USER MOD reduce.3.24.130724 H: found=0, std=0, add=755, rem=0, adj=20 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 Set 1.1: A 120 LYS NZ :NH3+ 165:sc= 0.0218 (180deg=0) USER MOD Set 1.2: A 123 GLN : amide:sc= 0.022 X(o=0.044,f=-0.19) USER MOD Set 2.1: A 76 SER OG : rot -150:sc= 0.0268 USER MOD Set 2.2: A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 MET CE :methyl 147:sc= 0 (180deg=-0.184) 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+ 143:sc= 0.894 (180deg=-0.0642) USER MOD Single : A 31 GLN : amide:sc= -0.289 X(o=-0.29,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 38 LYS NZ :NH3+ -157:sc= 0.534 (180deg=0.269) USER MOD Single : A 43 LYS NZ :NH3+ 150:sc= -1.07 (180deg=-2.56!) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= -1.38 K(o=-1.4,f=-3.8!) USER MOD Single : A 57 SER OG : rot 103:sc= 0.0468 USER MOD Single : A 61 SER OG : rot 180:sc= -0.579 USER MOD Single : A 62 ASN : amide:sc= -0.25 K(o=-0.25,f=-3.9) USER MOD Single : A 72 THR OG1 : rot -18:sc= 0.269 USER MOD Single : A 74 LYS NZ :NH3+ 142:sc= 0.538 (180deg=0.0359) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 67:sc= 1.21 USER MOD Single : A 88 CYS SG : rot 74:sc= -2.55! USER MOD Single : A 106 THR OG1 : rot -31:sc= 0.101 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0901) USER MOD Single : A 115 LYS NZ :NH3+ 178:sc= 0.462 (180deg=0.432) USER MOD ----------------------------------------------------------------- ATOM 296 N ARG A 22 -9.635 28.007 -16.496 1.00 0.00 N ATOM 297 CA ARG A 22 -10.858 28.786 -16.773 1.00 0.00 C ATOM 298 C ARG A 22 -11.940 28.436 -15.711 1.00 0.00 C ATOM 299 O ARG A 22 -11.656 27.633 -14.809 1.00 0.00 O ATOM 300 CB ARG A 22 -11.339 28.447 -18.221 1.00 0.00 C ATOM 301 CG ARG A 22 -10.334 28.828 -19.338 1.00 0.00 C ATOM 302 CD ARG A 22 -10.860 28.495 -20.750 1.00 0.00 C ATOM 303 NE ARG A 22 -9.928 28.918 -21.812 1.00 0.00 N ATOM 304 CZ ARG A 22 -10.262 29.101 -23.104 1.00 0.00 C ATOM 305 NH1 ARG A 22 -11.515 28.941 -23.513 1.00 0.00 N ATOM 306 NH2 ARG A 22 -9.337 29.446 -23.986 1.00 0.00 N ATOM 0 HA ARG A 22 -10.665 29.857 -16.711 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.542 27.378 -18.282 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.282 28.962 -18.407 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.117 29.894 -19.278 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.394 28.301 -19.171 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -11.031 27.421 -20.827 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.823 28.983 -20.900 1.00 0.00 H new ATOM 0 HE ARG A 22 -8.957 29.085 -21.548 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -12.239 28.676 -22.846 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.753 29.083 -24.495 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.370 29.574 -23.687 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.591 29.584 -24.964 1.00 0.00 H new ATOM 320 N PRO A 23 -13.167 29.091 -15.725 1.00 0.00 N ATOM 321 CA PRO A 23 -14.347 28.577 -14.984 1.00 0.00 C ATOM 322 C PRO A 23 -14.569 27.069 -15.268 1.00 0.00 C ATOM 323 O PRO A 23 -14.778 26.663 -16.423 1.00 0.00 O ATOM 324 CB PRO A 23 -15.512 29.451 -15.514 1.00 0.00 C ATOM 325 CG PRO A 23 -14.854 30.761 -15.848 1.00 0.00 C ATOM 326 CD PRO A 23 -13.472 30.398 -16.373 1.00 0.00 C ATOM 0 HA PRO A 23 -14.241 28.643 -13.901 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -15.981 29.004 -16.391 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -16.293 29.575 -14.763 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -15.427 31.309 -16.596 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -14.784 31.401 -14.968 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -13.468 30.314 -17.460 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -12.734 31.155 -16.109 1.00 0.00 H new ATOM 334 N MET A 24 -14.483 26.268 -14.193 1.00 0.00 N ATOM 335 CA MET A 24 -14.420 24.786 -14.260 1.00 0.00 C ATOM 336 C MET A 24 -15.764 24.174 -14.709 1.00 0.00 C ATOM 337 O MET A 24 -16.740 24.905 -14.936 1.00 0.00 O ATOM 338 CB MET A 24 -14.018 24.211 -12.870 1.00 0.00 C ATOM 339 CG MET A 24 -12.881 24.960 -12.155 1.00 0.00 C ATOM 340 SD MET A 24 -11.303 24.940 -13.034 1.00 0.00 S ATOM 341 CE MET A 24 -10.304 25.971 -11.949 1.00 0.00 C ATOM 0 H MET A 24 -14.455 26.629 -13.239 1.00 0.00 H new ATOM 0 HA MET A 24 -13.668 24.519 -15.003 1.00 0.00 H new ATOM 0 HB2 MET A 24 -14.897 24.216 -12.225 1.00 0.00 H new ATOM 0 HB3 MET A 24 -13.722 23.170 -12.997 1.00 0.00 H new ATOM 0 HG2 MET A 24 -13.185 25.996 -12.003 1.00 0.00 H new ATOM 0 HG3 MET A 24 -12.738 24.521 -11.168 1.00 0.00 H new ATOM 0 HE1 MET A 24 -9.271 25.623 -11.966 1.00 0.00 H new ATOM 0 HE2 MET A 24 -10.344 27.005 -12.291 1.00 0.00 H new ATOM 0 HE3 MET A 24 -10.691 25.910 -10.932 1.00 0.00 H new ATOM 351 N SER A 25 -15.807 22.819 -14.826 1.00 0.00 N ATOM 352 CA SER A 25 -17.036 22.090 -15.187 1.00 0.00 C ATOM 353 C SER A 25 -18.156 22.405 -14.172 1.00 0.00 C ATOM 354 O SER A 25 -17.974 22.246 -12.956 1.00 0.00 O ATOM 355 CB SER A 25 -16.751 20.573 -15.230 1.00 0.00 C ATOM 356 OG SER A 25 -15.732 20.280 -16.174 1.00 0.00 O ATOM 0 H SER A 25 -14.998 22.216 -14.673 1.00 0.00 H new ATOM 0 HA SER A 25 -17.367 22.411 -16.175 1.00 0.00 H new ATOM 0 HB2 SER A 25 -16.448 20.227 -14.242 1.00 0.00 H new ATOM 0 HB3 SER A 25 -17.662 20.034 -15.492 1.00 0.00 H new ATOM 0 HG SER A 25 -15.564 19.314 -16.185 1.00 0.00 H new ATOM 362 N TYR A 26 -19.316 22.816 -14.704 1.00 0.00 N ATOM 363 CA TYR A 26 -20.407 23.395 -13.909 1.00 0.00 C ATOM 364 C TYR A 26 -21.146 22.323 -13.109 1.00 0.00 C ATOM 365 O TYR A 26 -21.475 22.550 -11.951 1.00 0.00 O ATOM 366 CB TYR A 26 -21.374 24.183 -14.827 1.00 0.00 C ATOM 367 CG TYR A 26 -20.655 25.241 -15.698 1.00 0.00 C ATOM 368 CD1 TYR A 26 -20.002 26.334 -15.116 1.00 0.00 C ATOM 369 CD2 TYR A 26 -20.620 25.131 -17.092 1.00 0.00 C ATOM 370 CE1 TYR A 26 -19.340 27.268 -15.889 1.00 0.00 C ATOM 371 CE2 TYR A 26 -19.960 26.067 -17.867 1.00 0.00 C ATOM 372 CZ TYR A 26 -19.322 27.135 -17.261 1.00 0.00 C ATOM 373 OH TYR A 26 -18.664 28.073 -18.031 1.00 0.00 O ATOM 0 H TYR A 26 -19.524 22.756 -15.701 1.00 0.00 H new ATOM 0 HA TYR A 26 -19.975 24.089 -13.187 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -21.901 23.483 -15.476 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -22.127 24.677 -14.213 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.016 26.449 -14.042 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -21.117 24.301 -17.571 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -18.838 28.101 -15.419 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -19.943 25.965 -18.942 1.00 0.00 H new ATOM 0 HH TYR A 26 -18.745 27.834 -18.978 1.00 0.00 H new ATOM 383 N ASP A 27 -21.386 21.159 -13.744 1.00 0.00 N ATOM 384 CA ASP A 27 -22.066 20.008 -13.104 1.00 0.00 C ATOM 385 C ASP A 27 -21.235 19.453 -11.935 1.00 0.00 C ATOM 386 O ASP A 27 -21.779 19.102 -10.878 1.00 0.00 O ATOM 387 CB ASP A 27 -22.342 18.890 -14.141 1.00 0.00 C ATOM 388 CG ASP A 27 -23.095 17.678 -13.554 1.00 0.00 C ATOM 389 OD1 ASP A 27 -22.449 16.666 -13.200 1.00 0.00 O ATOM 390 OD2 ASP A 27 -24.335 17.744 -13.439 1.00 0.00 O ATOM 0 H ASP A 27 -21.116 20.987 -14.712 1.00 0.00 H new ATOM 0 HA ASP A 27 -23.018 20.363 -12.709 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -22.923 19.305 -14.964 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -21.394 18.551 -14.559 1.00 0.00 H new ATOM 395 N GLU A 28 -19.915 19.384 -12.155 1.00 0.00 N ATOM 396 CA GLU A 28 -18.938 18.944 -11.147 1.00 0.00 C ATOM 397 C GLU A 28 -18.913 19.931 -9.962 1.00 0.00 C ATOM 398 O GLU A 28 -18.793 19.526 -8.804 1.00 0.00 O ATOM 399 CB GLU A 28 -17.549 18.790 -11.840 1.00 0.00 C ATOM 400 CG GLU A 28 -16.355 18.342 -10.935 1.00 0.00 C ATOM 401 CD GLU A 28 -15.444 19.508 -10.487 1.00 0.00 C ATOM 402 OE1 GLU A 28 -15.456 19.877 -9.299 1.00 0.00 O ATOM 403 OE2 GLU A 28 -14.725 20.073 -11.348 1.00 0.00 O ATOM 0 H GLU A 28 -19.490 19.635 -13.048 1.00 0.00 H new ATOM 0 HA GLU A 28 -19.217 17.976 -10.731 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -17.652 18.067 -12.649 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -17.289 19.745 -12.297 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -16.749 17.840 -10.051 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -15.755 17.611 -11.476 1.00 0.00 H new ATOM 410 N LYS A 29 -19.070 21.226 -10.284 1.00 0.00 N ATOM 411 CA LYS A 29 -19.161 22.320 -9.295 1.00 0.00 C ATOM 412 C LYS A 29 -20.532 22.387 -8.586 1.00 0.00 C ATOM 413 O LYS A 29 -20.604 22.956 -7.498 1.00 0.00 O ATOM 414 CB LYS A 29 -18.752 23.694 -9.938 1.00 0.00 C ATOM 415 CG LYS A 29 -17.308 24.148 -9.583 1.00 0.00 C ATOM 416 CD LYS A 29 -16.246 23.079 -9.907 1.00 0.00 C ATOM 417 CE LYS A 29 -14.856 23.408 -9.348 1.00 0.00 C ATOM 418 NZ LYS A 29 -13.882 22.323 -9.646 1.00 0.00 N ATOM 0 H LYS A 29 -19.138 21.549 -11.249 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.442 22.094 -8.507 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -18.843 23.619 -11.022 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -19.455 24.461 -9.611 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -17.075 25.062 -10.130 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -17.260 24.391 -8.521 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -16.573 22.120 -9.505 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -16.176 22.964 -10.989 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -14.502 24.345 -9.777 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -14.921 23.555 -8.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -12.952 22.739 -9.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -13.802 21.693 -8.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.210 21.778 -10.469 1.00 0.00 H new ATOM 432 N ARG A 30 -21.606 21.838 -9.195 1.00 0.00 N ATOM 433 CA ARG A 30 -22.912 21.658 -8.499 1.00 0.00 C ATOM 434 C ARG A 30 -22.725 20.673 -7.331 1.00 0.00 C ATOM 435 O ARG A 30 -23.193 20.895 -6.206 1.00 0.00 O ATOM 436 CB ARG A 30 -23.999 21.098 -9.467 1.00 0.00 C ATOM 437 CG ARG A 30 -24.324 21.978 -10.692 1.00 0.00 C ATOM 438 CD ARG A 30 -25.317 21.298 -11.653 1.00 0.00 C ATOM 439 NE ARG A 30 -25.468 22.050 -12.914 1.00 0.00 N ATOM 440 CZ ARG A 30 -25.683 21.507 -14.128 1.00 0.00 C ATOM 441 NH1 ARG A 30 -25.719 20.188 -14.290 1.00 0.00 N ATOM 442 NH2 ARG A 30 -25.852 22.285 -15.188 1.00 0.00 N ATOM 0 H ARG A 30 -21.601 21.512 -10.161 1.00 0.00 H new ATOM 0 HA ARG A 30 -23.245 22.630 -8.135 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -23.674 20.120 -9.822 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -24.917 20.942 -8.901 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -24.740 22.927 -10.355 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -23.402 22.207 -11.227 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -24.975 20.287 -11.873 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -26.288 21.207 -11.166 1.00 0.00 H new ATOM 0 HE ARG A 30 -25.404 23.067 -12.862 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -25.583 19.572 -13.489 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -25.883 19.792 -15.216 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -25.820 23.299 -15.086 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -26.014 21.869 -16.105 1.00 0.00 H new ATOM 456 N GLN A 31 -22.002 19.587 -7.642 1.00 0.00 N ATOM 457 CA GLN A 31 -21.647 18.536 -6.679 1.00 0.00 C ATOM 458 C GLN A 31 -20.627 19.060 -5.650 1.00 0.00 C ATOM 459 O GLN A 31 -20.664 18.667 -4.485 1.00 0.00 O ATOM 460 CB GLN A 31 -21.085 17.321 -7.452 1.00 0.00 C ATOM 461 CG GLN A 31 -22.076 16.715 -8.471 1.00 0.00 C ATOM 462 CD GLN A 31 -21.454 15.636 -9.363 1.00 0.00 C ATOM 463 OE1 GLN A 31 -21.449 14.455 -9.019 