.781 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.710 8.949 -0.495 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.322 10.536 0.529 1.00 0.00 C ATOM 0 HA LEU A 15 0.284 10.711 0.671 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.100 9.702 2.872 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.940 8.609 2.142 1.00 0.00 H new ATOM 0 HG LEU A 15 3.130 8.454 1.042 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.412 8.795 -1.314 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.131 8.039 -0.338 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.037 9.769 -0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.993 10.358 -0.311 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.667 11.376 0.299 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.908 10.766 1.419 1.00 0.00 H new ATOM 144 N LEU A 16 -0.560 10.881 3.849 1.00 0.00 N ATOM 145 CA LEU A 16 -1.681 10.782 4.760 1.00 0.00 C ATOM 146 C LEU A 16 -2.816 11.693 4.286 1.00 0.00 C ATOM 147 O LEU A 16 -3.982 11.292 4.252 1.00 0.00 O ATOM 148 CB LEU A 16 -1.224 11.169 6.170 1.00 0.00 C ATOM 149 CG LEU A 16 -0.314 10.074 6.758 1.00 0.00 C ATOM 150 CD1 LEU A 16 0.203 10.521 8.130 1.00 0.00 C ATOM 151 CD2 LEU A 16 -1.089 8.760 6.911 1.00 0.00 C ATOM 0 H LEU A 16 0.299 11.240 4.266 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.051 9.757 4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.688 12.118 6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -2.092 11.314 6.814 1.00 0.00 H new ATOM 0 HG LEU A 16 0.525 9.913 6.080 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.847 9.746 8.546 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.771 11.445 8.021 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.641 10.690 8.799 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.432 7.996 7.328 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.937 8.913 7.579 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.450 8.435 5.935 1.00 0.00 H new ATOM 163 N GLY A 17 -2.467 12.911 3.879 1.00 0.00 N ATOM 164 CA GLY A 17 -3.467 13.840 3.366 1.00 0.00 C ATOM 165 C GLY A 17 -4.169 13.215 2.169 1.00 0.00 C ATOM 166 O GLY A 17 -5.372 13.387 1.974 1.00 0.00 O ATOM 0 H GLY A 17 -1.513 13.273 3.894 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.192 14.077 4.144 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -2.993 14.778 3.075 1.00 0.00 H new ATOM 170 N GLU A 18 -3.402 12.468 1.382 1.00 0.00 N ATOM 171 CA GLU A 18 -3.943 11.788 0.218 1.00 0.00 C ATOM 172 C GLU A 18 -4.815 10.624 0.657 1.00 0.00 C ATOM 173 O GLU A 18 -5.889 10.401 0.111 1.00 0.00 O ATOM 174 CB GLU A 18 -2.796 11.291 -0.652 1.00 0.00 C ATOM 175 CG GLU A 18 -2.407 12.390 -1.638 1.00 0.00 C ATOM 176 CD GLU A 18 -3.228 12.266 -2.918 1.00 0.00 C ATOM 177 OE1 GLU A 18 -4.220 11.556 -2.898 1.00 0.00 O ATOM 178 OE2 GLU A 18 -2.854 12.886 -3.899 1.00 0.00 O1- ATOM 0 H GLU A 18 -2.404 12.320 1.532 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.555 12.481 -0.358 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.941 11.023 -0.031 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.094 10.391 -1.190 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.571 13.368 -1.186 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.344 12.320 -1.871 1.00 0.00 H new ATOM 394 N VAL B 310 9.385 -12.695 0.740 1.00 0.00 N ATOM 395 CA VAL B 310 8.101 -12.031 0.546 1.00 0.00 C ATOM 396 C VAL B 310 7.374 -11.857 1.879 1.00 0.00 C ATOM 397 O VAL B 310 7.349 -12.768 2.705 1.00 0.00 O ATOM 398 CB VAL B 310 7.233 -12.852 -0.409 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.860 -12.197 -0.548 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.904 -12.906 -1.783 1.00 0.00 C ATOM 0 HA VAL B 310 8.284 -11.045 0.118 1.00 0.00 H new ATOM 0 HB VAL B 310 7.117 -13.861 -0.013 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.244 -12.784 -1.229 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.378 -12.151 0.429 1.00 0.00 H new ATOM 0 HG13 VAL B 310 5.977 -11.188 -0.943 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.288 -13.491 -2.466 1.00 0.00 H new ATOM 0 HG22 VAL B 310 8.018 -11.894 -2.172 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.885 -13.372 -1.691 1.00 0.00 H new ATOM 410 N SER B 311 6.785 -10.678 2.074 1.00 0.00 N ATOM 411 CA SER B 311 6.058 -10.383 3.303 1.00 0.00 C ATOM 412 C SER B 311 4.571 -10.239 3.012 1.00 0.00 C ATOM 413 O SER B 311 4.196 -9.918 1.896 1.00 0.00 O ATOM 414 CB SER B 311 6.582 -9.091 3.905 1.00 0.00 C ATOM 415 OG SER B 311 7.694 -8.639 3.145 1.00 0.00 O ATOM 0 H SER B 311 6.798 -9.915 1.397 1.00 0.00 H new ATOM 0 HA SER B 311 6.205 -11.203 4.006 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.798 -8.334 3.910 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.876 -9.252 4.942 1.00 0.00 H new ATOM 0 HG SER B 311 8.492 -8.618 3.714 1.00 0.00 H new ATOM 421 N PHE B 312 3.734 -10.507 4.012 1.00 0.00 N ATOM 422 CA PHE B 312 2.284 -10.435 3.836 1.00 0.00 C ATOM 423 C PHE B 312 1.628 -9.592 4.933 1.00 0.00 C ATOM 424 O PHE B 312 1.933 -9.774 6.112 1.00 0.00 O ATOM 425 CB PHE B 312 1.741 -11.859 3.910 1.00 0.00 C ATOM 426 CG PHE B 312 2.050 -12.593 2.625 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.458 -12.188 1.424 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.933 -13.682 2.636 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.745 -12.868 0.235 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.219 -14.362 1.447 1.00 0.00 C ATOM 431 CZ PHE B 312 2.626 -13.955 0.246 1.00 0.00 C ATOM 0 H PHE B 312 4.033 -10.775 4.950 1.00 0.00 H new ATOM 0 HA PHE B 312 2.060 -9.967 2.877 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.186 -12.384 4.755 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.664 -11.839 4.078 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.778 -11.349 1.414 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.392 -13.996 3.562 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.287 -12.554 -0.691 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.898 -15.202 1.456 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.848 -14.480 -0.671 1.00 0.00 H new ATOM 441 N PHE B 313 0.709 -8.683 4.558 1.00 0.00 N ATOM 442 CA PHE B 313 0.034 -7.868 5.559 1.00 0.00 C ATOM 443 C PHE B 313 -1.438 -7.727 5.228 1.00 0.00 C ATOM 444 O PHE B 313 -1.802 -7.325 4.125 1.00 0.00 O ATOM 445 CB PHE B 313 0.652 -6.479 5.626 1.00 0.00 C ATOM 446 CG PHE B 313 1.972 -6.545 6.349 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.138 -6.874 5.650 1.00 0.00 C ATOM 448 CD2 PHE B 313 2.028 -6.271 7.718 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.363 -6.930 6.325 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.253 -6.326 8.392 1.00 0.00 C ATOM 451 CZ PHE B 313 4.421 -6.656 7.694 1.00 0.00 C ATOM 0 H PHE B 313 0.429 -8.504 3.594 1.00 0.00 H new ATOM 0 HA PHE B 313 0.148 -8.367 6.522 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.797 -6.086 4.620 1.00 0.00 H new ATOM 0 HB3 PHE B 313 -0.022 -5.795 6.141 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.093 -7.084 4.592 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.126 -6.017 8.256 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.264 -7.185 5.787 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.298 -6.114 9.450 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.367 -6.699 8.214 1.00 0.00 H new ATOM 461 N LEU B 314 -2.274 -8.030 6.198 1.00 0.00 N ATOM 462 CA LEU B 314 -3.699 -7.905 6.011 1.00 0.00 C ATOM 463 C LEU B 314 -4.102 -6.464 6.202 1.00 0.00 C ATOM 464 O LEU B 314 -4.072 -5.888 7.278 1.00 0.00 O ATOM 465 CB LEU B 314 -4.479 -8.918 6.878 1.00 0.00 C ATOM 466 CG LEU B 314 -4.990 -8.371 8.224 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.861 -7.712 9.021 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.159 -7.394 8.017 1.00 0.00 C ATOM 0 H LEU B 314 -1.991 -8.363 7.120 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.969 -8.171 4.989 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.331 -9.282 6.305 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.836 -9.776 7.073 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.358 -9.217 8.805 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.254 -7.336 9.966 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.079 -8.445 9.219 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.445 -6.885 8.446 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.499 -7.024 8.984 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.828 -6.556 7.403 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.979 -7.909 7.516 1.00 0.00 H new ATOM 480 N VAL B 315 -4.387 -5.873 5.085 1.00 0.00 N ATOM 481 CA VAL B 315 -4.733 -4.475 5.027 1.00 0.00 C ATOM 482 C VAL B 315 -6.145 -4.307 4.482 1.00 0.00 C ATOM 483 O VAL B 315 -6.669 -5.223 3.872 1.00 0.00 O ATOM 484 CB VAL B 315 -3.737 -3.792 4.111 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.315 -3.987 4.639 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.860 -4.394 2.700 1.00 0.00 C ATOM 0 H VAL B 315 -4.388 -6.343 4.180 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.701 -4.033 6.023 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.950 -2.724 4.075 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.608 -3.492 3.973 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.235 -3.556 5.637 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -2.086 -5.052 4.684 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -3.147 -3.908 2.034 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.649 -5.463 2.741 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.871 -4.238 2.325 1.00 0.00 H new ATOM 496 N LYS B 316 -6.758 -3.139 4.684 1.00 0.00 N ATOM 497 CA LYS B 316 -8.097 -2.909 4.171 1.00 0.00 C ATOM 498 C LYS B 316 -8.018 -2.028 2.942 1.00 0.00 C ATOM 499 O LYS B 316 -7.153 -1.165 2.842 1.00 0.00 O ATOM 500 CB LYS B 316 -8.975 -2.232 5.213 1.00 0.00 C ATOM 501 CG LYS B 316 -8.718 -2.840 6.594 1.00 0.00 C ATOM 502 CD LYS B 316 -9.598 -2.143 7.634 1.00 0.00 C ATOM 503 CE LYS B 316 -10.737 -3.077 8.046 1.00 0.00 C ATOM 504 NZ LYS B 316 -11.760 -2.307 8.809 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.351 -2.353 5.192 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.538 -3.874 3.919 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.768 -1.162 5.234 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -10.025 -2.348 4.946 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -8.934 -3.908 6.578 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.667 -2.731 6.861 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -9.003 -1.871 8.506 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -10.002 -1.218 7.223 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -11.190 -3.528 7.163 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -10.350 -3.893 8.