USER MOD reduce.3.24.130724 H: found=0, std=0, add=755, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 756 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 Single : A 24 MET CE :methyl 176:sc= -0.852 (180deg=-0.941) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -151:sc= -0.169 (180deg=-1.56!) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -0.13 K(o=-0.13,f=-2.3!) USER MOD Single : A 38 LYS NZ :NH3+ -170:sc=-0.00283 (180deg=-0.115) USER MOD Single : A 43 LYS NZ :NH3+ -149:sc= 0.0251 (180deg=0) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= -4.31! C(o=-4.3!,f=-3.9!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 38:sc= -0.372 USER MOD Single : A 62 ASN : amide:sc= -0.345 K(o=-0.35,f=-1.7) USER MOD Single : A 72 THR OG1 : rot -17:sc= 0.274 USER MOD Single : A 74 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0223) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot -170:sc= 0 USER MOD Single : A 84 TYR OH : rot 130:sc= 0.202 USER MOD Single : A 87 SER OG : rot -72:sc= 0.619 USER MOD Single : A 88 CYS SG : rot 140:sc= -0.0103 USER MOD Single : A 106 THR OG1 : rot 24:sc= 0.0952 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 175:sc= 0.61 (180deg=0.508) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 GLN : amide:sc= 0 K(o=0,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -8.433 25.734 -17.132 1.00 0.00 N ATOM 297 CA ARG A 22 -9.775 25.978 -17.704 1.00 0.00 C ATOM 298 C ARG A 22 -10.851 25.739 -16.621 1.00 0.00 C ATOM 299 O ARG A 22 -10.588 24.980 -15.683 1.00 0.00 O ATOM 300 CB ARG A 22 -10.022 25.060 -18.935 1.00 0.00 C ATOM 301 CG ARG A 22 -9.109 25.351 -20.151 1.00 0.00 C ATOM 302 CD ARG A 22 -9.647 24.718 -21.442 1.00 0.00 C ATOM 303 NE ARG A 22 -11.010 25.205 -21.745 1.00 0.00 N ATOM 304 CZ ARG A 22 -11.833 24.709 -22.686 1.00 0.00 C ATOM 305 NH1 ARG A 22 -11.458 23.702 -23.458 1.00 0.00 N ATOM 306 NH2 ARG A 22 -13.031 25.241 -22.857 1.00 0.00 N ATOM 0 HA ARG A 22 -9.834 27.013 -18.041 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.881 24.023 -18.632 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.062 25.163 -19.245 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -9.019 26.429 -20.286 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -8.107 24.970 -19.951 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -8.980 24.954 -22.272 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.659 23.633 -21.341 1.00 0.00 H new ATOM 0 HE ARG A 22 -11.357 25.987 -21.190 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.532 23.290 -23.344 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -12.095 23.338 -24.167 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -13.328 26.025 -22.276 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -13.658 24.867 -23.570 1.00 0.00 H new ATOM 320 N PRO A 23 -12.076 26.378 -16.719 1.00 0.00 N ATOM 321 CA PRO A 23 -13.141 26.199 -15.710 1.00 0.00 C ATOM 322 C PRO A 23 -13.614 24.725 -15.656 1.00 0.00 C ATOM 323 O PRO A 23 -14.166 24.195 -16.635 1.00 0.00 O ATOM 324 CB PRO A 23 -14.271 27.169 -16.168 1.00 0.00 C ATOM 325 CG PRO A 23 -14.014 27.395 -17.628 1.00 0.00 C ATOM 326 CD PRO A 23 -12.512 27.302 -17.805 1.00 0.00 C ATOM 0 HA PRO A 23 -12.807 26.423 -14.697 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -15.257 26.734 -16.003 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -14.238 28.105 -15.611 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -14.526 26.648 -18.235 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -14.385 28.370 -17.943 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -12.250 26.913 -18.789 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -12.038 28.279 -17.712 1.00 0.00 H new ATOM 334 N MET A 24 -13.323 24.077 -14.510 1.00 0.00 N ATOM 335 CA MET A 24 -13.686 22.676 -14.209 1.00 0.00 C ATOM 336 C MET A 24 -15.213 22.473 -14.276 1.00 0.00 C ATOM 337 O MET A 24 -15.970 23.451 -14.178 1.00 0.00 O ATOM 338 CB MET A 24 -13.137 22.283 -12.804 1.00 0.00 C ATOM 339 CG MET A 24 -11.598 22.158 -12.694 1.00 0.00 C ATOM 340 SD MET A 24 -10.679 23.649 -13.164 1.00 0.00 S ATOM 341 CE MET A 24 -11.217 24.854 -11.951 1.00 0.00 C ATOM 0 H MET A 24 -12.815 24.525 -13.747 1.00 0.00 H new ATOM 0 HA MET A 24 -13.235 22.028 -14.961 1.00 0.00 H new ATOM 0 HB2 MET A 24 -13.475 23.026 -12.082 1.00 0.00 H new ATOM 0 HB3 MET A 24 -13.582 21.331 -12.514 1.00 0.00 H new ATOM 0 HG2 MET A 24 -11.341 21.898 -11.667 1.00 0.00 H new ATOM 0 HG3 MET A 24 -11.269 21.331 -13.324 1.00 0.00 H new ATOM 0 HE1 MET A 24 -10.668 25.785 -12.095 1.00 0.00 H new ATOM 0 HE2 MET A 24 -12.284 25.040 -12.071 1.00 0.00 H new ATOM 0 HE3 MET A 24 -11.026 24.471 -10.948 1.00 0.00 H new ATOM 351 N SER A 25 -15.638 21.193 -14.390 1.00 0.00 N ATOM 352 CA SER A 25 -17.036 20.808 -14.678 1.00 0.00 C ATOM 353 C SER A 25 -18.049 21.469 -13.715 1.00 0.00 C ATOM 354 O SER A 25 -17.881 21.424 -12.490 1.00 0.00 O ATOM 355 CB SER A 25 -17.172 19.266 -14.635 1.00 0.00 C ATOM 356 OG SER A 25 -16.339 18.650 -15.606 1.00 0.00 O ATOM 0 H SER A 25 -15.014 20.393 -14.283 1.00 0.00 H new ATOM 0 HA SER A 25 -17.275 21.172 -15.677 1.00 0.00 H new ATOM 0 HB2 SER A 25 -16.908 18.903 -13.642 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.210 18.985 -14.812 1.00 0.00 H new ATOM 0 HG SER A 25 -16.443 17.677 -15.556 1.00 0.00 H new ATOM 362 N TYR A 26 -19.103 22.063 -14.306 1.00 0.00 N ATOM 363 CA TYR A 26 -20.124 22.843 -13.575 1.00 0.00 C ATOM 364 C TYR A 26 -20.999 21.946 -12.678 1.00 0.00 C ATOM 365 O TYR A 26 -21.530 22.419 -11.675 1.00 0.00 O ATOM 366 CB TYR A 26 -20.994 23.677 -14.558 1.00 0.00 C ATOM 367 CG TYR A 26 -21.766 22.849 -15.612 1.00 0.00 C ATOM 368 CD1 TYR A 26 -23.093 22.474 -15.404 1.00 0.00 C ATOM 369 CD2 TYR A 26 -21.162 22.450 -16.812 1.00 0.00 C ATOM 370 CE1 TYR A 26 -23.779 21.729 -16.344 1.00 0.00 C ATOM 371 CE2 TYR A 26 -21.850 21.706 -17.749 1.00 0.00 C ATOM 372 CZ TYR A 26 -23.157 21.353 -17.511 1.00 0.00 C ATOM 373 OH TYR A 26 -23.852 20.615 -18.437 1.00 0.00 O ATOM 0 H TYR A 26 -19.273 22.016 -15.311 1.00 0.00 H new ATOM 0 HA TYR A 26 -19.597 23.535 -12.918 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -21.711 24.260 -13.980 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -20.350 24.387 -15.077 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -23.593 22.771 -14.494 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -20.138 22.730 -17.007 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -24.804 21.442 -16.162 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -21.364 21.403 -18.665 1.00 0.00 H new ATOM 0 HH TYR A 26 -23.275 20.430 -19.207 1.00 0.00 H new ATOM 383 N ASP A 27 -21.134 20.659 -13.058 1.00 0.00 N ATOM 384 CA ASP A 27 -21.827 19.626 -12.245 1.00 0.00 C ATOM 385 C ASP A 27 -21.072 19.351 -10.943 1.00 0.00 C ATOM 386 O ASP A 27 -21.684 19.127 -9.891 1.00 0.00 O ATOM 387 CB ASP A 27 -21.970 18.309 -13.044 1.00 0.00 C ATOM 388 CG ASP A 27 -22.876 18.469 -14.264 1.00 0.00 C ATOM 389 OD1 ASP A 27 -22.378 18.882 -15.327 1.00 0.00 O ATOM 390 OD2 ASP A 27 -24.088 18.200 -14.156 1.00 0.00 O ATOM 0 H ASP A 27 -20.766 20.301 -13.939 1.00 0.00 H new ATOM 0 HA ASP A 27 -22.818 20.010 -12.002 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -20.985 17.973 -13.367 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -22.374 17.533 -12.393 1.00 0.00 H new ATOM 395 N GLU A 28 -19.736 19.370 -11.041 1.00 0.00 N ATOM 396 CA GLU A 28 -18.852 19.231 -9.882 1.00 0.00 C ATOM 397 C GLU A 28 -18.995 20.475 -8.972 1.00 0.00 C ATOM 398 O GLU A 28 -18.932 20.354 -7.760 1.00 0.00 O ATOM 399 CB GLU A 28 -17.385 19.030 -10.355 1.00 0.00 C ATOM 400 CG GLU A 28 -16.351 18.787 -9.228 1.00 0.00 C ATOM 401 CD GLU A 28 -14.942 18.472 -9.764 1.00 0.00 C ATOM 402 OE1 GLU A 28 -14.181 19.420 -10.052 1.00 0.00 O ATOM 403 OE2 GLU A 28 -14.599 17.276 -9.915 1.00 0.00 O ATOM 0 H GLU A 28 -19.241 19.482 -11.926 1.00 0.00 H new ATOM 0 HA GLU A 28 -19.135 18.353 -9.302 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -17.355 18.183 -11.041 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -17.080 19.910 -10.921 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -16.302 19.670 -8.590 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -16.690 17.960 -8.603 1.00 0.00 H new ATOM 410 N LYS A 29 -19.210 21.661 -9.602 1.00 0.00 N ATOM 411 CA LYS A 29 -19.484 22.955 -8.907 1.00 0.00 C ATOM 412 C LYS A 29 -20.884 22.982 -8.247 1.00 0.00 C ATOM 413 O LYS A 29 -21.067 23.661 -7.226 1.00 0.00 O ATOM 414 CB LYS A 29 -19.293 24.173 -9.886 1.00 0.00 C ATOM 415 CG LYS A 29 -17.868 24.792 -9.985 1.00 0.00 C ATOM 416 CD LYS A 29 -16.788 23.875 -10.620 1.00 0.00 C ATOM 417 CE LYS A 29 -16.142 22.890 -9.629 1.00 0.00 C ATOM 418 NZ LYS A 29 -15.108 22.067 -10.281 1.00 0.00 N ATOM 0 H LYS A 29 -19.198 21.750 -10.618 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.754 23.046 -8.103 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -19.592 23.854 -10.884 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -19.983 24.961 -9.583 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -17.929 25.711 -10.568 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -17.541 25.071 -8.983 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -17.239 23.310 -11.436 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -16.008 24.498 -11.057 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -15.699 23.444 -8.801 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -16.910 22.243 -9.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -15.043 21.147 -9.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -15.360 21.920 -11.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.190 22.553 -10.223 1.00 0.00 H new ATOM 432 N ARG A 30 -21.853 22.249 -8.837 1.00 0.00 N ATOM 433 CA ARG A 30 -23.209 22.084 -8.255 1.00 0.00 C ATOM 434 C ARG A 30 -23.114 21.325 -6.928 1.00 0.00 C ATOM 435 O ARG A 30 -23.687 21.742 -5.912 1.00 0.00 O ATOM 436 CB ARG A 30 -24.144 21.325 -9.235 1.00 0.00 C ATOM 437 CG ARG A 30 -24.527 22.110 -10.505 1.00 0.00 C ATOM 438 CD ARG A 30 -25.375 21.277 -11.485 1.00 0.00 C ATOM 439 NE ARG A 30 -25.835 22.079 -12.629 1.00 0.00 N ATOM 440 CZ ARG A 30 -26.215 21.597 -13.821 1.00 0.00 C ATOM 441 NH1 ARG A 30 -26.102 20.308 -14.116 1.00 0.00 N ATOM 442 NH2 ARG A 30 -26.663 22.428 -14.742 1.00 0.00 N ATOM 0 H ARG A 30 -21.723 21.758 -9.722 1.00 0.00 H new ATOM 0 HA ARG A 30 -23.632 23.073 -8.077 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -23.658 20.396 -9.532 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -25.057 21.052 -8.705 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -25.081 23.005 -10.221 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -23.620 22.444 -11.009 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -24.788 20.432 -11.846 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -26.237 20.865 -10.960 1.00 0.00 H new ATOM 0 HE ARG A 30 -25.868 23.091 -12.505 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -25.719 19.659 -13.429 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -26.398 19.966 -15.030 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -26.718 23.427 -14.544 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -26.955 22.072 -15.652 1.00 0.00 H new ATOM 456 N GLN A 31 -22.358 20.211 -6.961 1.00 0.00 N ATOM 457 CA GLN A 31 -22.067 19.410 -5.767 1.00 0.00 C ATOM 458 C GLN A 31 -21.189 20.208 -4.791 1.00 0.00 C ATOM 459 O GLN A 31 -21.409 20.136 -3.599 1.00 0.00 O ATOM 460 CB GLN A 31 -21.358 18.081 -6.158 1.00 0.00 C ATOM 461 CG GLN A 31 -20.976 17.180 -4.955 1.00 0.00 C ATOM 462 CD GLN A 31 -20.278 15.875 -5.339 