USER MOD reduce.3.24.130724 H: found=0, std=0, add=655, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 656 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 49 LYS NZ :NH3+ -113:sc= 0.759 (180deg=-0.416) USER MOD Set 1.2: A 51 GLN : amide:sc= 0.132 K(o=0.89,f=-3.1) USER MOD Single : A 19 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 21 SER OG : rot 180:sc= -0.0268 USER MOD Single : A 26 THR OG1 : rot -179:sc= -0.128 USER MOD Single : A 27 SER OG : rot 13:sc= 0.477 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0661 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 118:sc= 1.25 USER MOD Single : A 44 CYS SG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl 180:sc= -0.0975 (180deg=-0.0975) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 168:sc= 1.21 (180deg=1.1) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot 50:sc= 0.944 USER MOD Single : A 70 GLN : amide:sc= -0.466 K(o=-0.47,f=-0.97) USER MOD Single : A 72 GLN : amide:sc= -1.49! K(o=-1.5!,f=-0.25) USER MOD Single : A 80 ASN : amide:sc= -0.279 K(o=-0.28,f=-1!) USER MOD Single : A 81 THR OG1 : rot -19:sc= 0.75 USER MOD Single : A 84 LYS NZ :NH3+ -169:sc= 1 (180deg=0.905) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot -150:sc= 1.07 USER MOD Single : A 89 SER OG : rot -88:sc= 0.00648 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN : amide:sc= 0.604 K(o=0.6,f=-0.059) USER MOD Single : A 100 GLN : amide:sc= -0.167 K(o=-0.17,f=-1.7) USER MOD Single : A 101 LYS NZ :NH3+ -164:sc= -0.0377 (180deg=-0.263) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 257 N GLY A 16 -37.497 12.548 11.053 1.00 0.00 N ATOM 258 CA GLY A 16 -36.699 13.749 11.143 1.00 0.00 C ATOM 259 C GLY A 16 -36.360 14.342 9.785 1.00 0.00 C ATOM 260 O GLY A 16 -36.717 13.789 8.743 1.00 0.00 O ATOM 0 HA2 GLY A 16 -37.236 14.492 11.733 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -35.775 13.525 11.676 1.00 0.00 H new ATOM 264 N GLU A 17 -35.678 15.462 9.813 1.00 0.00 N ATOM 265 CA GLU A 17 -35.254 16.175 8.629 1.00 0.00 C ATOM 266 C GLU A 17 -33.941 15.640 8.102 1.00 0.00 C ATOM 267 O GLU A 17 -33.305 14.805 8.746 1.00 0.00 O ATOM 268 CB GLU A 17 -35.139 17.687 8.874 1.00 0.00 C ATOM 269 CG GLU A 17 -34.484 18.101 10.197 1.00 0.00 C ATOM 270 CD GLU A 17 -35.346 17.808 11.410 1.00 0.00 C ATOM 271 OE1 GLU A 17 -36.320 18.556 11.658 1.00 0.00 O ATOM 272 OE2 GLU A 17 -35.060 16.821 12.116 1.00 0.00 O ATOM 0 H GLU A 17 -35.395 15.915 10.682 1.00 0.00 H new ATOM 0 HA GLU A 17 -36.028 16.011 7.879 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -34.569 18.126 8.055 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -36.139 18.119 8.834 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -33.532 17.580 10.302 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -34.262 19.168 10.167 1.00 0.00 H new ATOM 279 N TRP A 18 -33.562 16.100 6.905 1.00 0.00 N ATOM 280 CA TRP A 18 -32.326 15.703 6.276 1.00 0.00 C ATOM 281 C TRP A 18 -31.141 15.759 7.218 1.00 0.00 C ATOM 282 O TRP A 18 -30.785 16.815 7.751 1.00 0.00 O ATOM 283 CB TRP A 18 -32.038 16.630 5.116 1.00 0.00 C ATOM 284 CG TRP A 18 -32.822 16.319 3.912 1.00 0.00 C ATOM 285 CD1 TRP A 18 -33.777 17.091 3.346 1.00 0.00 C ATOM 286 CD2 TRP A 18 -32.730 15.137 3.127 1.00 0.00 C ATOM 287 NE1 TRP A 18 -34.293 16.463 2.255 1.00 0.00 N ATOM 288 CE2 TRP A 18 -33.662 15.254 2.094 1.00 0.00 C ATOM 289 CE3 TRP A 18 -31.946 13.991 3.206 1.00 0.00 C ATOM 290 CZ2 TRP A 18 -33.836 14.257 1.130 1.00 0.00 C ATOM 291 CZ3 TRP A 18 -32.113 13.002 2.260 1.00 0.00 C ATOM 292 CH2 TRP A 18 -33.052 13.137 1.232 1.00 0.00 C ATOM 0 H TRP A 18 -34.114 16.758 6.355 1.00 0.00 H new ATOM 0 HA TRP A 18 -32.455 14.671 5.951 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -32.245 17.656 5.420 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -30.977 16.577 4.873 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -34.084 18.062 3.706 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -35.030 16.831 1.653 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -31.218 13.878 3.996 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -34.560 14.365 0.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -31.509 12.108 2.314 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -33.161 12.345 0.506 1.00 0.00 H new ATOM 303 N GLN A 19 -30.531 14.613 7.399 1.00 0.00 N ATOM 304 CA GLN A 19 -29.340 14.482 8.186 1.00 0.00 C ATOM 305 C GLN A 19 -28.229 14.034 7.260 1.00 0.00 C ATOM 306 O GLN A 19 -28.283 12.934 6.696 1.00 0.00 O ATOM 307 CB GLN A 19 -29.553 13.463 9.311 1.00 0.00 C ATOM 308 CG GLN A 19 -30.696 13.824 10.251 1.00 0.00 C ATOM 309 CD GLN A 19 -30.925 12.792 11.337 1.00 0.00 C ATOM 310 OE1 GLN A 19 -30.669 11.601 11.149 1.00 0.00 O ATOM 311 NE2 GLN A 19 -31.418 13.240 12.474 1.00 0.00 N ATOM 0 H GLN A 19 -30.857 13.735 6.995 1.00 0.00 H new ATOM 0 HA GLN A 19 -29.082 15.433 8.653 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -29.750 12.485 8.872 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -28.633 13.374 9.888 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -30.486 14.788 10.714 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -31.612 13.941 9.671 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -31.616 14.234 12.588 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -31.602 12.593 13.240 1.00 0.00 H new ATOM 320 N TRP A 20 -27.243 14.878 7.091 1.00 0.00 N ATOM 321 CA TRP A 20 -26.175 14.622 6.155 1.00 0.00 C ATOM 322 C TRP A 20 -24.917 14.120 6.820 1.00 0.00 C ATOM 323 O TRP A 20 -24.592 14.492 7.949 1.00 0.00 O ATOM 324 CB TRP A 20 -25.888 15.851 5.295 1.00 0.00 C ATOM 325 CG TRP A 20 -26.880 16.039 4.196 1.00 0.00 C ATOM 326 CD1 TRP A 20 -27.878 16.949 4.153 1.00 0.00 C ATOM 327 CD2 TRP A 20 -26.971 15.283 2.978 1.00 0.00 C ATOM 328 NE1 TRP A 20 -28.593 16.818 2.988 1.00 0.00 N ATOM 329 CE2 TRP A 20 -28.054 15.801 2.248 1.00 0.00 C ATOM 330 CE3 TRP A 20 -26.238 14.220 2.437 1.00 0.00 C ATOM 331 CZ2 TRP A 20 -28.428 15.294 1.004 1.00 0.00 C ATOM 332 CZ3 TRP A 20 -26.609 13.719 1.201 1.00 0.00 C ATOM 333 CH2 TRP A 20 -27.694 14.256 0.499 1.00 0.00 C ATOM 0 H TRP A 20 -27.157 15.760 7.596 1.00 0.00 H new ATOM 0 HA TRP A 20 -26.523 13.819 5.505 1.00 0.00 H new ATOM 0 HB2 TRP A 20 -25.884 16.738 5.929 1.00 0.00 H new ATOM 0 HB3 TRP A 20 -24.890 15.762 4.865 1.00 0.00 H new ATOM 0 HD1 TRP A 20 -28.084 17.676 4.925 1.00 0.00 H new ATOM 0 HE1 TRP A 20 -29.396 17.387 2.718 1.00 0.00 H new ATOM 0 HE3 TRP A 20 -25.400 13.799 2.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 -29.265 15.705 0.460 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 -26.052 12.900 0.771 1.00 0.00 H new ATOM 0 HH2 TRP A 20 -27.958 13.842 -0.463 1.00 0.00 H new ATOM 344 N SER A 21 -24.226 13.270 6.104 1.00 0.00 N ATOM 345 CA SER A 21 -22.992 12.679 6.546 1.00 0.00 C ATOM 346 C SER A 21 -21.822 13.537 6.071 1.00 0.00 C ATOM 347 O SER A 21 -22.014 14.521 5.335 1.00 0.00 O ATOM 348 CB SER A 21 -22.875 11.242 6.014 1.00 0.00 C ATOM 349 OG SER A 21 -21.751 10.567 6.555 1.00 0.00 O ATOM 0 H SER A 21 -24.514 12.963 5.175 1.00 0.00 H new ATOM 0 HA SER A 21 -22.974 12.636 7.635 1.00 0.00 H new ATOM 0 HB2 SER A 21 -23.782 10.690 6.258 1.00 0.00 H new ATOM 0 HB3 SER A 21 -22.797 11.263 4.927 1.00 0.00 H new ATOM 0 HG SER A 21 -21.712 9.657 6.195 1.00 0.00 H new ATOM 355 N VAL A 22 -20.635 13.180 6.484 1.00 0.00 N ATOM 356 CA VAL A 22 -19.461 13.968 6.185 1.00 0.00 C ATOM 357 C VAL A 22 -18.796 13.463 4.919 1.00 0.00 C ATOM 358 O VAL A 22 -18.936 12.294 4.554 1.00 0.00 O ATOM 359 CB VAL A 22 -18.445 13.950 7.349 1.00 0.00 C ATOM 360 CG1 VAL A 22 -19.043 14.597 8.587 1.00 0.00 C ATOM 361 CG2 VAL A 22 -17.988 12.530 7.652 1.00 0.00 C ATOM 0 H VAL A 22 -20.451 12.341 7.034 1.00 0.00 H new ATOM 0 HA VAL A 22 -19.789 14.997 6.040 1.00 0.00 H new ATOM 0 HB VAL A 22 -17.571 14.527 7.046 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -18.314 14.576 9.397 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -19.309 15.631 8.365 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -19.936 14.050 8.888 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -17.273 12.546 8.475 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -18.849 11.922 7.930 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -17.514 12.104 6.768 1.00 0.00 H new ATOM 371 N CYS A 23 -18.097 14.341 4.246 1.00 0.00 N ATOM 372 CA CYS A 23 -17.487 14.012 2.986 1.00 0.00 C ATOM 373 C CYS A 23 -16.148 13.345 3.170 1.00 0.00 C ATOM 374 O CYS A 23 -15.188 13.961 3.638 1.00 0.00 O ATOM 375 CB CYS A 23 -17.335 15.258 2.112 1.00 0.00 C ATOM 376 SG CYS A 23 -18.873 15.780 1.293 1.00 0.00 S ATOM 0 H CYS A 23 -17.936 15.300 4.555 1.00 0.00 H new ATOM 0 HA CYS A 23 -18.149 13.306 2.485 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -16.967 16.079 2.728 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -16.578 15.066 1.352 1.00 0.00 H new ATOM 381 N VAL A 24 -16.086 12.082 2.818 1.00 0.00 N ATOM 382 CA VAL A 24 -14.849 11.355 2.839 1.00 0.00 C ATOM 383 C VAL A 24 -14.380 11.139 1.404 1.00 0.00 C ATOM 384 O VAL A 24 -14.915 10.297 0.685 1.00 0.00 O ATOM 385 CB VAL A 24 -14.969 9.999 3.593 1.00 0.00 C ATOM 386 CG1 VAL A 24 -15.052 10.239 5.087 1.00 0.00 C ATOM 387 CG2 VAL A 24 -16.187 9.208 3.122 1.00 0.00 C ATOM 0 H VAL A 24 -16.891 11.536 2.511 1.00 0.00 H new ATOM 0 HA VAL A 24 -14.114 11.944 3.387 1.00 0.00 H new ATOM 0 HB VAL A 24 -14.078 9.411 3.371 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -15.136 9.284 5.605 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -14.153 10.756 5.423 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -15.927 10.850 5.309 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -16.242 8.266 3.668 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -17.091 9.788 3.306 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -16.098 9.004 2.055 1.00 0.00 H new ATOM 397 N PRO A 25 -13.388 11.928 0.955 1.00 0.00 N ATOM 398 CA PRO A 25 -12.893 11.877 -0.428 1.00 0.00 C ATOM 399 C PRO A 25 -12.297 10.526 -0.784 1.00 0.00 C ATOM 400 O PRO A 25 -12.056 10.238 -1.943 1.00 0.00 O ATOM 401 CB PRO A 25 -11.811 12.965 -0.470 1.00 0.00 C ATOM 402 CG PRO A 25 -11.429 13.186 0.951 1.00 0.00 