USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 603 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 104 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HE2:sc= 0.249 K(o=0.25,f=-1.7) USER MOD Single : A 101 MET CE :methyl -161:sc= 0 (180deg=-0.137) USER MOD Single : A 106 TYR OH : rot 13:sc= 1.24 USER MOD Single : A 107 CYS SG : rot -130:sc= -0.178 USER MOD Single : A 113 SER OG : rot -41:sc= 0.821 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0.174 X(o=0.17,f=0) USER MOD Single : A 128 HIS : no HD1:sc=-0.00441 X(o=-0.0044,f=-0.25) USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 134 CYS SG : rot -24:sc= -1.3 USER MOD Single : A 138 SER OG : rot -81:sc= 1.21 USER MOD Single : A 145 SER OG : rot 107:sc= -0.141 USER MOD Single : A 146 GLN : amide:sc=-0.00297 X(o=-0.003,f=0) USER MOD Single : A 149 TYR OH : rot 120:sc= 0.0377 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= 0.787 K(o=0.79,f=-7.3!) USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=-0.0026) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 170:sc= 0.0821 USER MOD Single : A 164 TYR OH : rot 174:sc= -0.0532 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.269 K(o=0.27,f=-4.6!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 62.895 8.142 -11.025 1.00 25.00 N ATOM 307 CA HIS A 100 63.413 9.501 -10.923 1.00 25.00 C ATOM 308 C HIS A 100 64.295 9.518 -9.678 1.00 25.00 C ATOM 309 O HIS A 100 64.292 8.554 -8.917 1.00 25.00 O ATOM 310 CB HIS A 100 62.255 10.500 -10.798 1.00 25.00 C ATOM 311 CG HIS A 100 61.454 10.335 -9.544 1.00 25.00 C ATOM 312 ND1 HIS A 100 61.811 10.842 -8.318 1.00 25.00 N ATOM 313 CD2 HIS A 100 60.272 9.694 -9.328 1.00 25.00 C ATOM 314 CE1 HIS A 100 60.878 10.494 -7.437 1.00 25.00 C ATOM 315 NE2 HIS A 100 59.915 9.790 -7.999 1.00 25.00 N ATOM 0 HA HIS A 100 63.981 9.789 -11.807 1.00 25.00 H new ATOM 0 HB2 HIS A 100 62.655 11.513 -10.833 1.00 25.00 H new ATOM 0 HB3 HIS A 100 61.595 10.388 -11.658 1.00 25.00 H new ATOM 0 HD1 HIS A 100 62.647 11.391 -8.118 1.00 25.00 H new ATOM 0 HD2 HIS A 100 59.697 9.184 -10.087 1.00 25.00 H new ATOM 0 HE1 HIS A 100 60.905 10.756 -6.390 1.00 25.00 H new ATOM 323 N MET A 101 65.047 10.588 -9.476 1.00 25.00 N ATOM 324 CA MET A 101 65.978 10.685 -8.354 1.00 25.00 C ATOM 325 C MET A 101 65.404 11.496 -7.196 1.00 25.00 C ATOM 326 O MET A 101 64.404 12.211 -7.341 1.00 25.00 O ATOM 327 CB MET A 101 67.278 11.364 -8.809 1.00 25.00 C ATOM 328 CG MET A 101 67.880 10.780 -10.078 1.00 25.00 C ATOM 329 SD MET A 101 67.514 11.798 -11.505 1.00 25.00 S ATOM 330 CE MET A 101 68.687 13.168 -11.308 1.00 25.00 C ATOM 0 H MET A 101 65.033 11.411 -10.079 1.00 25.00 H new ATOM 0 HA MET A 101 66.165 9.667 -8.012 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.083 12.425 -8.968 1.00 25.00 H new ATOM 0 HB3 MET A 101 68.012 11.292 -8.006 1.00 25.00 H new ATOM 0 HG2 MET A 101 68.960 10.689 -9.962 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.491 9.774 -10.237 1.00 25.00 H new ATOM 0 HE1 MET A 101 68.357 14.018 -11.905 1.00 25.00 H new ATOM 0 HE2 MET A 101 68.735 13.458 -10.258 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.675 12.852 -11.643 1.00 25.00 H new ATOM 340 N LEU A 102 66.099 11.434 -6.071 1.00 25.00 N ATOM 341 CA LEU A 102 65.803 12.246 -4.897 1.00 25.00 C ATOM 342 C LEU A 102 67.148 12.829 -4.482 1.00 25.00 C ATOM 343 O LEU A 102 68.133 12.099 -4.435 1.00 25.00 O ATOM 344 CB LEU A 102 65.222 11.376 -3.773 1.00 25.00 C ATOM 345 CG LEU A 102 64.819 12.109 -2.480 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.521 12.895 -2.664 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.644 11.098 -1.351 1.00 25.00 C ATOM 0 H LEU A 102 66.896 10.810 -5.944 1.00 25.00 H new ATOM 0 HA LEU A 102 65.064 13.020 -5.105 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.344 10.858 -4.160 1.00 25.00 H new ATOM 0 HB3 LEU A 102 65.956 10.612 -3.518 1.00 25.00 H new ATOM 0 HG LEU A 102 65.612 12.814 -2.232 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.266 13.400 -1.732 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.653 13.635 -3.453 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.717 12.211 -2.938 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.359 11.619 -0.437 1.00 25.00 H new ATOM 0 HD22 LEU A 102 63.866 10.384 -1.620 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.582 10.568 -1.189 1.00 25.00 H new ATOM 359 N LEU A 103 67.202 14.128 -4.232 1.00 25.00 N ATOM 360 CA LEU A 103 68.446 14.806 -3.860 1.00 25.00 C ATOM 361 C LEU A 103 68.233 15.515 -2.545 1.00 25.00 C ATOM 362 O LEU A 103 67.111 15.907 -2.241 1.00 25.00 O ATOM 363 CB LEU A 103 68.827 15.848 -4.915 1.00 25.00 C ATOM 364 CG LEU A 103 69.062 15.334 -6.339 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.359 16.526 -7.245 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.203 14.348 -6.392 1.00 25.00 C ATOM 0 H LEU A 103 66.391 14.745 -4.279 1.00 25.00 H new ATOM 0 HA LEU A 103 69.243 14.067 -3.783 1.00 25.00 H new ATOM 0 HB2 LEU A 103 68.038 16.600 -4.951 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.734 16.353 -4.582 1.00 25.00 H new ATOM 0 HG LEU A 103 68.166 14.814 -6.677 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.529 16.176 -8.263 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.512 17.212 -7.234 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.249 17.043 -6.886 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.340 14.005 -7.418 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.117 14.830 -6.045 1.00 25.00 H new ATOM 0 HD23 LEU A 103 69.977 13.495 -5.752 1.00 25.00 H new ATOM 378 N THR A 104 69.297 15.723 -1.791 1.00 25.00 N ATOM 379 CA THR A 104 69.203 16.458 -0.532 1.00 25.00 C ATOM 380 C THR A 104 69.754 17.862 -0.755 1.00 25.00 C ATOM 381 O THR A 104 70.711 18.050 -1.495 1.00 25.00 O ATOM 382 CB THR A 104 69.980 15.734 0.586 1.00 25.00 C ATOM 383 OG1 THR A 104 69.554 14.370 0.633 1.00 25.00 O ATOM 384 CG2 THR A 104 69.714 16.354 1.951 1.00 25.00 C ATOM 0 H THR A 104 70.235 15.397 -2.023 1.00 25.00 H new ATOM 0 HA THR A 104 68.162 16.516 -0.215 1.00 25.00 H new ATOM 0 HB THR A 104 71.044 15.818 0.363 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.043 13.899 1.340 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.280 15.816 2.712 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.022 17.400 1.942 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.650 16.291 2.178 1.00 25.00 H new ATOM 392 N VAL A 105 69.120 18.855 -0.161 1.00 25.00 N ATOM 393 CA VAL A 105 69.536 20.239 -0.310 1.00 25.00 C ATOM 394 C VAL A 105 69.758 20.830 1.074 1.00 25.00 C ATOM 395 O VAL A 105 68.849 20.830 1.897 1.00 25.00 O ATOM 396 CB VAL A 105 68.443 21.054 -1.025 1.00 25.00 C ATOM 397 CG1 VAL A 105 68.898 22.501 -1.249 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.042 20.402 -2.367 1.00 25.00 C ATOM 0 H VAL A 105 68.304 18.727 0.437 1.00 25.00 H new ATOM 0 HA VAL A 105 70.452 20.276 -0.900 1.00 25.00 H new ATOM 0 HB VAL A 105 67.565 21.063 -0.379 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.109 23.056 -1.756 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.111 22.968 -0.288 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.798 22.508 -1.863 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.269 21.002 -2.846 1.00 25.00 H new ATOM 0 HG22 VAL A 105 68.914 20.346 -3.019 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.660 19.398 -2.184 1.00 25.00 H new ATOM 408 N TYR A 106 70.951 21.350 1.322 1.00 25.00 N ATOM 409 CA TYR A 106 71.257 22.009 2.590 1.00 25.00 C ATOM 410 C TYR A 106 71.408 23.509 2.336 1.00 25.00 C ATOM 411 O TYR A 106 72.335 23.934 1.652 1.00 25.00 O ATOM 412 CB TYR A 106 72.542 21.429 3.188 1.00 25.00 C ATOM 413 CG TYR A 106 72.730 21.763 4.653 1.00 25.00 C ATOM 414 CD1 TYR A 106 73.000 23.085 5.074 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.633 20.755 5.637 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.159 23.392 6.454 1.00 25.00 C ATOM 417 CE2 TYR A 106 72.797 21.064 7.019 1.00 25.00 C ATOM 418 CZ TYR A 106 73.062 22.379 7.410 1.00 25.00 C ATOM 419 OH TYR A 106 73.227 22.674 8.737 1.00 25.00 O ATOM 0 H TYR A 106 71.728 21.330 0.661 1.00 25.00 H new ATOM 0 HA TYR A 106 70.450 21.841 3.303 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.532 20.346 3.069 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.397 21.804 2.625 1.00 25.00 H new ATOM 0 HD1 TYR A 106 73.087 23.872 4.339 1.00 25.00 H new ATOM 0 HD2 TYR A 106 72.432 19.737 5.339 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.355 24.408 6.762 1.00 25.00 H new ATOM 0 HE2 TYR A 106 72.717 20.284 7.762 1.00 25.00 H new ATOM 0 HH TYR A 106 73.198 23.646 8.862 1.00 25.00 H new ATOM 429 N CYS A 107 70.496 24.308 2.862 1.00 25.00 N ATOM 430 CA CYS A 107 70.521 25.755 2.658 1.00 25.00 C ATOM 431 C CYS A 107 71.060 26.457 3.894 1.00 25.00 C ATOM 432 O CYS A 107 70.550 26.265 4.983 1.00 25.00 O ATOM 433 CB CYS A 107 69.110 26.261 2.365 1.00 25.00 C ATOM 434 SG CYS A 107 68.412 25.571 0.853 1.00 25.00 S ATOM 0 H CYS A 107 69.721 23.980 3.439 1.00 25.00 H new ATOM 0 HA CYS A 107 71.173 25.974 1.812 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.460 26.013 3.204 1.00 25.00 H new ATOM 0 HB3 CYS A 107 69.129 27.348 2.286 1.00 25.00 H new ATOM 0 HG CYS A 107 67.939 26.532 0.116 1.00 25.00 H new ATOM 440 N VAL A 108 72.082 27.280 3.713 1.00 25.00 N ATOM 441 CA VAL A 108 72.718 28.000 4.815 1.00 25.00 C ATOM 442 C VAL A 108 72.349 29.480 4.784 1.00 25.00 C ATOM 443 O