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -12.535 -2.942 9.089 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -11.323 -1.897 9.659 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -12.137 -1.544 8.212 1.00 0.00 H new ATOM 518 N GLU B 317 -8.910 -2.268 2.007 1.00 0.00 N ATOM 519 CA GLU B 317 -8.920 -1.515 0.767 1.00 0.00 C ATOM 520 C GLU B 317 -10.315 -1.079 0.363 1.00 0.00 C ATOM 521 O GLU B 317 -11.314 -1.711 0.688 1.00 0.00 O ATOM 522 CB GLU B 317 -8.339 -2.372 -0.341 1.00 0.00 C ATOM 523 CG GLU B 317 -7.912 -1.479 -1.514 1.00 0.00 C ATOM 524 CD GLU B 317 -7.343 -2.330 -2.643 1.00 0.00 C ATOM 525 OE1 GLU B 317 -6.668 -3.300 -2.345 1.00 0.00 O1- ATOM 526 OE2 GLU B 317 -7.593 -2.000 -3.791 1.00 0.00 O ATOM 0 H GLU B 317 -9.639 -2.978 2.079 1.00 0.00 H new ATOM 0 HA GLU B 317 -8.323 -0.617 0.927 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.483 -2.934 0.032 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -9.077 -3.101 -0.676 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -8.767 -0.907 -1.875 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -7.165 -0.759 -1.179 1.00 0.00 H new ATOM 678 N VAL B 326 -12.397 -2.770 2.596 1.00 0.00 N ATOM 679 CA VAL B 326 -12.610 -4.189 2.713 1.00 0.00 C ATOM 680 C VAL B 326 -11.327 -4.873 3.159 1.00 0.00 C ATOM 681 O VAL B 326 -10.294 -4.690 2.514 1.00 0.00 O ATOM 682 CB VAL B 326 -13.015 -4.705 1.342 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.841 -6.214 1.281 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.467 -4.311 1.064 1.00 0.00 C ATOM 0 HA VAL B 326 -13.385 -4.399 3.450 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.377 -4.261 0.578 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -13.134 -6.574 0.295 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.797 -6.468 1.465 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.467 -6.683 2.040 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.762 -4.679 0.081 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -15.114 -4.748 1.824 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.560 -3.225 1.088 1.00 0.00 H new ATOM 694 N PRO B 327 -11.341 -5.662 4.218 1.00 0.00 N ATOM 695 CA PRO B 327 -10.111 -6.357 4.651 1.00 0.00 C ATOM 696 C PRO B 327 -9.442 -6.935 3.426 1.00 0.00 C ATOM 697 O PRO B 327 -10.121 -7.325 2.477 1.00 0.00 O ATOM 698 CB PRO B 327 -10.609 -7.447 5.598 1.00 0.00 C ATOM 699 CG PRO B 327 -11.904 -6.934 6.143 1.00 0.00 C ATOM 700 CD PRO B 327 -12.483 -5.973 5.098 1.00 0.00 C ATOM 0 HA PRO B 327 -9.380 -5.717 5.145 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.750 -8.391 5.072 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.891 -7.632 6.397 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.594 -7.756 6.335 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.747 -6.422 7.092 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.299 -6.434 4.542 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.883 -5.073 5.564 1.00 0.00 H new ATOM 708 N ARG B 328 -8.131 -6.950 3.400 1.00 0.00 N ATOM 709 CA ARG B 328 -7.454 -7.431 2.237 1.00 0.00 C ATOM 710 C ARG B 328 -6.134 -8.004 2.652 1.00 0.00 C ATOM 711 O ARG B 328 -5.870 -8.155 3.842 1.00 0.00 O ATOM 712 CB ARG B 328 -7.277 -6.290 1.222 1.00 0.00 C ATOM 713 CG ARG B 328 -6.810 -6.839 -0.127 1.00 0.00 C ATOM 714 CD ARG B 328 -7.497 -6.069 -1.255 1.00 0.00 C ATOM 715 NE ARG B 328 -8.857 -6.559 -1.444 1.00 0.00 N ATOM 716 CZ ARG B 328 -9.482 -6.423 -2.610 1.00 0.00 C ATOM 717 NH1 ARG B 328 -8.879 -5.839 -3.609 1.00 0.00 N ATOM 718 NH2 ARG B 328 -10.699 -6.872 -2.754 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.527 -6.639 4.161 1.00 0.00 H new ATOM 0 HA ARG B 328 -8.041 -8.212 1.754 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -8.220 -5.757 1.097 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.551 -5.570 1.599 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -5.728 -6.745 -0.215 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -7.045 -7.901 -0.201 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -7.516 -5.005 -1.020 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -6.930 -6.181 -2.179 1.00 0.00 H new ATOM 0 HE ARG B 328 -9.338 -7.014 -0.668 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -7.928 -5.487 -3.496 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -9.358 -5.735 -4.503 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -11.171 -7.327 -1.972 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.179 -6.768 -3.648 1.00 0.00 H new ATOM 732 N LEU B 329 -5.331 -8.361 1.687 1.00 0.00 N ATOM 733 CA LEU B 329 -4.078 -8.971 1.985 1.00 0.00 C ATOM 734 C LEU B 329 -3.033 -8.450 1.026 1.00 0.00 C ATOM 735 O LEU B 329 -3.178 -8.555 -0.173 1.00 0.00 O ATOM 736 CB LEU B 329 -4.316 -10.484 1.903 1.00 0.00 C ATOM 737 CG LEU B 329 -3.199 -11.323 2.546 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.138 -12.695 1.866 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.831 -10.657 2.411 1.00 0.00 C ATOM 0 H LEU B 329 -5.527 -8.238 0.694 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.698 -8.734 2.979 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.262 -10.721 2.390 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.416 -10.771 0.856 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.432 -11.419 3.606 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.347 -13.291 2.320 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.093 -13.205 1.990 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -2.930 -12.566 0.804 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.073 -11.285 2.879 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.593 -10.526 1.355 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.850 -9.684 2.902 1.00 0.00 H new ATOM 751 N LEU B 330 -1.991 -7.852 1.583 1.00 0.00 N ATOM 752 CA LEU B 330 -0.926 -7.283 0.798 1.00 0.00 C ATOM 753 C LEU B 330 0.229 -8.244 0.761 1.00 0.00 C ATOM 754 O LEU B 330 0.364 -9.072 1.652 1.00 0.00 O ATOM 755 CB LEU B 330 -0.508 -5.965 1.460 1.00 0.00 C ATOM 756 CG LEU B 330 0.799 -5.412 0.871 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.580 -4.999 -0.579 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.220 -4.200 1.693 1.00 0.00 C ATOM 0 H LEU B 330 -1.867 -7.752 2.591 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.250 -7.095 -0.226 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.302 -5.229 1.334 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.385 -6.121 2.532 1.00 0.00 H new ATOM 0 HG LEU B 330 1.576 -6.176 0.902 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.511 -4.608 -0.990 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.262 -5.865 -1.160 1.00 0.00 H new ATOM 0 HD13 LEU B 330 -0.189 -4.228 -0.626 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.147 -3.792 1.291 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.439 -3.441 1.648 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.375 -4.499 2.730 1.00 0.00 H new ATOM 770 N GLY B 331 1.086 -8.102 -0.237 1.00 0.00 N ATOM 771 CA GLY B 331 2.238 -8.938 -0.315 1.00 0.00 C ATOM 772 C GLY B 331 3.424 -8.150 -0.832 1.00 0.00 C ATOM 773 O GLY B 331 3.500 -7.817 -2.005 1.00 0.00 O ATOM 0 H GLY B 331 0.994 -7.419 -0.989 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.466 -9.348 0.669 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.039 -9.783 -0.974 1.00 0.00 H new ATOM 777 N ILE B 332 4.362 -7.877 0.046 1.00 0.00 N ATOM 778 CA ILE B 332 5.560 -7.176 -0.352 1.00 0.00 C ATOM 779 C ILE B 332 6.569 -8.193 -0.821 1.00 0.00 C ATOM 780 O ILE B 332 6.927 -9.115 -0.091 1.00 0.00 O ATOM 781 CB ILE B 332 6.167 -6.402 0.811 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.111 -5.504 1.454 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.340 -5.551 0.305 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.427 -4.658 0.379 1.00 0.00 C ATOM 0 H ILE B 332 4.319 -8.128 1.034 1.00 0.00 H new ATOM 0 HA ILE B 332 5.302 -6.470 -1.141 1.00 0.00 H new ATOM 0 HB ILE B 332 6.529 -7.107 1.559 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.372 -6.112 1.976 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.575 -4.857 2.199 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.774 -4.997 1.138 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.098 -6.200 -0.133 1.00 0.00 H new ATOM 0 HG23 ILE B 332 6.982 -4.850 -0.449 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.675 -4.019 0.842 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.170 -4.038 -0.123 1.00 0.00 H new ATOM 0 HD13 ILE B 332 3.948 -5.313 -0.349 1.00 0.00 H new ATOM 796 N THR B 333 7.024 -8.006 -2.033 1.00 0.00 N ATOM 797 CA THR B 333 7.988 -8.878 -2.626 1.00 0.00 C ATOM 798 C THR B 333 9.225 -8.075 -2.930 1.00 0.00 C ATOM 799 O THR B 333 9.129 -6.947 -3.402 1.00 0.00 O ATOM 800 CB THR B 333 7.405 -9.452 -3.912 1.00 0.00 C ATOM 801 OG1 THR B 333 7.679 -8.575 -4.991 1.00 0.00 O ATOM 802 CG2 THR B 333 5.890 -9.609 -3.750 1.00 0.00 C ATOM 0 H THR B 333 6.730 -7.237 -2.635 1.00 0.00 H new ATOM 0 HA THR B 333 8.240 -9.697 -1.953 1.00 0.00 H new ATOM 0 HB THR B 333 7.855 -10.424 -4.117 1.00 0.00 H new ATOM 0 HG1 THR B 333 6.848 -8.379 -5.472 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.467 -10.019 -4.667 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.681 -10.284 -2.920 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.443 -8.636 -3.548 1.00 0.00 H new ATOM 810 N LYS B 334 10.379 -8.647 -2.667 1.00 0.00 N ATOM 811 CA LYS B 334 11.637 -7.953 -2.923 1.00 0.00 C ATOM 812 C LYS B 334 11.764 -7.545 -4.386 1.00 0.00 C ATOM 813 O LYS B 334 12.838 -7.211 -4.856 1.00 0.00 O ATOM 814 CB LYS B 334 12.807 -8.847 -2.540 1.00 0.00 C ATOM 815 CG LYS B 334 12.744 -10.155 -3.331 1.00 0.00 C ATOM 816 CD LYS B 334 12.668 -11.334 -2.359 1.00 0.00 C ATOM 817 CE LYS B 334 12.712 -12.647 -3.143 1.00 0.00 C ATOM 818 NZ LYS B 334 12.770 -13.792 -2.191 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.480 -9.585 -2.278 1.00 0.00 H new ATOM 0 HA LYS B 334 11.648 -7.047 -2.316 1.00 0.00 H new ATOM 0 HB2 LYS B 334 13.748 -8.335 -2.741 1.00 0.00 H new ATOM 0 HB3 LYS B 334 12.781 -9.057 -1.471 1.00 0.00 H new ATOM 0 HG2 LYS B 334 11.874 -10.154 -3.988 1.00 0.00 H new ATOM 0 HG3 LYS B 334 13.624 -10.250 -3.968 1.00 0.00 H new ATOM 0 HD2 LYS B 334 13.498 -11.291 -1.654 1.00 0.00 H new ATOM 0 HD3 LYS B 334 11.750 -11.278 -1.774 1.00 0.00 H new ATOM 0 HE2 LYS B 334 11.831 -12.733 -3.779 1.00 0.00 H new ATOM 0 HE3 LYS B 334 13.582 -12.662 -3.800 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 12.800 -14.685 -2.723 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 13.624 -13.711 -1.602 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 11.927 -13.780 -1.582 1.00 0.00 H new ATOM 832 N GLU B 335 10.659 -7.593 -5.091 1.00 0.00 N ATOM 833 CA GLU B 335 10.608 -7.208 -6.495 1.00 0.00 C ATOM 834 