C ATOM 403 CD PRO A 25 -12.662 12.928 1.761 1.00 0.00 C ATOM 0 HA PRO A 25 -13.698 12.031 -1.147 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.954 12.646 -1.064 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.190 13.881 -0.923 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.622 12.515 1.246 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.069 14.204 1.103 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -12.420 12.547 2.753 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -13.249 13.836 1.902 1.00 0.00 H new ATOM 411 N THR A 26 -11.997 9.741 0.248 1.00 0.00 N ATOM 412 CA THR A 26 -11.461 8.395 0.114 1.00 0.00 C ATOM 413 C THR A 26 -9.962 8.484 -0.125 1.00 0.00 C ATOM 414 O THR A 26 -9.209 7.519 0.020 1.00 0.00 O ATOM 415 CB THR A 26 -12.175 7.631 -1.028 1.00 0.00 C ATOM 416 OG1 THR A 26 -13.559 7.457 -0.676 1.00 0.00 O ATOM 417 CG2 THR A 26 -11.541 6.271 -1.288 1.00 0.00 C ATOM 0 H THR A 26 -12.123 10.031 1.218 1.00 0.00 H new ATOM 0 HA THR A 26 -11.640 7.835 1.032 1.00 0.00 H new ATOM 0 HB THR A 26 -12.080 8.217 -1.942 1.00 0.00 H new ATOM 0 HG1 THR A 26 -14.017 6.962 -1.386 1.00 0.00 H new ATOM 0 HG21 THR A 26 -12.073 5.770 -2.097 1.00 0.00 H new ATOM 0 HG22 THR A 26 -10.496 6.404 -1.569 1.00 0.00 H new ATOM 0 HG23 THR A 26 -11.599 5.664 -0.385 1.00 0.00 H new ATOM 425 N SER A 27 -9.554 9.672 -0.451 1.00 0.00 N ATOM 426 CA SER A 27 -8.210 9.984 -0.745 1.00 0.00 C ATOM 427 C SER A 27 -7.884 11.367 -0.186 1.00 0.00 C ATOM 428 O SER A 27 -8.401 11.770 0.862 1.00 0.00 O ATOM 429 CB SER A 27 -8.100 9.982 -2.240 1.00 0.00 C ATOM 430 OG SER A 27 -6.756 10.068 -2.683 1.00 0.00 O ATOM 0 H SER A 27 -10.181 10.474 -0.519 1.00 0.00 H new ATOM 0 HA SER A 27 -7.515 9.270 -0.303 1.00 0.00 H new ATOM 0 HB2 SER A 27 -8.552 9.072 -2.634 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.667 10.820 -2.645 1.00 0.00 H new ATOM 0 HG SER A 27 -6.152 9.906 -1.929 1.00 0.00 H new ATOM 436 N GLY A 28 -7.054 12.073 -0.888 1.00 0.00 N ATOM 437 CA GLY A 28 -6.679 13.401 -0.503 1.00 0.00 C ATOM 438 C GLY A 28 -6.319 14.198 -1.699 1.00 0.00 C ATOM 439 O GLY A 28 -6.718 15.350 -1.844 1.00 0.00 O ATOM 0 H GLY A 28 -6.615 11.745 -1.748 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -7.502 13.880 0.028 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -5.835 13.363 0.185 1.00 0.00 H new ATOM 443 N ASP A 29 -5.593 13.569 -2.586 1.00 0.00 N ATOM 444 CA ASP A 29 -5.165 14.210 -3.803 1.00 0.00 C ATOM 445 C ASP A 29 -6.009 13.746 -4.985 1.00 0.00 C ATOM 446 O ASP A 29 -5.529 13.052 -5.883 1.00 0.00 O ATOM 447 CB ASP A 29 -3.662 13.987 -4.050 1.00 0.00 C ATOM 448 CG ASP A 29 -3.268 12.522 -4.142 1.00 0.00 C ATOM 449 OD1 ASP A 29 -3.567 11.753 -3.199 1.00 0.00 O ATOM 450 OD2 ASP A 29 -2.621 12.143 -5.141 1.00 0.00 O ATOM 0 H ASP A 29 -5.283 12.602 -2.487 1.00 0.00 H new ATOM 0 HA ASP A 29 -5.316 15.284 -3.694 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -3.376 14.489 -4.974 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -3.097 14.456 -3.244 1.00 0.00 H new ATOM 455 N CYS A 30 -7.291 14.117 -4.946 1.00 0.00 N ATOM 456 CA CYS A 30 -8.251 13.809 -6.015 1.00 0.00 C ATOM 457 C CYS A 30 -8.679 12.341 -5.977 1.00 0.00 C ATOM 458 O CYS A 30 -8.207 11.519 -6.769 1.00 0.00 O ATOM 459 CB CYS A 30 -7.689 14.174 -7.411 1.00 0.00 C ATOM 460 SG CYS A 30 -6.953 15.848 -7.520 1.00 0.00 S ATOM 0 H CYS A 30 -7.696 14.641 -4.171 1.00 0.00 H new ATOM 0 HA CYS A 30 -9.133 14.425 -5.836 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -6.932 13.440 -7.687 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -8.492 14.096 -8.144 1.00 0.00 H new ATOM 465 N GLY A 31 -9.552 12.012 -5.034 1.00 0.00 N ATOM 466 CA GLY A 31 -10.065 10.670 -4.931 1.00 0.00 C ATOM 467 C GLY A 31 -11.567 10.671 -4.893 1.00 0.00 C ATOM 468 O GLY A 31 -12.173 11.668 -4.514 1.00 0.00 O ATOM 0 H GLY A 31 -9.914 12.661 -4.335 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -9.719 10.078 -5.779 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -9.675 10.195 -4.031 1.00 0.00 H new ATOM 472 N LEU A 32 -12.167 9.582 -5.301 1.00 0.00 N ATOM 473 CA LEU A 32 -13.613 9.479 -5.322 1.00 0.00 C ATOM 474 C LEU A 32 -14.148 9.081 -3.956 1.00 0.00 C ATOM 475 O LEU A 32 -13.762 8.056 -3.416 1.00 0.00 O ATOM 476 CB LEU A 32 -14.046 8.479 -6.393 1.00 0.00 C ATOM 477 CG LEU A 32 -15.551 8.309 -6.598 1.00 0.00 C ATOM 478 CD1 LEU A 32 -16.185 9.617 -7.056 1.00 0.00 C ATOM 479 CD2 LEU A 32 -15.815 7.204 -7.605 1.00 0.00 C ATOM 0 H LEU A 32 -11.678 8.748 -5.626 1.00 0.00 H new ATOM 0 HA LEU A 32 -14.031 10.455 -5.567 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -13.605 8.783 -7.342 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -13.624 7.506 -6.142 1.00 0.00 H new ATOM 0 HG LEU A 32 -16.004 8.032 -5.646 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -17.256 9.473 -7.196 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.018 10.386 -6.302 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.735 9.929 -7.998 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -16.890 7.089 -7.746 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.350 7.460 -8.557 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.395 6.268 -7.237 1.00 0.00 H new ATOM 491 N GLY A 33 -15.071 9.880 -3.427 1.00 0.00 N ATOM 492 CA GLY A 33 -15.609 9.637 -2.102 1.00 0.00 C ATOM 493 C GLY A 33 -17.094 9.879 -2.068 1.00 0.00 C ATOM 494 O GLY A 33 -17.641 10.513 -2.974 1.00 0.00 O ATOM 0 H GLY A 33 -15.458 10.698 -3.898 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.398 8.610 -1.803 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.115 10.287 -1.380 1.00 0.00 H new ATOM 498 N THR A 34 -17.758 9.405 -1.027 1.00 0.00 N ATOM 499 CA THR A 34 -19.219 9.490 -0.974 1.00 0.00 C ATOM 500 C THR A 34 -19.741 9.709 0.456 1.00 0.00 C ATOM 501 O THR A 34 -19.070 9.370 1.429 1.00 0.00 O ATOM 502 CB THR A 34 -19.839 8.189 -1.542 1.00 0.00 C ATOM 503 OG1 THR A 34 -19.162 7.821 -2.751 1.00 0.00 O ATOM 504 CG2 THR A 34 -21.311 8.372 -1.845 1.00 0.00 C ATOM 0 H THR A 34 -17.323 8.963 -0.217 1.00 0.00 H new ATOM 0 HA THR A 34 -19.513 10.351 -1.574 1.00 0.00 H new ATOM 0 HB THR A 34 -19.728 7.407 -0.791 1.00 0.00 H new ATOM 0 HG1 THR A 34 -19.555 6.997 -3.108 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.719 7.443 -2.242 1.00 0.00 H new ATOM 0 HG22 THR A 34 -21.840 8.639 -0.930 1.00 0.00 H new ATOM 0 HG23 THR A 34 -21.435 9.166 -2.581 1.00 0.00 H new ATOM 512 N ARG A 35 -20.937 10.302 0.560 1.00 0.00 N ATOM 513 CA ARG A 35 -21.598 10.502 1.835 1.00 0.00 C ATOM 514 C ARG A 35 -23.073 10.111 1.720 1.00 0.00 C ATOM 515 O ARG A 35 -23.654 10.150 0.626 1.00 0.00 O ATOM 516 CB ARG A 35 -21.459 11.952 2.311 1.00 0.00 C ATOM 517 CG ARG A 35 -22.216 12.970 1.477 1.00 0.00 C ATOM 518 CD ARG A 35 -22.073 14.356 2.068 1.00 0.00 C ATOM 519 NE ARG A 35 -22.924 15.339 1.402 1.00 0.00 N ATOM 520 CZ ARG A 35 -23.409 16.427 1.998 1.00 0.00 C ATOM 521 NH1 ARG A 35 -23.115 16.675 3.272 1.00 0.00 N ATOM 522 NH2 ARG A 35 -24.179 17.263 1.324 1.00 0.00 N ATOM 0 H ARG A 35 -21.464 10.652 -0.240 1.00 0.00 H new ATOM 0 HA ARG A 35 -21.117 9.865 2.577 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -21.807 12.016 3.342 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -20.402 12.219 2.314 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -21.838 12.964 0.455 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -23.270 12.697 1.428 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -22.323 14.323 3.128 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -21.033 14.673 1.996 1.00 0.00 H new ATOM 0 HE ARG A 35 -23.161 15.183 0.422 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -22.518 16.032 3.792 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -23.486 17.508 3.728 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -24.402 17.075 0.347 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -24.550 18.096 1.781 1.00 0.00 H new ATOM 536 N GLU A 36 -23.672 9.735 2.832 1.00 0.00 N ATOM 537 CA GLU A 36 -25.057 9.276 2.857 1.00 0.00 C ATOM 538 C GLU A 36 -25.938 10.222 3.679 1.00 0.00 C ATOM 539 O GLU A 36 -25.574 10.606 4.787 1.00 0.00 O ATOM 540 CB GLU A 36 -25.118 7.871 3.451 1.00 0.00 C ATOM 541 CG GLU A 36 -24.237 6.862 2.733 1.00 0.00 C ATOM 542 CD GLU A 36 -24.028 5.606 3.538 1.00 0.00 C ATOM 543 OE1 GLU A 36 -23.057 5.555 4.311 1.00 0.00 O ATOM 544 OE2 GLU A 36 -24.827 4.661 3.402 1.00 0.00 O ATOM 0 H GLU A 36 -23.218 9.737 3.745 1.00 0.00 H new ATOM 0 HA GLU A 36 -25.433 9.263 1.834 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -24.822 7.917 4.499 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -26.150 7.521 3.426 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -24.690 6.605 1.775 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -23.270 7.317 2.517 1.00 0.00 H new ATOM 551 N GLY A 37 -27.079 10.615 3.132 1.00 0.00 N ATOM 552 CA GLY A 37 -27.983 11.490 3.855 1.00 0.00 C ATOM 553 C GLY A 37 -29.353 10.848 3.998 1.00 0.00 C ATOM 554 O GLY A 37 -29.754 10.048 3.148 1.00 0.00 O ATOM 0 H GLY A 37 -27.396 10.345 2.201 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -27.574 11.709 4.841 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -28.075 12.441 3.330 1.00 0.00 H new ATOM 558 N THR A 38 -30.074 11.180 5.056 1.00 0.00 N ATOM 559 CA THR A 38 -31.386 10.585 5.309 1.00 0.00 C ATOM 560 C THR A 38 -32.414 11.644 5.699 1.00 0.00 C ATOM 561 O THR A 38 -32.055 12.703 6.196 1.00 0.00 O ATOM 562 CB THR A 38 -31.307 9.525 6.428 1.00 0.00 C ATOM 563 OG1 THR A 38 -30.541 10.038 7.532 1.00 0.00 O ATOM 564 CG2 THR A 38 -30.674 8.237 5.924 1.00 0.00 C ATOM 0 H THR A 38 -29.777 11.859 5.757 1.00 0.00 H new ATOM 0 HA THR A 38 -31.702 10.109 4.381 1.00 0.00 H new ATOM 0 HB THR A 38 -32.323 9.302 6.755 1.00 0.00 H new ATOM 0 HG1 THR A 38 -30.495 9.362 8.240 1.00 0.00 H new ATOM 0 HG21 THR A 38 -30.633 7.510 6.735 1.00 0.00 H new ATOM 0 HG22 THR A 38 -31.271 7.834 5.106 1.00 0.00 H new ATOM 0 HG23 THR A 38 -29.664 8.443 5.569 1.00 0.00 H new ATOM 572 N ARG A 39 -33.685 11.348 5.458 1.00 0.00 N ATOM 573 CA ARG A 39 -34.787 12.239 5.803 1.00 0.00 C ATOM 574 C ARG A 39 -36.031 11.407 6.069 1.00 0.00 C ATOM 575 O ARG A 39 -36.102 10.259 