USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 631 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 67 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 68 ASN : amide:sc= -1.32 K(o=-1.3,f=-8.7!) USER MOD Set 2.1: A 40 TYR OH : rot -159:sc= 1.7 USER MOD Set 2.2: A 78 LYS NZ :NH3+ 158:sc= 1.33 (180deg=0.104) USER MOD Set 3.1: A 28 LYS NZ :NH3+ -101:sc= 1.17 (180deg=-0.232) USER MOD Set 3.2: A 58 TYR OH : rot -71:sc= 1.62 USER MOD Single : A 15 TYR OH : rot 30:sc= 0 USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 121:sc= -3.68! USER MOD Single : A 25 MET CE :methyl -178:sc= -0.461 (180deg=-0.464) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00195 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0.227 USER MOD Single : A 30 THR OG1 : rot -80:sc= -0.179 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -70:sc= 1.32 USER MOD Single : A 41 GLN : amide:sc= -0.575 X(o=-0.58,f=-0.71) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= 1.15 (180deg=1.14) USER MOD Single : A 50 ASN : amide:sc= -0.488 X(o=-0.49,f=-0.57) USER MOD Single : A 51 THR OG1 : rot 31:sc= -0.113 USER MOD Single : A 52 SER OG : rot 180:sc= 0.0304 USER MOD Single : A 53 LYS NZ :NH3+ 152:sc= -2.1! (180deg=-3.84!) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -3.95! C(o=-3.9!,f=-3.6!) USER MOD Single : A 63 SER OG : rot 160:sc= -3.91! USER MOD Single : A 64 MET CE :methyl 175:sc= -1.37 (180deg=-1.39) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0.942 K(o=0.94,f=-0.12) USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 80 SER OG : rot -1:sc= 1.1 USER MOD Single : A 81 GLN : amide:sc= -1.31 K(o=-1.3,f=-0.32) USER MOD Single : A 84 LYS NZ :NH3+ -169:sc= 0.365 (180deg=0.324) USER MOD Single : A 87 GLN : amide:sc= -0.113 K(o=-0.11,f=-0.74) USER MOD Single : A 88 THR OG1 : rot 98:sc= 0.311 USER MOD ----------------------------------------------------------------- ATOM 220 N TYR A 15 -5.753 -25.570 1.619 1.00 0.00 N ATOM 221 CA TYR A 15 -6.771 -26.242 2.425 1.00 0.00 C ATOM 222 C TYR A 15 -7.910 -26.720 1.517 1.00 0.00 C ATOM 223 O TYR A 15 -8.158 -26.108 0.478 1.00 0.00 O ATOM 224 CB TYR A 15 -7.311 -25.283 3.501 1.00 0.00 C ATOM 225 CG TYR A 15 -6.277 -24.868 4.537 1.00 0.00 C ATOM 226 CD1 TYR A 15 -5.289 -23.938 4.233 1.00 0.00 C ATOM 227 CD2 TYR A 15 -6.289 -25.408 5.819 1.00 0.00 C ATOM 228 CE1 TYR A 15 -4.347 -23.562 5.172 1.00 0.00 C ATOM 229 CE2 TYR A 15 -5.349 -25.035 6.762 1.00 0.00 C ATOM 230 CZ TYR A 15 -4.380 -24.113 6.434 1.00 0.00 C ATOM 231 OH TYR A 15 -3.440 -23.739 7.373 1.00 0.00 O ATOM 0 HA TYR A 15 -6.326 -27.104 2.922 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -7.701 -24.389 3.014 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -8.149 -25.759 4.010 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -5.257 -23.502 3.246 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -7.046 -26.132 6.082 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -3.587 -22.838 4.917 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -5.375 -25.465 7.752 1.00 0.00 H new ATOM 0 HH TYR A 15 -3.158 -22.816 7.204 1.00 0.00 H new ATOM 241 N PRO A 16 -8.625 -27.811 1.878 1.00 0.00 N ATOM 242 CA PRO A 16 -8.401 -28.587 3.103 1.00 0.00 C ATOM 243 C PRO A 16 -7.261 -29.596 2.956 1.00 0.00 C ATOM 244 O PRO A 16 -7.004 -30.107 1.862 1.00 0.00 O ATOM 245 CB PRO A 16 -9.745 -29.323 3.320 1.00 0.00 C ATOM 246 CG PRO A 16 -10.637 -28.901 2.189 1.00 0.00 C ATOM 247 CD PRO A 16 -9.734 -28.377 1.109 1.00 0.00 C ATOM 0 HA PRO A 16 -8.110 -27.948 3.937 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -9.602 -30.404 3.321 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -10.184 -29.058 4.282 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -11.229 -29.742 1.827 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -11.339 -28.134 2.514 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -9.401 -29.168 0.438 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -10.229 -27.625 0.495 1.00 0.00 H new ATOM 255 N CYS A 17 -6.590 -29.885 4.064 1.00 0.00 N ATOM 256 CA CYS A 17 -5.479 -30.831 4.073 1.00 0.00 C ATOM 257 C CYS A 17 -5.291 -31.415 5.470 1.00 0.00 C ATOM 258 O CYS A 17 -5.781 -30.853 6.455 1.00 0.00 O ATOM 259 CB CYS A 17 -4.191 -30.135 3.615 1.00 0.00 C ATOM 260 SG CYS A 17 -3.758 -28.674 4.589 1.00 0.00 S ATOM 0 H CYS A 17 -6.797 -29.475 4.975 1.00 0.00 H new ATOM 0 HA CYS A 17 -5.707 -31.643 3.383 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -3.368 -30.848 3.663 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -4.299 -29.843 2.570 1.00 0.00 H new ATOM 0 HG CYS A 17 -2.657 -28.157 4.130 1.00 0.00 H new ATOM 266 N LEU A 18 -4.603 -32.550 5.543 1.00 0.00 N ATOM 267 CA LEU A 18 -4.280 -33.182 6.817 1.00 0.00 C ATOM 268 C LEU A 18 -3.264 -32.340 7.581 1.00 0.00 C ATOM 269 O LEU A 18 -2.078 -32.332 7.242 1.00 0.00 O ATOM 270 CB LEU A 18 -3.717 -34.593 6.581 1.00 0.00 C ATOM 271 CG LEU A 18 -4.728 -35.626 6.056 1.00 0.00 C ATOM 272 CD1 LEU A 18 -4.008 -36.847 5.489 1.00 0.00 C ATOM 273 CD2 LEU A 18 -5.693 -36.041 7.165 1.00 0.00 C ATOM 0 H LEU A 18 -4.256 -33.054 4.727 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.192 -33.258 7.409 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.893 -34.523 5.871 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.300 -34.961 7.518 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.302 -35.165 5.253 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.742 -37.565 5.123 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.361 -36.539 4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -3.406 -37.310 6.271 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.401 -36.772 6.776 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.132 -36.482 7.989 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.235 -35.165 7.522 1.00 0.00 H new ATOM 285 N TRP A 19 -3.734 -31.615 8.591 1.00 0.00 N ATOM 286 CA TRP A 19 -2.848 -30.822 9.435 1.00 0.00 C ATOM 287 C TRP A 19 -2.462 -31.629 10.673 1.00 0.00 C ATOM 288 O TRP A 19 -3.254 -32.440 11.163 1.00 0.00 O ATOM 289 CB TRP A 19 -3.504 -29.493 9.839 1.00 0.00 C ATOM 290 CG TRP A 19 -2.520 -28.524 10.431 1.00 0.00 C ATOM 291 CD1 TRP A 19 -2.285 -28.285 11.757 1.00 0.00 C ATOM 292 CD2 TRP A 19 -1.619 -27.679 9.705 1.00 0.00 C ATOM 293 NE1 TRP A 19 -1.290 -27.348 11.895 1.00 0.00 N ATOM 294 CE2 TRP A 19 -0.866 -26.960 10.650 1.00 0.00 C ATOM 295 CE3 TRP A 19 -1.376 -27.462 8.344 1.00 0.00 C ATOM 296 CZ2 TRP A 19 0.114 -26.043 10.279 1.00 0.00 C ATOM 297 CZ3 TRP A 19 -0.403 -26.551 7.978 1.00 0.00 C ATOM 298 CH2 TRP A 19 0.332 -25.852 8.942 1.00 0.00 C ATOM 0 H TRP A 19 -4.721 -31.560 8.844 1.00 0.00 H new ATOM 0 HA TRP A 19 -1.949 -30.584 8.866 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -3.972 -29.042 8.964 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -4.297 -29.687 10.561 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -2.805 -28.762 12.575 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -0.925 -26.997 12.781 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -1.939 -27.997 7.593 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 0.682 -25.501 11.