USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 579 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 312 TYR OH : rot 121:sc= -0.231 USER MOD Set 1.2: A 345 MET CE :methyl 180:sc= -0.754 (180deg=-0.754) USER MOD Set 1.3: A 352 GLN :FLIP amide:sc= 0.32 F(o=-2.8,f=-0.66) USER MOD Single : A 308 ASN : amide:sc= -1.25 K(o=-1.2,f=-3.7) USER MOD Single : A 309 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 314 LYS NZ :NH3+ -124:sc= -1.63 (180deg=-5.06!) USER MOD Single : A 315 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 317 SER OG : rot 180:sc= -0.894 USER MOD Single : A 321 THR OG1 : rot 180:sc= 0 USER MOD Single : A 327 SER OG : rot 180:sc= 0 USER MOD Single : A 341 GLN : amide:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 344 MET CE :methyl 170:sc= -2.42! (180deg=-2.56!) USER MOD Single : A 356 THR OG1 : rot 180:sc= 0 USER MOD Single : A 359 ASN :FLIP amide:sc= -0.66 F(o=-2.7,f=-0.66) USER MOD Single : A 360 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0228) USER MOD Single : A 365 GLN : amide:sc= -0.0298 K(o=-0.03,f=-0.85) USER MOD Single : A 368 HIS : no HD1:sc= -0.0508 X(o=-0.051,f=0) USER MOD Single : A 371 ASN :FLIP amide:sc= 0.621 F(o=-1,f=0.62) USER MOD Single : A 373 TYR OH : rot 180:sc= 0 USER MOD Single : A 374 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 376 TYR OH : rot 180:sc= 0 USER MOD Single : A 378 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 324 N PRO A 307 -6.165 8.178 -5.383 1.00 0.00 N ATOM 325 CA PRO A 307 -5.466 7.019 -5.947 1.00 0.00 C ATOM 326 C PRO A 307 -4.219 7.418 -6.729 1.00 0.00 C ATOM 327 O PRO A 307 -4.233 8.389 -7.485 1.00 0.00 O ATOM 328 CB PRO A 307 -6.506 6.397 -6.881 1.00 0.00 C ATOM 329 CG PRO A 307 -7.376 7.535 -7.291 1.00 0.00 C ATOM 330 CD PRO A 307 -7.384 8.513 -6.138 1.00 0.00 C ATOM 0 HA PRO A 307 -5.110 6.341 -5.171 1.00 0.00 H new ATOM 0 HB2 PRO A 307 -6.033 5.929 -7.744 1.00 0.00 H new ATOM 0 HB3 PRO A 307 -7.081 5.622 -6.374 1.00 0.00 H new ATOM 0 HG2 PRO A 307 -6.995 8.007 -8.196 1.00 0.00 H new ATOM 0 HG3 PRO A 307 -8.386 7.190 -7.513 1.00 0.00 H new ATOM 0 HD2 PRO A 307 -7.366 9.545 -6.489 1.00 0.00 H new ATOM 0 HD3 PRO A 307 -8.278 8.400 -5.524 1.00 0.00 H new ATOM 338 N ASN A 308 -3.142 6.663 -6.542 1.00 0.00 N ATOM 339 CA ASN A 308 -1.886 6.938 -7.230 1.00 0.00 C ATOM 340 C ASN A 308 -1.354 5.683 -7.914 1.00 0.00 C ATOM 341 O ASN A 308 -1.789 4.570 -7.620 1.00 0.00 O ATOM 342 CB ASN A 308 -0.847 7.475 -6.244 1.00 0.00 C ATOM 343 CG ASN A 308 -1.394 8.595 -5.380 1.00 0.00 C ATOM 344 OD1 ASN A 308 -2.354 8.405 -4.633 1.00 0.00 O ATOM 345 ND2 ASN A 308 -0.781 9.770 -5.477 1.00 0.00 N ATOM 0 H ASN A 308 -3.114 5.855 -5.919 1.00 0.00 H new ATOM 0 HA ASN A 308 -2.077 7.693 -7.993 1.00 0.00 H new ATOM 0 HB2 ASN A 308 -0.503 6.662 -5.605 1.00 0.00 H new ATOM 0 HB3 ASN A 308 0.021 7.836 -6.796 1.00 0.00 H new ATOM 0 HD21 ASN A 308 -1.103 10.561 -4.919 1.00 0.00 H new ATOM 0 HD22 ASN A 308 0.011 9.881 -6.110 1.00 0.00 H new ATOM 352 N LYS A 309 -0.408 5.870 -8.829 1.00 0.00 N ATOM 353 CA LYS A 309 0.187 4.754 -9.555 1.00 0.00 C ATOM 354 C LYS A 309 1.270 4.078 -8.721 1.00 0.00 C ATOM 355 O LYS A 309 2.010 3.228 -9.216 1.00 0.00 O ATOM 356 CB LYS A 309 0.777 5.238 -10.882 1.00 0.00 C ATOM 357 CG LYS A 309 1.814 6.336 -10.721 1.00 0.00 C ATOM 358 CD LYS A 309 3.219 5.766 -10.619 1.00 0.00 C ATOM 359 CE LYS A 309 3.756 5.361 -11.983 1.00 0.00 C ATOM 360 NZ LYS A 309 4.248 6.535 -12.756 1.00 0.00 N ATOM 0 H LYS A 309 -0.037 6.785 -9.085 1.00 0.00 H new ATOM 0 HA LYS A 309 -0.598 4.025 -9.758 1.00 0.00 H new ATOM 0 HB2 LYS A 309 1.232 4.392 -11.398 1.00 0.00 H new ATOM 0 HB3 LYS A 309 -0.030 5.602 -11.518 1.00 0.00 H new ATOM 0 HG2 LYS A 309 1.758 7.018 -11.569 1.00 0.00 H new ATOM 0 HG3 LYS A 309 1.591 6.920 -9.828 1.00 0.00 H new ATOM 0 HD2 LYS A 309 3.882 6.507 -10.171 1.00 0.00 H new ATOM 0 HD3 LYS A 309 3.214 4.900 -9.957 1.00 0.00 H new ATOM 0 HE2 LYS A 309 4.567 4.644 -11.856 1.00 0.00 H new ATOM 0 HE3 LYS A 309 2.971 4.857 -12.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 309 4.606 6.217 -13.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 309 3.468 7.208 -12.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 309 5.014 7.001 -12.229 1.00 0.00 H new ATOM 374 N VAL A 310 1.359 4.461 -7.450 1.00 0.00 N ATOM 375 CA VAL A 310 2.351 3.890 -6.547 1.00 0.00 C ATOM 376 C VAL A 310 1.709 3.441 -5.239 1.00 0.00 C ATOM 377 O VAL A 310 0.979 4.200 -4.600 1.00 0.00 O ATOM 378 CB VAL A 310 3.473 4.899 -6.236 1.00 0.00 C ATOM 379 CG1 VAL A 310 4.487 4.290 -5.280 1.00 0.00 C ATOM 380 CG2 VAL A 310 4.146 5.359 -7.519 1.00 0.00 C ATOM 0 H VAL A 310 0.756 5.164 -7.023 1.00 0.00 H new ATOM 0 HA VAL A 310 2.780 3.025 -7.053 1.00 0.00 H new ATOM 0 HB VAL A 310 3.032 5.771 -5.753 1.00 0.00 H new ATOM 0 HG11 VAL A 310 5.272 5.017 -5.071 1.00 0.00 H new ATOM 0 HG12 VAL A 310 3.990 4.015 -4.349 1.00 0.00 H new ATOM 0 HG13 VAL A 310 4.926 3.401 -5.733 1.00 0.00 H new ATOM 0 HG21 VAL A 310 4.936 6.071 -7.280 1.00 0.00 H new ATOM 0 HG22 VAL A 310 4.576 4.499 -8.033 1.00 0.00 H new ATOM 0 HG23 VAL A 310 3.410 5.837 -8.165 1.00 0.00 H new ATOM 390 N LEU A 311 1.984 2.202 -4.846 1.00 0.00 N ATOM 391 CA LEU A 311 1.433 1.650 -3.613 1.00 0.00 C ATOM 392 C LEU A 311 2.543 1.338 -2.614 1.00 0.00 C ATOM 393 O LEU A 311 3.421 0.516 -2.881 1.00 0.00 O ATOM 394 CB LEU A 311 0.630 0.383 -3.913 1.00 0.00 C ATOM 395 CG LEU A 311 -0.474 0.522 -4.962 1.00 0.00 C ATOM 396 CD1 LEU A 311 -1.128 -0.825 -5.228 1.00 0.00 C ATOM 397 CD2 LEU A 311 -1.510 1.542 -4.515 1.00 0.00 C ATOM 0 H LEU A 311 2.585 1.561 -5.363 1.00 0.00 H new ATOM 0 HA LEU A 311 0.771 2.396 -3.173 1.00 0.00 H new ATOM 0 HB2 LEU A 311 1.322 -0.392 -4.243 1.00 0.00 H new ATOM 0 HB3 LEU A 311 0.179 0.034 -2.984 1.00 0.00 H new ATOM 0 HG LEU A 311 -0.025 0.875 -5.890 1.00 0.00 H new ATOM 0 HD11 LEU A 311 -1.911 -0.708 -5.977 1.00 0.00 H new ATOM 0 HD12 LEU A 311 -0.379 -1.527 -5.593 1.00 0.00 H new ATOM 0 HD13 LEU A 311 -1.563 -1.207 -4.305 1.00 0.00 H new ATOM 0 HD21 LEU A 311 -2.288 1.627 -5.274 1.00 0.00 H new ATOM 0 HD22 LEU A 311 -1.955 1.220 -3.574 1.00 0.00 H new ATOM 0 HD23 LEU A 311 -1.030 2.511 -4.376 1.00 0.00 H new ATOM 409 N TYR A 312 2.496 1.998 -1.461 1.00 0.00 N ATOM 410 CA TYR A 312 3.498 1.791 -0.422 1.00 0.00 C ATOM 411 C TYR A 312 2.952 0.898 0.689 1.00 0.00 C ATOM 412 O TYR A 312 2.062 1.296 1.441 1.00 0.00 O ATOM 413 CB TYR A 312 3.944 3.133 0.160 1.00 0.00 C ATOM 414 CG TYR A 312 5.014 3.008 1.220 1.00 0.00 C ATOM 415 CD1 TYR A 312 5.978 2.008 1.147 1.00 0.00 C ATOM 416 CD2 TYR A 312 5.064 3.889 2.293 1.00 0.00 C ATOM 417 CE1 TYR A 312 6.957 1.889 2.115 1.00 0.00 C ATOM 418 CE2 TYR A 312 6.041 3.779 3.263 1.00 0.00 C ATOM 419 CZ TYR A 312 6.985 2.777 3.170 1.00 0.00 C ATOM 420 OH TYR A 312 7.960 2.663 4.134 1.00 0.00 O ATOM 0 H TYR A 312 1.776 2.680 -1.223 1.00 0.00 H new ATOM 0 HA TYR A 312 4.357 1.295 -0.874 1.00 0.00 H new ATOM 0 HB2 TYR A 312 4.316 3.764 -0.647 1.00 0.00 H new ATOM 0 HB3 TYR A 312 3.079 3.640 0.587 1.00 0.00 H new ATOM 0 HD1 TYR A 312 5.961 1.313 0.320 1.00 0.00 H new ATOM 0 HD2 TYR A 312 4.326 4.674 2.370 1.00 0.00 H new ATOM 0 HE1 TYR A 312 7.696 1.105 2.046 1.00 0.00 H new ATOM 0 HE2 TYR A 312 6.066 4.473 4.090 1.00 0.00 H new ATOM 0 HH TYR A 312 8.479 3.493 4.174 1.00 0.00 H new ATOM 430 N LEU A 313 3.494 -0.310 0.787 1.00 0.00 N ATOM 431 CA LEU A 313 3.064 -1.261 1.806 1.00 0.00 C ATOM 432 C LEU A 313 3.988 -1.215 3.019 1.00 0.00 C ATOM 433 O LEU A 313 5.186 -0.962 2.891 1.00 0.00 O ATOM 434 CB LEU A 313 3.032 -2.679 1.230 1.00 0.00 C ATOM 435 CG LEU A 313 1.982 -2.939 0.149 1.00 0.00 C ATOM 436 CD1 LEU A 313 2.183 -1.997 -1.029 1.00 0.00 C ATOM 437 CD2 LEU A 313 2.039 -4.389 -0.311 1.00 0.00 C ATOM 0 H LEU A 313 4.232 -0.655 0.173 1.00 0.00 H new ATOM 0 HA LEU A 313 2.060 -0.982 2.125 1.00 0.00 H new ATOM 0 HB2 LEU A 313 4.015 -2.904 0.816 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.863 -3.379 2.048 1.00 0.00 H new ATOM 0 HG LEU A 313 0.996 -2.751 0.574 1.00 0.00 H new ATOM 0 HD11 LEU A 313 1.427 -2.197 -1.788 1.00 0.00 H new ATOM 0 HD12 LEU A 313 2.092 -0.965 -0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 