C GLU B 335 9.280 -6.534 -6.824 1.00 0.00 C ATOM 835 O GLU B 335 9.061 -6.122 -7.964 1.00 0.00 O ATOM 836 CB GLU B 335 10.794 -8.436 -7.386 1.00 0.00 C ATOM 837 CG GLU B 335 9.815 -9.530 -6.957 1.00 0.00 C ATOM 838 CD GLU B 335 10.018 -10.778 -7.812 1.00 0.00 C ATOM 839 OE1 GLU B 335 9.408 -10.856 -8.865 1.00 0.00 O ATOM 840 OE2 GLU B 335 10.782 -11.635 -7.400 1.00 0.00 O1- ATOM 0 H GLU B 335 9.763 -7.900 -4.713 1.00 0.00 H new ATOM 0 HA GLU B 335 11.416 -6.500 -6.682 1.00 0.00 H new ATOM 0 HB2 GLU B 335 10.625 -8.170 -8.430 1.00 0.00 H new ATOM 0 HB3 GLU B 335 11.819 -8.800 -7.312 1.00 0.00 H new ATOM 0 HG2 GLU B 335 9.966 -9.772 -5.905 1.00 0.00 H new ATOM 0 HG3 GLU B 335 8.790 -9.173 -7.059 1.00 0.00 H new ATOM 847 N CYS B 336 8.366 -6.475 -5.852 1.00 0.00 N ATOM 848 CA CYS B 336 7.056 -5.911 -6.122 1.00 0.00 C ATOM 849 C CYS B 336 6.192 -5.815 -4.892 1.00 0.00 C ATOM 850 O CYS B 336 6.558 -6.236 -3.798 1.00 0.00 O ATOM 851 CB CYS B 336 6.336 -6.751 -7.181 1.00 0.00 C ATOM 852 SG CYS B 336 4.945 -7.633 -6.431 1.00 0.00 S ATOM 0 H CYS B 336 8.509 -6.803 -4.897 1.00 0.00 H new ATOM 0 HA CYS B 336 7.220 -4.896 -6.484 1.00 0.00 H new ATOM 0 HB2 CYS B 336 5.978 -6.108 -7.985 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.031 -7.463 -7.627 1.00 0.00 H new ATOM 0 HG CYS B 336 4.340 -8.341 -7.338 1.00 0.00 H new ATOM 858 N VAL B 337 5.032 -5.244 -5.118 1.00 0.00 N ATOM 859 CA VAL B 337 4.041 -5.049 -4.089 1.00 0.00 C ATOM 860 C VAL B 337 2.740 -5.518 -4.665 1.00 0.00 C ATOM 861 O VAL B 337 2.563 -5.415 -5.872 1.00 0.00 O ATOM 862 CB VAL B 337 3.991 -3.571 -3.759 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.201 -3.336 -2.472 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.426 -3.102 -3.583 1.00 0.00 C ATOM 0 H VAL B 337 4.748 -4.898 -6.034 1.00 0.00 H new ATOM 0 HA VAL B 337 4.264 -5.597 -3.174 1.00 0.00 H new ATOM 0 HB VAL B 337 3.495 -3.018 -4.557 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.175 -2.269 -2.250 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.183 -3.705 -2.597 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.680 -3.866 -1.649 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.434 -2.039 -3.343 1.00 0.00 H new ATOM 0 HG22 VAL B 337 5.894 -3.660 -2.772 1.00 0.00 H new ATOM 0 HG23 VAL B 337 5.980 -3.270 -4.507 1.00 0.00 H new ATOM 874 N MET B 338 1.858 -6.095 -3.866 1.00 0.00 N ATOM 875 CA MET B 338 0.646 -6.621 -4.482 1.00 0.00 C ATOM 876 C MET B 338 -0.558 -6.664 -3.565 1.00 0.00 C ATOM 877 O MET B 338 -0.438 -6.869 -2.362 1.00 0.00 O ATOM 878 CB MET B 338 0.913 -8.042 -4.985 1.00 0.00 C ATOM 879 CG MET B 338 1.936 -8.749 -4.094 1.00 0.00 C ATOM 880 SD MET B 338 2.332 -10.369 -4.793 1.00 0.00 S ATOM 881 CE MET B 338 2.757 -11.196 -3.242 1.00 0.00 C ATOM 0 H MET B 338 1.943 -6.209 -2.856 1.00 0.00 H new ATOM 0 HA MET B 338 0.403 -5.932 -5.291 1.00 0.00 H new ATOM 0 HB2 MET B 338 -0.018 -8.609 -4.999 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.280 -8.007 -6.011 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.840 -8.146 -4.012 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.537 -8.864 -3.086 1.00 0.00 H new ATOM 0 HE1 MET B 338 3.269 -12.134 -3.458 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.411 -10.552 -2.654 1.00 0.00 H new ATOM 0 HE3 MET B 338 1.847 -11.401 -2.678 1.00 0.00 H new ATOM 891 N ARG B 339 -1.733 -6.548 -4.180 1.00 0.00 N ATOM 892 CA ARG B 339 -2.978 -6.649 -3.445 1.00 0.00 C ATOM 893 C ARG B 339 -3.483 -8.072 -3.552 1.00 0.00 C ATOM 894 O ARG B 339 -3.939 -8.507 -4.613 1.00 0.00 O ATOM 895 CB ARG B 339 -4.023 -5.697 -4.014 1.00 0.00 C ATOM 896 CG ARG B 339 -3.455 -4.279 -4.051 1.00 0.00 C ATOM 897 CD ARG B 339 -4.534 -3.307 -4.532 1.00 0.00 C ATOM 898 NE ARG B 339 -5.679 -4.046 -5.053 1.00 0.00 N ATOM 899 CZ ARG B 339 -6.508 -3.507 -5.942 1.00 0.00 C ATOM 900 NH1 ARG B 339 -6.308 -2.289 -6.368 1.00 0.00 N ATOM 901 NH2 ARG B 339 -7.522 -4.194 -6.390 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.842 -6.385 -5.181 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.802 -6.380 -2.403 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.309 -6.012 -5.018 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.925 -5.723 -3.403 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -3.107 -3.990 -3.059 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -2.592 -4.239 -4.716 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.849 -2.665 -3.709 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -4.129 -2.656 -5.307 1.00 0.00 H new ATOM 0 HE ARG B 339 -5.847 -4.998 -4.728 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -5.515 -1.750 -6.019 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -6.944 -1.876 -7.050 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -7.680 -5.146 -6.058 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -8.157 -3.780 -7.072 1.00 0.00 H new ATOM 915 N VAL B 340 -3.364 -8.793 -2.455 1.00 0.00 N ATOM 916 CA VAL B 340 -3.770 -10.178 -2.400 1.00 0.00 C ATOM 917 C VAL B 340 -5.169 -10.320 -1.828 1.00 0.00 C ATOM 918 O VAL B 340 -5.614 -9.504 -1.022 1.00 0.00 O ATOM 919 CB VAL B 340 -2.756 -10.978 -1.590 1.00 0.00 C ATOM 920 CG1 VAL B 340 -2.908 -12.447 -1.914 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.355 -10.525 -1.963 1.00 0.00 C ATOM 0 H VAL B 340 -2.984 -8.434 -1.580 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.799 -10.575 -3.415 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.924 -10.818 -0.525 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.185 -13.024 -1.337 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -3.917 -12.773 -1.661 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.732 -12.605 -2.978 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.624 -11.093 -1.388 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.189 -10.693 -3.027 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.245 -9.463 -1.742 1.00 0.00 H new ATOM 931 N ASP B 341 -5.867 -11.352 -2.283 1.00 0.00 N ATOM 932 CA ASP B 341 -7.230 -11.590 -1.848 1.00 0.00 C ATOM 933 C ASP B 341 -7.255 -12.427 -0.583 1.00 0.00 C ATOM 934 O ASP B 341 -7.293 -13.648 -0.638 1.00 0.00 O ATOM 935 CB ASP B 341 -8.014 -12.304 -2.949 1.00 0.00 C ATOM 936 CG ASP B 341 -9.509 -12.228 -2.657 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.865 -11.669 -1.634 1.00 0.00 O1- ATOM 938 OD2 ASP B 341 -10.275 -12.731 -3.462 1.00 0.00 O ATOM 0 H ASP B 341 -5.510 -12.034 -2.952 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.693 -10.626 -1.638 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.800 -11.846 -3.915 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.700 -13.346 -3.013 1.00 0.00 H new ATOM 943 N GLU B 342 -7.245 -11.746 0.547 1.00 0.00 N ATOM 944 CA GLU B 342 -7.278 -12.400 1.853 1.00 0.00 C ATOM 945 C GLU B 342 -8.157 -13.639 1.810 1.00 0.00 C ATOM 946 O GLU B 342 -7.963 -14.589 2.568 1.00 0.00 O ATOM 947 CB GLU B 342 -7.854 -11.406 2.873 1.00 0.00 C ATOM 948 CG GLU B 342 -7.221 -11.592 4.251 1.00 0.00 C ATOM 949 CD GLU B 342 -8.292 -11.485 5.331 1.00 0.00 C ATOM 950 OE1 GLU B 342 -8.968 -10.470 5.368 1.00 0.00 O1- ATOM 951 OE2 GLU B 342 -8.422 -12.421 6.103 1.00 0.00 O ATOM 0 H GLU B 342 -7.214 -10.727 0.592 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.269 -12.703 2.133 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.683 -10.387 2.527 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.933 -11.541 2.945 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.730 -12.564 4.308 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.452 -10.837 4.413 1.00 0.00 H new ATOM 958 N LYS B 343 -9.117 -13.609 0.911 1.00 0.00 N ATOM 959 CA LYS B 343 -10.045 -14.712 0.740 1.00 0.00 C ATOM 960 C LYS B 343 -9.366 -15.928 0.121 1.00 0.00 C ATOM 961 O LYS B 343 -9.619 -17.060 0.531 1.00 0.00 O ATOM 962 CB LYS B 343 -11.180 -14.270 -0.174 1.00 0.00 C ATOM 963 CG LYS B 343 -11.972 -13.151 0.498 1.00 0.00 C ATOM 964 CD LYS B 343 -12.834 -12.443 -0.548 1.00 0.00 C ATOM 965 CE LYS B 343 -14.072 -11.847 0.125 1.00 0.00 C ATOM 966 NZ LYS B 343 -13.737 -11.453 1.522 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.278 -12.824 0.279 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.421 -14.991 1.724 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -10.779 -13.924 -1.127 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -11.835 -15.114 -0.391 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.601 -13.560 1.289 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.292 -12.440 0.967 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.259 -11.656 -1.036 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.133 -13.147 -1.324 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -14.421 -10.979 -0.435 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -14.884 -12.574 0.126 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -14.414 -10.737 1.853 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -13.787 -12.288 2.140 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -12.775 -11.059 1.550 1.00 0.00 H new ATOM 980 N THR B 344 -8.540 -15.688 -0.893 1.00 0.00 N ATOM 981 CA THR B 344 -7.871 -16.775 -1.595 1.00 0.00 C ATOM 982 C THR B 344 -6.356 -16.728 -1.427 1.00 0.00 C ATOM 983 O THR B 344 -5.682 -17.728 -1.667 1.00 0.00 O ATOM 984 CB THR B 344 -8.224 -16.702 -3.077 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.570 -15.589 -3.658 1.00 0.00 O ATOM 986 CG2 THR B 344 -9.738 -16.552 -3.237 1.00 0.00 C ATOM 0 H THR B 344 -8.320 -14.756 -1.244 1.00 0.00 H new ATOM 0 HA THR B 344 -8.216 -17.714 -1.163 1.00 0.00 H new ATOM 0 HB THR B 344 -7.900 -17.616 -3.576 1.00 0.00 H new ATOM 0 HG1 THR B 344 -8.238 -14.967 -4.016 1.00 0.00 H new ATOM 0 HG21 THR B 344 -9.989 -16.500 -4.297 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.238 -17.410 -2.788 1.00 0.00 H new ATOM 0 HG23 THR B 344 -10.068 -15.639 -2.741 1.00 0.00 H new ATOM 994 N LYS B 345 -5.823 -15.577 -1.018 1.00 0.00 N ATOM 995 CA LYS B 345 -4.387 -15.443 -0.832 1.00 0.00 C ATOM 996 C LYS B 345 -3.699 -15.263 -2.178 1.00 0.00 C ATOM 997 O LYS B 345 -2.477 -15.129 -2.251 1.00 0.00 O ATOM 998 CB LYS B 345 -3.843 -16.679 -0.130 1.00 0.00 C ATOM 999 CG LYS B 345 -2.631 -16.305 0.727 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.079 -17.562 1.405 1.00 0.00 C ATOM 1001 CE LYS B 345 -1.898 -17.301 2.902 1.00 0.00 C ATOM 1002 NZ LYS B 345 -0.954 -16.165 3.098 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.361 -14.735 -0.812 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.188 -14.565 -0.217 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -4.618 -17.122 0.495 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -3.559 -17.430 -0.867 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -1.861 -15.845 0.107 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -2.917 -15.569 