VAL A 108 72.479 30.152 3.749 1.00 25.00 O ATOM 444 CB VAL A 108 74.268 27.880 4.743 1.00 25.00 C ATOM 445 CG1 VAL A 108 74.923 28.519 5.987 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.686 26.409 4.636 1.00 25.00 C ATOM 0 H VAL A 108 72.496 27.470 2.800 1.00 25.00 H new ATOM 0 HA VAL A 108 72.358 27.549 5.740 1.00 25.00 H new ATOM 0 HB VAL A 108 74.608 28.412 3.855 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.007 28.424 5.917 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.654 29.574 6.039 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.572 28.010 6.885 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.773 26.342 4.587 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.328 25.865 5.510 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.254 25.973 3.735 1.00 25.00 H new ATOM 456 N ARG A 109 71.925 29.988 5.934 1.00 25.00 N ATOM 457 CA ARG A 109 71.599 31.406 6.114 1.00 25.00 C ATOM 458 C ARG A 109 72.427 31.906 7.284 1.00 25.00 C ATOM 459 O ARG A 109 72.678 31.165 8.220 1.00 25.00 O ATOM 460 CB ARG A 109 70.112 31.555 6.417 1.00 25.00 C ATOM 461 CG ARG A 109 69.223 31.376 5.194 1.00 25.00 C ATOM 462 CD ARG A 109 68.813 32.719 4.625 1.00 25.00 C ATOM 463 NE ARG A 109 67.642 33.269 5.329 1.00 25.00 N ATOM 464 CZ ARG A 109 67.109 34.469 5.115 1.00 25.00 C ATOM 465 NH1 ARG A 109 67.602 35.320 4.247 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 66.051 34.816 5.792 1.00 25.00 N ATOM 0 H ARG A 109 71.795 29.428 6.777 1.00 25.00 H new ATOM 0 HA ARG A 109 71.819 31.980 5.214 1.00 25.00 H new ATOM 0 HB2 ARG A 109 69.828 30.823 7.173 1.00 25.00 H new ATOM 0 HB3 ARG A 109 69.933 32.541 6.845 1.00 25.00 H new ATOM 0 HG2 ARG A 109 69.753 30.801 4.435 1.00 25.00 H new ATOM 0 HG3 ARG A 109 68.335 30.804 5.465 1.00 25.00 H new ATOM 0 HD2 ARG A 109 69.646 33.418 4.702 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.584 32.611 3.565 1.00 25.00 H new ATOM 0 HE ARG A 109 67.204 32.682 6.039 1.00 25.00 H new ATOM 0 HH11 ARG A 109 68.428 35.072 3.702 1.00 25.00 H new ATOM 0 HH12 ARG A 109 67.159 36.230 4.117 1.00 25.00 H new ATOM 0 HH21 ARG A 109 65.646 34.172 6.472 1.00 25.00 H new ATOM 0 HH22 ARG A 109 65.627 35.732 5.642 1.00 25.00 H new ATOM 480 N ARG A 110 72.865 33.158 7.227 1.00 25.00 N ATOM 481 CA ARG A 110 73.744 33.715 8.270 1.00 25.00 C ATOM 482 C ARG A 110 73.096 33.824 9.643 1.00 25.00 C ATOM 483 O ARG A 110 73.788 33.828 10.645 1.00 25.00 O ATOM 484 CB ARG A 110 74.241 35.109 7.866 1.00 25.00 C ATOM 485 CG ARG A 110 75.117 35.144 6.613 1.00 25.00 C ATOM 486 CD ARG A 110 76.354 34.254 6.763 1.00 25.00 C ATOM 487 NE ARG A 110 77.375 34.576 5.749 1.00 25.00 N ATOM 488 CZ ARG A 110 78.438 35.352 5.947 1.00 25.00 C ATOM 489 NH1 ARG A 110 78.695 35.914 7.102 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 79.258 35.567 4.956 1.00 25.00 N ATOM 0 H ARG A 110 72.633 33.810 6.478 1.00 25.00 H new ATOM 0 HA ARG A 110 74.567 33.005 8.352 1.00 25.00 H new ATOM 0 HB2 ARG A 110 73.377 35.754 7.705 1.00 25.00 H new ATOM 0 HB3 ARG A 110 74.805 35.532 8.697 1.00 25.00 H new ATOM 0 HG2 ARG A 110 74.534 34.816 5.752 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.428 36.170 6.415 1.00 25.00 H new ATOM 0 HD2 ARG A 110 76.776 34.381 7.760 1.00 25.00 H new ATOM 0 HD3 ARG A 110 76.064 33.207 6.670 1.00 25.00 H new ATOM 0 HE ARG A 110 77.257 34.171 4.820 1.00 25.00 H new ATOM 0 HH11 ARG A 110 78.069 35.764 7.893 1.00 25.00 H new ATOM 0 HH12 ARG A 110 79.521 36.502 7.210 1.00 25.00 H new ATOM 0 HH21 ARG A 110 79.080 35.143 4.046 1.00 25.00 H new ATOM 0 HH22 ARG A 110 80.077 36.159 5.091 1.00 25.00 H new ATOM 504 N ASP A 111 71.776 33.898 9.673 1.00 25.00 N ATOM 505 CA ASP A 111 71.021 34.033 10.925 1.00 25.00 C ATOM 506 C ASP A 111 70.791 32.676 11.615 1.00 25.00 C ATOM 507 O ASP A 111 69.891 32.535 12.431 1.00 25.00 O ATOM 508 CB ASP A 111 69.666 34.688 10.608 1.00 25.00 C ATOM 509 CG ASP A 111 69.463 35.999 11.347 1.00 25.00 C ATOM 510 OD1 ASP A 111 69.862 36.112 12.523 1.00 25.00 O ATOM 511 OD2 ASP A 111 68.951 36.944 10.711 1.00 25.00 O1- ATOM 0 H ASP A 111 71.191 33.867 8.838 1.00 25.00 H new ATOM 0 HA ASP A 111 71.602 34.649 11.612 1.00 25.00 H new ATOM 0 HB2 ASP A 111 69.595 34.865 9.535 1.00 25.00 H new ATOM 0 HB3 ASP A 111 68.863 33.999 10.871 1.00 25.00 H new ATOM 516 N LEU A 112 71.557 31.667 11.195 1.00 25.00 N ATOM 517 CA LEU A 112 71.387 30.265 11.635 1.00 25.00 C ATOM 518 C LEU A 112 69.974 29.783 11.302 1.00 25.00 C ATOM 519 O LEU A 112 69.428 28.882 11.915 1.00 25.00 O ATOM 520 CB LEU A 112 71.701 30.081 13.129 1.00 25.00 C ATOM 521 CG LEU A 112 73.111 30.503 13.582 1.00 25.00 C ATOM 522 CD1 LEU A 112 73.221 30.360 15.101 1.00 25.00 C ATOM 523 CD2 LEU A 112 74.210 29.665 12.902 1.00 25.00 C ATOM 0 H LEU A 112 72.323 31.793 10.533 1.00 25.00 H new ATOM 0 HA LEU A 112 72.107 29.654 11.091 1.00 25.00 H new ATOM 0 HB2 LEU A 112 70.971 30.649 13.705 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.559 29.030 13.382 1.00 25.00 H new ATOM 0 HG LEU A 112 73.259 31.542 13.289 1.00 25.00 H new ATOM 0 HD11 LEU A 112 74.219 30.658 15.423 1.00 25.00 H new ATOM 0 HD12 LEU A 112 72.479 30.998 15.581 1.00 25.00 H new ATOM 0 HD13 LEU A 112 73.044 29.322 15.382 1.00 25.00 H new ATOM 0 HD21 LEU A 112 75.188 29.996 13.250 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.073 28.613 13.152 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.148 29.792 11.821 1.00 25.00 H new ATOM 535 N SER A 113 69.433 30.386 10.256 1.00 25.00 N ATOM 536 CA SER A 113 68.113 30.064 9.703 1.00 25.00 C ATOM 537 C SER A 113 68.302 28.965 8.658 1.00 25.00 C ATOM 538 O SER A 113 67.597 28.899 7.649 1.00 25.00 O ATOM 539 CB SER A 113 67.489 31.323 9.086 1.00 25.00 C ATOM 540 OG SER A 113 66.233 31.057 8.484 1.00 25.00 O ATOM 0 H SER A 113 69.907 31.134 9.749 1.00 25.00 H new ATOM 0 HA SER A 113 67.436 29.712 10.481 1.00 25.00 H new ATOM 0 HB2 SER A 113 67.366 32.082 9.859 1.00 25.00 H new ATOM 0 HB3 SER A 113 68.168 31.735 8.339 1.00 25.00 H new ATOM 0 HG SER A 113 66.276 30.206 8.000 1.00 25.00 H new ATOM 546 N GLU A 114 69.370 28.208 8.837 1.00 25.00 N ATOM 547 CA GLU A 114 69.754 27.165 7.905 1.00 25.00 C ATOM 548 C GLU A 114 68.789 25.986 8.034 1.00 25.00 C ATOM 549 O GLU A 114 68.186 25.775 9.083 1.00 25.00 O ATOM 550 CB GLU A 114 71.201 26.731 8.174 1.00 25.00 C ATOM 551 CG GLU A 114 71.465 26.166 9.565 1.00 25.00 C ATOM 552 CD GLU A 114 72.952 26.047 9.837 1.00 25.00 C ATOM 553 OE1 GLU A 114 73.646 25.338 9.073 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.444 26.719 10.765 1.00 25.00 O1- ATOM 0 H GLU A 114 69.997 28.300 9.636 1.00 25.00 H new ATOM 0 HA GLU A 114 69.701 27.544 6.884 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.480 25.979 7.436 1.00 25.00 H new ATOM 0 HB3 GLU A 114 71.855 27.589 8.018 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.006 26.810 10.315 1.00 25.00 H new ATOM 0 HG3 GLU A 114 70.997 25.186 9.657 1.00 25.00 H new ATOM 561 N VAL A 115 68.604 25.260 6.941 1.00 25.00 N ATOM 562 CA VAL A 115 67.616 24.186 6.885 1.00 25.00 C ATOM 563 C VAL A 115 68.095 23.159 5.867 1.00 25.00 C ATOM 564 O VAL A 115 68.830 23.498 4.942 1.00 25.00 O ATOM 565 CB VAL A 115 66.199 24.772 6.492 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.199 25.356 5.062 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.085 23.719 6.635 1.00 25.00 C ATOM 0 H VAL A 115 69.127 25.394 6.076 1.00 25.00 H new ATOM 0 HA VAL A 115 67.510 23.708 7.859 1.00 25.00 H new ATOM 0 HB VAL A 115 65.994 25.582 7.192 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.209 25.748 4.829 1.00 25.00 H new ATOM 0 HG12 VAL A 115 66.932 26.160 4.997 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.456 24.572 4.349 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.129 24.161 6.356 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.298 22.873 5.982 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.039 23.377 7.669 1.00 25.00 H new ATOM 577 N THR A 116 67.682 21.913 6.023 1.00 25.00 N ATOM 578 CA THR A 116 68.003 20.873 5.059 1.00 25.00 C ATOM 579 C THR A 116 66.701 20.156 4.733 1.00 25.00 C ATOM 580 O THR A 116 65.832 20.018 5.597 1.00 25.00 O ATOM 581 CB THR A 116 69.101 19.905 5.588 1.00 25.00 C ATOM 582 OG1 THR A 116 69.404 18.926 4.591 1.00 25.00 O ATOM 583 CG2 THR A 116 68.677 19.184 6.859 1.00 25.00 C ATOM 0 H THR A 116 67.120 21.595 6.813 1.00 25.00 H new ATOM 0 HA THR A 116 68.429 21.307 4.154 1.00 25.00 H new ATOM 0 HB THR A 116 69.976 20.513 5.817 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.097 18.320 4.928 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.478 18.521 7.186 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.469 19.915 7.640 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.779 18.598 6.663 1.00 25.00 H new ATOM 591 N PHE A 117 66.542 19.774 3.477 1.00 25.00 N ATOM 592 CA PHE A 117 65.323 19.130 2.994 1.00 25.00 C ATOM 593 C PHE A 117 65.711 18.309 1.778 1.00 25.00 C ATOM 594 O PHE A 117 66.864 18.346 1.365 1.00 25.00 O ATOM 595 CB PHE A 117 64.249 20.176 2.640 1.00 25.00 C ATOM 596 CG PHE A 117 64.706 21.224 1.655 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.613 20.997 0.270 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.207 22.457 2.113 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.021 21.992 -0.656 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.611 23.462 1.199 1.00 25.00 C ATOM 601 CZ PHE A 117 65.516 23.227 -0.190 1.00 25.00 C ATOM 0 H PHE A 117 67.254 19.900 2.758 1.00 