USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=18 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 107 CYS SG : rot -53:sc= 0.414 USER MOD Set 1.2: A 138 SER OG : rot 161:sc= 1.1 USER MOD Set 2.1: A 128 HIS : no HE2:sc= 0.282 K(o=0.27,f=-3.3!) USER MOD Set 2.2: A 157 ASN : amide:sc= -0.0166 K(o=0.27,f=-0.66) USER MOD Set 3.1: A 100 HIS : no HD1:sc= 0.416 K(o=0.89,f=0) USER MOD Set 3.2: A 120 GLN : amide:sc= 0.478 K(o=0.89,f=0) USER MOD Set 4.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl -152:sc= -0.153 (180deg=-1.31) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= -0.025 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 134 CYS SG : rot -18:sc= 0.62 USER MOD Single : A 145 SER OG : rot -84:sc= 0.0606 USER MOD Single : A 146 GLN :FLIP amide:sc= -0.103 F(o=-1.2!,f=-0.1) USER MOD Single : A 149 TYR OH : rot 3:sc= 1.27 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 HIS : no HE2:sc= 0.725 K(o=0.72,f=-2.5!) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot -18:sc= 0.211 USER MOD Single : A 164 TYR OH : rot 178:sc= 0.534 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.0662 K(o=0.066,f=-4.5!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 62.488 8.675 -10.604 1.00 25.00 N ATOM 307 CA HIS A 100 62.746 10.070 -10.289 1.00 25.00 C ATOM 308 C HIS A 100 64.080 9.950 -9.577 1.00 25.00 C ATOM 309 O HIS A 100 64.510 8.827 -9.301 1.00 25.00 O ATOM 310 CB HIS A 100 61.682 10.659 -9.353 1.00 25.00 C ATOM 311 CG HIS A 100 61.715 10.085 -7.970 1.00 25.00 C ATOM 312 ND1 HIS A 100 61.133 8.896 -7.606 1.00 25.00 N ATOM 313 CD2 HIS A 100 62.293 10.557 -6.830 1.00 25.00 C ATOM 314 CE1 HIS A 100 61.374 8.692 -6.316 1.00 25.00 C ATOM 315 NE2 HIS A 100 62.072 9.678 -5.788 1.00 25.00 N ATOM 0 HA HIS A 100 62.737 10.729 -11.157 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.821 11.738 -9.293 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.696 10.488 -9.785 1.00 25.00 H new ATOM 0 HD2 HIS A 100 62.843 11.483 -6.753 1.00 25.00 H new ATOM 0 HE1 HIS A 100 61.039 7.825 -5.767 1.00 25.00 H new ATOM 0 HE2 HIS A 100 62.381 9.771 -4.821 1.00 25.00 H new ATOM 323 N MET A 101 64.710 11.060 -9.237 1.00 25.00 N ATOM 324 CA MET A 101 65.912 11.037 -8.415 1.00 25.00 C ATOM 325 C MET A 101 65.598 11.868 -7.183 1.00 25.00 C ATOM 326 O MET A 101 64.915 12.884 -7.286 1.00 25.00 O ATOM 327 CB MET A 101 67.114 11.616 -9.167 1.00 25.00 C ATOM 328 CG MET A 101 67.380 10.928 -10.504 1.00 25.00 C ATOM 329 SD MET A 101 68.963 11.397 -11.251 1.00 25.00 S ATOM 330 CE MET A 101 68.795 13.209 -11.413 1.00 25.00 C ATOM 0 H MET A 101 64.410 11.994 -9.518 1.00 25.00 H new ATOM 0 HA MET A 101 66.181 10.015 -8.150 1.00 25.00 H new ATOM 0 HB2 MET A 101 66.947 12.679 -9.340 1.00 25.00 H new ATOM 0 HB3 MET A 101 68.001 11.531 -8.540 1.00 25.00 H new ATOM 0 HG2 MET A 101 67.361 9.848 -10.359 1.00 25.00 H new ATOM 0 HG3 MET A 101 66.574 11.171 -11.196 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.400 13.557 -12.250 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.750 13.463 -11.590 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.134 13.689 -10.495 1.00 25.00 H new ATOM 340 N LEU A 102 66.056 11.423 -6.024 1.00 25.00 N ATOM 341 CA LEU A 102 65.818 12.135 -4.771 1.00 25.00 C ATOM 342 C LEU A 102 67.133 12.762 -4.340 1.00 25.00 C ATOM 343 O LEU A 102 68.124 12.062 -4.186 1.00 25.00 O ATOM 344 CB LEU A 102 65.323 11.160 -3.696 1.00 25.00 C ATOM 345 CG LEU A 102 65.037 11.766 -2.308 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.824 12.695 -2.335 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.794 10.641 -1.306 1.00 25.00 C ATOM 0 H LEU A 102 66.599 10.566 -5.921 1.00 25.00 H new ATOM 0 HA LEU A 102 65.056 12.902 -4.908 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.411 10.686 -4.057 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.067 10.372 -3.579 1.00 25.00 H new ATOM 0 HG LEU A 102 65.904 12.356 -2.012 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.655 13.102 -1.338 1.00 25.00 H new ATOM 0 HD12 LEU A 102 64.006 13.511 -3.034 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.944 12.135 -2.652 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.591 11.067 -0.323 1.00 25.00 H new ATOM 0 HD22 LEU A 102 63.939 10.046 -1.627 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.678 10.006 -1.251 1.00 25.00 H new ATOM 359 N LEU A 103 67.149 14.072 -4.175 1.00 25.00 N ATOM 360 CA LEU A 103 68.370 14.790 -3.812 1.00 25.00 C ATOM 361 C LEU A 103 68.138 15.597 -2.566 1.00 25.00 C ATOM 362 O LEU A 103 67.029 16.055 -2.320 1.00 25.00 O ATOM 363 CB LEU A 103 68.771 15.735 -4.940 1.00 25.00 C ATOM 364 CG LEU A 103 69.328 15.041 -6.185 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.325 16.007 -7.324 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.740 14.551 -5.941 1.00 25.00 C ATOM 0 H LEU A 103 66.329 14.668 -4.286 1.00 25.00 H new ATOM 0 HA LEU A 103 69.163 14.063 -3.639 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.901 16.326 -5.228 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.519 16.432 -4.563 1.00 25.00 H new ATOM 0 HG LEU A 103 68.701 14.181 -6.420 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.721 15.520 -8.215 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.305 16.341 -7.515 1.00 25.00 H new ATOM 0 HD13 LEU A 103 69.947 16.866 -7.074 1.00 25.00 H new ATOM 0 HD21 LEU A 103 71.115 14.061 -6.839 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.381 15.397 -5.694 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.741 13.842 -5.114 1.00 25.00 H new ATOM 378 N THR A 104 69.188 15.795 -1.792 1.00 25.00 N ATOM 379 CA THR A 104 69.100 16.582 -0.572 1.00 25.00 C ATOM 380 C THR A 104 69.677 17.968 -0.852 1.00 25.00 C ATOM 381 O THR A 104 70.631 18.110 -1.607 1.00 25.00 O ATOM 382 CB THR A 104 69.861 15.872 0.565 1.00 25.00 C ATOM 383 OG1 THR A 104 69.403 14.521 0.654 1.00 25.00 O ATOM 384 CG2 THR A 104 69.623 16.531 1.909 1.00 25.00 C ATOM 0 H THR A 104 70.117 15.421 -1.986 1.00 25.00 H new ATOM 0 HA THR A 104 68.062 16.687 -0.255 1.00 25.00 H new ATOM 0 HB THR A 104 70.925 15.927 0.333 1.00 25.00 H new ATOM 0 HG1 THR A 104 69.882 14.060 1.374 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.179 15.997 2.680 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.960 17.567 1.871 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.559 16.504 2.144 1.00 25.00 H new ATOM 392 N VAL A 105 69.081 18.991 -0.272 1.00 25.00 N ATOM 393 CA VAL A 105 69.545 20.359 -0.434 1.00 25.00 C ATOM 394 C VAL A 105 69.778 20.926 0.956 1.00 25.00 C ATOM 395 O VAL A 105 68.857 20.978 1.774 1.00 25.00 O ATOM 396 CB VAL A 105 68.490 21.226 -1.161 1.00 25.00 C ATOM 397 CG1 VAL A 105 68.996 22.673 -1.353 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.099 20.610 -2.516 1.00 25.00 C ATOM 0 H VAL A 105 68.260 18.899 0.326 1.00 25.00 H new ATOM 0 HA VAL A 105 70.456 20.367 -1.032 1.00 25.00 H new ATOM 0 HB VAL A 105 67.601 21.254 -0.531 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.234 23.260 -1.867 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.202 23.118 -0.380 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.909 22.663 -1.948 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.356 21.242 -3.002 1.00 25.00 H new ATOM 0 HG22 VAL A 105 68.982 20.535 -3.150 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.681 19.616 -2.357 1.00 25.00 H new ATOM 408 N TYR A 106 71.001 21.353 1.225 1.00 25.00 N ATOM 409 CA TYR A 106 71.327 21.991 2.493 1.00 25.00 C ATOM 410 C TYR A 106 71.361 23.496 2.253 1.00 25.00 C ATOM 411 O TYR A 106 72.207 23.992 1.513 1.00 25.00 O ATOM 412 CB TYR A 106 72.680 21.498 3.011 1.00 25.00 C ATOM 413 CG TYR A 106 72.894 21.807 4.476 1.00 25.00 C ATOM 414 CD1 TYR A 106 73.253 23.102 4.905 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.726 20.803 5.451 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.429 23.389 6.289 1.00 25.00 C ATOM 417 CE2 TYR A 106 72.900 21.086 6.831 1.00 25.00 C ATOM 418 CZ TYR A 106 73.244 22.379 7.234 1.00 25.00 C ATOM 419 OH TYR A 106 73.402 22.657 8.565 1.00 25.00 O ATOM 0 H TYR A 106 71.788 21.270 0.581 1.00 25.00 H new ATOM 0 HA TYR A 106 70.580 21.743 3.247 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.753 20.421 2.857 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.477 21.958 2.427 1.00 25.00 H new ATOM 0 HD1 TYR A 106 73.396 23.885 4.175 1.00 25.00 H new ATOM 0 HD2 TYR A 106 72.461 19.802 5.143 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.704 24.384 6.606 1.00 25.00 H new ATOM 0 HE2 TYR A 106 72.767 20.306 7.566 1.00 25.00 H new ATOM 0 HH TYR A 106 73.237 21.846 9.090 1.00 25.00 H new ATOM 429 N CYS A 107 70.424 24.222 2.837 1.00 25.00 N ATOM 430 CA CYS A 107 70.343 25.665 2.655 1.00 25.00 C ATOM 431 C CYS A 107 70.979 26.382 3.833 1.00 25.00 C ATOM 432 O CYS A 107 70.493 26.298 4.957 1.00 25.00 O ATOM 433 CB CYS A 107 68.887 26.104 2.545 1.00 25.00 C ATOM 434 SG CYS A 107 68.731 27.893 2.406 1.00 25.00 S ATOM 0 H CYS A 107 69.703 23.835 3.446 1.00 25.00 H new ATOM 0 HA CYS A 107 70.875 25.920 1.738 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.431 25.632 1.675 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.337 25.759 3.421 1.00 25.00 H new ATOM 0 HG CYS A 107 69.365 28.462 3.388 1.00 25.00 H new ATOM 440 N VAL A 108 72.046 27.116 3.567 1.00 25.00 N ATOM 441 CA VAL A 108 72.733 27.878 4.600 1.00 25.00 C ATOM 442 C VAL A 108 72.202 29.305 4.632 1.00 25.00 C ATOM 