1.478 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -2.760 -18.399 1.251 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.125 -17.840 0.956 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -2.860 -17.072 3.361 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -1.515 -18.195 3.394 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -0.479 -16.263 4.018 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -0.243 -16.169 2.339 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -1.480 -15.268 3.074 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.498 -15.235 -3.243 1.00 0.00 N ATOM 1017 CA GLU B 346 -3.963 -15.041 -4.574 1.00 0.00 C ATOM 1018 C GLU B 346 -3.808 -13.559 -4.841 1.00 0.00 C ATOM 1019 O GLU B 346 -4.451 -12.728 -4.200 1.00 0.00 O ATOM 1020 CB GLU B 346 -4.889 -15.652 -5.613 1.00 0.00 C ATOM 1021 CG GLU B 346 -6.083 -14.728 -5.840 1.00 0.00 C ATOM 1022 CD GLU B 346 -7.304 -15.537 -6.264 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -7.119 -16.635 -6.762 1.00 0.00 O ATOM 1024 OE2 GLU B 346 -8.407 -15.046 -6.084 1.00 0.00 O1- ATOM 0 H GLU B 346 -5.511 -15.344 -3.203 1.00 0.00 H new ATOM 0 HA GLU B 346 -2.992 -15.532 -4.640 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -4.352 -15.805 -6.549 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -5.232 -16.631 -5.278 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -6.303 -14.176 -4.926 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -5.842 -13.992 -6.607 1.00 0.00 H new ATOM 1031 N VAL B 347 -2.934 -13.233 -5.763 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.674 -11.835 -6.078 1.00 0.00 C ATOM 1033 C VAL B 347 -3.632 -11.290 -7.112 1.00 0.00 C ATOM 1034 O VAL B 347 -3.858 -11.893 -8.160 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.243 -11.641 -6.545 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.048 -10.182 -6.972 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.314 -11.949 -5.379 1.00 0.00 C ATOM 0 H VAL B 347 -2.392 -13.904 -6.308 1.00 0.00 H new ATOM 0 HA VAL B 347 -2.829 -11.275 -5.156 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.026 -12.299 -7.386 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.022 -10.036 -7.309 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.734 -9.946 -7.786 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.249 -9.525 -6.126 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.721 -11.816 -5.693 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.532 -11.273 -4.552 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.465 -12.979 -5.056 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.165 -10.114 -6.812 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.071 -9.449 -7.718 1.00 0.00 C ATOM 1049 C ILE B 348 -4.313 -8.347 -8.422 1.00 0.00 C ATOM 1050 O ILE B 348 -4.618 -8.003 -9.564 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.257 -8.859 -6.951 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -6.837 -9.919 -6.008 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.334 -8.411 -7.941 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.115 -11.209 -6.786 1.00 0.00 C ATOM 0 H ILE B 348 -3.981 -9.606 -5.947 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.459 -10.164 -8.443 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.921 -8.001 -6.368 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -6.138 -10.117 -5.195 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -7.758 -9.551 -5.555 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -8.178 -7.991 -7.395 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.922 -7.655 -8.609 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.670 -9.268 -8.525 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -7.527 -11.959 -6.111 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.830 -11.006 -7.583 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -6.186 -11.581 -7.218 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.325 -7.786 -7.726 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.546 -6.714 -8.300 1.00 0.00 C ATOM 1068 C GLN B 349 -1.082 -6.840 -7.949 1.00 0.00 C ATOM 1069 O GLN B 349 -0.722 -7.452 -6.947 1.00 0.00 O ATOM 1070 CB GLN B 349 -3.045 -5.416 -7.733 1.00 0.00 C ATOM 1071 CG GLN B 349 -2.324 -4.240 -8.379 1.00 0.00 C ATOM 1072 CD GLN B 349 -3.299 -3.090 -8.604 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -4.229 -2.855 -7.721 1.00 0.00 O flip ATOM 1074 NE2 GLN B 349 -3.217 -2.396 -9.617 1.00 0.00 N flip ATOM 0 H GLN B 349 -3.056 -8.057 -6.780 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.651 -6.756 -9.384 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -4.119 -5.328 -7.900 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.888 -5.399 -6.655 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -1.503 -3.912 -7.742 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -1.887 -4.548 -9.329 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -2.488 -2.583 -10.306 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -3.878 -1.634 -9.768 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.253 -6.212 -8.766 1.00 0.00 N ATOM 1084 CA GLU B 350 1.181 -6.202 -8.536 1.00 0.00 C ATOM 1085 C GLU B 350 1.782 -4.865 -8.896 1.00 0.00 C ATOM 1086 O GLU B 350 1.315 -4.174 -9.801 1.00 0.00 O ATOM 1087 CB GLU B 350 1.901 -7.254 -9.369 1.00 0.00 C ATOM 1088 CG GLU B 350 1.392 -8.642 -9.020 1.00 0.00 C ATOM 1089 CD GLU B 350 1.967 -9.674 -9.984 1.00 0.00 C ATOM 1090 OE1 GLU B 350 1.421 -9.814 -11.066 1.00 0.00 O1- ATOM 1091 OE2 GLU B 350 2.943 -10.312 -9.624 1.00 0.00 O ATOM 0 H GLU B 350 -0.550 -5.701 -9.597 1.00 0.00 H new ATOM 0 HA GLU B 350 1.312 -6.413 -7.475 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.744 -7.058 -10.430 1.00 0.00 H new ATOM 0 HB3 GLU B 350 2.975 -7.197 -9.190 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.673 -8.893 -7.997 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.303 -8.659 -9.065 1.00 0.00 H new ATOM 1098 N TRP B 351 2.852 -4.534 -8.201 1.00 0.00 N ATOM 1099 CA TRP B 351 3.562 -3.293 -8.478 1.00 0.00 C ATOM 1100 C TRP B 351 5.004 -3.367 -7.998 1.00 0.00 C ATOM 1101 O TRP B 351 5.266 -3.611 -6.828 1.00 0.00 O ATOM 1102 CB TRP B 351 2.850 -2.119 -7.826 1.00 0.00 C ATOM 1103 CG TRP B 351 2.374 -1.186 -8.887 1.00 0.00 C ATOM 1104 CD1 TRP B 351 3.153 -0.613 -9.828 1.00 0.00 C ATOM 1105 CD2 TRP B 351 1.019 -0.721 -9.142 1.00 0.00 C ATOM 1106 NE1 TRP B 351 2.363 0.175 -10.638 1.00 0.00 N ATOM 1107 CE2 TRP B 351 1.044 0.146 -10.257 1.00 0.00 C ATOM 1108 CE3 TRP B 351 -0.214 -0.963 -8.519 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 -0.110 0.751 -10.743 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 -1.384 -0.350 -9.003 1.00 0.00 C ATOM 1111 CH2 TRP B 351 -1.329 0.506 -10.115 1.00 0.00 C ATOM 0 H TRP B 351 3.248 -5.097 -7.448 1.00 0.00 H new ATOM 0 HA TRP B 351 3.572 -3.145 -9.558 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.008 -2.473 -7.231 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.525 -1.601 -7.145 1.00 0.00 H new ATOM 0 HD1 TRP B 351 4.220 -0.749 -9.930 1.00 0.00 H new ATOM 0 HE1 TRP B 351 2.717 0.716 -11.427 1.00 0.00 H new ATOM 0 HE3 TRP B 351 -0.265 -1.622 -7.665 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 -0.061 1.406 -11.601 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 -2.330 -0.539 -8.517 1.00 0.00 H new ATOM 0 HH2 TRP B 351 -2.230 0.974 -10.483 1.00 0.00 H new ATOM 1122 N SER B 352 5.937 -3.162 -8.919 1.00 0.00 N ATOM 1123 CA SER B 352 7.344 -3.234 -8.594 1.00 0.00 C ATOM 1124 C SER B 352 7.656 -2.491 -7.315 1.00 0.00 C ATOM 1125 O SER B 352 7.168 -1.386 -7.080 1.00 0.00 O ATOM 1126 CB SER B 352 8.189 -2.656 -9.717 1.00 0.00 C ATOM 1127 OG SER B 352 7.344 -2.024 -10.670 1.00 0.00 O ATOM 0 H SER B 352 5.738 -2.945 -9.896 1.00 0.00 H new ATOM 0 HA SER B 352 7.585 -4.288 -8.459 1.00 0.00 H new ATOM 0 HB2 SER B 352 8.904 -1.937 -9.316 1.00 0.00 H new ATOM 0 HB3 SER B 352 8.767 -3.447 -10.195 1.00 0.00 H new ATOM 0 HG SER B 352 7.560 -2.353 -11.568 1.00 0.00 H new ATOM 1133 N LEU B 353 8.511 -3.095 -6.515 1.00 0.00 N ATOM 1134 CA LEU B 353 8.947 -2.494 -5.294 1.00 0.00 C ATOM 1135 C LEU B 353 10.049 -1.524 -5.674 1.00 0.00 C ATOM 1136 O LEU B 353 10.149 -0.417 -5.142 1.00 0.00 O ATOM 1137 CB LEU B 353 9.459 -3.605 -4.374 1.00 0.00 C ATOM 1138 CG LEU B 353 9.199 -3.286 -2.901 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.376 -4.544 -2.083 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.211 -2.280 -2.407 1.00 0.00 C ATOM 0 H LEU B 353 8.916 -4.013 -6.702 1.00 0.00 H new ATOM 0 HA LEU B 353 8.155 -1.963 -4.766 1.00 0.00 H new ATOM 0 HB2 LEU B 353 8.973 -4.545 -4.634 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.528 -3.745 -4.533 1.00 0.00 H new ATOM 0 HG LEU B 353 8.188 -2.890 -2.801 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.192 -4.323 -1.032 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.670 -5.302 -2.424 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.394 -4.916 -2.203 1.00 0.00 H new ATOM 0 HD21 LEU B 353 10.020 -2.057 -1.357 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.215 -2.691 -2.514 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.130 -1.364 -2.993 1.00 0.00 H new ATOM 1152 N THR B 354 10.843 -1.941 -6.659 1.00 0.00 N ATOM 1153 CA THR B 354 11.906 -1.102 -7.169 1.00 0.00 C ATOM 1154 C THR B 354 11.319 0.054 -7.954 1.00 0.00 C ATOM 1155 O THR B 354 12.047 0.830 -8.574 1.00 0.00 O ATOM 1156 CB THR B 354 12.825 -1.918 -8.079 1.00 0.00 C ATOM 1157 OG1 THR B 354 13.185 -3.127 -7.432 1.00 0.00 O ATOM 1158 CG2 THR B 354 14.080 -1.109 -8.395 1.00 0.00 C ATOM 0 H THR B 354 10.765 -2.851 -7.112 1.00 0.00 H new ATOM 0 HA THR B 354 12.482 -0.714 -6.328 1.00 0.00 H new ATOM 0 HB THR B 354 12.303 -2.150 -9.007 1.00 0.00 H new ATOM 0 HG1 THR B 354 13.490 -3.777 -8.099 1.00 0.00 H new ATOM 0 HG21 THR B 354 14.735 -1.691 -9.044 1.00 0.00 H new ATOM 0 HG22 THR B 354 13.799 -0.184 -8.899 1.00 0.00 H new ATOM 0 HG23 THR B 354 14.604 -0.873 -7.469 1.00 0.00 H new ATOM 1166 N ASN B 355 10.000 0.173 -7.914 1.00 0.00 N ATOM 1167 CA ASN B 355 9.335 1.257 -8.622 1.00 0.00 C ATOM 1168 C ASN B 355 8.802 2.269 -7.632 1.00 0.00 C ATOM 1169 O ASN B 355 8.279 3.308 -8.018 1.00 0.00 O ATOM 1170 CB ASN B 355 8.179 0.726 -9.472 1.00 0.00 C ATOM 1171 CG ASN B 355 8.716 0.192 -10.795 1.00 0.00 C ATOM 1172 OD1 ASN B 355 9.903 -0.114 -10.904 1.00 0.00 O ATOM 1173 ND2 ASN B 355 7.911 0.061 -11.813 1.00 0.00 N ATOM 0 H ASN B 355 9.377 -0.456 -7.408 1.00 0.00 H new ATOM 0 HA ASN B 355 10.065 1.731 -9.278 1.00 0.00 H new ATOM 0 HB2 ASN B 355 7.654 -0.065 -8.936 1.00 0.00 H new ATOM 0 HB3 ASN B 355 7.456 1.520 -9.656 1.00 0.00 H new ATOM 0 HD21 ASN B 355 8.265 -0.295 -12.701 1.00 0.00 H new ATOM 0 HD22 ASN B 355 6.927 0.315 -11.721 1.00 0.00 H new ATOM 1180 N ILE B 356 8.929 1.963 -6.352 