1.00 0.00 O ATOM 464 NE2 GLN A 31 -20.936 16.033 -10.513 1.00 0.00 N ATOM 0 H GLN A 31 -21.643 19.413 -8.581 1.00 0.00 H new ATOM 0 HA GLN A 31 -22.535 18.231 -6.126 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -20.179 17.624 -7.977 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -20.797 16.550 -6.738 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -22.921 16.287 -7.933 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -22.470 17.513 -9.101 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -20.957 17.020 -10.768 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -20.516 15.352 -11.145 1.00 0.00 H new ATOM 473 N LEU A 32 -19.740 19.974 -6.099 1.00 0.00 N ATOM 474 CA LEU A 32 -18.739 20.627 -5.233 1.00 0.00 C ATOM 475 C LEU A 32 -19.455 21.538 -4.221 1.00 0.00 C ATOM 476 O LEU A 32 -19.069 21.593 -3.067 1.00 0.00 O ATOM 477 CB LEU A 32 -17.694 21.440 -6.086 1.00 0.00 C ATOM 478 CG LEU A 32 -16.182 21.248 -5.730 1.00 0.00 C ATOM 479 CD1 LEU A 32 -15.858 21.673 -4.281 1.00 0.00 C ATOM 480 CD2 LEU A 32 -15.749 19.795 -6.012 1.00 0.00 C ATOM 0 H LEU A 32 -19.699 20.279 -7.072 1.00 0.00 H new ATOM 0 HA LEU A 32 -18.186 19.860 -4.691 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.832 21.173 -7.134 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.932 22.500 -5.993 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.603 21.911 -6.373 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.797 21.520 -4.086 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.103 22.727 -4.147 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.445 21.073 -3.586 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.695 19.674 -5.760 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.347 19.113 -5.407 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.898 19.569 -7.068 1.00 0.00 H new ATOM 492 N SER A 33 -20.523 22.221 -4.686 1.00 0.00 N ATOM 493 CA SER A 33 -21.339 23.130 -3.855 1.00 0.00 C ATOM 494 C SER A 33 -22.148 22.341 -2.802 1.00 0.00 C ATOM 495 O SER A 33 -22.507 22.888 -1.754 1.00 0.00 O ATOM 496 CB SER A 33 -22.271 23.983 -4.744 1.00 0.00 C ATOM 497 OG SER A 33 -22.946 24.993 -3.997 1.00 0.00 O ATOM 0 H SER A 33 -20.844 22.157 -5.652 1.00 0.00 H new ATOM 0 HA SER A 33 -20.667 23.802 -3.321 1.00 0.00 H new ATOM 0 HB2 SER A 33 -21.688 24.449 -5.538 1.00 0.00 H new ATOM 0 HB3 SER A 33 -23.005 23.336 -5.225 1.00 0.00 H new ATOM 0 HG SER A 33 -23.524 25.511 -4.595 1.00 0.00 H new ATOM 503 N LEU A 34 -22.435 21.064 -3.116 1.00 0.00 N ATOM 504 CA LEU A 34 -23.051 20.105 -2.176 1.00 0.00 C ATOM 505 C LEU A 34 -22.038 19.791 -1.043 1.00 0.00 C ATOM 506 O LEU A 34 -22.416 19.674 0.130 1.00 0.00 O ATOM 507 CB LEU A 34 -23.479 18.829 -2.982 1.00 0.00 C ATOM 508 CG LEU A 34 -24.462 17.797 -2.310 1.00 0.00 C ATOM 509 CD1 LEU A 34 -25.056 16.837 -3.369 1.00 0.00 C ATOM 510 CD2 LEU A 34 -23.793 16.978 -1.176 1.00 0.00 C ATOM 0 H LEU A 34 -22.245 20.665 -4.035 1.00 0.00 H new ATOM 0 HA LEU A 34 -23.944 20.516 -1.705 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -23.939 19.165 -3.911 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -22.571 18.291 -3.253 1.00 0.00 H new ATOM 0 HG LEU A 34 -25.261 18.384 -1.858 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -25.732 16.133 -2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -25.605 17.412 -4.114 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -24.250 16.289 -3.856 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -24.519 16.284 -0.751 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -22.950 16.418 -1.580 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -23.440 17.655 -0.398 1.00 0.00 H new ATOM 522 N ASP A 35 -20.749 19.674 -1.420 1.00 0.00 N ATOM 523 CA ASP A 35 -19.636 19.453 -0.467 1.00 0.00 C ATOM 524 C ASP A 35 -19.285 20.733 0.306 1.00 0.00 C ATOM 525 O ASP A 35 -18.752 20.652 1.409 1.00 0.00 O ATOM 526 CB ASP A 35 -18.387 18.869 -1.181 1.00 0.00 C ATOM 527 CG ASP A 35 -18.619 17.433 -1.686 1.00 0.00 C ATOM 528 OD1 ASP A 35 -18.741 16.510 -0.843 1.00 0.00 O ATOM 529 OD2 ASP A 35 -18.690 17.207 -2.914 1.00 0.00 O ATOM 0 H ASP A 35 -20.447 19.730 -2.393 1.00 0.00 H new ATOM 0 HA ASP A 35 -19.978 18.717 0.261 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -18.120 19.509 -2.022 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -17.541 18.878 -0.493 1.00 0.00 H new ATOM 534 N ILE A 36 -19.561 21.914 -0.283 1.00 0.00 N ATOM 535 CA ILE A 36 -19.439 23.208 0.431 1.00 0.00 C ATOM 536 C ILE A 36 -20.528 23.276 1.524 1.00 0.00 C ATOM 537 O ILE A 36 -20.262 23.657 2.664 1.00 0.00 O ATOM 538 CB ILE A 36 -19.564 24.453 -0.548 1.00 0.00 C ATOM 539 CG1 ILE A 36 -18.451 24.407 -1.652 1.00 0.00 C ATOM 540 CG2 ILE A 36 -19.514 25.802 0.223 1.00 0.00 C ATOM 541 CD1 ILE A 36 -18.496 25.531 -2.683 1.00 0.00 C ATOM 0 H ILE A 36 -19.870 22.002 -1.251 1.00 0.00 H new ATOM 0 HA ILE A 36 -18.446 23.259 0.878 1.00 0.00 H new ATOM 0 HB ILE A 36 -20.538 24.388 -1.033 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.478 24.427 -1.162 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.524 23.454 -2.177 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.603 26.628 -0.483 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -20.337 25.844 0.936 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -18.567 25.881 0.757 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -17.683 25.402 -3.398 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -19.450 25.504 -3.210 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -18.387 26.491 -2.179 1.00 0.00 H new ATOM 553 N ASN A 37 -21.743 22.835 1.148 1.00 0.00 N ATOM 554 CA ASN A 37 -22.925 22.796 2.041 1.00 0.00 C ATOM 555 C ASN A 37 -22.676 21.905 3.286 1.00 0.00 C ATOM 556 O ASN A 37 -23.182 22.201 4.369 1.00 0.00 O ATOM 557 CB ASN A 37 -24.152 22.272 1.240 1.00 0.00 C ATOM 558 CG ASN A 37 -25.463 22.183 2.047 1.00 0.00 C ATOM 559 OD1 ASN A 37 -25.742 23.006 2.921 1.00 0.00 O ATOM 560 ND2 ASN A 37 -26.277 21.172 1.758 1.00 0.00 N ATOM 0 H ASN A 37 -21.938 22.492 0.207 1.00 0.00 H new ATOM 0 HA ASN A 37 -23.119 23.807 2.400 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -24.314 22.925 0.382 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -23.916 21.283 0.847 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -27.156 21.064 2.264 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -26.023 20.504 1.030 1.00 0.00 H new ATOM 567 N LYS A 38 -21.864 20.832 3.121 1.00 0.00 N ATOM 568 CA LYS A 38 -21.633 19.822 4.187 1.00 0.00 C ATOM 569 C LYS A 38 -20.704 20.379 5.296 1.00 0.00 C ATOM 570 O LYS A 38 -20.721 19.880 6.426 1.00 0.00 O ATOM 571 CB LYS A 38 -21.041 18.500 3.577 1.00 0.00 C ATOM 572 CG LYS A 38 -19.484 18.396 3.556 1.00 0.00 C ATOM 573 CD LYS A 38 -18.941 17.327 2.578 1.00 0.00 C ATOM 574 CE LYS A 38 -19.544 15.929 2.779 1.00 0.00 C ATOM 575 NZ LYS A 38 -19.036 14.972 1.759 1.00 0.00 N ATOM 0 H LYS A 38 -21.356 20.642 2.257 1.00 0.00 H new ATOM 0 HA LYS A 38 -22.595 19.590 4.644 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -21.435 17.655 4.141 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -21.406 18.399 2.555 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -19.068 19.367 3.285 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -19.131 18.167 4.562 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -19.137 17.652 1.556 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -17.859 17.264 2.690 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -19.300 15.565 3.777 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -20.631 15.987 2.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -19.708 14.185 1.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.932 15.460 0.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -18.112 14.601 2.060 1.00 0.00 H new ATOM 589 N LEU A 39 -19.914 21.421 4.956 1.00 0.00 N ATOM 590 CA LEU A 39 -18.888 21.998 5.855 1.00 0.00 C ATOM 591 C LEU A 39 -19.541 22.719 7.064 1.00 0.00 C ATOM 592 O LEU A 39 -20.502 23.461 6.865 1.00 0.00 O ATOM 593 CB LEU A 39 -17.974 22.982 5.067 1.00 0.00 C ATOM 594 CG LEU A 39 -17.285 22.385 3.793 1.00 0.00 C ATOM 595 CD1 LEU A 39 -16.415 23.435 3.067 1.00 0.00 C ATOM 596 CD2 LEU A 39 -16.465 21.109 4.126 1.00 0.00 C ATOM 0 H LEU A 39 -19.969 21.887 4.050 1.00 0.00 H new ATOM 0 HA LEU A 39 -18.279 21.180 6.241 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -18.570 23.844 4.767 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -17.199 23.349 5.740 1.00 0.00 H new ATOM 0 HG LEU A 39 -18.083 22.092 3.110 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -15.955 22.982 2.189 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -17.039 24.273 2.757 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -15.637 23.792 3.742 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -16.003 20.726 3.216 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.689 21.354 4.851 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -17.126 20.350 4.544 1.00 0.00 H new ATOM 608 N PRO A 40 -19.027 22.504 8.330 1.00 0.00 N ATOM 609 CA PRO A 40 -19.582 23.143 9.562 1.00 0.00 C ATOM 610 C PRO A 40 -19.592 24.681 9.464 1.00 0.00 C ATOM 611 O PRO A 40 -18.652 25.248 8.917 1.00 0.00 O ATOM 612 CB PRO A 40 -18.626 22.664 10.690 1.00 0.00 C ATOM 613 CG PRO A 40 -18.034 21.397 10.154 1.00 0.00 C ATOM 614 CD PRO A 40 -17.871 21.628 8.665 1.00 0.00 C ATOM 0 HA PRO A 40 -20.622 22.865 9.734 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -17.856 23.406 10.901 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -19.164 22.489 11.621 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -17.075 21.181 10.625 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -18.685 20.545 10.351 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -16.921 22.109 8.433 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -17.899 20.692 8.107 1.00 0.00 H new ATOM 622 N GLY A 41 -20.645 25.314 10.022 1.00 0.00 N ATOM 623 CA GLY A 41 -20.920 26.753 9.867 1.00 0.00 C ATOM 624 C GLY A 41 -19.766 27.682 10.250 1.00 0.00 C ATOM 625 O GLY A 41 -19.559 28.718 9.596 1.00 0.00 O ATOM 0 H GLY A 41 -21.335 24.832 10.599 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -21.191 26.945 8.829 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -21.788 27.008 10.475 1.00 0.00 H new ATOM 629 N GLU A 42 -19.009 27.295 11.295 1.00 0.00 N ATOM 630 CA GLU A 42 -17.841 28.069 11.786 1.00 0.00 C ATOM 631 C GLU A 42 -16.701 28.101 10.745 1.00 0.00 C ATOM 632 O GLU A 42 -15.927 29.063 10.675 1.00 0.00 O ATOM 633 CB GLU A 42 -17.369 27.498 13.166 1.00 0.00 C ATOM 634 CG GLU A 42 -16.844 26.032 13.187 1.00 0.00 C ATOM 635 CD GLU A 42 -15.366 25.860 12.760 1.00 0.00 C ATOM 636 OE1 GLU A 42 -15.038 24.895 12.045 1.00 0.00 O ATOM 637 OE2 GLU A 42 -14.522 26.694 13.149 1.00 0.00 O ATOM 0 H GLU A 42 -19.185 26.441 11.824 1.00 0.00 H new ATOM 0 HA GLU A 42 -18.144 29.105 11.934 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.579 28.145 13.547 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -18.203 27.568 13.864 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.964 25.633 14.194 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -17.469 25.429 12.529 1.00 0.00 H new ATOM 644 N LYS A 43 -16.619 27.024 9.947 1.00 0.00 N ATOM 645 CA LYS A 43 -15.641 26.884 8.853 1.00 0.00 C ATOM 646 C LYS A 43 -16.254 27.332 7.520 1.00 0.00 C ATOM 647 O LYS A 43 -15.538 27.783 6.642 1.00 0.00 O ATOM 648 CB LYS A 43 -15.169 25.405 8.763 1.00 0.00 C ATOM 649 CG LYS A 43 -14.176 25.101 7.611 1.00 0.00 C ATOM 650 CD LYS A 43 -13.552 23.683 7.682 1.00 0.00 C ATOM 651 CE LYS A 43 -12.414 23.552 8.725 1.00 0.00 C ATOM 652 NZ LYS A 43 -12.881 23.661 10.132 1.00 0.00 N ATOM 0 H LYS A 43 -17.236 26.217 10.043 1.00 0.00 H new ATOM 0 HA LYS A 43 -14.782 27.522 9.062 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -14.700 25.131 9.708 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -16.045 24.767 8.645 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -14.694 25.213 6.658 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -13.376 25.841 7.628 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -14.335 22.963 7.920 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.163 23.418 6.699 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.917 22.591 8.589 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -11.669 24.326 8.