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -0.207 -26.376 6.931 1.00 0.00 H new ATOM 0 HH2 TRP A 19 1.086 -25.148 8.624 1.00 0.00 H new ATOM 309 N ASP A 20 -1.246 -31.407 11.166 1.00 0.00 N ATOM 310 CA ASP A 20 -0.707 -32.188 12.279 1.00 0.00 C ATOM 311 C ASP A 20 -0.815 -31.417 13.593 1.00 0.00 C ATOM 312 O ASP A 20 -0.250 -30.328 13.737 1.00 0.00 O ATOM 313 CB ASP A 20 0.760 -32.551 12.008 1.00 0.00 C ATOM 314 CG ASP A 20 1.309 -33.561 13.008 1.00 0.00 C ATOM 315 OD1 ASP A 20 1.142 -34.777 12.770 1.00 0.00 O ATOM 316 OD2 ASP A 20 1.918 -33.151 14.022 1.00 0.00 O ATOM 0 H ASP A 20 -0.613 -30.690 10.812 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.295 -33.102 12.367 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.850 -32.958 11.001 1.00 0.00 H new ATOM 0 HB3 ASP A 20 1.366 -31.646 12.042 1.00 0.00 H new ATOM 321 N TYR A 21 -1.549 -31.986 14.540 1.00 0.00 N ATOM 322 CA TYR A 21 -1.688 -31.419 15.877 1.00 0.00 C ATOM 323 C TYR A 21 -0.856 -32.221 16.869 1.00 0.00 C ATOM 324 O TYR A 21 -0.697 -33.439 16.721 1.00 0.00 O ATOM 325 CB TYR A 21 -3.157 -31.427 16.323 1.00 0.00 C ATOM 326 CG TYR A 21 -4.067 -30.559 15.477 1.00 0.00 C ATOM 327 CD1 TYR A 21 -4.686 -31.067 14.341 1.00 0.00 C ATOM 328 CD2 TYR A 21 -4.315 -29.234 15.823 1.00 0.00 C ATOM 329 CE1 TYR A 21 -5.521 -30.281 13.574 1.00 0.00 C ATOM 330 CE2 TYR A 21 -5.153 -28.444 15.062 1.00 0.00 C ATOM 331 CZ TYR A 21 -5.753 -28.973 13.939 1.00 0.00 C ATOM 332 OH TYR A 21 -6.592 -28.196 13.181 1.00 0.00 O ATOM 0 H TYR A 21 -2.066 -32.855 14.404 1.00 0.00 H new ATOM 0 HA TYR A 21 -1.335 -30.388 15.849 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.527 -32.452 16.300 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -3.213 -31.091 17.359 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -4.511 -32.093 14.054 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -3.844 -28.817 16.701 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -5.991 -30.689 12.691 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -5.337 -27.418 15.344 1.00 0.00 H new ATOM 0 HH TYR A 21 -7.334 -27.878 13.737 1.00 0.00 H new ATOM 342 N ARG A 22 -0.336 -31.541 17.881 1.00 0.00 N ATOM 343 CA ARG A 22 0.470 -32.181 18.910 1.00 0.00 C ATOM 344 C ARG A 22 -0.112 -31.862 20.284 1.00 0.00 C ATOM 345 O ARG A 22 -0.123 -30.706 20.713 1.00 0.00 O ATOM 346 CB ARG A 22 1.924 -31.703 18.807 1.00 0.00 C ATOM 347 CG ARG A 22 2.926 -32.603 19.517 1.00 0.00 C ATOM 348 CD ARG A 22 2.922 -34.010 18.927 1.00 0.00 C ATOM 349 NE ARG A 22 3.005 -33.988 17.459 1.00 0.00 N ATOM 350 CZ ARG A 22 4.052 -34.418 16.753 1.00 0.00 C ATOM 351 NH1 ARG A 22 5.139 -34.863 17.371 1.00 0.00 N ATOM 352 NH2 ARG A 22 4.016 -34.379 15.426 1.00 0.00 N ATOM 0 H ARG A 22 -0.460 -30.537 18.011 1.00 0.00 H new ATOM 0 HA ARG A 22 0.456 -33.262 18.768 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.198 -31.632 17.754 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.995 -30.698 19.224 1.00 0.00 H new ATOM 0 HG2 ARG A 22 3.925 -32.175 19.435 1.00 0.00 H new ATOM 0 HG3 ARG A 22 2.686 -32.651 20.579 1.00 0.00 H new ATOM 0 HD2 ARG A 22 3.762 -34.575 19.330 1.00 0.00 H new ATOM 0 HD3 ARG A 22 2.013 -34.529 19.232 1.00 0.00 H new ATOM 0 HE ARG A 22 2.206 -33.618 16.944 1.00 0.00 H new ATOM 0 HH11 ARG A 22 5.176 -34.877 18.390 1.00 0.00 H new ATOM 0 HH12 ARG A 22 5.937 -35.191 16.827 1.00 0.00 H new ATOM 0 HH21 ARG A 22 3.189 -34.021 14.949 1.00 0.00 H new ATOM 0 HH22 ARG A 22 4.815 -34.707 14.884 1.00 0.00 H new ATOM 366 N VAL A 23 -0.614 -32.887 20.961 1.00 0.00 N ATOM 367 CA VAL A 23 -1.299 -32.714 22.239 1.00 0.00 C ATOM 368 C VAL A 23 -0.525 -33.400 23.362 1.00 0.00 C ATOM 369 O VAL A 23 -0.448 -34.625 23.406 1.00 0.00 O ATOM 370 CB VAL A 23 -2.733 -33.299 22.184 1.00 0.00 C ATOM 371 CG1 VAL A 23 -3.493 -33.004 23.476 1.00 0.00 C ATOM 372 CG2 VAL A 23 -3.485 -32.772 20.962 1.00 0.00 C ATOM 0 H VAL A 23 -0.560 -33.855 20.644 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.356 -31.644 22.437 1.00 0.00 H new ATOM 0 HB VAL A 23 -2.657 -34.382 22.087 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -4.496 -33.425 23.412 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -2.965 -33.451 24.319 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.560 -31.926 23.620 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -4.489 -33.195 20.942 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.550 -31.685 21.016 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.953 -33.059 20.055 1.00 0.00 H new ATOM 382 N ILE A 24 0.056 -32.612 24.260 1.00 0.00 N ATOM 383 CA ILE A 24 0.799 -33.160 25.391 1.00 0.00 C ATOM 384 C ILE A 24 -0.054 -33.118 26.660 1.00 0.00 C ATOM 385 O ILE A 24 -0.315 -32.044 27.213 1.00 0.00 O ATOM 386 CB ILE A 24 2.130 -32.396 25.620 1.00 0.00 C ATOM 387 CG1 ILE A 24 3.017 -32.480 24.363 1.00 0.00 C ATOM 388 CG2 ILE A 24 2.869 -32.953 26.840 1.00 0.00 C ATOM 389 CD1 ILE A 24 4.316 -31.705 24.474 1.00 0.00 C ATOM 0 H ILE A 24 0.027 -31.593 24.228 1.00 0.00 H new ATOM 0 HA ILE A 24 1.041 -34.197 25.156 1.00 0.00 H new ATOM 0 HB ILE A 24 1.899 -31.348 25.812 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.246 -33.526 24.161 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.454 -32.106 23.508 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.800 -32.404 26.984 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.243 -32.844 27.726 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.091 -34.008 26.680 1.00 0.00 H new ATOM 0 HD11 ILE A 24 4.884 -31.813 23.550 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.097 -30.651 24.644 1.00 0.00 H new ATOM 0 HD13 ILE A 24 4.901 -32.093 25.308 1.00 0.00 H new ATOM 401 N MET A 25 -0.506 -34.291 27.100 1.00 0.00 N ATOM 402 CA MET A 25 -1.318 -34.411 28.313 1.00 0.00 C ATOM 403 C MET A 25 -0.534 -35.117 29.413 1.00 0.00 C ATOM 404 O MET A 25 0.597 -35.544 29.198 1.00 0.00 O ATOM 405 CB MET A 25 -2.625 -35.174 28.033 1.00 0.00 C ATOM 406 CG MET A 25 -3.539 -34.492 27.022 1.00 0.00 C ATOM 407 SD MET A 25 -5.227 -35.139 27.058 1.00 0.00 S ATOM 408 CE MET A 25 -4.970 -36.851 26.603 1.00 0.00 C ATOM 0 H MET A 25 -0.323 -35.178 26.632 1.00 0.00 H new ATOM 0 HA MET A 25 -1.570 -33.404 28.644 1.00 0.00 H new ATOM 0 HB2 MET A 25 -2.380 -36.172 27.670 1.00 0.00 H new ATOM 0 HB3 MET A 25 -3.167 -35.300 28.970 1.00 0.00 H new ATOM 0 HG2 MET A 25 -3.561 -33.421 27.223 1.00 0.00 H new ATOM 0 HG3 MET A 25 -3.127 -34.620 26.021 1.00 0.00 H new ATOM 0 HE1 MET A 25 -5.931 -37.362 26.551 1.00 0.00 H new ATOM 0 HE2 MET A 25 -4.480 -36.899 25.630 1.00 0.00 H new ATOM 0 HE3 MET A 25 -4.342 -37.336 27.350 1.00 0.00 H new ATOM 418 N THR A 26 -1.138 -35.230 30.590 1.00 0.00 N ATOM 419 CA THR A 26 -0.507 -35.898 31.728 1.00 0.00 C ATOM 420 C THR A 26 -1.139 -37.267 31.994 1.00 0.00 C ATOM 421 O THR A 26 -0.893 -37.888 33.034 1.00 0.00 O ATOM 422 CB THR A 26 -0.620 -35.024 32.996 1.00 0.00 C ATOM 423 OG1 THR A 26 -1.973 -34.564 33.144 1.00 0.00 O ATOM 424 CG2 THR A 26 0.329 -33.833 32.930 1.00 0.00 C ATOM 0 H THR A 26 -2.071 -34.866 30.784 1.00 0.00 H new ATOM 0 HA THR A 26 0.544 -36.045 31.480 1.00 0.00 H new ATOM 0 HB THR A 26 -0.342 -35.630 33.858 1.00 0.00 H new ATOM 0 HG1 THR A 26 -2.044 -34.011 33.950 1.00 0.00 H new ATOM 0 HG21 THR A 26 0.227 -33.236 33.836 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.355 -34.190 32.844 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.084 -33.220 32.062 1.00 0.00 H new ATOM 432 N THR A 27 -1.935 -37.743 31.044 1.00 0.00 N ATOM 433 CA THR A 27 -2.648 -39.007 31.191 1.00 0.00 C ATOM 434 C THR A 27 -2.674 -39.761 29.865 1.00 0.00 C ATOM 435 O THR A 27 -2.495 -39.164 28.801 1.00 0.00 O ATOM 436 CB THR A 27 -4.100 -38.775 31.682 1.00 0.00 C ATOM 437 OG1 THR A 27 -4.774 -40.031 31.866 1.00 0.00 O ATOM 438 CG2 THR A 27 -4.887 -37.916 30.694 1.00 0.00 C ATOM 0 H THR A 27 -2.104 -37.269 30.157 1.00 0.00 H new ATOM 0 HA THR A 27 -2.118 -39.602 31.935 1.00 0.00 H new ATOM 0 HB THR A 27 -4.046 -38.249 32.635 1.00 0.00 H new ATOM 0 HG1 THR A 27 -5.689 -39.869 32.178 1.00 0.00 H new ATOM 0 HG21 THR A 27 -5.901 -37.771 31.066 1.00 0.00 H new ATOM 0 HG22 THR A 27 -4.399 -36.948 30.584 1.00 0.00 H new ATOM 0 HG23 THR A 27 -4.923 -38.416 29.726 1.00 0.00 H new ATOM 446 N LYS A 28 -2.889 -41.074 29.938 1.00 0.00 N ATOM 447 CA LYS A 28 -3.019 -41.904 28.743 1.00 0.00 C ATOM 448 C LYS A 28 -4.468 -41.892 28.268 1.00 0.00 C ATOM 449 O LYS A 28 -4.793 -42.430 27.208 1.00 0.00 O ATOM 450 CB LYS A 28 -2.582 -43.352 29.027 1.00 0.00 C ATOM 451 CG LYS A 28 -1.193 -43.478 29.648 1.00 0.00 C ATOM 452 CD LYS A 28 -0.744 -44.936 29.737 1.00 0.00 C ATOM 453 CE LYS A 28 0.552 -45.100 30.523 1.00 0.00 C ATOM 454 NZ LYS A 28 0.409 -44.675 31.943 1.00 0.00 N ATOM 0 H LYS A 28 -2.977 -41.586 30.816 1.00 0.00 H new ATOM 0 HA LYS A 28 -2.371 -41.495 27.968 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.309 -43.814 29.695 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -2.603 -43.915 28.094 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.476 -42.912 29.053 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -1.199 -43.037 30.645 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.529 -45.527 30.209 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -0.608 -45.333 28.731 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.866 -46.143 30.488 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.339 -44.514 30.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 0.815 -43.725 32.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.599 -44.657 32.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 0.911 -45.346 32.559 1.00 0.00 H new ATOM 468 N ASP A 29 -5.338 -41.272 29.064 1.00 0.00 N ATOM 469 CA ASP A 29 -6.761 -41.230 28.763 1.00 0.00 C ATOM 470 C ASP A 29 -7.026 -40.223 27.660 1.00 0.00 C ATOM 471 O ASP A 29 -7.346 -39.058 27.918 1.00 0.00 O ATOM 472 CB ASP A 29 -7.589 -40.884 30.015 1.00 0.00 C ATOM 473 CG ASP A 29 -9.077 -40.713 29.715 1.00 0.00 C ATOM 474 OD1 ASP A 29 -9.701 -41.668 29.199 1.00 0.00 O ATOM 475 OD2 ASP A 29 -9.630 -39.621 29.996 1.00 0.00 O ATOM 0 H ASP A 29 -5.077 -40.791 29.925 1.00 0.00 H new ATOM 0 HA ASP A 29 -7.067 -42.220 28.426 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -7.461 -41.671 30.758 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -7.204 -39.964 30.456 1.00 0.00 H new ATOM 480 N THR A 30 -6.829 -40.658 26.429 1.00 0.00 N ATOM 481 CA THR A 30 -7.156 -39.841 25.286 1.00 0.00 C ATOM 482 C THR A 30 -8.559 -40.205 24.795 1.00 0.00 C ATOM 483 O THR A 30 -8.762 -41.214 24.112 1.00 0.00 O ATOM 484 CB THR A 30 -6.107 -39.989 24.150 1.00 0.00 C ATOM 485 OG1 THR A 30 -6.543 -39.291 22.975 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.838 -41.454 23.811 1.00 0.00 C ATOM 0 H THR A 30 -6.444 -41.574 26.200 1.00 0.00 H new ATOM 0 HA THR A 30 -7.139 -38.794 25.588 1.00 0.00 H new ATOM 0 HB THR A 30 -5.175 -39.552 24.509 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.196 -39.840 22.492 1.00 0.00 H new ATOM 0 HG21 THR A 30 -5.099 -41.513 23.012 1.00 0.00 H new ATOM 0 HG22 THR A 30 -5.459 -41.968 24.694 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.764 -41.928 23.484 1.00 0.00 H new ATOM 494 N SER A 31 -9.530 -39.384 25.173 1.00 0.00 N ATOM 495 CA SER A 31 -10.929 -39.639 24.865 1.00 0.00 C ATOM 496 C SER A 31 -11.647 -38.314 24.643 1.00 0.00 C ATOM 497 O SER A 31 -12.261 -38.096 23.597 1.00 0.00 O ATOM 498 CB SER A 31 -11.581 -40.434 26.006 1.00 0.00 C ATOM 499 OG SER A 31 -12.892 -40.851 25.666 1.00 0.00 O ATOM 0 H SER A 31 -9.370 -38.526 25.700 1.00 0.00 H new ATOM 0 HA SER A 31 -11.003 -40.233 23.954 1.00 0.00 H new ATOM 0 HB2 SER A 31 -10.970 -41.306 26.239 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.615 -39.819 26.906 1.00 0.00 H new ATOM 0 HG SER A 31 -13.279 -41.356 26.412 1.00 0.00 H new ATOM 505 N THR A 32 -11.528 -37.418 25.621 1.00 0.00 N ATOM 506 CA THR A 32 -12.099 -36.081 25.516 1.00 0.00 C ATOM 507 C THR A 32 -11.494 -35.353 24.314 1.00 0.00 C ATOM 508 O THR A 32 -12.148 -34.532 23.668 1.00 0.00 O ATOM 509 CB THR A 32 -11.844 -35.279 26.812 1.00 0.00 C ATOM 510 OG1 THR A 32 -12.224 -36.075 27.947 1.00 0.00 O ATOM 511 CG2 THR A 32 -12.628 -33.969 26.823 1.00 0.00 C ATOM 0 H THR A 32 -11.039 -37.597 26.498 1.00 0.00 H new ATOM 0 HA THR A 32 -13.176 -36.169 25.374 1.00 0.00 H new ATOM 0 HB THR A 32 -10.782 -35.037 26.859 1.00 0.00 H new ATOM 0 HG1 THR A 32 -12.062 -35.569 28.770 1.00 0.00 H new ATOM 0 HG21 THR A 32 -12.425 -33.431 27.749 1.00 0.00 H new ATOM 0 HG22 THR A 32 -12.325 -33.357 25.974 1.00 0.00 H new ATOM 0 HG23 THR A 32 -13.695 -34.183 26.754 1.00 0.00 H new ATOM 519 N LEU A 33 -10.239 -35.687 24.017 1.00 0.00 N ATOM 520 CA LEU A 33 -9.553 -35.176 22.837 1.00 0.00 C ATOM 521 C LEU A 33 -10.307 -35.579 21.571 1.00 0.00 C ATOM 522 O LEU A 33 -10.524 -34.764 20.678 1.00 0.00 O ATOM 523 CB LEU A 33 -8.113 -35.713 22.797 1.00 0.00 C ATOM 524 CG LEU A 33 -7.266 -35.262 21.594 1.00 0.00 C ATOM 525 CD1 LEU A 33 -7.156 -33.739 21.548 1.00 0.00 C ATOM 526 CD2 LEU A 33 -5.879 -35.907 21.645 1.00 0.00 C ATOM 0 H LEU A 33 -9.673 -36.317 24.586 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.522 -34.088 22.888 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.605 -35.406 23.711 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.151 -36.802 22.803 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.763 -35.590 20.681 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.553 -33.444 20.689 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -8.152 -33.305 21.459 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.685 -33.380 22.463 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.293 -35.578 20.787 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.374 -35.612 22.565 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.981 -36.992 21.620 1.00 0.00 H new ATOM 538 N LYS A 34 -10.727 -36.841 21.516 1.00 0.00 N ATOM 539 CA LYS A 34 -11.459 -37.357 20.362 1.00 0.00 C ATOM 540 C LYS A 34 -12.862 -36.756 20.309 1.00 0.00 C ATOM 541 O LYS A 34 -13.391 -36.504 19.231 1.00 0.00 O ATOM 542 CB LYS A 34 -11.537 -38.889 20.414 1.00 0.00 C ATOM 543 CG LYS A 34 -10.175 -39.578 20.351 1.00 0.00 C ATOM 544 CD LYS A 34 -10.303 -41.098 20.445 1.00 0.00 C ATOM 545 CE LYS A 34 -10.958 -41.530 21.754 1.00 0.00 C ATOM 546 NZ LYS A 34 -11.094 -43.005 21.862 1.00 0.00 N ATOM 0 H LYS A 34 -10.573 -37.525 22.257 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.922 -37.069 19.458 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.042 -39.187 21.333 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -12.150 -39.241 19.584 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -9.676 -39.312 19.419 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -9.546 -39.215 21.164 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.892 -41.466 19.605 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -9.315 -41.552 20.365 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -10.367 -41.161 22.592 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.943 -41.071 21.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -11.544 -43.247 22.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.681 -43.358 21.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -10.153 -43.445 21.815 1.00 0.00 H new ATOM 560 N GLU A 35 -13.441 -36.507 21.485 1.00 0.00 N ATOM 561 CA GLU A 35 -14.787 -35.936 21.590 1.00 0.00 C ATOM 562 C GLU A 35 -14.933 -34.678 20.732 1.00 0.00 C ATOM 563 O GLU A 35 -15.896 -34.541 19.973 1.00 0.00 O ATOM 564 CB GLU A 35 -15.114 -35.594 23.053 1.00 0.00 C ATOM 565 CG GLU A 35 -15.333 -36.807 23.949 1.00 0.00 C ATOM 566 CD GLU A 35 -16.537 -37.634 23.531 1.00 0.00 C ATOM 567 OE1 GLU A 35 -17.631 -37.055 23.351 1.00 0.00 O ATOM 568 OE2 GLU A 35 -16.396 -38.865 