25.00 H new ATOM 0 HA PHE A 117 64.890 18.493 3.765 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.379 19.663 2.230 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.924 20.671 3.555 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.227 20.056 -0.093 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.285 22.640 3.175 1.00 25.00 H new ATOM 0 HE1 PHE A 117 64.952 21.803 -1.717 1.00 25.00 H new ATOM 0 HE2 PHE A 117 65.990 24.405 1.564 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.821 23.989 -0.892 1.00 25.00 H new ATOM 611 N SER A 118 64.772 17.578 1.199 1.00 25.00 N ATOM 612 CA SER A 118 65.053 16.770 0.016 1.00 25.00 C ATOM 613 C SER A 118 64.044 17.068 -1.077 1.00 25.00 C ATOM 614 O SER A 118 62.901 17.400 -0.792 1.00 25.00 O ATOM 615 CB SER A 118 65.024 15.280 0.367 1.00 25.00 C ATOM 616 OG SER A 118 65.987 14.979 1.365 1.00 25.00 O ATOM 0 H SER A 118 63.807 17.525 1.527 1.00 25.00 H new ATOM 0 HA SER A 118 66.049 17.024 -0.347 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.030 15.004 0.719 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.222 14.687 -0.526 1.00 25.00 H new ATOM 0 HG SER A 118 65.951 14.023 1.576 1.00 25.00 H new ATOM 622 N LEU A 119 64.482 16.960 -2.323 1.00 25.00 N ATOM 623 CA LEU A 119 63.638 17.243 -3.481 1.00 25.00 C ATOM 624 C LEU A 119 63.724 16.113 -4.482 1.00 25.00 C ATOM 625 O LEU A 119 64.782 15.534 -4.687 1.00 25.00 O ATOM 626 CB LEU A 119 64.096 18.530 -4.171 1.00 25.00 C ATOM 627 CG LEU A 119 63.551 19.838 -3.584 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.226 21.003 -4.296 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.029 19.920 -3.754 1.00 25.00 C ATOM 0 H LEU A 119 65.431 16.674 -2.562 1.00 25.00 H new ATOM 0 HA LEU A 119 62.612 17.353 -3.129 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.185 18.567 -4.141 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.808 18.478 -5.221 1.00 25.00 H new ATOM 0 HG LEU A 119 63.766 19.876 -2.516 1.00 25.00 H new ATOM 0 HD11 LEU A 119 63.851 21.943 -3.892 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.304 20.947 -4.144 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.007 20.954 -5.363 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.665 20.856 -3.330 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.779 19.880 -4.814 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.560 19.082 -3.239 1.00 25.00 H new ATOM 641 N GLN A 120 62.604 15.823 -5.119 1.00 25.00 N ATOM 642 CA GLN A 120 62.542 14.774 -6.131 1.00 25.00 C ATOM 643 C GLN A 120 62.647 15.407 -7.514 1.00 25.00 C ATOM 644 O GLN A 120 61.945 16.372 -7.820 1.00 25.00 O ATOM 645 CB GLN A 120 61.251 13.953 -5.987 1.00 25.00 C ATOM 646 CG GLN A 120 59.956 14.773 -5.919 1.00 25.00 C ATOM 647 CD GLN A 120 58.998 14.414 -7.028 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.109 13.597 -6.853 1.00 25.00 O ATOM 649 NE2 GLN A 120 59.174 15.018 -8.172 1.00 25.00 N ATOM 0 H GLN A 120 61.718 16.300 -4.955 1.00 25.00 H new ATOM 0 HA GLN A 120 63.377 14.087 -5.994 1.00 25.00 H new ATOM 0 HB2 GLN A 120 61.182 13.265 -6.829 1.00 25.00 H new ATOM 0 HB3 GLN A 120 61.325 13.346 -5.085 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.473 14.608 -4.956 1.00 25.00 H new ATOM 0 HG3 GLN A 120 60.196 15.835 -5.977 1.00 25.00 H new ATOM 0 HE21 GLN A 120 59.929 15.696 -8.280 1.00 25.00 H new ATOM 0 HE22 GLN A 120 58.557 14.812 -8.958 1.00 25.00 H new ATOM 658 N VAL A 121 63.556 14.890 -8.326 1.00 25.00 N ATOM 659 CA VAL A 121 63.834 15.448 -9.652 1.00 25.00 C ATOM 660 C VAL A 121 64.034 14.298 -10.626 1.00 25.00 C ATOM 661 O VAL A 121 64.305 13.183 -10.209 1.00 25.00 O ATOM 662 CB VAL A 121 65.130 16.327 -9.641 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.946 17.559 -8.747 1.00 25.00 C ATOM 664 CG2 VAL A 121 66.341 15.514 -9.160 1.00 25.00 C ATOM 0 H VAL A 121 64.123 14.075 -8.091 1.00 25.00 H new ATOM 0 HA VAL A 121 62.994 16.077 -9.948 1.00 25.00 H new ATOM 0 HB VAL A 121 65.313 16.657 -10.664 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.859 18.154 -8.755 1.00 25.00 H new ATOM 0 HG12 VAL A 121 64.118 18.160 -9.122 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.730 17.240 -7.727 1.00 25.00 H new ATOM 0 HG21 VAL A 121 67.228 16.147 -9.162 1.00 25.00 H new ATOM 0 HG22 VAL A 121 66.157 15.150 -8.149 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.499 14.667 -9.827 1.00 25.00 H new ATOM 674 N ASP A 122 63.915 14.562 -11.914 1.00 25.00 N ATOM 675 CA ASP A 122 64.128 13.532 -12.929 1.00 25.00 C ATOM 676 C ASP A 122 65.524 13.711 -13.532 1.00 25.00 C ATOM 677 O ASP A 122 66.165 14.740 -13.332 1.00 25.00 O ATOM 678 CB ASP A 122 63.048 13.632 -14.006 1.00 25.00 C ATOM 679 CG ASP A 122 62.693 12.274 -14.598 1.00 25.00 C ATOM 680 OD1 ASP A 122 63.607 11.600 -15.123 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 61.519 11.866 -14.502 1.00 25.00 O1- ATOM 0 H ASP A 122 63.672 15.479 -12.288 1.00 25.00 H new ATOM 0 HA ASP A 122 64.062 12.542 -12.478 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.153 14.085 -13.579 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.391 14.294 -14.801 1.00 25.00 H new ATOM 686 N ALA A 123 65.990 12.727 -14.284 1.00 25.00 N ATOM 687 CA ALA A 123 67.293 12.807 -14.936 1.00 25.00 C ATOM 688 C ALA A 123 67.328 13.968 -15.936 1.00 25.00 C ATOM 689 O ALA A 123 68.369 14.591 -16.153 1.00 25.00 O ATOM 690 CB ALA A 123 67.590 11.481 -15.645 1.00 25.00 C ATOM 0 H ALA A 123 65.485 11.859 -14.460 1.00 25.00 H new ATOM 0 HA ALA A 123 68.057 12.991 -14.181 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.563 11.539 -16.133 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.598 10.672 -14.915 1.00 25.00 H new ATOM 0 HB3 ALA A 123 66.821 11.288 -16.393 1.00 25.00 H new ATOM 696 N ASP A 124 66.177 14.249 -16.526 1.00 25.00 N ATOM 697 CA ASP A 124 66.044 15.292 -17.544 1.00 25.00 C ATOM 698 C ASP A 124 65.813 16.685 -16.936 1.00 25.00 C ATOM 699 O ASP A 124 65.605 17.661 -17.644 1.00 25.00 O ATOM 700 CB ASP A 124 64.860 14.927 -18.451 1.00 25.00 C ATOM 701 CG ASP A 124 65.071 15.349 -19.901 1.00 25.00 C ATOM 702 OD1 ASP A 124 66.237 15.473 -20.334 1.00 25.00 O ATOM 703 OD2 ASP A 124 64.061 15.450 -20.633 1.00 25.00 O1- ATOM 0 H ASP A 124 65.305 13.763 -16.316 1.00 25.00 H new ATOM 0 HA ASP A 124 66.977 15.342 -18.106 1.00 25.00 H new ATOM 0 HB2 ASP A 124 64.697 13.850 -18.411 1.00 25.00 H new ATOM 0 HB3 ASP A 124 63.956 15.400 -18.068 1.00 25.00 H new ATOM 708 N PHE A 125 65.818 16.772 -15.613 1.00 25.00 N ATOM 709 CA PHE A 125 65.530 18.034 -14.932 1.00 25.00 C ATOM 710 C PHE A 125 66.697 19.015 -15.051 1.00 25.00 C ATOM 711 O PHE A 125 67.837 18.693 -14.713 1.00 25.00 O ATOM 712 CB PHE A 125 65.227 17.759 -13.464 1.00 25.00 C ATOM 713 CG PHE A 125 64.258 18.718 -12.846 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.901 18.689 -13.222 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.673 19.628 -11.860 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.965 19.562 -12.621 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.740 20.498 -11.244 1.00 25.00 C ATOM 718 CZ PHE A 125 62.386 20.464 -11.628 1.00 25.00 C ATOM 0 H PHE A 125 66.017 15.990 -14.989 1.00 25.00 H new ATOM 0 HA PHE A 125 64.664 18.491 -15.410 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.830 16.748 -13.370 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.160 17.789 -12.901 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.571 17.992 -13.978 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.712 19.665 -11.569 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.929 19.536 -12.924 1.00 25.00 H new ATOM 0 HE2 PHE A 125 64.067 21.187 -10.480 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.673 21.128 -11.162 1.00 25.00 H new ATOM 728 N GLU A 126 66.403 20.208 -15.540 1.00 25.00 N ATOM 729 CA GLU A 126 67.412 21.253 -15.745 1.00 25.00 C ATOM 730 C GLU A 126 67.913 21.842 -14.436 1.00 25.00 C ATOM 731 O GLU A 126 67.152 21.970 -13.480 1.00 25.00 O ATOM 732 CB GLU A 126 66.807 22.420 -16.520 1.00 25.00 C ATOM 733 CG GLU A 126 66.386 22.124 -17.932 1.00 25.00 C ATOM 734 CD GLU A 126 65.685 23.328 -18.534 1.00 25.00 C ATOM 735 OE1 GLU A 126 66.261 24.438 -18.476 1.00 25.00 O ATOM 736 OE2 GLU A 126 64.505 23.198 -18.919 1.00 25.00 O1- ATOM 0 H GLU A 126 65.459 20.487 -15.809 1.00 25.00 H new ATOM 0 HA GLU A 126 68.232 20.775 -16.281 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.938 22.784 -15.971 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.534 23.232 -16.541 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.258 21.864 -18.532 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.720 21.261 -17.947 1.00 25.00 H new ATOM 743 N LEU A 127 69.145 22.337 -14.435 1.00 25.00 N ATOM 744 CA LEU A 127 69.663 23.105 -13.300 1.00 25.00 C ATOM 745 C LEU A 127 68.811 24.381 -13.166 1.00 25.00 C ATOM 746 O LEU A 127 68.507 24.827 -12.056 1.00 25.00 O ATOM 747 CB LEU A 127 71.141 23.457 -13.548 1.00 25.00 C ATOM 748 CG LEU A 127 72.094 23.877 -12.399 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.191 24.760 -12.999 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.460 24.620 -11.229 1.00 25.00 C ATOM 0 H LEU A 127 69.806 22.223 -15.204 1.00 25.00 H new ATOM 0 HA LEU A 127 69.605 22.526 -12.378 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.593 22.590 -14.029 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.152 24.268 -14.277 1.00 25.00 H new ATOM 0 HG LEU A 127 72.463 22.945 -11.970 1.00 25.00 H new ATOM 0 