313 3.174 -2.153 -1.455 1.00 0.00 H new ATOM 0 HD21 LEU A 313 1.285 -4.557 -1.080 1.00 0.00 H new ATOM 0 HD22 LEU A 313 3.027 -4.603 -0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 313 1.846 -5.047 0.536 1.00 0.00 H new ATOM 449 N LYS A 314 3.424 -1.463 4.196 1.00 0.00 N ATOM 450 CA LYS A 314 4.197 -1.454 5.433 1.00 0.00 C ATOM 451 C LYS A 314 3.741 -2.569 6.368 1.00 0.00 C ATOM 452 O LYS A 314 2.891 -3.382 6.010 1.00 0.00 O ATOM 453 CB LYS A 314 4.061 -0.099 6.132 1.00 0.00 C ATOM 454 CG LYS A 314 4.547 1.071 5.295 1.00 0.00 C ATOM 455 CD LYS A 314 3.864 2.366 5.697 1.00 0.00 C ATOM 456 CE LYS A 314 2.589 2.595 4.900 1.00 0.00 C ATOM 457 NZ LYS A 314 1.791 3.729 5.442 1.00 0.00 N ATOM 0 H LYS A 314 2.434 -1.673 4.320 1.00 0.00 H new ATOM 0 HA LYS A 314 5.244 -1.623 5.180 1.00 0.00 H new ATOM 0 HB2 LYS A 314 3.015 0.062 6.393 1.00 0.00 H new ATOM 0 HB3 LYS A 314 4.622 -0.124 7.066 1.00 0.00 H new ATOM 0 HG2 LYS A 314 5.626 1.177 5.408 1.00 0.00 H new ATOM 0 HG3 LYS A 314 4.356 0.870 4.241 1.00 0.00 H new ATOM 0 HD2 LYS A 314 3.629 2.340 6.761 1.00 0.00 H new ATOM 0 HD3 LYS A 314 4.546 3.202 5.542 1.00 0.00 H new ATOM 0 HE2 LYS A 314 2.843 2.795 3.859 1.00 0.00 H new ATOM 0 HE3 LYS A 314 1.985 1.688 4.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 314 0.830 3.401 5.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 314 2.244 4.091 6.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 314 1.740 4.488 4.733 1.00 0.00 H new ATOM 471 N ASN A 315 4.313 -2.601 7.567 1.00 0.00 N ATOM 472 CA ASN A 315 3.965 -3.616 8.554 1.00 0.00 C ATOM 473 C ASN A 315 4.169 -5.018 7.987 1.00 0.00 C ATOM 474 O ASN A 315 3.251 -5.840 7.988 1.00 0.00 O ATOM 475 CB ASN A 315 2.513 -3.443 9.004 1.00 0.00 C ATOM 476 CG ASN A 315 2.368 -2.407 10.102 1.00 0.00 C ATOM 477 OD1 ASN A 315 2.530 -1.210 9.868 1.00 0.00 O ATOM 478 ND2 ASN A 315 2.061 -2.866 11.311 1.00 0.00 N ATOM 0 H ASN A 315 5.020 -1.935 7.879 1.00 0.00 H new ATOM 0 HA ASN A 315 4.623 -3.491 9.414 1.00 0.00 H new ATOM 0 HB2 ASN A 315 1.903 -3.151 8.149 1.00 0.00 H new ATOM 0 HB3 ASN A 315 2.129 -4.400 9.358 1.00 0.00 H new ATOM 0 HD21 ASN A 315 1.951 -2.217 12.090 1.00 0.00 H new ATOM 0 HD22 ASN A 315 1.936 -3.867 11.460 1.00 0.00 H new ATOM 485 N LEU A 316 5.377 -5.284 7.503 1.00 0.00 N ATOM 486 CA LEU A 316 5.703 -6.587 6.934 1.00 0.00 C ATOM 487 C LEU A 316 6.756 -7.301 7.775 1.00 0.00 C ATOM 488 O LEU A 316 7.920 -6.903 7.800 1.00 0.00 O ATOM 489 CB LEU A 316 6.205 -6.427 5.497 1.00 0.00 C ATOM 490 CG LEU A 316 5.420 -5.453 4.618 1.00 0.00 C ATOM 491 CD1 LEU A 316 5.942 -5.485 3.189 1.00 0.00 C ATOM 492 CD2 LEU A 316 3.934 -5.782 4.652 1.00 0.00 C ATOM 0 H LEU A 316 6.147 -4.615 7.493 1.00 0.00 H new ATOM 0 HA LEU A 316 4.796 -7.191 6.931 1.00 0.00 H new ATOM 0 HB2 LEU A 316 7.244 -6.099 5.530 1.00 0.00 H new ATOM 0 HB3 LEU A 316 6.195 -7.406 5.018 1.00 0.00 H new ATOM 0 HG LEU A 316 5.558 -4.446 5.012 1.00 0.00 H new ATOM 0 HD11 LEU A 316 5.372 -4.786 2.578 1.00 0.00 H new ATOM 0 HD12 LEU A 316 6.994 -5.201 3.180 1.00 0.00 H new ATOM 0 HD13 LEU A 316 5.835 -6.492 2.785 1.00 0.00 H new ATOM 0 HD21 LEU A 316 3.391 -5.079 4.021 1.00 0.00 H new ATOM 0 HD22 LEU A 316 3.777 -6.796 4.284 1.00 0.00 H new ATOM 0 HD23 LEU A 316 3.568 -5.708 5.676 1.00 0.00 H new ATOM 504 N SER A 317 6.338 -8.360 8.462 1.00 0.00 N ATOM 505 CA SER A 317 7.245 -9.129 9.306 1.00 0.00 C ATOM 506 C SER A 317 8.504 -9.520 8.537 1.00 0.00 C ATOM 507 O SER A 317 8.467 -9.809 7.341 1.00 0.00 O ATOM 508 CB SER A 317 6.546 -10.384 9.832 1.00 0.00 C ATOM 509 OG SER A 317 7.332 -11.033 10.817 1.00 0.00 O ATOM 0 H SER A 317 5.378 -8.704 8.451 1.00 0.00 H new ATOM 0 HA SER A 317 7.535 -8.502 10.149 1.00 0.00 H new ATOM 0 HB2 SER A 317 5.578 -10.114 10.255 1.00 0.00 H new ATOM 0 HB3 SER A 317 6.354 -11.069 9.007 1.00 0.00 H new ATOM 0 HG SER A 317 6.862 -11.831 11.138 1.00 0.00 H new ATOM 515 N PRO A 318 9.647 -9.528 9.239 1.00 0.00 N ATOM 516 CA PRO A 318 10.939 -9.880 8.645 1.00 0.00 C ATOM 517 C PRO A 318 10.860 -11.145 7.796 1.00 0.00 C ATOM 518 O PRO A 318 11.709 -11.379 6.935 1.00 0.00 O ATOM 519 CB PRO A 318 11.839 -10.108 9.861 1.00 0.00 C ATOM 520 CG PRO A 318 11.254 -9.254 10.931 1.00 0.00 C ATOM 521 CD PRO A 318 9.765 -9.193 10.668 1.00 0.00 C ATOM 0 HA PRO A 318 11.302 -9.105 7.969 1.00 0.00 H new ATOM 0 HB2 PRO A 318 11.850 -11.158 10.154 1.00 0.00 H new ATOM 0 HB3 PRO A 318 12.870 -9.826 9.649 1.00 0.00 H new ATOM 0 HG2 PRO A 318 11.457 -9.674 11.916 1.00 0.00 H new ATOM 0 HG3 PRO A 318 11.692 -8.256 10.913 1.00 0.00 H new ATOM 0 HD2 PRO A 318 9.219 -9.901 11.291 1.00 0.00 H new ATOM 0 HD3 PRO A 318 9.361 -8.203 10.882 1.00 0.00 H new ATOM 529 N ARG A 319 9.836 -11.955 8.042 1.00 0.00 N ATOM 530 CA ARG A 319 9.648 -13.195 7.301 1.00 0.00 C ATOM 531 C ARG A 319 9.123 -12.915 5.896 1.00 0.00 C ATOM 532 O ARG A 319 9.474 -13.608 4.941 1.00 0.00 O ATOM 533 CB ARG A 319 8.678 -14.117 8.044 1.00 0.00 C ATOM 534 CG ARG A 319 9.307 -14.833 9.229 1.00 0.00 C ATOM 535 CD ARG A 319 9.901 -16.171 8.819 1.00 0.00 C ATOM 536 NE ARG A 319 10.428 -16.909 9.963 1.00 0.00 N ATOM 537 CZ ARG A 319 11.633 -16.700 10.481 1.00 0.00 C ATOM 538 NH1 ARG A 319 12.432 -15.779 9.961 1.00 0.00 N ATOM 539 NH2 ARG A 319 12.041 -17.412 11.524 1.00 0.00 N ATOM 0 H ARG A 319 9.124 -11.774 8.749 1.00 0.00 H new ATOM 0 HA ARG A 319 10.616 -13.688 7.217 1.00 0.00 H new ATOM 0 HB2 ARG A 319 7.828 -13.531 8.394 1.00 0.00 H new ATOM 0 HB3 ARG A 319 8.288 -14.859 7.347 1.00 0.00 H new ATOM 0 HG2 ARG A 319 10.085 -14.206 9.663 1.00 0.00 H new ATOM 0 HG3 ARG A 319 8.555 -14.989 10.002 1.00 0.00 H new ATOM 0 HD2 ARG A 319 9.138 -16.770 8.322 1.00 0.00 H new ATOM 0 HD3 ARG A 319 10.699 -16.007 8.095 1.00 0.00 H new ATOM 0 HE ARG A 319 9.838 -17.625 10.388 1.00 0.00 H new ATOM 0 HH11 ARG A 319 12.122 -15.228 9.160 1.00 0.00 H new ATOM 0 HH12 ARG A 319 13.357 -15.621 10.361 1.00 0.00 H new ATOM 0 HH21 ARG A 319 11.429 -18.121 11.929 1.00 0.00 H new ATOM 0 HH22 ARG A 319 12.967 -17.251 11.921 1.00 0.00 H new ATOM 553 N VAL A 320 8.280 -11.894 5.778 1.00 0.00 N ATOM 554 CA VAL A 320 7.706 -11.521 4.490 1.00 0.00 C ATOM 555 C VAL A 320 8.773 -11.493 3.401 1.00 0.00 C ATOM 556 O VAL A 320 9.882 -11.003 3.615 1.00 0.00 O ATOM 557 CB VAL A 320 7.022 -10.142 4.558 1.00 0.00 C ATOM 558 CG1 VAL A 320 6.438 -9.769 3.205 1.00 0.00 C ATOM 559 CG2 VAL A 320 5.946 -10.136 5.633 1.00 0.00 C ATOM 0 H VAL A 320 7.979 -11.310 6.559 1.00 0.00 H new ATOM 0 HA VAL A 320 6.960 -12.277 4.245 1.00 0.00 H new ATOM 0 HB VAL A 320 7.771 -9.395 4.821 1.00 0.00 H new ATOM 0 HG11 VAL A 320 5.959 -8.792 3.272 1.00 0.00 H new ATOM 0 HG12 VAL A 320 7.235 -9.732 2.462 1.00 0.00 H new ATOM 0 HG13 VAL A 320 5.701 -10.515 2.909 1.00 0.00 H new ATOM 0 HG21 VAL A 320 5.472 -9.155 5.668 1.00 0.00 H new ATOM 0 HG22 VAL A 320 5.196 -10.893 5.402 1.00 0.00 H new ATOM 0 HG23 VAL A 320 6.397 -10.356 6.601 1.00 0.00 H new ATOM 569 N THR A 321 8.430 -12.023 2.230 1.00 0.00 N ATOM 570 CA THR A 321 9.358 -12.059 1.107 1.00 0.00 C ATOM 571 C THR A 321 8.692 -11.564 -0.171 1.00 0.00 C ATOM 572 O THR A 321 7.483 -11.702 -0.346 1.00 0.00 O ATOM 573 CB THR A 321 9.899 -13.482 0.873 1.00 0.00 C ATOM 574 OG1 THR A 321 8.813 -14.405 0.745 1.00 0.00 O ATOM 575 CG2 THR A 321 10.806 -13.911 2.017 1.00 0.00 C ATOM 0 H THR A 321 7.516 -12.433 2.036 1.00 0.00 H new ATOM 0 HA THR A 321 10.188 -11.399 1.360 1.00 0.00 H new ATOM 0 HB THR A 321 10.481 -13.479 -0.049 1.00 0.00 H new ATOM 0 HG1 THR A 321 9.166 -15.307 0.595 1.00 0.00 H new ATOM 0 HG21 THR A 321 11.176 -14.919 1.830 1.00 0.00 H new ATOM 0 HG22 THR A 321 11.648 -13.223 2.091 1.00 0.00 H new ATOM 0 HG23 THR A 321 10.244 -13.898 2.951 1.00 0.00 H new ATOM 583 N GLU A 322 9.491 -10.987 -1.065 1.00 0.00 N ATOM 584 CA GLU A 322 8.978 -10.472 -2.328 1.00 0.00 C ATOM 585 C GLU A 322 7.820 -11.326 -2.834 1.00 0.00 C ATOM 586 O GLU A 322 6.822 -10.806 -3.333 1.00 0.00 O ATOM 587 CB GLU A 322 10.092 -10.429 -3.377 1.00 0.00 C ATOM 588 CG GLU A 322 9.763 -9.558 -4.578 1.00 0.00 C ATOM 589 CD GLU A 322 9.859 -8.076 -4.268 1.00 0.00 C ATOM 590 OE1 GLU A 322 8.859 -7.507 -3.782 1.00 0.00 O ATOM 591 OE2 GLU A 