1.00 0.00 N ATOM 1181 CA ILE B 356 8.435 2.860 -5.334 1.00 0.00 C ATOM 1182 C ILE B 356 9.121 4.224 -5.400 1.00 0.00 C ATOM 1183 O ILE B 356 10.312 4.313 -5.693 1.00 0.00 O ATOM 1184 CB ILE B 356 8.640 2.212 -3.987 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.690 1.018 -3.880 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.324 3.230 -2.902 1.00 0.00 C ATOM 1187 CD1 ILE B 356 7.926 0.274 -2.568 1.00 0.00 C ATOM 0 H ILE B 356 9.365 1.110 -6.001 1.00 0.00 H new ATOM 0 HA ILE B 356 7.373 3.041 -5.500 1.00 0.00 H new ATOM 0 HB ILE B 356 9.669 1.873 -3.870 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.656 1.360 -3.932 1.00 0.00 H new ATOM 0 HG13 ILE B 356 7.845 0.344 -4.722 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.468 2.774 -1.922 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.988 4.089 -3.004 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.289 3.558 -3.001 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.244 -0.574 -2.503 1.00 0.00 H new ATOM 0 HD12 ILE B 356 8.955 -0.084 -2.533 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.748 0.948 -1.730 1.00 0.00 H new ATOM 1199 N LYS B 357 8.358 5.289 -5.112 1.00 0.00 N ATOM 1200 CA LYS B 357 8.915 6.642 -5.131 1.00 0.00 C ATOM 1201 C LYS B 357 9.057 7.141 -3.701 1.00 0.00 C ATOM 1202 O LYS B 357 10.101 7.658 -3.302 1.00 0.00 O ATOM 1203 CB LYS B 357 8.015 7.577 -5.954 1.00 0.00 C ATOM 1204 CG LYS B 357 8.870 8.686 -6.572 1.00 0.00 C ATOM 1205 CD LYS B 357 9.438 8.207 -7.911 1.00 0.00 C ATOM 1206 CE LYS B 357 10.739 8.955 -8.212 1.00 0.00 C ATOM 1207 NZ LYS B 357 11.192 8.626 -9.593 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.369 5.238 -4.867 1.00 0.00 H new ATOM 0 HA LYS B 357 9.898 6.629 -5.601 1.00 0.00 H new ATOM 0 HB2 LYS B 357 7.506 7.015 -6.737 1.00 0.00 H new ATOM 0 HB3 LYS B 357 7.242 8.009 -5.318 1.00 0.00 H new ATOM 0 HG2 LYS B 357 8.269 9.583 -6.720 1.00 0.00 H new ATOM 0 HG3 LYS B 357 9.682 8.954 -5.895 1.00 0.00 H new ATOM 0 HD2 LYS B 357 9.623 7.133 -7.876 1.00 0.00 H new ATOM 0 HD3 LYS B 357 8.714 8.380 -8.708 1.00 0.00 H new ATOM 0 HE2 LYS B 357 10.584 10.030 -8.115 1.00 0.00 H new ATOM 0 HE3 LYS B 357 11.507 8.677 -7.490 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 12.076 9.134 -9.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 11.355 7.602 -9.670 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 10.461 8.913 -10.275 1.00 0.00 H new ATOM 1221 N ARG B 358 8.009 6.926 -2.926 1.00 0.00 N ATOM 1222 CA ARG B 358 7.999 7.283 -1.522 1.00 0.00 C ATOM 1223 C ARG B 358 6.723 6.725 -0.910 1.00 0.00 C ATOM 1224 O ARG B 358 5.658 6.789 -1.506 1.00 0.00 O ATOM 1225 CB ARG B 358 8.078 8.800 -1.337 1.00 0.00 C ATOM 1226 CG ARG B 358 7.093 9.494 -2.264 1.00 0.00 C ATOM 1227 CD ARG B 358 7.400 10.983 -2.325 1.00 0.00 C ATOM 1228 NE ARG B 358 6.161 11.744 -2.440 1.00 0.00 N ATOM 1229 CZ ARG B 358 5.403 11.665 -3.530 1.00 0.00 C ATOM 1230 NH1 ARG B 358 5.765 10.903 -4.526 1.00 0.00 N ATOM 1231 NH2 ARG B 358 4.294 12.349 -3.603 1.00 0.00 N1+ ATOM 0 H ARG B 358 7.142 6.499 -3.254 1.00 0.00 H new ATOM 0 HA ARG B 358 8.871 6.860 -1.023 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.858 9.059 -0.301 1.00 0.00 H new ATOM 0 HB3 ARG B 358 9.090 9.147 -1.545 1.00 0.00 H new ATOM 0 HG2 ARG B 358 7.152 9.060 -3.262 1.00 0.00 H new ATOM 0 HG3 ARG B 358 6.074 9.338 -1.909 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.942 11.288 -1.430 1.00 0.00 H new ATOM 0 HD3 ARG B 358 8.047 11.195 -3.176 1.00 0.00 H new ATOM 0 HE ARG B 358 5.871 12.348 -1.671 1.00 0.00 H new ATOM 0 HH11 ARG B 358 6.631 10.367 -4.469 1.00 0.00 H new ATOM 0 HH12 ARG B 358 5.182 10.844 -5.361 1.00 0.00 H new ATOM 0 HH21 ARG B 358 4.009 12.943 -2.825 1.00 0.00 H new ATOM 0 HH22 ARG B 358 3.712 12.289 -4.438 1.00 0.00 H new ATOM 1245 N TRP B 359 6.847 6.132 0.251 1.00 0.00 N ATOM 1246 CA TRP B 359 5.717 5.511 0.912 1.00 0.00 C ATOM 1247 C TRP B 359 5.464 6.179 2.252 1.00 0.00 C ATOM 1248 O TRP B 359 6.210 7.074 2.648 1.00 0.00 O ATOM 1249 CB TRP B 359 6.018 4.025 1.065 1.00 0.00 C ATOM 1250 CG TRP B 359 7.321 3.828 1.768 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.453 3.390 3.030 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.665 4.045 1.268 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.798 3.314 3.342 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.588 3.730 2.290 1.00 0.00 C ATOM 1255 CE3 TRP B 359 9.161 4.489 0.042 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.966 3.854 2.096 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.543 4.622 -0.160 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.445 4.306 0.869 1.00 0.00 C ATOM 0 H TRP B 359 7.725 6.064 0.765 1.00 0.00 H new ATOM 0 HA TRP B 359 4.808 5.631 0.322 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.218 3.541 1.626 1.00 0.00 H new ATOM 0 HB3 TRP B 359 6.051 3.551 0.084 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.640 3.138 3.694 1.00 0.00 H new ATOM 0 HE1 TRP B 359 9.161 2.991 4.239 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.476 4.732 -0.757 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.653 3.602 2.890 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.915 4.969 -1.112 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.508 4.413 0.709 1.00 0.00 H new ATOM 1269 N ALA B 360 4.400 5.781 2.941 1.00 0.00 N ATOM 1270 CA ALA B 360 4.098 6.420 4.211 1.00 0.00 C ATOM 1271 C ALA B 360 3.235 5.543 5.093 1.00 0.00 C ATOM 1272 O ALA B 360 2.014 5.488 4.947 1.00 0.00 O ATOM 1273 CB ALA B 360 3.388 7.743 3.966 1.00 0.00 C ATOM 0 H ALA B 360 3.754 5.046 2.653 1.00 0.00 H new ATOM 0 HA ALA B 360 5.043 6.590 4.727 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.164 8.218 4.921 1.00 0.00 H new ATOM 0 HB2 ALA B 360 4.031 8.397 3.377 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.460 7.563 3.424 1.00 0.00 H new ATOM 1279 N ALA B 361 3.891 4.879 6.013 1.00 0.00 N ATOM 1280 CA ALA B 361 3.225 4.010 6.949 1.00 0.00 C ATOM 1281 C ALA B 361 2.626 4.809 8.098 1.00 0.00 C ATOM 1282 O ALA B 361 3.156 5.853 8.480 1.00 0.00 O ATOM 1283 CB ALA B 361 4.208 2.992 7.499 1.00 0.00 C ATOM 0 H ALA B 361 4.903 4.927 6.133 1.00 0.00 H new ATOM 0 HA ALA B 361 2.420 3.496 6.424 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.697 2.338 8.206 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.611 2.396 6.680 1.00 0.00 H new ATOM 0 HB3 ALA B 361 5.022 3.510 8.006 1.00 0.00 H new ATOM 1289 N SER B 362 1.525 4.312 8.653 1.00 0.00 N ATOM 1290 CA SER B 362 0.875 4.987 9.766 1.00 0.00 C ATOM 1291 C SER B 362 0.441 3.956 10.810 1.00 0.00 C ATOM 1292 O SER B 362 0.587 2.754 10.591 1.00 0.00 O ATOM 1293 CB SER B 362 -0.330 5.772 9.250 1.00 0.00 C ATOM 1294 OG SER B 362 -0.285 7.096 9.760 1.00 0.00 O ATOM 0 H SER B 362 1.069 3.451 8.352 1.00 0.00 H new ATOM 0 HA SER B 362 1.572 5.682 10.234 1.00 0.00 H new ATOM 0 HB2 SER B 362 -0.326 5.790 8.160 1.00 0.00 H new ATOM 0 HB3 SER B 362 -1.255 5.284 9.557 1.00 0.00 H new ATOM 0 HG SER B 362 -1.057 7.601 9.428 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.076 4.386 11.936 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.515 3.460 13.012 1.00 0.00 C ATOM 1302 C PRO B 363 -1.866 2.830 12.710 1.00 0.00 C ATOM 1303 O PRO B 363 -2.332 1.958 13.436 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.603 4.341 14.252 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.738 5.749 13.769 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.314 5.790 12.299 1.00 0.00 C ATOM 0 HA PRO B 363 0.175 2.625 13.128 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.457 4.059 14.867 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.287 4.228 14.871 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.767 6.092 13.878 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.115 6.417 14.364 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.091 6.233 11.676 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.585 6.391 12.164 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.489 3.302 11.642 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.799 2.809 11.234 1.00 0.00 C ATOM 1316 C LYS B 364 -3.813 2.461 9.761 1.00 0.00 C ATOM 1317 O LYS B 364 -4.644 1.682 9.302 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.857 3.871 11.478 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.669 4.456 12.873 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.872 5.330 13.232 1.00 0.00 C ATOM 1321 CE LYS B 364 -5.448 6.382 14.257 1.00 0.00 C ATOM 1322 NZ LYS B 364 -6.622 7.222 14.623 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.108 4.030 11.038 1.00 0.00 H new ATOM 0 HA LYS B 364 -4.012 1.917 11.823 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.779 4.658 10.727 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.853 3.438 11.384 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.560 3.654 13.603 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.754 5.047 12.910 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -6.263 5.815 12.337 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.675 4.714 13.637 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -5.044 5.897 15.145 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -4.655 7.006 13.846 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -6.333 7.937 15.320 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -6.989 7.695 13.773 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -7.365 6.620 15.032 1.00 0.00 H new ATOM 1336 N SER B 365 -2.898 3.051 9.016 1.00 0.00 N ATOM 1337 CA SER B 365 -2.839 2.800 7.589 1.00 0.00 C ATOM 1338 C SER B 365 -1.448 2.984 7.045 1.00 0.00 C ATOM 1339 O SER B 365 -0.569 3.545 7.697 1.00 0.00 O ATOM 1340 CB SER B 365 -3.794 3.728 6.851 1.00 0.00 C ATOM 1341 OG SER B 365 -3.478 5.079 7.160 1.00 0.00 O ATOM 0 H SER B 365 -2.194 3.699 9.369 1.00 0.00 H new ATOM 0 HA SER B 365 -3.133 1.762 7.431 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.720 3.563 5.776 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.823 3.510 7.137 1.00 0.00 H new ATOM 0 HG SER B 365 -4.092 5.676 6.683 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.265 2.496 5.834 1.00 0.00 N ATOM 1348 CA PHE B 366 0.016 2.600 5.178 1.00 0.00 C ATOM 1349 C PHE B 366 -0.207 2.984 3.740 1.00 0.00 C ATOM 1350 O PHE B 366 -1.315 2.840 3.226 1.00 0.00 O ATOM 1351 CB PHE B 366 0.778 1.290 5.340 1.00 0.00 C ATOM 1352 CG PHE B 366 1.517 0.923 4.088 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.789 1.451 3.851 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.945 0.021 3.187 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.494 1.067 2.702 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.641 -0.354 2.038 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.914 0.164 1.795 1.00 0.00 C ATOM 0 H PHE B 366 -1.987 2.025 5.289 1.00 0.00 H new ATOM 0 HA PHE