23.379 1.00 0.00 O ATOM 0 H GLU A 35 -12.996 -36.693 22.384 1.00 0.00 H new ATOM 0 HA GLU A 35 -15.487 -36.687 21.224 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.301 -34.996 23.464 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -16.010 -34.973 23.077 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -14.442 -37.434 23.929 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.465 -36.474 24.978 1.00 0.00 H new ATOM 575 N LEU A 36 -13.972 -33.765 20.858 1.00 0.00 N ATOM 576 CA LEU A 36 -14.021 -32.497 20.132 1.00 0.00 C ATOM 577 C LEU A 36 -13.800 -32.735 18.640 1.00 0.00 C ATOM 578 O LEU A 36 -14.321 -32.004 17.803 1.00 0.00 O ATOM 579 CB LEU A 36 -12.985 -31.504 20.699 1.00 0.00 C ATOM 580 CG LEU A 36 -11.509 -31.767 20.326 1.00 0.00 C ATOM 581 CD1 LEU A 36 -11.086 -30.929 19.118 1.00 0.00 C ATOM 582 CD2 LEU A 36 -10.587 -31.508 21.517 1.00 0.00 C ATOM 0 H LEU A 36 -13.152 -33.879 21.454 1.00 0.00 H new ATOM 0 HA LEU A 36 -15.009 -32.056 20.263 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -13.250 -30.502 20.360 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -13.069 -31.506 21.786 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.419 -32.818 20.052 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -10.043 -31.136 18.879 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -11.711 -31.183 18.262 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.202 -29.871 19.351 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.554 -31.701 21.226 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.687 -30.470 21.835 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.862 -32.168 22.340 1.00 0.00 H new ATOM 594 N LEU A 37 -13.028 -33.769 18.319 1.00 0.00 N ATOM 595 CA LEU A 37 -12.731 -34.114 16.930 1.00 0.00 C ATOM 596 C LEU A 37 -13.959 -34.721 16.250 1.00 0.00 C ATOM 597 O LEU A 37 -14.247 -34.435 15.084 1.00 0.00 O ATOM 598 CB LEU A 37 -11.556 -35.103 16.875 1.00 0.00 C ATOM 599 CG LEU A 37 -10.252 -34.615 17.533 1.00 0.00 C ATOM 600 CD1 LEU A 37 -9.211 -35.730 17.567 1.00 0.00 C ATOM 601 CD2 LEU A 37 -9.703 -33.390 16.805 1.00 0.00 C ATOM 0 H LEU A 37 -12.594 -34.386 19.005 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.457 -33.203 16.398 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.861 -36.031 17.358 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.350 -35.339 15.831 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.479 -34.329 18.560 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.299 -35.362 18.036 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.599 -36.573 18.140 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.991 -36.053 16.550 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.782 -33.063 17.287 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.497 -33.646 15.766 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.437 -32.585 16.842 1.00 0.00 H new ATOM 613 N GLU A 38 -14.690 -35.544 16.998 1.00 0.00 N ATOM 614 CA GLU A 38 -15.840 -36.270 16.463 1.00 0.00 C ATOM 615 C GLU A 38 -16.987 -35.328 16.107 1.00 0.00 C ATOM 616 O GLU A 38 -17.831 -35.665 15.279 1.00 0.00 O ATOM 617 CB GLU A 38 -16.321 -37.333 17.460 1.00 0.00 C ATOM 618 CG GLU A 38 -15.312 -38.453 17.699 1.00 0.00 C ATOM 619 CD GLU A 38 -15.832 -39.520 18.647 1.00 0.00 C ATOM 620 OE1 GLU A 38 -16.531 -40.447 18.185 1.00 0.00 O ATOM 621 OE2 GLU A 38 -15.550 -39.438 19.859 1.00 0.00 O ATOM 0 H GLU A 38 -14.504 -35.726 17.984 1.00 0.00 H new ATOM 0 HA GLU A 38 -15.515 -36.763 15.547 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -16.547 -36.850 18.411 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -17.252 -37.767 17.094 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -15.055 -38.914 16.745 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -14.394 -38.028 18.105 1.00 0.00 