HD11 LEU A 127 73.878 25.072 -12.212 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.737 24.198 -13.756 1.00 25.00 H new ATOM 0 HD13 LEU A 127 72.740 25.641 -13.456 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.226 24.859 -10.492 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.002 25.542 -11.588 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.697 23.991 -10.769 1.00 25.00 H new ATOM 762 N HIS A 128 68.379 24.938 -14.294 1.00 25.00 N ATOM 763 CA HIS A 128 67.532 26.136 -14.272 1.00 25.00 C ATOM 764 C HIS A 128 66.242 25.885 -13.494 1.00 25.00 C ATOM 765 O HIS A 128 65.816 26.710 -12.684 1.00 25.00 O ATOM 766 CB HIS A 128 67.172 26.575 -15.693 1.00 25.00 C ATOM 767 CG HIS A 128 66.836 28.031 -15.793 1.00 25.00 C ATOM 768 ND1 HIS A 128 65.788 28.633 -15.141 1.00 25.00 N ATOM 769 CD2 HIS A 128 67.437 29.033 -16.491 1.00 25.00 C ATOM 770 CE1 HIS A 128 65.797 29.928 -15.445 1.00 25.00 C ATOM 771 NE2 HIS A 128 66.788 30.229 -16.259 1.00 25.00 N ATOM 0 H HIS A 128 68.596 24.587 -15.227 1.00 25.00 H new ATOM 0 HA HIS A 128 68.102 26.923 -13.779 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.008 26.355 -16.357 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.323 25.988 -16.044 1.00 25.00 H new ATOM 0 HD2 HIS A 128 68.297 28.910 -17.133 1.00 25.00 H new ATOM 0 HE1 HIS A 128 65.080 30.644 -15.071 1.00 25.00 H new ATOM 0 HE2 HIS A 128 67.024 31.147 -16.636 1.00 25.00 H new ATOM 779 N ASN A 129 65.618 24.742 -13.734 1.00 25.00 N ATOM 780 CA ASN A 129 64.388 24.393 -13.033 1.00 25.00 C ATOM 781 C ASN A 129 64.697 24.006 -11.591 1.00 25.00 C ATOM 782 O ASN A 129 63.926 24.292 -10.688 1.00 25.00 O ATOM 783 CB ASN A 129 63.671 23.245 -13.752 1.00 25.00 C ATOM 784 CG ASN A 129 62.627 23.740 -14.717 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.686 24.401 -14.321 1.00 25.00 O ATOM 786 ND2 ASN A 129 62.786 23.434 -15.976 1.00 25.00 N ATOM 0 H ASN A 129 65.939 24.043 -14.404 1.00 25.00 H new ATOM 0 HA ASN A 129 63.730 25.262 -13.028 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.403 22.642 -14.290 1.00 25.00 H new ATOM 0 HB3 ASN A 129 63.202 22.594 -13.015 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.107 23.752 -16.668 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.589 22.877 -16.268 1.00 25.00 H new ATOM 793 N PHE A 130 65.841 23.379 -11.368 1.00 25.00 N ATOM 794 CA PHE A 130 66.229 22.952 -10.026 1.00 25.00 C ATOM 795 C PHE A 130 66.421 24.109 -9.060 1.00 25.00 C ATOM 796 O PHE A 130 65.967 24.043 -7.926 1.00 25.00 O ATOM 797 CB PHE A 130 67.509 22.128 -10.089 1.00 25.00 C ATOM 798 CG PHE A 130 67.899 21.513 -8.769 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.992 20.693 -8.064 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.178 21.740 -8.229 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.358 20.100 -6.831 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.560 21.145 -7.002 1.00 25.00 C ATOM 803 CZ PHE A 130 68.646 20.322 -6.303 1.00 25.00 C ATOM 0 H PHE A 130 66.519 23.153 -12.096 1.00 25.00 H new ATOM 0 HA PHE A 130 65.405 22.349 -9.645 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.384 21.335 -10.827 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.323 22.763 -10.438 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.007 20.516 -8.470 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.876 22.374 -8.755 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.653 19.480 -6.297 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.547 21.319 -6.601 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.934 19.865 -5.368 1.00 25.00 H new ATOM 813 N ARG A 131 67.066 25.186 -9.492 1.00 25.00 N ATOM 814 CA ARG A 131 67.247 26.328 -8.591 1.00 25.00 C ATOM 815 C ARG A 131 65.900 26.973 -8.252 1.00 25.00 C ATOM 816 O ARG A 131 65.729 27.474 -7.153 1.00 25.00 O ATOM 817 CB ARG A 131 68.245 27.360 -9.150 1.00 25.00 C ATOM 818 CG ARG A 131 67.820 28.065 -10.436 1.00 25.00 C ATOM 819 CD ARG A 131 68.795 29.177 -10.829 1.00 25.00 C ATOM 820 NE ARG A 131 70.119 28.653 -11.217 1.00 25.00 N ATOM 821 CZ ARG A 131 71.240 28.751 -10.510 1.00 25.00 C ATOM 822 NH1 ARG A 131 71.294 29.355 -9.343 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 72.330 28.230 -10.999 1.00 25.00 N ATOM 0 H ARG A 131 67.462 25.297 -10.426 1.00 25.00 H new ATOM 0 HA ARG A 131 67.681 25.947 -7.667 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.424 28.116 -8.385 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.196 26.858 -9.330 1.00 25.00 H new ATOM 0 HG2 ARG A 131 67.756 27.337 -11.244 1.00 25.00 H new ATOM 0 HG3 ARG A 131 66.823 28.486 -10.306 1.00 25.00 H new ATOM 0 HD2 ARG A 131 68.376 29.748 -11.658 1.00 25.00 H new ATOM 0 HD3 ARG A 131 68.911 29.867 -9.993 1.00 25.00 H new ATOM 0 HE ARG A 131 70.179 28.170 -12.113 1.00 25.00 H new ATOM 0 HH11 ARG A 131 70.453 29.772 -8.945 1.00 25.00 H new ATOM 0 HH12 ARG A 131 72.177 29.406 -8.836 1.00 25.00 H new ATOM 0 HH21 ARG A 131 72.309 27.761 -11.904 1.00 25.00 H new ATOM 0 HH22 ARG A 131 73.204 28.292 -10.476 1.00 25.00 H new ATOM 837 N ALA A 132 64.937 26.905 -9.162 1.00 25.00 N ATOM 838 CA ALA A 132 63.594 27.424 -8.894 1.00 25.00 C ATOM 839 C ALA A 132 62.840 26.488 -7.938 1.00 25.00 C ATOM 840 O ALA A 132 62.138 26.930 -7.039 1.00 25.00 O ATOM 841 CB ALA A 132 62.823 27.582 -10.210 1.00 25.00 C ATOM 0 H ALA A 132 65.056 26.498 -10.090 1.00 25.00 H new ATOM 0 HA ALA A 132 63.681 28.401 -8.419 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.825 27.968 -10.003 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.353 28.277 -10.861 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.742 26.613 -10.703 1.00 25.00 H new ATOM 847 N LEU A 133 63.012 25.189 -8.121 1.00 25.00 N ATOM 848 CA LEU A 133 62.375 24.200 -7.253 1.00 25.00 C ATOM 849 C LEU A 133 62.927 24.333 -5.828 1.00 25.00 C ATOM 850 O LEU A 133 62.203 24.221 -4.849 1.00 25.00 O ATOM 851 CB LEU A 133 62.629 22.790 -7.810 1.00 25.00 C ATOM 852 CG LEU A 133 61.801 21.648 -7.202 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.311 21.798 -7.514 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.305 20.306 -7.747 1.00 25.00 C ATOM 0 H LEU A 133 63.587 24.790 -8.863 1.00 25.00 H new ATOM 0 HA LEU A 133 61.299 24.373 -7.223 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.444 22.810 -8.884 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.685 22.555 -7.673 1.00 25.00 H new ATOM 0 HG LEU A 133 61.922 21.686 -6.119 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.760 20.971 -7.066 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.947 22.740 -7.104 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.163 21.790 -8.594 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.718 19.495 -7.316 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.202 20.292 -8.832 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.354 20.176 -7.481 1.00 25.00 H new ATOM 866 N CYS A 134 64.213 24.632 -5.730 1.00 25.00 N ATOM 867 CA CYS A 134 64.862 24.871 -4.445 1.00 25.00 C ATOM 868 C CYS A 134 64.368 26.170 -3.803 1.00 25.00 C ATOM 869 O CYS A 134 64.244 26.261 -2.586 1.00 25.00 O ATOM 870 CB CYS A 134 66.373 24.956 -4.655 1.00 25.00 C ATOM 871 SG CYS A 134 67.301 25.205 -3.137 1.00 25.00 S ATOM 0 H CYS A 134 64.836 24.716 -6.533 1.00 25.00 H new ATOM 0 HA CYS A 134 64.615 24.045 -3.777 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.716 24.039 -5.134 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.590 25.775 -5.341 1.00 25.00 H new ATOM 0 HG CYS A 134 66.532 25.752 -2.243 1.00 25.00 H new ATOM 877 N GLU A 135 64.095 27.176 -4.622 1.00 25.00 N ATOM 878 CA GLU A 135 63.613 28.470 -4.130 1.00 25.00 C ATOM 879 C GLU A 135 62.276 28.293 -3.411 1.00 25.00 C ATOM 880 O GLU A 135 62.039 28.901 -2.367 1.00 25.00 O ATOM 881 CB GLU A 135 63.478 29.445 -5.313 1.00 25.00 C ATOM 882 CG GLU A 135 63.046 30.846 -4.940 1.00 25.00 C ATOM 883 CD GLU A 135 63.199 31.824 -6.099 1.00 25.00 C ATOM 884 OE1 GLU A 135 62.263 31.938 -6.919 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 64.271 32.482 -6.195 1.00 25.00 O1- ATOM 0 H GLU A 135 64.198 27.126 -5.636 1.00 25.00 H new ATOM 0 HA GLU A 135 64.327 28.881 -3.416 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.436 29.502 -5.829 1.00 25.00 H new ATOM 0 HB3 GLU A 135 62.758 29.035 -6.022 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.005 30.829 -4.616 1.00 25.00 H new ATOM 0 HG3 GLU A 135 63.638 31.193 -4.093 1.00 25.00 H new ATOM 892 N LEU A 136 61.436 27.416 -3.944 1.00 25.00 N ATOM 893 CA LEU A 136 60.117 27.152 -3.366 1.00 25.00 C ATOM 894 C LEU A 136 60.197 26.610 -1.935 1.00 25.00 C ATOM 895 O LEU A 136 59.445 27.034 -1.061 1.00 25.00 O ATOM 896 CB LEU A 136 59.374 26.146 -4.258 1.00 25.00 C ATOM 897 CG LEU A 136 57.908 25.846 -3.907 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.020 27.088 -4.073 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.401 24.718 -4.814 1.00 25.00 C ATOM 0 H LEU A 136 61.643 26.870 -4.781 1.00 25.00 H new ATOM 0 HA LEU A 136 59.580 28.099 -3.318 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.407 26.514 -5.283 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.925 25.206 -4.239 1.00 25.00 H new ATOM 0 HG LEU A 136 57.857 25.543 -2.861 1.00 25.00 H new ATOM 0 HD11 LEU A 136 55.991 26.837 -3.816 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.376 27.880 -3.414 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.062 27.430 -5.107 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.361 24.497 -4.573 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.474 25.029 -5.856 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.007 23.826 -4.658 1.00 25.00 H new ATOM 911 N GLU A 137 61.102 25.670 -1.705 1.00 25.00 N ATOM 912 CA GLU A 137 61.243 25.040 -0.385 1.00 25.00 C ATOM 913 C GLU A 137 62.031 25.906 0.599 1.00 25.00 C ATOM 914 O GLU A 137 61.827 25.835 1.806 1.00 25.00 O ATOM 915 CB GLU A 137 61.978 23.707 -0.533 1.00 25.00 C ATOM 916 CG GLU A 137 61.195 22.624 -1.262 1.00 25.00 C ATOM 917 CD GLU A 137 60.051 22.061 -0.428 1.00 25.00 C ATOM 918 OE1 GLU A 137 60.327 21.333 0.552 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.876 22.311 -0.775 1.00 25.00 O1- ATOM 0 H GLU A 137 61.752 25.322 -2.409 1.00 25.00 H new ATOM 0 HA GLU A 137 60.236 24.902 0.009 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.913 23.881 -1.066 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.240 23.340 0.459 1.00 25.00 H new ATOM 0 HG2 GLU A 137 60.795 23.033 -2.190 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.872 21.815 -1.536 1.00 25.00 H new ATOM 926 N SER A 138 62.974 26.687 0.089 1.00 25.00 N ATOM 927 CA SER A 138 63.861 27.472 0.954 1.00 25.00 C ATOM 928 C SER A 138 63.322 28.867 1.278 1.00 25.00 C ATOM 929 O SER A 138 63.738 29.478 2.263 1.00 25.00 O ATOM 930 CB SER A 138 65.237 27.589 0.306 1.00 25.00 C ATOM 931 OG SER A 138 65.154 28.248 -0.945 1.00 25.00 O ATOM 0 H SER A 138 63.148 26.797 -0.910 1.00 25.00 H new ATOM 0 HA SER A 138 63.926 26.937 1.902 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.909 28.138 0.966 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.665 26.596 0.170 1.00 25.00 H new ATOM 0 HG SER A 138 64.864 27.612 -1.631 1.00 25.00 H new ATOM 937 N GLY A 139 62.398 29.367 0.468 1.00 25.00 N ATOM 938 CA GLY A 139 61.767 30.651 0.741 1.00 25.00 C ATOM 939 C GLY A 139 62.695 31.854 0.697 1.00 25.00 C ATOM 940 O GLY A 139 62.435 32.865 1.355 1.00 25.00 O ATOM 0 H GLY A 139 62.070 28.905 -0.380 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.966 30.804 0.018 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.303 30.607 1.726 1.00 25.00 H new ATOM 944 N ILE A 140 63.776 31.764 -0.066 1.00 25.00 N ATOM 945 CA ILE A 140 64.729 32.872 -0.191 1.00 25.00 C ATOM 946 C ILE A 140 65.068 33.119 -1.658 1.00 25.00 C ATOM 947 O ILE A 140 64.971 32.213 -2.468 1.00 25.00 O ATOM 948 CB ILE A 140 66.049 32.631 0.640 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.601 31.187 0.530 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.786 32.933 2.115 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.305 30.829 -0.786 1.00 25.00 C ATOM 0 H ILE A 140 64.020 30.937 -0.610 1.00 25.00 H new ATOM 0 HA ILE A 140 64.245 33.756 0.223 1.00 25.00 H new ATOM 0 HB ILE A 140 66.799 33.300 0.217 1.00 25.00 H new ATOM 0 HG12 ILE A 140 67.302 31.025 1.349 1.00 25.00 H new ATOM 0 HG13 ILE A 140 65.774 30.492 0.676 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.698 32.766 2.689 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.474 33.972 2.224 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.999 32.277 2.486 1.00 25.00 H new ATOM 0 HD11 ILE A 140 67.648 29.795 -0.746 1.00 25.00 H new ATOM 0 HD12 ILE A 140 66.608 30.948 -1.616 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.160 31.489 -0.933 1.00 25.00 H new ATOM 963 N PRO A 141 65.457 34.357 -2.016 1.00 25.00 N ATOM 964 CA PRO A 141 65.772 34.565 -3.435 1.00 25.00 C ATOM 965 C PRO A 141 66.990 33.776 -3.902 1.00 25.00 C ATOM 966 O PRO A 141 68.095 33.922 -3.360 1.00 25.00 O ATOM 967 CB PRO A 141 66.043 36.072 -3.512 1.00 25.00 C ATOM 968 CG PRO A 141 66.450 36.450 -2.134 1.00 25.00 C ATOM 969 CD PRO A 141 65.615 35.601 -1.239 1.00 25.00 C ATOM 0 HA PRO A 141 64.965 34.222 -4.082 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.829 36.297 -4.233 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.154 36.619 -3.827 1.00 25.00 H new ATOM 0 HG2 PRO A 141 67.512 36.268 -1.972 1.00 25.00 H new ATOM 0 HG3 PRO A 141 66.276 37.510 -1.948 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.104 35.420 -0.282 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.654 36.067 -1.022 1.00 25.00 H new ATOM 977 N ALA A 142 66.803 32.973 -4.940 1.00 25.00 N ATOM 978 CA ALA A 142 67.895 32.194 -5.515 1.00 25.00 C ATOM 979 C ALA A 142 68.959 33.121 -6.114 1.00 25.00 C ATOM 980 O ALA A 142 70.121 32.753 -6.235 1.00 25.00 O ATOM 981 CB ALA A 142 67.348 31.240 -6.588 1.00 25.00 C ATOM 0 H ALA A 142 65.904 32.843 -5.403 1.00 25.00 H new ATOM 0 HA ALA A 142 68.361 31.606 -4.725 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.168 30.662 -7.013 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.622 30.563 -6.137 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.865 31.817 -7.376 1.00 25.00 H new ATOM 987 N ALA A 143 68.542 34.326 -6.485 1.00 25.00 N ATOM 988 CA ALA A 143 69.440 35.314 -7.084 1.00 25.00 C ATOM 989 C ALA A 143 70.491 35.836 -6.092 1.00 25.00 C ATOM 990 O ALA A 143 71.597 36.192 -6.486 1.00 25.00 O ATOM 991 CB ALA A 143 68.614 36.482 -7.639 1.00 25.00 C ATOM 0 H ALA A 143 67.579 34.647 -6.381 1.00 25.00 H new ATOM 0 HA ALA A 143 69.984 34.820 -7.889 1.00 25.00 H new ATOM 0 HB1 ALA A 143 69.281 37.219 -8.086 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.923 36.112 -8.396 1.00 25.00 H new ATOM 0 HB3 ALA A 143 68.050 36.946 -6.830 1.00 25.00 H new ATOM 997 N GLU A 144 70.153 35.872 -4.810 1.00 25.00 N ATOM 998 CA GLU A 144 71.079 36.365 -3.778 1.00 25.00 C ATOM 999 C GLU A 144 71.816 35.191 -3.134 1.00 25.00 C ATOM 1000 O GLU A 144 72.191 35.225 -1.952 1.00 25.00 O ATOM 1001 CB GLU A 144 70.317 37.127 -2.695 1.00 25.00 C ATOM 1002 CG GLU A 144 69.569 38.348 -3.202 1.00 25.00 C ATOM 1003 CD GLU A 144 68.853 39.086 -2.079 1.00 25.00 C ATOM 1004 OE1 GLU A 144 68.841 38.573 -0.935 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 68.282 40.162 -2.342 1.00 25.00 O1- ATOM 0 H GLU A 144 69.248 35.568 -4.452 1.00 25.00 H new ATOM 0 HA GLU A 144 71.795 37.035 -4.254 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.606 36.450 -2.222 1.00 25.00 H new ATOM 0 HB3 GLU A 144 71.020 37.440 -1.924 1.00 25.00 H new ATOM 0 HG2 GLU A 144 70.269 39.025 -3.692 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.843 38.041 -3.955 1.00 25.00 H new ATOM 1012 N SER A 145 71.962 34.116 -3.891 1.00 25.00 N ATOM 1013 CA SER A 145 72.520 32.891 -3.356 1.00 25.00 C ATOM 1014 C SER A 145 73.445 32.190 -4.333 1.00 25.00 C ATOM 1015 O SER A 145 73.359 32.379 -5.546 1.00 25.00 O ATOM 1016 CB SER A 145 71.370 31.956 -2.996 1.00 25.00 C ATOM 1017 OG SER A 145 71.822 30.915 -2.164 1.00 25.00 O ATOM 0 H SER A 145 71.701 34.069 -4.876 1.00 25.00 H new ATOM 0 HA SER A 145 73.116 33.149 -2.481 1.00 25.00 H new ATOM 0 HB2 SER A 145 70.582 32.516 -2.492 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.934 31.540 -3.904 1.00 25.00 H new ATOM 0 HG SER A 145 71.501 31.064 -1.250 1.00 25.00 H new ATOM 1023 N GLN A 146 74.300 31.331 -3.798 1.00 25.00 N ATOM 1024 CA GLN A 146 75.148 30.477 -4.614 1.00 25.00 C ATOM 1025 C GLN A 146 74.773 29.041 -4.277 1.00 25.00 C ATOM 1026 O GLN A 146 74.412 28.744 -3.141 1.00 25.00 O ATOM 1027 CB GLN A 146 76.644 30.738 -4.348 1.00 25.00 C ATOM 1028 CG GLN A 146 77.138 30.273 -2.967 1.00 25.00 C ATOM 1029 CD GLN A 146 78.609 30.544 -2.730 1.00 25.00 C ATOM 1030 OE1 GLN A 146 78.985 31.188 -1.758 1.00 25.00 O ATOM 1031 NE2 GLN A 146 79.450 30.025 -3.587 1.00 25.00 N ATOM 0 H GLN A 146 74.425 31.207 -2.793 1.00 25.00 H new ATOM 0 HA GLN A 146 74.992 30.684 -5.673 1.00 25.00 H new ATOM 0 HB2 GLN A 146 77.230 30.235 -5.117 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.837 31.806 -4.448 1.00 25.00 H new ATOM 0 HG2 GLN A 146 76.555 30.773 -2.194 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.952 29.204 -2.864 1.00 25.00 H new ATOM 0 HE21 GLN A 146 79.102 29.494 -4.386 1.00 25.00 H new ATOM 0 HE22 GLN A 146 80.454 30.151 -3.457 1.00 25.00 H new ATOM 1040 N ILE A 147 74.863 28.160 -5.257 1.00 25.00 N ATOM 1041 CA ILE A 147 74.574 26.750 -5.070 1.00 25.00 C ATOM 1042 C ILE A 147 75.809 25.976 -5.520 1.00 25.00 C ATOM 1043 O ILE A 147 76.415 26.289 -6.555 1.00 25.00 O ATOM 1044 CB ILE A 147 73.288 26.339 -5.860 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.971 24.847 -5.606 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.420 26.680 -7.375 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.704 24.320 -6.312 1.00 25.00 C ATOM 0 H ILE A 147 75.140 28.403 -6.208 1.00 25.00 H new ATOM 0 HA ILE A 147 74.364 26.523 -4.025 1.00 25.00 H new ATOM 0 HB ILE A 147 72.442 26.922 -5.495 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.824 24.250 -5.929 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.862 24.692 -4.533 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.510 26.382 -7.896 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.572 27.753 -7.495 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.271 26.144 -7.796 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.566 23.265 -6.073 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.836 24.885 -5.972 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.813 24.436 -7.390 1.00 25.00 H new ATOM 1059 N VAL A 148 76.222 25.014 -4.710 1.00 25.00 N ATOM 1060 CA VAL A 148 77.402 24.208 -4.993 1.00 25.00 C ATOM 1061 C VAL A 148 77.061 22.725 -4.857 1.00 25.00 C ATOM 1062 O VAL A 148 76.166 22.348 -4.104 1.00 25.00 O ATOM 1063 CB VAL A 148 78.615 24.571 -4.045 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.016 