443 O VAL A 108 72.413 30.094 3.697 1.00 25.00 O ATOM 444 CB VAL A 108 74.266 27.891 4.380 1.00 25.00 C ATOM 445 CG1 VAL A 108 74.972 28.625 5.536 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.790 26.457 4.284 1.00 25.00 C ATOM 0 H VAL A 108 72.459 27.202 2.638 1.00 25.00 H new ATOM 0 HA VAL A 108 72.538 27.392 5.556 1.00 25.00 H new ATOM 0 HB VAL A 108 74.478 28.417 3.449 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.048 28.624 5.364 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.614 29.653 5.587 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.754 28.118 6.476 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.869 26.473 4.129 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.564 25.924 5.208 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.311 25.950 3.446 1.00 25.00 H new ATOM 456 N ARG A 109 71.523 29.642 5.716 1.00 25.00 N ATOM 457 CA ARG A 109 71.031 31.000 5.938 1.00 25.00 C ATOM 458 C ARG A 109 72.083 31.722 6.757 1.00 25.00 C ATOM 459 O ARG A 109 72.663 31.145 7.661 1.00 25.00 O ATOM 460 CB ARG A 109 69.713 30.962 6.701 1.00 25.00 C ATOM 461 CG ARG A 109 68.508 30.570 5.832 1.00 25.00 C ATOM 462 CD ARG A 109 67.868 31.795 5.173 1.00 25.00 C ATOM 463 NE ARG A 109 67.215 32.649 6.183 1.00 25.00 N ATOM 464 CZ ARG A 109 67.282 33.975 6.244 1.00 25.00 C ATOM 465 NH1 ARG A 109 67.935 34.698 5.368 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 66.678 34.588 7.222 1.00 25.00 N ATOM 0 H ARG A 109 71.296 28.989 6.466 1.00 25.00 H new ATOM 0 HA ARG A 109 70.855 31.509 4.991 1.00 25.00 H new ATOM 0 HB2 ARG A 109 69.801 30.254 7.525 1.00 25.00 H new ATOM 0 HB3 ARG A 109 69.529 31.942 7.141 1.00 25.00 H new ATOM 0 HG2 ARG A 109 68.827 29.867 5.063 1.00 25.00 H new ATOM 0 HG3 ARG A 109 67.767 30.057 6.446 1.00 25.00 H new ATOM 0 HD2 ARG A 109 68.629 32.368 4.642 1.00 25.00 H new ATOM 0 HD3 ARG A 109 67.136 31.475 4.432 1.00 25.00 H new ATOM 0 HE ARG A 109 66.662 32.179 6.900 1.00 25.00 H new ATOM 0 HH11 ARG A 109 68.422 34.245 4.595 1.00 25.00 H new ATOM 0 HH12 ARG A 109 67.956 35.714 5.459 1.00 25.00 H new ATOM 0 HH21 ARG A 109 66.166 34.051 7.922 1.00 25.00 H new ATOM 0 HH22 ARG A 109 66.717 35.605 7.288 1.00 25.00 H new ATOM 480 N ARG A 110 72.334 32.981 6.432 1.00 25.00 N ATOM 481 CA ARG A 110 73.380 33.756 7.103 1.00 25.00 C ATOM 482 C ARG A 110 73.107 33.925 8.592 1.00 25.00 C ATOM 483 O ARG A 110 74.023 34.035 9.395 1.00 25.00 O ATOM 484 CB ARG A 110 73.506 35.125 6.431 1.00 25.00 C ATOM 485 CG ARG A 110 74.736 35.902 6.867 1.00 25.00 C ATOM 486 CD ARG A 110 74.905 37.163 6.051 1.00 25.00 C ATOM 487 NE ARG A 110 76.152 37.857 6.414 1.00 25.00 N ATOM 488 CZ ARG A 110 76.636 38.933 5.804 1.00 25.00 C ATOM 489 NH1 ARG A 110 76.032 39.490 4.784 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 77.757 39.449 6.224 1.00 25.00 N ATOM 0 H ARG A 110 71.830 33.493 5.708 1.00 25.00 H new ATOM 0 HA ARG A 110 74.316 33.206 7.010 1.00 25.00 H new ATOM 0 HB2 ARG A 110 73.536 34.989 5.350 1.00 25.00 H new ATOM 0 HB3 ARG A 110 72.616 35.714 6.654 1.00 25.00 H new ATOM 0 HG2 ARG A 110 74.652 36.158 7.923 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.622 35.276 6.760 1.00 25.00 H new ATOM 0 HD2 ARG A 110 74.917 36.916 4.989 1.00 25.00 H new ATOM 0 HD3 ARG A 110 74.054 37.824 6.215 1.00 25.00 H new ATOM 0 HE ARG A 110 76.687 37.481 7.197 1.00 25.00 H new ATOM 0 HH11 ARG A 110 75.159 39.098 4.432 1.00 25.00 H new ATOM 0 HH12 ARG A 110 76.435 40.316 4.342 1.00 25.00 H new ATOM 0 HH21 ARG A 110 78.250 39.026 7.011 1.00 25.00 H new ATOM 0 HH22 ARG A 110 78.141 40.275 5.766 1.00 25.00 H new ATOM 504 N ASP A 111 71.835 33.916 8.944 1.00 25.00 N ATOM 505 CA ASP A 111 71.386 34.092 10.323 1.00 25.00 C ATOM 506 C ASP A 111 71.415 32.780 11.123 1.00 25.00 C ATOM 507 O ASP A 111 70.735 32.656 12.137 1.00 25.00 O ATOM 508 CB ASP A 111 69.962 34.651 10.290 1.00 25.00 C ATOM 509 CG ASP A 111 69.808 35.772 9.278 1.00 25.00 C ATOM 510 OD1 ASP A 111 70.093 36.938 9.611 1.00 25.00 O ATOM 511 OD2 ASP A 111 69.464 35.464 8.108 1.00 25.00 O1- ATOM 0 H ASP A 111 71.073 33.785 8.279 1.00 25.00 H new ATOM 0 HA ASP A 111 72.068 34.779 10.825 1.00 25.00 H new ATOM 0 HB2 ASP A 111 69.264 33.849 10.050 1.00 25.00 H new ATOM 0 HB3 ASP A 111 69.695 35.019 11.281 1.00 25.00 H new ATOM 516 N LEU A 112 72.166 31.799 10.621 1.00 25.00 N ATOM 517 CA LEU A 112 72.299 30.454 11.222 1.00 25.00 C ATOM 518 C LEU A 112 70.945 29.755 11.342 1.00 25.00 C ATOM 519 O LEU A 112 70.733 28.877 12.165 1.00 25.00 O ATOM 520 CB LEU A 112 73.016 30.508 12.582 1.00 25.00 C ATOM 521 CG LEU A 112 74.413 31.157 12.576 1.00 25.00 C ATOM 522 CD1 LEU A 112 74.945 31.225 14.008 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.404 30.380 11.697 1.00 25.00 C ATOM 0 H LEU A 112 72.714 31.911 9.768 1.00 25.00 H new ATOM 0 HA LEU A 112 72.918 29.863 10.547 1.00 25.00 H new ATOM 0 HB2 LEU A 112 72.385 31.054 13.283 1.00 25.00 H new ATOM 0 HB3 LEU A 112 73.110 29.491 12.963 1.00 25.00 H new ATOM 0 HG LEU A 112 74.315 32.159 12.158 1.00 25.00 H new ATOM 0 HD11 LEU A 112 75.934 31.684 14.007 1.00 25.00 H new ATOM 0 HD12 LEU A 112 74.268 31.822 14.620 1.00 25.00 H new ATOM 0 HD13 LEU A 112 75.013 30.218 14.419 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.376 30.873 11.722 1.00 25.00 H new ATOM 0 HD22 LEU A 112 75.503 29.362 12.073 1.00 25.00 H new ATOM 0 HD23 LEU A 112 75.037 30.353 10.671 1.00 25.00 H new ATOM 535 N SER A 113 70.048 30.144 10.452 1.00 25.00 N ATOM 536 CA SER A 113 68.705 29.572 10.331 1.00 25.00 C ATOM 537 C SER A 113 68.740 28.429 9.324 1.00 25.00 C ATOM 538 O SER A 113 67.798 28.225 8.566 1.00 25.00 O ATOM 539 CB SER A 113 67.717 30.636 9.875 1.00 25.00 C ATOM 540 OG SER A 113 67.888 31.827 10.621 1.00 25.00 O ATOM 0 H SER A 113 70.232 30.884 9.774 1.00 25.00 H new ATOM 0 HA SER A 113 68.383 29.196 11.302 1.00 25.00 H new ATOM 0 HB2 SER A 113 67.859 30.841 8.814 1.00 25.00 H new ATOM 0 HB3 SER A 113 66.698 30.269 9.995 1.00 25.00 H new ATOM 0 HG SER A 113 67.246 32.501 10.314 1.00 25.00 H new ATOM 546 N GLU A 114 69.913 27.836 9.185 1.00 25.00 N ATOM 547 CA GLU A 114 70.190 26.887 8.117 1.00 25.00 C ATOM 548 C GLU A 114 69.474 25.559 8.347 1.00 25.00 C ATOM 549 O GLU A 114 69.134 25.197 9.472 1.00 25.00 O ATOM 550 CB GLU A 114 71.706 26.692 7.991 1.00 25.00 C ATOM 551 CG GLU A 114 72.434 26.237 9.252 1.00 25.00 C ATOM 552 CD GLU A 114 73.908 26.615 9.197 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.199 27.835 9.234 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.769 25.722 9.057 1.00 25.00 O1- ATOM 0 H GLU A 114 70.703 27.998 9.810 1.00 25.00 H new ATOM 0 HA GLU A 114 69.806 27.290 7.180 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.893 25.961 7.205 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.146 27.633 7.662 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.971 26.691 10.128 1.00 25.00 H new ATOM 0 HG3 GLU A 114 72.336 25.157 9.364 1.00 25.00 H new ATOM 561 N VAL A 115 69.129 24.913 7.242 1.00 25.00 N ATOM 562 CA VAL A 115 68.195 23.792 7.252 1.00 25.00 C ATOM 563 C VAL A 115 68.552 22.868 6.096 1.00 25.00 C ATOM 564 O VAL A 115 69.216 23.282 5.152 1.00 25.00 O ATOM 565 CB VAL A 115 66.715 24.339 7.107 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.472 24.952 5.710 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.663 23.254 7.409 1.00 25.00 C ATOM 0 H VAL A 115 69.486 25.149 6.316 1.00 25.00 H new ATOM 0 HA VAL A 115 68.260 23.239 8.189 1.00 25.00 H new ATOM 0 HB VAL A 115 66.601 25.127 7.852 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.447 25.317 5.646 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.163 25.780 5.551 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.635 24.192 4.946 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.664 23.675 7.297 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.787 22.424 6.714 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.793 22.895 8.430 1.00 25.00 H new ATOM 577 N THR A 116 68.094 21.631 6.153 1.00 25.00 N ATOM 578 CA THR A 116 68.281 20.693 5.058 1.00 25.00 C ATOM 579 C THR A 116 66.917 20.101 4.735 1.00 25.00 C ATOM 580 O THR A 116 66.076 19.950 5.625 1.00 25.00 O ATOM 581 CB THR A 116 69.325 19.598 5.413 1.00 25.00 C ATOM 582 OG1 THR A 116 69.584 18.791 4.265 1.00 25.00 O ATOM 583 CG2 THR A 116 68.857 18.690 6.548 1.00 25.00 C ATOM 0 H THR A 116 67.586 21.249 6.951 1.00 25.00 H new ATOM 0 HA THR A 116 68.683 21.203 4.183 1.00 25.00 H new ATOM 0 HB THR A 116 70.227 20.114 5.741 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.244 18.103 4.491 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.623 17.943 6.756 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.680 19.287 7.442 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.933 18.190 6.257 1.00 25.00 H new ATOM 591 N PHE A 117 66.683 19.818 3.466 1.00 25.00 N ATOM 592 CA PHE A 117 65.411 19.260 3.006 1.00 25.00 C ATOM 593 C PHE A 117 65.721 18.464 1.750 1.00 25.00 C ATOM 594 O PHE A 117 66.845 18.511 1.274 1.00 25.00 O ATOM 595 CB PHE A 117 64.383 20.372 2.741 1.00 25.00 C ATOM 596 CG PHE A 117 64.864 21.449 1.805 1.00 25.00 C ATOM 597 CD1 PHE A 117 65.522 22.592 2.310 1.00 25.00 C ATOM 598 CD2 PHE A 117 64.635 21.347 0.420 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.946 23.626 1.436 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.053 22.375 -0.462 1.00 25.00 C ATOM 601 CZ PHE A 117 65.709 23.517 0.048 1.00 25.00 C ATOM 0 H PHE A 