322 10.932 -7.487 -4.511 1.00 0.00 O ATOM 0 H GLU A 322 10.496 -10.865 -0.937 1.00 0.00 H new ATOM 0 HA GLU A 322 8.612 -9.460 -2.156 1.00 0.00 H new ATOM 0 HB2 GLU A 322 11.005 -10.060 -2.910 1.00 0.00 H new ATOM 0 HB3 GLU A 322 10.297 -11.443 -3.719 1.00 0.00 H new ATOM 0 HG2 GLU A 322 10.444 -9.799 -5.394 1.00 0.00 H new ATOM 0 HG3 GLU A 322 8.755 -9.788 -4.924 1.00 0.00 H new ATOM 598 N ARG A 323 7.962 -12.642 -2.703 1.00 0.00 N ATOM 599 CA ARG A 323 6.929 -13.570 -3.149 1.00 0.00 C ATOM 600 C ARG A 323 5.551 -13.117 -2.675 1.00 0.00 C ATOM 601 O ARG A 323 4.633 -12.946 -3.477 1.00 0.00 O ATOM 602 CB ARG A 323 7.222 -14.979 -2.629 1.00 0.00 C ATOM 603 CG ARG A 323 6.316 -16.045 -3.222 1.00 0.00 C ATOM 604 CD ARG A 323 6.202 -17.252 -2.303 1.00 0.00 C ATOM 605 NE ARG A 323 7.400 -18.085 -2.342 1.00 0.00 N ATOM 606 CZ ARG A 323 7.605 -19.037 -3.246 1.00 0.00 C ATOM 607 NH1 ARG A 323 6.694 -19.277 -4.179 1.00 0.00 N ATOM 608 NH2 ARG A 323 8.721 -19.754 -3.217 1.00 0.00 N ATOM 0 H ARG A 323 8.782 -13.089 -2.292 1.00 0.00 H new ATOM 0 HA ARG A 323 6.933 -13.584 -4.239 1.00 0.00 H new ATOM 0 HB2 ARG A 323 8.259 -15.231 -2.850 1.00 0.00 H new ATOM 0 HB3 ARG A 323 7.117 -14.986 -1.544 1.00 0.00 H new ATOM 0 HG2 ARG A 323 5.326 -15.626 -3.398 1.00 0.00 H new ATOM 0 HG3 ARG A 323 6.706 -16.359 -4.190 1.00 0.00 H new ATOM 0 HD2 ARG A 323 6.028 -16.914 -1.281 1.00 0.00 H new ATOM 0 HD3 ARG A 323 5.337 -17.848 -2.593 1.00 0.00 H new ATOM 0 HE ARG A 323 8.120 -17.928 -1.636 1.00 0.00 H new ATOM 0 HH11 ARG A 323 5.833 -18.730 -4.204 1.00 0.00 H new ATOM 0 HH12 ARG A 323 6.854 -20.008 -4.872 1.00 0.00 H new ATOM 0 HH21 ARG A 323 9.424 -19.575 -2.500 1.00 0.00 H new ATOM 0 HH22 ARG A 323 8.876 -20.484 -3.912 1.00 0.00 H new ATOM 622 N ASP A 324 5.414 -12.926 -1.368 1.00 0.00 N ATOM 623 CA ASP A 324 4.148 -12.494 -0.786 1.00 0.00 C ATOM 624 C ASP A 324 3.558 -11.328 -1.575 1.00 0.00 C ATOM 625 O ASP A 324 2.362 -11.304 -1.866 1.00 0.00 O ATOM 626 CB ASP A 324 4.345 -12.088 0.675 1.00 0.00 C ATOM 627 CG ASP A 324 4.666 -10.615 0.829 1.00 0.00 C ATOM 628 OD1 ASP A 324 5.840 -10.239 0.629 1.00 0.00 O ATOM 629 OD2 ASP A 324 3.743 -9.838 1.149 1.00 0.00 O ATOM 0 H ASP A 324 6.164 -13.063 -0.691 1.00 0.00 H new ATOM 0 HA ASP A 324 3.451 -13.331 -0.831 1.00 0.00 H new ATOM 0 HB2 ASP A 324 3.441 -12.321 1.239 1.00 0.00 H new ATOM 0 HB3 ASP A 324 5.152 -12.680 1.108 1.00 0.00 H new ATOM 634 N LEU A 325 4.406 -10.365 -1.919 1.00 0.00 N ATOM 635 CA LEU A 325 3.969 -9.194 -2.672 1.00 0.00 C ATOM 636 C LEU A 325 3.452 -9.596 -4.050 1.00 0.00 C ATOM 637 O LEU A 325 2.383 -9.159 -4.477 1.00 0.00 O ATOM 638 CB LEU A 325 5.121 -8.198 -2.819 1.00 0.00 C ATOM 639 CG LEU A 325 5.878 -7.855 -1.536 1.00 0.00 C ATOM 640 CD1 LEU A 325 7.038 -6.918 -1.835 1.00 0.00 C ATOM 641 CD2 LEU A 325 4.939 -7.235 -0.511 1.00 0.00 C ATOM 0 H LEU A 325 5.400 -10.372 -1.689 1.00 0.00 H new ATOM 0 HA LEU A 325 3.156 -8.721 -2.121 1.00 0.00 H new ATOM 0 HB2 LEU A 325 5.832 -8.600 -3.541 1.00 0.00 H new ATOM 0 HB3 LEU A 325 4.725 -7.275 -3.242 1.00 0.00 H new ATOM 0 HG LEU A 325 6.281 -8.777 -1.118 1.00 0.00 H new ATOM 0 HD11 LEU A 325 7.565 -6.685 -0.910 1.00 0.00 H new ATOM 0 HD12 LEU A 325 7.724 -7.399 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 325 6.657 -5.997 -2.278 1.00 0.00 H new ATOM 0 HD21 LEU A 325 5.496 -6.998 0.396 1.00 0.00 H new ATOM 0 HD22 LEU A 325 4.505 -6.322 -0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 325 4.143 -7.940 -0.274 1.00 0.00 H new ATOM 653 N VAL A 326 4.217 -10.435 -4.743 1.00 0.00 N ATOM 654 CA VAL A 326 3.835 -10.900 -6.071 1.00 0.00 C ATOM 655 C VAL A 326 2.471 -11.581 -6.043 1.00 0.00 C ATOM 656 O VAL A 326 1.593 -11.268 -6.847 1.00 0.00 O ATOM 657 CB VAL A 326 4.875 -11.882 -6.643 1.00 0.00 C ATOM 658 CG1 VAL A 326 4.453 -12.363 -8.022 1.00 0.00 C ATOM 659 CG2 VAL A 326 6.249 -11.230 -6.693 1.00 0.00 C ATOM 0 H VAL A 326 5.105 -10.806 -4.406 1.00 0.00 H new ATOM 0 HA VAL A 326 3.786 -10.020 -6.713 1.00 0.00 H new ATOM 0 HB VAL A 326 4.933 -12.749 -5.985 1.00 0.00 H new ATOM 0 HG11 VAL A 326 5.200 -13.056 -8.410 1.00 0.00 H new ATOM 0 HG12 VAL A 326 3.490 -12.869 -7.952 1.00 0.00 H new ATOM 0 HG13 VAL A 326 4.366 -11.509 -8.694 1.00 0.00 H new ATOM 0 HG21 VAL A 326 6.973 -11.937 -7.099 1.00 0.00 H new ATOM 0 HG22 VAL A 326 6.209 -10.346 -7.329 1.00 0.00 H new ATOM 0 HG23 VAL A 326 6.551 -10.940 -5.687 1.00 0.00 H new ATOM 669 N SER A 327 2.301 -12.514 -5.113 1.00 0.00 N ATOM 670 CA SER A 327 1.044 -13.243 -4.981 1.00 0.00 C ATOM 671 C SER A 327 -0.085 -12.307 -4.559 1.00 0.00 C ATOM 672 O SER A 327 -1.200 -12.390 -5.075 1.00 0.00 O ATOM 673 CB SER A 327 1.191 -14.376 -3.965 1.00 0.00 C ATOM 674 OG SER A 327 1.614 -15.573 -4.592 1.00 0.00 O ATOM 0 H SER A 327 3.018 -12.784 -4.439 1.00 0.00 H new ATOM 0 HA SER A 327 0.795 -13.668 -5.953 1.00 0.00 H new ATOM 0 HB2 SER A 327 1.911 -14.090 -3.198 1.00 0.00 H new ATOM 0 HB3 SER A 327 0.239 -14.543 -3.462 1.00 0.00 H new ATOM 0 HG SER A 327 1.702 -16.281 -3.920 1.00 0.00 H new ATOM 680 N LEU A 328 0.212 -11.419 -3.616 1.00 0.00 N ATOM 681 CA LEU A 328 -0.777 -10.468 -3.123 1.00 0.00 C ATOM 682 C LEU A 328 -1.424 -9.708 -4.277 1.00 0.00 C ATOM 683 O LEU A 328 -2.633 -9.480 -4.282 1.00 0.00 O ATOM 684 CB LEU A 328 -0.125 -9.483 -2.151 1.00 0.00 C ATOM 685 CG LEU A 328 0.087 -9.989 -0.725 1.00 0.00 C ATOM 686 CD1 LEU A 328 1.107 -9.127 0.003 1.00 0.00 C ATOM 687 CD2 LEU A 328 -1.232 -10.012 0.034 1.00 0.00 C ATOM 0 H LEU A 328 1.130 -11.338 -3.178 1.00 0.00 H new ATOM 0 HA LEU A 328 -1.553 -11.026 -2.599 1.00 0.00 H new ATOM 0 HB2 LEU A 328 0.842 -9.188 -2.558 1.00 0.00 H new ATOM 0 HB3 LEU A 328 -0.740 -8.584 -2.109 1.00 0.00 H new ATOM 0 HG LEU A 328 0.473 -11.007 -0.776 1.00 0.00 H new ATOM 0 HD11 LEU A 328 1.244 -9.503 1.017 1.00 0.00 H new ATOM 0 HD12 LEU A 328 2.058 -9.161 -0.529 1.00 0.00 H new ATOM 0 HD13 LEU A 328 0.751 -8.098 0.043 1.00 0.00 H new ATOM 0 HD21 LEU A 328 -1.062 -10.375 1.048 1.00 0.00 H new ATOM 0 HD22 LEU A 328 -1.646 -9.005 0.074 1.00 0.00 H new ATOM 0 HD23 LEU A 328 -1.933 -10.673 -0.475 1.00 0.00 H new ATOM 699 N PHE A 329 -0.610 -9.320 -5.254 1.00 0.00 N ATOM 700 CA PHE A 329 -1.104 -8.588 -6.414 1.00 0.00 C ATOM 701 C PHE A 329 -0.710 -9.291 -7.709 1.00 0.00 C ATOM 702 O PHE A 329 -0.331 -8.648 -8.688 1.00 0.00 O ATOM 703 CB PHE A 329 -0.558 -7.158 -6.410 1.00 0.00 C ATOM 704 CG PHE A 329 -0.638 -6.488 -5.069 1.00 0.00 C ATOM 705 CD1 PHE A 329 -1.866 -6.245 -4.474 1.00 0.00 C ATOM 706 CD2 PHE A 329 0.514 -6.104 -4.402 1.00 0.00 C ATOM 707 CE1 PHE A 329 -1.943 -5.629 -3.240 1.00 0.00 C ATOM 708 CE2 PHE A 329 0.442 -5.487 -3.167 1.00 0.00 C ATOM 709 CZ PHE A 329 -0.787 -5.250 -2.584 1.00 0.00 C ATOM 0 H PHE A 329 0.394 -9.500 -5.265 1.00 0.00 H new ATOM 0 HA PHE A 329 -2.192 -8.555 -6.356 1.00 0.00 H new ATOM 0 HB2 PHE A 329 0.482 -7.174 -6.737 1.00 0.00 H new ATOM 0 HB3 PHE A 329 -1.112 -6.564 -7.137 1.00 0.00 H new ATOM 0 HD1 PHE A 329 -2.773 -6.541 -4.981 1.00 0.00 H new ATOM 0 HD2 PHE A 329 1.478 -6.289 -4.852 1.00 0.00 H new ATOM 0 HE1 PHE A 329 -2.906 -5.444 -2.788 1.00 0.00 H new ATOM 0 HE2 PHE A 329 1.347 -5.190 -2.658 1.00 0.00 H new ATOM 0 HZ PHE A 329 -0.845 -4.770 -1.618 1.00 0.00 H new ATOM 719 N ALA A 330 -0.804 -10.617 -7.707 1.00 0.00 N ATOM 720 CA ALA A 330 -0.460 -11.409 -8.882 1.00 0.00 C ATOM 721 C ALA A 330 -1.543 -11.304 -9.951 1.00 0.00 C ATOM 722 O ALA A 330 -1.244 -11.203 -11.142 1.00 0.00 O ATOM 723 CB ALA A 330 -0.239 -12.863 -8.492 1.00 0.00 C ATOM 0 H ALA A 330 -1.115 -11.165 -6.905 1.00 0.00 H new ATOM 0 HA ALA A 330 0.465 -11.012 -9.300 1.00 0.00 H new ATOM 0 HB1 ALA A 330 0.017 -13.443 -9.379 1.00 0.00 H new ATOM 0 HB2 ALA A 330 0.575 -12.926 -7.770 1.00 0.00 H new ATOM 0 HB3 ALA A 330 -1.150 -13.263 -8.048 1.00 0.00 H new ATOM 729 N ARG A 331 -2.799 -11.330 -9.518 1.00 0.00 N ATOM 730 CA ARG A 331 -3.925 -11.240 -10.440 1.00 0.00 C ATOM 731 C ARG A 331 -3.759 -10.056 -11.388 1.00 0.00 C ATOM 732 O ARG A 331 -3.968 -10.180 -12.595 1.00 0.00 O ATOM 733 CB ARG A 331 -5.236 -11.106 -9.664 1.00 0.00 C ATOM 734 CG ARG A 331 -5.281 -9.893 -8.750 1.00 0.00 C ATOM 735 CD ARG A 331 -6.652 -9.725 -8.112 