26.049 -4.195 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.308 24.293 -2.589 1.00 25.00 C ATOM 0 H VAL A 148 75.751 24.769 -3.839 1.00 25.00 H new ATOM 0 HA VAL A 148 77.711 24.426 -6.016 1.00 25.00 H new ATOM 0 HB VAL A 148 79.442 23.932 -4.354 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.852 26.268 -3.531 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.311 26.243 -5.226 1.00 25.00 H new ATOM 0 HG13 VAL A 148 78.169 26.684 -3.934 1.00 25.00 H new ATOM 0 HG21 VAL A 148 79.171 24.558 -1.978 1.00 25.00 H new ATOM 0 HG22 VAL A 148 77.448 24.886 -2.279 1.00 25.00 H new ATOM 0 HG23 VAL A 148 78.084 23.234 -2.460 1.00 25.00 H new ATOM 1075 N TYR A 149 77.792 21.898 -5.581 1.00 25.00 N ATOM 1076 CA TYR A 149 77.665 20.446 -5.530 1.00 25.00 C ATOM 1077 C TYR A 149 79.101 19.961 -5.513 1.00 25.00 C ATOM 1078 O TYR A 149 79.923 20.499 -6.254 1.00 25.00 O ATOM 1079 CB TYR A 149 76.933 19.924 -6.764 1.00 25.00 C ATOM 1080 CG TYR A 149 77.051 18.428 -6.950 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.706 17.533 -5.914 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.527 17.896 -8.169 1.00 25.00 C ATOM 1083 CE1 TYR A 149 76.851 16.132 -6.093 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.652 16.494 -8.351 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.316 15.628 -7.311 1.00 25.00 C ATOM 1086 OH TYR A 149 77.448 14.280 -7.477 1.00 25.00 O ATOM 0 H TYR A 149 78.506 22.219 -6.235 1.00 25.00 H new ATOM 0 HA TYR A 149 77.091 20.101 -4.670 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.879 20.191 -6.691 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.327 20.424 -7.649 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.329 17.917 -4.978 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.799 18.564 -8.972 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.602 15.456 -5.288 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.006 16.099 -9.292 1.00 25.00 H new ATOM 0 HH TYR A 149 76.877 13.984 -8.216 1.00 25.00 H new ATOM 1096 N ALA A 150 79.422 19.049 -4.600 1.00 25.00 N ATOM 1097 CA ALA A 150 80.808 18.629 -4.353 1.00 25.00 C ATOM 1098 C ALA A 150 81.686 19.880 -4.138 1.00 25.00 C ATOM 1099 O ALA A 150 82.777 19.993 -4.681 1.00 25.00 O ATOM 1100 CB ALA A 150 81.330 17.758 -5.521 1.00 25.00 C ATOM 0 H ALA A 150 78.736 18.579 -4.010 1.00 25.00 H new ATOM 0 HA ALA A 150 80.851 18.016 -3.453 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.358 17.457 -5.319 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.705 16.871 -5.621 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.295 18.332 -6.447 1.00 25.00 H new ATOM 1106 N GLU A 151 81.128 20.823 -3.378 1.00 25.00 N ATOM 1107 CA GLU A 151 81.736 22.132 -3.050 1.00 25.00 C ATOM 1108 C GLU A 151 82.071 23.049 -4.247 1.00 25.00 C ATOM 1109 O GLU A 151 82.630 24.133 -4.070 1.00 25.00 O ATOM 1110 CB GLU A 151 82.985 21.945 -2.176 1.00 25.00 C ATOM 1111 CG GLU A 151 82.709 21.187 -0.884 1.00 25.00 C ATOM 1112 CD GLU A 151 83.883 21.258 0.076 1.00 25.00 C ATOM 1113 OE1 GLU A 151 84.973 20.749 -0.265 1.00 25.00 O ATOM 1114 OE2 GLU A 151 83.722 21.854 1.162 1.00 25.00 O1- ATOM 0 H GLU A 151 80.208 20.701 -2.955 1.00 25.00 H new ATOM 0 HA GLU A 151 80.949 22.656 -2.507 1.00 25.00 H new ATOM 0 HB2 GLU A 151 83.743 21.410 -2.748 1.00 25.00 H new ATOM 0 HB3 GLU A 151 83.400 22.923 -1.933 1.00 25.00 H new ATOM 0 HG2 GLU A 151 81.822 21.599 -0.404 1.00 25.00 H new ATOM 0 HG3 GLU A 151 82.491 20.144 -1.114 1.00 25.00 H new ATOM 1121 N ARG A 152 81.689 22.652 -5.453 1.00 25.00 N ATOM 1122 CA ARG A 152 81.969 23.443 -6.659 1.00 25.00 C ATOM 1123 C ARG A 152 80.674 24.052 -7.187 1.00 25.00 C ATOM 1124 O ARG A 152 79.630 23.412 -7.143 1.00 25.00 O ATOM 1125 CB ARG A 152 82.607 22.543 -7.716 1.00 25.00 C ATOM 1126 CG ARG A 152 83.975 21.997 -7.283 1.00 25.00 C ATOM 1127 CD ARG A 152 84.459 20.909 -8.213 1.00 25.00 C ATOM 1128 NE ARG A 152 84.759 21.432 -9.556 1.00 25.00 N ATOM 1129 CZ ARG A 152 85.155 20.700 -10.590 1.00 25.00 C ATOM 1130 NH1 ARG A 152 85.306 19.400 -10.507 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 85.396 21.286 -11.729 1.00 25.00 N ATOM 0 H ARG A 152 81.182 21.785 -5.630 1.00 25.00 H new ATOM 0 HA ARG A 152 82.659 24.251 -6.418 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.938 21.709 -7.928 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.721 23.104 -8.644 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.702 22.809 -7.263 1.00 25.00 H new ATOM 0 HG3 ARG A 152 83.906 21.605 -6.268 1.00 25.00 H new ATOM 0 HD2 ARG A 152 85.353 20.445 -7.796 1.00 25.00 H new ATOM 0 HD3 ARG A 152 83.700 20.130 -8.287 1.00 25.00 H new ATOM 0 HE ARG A 152 84.654 22.436 -9.704 1.00 25.00 H new ATOM 0 HH11 ARG A 152 85.117 18.920 -9.627 1.00 25.00 H new ATOM 0 HH12 ARG A 152 85.612 18.869 -11.322 1.00 25.00 H new ATOM 0 HH21 ARG A 152 85.280 22.295 -11.818 1.00 25.00 H new ATOM 0 HH22 ARG A 152 85.701 20.735 -12.531 1.00 25.00 H new ATOM 1145 N PRO A 153 80.710 25.316 -7.651 1.00 25.00 N ATOM 1146 CA PRO A 153 79.427 25.926 -8.024 1.00 25.00 C ATOM 1147 C PRO A 153 78.763 25.373 -9.280 1.00 25.00 C ATOM 1148 O PRO A 153 79.421 25.025 -10.260 1.00 25.00 O ATOM 1149 CB PRO A 153 79.791 27.401 -8.206 1.00 25.00 C ATOM 1150 CG PRO A 153 81.210 27.373 -8.631 1.00 25.00 C ATOM 1151 CD PRO A 153 81.820 26.275 -7.797 1.00 25.00 C ATOM 0 HA PRO A 153 78.677 25.720 -7.260 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.160 27.878 -8.956 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.663 27.960 -7.279 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.303 27.163 -9.697 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.700 28.330 -8.450 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.681 25.824 -8.290 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.164 26.645 -6.831 1.00 25.00 H new ATOM 1159 N LEU A 154 77.440 25.339 -9.243 1.00 25.00 N ATOM 1160 CA LEU A 154 76.626 24.921 -10.383 1.00 25.00 C ATOM 1161 C LEU A 154 76.184 26.194 -11.110 1.00 0.00 C ATOM 1162 O LEU A 154 75.407 26.985 -10.569 1.00 25.00 O ATOM 1163 CB LEU A 154 75.397 24.135 -9.908 1.00 25.00 C ATOM 1164 CG LEU A 154 75.618 22.801 -9.182 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.296 22.338 -8.576 1.00 25.00 C ATOM 1166 CD2 LEU A 154 76.130 21.745 -10.143 1.00 25.00 C ATOM 0 H LEU A 154 76.895 25.600 -8.421 1.00 25.00 H new ATOM 0 HA LEU A 154 77.199 24.270 -11.044 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.825 24.783 -9.244 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.772 23.939 -10.779 1.00 25.00 H new ATOM 0 HG LEU A 154 76.361 22.945 -8.398 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.445 21.390 -8.058 1.00 25.00 H new ATOM 0 HD12 LEU A 154 73.939 23.086 -7.868 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.559 22.207 -9.368 1.00 25.00 H new ATOM 0 HD21 LEU A 154 76.280 20.808 -9.607 1.00 25.00 H new ATOM 0 HD22 LEU A 154 75.402 21.595 -10.940 1.00 25.00 H new ATOM 0 HD23 LEU A 154 77.077 22.072 -10.573 1.00 25.00 H new ATOM 1178 N THR A 155 76.732 26.427 -12.297 1.00 25.00 N ATOM 1179 CA THR A 155 76.513 27.693 -13.013 1.00 25.00 C ATOM 1180 C THR A 155 75.814 27.584 -14.372 1.00 25.00 C ATOM 1181 O THR A 155 75.052 28.473 -14.739 1.00 25.00 O ATOM 1182 CB THR A 155 77.868 28.391 -13.257 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.737 27.494 -13.960 1.00 25.00 O ATOM 1184 CG2 THR A 155 78.543 28.755 -11.941 1.00 25.00 C ATOM 0 H THR A 155 77.330 25.763 -12.788 1.00 25.00 H new ATOM 0 HA THR A 155 75.845 28.254 -12.360 1.00 25.00 H new ATOM 0 HB THR A 155 77.682 29.298 -13.832 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.599 27.932 -14.120 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.495 29.245 -12.144 1.00 25.00 H new ATOM 0 HG22 THR A 155 77.900 29.431 -11.377 1.00 25.00 H new ATOM 0 HG23 THR A 155 78.718 27.850 -11.359 1.00 25.00 H new ATOM 1192 N ASP A 156 76.081 26.528 -15.128 1.00 25.00 N ATOM 1193 CA ASP A 156 75.490 26.382 -16.464 1.00 25.00 C ATOM 1194 C ASP A 156 74.074 25.828 -16.363 1.00 25.00 C ATOM 1195 O ASP A 156 73.855 24.624 -16.239 1.00 25.00 O ATOM 1196 CB ASP A 156 76.347 25.484 -17.358 1.00 25.00 C ATOM 1197 CG ASP A 156 75.814 25.405 -18.777 1.00 25.00 C ATOM 1198 OD1 ASP A 156 74.813 26.092 -19.088 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 76.398 24.649 -19.580 1.00 25.00 O1- ATOM 0 H ASP A 156 76.696 25.763 -14.849 1.00 25.00 H new ATOM 0 HA ASP A 156 75.451 27.371 -16.920 1.00 25.00 H new ATOM 0 HB2 ASP A 156 77.369 25.863 -17.377 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.387 24.482 -16.931 1.00 25.00 H new ATOM 1204 N ASN A 157 73.116 26.740 -16.393 1.00 25.00 N ATOM 1205 CA ASN A 157 71.709 26.405 -16.214 1.00 25.00 C ATOM 1206 C ASN A 157 71.126 25.529 -17.321 1.00 25.00 C ATOM 1207 O ASN A 157 70.085 24.907 -17.123 1.00 25.00 O ATOM 1208 CB ASN A 157 70.889 27.691 -16.112 1.00 25.00 C ATOM 1209 CG ASN A 157 71.084 28.396 -14.799 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.135 27.774 -13.744 1.00 25.00 O ATOM 1211 ND2 ASN A 157 71.181 29.696 -14.848 1.00 25.00 N ATOM 0 H ASN A 157 73.290 27.734 -16.542 1.00 25.00 H new ATOM 0 HA ASN A 157 71.653 25.820 -15.296 1.00 25.00 H new ATOM 0 HB2 ASN A 157 71.168 28.361 -16.925 1.00 25.00 H new ATOM 0 HB3 ASN A 157 69.833 27.456 -16.241 1.00 25.00 H new ATOM 0 HD21 ASN A 157 71.304 30.231 -13.988 1.00 25.00 H new ATOM 0 HD22 ASN A 157 71.134 30.177 -15.746 1.00 25.00 H new ATOM 