USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 816 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 22 TYR OH : rot 30:sc= 0.034 USER MOD Set 1.2: A 72 LYS NZ :NH3+ -112:sc= -2.32! (180deg=-3.12!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 TYR OH : rot 90:sc= -1.05 USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 138:sc= 0.197 USER MOD Single : A 44 HIS : no HD1:sc= -5.12! C(o=-5.1!,f=-5.1!) USER MOD Single : A 47 CYS SG : rot 163:sc= 0.27 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.439 X(o=-0.44,f=-0.079) USER MOD Single : A 58 MET CE :methyl -110:sc= -2.45! (180deg=-2.54) USER MOD Single : A 59 THR OG1 : rot -119:sc= -3.37! USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= -1.77 USER MOD Single : A 71 ASN : amide:sc= -4.25! C(o=-4.2!,f=-10!) USER MOD Single : A 73 GLN : amide:sc= -0.136 K(o=-0.14,f=-2.3!) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.804! X(o=-0.8!,f=-0.97) USER MOD Single : A 83 SER OG : rot 180:sc= -0.246 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.244 K(o=-0.24,f=-2.1!) USER MOD Single : A 95 ASN : amide:sc= -3.99! C(o=-4!,f=-6!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.253 X(o=-0.25,f=0.16) USER MOD Single : A 105 THR OG1 : rot 170:sc= -0.352 USER MOD Single : A 106 LYS NZ :NH3+ 138:sc= 0.898 (180deg=-0.322) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 170:sc= -0.0103 (180deg=-0.17) USER MOD Single : A 120 SER OG : rot -91:sc= 0.0217 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot -142:sc= 0.246 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 251 N PRO A 18 10.349 -25.489 -10.264 1.00 0.00 N ATOM 252 CA PRO A 18 11.045 -24.229 -9.990 1.00 0.00 C ATOM 253 C PRO A 18 10.226 -23.293 -9.108 1.00 0.00 C ATOM 254 O PRO A 18 9.589 -22.360 -9.598 1.00 0.00 O ATOM 255 CB PRO A 18 11.236 -23.620 -11.382 1.00 0.00 C ATOM 256 CG PRO A 18 10.143 -24.209 -12.206 1.00 0.00 C ATOM 257 CD PRO A 18 9.920 -25.595 -11.668 1.00 0.00 C ATOM 0 HA PRO A 18 11.976 -24.388 -9.447 1.00 0.00 H new ATOM 0 HB2 PRO A 18 11.167 -22.533 -11.351 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.216 -23.866 -11.791 1.00 0.00 H new ATOM 0 HG2 PRO A 18 9.234 -23.611 -12.134 1.00 0.00 H new ATOM 0 HG3 PRO A 18 10.421 -24.239 -13.259 1.00 0.00 H new ATOM 0 HD2 PRO A 18 8.875 -25.893 -11.747 1.00 0.00 H new ATOM 0 HD3 PRO A 18 10.505 -26.336 -12.212 1.00 0.00 H new ATOM 265 N LEU A 19 10.246 -23.549 -7.805 1.00 0.00 N ATOM 266 CA LEU A 19 9.504 -22.728 -6.853 1.00 0.00 C ATOM 267 C LEU A 19 9.735 -21.244 -7.118 1.00 0.00 C ATOM 268 O LEU A 19 8.792 -20.454 -7.140 1.00 0.00 O ATOM 269 CB LEU A 19 9.919 -23.073 -5.421 1.00 0.00 C ATOM 270 CG LEU A 19 9.341 -24.367 -4.848 1.00 0.00 C ATOM 271 CD1 LEU A 19 10.359 -25.057 -3.954 1.00 0.00 C ATOM 272 CD2 LEU A 19 8.059 -24.084 -4.079 1.00 0.00 C ATOM 0 H LEU A 19 10.767 -24.318 -7.383 1.00 0.00 H new ATOM 0 HA LEU A 19 8.442 -22.939 -6.978 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.007 -23.137 -5.385 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.626 -22.249 -4.771 1.00 0.00 H new ATOM 0 HG LEU A 19 9.104 -25.034 -5.677 1.00 0.00 H new ATOM 0 HD11 LEU A 19 9.929 -25.976 -3.555 1.00 0.00 H new ATOM 0 HD12 LEU A 19 11.251 -25.295 -4.534 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.628 -24.395 -3.131 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.662 -25.017 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.271 -23.398 -3.259 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.325 -23.635 -4.748 1.00 0.00 H new ATOM 284 N GLU A 20 10.995 -20.873 -7.321 1.00 0.00 N ATOM 285 CA GLU A 20 11.349 -19.483 -7.586 1.00 0.00 C ATOM 286 C GLU A 20 10.565 -18.941 -8.778 1.00 0.00 C ATOM 287 O GLU A 20 10.102 -17.800 -8.764 1.00 0.00 O ATOM 288 CB GLU A 20 12.851 -19.357 -7.849 1.00 0.00 C ATOM 289 CG GLU A 20 13.479 -18.130 -7.211 1.00 0.00 C ATOM 290 CD GLU A 20 13.979 -18.395 -5.804 1.00 0.00 C ATOM 291 OE1 GLU A 20 14.720 -19.381 -5.613 1.00 0.00 O ATOM 292 OE2 GLU A 20 13.628 -17.614 -4.894 1.00 0.00 O ATOM 0 H GLU A 20 11.788 -21.515 -7.307 1.00 0.00 H new ATOM 0 HA GLU A 20 11.092 -18.894 -6.705 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.353 -20.249 -7.474 1.00 0.00 H new ATOM 0 HB3 GLU A 20 13.022 -19.324 -8.925 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.309 -17.788 -7.829 1.00 0.00 H new ATOM 0 HG3 GLU A 20 12.747 -17.323 -7.186 1.00 0.00 H new ATOM 299 N LYS A 21 10.421 -19.766 -9.809 1.00 0.00 N ATOM 300 CA LYS A 21 9.693 -19.372 -11.009 1.00 0.00 C ATOM 301 C LYS A 21 8.204 -19.218 -10.717 1.00 0.00 C ATOM 302 O LYS A 21 7.531 -18.372 -11.306 1.00 0.00 O ATOM 303 CB LYS A 21 9.902 -20.405 -12.119 1.00 0.00 C ATOM 304 CG LYS A 21 11.343 -20.512 -12.587 1.00 0.00 C ATOM 305 CD LYS A 21 11.759 -19.296 -13.397 1.00 0.00 C ATOM 306 CE LYS A 21 12.655 -18.369 -12.589 1.00 0.00 C ATOM 307 NZ LYS A 21 14.083 -18.483 -12.997 1.00 0.00 N ATOM 0 H LYS A 21 10.799 -20.713 -9.838 1.00 0.00 H new ATOM 0 HA LYS A 21 10.081 -18.409 -11.339 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.571 -21.381 -11.763 1.00 0.00 H new ATOM 0 HB3 LYS A 21 9.271 -20.145 -12.969 1.00 0.00 H new ATOM 0 HG2 LYS A 21 12.000 -20.617 -11.724 1.00 0.00 H new ATOM 0 HG3 LYS A 21 11.464 -21.411 -13.191 1.00 0.00 H new ATOM 0 HD2 LYS A 21 12.284 -19.618 -14.296 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.872 -18.753 -13.723 1.00 0.00 H new ATOM 0 HE2 LYS A 21 12.322 -17.339 -12.717 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.560 -18.605 -11.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 14.661 -17.836 -12.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 14.409 -19.460 -12.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 14.178 -18.233 -14.002 1.00 0.00 H new ATOM 321 N TYR A 22 7.697 -20.040 -9.805 1.00 0.00 N ATOM 322 CA TYR A 22 6.287 -19.995 -9.436 1.00 0.00 C ATOM 323 C TYR A 22 5.950 -18.685 -8.731 1.00 0.00 C ATOM 324 O TYR A 22 4.975 -18.015 -9.073 1.00 0.00 O ATOM 325 CB TYR A 22 5.937 -21.179 -8.532 1.00 0.00 C ATOM 326 CG TYR A 22 4.689 -20.962 -7.707 1.00 0.00 C ATOM 327 CD1 TYR A 22 4.705 -20.134 -6.591 1.00 0.00 C ATOM 328 CD2 TYR A 22 3.494 -21.586 -8.043 1.00 0.00 C ATOM 329 CE1 TYR A 22 3.567 -19.934 -5.834 1.00 0.00 C ATOM 330 CE2 TYR A 22 2.350 -21.390 -7.292 1.00 0.00 C ATOM 331 CZ TYR A 22 2.392 -20.564 -6.189 1.00 0.00 C ATOM 332 OH TYR A 22 1.256 -20.367 -5.438 1.00 0.00 O ATOM 0 H TYR A 22 8.241 -20.745 -9.308 1.00 0.00 H new ATOM 0 HA TYR A 22 5.696 -20.057 -10.350 1.00 0.00 H new ATOM 0 HB2 TYR A 22 5.805 -22.069 -9.148 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.775 -21.375 -7.863 1.00 0.00 H new ATOM 0 HD1 TYR A 22 5.623 -19.638 -6.311 1.00 0.00 H new ATOM 0 HD2 TYR A 22 3.458 -22.235 -8.905 1.00 0.00 H new ATOM 0 HE1 TYR A 22 3.597 -19.288 -4.969 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.429 -21.881 -7.568 1.00 0.00 H new ATOM 0 HH TYR A 22 1.280 -19.473 -5.037 1.00 0.00 H new ATOM 342 N HIS A 23 6.764 -18.325 -7.744 1.00 0.00 N ATOM 343 CA HIS A 23 6.555 -17.094 -6.990 1.00 0.00 C ATOM 344 C HIS A 23 6.805 -15.871 -7.866 1.00 0.00 C ATOM 345 O HIS A 23 6.215 -14.813 -7.653 1.00 0.00 O ATOM 346 CB HIS A 23 7.472 -17.058 -5.767 1.00 0.00 C ATOM 347 CG HIS A 23 6.940 -16.222 -4.644 1.00 0.00 C ATOM 348 ND1 HIS A 23 7.564 -15.077 -4.197 1.00 0.00 N ATOM 349 CD2 HIS A 23 5.835 -16.371 -3.876 1.00 0.00 C ATOM 350 CE1 HIS A 23 6.866 -14.558 -3.202 1.00 0.00 C ATOM 351 NE2 HIS A 23 5.812 -15.324 -2.988 1.00 0.00 N ATOM 0 H HIS A 23 7.575 -18.868 -7.448 1.00 0.00 H new ATOM 0 HA HIS A 23 5.517 -17.073 -6.657 1.00 0.00 H new ATOM 0 HB2 HIS A 23 7.627 -18.076 -5.409 1.00 0.00 H new ATOM 0 HB3 HIS A 23 8.447 -16.673 -6.065 1.00 0.00 H new ATOM 0 HD2 HIS A 23 5.107 -17.166 -3.948 1.00 0.00 H new ATOM 0 HE1 HIS A 23 7.115 -13.660 -2.657 1.00 0.00 H new ATOM 0 HE2 HIS A 23 5.097 -15.164 -2.278 1.00 0.00 H new ATOM 359 N GLU A 24 7.685 -16.024 -8.851 1.00 0.00 N ATOM 360 CA GLU A 24 8.014 -14.931 -9.757 1.00 0.00 C ATOM 361 C GLU A 24 6.837 -14.612 -10.675 1.00 0.00 C ATOM 362 O GLU A 24 6.468 -13.451 -10.847 1.00 0.00 O ATOM 363 CB GLU A 24 9.246 -15.285 -10.593 1.00 0.00 C ATOM 364 CG GLU A 24 10.554 -14.817 -9.978 1.00 0.00 C ATOM 365 CD GLU A 24 11.024 -13.491 -10.544 1.00 0.00 C ATOM 366 OE1 GLU A 24 10.165 -12.639 -10.851 1.00 0.00 O ATOM 367 OE2 GLU A 24 12.252 -13.307 -10.681 1.00 0.00 O ATOM 0 H GLU A 24 8.182 -16.894 -9.041 1.00 0.00 H new ATOM 0 HA GLU A 24 8.233 -14.048 -9.156 1.00 0.00 H new ATOM 0 HB2 GLU A 24 9.284 -16.366 -10.729 1.00 0.00 H new ATOM 0 HB3 GLU A 24 9.142 -14.843 -11.584 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.431 -14.724 -8.899 1.00 0.00 H new ATOM 0 HG3 GLU A 24 11.321 -15.572 -10.147 1.00 0.00 H new ATOM 374 N GLU A 25 6.254 -15.652 -11.263 1.00 0.00 N ATOM 375 CA GLU A 25 5.121 -15.483 -12.164 1.00 0.00 C ATOM 376 C GLU A 25 3.889 -14.999 -11.405 1.00 0.00 C ATOM 377 O GLU A 25 3.307 -13.967 -11.737 1.00 0.00 O ATOM 378 CB GLU A 25 4.808 -16.799 -12.879 1.00 0.00 C ATOM 379 CG GLU A 25 5.949 -17.307 -13.745 1.00 0.00 C ATOM 380 CD GLU A 25 6.202 -16.425 -14.953 1.00 0.00 C ATOM 381 OE1 GLU A 25 5.430 -15.466 -15.158 1.00 0.00 O ATOM 382 OE2 GLU A 25 7.171 -16.695 -15.692 1.00 0.00 O ATOM 0 H GLU A 25 6.548 -16.620 -11.131 1.00 0.00 H new ATOM 0 HA GLU A 25 5.389 -14.730 -12.905 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.562 -17.557 -12.136 1.00 0.00 H new ATOM 0 HB3 GLU A 25 3.923 -16.663 -13.501 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.857 -17.365 -13.145 1.00 0.00 H new ATOM 0 HG3 GLU A 25 5.723 -18.319 -14.080 1.00 0.00 H new ATOM 389 N ALA A 26 3.497 -15.754 -10.383 1.00 0.00 N ATOM 390 CA ALA A 26 2.336 -15.402 -9.575 1.00 0.00 C ATOM 391 C ALA A 26 2.491 -14.012 -8.967 1.00 0.00 C ATOM 392 O ALA A 26 1.518 -13.269 -8.839 1.00 0.00 O ATOM 393 CB ALA A 26 2.121 -16.437 -8.481 1.00 0.00 C ATOM 0 H ALA A 26 3.966 -16.613 -10.096 1.00 0.00 H new ATOM 0 HA ALA A 26 1.462 -15.390 -10.226 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.251 -16.161 -7.885 1.00 0.00 H new ATOM 0 HB2 ALA A 26 1.956 -17.415 -8.933 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.002 -16.477 -7.840 1.00 0.00 H new ATOM 399 N ASP A 27 3.718 -13.668 -8.595 1.00 0.00 N ATOM 400 CA ASP A 27 4.000 -12.366 -8.001 1.00 0.00 C ATOM 401 C ASP A 27 3.811 -11.250 -9.023 1.00 0.00 C ATOM 402 O ASP A 27 3.187 -10.229 -8.734 1.00 0.00 O ATOM 403 CB ASP A 27 5.426 -12.332 -7.448 1.00 0.00 C ATOM 404 CG ASP A 27 5.831 -10.949 -6.976 1.00 0.00 C ATOM 405 OD1 ASP A 27 5.062 -10.337 -6.206 1.00 0.00 O ATOM 406 OD2 ASP A 27 6.916 -10.479 -7.377 1.00 0.00 O ATOM 0 H ASP A 27 4.534 -14.272 -8.694 1.00 0.00 H new ATOM 0 HA ASP A 27 3.297 -12.208 -7.183 1.00 0.00 H new ATOM 0 HB2 ASP A 27 5.508 -13.034 -6.618 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.120 -12.667 -8.219 1.00 0.00 H new ATOM 411 N ASP A 28 4.356 -11.451 -10.218 1.00 0.00 N ATOM 412 CA ASP A 28 4.247 -10.461 -11.284 1.00 0.00 C ATOM 413 C ASP A 28 2.826 -10.411 -11.837 1.00 0.00 C ATOM 414 O ASP A 28 2.359 -9.363 -12.283 1.00 0.00 O ATOM 415 CB ASP A 28 5.234 -10.781 -12.408 1.00 0.00 C ATOM 416 CG ASP A 28 5.669 -9.542 -13.166 1.00 0.00 C ATOM 417 OD1 ASP A 28 4.851 -8.608 -13.295 1.00 0.00 O ATOM 418 OD2 ASP A 28 6.828 -9.507 -13.631 1.00 0.00 O ATOM 0 H ASP A 28 4.877 -12.290 -10.473 1.00 0.00 H new ATOM 0 HA ASP A 28 4.489 -9.484 -10.865 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.111 -11.273 -11.988 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.775 -11.485 -13.102 1.00 0.00 H new ATOM 423 N TYR A 29 2.144 -11.551 -11.805 1.00 0.00 N ATOM 424 CA TYR A 29 0.778 -11.638 -12.306 1.00 0.00 C ATOM 425 C TYR A 29 -0.179 -10.844 -11.421 1.00 0.00 C ATOM 426 O TYR A 29 -0.947 -10.013 -11.907 1.00 0.00 O ATOM 427 CB TYR A 29 0.331 -13.099 -12.377 1.00 0.00 C ATOM 428 CG TYR A 29 0.345 -13.669 -13.777 1.00 0.00 C ATOM 429 CD1 TYR A 29 -0.725 -13.468 -14.641 1.00 0.00 C ATOM 430 CD2 TYR A 29 1.427 -14.410 -14.236 1.00 0.00 C ATOM 431 CE1 TYR A 29 -0.717 -13.988 -15.921 1.00 0.00 C ATOM 432 CE2 TYR A 29 1.444 -14.932 -15.515 1.00 0.00 C ATOM 433 CZ TYR A 29 0.370 -14.719 -16.354 1.00 0.00 C ATOM 434 OH TYR A 29 0.383 -15.238 -17.628 1.00 0.00 O ATOM 0 H TYR A 29 2.515 -12.427 -11.437 1.00 0.00 H new ATOM 0 HA TYR A 29 0.758 -11.209 -13.308 1.00 0.00 H new ATOM 0 HB2 TYR A 29 0.982 -13.701 -11.742 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -0.677 -13.182 -11.970 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.577 -12.896 -14.306 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.269 -14.581 -13.582 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -1.557 -13.823 -16.579 1.00 0.00 H new ATOM 0 HE2 TYR A 29 2.294 -15.504 -15.856 1.00 0.00 H new ATOM 0 HH TYR A 29 0.782 -14.587 -18.242 1.00 0.00 H new ATOM 444 N LEU A 30 -0.126 -11.107 -10.120 1.00 0.00 N ATOM 445 CA LEU A 30 -0.986 -10.417 -9.165 1.00 0.00 C ATOM 446 C LEU A 30 -0.630 -8.937 -9.081 1.00 0.00 C ATOM 447 O LEU A 30 -1.510 -8.079 -9.002 1.00 0.00 O ATOM 448 CB LEU A 30 -0.866 -11.061 -7.783 1.00 0.00 C ATOM 449 CG LEU A 30 -1.156 -12.561 -7.714 1.00 0.00 C ATOM 450 CD1 LEU A 30 -0.334 -13.214 -6.613 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.641 -12.807 -7.490 1.00 0.00 C ATOM 0 H LEU A 30 0.503 -11.793 -9.702 