B 366 0.632 3.377 5.631 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.483 1.378 6.167 1.00 0.00 H new ATOM 0 HB3 PHE B 366 0.081 0.493 5.599 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.226 2.150 4.549 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.037 -0.386 3.380 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.481 1.464 2.514 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.195 -1.044 1.337 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.455 -0.130 0.908 1.00 0.00 H new ATOM 1367 N THR B 367 0.801 3.570 3.120 1.00 0.00 N ATOM 1368 CA THR B 367 0.606 4.067 1.776 1.00 0.00 C ATOM 1369 C THR B 367 1.862 4.004 0.932 1.00 0.00 C ATOM 1370 O THR B 367 2.975 3.989 1.444 1.00 0.00 O ATOM 1371 CB THR B 367 0.129 5.511 1.872 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.178 5.547 2.426 1.00 0.00 O ATOM 1373 CG2 THR B 367 0.123 6.144 0.490 1.00 0.00 C ATOM 0 H THR B 367 1.733 3.709 3.511 1.00 0.00 H new ATOM 0 HA THR B 367 -0.130 3.431 1.284 1.00 0.00 H new ATOM 0 HB THR B 367 0.806 6.071 2.517 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.482 6.477 2.487 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.219 7.176 0.564 1.00 0.00 H new ATOM 0 HG22 THR B 367 1.131 6.124 0.076 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.548 5.586 -0.163 1.00 0.00 H new ATOM 1381 N LEU B 368 1.653 3.967 -0.376 1.00 0.00 N ATOM 1382 CA LEU B 368 2.738 3.903 -1.332 1.00 0.00 C ATOM 1383 C LEU B 368 2.630 4.997 -2.361 1.00 0.00 C ATOM 1384 O LEU B 368 1.535 5.254 -2.837 1.00 0.00 O ATOM 1385 CB LEU B 368 2.639 2.596 -2.081 1.00 0.00 C ATOM 1386 CG LEU B 368 3.383 1.547 -1.293 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.818 0.164 -1.632 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.875 1.621 -1.618 1.00 0.00 C ATOM 0 H LEU B 368 0.725 3.981 -0.800 1.00 0.00 H new ATOM 0 HA LEU B 368 3.675 4.003 -0.784 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.595 2.308 -2.208 1.00 0.00 H new ATOM 0 HB3 LEU B 368 3.065 2.696 -3.079 1.00 0.00 H new ATOM 0 HG LEU B 368 3.256 1.724 -0.225 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.353 -0.597 -1.064 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.759 0.131 -1.375 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.939 -0.027 -2.698 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.410 0.862 -1.047 1.00 0.00 H new ATOM 0 HD22 LEU B 368 5.024 1.446 -2.683 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.256 2.608 -1.355 1.00 0.00 H new ATOM 1400 N ASP B 369 3.760 5.586 -2.767 1.00 0.00 N ATOM 1401 CA ASP B 369 3.707 6.585 -3.817 1.00 0.00 C ATOM 1402 C ASP B 369 4.511 6.142 -5.016 1.00 0.00 C ATOM 1403 O ASP B 369 5.715 6.369 -5.098 1.00 0.00 O ATOM 1404 CB ASP B 369 4.260 7.930 -3.366 1.00 0.00 C ATOM 1405 CG ASP B 369 3.731 9.035 -4.268 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.738 8.836 -5.471 1.00 0.00 O ATOM 1407 OD2 ASP B 369 3.329 10.060 -3.747 1.00 0.00 O1- ATOM 0 H ASP B 369 4.689 5.391 -2.394 1.00 0.00 H new ATOM 0 HA ASP B 369 2.653 6.697 -4.073 1.00 0.00 H new ATOM 0 HB2 ASP B 369 3.973 8.123 -2.332 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.349 7.914 -3.396 1.00 0.00 H new ATOM 1412 N PHE B 370 3.820 5.550 -5.960 1.00 0.00 N ATOM 1413 CA PHE B 370 4.462 5.147 -7.210 1.00 0.00 C ATOM 1414 C PHE B 370 3.604 5.469 -8.417 1.00 0.00 C ATOM 1415 O PHE B 370 2.748 4.677 -8.811 1.00 0.00 O ATOM 1416 CB PHE B 370 4.783 3.667 -7.269 1.00 0.00 C ATOM 1417 CG PHE B 370 5.182 3.327 -8.697 1.00 0.00 C ATOM 1418 CD1 PHE B 370 6.198 4.054 -9.344 1.00 0.00 C ATOM 1419 CD2 PHE B 370 4.528 2.297 -9.387 1.00 0.00 C ATOM 1420 CE1 PHE B 370 6.555 3.753 -10.659 1.00 0.00 C ATOM 1421 CE2 PHE B 370 4.893 1.997 -10.710 1.00 0.00 C ATOM 1422 CZ PHE B 370 5.905 2.725 -11.343 1.00 0.00 C ATOM 0 H PHE B 370 2.825 5.334 -5.899 1.00 0.00 H new ATOM 0 HA PHE B 370 5.390 5.718 -7.233 1.00 0.00 H new ATOM 0 HB2 PHE B 370 5.592 3.425 -6.580 1.00 0.00 H new ATOM 0 HB3 PHE B 370 3.918 3.077 -6.965 1.00 0.00 H new ATOM 0 HD1 PHE B 370 6.705 4.850 -8.819 1.00 0.00 H new ATOM 0 HD2 PHE B 370 3.744 1.734 -8.902 1.00 0.00 H new ATOM 0 HE1 PHE B 370 7.336 4.317 -11.148 1.00 0.00 H new ATOM 0 HE2 PHE B 370 4.390 1.201 -11.240 1.00 0.00 H new ATOM 0 HZ PHE B 370 6.183 2.492 -12.360 1.00 0.00 H new ATOM 1432 N GLY B 371 3.860 6.619 -9.018 1.00 0.00 N ATOM 1433 CA GLY B 371 3.120 7.020 -10.213 1.00 0.00 C ATOM 1434 C GLY B 371 2.628 8.442 -10.082 1.00 0.00 C ATOM 1435 O GLY B 371 1.780 8.893 -10.843 1.00 0.00 O ATOM 0 H GLY B 371 4.565 7.287 -8.707 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.760 6.930 -11.091 1.00 0.00 H new ATOM 0 HA3 GLY B 371 2.274 6.350 -10.366 1.00 0.00 H new ATOM 1439 N ASP B 372 3.149 9.121 -9.082 1.00 0.00 N ATOM 1440 CA ASP B 372 2.757 10.499 -8.807 1.00 0.00 C ATOM 1441 C ASP B 372 2.626 11.313 -10.079 1.00 0.00 C ATOM 1442 O ASP B 372 2.005 12.378 -10.080 1.00 0.00 O ATOM 1443 CB ASP B 372 3.793 11.152 -7.895 1.00 0.00 C ATOM 1444 CG ASP B 372 3.215 12.405 -7.248 1.00 0.00 C ATOM 1445 OD1 ASP B 372 2.771 13.274 -7.979 1.00 0.00 O ATOM 1446 OD2 ASP B 372 3.224 12.477 -6.031 1.00 0.00 O1- ATOM 0 H ASP B 372 3.848 8.745 -8.441 1.00 0.00 H new ATOM 0 HA ASP B 372 1.782 10.476 -8.320 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.104 10.447 -7.124 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.683 11.409 -8.470 1.00 0.00 H new ATOM 1451 N TYR B 373 3.179 10.809 -11.167 1.00 0.00 N ATOM 1452 CA TYR B 373 3.071 11.510 -12.423 1.00 0.00 C ATOM 1453 C TYR B 373 1.607 11.763 -12.693 1.00 0.00 C ATOM 1454 O TYR B 373 1.206 12.830 -13.156 1.00 0.00 O ATOM 1455 CB TYR B 373 3.686 10.661 -13.522 1.00 0.00 C ATOM 1456 CG TYR B 373 4.813 9.856 -12.927 1.00 0.00 C ATOM 1457 CD1 TYR B 373 5.911 10.513 -12.367 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.768 8.460 -12.944 1.00 0.00 C ATOM 1459 CE1 TYR B 373 6.968 9.777 -11.822 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.828 7.719 -12.403 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.929 8.378 -11.842 1.00 0.00 C ATOM 1462 OH TYR B 373 7.973 7.650 -11.309 1.00 0.00 O ATOM 0 H TYR B 373 3.698 9.932 -11.203 1.00 0.00 H new ATOM 0 HA TYR B 373 3.602 12.461 -12.389 1.00 0.00 H new ATOM 0 HB2 TYR B 373 2.935 10.000 -13.955 1.00 0.00 H new ATOM 0 HB3 TYR B 373 4.057 11.294 -14.328 1.00 0.00 H new ATOM 0 HD1 TYR B 373 5.944 11.592 -12.355 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.917 7.952 -13.374 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.814 10.288 -11.386 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.796 6.640 -12.419 1.00 0.00 H new ATOM 0 HH TYR B 373 7.786 6.693 -11.403 1.00 0.00 H new ATOM 1472 N GLN B 374 0.818 10.778 -12.324 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.620 10.862 -12.439 1.00 0.00 C ATOM 1474 C GLN B 374 -1.200 10.562 -11.074 1.00 0.00 C ATOM 1475 O GLN B 374 -1.279 11.439 -10.212 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.129 9.844 -13.457 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.247 8.593 -13.426 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.072 7.369 -13.813 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -2.210 7.221 -13.368 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -0.565 6.480 -14.622 1.00 0.00 N ATOM 0 H GLN B 374 1.156 9.897 -11.936 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.919 11.854 -12.778 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.162 9.577 -13.233 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.122 10.280 -14.456 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.591 8.710 -14.113 1.00 0.00 H new ATOM 0 HG3 GLN B 374 0.175 8.459 -12.430 1.00 0.00 H new ATOM 0 HE21 GLN B 374 0.378 6.604 -14.990 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -1.112 5.661 -14.887 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.507 9.297 -10.853 1.00 0.00 N ATOM 1490 CA ASP B 375 -1.958 8.856 -9.560 1.00 0.00 C ATOM 1491 C ASP B 375 -1.131 7.653 -9.170 1.00 0.00 C ATOM 1492 O ASP B 375 -1.411 6.526 -9.583 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.434 8.486 -9.612 1.00 0.00 C ATOM 1494 CG ASP B 375 -4.047 8.584 -8.218 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.334 8.334 -7.260 1.00 0.00 O1- ATOM 1496 OD2 ASP B 375 -5.219 8.910 -8.129 1.00 0.00 O ATOM 0 H ASP B 375 -1.450 8.561 -11.557 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.840 9.653 -8.826 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -3.960 9.151 -10.297 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.550 7.474 -9.999 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.105 7.913 -8.396 1.00 0.00 N ATOM 1502 CA GLY B 376 0.796 6.860 -7.963 1.00 0.00 C ATOM 1503 C GLY B 376 0.520 6.417 -6.541 1.00 0.00 C ATOM 1504 O GLY B 376 1.210 5.553 -6.008 1.00 0.00 O ATOM 0 H GLY B 376 0.131 8.843 -8.050 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.701 6.005 -8.633 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.825 7.211 -8.039 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.428 7.068 -5.905 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.710 6.788 -4.507 1.00 0.00 C ATOM 1510 C TYR B 377 -1.651 5.623 -4.285 1.00 0.00 C ATOM 1511 O TYR B 377 -2.863 5.741 -4.457 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.272 8.030 -3.847 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.759 9.231 -4.595 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.585 9.280 -4.990 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.625 10.278 -4.921 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.059 10.375 -5.710 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -1.148 11.381 -5.638 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.193 11.430 -6.034 1.00 0.00 C ATOM 1519 OH TYR B 377 0.660 12.515 -6.747 1.00 0.00 O ATOM 0 H TYR B 377 -1.014 7.789 -6.325 1.00 0.00 H new ATOM 0 HA TYR B 377 0.239 6.499 -4.056 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.362 8.009 -3.862 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -0.969 8.075 -2.801 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.253 8.470 -4.737 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.661 10.236 -4.620 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.093 10.411 -6.019 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.815 12.194 -5.886 1.00 0.00 H new ATOM 0 HH TYR B 377 -0.070 13.154 -6.887 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.074 4.521 -3.820 1.00 0.00 N ATOM 1530 CA TYR B 378 -1.870 3.344 -3.476 1.00 0.00 C ATOM 1531 C TYR B 378 -1.758 3.102 -1.985 1.00 0.00 C ATOM 1532 O TYR B 378 -0.656 2.985 -1.446 1.00 0.00 O ATOM 1533 CB TYR B 378 -1.417 2.111 -4.243 1.00 0.00 C ATOM 1534 CG TYR B 378 -2.496 1.741 -5.228 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -3.680 1.142 -4.778 