117 67.364 19.966 2.721 1.00 25.00 H new ATOM 0 HA PHE A 117 64.963 18.617 3.764 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.479 19.924 2.328 1.00 25.00 H new ATOM 0 HB3 PHE A 117 64.106 20.829 3.691 1.00 25.00 H new ATOM 0 HD1 PHE A 117 65.704 22.680 3.371 1.00 25.00 H new ATOM 0 HD2 PHE A 117 64.135 20.475 0.025 1.00 25.00 H new ATOM 0 HE1 PHE A 117 66.450 24.496 1.832 1.00 25.00 H new ATOM 0 HE2 PHE A 117 64.870 22.285 -1.523 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.028 24.303 -0.620 1.00 25.00 H new ATOM 611 N SER A 118 64.760 17.719 1.225 1.00 25.00 N ATOM 612 CA SER A 118 65.005 16.884 0.050 1.00 25.00 C ATOM 613 C SER A 118 63.955 17.129 -1.018 1.00 25.00 C ATOM 614 O SER A 118 62.825 17.488 -0.710 1.00 25.00 O ATOM 615 CB SER A 118 65.017 15.405 0.441 1.00 25.00 C ATOM 616 OG SER A 118 66.014 15.148 1.418 1.00 25.00 O ATOM 0 H SER A 118 63.808 17.673 1.588 1.00 25.00 H new ATOM 0 HA SER A 118 65.980 17.152 -0.357 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.039 15.119 0.829 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.201 14.793 -0.442 1.00 25.00 H new ATOM 0 HG SER A 118 66.003 14.197 1.655 1.00 25.00 H new ATOM 622 N LEU A 119 64.350 16.950 -2.269 1.00 25.00 N ATOM 623 CA LEU A 119 63.487 17.204 -3.417 1.00 25.00 C ATOM 624 C LEU A 119 63.554 16.068 -4.415 1.00 25.00 C ATOM 625 O LEU A 119 64.591 15.423 -4.572 1.00 25.00 O ATOM 626 CB LEU A 119 63.934 18.490 -4.115 1.00 25.00 C ATOM 627 CG LEU A 119 63.358 19.786 -3.532 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.075 20.977 -4.148 1.00 25.00 C ATOM 629 CD2 LEU A 119 61.850 19.862 -3.808 1.00 25.00 C ATOM 0 H LEU A 119 65.283 16.623 -2.520 1.00 25.00 H new ATOM 0 HA LEU A 119 62.463 17.297 -3.055 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.022 18.546 -4.076 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.655 18.429 -5.167 1.00 25.00 H new ATOM 0 HG LEU A 119 63.509 19.800 -2.453 1.00 25.00 H new ATOM 0 HD11 LEU A 119 63.668 21.900 -3.736 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.140 20.917 -3.922 1.00 25.00 H new ATOM 0 HD13 LEU A 119 63.932 20.969 -5.229 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.450 20.786 -3.390 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.676 19.845 -4.884 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.352 19.009 -3.346 1.00 25.00 H new ATOM 641 N GLN A 120 62.453 15.858 -5.118 1.00 25.00 N ATOM 642 CA GLN A 120 62.377 14.847 -6.165 1.00 25.00 C ATOM 643 C GLN A 120 62.484 15.558 -7.507 1.00 25.00 C ATOM 644 O GLN A 120 61.777 16.533 -7.753 1.00 25.00 O ATOM 645 CB GLN A 120 61.049 14.090 -6.081 1.00 25.00 C ATOM 646 CG GLN A 120 60.886 13.286 -4.797 1.00 25.00 C ATOM 647 CD GLN A 120 59.554 12.570 -4.733 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.507 13.190 -4.684 1.00 25.00 O ATOM 649 NE2 GLN A 120 59.589 11.266 -4.733 1.00 25.00 N ATOM 0 H GLN A 120 61.588 16.381 -4.981 1.00 25.00 H new ATOM 0 HA GLN A 120 63.185 14.125 -6.048 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.228 14.803 -6.160 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.970 13.416 -6.934 1.00 25.00 H new ATOM 0 HG2 GLN A 120 61.692 12.556 -4.723 1.00 25.00 H new ATOM 0 HG3 GLN A 120 60.979 13.952 -3.939 1.00 25.00 H new ATOM 0 HE21 GLN A 120 60.485 10.780 -4.775 1.00 25.00 H new ATOM 0 HE22 GLN A 120 58.721 10.733 -4.691 1.00 25.00 H new ATOM 658 N VAL A 121 63.382 15.086 -8.356 1.00 25.00 N ATOM 659 CA VAL A 121 63.608 15.682 -9.673 1.00 25.00 C ATOM 660 C VAL A 121 63.615 14.586 -10.728 1.00 25.00 C ATOM 661 O VAL A 121 63.749 13.408 -10.407 1.00 25.00 O ATOM 662 CB VAL A 121 64.973 16.441 -9.731 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.974 17.622 -8.762 1.00 25.00 C ATOM 664 CG2 VAL A 121 66.145 15.502 -9.403 1.00 25.00 C ATOM 0 H VAL A 121 63.976 14.281 -8.157 1.00 25.00 H new ATOM 0 HA VAL A 121 62.805 16.395 -9.861 1.00 25.00 H new ATOM 0 HB VAL A 121 65.100 16.813 -10.748 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.933 18.137 -8.817 1.00 25.00 H new ATOM 0 HG12 VAL A 121 64.175 18.313 -9.030 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.815 17.259 -7.746 1.00 25.00 H new ATOM 0 HG21 VAL A 121 67.081 16.058 -9.451 1.00 25.00 H new ATOM 0 HG22 VAL A 121 66.016 15.095 -8.400 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.170 14.686 -10.125 1.00 25.00 H new ATOM 674 N ASP A 122 63.497 14.972 -11.985 1.00 25.00 N ATOM 675 CA ASP A 122 63.615 14.027 -13.093 1.00 25.00 C ATOM 676 C ASP A 122 65.102 13.847 -13.425 1.00 25.00 C ATOM 677 O ASP A 122 65.937 14.636 -12.988 1.00 25.00 O ATOM 678 CB ASP A 122 62.866 14.548 -14.320 1.00 25.00 C ATOM 679 CG ASP A 122 62.801 13.519 -15.422 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.081 12.520 -15.256 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 63.608 13.620 -16.365 1.00 25.00 O1- ATOM 0 H ASP A 122 63.319 15.935 -12.270 1.00 25.00 H new ATOM 0 HA ASP A 122 63.177 13.071 -12.807 1.00 25.00 H new ATOM 0 HB2 ASP A 122 61.855 14.835 -14.032 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.359 15.446 -14.691 1.00 25.00 H new ATOM 686 N ALA A 123 65.436 12.836 -14.212 1.00 25.00 N ATOM 687 CA ALA A 123 66.819 12.618 -14.624 1.00 25.00 C ATOM 688 C ALA A 123 67.313 13.767 -15.518 1.00 25.00 C ATOM 689 O ALA A 123 68.452 14.227 -15.389 1.00 25.00 O ATOM 690 CB ALA A 123 66.927 11.285 -15.369 1.00 25.00 C ATOM 0 H ALA A 123 64.772 12.154 -14.579 1.00 25.00 H new ATOM 0 HA ALA A 123 67.448 12.589 -13.734 1.00 25.00 H new ATOM 0 HB1 ALA A 123 67.960 11.123 -15.676 1.00 25.00 H new ATOM 0 HB2 ALA A 123 66.612 10.474 -14.712 1.00 25.00 H new ATOM 0 HB3 ALA A 123 66.286 11.308 -16.250 1.00 25.00 H new ATOM 696 N ASP A 124 66.456 14.218 -16.421 1.00 25.00 N ATOM 697 CA ASP A 124 66.823 15.241 -17.404 1.00 25.00 C ATOM 698 C ASP A 124 66.395 16.630 -16.938 1.00 25.00 C ATOM 699 O ASP A 124 66.425 17.599 -17.695 1.00 25.00 O ATOM 700 CB ASP A 124 66.198 14.903 -18.759 1.00 25.00 C ATOM 701 CG ASP A 124 66.828 13.671 -19.391 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.081 13.619 -19.460 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.090 12.749 -19.802 1.00 25.00 O1- ATOM 0 H ASP A 124 65.493 13.892 -16.498 1.00 25.00 H new ATOM 0 HA ASP A 124 67.908 15.251 -17.508 1.00 25.00 H new ATOM 0 HB2 ASP A 124 65.128 14.738 -18.633 1.00 25.00 H new ATOM 0 HB3 ASP A 124 66.312 15.753 -19.432 1.00 25.00 H new ATOM 708 N PHE A 125 66.037 16.727 -15.666 1.00 25.00 N ATOM 709 CA PHE A 125 65.642 17.998 -15.065 1.00 25.00 C ATOM 710 C PHE A 125 66.805 18.987 -15.158 1.00 25.00 C ATOM 711 O PHE A 125 67.943 18.636 -14.856 1.00 25.00 O ATOM 712 CB PHE A 125 65.274 17.754 -13.601 1.00 25.00 C ATOM 713 CG PHE A 125 64.278 18.728 -13.042 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.924 18.645 -13.418 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.668 19.705 -12.107 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.963 19.528 -12.868 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.709 20.587 -11.544 1.00 25.00 C ATOM 718 CZ PHE A 125 62.358 20.497 -11.927 1.00 25.00 C ATOM 0 H PHE A 125 66.011 15.935 -15.023 1.00 25.00 H new ATOM 0 HA PHE A 125 64.784 18.414 -15.592 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.872 16.746 -13.503 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.182 17.795 -12.999 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.614 17.899 -14.135 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.705 19.784 -11.816 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.929 19.458 -13.170 1.00 25.00 H new ATOM 0 HE2 PHE A 125 64.017 21.328 -10.821 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.627 21.169 -11.501 1.00 25.00 H new ATOM 728 N GLU A 126 66.529 20.207 -15.592 1.00 25.00 N ATOM 729 CA GLU A 126 67.568 21.232 -15.716 1.00 25.00 C ATOM 730 C GLU A 126 67.948 21.798 -14.360 1.00 25.00 C ATOM 731 O GLU A 126 67.094 21.946 -13.482 1.00 25.00 O ATOM 732 CB GLU A 126 67.063 22.417 -16.531 1.00 25.00 C ATOM 733 CG GLU A 126 66.738 22.133 -17.966 1.00 25.00 C ATOM 734 CD GLU A 126 66.249 23.393 -18.650 1.00 25.00 C ATOM 735 OE1 GLU A 126 67.062 24.328 -18.827 1.00 25.00 O ATOM 736 OE2 GLU A 126 65.029 23.497 -18.895 1.00 25.00 O1- ATOM 0 H GLU A 126 65.596 20.517 -15.866 1.00 25.00 H new ATOM 0 HA GLU A 126 68.419 20.747 -16.194 1.00 25.00 H new ATOM 0 HB2 GLU A 126 66.169 22.811 -16.047 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.817 23.204 -16.498 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.621 21.752 -18.478 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.975 21.357 -18.027 1.00 25.00 H new ATOM 743 N LEU A 127 69.182 22.265 -14.231 1.00 25.00 N ATOM 744 CA LEU A 127 69.573 23.010 -13.035 1.00 25.00 C ATOM 745 C LEU A 127 68.811 24.327 -12.989 1.00 25.00 C ATOM 746 O LEU A 127 68.544 24.862 -11.914 1.00 25.00 O ATOM 747 CB LEU A 127 71.064 23.321 -13.038 1.00 25.00 C ATOM 748 CG LEU A 127 72.029 22.322 -12.394 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.412 22.945 -12.475 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.698 22.022 -10.929 1.00 25.00 C ATOM 0 H LEU A 127 69.921 22.146 -14.924 1.00 25.00 H new ATOM 0 HA LEU A 127 69.341 22.394 -12.166 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.371 23.454 -14.075 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.202 24.280 -12.539 1.00 25.00 H new ATOM 0 HG LEU A 127 71.959 21.372 -12.923 