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.016 -10.505 -9.512 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.144 -10.889 -7.411 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.548 -10.548 -7.105 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.873 -13.010 -8.666 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.554 -14.281 -6.579 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.727 -13.068 -6.816 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.585 -12.761 -5.654 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.829 -13.880 -7.444 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -2.949 -12.344 -6.553 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.210 -12.374 -8.313 1.00 0.00 H new ATOM 463 N ASP A 31 0.666 -8.643 -9.102 1.00 0.00 N ATOM 464 CA ASP A 31 1.139 -7.266 -9.032 1.00 0.00 C ATOM 465 C ASP A 31 0.597 -6.445 -10.198 1.00 0.00 C ATOM 466 O ASP A 31 -0.059 -5.422 -9.999 1.00 0.00 O ATOM 467 CB ASP A 31 2.668 -7.229 -9.032 1.00 0.00 C ATOM 468 CG ASP A 31 3.244 -7.074 -7.639 1.00 0.00 C ATOM 469 OD1 ASP A 31 2.656 -7.631 -6.688 1.00 0.00 O ATOM 470 OD2 ASP A 31 4.284 -6.397 -7.499 1.00 0.00 O ATOM 0 H ASP A 31 1.407 -9.341 -9.167 1.00 0.00 H new ATOM 0 HA ASP A 31 0.773 -6.829 -8.103 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.051 -8.146 -9.480 1.00 0.00 H new ATOM 0 HB3 ASP A 31 3.008 -6.403 -9.657 1.00 0.00 H new ATOM 475 N HIS A 32 0.877 -6.899 -11.415 1.00 0.00 N ATOM 476 CA HIS A 32 0.418 -6.207 -12.614 1.00 0.00 C ATOM 477 C HIS A 32 -1.105 -6.238 -12.710 1.00 0.00 C ATOM 478 O HIS A 32 -1.713 -5.396 -13.373 1.00 0.00 O ATOM 479 CB HIS A 32 1.032 -6.841 -13.862 1.00 0.00 C ATOM 480 CG HIS A 32 2.086 -5.996 -14.507 1.00 0.00 C ATOM 481 ND1 HIS A 32 1.876 -5.289 -15.672 1.00 0.00 N ATOM 482 CD2 HIS A 32 3.365 -5.744 -14.142 1.00 0.00 C ATOM 483 CE1 HIS A 32 2.980 -4.641 -15.997 1.00 0.00 C ATOM 484 NE2 HIS A 32 3.899 -4.899 -15.084 1.00 0.00 N ATOM 0 H HIS A 32 1.420 -7.743 -11.597 1.00 0.00 H new ATOM 0 HA HIS A 32 0.740 -5.168 -12.549 1.00 0.00 H new ATOM 0 HB2 HIS A 32 1.465 -7.805 -13.594 1.00 0.00 H new ATOM 0 HB3 HIS A 32 0.241 -7.037 -14.586 1.00 0.00 H new ATOM 0 HD2 HIS A 32 3.871 -6.135 -13.272 1.00 0.00 H new ATOM 0 HE1 HIS A 32 3.109 -4.008 -16.862 1.00 0.00 H new ATOM 0 HE2 HIS A 32 4.850 -4.531 -15.079 1.00 0.00 H new ATOM 492 N LEU A 33 -1.715 -7.213 -12.045 1.00 0.00 N ATOM 493 CA LEU A 33 -3.167 -7.354 -12.056 1.00 0.00 C ATOM 494 C LEU A 33 -3.831 -6.210 -11.296 1.00 0.00 C ATOM 495 O LEU A 33 -4.699 -5.518 -11.830 1.00 0.00 O ATOM 496 CB LEU A 33 -3.573 -8.694 -11.440 1.00 0.00 C ATOM 497 CG LEU A 33 -3.959 -9.796 -12.426 1.00 0.00 C ATOM 498 CD1 LEU A 33 -2.952 -9.872 -13.563 1.00 0.00 C ATOM 499 CD2 LEU A 33 -4.063 -11.137 -11.714 1.00 0.00 C ATOM 0 H LEU A 33 -1.227 -7.917 -11.492 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.503 -7.320 -13.092 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.747 -9.055 -10.828 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.415 -8.523 -10.770 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.935 -9.554 -12.847 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -3.243 -10.662 -14.255 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -2.927 -8.919 -14.091 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -1.963 -10.090 -13.159 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.339 -11.910 -12.432 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.102 -11.386 -11.264 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.823 -11.077 -10.935 1.00 0.00 H new ATOM 511 N LEU A 34 -3.416 -6.015 -10.050 1.00 0.00 N ATOM 512 CA LEU A 34 -3.969 -4.953 -9.216 1.00 0.00 C ATOM 513 C LEU A 34 -3.525 -3.582 -9.717 1.00 0.00 C ATOM 514 O LEU A 34 -4.211 -2.581 -9.507 1.00 0.00 O ATOM 515 CB LEU A 34 -3.536 -5.142 -7.761 1.00 0.00 C ATOM 516 CG LEU A 34 -2.044 -5.382 -7.530 1.00 0.00 C ATOM 517 CD1 LEU A 34 -1.353 -4.091 -7.119 1.00 0.00 C ATOM 518 CD2 LEU A 34 -1.834 -6.460 -6.477 1.00 0.00 C ATOM 0 H LEU A 34 -2.698 -6.578 -9.594 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.056 -5.007 -9.274 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.833 -4.258 -7.197 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.088 -5.985 -7.345 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.602 -5.725 -8.465 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.292 -4.281 -6.959 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.473 -3.347 -7.907 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.798 -3.718 -6.196 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.766 -6.618 -6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.291 -6.146 -5.539 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.294 -7.390 -6.811 1.00 0.00 H new ATOM 530 N ASP A 35 -2.375 -3.544 -10.380 1.00 0.00 N ATOM 531 CA ASP A 35 -1.840 -2.296 -10.914 1.00 0.00 C ATOM 532 C ASP A 35 -2.683 -1.801 -12.085 1.00 0.00 C ATOM 533 O ASP A 35 -2.993 -0.614 -12.181 1.00 0.00 O ATOM 534 CB ASP A 35 -0.389 -2.486 -11.357 1.00 0.00 C ATOM 535 CG ASP A 35 0.335 -1.168 -11.550 1.00 0.00 C ATOM 536 OD1 ASP A 35 0.221 -0.583 -12.647 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.015 -0.721 -10.603 1.00 0.00 O ATOM 0 H ASP A 35 -1.795 -4.363 -10.561 1.00 0.00 H new ATOM 0 HA ASP A 35 -1.874 -1.547 -10.123 1.00 0.00 H new ATOM 0 HB2 ASP A 35 0.140 -3.082 -10.613 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.368 -3.049 -12.290 1.00 0.00 H new ATOM 542 N SER A 36 -3.049 -2.719 -12.974 1.00 0.00 N ATOM 543 CA SER A 36 -3.852 -2.375 -14.142 1.00 0.00 C ATOM 544 C SER A 36 -5.294 -2.081 -13.742 1.00 0.00 C ATOM 545 O SER A 36 -5.892 -1.107 -14.202 1.00 0.00 O ATOM 546 CB SER A 36 -3.816 -3.512 -15.164 1.00 0.00 C ATOM 547 OG SER A 36 -3.864 -3.009 -16.488 1.00 0.00 O ATOM 0 H SER A 36 -2.802 -3.707 -12.908 1.00 0.00 H new ATOM 0 HA SER A 36 -3.428 -1.477 -14.592 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.908 -4.099 -15.027 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.658 -4.183 -14.996 1.00 0.00 H new ATOM 0 HG SER A 36 -3.838 -3.755 -17.123 1.00 0.00 H new ATOM 553 N LEU A 37 -5.848 -2.930 -12.883 1.00 0.00 N ATOM 554 CA LEU A 37 -7.222 -2.762 -12.420 1.00 0.00 C ATOM 555 C LEU A 37 -7.368 -1.483 -11.602 1.00 0.00 C ATOM 556 O LEU A 37 -8.325 -0.729 -11.779 1.00 0.00 O ATOM 557 CB LEU A 37 -7.649 -3.969 -11.582 1.00 0.00 C ATOM 558 CG LEU A 37 -8.240 -5.148 -12.356 1.00 0.00 C ATOM 559 CD1 LEU A 37 -9.229 -4.657 -13.402 1.00 0.00 C ATOM 560 CD2 LEU A 37 -7.135 -5.967 -13.007 1.00 0.00 C ATOM 0 H LEU A 37 -5.368 -3.741 -12.493 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.868 -2.687 -13.295 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.782 -4.324 -11.025 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.384 -3.636 -10.850 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.773 -5.789 -11.653 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.640 -5.510 -13.943 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.038 -4.115 -12.912 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.720 -3.994 -14.102 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.574 -6.802 -13.553 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.574 -5.337 -13.697 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.464 -6.350 -12.238 1.00 0.00 H new ATOM 572 N GLU A 38 -6.413 -1.246 -10.709 1.00 0.00 N ATOM 573 CA GLU A 38 -6.436 -0.056 -9.865 1.00 0.00 C ATOM 574 C GLU A 38 -6.341 1.211 -10.709 1.00 0.00 C ATOM 575 O GLU A 38 -7.024 2.199 -10.441 1.00 0.00 O ATOM 576 CB GLU A 38 -5.287 -0.098 -8.855 1.00 0.00 C ATOM 577 CG GLU A 38 -5.497 -1.104 -7.736 1.00 0.00 C ATOM 578 CD GLU A 38 -4.194 -1.550 -7.102 1.00 0.00 C ATOM 579 OE1 GLU A 38 -3.127 -1.307 -7.703 1.00 0.00 O ATOM 580 OE2 GLU A 38 -4.241 -2.142 -6.003 1.00 0.00 O ATOM 0 H GLU A 38 -5.615 -1.861 -10.551 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.383 -0.042 -9.326 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.362 -0.338 -9.379 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.159 0.894 -8.421 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.137 -0.663 -6.971 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -6.023 -1.974 -8.129 1.00 0.00 H new ATOM 587 N GLU A 39 -5.489 1.174 -11.728 1.00 0.00 N ATOM 588 CA GLU A 39 -5.303 2.321 -12.610 1.00 0.00 C ATOM 589 C GLU A 39 -6.559 2.580 -13.437 1.00 0.00 C ATOM 590 O GLU A 39 -6.857 3.720 -13.794 1.00 0.00 O ATOM 591 CB GLU A 39 -4.107 2.091 -13.537 1.00 0.00 C ATOM 592 CG GLU A 39 -3.302 3.349 -13.815 1.00 0.00 C ATOM 593 CD GLU A 39 -3.259 3.700 -15.290 1.00 0.00 C ATOM 594 OE1 GLU A 39 -3.141 2.772 -16.117 1.00 0.00 O ATOM 595 OE2 GLU A 39 -3.343 4.903 -15.615 1.00 0.00 O ATOM 0 H GLU A 39 -4.917 0.363 -11.964 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.110 3.196 -11.990 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.452 1.342 -13.092 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.464 1.682 -14.482 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.733 4.182 -13.260 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.285 3.213 -13.448 1.00 0.00 H new ATOM 602 N LEU A 40 -7.292 1.513 -13.739 1.00 0.00 N ATOM 603 CA LEU A 40 -8.516 1.624 -14.524 1.00 0.00 C ATOM 604 C LEU A 40 -9.682 2.080 -13.654 1.00 0.00 C ATOM 605 O LEU A 40 -10.469 2.938 -14.053 1.00 0.00 O ATOM 606 CB LEU A 40 -8.848 0.282 -15.179 1.00 0.00 C ATOM 607 CG LEU A 40 -8.136 -0.015 -16.499 1.00 0.00 C ATOM 608 CD1 LEU A 40 -8.738 -1.242 -17.166 1.00 0.00 C ATOM 609 CD2 LEU A 40 -8.209 1.189 -17.427 1.00 0.00 C ATOM 0 H LEU A 40 -7.060 0.562 -13.452 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.353 2.371 -15.301 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.608 -0.513 -14.473 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.923 0.241 -15.352 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.087 -0.221 -16.286 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -8.219 -1.438 -18.104 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.633 -2.103 -16.506 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.795 -1.065 -17.366 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.697 0.960 -18.362 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.253 1.426 -17.634 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.730 2.045 -16.951 1.00 0.00 H new ATOM 621 N SER A 41 -9.786 1.501 -12.461 1.00 0.00 N ATOM 622 CA SER A 41 -10.857 1.847 -11.534 1.00 0.00 C ATOM 623 C SER A 41 -10.697 3.278 -11.029 1.00 0.00 C ATOM 624 O SER A 41 -11.665 3.910 -10.609 1.00 0.00 O ATOM 625 CB SER A 41 -10.872 0.875 -10.353 1.00 0.00 C ATOM 626 OG SER A 41 -11.691 1.360 -9.304 1.00 0.00 O ATOM 0 H SER A 41 -9.141 0.790 -12.114 1.00 0.00 H new ATOM 0 HA SER A 41 -11.804 1.773 -12.068 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.237 -0.098 -10.683 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.856 0.727 -9.987 1.00 0.00 H new ATOM 0 HG SER A 41 -12.218 0.622 -8.933 1.00 0.00 H new ATOM 632 N GLU A 42 -9.467 3.780 -11.072 1.00 0.00 N ATOM 633 CA GLU A 42 -9.179 5.135 -10.617 1.00 0.00 C ATOM 634 C GLU A 42 -9.579 6.160 -11.674 1.00 0.00 C ATOM 635 O GLU A 42 -10.211 7.170 -11.367 1.00 0.00 O ATOM 636 CB GLU A 42 -7.693 5.281 -10.285 1.00 0.00 C ATOM 637 CG GLU A 42 -7.355 6.572 -9.559 1.00 0.00 C ATOM 638 CD GLU A 42 -5.999 7.125 -9.953 1.00 0.00 C ATOM 639 OE1 GLU A 42 -5.239 6.404 -10.633 1.00 0.00 O ATOM 640 OE2 GLU A 42 -5.697 8.278 -9.582 1.00 0.00 O ATOM 0 H GLU A 42 -8.654 3.269 -11.417 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.764 5.320 -9.716 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.382 4.436 -9.670 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.117 5.232 -11.209 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.123 7.316 -9.772 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.373 6.395 -8.484 1.00 0.00 H new ATOM 647 N ALA A 43 -9.204 5.892 -12.921 1.00 0.00 N ATOM 648 CA ALA A 43 -9.524 6.790 -14.024 1.00 0.00 C ATOM 649 C ALA A 43 -11.024 6.813 -14.295 1.00 0.00 C ATOM 650 O ALA A 43 -11.511 7.627 -15.080 1.00 0.00 O ATOM 651 CB ALA A 43 -8.765 6.377 -15.276 1.00 0.00 C ATOM 0 H ALA A 43 -8.679 5.061 -13.192 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.217 7.797 -13.742 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -9.013 7.056 -16.092 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -7.693 6.419 -15.082 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.044 5.360 -15.552 1.00 0.00 H new ATOM 657 N HIS A 44 -11.753 5.913 -13.643 1.00 0.00 N ATOM 658 CA HIS A 44 -13.199 5.830 -13.814 1.00 0.00 C ATOM 659 C HIS A 44 -13.553 5.387 -15.231 1.00 0.00 C ATOM 660 O HIS A 44 -13.634 6.193 -16.158 1.00 0.00 O ATOM 661 CB HIS A 44 -13.848 7.181 -13.513 1.00 0.00 C ATOM 662 CG HIS A 44 -14.996 7.509 -14.417 1.00 0.00 C ATOM 663 ND1 HIS A 44 -15.893 6.564 -14.868 1.00 0.00 N ATOM 664 CD2 HIS A 44 -15.391 8.687 -14.954 1.00 0.00 C ATOM 665 CE1 HIS A 44 -16.790 7.146 -15.644 1.00 0.00 C ATOM 666 NE2 HIS A 44 -16.508 8.435 -15.712 1.00 0.00 N ATOM 0 H HIS A 44 -11.366 5.231 -12.991 1.00 0.00 H new ATOM 0 HA HIS A 44 -13.581 5.088 -13.113 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -14.197 7.185 -12.480 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -13.094 7.964 -13.598 