1.00 0.00 C ATOM 463 OE1 GLN A 31 -19.600 15.785 -6.366 1.00 0.00 O ATOM 464 NE2 GLN A 31 -20.442 14.849 -4.515 1.00 0.00 N ATOM 0 H GLN A 31 -21.936 19.846 -7.815 1.00 0.00 H new ATOM 0 HA GLN A 31 -23.011 19.169 -5.277 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -22.011 17.518 -6.825 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -20.455 18.317 -6.720 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -20.324 17.743 -4.287 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -21.879 16.943 -4.393 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -21.009 14.956 -3.674 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -20.001 13.953 -4.722 1.00 0.00 H new ATOM 473 N LEU A 32 -20.244 21.001 -5.346 1.00 0.00 N ATOM 474 CA LEU A 32 -19.186 21.713 -4.587 1.00 0.00 C ATOM 475 C LEU A 32 -19.805 22.675 -3.561 1.00 0.00 C ATOM 476 O LEU A 32 -19.509 22.586 -2.377 1.00 0.00 O ATOM 477 CB LEU A 32 -18.244 22.494 -5.574 1.00 0.00 C ATOM 478 CG LEU A 32 -16.736 22.619 -5.199 1.00 0.00 C ATOM 479 CD1 LEU A 32 -16.506 23.463 -3.929 1.00 0.00 C ATOM 480 CD2 LEU A 32 -16.097 21.211 -5.097 1.00 0.00 C ATOM 0 H LEU A 32 -20.193 21.168 -6.351 1.00 0.00 H new ATOM 0 HA LEU A 32 -18.593 20.975 -4.046 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.307 22.011 -6.549 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -18.644 23.501 -5.691 1.00 0.00 H new ATOM 0 HG LEU A 32 -16.235 23.164 -5.999 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.438 23.516 -3.716 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.895 24.469 -4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -17.022 23.001 -3.087 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.043 21.308 -4.835 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.611 20.633 -4.329 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.187 20.700 -6.056 1.00 0.00 H new ATOM 492 N SER A 33 -20.661 23.583 -4.054 1.00 0.00 N ATOM 493 CA SER A 33 -21.342 24.599 -3.229 1.00 0.00 C ATOM 494 C SER A 33 -22.232 23.929 -2.154 1.00 0.00 C ATOM 495 O SER A 33 -22.204 24.293 -0.963 1.00 0.00 O ATOM 496 CB SER A 33 -22.175 25.520 -4.150 1.00 0.00 C ATOM 497 OG SER A 33 -22.768 26.581 -3.425 1.00 0.00 O ATOM 0 H SER A 33 -20.903 23.635 -5.043 1.00 0.00 H new ATOM 0 HA SER A 33 -20.598 25.199 -2.704 1.00 0.00 H new ATOM 0 HB2 SER A 33 -21.536 25.926 -4.934 1.00 0.00 H new ATOM 0 HB3 SER A 33 -22.952 24.936 -4.643 1.00 0.00 H new ATOM 0 HG SER A 33 -23.286 27.145 -4.036 1.00 0.00 H new ATOM 503 N LEU A 34 -22.960 22.895 -2.607 1.00 0.00 N ATOM 504 CA LEU A 34 -23.867 22.084 -1.770 1.00 0.00 C ATOM 505 C LEU A 34 -23.047 21.330 -0.685 1.00 0.00 C ATOM 506 O LEU A 34 -23.525 21.105 0.428 1.00 0.00 O ATOM 507 CB LEU A 34 -24.656 21.097 -2.708 1.00 0.00 C ATOM 508 CG LEU A 34 -26.137 20.738 -2.319 1.00 0.00 C ATOM 509 CD1 LEU A 34 -26.840 19.992 -3.482 1.00 0.00 C ATOM 510 CD2 LEU A 34 -26.230 19.912 -1.012 1.00 0.00 C ATOM 0 H LEU A 34 -22.936 22.592 -3.581 1.00 0.00 H new ATOM 0 HA LEU A 34 -24.586 22.716 -1.248 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -24.668 21.526 -3.710 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.091 20.167 -2.766 1.00 0.00 H new ATOM 0 HG LEU A 34 -26.651 21.681 -2.135 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -27.864 19.752 -3.194 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -26.852 20.627 -4.368 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -26.300 19.071 -3.703 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -27.275 19.694 -0.793 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -25.682 18.978 -1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -25.799 20.483 -0.189 1.00 0.00 H new ATOM 522 N ASP A 35 -21.794 20.992 -1.038 1.00 0.00 N ATOM 523 CA ASP A 35 -20.867 20.230 -0.186 1.00 0.00 C ATOM 524 C ASP A 35 -20.194 21.135 0.853 1.00 0.00 C ATOM 525 O ASP A 35 -19.870 20.684 1.957 1.00 0.00 O ATOM 526 CB ASP A 35 -19.808 19.522 -1.059 1.00 0.00 C ATOM 527 CG ASP A 35 -18.886 18.595 -0.261 1.00 0.00 C ATOM 528 OD1 ASP A 35 -19.304 17.457 0.038 1.00 0.00 O ATOM 529 OD2 ASP A 35 -17.764 19.008 0.086 1.00 0.00 O ATOM 0 H ASP A 35 -21.391 21.246 -1.940 1.00 0.00 H new ATOM 0 HA ASP A 35 -21.440 19.477 0.355 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -20.313 18.943 -1.832 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -19.204 20.274 -1.567 1.00 0.00 H new ATOM 534 N ILE A 36 -19.985 22.415 0.491 1.00 0.00 N ATOM 535 CA ILE A 36 -19.444 23.430 1.416 1.00 0.00 C ATOM 536 C ILE A 36 -20.394 23.599 2.607 1.00 0.00 C ATOM 537 O ILE A 36 -19.959 23.714 3.748 1.00 0.00 O ATOM 538 CB ILE A 36 -19.217 24.814 0.685 1.00 0.00 C ATOM 539 CG1 ILE A 36 -18.121 24.676 -0.427 1.00 0.00 C ATOM 540 CG2 ILE A 36 -18.858 25.957 1.679 1.00 0.00 C ATOM 541 CD1 ILE A 36 -17.989 25.880 -1.354 1.00 0.00 C ATOM 0 H ILE A 36 -20.184 22.773 -0.443 1.00 0.00 H new ATOM 0 HA ILE A 36 -18.474 23.087 1.775 1.00 0.00 H new ATOM 0 HB ILE A 36 -20.161 25.089 0.215 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.158 24.498 0.053 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.345 23.795 -1.029 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -18.712 26.886 1.128 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -19.669 26.084 2.396 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -17.941 25.702 2.210 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -17.206 25.690 -2.088 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -18.935 26.049 -1.868 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -17.731 26.763 -0.769 1.00 0.00 H new ATOM 553 N ASN A 37 -21.698 23.569 2.307 1.00 0.00 N ATOM 554 CA ASN A 37 -22.775 23.635 3.320 1.00 0.00 C ATOM 555 C ASN A 37 -22.724 22.455 4.329 1.00 0.00 C ATOM 556 O ASN A 37 -23.209 22.579 5.456 1.00 0.00 O ATOM 557 CB ASN A 37 -24.143 23.668 2.598 1.00 0.00 C ATOM 558 CG ASN A 37 -24.357 24.917 1.732 1.00 0.00 C ATOM 559 OD1 ASN A 37 -23.412 25.561 1.282 1.00 0.00 O ATOM 560 ND2 ASN A 37 -25.609 25.248 1.463 1.00 0.00 N ATOM 0 H ASN A 37 -22.045 23.498 1.350 1.00 0.00 H new ATOM 0 HA ASN A 37 -22.631 24.545 3.903 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -24.233 22.782 1.970 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -24.937 23.613 3.342 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -25.807 26.054 0.870 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -26.376 24.697 1.849 1.00 0.00 H new ATOM 567 N LYS A 38 -22.128 21.317 3.911 1.00 0.00 N ATOM 568 CA LYS A 38 -22.031 20.085 4.742 1.00 0.00 C ATOM 569 C LYS A 38 -20.905 20.190 5.789 1.00 0.00 C ATOM 570 O LYS A 38 -20.907 19.458 6.791 1.00 0.00 O ATOM 571 CB LYS A 38 -21.813 18.854 3.836 1.00 0.00 C ATOM 572 CG LYS A 38 -22.816 18.765 2.672 1.00 0.00 C ATOM 573 CD LYS A 38 -22.599 17.520 1.784 1.00 0.00 C ATOM 574 CE LYS A 38 -23.599 17.443 0.626 1.00 0.00 C ATOM 575 NZ LYS A 38 -25.001 17.347 1.111 1.00 0.00 N ATOM 0 H LYS A 38 -21.700 21.221 2.990 1.00 0.00 H new ATOM 0 HA LYS A 38 -22.970 19.971 5.284 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -20.801 18.884 3.432 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -21.888 17.950 4.440 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -23.829 18.747 3.073 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -22.733 19.662 2.058 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -21.585 17.536 1.384 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -22.686 16.622 2.396 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -23.493 18.325 -0.005 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -23.369 16.577 0.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -25.630 17.127 0.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -25.071 16.593 1.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -25.284 18.253 1.536 1.00 0.00 H new ATOM 589 N LEU A 39 -19.949 21.097 5.538 1.00 0.00 N ATOM 590 CA LEU A 39 -18.903 21.471 6.511 1.00 0.00 C ATOM 591 C LEU A 39 -19.541 22.146 7.757 1.00 0.00 C ATOM 592 O LEU A 39 -20.671 22.640 7.666 1.00 0.00 O ATOM 593 CB LEU A 39 -17.886 22.436 5.839 1.00 0.00 C ATOM 594 CG LEU A 39 -16.993 21.830 4.708 1.00 0.00 C ATOM 595 CD1 LEU A 39 -16.191 22.928 3.959 1.00 0.00 C ATOM 596 CD2 LEU A 39 -16.046 20.734 5.275 1.00 0.00 C ATOM 0 H LEU A 39 -19.877 21.596 4.651 1.00 0.00 H new ATOM 0 HA LEU A 39 -18.381 20.571 6.836 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -18.439 23.278 5.423 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -17.231 22.835 6.614 1.00 0.00 H new ATOM 0 HG LEU A 39 -17.658 21.362 3.982 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -15.583 22.467 3.181 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -16.882 23.638 3.506 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -15.544 23.450 4.664 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -15.435 20.328 4.469 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.399 21.170 6.036 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -16.639 19.934 5.719 1.00 0.00 H new ATOM 608 N PRO A 40 -18.854 22.148 8.953 1.00 0.00 N ATOM 609 CA PRO A 40 -19.285 22.969 10.118 1.00 0.00 C ATOM 610 C PRO A 40 -19.394 24.469 9.747 1.00 0.00 C ATOM 611 O PRO A 40 -18.679 24.928 8.845 1.00 0.00 O ATOM 612 CB PRO A 40 -18.170 22.724 11.175 1.00 0.00 C ATOM 613 CG PRO A 40 -17.565 21.402 10.790 1.00 0.00 C ATOM 614 CD PRO A 40 -17.642 21.341 9.277 1.00 0.00 C ATOM 0 HA PRO A 40 -20.276 22.694 10.481 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -17.426 23.520 11.158 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -18.581 22.693 12.184 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -16.533 21.329 11.133 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -18.111 20.575 11.244 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -16.748 21.757 8.813 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -17.737 20.315 8.922 1.00 0.00 H new ATOM 622 N GLY A 41 -20.279 25.206 10.449 1.00 0.00 N ATOM 623 CA GLY A 41 -20.572 26.623 10.147 1.00 0.00 C ATOM 624 C GLY A 41 -19.335 27.522 10.094 1.00 0.00 C ATOM 625 O GLY A 41 -19.269 28.436 9.268 1.00 0.00 O ATOM 0 H GLY A 41 -20.809 24.838 11.239 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -21.089 26.679 9.189 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -21.256 27.010 10.902 1.00 0.00 H new ATOM 629 N GLU A 42 -18.348 27.216 10.964 1.00 0.00 N ATOM 630 CA GLU A 42 -17.038 27.916 11.034 1.00 0.00 C ATOM 631 C GLU A 42 -16.316 27.921 9.664 1.00 0.00 C ATOM 632 O GLU A 42 -15.670 28.907 9.298 1.00 0.00 O ATOM 633 CB GLU A 42 -16.135 27.236 12.108 1.00 0.00 C ATOM 634 CG GLU A 42 -15.872 25.741 11.836 1.00 0.00 C ATOM 635 CD GLU A 42 -14.959 25.069 12.862 1.00 0.00 C ATOM 636 OE1 GLU A 42 -13.720 25.157 12.716 1.00 0.00 O ATOM 637 OE2 GLU A 42 -15.470 24.435 13.808 1.00 0.00 O ATOM 0 H GLU A 42 -18.436 26.465 11.649 1.00 0.00 H new ATOM 0 HA GLU A 42 -17.227 28.953 11.313 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -15.181 27.762 12.154 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -16.605 27.342 13.086 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.826 25.214 11.814 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -15.427 25.636 10.846 1.00 0.00 H new ATOM 644 N LYS A 43 -16.490 26.821 8.901 1.00 0.00 N ATOM 645 CA LYS A 43 -15.810 26.616 7.618 1.00 0.00 C ATOM 646 C LYS A 43 -16.546 27.403 6.530 1.00 0.00 C ATOM 647 O LYS A 43 -15.904 27.935 5.644 1.00 0.00 O ATOM 648 CB LYS A 43 -15.770 25.110 7.223 1.00 0.00 C ATOM 649 CG LYS A 43 -15.261 24.131 8.306 1.00 0.00 C ATOM 650 CD LYS A 43 -13.821 24.427 8.791 1.00 0.00 C ATOM 651 CE LYS A 43 -13.330 23.368 9.803 1.00 0.00 C ATOM 652 NZ LYS A 43 -12.013 23.715 10.392 1.00 0.00 N ATOM 0 H LYS A 43 -17.108 26.053 9.163 1.00 0.00 H new ATOM 0 HA LYS A 43 -14.783 26.966 7.718 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -16.775 24.806 6.932 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -15.137 25.004 6.342 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -15.936 24.167 9.161 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -15.300 23.116 7.911 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.147 24.452 7.935 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.788 25.414 9.252 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.065 23.264 10.601 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -13.259 22.400 9.