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.142 22.270 -12.027 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.672 23.120 -13.519 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.416 23.893 -11.937 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.419 21.308 -10.532 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.744 22.944 -10.349 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.695 21.601 -10.862 1.00 25.00 H new ATOM 762 N HIS A 128 68.442 24.831 -14.159 1.00 25.00 N ATOM 763 CA HIS A 128 67.673 26.066 -14.273 1.00 25.00 C ATOM 764 C HIS A 128 66.351 25.941 -13.519 1.00 25.00 C ATOM 765 O HIS A 128 65.932 26.865 -12.826 1.00 25.00 O ATOM 766 CB HIS A 128 67.396 26.364 -15.750 1.00 25.00 C ATOM 767 CG HIS A 128 66.976 27.776 -16.010 1.00 25.00 C ATOM 768 ND1 HIS A 128 67.653 28.636 -16.834 1.00 25.00 N ATOM 769 CD2 HIS A 128 65.914 28.493 -15.547 1.00 25.00 C ATOM 770 CE1 HIS A 128 67.009 29.796 -16.850 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.950 29.774 -16.066 1.00 25.00 N ATOM 0 H HIS A 128 68.666 24.397 -15.055 1.00 25.00 H new ATOM 0 HA HIS A 128 68.250 26.881 -13.837 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.294 26.149 -16.330 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.617 25.691 -16.107 1.00 25.00 H new ATOM 0 HD1 HIS A 128 68.507 28.421 -17.348 1.00 25.00 H new ATOM 0 HD2 HIS A 128 65.157 28.117 -14.875 1.00 25.00 H new ATOM 0 HE1 HIS A 128 67.315 30.652 -17.433 1.00 25.00 H new ATOM 779 N ASN A 129 65.708 24.789 -13.647 1.00 25.00 N ATOM 780 CA ASN A 129 64.462 24.525 -12.937 1.00 25.00 C ATOM 781 C ASN A 129 64.722 24.096 -11.492 1.00 25.00 C ATOM 782 O ASN A 129 63.955 24.418 -10.599 1.00 25.00 O ATOM 783 CB ASN A 129 63.652 23.459 -13.681 1.00 25.00 C ATOM 784 CG ASN A 129 63.140 23.959 -15.008 1.00 25.00 C ATOM 785 OD1 ASN A 129 62.505 24.994 -15.077 1.00 25.00 O ATOM 786 ND2 ASN A 129 63.444 23.253 -16.061 1.00 25.00 N ATOM 0 H ASN A 129 66.028 24.021 -14.236 1.00 25.00 H new ATOM 0 HA ASN A 129 63.886 25.450 -12.904 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.274 22.578 -13.841 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.810 23.147 -13.063 1.00 25.00 H new ATOM 0 HD21 ASN A 129 63.147 23.563 -16.986 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.979 22.390 -15.960 1.00 25.00 H new ATOM 793 N PHE A 130 65.811 23.378 -11.257 1.00 25.00 N ATOM 794 CA PHE A 130 66.141 22.890 -9.913 1.00 25.00 C ATOM 795 C PHE A 130 66.382 24.015 -8.916 1.00 25.00 C ATOM 796 O PHE A 130 65.900 23.963 -7.787 1.00 25.00 O ATOM 797 CB PHE A 130 67.375 22.000 -9.987 1.00 25.00 C ATOM 798 CG PHE A 130 67.747 21.359 -8.677 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.806 20.609 -7.945 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.055 21.490 -8.175 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.170 19.983 -6.725 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.431 20.868 -6.963 1.00 25.00 C ATOM 803 CZ PHE A 130 68.487 20.108 -6.239 1.00 25.00 C ATOM 0 H PHE A 130 66.486 23.117 -11.976 1.00 25.00 H new ATOM 0 HA PHE A 130 65.280 22.326 -9.555 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.202 21.218 -10.726 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.218 22.594 -10.342 1.00 25.00 H new ATOM 0 HD1 PHE A 130 65.797 20.509 -8.316 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.781 22.073 -8.723 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.440 19.412 -6.170 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.439 20.974 -6.591 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.773 19.624 -5.317 1.00 25.00 H new ATOM 813 N ARG A 131 67.090 25.056 -9.332 1.00 25.00 N ATOM 814 CA ARG A 131 67.315 26.205 -8.451 1.00 25.00 C ATOM 815 C ARG A 131 65.989 26.873 -8.072 1.00 25.00 C ATOM 816 O ARG A 131 65.845 27.344 -6.959 1.00 25.00 O ATOM 817 CB ARG A 131 68.278 27.216 -9.094 1.00 25.00 C ATOM 818 CG ARG A 131 67.750 27.847 -10.370 1.00 25.00 C ATOM 819 CD ARG A 131 68.697 28.848 -10.969 1.00 25.00 C ATOM 820 NE ARG A 131 68.114 29.411 -12.199 1.00 25.00 N ATOM 821 CZ ARG A 131 68.547 30.497 -12.826 1.00 25.00 C ATOM 822 NH1 ARG A 131 69.575 31.189 -12.396 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 67.938 30.899 -13.904 1.00 25.00 N ATOM 0 H ARG A 131 67.514 25.134 -10.256 1.00 25.00 H new ATOM 0 HA ARG A 131 67.780 25.838 -7.536 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.494 28.005 -8.374 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.221 26.716 -9.312 1.00 25.00 H new ATOM 0 HG2 ARG A 131 67.550 27.063 -11.100 1.00 25.00 H new ATOM 0 HG3 ARG A 131 66.799 28.336 -10.160 1.00 25.00 H new ATOM 0 HD2 ARG A 131 68.899 29.645 -10.253 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.651 28.371 -11.193 1.00 25.00 H new ATOM 0 HE ARG A 131 67.312 28.926 -12.602 1.00 25.00 H new ATOM 0 HH11 ARG A 131 70.070 30.897 -11.553 1.00 25.00 H new ATOM 0 HH12 ARG A 131 69.880 32.019 -12.904 1.00 25.00 H new ATOM 0 HH21 ARG A 131 67.135 30.380 -14.260 1.00 25.00 H new ATOM 0 HH22 ARG A 131 68.264 31.733 -14.393 1.00 25.00 H new ATOM 837 N ALA A 132 65.018 26.878 -8.978 1.00 25.00 N ATOM 838 CA ALA A 132 63.710 27.470 -8.696 1.00 25.00 C ATOM 839 C ALA A 132 62.923 26.549 -7.757 1.00 25.00 C ATOM 840 O ALA A 132 62.218 27.001 -6.866 1.00 25.00 O ATOM 841 CB ALA A 132 62.941 27.692 -10.004 1.00 25.00 C ATOM 0 H ALA A 132 65.109 26.480 -9.913 1.00 25.00 H new ATOM 0 HA ALA A 132 63.846 28.436 -8.210 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.969 28.133 -9.784 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.507 28.364 -10.649 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.800 26.737 -10.510 1.00 25.00 H new ATOM 847 N LEU A 133 63.080 25.250 -7.954 1.00 25.00 N ATOM 848 CA LEU A 133 62.403 24.256 -7.131 1.00 25.00 C ATOM 849 C LEU A 133 62.862 24.358 -5.671 1.00 25.00 C ATOM 850 O LEU A 133 62.053 24.302 -4.758 1.00 25.00 O ATOM 851 CB LEU A 133 62.682 22.855 -7.698 1.00 25.00 C ATOM 852 CG LEU A 133 61.800 21.703 -7.197 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.348 21.869 -7.638 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.352 20.380 -7.744 1.00 25.00 C ATOM 0 H LEU A 133 63.675 24.855 -8.682 1.00 25.00 H new ATOM 0 HA LEU A 133 61.329 24.441 -7.152 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.587 22.905 -8.783 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.720 22.604 -7.480 1.00 25.00 H new ATOM 0 HG LEU A 133 61.819 21.706 -6.107 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.756 21.034 -7.264 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.951 22.803 -7.239 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.298 21.890 -8.727 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.732 19.555 -7.394 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.342 20.404 -8.834 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.375 20.240 -7.394 1.00 25.00 H new ATOM 866 N CYS A 134 64.155 24.558 -5.449 1.00 25.00 N ATOM 867 CA CYS A 134 64.659 24.717 -4.081 1.00 25.00 C ATOM 868 C CYS A 134 64.365 26.114 -3.523 1.00 25.00 C ATOM 869 O CYS A 134 64.271 26.292 -2.314 1.00 25.00 O ATOM 870 CB CYS A 134 66.153 24.384 -3.993 1.00 25.00 C ATOM 871 SG CYS A 134 67.268 25.539 -4.826 1.00 25.00 S ATOM 0 H CYS A 134 64.865 24.614 -6.179 1.00 25.00 H new ATOM 0 HA CYS A 134 64.123 24.002 -3.457 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.433 24.333 -2.941 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.310 23.390 -4.413 1.00 25.00 H new ATOM 0 HG CYS A 134 66.594 26.257 -5.675 1.00 25.00 H new ATOM 877 N GLU A 135 64.210 27.096 -4.402 1.00 25.00 N ATOM 878 CA GLU A 135 63.854 28.461 -3.995 1.00 25.00 C ATOM 879 C GLU A 135 62.446 28.435 -3.396 1.00 25.00 C ATOM 880 O GLU A 135 62.186 29.068 -2.370 1.00 25.00 O ATOM 881 CB GLU A 135 63.949 29.397 -5.219 1.00 25.00 C ATOM 882 CG GLU A 135 62.880 30.489 -5.361 1.00 25.00 C ATOM 883 CD GLU A 135 63.042 31.267 -6.669 1.00 25.00 C ATOM 884 OE1 GLU A 135 64.089 31.938 -6.849 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 62.141 31.195 -7.527 1.00 25.00 O1- ATOM 0 H GLU A 135 64.325 26.977 -5.409 1.00 25.00 H new ATOM 0 HA GLU A 135 64.541 28.840 -3.238 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.925 29.882 -5.196 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.921 28.780 -6.117 1.00 25.00 H new ATOM 0 HG2 GLU A 135 61.889 30.036 -5.326 1.00 25.00 H new ATOM 0 HG3 GLU A 135 62.946 31.176 -4.517 1.00 25.00 H new ATOM 892 N LEU A 136 61.565 27.648 -4.004 1.00 25.00 N ATOM 893 CA LEU A 136 60.190 27.506 -3.528 1.00 25.00 C ATOM 894 C LEU A 136 60.147 26.894 -2.129 1.00 25.00 C ATOM 895 O LEU A 136 59.430 27.377 -1.259 1.00 25.00 O ATOM 896 CB LEU A 136 59.403 26.617 -4.503 1.00 25.00 C ATOM 897 CG LEU A 136 57.913 26.395 -4.193 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.112 27.697 -4.301 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.351 25.356 -5.163 1.00 25.00 C ATOM 0 H LEU A 136 61.779 27.094 -4.833 1.00 25.00 H new ATOM 0 HA LEU A 136 59.740 28.498 -3.478 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.481 27.053 -5.499 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.890 25.643 -4.543 1.00 25.00 H new ATOM 0 HG LEU A 136 57.824 26.039 -3.167 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.064 27.499 -4.075 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.505 28.426 -3.592 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.196 