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.262 23.096 10.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -12.852 24.657 10.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -13.856 23.307 10.202 1.00 0.00 H new ATOM 666 N LEU A 44 -17.587 27.235 7.405 1.00 0.00 N ATOM 667 CA LEU A 44 -18.310 27.449 6.142 1.00 0.00 C ATOM 668 C LEU A 44 -18.165 28.899 5.671 1.00 0.00 C ATOM 669 O LEU A 44 -17.800 29.137 4.522 1.00 0.00 O ATOM 670 CB LEU A 44 -19.800 27.043 6.300 1.00 0.00 C ATOM 671 CG LEU A 44 -20.725 27.261 5.059 1.00 0.00 C ATOM 672 CD1 LEU A 44 -20.166 26.563 3.799 1.00 0.00 C ATOM 673 CD2 LEU A 44 -22.172 26.798 5.356 1.00 0.00 C ATOM 0 H LEU A 44 -18.197 27.005 8.189 1.00 0.00 H new ATOM 0 HA LEU A 44 -17.870 26.813 5.373 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -19.838 25.988 6.571 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -20.218 27.602 7.137 1.00 0.00 H new ATOM 0 HG LEU A 44 -20.748 28.331 4.854 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -20.837 26.738 2.958 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -19.180 26.966 3.567 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -20.086 25.492 3.982 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -22.794 26.961 4.476 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -22.170 25.737 5.608 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -22.572 27.369 6.194 1.00 0.00 H new ATOM 685 N GLY A 45 -18.412 29.852 6.586 1.00 0.00 N ATOM 686 CA GLY A 45 -18.244 31.280 6.292 1.00 0.00 C ATOM 687 C GLY A 45 -16.785 31.684 6.093 1.00 0.00 C ATOM 688 O GLY A 45 -16.513 32.719 5.498 1.00 0.00 O ATOM 0 H GLY A 45 -18.729 29.656 7.535 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -18.809 31.529 5.394 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -18.669 31.865 7.108 1.00 0.00 H new ATOM 692 N ARG A 46 -15.857 30.845 6.597 1.00 0.00 N ATOM 693 CA ARG A 46 -14.395 31.005 6.424 1.00 0.00 C ATOM 694 C ARG A 46 -13.972 30.532 5.008 1.00 0.00 C ATOM 695 O ARG A 46 -13.045 31.086 4.398 1.00 0.00 O ATOM 696 CB ARG A 46 -13.694 30.194 7.553 1.00 0.00 C ATOM 697 CG ARG A 46 -12.146 30.192 7.562 1.00 0.00 C ATOM 698 CD ARG A 46 -11.603 29.334 8.724 1.00 0.00 C ATOM 699 NE ARG A 46 -10.136 29.281 8.777 1.00 0.00 N ATOM 700 CZ ARG A 46 -9.416 28.977 9.875 1.00 0.00 C ATOM 701 NH1 ARG A 46 -10.006 28.777 11.053 1.00 0.00 N ATOM 702 NH2 ARG A 46 -8.097 28.885 9.789 1.00 0.00 N ATOM 0 H ARG A 46 -16.105 30.022 7.146 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.099 32.051 6.503 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -14.037 30.582 8.512 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.033 29.160 7.488 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.773 29.805 6.614 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.778 31.214 7.656 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -11.979 29.733 9.666 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.992 28.320 8.629 1.00 0.00 H new ATOM 0 HE ARG A 46 -9.624 29.490 7.920 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -11.020 28.853 11.135 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.444 28.548 11.873 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -7.632 29.044 8.895 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -7.547 28.655 10.617 1.00 0.00 H new ATOM 716 N VAL A 47 -14.694 29.514 4.492 1.00 0.00 N ATOM 717 CA VAL A 47 -14.546 29.015 3.106 1.00 0.00 C ATOM 718 C VAL A 47 -15.152 30.031 2.124 1.00 0.00 C ATOM 719 O VAL A 47 -14.634 30.249 1.030 1.00 0.00 O ATOM 720 CB VAL A 47 -15.239 27.604 2.918 1.00 0.00 C ATOM 721 CG1 VAL A 47 -15.150 27.102 1.455 1.00 0.00 C ATOM 722 CG2 VAL A 47 -14.639 26.558 3.889 1.00 0.00 C ATOM 0 H VAL A 47 -15.401 29.011 5.029 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.482 28.893 2.902 1.00 0.00 H new ATOM 0 HB VAL A 47 -16.295 27.734 3.155 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -15.638 26.131 1.373 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -15.646 27.814 0.795 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.103 27.007 1.166 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.132 25.598 3.739 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -13.572 26.452 3.695 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -14.790 26.887 4.917 1.00 0.00 H new ATOM 732 N VAL A 48 -16.265 30.642 2.541 1.00 0.00 N ATOM 733 CA VAL A 48 -16.931 31.701 1.776 1.00 0.00 C ATOM 734 C VAL A 48 -16.112 33.008 1.867 1.00 0.00 C ATOM 735 O VAL A 48 -16.126 33.793 0.934 1.00 0.00 O ATOM 736 CB VAL A 48 -18.419 31.925 2.274 1.00 0.00 C ATOM 737 CG1 VAL A 48 -19.110 33.107 1.549 1.00 0.00 C ATOM 738 CG2 VAL A 48 -19.259 30.629 2.114 1.00 0.00 C ATOM 0 H VAL A 48 -16.730 30.416 3.420 1.00 0.00 H new ATOM 0 HA VAL A 48 -16.984 31.392 0.732 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.361 32.180 3.332 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.127 33.220 1.925 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -18.551 34.024 1.734 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -19.139 32.910 0.477 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -20.276 30.809 2.463 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.282 30.337 1.064 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -18.810 29.829 2.703 1.00 0.00 H new ATOM 748 N HIS A 49 -15.355 33.201 2.974 1.00 0.00 N ATOM 749 CA HIS A 49 -14.620 34.465 3.233 1.00 0.00 C ATOM 750 C HIS A 49 -13.488 34.709 2.213 1.00 0.00 C ATOM 751 O HIS A 49 -13.179 35.861 1.898 1.00 0.00 O ATOM 752 CB HIS A 49 -14.059 34.523 4.678 1.00 0.00 C ATOM 753 CG HIS A 49 -13.565 35.899 5.066 1.00 0.00 C ATOM 754 ND1 HIS A 49 -12.302 36.171 5.547 1.00 0.00 N ATOM 755 CD2 HIS A 49 -14.210 37.100 5.026 1.00 0.00 C ATOM 756 CE1 HIS A 49 -12.217 37.486 5.765 1.00 0.00 C ATOM 757 NE2 HIS A 49 -13.347 38.097 5.467 1.00 0.00 N ATOM 0 H HIS A 49 -15.237 32.497 3.703 1.00 0.00 H new ATOM 0 HA HIS A 49 -15.352 35.264 3.116 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -14.836 34.212 5.376 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -13.241 33.809 4.773 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -15.229 37.252 4.703 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -11.335 37.985 6.138 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -13.547 39.094 5.544 1.00 0.00 H new ATOM 765 N ILE A 50 -12.878 33.618 1.694 1.00 0.00 N ATOM 766 CA ILE A 50 -11.856 33.718 0.623 1.00 0.00 C ATOM 767 C ILE A 50 -12.513 34.205 -0.688 1.00 0.00 C ATOM 768 O ILE A 50 -11.874 34.874 -1.498 1.00 0.00 O ATOM 769 CB ILE A 50 -11.075 32.361 0.381 1.00 0.00 C ATOM 770 CG1 ILE A 50 -11.983 31.277 -0.299 1.00 0.00 C ATOM 771 CG2 ILE A 50 -10.474 31.833 1.717 1.00 0.00 C ATOM 772 CD1 ILE A 50 -11.276 30.001 -0.711 1.00 0.00 C ATOM 0 H ILE A 50 -13.073 32.664 1.996 1.00 0.00 H new ATOM 0 HA ILE A 50 -11.115 34.444 0.956 1.00 0.00 H new ATOM 0 HB ILE A 50 -10.256 32.568 -0.308 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.789 31.020 0.388 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.446 31.717 -1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -9.941 30.900 1.533 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -9.783 32.572 2.122 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.277 31.657 2.433 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -11.993 29.320 -1.170 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.489 30.236 -1.427 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -10.838 29.528 0.168 1.00 0.00 H new ATOM 784 N ILE A 51 -13.802 33.849 -0.863 1.00 0.00 N ATOM 785 CA ILE A 51 -14.628 34.273 -2.008 1.00 0.00 C ATOM 786 C ILE A 51 -15.080 35.746 -1.820 1.00 0.00 C ATOM 787 O ILE A 51 -15.181 36.482 -2.788 1.00 0.00 O ATOM 788 CB ILE A 51 -15.886 33.322 -2.177 1.00 0.00 C ATOM 789 CG1 ILE A 51 -15.427 31.825 -2.319 1.00 0.00 C ATOM 790 CG2 ILE A 51 -16.791 33.742 -3.367 1.00 0.00 C ATOM 791 CD1 ILE A 51 -16.560 30.808 -2.381 1.00 0.00 C ATOM 0 H ILE A 51 -14.303 33.252 -0.205 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.027 34.202 -2.915 1.00 0.00 H new ATOM 0 HB ILE A 51 -16.490 33.421 -1.275 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -14.823 31.730 -3.222 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -14.782 31.577 -1.476 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.637 33.059 -3.439 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -17.156 34.756 -3.206 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -16.216 33.706 -4.292 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -16.144 29.805 -2.479 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -17.153 30.868 -1.468 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.195 31.023 -3.241 1.00 0.00 H new ATOM 803 N GLN A 52 -15.328 36.158 -0.552 1.00 0.00 N ATOM 804 CA GLN A 52 -15.687 37.562 -0.197 1.00 0.00 C ATOM 805 C GLN A 52 -14.486 38.493 -0.461 1.00 0.00 C ATOM 806 O GLN A 52 -14.638 39.650 -0.878 1.00 0.00 O ATOM 807 CB GLN A 52 -16.101 37.681 1.311 1.00 0.00 C ATOM 808 CG GLN A 52 -17.179 36.695 1.786 1.00 0.00 C ATOM 809 CD GLN A 52 -18.500 36.816 1.038 1.00 0.00 C ATOM 810 OE1 GLN A 52 -18.679 36.214 -0.012 1.00 0.00 O ATOM 811 NE2 GLN A 52 -19.442 37.564 1.591 1.00 0.00 N ATOM 0 H GLN A 52 -15.286 35.533 0.253 1.00 0.00 H new ATOM 0 HA GLN A 52 -16.534 37.855 -0.817 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -15.211 37.541 1.925 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -16.457 38.695 1.492 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -16.802 35.678 1.675 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -17.359 36.854 2.849 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -19.257 38.052 2.468 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -20.353 37.653 1.141 1.00 0.00 H new ATOM 820 N ALA A 53 -13.294 37.942 -0.202 1.00 0.00 N ATOM 821 CA ALA A 53 -12.022 38.651 -0.300 1.00 0.00 C ATOM 822 C ALA A 53 -11.597 38.797 -1.771 1.00 0.00 C ATOM 823 O ALA A 53 -11.300 39.902 -2.222 1.00 0.00 O ATOM 824 CB ALA A 53 -10.960 37.899 0.520 1.00 0.00 C ATOM 0 H ALA A 53 -13.190 36.970 0.087 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.131 39.656 0.107 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -10.007 38.424 0.450 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -11.273 37.851 1.563 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -10.846 36.888 0.128 1.00 0.00 H new ATOM 830 N ARG A 54 -11.599 37.666 -2.512 1.00 0.00 N ATOM 831 CA ARG A 54 -11.164 37.618 -3.932 1.00 0.00 C ATOM 832 C ARG A 54 -12.229 38.242 -4.853 1.00 0.00 C ATOM 833 O ARG A 54 -11.908 38.812 -5.904 1.00 0.00 O ATOM 834 CB ARG A 54 -10.855 36.152 -4.362 1.00 0.00 C ATOM 835 CG ARG A 54 -10.232 36.006 -5.775 1.00 0.00 C ATOM 836 CD ARG A 54 -8.884 36.745 -5.890 1.00 0.00 C ATOM 837 NE ARG A 54 -8.338 36.699 -7.256 1.00 0.00 N ATOM 838 CZ ARG A 54 -7.055 36.922 -7.585 1.00 0.00 C ATOM 839 NH1 ARG A 54 -6.145 37.134 -6.649 1.00 0.00 N ATOM 840 NH2 ARG A 54 -6.690 36.918 -8.857 1.00 0.00 N ATOM 0 H ARG A 54 -11.900 36.763 -2.147 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.249 38.203 -4.027 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -10.175 