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -11.492 22.843 10.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.467 24.281 9.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -12.156 24.265 11.263 1.00 0.00 H new ATOM 666 N LEU A 44 -17.896 27.499 6.634 1.00 0.00 N ATOM 667 CA LEU A 44 -18.721 28.286 5.683 1.00 0.00 C ATOM 668 C LEU A 44 -18.322 29.765 5.751 1.00 0.00 C ATOM 669 O LEU A 44 -18.107 30.392 4.726 1.00 0.00 O ATOM 670 CB LEU A 44 -20.254 28.134 5.954 1.00 0.00 C ATOM 671 CG LEU A 44 -20.928 26.810 5.458 1.00 0.00 C ATOM 672 CD1 LEU A 44 -20.384 25.579 6.198 1.00 0.00 C ATOM 673 CD2 LEU A 44 -22.475 26.890 5.558 1.00 0.00 C ATOM 0 H LEU A 44 -18.436 27.041 7.368 1.00 0.00 H new ATOM 0 HA LEU A 44 -18.530 27.893 4.684 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -20.420 28.219 7.028 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -20.767 28.974 5.485 1.00 0.00 H new ATOM 0 HG LEU A 44 -20.669 26.694 4.406 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -20.878 24.682 5.824 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -19.310 25.499 6.030 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -20.578 25.681 7.266 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -22.911 25.955 5.206 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -22.764 27.057 6.595 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -22.837 27.714 4.943 1.00 0.00 H new ATOM 685 N GLY A 45 -18.183 30.286 6.984 1.00 0.00 N ATOM 686 CA GLY A 45 -17.789 31.684 7.212 1.00 0.00 C ATOM 687 C GLY A 45 -16.377 32.015 6.711 1.00 0.00 C ATOM 688 O GLY A 45 -16.059 33.181 6.484 1.00 0.00 O ATOM 0 H GLY A 45 -18.339 29.754 7.840 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -18.504 32.340 6.716 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.846 31.899 8.279 1.00 0.00 H new ATOM 692 N ARG A 46 -15.547 30.972 6.524 1.00 0.00 N ATOM 693 CA ARG A 46 -14.146 31.105 6.069 1.00 0.00 C ATOM 694 C ARG A 46 -14.034 30.911 4.538 1.00 0.00 C ATOM 695 O ARG A 46 -13.237 31.585 3.879 1.00 0.00 O ATOM 696 CB ARG A 46 -13.270 30.082 6.840 1.00 0.00 C ATOM 697 CG ARG A 46 -11.751 30.202 6.590 1.00 0.00 C ATOM 698 CD ARG A 46 -10.936 29.293 7.525 1.00 0.00 C ATOM 699 NE ARG A 46 -9.486 29.413 7.283 1.00 0.00 N ATOM 700 CZ ARG A 46 -8.540 29.524 8.232 1.00 0.00 C ATOM 701 NH1 ARG A 46 -8.867 29.675 9.510 1.00 0.00 N ATOM 702 NH2 ARG A 46 -7.263 29.529 7.889 1.00 0.00 N ATOM 0 H ARG A 46 -15.830 30.005 6.685 1.00 0.00 H new ATOM 0 HA ARG A 46 -13.788 32.112 6.282 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.457 30.198 7.907 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -13.589 29.076 6.568 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.533 29.943 5.554 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.442 31.237 6.732 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -11.153 29.550 8.562 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.243 28.257 7.383 1.00 0.00 H new ATOM 0 HE ARG A 46 -9.174 29.412 6.312 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.849 29.708 9.785 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -8.136 29.758 10.217 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -6.998 29.449 6.907 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.543 29.613 8.606 1.00 0.00 H new ATOM 716 N VAL A 47 -14.857 30.003 3.989 1.00 0.00 N ATOM 717 CA VAL A 47 -14.907 29.712 2.542 1.00 0.00 C ATOM 718 C VAL A 47 -15.573 30.887 1.799 1.00 0.00 C ATOM 719 O VAL A 47 -15.069 31.357 0.788 1.00 0.00 O ATOM 720 CB VAL A 47 -15.662 28.352 2.248 1.00 0.00 C ATOM 721 CG1 VAL A 47 -15.917 28.147 0.740 1.00 0.00 C ATOM 722 CG2 VAL A 47 -14.881 27.140 2.824 1.00 0.00 C ATOM 0 H VAL A 47 -15.511 29.445 4.538 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.886 29.595 2.178 1.00 0.00 H new ATOM 0 HB VAL A 47 -16.629 28.417 2.747 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.437 27.202 0.584 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.529 28.965 0.360 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.965 28.129 0.209 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.424 26.220 2.606 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -13.892 27.094 2.368 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -14.777 27.253 3.903 1.00 0.00 H new ATOM 732 N VAL A 48 -16.706 31.360 2.335 1.00 0.00 N ATOM 733 CA VAL A 48 -17.396 32.571 1.845 1.00 0.00 C ATOM 734 C VAL A 48 -16.471 33.808 1.962 1.00 0.00 C ATOM 735 O VAL A 48 -16.535 34.711 1.122 1.00 0.00 O ATOM 736 CB VAL A 48 -18.762 32.795 2.624 1.00 0.00 C ATOM 737 CG1 VAL A 48 -19.406 34.175 2.331 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.764 31.645 2.311 1.00 0.00 C ATOM 0 H VAL A 48 -17.175 30.915 3.124 1.00 0.00 H new ATOM 0 HA VAL A 48 -17.636 32.430 0.791 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.522 32.783 3.687 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.336 34.269 2.892 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -18.720 34.968 2.630 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -19.615 34.260 1.265 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.694 31.815 2.853 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.967 31.621 1.240 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.333 30.693 2.620 1.00 0.00 H new ATOM 748 N HIS A 49 -15.574 33.801 2.978 1.00 0.00 N ATOM 749 CA HIS A 49 -14.645 34.918 3.245 1.00 0.00 C ATOM 750 C HIS A 49 -13.585 35.070 2.128 1.00 0.00 C ATOM 751 O HIS A 49 -13.286 36.191 1.706 1.00 0.00 O ATOM 752 CB HIS A 49 -13.948 34.764 4.616 1.00 0.00 C ATOM 753 CG HIS A 49 -13.187 35.996 5.055 1.00 0.00 C ATOM 754 ND1 HIS A 49 -11.817 36.057 5.198 1.00 0.00 N ATOM 755 CD2 HIS A 49 -13.646 37.245 5.339 1.00 0.00 C ATOM 756 CE1 HIS A 49 -11.497 37.301 5.582 1.00 0.00 C ATOM 757 NE2 HIS A 49 -12.572 38.064 5.677 1.00 0.00 N ATOM 0 H HIS A 49 -15.477 33.023 3.631 1.00 0.00 H new ATOM 0 HA HIS A 49 -15.251 35.824 3.264 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -14.698 34.524 5.370 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -13.260 33.920 4.571 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -14.681 37.553 5.307 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -10.491 37.636 5.787 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -12.607 39.048 5.943 1.00 0.00 H new ATOM 765 N ILE A 50 -13.016 33.938 1.662 1.00 0.00 N ATOM 766 CA ILE A 50 -11.995 33.953 0.589 1.00 0.00 C ATOM 767 C ILE A 50 -12.627 34.342 -0.771 1.00 0.00 C ATOM 768 O ILE A 50 -11.953 34.923 -1.622 1.00 0.00 O ATOM 769 CB ILE A 50 -11.179 32.596 0.487 1.00 0.00 C ATOM 770 CG1 ILE A 50 -12.084 31.399 0.045 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.461 32.287 1.834 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.367 30.067 -0.125 1.00 0.00 C ATOM 0 H ILE A 50 -13.244 33.006 2.009 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.268 34.719 0.860 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.423 32.726 -0.287 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.877 31.274 0.782 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.564 31.657 -0.899 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -9.907 31.353 1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -9.772 33.097 2.073 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.202 32.195 2.628 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.083 29.305 -0.432 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.593 30.165 -0.886 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -10.911 29.776 0.821 1.00 0.00 H new ATOM 784 N ILE A 51 -13.922 34.020 -0.959 1.00 0.00 N ATOM 785 CA ILE A 51 -14.684 34.403 -2.174 1.00 0.00 C ATOM 786 C ILE A 51 -14.901 35.939 -2.221 1.00 0.00 C ATOM 787 O ILE A 51 -14.568 36.598 -3.220 1.00 0.00 O ATOM 788 CB ILE A 51 -16.081 33.662 -2.236 1.00 0.00 C ATOM 789 CG1 ILE A 51 -15.892 32.112 -2.162 1.00 0.00 C ATOM 790 CG2 ILE A 51 -16.876 34.049 -3.512 1.00 0.00 C ATOM 791 CD1 ILE A 51 -17.183 31.321 -1.985 1.00 0.00 C ATOM 0 H ILE A 51 -14.470 33.491 -0.281 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.096 34.099 -3.040 1.00 0.00 H new ATOM 0 HB ILE A 51 -16.660 33.985 -1.370 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -15.398 31.776 -3.074 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -15.223 31.880 -1.333 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.830 33.521 -3.521 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -17.056 35.124 -3.516 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -16.301 33.774 -4.396 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -16.954 30.256 -1.944 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -17.671 31.623 -1.058 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.848 31.517 -2.826 1.00 0.00 H new ATOM 803 N GLN A 52 -15.437 36.493 -1.107 1.00 0.00 N ATOM 804 CA GLN A 52 -15.773 37.933 -0.992 1.00 0.00 C ATOM 805 C GLN A 52 -14.505 38.812 -0.937 1.00 0.00 C ATOM 806 O GLN A 52 -14.575 40.007 -1.224 1.00 0.00 O ATOM 807 CB GLN A 52 -16.669 38.191 0.251 1.00 0.00 C ATOM 808 CG GLN A 52 -15.994 37.874 1.593 1.00 0.00 C ATOM 809 CD GLN A 52 -16.898 38.033 2.814 1.00 0.00 C ATOM 810 OE1 GLN A 52 -16.925 39.075 3.452 1.00 0.00 O ATOM 811 NE2 GLN A 52 -17.655 36.998 3.128 1.00 0.00 N ATOM 0 H GLN A 52 -15.648 35.957 -0.266 1.00 0.00 H new ATOM 0 HA GLN A 52 -16.329 38.211 -1.887 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -16.978 39.236 0.251 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -17.575 37.591 0.162 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -15.622 36.850 1.564 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -15.128 38.525 1.712 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -17.606 36.144 2.573 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -18.288 37.053 3.926 1.00 0.00 H new ATOM 820 N ALA A 53 -13.353 38.202 -0.566 1.00 0.00 N ATOM 821 CA ALA A 53 -12.035 38.875 -0.552 1.00 0.00 C ATOM 822 C ALA A 53 -11.646 39.371 -1.961 1.00 0.00 C ATOM 823 O ALA A 53 -11.004 40.415 -2.108 1.00 0.00 O ATOM 824 CB ALA A 53 -10.961 37.925 0.012 1.00 0.00 C ATOM 0 H ALA A 53 -13.314 37.227 -0.268 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.103 39.749 0.096 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.995 38.430 0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -11.227 37.639 1.030 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -10.900 37.033 -0.612 1.00 0.00 H new ATOM 830 N ARG A 54 -12.054 38.599 -2.988 1.00 0.00 N ATOM 831 CA ARG A 54 -11.876 38.974 -4.402 1.00 0.00 C ATOM 832 C ARG A 54 -13.044 39.874 -4.850 1.00 0.00 C ATOM 833 O ARG A 54 -12.825 40.997 -5.309 1.00 0.00 O ATOM 834 CB ARG A 54 -11.769 37.709 -5.324 1.00 0.00 C ATOM 835 CG ARG A 54 -10.415 36.944 -5.255 1.00 0.00 C ATOM 836 CD ARG A 54 -10.175 36.225 -3.915 