1.00 0.00 C ATOM 736 NE ARG A 331 -6.570 -9.095 -6.797 1.00 0.00 N ATOM 737 CZ ARG A 331 -6.304 -9.760 -5.679 1.00 0.00 C ATOM 738 NH1 ARG A 331 -6.093 -11.069 -5.715 1.00 0.00 N ATOM 739 NH2 ARG A 331 -6.247 -9.116 -4.520 1.00 0.00 N ATOM 0 H ARG A 331 -3.062 -11.413 -8.536 1.00 0.00 H new ATOM 0 HA ARG A 331 -3.952 -12.155 -11.032 1.00 0.00 H new ATOM 0 HB2 ARG A 331 -6.063 -11.048 -10.372 1.00 0.00 H new ATOM 0 HB3 ARG A 331 -5.389 -12.006 -9.068 1.00 0.00 H new ATOM 0 HG2 ARG A 331 -4.526 -9.996 -7.970 1.00 0.00 H new ATOM 0 HG3 ARG A 331 -5.032 -8.998 -9.320 1.00 0.00 H new ATOM 0 HD2 ARG A 331 -7.284 -9.122 -8.764 1.00 0.00 H new ATOM 0 HD3 ARG A 331 -7.130 -10.700 -8.018 1.00 0.00 H new ATOM 0 HE ARG A 331 -6.726 -8.089 -6.734 1.00 0.00 H new ATOM 0 HH11 ARG A 331 -6.135 -11.568 -6.604 1.00 0.00 H new ATOM 0 HH12 ARG A 331 -5.889 -11.577 -4.854 1.00 0.00 H new ATOM 0 HH21 ARG A 331 -6.408 -8.109 -4.488 1.00 0.00 H new ATOM 0 HH22 ARG A 331 -6.043 -9.628 -3.662 1.00 0.00 H new ATOM 753 N PHE A 332 -3.383 -8.910 -10.833 1.00 0.00 N ATOM 754 CA PHE A 332 -3.191 -7.702 -11.629 1.00 0.00 C ATOM 755 C PHE A 332 -2.040 -7.879 -12.616 1.00 0.00 C ATOM 756 O PHE A 332 -2.168 -7.557 -13.796 1.00 0.00 O ATOM 757 CB PHE A 332 -2.916 -6.504 -10.717 1.00 0.00 C ATOM 758 CG PHE A 332 -3.884 -6.385 -9.575 1.00 0.00 C ATOM 759 CD1 PHE A 332 -3.638 -7.026 -8.372 1.00 0.00 C ATOM 760 CD2 PHE A 332 -5.040 -5.631 -9.705 1.00 0.00 C ATOM 761 CE1 PHE A 332 -4.527 -6.919 -7.319 1.00 0.00 C ATOM 762 CE2 PHE A 332 -5.931 -5.519 -8.655 1.00 0.00 C ATOM 763 CZ PHE A 332 -5.675 -6.165 -7.460 1.00 0.00 C ATOM 0 H PHE A 332 -3.205 -8.791 -9.836 1.00 0.00 H new ATOM 0 HA PHE A 332 -4.105 -7.518 -12.193 1.00 0.00 H new ATOM 0 HB2 PHE A 332 -1.905 -6.586 -10.319 1.00 0.00 H new ATOM 0 HB3 PHE A 332 -2.952 -5.590 -11.310 1.00 0.00 H new ATOM 0 HD1 PHE A 332 -2.741 -7.616 -8.255 1.00 0.00 H new ATOM 0 HD2 PHE A 332 -5.246 -5.126 -10.637 1.00 0.00 H new ATOM 0 HE1 PHE A 332 -4.324 -7.425 -6.387 1.00 0.00 H new ATOM 0 HE2 PHE A 332 -6.827 -4.927 -8.768 1.00 0.00 H new ATOM 0 HZ PHE A 332 -6.371 -6.080 -6.639 1.00 0.00 H new ATOM 884 N ILE A 340 4.090 -5.350 -13.242 1.00 0.00 N ATOM 885 CA ILE A 340 4.152 -4.599 -11.994 1.00 0.00 C ATOM 886 C ILE A 340 5.538 -4.692 -11.365 1.00 0.00 C ATOM 887 O ILE A 340 6.069 -5.784 -11.168 1.00 0.00 O ATOM 888 CB ILE A 340 3.107 -5.104 -10.982 1.00 0.00 C ATOM 889 CG1 ILE A 340 1.699 -4.988 -11.568 1.00 0.00 C ATOM 890 CG2 ILE A 340 3.210 -4.323 -9.680 1.00 0.00 C ATOM 891 CD1 ILE A 340 0.656 -5.763 -10.794 1.00 0.00 C ATOM 0 HA ILE A 340 3.936 -3.559 -12.240 1.00 0.00 H new ATOM 0 HB ILE A 340 3.307 -6.154 -10.770 1.00 0.00 H new ATOM 0 HG12 ILE A 340 1.412 -3.937 -11.597 1.00 0.00 H new ATOM 0 HG13 ILE A 340 1.713 -5.343 -12.599 1.00 0.00 H new ATOM 0 HG21 ILE A 340 2.465 -4.691 -8.975 1.00 0.00 H new ATOM 0 HG22 ILE A 340 4.206 -4.452 -9.256 1.00 0.00 H new ATOM 0 HG23 ILE A 340 3.033 -3.265 -9.875 1.00 0.00 H new ATOM 0 HD11 ILE A 340 -0.318 -5.635 -11.267 1.00 0.00 H new ATOM 0 HD12 ILE A 340 0.919 -6.821 -10.787 1.00 0.00 H new ATOM 0 HD13 ILE A 340 0.614 -5.393 -9.770 1.00 0.00 H new ATOM 903 N GLN A 341 6.118 -3.537 -11.051 1.00 0.00 N ATOM 904 CA GLN A 341 7.442 -3.488 -10.443 1.00 0.00 C ATOM 905 C GLN A 341 7.345 -3.519 -8.922 1.00 0.00 C ATOM 906 O GLN A 341 6.730 -2.644 -8.311 1.00 0.00 O ATOM 907 CB GLN A 341 8.186 -2.229 -10.893 1.00 0.00 C ATOM 908 CG GLN A 341 8.795 -2.346 -12.281 1.00 0.00 C ATOM 909 CD GLN A 341 10.186 -2.948 -12.260 1.00 0.00 C ATOM 910 OE1 GLN A 341 10.346 -4.168 -12.222 1.00 0.00 O ATOM 911 NE2 GLN A 341 11.202 -2.094 -12.286 1.00 0.00 N ATOM 0 H GLN A 341 5.692 -2.624 -11.208 1.00 0.00 H new ATOM 0 HA GLN A 341 7.997 -4.367 -10.771 1.00 0.00 H new ATOM 0 HB2 GLN A 341 7.497 -1.385 -10.878 1.00 0.00 H new ATOM 0 HB3 GLN A 341 8.977 -2.008 -10.176 1.00 0.00 H new ATOM 0 HG2 GLN A 341 8.147 -2.960 -12.907 1.00 0.00 H new ATOM 0 HG3 GLN A 341 8.838 -1.358 -12.739 1.00 0.00 H new ATOM 0 HE21 GLN A 341 11.024 -1.090 -12.317 1.00 0.00 H new ATOM 0 HE22 GLN A 341 12.161 -2.442 -12.275 1.00 0.00 H new ATOM 920 N PHE A 342 7.953 -4.533 -8.315 1.00 0.00 N ATOM 921 CA PHE A 342 7.933 -4.679 -6.864 1.00 0.00 C ATOM 922 C PHE A 342 9.287 -4.315 -6.263 1.00 0.00 C ATOM 923 O PHE A 342 10.335 -4.667 -6.806 1.00 0.00 O ATOM 924 CB PHE A 342 7.559 -6.112 -6.480 1.00 0.00 C ATOM 925 CG PHE A 342 6.194 -6.522 -6.951 1.00 0.00 C ATOM 926 CD1 PHE A 342 5.964 -6.806 -8.288 1.00 0.00 C ATOM 927 CD2 PHE A 342 5.140 -6.625 -6.057 1.00 0.00 C ATOM 928 CE1 PHE A 342 4.708 -7.184 -8.724 1.00 0.00 C ATOM 929 CE2 PHE A 342 3.881 -7.002 -6.487 1.00 0.00 C ATOM 930 CZ PHE A 342 3.665 -7.282 -7.822 1.00 0.00 C ATOM 0 H PHE A 342 8.466 -5.266 -8.805 1.00 0.00 H new ATOM 0 HA PHE A 342 7.183 -3.996 -6.464 1.00 0.00 H new ATOM 0 HB2 PHE A 342 8.299 -6.796 -6.896 1.00 0.00 H new ATOM 0 HB3 PHE A 342 7.606 -6.213 -5.396 1.00 0.00 H new ATOM 0 HD1 PHE A 342 6.775 -6.731 -8.997 1.00 0.00 H new ATOM 0 HD2 PHE A 342 5.304 -6.408 -5.012 1.00 0.00 H new ATOM 0 HE1 PHE A 342 4.542 -7.403 -9.768 1.00 0.00 H new ATOM 0 HE2 PHE A 342 3.068 -7.077 -5.780 1.00 0.00 H new ATOM 0 HZ PHE A 342 2.683 -7.577 -8.161 1.00 0.00 H new ATOM 940 N ARG A 343 9.258 -3.609 -5.137 1.00 0.00 N ATOM 941 CA ARG A 343 10.482 -3.196 -4.463 1.00 0.00 C ATOM 942 C ARG A 343 10.367 -3.401 -2.954 1.00 0.00 C ATOM 943 O ARG A 343 9.395 -2.974 -2.333 1.00 0.00 O ATOM 944 CB ARG A 343 10.787 -1.728 -4.766 1.00 0.00 C ATOM 945 CG ARG A 343 12.037 -1.210 -4.075 1.00 0.00 C ATOM 946 CD ARG A 343 11.965 0.292 -3.845 1.00 0.00 C ATOM 947 NE ARG A 343 12.065 1.043 -5.093 1.00 0.00 N ATOM 948 CZ ARG A 343 12.022 2.369 -5.158 1.00 0.00 C ATOM 949 NH1 ARG A 343 11.884 3.086 -4.052 1.00 0.00 N ATOM 950 NH2 ARG A 343 12.120 2.979 -6.333 1.00 0.00 N ATOM 0 H ARG A 343 8.400 -3.311 -4.673 1.00 0.00 H new ATOM 0 HA ARG A 343 11.298 -3.814 -4.836 1.00 0.00 H new ATOM 0 HB2 ARG A 343 10.900 -1.604 -5.843 1.00 0.00 H new ATOM 0 HB3 ARG A 343 9.936 -1.119 -4.463 1.00 0.00 H new ATOM 0 HG2 ARG A 343 12.164 -1.720 -3.120 1.00 0.00 H new ATOM 0 HG3 ARG A 343 12.912 -1.445 -4.680 1.00 0.00 H new ATOM 0 HD2 ARG A 343 11.026 0.538 -3.348 1.00 0.00 H new ATOM 0 HD3 ARG A 343 12.769 0.595 -3.174 1.00 0.00 H new ATOM 0 HE ARG A 343 12.174 0.521 -5.962 1.00 0.00 H new ATOM 0 HH11 ARG A 343 11.811 2.620 -3.148 1.00 0.00 H new ATOM 0 HH12 ARG A 343 11.851 4.104 -4.105 1.00 0.00 H new ATOM 0 HH21 ARG A 343 12.228 2.429 -7.185 1.00 0.00 H new ATOM 0 HH22 ARG A 343 12.087 3.997 -6.383 1.00 0.00 H new ATOM 964 N MET A 344 11.367 -4.057 -2.375 1.00 0.00 N ATOM 965 CA MET A 344 11.378 -4.318 -0.939 1.00 0.00 C ATOM 966 C MET A 344 12.468 -3.507 -0.248 1.00 0.00 C ATOM 967 O MET A 344 13.530 -3.263 -0.819 1.00 0.00 O ATOM 968 CB MET A 344 11.590 -5.810 -0.673 1.00 0.00 C ATOM 969 CG MET A 344 11.916 -6.128 0.778 1.00 0.00 C ATOM 970 SD MET A 344 10.552 -5.748 1.895 1.00 0.00 S ATOM 971 CE MET A 344 9.282 -6.840 1.262 1.00 0.00 C ATOM 0 H MET A 344 12.179 -4.417 -2.876 1.00 0.00 H new ATOM 0 HA MET A 344 10.413 -4.017 -0.532 1.00 0.00 H new ATOM 0 HB2 MET A 344 10.691 -6.354 -0.962 1.00 0.00 H new ATOM 0 HB3 MET A 344 12.399 -6.172 -1.307 1.00 0.00 H new ATOM 0 HG2 MET A 344 12.170 -7.184 0.866 1.00 0.00 H new ATOM 0 HG3 MET A 344 12.797 -5.562 1.081 1.00 0.00 H new ATOM 0 HE1 MET A 344 8.438 -6.854 1.951 1.00 0.00 H new ATOM 0 HE2 MET A 344 8.949 -6.484 0.287 1.00 0.00 H new ATOM 0 HE3 MET A 344 9.685 -7.848 1.161 1.00 0.00 H new ATOM 981 N MET A 345 12.198 -3.090 0.985 1.00 0.00 N ATOM 982 CA MET A 345 13.156 -2.306 1.755 1.00 0.00 C ATOM 983 C MET A 345 14.168 -3.214 2.448 1.00 0.00 C ATOM 984 O MET A 345 13.947 -4.417 2.584 1.00 0.00 O ATOM 985 CB MET A 345 12.431 -1.446 2.791 1.00 0.00 C ATOM 986 CG MET A 345 13.148 -0.145 3.111 1.00 0.00 C ATOM 987 SD MET A 345 12.173 0.946 4.163 1.00 0.00 S ATOM 988 CE MET A 345 11.110 1.725 2.951 1.00 0.00 C ATOM 0 H MET A 345 11.323 -3.282 1.472 1.00 0.00 H new ATOM 0 HA MET A 345 13.691 -1.654 1.065 1.00 0.00 H new ATOM 0 HB2 MET A 345 11.430 -1.219 2.426 1.00 0.00 H new ATOM 0 HB3 MET A 345 12.312 -2.021 3.709 1.00 