35.710 -3.633 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.779 35.575 -4.326 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.087 34.949 -6.000 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.925 36.398 -6.519 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.015 37.784 -5.588 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -8.168 36.300 -5.199 1.00 0.00 H new ATOM 0 HE ARG A 54 -8.986 36.480 -8.013 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -6.415 37.129 -5.665 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -5.174 37.302 -6.911 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -7.383 36.746 -9.586 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -5.716 37.087 -9.109 1.00 0.00 H new ATOM 854 N GLU A 55 -13.492 38.134 -4.435 1.00 0.00 N ATOM 855 CA GLU A 55 -14.639 38.685 -5.161 1.00 0.00 C ATOM 856 C GLU A 55 -15.418 39.619 -4.211 1.00 0.00 C ATOM 857 O GLU A 55 -16.335 39.170 -3.512 1.00 0.00 O ATOM 858 CB GLU A 55 -15.539 37.529 -5.750 1.00 0.00 C ATOM 859 CG GLU A 55 -15.682 37.539 -7.287 1.00 0.00 C ATOM 860 CD GLU A 55 -16.383 38.806 -7.810 1.00 0.00 C ATOM 861 OE1 GLU A 55 -17.613 38.779 -7.989 1.00 0.00 O ATOM 862 OE2 GLU A 55 -15.705 39.840 -8.036 1.00 0.00 O ATOM 0 H GLU A 55 -13.750 37.656 -3.572 1.00 0.00 H new ATOM 0 HA GLU A 55 -14.300 39.268 -6.017 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.120 36.570 -5.444 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -16.532 37.599 -5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.694 37.462 -7.740 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -16.246 36.661 -7.601 1.00 0.00 H new ATOM 869 N PRO A 56 -15.024 40.940 -4.133 1.00 0.00 N ATOM 870 CA PRO A 56 -15.689 41.935 -3.252 1.00 0.00 C ATOM 871 C PRO A 56 -17.179 42.169 -3.596 1.00 0.00 C ATOM 872 O PRO A 56 -17.939 42.637 -2.746 1.00 0.00 O ATOM 873 CB PRO A 56 -14.852 43.233 -3.461 1.00 0.00 C ATOM 874 CG PRO A 56 -13.536 42.749 -3.998 1.00 0.00 C ATOM 875 CD PRO A 56 -13.880 41.559 -4.863 1.00 0.00 C ATOM 0 HA PRO A 56 -15.712 41.592 -2.218 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -15.340 43.912 -4.160 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -14.723 43.777 -2.525 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -13.036 43.526 -4.576 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -12.860 42.468 -3.191 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -14.160 41.860 -5.873 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -13.040 40.871 -4.957 1.00 0.00 H new ATOM 883 N SER A 57 -17.573 41.818 -4.841 1.00 0.00 N ATOM 884 CA SER A 57 -18.970 41.914 -5.327 1.00 0.00 C ATOM 885 C SER A 57 -19.924 41.017 -4.500 1.00 0.00 C ATOM 886 O SER A 57 -21.128 41.268 -4.435 1.00 0.00 O ATOM 887 CB SER A 57 -19.034 41.499 -6.815 1.00 0.00 C ATOM 888 OG SER A 57 -18.006 42.108 -7.578 1.00 0.00 O ATOM 0 H SER A 57 -16.926 41.457 -5.543 1.00 0.00 H new ATOM 0 HA SER A 57 -19.293 42.949 -5.213 1.00 0.00 H new ATOM 0 HB2 SER A 57 -18.951 40.415 -6.894 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.004 41.775 -7.228 1.00 0.00 H new ATOM 0 HG SER A 57 -17.297 41.454 -7.752 1.00 0.00 H new ATOM 894 N LEU A 58 -19.352 39.960 -3.903 1.00 0.00 N ATOM 895 CA LEU A 58 -20.088 38.989 -3.076 1.00 0.00 C ATOM 896 C LEU A 58 -19.902 39.253 -1.576 1.00 0.00 C ATOM 897 O LEU A 58 -20.569 38.616 -0.772 1.00 0.00 O ATOM 898 CB LEU A 58 -19.618 37.553 -3.428 1.00 0.00 C ATOM 899 CG LEU A 58 -20.049 37.033 -4.835 1.00 0.00 C ATOM 900 CD1 LEU A 58 -19.394 35.682 -5.144 1.00 0.00 C ATOM 901 CD2 LEU A 58 -21.592 36.930 -4.946 1.00 0.00 C ATOM 0 H LEU A 58 -18.356 39.753 -3.981 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.151 39.097 -3.293 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -18.530 37.519 -3.365 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -20.003 36.868 -2.673 1.00 0.00 H new ATOM 0 HG LEU A 58 -19.706 37.756 -5.575 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -19.710 35.341 -6.130 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -18.310 35.791 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -19.696 34.951 -4.394 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.862 36.565 -5.937 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -21.966 36.239 -4.191 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -22.035 37.914 -4.789 1.00 0.00 H new ATOM 913 N ARG A 59 -19.007 40.193 -1.213 1.00 0.00 N ATOM 914 CA ARG A 59 -18.660 40.471 0.201 1.00 0.00 C ATOM 915 C ARG A 59 -19.852 41.058 0.979 1.00 0.00 C ATOM 916 O ARG A 59 -20.091 40.697 2.144 1.00 0.00 O ATOM 917 CB ARG A 59 -17.432 41.408 0.298 1.00 0.00 C ATOM 918 CG ARG A 59 -16.909 41.631 1.738 1.00 0.00 C ATOM 919 CD ARG A 59 -15.688 42.559 1.781 1.00 0.00 C ATOM 920 NE ARG A 59 -14.580 42.036 0.955 1.00 0.00 N ATOM 921 CZ ARG A 59 -13.678 42.786 0.310 1.00 0.00 C ATOM 922 NH1 ARG A 59 -13.729 44.114 0.372 1.00 0.00 N ATOM 923 NH2 ARG A 59 -12.736 42.198 -0.409 1.00 0.00 N ATOM 0 H ARG A 59 -18.507 40.778 -1.882 1.00 0.00 H new ATOM 0 HA ARG A 59 -18.404 39.517 0.662 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -16.626 40.994 -0.308 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -17.692 42.374 -0.134 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -17.706 42.055 2.349 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -16.647 40.669 2.179 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -15.971 43.550 1.427 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -15.352 42.673 2.812 1.00 0.00 H new ATOM 0 HE ARG A 59 -14.496 41.023 0.869 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -14.461 44.571 0.915 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -13.036 44.675 -0.124 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -12.701 41.180 -0.469 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -12.045 42.762 -0.903 1.00 0.00 H new ATOM 937 N ASP A 60 -20.590 41.958 0.312 1.00 0.00 N ATOM 938 CA ASP A 60 -21.800 42.594 0.870 1.00 0.00 C ATOM 939 C ASP A 60 -22.973 41.587 0.918 1.00 0.00 C ATOM 940 O ASP A 60 -23.920 41.760 1.688 1.00 0.00 O ATOM 941 CB ASP A 60 -22.186 43.841 0.032 1.00 0.00 C ATOM 942 CG ASP A 60 -22.692 43.493 -1.381 1.00 0.00 C ATOM 943 OD1 ASP A 60 -21.911 42.932 -2.177 1.00 0.00 O ATOM 944 OD2 ASP A 60 -23.860 43.773 -1.700 1.00 0.00 O ATOM 0 H ASP A 60 -20.366 42.268 -0.633 1.00 0.00 H new ATOM 0 HA ASP A 60 -21.584 42.913 1.890 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -22.959 44.400 0.560 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -21.319 44.497 -0.051 1.00 0.00 H new ATOM 949 N SER A 61 -22.893 40.549 0.060 1.00 0.00 N ATOM 950 CA SER A 61 -23.835 39.428 0.052 1.00 0.00 C ATOM 951 C SER A 61 -23.466 38.470 1.202 1.00 0.00 C ATOM 952 O SER A 61 -22.398 37.843 1.165 1.00 0.00 O ATOM 953 CB SER A 61 -23.789 38.716 -1.324 1.00 0.00 C ATOM 954 OG SER A 61 -24.781 37.713 -1.451 1.00 0.00 O ATOM 0 H SER A 61 -22.164 40.472 -0.650 1.00 0.00 H new ATOM 0 HA SER A 61 -24.855 39.780 0.204 1.00 0.00 H new ATOM 0 HB2 SER A 61 -23.920 39.454 -2.115 1.00 0.00 H new ATOM 0 HB3 SER A 61 -22.805 38.269 -1.465 1.00 0.00 H new ATOM 0 HG SER A 61 -24.712 37.295 -2.335 1.00 0.00 H new ATOM 960 N ASN A 62 -24.330 38.400 2.242 1.00 0.00 N ATOM 961 CA ASN A 62 -24.062 37.607 3.460 1.00 0.00 C ATOM 962 C ASN A 62 -23.876 36.100 3.124 1.00 0.00 C ATOM 963 O ASN A 62 -24.568 35.591 2.239 1.00 0.00 O ATOM 964 CB ASN A 62 -25.196 37.808 4.512 1.00 0.00 C ATOM 965 CG ASN A 62 -26.547 37.206 4.104 1.00 0.00 C ATOM 966 OD1 ASN A 62 -26.819 36.038 4.369 1.00 0.00 O ATOM 967 ND2 ASN A 62 -27.411 37.992 3.484 1.00 0.00 N ATOM 0 H ASN A 62 -25.225 38.889 2.259 1.00 0.00 H new ATOM 0 HA ASN A 62 -23.128 37.966 3.893 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -24.883 37.363 5.456 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -25.326 38.875 4.690 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -28.326 37.632 3.215 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -27.162 38.959 3.275 1.00 0.00 H new ATOM 974 N PRO A 63 -22.944 35.366 3.835 1.00 0.00 N ATOM 975 CA PRO A 63 -22.588 33.957 3.494 1.00 0.00 C ATOM 976 C PRO A 63 -23.771 32.969 3.603 1.00 0.00 C ATOM 977 O PRO A 63 -23.718 31.875 3.030 1.00 0.00 O ATOM 978 CB PRO A 63 -21.462 33.612 4.515 1.00 0.00 C ATOM 979 CG PRO A 63 -21.695 34.555 5.656 1.00 0.00 C ATOM 980 CD PRO A 63 -22.166 35.841 5.019 1.00 0.00 C ATOM 0 HA PRO A 63 -22.280 33.866 2.452 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.523 32.573 4.839 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.473 33.752 4.079 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -22.441 34.161 6.346 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -20.782 34.712 6.230 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -22.785 36.425 5.700 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -21.330 36.475 4.724 1.00 0.00 H new ATOM 988 N GLU A 64 -24.831 33.371 4.336 1.00 0.00 N ATOM 989 CA GLU A 64 -26.033 32.544 4.532 1.00 0.00 C ATOM 990 C GLU A 64 -26.912 32.553 3.271 1.00 0.00 C ATOM 991 O GLU A 64 -27.530 31.545 2.929 1.00 0.00 O ATOM 992 CB GLU A 64 -26.840 33.057 5.760 1.00 0.00 C ATOM 993 CG GLU A 64 -26.009 33.217 7.051 1.00 0.00 C ATOM 994 CD GLU A 64 -25.281 31.929 7.471 1.00 0.00 C ATOM 995 OE1 GLU A 64 -24.035 31.844 7.333 1.00 0.00 O ATOM 996 OE2 GLU A 64 -25.950 30.980 7.931 1.00 0.00 O ATOM 0 H GLU A 64 -24.874 34.275 4.806 1.00 0.00 H new ATOM 0 HA GLU A 64 -25.720 31.517 4.720 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -27.287 34.019 5.509 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -27.660 32.366 5.954 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -25.275 34.010 6.906 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -26.666 33.535 7.860 1.00 0.00 H new ATOM 1003 N GLU A 65 -26.948 33.712 2.585 1.00 0.00 N ATOM 1004 CA GLU A 65 -27.824 33.950 1.413 1.00 0.00 C ATOM 1005 C GLU A 65 -26.999 34.358 0.180 1.00 0.00 C ATOM 1006 O GLU A 65 -27.541 34.958 -0.763 1.00 0.00 O ATOM 1007 CB GLU A 65 -28.863 35.054 1.762 1.00 0.00 C ATOM 1008 CG GLU A 65 -29.752 34.739 2.983 1.00 0.00 C ATOM 1009 CD GLU A 65 -30.729 35.878 3.321 1.00 0.00 C ATOM 1010 OE1 GLU A 65 -30.293 36.868 3.946 1.00 0.00 O ATOM 1011 OE2 GLU A 65 -31.918 35.802 2.943 1.00 0.00 O ATOM 0 H GLU A 65 -26.368 34.516 2.827 1.00 0.00 H new ATOM 0 HA GLU A 65 -28.346 33.024 1.170 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -28.332 35.988 1.947 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -29.504 35.218 0.896 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -30.317 33.828 2.789 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -29.117 34.543 3.847 1.00 0.00 H new ATOM 1018 N ILE A 66 -25.696 34.008 0.171 1.00 0.00 N ATOM 1019 CA ILE A 66 -24.790 34.363 -0.937 1.00 0.00 C ATOM 1020 C ILE A 66 -25.124 33.551 -2.210 1.00 0.00 C ATOM 1021 O ILE A 66 -25.336 32.337 -2.148 1.00 0.00 O ATOM 1022 CB ILE A 66 -23.266 34.185 -0.549 1.00 0.00 C ATOM 1023 CG1 ILE A 66 -22.338 34.694 -1.703 1.00 0.00 C ATOM 1024 CG2 ILE A 66 -22.931 32.712 -0.164 1.00 0.00 C ATOM 1025 CD1 ILE A 66 -20.854 34.548 -1.446 1.00 0.00 C ATOM 0 H ILE A 66 -25.249 33.479 0.920 1.00 0.00 H new ATOM 0 HA ILE A 66 -24.950 35.421 -1.146 1.00 0.00 H new ATOM 0 HB ILE A 66 -23.079 34.795 0.335 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -22.588 34.152 -2.615 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -22.557 35.746 -1.887 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -21.875 32.635 0.095 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -23.537 32.412 0.691 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -23.146 32.057 -1.009 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -20.297 