1.00 0.00 C ATOM 837 NE ARG A 54 -8.838 35.608 -3.854 1.00 0.00 N ATOM 838 CZ ARG A 54 -8.475 34.581 -3.066 1.00 0.00 C ATOM 839 NH1 ARG A 54 -9.349 33.976 -2.270 1.00 0.00 N ATOM 840 NH2 ARG A 54 -7.220 34.158 -3.091 1.00 0.00 N ATOM 0 H ARG A 54 -12.516 37.699 -2.859 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.940 39.525 -4.496 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.570 37.019 -5.060 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.941 38.017 -6.355 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.381 36.211 -6.061 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -9.601 37.648 -5.430 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -10.284 36.937 -3.097 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -10.936 35.457 -3.774 1.00 0.00 H new ATOM 0 HE ARG A 54 -8.121 35.996 -4.467 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -10.320 34.289 -2.247 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -9.050 33.199 -1.681 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -6.541 34.611 -3.703 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -6.932 33.380 -2.498 1.00 0.00 H new ATOM 854 N GLU A 55 -14.283 39.378 -4.676 1.00 0.00 N ATOM 855 CA GLU A 55 -15.501 40.043 -5.186 1.00 0.00 C ATOM 856 C GLU A 55 -16.232 40.819 -4.067 1.00 0.00 C ATOM 857 O GLU A 55 -16.829 40.197 -3.181 1.00 0.00 O ATOM 858 CB GLU A 55 -16.451 38.996 -5.819 1.00 0.00 C ATOM 859 CG GLU A 55 -15.842 38.217 -7.000 1.00 0.00 C ATOM 860 CD GLU A 55 -15.406 39.114 -8.178 1.00 0.00 C ATOM 861 OE1 GLU A 55 -16.289 39.638 -8.893 1.00 0.00 O ATOM 862 OE2 GLU A 55 -14.183 39.301 -8.385 1.00 0.00 O ATOM 0 H GLU A 55 -14.470 38.507 -4.179 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.198 40.762 -5.947 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -16.755 38.286 -5.049 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -17.354 39.502 -6.160 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.979 37.654 -6.645 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -16.571 37.491 -7.359 1.00 0.00 H new ATOM 869 N PRO A 56 -16.200 42.204 -4.089 1.00 0.00 N ATOM 870 CA PRO A 56 -16.905 43.052 -3.089 1.00 0.00 C ATOM 871 C PRO A 56 -18.441 42.888 -3.121 1.00 0.00 C ATOM 872 O PRO A 56 -19.114 43.087 -2.102 1.00 0.00 O ATOM 873 CB PRO A 56 -16.485 44.509 -3.470 1.00 0.00 C ATOM 874 CG PRO A 56 -15.257 44.350 -4.316 1.00 0.00 C ATOM 875 CD PRO A 56 -15.458 43.052 -5.066 1.00 0.00 C ATOM 0 HA PRO A 56 -16.631 42.774 -2.071 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -17.278 45.018 -4.017 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -16.278 45.105 -2.581 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -15.141 45.188 -5.003 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.357 44.315 -3.702 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -16.028 43.201 -5.983 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -14.508 42.600 -5.351 1.00 0.00 H new ATOM 883 N SER A 57 -18.977 42.505 -4.299 1.00 0.00 N ATOM 884 CA SER A 57 -20.427 42.307 -4.511 1.00 0.00 C ATOM 885 C SER A 57 -20.948 41.077 -3.728 1.00 0.00 C ATOM 886 O SER A 57 -22.132 41.010 -3.371 1.00 0.00 O ATOM 887 CB SER A 57 -20.718 42.153 -6.024 1.00 0.00 C ATOM 888 OG SER A 57 -22.110 42.089 -6.295 1.00 0.00 O ATOM 0 H SER A 57 -18.416 42.324 -5.131 1.00 0.00 H new ATOM 0 HA SER A 57 -20.953 43.183 -4.133 1.00 0.00 H new ATOM 0 HB2 SER A 57 -20.282 42.993 -6.564 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.235 41.250 -6.396 1.00 0.00 H new ATOM 0 HG SER A 57 -22.251 41.994 -7.260 1.00 0.00 H new ATOM 894 N LEU A 58 -20.041 40.117 -3.454 1.00 0.00 N ATOM 895 CA LEU A 58 -20.368 38.862 -2.747 1.00 0.00 C ATOM 896 C LEU A 58 -20.099 38.972 -1.227 1.00 0.00 C ATOM 897 O LEU A 58 -20.091 37.953 -0.522 1.00 0.00 O ATOM 898 CB LEU A 58 -19.570 37.680 -3.381 1.00 0.00 C ATOM 899 CG LEU A 58 -19.913 37.352 -4.878 1.00 0.00 C ATOM 900 CD1 LEU A 58 -19.064 36.176 -5.424 1.00 0.00 C ATOM 901 CD2 LEU A 58 -21.427 37.070 -5.052 1.00 0.00 C ATOM 0 H LEU A 58 -19.058 40.191 -3.718 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.435 38.670 -2.862 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -18.506 37.906 -3.312 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -19.745 36.786 -2.783 1.00 0.00 H new ATOM 0 HG LEU A 58 -19.659 38.234 -5.467 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -19.334 35.983 -6.462 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -18.006 36.433 -5.366 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -19.254 35.283 -4.828 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.638 36.846 -6.098 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -21.712 36.219 -4.434 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -21.998 37.947 -4.747 1.00 0.00 H new ATOM 913 N ARG A 59 -19.911 40.215 -0.723 1.00 0.00 N ATOM 914 CA ARG A 59 -19.667 40.463 0.716 1.00 0.00 C ATOM 915 C ARG A 59 -20.997 40.662 1.471 1.00 0.00 C ATOM 916 O ARG A 59 -21.176 40.149 2.585 1.00 0.00 O ATOM 917 CB ARG A 59 -18.739 41.700 0.919 1.00 0.00 C ATOM 918 CG ARG A 59 -18.144 41.793 2.344 1.00 0.00 C ATOM 919 CD ARG A 59 -17.153 42.955 2.549 1.00 0.00 C ATOM 920 NE ARG A 59 -16.150 42.637 3.595 1.00 0.00 N ATOM 921 CZ ARG A 59 -15.776 43.424 4.614 1.00 0.00 C ATOM 922 NH1 ARG A 59 -16.375 44.578 4.848 1.00 0.00 N ATOM 923 NH2 ARG A 59 -14.796 43.025 5.413 1.00 0.00 N ATOM 0 H ARG A 59 -19.924 41.061 -1.293 1.00 0.00 H new ATOM 0 HA ARG A 59 -19.165 39.586 1.125 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -17.925 41.657 0.195 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -19.305 42.608 0.709 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -18.960 41.898 3.059 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -17.638 40.856 2.574 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -16.644 43.171 1.609 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -17.700 43.855 2.829 1.00 0.00 H new ATOM 0 HE ARG A 59 -15.698 41.725 3.532 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -17.139 44.887 4.247 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -16.073 45.160 5.629 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -14.337 42.129 5.249 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -14.501 43.614 6.192 1.00 0.00 H new ATOM 937 N ASP A 60 -21.920 41.410 0.847 1.00 0.00 N ATOM 938 CA ASP A 60 -23.234 41.756 1.437 1.00 0.00 C ATOM 939 C ASP A 60 -24.206 40.575 1.351 1.00 0.00 C ATOM 940 O ASP A 60 -25.113 40.452 2.187 1.00 0.00 O ATOM 941 CB ASP A 60 -23.843 42.989 0.715 1.00 0.00 C ATOM 942 CG ASP A 60 -22.901 44.198 0.698 1.00 0.00 C ATOM 943 OD1 ASP A 60 -23.071 45.123 1.521 1.00 0.00 O ATOM 944 OD2 ASP A 60 -21.953 44.202 -0.118 1.00 0.00 O ATOM 0 H ASP A 60 -21.780 41.797 -0.086 1.00 0.00 H new ATOM 0 HA ASP A 60 -23.074 41.997 2.488 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -24.093 42.716 -0.310 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -24.775 43.268 1.207 1.00 0.00 H new ATOM 949 N SER A 61 -24.011 39.728 0.319 1.00 0.00 N ATOM 950 CA SER A 61 -24.830 38.533 0.094 1.00 0.00 C ATOM 951 C SER A 61 -24.672 37.556 1.278 1.00 0.00 C ATOM 952 O SER A 61 -23.557 37.084 1.554 1.00 0.00 O ATOM 953 CB SER A 61 -24.433 37.878 -1.250 1.00 0.00 C ATOM 954 OG SER A 61 -23.032 37.662 -1.341 1.00 0.00 O ATOM 0 H SER A 61 -23.279 39.859 -0.379 1.00 0.00 H new ATOM 0 HA SER A 61 -25.883 38.810 0.034 1.00 0.00 H new ATOM 0 HB2 SER A 61 -24.955 36.927 -1.358 1.00 0.00 H new ATOM 0 HB3 SER A 61 -24.756 38.515 -2.074 1.00 0.00 H new ATOM 0 HG SER A 61 -22.686 37.387 -0.466 1.00 0.00 H new ATOM 960 N ASN A 62 -25.801 37.301 1.966 1.00 0.00 N ATOM 961 CA ASN A 62 -25.852 36.597 3.264 1.00 0.00 C ATOM 962 C ASN A 62 -25.338 35.142 3.122 1.00 0.00 C ATOM 963 O ASN A 62 -25.783 34.452 2.224 1.00 0.00 O ATOM 964 CB ASN A 62 -27.326 36.637 3.786 1.00 0.00 C ATOM 965 CG ASN A 62 -27.458 36.755 5.308 1.00 0.00 C ATOM 966 OD1 ASN A 62 -26.635 37.377 5.974 1.00 0.00 O ATOM 967 ND2 ASN A 62 -28.493 36.157 5.871 1.00 0.00 N ATOM 0 H ASN A 62 -26.722 37.584 1.630 1.00 0.00 H new ATOM 0 HA ASN A 62 -25.200 37.091 3.984 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -27.839 37.480 3.323 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -27.839 35.733 3.459 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -28.623 36.206 6.882 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -29.162 35.647 5.295 1.00 0.00 H new ATOM 974 N PRO A 63 -24.412 34.658 4.016 1.00 0.00 N ATOM 975 CA PRO A 63 -23.616 33.414 3.787 1.00 0.00 C ATOM 976 C PRO A 63 -24.428 32.091 3.602 1.00 0.00 C ATOM 977 O PRO A 63 -23.849 31.098 3.136 1.00 0.00 O ATOM 978 CB PRO A 63 -22.686 33.346 5.034 1.00 0.00 C ATOM 979 CG PRO A 63 -23.399 34.158 6.073 1.00 0.00 C ATOM 980 CD PRO A 63 -24.053 35.288 5.319 1.00 0.00 C ATOM 0 HA PRO A 63 -23.096 33.480 2.831 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -22.539 32.318 5.365 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -21.699 33.755 4.817 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -24.140 33.557 6.601 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -22.703 34.536 6.822 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -24.932 35.666 5.841 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -23.375 36.131 5.187 1.00 0.00 H new ATOM 988 N GLU A 64 -25.727 32.036 3.981 1.00 0.00 N ATOM 989 CA GLU A 64 -26.569 30.833 3.691 1.00 0.00 C ATOM 990 C GLU A 64 -27.287 30.996 2.335 1.00 0.00 C ATOM 991 O GLU A 64 -27.554 30.023 1.629 1.00 0.00 O ATOM 992 CB GLU A 64 -27.579 30.504 4.839 1.00 0.00 C ATOM 993 CG GLU A 64 -28.854 31.373 4.935 1.00 0.00 C ATOM 994 CD GLU A 64 -28.582 32.821 5.347 1.00 0.00 C ATOM 995 OE1 GLU A 64 -28.364 33.664 4.467 1.00 0.00 O ATOM 996 OE2 GLU A 64 -28.563 33.116 6.564 1.00 0.00 O ATOM 0 H GLU A 64 -26.212 32.785 4.476 1.00 0.00 H new ATOM 0 HA GLU A 64 -25.897 29.977 3.631 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -27.887 29.464 4.729 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -27.047 30.580 5.788 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -29.360 31.368 3.969 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -29.537 30.922 5.655 1.00 0.00 H new ATOM 1003 N GLU A 65 -27.594 32.254 2.002 1.00 0.00 N ATOM 1004 CA GLU A 65 -28.350 32.642 0.794 1.00 0.00 C ATOM 1005 C GLU A 65 -27.398 33.050 -0.365 1.00 0.00 C ATOM 1006 O GLU A 65 -27.850 33.280 -1.500 1.00 0.00 O ATOM 1007 CB GLU A 65 -29.290 33.818 1.185 1.00 0.00 C ATOM 1008 CG GLU A 65 -30.285 34.280 0.098 1.00 0.00 C ATOM 1009 CD GLU A 65 -31.111 35.496 0.532 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -32.323 35.353 0.804 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -30.532 36.594 0.660 1.00 0.00 O ATOM 0 H GLU A 65 -27.320 33.053 2.574 1.00 0.00 H new ATOM 0 HA GLU A 65 -28.933 31.795 0.431 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -29.858 33.525 2.068 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -28.673 34.670 1.471 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -29.736 34.524 -0.811 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -30.957 33.458 -0.147 1.00 0.00 H new ATOM 1018 N ILE A 66 -26.080 33.131 -0.076 1.00 0.00 N ATOM 1019 CA ILE A 66 -25.070 33.595 -1.044 1.00 0.00 C ATOM 1020 C ILE A 66 -24.974 32.636 -2.235 1.00 0.00 C ATOM 1021 O ILE A 66 -24.940 31.412 -2.065 1.00 0.00 O ATOM 1022 CB ILE A 66 -23.640 33.786 -0.378 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -22.620 34.402 -1.399 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -23.086 32.457 0.200 