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -2.317 2.005 -6.588 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -4.685 0.803 -5.693 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -3.321 1.666 -7.504 1.00 0.00 C ATOM 1539 CZ TYR B 378 -4.504 1.066 -7.056 1.00 0.00 C ATOM 1540 OH TYR B 378 -5.494 0.733 -7.960 1.00 0.00 O ATOM 0 H TYR B 378 -0.070 4.416 -3.673 1.00 0.00 H new ATOM 0 HA TYR B 378 -2.907 3.531 -3.753 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -0.480 2.311 -4.764 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.230 1.285 -3.557 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -3.818 0.942 -3.726 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -1.405 2.470 -6.933 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -5.597 0.340 -5.348 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -3.183 1.867 -8.556 1.00 0.00 H new ATOM 0 HH TYR B 378 -5.210 0.984 -8.864 1.00 0.00 H new ATOM 1550 N SER B 379 -2.900 3.083 -1.313 1.00 0.00 N ATOM 1551 CA SER B 379 -2.906 2.916 0.125 1.00 0.00 C ATOM 1552 C SER B 379 -4.000 2.001 0.606 1.00 0.00 C ATOM 1553 O SER B 379 -4.971 1.729 -0.102 1.00 0.00 O ATOM 1554 CB SER B 379 -3.089 4.263 0.793 1.00 0.00 C ATOM 1555 OG SER B 379 -3.019 4.092 2.195 1.00 0.00 O ATOM 0 H SER B 379 -3.822 3.180 -1.738 1.00 0.00 H new ATOM 0 HA SER B 379 -1.949 2.466 0.389 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.318 4.957 0.459 1.00 0.00 H new ATOM 0 HB3 SER B 379 -4.050 4.695 0.513 1.00 0.00 H new ATOM 0 HG SER B 379 -2.082 4.116 2.481 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.836 1.558 1.842 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.804 0.696 2.464 1.00 0.00 C ATOM 1563 C VAL B 380 -4.809 0.916 3.974 1.00 0.00 C ATOM 1564 O VAL B 380 -3.966 1.648 4.495 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.424 -0.734 2.169 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -4.952 -1.154 0.807 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -2.902 -0.845 2.182 1.00 0.00 C ATOM 0 H VAL B 380 -3.034 1.788 2.430 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.798 0.916 2.074 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.859 -1.388 2.925 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.669 -2.188 0.610 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -6.038 -1.067 0.795 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.528 -0.509 0.038 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.610 -1.874 1.970 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.483 -0.185 1.422 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.524 -0.555 3.163 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.749 0.280 4.682 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.808 0.435 6.131 1.00 0.00 C ATOM 1579 C GLN B 381 -5.171 -0.746 6.825 1.00 0.00 C ATOM 1580 O GLN B 381 -5.531 -1.901 6.607 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.241 0.565 6.595 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.366 1.674 7.633 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.832 1.880 7.996 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.451 1.005 8.602 1.00 0.00 O ATOM 1585 NE2 GLN B 381 -9.429 2.990 7.657 1.00 0.00 N ATOM 0 H GLN B 381 -6.461 -0.332 4.283 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.259 1.341 6.388 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.887 0.780 5.744 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.579 -0.380 7.021 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -6.794 1.416 8.524 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.945 2.600 7.241 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.914 3.713 7.155 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.411 3.134 7.894 1.00 0.00 H new ATOM 1594 N THR B 382 -4.228 -0.423 7.667 1.00 0.00 N ATOM 1595 CA THR B 382 -3.508 -1.420 8.441 1.00 0.00 C ATOM 1596 C THR B 382 -2.956 -0.792 9.706 1.00 0.00 C ATOM 1597 O THR B 382 -2.404 0.305 9.662 1.00 0.00 O ATOM 1598 CB THR B 382 -2.376 -2.017 7.618 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.385 -2.540 8.491 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.758 -0.943 6.727 1.00 0.00 C ATOM 0 H THR B 382 -3.930 0.537 7.842 1.00 0.00 H new ATOM 0 HA THR B 382 -4.199 -2.219 8.711 1.00 0.00 H new ATOM 0 HB THR B 382 -2.770 -2.816 6.990 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.501 -2.229 8.206 1.00 0.00 H new ATOM 0 HG21 THR B 382 -0.948 -1.378 6.141 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.519 -0.545 6.056 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.365 -0.138 7.347 1.00 0.00 H new ATOM 1608 N THR B 383 -3.083 -1.478 10.826 1.00 0.00 N ATOM 1609 CA THR B 383 -2.570 -0.927 12.064 1.00 0.00 C ATOM 1610 C THR B 383 -1.109 -1.280 12.260 1.00 0.00 C ATOM 1611 O THR B 383 -0.545 -1.100 13.338 1.00 0.00 O ATOM 1612 CB THR B 383 -3.426 -1.360 13.241 1.00 0.00 C ATOM 1613 OG1 THR B 383 -3.962 -2.654 12.995 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.551 -0.339 13.370 1.00 0.00 C ATOM 0 H THR B 383 -3.525 -2.394 10.905 1.00 0.00 H new ATOM 0 HA THR B 383 -2.626 0.160 12.003 1.00 0.00 H new ATOM 0 HB THR B 383 -2.840 -1.408 14.159 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.512 -2.931 13.757 1.00 0.00 H new ATOM 0 HG21 THR B 383 -5.195 -0.611 14.207 1.00 0.00 H new ATOM 0 HG22 THR B 383 -4.127 0.650 13.544 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.137 -0.325 12.451 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.485 -1.693 11.167 1.00 0.00 N ATOM 1623 CA GLU B 384 0.943 -1.966 11.176 1.00 0.00 C ATOM 1624 C GLU B 384 1.535 -1.552 9.836 1.00 0.00 C ATOM 1625 O GLU B 384 1.730 -2.362 8.931 1.00 0.00 O ATOM 1626 CB GLU B 384 1.229 -3.455 11.434 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.042 -4.153 11.926 1.00 0.00 C ATOM 1628 CD GLU B 384 0.233 -5.635 12.160 1.00 0.00 C ATOM 1629 OE1 GLU B 384 0.490 -6.330 11.191 1.00 0.00 O1- ATOM 1630 OE2 GLU B 384 0.179 -6.053 13.306 1.00 0.00 O ATOM 0 H GLU B 384 -0.942 -1.846 10.268 1.00 0.00 H new ATOM 0 HA GLU B 384 1.401 -1.395 11.984 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.584 -3.930 10.519 1.00 0.00 H new ATOM 0 HB3 GLU B 384 2.021 -3.559 12.175 1.00 0.00 H new ATOM 0 HG2 GLU B 384 -0.387 -3.689 12.850 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.839 -4.034 11.192 1.00 0.00 H new ATOM 1637 N GLY B 385 1.846 -0.276 9.735 1.00 0.00 N ATOM 1638 CA GLY B 385 2.454 0.262 8.534 1.00 0.00 C ATOM 1639 C GLY B 385 3.961 0.089 8.586 1.00 0.00 C ATOM 1640 O GLY B 385 4.564 -0.526 7.714 1.00 0.00 O ATOM 0 H GLY B 385 1.687 0.410 10.473 1.00 0.00 H new ATOM 0 HA2 GLY B 385 2.053 -0.245 7.656 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.205 1.318 8.434 1.00 0.00 H new ATOM 1644 N GLU B 386 4.552 0.660 9.624 1.00 0.00 N ATOM 1645 CA GLU B 386 5.995 0.607 9.824 1.00 0.00 C ATOM 1646 C GLU B 386 6.525 -0.782 9.577 1.00 0.00 C ATOM 1647 O GLU B 386 7.702 -0.972 9.321 1.00 0.00 O ATOM 1648 CB GLU B 386 6.326 1.024 11.247 1.00 0.00 C ATOM 1649 CG GLU B 386 5.414 0.279 12.218 1.00 0.00 C ATOM 1650 CD GLU B 386 5.772 0.649 13.655 1.00 0.00 C ATOM 1651 OE1 GLU B 386 6.933 0.525 14.006 1.00 0.00 O1- ATOM 1652 OE2 GLU B 386 4.879 1.053 14.382 1.00 0.00 O ATOM 0 H GLU B 386 4.049 1.171 10.349 1.00 0.00 H new ATOM 0 HA GLU B 386 6.464 1.289 9.115 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.370 0.803 11.469 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.196 2.100 11.362 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.372 0.530 12.017 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.516 -0.797 12.074 1.00 0.00 H new ATOM 1659 N GLN B 387 5.647 -1.744 9.641 1.00 0.00 N ATOM 1660 CA GLN B 387 6.046 -3.122 9.407 1.00 0.00 C ATOM 1661 C GLN B 387 6.076 -3.380 7.921 1.00 0.00 C ATOM 1662 O GLN B 387 6.974 -4.034 7.401 1.00 0.00 O ATOM 1663 CB GLN B 387 5.073 -4.084 10.084 1.00 0.00 C ATOM 1664 CG GLN B 387 5.095 -3.864 11.597 1.00 0.00 C ATOM 1665 CD GLN B 387 4.566 -5.105 12.308 1.00 0.00 C ATOM 1666 OE1 GLN B 387 3.748 -5.838 11.752 1.00 0.00 O ATOM 1667 NE2 GLN B 387 4.986 -5.386 13.511 1.00 0.00 N ATOM 0 H GLN B 387 4.658 -1.612 9.850 1.00 0.00 H new ATOM 0 HA GLN B 387 7.037 -3.285 9.830 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.065 -3.927 9.699 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.346 -5.114 9.853 1.00 0.00 H new ATOM 0 HG2 GLN B 387 6.111 -3.650 11.928 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.486 -2.998 11.857 1.00 0.00 H new ATOM 0 HE21 GLN B 387 5.664 -4.777 13.970 1.00 0.00 H new ATOM 0 HE22 GLN B 387 4.637 -6.214 13.993 1.00 0.00 H new ATOM 1676 N ILE B 388 5.096 -2.824 7.250 1.00 0.00 N ATOM 1677 CA ILE B 388 4.995 -2.935 5.809 1.00 0.00 C ATOM 1678 C ILE B 388 5.993 -1.993 5.151 1.00 0.00 C ATOM 1679 O ILE B 388 6.628 -2.319 4.150 1.00 0.00 O ATOM 1680 CB ILE B 388 3.597 -2.514 5.386 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.583 -3.586 5.763 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.561 -2.293 3.877 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.188 -2.962 5.760 1.00 0.00 C ATOM 0 H ILE B 388 4.347 -2.283 7.683 1.00 0.00 H new ATOM 0 HA ILE B 388 5.200 -3.963 5.509 1.00 0.00 H new ATOM 0 HB ILE B 388 3.342 -1.587 5.900 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.628 -4.414 5.056 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.813 -3.994 6.747 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.557 -1.991 3.577 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.271 -1.511 3.607 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.829 -3.218 3.367 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.450 -3.718 6.028 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.152 -2.147 6.483 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.965 -2.574 4.766 1.00 0.00 H new ATOM 1695 N ALA B 389 6.074 -0.802 5.718 1.00 0.00 N ATOM 1696 CA ALA B 389 6.933 0.257 5.203 1.00 0.00 C ATOM 1697 C ALA B 389 8.410 0.029 5.476 1.00 0.00 C ATOM 1698 O ALA B 389 9.234 0.296 4.613 1.00 0.00 O ATOM 1699 CB ALA B 389 6.527 1.574 5.841 1.00 0.00 C ATOM 0 H ALA B 389 5.546 -0.539 6.550 1.00 0.00 H new ATOM 0 HA ALA B 389 6.802 0.268 4.121 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.164 2.373 5.462 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.487 1.792 5.596 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.638 1.504 6.923 1.00 0.00 H new ATOM 1705 N GLN B 390 8.758 -0.424 6.674 1.00 0.00 N ATOM 1706 CA GLN B 390 10.177 -0.601 6.993 1.00 0.00 C ATOM 1707 C GLN B 390 10.801 -1.656 6.117 1.00 0.00 C ATOM 1708 O GLN B 390 11.973 -1.588 5.746 1.00 0.00 O ATOM 1709 CB GLN B 390 10.359 -1.014 8.442 1.00 0.00 C ATOM 1710 CG GLN B 390 9.800 -2.423 8.650 1.00 0.00 C ATOM 1711 CD GLN B 390 9.539 -2.669 10.134 1.00 0.00 C ATOM 1712 OE1 GLN B 390 9.310 -1.724 10.891 1.00 0.00 O