0.00 H new ATOM 0 HG2 MET A 345 14.094 -0.368 3.604 1.00 0.00 H new ATOM 0 HG3 MET A 345 13.387 0.372 2.181 1.00 0.00 H new ATOM 0 HE1 MET A 345 10.446 2.431 3.450 1.00 0.00 H new ATOM 0 HE2 MET A 345 11.720 2.256 2.220 1.00 0.00 H new ATOM 0 HE3 MET A 345 10.517 0.964 2.445 1.00 0.00 H new ATOM 1084 N GLY A 351 10.443 -3.908 7.117 1.00 0.00 N ATOM 1085 CA GLY A 351 9.027 -4.224 7.078 1.00 0.00 C ATOM 1086 C GLY A 351 8.251 -3.293 6.168 1.00 0.00 C ATOM 1087 O GLY A 351 7.056 -3.074 6.369 1.00 0.00 O ATOM 0 HA2 GLY A 351 8.896 -5.252 6.739 1.00 0.00 H new ATOM 0 HA3 GLY A 351 8.617 -4.167 8.086 1.00 0.00 H new ATOM 1091 N GLN A 352 8.930 -2.743 5.168 1.00 0.00 N ATOM 1092 CA GLN A 352 8.297 -1.827 4.226 1.00 0.00 C ATOM 1093 C GLN A 352 8.659 -2.186 2.790 1.00 0.00 C ATOM 1094 O GLN A 352 9.769 -2.640 2.514 1.00 0.00 O ATOM 1095 CB GLN A 352 8.712 -0.385 4.525 1.00 0.00 C ATOM 1096 CG GLN A 352 8.447 0.040 5.959 1.00 0.00 C ATOM 1097 CD GLN A 352 9.437 1.077 6.453 1.00 0.00 C ATOM 1098 OE1 GLN A 352 10.403 0.640 7.253 1.00 0.00 O flip ATOM 1099 NE2 GLN A 352 9.334 2.258 6.120 1.00 0.00 N flip ATOM 0 H GLN A 352 9.919 -2.915 4.988 1.00 0.00 H new ATOM 0 HA GLN A 352 7.217 -1.917 4.342 1.00 0.00 H new ATOM 0 HB2 GLN A 352 9.775 -0.270 4.311 1.00 0.00 H new ATOM 0 HB3 GLN A 352 8.177 0.285 3.852 1.00 0.00 H new ATOM 0 HG2 GLN A 352 7.437 0.443 6.034 1.00 0.00 H new ATOM 0 HG3 GLN A 352 8.490 -0.835 6.607 1.00 0.00 H new ATOM 0 HE21 GLN A 352 8.576 2.550 5.503 1.00 0.00 H new ATOM 0 HE22 GLN A 352 10.007 2.945 6.461 1.00 0.00 H new ATOM 1108 N ALA A 353 7.714 -1.982 1.877 1.00 0.00 N ATOM 1109 CA ALA A 353 7.935 -2.283 0.468 1.00 0.00 C ATOM 1110 C ALA A 353 7.171 -1.314 -0.427 1.00 0.00 C ATOM 1111 O ALA A 353 6.073 -0.874 -0.087 1.00 0.00 O ATOM 1112 CB ALA A 353 7.527 -3.718 0.165 1.00 0.00 C ATOM 0 H ALA A 353 6.788 -1.610 2.089 1.00 0.00 H new ATOM 0 HA ALA A 353 8.999 -2.167 0.260 1.00 0.00 H new ATOM 0 HB1 ALA A 353 7.697 -3.929 -0.891 1.00 0.00 H new ATOM 0 HB2 ALA A 353 8.121 -4.401 0.772 1.00 0.00 H new ATOM 0 HB3 ALA A 353 6.470 -3.852 0.396 1.00 0.00 H new ATOM 1118 N PHE A 354 7.760 -0.983 -1.572 1.00 0.00 N ATOM 1119 CA PHE A 354 7.135 -0.064 -2.515 1.00 0.00 C ATOM 1120 C PHE A 354 6.834 -0.763 -3.838 1.00 0.00 C ATOM 1121 O PHE A 354 7.726 -1.326 -4.472 1.00 0.00 O ATOM 1122 CB PHE A 354 8.042 1.144 -2.760 1.00 0.00 C ATOM 1123 CG PHE A 354 8.074 2.111 -1.610 1.00 0.00 C ATOM 1124 CD1 PHE A 354 7.135 3.125 -1.514 1.00 0.00 C ATOM 1125 CD2 PHE A 354 9.044 2.006 -0.626 1.00 0.00 C ATOM 1126 CE1 PHE A 354 7.162 4.017 -0.458 1.00 0.00 C ATOM 1127 CE2 PHE A 354 9.075 2.895 0.432 1.00 0.00 C ATOM 1128 CZ PHE A 354 8.134 3.901 0.515 1.00 0.00 C ATOM 0 H PHE A 354 8.669 -1.338 -1.869 1.00 0.00 H new ATOM 0 HA PHE A 354 6.195 0.277 -2.082 1.00 0.00 H new ATOM 0 HB2 PHE A 354 9.055 0.794 -2.959 1.00 0.00 H new ATOM 0 HB3 PHE A 354 7.704 1.667 -3.655 1.00 0.00 H new ATOM 0 HD1 PHE A 354 6.373 3.220 -2.273 1.00 0.00 H new ATOM 0 HD2 PHE A 354 9.784 1.221 -0.686 1.00 0.00 H new ATOM 0 HE1 PHE A 354 6.424 4.803 -0.395 1.00 0.00 H new ATOM 0 HE2 PHE A 354 9.835 2.802 1.193 1.00 0.00 H new ATOM 0 HZ PHE A 354 8.158 4.597 1.341 1.00 0.00 H new ATOM 1138 N ILE A 355 5.569 -0.723 -4.246 1.00 0.00 N ATOM 1139 CA ILE A 355 5.150 -1.352 -5.494 1.00 0.00 C ATOM 1140 C ILE A 355 4.685 -0.309 -6.505 1.00 0.00 C ATOM 1141 O ILE A 355 4.029 0.670 -6.148 1.00 0.00 O ATOM 1142 CB ILE A 355 4.015 -2.365 -5.258 1.00 0.00 C ATOM 1143 CG1 ILE A 355 4.471 -3.460 -4.292 1.00 0.00 C ATOM 1144 CG2 ILE A 355 3.564 -2.971 -6.578 1.00 0.00 C ATOM 1145 CD1 ILE A 355 3.351 -4.366 -3.833 1.00 0.00 C ATOM 0 H ILE A 355 4.818 -0.263 -3.732 1.00 0.00 H new ATOM 0 HA ILE A 355 6.018 -1.878 -5.892 1.00 0.00 H new ATOM 0 HB ILE A 355 3.169 -1.842 -4.812 1.00 0.00 H new ATOM 0 HG12 ILE A 355 5.240 -4.063 -4.776 1.00 0.00 H new ATOM 0 HG13 ILE A 355 4.932 -2.995 -3.420 1.00 0.00 H new ATOM 0 HG21 ILE A 355 2.761 -3.685 -6.395 1.00 0.00 H new ATOM 0 HG22 ILE A 355 3.204 -2.181 -7.237 1.00 0.00 H new ATOM 0 HG23 ILE A 355 4.404 -3.482 -7.050 1.00 0.00 H new ATOM 0 HD11 ILE A 355 3.748 -5.118 -3.151 1.00 0.00 H new ATOM 0 HD12 ILE A 355 2.592 -3.775 -3.320 1.00 0.00 H new ATOM 0 HD13 ILE A 355 2.905 -4.859 -4.697 1.00 0.00 H new ATOM 1157 N THR A 356 5.027 -0.528 -7.771 1.00 0.00 N ATOM 1158 CA THR A 356 4.644 0.391 -8.836 1.00 0.00 C ATOM 1159 C THR A 356 3.745 -0.295 -9.857 1.00 0.00 C ATOM 1160 O THR A 356 4.169 -1.218 -10.552 1.00 0.00 O ATOM 1161 CB THR A 356 5.880 0.960 -9.557 1.00 0.00 C ATOM 1162 OG1 THR A 356 6.725 1.640 -8.622 1.00 0.00 O ATOM 1163 CG2 THR A 356 5.467 1.919 -10.664 1.00 0.00 C ATOM 0 H THR A 356 5.568 -1.334 -8.084 1.00 0.00 H new ATOM 0 HA THR A 356 4.097 1.209 -8.367 1.00 0.00 H new ATOM 0 HB THR A 356 6.427 0.129 -10.002 1.00 0.00 H new ATOM 0 HG1 THR A 356 7.509 1.997 -9.089 1.00 0.00 H new ATOM 0 HG21 THR A 356 6.357 2.308 -11.159 1.00 0.00 H new ATOM 0 HG22 THR A 356 4.849 1.392 -11.391 1.00 0.00 H new ATOM 0 HG23 THR A 356 4.899 2.745 -10.236 1.00 0.00 H new ATOM 1171 N PHE A 357 2.499 0.162 -9.942 1.00 0.00 N ATOM 1172 CA PHE A 357 1.539 -0.408 -10.879 1.00 0.00 C ATOM 1173 C PHE A 357 1.459 0.427 -12.153 1.00 0.00 C ATOM 1174 O PHE A 357 1.818 1.605 -12.177 1.00 0.00 O ATOM 1175 CB PHE A 357 0.155 -0.502 -10.230 1.00 0.00 C ATOM 1176 CG PHE A 357 0.014 -1.660 -9.285 1.00 0.00 C ATOM 1177 CD1 PHE A 357 0.582 -1.614 -8.021 1.00 0.00 C ATOM 1178 CD2 PHE A 357 -0.688 -2.795 -9.658 1.00 0.00 C ATOM 1179 CE1 PHE A 357 0.454 -2.678 -7.150 1.00 0.00 C ATOM 1180 CE2 PHE A 357 -0.819 -3.863 -8.790 1.00 0.00 C ATOM 1181 CZ PHE A 357 -0.248 -3.804 -7.534 1.00 0.00 C ATOM 0 H PHE A 357 2.132 0.925 -9.373 1.00 0.00 H new ATOM 0 HA PHE A 357 1.879 -1.409 -11.143 1.00 0.00 H new ATOM 0 HB2 PHE A 357 -0.048 0.423 -9.691 1.00 0.00 H new ATOM 0 HB3 PHE A 357 -0.599 -0.588 -11.012 1.00 0.00 H new ATOM 0 HD1 PHE A 357 1.131 -0.736 -7.714 1.00 0.00 H new ATOM 0 HD2 PHE A 357 -1.138 -2.846 -10.638 1.00 0.00 H new ATOM 0 HE1 PHE A 357 0.903 -2.630 -6.169 1.00 0.00 H new ATOM 0 HE2 PHE A 357 -1.367 -4.742 -9.094 1.00 0.00 H new ATOM 0 HZ PHE A 357 -0.350 -4.636 -6.853 1.00 0.00 H new ATOM 1191 N PRO A 358 0.979 -0.195 -13.240 1.00 0.00 N ATOM 1192 CA PRO A 358 0.841 0.471 -14.538 1.00 0.00 C ATOM 1193 C PRO A 358 0.252 1.871 -14.411 1.00 0.00 C ATOM 1194 O PRO A 358 0.727 2.814 -15.043 1.00 0.00 O ATOM 1195 CB PRO A 358 -0.114 -0.444 -15.307 1.00 0.00 C ATOM 1196 CG PRO A 358 0.103 -1.797 -14.721 1.00 0.00 C ATOM 1197 CD PRO A 358 0.533 -1.598 -13.284 1.00 0.00 C ATOM 0 HA PRO A 358 1.804 0.612 -15.028 1.00 0.00 H new ATOM 0 HB2 PRO A 358 -1.149 -0.123 -15.190 1.00 0.00 H new ATOM 0 HB3 PRO A 358 0.104 -0.436 -16.375 1.00 0.00 H new ATOM 0 HG2 PRO A 358 -0.811 -2.389 -14.771 1.00 0.00 H new ATOM 0 HG3 PRO A 358 0.865 -2.340 -15.279 1.00 0.00 H new ATOM 0 HD2 PRO A 358 -0.290 -1.778 -12.592 1.00 0.00 H new ATOM 0 HD3 PRO A 358 1.336 -2.282 -13.009 1.00 0.00 H new ATOM 1205 N ASN A 359 -0.786 1.999 -13.591 1.00 0.00 N ATOM 1206 CA ASN A 359 -1.441 3.285 -13.381 1.00 0.00 C ATOM 1207 C ASN A 359 -2.078 3.353 -11.997 1.00 0.00 C ATOM 1208 O ASN A 359 -1.931 2.437 -11.188 1.00 0.00 O ATOM 1209 CB ASN A 359 -2.504 3.521 -14.457 1.00 0.00 C ATOM 1210 CG ASN A 359 -3.159 2.233 -14.913 1.00 0.00 C ATOM 1211 OD1 ASN A 359 -4.149 1.772 -14.157 1.00 0.00 O flip ATOM 1212 ND2 ASN A 359 -2.782 1.658 -15.934 1.00 0.00 N flip ATOM 0 H ASN A 359 -1.192 1.228 -13.061 1.00 0.00 H new ATOM 0 HA ASN A 359 -0.683 4.066 -13.450 1.00 0.00 H new ATOM 0 HB2 ASN A 359 -3.267 4.196 -14.069 1.00 0.00 H new ATOM 0 HB3 ASN A 359 -2.047 4.016 -15.314 1.00 0.00 H new ATOM 0 HD21 ASN A 359 -2.017 2.047 -16.486 1.00 0.00 H new ATOM 0 HD22 ASN A 359 -3.234 0.792 -16.228 1.00 0.00 H new ATOM 1219 N LYS A 360 -2.788 4.445 -11.731 1.00 0.00 N ATOM 1220 CA LYS A 360 -3.451 4.632 -10.446 1.00 0.00 C ATOM 1221 C LYS A 360 -4.694 3.756 -10.341 1.00 0.00 C ATOM 1222 O LYS A 360 -4.980 3.192 -9.285 1.00 0.00 O ATOM 1223 CB LYS A 360 -3.831 6.102 -10.254 1.00 0.00 C ATOM 1224 CG LYS A 360 -4.778 6.628 -11.319 1.00 0.00 C ATOM 1225 CD LYS A 360 -5.179 8.068 -11.046 1.00 0.00 C ATOM 1226 CE LYS A 360 -6.009 8.641 -12.186 1.00 0.00 C ATOM 1227 NZ LYS A 360 -5.174 8.948 -13.379 1.00 0.00 N ATOM 0 H LYS A 360 -2.919 5.214 -12.389 1.00 0.00 H new ATOM 0 HA LYS A 360 -2.755 4.338 -9.661 1.00 0.00 H new ATOM 0 HB2 LYS A 360 -4.294 6.224 -9.275 1.00 0.00 H new ATOM 0 HB3 LYS A 360 -2.924 6.707 -10.255 1.00 0.00 H new ATOM 0 HG2 LYS A 360 -4.301 6.561 -12.297 1.00 0.00 H new ATOM 0 HG3 LYS A 360 -5.669 6.002 -11.356 1.00 0.00 H new ATOM 0 HD2 LYS A 360 -5.749 8.119 -10.118 1.00 0.00 H new ATOM 0 HD3 LYS A 360 -4.285 8.675 -10.904 1.00 0.00 H new ATOM 0 HE2 LYS A 360 -6.788 7.930 -12.461 1.00 0.00 H new ATOM 0 HE3 LYS A 360 -6.510 9.549 -11.