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -21.244 34.737 -0.839 1.00 0.00 C ATOM 0 H ILE A 66 -25.691 32.877 0.832 1.00 0.00 H new ATOM 0 HA ILE A 66 -25.400 34.571 -1.399 1.00 0.00 H new ATOM 0 HB ILE A 66 -23.768 34.481 0.452 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -22.495 33.703 -2.226 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -23.054 35.312 -1.814 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -22.107 32.634 0.645 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -23.768 32.079 0.962 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -22.993 31.723 -0.600 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -20.621 35.156 -1.630 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -21.346 35.465 -0.034 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -20.778 33.831 -0.452 1.00 0.00 H new ATOM 1037 N GLU A 67 -24.991 33.201 -3.445 1.00 0.00 N ATOM 1038 CA GLU A 67 -24.759 32.449 -4.676 1.00 0.00 C ATOM 1039 C GLU A 67 -23.329 32.713 -5.133 1.00 0.00 C ATOM 1040 O GLU A 67 -22.991 33.842 -5.521 1.00 0.00 O ATOM 1041 CB GLU A 67 -25.795 32.838 -5.755 1.00 0.00 C ATOM 1042 CG GLU A 67 -27.244 32.535 -5.326 1.00 0.00 C ATOM 1043 CD GLU A 67 -28.285 32.867 -6.402 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -28.675 31.959 -7.169 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -28.709 34.037 -6.502 1.00 0.00 O ATOM 0 H GLU A 67 -25.166 34.194 -3.596 1.00 0.00 H new ATOM 0 HA GLU A 67 -24.883 31.381 -4.499 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -25.701 33.901 -5.976 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -25.573 32.300 -6.676 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -27.324 31.479 -5.068 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -27.473 33.102 -4.424 1.00 0.00 H new ATOM 1052 N ILE A 68 -22.490 31.668 -5.026 1.00 0.00 N ATOM 1053 CA ILE A 68 -21.075 31.708 -5.427 1.00 0.00 C ATOM 1054 C ILE A 68 -21.021 31.900 -6.956 1.00 0.00 C ATOM 1055 O ILE A 68 -21.187 30.940 -7.716 1.00 0.00 O ATOM 1056 CB ILE A 68 -20.321 30.383 -5.002 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -20.518 30.083 -3.472 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -18.813 30.461 -5.360 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -19.928 28.759 -2.998 1.00 0.00 C ATOM 0 H ILE A 68 -22.779 30.763 -4.655 1.00 0.00 H new ATOM 0 HA ILE A 68 -20.572 32.534 -4.924 1.00 0.00 H new ATOM 0 HB ILE A 68 -20.759 29.558 -5.564 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -20.068 30.892 -2.897 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -21.585 30.089 -3.249 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -18.319 29.538 -5.057 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -18.701 30.597 -6.436 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -18.358 31.304 -4.839 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -20.113 28.640 -1.930 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.395 27.937 -3.541 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -18.854 28.752 -3.183 1.00 0.00 H new ATOM 1071 N ASP A 69 -20.857 33.163 -7.378 1.00 0.00 N ATOM 1072 CA ASP A 69 -21.061 33.576 -8.773 1.00 0.00 C ATOM 1073 C ASP A 69 -19.887 33.098 -9.659 1.00 0.00 C ATOM 1074 O ASP A 69 -18.934 33.840 -9.885 1.00 0.00 O ATOM 1075 CB ASP A 69 -21.253 35.124 -8.844 1.00 0.00 C ATOM 1076 CG ASP A 69 -21.866 35.603 -10.181 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -22.942 36.235 -10.170 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -21.287 35.335 -11.248 1.00 0.00 O ATOM 0 H ASP A 69 -20.579 33.926 -6.761 1.00 0.00 H new ATOM 0 HA ASP A 69 -21.966 33.108 -9.160 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -21.896 35.442 -8.023 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -20.288 35.610 -8.700 1.00 0.00 H new ATOM 1083 N PHE A 70 -19.989 31.847 -10.157 1.00 0.00 N ATOM 1084 CA PHE A 70 -18.926 31.188 -10.959 1.00 0.00 C ATOM 1085 C PHE A 70 -18.683 31.891 -12.315 1.00 0.00 C ATOM 1086 O PHE A 70 -17.639 31.687 -12.941 1.00 0.00 O ATOM 1087 CB PHE A 70 -19.275 29.687 -11.191 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.402 28.853 -9.904 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -18.304 28.671 -9.061 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -20.611 28.246 -9.548 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -18.410 27.908 -7.910 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -20.716 27.486 -8.395 1.00 0.00 C ATOM 1093 CZ PHE A 70 -19.617 27.319 -7.575 1.00 0.00 C ATOM 0 H PHE A 70 -20.812 31.261 -10.016 1.00 0.00 H new ATOM 0 HA PHE A 70 -18.002 31.265 -10.385 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -20.214 29.627 -11.742 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -18.506 29.242 -11.822 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -17.359 29.131 -9.310 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.476 28.372 -10.182 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -17.549 27.772 -7.272 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -21.657 27.024 -8.137 1.00 0.00 H new ATOM 0 HZ PHE A 70 -19.699 26.730 -6.674 1.00 0.00 H new ATOM 1103 N GLU A 71 -19.658 32.709 -12.764 1.00 0.00 N ATOM 1104 CA GLU A 71 -19.559 33.458 -14.029 1.00 0.00 C ATOM 1105 C GLU A 71 -18.526 34.594 -13.878 1.00 0.00 C ATOM 1106 O GLU A 71 -17.621 34.725 -14.707 1.00 0.00 O ATOM 1107 CB GLU A 71 -20.973 33.978 -14.437 1.00 0.00 C ATOM 1108 CG GLU A 71 -21.137 34.513 -15.890 1.00 0.00 C ATOM 1109 CD GLU A 71 -20.526 35.911 -16.148 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -19.499 36.014 -16.851 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -21.070 36.905 -15.634 1.00 0.00 O ATOM 0 H GLU A 71 -20.531 32.867 -12.261 1.00 0.00 H new ATOM 0 HA GLU A 71 -19.208 32.810 -14.832 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -21.687 33.167 -14.292 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.252 34.776 -13.749 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -20.679 33.801 -16.577 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -22.200 34.548 -16.130 1.00 0.00 H new ATOM 1118 N THR A 72 -18.660 35.392 -12.806 1.00 0.00 N ATOM 1119 CA THR A 72 -17.742 36.508 -12.507 1.00 0.00 C ATOM 1120 C THR A 72 -16.397 35.969 -11.995 1.00 0.00 C ATOM 1121 O THR A 72 -15.340 36.528 -12.304 1.00 0.00 O ATOM 1122 CB THR A 72 -18.353 37.493 -11.454 1.00 0.00 C ATOM 1123 OG1 THR A 72 -18.643 36.789 -10.235 1.00 0.00 O ATOM 1124 CG2 THR A 72 -19.642 38.160 -11.970 1.00 0.00 C ATOM 0 H THR A 72 -19.408 35.283 -12.121 1.00 0.00 H new ATOM 0 HA THR A 72 -17.584 37.060 -13.434 1.00 0.00 H new ATOM 0 HB THR A 72 -17.615 38.274 -11.273 1.00 0.00 H new ATOM 0 HG1 THR A 72 -18.651 35.824 -10.408 1.00 0.00 H new ATOM 0 HG21 THR A 72 -20.032 38.835 -11.208 1.00 0.00 H new ATOM 0 HG22 THR A 72 -19.422 38.724 -12.876 1.00 0.00 H new ATOM 0 HG23 THR A 72 -20.385 37.394 -12.191 1.00 0.00 H new ATOM 1132 N LEU A 73 -16.453 34.861 -11.225 1.00 0.00 N ATOM 1133 CA LEU A 73 -15.256 34.188 -10.715 1.00 0.00 C ATOM 1134 C LEU A 73 -14.487 33.537 -11.876 1.00 0.00 C ATOM 1135 O LEU A 73 -14.919 32.530 -12.445 1.00 0.00 O ATOM 1136 CB LEU A 73 -15.610 33.139 -9.624 1.00 0.00 C ATOM 1137 CG LEU A 73 -16.244 33.696 -8.308 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -16.535 32.556 -7.305 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -15.370 34.803 -7.676 1.00 0.00 C ATOM 0 H LEU A 73 -17.327 34.416 -10.945 1.00 0.00 H new ATOM 0 HA LEU A 73 -14.618 34.936 -10.245 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.300 32.415 -10.057 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.701 32.597 -9.363 1.00 0.00 H new ATOM 0 HG LEU A 73 -17.197 34.155 -8.571 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -16.975 32.972 -6.399 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.230 31.846 -7.753 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -15.605 32.045 -7.055 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.844 35.165 -6.764 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.386 34.398 -7.438 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.262 35.628 -8.380 1.00 0.00 H new ATOM 1151 N LYS A 74 -13.394 34.200 -12.271 1.00 0.00 N ATOM 1152 CA LYS A 74 -12.384 33.659 -13.199 1.00 0.00 C ATOM 1153 C LYS A 74 -11.873 32.259 -12.729 1.00 0.00 C ATOM 1154 O LYS A 74 -11.750 32.043 -11.516 1.00 0.00 O ATOM 1155 CB LYS A 74 -11.207 34.671 -13.392 1.00 0.00 C ATOM 1156 CG LYS A 74 -10.363 35.050 -12.136 1.00 0.00 C ATOM 1157 CD LYS A 74 -11.140 35.875 -11.076 1.00 0.00 C ATOM 1158 CE LYS A 74 -10.240 36.511 -10.000 1.00 0.00 C ATOM 1159 NZ LYS A 74 -9.437 37.631 -10.549 1.00 0.00 N ATOM 0 H LYS A 74 -13.179 35.144 -11.951 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.859 33.517 -14.170 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -10.529 34.259 -14.139 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.620 35.590 -13.808 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -9.994 34.136 -11.670 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.491 35.620 -12.456 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -11.699 36.663 -11.581 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.870 35.228 -10.590 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.857 36.874 -9.178 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.574 35.753 -9.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -8.921 38.099 -9.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -8.758 37.263 -11.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -10.068 38.317 -11.010 1.00 0.00 H new ATOM 1173 N PRO A 75 -11.598 31.297 -13.691 1.00 0.00 N ATOM 1174 CA PRO A 75 -11.239 29.864 -13.402 1.00 0.00 C ATOM 1175 C PRO A 75 -10.207 29.626 -12.267 1.00 0.00 C ATOM 1176 O PRO A 75 -10.259 28.588 -11.603 1.00 0.00 O ATOM 1177 CB PRO A 75 -10.667 29.380 -14.752 1.00 0.00 C ATOM 1178 CG PRO A 75 -11.417 30.165 -15.784 1.00 0.00 C ATOM 1179 CD PRO A 75 -11.652 31.531 -15.172 1.00 0.00 C ATOM 0 HA PRO A 75 -12.115 29.330 -13.033 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.595 29.563 -14.817 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.816 28.308 -14.884 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -10.844 30.244 -16.708 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -12.361 29.681 -16.034 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.890 32.244 -15.489 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -12.616 31.940 -15.474 1.00 0.00 H new ATOM 1187 N SER A 76 -9.272 30.582 -12.079 1.00 0.00 N ATOM 1188 CA SER A 76 -8.265 30.533 -10.995 1.00 0.00 C ATOM 1189 C SER A 76 -8.933 30.439 -9.611 1.00 0.00 C ATOM 1190 O SER A 76 -8.541 29.609 -8.781 1.00 0.00 O ATOM 1191 CB SER A 76 -7.350 31.777 -11.054 1.00 0.00 C ATOM 1192 OG SER A 76 -6.604 31.813 -12.260 1.00 0.00 O ATOM 0 H SER A 76 -9.193 31.408 -12.672 1.00 0.00 H new ATOM 0 HA SER A 76 -7.663 29.637 -11.143 1.00 0.00 H new ATOM 0 HB2 SER A 76 -7.955 32.680 -10.971 1.00 0.00 H new ATOM 0 HB3 SER A 76 -6.669 31.771 -10.203 1.00 0.00 H new ATOM 0 HG SER A 76 -6.036 32.612 -12.270 1.00 0.00 H new ATOM 1198 N THR A 77 -9.965 31.281 -9.399 1.00 0.00 N ATOM 1199 CA THR A 77 -10.711 31.343 -8.131 1.00 0.00 C ATOM 1200 C THR A 77 -11.406 30.006 -7.836 1.00 0.00 C ATOM 1201 O THR A 77 -11.396 29.554 -6.693 1.00 0.00 O ATOM 1202 CB THR A 77 -11.778 32.488 -8.137 1.00 0.00 C ATOM 1203 OG1 THR A 77 -11.180 33.684 -8.636 1.00 0.00 O ATOM 1204 CG2 THR A 77 -12.358 32.755 -6.726 1.00 0.00 C ATOM 0 H THR A 77 -10.303 31.936 -10.104 1.00 0.00 H new ATOM 0 HA THR A 77 -9.981 