ATOM 1713 NE2 GLN B 390 9.558 -3.889 10.597 1.00 0.00 N ATOM 0 H GLN B 390 8.107 -0.669 7.420 1.00 0.00 H new ATOM 0 HA GLN B 390 10.666 0.357 6.818 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.416 -0.989 8.708 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.848 -0.309 9.098 1.00 0.00 H new ATOM 0 HG2 GLN B 390 8.876 -2.543 8.085 1.00 0.00 H new ATOM 0 HG3 GLN B 390 10.505 -3.162 8.269 1.00 0.00 H new ATOM 0 HE21 GLN B 390 9.748 -4.670 9.969 1.00 0.00 H new ATOM 0 HE22 GLN B 390 9.383 -4.062 11.587 1.00 0.00 H new ATOM 1722 N LEU B 391 9.999 -2.632 5.815 1.00 0.00 N ATOM 1723 CA LEU B 391 10.417 -3.742 4.996 1.00 0.00 C ATOM 1724 C LEU B 391 10.513 -3.276 3.554 1.00 0.00 C ATOM 1725 O LEU B 391 11.561 -3.383 2.921 1.00 0.00 O ATOM 1726 CB LEU B 391 9.405 -4.861 5.231 1.00 0.00 C ATOM 1727 CG LEU B 391 8.568 -5.201 3.991 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.417 -5.951 2.953 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.410 -6.076 4.449 1.00 0.00 C ATOM 0 H LEU B 391 9.030 -2.686 6.129 1.00 0.00 H new ATOM 0 HA LEU B 391 11.406 -4.125 5.249 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.934 -5.756 5.558 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.737 -4.571 6.042 1.00 0.00 H new ATOM 0 HG LEU B 391 8.202 -4.288 3.521 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.805 -6.183 2.081 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.257 -5.326 2.650 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.792 -6.877 3.390 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.791 -6.339 3.591 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.800 -6.985 4.907 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.809 -5.532 5.177 1.00 0.00 H new ATOM 1741 N ILE B 392 9.433 -2.692 3.067 1.00 0.00 N ATOM 1742 CA ILE B 392 9.412 -2.133 1.751 1.00 0.00 C ATOM 1743 C ILE B 392 10.642 -1.286 1.653 1.00 0.00 C ATOM 1744 O ILE B 392 11.495 -1.478 0.798 1.00 0.00 O ATOM 1745 CB ILE B 392 8.164 -1.263 1.627 1.00 0.00 C ATOM 1746 CG1 ILE B 392 7.041 -2.078 0.989 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.451 -0.006 0.793 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.740 -1.288 1.045 1.00 0.00 C ATOM 0 H ILE B 392 8.556 -2.598 3.579 1.00 0.00 H new ATOM 0 HA ILE B 392 9.393 -2.889 0.966 1.00 0.00 H new ATOM 0 HB ILE B 392 7.859 -0.940 2.623 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.291 -2.313 -0.046 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.925 -3.027 1.512 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.546 0.597 0.720 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.237 0.577 1.272 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.774 -0.298 -0.206 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.940 -1.872 0.589 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.488 -1.076 2.084 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.860 -0.351 0.502 1.00 0.00 H new ATOM 1760 N ALA B 393 10.718 -0.381 2.612 1.00 0.00 N ATOM 1761 CA ALA B 393 11.842 0.527 2.747 1.00 0.00 C ATOM 1762 C ALA B 393 13.147 -0.243 2.767 1.00 0.00 C ATOM 1763 O ALA B 393 14.178 0.242 2.303 1.00 0.00 O ATOM 1764 CB ALA B 393 11.737 1.269 4.060 1.00 0.00 C ATOM 0 H ALA B 393 9.997 -0.255 3.323 1.00 0.00 H new ATOM 0 HA ALA B 393 11.824 1.216 1.902 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.581 1.951 4.161 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.807 1.837 4.084 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.747 0.555 4.883 1.00 0.00 H new ATOM 1770 N GLY B 394 13.098 -1.437 3.346 1.00 0.00 N ATOM 1771 CA GLY B 394 14.294 -2.255 3.462 1.00 0.00 C ATOM 1772 C GLY B 394 14.520 -3.054 2.206 1.00 0.00 C ATOM 1773 O GLY B 394 15.612 -3.551 1.955 1.00 0.00 O ATOM 0 H GLY B 394 12.253 -1.854 3.737 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.158 -1.619 3.654 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.198 -2.928 4.314 1.00 0.00 H new ATOM 1777 N TYR B 395 13.471 -3.170 1.426 1.00 0.00 N ATOM 1778 CA TYR B 395 13.528 -3.905 0.190 1.00 0.00 C ATOM 1779 C TYR B 395 14.005 -2.982 -0.918 1.00 0.00 C ATOM 1780 O TYR B 395 14.802 -3.381 -1.758 1.00 0.00 O ATOM 1781 CB TYR B 395 12.147 -4.482 -0.080 1.00 0.00 C ATOM 1782 CG TYR B 395 11.933 -5.782 0.706 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.717 -6.118 1.838 1.00 0.00 C ATOM 1784 CD2 TYR B 395 10.941 -6.672 0.278 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.495 -7.328 2.509 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.729 -7.881 0.951 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.506 -8.210 2.063 1.00 0.00 C ATOM 1788 OH TYR B 395 11.295 -9.402 2.724 1.00 0.00 O ATOM 0 H TYR B 395 12.560 -2.759 1.631 1.00 0.00 H new ATOM 0 HA TYR B 395 14.237 -4.731 0.244 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.384 -3.755 0.198 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.031 -4.674 -1.147 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.485 -5.442 2.183 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.333 -6.424 -0.580 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.090 -7.580 3.374 1.00 0.00 H new ATOM 0 HE2 TYR B 395 9.963 -8.561 0.609 1.00 0.00 H new ATOM 0 HH TYR B 395 10.571 -9.896 2.285 1.00 0.00 H new ATOM 1798 N ILE B 396 13.582 -1.725 -0.877 1.00 0.00 N ATOM 1799 CA ILE B 396 14.073 -0.766 -1.868 1.00 0.00 C ATOM 1800 C ILE B 396 15.531 -0.503 -1.625 1.00 0.00 C ATOM 1801 O ILE B 396 16.240 0.069 -2.454 1.00 0.00 O ATOM 1802 CB ILE B 396 13.326 0.564 -1.869 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.149 0.499 -0.925 1.00 0.00 C ATOM 1804 CG2 ILE B 396 12.833 0.852 -3.285 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.348 1.798 -1.001 1.00 0.00 C ATOM 0 H ILE B 396 12.923 -1.351 -0.195 1.00 0.00 H new ATOM 0 HA ILE B 396 13.903 -1.222 -2.843 1.00 0.00 H new ATOM 0 HB ILE B 396 13.996 1.358 -1.539 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.512 -0.347 -1.183 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.498 0.336 0.095 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.297 1.801 -3.298 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.685 0.907 -3.963 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.164 0.054 -3.607 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.501 1.744 -0.317 1.00 0.00 H new ATOM 0 HD12 ILE B 396 11.986 2.636 -0.722 1.00 0.00 H new ATOM 0 HD13 ILE B 396 10.985 1.942 -2.018 1.00 0.00 H new ATOM 1817 N ASP B 397 15.957 -0.942 -0.475 1.00 0.00 N ATOM 1818 CA ASP B 397 17.337 -0.761 -0.059 1.00 0.00 C ATOM 1819 C ASP B 397 18.206 -1.789 -0.737 1.00 0.00 C ATOM 1820 O ASP B 397 19.421 -1.636 -0.861 1.00 0.00 O ATOM 1821 CB ASP B 397 17.429 -0.926 1.454 1.00 0.00 C ATOM 1822 CG ASP B 397 18.386 0.106 2.040 1.00 0.00 C ATOM 1823 OD1 ASP B 397 18.020 1.268 2.081 1.00 0.00 O ATOM 1824 OD2 ASP B 397 19.471 -0.283 2.440 1.00 0.00 O1- ATOM 0 H ASP B 397 15.372 -1.432 0.202 1.00 0.00 H new ATOM 0 HA ASP B 397 17.678 0.236 -0.338 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.441 -0.811 1.900 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.773 -1.931 1.697 1.00 0.00 H new ATOM 1829 N ILE B 398 17.555 -2.853 -1.136 1.00 0.00 N ATOM 1830 CA ILE B 398 18.204 -3.962 -1.771 1.00 0.00 C ATOM 1831 C ILE B 398 18.216 -3.828 -3.277 1.00 0.00 C ATOM 1832 O ILE B 398 19.263 -3.808 -3.925 1.00 0.00 O ATOM 1833 CB ILE B 398 17.412 -5.191 -1.391 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.435 -5.338 0.135 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.018 -6.407 -2.058 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.343 -6.302 0.615 1.00 0.00 C ATOM 0 H ILE B 398 16.548 -2.970 -1.026 1.00 0.00 H new ATOM 0 HA ILE B 398 19.244 -4.014 -1.448 1.00 0.00 H new ATOM 0 HB ILE B 398 16.379 -5.097 -1.724 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.412 -5.703 0.453 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.292 -4.362 0.599 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.447 -7.294 -1.784 1.00 0.00 H new ATOM 0 HG22 ILE B 398 17.993 -6.279 -3.140 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.051 -6.525 -1.730 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.384 -6.386 1.701 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.366 -5.922 0.317 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.502 -7.284 0.169 1.00 0.00 H new ATOM 1848 N ILE B 399 17.013 -3.802 -3.808 1.00 0.00 N ATOM 1849 CA ILE B 399 16.790 -3.744 -5.237 1.00 0.00 C ATOM 1850 C ILE B 399 17.303 -2.451 -5.851 1.00 0.00 C ATOM 1851 O ILE B 399 17.516 -2.385 -7.061 1.00 0.00 O ATOM 1852 CB ILE B 399 15.301 -3.862 -5.473 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.646 -2.583 -4.970 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.764 -5.050 -4.676 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.213 -2.874 -4.489 1.00 0.00 C ATOM 0 H ILE B 399 16.155 -3.821 -3.256 1.00 0.00 H new ATOM 0 HA ILE B 399 17.338 -4.558 -5.712 1.00 0.00 H new ATOM 0 HB ILE B 399 15.088 -4.010 -6.532 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.233 -2.162 -4.154 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.626 -1.838 -5.766 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.690 -5.143 -4.840 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.261 -5.963 -5.004 1.00 0.00 H new ATOM 0 HG23 ILE B 399 14.956 -4.893 -3.615 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.755 -1.952 -4.132 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.626 -3.274 -5.316 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.242 -3.602 -3.679 1.00 0.00 H new ATOM 1867 N LEU B 400 17.478 -1.415 -5.036 1.00 0.00 N ATOM 1868 CA LEU B 400 17.949 -0.141 -5.589 1.00 0.00 C ATOM 1869 C LEU B 400 19.157 -0.358 -6.499 1.00 0.00 C ATOM 1870 O LEU B 400 19.625 -1.482 -6.580 1.00 0.00 O ATOM 1871 CB LEU B 400 18.317 0.856 -4.488 1.00 0.00 C ATOM 1872 CG LEU B 400 19.114 0.164 -3.382 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.464 -0.321 -3.919 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.352 1.157 -2.244 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.597 0.606 -7.103 1.00 0.00 O ATOM 0 H LEU B 400 17.310 -1.423 -4.030 1.00 0.00 H new ATOM 0 HA LEU B 400 17.126 0.275 -6.170 1.00 0.00 H new ATOM 0 HB2 LEU B 400 18.903 1.672 -4.910 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.411 1.296 -4.071 1.00 0.00 H new ATOM 0 HG LEU B 400 18.549 -0.696 -3.021 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.019 -0.811 -3.119 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.299 -1.028 -4.732 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.036 0.530 -4.288 1.00 0.00 H new ATOM 0 HD21 LEU B 400 19.920 0.672 -1.450 1.00 0.00 H new ATOM 0 HD22 LEU B 400 19.912 2.013 -2.620 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.394 1.495 -1.850 1.00 0.00 H new