1218 N HIS A 158 71.789 25.493 -18.470 1.00 25.00 N ATOM 1219 CA HIS A 158 71.310 24.746 -19.633 1.00 25.00 C ATOM 1220 C HIS A 158 71.445 23.232 -19.442 1.00 25.00 C ATOM 1221 O HIS A 158 70.821 22.442 -20.142 1.00 25.00 O ATOM 1222 CB HIS A 158 72.135 25.184 -20.853 1.00 25.00 C ATOM 1223 CG HIS A 158 71.647 24.634 -22.156 1.00 25.00 C ATOM 1224 ND1 HIS A 158 72.471 24.311 -23.204 1.00 25.00 N ATOM 1225 CD2 HIS A 158 70.388 24.352 -22.597 1.00 25.00 C ATOM 1226 CE1 HIS A 158 71.719 23.862 -24.204 1.00 25.00 C ATOM 1227 NE2 HIS A 158 70.440 23.872 -23.893 1.00 25.00 N ATOM 0 H HIS A 158 72.672 25.979 -18.625 1.00 25.00 H new ATOM 0 HA HIS A 158 70.250 24.960 -19.773 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.131 26.273 -20.907 1.00 25.00 H new ATOM 0 HB3 HIS A 158 73.170 24.876 -20.707 1.00 25.00 H new ATOM 0 HD2 HIS A 158 69.485 24.484 -22.020 1.00 25.00 H new ATOM 0 HE1 HIS A 158 72.109 23.530 -25.155 1.00 25.00 H new ATOM 0 HE2 HIS A 158 69.657 23.587 -24.481 1.00 25.00 H new ATOM 1235 N ARG A 159 72.287 22.818 -18.508 1.00 25.00 N ATOM 1236 CA ARG A 159 72.544 21.391 -18.306 1.00 25.00 C ATOM 1237 C ARG A 159 71.583 20.769 -17.308 1.00 25.00 C ATOM 1238 O ARG A 159 71.165 21.406 -16.344 1.00 25.00 O ATOM 1239 CB ARG A 159 73.977 21.190 -17.826 1.00 25.00 C ATOM 1240 CG ARG A 159 74.998 21.562 -18.882 1.00 25.00 C ATOM 1241 CD ARG A 159 76.404 21.487 -18.335 1.00 25.00 C ATOM 1242 NE ARG A 159 76.785 20.112 -17.963 1.00 25.00 N ATOM 1243 CZ ARG A 159 77.977 19.752 -17.506 1.00 25.00 C ATOM 1244 NH1 ARG A 159 78.954 20.615 -17.360 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.196 18.512 -17.194 1.00 25.00 N ATOM 0 H ARG A 159 72.801 23.437 -17.882 1.00 25.00 H new ATOM 0 HA ARG A 159 72.393 20.893 -19.264 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.146 21.792 -16.933 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.118 20.148 -17.539 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.901 20.892 -19.736 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.799 22.571 -19.244 1.00 25.00 H new ATOM 0 HD2 ARG A 159 77.103 21.867 -19.081 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.487 22.134 -17.462 1.00 25.00 H new ATOM 0 HE ARG A 159 76.079 19.383 -18.065 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.809 21.595 -17.601 1.00 25.00 H new ATOM 0 HH12 ARG A 159 79.859 20.306 -17.006 1.00 25.00 H new ATOM 0 HH21 ARG A 159 77.454 17.821 -17.301 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.110 18.229 -16.842 1.00 25.00 H new ATOM 1259 N SER A 160 71.270 19.503 -17.528 1.00 25.00 N ATOM 1260 CA SER A 160 70.431 18.752 -16.605 1.00 25.00 C ATOM 1261 C SER A 160 71.264 18.307 -15.410 1.00 25.00 C ATOM 1262 O SER A 160 72.493 18.267 -15.472 1.00 25.00 O ATOM 1263 CB SER A 160 69.826 17.531 -17.300 1.00 25.00 C ATOM 1264 OG SER A 160 70.840 16.628 -17.712 1.00 25.00 O ATOM 0 H SER A 160 71.585 18.971 -18.340 1.00 25.00 H new ATOM 0 HA SER A 160 69.618 19.394 -16.266 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.137 17.026 -16.622 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.245 17.851 -18.165 1.00 25.00 H new ATOM 0 HG SER A 160 70.430 15.854 -18.152 1.00 25.00 H new ATOM 1270 N LEU A 161 70.600 17.964 -14.323 1.00 25.00 N ATOM 1271 CA LEU A 161 71.288 17.531 -13.108 1.00 25.00 C ATOM 1272 C LEU A 161 72.020 16.206 -13.326 1.00 25.00 C ATOM 1273 O LEU A 161 73.129 15.996 -12.815 1.00 25.00 O ATOM 1274 CB LEU A 161 70.271 17.392 -11.974 1.00 25.00 C ATOM 1275 CG LEU A 161 69.542 18.692 -11.599 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.423 18.352 -10.645 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.498 19.714 -10.971 1.00 25.00 C ATOM 0 H LEU A 161 69.583 17.975 -14.250 1.00 25.00 H new ATOM 0 HA LEU A 161 72.034 18.281 -12.844 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.530 16.646 -12.259 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.783 17.011 -11.090 1.00 25.00 H new ATOM 0 HG LEU A 161 69.139 19.150 -12.502 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.893 19.263 -10.367 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.731 17.662 -11.127 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.836 17.885 -9.751 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.947 20.620 -10.719 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.938 19.293 -10.067 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.289 19.956 -11.681 1.00 25.00 H new ATOM 1289 N ALA A 162 71.442 15.335 -14.144 1.00 25.00 N ATOM 1290 CA ALA A 162 72.090 14.068 -14.472 1.00 25.00 C ATOM 1291 C ALA A 162 73.396 14.320 -15.233 1.00 25.00 C ATOM 1292 O ALA A 162 74.351 13.567 -15.095 1.00 25.00 O ATOM 1293 CB ALA A 162 71.156 13.197 -15.294 1.00 25.00 C ATOM 0 H ALA A 162 70.536 15.479 -14.589 1.00 25.00 H new ATOM 0 HA ALA A 162 72.325 13.545 -13.545 1.00 25.00 H new ATOM 0 HB1 ALA A 162 71.651 12.256 -15.532 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.249 12.996 -14.723 1.00 25.00 H new ATOM 0 HB3 ALA A 162 70.896 13.713 -16.218 1.00 25.00 H new ATOM 1299 N SER A 163 73.452 15.410 -15.989 1.00 25.00 N ATOM 1300 CA SER A 163 74.670 15.771 -16.721 1.00 25.00 C ATOM 1301 C SER A 163 75.766 16.217 -15.756 1.00 25.00 C ATOM 1302 O SER A 163 76.945 16.188 -16.099 1.00 25.00 O ATOM 1303 CB SER A 163 74.382 16.894 -17.725 1.00 25.00 C ATOM 1304 OG SER A 163 75.537 17.225 -18.484 1.00 25.00 O ATOM 0 H SER A 163 72.675 16.059 -16.114 1.00 25.00 H new ATOM 0 HA SER A 163 75.011 14.888 -17.262 1.00 25.00 H new ATOM 0 HB2 SER A 163 73.580 16.586 -18.396 1.00 25.00 H new ATOM 0 HB3 SER A 163 74.030 17.778 -17.193 1.00 25.00 H new ATOM 0 HG SER A 163 75.286 17.823 -19.218 1.00 25.00 H new ATOM 1310 N TYR A 164 75.390 16.609 -14.545 1.00 25.00 N ATOM 1311 CA TYR A 164 76.366 17.001 -13.527 1.00 25.00 C ATOM 1312 C TYR A 164 76.694 15.807 -12.639 1.00 25.00 C ATOM 1313 O TYR A 164 77.569 15.885 -11.784 1.00 25.00 O ATOM 1314 CB TYR A 164 75.811 18.126 -12.656 1.00 25.00 C ATOM 1315 CG TYR A 164 75.938 19.501 -13.259 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.194 20.134 -13.323 1.00 25.00 C ATOM 1317 CD2 TYR A 164 74.807 20.193 -13.742 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.321 21.439 -13.848 1.00 25.00 C ATOM 1319 CE2 TYR A 164 74.933 21.505 -14.266 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.190 22.113 -14.307 1.00 25.00 C ATOM 1321 OH TYR A 164 76.346 23.378 -14.785 1.00 25.00 O ATOM 0 H TYR A 164 74.418 16.665 -14.241 1.00 25.00 H new ATOM 0 HA TYR A 164 77.267 17.349 -14.033 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.759 17.927 -12.454 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.328 18.114 -11.696 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.071 19.615 -12.966 1.00 25.00 H new ATOM 0 HD2 TYR A 164 73.837 19.719 -13.712 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.290 21.913 -13.894 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.063 22.030 -14.631 1.00 25.00 H new ATOM 0 HH TYR A 164 75.497 23.693 -15.160 1.00 25.00 H new ATOM 1331 N GLY A 165 75.989 14.706 -12.850 1.00 25.00 N ATOM 1332 CA GLY A 165 76.206 13.512 -12.057 1.00 25.00 C ATOM 1333 C GLY A 165 75.439 13.511 -10.751 1.00 25.00 C ATOM 1334 O GLY A 165 75.803 12.771 -9.842 1.00 25.00 O ATOM 0 H GLY A 165 75.264 14.617 -13.562 1.00 25.00 H new ATOM 0 HA2 GLY A 165 75.916 12.639 -12.641 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.271 13.414 -11.845 1.00 25.00 H new ATOM 1338 N LEU A 166 74.375 14.304 -10.644 1.00 25.00 N ATOM 1339 CA LEU A 166 73.571 14.301 -9.419 1.00 25.00 C ATOM 1340 C LEU A 166 72.777 12.999 -9.329 1.00 25.00 C ATOM 1341 O LEU A 166 71.634 12.910 -9.783 1.00 25.00 O ATOM 1342 CB LEU A 166 72.600 15.489 -9.373 1.00 25.00 C ATOM 1343 CG LEU A 166 73.056 16.830 -8.773 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.470 16.666 -7.321 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.176 17.475 -9.556 1.00 25.00 C ATOM 0 H LEU A 166 74.053 14.943 -11.370 1.00 25.00 H new ATOM 0 HA LEU A 166 74.254 14.387 -8.574 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.277 15.684 -10.396 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.720 15.167 -8.817 1.00 25.00 H new ATOM 0 HG LEU A 166 72.194 17.495 -8.830 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.788 17.629 -6.922 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.625 16.294 -6.741 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.295 15.957 -7.256 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.454 18.417 -9.084 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.039 16.809 -9.573 1.00 25.00 H new ATOM 0 HD23 LEU A 166 73.844 17.665 -10.577 1.00 25.00 H new ATOM 1357 N LYS A 167 73.409 11.986 -8.765 1.00 25.00 N ATOM 1358 CA LYS A 167 72.761 10.696 -8.530 1.00 25.00 C ATOM 1359 C LYS A 167 71.771 10.804 -7.394 1.00 25.00 C ATOM 1360 O LYS A 167 71.837 11.701 -6.573 1.00 25.00 O ATOM 1361 CB LYS A 167 73.806 9.636 -8.163 1.00 25.00 C ATOM 1362 CG LYS A 167 74.673 9.189 -9.324 1.00 25.00 C ATOM 1363 CD LYS A 167 73.835 8.447 -10.360 1.00 25.00 C ATOM 1364 CE LYS A 167 74.699 7.845 -11.440 1.00 25.00 C ATOM 1365 NZ LYS A 167 73.823 7.152 -12.439 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.380 12.027 -8.456 1.00 25.00 H new ATOM 0 HA LYS A 167 72.244 10.407 -9.445 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.448 10.032 -7.376 1.00 25.00 H new ATOM 0 HB3 LYS A 167 73.295 8.766 -7.750 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.149 