31.554 -7.349 1.00 0.00 H new ATOM 0 HB THR A 77 -12.601 32.172 -8.778 1.00 0.00 H new ATOM 0 HG1 THR A 77 -11.790 34.438 -8.496 1.00 0.00 H new ATOM 0 HG21 THR A 77 -13.094 33.557 -6.781 1.00 0.00 H new ATOM 0 HG22 THR A 77 -12.836 31.850 -6.352 1.00 0.00 H new ATOM 0 HG23 THR A 77 -11.553 33.046 -6.051 1.00 0.00 H new ATOM 1212 N LEU A 78 -11.989 29.393 -8.897 1.00 0.00 N ATOM 1213 CA LEU A 78 -12.648 28.072 -8.807 1.00 0.00 C ATOM 1214 C LEU A 78 -11.648 27.011 -8.347 1.00 0.00 C ATOM 1215 O LEU A 78 -11.903 26.334 -7.369 1.00 0.00 O ATOM 1216 CB LEU A 78 -13.300 27.628 -10.159 1.00 0.00 C ATOM 1217 CG LEU A 78 -14.685 28.258 -10.518 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -14.574 29.769 -10.796 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -15.341 27.509 -11.706 1.00 0.00 C ATOM 0 H LEU A 78 -12.014 29.800 -9.832 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.450 28.171 -8.075 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.603 27.860 -10.964 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.415 26.544 -10.140 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.333 28.143 -9.649 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -15.559 30.167 -11.041 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.189 30.275 -9.911 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.896 29.936 -11.633 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.303 27.966 -11.937 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -14.691 27.571 -12.579 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -15.491 26.463 -11.439 1.00 0.00 H new ATOM 1231 N ARG A 79 -10.503 26.925 -9.054 1.00 0.00 N ATOM 1232 CA ARG A 79 -9.449 25.910 -8.810 1.00 0.00 C ATOM 1233 C ARG A 79 -8.983 25.912 -7.342 1.00 0.00 C ATOM 1234 O ARG A 79 -8.823 24.851 -6.723 1.00 0.00 O ATOM 1235 CB ARG A 79 -8.239 26.167 -9.755 1.00 0.00 C ATOM 1236 CG ARG A 79 -7.086 25.138 -9.618 1.00 0.00 C ATOM 1237 CD ARG A 79 -5.863 25.474 -10.497 1.00 0.00 C ATOM 1238 NE ARG A 79 -5.288 26.803 -10.179 1.00 0.00 N ATOM 1239 CZ ARG A 79 -4.383 27.054 -9.211 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -3.910 26.075 -8.442 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -3.919 28.289 -9.050 1.00 0.00 N ATOM 0 H ARG A 79 -10.279 27.562 -9.818 1.00 0.00 H new ATOM 0 HA ARG A 79 -9.875 24.929 -9.019 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -8.592 26.163 -10.786 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.845 27.164 -9.557 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -6.773 25.089 -8.575 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -7.457 24.149 -9.886 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -5.099 24.708 -10.361 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -6.155 25.449 -11.547 1.00 0.00 H new ATOM 0 HE ARG A 79 -5.604 27.594 -10.740 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -4.232 25.117 -8.580 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -3.226 26.283 -7.715 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -4.247 29.040 -9.657 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -3.234 28.485 -8.320 1.00 0.00 H new ATOM 1255 N GLU A 80 -8.778 27.125 -6.811 1.00 0.00 N ATOM 1256 CA GLU A 80 -8.361 27.347 -5.418 1.00 0.00 C ATOM 1257 C GLU A 80 -9.490 26.974 -4.432 1.00 0.00 C ATOM 1258 O GLU A 80 -9.241 26.309 -3.427 1.00 0.00 O ATOM 1259 CB GLU A 80 -7.955 28.834 -5.227 1.00 0.00 C ATOM 1260 CG GLU A 80 -6.751 29.289 -6.091 1.00 0.00 C ATOM 1261 CD GLU A 80 -6.462 30.793 -5.967 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -6.785 31.561 -6.902 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -5.940 31.222 -4.915 1.00 0.00 O ATOM 0 H GLU A 80 -8.898 27.988 -7.341 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.506 26.705 -5.207 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.813 29.464 -5.461 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.715 29.000 -4.177 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.865 28.728 -5.795 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.947 29.047 -7.135 1.00 0.00 H new ATOM 1270 N LEU A 81 -10.724 27.391 -4.773 1.00 0.00 N ATOM 1271 CA LEU A 81 -11.917 27.266 -3.905 1.00 0.00 C ATOM 1272 C LEU A 81 -12.328 25.791 -3.702 1.00 0.00 C ATOM 1273 O LEU A 81 -12.595 25.348 -2.575 1.00 0.00 O ATOM 1274 CB LEU A 81 -13.100 28.051 -4.537 1.00 0.00 C ATOM 1275 CG LEU A 81 -14.439 28.055 -3.735 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -14.256 28.740 -2.362 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -15.579 28.714 -4.549 1.00 0.00 C ATOM 0 H LEU A 81 -10.926 27.831 -5.671 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.666 27.680 -2.929 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -12.785 29.085 -4.681 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.296 27.636 -5.526 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.726 27.019 -3.554 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -15.203 28.731 -1.822 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.503 28.203 -1.785 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -13.933 29.770 -2.510 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -16.498 28.701 -3.964 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -15.311 29.745 -4.782 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -15.731 28.161 -5.476 1.00 0.00 H new ATOM 1289 N GLU A 82 -12.381 25.048 -4.816 1.00 0.00 N ATOM 1290 CA GLU A 82 -12.823 23.650 -4.834 1.00 0.00 C ATOM 1291 C GLU A 82 -11.766 22.738 -4.202 1.00 0.00 C ATOM 1292 O GLU A 82 -12.114 21.783 -3.516 1.00 0.00 O ATOM 1293 CB GLU A 82 -13.186 23.212 -6.279 1.00 0.00 C ATOM 1294 CG GLU A 82 -12.032 23.248 -7.293 1.00 0.00 C ATOM 1295 CD GLU A 82 -12.510 23.081 -8.741 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -12.444 21.960 -9.280 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -13.019 24.060 -9.326 1.00 0.00 O ATOM 0 H GLU A 82 -12.116 25.404 -5.735 1.00 0.00 H new ATOM 0 HA GLU A 82 -13.726 23.559 -4.231 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -13.583 22.197 -6.243 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.987 23.855 -6.644 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.499 24.194 -7.198 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -11.321 22.457 -7.056 1.00 0.00 H new ATOM 1304 N ARG A 83 -10.474 23.070 -4.417 1.00 0.00 N ATOM 1305 CA ARG A 83 -9.335 22.347 -3.798 1.00 0.00 C ATOM 1306 C ARG A 83 -9.180 22.702 -2.304 1.00 0.00 C ATOM 1307 O ARG A 83 -8.605 21.914 -1.536 1.00 0.00 O ATOM 1308 CB ARG A 83 -8.006 22.574 -4.593 1.00 0.00 C ATOM 1309 CG ARG A 83 -7.696 21.496 -5.672 1.00 0.00 C ATOM 1310 CD ARG A 83 -8.802 21.346 -6.731 1.00 0.00 C ATOM 1311 NE ARG A 83 -8.501 20.266 -7.691 1.00 0.00 N ATOM 1312 CZ ARG A 83 -9.389 19.664 -8.509 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -10.673 19.984 -8.489 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -8.978 18.725 -9.352 1.00 0.00 N ATOM 0 H ARG A 83 -10.190 23.842 -5.020 1.00 0.00 H new ATOM 0 HA ARG A 83 -9.560 21.282 -3.851 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -8.051 23.549 -5.077 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -7.178 22.608 -3.885 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -6.761 21.751 -6.170 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -7.543 20.535 -5.180 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -9.752 21.139 -6.238 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -8.920 22.287 -7.268 1.00 0.00 H new ATOM 0 HE ARG A 83 -7.534 19.946 -7.740 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -11.010 20.700 -7.845 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -11.325 19.515 -9.117 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -7.993 18.460 -9.380 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -9.647 18.268 -9.972 1.00 0.00 H new ATOM 1328 N TYR A 84 -9.708 23.877 -1.908 1.00 0.00 N ATOM 1329 CA TYR A 84 -9.701 24.341 -0.510 1.00 0.00 C ATOM 1330 C TYR A 84 -10.569 23.418 0.377 1.00 0.00 C ATOM 1331 O TYR A 84 -10.208 23.130 1.517 1.00 0.00 O ATOM 1332 CB TYR A 84 -10.204 25.809 -0.429 1.00 0.00 C ATOM 1333 CG TYR A 84 -10.110 26.443 0.969 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -11.231 26.562 1.799 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -8.885 26.901 1.460 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -11.127 27.110 3.061 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -8.783 27.453 2.717 1.00 0.00 C ATOM 1338 CZ TYR A 84 -9.902 27.554 3.512 1.00 0.00 C ATOM 1339 OH TYR A 84 -9.792 28.087 4.764 1.00 0.00 O ATOM 0 H TYR A 84 -10.152 24.531 -2.552 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.677 24.303 -0.138 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.628 26.415 -1.128 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -11.242 25.842 -0.759 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -12.192 26.219 1.446 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.002 26.821 0.843 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -12.000 27.191 3.692 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -7.828 27.806 3.078 1.00 0.00 H new ATOM 0 HH TYR A 84 -9.049 27.658 5.238 1.00 0.00 H new ATOM 1349 N VAL A 85 -11.720 22.976 -0.158 1.00 0.00 N ATOM 1350 CA VAL A 85 -12.635 22.051 0.550 1.00 0.00 C ATOM 1351 C VAL A 85 -12.313 20.579 0.202 1.00 0.00 C ATOM 1352 O VAL A 85 -12.665 19.672 0.956 1.00 0.00 O ATOM 1353 CB VAL A 85 -14.147 22.381 0.238 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -14.477 23.852 0.607 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -14.516 22.073 -1.237 1.00 0.00 C ATOM 0 H VAL A 85 -12.045 23.245 -1.087 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.478 22.192 1.620 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.760 21.729 0.860 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -15.524 24.057 0.384 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -14.295 24.010 1.670 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -13.844 24.523 0.027 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.565 22.315 -1.408 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -13.893 22.672 -1.901 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.350 21.015 -1.440 1.00 0.00 H new ATOM 1365 N LEU A 86 -11.632 20.365 -0.949 1.00 0.00 N ATOM 1366 CA LEU A 86 -11.168 19.028 -1.403 1.00 0.00 C ATOM 1367 C LEU A 86 -10.045 18.505 -0.490 1.00 0.00 C ATOM 1368 O LEU A 86 -9.857 17.294 -0.377 1.00 0.00 O ATOM 1369 CB LEU A 86 -10.723 19.123 -2.897 1.00 0.00 C ATOM 1370 CG LEU A 86 -10.251 17.818 -3.656 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -10.579 17.897 -5.170 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -8.732 17.556 -3.475 1.00 0.00 C ATOM 0 H LEU A 86 -11.387 21.117 -1.593 1.00 0.00 H new ATOM 0 HA LEU A 86 -11.983 18.308 -1.336 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.556 19.544 -3.459 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.907 19.844 -2.949 1.00 0.00 H new ATOM 0 HG LEU A 86 -10.801 16.989 -3.211 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -10.242 16.985 -5.663 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -11.655 18.006 -5.304 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -10.070 18.756 -5.608 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -8.452 16.650 -4.013 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -8.168 18.401 -3.869 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -8.508 17.432 -2.415 1.00 0.00 H new ATOM 1384 N SER A 87 -9.311 19.429 0.165 1.00 0.00 N ATOM 