5.670 1.00 0.00 O ATOM 576 CB ARG A 39 -35.079 13.225 4.653 1.00 0.00 C ATOM 577 CG ARG A 39 -36.328 14.085 4.877 1.00 0.00 C ATOM 578 CD ARG A 39 -36.710 14.883 3.647 1.00 0.00 C ATOM 579 NE ARG A 39 -38.044 15.482 3.782 1.00 0.00 N ATOM 580 CZ ARG A 39 -38.325 16.778 3.583 1.00 0.00 C ATOM 581 NH1 ARG A 39 -37.357 17.634 3.268 1.00 0.00 N ATOM 582 NH2 ARG A 39 -39.574 17.217 3.723 1.00 0.00 N ATOM 0 H ARG A 39 -33.983 10.479 5.015 1.00 0.00 H new ATOM 0 HA ARG A 39 -34.510 12.809 6.690 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -34.218 13.880 4.521 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -35.198 12.663 3.727 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -37.161 13.443 5.163 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -36.151 14.767 5.709 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -35.973 15.669 3.480 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -36.689 14.234 2.771 1.00 0.00 H new ATOM 0 HE ARG A 39 -38.813 14.867 4.047 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -36.396 17.306 3.177 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -37.576 18.619 3.118 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -40.317 16.568 3.982 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -39.788 18.203 3.572 1.00 0.00 H new ATOM 596 N THR A 40 -36.988 11.968 6.756 1.00 0.00 N ATOM 597 CA THR A 40 -38.240 11.302 6.964 1.00 0.00 C ATOM 598 C THR A 40 -39.382 12.276 6.691 1.00 0.00 C ATOM 599 O THR A 40 -39.198 13.492 6.774 1.00 0.00 O ATOM 600 CB THR A 40 -38.362 10.777 8.393 1.00 0.00 C ATOM 601 OG1 THR A 40 -37.055 10.619 8.966 1.00 0.00 O ATOM 602 CG2 THR A 40 -39.065 9.436 8.394 1.00 0.00 C ATOM 0 H THR A 40 -36.921 12.892 7.183 1.00 0.00 H new ATOM 0 HA THR A 40 -38.290 10.454 6.281 1.00 0.00 H new ATOM 0 HB THR A 40 -38.938 11.492 8.980 1.00 0.00 H new ATOM 0 HG1 THR A 40 -36.963 11.213 9.740 1.00 0.00 H new ATOM 0 HG21 THR A 40 -39.148 9.069 9.417 1.00 0.00 H new ATOM 0 HG22 THR A 40 -40.062 9.547 7.967 1.00 0.00 H new ATOM 0 HG23 THR A 40 -38.493 8.725 7.799 1.00 0.00 H new ATOM 610 N GLY A 41 -40.537 11.748 6.346 1.00 0.00 N ATOM 611 CA GLY A 41 -41.682 12.587 6.092 1.00 0.00 C ATOM 612 C GLY A 41 -42.679 12.497 7.215 1.00 0.00 C ATOM 613 O GLY A 41 -42.308 12.228 8.351 1.00 0.00 O ATOM 0 H GLY A 41 -40.705 10.748 6.236 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -41.359 13.621 5.970 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -42.155 12.288 5.157 1.00 0.00 H new ATOM 617 N ALA A 42 -43.940 12.714 6.914 1.00 0.00 N ATOM 618 CA ALA A 42 -44.972 12.646 7.931 1.00 0.00 C ATOM 619 C ALA A 42 -45.332 11.199 8.274 1.00 0.00 C ATOM 620 O ALA A 42 -45.634 10.883 9.420 1.00 0.00 O ATOM 621 CB ALA A 42 -46.205 13.408 7.475 1.00 0.00 C ATOM 0 H ALA A 42 -44.277 12.938 5.978 1.00 0.00 H new ATOM 0 HA ALA A 42 -44.581 13.109 8.837 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -46.974 13.351 8.246 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -45.944 14.452 7.300 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -46.583 12.969 6.552 1.00 0.00 H new ATOM 627 N GLU A 43 -45.268 10.322 7.279 1.00 0.00 N ATOM 628 CA GLU A 43 -45.636 8.911 7.461 1.00 0.00 C ATOM 629 C GLU A 43 -44.478 8.074 8.004 1.00 0.00 C ATOM 630 O GLU A 43 -44.616 6.863 8.179 1.00 0.00 O ATOM 631 CB GLU A 43 -46.115 8.303 6.129 1.00 0.00 C ATOM 632 CG GLU A 43 -46.784 9.291 5.174 1.00 0.00 C ATOM 633 CD GLU A 43 -45.793 9.967 4.239 1.00 0.00 C ATOM 634 OE1 GLU A 43 -45.023 10.833 4.700 1.00 0.00 O ATOM 635 OE2 GLU A 43 -45.782 9.635 3.033 1.00 0.00 O ATOM 0 H GLU A 43 -44.965 10.558 6.334 1.00 0.00 H new ATOM 0 HA GLU A 43 -46.443 8.890 8.194 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -45.260 7.854 5.623 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -46.817 7.498 6.346 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -47.535 8.767 4.583 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -47.308 10.052 5.753 1.00 0.00 H new ATOM 642 N CYS A 44 -43.350 8.716 8.262 1.00 0.00 N ATOM 643 CA CYS A 44 -42.149 8.020 8.751 1.00 0.00 C ATOM 644 C CYS A 44 -41.706 6.914 7.779 1.00 0.00 C ATOM 645 O CYS A 44 -41.151 5.897 8.191 1.00 0.00 O ATOM 646 CB CYS A 44 -42.378 7.441 10.163 1.00 0.00 C ATOM 647 SG CYS A 44 -42.430 8.693 11.498 1.00 0.00 S ATOM 0 H CYS A 44 -43.231 9.722 8.143 1.00 0.00 H new ATOM 0 HA CYS A 44 -41.348 8.757 8.810 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -43.316 6.886 10.166 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -41.584 6.727 10.382 1.00 0.00 H new ATOM 0 HG CYS A 44 -42.629 8.103 12.639 1.00 0.00 H new ATOM 652 N LYS A 45 -41.928 7.143 6.483 1.00 0.00 N ATOM 653 CA LYS A 45 -41.578 6.171 5.442 1.00 0.00 C ATOM 654 C LYS A 45 -40.057 6.023 5.306 1.00 0.00 C ATOM 655 O LYS A 45 -39.571 5.006 4.821 1.00 0.00 O ATOM 656 CB LYS A 45 -42.196 6.588 4.099 1.00 0.00 C ATOM 657 CG LYS A 45 -41.992 5.582 2.965 1.00 0.00 C ATOM 658 CD LYS A 45 -42.727 4.269 3.219 1.00 0.00 C ATOM 659 CE LYS A 45 -44.236 4.471 3.257 1.00 0.00 C ATOM 660 NZ LYS A 45 -44.971 3.187 3.381 1.00 0.00 N ATOM 0 H LYS A 45 -42.352 8.000 6.126 1.00 0.00 H new ATOM 0 HA LYS A 45 -41.983 5.202 5.735 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -43.265 6.746 4.239 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -41.769 7.545 3.799 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -42.342 6.017 2.029 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -40.927 5.383 2.846 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -42.475 3.553 2.437 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -42.393 3.841 4.164 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -44.493 5.117 4.096 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -44.555 4.984 2.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -45.994 3.373 3.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -44.747 2.579 2.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -44.687 2.708 4.260 1.00 0.00 H new ATOM 674 N GLN A 46 -39.324 7.059 5.728 1.00 0.00 N ATOM 675 CA GLN A 46 -37.854 7.061 5.705 1.00 0.00 C ATOM 676 C GLN A 46 -37.298 7.184 4.290 1.00 0.00 C ATOM 677 O GLN A 46 -37.326 6.236 3.498 1.00 0.00 O ATOM 678 CB GLN A 46 -37.274 5.838 6.433 1.00 0.00 C ATOM 679 CG GLN A 46 -37.511 5.855 7.937 1.00 0.00 C ATOM 680 CD GLN A 46 -37.085 4.570 8.618 1.00 0.00 C ATOM 681 OE1 GLN A 46 -37.881 3.642 8.769 1.00 0.00 O ATOM 682 NE2 GLN A 46 -35.836 4.501 9.028 1.00 0.00 N ATOM 0 H GLN A 46 -39.731 7.919 6.095 1.00 0.00 H new ATOM 0 HA GLN A 46 -37.534 7.950 6.249 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -37.715 4.933 6.014 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -36.202 5.787 6.243 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -36.965 6.690 8.376 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -38.570 6.029 8.131 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -35.208 5.291 8.884 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -35.497 3.657 9.489 1.00 0.00 H new ATOM 691 N THR A 47 -36.802 8.360 3.993 1.00 0.00 N ATOM 692 CA THR A 47 -36.228 8.676 2.710 1.00 0.00 C ATOM 693 C THR A 47 -34.706 8.726 2.837 1.00 0.00 C ATOM 694 O THR A 47 -34.181 9.144 3.873 1.00 0.00 O ATOM 695 CB THR A 47 -36.734 10.051 2.237 1.00 0.00 C ATOM 696 OG1 THR A 47 -38.134 10.164 2.516 1.00 0.00 O ATOM 697 CG2 THR A 47 -36.509 10.225 0.748 1.00 0.00 C ATOM 0 H THR A 47 -36.786 9.140 4.651 1.00 0.00 H new ATOM 0 HA THR A 47 -36.519 7.912 1.989 1.00 0.00 H new ATOM 0 HB THR A 47 -36.180 10.825 2.768 1.00 0.00 H new ATOM 0 HG1 THR A 47 -38.458 11.039 2.217 1.00 0.00 H new ATOM 0 HG21 THR A 47 -36.874 11.204 0.437 1.00 0.00 H new ATOM 0 HG22 THR A 47 -35.444 10.149 0.530 1.00 0.00 H new ATOM 0 HG23 THR A 47 -37.047 9.448 0.205 1.00 0.00 H new ATOM 705 N MET A 48 -34.000 8.307 1.812 1.00 0.00 N ATOM 706 CA MET A 48 -32.554 8.324 1.852 1.00 0.00 C ATOM 707 C MET A 48 -31.990 8.774 0.519 1.00 0.00 C ATOM 708 O MET A 48 -32.590 8.540 -0.530 1.00 0.00 O ATOM 709 CB MET A 48 -32.007 6.938 2.227 1.00 0.00 C ATOM 710 CG MET A 48 -30.501 6.902 2.448 1.00 0.00 C ATOM 711 SD MET A 48 -29.904 5.276 2.950 1.00 0.00 S ATOM 712 CE MET A 48 -28.179 5.638 3.268 1.00 0.00 C ATOM 0 H MET A 48 -34.400 7.952 0.944 1.00 0.00 H new ATOM 0 HA MET A 48 -32.241 9.035 2.616 1.00 0.00 H new ATOM 0 HB2 MET A 48 -32.505 6.596 3.135 1.00 0.00 H new ATOM 0 HB3 MET A 48 -32.264 6.232 1.437 1.00 0.00 H new ATOM 0 HG2 MET A 48 -29.997 7.201 1.529 1.00 0.00 H new ATOM 0 HG3 MET A 48 -30.233 7.633 3.211 1.00 0.00 H new ATOM 0 HE1 MET A 48 -27.670 4.729 3.589 1.00 0.00 H new ATOM 0 HE2 MET A 48 -27.712 6.013 2.357 1.00 0.00 H new ATOM 0 HE3 MET A 48 -28.104 6.392 4.051 1.00 0.00 H new ATOM 722 N LYS A 49 -30.854 9.437 0.569 1.00 0.00 N ATOM 723 CA LYS A 49 -30.178 9.912 -0.619 1.00 0.00 C ATOM 724 C LYS A 49 -28.683 9.783 -0.418 1.00 0.00 C ATOM 725 O LYS A 49 -28.169 10.113 0.649 1.00 0.00 O ATOM 726 CB LYS A 49 -30.544 11.382 -0.885 1.00 0.00 C ATOM 727 CG LYS A 49 -29.906 11.978 -2.139 1.00 0.00 C ATOM 728 CD LYS A 49 -30.462 11.345 -3.403 1.00 0.00 C ATOM 729 CE LYS A 49 -29.812 11.917 -4.657 1.00 0.00 C ATOM 730 NZ LYS A 49 -28.347 11.672 -4.695 1.00 0.00 N ATOM 0 H LYS A 49 -30.372 9.662 1.439 1.00 0.00 H new ATOM 0 HA LYS A 49 -30.488 9.316 -1.477 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -31.628 11.463 -0.970 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -30.246 11.979 -0.023 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -30.082 13.053 -2.162 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -28.826 11.833 -2.103 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -30.302 10.267 -3.370 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -31.539 11.506 -3.446 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -30.275 11.473 -5.538 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -30.000 12.990 -4.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -27.841 12.577 -4.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -28.078 11.051 -3.