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -14.916 9.647 -14.813 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -17.613 6.652 -16.138 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -17.034 9.130 -16.241 1.00 0.00 H new ATOM 674 N PRO A 45 -13.769 4.074 -15.404 1.00 0.00 N ATOM 675 CA PRO A 45 -14.118 3.494 -16.704 1.00 0.00 C ATOM 676 C PRO A 45 -15.521 3.884 -17.155 1.00 0.00 C ATOM 677 O PRO A 45 -15.715 4.354 -18.277 1.00 0.00 O ATOM 678 CB PRO A 45 -14.037 1.986 -16.453 1.00 0.00 C ATOM 679 CG PRO A 45 -14.278 1.832 -14.991 1.00 0.00 C ATOM 680 CD PRO A 45 -13.690 3.056 -14.343 1.00 0.00 C ATOM 0 HA PRO A 45 -13.457 3.844 -17.497 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.784 1.447 -17.036 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -13.063 1.589 -16.738 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -15.344 1.751 -14.778 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.807 0.925 -14.611 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -14.254 3.353 -13.459 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -12.662 2.887 -14.024 1.00 0.00 H new ATOM 688 N ASP A 46 -16.497 3.688 -16.275 1.00 0.00 N ATOM 689 CA ASP A 46 -17.883 4.021 -16.583 1.00 0.00 C ATOM 690 C ASP A 46 -18.572 4.648 -15.375 1.00 0.00 C ATOM 691 O ASP A 46 -19.405 5.544 -15.518 1.00 0.00 O ATOM 692 CB ASP A 46 -18.644 2.771 -17.027 1.00 0.00 C ATOM 693 CG ASP A 46 -19.772 3.091 -17.988 1.00 0.00 C ATOM 694 OD1 ASP A 46 -20.863 3.472 -17.516 1.00 0.00 O ATOM 695 OD2 ASP A 46 -19.563 2.961 -19.212 1.00 0.00 O ATOM 0 H ASP A 46 -16.354 3.300 -15.343 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.884 4.746 -17.397 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -17.951 2.077 -17.503 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -19.050 2.266 -16.151 1.00 0.00 H new ATOM 700 N CYS A 47 -18.220 4.171 -14.186 1.00 0.00 N ATOM 701 CA CYS A 47 -18.806 4.684 -12.952 1.00 0.00 C ATOM 702 C CYS A 47 -17.742 4.846 -11.871 1.00 0.00 C ATOM 703 O CYS A 47 -17.233 5.944 -11.648 1.00 0.00 O ATOM 704 CB CYS A 47 -19.911 3.748 -12.461 1.00 0.00 C ATOM 705 SG CYS A 47 -20.136 2.271 -13.480 1.00 0.00 S ATOM 0 H CYS A 47 -17.532 3.430 -14.050 1.00 0.00 H new ATOM 0 HA CYS A 47 -19.236 5.663 -13.162 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -19.685 3.441 -11.440 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -20.851 4.299 -12.427 1.00 0.00 H new ATOM 0 HG CYS A 47 -20.808 1.381 -12.812 1.00 0.00 H new ATOM 711 N ILE A 48 -17.413 3.746 -11.203 1.00 0.00 N ATOM 712 CA ILE A 48 -16.411 3.766 -10.145 1.00 0.00 C ATOM 713 C ILE A 48 -16.314 2.411 -9.453 1.00 0.00 C ATOM 714 O ILE A 48 -16.846 2.203 -8.363 1.00 0.00 O ATOM 715 CB ILE A 48 -16.725 4.846 -9.093 1.00 0.00 C ATOM 716 CG1 ILE A 48 -15.774 4.720 -7.901 1.00 0.00 C ATOM 717 CG2 ILE A 48 -18.172 4.735 -8.636 1.00 0.00 C ATOM 718 CD1 ILE A 48 -15.640 5.994 -7.097 1.00 0.00 C ATOM 0 H ILE A 48 -17.826 2.829 -11.376 1.00 0.00 H new ATOM 0 HA ILE A 48 -15.457 3.998 -10.619 1.00 0.00 H new ATOM 0 HB ILE A 48 -16.581 5.827 -9.547 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -16.128 3.923 -7.247 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -14.789 4.423 -8.262 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -18.379 5.505 -7.893 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -18.835 4.869 -9.491 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -18.340 3.752 -8.197 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -14.951 5.831 -6.269 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -15.257 6.789 -7.736 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -16.616 6.282 -6.706 1.00 0.00 H new ATOM 730 N PRO A 49 -15.616 1.465 -10.100 1.00 0.00 N ATOM 731 CA PRO A 49 -15.430 0.113 -9.564 1.00 0.00 C ATOM 732 C PRO A 49 -14.515 0.094 -8.345 1.00 0.00 C ATOM 733 O PRO A 49 -13.797 1.058 -8.080 1.00 0.00 O ATOM 734 CB PRO A 49 -14.787 -0.644 -10.728 1.00 0.00 C ATOM 735 CG PRO A 49 -14.107 0.408 -11.535 1.00 0.00 C ATOM 736 CD PRO A 49 -14.954 1.643 -11.403 1.00 0.00 C ATOM 0 HA PRO A 49 -16.368 -0.323 -9.221 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -14.077 -1.390 -10.371 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -15.536 -1.173 -11.318 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.096 0.587 -11.170 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -14.020 0.104 -12.578 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -14.349 2.549 -11.426 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -15.678 1.722 -12.214 1.00 0.00 H new ATOM 744 N ASP A 50 -14.544 -1.010 -7.606 1.00 0.00 N ATOM 745 CA ASP A 50 -13.715 -1.156 -6.415 1.00 0.00 C ATOM 746 C ASP A 50 -12.543 -2.096 -6.681 1.00 0.00 C ATOM 747 O ASP A 50 -12.677 -3.082 -7.405 1.00 0.00 O ATOM 748 CB ASP A 50 -14.551 -1.680 -5.247 1.00 0.00 C ATOM 749 CG ASP A 50 -14.480 -0.776 -4.032 1.00 0.00 C ATOM 750 OD1 ASP A 50 -14.675 0.447 -4.192 1.00 0.00 O ATOM 751 OD2 ASP A 50 -14.229 -1.290 -2.922 1.00 0.00 O ATOM 0 H ASP A 50 -15.133 -1.817 -7.811 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.318 -0.174 -6.155 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.590 -1.778 -5.563 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -14.205 -2.677 -4.975 1.00 0.00 H new ATOM 756 N VAL A 51 -11.394 -1.782 -6.090 1.00 0.00 N ATOM 757 CA VAL A 51 -10.198 -2.598 -6.263 1.00 0.00 C ATOM 758 C VAL A 51 -9.678 -3.101 -4.921 1.00 0.00 C ATOM 759 O VAL A 51 -9.203 -2.320 -4.097 1.00 0.00 O ATOM 760 CB VAL A 51 -9.080 -1.813 -6.973 1.00 0.00 C ATOM 761 CG1 VAL A 51 -9.600 -1.188 -8.259 1.00 0.00 C ATOM 762 CG2 VAL A 51 -8.506 -0.750 -6.049 1.00 0.00 C ATOM 0 H VAL A 51 -11.266 -0.969 -5.488 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.482 -3.449 -6.882 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.281 -2.507 -7.232 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -8.796 -0.637 -8.747 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -9.959 -1.972 -8.925 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -10.418 -0.506 -8.027 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.717 -0.205 -6.567 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.295 -0.057 -5.758 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -8.094 -1.226 -5.159 1.00 0.00 H new ATOM 772 N GLU A 52 -9.770 -4.410 -4.709 1.00 0.00 N ATOM 773 CA GLU A 52 -9.307 -5.016 -3.466 1.00 0.00 C ATOM 774 C GLU A 52 -8.134 -5.957 -3.723 1.00 0.00 C ATOM 775 O GLU A 52 -8.202 -6.831 -4.589 1.00 0.00 O ATOM 776 CB GLU A 52 -10.448 -5.779 -2.790 1.00 0.00 C ATOM 777 CG GLU A 52 -9.974 -6.877 -1.852 1.00 0.00 C ATOM 778 CD GLU A 52 -11.113 -7.736 -1.337 1.00 0.00 C ATOM 779 OE1 GLU A 52 -12.230 -7.203 -1.173 1.00 0.00 O ATOM 780 OE2 GLU A 52 -10.887 -8.941 -1.099 1.00 0.00 O ATOM 0 H GLU A 52 -10.160 -5.071 -5.381 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.971 -4.217 -2.805 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -11.063 -5.075 -2.230 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.085 -6.218 -3.558 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.254 -7.509 -2.372 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.452 -6.428 -1.007 1.00 0.00 H new ATOM 787 N LEU A 53 -7.058 -5.772 -2.966 1.00 0.00 N ATOM 788 CA LEU A 53 -5.868 -6.603 -3.111 1.00 0.00 C ATOM 789 C LEU A 53 -5.446 -7.188 -1.768 1.00 0.00 C ATOM 790 O LEU A 53 -4.979 -6.469 -0.885 1.00 0.00 O ATOM 791 CB LEU A 53 -4.721 -5.785 -3.708 1.00 0.00 C ATOM 792 CG LEU A 53 -3.310 -6.307 -3.431 1.00 0.00 C ATOM 793 CD1 LEU A 53 -2.794 -5.773 -2.104 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.294 -7.829 -3.438 1.00 0.00 C ATOM 0 H LEU A 53 -6.985 -5.054 -2.245 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.108 -7.425 -3.785 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.862 -5.732 -4.788 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.791 -4.766 -3.327 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.650 -5.953 -4.223 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.789 -6.155 -1.924 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.768 -4.684 -2.136 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.455 -6.097 -1.300 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.282 -8.183 -3.239 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.968 -8.203 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.621 -8.192 -4.413 1.00 0.00 H new ATOM 806 N SER A 54 -5.611 -8.499 -1.621 1.00 0.00 N ATOM 807 CA SER A 54 -5.249 -9.182 -0.384 1.00 0.00 C ATOM 808 C SER A 54 -4.147 -10.208 -0.633 1.00 0.00 C ATOM 809 O SER A 54 -4.353 -11.200 -1.333 1.00 0.00 O ATOM 810 CB SER A 54 -6.474 -9.869 0.222 1.00 0.00 C ATOM 811 OG SER A 54 -7.674 -9.305 -0.278 1.00 0.00 O ATOM 0 H SER A 54 -5.993 -9.110 -2.343 1.00 0.00 H new ATOM 0 HA SER A 54 -4.876 -8.436 0.318 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.447 -10.935 -0.005 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.448 -9.774 1.308 1.00 0.00 H new ATOM 0 HG SER A 54 -8.442 -9.762 0.123 1.00 0.00 H new ATOM 817 N HIS A 55 -2.976 -9.961 -0.054 1.00 0.00 N ATOM 818 CA HIS A 55 -1.841 -10.863 -0.212 1.00 0.00 C ATOM 819 C HIS A 55 -2.310 -12.268 -0.577 1.00 0.00 C ATOM 820 O HIS A 55 -2.586 -13.088 0.298 1.00 0.00 O ATOM 821 CB HIS A 55 -1.015 -10.907 1.074 1.00 0.00 C ATOM 822 CG HIS A 55 0.206 -11.768 0.972 1.00 0.00 C ATOM 823 ND1 HIS A 55 0.979 -12.110 2.062 1.00 0.00 N ATOM 824 CD2 HIS A 55 0.786 -12.359 -0.098 1.00 0.00 C ATOM 825 CE1 HIS A 55 1.982 -12.873 1.666 1.00 0.00 C ATOM 826 NE2 HIS A 55 1.888 -13.039 0.359 1.00 0.00 N ATOM 0 H HIS A 55 -2.789 -9.145 0.528 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.218 -10.485 -1.023 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -0.714 -9.893 1.337 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.642 -11.274 1.886 1.00 0.00 H new ATOM 0 HD2 HIS A 55 0.445 -12.306 -1.122 1.00 0.00 H new ATOM 0 HE1 HIS A 55 2.748 -13.290 2.303 1.00 0.00 H new ATOM 0 HE2 HIS A 55 2.530 -13.584 -0.217 1.00 0.00 H new ATOM 834 N GLY A 56 -2.398 -12.539 -1.876 1.00 0.00 N ATOM 835 CA GLY A 56 -2.834 -13.845 -2.333 1.00 0.00 C ATOM 836 C GLY A 56 -4.156 -13.788 -3.074 1.00 0.00 C ATOM 837 O GLY A 56 -4.721 -14.822 -3.430 1.00 0.00 O ATOM 0 H GLY A 56 -2.175 -11.877 -2.619 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.073 -14.271 -2.987 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.929 -14.513 -1.477 1.00 0.00 H new ATOM 841 N VAL A 57 -4.650 -12.576 -3.306 1.00 0.00 N ATOM 842 CA VAL A 57 -5.914 -12.388 -4.009 1.00 0.00 C ATOM 843 C VAL A 57 -6.014 -10.983 -4.593 1.00 0.00 C ATOM 844 O VAL A 57 -5.483 -10.027 -4.030 1.00 0.00 O ATOM 845 CB VAL A 57 -7.116 -12.632 -3.077 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.418 -12.590 -3.863 1.00 0.00 C ATOM 847 CG2 VAL A 57 -6.965 -13.959 -2.349 1.00 0.00 C ATOM 0 H VAL A 57 -4.195 -11.710 -3.018 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.938 -13.117 -4.819 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.144 -11.837 -2.332 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.256 -12.764 -3.188 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.528 -11.613 -4.333 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.404 -13.363 -4.632 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.823 -14.115 -1.695 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.911 -14.769 -3.076 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.052 -13.945 -1.753 1.00 0.00 H new ATOM 857 N MET A 58 -6.699 -10.867 -5.726 1.00 0.00 N ATOM 858 CA MET A 58 -6.870 -9.578 -6.386 1.00 0.00 C ATOM 859 C MET A 58 -8.329 -9.356 -6.774 1.00 0.00 C ATOM 860 O MET A 58 -8.722 -9.595 -7.917 1.00 0.00 O ATOM 861 CB MET A 58 -5.981 -9.495 -7.628 1.00 0.00 C ATOM 862 CG MET A 58 -5.331 -8.134 -7.820 1.00 0.00 C ATOM 863 SD MET A 58 -6.537 -6.818 -8.071 1.00 0.00 S ATOM 864 CE MET A 58 -7.084 -7.172 -9.739 1.00 0.00 C ATOM 0 H MET A 58 -7.144 -11.649 -6.206 1.00 0.00 H new ATOM 0 HA MET A 58 -6.576 -8.797 -5.685 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.202 -10.254 -7.559 1.00 0.00 H new ATOM 0 HB3 MET A 58 -6.578 -9.731 -8.509 1.00 0.00 H new ATOM 0 HG2 MET A 58 -4.721 -7.901 -6.947 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.659 -8.174 -8.677 1.00 0.00 H new ATOM 0 HE1 MET A 58 -6.718 -6.398 -10.414 1.00 0.00 H new ATOM 0 HE2 MET A 58 -6.694 -8.141 -10.052 1.00 0.00 H new ATOM 0 HE3 MET A 58 -8.173 -7.193 -9.768 1.00 0.00 H new ATOM 874 N THR A 59 -9.128 -8.896 -5.817 1.00 0.00 N ATOM 875 CA THR A 59 -10.543 -8.643 -6.058 1.00 0.00 C ATOM 876 C THR A 59 -10.753 -7.289 -6.725 1.00 0.00 C ATOM 877 O THR A 59 -9.961 -6.364 -6.538 1.00 0.00 O ATOM 878 CB THR A 59 -11.353 -8.690 -4.749 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.480 -8.932 -3.640 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.417 -9.777 -4.810 1.00 0.00 C ATOM 0 H THR A 59 -8.819 -8.691 -4.867 1.00 0.00 H new ATOM 0 HA THR A 59 -10.897 -9.431 -6.723 1.00 0.00 H new ATOM 0 HB THR A 59 -11.846 -7.727 -4.618 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.735 -9.769 -3.199 1.00 0.00 H new ATOM 0 HG21 THR A 59 -12.976 -9.791 -3.875 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.098 -9.574 -5.637 1.00 0.00 H new ATOM 0 HG23 THR A 59 -11.940 -10.745 -4.962 1.00 0.00 H new ATOM 888 N LEU A 60 -11.825 -7.177 -7.501 1.00 0.00 N ATOM 889 CA LEU A 60 -12.141 -5.933 -8.195 1.00 0.00 C ATOM 890 C LEU A 60 -13.636 -5.831 -8.478 1.00 0.00 C ATOM 891 O LEU A 60 -14.162 -6.529 -9.344 1.00 0.00 O ATOM 892 CB LEU A 60 -11.356 -5.844 -9.505 1.00 0.00 C ATOM 893 CG LEU A 60 -11.839 -4.795 -10.507 1.00 0.00 C ATOM 894 CD1 LEU A 60 -11.034 -3.512 -10.367 1.00 0.00 C ATOM 895 CD2 LEU A 60 -11.746 -5.332 -11.928 1.00 0.00 C ATOM 0 H LEU A 60 -12.490 -7.932 -7.666 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.855 -5.103 -7.549 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.313 -5.637 -9.267 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.384 -6.820 -9.989 1.00 0.00 H new ATOM 0 HG LEU A 60 -12.884 -4.570 -10.292 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -11.392 -2.777 -11.088 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -11.151 -3.117 -9.358 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.981 -3.721 -10.555 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -12.094 -4.572 -12.628 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.710 -5.586 -12.154 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -12.367 -6.223 -12.022 1.00 0.00 H new ATOM 907 N GLU A 61 -14.314 -4.956 -7.742 1.00 0.00 N ATOM 908 CA GLU A 61 -15.749 -4.762 -7.915 1.00 0.00 C ATOM 909 C GLU A 61 -16.037 -3.888 -9.133 1.00 0.00 C ATOM 910 O GLU A 61 -15.322 -2.921 -9.399 1.00 0.00 O ATOM 911 CB GLU A 61 -16.355 -4.126 -6.662 1.00 0.00 C ATOM 912 CG GLU A 61 -17.376 -3.042 -6.963 1.00 0.00 C ATOM 913 CD GLU A 61 -18.363 -2.839 -5.830 1.00 0.00 C ATOM 914 OE1 GLU A 61 -18.693 -3.830 -5.145 1.00 0.00 O ATOM 915 OE2 GLU A 61 -18.805 -1.688 -5.628 1.00 0.00 O ATOM 0 H GLU A 61 -13.893 -4.371 -7.021 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.205 -5.739 -8.074 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.829 -4.904 -6.063 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.554 -3.701 -6.057 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.857 -2.104 -7.160 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.920 -3.302 -7.871 1.00 0.00 H new ATOM 922 N ILE A 62 -17.087 -4.236 -9.868 1.00 0.00 N ATOM 923 CA ILE A 62 -17.470 -3.484 -11.056 1.00 0.00 C ATOM 924 C ILE A 62 -18.980 -3.276 -11.112 1.00 0.00 C ATOM 925 O ILE A 62 -19.730 -4.119 -11.605 1.00 0.00 O ATOM 926 CB ILE A 62 -17.014 -4.195 -12.344 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.570 -4.682 -12.199 1.00 0.00 C ATOM 928 CG2 ILE A 62 -17.146 -3.263 -13.539 1.00 0.00 C ATOM 929 CD1 ILE A 62 -14.550 -3.566 -12.231 1.00 0.00 C ATOM 0 H ILE A 62 -17.688 -5.034 -9.662 1.00 0.00 H new ATOM 0 HA ILE A 62 -16.974 -2.516 -10.990 1.00 0.00 H new ATOM 0 HB ILE A 62 -17.655 -5.060 -12.510 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -15.471 -5.227 -11.260 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -15.351 -5.387 -13.001 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -16.820 -3.780 -14.441 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -18.187 -2.960 -13.651 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -16.526 -2.380 -13.382 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -13.549 -3.984 -12.123 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -14.621 -3.035 -13.180 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -14.744 -2.873 -11.413 1.00 0.00 H new ATOM 941 N PRO A 63 -19.438 -2.125 -10.598 1.00 0.00 N ATOM 942 CA PRO A 63 -20.862 -1.777 -10.579 1.00 0.00 C ATOM 943 C PRO A 63 -21.405 -1.483 -11.973 1.00 0.00 C ATOM 944 O PRO A 63 -21.810 -0.359 -12.268 1.00 0.00 O ATOM 945 CB PRO A 63 -20.908 -0.517 -9.711 1.00 0.00 C ATOM 946 CG PRO A 63 -19.550 0.082 -9.840 1.00 0.00 C ATOM 947 CD PRO A 63 -18.601 -1.074 -9.995 1.00 0.00 C ATOM 0 HA PRO A 63 -21.476 -2.594 -10.201 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.679 0.173 -10.055 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -21.137 -0.759 -8.673 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -19.497 0.748 -10.701 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.301 0.677 -8.961 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -17.756 -0.817 -10.634 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -18.191 -1.388 -9.035 1.00 0.00 H new ATOM 955 N ALA A 64 -21.411 -2.501 -12.828 1.00 0.00 N ATOM 956 CA ALA A 64 -21.907 -2.352 -14.190 1.00 0.00 C ATOM 957 C ALA A 64 -21.999 -3.703 -14.892 1.00 0.00 C ATOM 958 O ALA A 64 -22.942 -3.963 -15.639 1.00 0.00 O ATOM 959 CB ALA A 64 -21.012 -1.407 -14.977 1.00 0.00 C ATOM 0 H ALA A 64 -21.078 -3.438 -12.601 1.00 0.00 H new ATOM 0 HA ALA A 64 -22.910 -1.928 -14.140 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -21.394 -1.305 -15.993 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -21.000 -0.430 -14.494 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -19.999 -1.808 -15.009 1.00 0.00 H new ATOM 965 N PHE A 65 -21.014 -4.560 -14.647 1.00 0.00 N ATOM 966 CA PHE A 65 -20.983 -5.885 -15.256 1.00 0.00 C ATOM 967 C PHE A 65 -20.877 -6.972 -14.191 1.00 0.00 C ATOM 968 O PHE A 65 -21.167 -8.139 -14.448 1.00 0.00 O ATOM 969 CB PHE A 65 -19.809 -5.994 -16.231 1.00 0.00 C ATOM 970 CG PHE A 65 -19.042 -4.712 -16.392 1.00 0.00 C ATOM 971 CD1 PHE A 65 -19.694 -3.537 -16.731 1.00 0.00 C ATOM 972 CD2 PHE A 65 -17.670 -4.682 -16.203 1.00 0.00 C ATOM 973 CE1 PHE A 65 -18.991 -2.357 -16.880 1.00 0.00 C ATOM 974 CE2 PHE A 65 -16.961 -3.504 -16.350 1.00 0.00 C ATOM 975 CZ PHE A 65 -17.623 -2.340 -16.688 1.00 0.00 C ATOM 0 H PHE A 65 -20.226 -4.361 -14.031 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.915 -6.027 -15.803 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.130 -6.773 -15.884 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -20.184 -6.308 -17.205 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.764 -3.544 -16.880 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -17.148 -5.589 -15.938 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.511 -1.448 -17.146 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -15.891 -3.494 -16.201 1.00 0.00 H new ATOM 0 HZ PHE A 65 -17.072 -1.418 -16.802 1.00 0.00 H new ATOM 985 N GLY A 66 -20.458 -6.578 -12.992 1.00 0.00 N ATOM 986 CA GLY A 66 -20.319 -7.530 -11.905 1.00 0.00 C ATOM 987 C GLY A 66 -19.077 -7.283 -11.073 1.00 0.00 C ATOM 988 O GLY A 66 -18.661 -6.139 -10.887 1.00 0.00 O ATOM 0 H GLY A 66 -20.212 -5.617 -12.754 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.199 -7.475 -11.264 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.284 -8.540 -12.313 1.00 0.00 H new ATOM 992 N THR A 67 -18.481 -8.359 -10.567 1.00 0.00 N ATOM 993 CA THR A 67 -17.281 -8.254 -9.748 1.00 0.00 C ATOM 994 C THR A 67 -16.194 -9.203 -10.240 1.00 0.00 C ATOM 995 O THR A 67 -16.387 -10.419 -10.273 1.00 0.00 O ATOM 996 CB THR A 67 -17.582 -8.560 -8.268 1.00 0.00 C ATOM 997 OG1 THR A 67 -18.753 -7.849 -7.850 1.00 0.00 O ATOM 998 CG2 THR A 67 -16.405 -8.174 -7.385 1.00 0.00 C ATOM 0 H THR A 67 -18.811 -9.313 -10.711 1.00 0.00 H new ATOM 0 HA THR A 67 -16.929 -7.226 -9.835 1.00 0.00 H new ATOM 0 HB THR A 67 -17.753 -9.632 -8.168 1.00 0.00 H new ATOM 0 HG1 THR A 67 -18.939 -8.050 -6.909 1.00 0.00 H new ATOM 0 HG21 THR A 67 -16.641 -8.399 -6.345 1.00 0.00 H new ATOM 0 HG22 THR A 67 -15.523 -8.738 -7.687 1.00 0.00 H new ATOM 0 HG23 THR A 67 -16.206 -7.107 -7.489 1.00 0.00 H new ATOM 1006 N TYR A 68 -15.053 -8.641 -10.621 1.00 0.00 N ATOM 1007 CA TYR A 68 -13.935 -9.438 -11.113 1.00 0.00 C ATOM 1008 C TYR A 68 -12.970 -9.781 -9.982 1.00 0.00 C ATOM 1009 O TYR A 68 -12.631 -8.929 -9.160 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.194 -8.686 -12.220 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.612 -9.096 -13.614 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.362 -10.377 -14.088 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.259 -8.200 -14.457 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -13.741 -10.755 -15.361 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -14.644 -8.570 -15.732 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.382 -9.848 -16.179 1.00 0.00 C ATOM 1017 OH TYR A 68 -14.763 -10.221 -17.448 1.00 0.00 O ATOM 0 H TYR A 68 -14.877 -7.636 -10.599 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.335 -10.367 -11.519 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.365 -7.616 -12.098 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -12.123 -8.853 -12.107 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.862 -11.091 -13.450 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.464 -7.198 -14.110 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.537 -11.755 -15.714 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.147 -7.862 -16.374 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.203 -9.466 -17.893 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.532 -11.035 -9.946 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.605 -11.492 -8.918 1.00 0.00 C ATOM 1029 C VAL A 69 -10.494 -12.345 -9.520 1.00 0.00 C ATOM 1030 O VAL A 69 -10.734 -13.148 -10.422 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.330 -12.306 -7.830 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.584 -12.215 -6.508 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.766 -11.828 -7.676 1.00 0.00 C ATOM 0 H VAL A 69 -12.804 -11.753 -10.617 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.170 -10.601 -8.465 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.350 -13.352 -8.136 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.111 -12.796 -5.752 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.576 -12.610 -6.631 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.529 -11.173 -6.192 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.264 -12.414 -6.903 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.771 -10.775 -7.393 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.294 -11.952 -8.622 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.278 -12.166 -9.015 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.130 -12.920 -9.502 1.00 0.00 C ATOM 1045 C ILE A 70 -7.167 -13.249 -8.366 1.00 0.00 C ATOM 1046 O ILE A 70 -6.511 -12.364 -7.819 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.371 -12.147 -10.596 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.353 -11.379 -11.483 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.529 -13.100 -11.431 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -7.860 -11.180 -12.899 1.00 0.00 C ATOM 0 H ILE A 70 -9.063 -11.505 -8.269 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.518 -13.846 -9.927 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.705 -11.429 -10.117 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -9.302 -11.915 -11.509 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -8.549 -10.405 -11.035 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -5.999 -12.538 -12.200 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.808 -13.606 -10.789 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.176 -13.839 -11.903 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.607 -10.628 -13.470 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.927 -10.617 -12.884 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.691 -12.151 -13.365 1.00 0.00 H new ATOM 1062 N ASN A 71 -7.086 -14.530 -8.018 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.202 -14.976 -6.948 1.00 0.00 C ATOM 1064 C ASN A 71 -5.132 -15.922 -7.486 1.00 0.00 C ATOM 1065 O ASN A 71 -5.293 -16.517 -8.552 1.00 0.00 O ATOM 1066 CB ASN A 71 -7.008 -15.672 -5.849 1.00 0.00 C ATOM 1067 CG ASN A 71 -6.297 -16.891 -5.295 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -5.215 -16.784 -4.717 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -6.904 -18.060 -5.469 1.00 0.00 N ATOM 0 H ASN A 71 -7.622 -15.276 -8.461 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.709 -14.099 -6.528 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -7.198 -14.967 -5.040 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -7.978 -15.970 -6.247 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -6.474 -18.915 -5.117 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -7.800 -18.102 -5.954 1.00 0.00 H new ATOM 1076 N LYS A 72 -4.041 -16.058 -6.740 1.00 0.00 N ATOM 1077 CA LYS A 72 -2.945 -16.932 -7.139 1.00 0.00 C ATOM 1078 C LYS A 72 -2.240 -17.514 -5.918 1.00 0.00 C ATOM 1079 O LYS A 72 -1.023 -17.402 -5.781 1.00 0.00 O ATOM 1080 CB LYS A 72 -1.941 -16.165 -8.003 1.00 0.00 C ATOM 1081 CG LYS A 72 -0.840 -17.039 -8.578 1.00 0.00 C ATOM 1082 CD LYS A 72 -1.398 -18.323 -9.168 1.00 0.00 C ATOM 1083 CE LYS A 72 -1.317 -19.473 -8.177 1.00 0.00 C ATOM 1084 NZ LYS A 72 0.028 -19.566 -7.544 1.00 0.00 N ATOM 0 H LYS A 72 -3.892 -15.573 -5.855 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.363 -17.753 -7.721 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.474 -15.681 -8.822 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.490 -15.374 -7.405 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.302 -16.487 -9.349 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.120 -17.280 -7.796 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.436 -18.168 -9.463 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.845 -18.580 -10.071 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.074 -19.340 -7.404 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.544 -20.409 -8.