34.928 -2.302 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -20.581 35.114 -0.556 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -20.613 33.496 -1.295 1.00 0.00 H new ATOM 1037 N GLU A 67 -25.206 34.247 -3.354 1.00 0.00 N ATOM 1038 CA GLU A 67 -25.395 33.608 -4.668 1.00 0.00 C ATOM 1039 C GLU A 67 -24.013 33.324 -5.301 1.00 0.00 C ATOM 1040 O GLU A 67 -23.387 34.183 -5.942 1.00 0.00 O ATOM 1041 CB GLU A 67 -26.302 34.489 -5.580 1.00 0.00 C ATOM 1042 CG GLU A 67 -25.875 35.967 -5.658 1.00 0.00 C ATOM 1043 CD GLU A 67 -26.783 36.834 -6.547 1.00 0.00 C ATOM 1044 OE1 GLU A 67 -26.539 36.912 -7.772 1.00 0.00 O ATOM 1045 OE2 GLU A 67 -27.755 37.429 -6.034 1.00 0.00 O ATOM 0 H GLU A 67 -25.144 35.264 -3.396 1.00 0.00 H new ATOM 0 HA GLU A 67 -25.910 32.655 -4.548 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -26.303 34.069 -6.586 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -27.327 34.438 -5.212 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -25.863 36.385 -4.651 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -24.854 36.020 -6.037 1.00 0.00 H new ATOM 1052 N ILE A 68 -23.524 32.098 -5.077 1.00 0.00 N ATOM 1053 CA ILE A 68 -22.257 31.616 -5.659 1.00 0.00 C ATOM 1054 C ILE A 68 -22.547 30.894 -6.987 1.00 0.00 C ATOM 1055 O ILE A 68 -22.776 29.677 -7.038 1.00 0.00 O ATOM 1056 CB ILE A 68 -21.427 30.693 -4.660 1.00 0.00 C ATOM 1057 CG1 ILE A 68 -22.332 29.604 -3.981 1.00 0.00 C ATOM 1058 CG2 ILE A 68 -20.696 31.552 -3.595 1.00 0.00 C ATOM 1059 CD1 ILE A 68 -21.598 28.611 -3.089 1.00 0.00 C ATOM 0 H ILE A 68 -23.992 31.410 -4.488 1.00 0.00 H new ATOM 0 HA ILE A 68 -21.625 32.483 -5.850 1.00 0.00 H new ATOM 0 HB ILE A 68 -20.677 30.166 -5.250 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -23.094 30.108 -3.386 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -22.853 29.050 -4.762 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -20.136 30.901 -2.924 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -20.010 32.239 -4.090 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -21.428 32.121 -3.021 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -22.312 27.902 -2.669 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -20.856 28.072 -3.678 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -21.100 29.147 -2.281 1.00 0.00 H new ATOM 1071 N ASP A 69 -22.568 31.687 -8.063 1.00 0.00 N ATOM 1072 CA ASP A 69 -22.756 31.187 -9.430 1.00 0.00 C ATOM 1073 C ASP A 69 -21.377 31.071 -10.098 1.00 0.00 C ATOM 1074 O ASP A 69 -20.652 32.057 -10.166 1.00 0.00 O ATOM 1075 CB ASP A 69 -23.686 32.134 -10.234 1.00 0.00 C ATOM 1076 CG ASP A 69 -23.882 31.659 -11.681 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -24.733 30.775 -11.907 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -23.174 32.139 -12.588 1.00 0.00 O ATOM 0 H ASP A 69 -22.455 32.699 -8.011 1.00 0.00 H new ATOM 0 HA ASP A 69 -23.233 30.207 -9.406 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -24.655 32.196 -9.739 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -23.264 33.139 -10.237 1.00 0.00 H new ATOM 1083 N PHE A 70 -21.048 29.885 -10.618 1.00 0.00 N ATOM 1084 CA PHE A 70 -19.680 29.544 -11.081 1.00 0.00 C ATOM 1085 C PHE A 70 -19.317 30.198 -12.434 1.00 0.00 C ATOM 1086 O PHE A 70 -18.166 30.105 -12.880 1.00 0.00 O ATOM 1087 CB PHE A 70 -19.526 28.002 -11.123 1.00 0.00 C ATOM 1088 CG PHE A 70 -19.859 27.350 -9.774 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -18.962 27.420 -8.705 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -21.082 26.701 -9.567 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -19.269 26.855 -7.480 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -21.382 26.135 -8.344 1.00 0.00 C ATOM 1093 CZ PHE A 70 -20.478 26.215 -7.299 1.00 0.00 C ATOM 0 H PHE A 70 -21.718 29.125 -10.734 1.00 0.00 H new ATOM 0 HA PHE A 70 -18.968 29.958 -10.366 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -20.180 27.594 -11.893 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -18.504 27.748 -11.405 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -18.015 27.923 -8.837 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -21.799 26.642 -10.373 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -18.562 26.915 -6.665 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -22.325 25.628 -8.202 1.00 0.00 H new ATOM 0 HZ PHE A 70 -20.719 25.776 -6.342 1.00 0.00 H new ATOM 1103 N GLU A 71 -20.302 30.862 -13.077 1.00 0.00 N ATOM 1104 CA GLU A 71 -20.067 31.654 -14.303 1.00 0.00 C ATOM 1105 C GLU A 71 -19.794 33.127 -13.939 1.00 0.00 C ATOM 1106 O GLU A 71 -19.061 33.826 -14.650 1.00 0.00 O ATOM 1107 CB GLU A 71 -21.276 31.541 -15.270 1.00 0.00 C ATOM 1108 CG GLU A 71 -21.662 30.090 -15.632 1.00 0.00 C ATOM 1109 CD GLU A 71 -22.740 29.999 -16.721 1.00 0.00 C ATOM 1110 OE1 GLU A 71 -23.938 30.120 -16.398 1.00 0.00 O ATOM 1111 OE2 GLU A 71 -22.391 29.817 -17.905 1.00 0.00 O ATOM 0 H GLU A 71 -21.273 30.864 -12.764 1.00 0.00 H new ATOM 0 HA GLU A 71 -19.190 31.254 -14.813 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -22.137 32.032 -14.817 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.046 32.084 -16.187 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -20.772 29.558 -15.967 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -22.018 29.582 -14.736 1.00 0.00 H new ATOM 1118 N THR A 72 -20.411 33.597 -12.833 1.00 0.00 N ATOM 1119 CA THR A 72 -20.141 34.939 -12.275 1.00 0.00 C ATOM 1120 C THR A 72 -18.852 34.923 -11.430 1.00 0.00 C ATOM 1121 O THR A 72 -18.249 35.970 -11.193 1.00 0.00 O ATOM 1122 CB THR A 72 -21.341 35.483 -11.418 1.00 0.00 C ATOM 1123 OG1 THR A 72 -21.590 34.651 -10.272 1.00 0.00 O ATOM 1124 CG2 THR A 72 -22.630 35.585 -12.244 1.00 0.00 C ATOM 0 H THR A 72 -21.103 33.063 -12.307 1.00 0.00 H new ATOM 0 HA THR A 72 -20.011 35.615 -13.121 1.00 0.00 H new ATOM 0 HB THR A 72 -21.051 36.480 -11.085 1.00 0.00 H new ATOM 0 HG1 THR A 72 -21.172 33.775 -10.407 1.00 0.00 H new ATOM 0 HG21 THR A 72 -23.436 35.965 -11.616 1.00 0.00 H new ATOM 0 HG22 THR A 72 -22.472 36.264 -13.082 1.00 0.00 H new ATOM 0 HG23 THR A 72 -22.899 34.599 -12.622 1.00 0.00 H new ATOM 1132 N LEU A 73 -18.444 33.717 -10.979 1.00 0.00 N ATOM 1133 CA LEU A 73 -17.180 33.514 -10.255 1.00 0.00 C ATOM 1134 C LEU A 73 -16.010 33.454 -11.244 1.00 0.00 C ATOM 1135 O LEU A 73 -16.122 32.865 -12.331 1.00 0.00 O ATOM 1136 CB LEU A 73 -17.233 32.223 -9.390 1.00 0.00 C ATOM 1137 CG LEU A 73 -18.206 32.257 -8.169 1.00 0.00 C ATOM 1138 CD1 LEU A 73 -18.245 30.899 -7.430 1.00 0.00 C ATOM 1139 CD2 LEU A 73 -17.840 33.403 -7.208 1.00 0.00 C ATOM 0 H LEU A 73 -18.984 32.861 -11.109 1.00 0.00 H new ATOM 0 HA LEU A 73 -17.029 34.359 -9.584 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -17.517 31.390 -10.033 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.228 32.014 -9.023 1.00 0.00 H new ATOM 0 HG LEU A 73 -19.209 32.444 -8.553 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -18.933 30.963 -6.587 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -18.582 30.121 -8.115 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -17.247 30.654 -7.066 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -18.532 33.406 -6.366 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -16.823 33.260 -6.842 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -17.906 34.355 -7.735 1.00 0.00 H new ATOM 1151 N LYS A 74 -14.898 34.077 -10.847 1.00 0.00 N ATOM 1152 CA LYS A 74 -13.674 34.177 -11.659 1.00 0.00 C ATOM 1153 C LYS A 74 -12.842 32.882 -11.537 1.00 0.00 C ATOM 1154 O LYS A 74 -12.923 32.223 -10.506 1.00 0.00 O ATOM 1155 CB LYS A 74 -12.878 35.415 -11.172 1.00 0.00 C ATOM 1156 CG LYS A 74 -13.647 36.748 -11.370 1.00 0.00 C ATOM 1157 CD LYS A 74 -13.046 37.923 -10.565 1.00 0.00 C ATOM 1158 CE LYS A 74 -13.806 39.244 -10.788 1.00 0.00 C ATOM 1159 NZ LYS A 74 -13.381 40.300 -9.833 1.00 0.00 N ATOM 0 H LYS A 74 -14.817 34.535 -9.939 1.00 0.00 H new ATOM 0 HA LYS A 74 -13.921 34.298 -12.714 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.639 35.294 -10.115 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.931 35.465 -11.709 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -13.649 37.005 -12.429 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -14.687 36.608 -11.074 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.059 37.675 -9.504 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -12.002 38.056 -10.849 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -13.640 39.590 -11.808 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -14.876 39.069 -10.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -13.356 41.219 -10.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -14.055 40.345 -9.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.433 40.077 -9.467 1.00 0.00 H new ATOM 1173 N PRO A 75 -12.043 32.486 -12.591 1.00 0.00 N ATOM 1174 CA PRO A 75 -11.190 31.259 -12.557 1.00 0.00 C ATOM 1175 C PRO A 75 -10.217 31.208 -11.355 1.00 0.00 C ATOM 1176 O PRO A 75 -9.814 30.118 -10.931 1.00 0.00 O ATOM 1177 CB PRO A 75 -10.423 31.302 -13.910 1.00 0.00 C ATOM 1178 CG PRO A 75 -10.588 32.706 -14.420 1.00 0.00 C ATOM 1179 CD PRO A 75 -11.928 33.172 -13.907 1.00 0.00 C ATOM 0 HA PRO A 75 -11.796 30.362 -12.430 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.370 31.056 -13.772 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.830 30.578 -14.615 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -9.786 33.350 -14.060 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -10.555 32.733 -15.509 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -11.964 34.256 -13.801 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -12.738 32.890 -14.580 1.00 0.00 H new ATOM 1187 N SER A 76 -9.836 32.394 -10.840 1.00 0.00 N ATOM 1188 CA SER A 76 -9.052 32.529 -9.600 1.00 0.00 C ATOM 1189 C SER A 76 -9.871 32.028 -8.395 1.00 0.00 C ATOM 1190 O SER A 76 -9.399 31.202 -7.610 1.00 0.00 O ATOM 1191 CB SER A 76 -8.642 34.005 -9.410 1.00 0.00 C ATOM 1192 OG SER A 76 -9.768 34.878 -9.482 1.00 0.00 O ATOM 0 H SER A 76 -10.065 33.287 -11.275 1.00 0.00 H new ATOM 0 HA SER A 76 -8.151 31.920 -9.672 1.00 0.00 H new ATOM 0 HB2 SER A 76 -8.150 34.125 -8.445 1.00 0.00 H new ATOM 0 HB3 SER A 76 -7.917 34.283 -10.175 1.00 0.00 H new ATOM 0 HG SER A 76 -9.485 35.749 -9.831 1.00 0.00 H new ATOM 1198 N THR A 77 -11.122 32.511 -8.301 1.00 0.00 N ATOM 1199 CA THR A 77 -12.055 32.111 -7.240 1.00 0.00 C ATOM 1200 C THR A 77 -12.342 30.591 -7.311 1.00 0.00 C ATOM 1201 O THR A 77 -12.377 29.931 -6.279 1.00 0.00 O ATOM 1202 CB THR A 77 -13.393 32.920 -7.331 1.00 0.00 C ATOM 1203 OG1 THR A 77 -13.096 34.318 -7.510 1.00 0.00 O ATOM 1204 CG2 THR A 77 -14.274 32.738 -6.073 1.00 0.00 C ATOM 0 H THR A 77 -11.511 33.188 -8.958 1.00 0.00 H new ATOM 0 HA THR A 77 -11.586 32.334 -6.282 1.00 0.00 H new ATOM 0 HB THR A 77 -13.953 32.536 -8.184 1.00 0.00 H new ATOM 0 HG1 THR A 77 -13.932 34.825 -7.569 1.00 0.00 H new ATOM 0 HG21 THR A 77 -15.190 33.318 -6.183 1.00 0.00 H new ATOM 0 HG22 THR A 77 -14.524 31.684 -5.953 1.00 0.00 H new ATOM 0 HG23 THR A 77 -13.729 33.084 -5.194 1.00 0.00 H new ATOM 1212 N LEU A 78 -12.501 30.065 -8.552 1.00 0.00 N ATOM 1213 CA LEU A 78 -12.773 28.629 -8.822 1.00 0.00 C ATOM 1214 C LEU A 78 -11.640 27.728 -8.285 1.00 0.00 C ATOM 1215 O LEU A 78 -11.899 26.826 -7.480 1.00 0.00 O ATOM 1216 CB LEU A 78 -12.985 28.362 -10.360 1.00 0.00 C ATOM 1217 CG LEU A 78 -14.456 28.406 -10.900 1.00 0.00 C ATOM 1218 CD1 LEU A 78 -15.346 27.381 -10.166 1.00 0.00 C ATOM 1219 CD2 LEU A 78 -15.044 29.816 -10.827 1.00 0.00 C ATOM 0 H LEU A 78 -12.444 30.629 -9.400 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.694 28.378 -8.296 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.400 29.096 -10.914 