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -28.094 11.217 -5.595 1.00 0.00 H new ATOM 744 N THR A 50 -27.985 9.308 -1.416 1.00 0.00 N ATOM 745 CA THR A 50 -26.561 9.162 -1.340 1.00 0.00 C ATOM 746 C THR A 50 -25.918 10.063 -2.373 1.00 0.00 C ATOM 747 O THR A 50 -26.391 10.145 -3.510 1.00 0.00 O ATOM 748 CB THR A 50 -26.149 7.697 -1.590 1.00 0.00 C ATOM 749 OG1 THR A 50 -26.860 7.175 -2.727 1.00 0.00 O ATOM 750 CG2 THR A 50 -26.451 6.840 -0.372 1.00 0.00 C ATOM 0 H THR A 50 -28.391 9.012 -2.304 1.00 0.00 H new ATOM 0 HA THR A 50 -26.226 9.443 -0.342 1.00 0.00 H new ATOM 0 HB THR A 50 -25.077 7.671 -1.784 1.00 0.00 H new ATOM 0 HG1 THR A 50 -26.592 6.245 -2.881 1.00 0.00 H new ATOM 0 HG21 THR A 50 -26.153 5.810 -0.569 1.00 0.00 H new ATOM 0 HG22 THR A 50 -25.898 7.220 0.487 1.00 0.00 H new ATOM 0 HG23 THR A 50 -27.519 6.874 -0.159 1.00 0.00 H new ATOM 758 N GLN A 51 -24.872 10.759 -1.991 1.00 0.00 N ATOM 759 CA GLN A 51 -24.240 11.687 -2.901 1.00 0.00 C ATOM 760 C GLN A 51 -22.728 11.601 -2.817 1.00 0.00 C ATOM 761 O GLN A 51 -22.159 11.487 -1.729 1.00 0.00 O ATOM 762 CB GLN A 51 -24.716 13.116 -2.612 1.00 0.00 C ATOM 763 CG GLN A 51 -24.282 14.133 -3.657 1.00 0.00 C ATOM 764 CD GLN A 51 -24.838 13.835 -5.034 1.00 0.00 C ATOM 765 OE1 GLN A 51 -25.928 13.278 -5.172 1.00 0.00 O ATOM 766 NE2 GLN A 51 -24.091 14.197 -6.057 1.00 0.00 N ATOM 0 H GLN A 51 -24.444 10.702 -1.067 1.00 0.00 H new ATOM 0 HA GLN A 51 -24.530 11.416 -3.916 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -25.804 13.120 -2.545 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -24.336 13.425 -1.638 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -24.606 15.126 -3.347 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -23.193 14.154 -3.707 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -23.194 14.656 -5.897 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -24.409 14.018 -7.009 1.00 0.00 H new ATOM 775 N ARG A 52 -22.084 11.645 -3.967 1.00 0.00 N ATOM 776 CA ARG A 52 -20.639 11.620 -4.027 1.00 0.00 C ATOM 777 C ARG A 52 -20.117 13.033 -3.912 1.00 0.00 C ATOM 778 O ARG A 52 -20.610 13.940 -4.589 1.00 0.00 O ATOM 779 CB ARG A 52 -20.156 10.983 -5.325 1.00 0.00 C ATOM 780 CG ARG A 52 -20.770 9.626 -5.600 1.00 0.00 C ATOM 781 CD ARG A 52 -20.089 8.942 -6.762 1.00 0.00 C ATOM 782 NE ARG A 52 -20.850 7.782 -7.237 1.00 0.00 N ATOM 783 CZ ARG A 52 -20.320 6.599 -7.561 1.00 0.00 C ATOM 784 NH1 ARG A 52 -19.023 6.379 -7.395 1.00 0.00 N ATOM 785 NH2 ARG A 52 -21.097 5.632 -8.036 1.00 0.00 N ATOM 0 H ARG A 52 -22.543 11.699 -4.876 1.00 0.00 H new ATOM 0 HA ARG A 52 -20.260 11.018 -3.201 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -20.385 11.651 -6.155 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.071 10.881 -5.288 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -20.691 9.001 -4.710 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -21.832 9.742 -5.815 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -19.964 9.653 -7.579 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -19.091 8.623 -6.461 1.00 0.00 H new ATOM 0 HE ARG A 52 -21.861 7.886 -7.327 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.425 7.115 -7.018 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -18.623 5.474 -7.644 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -22.097 5.793 -8.153 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -20.693 4.729 -8.284 1.00 0.00 H new ATOM 799 N CYS A 53 -19.149 13.235 -3.047 1.00 0.00 N ATOM 800 CA CYS A 53 -18.627 14.571 -2.813 1.00 0.00 C ATOM 801 C CYS A 53 -17.604 14.919 -3.888 1.00 0.00 C ATOM 802 O CYS A 53 -17.068 14.030 -4.551 1.00 0.00 O ATOM 803 CB CYS A 53 -18.013 14.665 -1.415 1.00 0.00 C ATOM 804 SG CYS A 53 -19.197 14.306 -0.069 1.00 0.00 S ATOM 0 H CYS A 53 -18.707 12.500 -2.495 1.00 0.00 H new ATOM 0 HA CYS A 53 -19.443 15.291 -2.867 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -17.177 13.969 -1.347 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -17.607 15.666 -1.272 1.00 0.00 H new ATOM 809 N LYS A 54 -17.330 16.198 -4.061 1.00 0.00 N ATOM 810 CA LYS A 54 -16.450 16.633 -5.110 1.00 0.00 C ATOM 811 C LYS A 54 -15.161 17.238 -4.564 1.00 0.00 C ATOM 812 O LYS A 54 -15.176 18.028 -3.622 1.00 0.00 O ATOM 813 CB LYS A 54 -17.181 17.638 -5.990 1.00 0.00 C ATOM 814 CG LYS A 54 -16.353 18.216 -7.113 1.00 0.00 C ATOM 815 CD LYS A 54 -15.841 17.141 -8.060 1.00 0.00 C ATOM 816 CE LYS A 54 -15.181 17.748 -9.289 1.00 0.00 C ATOM 817 NZ LYS A 54 -14.068 18.669 -8.943 1.00 0.00 N ATOM 0 H LYS A 54 -17.708 16.949 -3.484 1.00 0.00 H new ATOM 0 HA LYS A 54 -16.164 15.762 -5.700 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -18.060 17.154 -6.417 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -17.539 18.455 -5.364 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -16.952 18.935 -7.672 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -15.508 18.763 -6.695 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -15.125 16.506 -7.538 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -16.669 16.502 -8.368 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -14.802 16.949 -9.925 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -15.929 18.289 -9.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -13.525 18.895 -9.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -14.455 19.545 -8.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -13.443 18.213 -8.248 1.00 0.00 H new ATOM 831 N ILE A 55 -14.056 16.841 -5.172 1.00 0.00 N ATOM 832 CA ILE A 55 -12.743 17.347 -4.812 1.00 0.00 C ATOM 833 C ILE A 55 -12.199 18.214 -5.939 1.00 0.00 C ATOM 834 O ILE A 55 -12.170 17.788 -7.101 1.00 0.00 O ATOM 835 CB ILE A 55 -11.721 16.203 -4.500 1.00 0.00 C ATOM 836 CG1 ILE A 55 -12.132 15.414 -3.252 1.00 0.00 C ATOM 837 CG2 ILE A 55 -10.310 16.758 -4.328 1.00 0.00 C ATOM 838 CD1 ILE A 55 -13.204 14.384 -3.501 1.00 0.00 C ATOM 0 H ILE A 55 -14.044 16.158 -5.930 1.00 0.00 H new ATOM 0 HA ILE A 55 -12.865 17.935 -3.902 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.725 15.524 -5.353 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -11.252 14.916 -2.844 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.484 16.113 -2.493 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.621 15.941 -4.112 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.002 17.259 -5.245 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.297 17.471 -3.503 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -13.438 13.870 -2.569 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -14.100 14.876 -3.879 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.850 13.661 -4.235 1.00 0.00 H new ATOM 850 N PRO A 56 -11.801 19.453 -5.626 1.00 0.00 N ATOM 851 CA PRO A 56 -11.218 20.362 -6.610 1.00 0.00 C ATOM 852 C PRO A 56 -9.826 19.903 -7.034 1.00 0.00 C ATOM 853 O PRO A 56 -8.848 20.060 -6.294 1.00 0.00 O ATOM 854 CB PRO A 56 -11.146 21.698 -5.867 1.00 0.00 C ATOM 855 CG PRO A 56 -11.102 21.330 -4.423 1.00 0.00 C ATOM 856 CD PRO A 56 -11.903 20.068 -4.288 1.00 0.00 C ATOM 0 HA PRO A 56 -11.802 20.414 -7.529 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.262 22.265 -6.158 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.012 22.322 -6.090 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -10.075 21.177 -4.092 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -11.521 22.125 -3.806 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -11.498 19.416 -3.514 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.939 20.276 -4.019 1.00 0.00 H new ATOM 864 N CYS A 57 -9.745 19.319 -8.210 1.00 0.00 N ATOM 865 CA CYS A 57 -8.494 18.800 -8.710 1.00 0.00 C ATOM 866 C CYS A 57 -7.869 19.786 -9.691 1.00 0.00 C ATOM 867 O CYS A 57 -8.469 20.819 -10.010 1.00 0.00 O ATOM 868 CB CYS A 57 -8.722 17.442 -9.380 1.00 0.00 C ATOM 869 SG CYS A 57 -7.236 16.390 -9.457 1.00 0.00 S ATOM 0 H CYS A 57 -10.537 19.192 -8.840 1.00 0.00 H new ATOM 0 HA CYS A 57 -7.806 18.664 -7.875 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -9.504 16.909 -8.839 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -9.091 17.606 -10.393 1.00 0.00 H new ATOM 993 N GLY A 64 -9.295 22.387 -26.705 1.00 0.00 N ATOM 994 CA GLY A 64 -10.184 21.677 -27.592 1.00 0.00 C ATOM 995 C GLY A 64 -9.443 20.624 -28.382 1.00 0.00 C ATOM 996 O GLY A 64 -8.750 20.937 -29.347 1.00 0.00 O ATOM 0 HA2 GLY A 64 -10.980 21.208 -27.014 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -10.658 22.381 -28.276 1.00 0.00 H new ATOM 1000 N ALA A 65 -9.588 19.376 -27.972 1.00 0.00 N ATOM 1001 CA ALA A 65 -8.902 18.267 -28.619 1.00 0.00 C ATOM 1002 C ALA A 65 -9.421 18.034 -30.036 1.00 0.00 C ATOM 1003 O ALA A 65 -8.665 17.629 -30.924 1.00 0.00 O ATOM 1004 CB ALA A 65 -9.048 17.004 -27.786 1.00 0.00 C ATOM 0 H ALA A 65 -10.179 19.102 -27.187 1.00 0.00 H new ATOM 0 HA ALA A 65 -7.846 18.525 -28.694 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -8.531 16.181 -28.279 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.613 17.166 -26.800 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -10.105 16.758 -27.681 1.00 0.00 H new ATOM 1010 N GLU A 66 -10.707 18.294 -30.242 1.00 0.00 N ATOM 1011 CA GLU A 66 -11.324 18.112 -31.550 1.00 0.00 C ATOM 1012 C GLU A 66 -11.116 19.346 -32.432 1.00 0.00 C ATOM 1013 O GLU A 66 -11.330 19.302 -33.644 1.00 0.00 O ATOM 1014 CB GLU A 66 -12.817 17.792 -31.405 1.00 0.00 C ATOM 1015 CG GLU A 66 -13.090 16.490 -30.660 1.00 0.00 C ATOM 1016 CD GLU A 66 -14.566 16.155 -30.569 1.00 0.00 C ATOM 1017 OE1 GLU A 66 -15.218 16.574 -29.591 1.00 0.00 O ATOM 1018 OE2 GLU A 66 -15.078 15.456 -31.461 1.00 0.00 O ATOM 0 H GLU A 66 -11.343 18.632 -29.519 1.00 0.00 H new ATOM 0 HA GLU A 66 -10.839 17.266 -32.037 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -13.307 18.612 -30.879 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -13.266 17.735 -32.396 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -12.569 15.675 -31.162 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -12.677 16.561 -29.654 1.00 0.00 H new ATOM 1025 N CYS A 67 -10.688 20.435 -31.821 1.00 0.00 N ATOM 1026 CA CYS A 67 -10.427 21.670 -32.545 1.00 0.00 C ATOM 1027 C CYS A 67 -9.047 21.609 -33.186 1.00 0.00 C ATOM 1028 O CYS A 67 -8.194 20.826 -32.752 1.00 0.00 O ATOM 1029 CB CYS A 67 -10.529 22.860 -31.598 1.00 0.00 C ATOM 1030 SG CYS A 67 -12.166 23.035 -30.821 1.00 0.00 S ATOM 0 H CYS A 67 -10.512 20.491 -30.818 1.00 0.00 H new ATOM 0 HA CYS A 67 -11.171 21.792 -33.332 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -9.775 22.758 -30.818 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -10.298 23.772 -32.148 1.00 0.00 H new ATOM 1035 N LYS A 68 -8.808 22.424 -34.213 1.00 0.00 N ATOM 1036 CA LYS A 68 -7.526 22.356 -34.904 1.00 0.00 C ATOM 1037 C LYS A 68 -6.898 23.713 -35.000 1.00 0.00 C ATOM 1038 O LYS A 68 -7.518 24.651 -35.483 1.00 0.00 O ATOM 1039 CB LYS A 68 -7.672 21.721 -36.289 1.00 0.00 C ATOM 1040 CG LYS A 68 -8.197 20.293 -36.249 1.00 0.00 C ATOM 1041 CD LYS A 68 -8.075 19.602 -37.597 1.00 0.00 C ATOM 1042 CE LYS A 68 -6.623 19.347 -37.966 1.00 0.00 C ATOM 1043 NZ LYS A 68 -6.504 18.588 -39.229 1.00 0.00 N ATOM 0 H LYS A 68 -9.463 23.117 -34.574 1.00 0.00 H new ATOM 0 HA LYS A 68 -6.866 21.718 -34.316 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -8.346 22.331 -36.891 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -6.703 21.730 -36.788 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -7.646 19.725 -35.500 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -9.242 20.300 -35.939 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -8.616 18.656 -37.572 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -8.544 20.217 -38.365 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.100 20.298 -38.063 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.135 18.795 -37.