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.505 -20.432 -7.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.596 -18.737 -7.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.076 -19.593 -6.510 1.00 0.00 H new ATOM 1098 N GLN A 73 -3.015 -18.136 -5.034 1.00 0.00 N ATOM 1099 CA GLN A 73 -2.463 -18.735 -3.825 1.00 0.00 C ATOM 1100 C GLN A 73 -3.348 -19.875 -3.330 1.00 0.00 C ATOM 1101 O GLN A 73 -3.638 -19.997 -2.140 1.00 0.00 O ATOM 1102 CB GLN A 73 -2.313 -17.678 -2.729 1.00 0.00 C ATOM 1103 CG GLN A 73 -1.572 -18.178 -1.500 1.00 0.00 C ATOM 1104 CD GLN A 73 -0.914 -17.057 -0.719 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -0.698 -15.964 -1.243 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -0.592 -17.322 0.542 1.00 0.00 N ATOM 0 H GLN A 73 -4.025 -18.238 -5.133 1.00 0.00 H new ATOM 0 HA GLN A 73 -1.480 -19.140 -4.066 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.784 -16.816 -3.137 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.303 -17.333 -2.431 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -2.269 -18.708 -0.851 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -0.812 -18.897 -1.806 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -0.789 -18.242 0.936 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -0.148 -16.606 1.116 1.00 0.00 H new ATOM 1115 N PRO A 74 -3.789 -20.730 -4.265 1.00 0.00 N ATOM 1116 CA PRO A 74 -4.647 -21.876 -3.947 1.00 0.00 C ATOM 1117 C PRO A 74 -3.906 -22.956 -3.167 1.00 0.00 C ATOM 1118 O PRO A 74 -2.685 -22.921 -3.018 1.00 0.00 O ATOM 1119 CB PRO A 74 -5.063 -22.400 -5.324 1.00 0.00 C ATOM 1120 CG PRO A 74 -3.973 -21.961 -6.241 1.00 0.00 C ATOM 1121 CD PRO A 74 -3.484 -20.646 -5.703 1.00 0.00 C ATOM 0 HA PRO A 74 -5.487 -21.593 -3.312 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -5.165 -23.485 -5.321 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -6.026 -21.991 -5.629 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.168 -22.695 -6.269 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.341 -21.853 -7.261 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.417 -20.511 -5.880 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.994 -19.805 -6.173 1.00 0.00 H new ATOM 1129 N PRO A 75 -4.661 -23.941 -2.657 1.00 0.00 N ATOM 1130 CA PRO A 75 -4.096 -25.052 -1.885 1.00 0.00 C ATOM 1131 C PRO A 75 -3.270 -25.999 -2.749 1.00 0.00 C ATOM 1132 O PRO A 75 -2.769 -27.014 -2.269 1.00 0.00 O ATOM 1133 CB PRO A 75 -5.333 -25.769 -1.338 1.00 0.00 C ATOM 1134 CG PRO A 75 -6.420 -25.435 -2.300 1.00 0.00 C ATOM 1135 CD PRO A 75 -6.123 -24.047 -2.796 1.00 0.00 C ATOM 0 HA PRO A 75 -3.411 -24.704 -1.112 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -5.173 -26.846 -1.279 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -5.576 -25.428 -0.332 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.443 -26.147 -3.125 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -7.396 -25.476 -1.816 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -6.439 -23.914 -3.831 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -6.639 -23.290 -2.205 1.00 0.00 H new ATOM 1143 N ASN A 76 -3.132 -25.658 -4.026 1.00 0.00 N ATOM 1144 CA ASN A 76 -2.367 -26.479 -4.958 1.00 0.00 C ATOM 1145 C ASN A 76 -1.328 -25.639 -5.695 1.00 0.00 C ATOM 1146 O ASN A 76 -0.154 -25.618 -5.324 1.00 0.00 O ATOM 1147 CB ASN A 76 -3.302 -27.152 -5.964 1.00 0.00 C ATOM 1148 CG ASN A 76 -3.727 -28.539 -5.521 1.00 0.00 C ATOM 1149 OD1 ASN A 76 -3.205 -29.543 -6.004 1.00 0.00 O ATOM 1150 ND2 ASN A 76 -4.679 -28.599 -4.598 1.00 0.00 N ATOM 0 H ASN A 76 -3.540 -24.819 -4.439 1.00 0.00 H new ATOM 0 HA ASN A 76 -1.848 -27.247 -4.385 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -4.187 -26.531 -6.105 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -2.803 -27.219 -6.931 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -5.006 -29.504 -4.261 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -5.083 -27.740 -4.226 1.00 0.00 H new ATOM 1157 N LYS A 77 -1.767 -24.948 -6.741 1.00 0.00 N ATOM 1158 CA LYS A 77 -0.877 -24.105 -7.530 1.00 0.00 C ATOM 1159 C LYS A 77 -1.516 -23.742 -8.867 1.00 0.00 C ATOM 1160 O LYS A 77 -1.244 -24.376 -9.886 1.00 0.00 O ATOM 1161 CB LYS A 77 0.457 -24.816 -7.766 1.00 0.00 C ATOM 1162 CG LYS A 77 1.216 -24.300 -8.976 1.00 0.00 C ATOM 1163 CD LYS A 77 1.184 -25.299 -10.121 1.00 0.00 C ATOM 1164 CE LYS A 77 2.430 -26.172 -10.134 1.00 0.00 C ATOM 1165 NZ LYS A 77 2.115 -27.583 -10.487 1.00 0.00 N ATOM 0 H LYS A 77 -2.735 -24.955 -7.062 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.697 -23.186 -6.972 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.082 -24.702 -6.880 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.273 -25.883 -7.891 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.782 -23.355 -9.304 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.250 -24.096 -8.698 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.298 -25.928 -10.032 1.00 0.00 H new ATOM 0 HD3 LYS A 77 1.102 -24.766 -11.068 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.147 -25.770 -10.850 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.906 -26.140 -9.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.990 -28.145 -10.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.450 -27.975 -9.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.684 -27.616 -11.433 1.00 0.00 H new ATOM 1179 N GLN A 78 -2.363 -22.718 -8.855 1.00 0.00 N ATOM 1180 CA GLN A 78 -3.039 -22.272 -10.068 1.00 0.00 C ATOM 1181 C GLN A 78 -3.631 -20.879 -9.880 1.00 0.00 C ATOM 1182 O GLN A 78 -3.722 -20.379 -8.758 1.00 0.00 O ATOM 1183 CB GLN A 78 -4.140 -23.260 -10.456 1.00 0.00 C ATOM 1184 CG GLN A 78 -3.652 -24.402 -11.333 1.00 0.00 C ATOM 1185 CD GLN A 78 -3.743 -25.748 -10.642 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -4.827 -26.191 -10.260 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -2.602 -26.407 -10.476 1.00 0.00 N ATOM 0 H GLN A 78 -2.598 -22.182 -8.020 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.302 -22.228 -10.870 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.582 -23.673 -9.549 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.930 -22.723 -10.980 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.241 -24.428 -12.250 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.618 -24.216 -11.623 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -1.726 -26.003 -10.808 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -2.601 -27.318 -10.016 1.00 0.00 H new ATOM 1196 N ILE A 79 -4.032 -20.258 -10.984 1.00 0.00 N ATOM 1197 CA ILE A 79 -4.616 -18.924 -10.940 1.00 0.00 C ATOM 1198 C ILE A 79 -6.137 -18.986 -11.041 1.00 0.00 C ATOM 1199 O ILE A 79 -6.683 -19.493 -12.020 1.00 0.00 O ATOM 1200 CB ILE A 79 -4.074 -18.034 -12.074 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -2.916 -17.172 -11.565 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.183 -17.160 -12.638 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -2.546 -16.044 -12.502 1.00 0.00 C ATOM 0 H ILE A 79 -3.963 -20.658 -11.920 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.335 -18.488 -9.981 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.702 -18.675 -12.873 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.184 -16.754 -10.594 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.043 -17.806 -11.409 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.784 -16.537 -13.438 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.979 -17.792 -13.032 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.582 -16.524 -11.848 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.719 -15.475 -12.078 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.247 -16.455 -13.466 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.405 -15.388 -12.638 1.00 0.00 H new ATOM 1215 N TRP A 80 -6.813 -18.465 -10.024 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.272 -18.460 -9.999 1.00 0.00 C ATOM 1217 C TRP A 80 -8.820 -17.136 -10.520 1.00 0.00 C ATOM 1218 O TRP A 80 -8.453 -16.065 -10.034 1.00 0.00 O ATOM 1219 CB TRP A 80 -8.779 -18.712 -8.578 1.00 0.00 C ATOM 1220 CG TRP A 80 -9.033 -20.160 -8.287 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.228 -21.214 -8.608 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -10.172 -20.712 -7.617 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -8.797 -22.389 -8.178 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -9.989 -22.107 -7.566 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.327 -20.163 -7.053 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -10.920 -22.959 -6.975 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -12.249 -21.009 -6.467 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -12.041 -22.394 -6.431 1.00 0.00 C ATOM 0 H TRP A 80 -6.375 -18.041 -9.206 1.00 0.00 H new ATOM 0 HA TRP A 80 -8.625 -19.260 -10.650 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -8.049 -18.328 -7.866 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.700 -18.151 -8.424 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.283 -21.136 -9.124 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -8.396 -23.320 -8.296 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.496 -19.096 -7.075 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -10.762 -24.027 -6.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -13.145 -20.595 -6.029 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -12.780 -23.028 -5.965 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.700 -17.215 -11.512 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.299 -16.021 -12.100 1.00 0.00 C ATOM 1241 C LEU A 81 -11.813 -16.022 -11.908 1.00 0.00 C ATOM 1242 O LEU A 81 -12.539 -16.709 -12.626 1.00 0.00 O ATOM 1243 CB LEU A 81 -9.962 -15.938 -13.589 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.186 -14.579 -14.253 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -11.620 -14.453 -14.744 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -9.850 -13.452 -13.287 1.00 0.00 C ATOM 0 H LEU A 81 -10.015 -18.092 -11.926 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.887 -15.149 -11.592 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -8.916 -16.216 -13.720 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.559 -16.681 -14.118 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.522 -14.503 -15.114 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.760 -13.479 -15.213 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -11.826 -15.239 -15.471 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.303 -14.550 -13.900 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.015 -12.492 -13.776 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.488 -13.525 -12.406 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.805 -13.531 -12.985 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.281 -15.245 -10.937 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.708 -15.152 -10.654 1.00 0.00 C ATOM 1260 C ALA A 82 -14.377 -14.108 -11.542 1.00 0.00 C ATOM 1261 O ALA A 82 -14.200 -12.906 -11.344 1.00 0.00 O ATOM 1262 CB ALA A 82 -13.935 -14.823 -9.186 1.00 0.00 C ATOM 0 H ALA A 82 -11.693 -14.671 -10.333 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.160 -16.120 -10.872 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -15.005 -14.757 -8.989 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.500 -15.607 -8.566 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.463 -13.869 -8.950 1.00 0.00 H new ATOM 1268 N SER A 83 -15.145 -14.575 -12.521 1.00 0.00 N ATOM 1269 CA SER A 83 -15.837 -13.682 -13.442 1.00 0.00 C ATOM 1270 C SER A 83 -16.784 -12.752 -12.689 1.00 0.00 C ATOM 1271 O SER A 83 -17.051 -12.927 -11.500 1.00 0.00 O ATOM 1272 CB SER A 83 -16.616 -14.490 -14.481 1.00 0.00 C ATOM 1273 OG SER A 83 -16.016 -14.388 -15.761 1.00 0.00 O ATOM 0 H SER A 83 -15.304 -15.567 -12.697 1.00 0.00 H new ATOM 0 HA SER A 83 -15.089 -13.075 -13.951 1.00 0.00 H new ATOM 0 HB2 SER A 83 -16.656 -15.536 -14.177 1.00 0.00 H new ATOM 0 HB3 SER A 83 -17.644 -14.132 -14.528 1.00 0.00 H new ATOM 0 HG SER A 83 -16.532 -14.915 -16.407 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.305 -11.740 -13.397 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.231 -10.762 -12.818 1.00 0.00 C ATOM 1281 C PRO A 84 -19.593 -11.371 -12.501 1.00 0.00 C ATOM 1282 O PRO A 84 -20.485 -10.691 -11.991 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.361 -9.703 -13.915 1.00 0.00 C ATOM 1284 CG PRO A 84 -18.051 -10.427 -15.179 1.00 0.00 C ATOM 1285 CD PRO A 84 -17.031 -11.471 -14.819 1.00 0.00 C ATOM 0 HA PRO A 84 -17.867 -10.369 -11.869 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.364 -9.278 -13.938 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.669 -8.877 -13.752 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.948 -10.885 -15.596 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -17.661 -9.744 -15.934 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.143 -12.369 -15.427 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -16.014 -11.109 -14.971 1.00 0.00 H new ATOM 1293 N LEU A 85 -19.747 -12.655 -12.806 1.00 0.00 N ATOM 1294 CA LEU A 85 -21.001 -13.356 -12.553 1.00 0.00 C ATOM 1295 C LEU A 85 -20.757 -14.646 -11.776 1.00 0.00 C ATOM 1296 O LEU A 85 -21.419 -15.657 -12.008 1.00 0.00 O ATOM 1297 CB LEU A 85 -21.709 -13.668 -13.872 1.00 0.00 C ATOM 1298 CG LEU A 85 -22.629 -12.574 -14.416 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -22.388 -12.364 -15.903 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -24.087 -12.923 -14.153 1.00 0.00 C ATOM 0 H LEU A 85 -19.019 -13.232 -13.229 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.637 -12.706 -11.952 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -20.952 -13.885 -14.625 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -22.297 -14.576 -13.740 1.00 0.00 H new ATOM 0 HG LEU A 85 -22.401 -11.643 -13.897 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -23.052 -11.582 -16.272 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -21.352 -12.067 -16.065 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -22.588 -13.292 -16.439 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -24.727 -12.133 -14.547 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -24.330 -13.865 -14.644 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -24.250 -13.020 -13.080 1.00 0.00 H new ATOM 1312 N SER A 86 -19.803 -14.602 -10.851 1.00 0.00 N ATOM 1313 CA SER A 86 -19.471 -15.767 -10.041 1.00 0.00 C ATOM 1314 C SER A 86 -19.012 -16.927 -10.919 1.00 0.00 C ATOM 1315 O SER A 86 -19.694 -17.946 -11.028 1.00 0.00 O ATOM 1316 CB SER A 86 -20.677 -16.194 -9.203 1.00 0.00 C ATOM 1317 OG SER A 86 -21.295 -15.074 -8.592 1.00 0.00 O ATOM 0 H SER A 86 -19.247 -13.772 -10.644 1.00 0.00 H new ATOM 0 HA SER A 86 -18.653 -15.493 -9.374 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.398 -16.712 -9.835 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.360 -16.901 -8.437 1.00 0.00 H new ATOM 0 HG SER A 86 -22.064 -15.373 -8.063 1.00 0.00 H new ATOM 1323 N GLY A 87 -17.851 -16.764 -11.546 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.320 -17.805 -12.407 1.00 0.00 C ATOM 1325 C GLY A 87 -15.813 -17.926 -12.309 1.00 0.00 C ATOM 1326 O GLY A 87 -15.069 -17.361 -13.111 1.00 0.00 O ATOM 0 H GLY A 87 -17.269 -15.930 -11.473 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.776 -18.759 -12.142 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.598 -17.595 -13.440 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.340 -18.678 -11.304 1.00 0.00 N ATOM 1331 CA PRO A 88 -13.907 -18.888 -11.078 1.00 0.00 C ATOM 1332 C PRO A 88 -13.272 -19.758 -12.157 1.00 0.00 C ATOM 1333 O PRO A 88 -13.823 -20.789 -12.541 1.00 0.00 O ATOM 1334 CB PRO A 88 -13.862 -19.599 -9.723 1.00 0.00 C ATOM 1335 CG PRO A 88 -15.185 -20.273 -9.604 1.00 0.00 C ATOM 1336 CD PRO A 88 -16.169 -19.381 -10.310 1.00 0.00 C ATOM 0 HA PRO A 88 -13.349 -17.952 -11.102 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -13.045 -20.320 -9.681 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -13.704 -18.891 -8.910 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.161 -21.264 -10.058 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.461 -20.408 -8.558 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.964 -19.956 -10.784 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.647 -18.685 -9.621 1.00 0.00 H new ATOM 1344 N ASN A 89 -12.109 -19.336 -12.643 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.399 -20.077 -13.679 1.00 0.00 C ATOM 1346 C ASN A 89 -10.036 -20.543 -13.177 1.00 0.00 C ATOM 1347 O ASN A 89 -9.232 -19.742 -12.698 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.226 -19.211 -14.928 1.00 0.00 C ATOM 1349 CG ASN A 89 -11.775 -19.877 -16.175 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -11.994 -21.088 -16.199 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -11.999 -19.087 -17.218 1.00 0.00 N ATOM 0 H ASN A 89 -11.638 -18.485 -12.336 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.993 -20.955 -13.934 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -11.730 -18.256 -14.777 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.168 -18.993 -15.072 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -12.368 -19.479 -18.085 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -11.803 -18.088 -17.153 1.00 0.00 H new ATOM 1358 N ARG A 90 -9.782 -21.843 -13.290 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.517 -22.416 -12.847 1.00 0.00 C ATOM 1360 C ARG A 90 -7.484 -22.388 -13.971 1.00 0.00 C ATOM 1361 O ARG A 90 -7.595 -23.129 -14.948 1.00 0.00 O ATOM 1362 CB ARG A 90 -8.724 -23.853 -12.366 1.00 0.00 C ATOM 1363 CG ARG A 90 -9.783 -23.986 -11.284 1.00 0.00 C ATOM 1364 CD ARG A 90 -9.671 -25.317 -10.557 1.00 0.00 C ATOM 1365 NE ARG A 90 -10.500 -26.349 -11.174 1.00 0.00 N ATOM 1366 CZ ARG A 90 -10.120 -27.062 -12.229 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -8.932 -26.857 -12.780 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -10.930 -27.984 -12.734 1.00 0.00 N ATOM 0 H ARG A 90 -10.436 -22.519 -13.685 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.144 -21.813 -12.019 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.005 -24.475 -13.216 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -7.778 -24.240 -11.987 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -9.679 -23.170 -10.569 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.774 -23.896 -11.730 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -8.631 -25.642 -10.554 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -9.968 -25.188 -9.516 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.420 -26.532 -10.774 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -8.306 -26.150 -12.394 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -8.644 -27.406 -13.590 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.845 -28.146 -12.312 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -10.638 -28.531 -13.544 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.482 -21.528 -13.825 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.431 -21.402 -14.828 1.00 0.00 C ATOM 1384 C PHE A 91 -4.171 -22.144 -14.392 1.00 0.00 C ATOM 1385 O PHE A 91 -3.795 -22.115 -13.220 1.00 0.00 O ATOM 1386 CB PHE A 91 -5.107 -19.927 -15.076 1.00 0.00 C ATOM 1387 CG PHE A 91 -6.111 -19.232 -15.950 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -5.969 -19.235 -17.329 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -7.197 -18.576 -15.394 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -6.891 -18.595 -18.135 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -8.123 -17.934 -16.196 1.00 0.00 C ATOM 1392 CZ PHE A 91 -7.970 -17.945 -17.568 1.00 0.00 C ATOM 0 H PHE A 91 -6.375 -20.908 -13.022 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.793 -21.848 -15.754 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.051 -19.410 -14.118 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.122 -19.852 -15.537 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.129 -19.743 -17.778 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.322 -18.566 -14.321 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.768 -18.603 -19.208 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -8.964 -17.425 -15.750 1.00 0.00 H new ATOM 0 HZ PHE A 91 -8.693 -17.446 -18.197 1.00 0.00 H new ATOM 1402 N ASP A 92 -3.524 -22.809 -15.343 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.307 -23.560 -15.058 1.00 0.00 C ATOM 1404 C ASP A 92 -1.075 -22.797 -15.535 1.00 0.00 C ATOM 1405 O ASP A 92 -1.123 -22.081 -16.536 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.361 -24.934 -15.727 1.00 0.00 C ATOM 1407 CG ASP A 92 -1.435 -25.936 -15.067 1.00 0.00 C ATOM 1408 OD1 ASP A 92 -0.237 -25.958 -15.418 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -1.908 -26.700 -14.199 1.00 0.00 O ATOM 0 H ASP A 92 -3.822 -22.843 -16.318 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.236 -23.693 -13.979 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.383 -25.311 -15.693 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.093 -24.834 -16.779 1.00 0.00 H new ATOM 1414 N LEU A 93 0.028 -22.954 -14.811 1.00 0.00 N ATOM 1415 CA LEU A 93 1.274 -22.279 -15.159 1.00 0.00 C ATOM 1416 C LEU A 93 1.859 -22.847 -16.448 1.00 0.00 C ATOM 1417 O LEU A 93 2.298 -23.997 -16.490 1.00 0.00 O ATOM 1418 CB LEU A 93 2.287 -22.417 -14.021 1.00 0.00 C ATOM 1419 CG LEU A 93 3.722 -22.744 -14.436 1.00 0.00 C ATOM 1420 CD1 LEU A 93 4.205 -21.771 -15.500 1.00 0.00 C ATOM 1421 CD2 LEU A 93 4.646 -22.718 -13.227 1.00 0.00 C ATOM 0 H LEU A 93 0.085 -23.542 -13.980 1.00 0.00 H new ATOM 0 HA LEU A 93 1.055 -21.223 -15.316 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.297 -21.485 -13.455 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.939 -23.197 -13.344 1.00 0.00 H new ATOM 0 HG LEU A 93 3.738 -23.749 -14.858 1.00 0.00 H new ATOM 0 HD11 LEU A 93 5.228 -22.019 -15.783 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.560 -21.840 -16.376 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.174 -20.755 -15.105 1.00 0.00 H new ATOM 0 HD21 LEU A 93 5.663 -22.953 -13.541 1.00 0.00 H new ATOM 0 HD22 LEU A 93 4.626 -21.726 -12.775 1.00 0.00 H new ATOM 0 HD23 LEU A 93 4.312 -23.456 -12.498 1.00 0.00 H new ATOM 1433 N LEU A 94 1.866 -22.032 -17.498 1.00 0.00 N ATOM 1434 CA LEU A 94 2.400 -22.453 -18.789 1.00 0.00 C ATOM 1435 C LEU A 94 3.439 -21.459 -19.298 1.00 0.00 C ATOM 1436 O LEU A 94 3.125 -20.300 -19.566 1.00 0.00 O ATOM 1437 CB LEU A 94 1.269 -22.593 -19.810 1.00 0.00 C ATOM 1438 CG LEU A 94 0.813 -24.020 -20.114 1.00 0.00 C ATOM 1439 CD1 LEU A 94 1.899 -24.780 -20.860 1.00 0.00 C ATOM 1440 CD2 LEU A 94 0.437 -24.745 -18.831 1.00 0.00 C ATOM 0 H LEU A 94 1.508 -21.077 -17.481 1.00 0.00 H new ATOM 0 HA LEU A 94 2.884 -23.421 -18.656 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.410 -22.027 -19.450 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.589 -22.129 -20.743 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.070 -23.971 -20.751 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.556 -25.794 -21.068 1.00 0.00 H new ATOM 0 HD12 LEU A 94 2.119 -24.272 -21.799 1.00 0.00 H new ATOM 0 HD13 LEU A 94 2.801 -24.820 -20.249 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.115 -25.759 -19.067 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.302 -24.784 -18.168 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.375 -24.212 -18.337 1.00 0.00 H new ATOM 1452 N ASN A 95 4.678 -21.922 -19.430 1.00 0.00 N ATOM 1453 CA ASN A 95 5.764 -21.074 -19.908 1.00 0.00 C ATOM 1454 C ASN A 95 5.764 -19.731 -19.185 1.00 0.00 C ATOM 1455 O ASN A 95 5.949 -18.682 -19.802 1.00 0.00 O ATOM 1456 CB ASN A 95 5.640 -20.854 -21.417 1.00 0.00 C ATOM 1457 CG ASN A 95 4.387 -20.083 -21.788 1.00 0.00 C ATOM 1458 OD1 ASN A 95 3.347 -20.672 -22.083 1.00 0.00 O ATOM 1459 ND2 ASN A 95 4.482 -18.758 -21.774 1.00 0.00 N ATOM 0 H ASN A 95 4.955 -22.879 -19.213 1.00 0.00 H new ATOM 0 HA ASN A 95 6.706 -21.579 -19.697 1.00 0.00 H new ATOM 0 HB2 ASN A 95 6.516 -20.313 -21.776 1.00 0.00 H new ATOM 0 HB3 ASN A 95 5.632 -21.820 -21.923 1.00 0.00 H new ATOM 0 HD21 ASN A 95 3.672 -18.186 -22.014 1.00 0.00 H new ATOM 0 HD22 ASN A 95 5.365 -18.313 -21.523 1.00 0.00 H new ATOM 1466 N GLY A 96 5.557 -19.771 -17.872 1.00 0.00 N ATOM 1467 CA GLY A 96 5.538 -18.551 -17.087 1.00 0.00 C ATOM 1468 C GLY A 96 4.273 -17.743 -17.301 1.00 0.00 C ATOM 1469 O GLY A 96 4.247 -16.541 -17.043 1.00 0.00 O ATOM 0 H GLY A 96 5.402 -20.626 -17.338 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.631 -18.801 -16.030 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.403 -17.941 -17.348 1.00 0.00 H new ATOM 1473 N GLU A 97 3.223 -18.406 -17.777 1.00 0.00 N ATOM 1474 CA GLU A 97 1.951 -17.740 -18.028 1.00 0.00 C ATOM 1475 C GLU A 97 0.780 -18.648 -17.663 1.00 0.00 C ATOM 1476 O GLU A 97 0.650 -19.753 -18.190 1.00 0.00 O ATOM 1477 CB GLU A 97 1.849 -17.323 -19.497 1.00 0.00 C ATOM 1478 CG GLU A 97 2.793 -16.195 -19.877 1.00 0.00 C ATOM 1479 CD GLU A 97 2.677 -15.803 -21.337 1.00 0.00 C ATOM 1480 OE1 GLU A 97 1.719 -15.081 -21.683 1.00 0.00 O ATOM 1481 OE2 GLU A 97 3.544 -16.219 -22.134 1.00 0.00 O ATOM 0 H GLU A 97 3.229 -19.402 -17.996 1.00 0.00 H new ATOM 0 HA GLU A 97 1.907 -16.849 -17.401 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.058 -18.188 -20.127 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.825 -17.015 -19.708 1.00 0.00 H new ATOM 0 HG2 GLU A 97 2.584 -15.326 -19.254 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.819 -16.498 -19.667 1.00 0.00 H new ATOM 1488 N TRP A 98 -0.069 -18.173 -16.759 1.00 0.00 N ATOM 1489 CA TRP A 98 -1.229 -18.942 -16.322 1.00 0.00 C ATOM 1490 C TRP A 98 -2.275 -19.025 -17.429 1.00 0.00 C ATOM 1491 O TRP A 98 -3.066 -18.101 -17.619 1.00 0.00 O ATOM 1492 CB TRP A 98 -1.842 -18.313 -15.070 1.00 0.00 C ATOM 1493 CG TRP A 98 -0.835 -18.016 -14.001 1.00 0.00 C ATOM 1494 CD1 TRP A 98 -0.203 -16.825 -13.778 1.00 0.00 C ATOM 1495 CD2 TRP A 98 -0.342 -18.925 -13.011 1.00 0.00 C ATOM 1496 NE1 TRP A 98 0.653 -16.940 -12.709 1.00 0.00 N ATOM 1497 CE2 TRP A 98 0.585 -18.218 -12.220 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.595 -20.267 -12.714 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.259 -18.810 -11.155 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 0.075 -20.853 -11.657 1.00 0.00 C ATOM 1501 CH2 TRP A 98 0.992 -20.125 -10.887 1.00 0.00 C ATOM 0 H TRP A 98 0.024 -17.260 -16.314 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.896 -19.953 -16.086 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.350 -17.389 -15.348 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.600 -18.985 -14.668 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -0.354 -15.926 -14.357 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.243 -16.195 -12.340 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.302 -20.836 -13.