1385 CA SER A 87 -8.275 19.072 1.157 1.00 0.00 C ATOM 1386 C SER A 87 -8.907 18.416 2.404 1.00 0.00 C ATOM 1387 O SER A 87 -8.263 17.622 3.095 1.00 0.00 O ATOM 1388 CB SER A 87 -7.447 20.315 1.547 1.00 0.00 C ATOM 1389 OG SER A 87 -8.250 21.303 2.165 1.00 0.00 O ATOM 0 H SER A 87 -9.418 20.433 0.023 1.00 0.00 H new ATOM 0 HA SER A 87 -7.604 18.344 0.702 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.645 20.021 2.224 1.00 0.00 H new ATOM 0 HB3 SER A 87 -6.976 20.733 0.657 1.00 0.00 H new ATOM 0 HG SER A 87 -8.831 21.719 1.494 1.00 0.00 H new ATOM 1395 N CYS A 88 -10.177 18.775 2.667 1.00 0.00 N ATOM 1396 CA CYS A 88 -10.991 18.175 3.732 1.00 0.00 C ATOM 1397 C CYS A 88 -11.541 16.806 3.278 1.00 0.00 C ATOM 1398 O CYS A 88 -11.441 15.820 4.010 1.00 0.00 O ATOM 1399 CB CYS A 88 -12.151 19.130 4.103 1.00 0.00 C ATOM 1400 SG CYS A 88 -13.318 18.481 5.326 1.00 0.00 S ATOM 0 H CYS A 88 -10.668 19.497 2.140 1.00 0.00 H new ATOM 0 HA CYS A 88 -10.368 18.018 4.613 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -11.728 20.059 4.484 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -12.701 19.379 3.195 1.00 0.00 H new ATOM 0 HG CYS A 88 -13.653 19.428 6.152 1.00 0.00 H new ATOM 1406 N LEU A 89 -12.101 16.769 2.048 1.00 0.00 N ATOM 1407 CA LEU A 89 -12.775 15.576 1.481 1.00 0.00 C ATOM 1408 C LEU A 89 -11.790 14.414 1.253 1.00 0.00 C ATOM 1409 O LEU A 89 -11.940 13.330 1.829 1.00 0.00 O ATOM 1410 CB LEU A 89 -13.471 15.946 0.143 1.00 0.00 C ATOM 1411 CG LEU A 89 -14.569 17.049 0.233 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -15.097 17.423 -1.176 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -15.719 16.614 1.188 1.00 0.00 C ATOM 0 H LEU A 89 -12.099 17.570 1.416 1.00 0.00 H new ATOM 0 HA LEU A 89 -13.520 15.244 2.204 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -12.708 16.275 -0.563 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -13.921 15.044 -0.272 1.00 0.00 H new ATOM 0 HG LEU A 89 -14.118 17.946 0.658 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -15.862 18.194 -1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -14.274 17.798 -1.785 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -15.527 16.540 -1.650 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -16.472 17.401 1.233 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -16.175 15.697 0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -15.317 16.439 2.186 1.00 0.00 H new ATOM 1425 N ARG A 90 -10.796 14.663 0.391 1.00 0.00 N ATOM 1426 CA ARG A 90 -9.782 13.674 0.007 1.00 0.00 C ATOM 1427 C ARG A 90 -8.695 13.591 1.086 1.00 0.00 C ATOM 1428 O ARG A 90 -8.184 14.624 1.536 1.00 0.00 O ATOM 1429 CB ARG A 90 -9.163 14.041 -1.373 1.00 0.00 C ATOM 1430 CG ARG A 90 -10.192 14.181 -2.524 1.00 0.00 C ATOM 1431 CD ARG A 90 -10.999 12.896 -2.786 1.00 0.00 C ATOM 1432 NE ARG A 90 -12.040 13.109 -3.813 1.00 0.00 N ATOM 1433 CZ ARG A 90 -12.872 12.170 -4.290 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -12.782 10.908 -3.898 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -13.785 12.502 -5.187 1.00 0.00 N ATOM 0 H ARG A 90 -10.672 15.567 -0.064 1.00 0.00 H new ATOM 0 HA ARG A 90 -10.257 12.697 -0.083 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.618 14.980 -1.274 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.435 13.277 -1.645 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.881 14.992 -2.288 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.668 14.464 -3.437 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -10.326 12.102 -3.109 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -11.464 12.562 -1.859 1.00 0.00 H new ATOM 0 HE ARG A 90 -12.134 14.051 -4.192 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -12.070 10.634 -3.221 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -13.425 10.210 -4.273 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -13.854 13.466 -5.512 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -14.421 11.794 -5.554 1.00 0.00 H new ATOM 1724 N THR A 106 7.436 38.733 -15.460 1.00 0.00 N ATOM 1725 CA THR A 106 6.834 40.074 -15.373 1.00 0.00 C ATOM 1726 C THR A 106 7.849 41.172 -15.787 1.00 0.00 C ATOM 1727 O THR A 106 9.057 41.044 -15.521 1.00 0.00 O ATOM 1728 CB THR A 106 6.301 40.327 -13.916 1.00 0.00 C ATOM 1729 OG1 THR A 106 5.379 39.287 -13.550 1.00 0.00 O ATOM 1730 CG2 THR A 106 5.610 41.698 -13.736 1.00 0.00 C ATOM 0 HA THR A 106 5.996 40.123 -16.069 1.00 0.00 H new ATOM 0 HB THR A 106 7.177 40.324 -13.267 1.00 0.00 H new ATOM 0 HG1 THR A 106 5.566 38.483 -14.078 1.00 0.00 H new ATOM 0 HG21 THR A 106 5.269 41.801 -12.706 1.00 0.00 H new ATOM 0 HG22 THR A 106 6.317 42.495 -13.965 1.00 0.00 H new ATOM 0 HG23 THR A 106 4.756 41.766 -14.410 1.00 0.00 H new ATOM 1738 N LYS A 107 7.318 42.248 -16.404 1.00 0.00 N ATOM 1739 CA LYS A 107 8.104 43.374 -16.949 1.00 0.00 C ATOM 1740 C LYS A 107 8.952 44.035 -15.852 1.00 0.00 C ATOM 1741 O LYS A 107 10.182 44.151 -15.968 1.00 0.00 O ATOM 1742 CB LYS A 107 7.136 44.427 -17.574 1.00 0.00 C ATOM 1743 CG LYS A 107 6.274 43.917 -18.756 1.00 0.00 C ATOM 1744 CD LYS A 107 7.087 43.690 -20.051 1.00 0.00 C ATOM 1745 CE LYS A 107 7.683 44.993 -20.620 1.00 0.00 C ATOM 1746 NZ LYS A 107 8.477 44.749 -21.852 1.00 0.00 N ATOM 0 H LYS A 107 6.313 42.360 -16.540 1.00 0.00 H new ATOM 0 HA LYS A 107 8.777 42.989 -17.715 1.00 0.00 H new ATOM 0 HB2 LYS A 107 6.470 44.793 -16.792 1.00 0.00 H new ATOM 0 HB3 LYS A 107 7.724 45.278 -17.916 1.00 0.00 H new ATOM 0 HG2 LYS A 107 5.792 42.982 -18.469 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.480 44.637 -18.955 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.894 42.985 -19.849 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.444 43.232 -20.802 1.00 0.00 H new ATOM 0 HE2 LYS A 107 6.878 45.694 -20.840 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.317 45.461 -19.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 8.860 45.650 -22.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.261 44.100 -21.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 7.867 44.326 -22.580 1.00 0.00 H new ATOM 1760 N GLU A 108 8.262 44.427 -14.770 1.00 0.00 N ATOM 1761 CA GLU A 108 8.859 45.149 -13.634 1.00 0.00 C ATOM 1762 C GLU A 108 9.858 44.278 -12.858 1.00 0.00 C ATOM 1763 O GLU A 108 10.764 44.810 -12.237 1.00 0.00 O ATOM 1764 CB GLU A 108 7.735 45.634 -12.689 1.00 0.00 C ATOM 1765 CG GLU A 108 6.746 46.617 -13.355 1.00 0.00 C ATOM 1766 CD GLU A 108 5.486 46.881 -12.517 1.00 0.00 C ATOM 1767 OE1 GLU A 108 4.515 46.104 -12.640 1.00 0.00 O ATOM 1768 OE2 GLU A 108 5.462 47.850 -11.730 1.00 0.00 O ATOM 0 H GLU A 108 7.264 44.250 -14.657 1.00 0.00 H new ATOM 0 HA GLU A 108 9.411 46.002 -14.029 1.00 0.00 H new ATOM 0 HB2 GLU A 108 7.182 44.769 -12.322 1.00 0.00 H new ATOM 0 HB3 GLU A 108 8.185 46.117 -11.821 1.00 0.00 H new ATOM 0 HG2 GLU A 108 7.255 47.563 -13.539 1.00 0.00 H new ATOM 0 HG3 GLU A 108 6.450 46.220 -14.326 1.00 0.00 H new ATOM 1775 N GLU A 109 9.684 42.941 -12.935 1.00 0.00 N ATOM 1776 CA GLU A 109 10.441 41.972 -12.115 1.00 0.00 C ATOM 1777 C GLU A 109 11.878 41.790 -12.643 1.00 0.00 C ATOM 1778 O GLU A 109 12.852 41.831 -11.875 1.00 0.00 O ATOM 1779 CB GLU A 109 9.709 40.603 -12.077 1.00 0.00 C ATOM 1780 CG GLU A 109 10.163 39.668 -10.934 1.00 0.00 C ATOM 1781 CD GLU A 109 9.859 40.253 -9.546 1.00 0.00 C ATOM 1782 OE1 GLU A 109 8.677 40.256 -9.149 1.00 0.00 O ATOM 1783 OE2 GLU A 109 10.793 40.724 -8.857 1.00 0.00 O ATOM 0 H GLU A 109 9.014 42.503 -13.568 1.00 0.00 H new ATOM 0 HA GLU A 109 10.501 42.371 -11.102 1.00 0.00 H new ATOM 0 HB2 GLU A 109 8.638 40.780 -11.981 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.864 40.095 -13.029 1.00 0.00 H new ATOM 0 HG2 GLU A 109 9.665 38.704 -11.037 1.00 0.00 H new ATOM 0 HG3 GLU A 109 11.234 39.484 -11.022 1.00 0.00 H new ATOM 1790 N LEU A 110 11.998 41.584 -13.967 1.00 0.00 N ATOM 1791 CA LEU A 110 13.312 41.431 -14.639 1.00 0.00 C ATOM 1792 C LEU A 110 14.071 42.771 -14.654 1.00 0.00 C ATOM 1793 O LEU A 110 15.302 42.797 -14.748 1.00 0.00 O ATOM 1794 CB LEU A 110 13.118 40.824 -16.063 1.00 0.00 C ATOM 1795 CG LEU A 110 12.225 41.629 -17.083 1.00 0.00 C ATOM 1796 CD1 LEU A 110 13.021 42.707 -17.868 1.00 0.00 C ATOM 1797 CD2 LEU A 110 11.482 40.677 -18.044 1.00 0.00 C ATOM 0 H LEU A 110 11.200 41.519 -14.599 1.00 0.00 H new ATOM 0 HA LEU A 110 13.931 40.732 -14.077 1.00 0.00 H new ATOM 0 HB2 LEU A 110 14.104 40.693 -16.510 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.685 39.830 -15.949 1.00 0.00 H new ATOM 0 HG LEU A 110 11.486 42.165 -16.488 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.351 43.226 -18.553 1.00 0.00 H new ATOM 0 HD12 LEU A 110 13.451 43.423 -17.168 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.820 42.229 -18.434 1.00 0.00 H new ATOM 0 HD21 LEU A 110 10.874 41.260 -18.736 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.207 40.088 -18.606 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.839 40.010 -17.470 1.00 0.00 H new ATOM 1809 N ALA A 111 13.307 43.875 -14.561 1.00 0.00 N ATOM 1810 CA ALA A 111 13.854 45.235 -14.419 1.00 0.00 C ATOM 1811 C ALA A 111 14.238 45.529 -12.952 1.00 0.00 C ATOM 1812 O ALA A 111 15.116 46.348 -12.703 1.00 0.00 O ATOM 1813 CB ALA A 111 12.836 46.269 -14.936 1.00 0.00 C ATOM 0 H ALA A 111 12.288 43.847 -14.582 1.00 0.00 H new ATOM 0 HA ALA A 111 14.762 45.307 -15.018 1.00 0.00 H new ATOM 0 HB1 ALA A 111 13.249 47.272 -14.827 1.00 0.00 H new ATOM 0 HB2 ALA A 111 12.624 46.076 -15.988 1.00 0.00 H new ATOM 0 HB3 ALA A 111 11.914 46.192 -14.360 1.00 0.00 H new ATOM 1819 N LEU A 112 13.568 44.839 -11.997 1.00 0.00 N ATOM 1820 CA LEU A 112 13.768 45.017 -10.534 1.00 0.00 C ATOM 1821 C LEU A 112 15.175 44.534 -10.127 1.00 0.00 C ATOM 1822 O LEU A 112 15.915 45.249 -9.437 1.00 0.00 O ATOM 1823 CB LEU A 112 12.628 44.255 -9.773 1.00 0.00 C ATOM 1824 CG LEU A 112 12.466 44.476 -8.220 1.00 0.00 C ATOM 1825 CD1 LEU A 112 11.008 44.202 -7.775 1.00 0.00 C ATOM 1826 CD2 LEU A 112 13.436 43.591 -7.397 1.00 0.00 C ATOM 0 H LEU A 112 12.865 44.135 -12.221 1.00 0.00 H new ATOM 0 HA LEU A 112 13.710 46.072 -10.265 1.00 0.00 H new ATOM 0 HB2 LEU A 112 11.682 44.522 -10.244 1.00 0.00 H new ATOM 0 HB3 LEU A 112 12.777 43.188 -9.940 1.00 0.00 H new ATOM 0 HG LEU A 112 12.716 45.519 -8.025 1.00 0.00 H new ATOM 0 HD11 LEU A 112 10.920 44.361 -6.700 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.334 44.880 -8.298 1.00 0.00 H new ATOM 0 HD13 LEU A 112 10.743 43.172 -8.013 1.00 0.00 H new ATOM 0 HD21 LEU A 112 13.287 43.779 -6.334 1.00 0.00 H new ATOM 0 HD22 LEU A 112 13.240 42.540 -7.611 1.00 0.00 H new ATOM 0 HD23 LEU A 112 14.465 43.830 -7.667 1.00 0.00 H new ATOM 1838 N GLU A 113 15.530 43.311 -10.574 1.00 0.00 N ATOM 1839 CA GLU A 113 16.867 42.717 -10.333 1.00 0.00 C ATOM 1840 C GLU A 113 17.972 43.497 -11.090 1.00 0.00 C ATOM 1841 O GLU A 113 19.076 43.713 -10.565 1.00 0.00 O ATOM 1842 CB GLU A 113 16.878 41.212 -10.735 1.00 0.00 C ATOM 1843 CG GLU A 113 16.425 40.930 -12.186 1.00 0.00 C ATOM 1844 CD GLU A 113 16.542 39.453 -12.592 1.00 0.00 C ATOM 1845 OE1 GLU A 113 17.566 39.065 -13.198 1.00 0.00 O ATOM 1846 OE2 GLU A 113 15.623 38.666 -12.290 1.00 0.00 O ATOM 0 H GLU A 113 14.904 42.709 -11.109 1.00 0.00 H new ATOM 0 HA GLU A 113 17.080 42.790 -9.267 1.00 0.00 H new ATOM 0 HB2 GLU A 113 17.887 40.821 -10.601 1.00 0.00 H new ATOM 0 HB3 GLU A 113 16.230 40.662 -10.053 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.389 41.249 -12.303 1.00 0.00 H new ATOM 0 HG3 GLU A 113 17.023 41.534 -12.868 1.00 0.00 H new ATOM 1853 N LYS A 114 17.636 43.942 -12.315 1.00 0.00 N ATOM 1854 CA LYS A 114 18.566 44.658 -13.211 1.00 0.00 C ATOM 1855 C LYS A 114 18.742 46.137 -12.791 1.00 0.00 C ATOM 1856 O LYS A 114 19.697 46.799 -13.216 1.00 0.00 O ATOM 1857 CB LYS A 114 18.048 44.547 -14.671 1.00 0.00 C ATOM 1858 CG LYS A 114 18.974 45.174 -15.745 1.00 0.00 C ATOM 1859 CD LYS A 114 18.433 44.998 -17.181 1.00 0.00 C ATOM 1860 CE LYS A 114 18.396 43.527 -17.628 1.00 0.00 C ATOM 1861 NZ LYS A 114 17.834 43.380 -18.993 1.00 0.00 N ATOM 0 H LYS A 114 16.706 43.815 -12.714 1.00 0.00 H new ATOM 0 HA LYS A 114 19.550 44.195 -13.139 1.00 0.00 H new ATOM 0 HB2 LYS A 114 17.902 43.494 -14.909 1.00 0.00 H new ATOM 0 HB3 LYS A 114 17.071 45.026 -14.731 1.00 0.00 H new ATOM 0 HG2 LYS A 114 19.097 46.237 -15.536 1.00 0.00 H new ATOM 0 HG3 LYS A 114 19.962 44.719 -15.676 1.00 0.00 H new ATOM 0 HD2 LYS A 114 17.428 45.416 -17.239 1.00 0.00 H new ATOM 0 HD3 LYS A 114 19.056 45.567 -17.871 1.00 0.00 H new ATOM 0 HE2 LYS A 114 19.405 43.114 -17.604 1.00 0.00 H new ATOM 0 HE3 LYS A 114 17.798 42.948 -16.