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -5.499 18.433 -39.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.982 17.670 -39.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -6.947 19.126 -40.001 1.00 0.00 H new ATOM 1057 N TYR A 69 -5.654 23.807 -34.567 1.00 0.00 N ATOM 1058 CA TYR A 69 -4.968 25.080 -34.505 1.00 0.00 C ATOM 1059 C TYR A 69 -3.665 25.055 -35.267 1.00 0.00 C ATOM 1060 O TYR A 69 -2.836 24.165 -35.078 1.00 0.00 O ATOM 1061 CB TYR A 69 -4.694 25.449 -33.054 1.00 0.00 C ATOM 1062 CG TYR A 69 -5.946 25.541 -32.259 1.00 0.00 C ATOM 1063 CD1 TYR A 69 -6.281 24.566 -31.333 1.00 0.00 C ATOM 1064 CD2 TYR A 69 -6.820 26.583 -32.461 1.00 0.00 C ATOM 1065 CE1 TYR A 69 -7.460 24.635 -30.637 1.00 0.00 C ATOM 1066 CE2 TYR A 69 -7.985 26.669 -31.771 1.00 0.00 C ATOM 1067 CZ TYR A 69 -8.313 25.689 -30.856 1.00 0.00 C ATOM 1068 OH TYR A 69 -9.503 25.758 -30.169 1.00 0.00 O ATOM 0 H TYR A 69 -5.098 23.012 -34.252 1.00 0.00 H new ATOM 0 HA TYR A 69 -5.616 25.824 -34.967 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -4.035 24.704 -32.608 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.169 26.403 -33.015 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.605 23.742 -31.158 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.574 27.348 -33.183 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -7.716 23.867 -29.922 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -8.653 27.501 -31.937 1.00 0.00 H new ATOM 0 HH TYR A 69 -9.336 25.631 -29.212 1.00 0.00 H new ATOM 1078 N GLN A 70 -3.486 26.031 -36.123 1.00 0.00 N ATOM 1079 CA GLN A 70 -2.248 26.188 -36.842 1.00 0.00 C ATOM 1080 C GLN A 70 -1.557 27.441 -36.362 1.00 0.00 C ATOM 1081 O GLN A 70 -2.176 28.502 -36.285 1.00 0.00 O ATOM 1082 CB GLN A 70 -2.484 26.259 -38.353 1.00 0.00 C ATOM 1083 CG GLN A 70 -2.884 24.936 -38.985 1.00 0.00 C ATOM 1084 CD GLN A 70 -2.995 25.025 -40.497 1.00 0.00 C ATOM 1085 OE1 GLN A 70 -2.308 25.822 -41.137 1.00 0.00 O ATOM 1086 NE2 GLN A 70 -3.845 24.207 -41.076 1.00 0.00 N ATOM 0 H GLN A 70 -4.191 26.735 -36.339 1.00 0.00 H new ATOM 0 HA GLN A 70 -1.619 25.319 -36.650 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -3.263 26.995 -38.553 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -1.575 26.619 -38.835 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -2.150 24.174 -38.722 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -3.840 24.614 -38.572 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -4.396 23.561 -40.511 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -3.953 24.218 -42.090 1.00 0.00 H new ATOM 1095 N PHE A 71 -0.290 27.324 -36.018 1.00 0.00 N ATOM 1096 CA PHE A 71 0.456 28.457 -35.516 1.00 0.00 C ATOM 1097 C PHE A 71 1.207 29.151 -36.637 1.00 0.00 C ATOM 1098 O PHE A 71 1.818 28.501 -37.490 1.00 0.00 O ATOM 1099 CB PHE A 71 1.413 28.042 -34.380 1.00 0.00 C ATOM 1100 CG PHE A 71 2.357 26.917 -34.729 1.00 0.00 C ATOM 1101 CD1 PHE A 71 3.584 27.178 -35.318 1.00 0.00 C ATOM 1102 CD2 PHE A 71 2.014 25.601 -34.462 1.00 0.00 C ATOM 1103 CE1 PHE A 71 4.449 26.149 -35.633 1.00 0.00 C ATOM 1104 CE2 PHE A 71 2.876 24.569 -34.776 1.00 0.00 C ATOM 1105 CZ PHE A 71 4.095 24.844 -35.364 1.00 0.00 C ATOM 0 H PHE A 71 0.243 26.456 -36.077 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.259 29.166 -35.100 1.00 0.00 H new ATOM 0 HB2 PHE A 71 2.000 28.911 -34.082 1.00 0.00 H new ATOM 0 HB3 PHE A 71 0.821 27.745 -33.514 1.00 0.00 H new ATOM 0 HD1 PHE A 71 3.867 28.198 -35.533 1.00 0.00 H new ATOM 0 HD2 PHE A 71 1.062 25.380 -34.003 1.00 0.00 H new ATOM 0 HE1 PHE A 71 5.403 26.366 -36.090 1.00 0.00 H new ATOM 0 HE2 PHE A 71 2.597 23.548 -34.562 1.00 0.00 H new ATOM 0 HZ PHE A 71 4.770 24.038 -35.613 1.00 0.00 H new ATOM 1115 N GLN A 72 1.143 30.459 -36.637 1.00 0.00 N ATOM 1116 CA GLN A 72 1.803 31.261 -37.635 1.00 0.00 C ATOM 1117 C GLN A 72 2.997 31.974 -37.020 1.00 0.00 C ATOM 1118 O GLN A 72 3.101 32.097 -35.791 1.00 0.00 O ATOM 1119 CB GLN A 72 0.828 32.263 -38.254 1.00 0.00 C ATOM 1120 CG GLN A 72 0.775 33.592 -37.545 1.00 0.00 C ATOM 1121 CD GLN A 72 -0.440 34.416 -37.939 1.00 0.00 C ATOM 1122 OE1 GLN A 72 -0.936 34.317 -39.057 1.00 0.00 O ATOM 1123 NE2 GLN A 72 -0.922 35.237 -37.029 1.00 0.00 N ATOM 0 H GLN A 72 0.629 30.999 -35.941 1.00 0.00 H new ATOM 0 HA GLN A 72 2.160 30.608 -38.431 1.00 0.00 H new ATOM 0 HB2 GLN A 72 1.108 32.430 -39.294 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -0.171 31.826 -38.258 1.00 0.00 H new ATOM 0 HG2 GLN A 72 0.762 33.425 -36.468 1.00 0.00 H new ATOM 0 HG3 GLN A 72 1.680 34.156 -37.770 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -0.484 35.293 -36.110 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -1.733 35.817 -37.244 1.00 0.00 H new ATOM 1132 N ALA A 73 3.874 32.449 -37.862 1.00 0.00 N ATOM 1133 CA ALA A 73 5.086 33.099 -37.417 1.00 0.00 C ATOM 1134 C ALA A 73 5.275 34.425 -38.127 1.00 0.00 C ATOM 1135 O ALA A 73 5.829 34.484 -39.226 1.00 0.00 O ATOM 1136 CB ALA A 73 6.295 32.195 -37.633 1.00 0.00 C ATOM 0 H ALA A 73 3.773 32.399 -38.876 1.00 0.00 H new ATOM 0 HA ALA A 73 4.994 33.294 -36.349 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.196 32.704 -37.291 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.164 31.271 -37.069 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.390 31.962 -38.694 1.00 0.00 H new ATOM 1142 N TRP A 74 4.780 35.481 -37.517 1.00 0.00 N ATOM 1143 CA TRP A 74 4.904 36.816 -38.081 1.00 0.00 C ATOM 1144 C TRP A 74 6.152 37.507 -37.548 1.00 0.00 C ATOM 1145 O TRP A 74 6.640 38.473 -38.131 1.00 0.00 O ATOM 1146 CB TRP A 74 3.648 37.648 -37.774 1.00 0.00 C ATOM 1147 CG TRP A 74 3.189 37.558 -36.343 1.00 0.00 C ATOM 1148 CD1 TRP A 74 2.230 36.726 -35.850 1.00 0.00 C ATOM 1149 CD2 TRP A 74 3.668 38.325 -35.226 1.00 0.00 C ATOM 1150 NE1 TRP A 74 2.080 36.926 -34.502 1.00 0.00 N ATOM 1151 CE2 TRP A 74 2.951 37.899 -34.094 1.00 0.00 C ATOM 1152 CE3 TRP A 74 4.632 39.328 -35.077 1.00 0.00 C ATOM 1153 CZ2 TRP A 74 3.167 38.440 -32.829 1.00 0.00 C ATOM 1154 CZ3 TRP A 74 4.845 39.863 -33.820 1.00 0.00 C ATOM 1155 CH2 TRP A 74 4.115 39.418 -32.711 1.00 0.00 C ATOM 0 H TRP A 74 4.285 35.444 -36.626 1.00 0.00 H new ATOM 0 HA TRP A 74 4.999 36.727 -39.163 1.00 0.00 H new ATOM 0 HB2 TRP A 74 3.848 38.692 -38.016 1.00 0.00 H new ATOM 0 HB3 TRP A 74 2.839 37.319 -38.426 1.00 0.00 H new ATOM 0 HD1 TRP A 74 1.669 36.013 -36.436 1.00 0.00 H new ATOM 0 HE1 TRP A 74 1.424 36.429 -33.900 1.00 0.00 H new ATOM 0 HE3 TRP A 74 5.199 39.678 -35.927 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 2.606 38.099 -31.972 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 5.587 40.637 -33.691 1.00 0.00 H new ATOM 0 HH2 TRP A 74 4.305 39.856 -31.742 1.00 0.00 H new ATOM 1166 N GLY A 75 6.669 36.988 -36.451 1.00 0.00 N ATOM 1167 CA GLY A 75 7.848 37.551 -35.835 1.00 0.00 C ATOM 1168 C GLY A 75 8.413 36.617 -34.798 1.00 0.00 C ATOM 1169 O GLY A 75 7.800 36.399 -33.753 1.00 0.00 O ATOM 0 H GLY A 75 6.287 36.174 -35.969 1.00 0.00 H new ATOM 0 HA2 GLY A 75 8.601 37.752 -36.598 1.00 0.00 H new ATOM 0 HA3 GLY A 75 7.600 38.506 -35.373 1.00 0.00 H new ATOM 1173 N GLU A 76 9.567 36.049 -35.077 1.00 0.00 N ATOM 1174 CA GLU A 76 10.168 35.115 -34.173 1.00 0.00 C ATOM 1175 C GLU A 76 11.176 35.781 -33.268 1.00 0.00 C ATOM 1176 O GLU A 76 12.192 36.295 -33.729 1.00 0.00 O ATOM 1177 CB GLU A 76 10.833 33.988 -34.936 1.00 0.00 C ATOM 1178 CG GLU A 76 9.860 33.041 -35.598 1.00 0.00 C ATOM 1179 CD GLU A 76 10.532 31.783 -36.072 1.00 0.00 C ATOM 1180 OE1 GLU A 76 10.598 30.809 -35.286 1.00 0.00 O ATOM 1181 OE2 GLU A 76 10.991 31.750 -37.231 1.00 0.00 O ATOM 0 H GLU A 76 10.102 36.224 -35.927 1.00 0.00 H new ATOM 0 HA GLU A 76 9.370 34.709 -33.551 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.486 34.414 -35.698 1.00 0.00 H new ATOM 0 HB3 GLU A 76 11.467 33.423 -34.252 1.00 0.00 H new ATOM 0 HG2 GLU A 76 9.067 32.786 -34.895 1.00 0.00 H new ATOM 0 HG3 GLU A 76 9.387 33.540 -36.444 1.00 0.00 H new ATOM 1188 N CYS A 77 10.863 35.763 -31.982 1.00 0.00 N ATOM 1189 CA CYS A 77 11.728 36.272 -30.919 1.00 0.00 C ATOM 1190 C CYS A 77 12.028 37.759 -31.075 1.00 0.00 C ATOM 1191 O CYS A 77 12.793 38.178 -31.949 1.00 0.00 O ATOM 1192 CB CYS A 77 13.018 35.453 -30.815 1.00 0.00 C ATOM 1193 SG CYS A 77 13.967 35.748 -29.284 1.00 0.00 S ATOM 0 H CYS A 77 9.981 35.386 -31.636 1.00 0.00 H new ATOM 0 HA CYS A 77 11.179 36.159 -29.984 1.00 0.00 H new ATOM 0 HB2 CYS A 77 12.769 34.394 -30.877 1.00 0.00 H new ATOM 0 HB3 CYS A 77 13.651 35.682 -31.672 1.00 0.00 H new ATOM 1198 N ASP A 78 11.428 38.541 -30.210 1.00 0.00 N ATOM 1199 CA ASP A 78 11.622 39.976 -30.207 1.00 0.00 C ATOM 1200 C ASP A 78 12.898 40.319 -29.469 1.00 0.00 C ATOM 1201 O