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 360 -5.755 9.429 -14.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 360 -4.385 9.566 -13.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 360 -4.797 8.064 -13.776 1.00 0.00 H new ATOM 1241 N GLU A 361 -5.429 3.645 -11.443 1.00 0.00 N ATOM 1242 CA GLU A 361 -6.642 2.837 -11.475 1.00 0.00 C ATOM 1243 C GLU A 361 -6.396 1.462 -10.860 1.00 0.00 C ATOM 1244 O GLU A 361 -6.953 1.129 -9.813 1.00 0.00 O ATOM 1245 CB GLU A 361 -7.142 2.683 -12.912 1.00 0.00 C ATOM 1246 CG GLU A 361 -7.933 3.879 -13.413 1.00 0.00 C ATOM 1247 CD GLU A 361 -7.983 3.953 -14.926 1.00 0.00 C ATOM 1248 OE1 GLU A 361 -7.015 3.502 -15.575 1.00 0.00 O ATOM 1249 OE2 GLU A 361 -8.989 4.462 -15.463 1.00 0.00 O ATOM 0 H GLU A 361 -5.205 4.105 -12.326 1.00 0.00 H new ATOM 0 HA GLU A 361 -7.404 3.348 -10.887 1.00 0.00 H new ATOM 0 HB2 GLU A 361 -6.288 2.522 -13.570 1.00 0.00 H new ATOM 0 HB3 GLU A 361 -7.767 1.792 -12.977 1.00 0.00 H new ATOM 0 HG2 GLU A 361 -8.949 3.827 -13.022 1.00 0.00 H new ATOM 0 HG3 GLU A 361 -7.487 4.794 -13.023 1.00 0.00 H new ATOM 1256 N ILE A 362 -5.556 0.669 -11.518 1.00 0.00 N ATOM 1257 CA ILE A 362 -5.236 -0.669 -11.037 1.00 0.00 C ATOM 1258 C ILE A 362 -4.719 -0.628 -9.602 1.00 0.00 C ATOM 1259 O ILE A 362 -5.262 -1.290 -8.718 1.00 0.00 O ATOM 1260 CB ILE A 362 -4.183 -1.351 -11.929 1.00 0.00 C ATOM 1261 CG1 ILE A 362 -4.802 -1.757 -13.269 1.00 0.00 C ATOM 1262 CG2 ILE A 362 -3.594 -2.564 -11.223 1.00 0.00 C ATOM 1263 CD1 ILE A 362 -3.780 -2.034 -14.348 1.00 0.00 C ATOM 0 H ILE A 362 -5.086 0.930 -12.385 1.00 0.00 H new ATOM 0 HA ILE A 362 -6.160 -1.246 -11.073 1.00 0.00 H new ATOM 0 HB ILE A 362 -3.379 -0.641 -12.122 1.00 0.00 H new ATOM 0 HG12 ILE A 362 -5.414 -2.647 -13.122 1.00 0.00 H new ATOM 0 HG13 ILE A 362 -5.469 -0.964 -13.607 1.00 0.00 H new ATOM 0 HG21 ILE A 362 -2.851 -3.035 -11.867 1.00 0.00 H new ATOM 0 HG22 ILE A 362 -3.121 -2.249 -10.293 1.00 0.00 H new ATOM 0 HG23 ILE A 362 -4.388 -3.278 -11.003 1.00 0.00 H new ATOM 0 HD11 ILE A 362 -4.290 -2.316 -15.269 1.00 0.00 H new ATOM 0 HD12 ILE A 362 -3.184 -1.138 -14.523 1.00 0.00 H new ATOM 0 HD13 ILE A 362 -3.128 -2.848 -14.031 1.00 0.00 H new ATOM 1275 N ALA A 363 -3.670 0.155 -9.379 1.00 0.00 N ATOM 1276 CA ALA A 363 -3.082 0.285 -8.051 1.00 0.00 C ATOM 1277 C ALA A 363 -4.164 0.416 -6.983 1.00 0.00 C ATOM 1278 O ALA A 363 -4.262 -0.417 -6.083 1.00 0.00 O ATOM 1279 CB ALA A 363 -2.145 1.483 -8.004 1.00 0.00 C ATOM 0 H ALA A 363 -3.209 0.709 -10.100 1.00 0.00 H new ATOM 0 HA ALA A 363 -2.509 -0.619 -7.843 1.00 0.00 H new ATOM 0 HB1 ALA A 363 -1.713 1.568 -7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 363 -1.347 1.350 -8.735 1.00 0.00 H new ATOM 0 HB3 ALA A 363 -2.702 2.390 -8.237 1.00 0.00 H new ATOM 1285 N TRP A 364 -4.971 1.464 -7.090 1.00 0.00 N ATOM 1286 CA TRP A 364 -6.045 1.704 -6.132 1.00 0.00 C ATOM 1287 C TRP A 364 -6.838 0.427 -5.875 1.00 0.00 C ATOM 1288 O TRP A 364 -6.918 -0.045 -4.742 1.00 0.00 O ATOM 1289 CB TRP A 364 -6.976 2.804 -6.644 1.00 0.00 C ATOM 1290 CG TRP A 364 -8.241 2.928 -5.849 1.00 0.00 C ATOM 1291 CD1 TRP A 364 -8.386 2.736 -4.504 1.00 0.00 C ATOM 1292 CD2 TRP A 364 -9.537 3.270 -6.350 1.00 0.00 C ATOM 1293 NE1 TRP A 364 -9.695 2.939 -4.140 1.00 0.00 N ATOM 1294 CE2 TRP A 364 -10.422 3.268 -5.254 1.00 0.00 C ATOM 1295 CE3 TRP A 364 -10.038 3.580 -7.617 1.00 0.00 C ATOM 1296 CZ2 TRP A 364 -11.776 3.562 -5.389 1.00 0.00 C ATOM 1297 CZ3 TRP A 364 -11.381 3.871 -7.750 1.00 0.00 C ATOM 1298 CH2 TRP A 364 -12.238 3.861 -6.642 1.00 0.00 C ATOM 0 H TRP A 364 -4.903 2.162 -7.831 1.00 0.00 H new ATOM 0 HA TRP A 364 -5.597 2.027 -5.192 1.00 0.00 H new ATOM 0 HB2 TRP A 364 -6.447 3.757 -6.623 1.00 0.00 H new ATOM 0 HB3 TRP A 364 -7.228 2.602 -7.685 1.00 0.00 H new ATOM 0 HD1 TRP A 364 -7.589 2.465 -3.827 1.00 0.00 H new ATOM 0 HE1 TRP A 364 -10.066 2.858 -3.193 1.00 0.00 H new ATOM 0 HE3 TRP A 364 -9.386 3.592 -8.478 1.00 0.00 H new ATOM 0 HZ2 TRP A 364 -12.438 3.554 -4.536 1.00 0.00 H new ATOM 0 HZ3 TRP A 364 -11.778 4.111 -8.725 1.00 0.00 H new ATOM 0 HH2 TRP A 364 -13.284 4.094 -6.779 1.00 0.00 H new ATOM 1309 N GLN A 365 -7.424 -0.124 -6.934 1.00 0.00 N ATOM 1310 CA GLN A 365 -8.211 -1.345 -6.820 1.00 0.00 C ATOM 1311 C GLN A 365 -7.483 -2.387 -5.977 1.00 0.00 C ATOM 1312 O GLN A 365 -8.083 -3.040 -5.125 1.00 0.00 O ATOM 1313 CB GLN A 365 -8.512 -1.914 -8.208 1.00 0.00 C ATOM 1314 CG GLN A 365 -9.305 -0.968 -9.095 1.00 0.00 C ATOM 1315 CD GLN A 365 -10.191 -1.700 -10.084 1.00 0.00 C ATOM 1316 OE1 GLN A 365 -9.980 -2.879 -10.368 1.00 0.00 O ATOM 1317 NE2 GLN A 365 -11.187 -1.002 -10.615 1.00 0.00 N ATOM 0 H GLN A 365 -7.368 0.256 -7.879 1.00 0.00 H new ATOM 0 HA GLN A 365 -9.150 -1.097 -6.325 1.00 0.00 H new ATOM 0 HB2 GLN A 365 -7.572 -2.160 -8.702 1.00 0.00 H new ATOM 0 HB3 GLN A 365 -9.067 -2.846 -8.097 1.00 0.00 H new ATOM 0 HG2 GLN A 365 -9.921 -0.321 -8.470 1.00 0.00 H new ATOM 0 HG3 GLN A 365 -8.616 -0.323 -9.639 1.00 0.00 H new ATOM 0 HE21 GLN A 365 -11.324 -0.027 -10.350 1.00 0.00 H new ATOM 0 HE22 GLN A 365 -11.815 -1.441 -11.288 1.00 0.00 H new ATOM 1326 N ALA A 366 -6.185 -2.538 -6.224 1.00 0.00 N ATOM 1327 CA ALA A 366 -5.374 -3.499 -5.487 1.00 0.00 C ATOM 1328 C ALA A 366 -5.298 -3.133 -4.009 1.00 0.00 C ATOM 1329 O ALA A 366 -5.354 -4.004 -3.139 1.00 0.00 O ATOM 1330 CB ALA A 366 -3.978 -3.580 -6.085 1.00 0.00 C ATOM 0 H ALA A 366 -5.673 -2.007 -6.929 1.00 0.00 H new ATOM 0 HA ALA A 366 -5.849 -4.477 -5.569 1.00 0.00 H new ATOM 0 HB1 ALA A 366 -3.383 -4.301 -5.525 1.00 0.00 H new ATOM 0 HB2 ALA A 366 -4.046 -3.896 -7.126 1.00 0.00 H new ATOM 0 HB3 ALA A 366 -3.503 -2.600 -6.034 1.00 0.00 H new ATOM 1336 N LEU A 367 -5.169 -1.841 -3.729 1.00 0.00 N ATOM 1337 CA LEU A 367 -5.084 -1.360 -2.355 1.00 0.00 C ATOM 1338 C LEU A 367 -6.374 -1.652 -1.595 1.00 0.00 C ATOM 1339 O LEU A 367 -6.350 -2.231 -0.508 1.00 0.00 O ATOM 1340 CB LEU A 367 -4.797 0.143 -2.336 1.00 0.00 C ATOM 1341 CG LEU A 367 -4.722 0.795 -0.956 1.00 0.00 C ATOM 1342 CD1 LEU A 367 -3.970 2.115 -1.028 1.00 0.00 C ATOM 1343 CD2 LEU A 367 -6.119 1.006 -0.388 1.00 0.00 C ATOM 0 H LEU A 367 -5.121 -1.107 -4.436 1.00 0.00 H new ATOM 0 HA LEU A 367 -4.266 -1.886 -1.862 1.00 0.00 H new ATOM 0 HB2 LEU A 367 -3.852 0.319 -2.850 1.00 0.00 H new ATOM 0 HB3 LEU A 367 -5.572 0.648 -2.912 1.00 0.00 H new ATOM 0 HG LEU A 367 -4.177 0.126 -0.290 1.00 0.00 H new ATOM 0 HD11 LEU A 367 -3.927 2.564 -0.036 1.00 0.00 H new ATOM 0 HD12 LEU A 367 -2.957 1.938 -1.390 1.00 0.00 H new ATOM 0 HD13 LEU A 367 -4.486 2.791 -1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 367 -6.046 1.471 0.595 1.00 0.00 H new ATOM 0 HD22 LEU A 367 -6.689 1.654 -1.054 1.00 0.00 H new ATOM 0 HD23 LEU A 367 -6.624 0.044 -0.297 1.00 0.00 H new ATOM 1355 N HIS A 368 -7.501 -1.250 -2.175 1.00 0.00 N ATOM 1356 CA HIS A 368 -8.802 -1.471 -1.554 1.00 0.00 C ATOM 1357 C HIS A 368 -9.089 -2.963 -1.410 1.00 0.00 C ATOM 1358 O HIS A 368 -9.732 -3.393 -0.452 1.00 0.00 O ATOM 1359 CB HIS A 368 -9.904 -0.805 -2.377 1.00 0.00 C ATOM 1360 CG HIS A 368 -11.225 -0.745 -1.673 1.00 0.00 C ATOM 1361 ND1 HIS A 368 -11.722 0.407 -1.103 1.00 0.00 N ATOM 1362 CD2 HIS A 368 -12.153 -1.704 -1.452 1.00 0.00 C ATOM 1363 CE1 HIS A 368 -12.899 0.153 -0.558 1.00 0.00 C ATOM 1364 NE2 HIS A 368 -13.184 -1.121 -0.756 1.00 0.00 N ATOM 0 H HIS A 368 -7.539 -0.770 -3.074 1.00 0.00 H new ATOM 0 HA HIS A 368 -8.782 -1.025 -0.560 1.00 0.00 H new ATOM 0 HB2 HIS A 368 -9.592 0.207 -2.634 