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.569 27.382 -10.593 1.00 0.00 H new ATOM 0 HG LEU A 78 -14.428 28.127 -11.953 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.361 27.432 -10.560 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.948 26.378 -10.319 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -15.359 27.608 -9.100 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.064 29.805 -11.210 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.049 30.155 -9.791 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -14.438 30.494 -11.428 1.00 0.00 H new ATOM 1231 N ARG A 79 -10.392 28.004 -8.732 1.00 0.00 N ATOM 1232 CA ARG A 79 -9.207 27.160 -8.423 1.00 0.00 C ATOM 1233 C ARG A 79 -8.910 27.166 -6.905 1.00 0.00 C ATOM 1234 O ARG A 79 -8.429 26.163 -6.354 1.00 0.00 O ATOM 1235 CB ARG A 79 -7.963 27.621 -9.250 1.00 0.00 C ATOM 1236 CG ARG A 79 -7.342 28.962 -8.802 1.00 0.00 C ATOM 1237 CD ARG A 79 -6.225 29.476 -9.729 1.00 0.00 C ATOM 1238 NE ARG A 79 -6.750 29.946 -11.028 1.00 0.00 N ATOM 1239 CZ ARG A 79 -5.996 30.395 -12.049 1.00 0.00 C ATOM 1240 NH1 ARG A 79 -4.665 30.387 -11.986 1.00 0.00 N ATOM 1241 NH2 ARG A 79 -6.590 30.846 -13.143 1.00 0.00 N ATOM 0 H ARG A 79 -10.176 28.813 -9.314 1.00 0.00 H new ATOM 0 HA ARG A 79 -9.433 26.134 -8.713 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -7.199 26.846 -9.191 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -8.252 27.704 -10.298 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -8.129 29.714 -8.746 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -6.940 28.846 -7.795 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -5.694 30.291 -9.238 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -5.501 28.679 -9.899 1.00 0.00 H new ATOM 0 HE ARG A 79 -7.761 29.929 -11.161 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -4.196 30.035 -11.151 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -4.115 30.732 -12.773 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -7.608 30.851 -13.206 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -6.030 31.189 -13.923 1.00 0.00 H new ATOM 1255 N GLU A 80 -9.226 28.302 -6.248 1.00 0.00 N ATOM 1256 CA GLU A 80 -9.090 28.463 -4.796 1.00 0.00 C ATOM 1257 C GLU A 80 -10.150 27.637 -4.053 1.00 0.00 C ATOM 1258 O GLU A 80 -9.793 26.762 -3.267 1.00 0.00 O ATOM 1259 CB GLU A 80 -9.151 29.979 -4.393 1.00 0.00 C ATOM 1260 CG GLU A 80 -7.778 30.654 -4.147 1.00 0.00 C ATOM 1261 CD GLU A 80 -6.762 30.473 -5.296 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -5.876 29.594 -5.199 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -6.841 31.210 -6.292 1.00 0.00 O ATOM 0 H GLU A 80 -9.584 29.134 -6.718 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.112 28.084 -4.500 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -9.671 30.526 -5.179 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.751 30.074 -3.488 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -7.935 31.720 -3.982 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.347 30.250 -3.231 1.00 0.00 H new ATOM 1270 N LEU A 81 -11.447 27.889 -4.353 1.00 0.00 N ATOM 1271 CA LEU A 81 -12.574 27.341 -3.563 1.00 0.00 C ATOM 1272 C LEU A 81 -12.618 25.808 -3.624 1.00 0.00 C ATOM 1273 O LEU A 81 -12.882 25.173 -2.611 1.00 0.00 O ATOM 1274 CB LEU A 81 -13.956 27.994 -3.960 1.00 0.00 C ATOM 1275 CG LEU A 81 -14.560 27.718 -5.398 1.00 0.00 C ATOM 1276 CD1 LEU A 81 -15.337 26.372 -5.497 1.00 0.00 C ATOM 1277 CD2 LEU A 81 -15.468 28.886 -5.853 1.00 0.00 C ATOM 0 H LEU A 81 -11.738 28.470 -5.139 1.00 0.00 H new ATOM 0 HA LEU A 81 -12.394 27.613 -2.523 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -14.694 27.669 -3.227 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.852 29.073 -3.850 1.00 0.00 H new ATOM 0 HG LEU A 81 -13.703 27.639 -6.067 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -15.723 26.248 -6.509 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -14.666 25.546 -5.261 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -16.167 26.378 -4.790 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -15.869 28.670 -6.843 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -16.289 29.005 -5.146 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -14.885 29.807 -5.890 1.00 0.00 H new ATOM 1289 N GLU A 82 -12.322 25.218 -4.804 1.00 0.00 N ATOM 1290 CA GLU A 82 -12.432 23.758 -4.995 1.00 0.00 C ATOM 1291 C GLU A 82 -11.406 22.998 -4.136 1.00 0.00 C ATOM 1292 O GLU A 82 -11.747 22.010 -3.485 1.00 0.00 O ATOM 1293 CB GLU A 82 -12.283 23.380 -6.488 1.00 0.00 C ATOM 1294 CG GLU A 82 -10.924 23.742 -7.116 1.00 0.00 C ATOM 1295 CD GLU A 82 -10.788 23.257 -8.554 1.00 0.00 C ATOM 1296 OE1 GLU A 82 -10.189 22.187 -8.786 1.00 0.00 O ATOM 1297 OE2 GLU A 82 -11.328 23.912 -9.455 1.00 0.00 O ATOM 0 H GLU A 82 -12.008 25.727 -5.630 1.00 0.00 H new ATOM 0 HA GLU A 82 -13.427 23.460 -4.665 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -12.441 22.307 -6.594 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.072 23.876 -7.054 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -10.793 24.824 -7.089 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -10.125 23.309 -6.515 1.00 0.00 H new ATOM 1304 N ARG A 83 -10.152 23.496 -4.127 1.00 0.00 N ATOM 1305 CA ARG A 83 -9.035 22.850 -3.407 1.00 0.00 C ATOM 1306 C ARG A 83 -9.096 23.206 -1.909 1.00 0.00 C ATOM 1307 O ARG A 83 -8.622 22.441 -1.074 1.00 0.00 O ATOM 1308 CB ARG A 83 -7.661 23.224 -4.066 1.00 0.00 C ATOM 1309 CG ARG A 83 -6.516 22.168 -3.885 1.00 0.00 C ATOM 1310 CD ARG A 83 -5.776 22.258 -2.537 1.00 0.00 C ATOM 1311 NE ARG A 83 -4.827 21.133 -2.347 1.00 0.00 N ATOM 1312 CZ ARG A 83 -3.583 21.049 -2.859 1.00 0.00 C ATOM 1313 NH1 ARG A 83 -3.098 22.005 -3.637 1.00 0.00 N ATOM 1314 NH2 ARG A 83 -2.833 19.988 -2.596 1.00 0.00 N ATOM 0 H ARG A 83 -9.886 24.351 -4.615 1.00 0.00 H new ATOM 0 HA ARG A 83 -9.131 21.767 -3.485 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.820 23.382 -5.133 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -7.325 24.174 -3.650 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -6.940 21.169 -3.987 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.793 22.292 -4.692 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -5.234 23.202 -2.483 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -6.502 22.261 -1.724 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.146 20.350 -1.776 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.668 22.822 -3.857 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.154 21.925 -4.016 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.198 19.239 -2.008 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -1.891 19.921 -2.982 1.00 0.00 H new ATOM 1328 N TYR A 84 -9.707 24.363 -1.581 1.00 0.00 N ATOM 1329 CA TYR A 84 -9.927 24.796 -0.184 1.00 0.00 C ATOM 1330 C TYR A 84 -10.946 23.857 0.490 1.00 0.00 C ATOM 1331 O TYR A 84 -10.734 23.389 1.611 1.00 0.00 O ATOM 1332 CB TYR A 84 -10.420 26.271 -0.147 1.00 0.00 C ATOM 1333 CG TYR A 84 -10.311 26.970 1.228 1.00 0.00 C ATOM 1334 CD1 TYR A 84 -11.286 26.809 2.214 1.00 0.00 C ATOM 1335 CD2 TYR A 84 -9.230 27.807 1.533 1.00 0.00 C ATOM 1336 CE1 TYR A 84 -11.186 27.454 3.437 1.00 0.00 C ATOM 1337 CE2 TYR A 84 -9.132 28.446 2.753 1.00 0.00 C ATOM 1338 CZ TYR A 84 -10.112 28.265 3.700 1.00 0.00 C ATOM 1339 OH TYR A 84 -10.028 28.910 4.913 1.00 0.00 O ATOM 0 H TYR A 84 -10.061 25.022 -2.274 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.986 24.744 0.364 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.848 26.846 -0.875 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -11.461 26.297 -0.468 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -12.135 26.170 2.020 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.455 27.956 0.796 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -11.955 27.318 4.183 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -8.288 29.086 2.963 1.00 0.00 H new ATOM 0 HH TYR A 84 -9.207 29.445 4.943 1.00 0.00 H new ATOM 1349 N VAL A 85 -12.042 23.580 -0.233 1.00 0.00 N ATOM 1350 CA VAL A 85 -13.076 22.622 0.198 1.00 0.00 C ATOM 1351 C VAL A 85 -12.518 21.194 0.188 1.00 0.00 C ATOM 1352 O VAL A 85 -12.869 20.411 1.049 1.00 0.00 O ATOM 1353 CB VAL A 85 -14.372 22.713 -0.700 1.00 0.00 C ATOM 1354 CG1 VAL A 85 -15.432 21.633 -0.325 1.00 0.00 C ATOM 1355 CG2 VAL A 85 -14.982 24.128 -0.607 1.00 0.00 C ATOM 0 H VAL A 85 -12.238 24.014 -1.135 1.00 0.00 H new ATOM 0 HA VAL A 85 -13.363 22.885 1.216 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.071 22.516 -1.729 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.303 21.739 -0.971 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.002 20.640 -0.455 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -15.733 21.764 0.714 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.875 24.181 -1.230 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.248 24.342 0.428 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.254 24.862 -0.954 1.00 0.00 H new ATOM 1365 N LEU A 86 -11.620 20.890 -0.780 1.00 0.00 N ATOM 1366 CA LEU A 86 -10.939 19.570 -0.891 1.00 0.00 C ATOM 1367 C LEU A 86 -10.040 19.336 0.349 1.00 0.00 C ATOM 1368 O LEU A 86 -9.919 18.206 0.827 1.00 0.00 O ATOM 1369 CB LEU A 86 -10.133 19.505 -2.233 1.00 0.00 C ATOM 1370 CG LEU A 86 -9.649 18.095 -2.750 1.00 0.00 C ATOM 1371 CD1 LEU A 86 -9.336 18.144 -4.266 1.00 0.00 C ATOM 1372 CD2 LEU A 86 -8.415 17.560 -1.975 1.00 0.00 C ATOM 0 H LEU A 86 -11.345 21.550 -1.507 1.00 0.00 H new ATOM 0 HA LEU A 86 -11.676 18.768 -0.912 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.750 19.951 -3.013 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.253 20.138 -2.123 1.00 0.00 H new ATOM 0 HG LEU A 86 -10.472 17.403 -2.569 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.004 17.161 -4.601 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -10.234 18.430 -4.814 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.549 18.875 -4.452 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -8.128 16.587 -2.375 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -7.585 18.258 -2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -8.665 17.459 -0.919 1.00 0.00 H new ATOM 1384 N SER A 87 -9.447 20.428 0.868 1.00 0.00 N ATOM 1385 CA SER A 87 -8.639 20.412 2.104 1.00 0.00 C ATOM 1386 C SER A 87 -9.514 20.074 3.330 1.00 0.00 C ATOM 1387 O SER A 87 -9.047 19.446 4.274 1.00 0.00 O ATOM 1388 CB SER A 87 -7.951 21.779 2.303 1.00 0.00 C ATOM 1389 OG SER A 87 -7.102 22.096 1.214 1.00 0.00 O ATOM 0 H SER A 87 -9.515 21.351 0.440 1.00 0.00 H new ATOM 0 HA SER A 87 -7.877 19.639 2.006 1.00 0.00 H new ATOM 0 HB2 SER A 87 -8.708 22.556 2.414 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.371 21.765 3.226 1.00 0.00 H new ATOM 0 HG SER A 87 -7.642 22.232 0.407 1.00 0.00 H new ATOM 1395 N CYS A 88 -10.790 20.505 3.287 1.00 0.00 N ATOM 1396 CA CYS A 88 -11.779 20.251 4.356 1.00 0.00 C ATOM 1397 C CYS A 88 -12.512 18.903 4.132 1.00 0.00 C ATOM 1398 O CYS A 88 -13.015 18.294 5.080 1.00 0.00 O ATOM 1399 CB CYS A 88 -12.784 21.421 4.398 1.00 0.00 C ATOM 1400 SG CYS A 88 -12.013 23.038 4.641 1.00 0.00 S ATOM 0 H CYS A 88 -11.167 21.042 2.506 1.00 0.00 H new ATOM 0 HA CYS A 88 -11.261 20.182 5.313 1.00 0.00 H new ATOM 0 HB2 CYS A 88 -13.350 21.435 3.466 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -13.498 21.245 5.202 1.00 0.00 H new ATOM 0 HG CYS A 88 -11.420 23.405 3.544 1.00 0.00 H new ATOM 1406 N LEU A 89 -12.528 18.451 2.864 1.00 0.00 N ATOM 1407 CA LEU A 89 -13.225 17.230 2.417 1.00 0.00 C ATOM 1408 C LEU A 89 -12.407 16.011 2.859 1.00 0.00 C ATOM 1409 O LEU A 89 -12.957 15.057 3.402 1.00 0.00 O ATOM 1410 CB LEU A 89 -13.411 17.300 0.854 1.00 0.00 C ATOM 1411 CG LEU A 89 -14.405 16.297 0.146 1.00 0.00 C ATOM 1412 