ASP A 78 13.132 39.839 -28.367 1.00 0.00 O ATOM 1202 CB ASP A 78 10.452 40.691 -29.561 1.00 0.00 C ATOM 1203 CG ASP A 78 10.648 42.185 -29.550 1.00 0.00 C ATOM 1204 OD1 ASP A 78 10.412 42.824 -30.595 1.00 0.00 O ATOM 1205 OD2 ASP A 78 11.058 42.719 -28.514 1.00 0.00 O ATOM 0 H ASP A 78 10.792 38.204 -29.488 1.00 0.00 H new ATOM 0 HA ASP A 78 11.693 40.308 -31.243 1.00 0.00 H new ATOM 0 HB2 ASP A 78 9.536 40.448 -30.099 1.00 0.00 H new ATOM 0 HB3 ASP A 78 10.326 40.333 -28.539 1.00 0.00 H new ATOM 1210 N LEU A 79 13.705 41.138 -30.082 1.00 0.00 N ATOM 1211 CA LEU A 79 15.007 41.494 -29.536 1.00 0.00 C ATOM 1212 C LEU A 79 14.903 42.411 -28.342 1.00 0.00 C ATOM 1213 O LEU A 79 15.725 42.349 -27.425 1.00 0.00 O ATOM 1214 CB LEU A 79 15.795 42.196 -30.591 1.00 0.00 C ATOM 1215 CG LEU A 79 15.780 41.520 -31.942 1.00 0.00 C ATOM 1216 CD1 LEU A 79 16.375 42.430 -33.008 1.00 0.00 C ATOM 1217 CD2 LEU A 79 16.520 40.190 -31.894 1.00 0.00 C ATOM 0 H LEU A 79 13.490 41.583 -30.974 1.00 0.00 H new ATOM 0 HA LEU A 79 15.489 40.571 -29.214 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.407 43.209 -30.702 1.00 0.00 H new ATOM 0 HB3 LEU A 79 16.828 42.285 -30.255 1.00 0.00 H new ATOM 0 HG LEU A 79 14.742 41.319 -32.206 1.00 0.00 H new ATOM 0 HD11 LEU A 79 16.354 41.923 -33.973 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.792 43.349 -33.069 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.406 42.671 -32.747 1.00 0.00 H new ATOM 0 HD21 LEU A 79 16.495 39.724 -32.879 1.00 0.00 H new ATOM 0 HD22 LEU A 79 17.556 40.360 -31.600 1.00 0.00 H new ATOM 0 HD23 LEU A 79 16.040 39.533 -31.169 1.00 0.00 H new ATOM 1229 N ASN A 80 13.896 43.247 -28.350 1.00 0.00 N ATOM 1230 CA ASN A 80 13.738 44.226 -27.296 1.00 0.00 C ATOM 1231 C ASN A 80 13.380 43.550 -26.009 1.00 0.00 C ATOM 1232 O ASN A 80 13.926 43.864 -24.947 1.00 0.00 O ATOM 1233 CB ASN A 80 12.621 45.217 -27.671 1.00 0.00 C ATOM 1234 CG ASN A 80 12.540 46.439 -26.749 1.00 0.00 C ATOM 1235 OD1 ASN A 80 12.906 46.387 -25.579 1.00 0.00 O ATOM 1236 ND2 ASN A 80 12.040 47.537 -27.274 1.00 0.00 N ATOM 0 H ASN A 80 13.174 43.273 -29.070 1.00 0.00 H new ATOM 0 HA ASN A 80 14.680 44.760 -27.172 1.00 0.00 H new ATOM 0 HB2 ASN A 80 12.778 45.556 -28.695 1.00 0.00 H new ATOM 0 HB3 ASN A 80 11.664 44.695 -27.652 1.00 0.00 H new ATOM 0 HD21 ASN A 80 11.947 48.378 -26.705 1.00 0.00 H new ATOM 0 HD22 ASN A 80 11.745 47.547 -28.250 1.00 0.00 H new ATOM 1243 N THR A 81 12.506 42.598 -26.094 1.00 0.00 N ATOM 1244 CA THR A 81 12.015 41.954 -24.892 1.00 0.00 C ATOM 1245 C THR A 81 12.580 40.560 -24.692 1.00 0.00 C ATOM 1246 O THR A 81 12.311 39.917 -23.681 1.00 0.00 O ATOM 1247 CB THR A 81 10.475 41.942 -24.856 1.00 0.00 C ATOM 1248 OG1 THR A 81 9.999 41.326 -23.657 1.00 0.00 O ATOM 1249 CG2 THR A 81 9.931 41.223 -26.055 1.00 0.00 C ATOM 0 H THR A 81 12.114 42.244 -26.967 1.00 0.00 H new ATOM 0 HA THR A 81 12.373 42.553 -24.055 1.00 0.00 H new ATOM 0 HB THR A 81 10.127 42.975 -24.874 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.714 40.785 -23.261 1.00 0.00 H new ATOM 0 HG21 THR A 81 8.842 41.223 -26.016 1.00 0.00 H new ATOM 0 HG22 THR A 81 10.261 41.728 -26.963 1.00 0.00 H new ATOM 0 HG23 THR A 81 10.294 40.195 -26.059 1.00 0.00 H new ATOM 1257 N ALA A 82 13.393 40.126 -25.634 1.00 0.00 N ATOM 1258 CA ALA A 82 14.000 38.800 -25.616 1.00 0.00 C ATOM 1259 C ALA A 82 12.979 37.664 -25.498 1.00 0.00 C ATOM 1260 O ALA A 82 13.278 36.617 -24.914 1.00 0.00 O ATOM 1261 CB ALA A 82 15.054 38.706 -24.515 1.00 0.00 C ATOM 0 H ALA A 82 13.657 40.686 -26.445 1.00 0.00 H new ATOM 0 HA ALA A 82 14.484 38.669 -26.584 1.00 0.00 H new ATOM 0 HB1 ALA A 82 15.495 37.709 -24.518 1.00 0.00 H new ATOM 0 HB2 ALA A 82 15.833 39.448 -24.692 1.00 0.00 H new ATOM 0 HB3 ALA A 82 14.588 38.894 -23.548 1.00 0.00 H new ATOM 1267 N LEU A 83 11.795 37.837 -26.055 1.00 0.00 N ATOM 1268 CA LEU A 83 10.767 36.814 -25.943 1.00 0.00 C ATOM 1269 C LEU A 83 10.247 36.455 -27.300 1.00 0.00 C ATOM 1270 O LEU A 83 10.435 37.190 -28.248 1.00 0.00 O ATOM 1271 CB LEU A 83 9.622 37.301 -25.061 1.00 0.00 C ATOM 1272 CG LEU A 83 10.027 37.963 -23.744 1.00 0.00 C ATOM 1273 CD1 LEU A 83 8.805 38.481 -23.026 1.00 0.00 C ATOM 1274 CD2 LEU A 83 10.777 36.992 -22.848 1.00 0.00 C ATOM 0 H LEU A 83 11.521 38.665 -26.584 1.00 0.00 H new ATOM 0 HA LEU A 83 11.209 35.929 -25.485 1.00 0.00 H new ATOM 0 HB2 LEU A 83 9.025 38.011 -25.633 1.00 0.00 H new ATOM 0 HB3 LEU A 83 8.977 36.452 -24.835 1.00 0.00 H new ATOM 0 HG LEU A 83 10.691 38.796 -23.977 1.00 0.00 H new ATOM 0 HD11 LEU A 83 9.105 38.951 -22.089 1.00 0.00 H new ATOM 0 HD12 LEU A 83 8.298 39.214 -23.653 1.00 0.00 H new ATOM 0 HD13 LEU A 83 8.128 37.653 -22.816 1.00 0.00 H new ATOM 0 HD21 LEU A 83 11.052 37.492 -21.919 1.00 0.00 H new ATOM 0 HD22 LEU A 83 10.140 36.136 -22.625 1.00 0.00 H new ATOM 0 HD23 LEU A 83 11.679 36.650 -23.356 1.00 0.00 H new ATOM 1286 N LYS A 84 9.565 35.354 -27.390 1.00 0.00 N ATOM 1287 CA LYS A 84 9.071 34.893 -28.647 1.00 0.00 C ATOM 1288 C LYS A 84 7.568 34.777 -28.598 1.00 0.00 C ATOM 1289 O LYS A 84 7.014 34.288 -27.624 1.00 0.00 O ATOM 1290 CB LYS A 84 9.700 33.544 -28.972 1.00 0.00 C ATOM 1291 CG LYS A 84 9.597 33.175 -30.420 1.00 0.00 C ATOM 1292 CD LYS A 84 10.321 31.875 -30.722 1.00 0.00 C ATOM 1293 CE LYS A 84 10.190 31.506 -32.190 1.00 0.00 C ATOM 1294 NZ LYS A 84 11.043 30.349 -32.557 1.00 0.00 N ATOM 0 H LYS A 84 9.337 34.754 -26.597 1.00 0.00 H new ATOM 0 HA LYS A 84 9.336 35.606 -29.428 1.00 0.00 H new ATOM 0 HB2 LYS A 84 10.751 33.562 -28.683 1.00 0.00 H new ATOM 0 HB3 LYS A 84 9.217 32.772 -28.372 1.00 0.00 H new ATOM 0 HG2 LYS A 84 8.547 33.080 -30.697 1.00 0.00 H new ATOM 0 HG3 LYS A 84 10.016 33.975 -31.030 1.00 0.00 H new ATOM 0 HD2 LYS A 84 11.375 31.972 -30.461 1.00 0.00 H new ATOM 0 HD3 LYS A 84 9.912 31.075 -30.105 1.00 0.00 H new ATOM 0 HE2 LYS A 84 9.149 31.272 -32.412 1.00 0.00 H new ATOM 0 HE3 LYS A 84 10.462 32.365 -32.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 11.067 30.250 -33.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 12.008 30.503 -32.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 10.653 29.482 -32.135 1.00 0.00 H new ATOM 1308 N THR A 85 6.914 35.224 -29.642 1.00 0.00 N ATOM 1309 CA THR A 85 5.472 35.210 -29.694 1.00 0.00 C ATOM 1310 C THR A 85 4.986 34.352 -30.858 1.00 0.00 C ATOM 1311 O THR A 85 5.618 34.314 -31.918 1.00 0.00 O ATOM 1312 CB THR A 85 4.917 36.638 -29.849 1.00 0.00 C ATOM 1313 OG1 THR A 85 5.642 37.535 -28.994 1.00 0.00 O ATOM 1314 CG2 THR A 85 3.441 36.689 -29.484 1.00 0.00 C ATOM 0 H THR A 85 7.362 35.606 -30.475 1.00 0.00 H new ATOM 0 HA THR A 85 5.110 34.786 -28.757 1.00 0.00 H new ATOM 0 HB THR A 85 5.034 36.937 -30.891 1.00 0.00 H new ATOM 0 HG1 THR A 85 5.287 38.443 -29.096 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.072 37.708 -29.601 1.00 0.00 H new ATOM 0 HG22 THR A 85 2.881 36.022 -30.140 1.00 0.00 H new ATOM 0 HG23 THR A 85 3.311 36.373 -28.449 1.00 0.00 H new ATOM 1322 N ARG A 86 3.884 33.664 -30.653 1.00 0.00 N ATOM 1323 CA ARG A 86 3.288 32.816 -31.672 1.00 0.00 C ATOM 1324 C ARG A 86 1.779 32.960 -31.652 1.00 0.00 C ATOM 1325 O ARG A 86 1.175 33.089 -30.583 1.00 0.00 O ATOM 1326 CB ARG A 86 3.680 31.347 -31.483 1.00 0.00 C ATOM 1327 CG ARG A 86 4.923 30.935 -32.255 1.00 0.00 C ATOM 1328 CD ARG A 86 5.191 29.446 -32.110 1.00 0.00 C ATOM 1329 NE ARG A 86 6.205 28.972 -33.055 1.00 0.00 N ATOM 1330 CZ ARG A 86 6.613 27.703 -33.144 1.00 0.00 C ATOM 1331 NH1 ARG A 86 6.114 26.781 -32.325 1.00 0.00 N ATOM 1332 NH2 ARG A 86 7.514 27.355 -34.057 1.00 0.00 N ATOM 0 H ARG A 86 3.371 33.675 -29.772 1.00 0.00 H new ATOM 0 HA ARG A 86 3.669 33.140 -32.640 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.845 31.159 -30.422 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.847 30.716 -31.793 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.799 31.184 -33.309 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.783 31.499 -31.893 1.00 0.00 H new ATOM 0 HD2 ARG A 86 5.519 29.235 -31.092 1.00 0.00 H new ATOM 0 HD3 ARG A 86 4.264 28.895 -32.267 1.00 0.00 H new ATOM 0 HE ARG A 86 6.626 29.654 -33.685 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.418 27.042 -31.627 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.427 25.813 -32.395 1.00 0.00 H new ATOM 0 HH21 ARG A 86 7.895 28.057 -34.691 1.00 0.00 H new ATOM 0 HH22 ARG A 86 7.824 26.386 -34.124 1.00 0.00 H new ATOM 1346 N THR A 87 1.179 32.966 -32.822 1.00 0.00 N ATOM 1347 CA THR A 87 -0.257 33.112 -32.927 1.00 0.00 C ATOM 1348 C THR A 87 -0.856 31.903 -33.639 1.00 0.00 C ATOM 1349 O THR A 87 -0.234 31.342 -34.532 1.00 0.00 O ATOM 1350 CB THR A 87 -0.612 34.401 -33.700 1.00 0.00 C ATOM 1351 OG1 THR A 87 0.152 35.498 -33.171 1.00 0.00 O ATOM 1352 CG2 THR A 87 -2.098 34.722 -33.580 1.00 0.00 C ATOM 0 H THR A 87 1.663 32.871 -33.715 1.00 0.00 H new ATOM 0 HA THR A 87 -0.673 33.178 -31.921 1.00 0.00 H new ATOM 0 HB THR A 87 -0.375 34.247 -34.753 1.00 0.00 H new ATOM 0 HG1 THR A 87 -0.354 36.330 -33.277 1.00 0.00 H new ATOM 0 HG21 THR A 87 -2.319 35.634 -34.134 1.00 0.00 H new ATOM 0 HG22 THR A 87 -2.682 33.898 -33.990 1.00 0.00 H new ATOM 0 HG23 THR A 87 -2.356 34.863 -32.530 1.00 0.00 H new ATOM 1360 N GLY A 88 -2.048 31.510 -33.239 1.00 0.00 N ATOM 1361 CA GLY A 88 -2.706 30.379 -33.848 1.00 0.00 C ATOM 1362 C GLY A 88 -4.199 30.580 -33.931 1.00 0.00 C ATOM 1363 O GLY A 88 -4.760 31.385 -33.193 1.00 0.00 O ATOM 0 H GLY A 88 -2.579 31.960 -32.493 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -2.304 30.220 -34.849 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.491 29.479 -33.271 1.00 0.00 H new ATOM 1367 N SER A 89 -4.837 29.881 -34.841 1.00 0.00 N ATOM 1368 CA SER A 89 -6.281 29.985 -35.015 1.00 0.00 C ATOM 1369 C SER A 89 -6.883 28.651 -35.418 1.00 0.00 C ATOM 1370 O SER A 89 -6.211 27.828 -36.059 1.00 0.00 O ATOM 1371 CB SER A 89 -6.601 31.046 -36.065 1.00 0.00 C ATOM 1372 OG SER A 89 -6.048 32.305 -35.699 1.00 0.00 O ATOM 0 H SER A 89 -4.382 29.228 -35.479 1.00 0.00 H new ATOM 0 HA SER A 89 -6.720 30.277 -34.061 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.204 30.737 -37.032 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.681 