1.00 0.00 H new ATOM 0 HB3 HIS A 368 -10.025 -1.349 -3.314 1.00 0.00 H new ATOM 0 HD2 HIS A 368 -12.094 -2.736 -1.765 1.00 0.00 H new ATOM 0 HE1 HIS A 368 -13.522 0.866 -0.039 1.00 0.00 H new ATOM 0 HE2 HIS A 368 -14.031 -1.595 -0.443 1.00 0.00 H new ATOM 1372 N LEU A 369 -8.608 -3.747 -2.370 1.00 0.00 N ATOM 1373 CA LEU A 369 -8.814 -5.191 -2.351 1.00 0.00 C ATOM 1374 C LEU A 369 -7.966 -5.849 -1.268 1.00 0.00 C ATOM 1375 O LEU A 369 -8.430 -6.740 -0.557 1.00 0.00 O ATOM 1376 CB LEU A 369 -8.474 -5.792 -3.717 1.00 0.00 C ATOM 1377 CG LEU A 369 -9.526 -5.610 -4.811 1.00 0.00 C ATOM 1378 CD1 LEU A 369 -8.904 -5.800 -6.186 1.00 0.00 C ATOM 1379 CD2 LEU A 369 -10.681 -6.579 -4.608 1.00 0.00 C ATOM 0 H LEU A 369 -8.074 -3.407 -3.170 1.00 0.00 H new ATOM 0 HA LEU A 369 -9.864 -5.380 -2.128 1.00 0.00 H new ATOM 0 HB2 LEU A 369 -7.539 -5.351 -4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 369 -8.294 -6.859 -3.587 1.00 0.00 H new ATOM 0 HG LEU A 369 -9.916 -4.594 -4.748 1.00 0.00 H new ATOM 0 HD11 LEU A 369 -9.668 -5.667 -6.952 1.00 0.00 H new ATOM 0 HD12 LEU A 369 -8.112 -5.066 -6.332 1.00 0.00 H new ATOM 0 HD13 LEU A 369 -8.486 -6.804 -6.261 1.00 0.00 H new ATOM 0 HD21 LEU A 369 -11.420 -6.435 -5.396 1.00 0.00 H new ATOM 0 HD22 LEU A 369 -10.308 -7.602 -4.644 1.00 0.00 H new ATOM 0 HD23 LEU A 369 -11.144 -6.395 -3.639 1.00 0.00 H new ATOM 1391 N VAL A 370 -6.720 -5.401 -1.147 1.00 0.00 N ATOM 1392 CA VAL A 370 -5.807 -5.943 -0.148 1.00 0.00 C ATOM 1393 C VAL A 370 -5.614 -4.967 1.008 1.00 0.00 C ATOM 1394 O VAL A 370 -4.545 -4.912 1.615 1.00 0.00 O ATOM 1395 CB VAL A 370 -4.433 -6.272 -0.762 1.00 0.00 C ATOM 1396 CG1 VAL A 370 -3.600 -7.101 0.204 1.00 0.00 C ATOM 1397 CG2 VAL A 370 -4.603 -6.996 -2.089 1.00 0.00 C ATOM 0 H VAL A 370 -6.320 -4.664 -1.728 1.00 0.00 H new ATOM 0 HA VAL A 370 -6.258 -6.862 0.227 1.00 0.00 H new ATOM 0 HB VAL A 370 -3.905 -5.337 -0.949 1.00 0.00 H new ATOM 0 HG11 VAL A 370 -2.633 -7.323 -0.248 1.00 0.00 H new ATOM 0 HG12 VAL A 370 -3.449 -6.541 1.127 1.00 0.00 H new ATOM 0 HG13 VAL A 370 -4.120 -8.033 0.425 1.00 0.00 H new ATOM 0 HG21 VAL A 370 -3.623 -7.221 -2.509 1.00 0.00 H new ATOM 0 HG22 VAL A 370 -5.151 -7.925 -1.929 1.00 0.00 H new ATOM 0 HG23 VAL A 370 -5.157 -6.362 -2.781 1.00 0.00 H new ATOM 1407 N ASN A 371 -6.655 -4.198 1.306 1.00 0.00 N ATOM 1408 CA ASN A 371 -6.601 -3.223 2.390 1.00 0.00 C ATOM 1409 C ASN A 371 -6.704 -3.912 3.746 1.00 0.00 C ATOM 1410 O ASN A 371 -7.620 -4.696 3.989 1.00 0.00 O ATOM 1411 CB ASN A 371 -7.728 -2.199 2.239 1.00 0.00 C ATOM 1412 CG ASN A 371 -8.995 -2.623 2.955 1.00 0.00 C ATOM 1413 OD1 ASN A 371 -9.084 -2.302 4.241 1.00 0.00 O flip ATOM 1414 ND2 ASN A 371 -9.884 -3.231 2.359 1.00 0.00 N flip ATOM 0 H ASN A 371 -7.547 -4.230 0.812 1.00 0.00 H new ATOM 0 HA ASN A 371 -5.642 -2.709 2.335 1.00 0.00 H new ATOM 0 HB2 ASN A 371 -7.397 -1.238 2.632 1.00 0.00 H new ATOM 0 HB3 ASN A 371 -7.944 -2.054 1.180 1.00 0.00 H new ATOM 0 HD21 ASN A 371 -9.773 -3.457 1.370 1.00 0.00 H new ATOM 0 HD22 ASN A 371 -10.732 -3.509 2.854 1.00 0.00 H new ATOM 1421 N GLY A 372 -5.756 -3.612 4.630 1.00 0.00 N ATOM 1422 CA GLY A 372 -5.758 -4.210 5.952 1.00 0.00 C ATOM 1423 C GLY A 372 -5.693 -5.723 5.904 1.00 0.00 C ATOM 1424 O GLY A 372 -6.431 -6.406 6.615 1.00 0.00 O ATOM 0 H GLY A 372 -4.987 -2.965 4.453 1.00 0.00 H new ATOM 0 HA2 GLY A 372 -4.909 -3.831 6.520 1.00 0.00 H new ATOM 0 HA3 GLY A 372 -6.659 -3.905 6.484 1.00 0.00 H new ATOM 1428 N TYR A 373 -4.811 -6.250 5.062 1.00 0.00 N ATOM 1429 CA TYR A 373 -4.655 -7.693 4.921 1.00 0.00 C ATOM 1430 C TYR A 373 -3.722 -8.248 5.992 1.00 0.00 C ATOM 1431 O TYR A 373 -2.525 -7.954 6.003 1.00 0.00 O ATOM 1432 CB TYR A 373 -4.116 -8.035 3.531 1.00 0.00 C ATOM 1433 CG TYR A 373 -3.978 -9.520 3.285 1.00 0.00 C ATOM 1434 CD1 TYR A 373 -5.093 -10.350 3.274 1.00 0.00 C ATOM 1435 CD2 TYR A 373 -2.732 -10.094 3.060 1.00 0.00 C ATOM 1436 CE1 TYR A 373 -4.971 -11.707 3.050 1.00 0.00 C ATOM 1437 CE2 TYR A 373 -2.601 -11.451 2.834 1.00 0.00 C ATOM 1438 CZ TYR A 373 -3.723 -12.253 2.830 1.00 0.00 C ATOM 1439 OH TYR A 373 -3.598 -13.605 2.605 1.00 0.00 O ATOM 0 H TYR A 373 -4.193 -5.699 4.466 1.00 0.00 H new ATOM 0 HA TYR A 373 -5.635 -8.153 5.047 1.00 0.00 H new ATOM 0 HB2 TYR A 373 -4.780 -7.610 2.778 1.00 0.00 H new ATOM 0 HB3 TYR A 373 -3.143 -7.561 3.401 1.00 0.00 H new ATOM 0 HD1 TYR A 373 -6.072 -9.926 3.444 1.00 0.00 H new ATOM 0 HD2 TYR A 373 -1.851 -9.469 3.062 1.00 0.00 H new ATOM 0 HE1 TYR A 373 -5.848 -12.338 3.047 1.00 0.00 H new ATOM 0 HE2 TYR A 373 -1.625 -11.881 2.661 1.00 0.00 H new ATOM 0 HH TYR A 373 -2.654 -13.828 2.467 1.00 0.00 H new ATOM 1449 N LYS A 374 -4.276 -9.053 6.892 1.00 0.00 N ATOM 1450 CA LYS A 374 -3.496 -9.652 7.968 1.00 0.00 C ATOM 1451 C LYS A 374 -2.474 -10.641 7.413 1.00 0.00 C ATOM 1452 O LYS A 374 -2.823 -11.755 7.020 1.00 0.00 O ATOM 1453 CB LYS A 374 -4.418 -10.361 8.962 1.00 0.00 C ATOM 1454 CG LYS A 374 -3.842 -10.456 10.364 1.00 0.00 C ATOM 1455 CD LYS A 374 -4.862 -11.001 11.350 1.00 0.00 C ATOM 1456 CE LYS A 374 -4.638 -10.446 12.748 1.00 0.00 C ATOM 1457 NZ LYS A 374 -5.479 -11.141 13.762 1.00 0.00 N ATOM 0 H LYS A 374 -5.264 -9.306 6.897 1.00 0.00 H new ATOM 0 HA LYS A 374 -2.962 -8.854 8.483 1.00 0.00 H new ATOM 0 HB2 LYS A 374 -5.369 -9.831 9.004 1.00 0.00 H new ATOM 0 HB3 LYS A 374 -4.629 -11.366 8.596 1.00 0.00 H new ATOM 0 HG2 LYS A 374 -2.963 -11.101 10.354 1.00 0.00 H new ATOM 0 HG3 LYS A 374 -3.510 -9.470 10.690 1.00 0.00 H new ATOM 0 HD2 LYS A 374 -5.867 -10.747 11.013 1.00 0.00 H new ATOM 0 HD3 LYS A 374 -4.800 -12.089 11.375 1.00 0.00 H new ATOM 0 HE2 LYS A 374 -3.586 -10.550 13.016 1.00 0.00 H new ATOM 0 HE3 LYS A 374 -4.866 -9.380 12.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 -5.297 -10.734 14.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 -6.484 -11.021 13.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 -5.244 -12.154 13.772 1.00 0.00 H new ATOM 1471 N LEU A 375 -1.212 -10.226 7.385 1.00 0.00 N ATOM 1472 CA LEU A 375 -0.139 -11.076 6.880 1.00 0.00 C ATOM 1473 C LEU A 375 0.890 -11.360 7.969 1.00 0.00 C ATOM 1474 O LEU A 375 1.292 -10.459 8.707 1.00 0.00 O ATOM 1475 CB LEU A 375 0.541 -10.414 5.681 1.00 0.00 C ATOM 1476 CG LEU A 375 1.392 -11.330 4.801 1.00 0.00 C ATOM 1477 CD1 LEU A 375 0.512 -12.136 3.860 1.00 0.00 C ATOM 1478 CD2 LEU A 375 2.412 -10.518 4.016 1.00 0.00 C ATOM 0 H LEU A 375 -0.907 -9.307 7.706 1.00 0.00 H new ATOM 0 HA LEU A 375 -0.578 -12.023 6.565 1.00 0.00 H new ATOM 0 HB2 LEU A 375 -0.229 -9.958 5.058 1.00 0.00 H new ATOM 0 HB3 LEU A 375 1.174 -9.606 6.048 1.00 0.00 H new ATOM 0 HG LEU A 375 1.929 -12.025 5.447 1.00 0.00 H new ATOM 0 HD11 LEU A 375 1.136 -12.782 3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 375 -0.178 -12.747 4.441 1.00 0.00 H new ATOM 0 HD13 LEU A 375 -0.054 -11.458 3.221 1.00 0.00 H new ATOM 0 HD21 LEU A 375 3.009 -11.186 3.395 1.00 0.00 H new ATOM 0 HD22 LEU A 375 1.894 -9.799 3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 375 3.065 -9.986 4.709 1.00 0.00 H new ATOM 1490 N TYR A 376 1.312 -12.616 8.064 1.00 0.00 N ATOM 1491 CA TYR A 376 2.294 -13.018 9.064 1.00 0.00 C ATOM 1492 C TYR A 376 1.995 -12.371 10.412 1.00 0.00 C ATOM 1493 O TYR A 376 2.873 -11.776 11.036 1.00 0.00 O ATOM 1494 CB TYR A 376 3.704 -12.640 8.606 1.00 0.00 C ATOM 1495 CG TYR A 376 4.270 -13.571 7.557 1.00 0.00 C ATOM 1496 CD1 TYR A 376 4.808 -14.802 7.910 1.00 0.00 C ATOM 1497 CD2 TYR A 376 4.264 -13.219 6.212 1.00 0.00 C ATOM 1498 CE1 TYR A 376 5.328 -15.655 6.954 1.00 0.00 C ATOM 1499 CE2 TYR A 376 4.779 -14.066 5.250 1.00 0.00 C ATOM 1500 CZ TYR A 376 5.310 -15.282 5.626 1.00 0.00 C ATOM 1501 OH TYR A 376 5.824 -16.130 4.671 1.00 0.00 O ATOM 0 H TYR A 376 0.990 -13.373 7.461 1.00 0.00 H new ATOM 0 HA TYR A 376 2.235 -14.100 9.180 1.00 0.00 H new ATOM 0 HB2 TYR A 376 3.688 -11.625 8.208 1.00 0.00 H new ATOM 0 HB3 TYR A 376 4.368 -12.633 9.470 1.00 0.00 H new ATOM 0 HD1 TYR A 376 4.820 -15.098 8.949 1.00 0.00 H new ATOM 0 HD2 TYR A 376 3.850 -12.267 5.914 1.00 0.00 H new ATOM 0 HE1 TYR A 376 5.746 -16.607 7.245 1.00 0.00 H new ATOM 0 HE2 TYR A 376 4.766 -13.778 4.209 1.00 0.00 H new ATOM 0 HH