28.093 -5.313 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.295 25.193 -4.950 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.463 25.715 -6.186 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.894 24.418 -5.046 1.00 25.00 H new ATOM 911 N GLU A 137 60.924 25.841 -1.919 1.00 25.00 N ATOM 912 CA GLU A 137 60.958 25.156 -0.624 1.00 25.00 C ATOM 913 C GLU A 137 61.584 26.025 0.462 1.00 25.00 C ATOM 914 O GLU A 137 61.124 26.049 1.600 1.00 25.00 O ATOM 915 CB GLU A 137 61.789 23.875 -0.730 1.00 25.00 C ATOM 916 CG GLU A 137 61.171 22.790 -1.588 1.00 25.00 C ATOM 917 CD GLU A 137 59.854 22.269 -1.028 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.834 21.822 0.139 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.845 22.281 -1.767 1.00 25.00 O1- ATOM 0 H GLU A 137 61.541 25.439 -2.625 1.00 25.00 H new ATOM 0 HA GLU A 137 59.925 24.934 -0.356 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.769 24.126 -1.136 1.00 25.00 H new ATOM 0 HB3 GLU A 137 61.951 23.479 0.272 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.004 23.179 -2.592 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.874 21.962 -1.680 1.00 25.00 H new ATOM 926 N SER A 138 62.672 26.702 0.124 1.00 25.00 N ATOM 927 CA SER A 138 63.419 27.463 1.119 1.00 25.00 C ATOM 928 C SER A 138 62.873 28.873 1.346 1.00 25.00 C ATOM 929 O SER A 138 63.216 29.516 2.342 1.00 25.00 O ATOM 930 CB SER A 138 64.889 27.537 0.723 1.00 25.00 C ATOM 931 OG SER A 138 65.655 28.052 1.798 1.00 25.00 O ATOM 0 H SER A 138 63.055 26.741 -0.820 1.00 25.00 H new ATOM 0 HA SER A 138 63.306 26.929 2.063 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.251 26.546 0.450 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.006 28.172 -0.155 1.00 25.00 H new ATOM 0 HG SER A 138 66.597 27.814 1.672 1.00 25.00 H new ATOM 937 N GLY A 139 62.040 29.362 0.436 1.00 25.00 N ATOM 938 CA GLY A 139 61.416 30.667 0.609 1.00 25.00 C ATOM 939 C GLY A 139 62.356 31.840 0.397 1.00 25.00 C ATOM 940 O GLY A 139 62.150 32.920 0.950 1.00 25.00 O ATOM 0 H GLY A 139 61.782 28.878 -0.424 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.582 30.754 -0.088 1.00 25.00 H new ATOM 0 HA3 GLY A 139 60.999 30.727 1.614 1.00 25.00 H new ATOM 944 N ILE A 140 63.401 31.630 -0.392 1.00 25.00 N ATOM 945 CA ILE A 140 64.391 32.676 -0.681 1.00 25.00 C ATOM 946 C ILE A 140 64.735 32.640 -2.168 1.00 25.00 C ATOM 947 O ILE A 140 64.816 31.566 -2.756 1.00 25.00 O ATOM 948 CB ILE A 140 65.705 32.472 0.126 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.064 30.978 0.184 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.560 33.054 1.557 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.490 30.694 0.536 1.00 25.00 C ATOM 0 H ILE A 140 63.592 30.739 -0.850 1.00 25.00 H new ATOM 0 HA ILE A 140 63.954 33.633 -0.396 1.00 25.00 H new ATOM 0 HB ILE A 140 66.511 33.004 -0.379 1.00 25.00 H new ATOM 0 HG12 ILE A 140 65.419 30.491 0.915 1.00 25.00 H new ATOM 0 HG13 ILE A 140 65.846 30.527 -0.784 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.489 32.902 2.107 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.344 34.121 1.496 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.745 32.548 2.075 1.00 25.00 H new ATOM 0 HD11 ILE A 140 67.653 29.616 0.554 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.146 31.148 -0.207 1.00 25.00 H new ATOM 0 HD13 ILE A 140 67.712 31.111 1.518 1.00 25.00 H new ATOM 963 N PRO A 141 64.930 33.814 -2.799 1.00 25.00 N ATOM 964 CA PRO A 141 65.228 33.739 -4.234 1.00 25.00 C ATOM 965 C PRO A 141 66.551 33.055 -4.563 1.00 25.00 C ATOM 966 O PRO A 141 67.578 33.299 -3.918 1.00 25.00 O ATOM 967 CB PRO A 141 65.290 35.215 -4.654 1.00 25.00 C ATOM 968 CG PRO A 141 64.535 35.945 -3.599 1.00 25.00 C ATOM 969 CD PRO A 141 64.869 35.214 -2.341 1.00 25.00 C ATOM 0 HA PRO A 141 64.480 33.140 -4.753 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.320 35.565 -4.716 1.00 25.00 H new ATOM 0 HB3 PRO A 141 64.842 35.366 -5.636 1.00 25.00 H new ATOM 0 HG2 PRO A 141 64.837 36.991 -3.544 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.463 35.932 -3.795 1.00 25.00 H new ATOM 0 HD2 PRO A 141 65.817 35.545 -1.918 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.109 35.358 -1.573 1.00 25.00 H new ATOM 977 N ALA A 142 66.543 32.258 -5.619 1.00 25.00 N ATOM 978 CA ALA A 142 67.749 31.612 -6.124 1.00 25.00 C ATOM 979 C ALA A 142 68.735 32.672 -6.628 1.00 25.00 C ATOM 980 O ALA A 142 69.936 32.454 -6.656 1.00 25.00 O ATOM 981 CB ALA A 142 67.382 30.645 -7.253 1.00 25.00 C ATOM 0 H ALA A 142 65.701 32.039 -6.152 1.00 25.00 H new ATOM 0 HA ALA A 142 68.222 31.050 -5.319 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.285 30.164 -7.628 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.697 29.886 -6.874 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.902 31.196 -8.062 1.00 25.00 H new ATOM 987 N ALA A 143 68.204 33.820 -7.028 1.00 25.00 N ATOM 988 CA ALA A 143 69.021 34.925 -7.526 1.00 25.00 C ATOM 989 C ALA A 143 69.831 35.593 -6.403 1.00 25.00 C ATOM 990 O ALA A 143 70.873 36.186 -6.651 1.00 25.00 O ATOM 991 CB ALA A 143 68.115 35.961 -8.205 1.00 25.00 C ATOM 0 H ALA A 143 67.203 34.013 -7.018 1.00 25.00 H new ATOM 0 HA ALA A 143 69.733 34.520 -8.245 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.722 36.786 -8.577 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.588 35.494 -9.037 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.391 36.340 -7.484 1.00 25.00 H new ATOM 997 N GLU A 144 69.332 35.498 -5.178 1.00 25.00 N ATOM 998 CA GLU A 144 69.958 36.140 -4.014 1.00 25.00 C ATOM 999 C GLU A 144 70.834 35.139 -3.261 1.00 25.00 C ATOM 1000 O GLU A 144 71.179 35.340 -2.093 1.00 25.00 O ATOM 1001 CB GLU A 144 68.867 36.681 -3.077 1.00 25.00 C ATOM 1002 CG GLU A 144 68.078 37.853 -3.657 1.00 25.00 C ATOM 1003 CD GLU A 144 68.949 39.085 -3.881 1.00 25.00 C ATOM 1004 OE1 GLU A 144 69.581 39.557 -2.908 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 68.989 39.588 -5.023 1.00 25.00 O1- ATOM 0 H GLU A 144 68.484 34.977 -4.956 1.00 25.00 H new ATOM 0 HA GLU A 144 70.584 36.963 -4.359 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.175 35.874 -2.837 1.00 25.00 H new ATOM 0 HB3 GLU A 144 69.329 36.995 -2.141 1.00 25.00 H new ATOM 0 HG2 GLU A 144 67.628 37.552 -4.603 1.00 25.00 H new ATOM 0 HG3 GLU A 144 67.261 38.107 -2.982 1.00 25.00 H new ATOM 1012 N SER A 145 71.172 34.043 -3.921 1.00 25.00 N ATOM 1013 CA SER A 145 71.967 32.987 -3.309 1.00 25.00 C ATOM 1014 C SER A 145 72.869 32.347 -4.357 1.00 25.00 C ATOM 1015 O SER A 145 72.821 32.699 -5.532 1.00 25.00 O ATOM 1016 CB SER A 145 71.035 31.939 -2.698 1.00 25.00 C ATOM 1017 OG SER A 145 70.174 31.386 -3.673 1.00 25.00 O ATOM 0 H SER A 145 70.906 33.860 -4.889 1.00 25.00 H new ATOM 0 HA SER A 145 72.592 33.409 -2.522 1.00 25.00 H new ATOM 0 HB2 SER A 145 71.626 31.146 -2.240 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.443 32.394 -1.904 1.00 25.00 H new ATOM 0 HG SER A 145 69.393 31.967 -3.787 1.00 25.00 H new ATOM 1023 N GLN A 146 73.692 31.402 -3.931 1.00 25.00 N ATOM 1024 CA GLN A 146 74.542 30.652 -4.850 1.00 25.00 C ATOM 1025 C GLN A 146 74.444 29.182 -4.487 1.00 25.00 C ATOM 1026 O GLN A 146 74.096 28.847 -3.363 1.00 25.00 O ATOM 1027 CB GLN A 146 75.996 31.135 -4.782 1.00 25.00 C ATOM 1028 CG GLN A 146 76.687 30.889 -3.431 1.00 25.00 C ATOM 1029 CD GLN A 146 78.141 31.333 -3.409 1.00 25.00 C ATOM 1030 OE1 GLN A 146 78.628 31.827 -4.520 1.00 25.00 O flip ATOM 1031 NE2 GLN A 146 78.821 31.206 -2.399 1.00 25.00 N flip ATOM 0 H GLN A 146 73.792 31.134 -2.952 1.00 25.00 H new ATOM 0 HA GLN A 146 74.204 30.809 -5.874 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.568 30.636 -5.564 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.021 32.203 -5.000 1.00 25.00 H new ATOM 0 HG2 GLN A 146 76.141 31.418 -2.650 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.635 29.827 -3.192 1.00 25.00 H new ATOM 0 HE21 GLN A 146 78.408 30.817 -1.551 1.00 25.00 H new ATOM 0 HE22 GLN A 146 79.801 31.489 -2.405 1.00 25.00 H new ATOM 1040 N ILE A 147 74.758 28.313 -5.432 1.00 25.00 N ATOM 1041 CA ILE A 147 74.659 26.871 -5.226 1.00 25.00 C ATOM 1042 C ILE A 147 76.009 26.223 -5.556 1.00 25.00 C ATOM 1043 O ILE A 147 76.701 26.622 -6.508 1.00 25.00 O ATOM 1044 CB ILE A 147 73.478 26.284 -6.081 1.00 25.00 C ATOM 1045 CG1 ILE A 147 73.279 24.785 -5.767 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.701 26.557 -7.592 1.00 25.00 C ATOM 1047 CD1 ILE A 147 72.090 24.112 -6.509 1.00 25.00 C ATOM 0 H ILE A 147 75.087 28.581 -6.360 1.00 25.00 H new ATOM 0 HA ILE A 147 74.431 26.649 -4.183 1.00 25.00 H new ATOM 0 HB ILE A 147 72.553 26.792 -5.808 1.00 25.00 H new ATOM 0 HG12 ILE A 147 74.195 24.251 -6.020 1.00 25.00 H new ATOM 0 HG13 ILE A 147 73.130 24.671 -4.693 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.871 26.141 -8.163 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.757 27.632 -7.763 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.632 26.090 -7.913 1.00 25.00 H new ATOM 0 HD11 ILE A 147 72.031 23.061 -6.224 1.00 25.00 H new ATOM 0 HD12 ILE A 147 71.161 24.614 -6.238 1.00 25.00 H new ATOM 0 HD13 ILE A 147 72.243 24.188 -7.586 1.00 25.00 H new ATOM 1059 N VAL A 148 76.411 25.272 -4.727 1.00 25.00 N ATOM 1060 CA VAL A 148 77.695 24.597 -4.860 1.00 25.00 C ATOM 1061 C VAL A 148 77.459 23.093 -4.648 1.00 25.00 C ATOM 1062 O VAL A 148 76.643 22.690 -3.816 1.00 25.00 O ATOM 1063 CB VAL A 148 