CD1 LEU A 89 -13.839 14.864 0.023 1.00 0.00 C ATOM 1413 CD2 LEU A 89 -15.781 16.303 0.842 1.00 0.00 C ATOM 0 H LEU A 89 -12.047 18.935 2.106 1.00 0.00 H new ATOM 0 HA LEU A 89 -14.215 17.144 2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.736 18.311 0.608 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -12.429 17.162 0.401 1.00 0.00 H new ATOM 0 HG LEU A 89 -14.533 16.656 -0.875 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.570 14.225 -0.472 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -12.920 14.885 -0.563 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -13.627 14.470 1.017 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -16.448 15.605 0.336 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.663 16.003 1.883 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -16.206 17.306 0.799 1.00 0.00 H new ATOM 1425 N ARG A 90 -11.079 16.110 2.615 1.00 0.00 N ATOM 1426 CA ARG A 90 -10.051 15.098 2.947 1.00 0.00 C ATOM 1427 C ARG A 90 -10.126 13.898 1.974 1.00 0.00 C ATOM 1428 O ARG A 90 -11.212 13.467 1.567 1.00 0.00 O ATOM 1429 CB ARG A 90 -10.132 14.642 4.439 1.00 0.00 C ATOM 1430 CG ARG A 90 -8.963 13.744 4.913 1.00 0.00 C ATOM 1431 CD ARG A 90 -9.020 13.441 6.423 1.00 0.00 C ATOM 1432 NE ARG A 90 -9.088 14.679 7.216 1.00 0.00 N ATOM 1433 CZ ARG A 90 -8.718 14.817 8.493 1.00 0.00 C ATOM 1434 NH1 ARG A 90 -8.210 13.803 9.184 1.00 0.00 N ATOM 1435 NH2 ARG A 90 -8.853 15.998 9.073 1.00 0.00 N ATOM 0 H ARG A 90 -10.679 16.932 2.162 1.00 0.00 H new ATOM 0 HA ARG A 90 -9.076 15.569 2.822 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -10.170 15.528 5.073 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -11.068 14.103 4.588 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -8.982 12.806 4.358 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -8.017 14.233 4.680 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.890 12.821 6.639 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.140 12.868 6.714 1.00 0.00 H new ATOM 0 HE ARG A 90 -9.451 15.509 6.747 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -8.094 12.891 8.741 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -7.936 13.936 10.157 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -9.234 16.784 8.547 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.576 16.123 10.047 1.00 0.00 H new ATOM 1724 N THR A 106 -23.137 -19.537 6.930 1.00 0.00 N ATOM 1725 CA THR A 106 -24.507 -19.569 7.465 1.00 0.00 C ATOM 1726 C THR A 106 -24.460 -19.824 8.979 1.00 0.00 C ATOM 1727 O THR A 106 -23.407 -20.171 9.530 1.00 0.00 O ATOM 1728 CB THR A 106 -25.366 -20.678 6.763 1.00 0.00 C ATOM 1729 OG1 THR A 106 -24.698 -21.944 6.836 1.00 0.00 O ATOM 1730 CG2 THR A 106 -25.654 -20.331 5.292 1.00 0.00 C ATOM 0 HA THR A 106 -24.976 -18.605 7.267 1.00 0.00 H new ATOM 0 HB THR A 106 -26.318 -20.735 7.290 1.00 0.00 H new ATOM 0 HG1 THR A 106 -23.728 -21.803 6.831 1.00 0.00 H new ATOM 0 HG21 THR A 106 -26.251 -21.124 4.841 1.00 0.00 H new ATOM 0 HG22 THR A 106 -26.202 -19.390 5.241 1.00 0.00 H new ATOM 0 HG23 THR A 106 -24.713 -20.233 4.750 1.00 0.00 H new ATOM 1738 N LYS A 107 -25.614 -19.660 9.641 1.00 0.00 N ATOM 1739 CA LYS A 107 -25.766 -19.924 11.091 1.00 0.00 C ATOM 1740 C LYS A 107 -25.688 -21.442 11.391 1.00 0.00 C ATOM 1741 O LYS A 107 -25.454 -21.854 12.534 1.00 0.00 O ATOM 1742 CB LYS A 107 -27.102 -19.316 11.584 1.00 0.00 C ATOM 1743 CG LYS A 107 -27.315 -19.363 13.120 1.00 0.00 C ATOM 1744 CD LYS A 107 -28.621 -18.668 13.558 1.00 0.00 C ATOM 1745 CE LYS A 107 -28.873 -18.785 15.067 1.00 0.00 C ATOM 1746 NZ LYS A 107 -30.142 -18.127 15.473 1.00 0.00 N ATOM 0 H LYS A 107 -26.472 -19.341 9.192 1.00 0.00 H new ATOM 0 HA LYS A 107 -24.945 -19.451 11.630 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -27.154 -18.278 11.256 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -27.924 -19.844 11.102 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -27.332 -20.402 13.449 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -26.470 -18.886 13.615 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -28.578 -17.615 13.281 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -29.460 -19.106 13.018 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -28.904 -19.838 15.349 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -28.042 -18.335 15.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -30.273 -18.230 16.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -30.103 -17.117 15.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -30.939 -18.573 14.976 1.00 0.00 H new ATOM 1760 N GLU A 108 -25.861 -22.258 10.330 1.00 0.00 N ATOM 1761 CA GLU A 108 -25.702 -23.726 10.376 1.00 0.00 C ATOM 1762 C GLU A 108 -24.278 -24.123 10.788 1.00 0.00 C ATOM 1763 O GLU A 108 -24.085 -25.165 11.404 1.00 0.00 O ATOM 1764 CB GLU A 108 -26.030 -24.337 8.992 1.00 0.00 C ATOM 1765 CG GLU A 108 -27.418 -23.957 8.449 1.00 0.00 C ATOM 1766 CD GLU A 108 -27.725 -24.622 7.102 1.00 0.00 C ATOM 1767 OE1 GLU A 108 -28.410 -25.667 7.090 1.00 0.00 O ATOM 1768 OE2 GLU A 108 -27.259 -24.116 6.059 1.00 0.00 O ATOM 0 H GLU A 108 -26.118 -21.911 9.406 1.00 0.00 H new ATOM 0 HA GLU A 108 -26.394 -24.113 11.123 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -25.272 -24.017 8.277 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -25.964 -25.423 9.062 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -28.179 -24.245 9.174 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -27.477 -22.874 8.338 1.00 0.00 H new ATOM 1775 N GLU A 109 -23.298 -23.273 10.420 1.00 0.00 N ATOM 1776 CA GLU A 109 -21.877 -23.433 10.800 1.00 0.00 C ATOM 1777 C GLU A 109 -21.720 -23.394 12.336 1.00 0.00 C ATOM 1778 O GLU A 109 -21.056 -24.248 12.934 1.00 0.00 O ATOM 1779 CB GLU A 109 -21.045 -22.311 10.120 1.00 0.00 C ATOM 1780 CG GLU A 109 -19.537 -22.282 10.461 1.00 0.00 C ATOM 1781 CD GLU A 109 -18.750 -21.318 9.552 1.00 0.00 C ATOM 1782 OE1 GLU A 109 -18.679 -20.106 9.851 1.00 0.00 O ATOM 1783 OE2 GLU A 109 -18.233 -21.767 8.503 1.00 0.00 O ATOM 0 H GLU A 109 -23.471 -22.448 9.845 1.00 0.00 H new ATOM 0 HA GLU A 109 -21.511 -24.402 10.460 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -21.151 -22.412 9.040 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -21.478 -21.349 10.394 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -19.408 -21.984 11.501 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -19.125 -23.287 10.364 1.00 0.00 H new ATOM 1790 N LEU A 110 -22.415 -22.423 12.947 1.00 0.00 N ATOM 1791 CA LEU A 110 -22.423 -22.209 14.405 1.00 0.00 C ATOM 1792 C LEU A 110 -23.134 -23.377 15.123 1.00 0.00 C ATOM 1793 O LEU A 110 -22.720 -23.809 16.207 1.00 0.00 O ATOM 1794 CB LEU A 110 -23.124 -20.857 14.717 1.00 0.00 C ATOM 1795 CG LEU A 110 -22.539 -19.598 13.985 1.00 0.00 C ATOM 1796 CD1 LEU A 110 -23.381 -18.329 14.282 1.00 0.00 C ATOM 1797 CD2 LEU A 110 -21.044 -19.378 14.345 1.00 0.00 C ATOM 0 H LEU A 110 -22.995 -21.756 12.438 1.00 0.00 H new ATOM 0 HA LEU A 110 -21.397 -22.173 14.772 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -24.178 -20.948 14.456 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -23.075 -20.684 15.792 1.00 0.00 H new ATOM 0 HG LEU A 110 -22.596 -19.788 12.913 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -22.949 -17.475 13.760 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -24.404 -18.483 13.940 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -23.382 -18.136 15.355 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -20.669 -18.498 13.822 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -20.947 -19.229 15.420 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -20.465 -20.252 14.046 1.00 0.00 H new ATOM 1809 N ALA A 111 -24.201 -23.882 14.476 1.00 0.00 N ATOM 1810 CA ALA A 111 -25.003 -25.021 14.969 1.00 0.00 C ATOM 1811 C ALA A 111 -24.271 -26.364 14.785 1.00 0.00 C ATOM 1812 O ALA A 111 -24.547 -27.330 15.501 1.00 0.00 O ATOM 1813 CB ALA A 111 -26.365 -25.042 14.256 1.00 0.00 C ATOM 0 H ALA A 111 -24.535 -23.508 13.588 1.00 0.00 H new ATOM 0 HA ALA A 111 -25.157 -24.887 16.040 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -26.954 -25.883 14.622 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -26.896 -24.112 14.458 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -26.212 -25.146 13.182 1.00 0.00 H new ATOM 1819 N LEU A 112 -23.341 -26.412 13.818 1.00 0.00 N ATOM 1820 CA LEU A 112 -22.550 -27.620 13.511 1.00 0.00 C ATOM 1821 C LEU A 112 -21.426 -27.813 14.554 1.00 0.00 C ATOM 1822 O LEU A 112 -21.040 -28.944 14.861 1.00 0.00 O ATOM 1823 CB LEU A 112 -21.976 -27.519 12.072 1.00 0.00 C ATOM 1824 CG LEU A 112 -21.241 -28.787 11.522 1.00 0.00 C ATOM 1825 CD1 LEU A 112 -22.192 -30.017 11.457 1.00 0.00 C ATOM 1826 CD2 LEU A 112 -20.592 -28.496 10.141 1.00 0.00 C ATOM 0 H LEU A 112 -23.114 -25.614 13.224 1.00 0.00 H new ATOM 0 HA LEU A 112 -23.198 -28.495 13.562 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -22.795 -27.279 11.394 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -21.280 -26.681 12.041 1.00 0.00 H new ATOM 0 HG LEU A 112 -20.442 -29.036 12.220 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -21.647 -30.878 11.071 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -22.565 -30.242 12.456 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -23.031 -29.794 10.799 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -20.087 -29.392 9.780 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -21.365 -28.203 9.430 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -19.868 -27.688 10.242 1.00 0.00 H new ATOM 1838 N GLU A 113 -20.925 -26.681 15.099 1.00 0.00 N ATOM 1839 CA GLU A 113 -19.939 -26.675 16.211 1.00 0.00 C ATOM 1840 C GLU A 113 -20.524 -27.313 17.497 1.00 0.00 C ATOM 1841 O GLU A 113 -19.769 -27.813 18.341 1.00 0.00 O ATOM 1842 CB GLU A 113 -19.451 -25.227 16.484 1.00 0.00 C ATOM 1843 CG GLU A 113 -18.701 -24.588 15.291 1.00 0.00 C ATOM 1844 CD GLU A 113 -18.250 -23.144 15.551 1.00 0.00 C ATOM 1845 OE1 GLU A 113 -19.038 -22.210 15.296 1.00 0.00 O ATOM 1846 OE2 GLU A 113 -17.108 -22.935 16.027 1.00 0.00 O ATOM 0 H GLU A 113 -21.190 -25.748 14.784 1.00 0.00 H new ATOM 0 HA GLU A 113 -19.086 -27.282 15.909 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -20.310 -24.605 16.737 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -18.794 -25.232 17.354 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -17.828 -25.196 15.054 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -19.348 -24.605 14.414 1.00 0.00 H new ATOM 1853 N LYS A 114 -21.873 -27.273 17.629 1.00 0.00 N ATOM 1854 CA LYS A 114 -22.597 -27.919 18.744 1.00 0.00 C ATOM 1855 C LYS A 114 -22.398 -29.450 18.690 1.00 0.00 C ATOM 1856 O LYS A 114 -22.247 -30.085 19.738 1.00 0.00 O ATOM 1857 CB LYS A 114 -24.114 -27.534 18.688 1.00 0.00 C ATOM 1858 CG LYS A 114 -25.012 -27.944 19.905 1.00 0.00 C ATOM 1859 CD LYS A 114 -25.389 -29.451 19.964 1.00 0.00 C ATOM 1860 CE LYS A 114 -26.357 -29.790 21.108 1.00 0.00 C ATOM 1861 NZ LYS A 114 -27.676 -29.141 20.923 1.00 0.00 N ATOM 0 H LYS A 114 -22.484 -26.794 16.967 1.00 0.00 H new ATOM 0 HA LYS A 114 -22.194 -27.565 19.693 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -24.182 -26.453 18.570 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -24.541 -27.980 17.790 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -24.493 -27.678 20.826 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -25.929 -27.356 19.875 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -25.841 -29.743 19.016 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -24.480 -30.042 20.079 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -26.488 -30.871 21.165 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -25.925 -29.471 22.