TYR A 376 5.734 -15.719 3.786 1.00 0.00 H new ATOM 1511 N GLY A 377 0.748 -12.494 10.857 1.00 0.00 N ATOM 1512 CA GLY A 377 0.354 -11.917 12.129 1.00 0.00 C ATOM 1513 C GLY A 377 0.683 -10.440 12.223 1.00 0.00 C ATOM 1514 O GLY A 377 1.143 -9.964 13.262 1.00 0.00 O ATOM 0 H GLY A 377 0.004 -12.983 10.359 1.00 0.00 H new ATOM 0 HA2 GLY A 377 -0.718 -12.057 12.272 1.00 0.00 H new ATOM 0 HA3 GLY A 377 0.855 -12.450 12.937 1.00 0.00 H new ATOM 1518 N LYS A 378 0.451 -9.714 11.135 1.00 0.00 N ATOM 1519 CA LYS A 378 0.726 -8.282 11.099 1.00 0.00 C ATOM 1520 C LYS A 378 -0.120 -7.593 10.032 1.00 0.00 C ATOM 1521 O LYS A 378 0.097 -7.784 8.836 1.00 0.00 O ATOM 1522 CB LYS A 378 2.211 -8.034 10.825 1.00 0.00 C ATOM 1523 CG LYS A 378 3.122 -8.502 11.947 1.00 0.00 C ATOM 1524 CD LYS A 378 4.423 -7.716 11.973 1.00 0.00 C ATOM 1525 CE LYS A 378 5.500 -8.447 12.760 1.00 0.00 C ATOM 1526 NZ LYS A 378 5.337 -8.263 14.228 1.00 0.00 N ATOM 0 H LYS A 378 0.073 -10.093 10.267 1.00 0.00 H new ATOM 0 HA LYS A 378 0.467 -7.863 12.071 1.00 0.00 H new ATOM 0 HB2 LYS A 378 2.492 -8.544 9.903 1.00 0.00 H new ATOM 0 HB3 LYS A 378 2.369 -6.968 10.661 1.00 0.00 H new ATOM 0 HG2 LYS A 378 2.610 -8.392 12.903 1.00 0.00 H new ATOM 0 HG3 LYS A 378 3.339 -9.563 11.822 1.00 0.00 H new ATOM 0 HD2 LYS A 378 4.768 -7.547 10.953 1.00 0.00 H new ATOM 0 HD3 LYS A 378 4.248 -6.736 12.417 1.00 0.00 H new ATOM 0 HE2 LYS A 378 5.465 -9.510 12.521 1.00 0.00 H new ATOM 0 HE3 LYS A 378 6.482 -8.084 12.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 378 6.090 -8.777 14.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 378 5.396 -7.251 14.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 378 4.411 -8.633 14.524 1.00 0.00 H new ATOM 1540 N ILE A 379 -1.082 -6.792 10.474 1.00 0.00 N ATOM 1541 CA ILE A 379 -1.959 -6.073 9.558 1.00 0.00 C ATOM 1542 C ILE A 379 -1.152 -5.304 8.515 1.00 0.00 C ATOM 1543 O ILE A 379 -0.367 -4.417 8.852 1.00 0.00 O ATOM 1544 CB ILE A 379 -2.875 -5.089 10.308 1.00 0.00 C ATOM 1545 CG1 ILE A 379 -3.710 -5.831 11.352 1.00 0.00 C ATOM 1546 CG2 ILE A 379 -3.774 -4.350 9.330 1.00 0.00 C ATOM 1547 CD1 ILE A 379 -4.734 -6.769 10.751 1.00 0.00 C ATOM 0 H ILE A 379 -1.275 -6.624 11.461 1.00 0.00 H new ATOM 0 HA ILE A 379 -2.575 -6.821 9.060 1.00 0.00 H new ATOM 0 HB ILE A 379 -2.252 -4.356 10.822 1.00 0.00 H new ATOM 0 HG12 ILE A 379 -3.044 -6.400 12.000 1.00 0.00 H new ATOM 0 HG13 ILE A 379 -4.221 -5.102 11.981 1.00 0.00 H new ATOM 0 HG21 ILE A 379 -4.415 -3.658 9.876 1.00 0.00 H new ATOM 0 HG22 ILE A 379 -3.161 -3.793 8.621 1.00 0.00 H new ATOM 0 HG23 ILE A 379 -4.392 -5.068 8.790 1.00 0.00 H new ATOM 0 HD11 ILE A 379 -5.289 -7.261 11.549 1.00 0.00 H new ATOM 0 HD12 ILE A 379 -5.423 -6.202 10.125 1.00 0.00 H new ATOM 0 HD13 ILE A 379 -4.228 -7.520 10.145 1.00 0.00 H new ATOM 1559 N LEU A 380 -1.352 -5.651 7.248 1.00 0.00 N ATOM 1560 CA LEU A 380 -0.644 -4.992 6.155 1.00 0.00 C ATOM 1561 C LEU A 380 -1.255 -3.628 5.854 1.00 0.00 C ATOM 1562 O LEU A 380 -2.404 -3.532 5.421 1.00 0.00 O ATOM 1563 CB LEU A 380 -0.678 -5.866 4.900 1.00 0.00 C ATOM 1564 CG LEU A 380 0.217 -5.418 3.745 1.00 0.00 C ATOM 1565 CD1 LEU A 380 0.473 -6.572 2.788 1.00 0.00 C ATOM 1566 CD2 LEU A 380 -0.409 -4.242 3.010 1.00 0.00 C ATOM 0 H LEU A 380 -1.997 -6.383 6.952 1.00 0.00 H new ATOM 0 HA LEU A 380 0.392 -4.846 6.462 1.00 0.00 H new ATOM 0 HB2 LEU A 380 -0.394 -6.880 5.180 1.00 0.00 H new ATOM 0 HB3 LEU A 380 -1.706 -5.910 4.540 1.00 0.00 H new ATOM 0 HG LEU A 380 1.174 -5.096 4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 380 1.112 -6.233 1.972 1.00 0.00 H new ATOM 0 HD12 LEU A 380 0.966 -7.385 3.322 1.00 0.00 H new ATOM 0 HD13 LEU A 380 -0.475 -6.926 2.383 1.00 0.00 H new ATOM 0 HD21 LEU A 380 0.242 -3.937 2.191 1.00 0.00 H new ATOM 0 HD22 LEU A 380 -1.380 -4.537 2.611 1.00 0.00 H new ATOM 0 HD23 LEU A 380 -0.539 -3.409 3.701 1.00 0.00 H new ATOM 1578 N VAL A 381 -0.479 -2.574 6.086 1.00 0.00 N ATOM 1579 CA VAL A 381 -0.942 -1.214 5.837 1.00 0.00 C ATOM 1580 C VAL A 381 -0.520 -0.734 4.453 1.00 0.00 C ATOM 1581 O VAL A 381 0.670 -0.652 4.150 1.00 0.00 O ATOM 1582 CB VAL A 381 -0.401 -0.234 6.895 1.00 0.00 C ATOM 1583 CG1 VAL A 381 -0.967 1.160 6.670 1.00 0.00 C ATOM 1584 CG2 VAL A 381 -0.726 -0.730 8.296 1.00 0.00 C ATOM 0 H VAL A 381 0.473 -2.636 6.446 1.00 0.00 H new ATOM 0 HA VAL A 381 -2.030 -1.235 5.895 1.00 0.00 H new ATOM 0 HB VAL A 381 0.683 -0.181 6.795 1.00 0.00 H new ATOM 0 HG11 VAL A 381 -0.574 1.839 7.427 1.00 0.00 H new ATOM 0 HG12 VAL A 381 -0.679 1.514 5.680 1.00 0.00 H new ATOM 0 HG13 VAL A 381 -2.054 1.127 6.742 1.00 0.00 H new ATOM 0 HG21 VAL A 381 -0.336 -0.026 9.031 1.00 0.00 H new ATOM 0 HG22 VAL A 381 -1.807 -0.814 8.411 1.00 0.00 H new ATOM 0 HG23 VAL A 381 -0.268 -1.707 8.452 1.00 0.00 H new ATOM 1594 N ILE A 382 -1.504 -0.418 3.616 1.00 0.00 N ATOM 1595 CA ILE A 382 -1.233 0.055 2.265 1.00 0.00 C ATOM 1596 C ILE A 382 -1.526 1.545 2.136 1.00 0.00 C ATOM 1597 O ILE A 382 -2.613 2.007 2.485 1.00 0.00 O ATOM 1598 CB ILE A 382 -2.068 -0.713 1.223 1.00 0.00 C ATOM 1599 CG1 ILE A 382 -1.939 -2.221 1.445 1.00 0.00 C ATOM 1600 CG2 ILE A 382 -1.628 -0.341 -0.186 1.00 0.00 C ATOM 1601 CD1 ILE A 382 -2.880 -3.040 0.589 1.00 0.00 C ATOM 0 H ILE A 382 -2.495 -0.481 3.850 1.00 0.00 H new ATOM 0 HA ILE A 382 -0.175 -0.123 2.074 1.00 0.00 H new ATOM 0 HB ILE A 382 -3.115 -0.435 1.342 1.00 0.00 H new ATOM 0 HG12 ILE A 382 -0.913 -2.525 1.236 1.00 0.00 H new ATOM 0 HG13 ILE A 382 -2.129 -2.443 2.495 1.00 0.00 H new ATOM 0 HG21 ILE A 382 -2.227 -0.892 -0.911 1.00 0.00 H new ATOM 0 HG22 ILE A 382 -1.766 0.729 -0.339 1.00 0.00 H new ATOM 0 HG23 ILE A 382 -0.576 -0.594 -0.317 1.00 0.00 H new ATOM 0 HD11 ILE A 382 -2.734 -4.100 0.799 1.00 0.00 H new ATOM 0 HD12 ILE A 382 -3.910 -2.764 0.815 1.00 0.00 H new ATOM 0 HD13 ILE A 382 -2.675 -2.847 -0.464 1.00 0.00 H new ATOM 1613 N GLU A 383 -0.550 2.294 1.630 1.00 0.00 N ATOM 1614 CA GLU A 383 -0.705 3.733 1.453 1.00 0.00 C ATOM 1615 C GLU A 383 -0.096 4.187 0.130 1.00 0.00 C ATOM 1616 O GLU A 383 1.044 3.848 -0.191 1.00 0.00 O ATOM 1617 CB GLU A 383 -0.050 4.484 2.614 1.00 0.00 C ATOM 1618 CG GLU A 383 -0.875 4.474 3.889 1.00 0.00 C ATOM 1619 CD GLU A 383 -1.966 5.527 3.887 1.00 0.00 C ATOM 1620 OE1 GLU A 383 -3.073 5.233 3.387 1.00 0.00 O ATOM 1621 OE2 GLU A 383 -1.714 6.644 4.385 1.00 0.00 O ATOM 0 H GLU A 383 0.355 1.928 1.336 1.00 0.00 H new ATOM 0 HA GLU A 383 -1.771 3.960 1.438 1.00 0.00 H new ATOM 0 HB2 GLU A 383 0.924 4.041 2.819 1.00 0.00 H new ATOM 0 HB3 GLU A 383 0.127 5.517 2.314 1.00 0.00 H new ATOM 0 HG2 GLU A 383 -1.326 3.490 4.018 1.00 0.00 H new ATOM 0 HG3 GLU A 383 -0.218 4.638 4.743 1.00 0.00 H new ATOM 1628 N PHE A 384 -0.864 4.956 -0.635 1.00 0.00 N ATOM 1629 CA PHE A 384 -0.401 5.456 -1.924 1.00 0.00 C ATOM 1630 C PHE A 384 0.881 6.267 -1.765 1.00 0.00 C ATOM 1631 O PHE A 384 0.978 7.132 -0.895 1.00 0.00 O ATOM 1632 CB PHE A 384 -1.484 6.316 -2.580 1.00 0.00 C ATOM 1633 CG PHE A 384 -2.726 5.549 -2.935 1.00 0.00 C ATOM 1634 CD1 PHE A 384 -2.643 4.354 -3.631 1.00 0.00 C ATOM 1635 CD2 PHE A 384 -3.977 6.023 -2.571 1.00 0.00 C ATOM 1636 CE1 PHE A 384 -3.784 3.646 -3.960 1.00 0.00 C ATOM 1637 CE2 PHE A 384 -5.121 5.319 -2.897 1.00 0.00 C ATOM 1638 CZ PHE A 384 -5.024 4.129 -3.591 1.00 0.00 C ATOM 0 H PHE A 384 -1.809 5.246 -0.385 1.00 0.00 H new ATOM 0 HA PHE A 384 -0.190 4.599 -2.563 1.00 0.00 H new ATOM 0 HB2 PHE A 384 -1.750 7.129 -1.904 1.00 0.00 H new ATOM 0 HB3 PHE A 384 -1.077 6.772 -3.483 1.00 0.00 H new ATOM 0 HD1 PHE A 384 -1.675 3.971 -3.920 1.00 0.00 H new ATOM 0 HD2 PHE A 384 -4.059 6.952 -2.027 1.00 0.00 H new ATOM 0 HE1 PHE A 384 -3.706 2.717 -4.505 1.00 0.00 H new ATOM 0 HE2 PHE A 384 -6.090 5.699 -2.609 1.00 0.00 H new ATOM 0 HZ PHE A 384 -5.917 3.577 -3.845 1.00 0.00 H new ATOM 1648 N GLY A 385 1.865 5.981 -2.612 1.00 0.00 N ATOM 1649 CA GLY A 385 3.129 6.691 -2.549 1.00 0.00 C ATOM 1650 C GLY A 385 2.947 8.177 -2.315 1.00 0.00 C ATOM 1651 O GLY A 385 2.511 8.905 -3.207 1.00 0.00 O ATOM 0 H GLY A 385 1.809 5.270 -3.341 1.00 0.00 H new ATOM 0 HA2 GLY A 385 3.738 6.272 -1.748 1.00 0.00 H new ATOM 0 HA3 GLY A 385 3.676 6.537 -3.479 1.00 0.00 H new