31.138 -36.178 1.00 0.00 H new ATOM 0 HG SER A 89 -6.686 32.791 -35.135 1.00 0.00 H new ATOM 1378 N LEU A 90 -8.137 28.421 -35.018 1.00 0.00 N ATOM 1379 CA LEU A 90 -8.834 27.202 -35.388 1.00 0.00 C ATOM 1380 C LEU A 90 -9.148 27.205 -36.897 1.00 0.00 C ATOM 1381 O LEU A 90 -9.619 28.206 -37.447 1.00 0.00 O ATOM 1382 CB LEU A 90 -10.099 26.940 -34.471 1.00 0.00 C ATOM 1383 CG LEU A 90 -11.472 27.501 -34.892 1.00 0.00 C ATOM 1384 CD1 LEU A 90 -11.360 28.935 -35.235 1.00 0.00 C ATOM 1385 CD2 LEU A 90 -12.090 26.707 -36.033 1.00 0.00 C ATOM 0 H LEU A 90 -8.681 29.063 -34.442 1.00 0.00 H new ATOM 0 HA LEU A 90 -8.177 26.352 -35.205 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.206 25.861 -34.364 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.873 27.338 -33.482 1.00 0.00 H new ATOM 0 HG LEU A 90 -12.145 27.400 -34.040 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -12.338 29.316 -35.530 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -11.001 29.490 -34.368 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.659 29.058 -36.060 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -13.056 27.139 -36.295 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -11.430 26.741 -36.900 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -12.228 25.671 -35.723 1.00 0.00 H new ATOM 1397 N LYS A 91 -8.809 26.130 -37.573 1.00 0.00 N ATOM 1398 CA LYS A 91 -9.050 26.044 -39.007 1.00 0.00 C ATOM 1399 C LYS A 91 -10.401 25.388 -39.295 1.00 0.00 C ATOM 1400 O LYS A 91 -11.075 25.727 -40.272 1.00 0.00 O ATOM 1401 CB LYS A 91 -7.912 25.296 -39.701 1.00 0.00 C ATOM 1402 CG LYS A 91 -6.551 25.966 -39.532 1.00 0.00 C ATOM 1403 CD LYS A 91 -6.550 27.389 -40.087 1.00 0.00 C ATOM 1404 CE LYS A 91 -5.212 28.080 -39.857 1.00 0.00 C ATOM 1405 NZ LYS A 91 -5.186 29.452 -40.422 1.00 0.00 N ATOM 0 H LYS A 91 -8.369 25.306 -37.163 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.081 27.056 -39.410 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -7.860 24.282 -39.306 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.138 25.213 -40.764 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -6.284 25.987 -38.475 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -5.789 25.376 -40.041 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -6.768 27.364 -41.155 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -7.344 27.966 -39.613 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -5.007 28.125 -38.787 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -4.416 27.488 -40.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -4.257 29.884 -40.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -5.355 29.408 -41.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -5.928 30.026 -39.973 1.00 0.00 H new ATOM 1419 N ARG A 92 -10.791 24.463 -38.437 1.00 0.00 N ATOM 1420 CA ARG A 92 -12.077 23.791 -38.553 1.00 0.00 C ATOM 1421 C ARG A 92 -12.631 23.535 -37.160 1.00 0.00 C ATOM 1422 O ARG A 92 -11.865 23.260 -36.227 1.00 0.00 O ATOM 1423 CB ARG A 92 -11.942 22.481 -39.360 1.00 0.00 C ATOM 1424 CG ARG A 92 -11.116 21.390 -38.693 1.00 0.00 C ATOM 1425 CD ARG A 92 -11.993 20.397 -37.935 1.00 0.00 C ATOM 1426 NE ARG A 92 -12.953 19.729 -38.819 1.00 0.00 N ATOM 1427 CZ ARG A 92 -13.480 18.523 -38.596 1.00 0.00 C ATOM 1428 NH1 ARG A 92 -13.121 17.822 -37.531 1.00 0.00 N ATOM 1429 NH2 ARG A 92 -14.356 18.016 -39.446 1.00 0.00 N ATOM 0 H ARG A 92 -10.230 24.156 -37.643 1.00 0.00 H new ATOM 0 HA ARG A 92 -12.774 24.429 -39.097 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.940 22.090 -39.556 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -11.495 22.713 -40.327 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.537 20.860 -39.449 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -10.403 21.844 -38.005 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -11.362 19.650 -37.453 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.531 20.918 -37.143 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.239 20.221 -39.665 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.438 18.203 -36.876 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.527 16.901 -37.366 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -14.630 18.546 -40.273 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.758 17.094 -39.275 1.00 0.00 H new ATOM 1443 N ALA A 93 -13.938 23.639 -37.005 1.00 0.00 N ATOM 1444 CA ALA A 93 -14.566 23.483 -35.703 1.00 0.00 C ATOM 1445 C ALA A 93 -15.788 22.595 -35.798 1.00 0.00 C ATOM 1446 O ALA A 93 -16.498 22.606 -36.807 1.00 0.00 O ATOM 1447 CB ALA A 93 -14.960 24.841 -35.141 1.00 0.00 C ATOM 0 H ALA A 93 -14.589 23.832 -37.767 1.00 0.00 H new ATOM 0 HA ALA A 93 -13.845 23.014 -35.034 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -15.429 24.709 -34.166 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -14.071 25.463 -35.035 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -15.663 25.325 -35.819 1.00 0.00 H new ATOM 1453 N LEU A 94 -16.027 21.822 -34.760 1.00 0.00 N ATOM 1454 CA LEU A 94 -17.187 20.952 -34.706 1.00 0.00 C ATOM 1455 C LEU A 94 -18.359 21.675 -34.047 1.00 0.00 C ATOM 1456 O LEU A 94 -18.211 22.800 -33.571 1.00 0.00 O ATOM 1457 CB LEU A 94 -16.868 19.645 -33.962 1.00 0.00 C ATOM 1458 CG LEU A 94 -15.901 18.680 -34.675 1.00 0.00 C ATOM 1459 CD1 LEU A 94 -14.473 19.202 -34.646 1.00 0.00 C ATOM 1460 CD2 LEU A 94 -15.976 17.297 -34.059 1.00 0.00 C ATOM 0 H LEU A 94 -15.429 21.777 -33.935 1.00 0.00 H new ATOM 0 HA LEU A 94 -17.465 20.693 -35.727 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -16.446 19.898 -32.989 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -17.804 19.118 -33.776 1.00 0.00 H new ATOM 0 HG LEU A 94 -16.209 18.613 -35.718 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -13.817 18.497 -35.157 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -14.429 20.169 -35.148 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -14.148 19.315 -33.612 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -15.286 16.630 -34.576 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -15.705 17.353 -33.005 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -16.991 16.912 -34.152 1.00 0.00 H new ATOM 1472 N HIS A 95 -19.517 21.040 -34.026 1.00 0.00 N ATOM 1473 CA HIS A 95 -20.705 21.639 -33.411 1.00 0.00 C ATOM 1474 C HIS A 95 -20.783 21.290 -31.932 1.00 0.00 C ATOM 1475 O HIS A 95 -21.503 21.929 -31.165 1.00 0.00 O ATOM 1476 CB HIS A 95 -21.981 21.185 -34.123 1.00 0.00 C ATOM 1477 CG HIS A 95 -22.036 21.568 -35.568 1.00 0.00 C ATOM 1478 ND1 HIS A 95 -22.290 20.668 -36.579 1.00 0.00 N ATOM 1479 CD2 HIS A 95 -21.872 22.766 -36.167 1.00 0.00 C ATOM 1480 CE1 HIS A 95 -22.279 21.299 -37.737 1.00 0.00 C ATOM 1481 NE2 HIS A 95 -22.028 22.574 -37.514 1.00 0.00 N ATOM 0 H HIS A 95 -19.668 20.113 -34.424 1.00 0.00 H new ATOM 0 HA HIS A 95 -20.619 22.721 -33.512 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -22.066 20.101 -34.041 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -22.843 21.612 -33.611 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -21.657 23.703 -35.675 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -22.447 20.848 -38.704 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -21.961 23.299 -38.228 1.00 0.00 H new ATOM 1490 N ASN A 96 -20.039 20.276 -31.538 1.00 0.00 N ATOM 1491 CA ASN A 96 -20.018 19.833 -30.147 1.00 0.00 C ATOM 1492 C ASN A 96 -18.766 20.338 -29.453 1.00 0.00 C ATOM 1493 O ASN A 96 -18.303 19.757 -28.469 1.00 0.00 O ATOM 1494 CB ASN A 96 -20.085 18.298 -30.072 1.00 0.00 C ATOM 1495 CG ASN A 96 -18.853 17.615 -30.649 1.00 0.00 C ATOM 1496 OD1 ASN A 96 -18.773 17.367 -31.851 1.00 0.00 O ATOM 1497 ND2 ASN A 96 -17.899 17.292 -29.793 1.00 0.00 N ATOM 0 H ASN A 96 -19.436 19.737 -32.160 1.00 0.00 H new ATOM 0 HA ASN A 96 -20.890 20.244 -29.639 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -20.206 17.996 -29.032 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -20.969 17.953 -30.609 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -17.057 16.819 -30.122 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -18.005 17.516 -28.803 1.00 0.00 H new ATOM 1504 N ALA A 97 -18.268 21.454 -29.928 1.00 0.00 N ATOM 1505 CA ALA A 97 -17.025 22.005 -29.413 1.00 0.00 C ATOM 1506 C ALA A 97 -16.840 23.453 -29.810 1.00 0.00 C ATOM 1507 O ALA A 97 -16.778 23.783 -30.996 1.00 0.00 O ATOM 1508 CB ALA A 97 -15.838 21.174 -29.892 1.00 0.00 C ATOM 0 H ALA A 97 -18.700 22.003 -30.671 1.00 0.00 H new ATOM 0 HA ALA A 97 -17.078 21.966 -28.325 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.914 21.598 -29.499 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.946 20.149 -29.539 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -15.805 21.181 -30.981 1.00 0.00 H new ATOM 1514 N GLU A 98 -16.783 24.320 -28.821 1.00 0.00 N ATOM 1515 CA GLU A 98 -16.495 25.720 -29.053 1.00 0.00 C ATOM 1516 C GLU A 98 -14.995 25.885 -29.176 1.00 0.00 C ATOM 1517 O GLU A 98 -14.262 25.709 -28.203 1.00 0.00 O ATOM 1518 CB GLU A 98 -17.031 26.572 -27.906 1.00 0.00 C ATOM 1519 CG GLU A 98 -18.544 26.584 -27.811 1.00 0.00 C ATOM 1520 CD GLU A 98 -19.183 27.269 -28.994 1.00 0.00 C ATOM 1521 OE1 GLU A 98 -19.338 28.506 -28.953 1.00 0.00 O ATOM 1522 OE2 GLU A 98 -19.526 26.577 -29.978 1.00 0.00 O ATOM 0 H GLU A 98 -16.934 24.077 -27.842 1.00 0.00 H new ATOM 0 HA GLU A 98 -16.982 26.051 -29.970 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -16.620 26.201 -26.967 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -16.675 27.595 -28.028 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.910 25.560 -27.745 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -18.845 27.090 -26.894 1.00 0.00 H new ATOM 1529 N CYS A 99 -14.535 26.202 -30.359 1.00 0.00 N ATOM 1530 CA CYS A 99 -13.114 26.294 -30.608 1.00 0.00 C ATOM 1531 C CYS A 99 -12.593 27.714 -30.454 1.00 0.00 C ATOM 1532 O CYS A 99 -13.362 28.680 -30.410 1.00 0.00 O ATOM 1533 CB CYS A 99 -12.794 25.753 -31.996 1.00 0.00 C ATOM 1534 SG CYS A 99 -13.255 24.006 -32.227 1.00 0.00 S ATOM 0 H CYS A 99 -15.123 26.402 -31.168 1.00 0.00 H new ATOM 0 HA CYS A 99 -12.607 25.687 -29.857 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -13.313 26.358 -32.740 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -11.726 25.865 -32.182 1.00 0.00 H new ATOM 1539 N GLN A 100 -11.286 27.823 -30.365 1.00 0.00 N ATOM 1540 CA GLN A 100 -10.629 29.097 -30.216 1.00 0.00 C ATOM 1541 C GLN A 100 -10.370 29.713 -31.570 1.00 0.00 C ATOM 1542 O GLN A 100 -9.732 29.114 -32.428 1.00 0.00 O ATOM 1543 CB GLN A 100 -9.327 28.928 -29.448 1.00 0.00 C ATOM 1544 CG GLN A 100 -9.535 28.325 -28.081 1.00 0.00 C ATOM 1545 CD GLN A 100 -8.243 27.925 -27.401 1.00 0.00 C ATOM 1546 OE1 GLN A 100 -7.269 27.561 -28.055 1.00 0.00 O ATOM 1547 NE2 GLN A 100 -8.231 27.980 -26.084 1.00 0.00 N ATOM 0 H GLN A 100 -10.649 27.027 -30.394 1.00 0.00 H new ATOM 0 HA GLN A 100 -11.280 29.765 -29.652 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -8.651 28.294 -30.022 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -8.842 29.899 -29.343 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -10.062 29.042 -27.452 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -10.176 27.448 -28.172 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -9.062 28.288 -25.579 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -7.391 27.714 -25.570 1.00 0.00 H new ATOM 1556 N LYS A 101 -10.852 30.912 -31.746 1.00 0.00 N ATOM 1557 CA LYS A 101 -10.704 31.614 -32.992 1.00 0.00 C ATOM 1558 C LYS A 101 -9.290 32.119 -33.147 1.00 0.00 C ATOM 1559 O LYS A 101 -8.781 32.215 -34.254 1.00 0.00 O ATOM 1560 CB LYS A 101 -11.724 32.756 -33.117 1.00 0.00 C ATOM 1561 CG LYS A 101 -11.778 33.691 -31.919 1.00 0.00 C ATOM 1562 CD LYS A 101 -12.844 34.759 -32.103 1.00 0.00 C ATOM 1563 CE LYS A 101 -13.060 35.560 -30.830 1.00 0.00 C ATOM 1564 NZ LYS A 101 -13.637 34.729 -29.737 1.00 0.00 N ATOM 0 H LYS A 101 -11.359 31.431 -31.029 1.00 0.00 H new ATOM 0 HA LYS A 101 -10.906 30.914 -33.803 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -11.488 33.340 -34.007 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -12.714 32.326 -33.271 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -11.986 33.117 -31.016 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.806 34.164 -31.779 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -12.552 35.430 -32.910 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -13.782 34.290 -32.402 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -12.110 35.981 -30.502 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -13.725 36.398 -31.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -14.017 35.349 -28.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -14.402 34.136 -30.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -12.895 34.121 -29.335 1.00 0.00 H new ATOM 1578 N THR A 102 -8.663 32.452 -32.034 1.00 0.00 N ATOM 1579 CA THR A 102 -7.284 32.858 -32.068 1.00 0.00 C ATOM 1580 C THR A 102 -6.626 32.697 -30.710 1.00 0.00 C ATOM 1581 O THR A 102 -7.272 32.804 -29.665 1.00 0.00 O ATOM 1582 CB THR A 102 -7.116 34.317 -32.570 1.00 0.00 C ATOM 1583 OG1 THR A 102 -5.725 34.659 -32.655 1.00 0.00 O ATOM 1584 CG2 THR A 102 -7.829 35.303 -31.655 1.00 0.00 C ATOM 0 H THR A 102 -9.088 32.447 -31.107 1.00 0.00 H new ATOM 0 HA THR A 102 -6.786 32.199 -32.779 1.00 0.00 H new ATOM 0 HB THR A 102 -7.566 34.379 -33.561 1.00 0.00 H new ATOM 0 HG1 THR A 102 -5.634 35.581 -32.974 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.692 36.316 -32.034 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.893 35.068 -31.625 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.413 35.233 -30.650 1.00 0.00 H new ATOM 1592 N VAL A 103 -5.348 32.424 -30.754 1.00 0.00 N ATOM 1593 CA VAL A 103 -4.525 32.299 -29.567 1.00 0.00 C ATOM 1594 C VAL A 103 -3.163 32.894 -29.789 1.00 0.00 C ATOM 1595 O VAL A 103 -2.577 32.775 -30.862 1.00 0.00 O ATOM 1596 CB VAL A 103 -4.371 30.827 -29.087 1.00 0.00 C ATOM 1597 CG1 VAL A 103 -5.670 30.309 -28.498 1.00 0.00 C ATOM 1598 CG2 VAL A 103 -3.905 29.924 -30.224 1.00 0.00 C ATOM 0 H VAL A 103 -4.837 32.279 -31.625 1.00 0.00 H new ATOM 0 HA VAL A 103 -5.046 32.851 -28.784 1.00 0.00 H new ATOM 0 HB VAL A 103 -3.610 30.812 -28.307 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.535 29.278 -28.170 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.955 30.926 -27.646 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -6.454 30.350 -29.254 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -3.806 28.902 -29.859 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -4.635 29.952 -31.033 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.940 30.272 -30.593 1.00 0.00 H new ATOM 1608 N THR A 104 -2.689 33.567 -28.791 1.00 0.00 N ATOM 1609 CA THR A 104 -1.394 34.168 -28.821 1.00 0.00 C ATOM 1610 C THR A 104 -0.628 33.760 -27.576 1.00 0.00 C ATOM 1611 O THR A 104 -1.154 33.846 -26.465 1.00 0.00 O ATOM 1612 CB THR A 104 -1.520 35.692 -28.895 1.00 0.00 C ATOM 1613 OG1 THR A 104 -2.255 36.051 -30.075 1.00 0.00 O ATOM 1614 CG2 THR A 104 -0.155 36.366 -28.920 1.00 0.00 C ATOM 0 H THR A 104 -3.197 33.717 -27.919 1.00 0.00 H new ATOM 0 HA THR A 104 -0.854 33.827 -29.705 1.00 0.00 H new ATOM 0 HB THR A 104 -2.047 36.033 -28.004 1.00 0.00 H new ATOM 0 HG1 THR A 104 -2.339 37.026 -30.124 1.00 0.00 H new ATOM 0 HG21 THR A 104 -0.284 37.447 -28.973 1.00 0.00 H new ATOM 0 HG22 THR A 104 0.394 36.110 -28.014 1.00 0.00 H new ATOM 0 HG23 THR A 104 0.404 36.024 -29.791 1.00 0.00 H new ATOM 1622 N ILE A 105 0.598 33.321 -27.752 1.00 0.00 N ATOM 1623 CA ILE A 105 1.407 32.864 -26.643 1.00 0.00 C ATOM 1624 C ILE A 105 2.811 33.420 -26.748 1.00 0.00 C ATOM 1625 O ILE A 105 3.331 33.609 -27.850 1.00 0.00 O ATOM 1626 CB ILE A 105 1.474 31.313 -26.572 1.00 0.00 C ATOM 1627 CG1 ILE A 105 1.917 30.726 -27.922 1.00 0.00 C ATOM 1628 CG2 ILE A 105 0.130 30.732 -26.140 1.00 0.00 C ATOM 1629 CD1 ILE A 105 2.049 29.216 -27.923 1.00 0.00 C ATOM 0 H ILE A 105 1.060 33.270 -28.660 1.00 0.00 H new ATOM 0 HA ILE A 105 0.932 33.227 -25.731 1.00 0.00 H new ATOM 0 HB ILE A 105 2.217 31.038 -25.823 1.00 0.00 H new ATOM 0 HG12 ILE A 105 1.198 31.018 -28.687 1.00 0.00 H new ATOM 0 HG13 ILE A 105 2.875 31.165 -28.201 1.00 0.00 H new ATOM 0 HG21 ILE A 105 0.200 29.645 -26.097 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -0.133 31.118 -25.155 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -0.638 31.018 -26.859 1.00 0.00 H new ATOM 0 HD11 ILE A 105 2.365 28.879 -28.910 1.00 0.00 H new ATOM 0 HD12 ILE A 105 2.790 28.915 -27.183 1.00 0.00 H new ATOM 0 HD13 ILE A 105 1.087 28.767 -27.677 1.00 0.00 H new ATOM 1641 N SER A 106 3.403 33.702 -25.614 1.00 0.00 N ATOM 1642 CA SER A 106 4.746 34.224 -25.577 1.00 0.00 C ATOM 1643 C SER A 106 5.657 33.324 -24.744 1.00 0.00 C ATOM 1644 O SER A 106 5.291 32.891 -23.648 1.00 0.00 O ATOM 1645 CB SER A 106 4.736 35.656 -25.035 1.00 0.00 C ATOM 1646 OG SER A 106 3.895 35.767 -23.892 1.00 0.00 O ATOM 0 H SER A 106 2.972 33.578 -24.698 1.00 0.00 H new ATOM 0 HA SER A 106 5.143 34.243 -26.592 1.00 0.00 H new ATOM 0 HB2 SER A 106 5.751 35.956 -24.774 1.00 0.00 H new ATOM 0 HB3 SER A 106 4.391 36.339 -25.811 1.00 0.00 H new ATOM 0 HG SER A 106 3.908 36.691 -23.565 1.00 0.00 H new ATOM 1652 N LYS A 107 6.832 33.044 -25.271 1.00 0.00 N ATOM 1653 CA LYS A 107 7.804 32.198 -24.605 1.00 0.00 C ATOM 1654 C LYS A 107 9.132 32.925 -24.495 1.00 0.00 C ATOM 1655 O LYS A 107 9.598 33.518 -25.462 1.00 0.00 O ATOM 1656 CB LYS A 107 7.998 30.883 -25.373 1.00 0.00 C ATOM 1657 CG LYS A 107 6.739 30.038 -25.500 1.00 0.00 C ATOM 1658 CD LYS A 107 7.030 28.726 -26.209 1.00 0.00 C ATOM 1659 CE LYS A 107 5.774 27.879 -26.356 1.00 0.00 C ATOM 1660 NZ LYS A 107 6.063 26.567 -26.986 1.00 0.00 N ATOM 0 H LYS A 107 7.141 33.398 -26.176 1.00 0.00 H new ATOM 0 HA LYS A 107 7.431 31.967 -23.607 1.00 0.00 H new ATOM 0 HB2 LYS A 107 8.370 31.111 -26.372 1.00 0.00 H new ATOM 0 HB3 LYS A 107 8.767 30.294 -24.873 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.331 29.837 -24.510 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.979 30.592 -26.051 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.450 28.929 -27.194 1.00 0.00 H new ATOM 0 HD3 LYS A 107 7.782 28.169 -25.651 1.00 0.00 H new ATOM 0 HE2 LYS A 107 5.326 27.720 -25.375 1.00 0.00 H new ATOM 0 HE3 LYS A 107 5.041 28.417 -26.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 5.182 26.020 -27.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 6.467 26.718 -27.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 6.743 26.042 -26.399 1.00 0.00 H new ATOM 1674 N PRO A 108 9.740 32.916 -23.312 1.00 0.00 N ATOM 1675 CA PRO A 108 11.025 33.579 -23.095 1.00 0.00 C ATOM 1676 C PRO A 108 12.150 32.949 -23.924 1.00 0.00 C ATOM 1677 O PRO A 108 12.392 31.745 -23.843 1.00 0.00 O ATOM 1678 CB PRO A 108 11.287 33.389 -21.594 1.00 0.00 C ATOM 1679 CG PRO A 108 10.446 32.222 -21.202 1.00 0.00 C ATOM 1680 CD PRO A 108 9.238 32.262 -22.091 1.00 0.00 C ATOM 0 HA PRO A 108 10.998 34.625 -23.400 1.00 0.00 H new ATOM 0 HB2 PRO A 108 12.342 33.199 -21.398 1.00 0.00 H new ATOM 0 HB3 PRO A 108 11.014 34.280 -21.029 1.00 0.00 H new ATOM 0 HG2 PRO A 108 10.993 31.288 -21.329 1.00 0.00 H new ATOM 0 HG3 PRO A 108 10.159 32.283 -20.152 1.00 0.00 H new ATOM 0 HD2 PRO A 108 8.857 31.262 -22.298 1.00 0.00 H new ATOM 0 HD3 PRO A 108 8.423 32.826 -21.638 1.00 0.00 H new ATOM 1688 N CYS A 109 12.830 33.773 -24.727 1.00 0.00 N ATOM 1689 CA CYS A 109 13.957 33.288 -25.535 1.00 0.00 C ATOM 1690 C CYS A 109 15.159 33.025 -24.639 1.00 0.00 C ATOM 1691 O CYS A 109 16.102 32.322 -25.021 1.00 0.00 O ATOM 1692 CB CYS A 109 14.336 34.296 -26.632 1.00 0.00 C ATOM 1693 SG CYS A 109 13.053 34.558 -27.906 1.00 0.00 S ATOM 0 H CYS A 109 12.625 34.766 -24.836 1.00 0.00 H new ATOM 0 HA CYS A 109 13.650 32.361 -26.020 1.00 0.00 H new ATOM 0 HB2 CYS A 109 14.564 35.253 -26.163 1.00 0.00 H new ATOM 0 HB3 CYS A 109 15.249 33.955 -27.120 1.00 0.00 H new ATOM 1698 N GLY A 110 15.114 33.598 -23.456 1.00 0.00 N ATOM 1699 CA GLY A 110 16.149 33.415 -22.482 1.00 0.00 C ATOM 1700 C GLY A 110 15.572 33.415 -21.094 1.00 0.00 C ATOM 1701 O GLY A 110 14.462 33.910 -20.896 1.00 0.00 O ATOM 0 H GLY A 110 14.353 34.204 -23.149 1.00 0.00 H new ATOM 0 HA2 GLY A 110 16.668 32.474 -22.666 1.00 0.00 H new ATOM 0 HA3 GLY A 110 16.888 34.210 -22.575 1.00 0.00 H new