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -28.351 -29.523 21.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -27.581 -28.115 21.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -28.023 -29.329 19.961 1.00 0.00 H new ATOM 1875 N LYS A 115 -22.406 -30.029 17.459 1.00 0.00 N ATOM 1876 CA LYS A 115 -22.271 -31.490 17.250 1.00 0.00 C ATOM 1877 C LYS A 115 -21.007 -32.048 17.939 1.00 0.00 C ATOM 1878 O LYS A 115 -21.051 -33.140 18.487 1.00 0.00 O ATOM 1879 CB LYS A 115 -22.264 -31.854 15.735 1.00 0.00 C ATOM 1880 CG LYS A 115 -21.980 -33.355 15.447 1.00 0.00 C ATOM 1881 CD LYS A 115 -21.896 -33.704 13.944 1.00 0.00 C ATOM 1882 CE LYS A 115 -21.407 -35.149 13.700 1.00 0.00 C ATOM 1883 NZ LYS A 115 -22.226 -36.157 14.432 1.00 0.00 N ATOM 0 H LYS A 115 -22.505 -29.499 16.593 1.00 0.00 H new ATOM 0 HA LYS A 115 -23.143 -31.956 17.709 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -23.229 -31.588 15.303 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -21.511 -31.249 15.230 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -21.042 -33.635 15.927 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -22.765 -33.957 15.905 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -22.878 -33.574 13.488 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -21.220 -33.006 13.449 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -21.439 -35.365 12.632 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -20.366 -35.235 14.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -21.880 -37.112 14.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -22.149 -35.990 15.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -23.221 -36.073 14.142 1.00 0.00 H new ATOM 1897 N ARG A 116 -19.910 -31.266 17.920 1.00 0.00 N ATOM 1898 CA ARG A 116 -18.631 -31.618 18.581 1.00 0.00 C ATOM 1899 C ARG A 116 -18.847 -31.965 20.077 1.00 0.00 C ATOM 1900 O ARG A 116 -18.323 -32.964 20.579 1.00 0.00 O ATOM 1901 CB ARG A 116 -17.650 -30.425 18.451 1.00 0.00 C ATOM 1902 CG ARG A 116 -16.234 -30.679 19.023 1.00 0.00 C ATOM 1903 CD ARG A 116 -15.393 -29.394 19.090 1.00 0.00 C ATOM 1904 NE ARG A 116 -15.964 -28.414 20.039 1.00 0.00 N ATOM 1905 CZ ARG A 116 -15.776 -27.081 19.995 1.00 0.00 C ATOM 1906 NH1 ARG A 116 -15.068 -26.519 19.031 1.00 0.00 N ATOM 1907 NH2 ARG A 116 -16.306 -26.309 20.928 1.00 0.00 N ATOM 0 H ARG A 116 -19.883 -30.365 17.443 1.00 0.00 H new ATOM 0 HA ARG A 116 -18.216 -32.499 18.092 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -17.558 -30.162 17.397 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -18.081 -29.562 18.958 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -16.319 -31.107 20.022 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -15.721 -31.415 18.404 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -14.375 -29.641 19.391 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -15.333 -28.947 18.098 1.00 0.00 H new ATOM 0 HE ARG A 116 -16.550 -28.778 20.790 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -14.651 -27.097 18.301 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -14.938 -25.507 19.017 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -16.857 -26.723 21.680 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -16.164 -25.299 20.896 1.00 0.00 H new ATOM 1921 N GLU A 117 -19.658 -31.121 20.747 1.00 0.00 N ATOM 1922 CA GLU A 117 -20.053 -31.289 22.167 1.00 0.00 C ATOM 1923 C GLU A 117 -20.945 -32.536 22.331 1.00 0.00 C ATOM 1924 O GLU A 117 -20.806 -33.271 23.311 1.00 0.00 O ATOM 1925 CB GLU A 117 -20.773 -29.983 22.655 1.00 0.00 C ATOM 1926 CG GLU A 117 -21.286 -29.960 24.133 1.00 0.00 C ATOM 1927 CD GLU A 117 -22.720 -30.511 24.309 1.00 0.00 C ATOM 1928 OE1 GLU A 117 -23.678 -29.846 23.867 1.00 0.00 O ATOM 1929 OE2 GLU A 117 -22.898 -31.601 24.896 1.00 0.00 O ATOM 0 H GLU A 117 -20.064 -30.291 20.314 1.00 0.00 H new ATOM 0 HA GLU A 117 -19.169 -31.446 22.786 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -20.085 -29.148 22.523 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -21.624 -29.801 21.999 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -20.605 -30.544 24.752 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -21.254 -28.935 24.502 1.00 0.00 H new ATOM 1936 N LEU A 118 -21.844 -32.761 21.349 1.00 0.00 N ATOM 1937 CA LEU A 118 -22.788 -33.899 21.350 1.00 0.00 C ATOM 1938 C LEU A 118 -22.040 -35.252 21.297 1.00 0.00 C ATOM 1939 O LEU A 118 -22.439 -36.211 21.964 1.00 0.00 O ATOM 1940 CB LEU A 118 -23.774 -33.788 20.159 1.00 0.00 C ATOM 1941 CG LEU A 118 -24.844 -34.929 20.049 1.00 0.00 C ATOM 1942 CD1 LEU A 118 -25.845 -34.886 21.236 1.00 0.00 C ATOM 1943 CD2 LEU A 118 -25.572 -34.880 18.685 1.00 0.00 C ATOM 0 H LEU A 118 -21.936 -32.157 20.532 1.00 0.00 H new ATOM 0 HA LEU A 118 -23.352 -33.860 22.282 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -24.295 -32.833 20.231 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -23.197 -33.767 19.235 1.00 0.00 H new ATOM 0 HG LEU A 118 -24.320 -35.883 20.107 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -26.572 -35.690 21.128 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -25.303 -35.010 22.174 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -26.363 -33.927 21.241 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -26.308 -35.682 18.636 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -26.075 -33.919 18.575 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -24.847 -35.004 17.881 1.00 0.00 H new ATOM 1955 N GLU A 119 -20.954 -35.312 20.494 1.00 0.00 N ATOM 1956 CA GLU A 119 -20.092 -36.511 20.382 1.00 0.00 C ATOM 1957 C GLU A 119 -19.493 -36.829 21.755 1.00 0.00 C ATOM 1958 O GLU A 119 -19.615 -37.950 22.260 1.00 0.00 O ATOM 1959 CB GLU A 119 -18.942 -36.295 19.353 1.00 0.00 C ATOM 1960 CG GLU A 119 -19.375 -35.756 17.979 1.00 0.00 C ATOM 1961 CD GLU A 119 -20.475 -36.582 17.292 1.00 0.00 C ATOM 1962 OE1 GLU A 119 -20.149 -37.596 16.630 1.00 0.00 O ATOM 1963 OE2 GLU A 119 -21.673 -36.214 17.386 1.00 0.00 O ATOM 0 H GLU A 119 -20.651 -34.534 19.908 1.00 0.00 H new ATOM 0 HA GLU A 119 -20.705 -37.341 20.032 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -18.218 -35.603 19.783 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -18.427 -37.244 19.206 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -19.728 -34.732 18.099 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -18.503 -35.719 17.325 1.00 0.00 H new ATOM 1970 N LYS A 120 -18.912 -35.779 22.361 1.00 0.00 N ATOM 1971 CA LYS A 120 -18.232 -35.848 23.661 1.00 0.00 C ATOM 1972 C LYS A 120 -19.199 -36.212 24.800 1.00 0.00 C ATOM 1973 O LYS A 120 -18.789 -36.858 25.764 1.00 0.00 O ATOM 1974 CB LYS A 120 -17.520 -34.492 23.955 1.00 0.00 C ATOM 1975 CG LYS A 120 -16.411 -34.074 22.940 1.00 0.00 C ATOM 1976 CD LYS A 120 -15.051 -34.824 23.109 1.00 0.00 C ATOM 1977 CE LYS A 120 -15.039 -36.270 22.590 1.00 0.00 C ATOM 1978 NZ LYS A 120 -13.763 -36.968 22.906 1.00 0.00 N ATOM 0 H LYS A 120 -18.903 -34.844 21.952 1.00 0.00 H new ATOM 0 HA LYS A 120 -17.489 -36.643 23.609 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -18.274 -33.706 23.984 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -17.076 -34.544 24.949 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -16.781 -34.245 21.929 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -16.234 -33.003 23.038 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -14.276 -34.261 22.590 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -14.786 -34.831 24.166 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -15.871 -36.820 23.030 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -15.193 -36.269 21.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -13.885 -37.992 22.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -13.013 -36.624 22.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -13.498 -36.777 23.893 1.00 0.00 H new ATOM 1992 N ARG A 121 -20.472 -35.810 24.652 1.00 0.00 N ATOM 1993 CA ARG A 121 -21.539 -36.044 25.649 1.00 0.00 C ATOM 1994 C ARG A 121 -21.764 -37.549 25.896 1.00 0.00 C ATOM 1995 O ARG A 121 -21.748 -38.013 27.044 1.00 0.00 O ATOM 1996 CB ARG A 121 -22.849 -35.378 25.151 1.00 0.00 C ATOM 1997 CG ARG A 121 -24.074 -35.546 26.074 1.00 0.00 C ATOM 1998 CD ARG A 121 -25.352 -34.956 25.466 1.00 0.00 C ATOM 1999 NE ARG A 121 -25.219 -33.518 25.182 1.00 0.00 N ATOM 2000 CZ ARG A 121 -26.242 -32.664 25.023 1.00 0.00 C ATOM 2001 NH1 ARG A 121 -27.497 -33.079 25.109 1.00 0.00 N ATOM 2002 NH2 ARG A 121 -26.000 -31.395 24.767 1.00 0.00 N ATOM 0 H ARG A 121 -20.797 -35.306 23.827 1.00 0.00 H new ATOM 0 HA ARG A 121 -21.234 -35.602 26.598 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -22.664 -34.313 25.012 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -23.095 -35.789 24.172 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -24.228 -36.605 26.279 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -23.874 -35.063 27.030 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -25.592 -35.486 24.544 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -26.185 -35.114 26.151 1.00 0.00 H new ATOM 0 HE ARG A 121 -24.275 -33.141 25.100 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -27.698 -34.061 25.299 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -28.263 -32.417 24.986 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -25.038 -31.065 24.690 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -26.775 -30.743 24.645 1.00 0.00 H new ATOM 2016 N LEU A 122 -21.950 -38.301 24.800 1.00 0.00 N ATOM 2017 CA LEU A 122 -22.248 -39.749 24.861 1.00 0.00 C ATOM 2018 C LEU A 122 -20.981 -40.576 25.153 1.00 0.00 C ATOM 2019 O LEU A 122 -21.068 -41.697 25.662 1.00 0.00 O ATOM 2020 CB LEU A 122 -22.959 -40.235 23.558 1.00 0.00 C ATOM 2021 CG LEU A 122 -24.466 -39.816 23.378 1.00 0.00 C ATOM 2022 CD1 LEU A 122 -25.321 -40.278 24.575 1.00 0.00 C ATOM 2023 CD2 LEU A 122 -24.625 -38.298 23.125 1.00 0.00 C ATOM 0 H LEU A 122 -21.900 -37.930 23.851 1.00 0.00 H new ATOM 0 HA LEU A 122 -22.936 -39.907 25.691 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -22.397 -39.860 22.703 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -22.902 -41.323 23.524 1.00 0.00 H new ATOM 0 HG LEU A 122 -24.833 -40.325 22.487 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -26.356 -39.974 24.421 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -25.270 -41.363 24.661 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -24.941 -39.824 25.490 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -25.682 -38.057 23.007 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -24.219 -37.744 23.971 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -24.087 -38.022 22.218 1.00 0.00 H new ATOM 2035 N GLN A 123 -19.810 -40.004 24.835 1.00 0.00 N ATOM 2036 CA GLN A 123 -18.498 -40.598 25.176 1.00 0.00 C ATOM 2037 C GLN A 123 -18.137 -40.327 26.658 1.00 0.00 C ATOM 2038 O GLN A 123 -17.267 -40.995 27.228 1.00 0.00 O ATOM 2039 CB GLN A 123 -17.421 -40.034 24.214 1.00 0.00 C ATOM 2040 CG GLN A 123 -17.672 -40.396 22.726 1.00 0.00 C ATOM 2041 CD GLN A 123 -16.717 -39.712 21.739 1.00 0.00 C ATOM 2042 OE1 GLN A 123 -15.571 -39.415 22.064 1.00 0.00 O ATOM 2043 NE2 GLN A 123 -17.184 -39.458 20.524 1.00 0.00 N ATOM 0 H GLN A 123 -19.740 -39.118 24.335 1.00 0.00 H new ATOM 0 HA GLN A 123 -18.545 -41.680 25.054 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -17.386 -38.949 24.315 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -16.444 -40.413 24.512 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -17.585 -41.476 22.608 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -18.696 -40.128 22.467 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -18.141 -39.716 20.281 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -16.587 -39.005 19.832 1.00 0.00 H new