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 1.967 -18.251 -10.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 -0.111 -21.890 -11.420 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.498 -20.611 -10.066 1.00 0.00 H new ATOM 1512 N VAL A 99 -2.274 -20.137 -18.156 1.00 0.00 N ATOM 1513 CA VAL A 99 -3.224 -20.341 -19.243 1.00 0.00 C ATOM 1514 C VAL A 99 -4.087 -21.573 -18.995 1.00 0.00 C ATOM 1515 O VAL A 99 -3.718 -22.457 -18.223 1.00 0.00 O ATOM 1516 CB VAL A 99 -2.504 -20.495 -20.596 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -1.488 -19.381 -20.791 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -1.837 -21.859 -20.691 1.00 0.00 C ATOM 0 H VAL A 99 -1.626 -20.911 -18.012 1.00 0.00 H new ATOM 0 HA VAL A 99 -3.860 -19.457 -19.277 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.244 -20.421 -21.392 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.990 -19.507 -21.752 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.996 -18.417 -20.769 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.748 -19.419 -19.991 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.333 -21.951 -21.653 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.108 -21.964 -19.888 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.592 -22.640 -20.600 1.00 0.00 H new ATOM 1528 N SER A 100 -5.239 -21.624 -19.656 1.00 0.00 N ATOM 1529 CA SER A 100 -6.158 -22.746 -19.505 1.00 0.00 C ATOM 1530 C SER A 100 -6.163 -23.617 -20.758 1.00 0.00 C ATOM 1531 O SER A 100 -6.142 -23.110 -21.881 1.00 0.00 O ATOM 1532 CB SER A 100 -7.572 -22.240 -19.217 1.00 0.00 C ATOM 1533 OG SER A 100 -7.968 -22.557 -17.894 1.00 0.00 O ATOM 0 H SER A 100 -5.558 -20.901 -20.301 1.00 0.00 H new ATOM 0 HA SER A 100 -5.818 -23.351 -18.664 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.612 -21.161 -19.363 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.272 -22.684 -19.925 1.00 0.00 H new ATOM 0 HG SER A 100 -8.875 -22.221 -17.735 1.00 0.00 H new ATOM 1539 N LEU A 101 -6.190 -24.930 -20.559 1.00 0.00 N ATOM 1540 CA LEU A 101 -6.197 -25.873 -21.672 1.00 0.00 C ATOM 1541 C LEU A 101 -6.979 -25.312 -22.855 1.00 0.00 C ATOM 1542 O LEU A 101 -6.521 -25.367 -23.997 1.00 0.00 O ATOM 1543 CB LEU A 101 -6.803 -27.207 -21.232 1.00 0.00 C ATOM 1544 CG LEU A 101 -6.814 -28.318 -22.282 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -5.456 -28.427 -22.958 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -7.205 -29.646 -21.649 1.00 0.00 C ATOM 0 H LEU A 101 -6.207 -25.366 -19.637 1.00 0.00 H new ATOM 0 HA LEU A 101 -5.166 -26.035 -21.986 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.253 -27.563 -20.361 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -7.829 -27.029 -20.910 1.00 0.00 H new ATOM 0 HG LEU A 101 -7.555 -28.068 -23.041 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.483 -29.223 -23.702 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -5.215 -27.482 -23.446 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.695 -28.654 -22.211 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -7.208 -30.425 -22.411 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.488 -29.903 -20.870 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -8.200 -29.562 -21.212 1.00 0.00 H new ATOM 1558 N ARG A 102 -8.160 -24.771 -22.575 1.00 0.00 N ATOM 1559 CA ARG A 102 -9.005 -24.199 -23.616 1.00 0.00 C ATOM 1560 C ARG A 102 -8.161 -23.511 -24.684 1.00 0.00 C ATOM 1561 O ARG A 102 -7.815 -22.337 -24.556 1.00 0.00 O ATOM 1562 CB ARG A 102 -9.992 -23.200 -23.009 1.00 0.00 C ATOM 1563 CG ARG A 102 -10.891 -22.531 -24.037 1.00 0.00 C ATOM 1564 CD ARG A 102 -12.279 -23.151 -24.051 1.00 0.00 C ATOM 1565 NE ARG A 102 -12.989 -22.934 -22.794 1.00 0.00 N ATOM 1566 CZ ARG A 102 -14.310 -23.002 -22.674 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -15.061 -23.282 -23.730 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -14.882 -22.792 -21.495 1.00 0.00 N ATOM 0 H ARG A 102 -8.553 -24.717 -21.635 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.562 -25.011 -24.084 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -10.613 -23.715 -22.276 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.435 -22.433 -22.472 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.969 -21.467 -23.816 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.442 -22.619 -25.026 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.857 -22.726 -24.872 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.196 -24.221 -24.240 1.00 0.00 H new ATOM 0 HE ARG A 102 -12.440 -22.718 -21.962 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.625 -23.446 -24.637 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -16.075 -23.334 -23.635 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -14.307 -22.578 -20.680 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -15.897 -22.844 -21.404 1.00 0.00 H new ATOM 1582 N ASN A 103 -7.832 -24.250 -25.738 1.00 0.00 N ATOM 1583 CA ASN A 103 -7.027 -23.712 -26.829 1.00 0.00 C ATOM 1584 C ASN A 103 -5.939 -22.785 -26.296 1.00 0.00 C ATOM 1585 O ASN A 103 -5.490 -21.873 -26.989 1.00 0.00 O ATOM 1586 CB ASN A 103 -7.914 -22.958 -27.821 1.00 0.00 C ATOM 1587 CG ASN A 103 -7.322 -22.924 -29.217 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -6.108 -22.802 -29.385 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -8.179 -23.032 -30.226 1.00 0.00 N ATOM 0 H ASN A 103 -8.110 -25.224 -25.860 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.549 -24.547 -27.341 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -8.896 -23.430 -27.857 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.063 -21.938 -27.468 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -7.839 -23.016 -31.188 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -9.177 -23.131 -30.039 1.00 0.00 H new ATOM 1596 N GLY A 104 -5.518 -23.026 -25.057 1.00 0.00 N ATOM 1597 CA GLY A 104 -4.486 -22.205 -24.452 1.00 0.00 C ATOM 1598 C GLY A 104 -4.934 -20.772 -24.242 1.00 0.00 C ATOM 1599 O GLY A 104 -4.444 -19.856 -24.904 1.00 0.00 O ATOM 0 H GLY A 104 -5.873 -23.775 -24.463 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -4.198 -22.637 -23.493 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -3.599 -22.216 -25.086 1.00 0.00 H new ATOM 1603 N THR A 105 -5.870 -20.575 -23.318 1.00 0.00 N ATOM 1604 CA THR A 105 -6.386 -19.244 -23.025 1.00 0.00 C ATOM 1605 C THR A 105 -5.605 -18.589 -21.891 1.00 0.00 C ATOM 1606 O THR A 105 -5.409 -19.186 -20.833 1.00 0.00 O ATOM 1607 CB THR A 105 -7.878 -19.291 -22.645 1.00 0.00 C ATOM 1608 OG1 THR A 105 -8.168 -20.509 -21.950 1.00 0.00 O ATOM 1609 CG2 THR A 105 -8.755 -19.187 -23.884 1.00 0.00 C ATOM 0 H THR A 105 -6.286 -21.321 -22.760 1.00 0.00 H new ATOM 0 HA THR A 105 -6.268 -18.652 -23.933 1.00 0.00 H new ATOM 0 HB THR A 105 -8.092 -18.442 -21.995 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.071 -20.463 -21.572 1.00 0.00 H new ATOM 0 HG21 THR A 105 -9.804 -19.222 -23.591 1.00 0.00 H new ATOM 0 HG22 THR A 105 -8.552 -18.246 -24.395 1.00 0.00 H new ATOM 0 HG23 THR A 105 -8.537 -20.018 -24.555 1.00 0.00 H new ATOM 1617 N LYS A 106 -5.162 -17.357 -22.119 1.00 0.00 N ATOM 1618 CA LYS A 106 -4.403 -16.619 -21.117 1.00 0.00 C ATOM 1619 C LYS A 106 -5.327 -15.755 -20.263 1.00 0.00 C ATOM 1620 O LYS A 106 -6.324 -15.223 -20.753 1.00 0.00 O ATOM 1621 CB LYS A 106 -3.346 -15.742 -21.791 1.00 0.00 C ATOM 1622 CG LYS A 106 -3.183 -16.017 -23.275 1.00 0.00 C ATOM 1623 CD LYS A 106 -1.782 -15.678 -23.756 1.00 0.00 C ATOM 1624 CE LYS A 106 -1.792 -14.498 -24.715 1.00 0.00 C ATOM 1625 NZ LYS A 106 -1.921 -13.200 -23.996 1.00 0.00 N ATOM 0 H LYS A 106 -5.316 -16.849 -22.990 1.00 0.00 H new ATOM 0 HA LYS A 106 -3.907 -17.341 -20.469 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.613 -14.694 -21.652 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -2.388 -15.896 -21.294 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -3.393 -17.067 -23.476 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.912 -15.433 -23.836 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -1.148 -15.447 -22.900 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -1.346 -16.546 -24.250 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -0.873 -14.499 -25.301 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -2.618 -14.608 -25.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -1.278 -12.502 -24.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.900 -12.858 -24.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -1.675 -13.332 -22.994 1.00 0.00 H new ATOM 1639 N LEU A 107 -4.988 -15.618 -18.986 1.00 0.00 N ATOM 1640 CA LEU A 107 -5.787 -14.817 -18.065 1.00 0.00 C ATOM 1641 C LEU A 107 -6.122 -13.459 -18.674 1.00 0.00 C ATOM 1642 O LEU A 107 -7.251 -13.220 -19.104 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.038 -14.625 -16.744 1.00 0.00 C ATOM 1644 CG LEU A 107 -5.745 -13.773 -15.690 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -7.227 -14.109 -15.638 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -5.103 -13.973 -14.325 1.00 0.00 C ATOM 0 H LEU A 107 -4.166 -16.051 -18.565 1.00 0.00 H new ATOM 0 HA LEU A 107 -6.719 -15.349 -17.874 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.840 -15.607 -16.315 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.071 -14.171 -16.960 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.641 -12.724 -15.969 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.714 -13.493 -14.882 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.679 -13.914 -16.611 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.353 -15.161 -15.384 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -5.619 -13.359 -13.587 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.176 -15.022 -14.039 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.054 -13.681 -14.370 1.00 0.00 H new ATOM 1658 N THR A 108 -5.132 -12.571 -18.709 1.00 0.00 N ATOM 1659 CA THR A 108 -5.321 -11.238 -19.266 1.00 0.00 C ATOM 1660 C THR A 108 -6.070 -11.298 -20.593 1.00 0.00 C ATOM 1661 O THR A 108 -6.663 -10.310 -21.027 1.00 0.00 O ATOM 1662 CB THR A 108 -3.974 -10.523 -19.482 1.00 0.00 C ATOM 1663 OG1 THR A 108 -4.194 -9.133 -19.743 1.00 0.00 O ATOM 1664 CG2 THR A 108 -3.210 -11.147 -20.640 1.00 0.00 C ATOM 0 H THR A 108 -4.192 -12.752 -18.358 1.00 0.00 H new ATOM 0 HA THR A 108 -5.911 -10.674 -18.543 1.00 0.00 H new ATOM 0 HB THR A 108 -3.380 -10.632 -18.575 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.333 -8.685 -19.878 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.262 -10.626 -20.774 1.00 0.00 H new ATOM 0 HG22 THR A 108 -3.019 -12.198 -20.425 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.801 -11.065 -21.552 1.00 0.00 H new ATOM 1672 N ASP A 109 -6.041 -12.462 -21.232 1.00 0.00 N ATOM 1673 CA ASP A 109 -6.719 -12.651 -22.509 1.00 0.00 C ATOM 1674 C ASP A 109 -8.222 -12.816 -22.306 1.00 0.00 C ATOM 1675 O ASP A 109 -9.024 -12.193 -23.003 1.00 0.00 O ATOM 1676 CB ASP A 109 -6.153 -13.871 -23.236 1.00 0.00 C ATOM 1677 CG ASP A 109 -5.700 -13.547 -24.646 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -6.571 -13.354 -25.520 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -4.474 -13.485 -24.875 1.00 0.00 O ATOM 0 H ASP A 109 -5.555 -13.289 -20.886 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.548 -11.764 -23.118 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.311 -14.269 -22.670 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.912 -14.653 -23.272 1.00 0.00 H new ATOM 1684 N ILE A 110 -8.596 -13.659 -21.350 1.00 0.00 N ATOM 1685 CA ILE A 110 -10.002 -13.905 -21.056 1.00 0.00 C ATOM 1686 C ILE A 110 -10.614 -12.742 -20.282 1.00 0.00 C ATOM 1687 O ILE A 110 -11.803 -12.450 -20.416 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.190 -15.201 -20.246 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -10.542 -16.364 -21.177 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -11.269 -15.015 -19.190 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -10.203 -17.722 -20.603 1.00 0.00 C ATOM 0 H ILE A 110 -7.945 -14.183 -20.766 1.00 0.00 H new ATOM 0 HA ILE A 110 -10.511 -14.008 -22.014 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.253 -15.435 -19.741 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.608 -16.329 -21.401 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -10.013 -16.236 -22.121 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -11.390 -15.940 -18.626 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -10.980 -14.212 -18.512 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -12.212 -14.760 -19.674 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.480 -18.498 -21.317 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.133 -17.776 -20.405 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -10.752 -17.872 -19.673 1.00 0.00 H new ATOM 1703 N LEU A 111 -9.794 -12.081 -19.473 1.00 0.00 N ATOM 1704 CA LEU A 111 -10.253 -10.947 -18.678 1.00 0.00 C ATOM 1705 C LEU A 111 -10.426 -9.706 -19.549 1.00 0.00 C ATOM 1706 O LEU A 111 -11.370 -8.936 -19.371 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.264 -10.657 -17.548 1.00 0.00 C ATOM 1708 CG LEU A 111 -9.877 -10.378 -16.175 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -10.677 -9.085 -16.200 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -10.754 -11.542 -15.736 1.00 0.00 C ATOM 0 H LEU A 111 -8.808 -12.310 -19.350 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.221 -11.205 -18.248 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.588 -11.507 -17.456 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.658 -9.798 -17.834 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.068 -10.266 -15.453 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.106 -8.903 -15.214 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -10.022 -8.257 -16.469 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.478 -9.167 -16.934 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.182 -11.326 -14.757 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.557 -11.686 -16.459 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.152 -12.449 -15.677 1.00 0.00 H new ATOM 1722 N THR A 112 -9.509 -9.519 -20.493 1.00 0.00 N ATOM 1723 CA THR A 112 -9.560 -8.373 -21.391 1.00 0.00 C ATOM 1724 C THR A 112 -10.658 -8.541 -22.435 1.00 0.00 C ATOM 1725 O THR A 112 -11.352 -7.585 -22.779 1.00 0.00 O ATOM 1726 CB THR A 112 -8.214 -8.161 -22.109 1.00 0.00 C ATOM 1727 OG1 THR A 112 -8.163 -6.849 -22.679 1.00 0.00 O ATOM 1728 CG2 THR A 112 -8.012 -9.202 -23.200 1.00 0.00 C ATOM 0 H THR A 112 -8.722 -10.147 -20.655 1.00 0.00 H new ATOM 0 HA THR A 112 -9.777 -7.500 -20.776 1.00 0.00 H new ATOM 0 HB THR A 112 -7.416 -8.268 -21.375 1.00 0.00 H new ATOM 0 HG1 THR A 112 -7.303 -6.722 -23.132 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.055 -9.032 -23.693 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.020 -10.198 -22.758 1.00 0.00 H new ATOM 0 HG23 THR A 112 -8.816 -9.123 -23.932 1.00 0.00 H new ATOM 1736 N GLU A 113 -10.811 -9.764 -22.935 1.00 0.00 N ATOM 1737 CA GLU A 113 -11.825 -10.056 -23.941 1.00 0.00 C ATOM 1738 C GLU A 113 -13.214 -10.116 -23.311 1.00 0.00 C ATOM 1739 O GLU A 113 -14.198 -9.687 -23.912 1.00 0.00 O ATOM 1740 CB GLU A 113 -11.514 -11.380 -24.642 1.00 0.00 C ATOM 1741 CG GLU A 113 -10.261 -11.334 -25.500 1.00 0.00 C ATOM 1742 CD GLU A 113 -10.571 -11.190 -26.978 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -11.242 -10.204 -27.349 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -10.144 -12.063 -27.762 1.00 0.00 O ATOM 0 H GLU A 113 -10.246 -10.567 -22.660 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.812 -9.252 -24.677 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.401 -12.162 -23.891 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.362 -11.659 -25.267 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -9.637 -10.500 -25.180 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.683 -12.244 -25.341 1.00 0.00 H new ATOM 1751 N GLU A 114 -13.284 -10.651 -22.096 1.00 0.00 N ATOM 1752 CA GLU A 114 -14.552 -10.769 -21.385 1.00 0.00 C ATOM 1753 C GLU A 114 -15.061 -9.397 -20.952 1.00 0.00 C ATOM 1754 O GLU A 114 -16.248 -9.096 -21.076 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.395 -11.676 -20.163 1.00 0.00 C ATOM 1756 CG GLU A 114 -15.698 -11.936 -19.427 1.00 0.00 C ATOM 1757 CD GLU A 114 -16.461 -13.120 -19.990 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -15.820 -14.001 -20.600 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -17.697 -13.164 -19.822 1.00 0.00 O ATOM 0 H GLU A 114 -12.478 -11.009 -21.584 1.00 0.00 H new ATOM 0 HA GLU A 114 -15.281 -11.211 -22.064 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.970 -12.628 -20.480 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -13.682 -11.223 -19.474 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.486 -12.113 -18.373 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -16.325 -11.046 -19.481 1.00 0.00 H new ATOM 1766 N VAL A 115 -14.155 -8.570 -20.441 1.00 0.00 N ATOM 1767 CA VAL A 115 -14.511 -7.230 -19.990 1.00 0.00 C ATOM 1768 C VAL A 115 -14.820 -6.316 -21.170 1.00 0.00 C ATOM 1769 O VAL A 115 -15.659 -5.421 -21.071 1.00 0.00 O ATOM 1770 CB VAL A 115 -13.382 -6.602 -19.150 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -13.112 -7.438 -17.909 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -12.120 -6.449 -19.985 1.00 0.00 C ATOM 0 H VAL A 115 -13.169 -8.804 -20.329 1.00 0.00 H new ATOM 0 HA VAL A 115 -15.402 -7.331 -19.370 1.00 0.00 H new ATOM 0 HB VAL A 115 -13.700 -5.610 -18.828 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -12.312 -6.979 -17.328 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -14.016 -7.491 -17.302 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -12.814 -8.444 -18.206 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -11.333 -6.004 -19.376 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -11.796 -7.428 -20.338 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -12.325 -5.805 -20.840 1.00 0.00 H new ATOM 1782 N GLU A 116 -14.137 -6.549 -22.286 1.00 0.00 N ATOM 1783 CA GLU A 116 -14.339 -5.745 -23.486 1.00 0.00 C ATOM 1784 C GLU A 116 -15.697 -6.041 -24.117 1.00 0.00 C ATOM 1785 O GLU A 116 -16.424 -5.128 -24.511 1.00 0.00 O ATOM 1786 CB GLU A 116 -13.225 -6.012 -24.500 1.00 0.00 C ATOM 1787 CG GLU A 116 -13.172 -4.996 -25.628 1.00 0.00 C ATOM 1788 CD GLU A 116 -11.892 -5.088 -26.436 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -10.803 -4.967 -25.837 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -11.979 -5.280 -27.667 1.00 0.00 O ATOM 0 H GLU A 116 -13.440 -7.287 -22.384 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.313 -4.694 -23.197 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.266 -6.016 -23.981 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -13.362 -7.007 -24.924 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -14.026 -5.147 -26.288 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -13.264 -3.992 -25.213 1.00 0.00 H new ATOM 1797 N LYS A 117 -16.033 -7.323 -24.209 1.00 0.00 N ATOM 1798 CA LYS A 117 -17.303 -7.742 -24.791 1.00 0.00 C ATOM 1799 C LYS A 117 -18.433 -7.624 -23.772 1.00 0.00 C ATOM 1800 O LYS A 117 -19.609 -7.658 -24.130 1.00 0.00 O ATOM 1801 CB LYS A 117 -17.205 -9.183 -25.296 1.00 0.00 C ATOM 1802 CG LYS A 117 -16.158 -9.378 -26.379 1.00 0.00 C ATOM 1803 CD LYS A 117 -16.288 -10.739 -27.041 1.00 0.00 C ATOM 1804 CE LYS A 117 -15.789 -11.851 -26.131 1.00 0.00 C ATOM 1805 NZ LYS A 117 -14.530 -12.462 -26.641 1.00 0.00 N ATOM 0 H LYS A 117 -15.443 -8.091 -23.888 1.00 0.00 H new ATOM 0 HA LYS A 117 -17.525 -7.084 -25.631 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.974 -9.838 -24.456 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -18.177 -9.491 -25.682 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -16.261 -8.595 -27.131 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -15.163 -9.276 -25.947 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -17.331 -10.920 -27.301 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -15.721 -10.748 -27.972 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -15.620 -11.453 -25.130 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -16.556 -12.620 -26.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.132 -13.093 -25.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -14.733 -13.009 -27.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -13.844 -11.712 -26.861 1.00 0.00 H new ATOM 1819 N ALA A 118 -18.066 -7.486 -22.502 1.00 0.00 N ATOM 1820 CA ALA A 118 -19.049 -7.360 -21.433 1.00 0.00 C ATOM 1821 C ALA A 118 -19.482 -5.909 -21.253 1.00 0.00 C ATOM 1822 O ALA A 118 -20.609 -5.634 -20.840 1.00 0.00 O ATOM 1823 CB ALA A 118 -18.486 -7.910 -20.131 1.00 0.00 C ATOM 0 H ALA A 118 -17.096 -7.459 -22.189 1.00 0.00 H new ATOM 0 HA ALA A 118 -19.928 -7.942 -21.711 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -19.231 -7.809 -19.341 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -18.233 -8.962 -20.260 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -17.590 -7.353 -19.858 1.00 0.00 H new ATOM 1829 N ILE A 119 -18.580 -4.984 -21.565 1.00 0.00 N ATOM 1830 CA ILE A 119 -18.870 -3.562 -21.437 1.00 0.00 C ATOM 1831 C ILE A 119 -19.202 -2.945 -22.792 1.00 0.00 C ATOM 1832 O ILE A 119 -19.938 -1.961 -22.874 1.00 0.00 O ATOM 1833 CB ILE A 119 -17.685 -2.799 -20.815 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -17.251 -3.466 -19.508 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -18.058 -1.344 -20.576 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -15.962 -2.909 -18.945 1.00 0.00 C ATOM 0 H ILE A 119 -17.643 -5.194 -21.908 1.00 0.00 H new ATOM 0 HA ILE A 119 -19.734 -3.474 -20.778 1.00 0.00 H new ATOM 0 HB ILE A 119 -16.847 -2.828 -21.512 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -18.043 -3.347 -18.768 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -17.132 -4.536 -19.678 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -17.210 -0.819 -20.136 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -18.323 -0.876 -21.524 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -18.909 -1.293 -19.896 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -15.715 -3.428 -18.019 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -15.158 -3.052 -19.667 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -16.083 -1.845 -18.743 1.00 0.00 H new ATOM 1848 N SER A 120 -18.655 -3.530 -23.853 1.00 0.00 N ATOM 1849 CA SER A 120 -18.892 -3.037 -25.204 1.00 0.00 C ATOM 1850 C SER A 120 -20.024 -3.810 -25.874 1.00 0.00 C ATOM 1851 O SER A 120 -21.030 -3.230 -26.285 1.00 0.00 O ATOM 1852 CB SER A 120 -17.617 -3.151 -26.042 1.00 0.00 C ATOM 1853 OG SER A 120 -17.598 -4.359 -26.782 1.00 0.00 O ATOM 0 H SER A 120 -18.045 -4.346 -23.803 1.00 0.00 H new ATOM 0 HA SER A 120 -19.182 -1.988 -25.136 1.00 0.00 H new ATOM 0 HB2 SER A 120 -17.549 -2.303 -26.723 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.745 -3.107 -25.390 1.00 0.00 H new ATOM 0 HG SER A 120 -17.148 -5.055 -26.260 1.00 0.00 H new ATOM 1859 N LYS A 121 -19.854 -5.123 -25.980 1.00 0.00 N ATOM 1860 CA LYS A 121 -20.860 -5.978 -26.599 1.00 0.00 C ATOM 1861 C LYS A 121 -22.195 -5.861 -25.870 1.00 0.00 C ATOM 1862 O LYS A 121 -23.249 -6.153 -26.436 1.00 0.00 O ATOM 1863 CB LYS A 121 -20.392 -7.435 -26.596 1.00 0.00 C ATOM 1864 CG LYS A 121 -20.580 -8.137 -27.930 1.00 0.00 C ATOM 1865 CD LYS A 121 -21.949 -8.791 -28.028 1.00 0.00 C ATOM 1866 CE LYS A 121 -22.070 -9.645 -29.280 1.00 0.00 C ATOM 1867 NZ LYS A 121 -23.314 -10.464 -29.275 1.00 0.00 N ATOM 0 H LYS A 121 -19.028 -5.619 -25.645 1.00 0.00 H new ATOM 0 HA LYS A 121 -20.997 -5.649 -27.629 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -19.337 -7.469 -26.323 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -20.938 -7.982 -25.827 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -20.460 -7.418 -28.741 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -19.805 -8.893 -28.057 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -22.122 -9.409 -27.147 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -22.721 -8.022 -28.035 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -22.062 -9.002 -30.160 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -21.203 -10.302 -29.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -23.359 -11.032 -30.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -23.310 -11.096 -28.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -24.142 -9.837 -29.227 1.00 0.00 H new ATOM 1881 N SER A 122 -22.143 -5.431 -24.614 1.00 0.00 N ATOM 1882 CA SER A 122 -23.348 -5.277 -23.808 1.00 0.00 C ATOM 1883 C SER A 122 -24.269 -4.216 -24.404 1.00 0.00 C ATOM 1884 O SER A 122 -25.488 -4.381 -24.429 1.00 0.00 O ATOM 1885 CB SER A 122 -22.982 -4.902 -22.371 1.00 0.00 C ATOM 1886 OG SER A 122 -21.923 -3.961 -22.343 1.00 0.00 O ATOM 0 H SER A 122 -21.279 -5.183 -24.132 1.00 0.00 H new ATOM 0 HA SER A 122 -23.876 -6.230 -23.804 1.00 0.00 H new ATOM 0 HB2 SER A 122 -23.855 -4.487 -21.867 1.00 0.00 H new ATOM 0 HB3 SER A 122 -22.692 -5.797 -21.821 1.00 0.00 H new ATOM 0 HG SER A 122 -21.324 -4.165 -21.595 1.00 0.00 H new ATOM 1892 N GLN A 123 -23.674 -3.127 -24.881 1.00 0.00 N ATOM 1893 CA GLN A 123 -24.440 -2.038 -25.476 1.00 0.00 C ATOM 1894 C GLN A 123 -24.188 -1.953 -26.978 1.00 0.00 C ATOM 1895 O GLN A 123 -23.898 -0.880 -27.510 1.00 0.00 O ATOM 1896 CB GLN A 123 -24.079 -0.709 -24.810 1.00 0.00 C ATOM 1897 CG GLN A 123 -22.594 -0.388 -24.859 1.00 0.00 C ATOM 1898 CD GLN A 123 -22.323 1.090 -25.061 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -21.985 1.527 -26.161 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -22.471 1.870 -23.996 1.00 0.00 N ATOM 0 H GLN A 123 -22.665 -2.976 -24.867 1.00 0.00 H new ATOM 0 HA GLN A 123 -25.499 -2.241 -25.315 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -24.632 0.094 -25.297 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -24.403 -0.734 -23.770 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -22.124 -0.716 -23.932 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -22.131 -0.952 -25.668 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -22.753 1.466 -23.103 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -22.303 2.873 -24.071 1.00 0.00 H new