78.744 25.216 -3.847 1.00 25.00 C ATOM 1064 CG1 VAL A 148 78.338 24.999 -2.390 1.00 25.00 C ATOM 1065 CG2 VAL A 148 80.141 24.662 -4.080 1.00 25.00 C ATOM 0 H VAL A 148 75.853 24.944 -3.938 1.00 25.00 H new ATOM 0 HA VAL A 148 78.121 24.739 -5.853 1.00 25.00 H new ATOM 0 HB VAL A 148 78.755 26.289 -4.039 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.088 25.441 -1.734 1.00 25.00 H new ATOM 0 HG12 VAL A 148 77.373 25.471 -2.207 1.00 25.00 H new ATOM 0 HG13 VAL A 148 78.263 23.930 -2.188 1.00 25.00 H new ATOM 0 HG21 VAL A 148 80.833 25.109 -3.367 1.00 25.00 H new ATOM 0 HG22 VAL A 148 80.130 23.580 -3.946 1.00 25.00 H new ATOM 0 HG23 VAL A 148 80.462 24.899 -5.094 1.00 25.00 H new ATOM 1075 N TYR A 149 78.131 22.273 -5.440 1.00 25.00 N ATOM 1076 CA TYR A 149 77.992 20.818 -5.377 1.00 25.00 C ATOM 1077 C TYR A 149 79.369 20.220 -5.598 1.00 25.00 C ATOM 1078 O TYR A 149 80.098 20.684 -6.468 1.00 25.00 O ATOM 1079 CB TYR A 149 77.040 20.339 -6.468 1.00 25.00 C ATOM 1080 CG TYR A 149 77.130 18.855 -6.732 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.842 17.919 -5.718 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.528 18.374 -7.998 1.00 25.00 C ATOM 1083 CE1 TYR A 149 76.953 16.528 -5.964 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.627 16.980 -8.248 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.339 16.072 -7.230 1.00 25.00 C ATOM 1086 OH TYR A 149 77.436 14.730 -7.488 1.00 25.00 O ATOM 0 H TYR A 149 78.791 22.594 -6.148 1.00 25.00 H new ATOM 0 HA TYR A 149 77.588 20.512 -4.412 1.00 25.00 H new ATOM 0 HB2 TYR A 149 76.018 20.589 -6.184 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.255 20.879 -7.390 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.533 18.266 -4.743 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.760 19.075 -8.786 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.740 15.821 -5.176 1.00 25.00 H new ATOM 0 HE2 TYR A 149 77.924 16.624 -9.223 1.00 25.00 H new ATOM 0 HH TYR A 149 77.160 14.224 -6.695 1.00 25.00 H new ATOM 1096 N ALA A 150 79.741 19.241 -4.775 1.00 25.00 N ATOM 1097 CA ALA A 150 81.081 18.636 -4.804 1.00 25.00 C ATOM 1098 C ALA A 150 82.158 19.738 -4.741 1.00 25.00 C ATOM 1099 O ALA A 150 83.144 19.705 -5.470 1.00 25.00 O ATOM 1100 CB ALA A 150 81.249 17.752 -6.062 1.00 25.00 C ATOM 0 H ALA A 150 79.125 18.841 -4.067 1.00 25.00 H new ATOM 0 HA ALA A 150 81.202 17.994 -3.932 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.246 17.312 -6.067 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.502 16.958 -6.051 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.117 18.362 -6.956 1.00 25.00 H new ATOM 1106 N GLU A 151 81.887 20.735 -3.897 1.00 25.00 N ATOM 1107 CA GLU A 151 82.730 21.935 -3.700 1.00 25.00 C ATOM 1108 C GLU A 151 82.957 22.799 -4.958 1.00 25.00 C ATOM 1109 O GLU A 151 83.691 23.787 -4.920 1.00 25.00 O ATOM 1110 CB GLU A 151 84.070 21.566 -3.049 1.00 25.00 C ATOM 1111 CG GLU A 151 83.901 20.824 -1.725 1.00 25.00 C ATOM 1112 CD GLU A 151 85.183 20.791 -0.903 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.285 20.782 -1.495 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.082 20.797 0.342 1.00 25.00 O1- ATOM 0 H GLU A 151 81.053 20.738 -3.310 1.00 25.00 H new ATOM 0 HA GLU A 151 82.151 22.567 -3.026 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.644 20.946 -3.737 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.649 22.474 -2.880 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.113 21.302 -1.143 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.575 19.803 -1.924 1.00 25.00 H new ATOM 1121 N ARG A 152 82.275 22.480 -6.049 1.00 25.00 N ATOM 1122 CA ARG A 152 82.367 23.255 -7.288 1.00 25.00 C ATOM 1123 C ARG A 152 81.102 24.088 -7.474 1.00 25.00 C ATOM 1124 O ARG A 152 79.990 23.574 -7.327 1.00 25.00 O ATOM 1125 CB ARG A 152 82.510 22.307 -8.478 1.00 25.00 C ATOM 1126 CG ARG A 152 83.797 21.489 -8.467 1.00 25.00 C ATOM 1127 CD ARG A 152 83.759 20.422 -9.546 1.00 25.00 C ATOM 1128 NE ARG A 152 83.710 21.016 -10.894 1.00 25.00 N ATOM 1129 CZ ARG A 152 83.530 20.340 -12.022 1.00 25.00 C ATOM 1130 NH1 ARG A 152 83.379 19.038 -12.042 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 83.499 20.989 -13.153 1.00 25.00 N ATOM 0 H ARG A 152 81.644 21.681 -6.105 1.00 25.00 H new ATOM 0 HA ARG A 152 83.235 23.912 -7.229 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.659 21.626 -8.492 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.468 22.888 -9.399 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.653 22.145 -8.626 1.00 25.00 H new ATOM 0 HG3 ARG A 152 83.930 21.023 -7.491 1.00 25.00 H new ATOM 0 HD2 ARG A 152 84.639 19.785 -9.460 1.00 25.00 H new ATOM 0 HD3 ARG A 152 82.888 19.784 -9.397 1.00 25.00 H new ATOM 0 HE ARG A 152 83.823 22.027 -10.966 1.00 25.00 H new ATOM 0 HH11 ARG A 152 83.398 18.509 -11.170 1.00 25.00 H new ATOM 0 HH12 ARG A 152 83.243 18.554 -12.929 1.00 25.00 H new ATOM 0 HH21 ARG A 152 83.612 22.003 -13.163 1.00 25.00 H new ATOM 0 HH22 ARG A 152 83.361 20.483 -14.028 1.00 25.00 H new ATOM 1145 N PRO A 153 81.242 25.385 -7.805 1.00 25.00 N ATOM 1146 CA PRO A 153 80.000 26.123 -8.044 1.00 25.00 C ATOM 1147 C PRO A 153 79.344 25.668 -9.340 1.00 25.00 C ATOM 1148 O PRO A 153 80.021 25.240 -10.280 1.00 25.00 O ATOM 1149 CB PRO A 153 80.474 27.574 -8.134 1.00 25.00 C ATOM 1150 CG PRO A 153 81.850 27.470 -8.673 1.00 25.00 C ATOM 1151 CD PRO A 153 82.425 26.241 -8.014 1.00 25.00 C ATOM 0 HA PRO A 153 79.247 25.972 -7.270 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.832 28.163 -8.789 1.00 25.00 H new ATOM 0 HB3 PRO A 153 80.464 28.058 -7.158 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.844 27.372 -9.759 1.00 25.00 H new ATOM 0 HG3 PRO A 153 82.437 28.358 -8.437 1.00 25.00 H new ATOM 0 HD2 PRO A 153 83.167 25.755 -8.647 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.918 26.483 -7.073 1.00 25.00 H new ATOM 1159 N LEU A 154 78.028 25.749 -9.386 1.00 25.00 N ATOM 1160 CA LEU A 154 77.277 25.322 -10.566 1.00 25.00 C ATOM 1161 C LEU A 154 76.871 26.548 -11.375 1.00 0.00 C ATOM 1162 O LEU A 154 76.106 27.382 -10.899 1.00 25.00 O ATOM 1163 CB LEU A 154 76.031 24.541 -10.146 1.00 25.00 C ATOM 1164 CG LEU A 154 76.254 23.278 -9.292 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.924 22.779 -8.761 1.00 25.00 C ATOM 1166 CD2 LEU A 154 76.911 22.180 -10.101 1.00 25.00 C ATOM 0 H LEU A 154 77.451 26.105 -8.624 1.00 25.00 H new ATOM 0 HA LEU A 154 77.906 24.673 -11.176 1.00 25.00 H new ATOM 0 HB2 LEU A 154 75.379 25.215 -9.590 1.00 25.00 H new ATOM 0 HB3 LEU A 154 75.493 24.250 -11.048 1.00 25.00 H new ATOM 0 HG LEU A 154 76.913 23.541 -8.464 1.00 25.00 H new ATOM 0 HD11 LEU A 154 75.085 21.886 -8.158 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.464 23.553 -8.147 1.00 25.00 H new ATOM 0 HD13 LEU A 154 74.266 22.539 -9.596 1.00 25.00 H new ATOM 0 HD21 LEU A 154 77.056 21.302 -9.472 1.00 25.00 H new ATOM 0 HD22 LEU A 154 76.274 21.920 -10.946 1.00 25.00 H new ATOM 0 HD23 LEU A 154 77.877 22.527 -10.468 1.00 25.00 H new ATOM 1178 N THR A 155 77.408 26.674 -12.581 1.00 25.00 N ATOM 1179 CA THR A 155 77.144 27.845 -13.424 1.00 25.00 C ATOM 1180 C THR A 155 76.380 27.514 -14.704 1.00 25.00 C ATOM 1181 O THR A 155 75.565 28.315 -15.170 1.00 25.00 O ATOM 1182 CB THR A 155 78.471 28.522 -13.831 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.306 27.565 -14.494 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.222 29.029 -12.602 1.00 25.00 C ATOM 0 H THR A 155 78.029 25.983 -13.002 1.00 25.00 H new ATOM 0 HA THR A 155 76.525 28.507 -12.819 1.00 25.00 H new ATOM 0 HB THR A 155 78.238 29.361 -14.487 1.00 25.00 H new ATOM 0 HG1 THR A 155 80.149 27.992 -14.755 1.00 25.00 H new ATOM 0 HG21 THR A 155 80.153 29.502 -12.914 1.00 25.00 H new ATOM 0 HG22 THR A 155 78.605 29.756 -12.073 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.444 28.192 -11.940 1.00 25.00 H new ATOM 1192 N ASP A 156 76.625 26.338 -15.269 1.00 25.00 N ATOM 1193 CA ASP A 156 75.986 25.940 -16.528 1.00 25.00 C ATOM 1194 C ASP A 156 74.603 25.368 -16.231 1.00 25.00 C ATOM 1195 O ASP A 156 74.373 24.160 -16.284 1.00 25.00 O ATOM 1196 CB ASP A 156 76.844 24.919 -17.286 1.00 25.00 C ATOM 1197 CG ASP A 156 78.188 25.480 -17.703 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.277 26.687 -17.992 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 79.165 24.702 -17.726 1.00 25.00 O1- ATOM 0 H ASP A 156 77.260 25.641 -14.880 1.00 25.00 H new ATOM 0 HA ASP A 156 75.885 26.818 -17.166 1.00 25.00 H new ATOM 0 HB2 ASP A 156 77.000 24.043 -16.656 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.304 24.583 -18.172 1.00 25.00 H new ATOM 1204 N ASN A 157 73.692 26.258 -15.873 1.00 25.00 N ATOM 1205 CA ASN A 157 72.339 25.889 -15.451 1.00 25.00 C ATOM 1206 C ASN A 157 71.493 25.277 -16.574 1.00 25.00 C ATOM 1207 O ASN A 157 70.471 24.655 -16.313 1.00 25.00 O ATOM 1208 CB ASN A 157 71.631 27.121 -14.872 1.00 25.00 C ATOM 1209 CG ASN A 157 71.476 28.232 -15.883 1.00 25.00 C ATOM 1210 OD1 ASN A 157 70.565 28.232 -16.685 1.00 25.00 O ATOM 1211 ND2 ASN A 157 72.377 29.179 -15.855 1.00 25.00 N ATOM 0 H ASN A 157 73.865 27.263 -15.865 1.00 25.00 H new ATOM 0 HA ASN A 157 72.444 25.114 -14.691 1.00 25.00 H new ATOM 0 HB2 ASN A 157 70.647 26.830 -14.504 1.00 25.00 H new ATOM 0 HB3 ASN A 157 72.195 27.490 -14.016 1.00 25.00 H new ATOM 0 HD21 ASN A 157 72.328 29.950 -16.521 1.00 25.00 H new ATOM 0 HD22 ASN A 157 73.129 29.147 -15.167 1.00 25.00 H new ATOM 1218 N HIS A 158 71.964 25.410 -17.805 1.00 25.00 N ATOM 1219 CA HIS A 158 71.298 24.839 -18.977 1.00 25.00 C ATOM 1220 C HIS A 158 71.457 23.307 -19.002 1.00 25.00 C ATOM 1221 O HIS A 158 70.785 22.604 -19.749 1.00 25.00 O ATOM 1222 CB HIS A 158 71.946 25.441 -20.235 1.00 25.00 C ATOM 1223 CG HIS A 158 71.065 25.431 -21.450 1.00 25.00 C ATOM 1224 ND1 HIS A 158 70.297 24.368 -21.852 1.00 25.00 N ATOM 1225 CD2 HIS A 158 70.843 26.396 -22.386 1.00 25.00 C ATOM 1226 CE1 HIS A 158 69.665 24.707 -22.970 1.00 25.00 C ATOM 1227 NE2 HIS A 158 69.968 25.933 -23.346 1.00 25.00 N ATOM 0 H HIS A 158 72.821 25.918 -18.025 1.00 25.00 H new ATOM 0 HA HIS A 158 70.233 25.071 -18.940 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.239 26.469 -20.022 1.00 25.00 H new ATOM 0 HB3 HIS A 158 72.859 24.889 -20.458 1.00 25.00 H new ATOM 0 HD1 HIS A 158 70.224 23.470 -21.374 1.00 25.00 H new ATOM 0 HD2 HIS A 158 71.288 27.380 -22.377 1.00 25.00 H new ATOM 0 HE1 HIS A 158 68.987 24.058 -23.505 1.00 25.00 H new ATOM 1235 N ARG A 159 72.389 22.786 -18.215 1.00 25.00 N ATOM 1236 CA ARG A 159 72.654 21.349 -18.215 1.00 25.00 C ATOM 1237 C ARG A 159 71.749 20.649 -17.217 1.00 25.00 C ATOM 1238 O ARG A 159 71.386 21.216 -16.180 1.00 25.00 O ATOM 1239 CB ARG A 159 74.120 21.079 -17.880 1.00 25.00 C ATOM 1240 CG ARG A 159 75.076 21.630 -18.921 1.00 25.00 C ATOM 1241 CD ARG A 159 76.517 21.348 -18.553 1.00 25.00 C ATOM 1242 NE ARG A 159 77.430 22.048 -19.472 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.749 22.125 -19.333 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.382 21.548 -18.342 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 79.440 22.796 -20.211 1.00 25.00 N ATOM 0 H ARG A 159 72.969 23.327 -17.574 1.00 25.00 H new ATOM 0 HA ARG A 159 72.447 20.956 -19.211 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.353 21.520 -16.911 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.274 20.004 -17.786 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.854 21.187 -19.892 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.928 22.705 -19.020 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.706 21.669 -17.529 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.705 20.275 -18.591 1.00 25.00 H new ATOM 0 HE ARG A 159 77.016 22.511 -20.281 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.861 21.017 -17.644 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.396 21.629 -18.268 1.00 25.00 H new ATOM 0 HH21 ARG A 159 78.967 23.253 -20.991 1.00 25.00 H new ATOM 0 HH22 ARG A 159 80.453 22.864 -20.118 1.00 25.00 H new ATOM 1259 N SER A 160 71.402 19.411 -17.530 1.00 25.00 N ATOM 1260 CA SER A 160 70.566 18.605 -16.656 1.00 25.00 C ATOM 1261 C SER A 160 71.391 18.115 -15.479 1.00 25.00 C ATOM 1262 O SER A 160 72.619 18.092 -15.536 1.00 25.00 O ATOM 1263 CB SER A 160 69.995 17.411 -17.422 1.00 25.00 C ATOM 1264 OG SER A 160 71.036 16.593 -17.932 1.00 25.00 O ATOM 0 H SER A 160 71.689 18.940 -18.388 1.00 25.00 H new ATOM 0 HA SER A 160 69.739 19.215 -16.293 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.355 16.824 -16.764 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.370 17.765 -18.242 1.00 25.00 H new ATOM 0 HG SER A 160 70.648 15.835 -18.417 1.00 25.00 H new ATOM 1270 N LEU A 161 70.725 17.709 -14.413 1.00 25.00 N ATOM 1271 CA LEU A 161 71.409 17.231 -13.212 1.00 25.00 C ATOM 1272 C LEU A 161 72.167 15.924 -13.488 1.00 25.00 C ATOM 1273 O LEU A 161 73.253 15.680 -12.930 1.00 25.00 O ATOM 1274 CB LEU A 161 70.389 17.061 -12.083 1.00 25.00 C ATOM 1275 CG LEU A 161 70.069 18.379 -11.345 1.00 25.00 C ATOM 1276 CD1 LEU A 161 69.143 19.303 -12.095 1.00 25.00 C ATOM 1277 CD2 LEU A 161 69.459 18.073 -10.016 1.00 25.00 C ATOM 0 H LEU A 161 69.707 17.699 -14.349 1.00 25.00 H new ATOM 0 HA LEU A 161 72.152 17.968 -12.906 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.467 16.650 -12.495 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.770 16.334 -11.365 1.00 25.00 H new ATOM 0 HG LEU A 161 71.021 18.900 -11.245 1.00 25.00 H new ATOM 0 HD11 LEU A 161 68.972 20.204 -11.505 1.00 25.00 H new ATOM 0 HD12 LEU A 161 69.594 19.575 -13.049 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.193 18.800 -12.273 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.234 19.004 -9.496 1.00 25.00 H new ATOM 0 HD22 LEU A 161 68.539 17.506 -10.160 1.00 25.00 H new ATOM 0 HD23 LEU A 161 70.158 17.485 -9.421 1.00 25.00 H new ATOM 1289 N ALA A 162 71.658 15.130 -14.424 1.00 25.00 N ATOM 1290 CA ALA A 162 72.352 13.921 -14.864 1.00 25.00 C ATOM 1291 C ALA A 162 73.723 14.260 -15.471 1.00 25.00 C ATOM 1292 O ALA A 162 74.665 13.487 -15.348 1.00 25.00 O ATOM 1293 CB ALA A 162 71.495 13.167 -15.884 1.00 25.00 C ATOM 0 H ALA A 162 70.768 15.300 -14.893 1.00 25.00 H new ATOM 0 HA ALA A 162 72.515 13.286 -13.994 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.020 12.268 -16.206 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.546 12.889 -15.427 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.308 13.807 -16.746 1.00 25.00 H new ATOM 1299 N SER A 163 73.846 15.436 -16.077 1.00 25.00 N ATOM 1300 CA SER A 163 75.117 15.872 -16.668 1.00 25.00 C ATOM 1301 C SER A 163 76.167 16.182 -15.603 1.00 25.00 C ATOM 1302 O SER A 163 77.356 16.256 -15.911 1.00 25.00 O ATOM 1303 CB SER A 163 74.912 17.117 -17.537 1.00 25.00 C ATOM 1304 OG SER A 163 76.122 17.493 -18.176 1.00 25.00 O ATOM 0 H SER A 163 73.085 16.108 -16.175 1.00 25.00 H new ATOM 0 HA SER A 163 75.476 15.045 -17.281 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.146 16.920 -18.287 1.00 25.00 H new ATOM 0 HB3 SER A 163 74.550 17.940 -16.921 1.00 25.00 H new ATOM 0 HG SER A 163 76.879 17.070 -17.719 1.00 25.00 H new ATOM 1310 N TYR A 164 75.740 16.354 -14.358 1.00 25.00 N ATOM 1311 CA TYR A 164 76.668 16.600 -13.255 1.00 25.00 C ATOM 1312 C TYR A 164 76.872 15.326 -12.459 1.00 25.00 C ATOM 1313 O TYR A 164 77.665 15.288 -11.527 1.00 25.00 O ATOM 1314 CB TYR A 164 76.122 17.684 -12.334 1.00 25.00 C ATOM 1315 CG TYR A 164 76.144 19.038 -12.981 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.295 19.844 -12.907 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.028 19.519 -13.690 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.328 21.114 -13.520 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.058 20.786 -14.306 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.208 21.576 -14.206 1.00 25.00 C ATOM 1321 OH TYR A 164 76.252 22.818 -14.770 1.00 25.00 O ATOM 0 H TYR A 164 74.758 16.328 -14.084 1.00 25.00 H new ATOM 0 HA TYR A 164 77.620 16.930 -13.671 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.100 17.436 -12.049 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.711 17.711 -11.417 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.164 19.486 -12.374 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.139 18.911 -13.763 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.217 21.724 -13.458 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.198 21.145 -14.852 1.00 25.00 H new ATOM 0 HH TYR A 164 75.412 22.992 -15.243 1.00 25.00 H new ATOM 1331 N GLY A 165 76.130 14.289 -12.820 1.00 25.00 N ATOM 1332 CA GLY A 165 76.181 13.046 -12.081 1.00 25.00 C ATOM 1333 C GLY A 165 75.450 13.170 -10.762 1.00 25.00 C ATOM 1334 O GLY A 165 75.780 12.464 -9.810 1.00 25.00 O ATOM 0 H GLY A 165 75.491 14.288 -13.615 1.00 25.00 H new ATOM 0 HA2 GLY A 165 75.736 12.247 -12.674 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.219 12.768 -11.901 1.00 25.00 H new ATOM 1338 N LEU A 166 74.466 14.063 -10.691 1.00 25.00 N ATOM 1339 CA LEU A 166 73.712 14.268 -9.448 1.00 25.00 C ATOM 1340 C LEU A 166 72.730 13.118 -9.228 1.00 25.00 C ATOM 1341 O LEU A 166 71.547 13.210 -9.546 1.00 25.00 O ATOM 1342 CB LEU A 166 72.982 15.614 -9.485 1.00 25.00 C ATOM 1343 CG LEU A 166 73.851 16.782 -9.006 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.354 18.117 -9.545 1.00 25.00 C ATOM 1345 CD2 LEU A 166 73.852 16.810 -7.486 1.00 25.00 C ATOM 0 H LEU A 166 74.171 14.653 -11.469 1.00 25.00 H new ATOM 0 HA LEU A 166 74.410 14.283 -8.611 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.648 15.811 -10.503 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.089 15.554 -8.862 1.00 25.00 H new ATOM 0 HG LEU A 166 74.862 16.632 -9.384 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.998 18.918 -9.182 1.00 25.00 H new ATOM 0 HD12 LEU A 166 73.375 18.100 -10.635 1.00 25.00 H new ATOM 0 HD13 LEU A 166 72.333 18.289 -9.205 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.468 17.639 -7.138 1.00 25.00 H new ATOM 0 HD22 LEU A 166 72.832 16.939 -7.124 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.256 15.872 -7.105 1.00 25.00 H new ATOM 1357 N LYS A 167 73.269 12.012 -8.740 1.00 25.00 N ATOM 1358 CA LYS A 167 72.505 10.788 -8.508 1.00 25.00 C ATOM 1359 C LYS A 167 71.581 10.904 -7.315 1.00 25.00 C ATOM 1360 O LYS A 167 71.839 11.651 -6.378 1.00 25.00 O ATOM 1361 CB LYS A 167 73.455 9.626 -8.219 1.00 25.00 C ATOM 1362 CG LYS A 167 74.361 9.258 -9.367 1.00 25.00 C ATOM 1363 CD LYS A 167 75.262 8.120 -8.953 1.00 25.00 C ATOM 1364 CE LYS A 167 76.254 7.787 -10.045 1.00 25.00 C ATOM 1365 NZ LYS A 167 77.148 6.672 -9.601 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.255 11.934 -8.491 1.00 25.00 H new ATOM 0 HA LYS A 167 71.917 10.618 -9.410 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.069 9.882 -7.356 1.00 25.00 H new ATOM 0 