10.055 -9.785 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.471 8.541 -8.962 1.00 25.00 H new ATOM 0 HD2 LYS A 167 73.262 7.660 -9.870 1.00 25.00 H new ATOM 0 HD3 LYS A 167 73.116 9.133 -10.808 1.00 25.00 H new ATOM 0 HE2 LYS A 167 75.285 8.623 -11.930 1.00 25.00 H new ATOM 0 HE3 LYS A 167 75.406 7.138 -11.006 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 74.413 6.734 -13.187 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 73.282 6.401 -11.965 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 73.165 7.839 -12.860 1.00 25.00 H new ATOM 1379 N ASP A 168 70.868 9.845 -7.332 1.00 25.00 N ATOM 1380 CA ASP A 168 69.929 9.750 -6.234 1.00 25.00 C ATOM 1381 C ASP A 168 70.726 9.602 -4.940 1.00 25.00 C ATOM 1382 O ASP A 168 71.626 8.776 -4.837 1.00 25.00 O ATOM 1383 CB ASP A 168 68.975 8.557 -6.435 1.00 25.00 C ATOM 1384 CG ASP A 168 69.692 7.286 -6.921 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.244 7.294 -8.061 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.616 6.260 -6.219 1.00 25.00 O1- ATOM 0 H ASP A 168 70.765 9.115 -8.037 1.00 25.00 H new ATOM 0 HA ASP A 168 69.314 10.649 -6.188 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.467 8.343 -5.495 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.206 8.832 -7.157 1.00 25.00 H new ATOM 1391 N GLY A 169 70.424 10.465 -3.980 1.00 25.00 N ATOM 1392 CA GLY A 169 71.135 10.479 -2.712 1.00 25.00 C ATOM 1393 C GLY A 169 72.187 11.569 -2.600 1.00 25.00 C ATOM 1394 O GLY A 169 72.628 11.875 -1.491 1.00 25.00 O ATOM 0 H GLY A 169 69.688 11.167 -4.057 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.413 10.602 -1.905 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.614 9.511 -2.566 1.00 25.00 H new ATOM 1398 N ASP A 170 72.580 12.182 -3.709 1.00 25.00 N ATOM 1399 CA ASP A 170 73.564 13.268 -3.661 1.00 25.00 C ATOM 1400 C ASP A 170 72.987 14.488 -2.955 1.00 25.00 C ATOM 1401 O ASP A 170 71.767 14.684 -2.888 1.00 25.00 O ATOM 1402 CB ASP A 170 74.034 13.680 -5.061 1.00 25.00 C ATOM 1403 CG ASP A 170 75.270 12.923 -5.502 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.243 12.890 -4.719 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.299 12.416 -6.643 1.00 25.00 O1- ATOM 0 H ASP A 170 72.241 11.954 -4.644 1.00 25.00 H new ATOM 0 HA ASP A 170 74.421 12.889 -3.105 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.230 13.506 -5.777 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.244 14.750 -5.071 1.00 25.00 H new ATOM 1410 N VAL A 171 73.877 15.314 -2.426 1.00 25.00 N ATOM 1411 CA VAL A 171 73.484 16.496 -1.665 1.00 25.00 C ATOM 1412 C VAL A 171 74.113 17.755 -2.263 1.00 25.00 C ATOM 1413 O VAL A 171 75.282 17.755 -2.667 1.00 25.00 O ATOM 1414 CB VAL A 171 73.850 16.321 -0.142 1.00 25.00 C ATOM 1415 CG1 VAL A 171 75.339 15.986 0.043 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.476 17.570 0.683 1.00 25.00 C ATOM 0 H VAL A 171 74.886 15.188 -2.510 1.00 25.00 H new ATOM 0 HA VAL A 171 72.402 16.612 -1.729 1.00 25.00 H new ATOM 0 HB VAL A 171 73.261 15.483 0.229 1.00 25.00 H new ATOM 0 HG11 VAL A 171 75.557 15.872 1.105 1.00 25.00 H new ATOM 0 HG12 VAL A 171 75.570 15.056 -0.477 1.00 25.00 H new ATOM 0 HG13 VAL A 171 75.947 16.792 -0.368 1.00 25.00 H new ATOM 0 HG21 VAL A 171 73.744 17.410 1.727 1.00 25.00 H new ATOM 0 HG22 VAL A 171 74.016 18.435 0.298 1.00 25.00 H new ATOM 0 HG23 VAL A 171 72.403 17.748 0.607 1.00 25.00 H new ATOM 1426 N VAL A 172 73.339 18.831 -2.320 1.00 25.00 N ATOM 1427 CA VAL A 172 73.848 20.118 -2.780 1.00 25.00 C ATOM 1428 C VAL A 172 73.788 21.078 -1.607 1.00 25.00 C ATOM 1429 O VAL A 172 73.027 20.878 -0.658 1.00 25.00 O ATOM 1430 CB VAL A 172 73.050 20.683 -3.993 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.151 19.740 -5.187 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.585 20.897 -3.640 1.00 25.00 C ATOM 0 H VAL A 172 72.355 18.839 -2.053 1.00 25.00 H new ATOM 0 HA VAL A 172 74.871 19.990 -3.132 1.00 25.00 H new ATOM 0 HB VAL A 172 73.490 21.646 -4.254 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.587 20.152 -6.024 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.196 19.627 -5.474 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.741 18.767 -4.917 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.056 21.292 -4.507 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.139 19.947 -3.344 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.509 21.606 -2.815 1.00 25.00 H new ATOM 1442 N ILE A 173 74.611 22.108 -1.661 1.00 25.00 N ATOM 1443 CA ILE A 173 74.707 23.084 -0.587 1.00 25.00 C ATOM 1444 C ILE A 173 74.412 24.447 -1.193 1.00 25.00 C ATOM 1445 O ILE A 173 74.989 24.829 -2.208 1.00 25.00 O ATOM 1446 CB ILE A 173 76.115 23.034 0.077 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.256 21.732 0.889 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.373 24.288 0.952 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.687 21.426 1.368 1.00 25.00 C ATOM 0 H ILE A 173 75.232 22.293 -2.449 1.00 25.00 H new ATOM 0 HA ILE A 173 73.990 22.869 0.205 1.00 25.00 H new ATOM 0 HB ILE A 173 76.875 23.039 -0.705 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.601 21.789 1.758 1.00 25.00 H new ATOM 0 HG13 ILE A 173 75.905 20.899 0.279 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.364 24.221 1.401 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.315 25.183 0.332 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.621 24.343 1.740 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.691 20.492 1.930 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.347 21.333 0.506 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.038 22.236 2.008 1.00 25.00 H new ATOM 1461 N LEU A 174 73.501 25.171 -0.572 1.00 25.00 N ATOM 1462 CA LEU A 174 73.106 26.495 -1.019 1.00 25.00 C ATOM 1463 C LEU A 174 73.505 27.483 0.068 1.00 25.00 C ATOM 1464 O LEU A 174 73.328 27.211 1.242 1.00 25.00 O ATOM 1465 CB LEU A 174 71.594 26.515 -1.267 1.00 25.00 C ATOM 1466 CG LEU A 174 71.023 27.877 -1.674 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.969 27.731 -2.758 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.418 28.599 -0.464 1.00 25.00 C ATOM 0 H LEU A 174 73.009 24.855 0.264 1.00 25.00 H new ATOM 0 HA LEU A 174 73.598 26.766 -1.953 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.359 25.791 -2.048 1.00 25.00 H new ATOM 0 HB3 LEU A 174 71.088 26.182 -0.361 1.00 25.00 H new ATOM 0 HG LEU A 174 71.848 28.470 -2.067 1.00 25.00 H new ATOM 0 HD11 LEU A 174 69.583 28.715 -3.025 1.00 25.00 H new ATOM 0 HD12 LEU A 174 70.413 27.265 -3.637 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.153 27.109 -2.391 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.019 29.564 -0.778 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.615 27.994 -0.043 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.189 28.754 0.291 1.00 25.00 H new ATOM 1480 N ARG A 175 74.067 28.617 -0.316 1.00 25.00 N ATOM 1481 CA ARG A 175 74.500 29.641 0.641 1.00 25.00 C ATOM 1482 C ARG A 175 73.956 30.996 0.208 1.00 25.00 C ATOM 1483 O ARG A 175 74.399 31.561 -0.788 1.00 25.00 O ATOM 1484 CB ARG A 175 76.027 29.688 0.691 1.00 25.00 C ATOM 1485 CG ARG A 175 76.660 28.527 1.452 1.00 25.00 C ATOM 1486 CD ARG A 175 78.110 28.317 1.033 1.00 25.00 C ATOM 1487 NE ARG A 175 78.888 29.567 1.076 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.204 29.658 0.907 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.962 28.610 0.712 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.765 30.836 0.936 1.00 25.00 N ATOM 0 H ARG A 175 74.238 28.860 -1.292 1.00 25.00 H new ATOM 0 HA ARG A 175 74.120 29.397 1.633 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.413 29.694 -0.328 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.336 30.625 1.155 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.613 28.723 2.523 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.091 27.616 1.269 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.573 27.580 1.689 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.139 27.907 0.023 1.00 25.00 H new ATOM 0 HE ARG A 175 78.376 30.432 1.249 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.547 27.679 0.685 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.968 28.724 0.587 1.00 25.00 H new ATOM 0 HH21 ARG A 175 80.195 31.669 1.087 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.773 30.924 0.808 1.00 25.00 H new ATOM 1504 N GLN A 176 72.980 31.503 0.964 1.00 25.00 N ATOM 1505 CA GLN A 176 72.309 32.781 0.666 1.00 25.00 C ATOM 1506 C GLN A 176 72.954 33.950 1.420 1.00 25.00 C ATOM 1507 O GLN A 176 73.355 33.873 2.571 1.00 25.00 O ATOM 1508 CB GLN A 176 70.795 32.633 0.954 1.00 25.00 C ATOM 1509 CG GLN A 176 69.942 33.762 0.320 1.00 25.00 C ATOM 1510 CD GLN A 176 69.730 34.941 1.243 1.00 25.00 C ATOM 1511 OE1 GLN A 176 69.861 34.899 2.447 1.00 25.00 O ATOM 1512 NE2 GLN A 176 69.329 36.055 0.668 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.111 34.941 0.761 1.00 25.00 O ATOM 0 H GLN A 176 72.628 31.042 1.803 1.00 25.00 H new ATOM 0 HA GLN A 176 72.431 33.021 -0.390 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.452 31.670 0.575 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.635 32.627 2.032 1.00 25.00 H new ATOM 0 HG2 GLN A 176 70.428 34.107 -0.593 1.00 25.00 H new ATOM 0 HG3 GLN A 176 68.972 33.357 0.031 1.00 25.00 H new ATOM 0 HE21 GLN A 176 69.218 36.095 -0.345 1.00 25.00 H new ATOM 0 HE22 GLN A 176 69.130 36.879 1.236 1.00 25.00 H new