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 17.826 42.375 -19.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 16.862 43.751 -19.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 18.419 43.912 -19.669 1.00 0.00 H new ATOM 1875 N LYS A 115 17.824 46.635 -11.944 1.00 0.00 N ATOM 1876 CA LYS A 115 17.891 48.008 -11.408 1.00 0.00 C ATOM 1877 C LYS A 115 19.153 48.143 -10.530 1.00 0.00 C ATOM 1878 O LYS A 115 19.896 49.120 -10.643 1.00 0.00 O ATOM 1879 CB LYS A 115 16.590 48.355 -10.595 1.00 0.00 C ATOM 1880 CG LYS A 115 16.153 49.847 -10.641 1.00 0.00 C ATOM 1881 CD LYS A 115 17.202 50.827 -10.065 1.00 0.00 C ATOM 1882 CE LYS A 115 16.773 52.297 -10.172 1.00 0.00 C ATOM 1883 NZ LYS A 115 17.838 53.215 -9.701 1.00 0.00 N ATOM 0 H LYS A 115 17.020 46.102 -11.613 1.00 0.00 H new ATOM 0 HA LYS A 115 17.954 48.718 -12.232 1.00 0.00 H new ATOM 0 HB2 LYS A 115 15.771 47.742 -10.973 1.00 0.00 H new ATOM 0 HB3 LYS A 115 16.746 48.072 -9.554 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.943 50.122 -11.675 1.00 0.00 H new ATOM 0 HG3 LYS A 115 15.222 49.960 -10.086 1.00 0.00 H new ATOM 0 HD2 LYS A 115 17.383 50.583 -9.018 1.00 0.00 H new ATOM 0 HD3 LYS A 115 18.146 50.691 -10.592 1.00 0.00 H new ATOM 0 HE2 LYS A 115 16.524 52.529 -11.208 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.869 52.456 -9.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 17.546 54.199 -9.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 17.998 53.068 -8.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 18.718 53.022 -10.222 1.00 0.00 H new ATOM 1897 N ARG A 116 19.392 47.124 -9.681 1.00 0.00 N ATOM 1898 CA ARG A 116 20.584 47.071 -8.815 1.00 0.00 C ATOM 1899 C ARG A 116 21.856 46.962 -9.671 1.00 0.00 C ATOM 1900 O ARG A 116 22.870 47.548 -9.328 1.00 0.00 O ATOM 1901 CB ARG A 116 20.503 45.902 -7.783 1.00 0.00 C ATOM 1902 CG ARG A 116 19.524 46.141 -6.601 1.00 0.00 C ATOM 1903 CD ARG A 116 18.042 46.123 -7.008 1.00 0.00 C ATOM 1904 NE ARG A 116 17.176 46.652 -5.933 1.00 0.00 N ATOM 1905 CZ ARG A 116 16.158 46.008 -5.346 1.00 0.00 C ATOM 1906 NH1 ARG A 116 15.864 44.764 -5.670 1.00 0.00 N ATOM 1907 NH2 ARG A 116 15.430 46.626 -4.424 1.00 0.00 N ATOM 0 H ARG A 116 18.770 46.322 -9.577 1.00 0.00 H new ATOM 0 HA ARG A 116 20.623 47.998 -8.243 1.00 0.00 H new ATOM 0 HB2 ARG A 116 20.203 44.994 -8.307 1.00 0.00 H new ATOM 0 HB3 ARG A 116 21.500 45.723 -7.380 1.00 0.00 H new ATOM 0 HG2 ARG A 116 19.692 45.376 -5.842 1.00 0.00 H new ATOM 0 HG3 ARG A 116 19.753 47.102 -6.141 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.905 46.717 -7.912 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.742 45.103 -7.248 1.00 0.00 H new ATOM 0 HE ARG A 116 17.372 47.598 -5.607 1.00 0.00 H new ATOM 0 HH11 ARG A 116 16.415 44.277 -6.377 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.086 44.288 -5.213 1.00 0.00 H new ATOM 0 HH21 ARG A 116 15.646 47.588 -4.164 1.00 0.00 H new ATOM 0 HH22 ARG A 116 14.654 46.139 -3.975 1.00 0.00 H new ATOM 1921 N GLU A 117 21.760 46.224 -10.801 1.00 0.00 N ATOM 1922 CA GLU A 117 22.858 46.079 -11.782 1.00 0.00 C ATOM 1923 C GLU A 117 23.236 47.445 -12.403 1.00 0.00 C ATOM 1924 O GLU A 117 24.417 47.737 -12.628 1.00 0.00 O ATOM 1925 CB GLU A 117 22.452 45.073 -12.894 1.00 0.00 C ATOM 1926 CG GLU A 117 23.569 44.743 -13.906 1.00 0.00 C ATOM 1927 CD GLU A 117 24.790 44.081 -13.241 1.00 0.00 C ATOM 1928 OE1 GLU A 117 24.703 42.883 -12.902 1.00 0.00 O ATOM 1929 OE2 GLU A 117 25.839 44.746 -13.057 1.00 0.00 O ATOM 0 H GLU A 117 20.916 45.711 -11.058 1.00 0.00 H new ATOM 0 HA GLU A 117 23.733 45.695 -11.258 1.00 0.00 H new ATOM 0 HB2 GLU A 117 22.122 44.147 -12.424 1.00 0.00 H new ATOM 0 HB3 GLU A 117 21.597 45.478 -13.436 1.00 0.00 H new ATOM 0 HG2 GLU A 117 23.174 44.079 -14.675 1.00 0.00 H new ATOM 0 HG3 GLU A 117 23.884 45.659 -14.406 1.00 0.00 H new ATOM 1936 N LEU A 118 22.206 48.276 -12.656 1.00 0.00 N ATOM 1937 CA LEU A 118 22.370 49.636 -13.203 1.00 0.00 C ATOM 1938 C LEU A 118 23.144 50.534 -12.210 1.00 0.00 C ATOM 1939 O LEU A 118 23.942 51.387 -12.618 1.00 0.00 O ATOM 1940 CB LEU A 118 20.976 50.239 -13.539 1.00 0.00 C ATOM 1941 CG LEU A 118 20.953 51.692 -14.124 1.00 0.00 C ATOM 1942 CD1 LEU A 118 21.787 51.807 -15.428 1.00 0.00 C ATOM 1943 CD2 LEU A 118 19.496 52.173 -14.339 1.00 0.00 C ATOM 0 H LEU A 118 21.233 48.021 -12.486 1.00 0.00 H new ATOM 0 HA LEU A 118 22.954 49.583 -14.122 1.00 0.00 H new ATOM 0 HB2 LEU A 118 20.484 49.578 -14.253 1.00 0.00 H new ATOM 0 HB3 LEU A 118 20.375 50.230 -12.630 1.00 0.00 H new ATOM 0 HG LEU A 118 21.423 52.349 -13.392 1.00 0.00 H new ATOM 0 HD11 LEU A 118 21.743 52.831 -15.799 1.00 0.00 H new ATOM 0 HD12 LEU A 118 22.823 51.540 -15.222 1.00 0.00 H new ATOM 0 HD13 LEU A 118 21.381 51.131 -16.180 1.00 0.00 H new ATOM 0 HD21 LEU A 118 19.503 53.184 -14.746 1.00 0.00 H new ATOM 0 HD22 LEU A 118 18.991 51.505 -15.037 1.00 0.00 H new ATOM 0 HD23 LEU A 118 18.967 52.169 -13.386 1.00 0.00 H new ATOM 1955 N GLU A 119 22.899 50.316 -10.903 1.00 0.00 N ATOM 1956 CA GLU A 119 23.617 51.021 -9.821 1.00 0.00 C ATOM 1957 C GLU A 119 25.077 50.541 -9.767 1.00 0.00 C ATOM 1958 O GLU A 119 25.998 51.358 -9.709 1.00 0.00 O ATOM 1959 CB GLU A 119 22.914 50.805 -8.447 1.00 0.00 C ATOM 1960 CG GLU A 119 21.379 51.012 -8.448 1.00 0.00 C ATOM 1961 CD GLU A 119 20.921 52.331 -9.102 1.00 0.00 C ATOM 1962 OE1 GLU A 119 20.913 53.377 -8.420 1.00 0.00 O ATOM 1963 OE2 GLU A 119 20.556 52.329 -10.304 1.00 0.00 O ATOM 0 H GLU A 119 22.202 49.651 -10.568 1.00 0.00 H new ATOM 0 HA GLU A 119 23.603 52.090 -10.034 1.00 0.00 H new ATOM 0 HB2 GLU A 119 23.127 49.793 -8.104 1.00 0.00 H new ATOM 0 HB3 GLU A 119 23.355 51.487 -7.721 1.00 0.00 H new ATOM 0 HG2 GLU A 119 20.911 50.178 -8.971 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.019 50.985 -7.420 1.00 0.00 H new ATOM 1970 N LYS A 120 25.256 49.196 -9.853 1.00 0.00 N ATOM 1971 CA LYS A 120 26.577 48.523 -9.824 1.00 0.00 C ATOM 1972 C LYS A 120 27.490 49.037 -10.938 1.00 0.00 C ATOM 1973 O LYS A 120 28.701 49.038 -10.780 1.00 0.00 O ATOM 1974 CB LYS A 120 26.432 46.985 -9.975 1.00 0.00 C ATOM 1975 CG LYS A 120 25.667 46.295 -8.836 1.00 0.00 C ATOM 1976 CD LYS A 120 25.407 44.799 -9.124 1.00 0.00 C ATOM 1977 CE LYS A 120 24.493 44.143 -8.080 1.00 0.00 C ATOM 1978 NZ LYS A 120 24.286 42.701 -8.355 1.00 0.00 N ATOM 0 H LYS A 120 24.477 48.544 -9.945 1.00 0.00 H new ATOM 0 HA LYS A 120 27.021 48.753 -8.855 1.00 0.00 H new ATOM 0 HB2 LYS A 120 25.924 46.773 -10.916 1.00 0.00 H new ATOM 0 HB3 LYS A 120 27.427 46.545 -10.044 1.00 0.00 H new ATOM 0 HG2 LYS A 120 26.234 46.391 -7.910 1.00 0.00 H new ATOM 0 HG3 LYS A 120 24.715 46.803 -8.681 1.00 0.00 H new ATOM 0 HD2 LYS A 120 24.956 44.697 -10.111 1.00 0.00 H new ATOM 0 HD3 LYS A 120 26.359 44.268 -9.152 1.00 0.00 H new ATOM 0 HE2 LYS A 120 24.929 44.265 -7.088 1.00 0.00 H new ATOM 0 HE3 LYS A 120 23.530 44.653 -8.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 23.663 42.295 -7.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 23.847 42.586 -9.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 25.202 42.210 -8.340 1.00 0.00 H new ATOM 1992 N ARG A 121 26.884 49.467 -12.055 1.00 0.00 N ATOM 1993 CA ARG A 121 27.620 49.990 -13.213 1.00 0.00 C ATOM 1994 C ARG A 121 28.418 51.263 -12.832 1.00 0.00 C ATOM 1995 O ARG A 121 29.533 51.474 -13.303 1.00 0.00 O ATOM 1996 CB ARG A 121 26.635 50.266 -14.388 1.00 0.00 C ATOM 1997 CG ARG A 121 27.285 50.360 -15.799 1.00 0.00 C ATOM 1998 CD ARG A 121 27.697 48.989 -16.397 1.00 0.00 C ATOM 1999 NE ARG A 121 28.745 48.300 -15.607 1.00 0.00 N ATOM 2000 CZ ARG A 121 30.017 48.105 -15.984 1.00 0.00 C ATOM 2001 NH1 ARG A 121 30.450 48.505 -17.176 1.00 0.00 N ATOM 2002 NH2 ARG A 121 30.855 47.491 -15.154 1.00 0.00 N ATOM 0 H ARG A 121 25.872 49.462 -12.180 1.00 0.00 H new ATOM 0 HA ARG A 121 28.341 49.241 -13.540 1.00 0.00 H new ATOM 0 HB2 ARG A 121 25.886 49.475 -14.404 1.00 0.00 H new ATOM 0 HB3 ARG A 121 26.109 51.199 -14.187 1.00 0.00 H new ATOM 0 HG2 ARG A 121 26.585 50.845 -16.479 1.00 0.00 H new ATOM 0 HG3 ARG A 121 28.166 50.999 -15.740 1.00 0.00 H new ATOM 0 HD2 ARG A 121 26.818 48.348 -16.460 1.00 0.00 H new ATOM 0 HD3 ARG A 121 28.057 49.137 -17.415 1.00 0.00 H new ATOM 0 HE ARG A 121 28.473 47.941 -14.692 1.00 0.00 H new ATOM 0 HH11 ARG A 121 29.811 48.969 -17.821 1.00 0.00 H new ATOM 0 HH12 ARG A 121 31.421 48.348 -17.445 1.00 0.00 H new ATOM 0 HH21 ARG A 121 30.528 47.174 -14.241 1.00 0.00 H new ATOM 0 HH22 ARG A 121 31.825 47.337 -15.430 1.00 0.00 H new ATOM 2016 N LEU A 122 27.824 52.081 -11.944 1.00 0.00 N ATOM 2017 CA LEU A 122 28.443 53.320 -11.422 1.00 0.00 C ATOM 2018 C LEU A 122 29.256 53.045 -10.131 1.00 0.00 C ATOM 2019 O LEU A 122 30.116 53.842 -9.766 1.00 0.00 O ATOM 2020 CB LEU A 122 27.351 54.409 -11.153 1.00 0.00 C ATOM 2021 CG LEU A 122 26.665 55.079 -12.401 1.00 0.00 C ATOM 2022 CD1 LEU A 122 27.705 55.723 -13.345 1.00 0.00 C ATOM 2023 CD2 LEU A 122 25.743 54.098 -13.159 1.00 0.00 C ATOM 0 H LEU A 122 26.894 51.902 -11.564 1.00 0.00 H new ATOM 0 HA LEU A 122 29.132 53.691 -12.181 1.00 0.00 H new ATOM 0 HB2 LEU A 122 26.569 53.957 -10.543 1.00 0.00 H new ATOM 0 HB3 LEU A 122 27.805 55.199 -10.555 1.00 0.00 H new ATOM 0 HG LEU A 122 26.030 55.878 -12.018 1.00 0.00 H new ATOM 0 HD11 LEU A 122 27.194 56.175 -14.195 1.00 0.00 H new ATOM 0 HD12 LEU A 122 28.260 56.490 -12.805 1.00 0.00 H new ATOM 0 HD13 LEU A 122 28.395 54.958 -13.702 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.293 54.607 -14.012 1.00 0.00 H new ATOM 0 HD22 LEU A 122 26.327 53.248 -13.511 1.00 0.00 H new ATOM 0 HD23 LEU A 122 24.957 53.747 -12.490 1.00 0.00 H new ATOM 2035 N GLN A 123 28.953 51.929 -9.432 1.00 0.00 N ATOM 2036 CA GLN A 123 29.638 51.547 -8.167 1.00 0.00 C ATOM 2037 C GLN A 123 30.970 50.817 -8.438 1.00 0.00 C ATOM 2038 O GLN A 123 31.929 50.939 -7.671 1.00 0.00 O ATOM 2039 CB GLN A 123 28.705 50.643 -7.307 1.00 0.00 C ATOM 2040 CG GLN A 123 27.396 51.329 -6.856 1.00 0.00 C ATOM 2041 CD GLN A 123 26.410 50.388 -6.143 1.00 0.00 C ATOM 2042 OE1 GLN A 123 26.374 49.183 -6.401 1.00 0.00 O ATOM 2043 NE2 GLN A 123 25.578 50.936 -5.273 1.00 0.00 N ATOM 0 H GLN A 123 28.232 51.268 -9.722 1.00 0.00 H new ATOM 0 HA GLN A 123 29.863 52.464 -7.622 1.00 0.00 H new ATOM 0 HB2 GLN A 123 28.455 49.750 -7.880 1.00 0.00 H new ATOM 0 HB3 GLN A 123 29.252 50.313 -6.424 1.00 0.00 H new ATOM 0 HG2 GLN A 123 27.642 52.155 -6.188 1.00 0.00 H new ATOM 0 HG3 GLN A 123 26.905 51.760 -7.728 1.00 0.00 H new ATOM 0 HE21 GLN A 123 25.630 51.936 -5.078 1.00 0.00 H new ATOM 0 HE22 GLN A 123 24.885 50.359 -4.797 1.00 0.00 H new