HB3 LYS A 167 72.866 8.752 -7.943 1.00 25.00 H new ATOM 0 HG2 LYS A 167 73.767 8.969 -10.234 1.00 25.00 H new ATOM 0 HG3 LYS A 167 74.959 10.120 -9.663 1.00 25.00 H new ATOM 0 HD2 LYS A 167 75.796 8.388 -8.041 1.00 25.00 H new ATOM 0 HD3 LYS A 167 74.660 7.241 -8.723 1.00 25.00 H new ATOM 0 HE2 LYS A 167 75.725 7.500 -10.954 1.00 25.00 H new ATOM 0 HE3 LYS A 167 76.850 8.667 -10.288 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 77.827 6.449 -10.357 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 77.665 6.961 -8.746 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 76.575 5.830 -9.391 1.00 25.00 H new ATOM 1379 N ASP A 168 70.565 10.066 -7.315 1.00 25.00 N ATOM 1380 CA ASP A 168 69.687 9.923 -6.172 1.00 25.00 C ATOM 1381 C ASP A 168 70.529 9.563 -4.947 1.00 25.00 C ATOM 1382 O ASP A 168 71.395 8.691 -5.001 1.00 25.00 O ATOM 1383 CB ASP A 168 68.618 8.846 -6.434 1.00 25.00 C ATOM 1384 CG ASP A 168 69.160 7.634 -7.208 1.00 25.00 C ATOM 1385 OD1 ASP A 168 69.511 7.788 -8.411 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.141 6.519 -6.653 1.00 25.00 O1- ATOM 0 H ASP A 168 70.325 9.467 -8.105 1.00 25.00 H new ATOM 0 HA ASP A 168 69.166 10.864 -5.994 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.210 8.508 -5.481 1.00 25.00 H new ATOM 0 HB3 ASP A 168 67.795 9.289 -6.994 1.00 25.00 H new ATOM 1391 N GLY A 169 70.303 10.298 -3.867 1.00 25.00 N ATOM 1392 CA GLY A 169 71.055 10.120 -2.638 1.00 25.00 C ATOM 1393 C GLY A 169 72.099 11.197 -2.413 1.00 25.00 C ATOM 1394 O GLY A 169 72.576 11.360 -1.291 1.00 25.00 O ATOM 0 H GLY A 169 69.595 11.031 -3.820 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.364 10.112 -1.795 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.545 9.147 -2.658 1.00 25.00 H new ATOM 1398 N ASP A 170 72.463 11.936 -3.453 1.00 25.00 N ATOM 1399 CA ASP A 170 73.475 12.990 -3.315 1.00 25.00 C ATOM 1400 C ASP A 170 72.888 14.278 -2.707 1.00 25.00 C ATOM 1401 O ASP A 170 71.664 14.415 -2.550 1.00 25.00 O ATOM 1402 CB ASP A 170 74.119 13.279 -4.675 1.00 25.00 C ATOM 1403 CG ASP A 170 75.606 13.571 -4.566 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.053 14.091 -3.519 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.335 13.288 -5.541 1.00 25.00 O1- ATOM 0 H ASP A 170 72.081 11.832 -4.393 1.00 25.00 H new ATOM 0 HA ASP A 170 74.239 12.630 -2.626 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.968 12.424 -5.334 1.00 25.00 H new ATOM 0 HB3 ASP A 170 73.618 14.130 -5.137 1.00 25.00 H new ATOM 1410 N VAL A 171 73.761 15.209 -2.346 1.00 25.00 N ATOM 1411 CA VAL A 171 73.365 16.444 -1.665 1.00 25.00 C ATOM 1412 C VAL A 171 74.041 17.675 -2.288 1.00 25.00 C ATOM 1413 O VAL A 171 75.213 17.630 -2.670 1.00 25.00 O ATOM 1414 CB VAL A 171 73.690 16.332 -0.122 1.00 25.00 C ATOM 1415 CG1 VAL A 171 75.170 15.999 0.118 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.306 17.617 0.647 1.00 25.00 C ATOM 0 H VAL A 171 74.764 15.134 -2.515 1.00 25.00 H new ATOM 0 HA VAL A 171 72.290 16.576 -1.789 1.00 25.00 H new ATOM 0 HB VAL A 171 73.081 15.514 0.263 1.00 25.00 H new ATOM 0 HG11 VAL A 171 75.358 15.930 1.189 1.00 25.00 H new ATOM 0 HG12 VAL A 171 75.410 15.047 -0.355 1.00 25.00 H new ATOM 0 HG13 VAL A 171 75.794 16.784 -0.310 1.00 25.00 H new ATOM 0 HG21 VAL A 171 73.547 17.495 1.703 1.00 25.00 H new ATOM 0 HG22 VAL A 171 73.863 18.463 0.243 1.00 25.00 H new ATOM 0 HG23 VAL A 171 72.237 17.801 0.538 1.00 25.00 H new ATOM 1426 N VAL A 172 73.311 18.784 -2.372 1.00 25.00 N ATOM 1427 CA VAL A 172 73.882 20.046 -2.852 1.00 25.00 C ATOM 1428 C VAL A 172 73.790 21.049 -1.716 1.00 25.00 C ATOM 1429 O VAL A 172 73.012 20.863 -0.779 1.00 25.00 O ATOM 1430 CB VAL A 172 73.140 20.597 -4.107 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.233 19.601 -5.261 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.675 20.889 -3.799 1.00 25.00 C ATOM 0 H VAL A 172 72.325 18.838 -2.115 1.00 25.00 H new ATOM 0 HA VAL A 172 74.915 19.875 -3.154 1.00 25.00 H new ATOM 0 HB VAL A 172 73.625 21.530 -4.395 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.710 20.001 -6.130 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.280 19.433 -5.513 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.776 18.657 -4.965 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.184 21.272 -4.694 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.181 19.972 -3.478 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.611 21.632 -3.004 1.00 25.00 H new ATOM 1442 N ILE A 173 74.579 22.109 -1.786 1.00 25.00 N ATOM 1443 CA ILE A 173 74.578 23.129 -0.745 1.00 25.00 C ATOM 1444 C ILE A 173 74.240 24.467 -1.387 1.00 25.00 C ATOM 1445 O ILE A 173 74.895 24.904 -2.334 1.00 25.00 O ATOM 1446 CB ILE A 173 75.956 23.205 -0.019 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.281 21.848 0.647 1.00 25.00 C ATOM 1448 CG2 ILE A 173 75.958 24.345 1.038 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.719 21.726 1.182 1.00 25.00 C ATOM 0 H ILE A 173 75.229 22.287 -2.552 1.00 25.00 H new ATOM 0 HA ILE A 173 73.833 22.873 0.009 1.00 25.00 H new ATOM 0 HB ILE A 173 76.726 23.426 -0.758 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.586 21.687 1.471 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.108 21.052 -0.077 1.00 25.00 H new ATOM 0 HG21 ILE A 173 76.929 24.381 1.533 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.767 25.298 0.545 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.180 24.156 1.778 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.858 20.743 1.632 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.425 21.852 0.361 1.00 25.00 H new ATOM 0 HD13 ILE A 173 77.895 22.497 1.933 1.00 25.00 H new ATOM 1461 N LEU A 174 73.219 25.121 -0.862 1.00 25.00 N ATOM 1462 CA LEU A 174 72.820 26.443 -1.316 1.00 25.00 C ATOM 1463 C LEU A 174 73.246 27.414 -0.226 1.00 25.00 C ATOM 1464 O LEU A 174 73.030 27.164 0.951 1.00 25.00 O ATOM 1465 CB LEU A 174 71.308 26.496 -1.547 1.00 25.00 C ATOM 1466 CG LEU A 174 70.810 27.850 -2.079 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.892 27.653 -3.272 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.085 28.613 -0.985 1.00 25.00 C ATOM 0 H LEU A 174 72.642 24.750 -0.107 1.00 25.00 H new ATOM 0 HA LEU A 174 73.289 26.699 -2.266 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.030 25.714 -2.253 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.798 26.275 -0.609 1.00 25.00 H new ATOM 0 HG LEU A 174 71.676 28.430 -2.400 1.00 25.00 H new ATOM 0 HD11 LEU A 174 69.551 28.623 -3.633 1.00 25.00 H new ATOM 0 HD12 LEU A 174 70.433 27.140 -4.067 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.032 27.054 -2.974 1.00 25.00 H new ATOM 0 HD21 LEU A 174 69.738 29.569 -1.377 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.230 28.031 -0.640 1.00 25.00 H new ATOM 0 HD23 LEU A 174 70.765 28.788 -0.151 1.00 25.00 H new ATOM 1480 N ARG A 175 73.892 28.500 -0.609 1.00 25.00 N ATOM 1481 CA ARG A 175 74.420 29.472 0.347 1.00 25.00 C ATOM 1482 C ARG A 175 73.759 30.819 0.135 1.00 25.00 C ATOM 1483 O ARG A 175 73.950 31.467 -0.892 1.00 25.00 O ATOM 1484 CB ARG A 175 75.932 29.601 0.170 1.00 25.00 C ATOM 1485 CG ARG A 175 76.702 28.325 0.508 1.00 25.00 C ATOM 1486 CD ARG A 175 78.128 28.395 -0.015 1.00 25.00 C ATOM 1487 NE ARG A 175 78.870 29.534 0.550 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.105 29.885 0.213 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.808 29.215 -0.667 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.646 30.929 0.776 1.00 25.00 N ATOM 0 H ARG A 175 74.068 28.738 -1.585 1.00 25.00 H new ATOM 0 HA ARG A 175 74.206 29.129 1.359 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.145 29.881 -0.862 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.295 30.412 0.802 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.714 28.178 1.588 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.194 27.464 0.075 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.648 27.468 0.227 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.111 28.477 -1.102 1.00 25.00 H new ATOM 0 HE ARG A 175 78.398 30.098 1.256 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.409 28.392 -1.119 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.754 29.516 -0.900 1.00 25.00 H new ATOM 0 HH21 ARG A 175 80.121 31.465 1.467 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.594 31.209 0.526 1.00 25.00 H new ATOM 1504 N GLN A 176 72.973 31.223 1.130 1.00 25.00 N ATOM 1505 CA GLN A 176 72.251 32.505 1.142 1.00 25.00 C ATOM 1506 C GLN A 176 72.663 33.382 2.330 1.00 25.00 C ATOM 1507 O GLN A 176 73.055 34.522 2.221 1.00 25.00 O ATOM 1508 CB GLN A 176 70.730 32.245 1.118 1.00 25.00 C ATOM 1509 CG GLN A 176 69.939 33.495 0.667 1.00 25.00 C ATOM 1510 CD GLN A 176 69.711 34.480 1.778 1.00 25.00 C ATOM 1511 OE1 GLN A 176 69.508 34.171 2.935 1.00 25.00 O ATOM 1512 NE2 GLN A 176 69.730 35.751 1.415 1.00 25.00 N ATOM 1513 OXT GLN A 176 72.589 32.845 3.401 1.00 25.00 O ATOM 0 H GLN A 176 72.813 30.663 1.968 1.00 25.00 H new ATOM 0 HA GLN A 176 72.521 33.063 0.245 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.514 31.416 0.444 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.397 31.944 2.111 1.00 25.00 H new ATOM 0 HG2 GLN A 176 70.479 33.987 -0.142 1.00 25.00 H new ATOM 0 HG3 GLN A 176 68.976 33.182 0.263 1.00 25.00 H new ATOM 0 HE21 GLN A 176 69.901 36.001 0.441 1.00 25.00 H new ATOM 0 HE22 GLN A 176 69.573 36.482 2.109 1.00 25.00 H new