H new ATOM 628 N THR A 39 -17.010 -34.144 16.714 1.00 0.00 N ATOM 629 CA THR A 39 -18.060 -33.168 16.427 1.00 0.00 C ATOM 630 C THR A 39 -18.024 -32.759 14.953 1.00 0.00 C ATOM 631 O THR A 39 -19.055 -32.433 14.359 1.00 0.00 O ATOM 632 CB THR A 39 -17.938 -31.907 17.315 1.00 0.00 C ATOM 633 OG1 THR A 39 -16.711 -31.218 17.033 1.00 0.00 O ATOM 634 CG2 THR A 39 -17.991 -32.270 18.795 1.00 0.00 C ATOM 0 H THR A 39 -16.321 -33.838 17.401 1.00 0.00 H new ATOM 0 HA THR A 39 -19.012 -33.649 16.651 1.00 0.00 H new ATOM 0 HB THR A 39 -18.781 -31.255 17.087 1.00 0.00 H new ATOM 0 HG1 THR A 39 -15.955 -31.750 17.358 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.903 -31.364 19.395 1.00 0.00 H new ATOM 0 HG22 THR A 39 -18.939 -32.761 19.016 1.00 0.00 H new ATOM 0 HG23 THR A 39 -17.169 -32.945 19.034 1.00 0.00 H new ATOM 642 N TYR A 40 -16.825 -32.792 14.370 1.00 0.00 N ATOM 643 CA TYR A 40 -16.635 -32.478 12.955 1.00 0.00 C ATOM 644 C TYR A 40 -17.008 -33.680 12.093 1.00 0.00 C ATOM 645 O TYR A 40 -17.303 -33.538 10.902 1.00 0.00 O ATOM 646 CB TYR A 40 -15.174 -32.082 12.686 1.00 0.00 C ATOM 647 CG TYR A 40 -14.717 -30.857 13.455 1.00 0.00 C ATOM 648 CD1 TYR A 40 -14.288 -30.961 14.775 1.00 0.00 C ATOM 649 CD2 TYR A 40 -14.723 -29.598 12.865 1.00 0.00 C ATOM 650 CE1 TYR A 40 -13.879 -29.848 15.481 1.00 0.00 C ATOM 651 CE2 TYR A 40 -14.316 -28.481 13.567 1.00 0.00 C ATOM 652 CZ TYR A 40 -13.895 -28.612 14.873 1.00 0.00 C ATOM 653 OH TYR A 40 -13.501 -27.500 15.579 1.00 0.00 O ATOM 0 H TYR A 40 -15.965 -33.035 14.862 1.00 0.00 H new ATOM 0 HA TYR A 40 -17.283 -31.640 12.699 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.527 -32.921 12.942 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.049 -31.897 11.619 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.275 -31.929 15.255 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -15.051 -29.492 11.842 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -13.548 -29.945 16.504 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.327 -27.510 13.095 1.00 0.00 H new ATOM 0 HH TYR A 40 -13.866 -26.696 15.154 1.00 0.00 H new ATOM 663 N GLN A 41 -16.976 -34.868 12.708 1.00 0.00 N ATOM 664 CA GLN A 41 -17.282 -36.126 12.022 1.00 0.00 C ATOM 665 C GLN A 41 -16.351 -36.347 10.829 1.00 0.00 C ATOM 666 O GLN A 41 -16.661 -37.120 9.919 1.00 0.00 O ATOM 667 CB GLN A 41 -18.756 -36.153 11.582 1.00 0.00 C ATOM 668 CG GLN A 41 -19.733 -36.228 12.749 1.00 0.00 C ATOM 669 CD GLN A 41 -19.628 -37.536 13.519 1.00 0.00 C ATOM 670 OE1 GLN A 41 -19.338 -38.590 12.949 1.00 0.00 O ATOM 671 NE2 GLN A 41 -19.836 -37.477 14.823 1.00 0.00 N ATOM 0 H GLN A 41 -16.738 -34.983 13.693 1.00 0.00 H new ATOM 0 HA GLN A 41 -17.117 -36.944 12.724 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -18.969 -35.259 10.996 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -18.917 -37.009 10.927 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -19.547 -35.396 13.428 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -20.750 -36.112 12.374 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -20.074 -36.588 15.262 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -19.758 -38.321 15.391 1.00 0.00 H new ATOM 680 N ARG A 42 -15.201 -35.680 10.853 1.00 0.00 N ATOM 681 CA ARG A 42 -14.205 -35.815 9.795 1.00 0.00 C ATOM 682 C ARG A 42 -13.129 -36.813 10.225 1.00 0.00 C ATOM 683 O ARG A 42 -12.927 -37.022 11.423 1.00 0.00 O ATOM 684 CB ARG A 42 -13.570 -34.451 9.472 1.00 0.00 C ATOM 685 CG ARG A 42 -12.651 -33.908 10.564 1.00 0.00 C ATOM 686 CD ARG A 42 -11.865 -32.686 10.090 1.00 0.00 C ATOM 687 NE ARG A 42 -12.660 -31.450 10.083 1.00 0.00 N ATOM 688 CZ ARG A 42 -13.246 -30.922 9.001 1.00 0.00 C ATOM 689 NH1 ARG A 42 -13.233 -31.563 7.838 1.00 0.00 N ATOM 690 NH2 ARG A 42 -13.837 -29.739 9.087 1.00 0.00 N ATOM 0 H ARG A 42 -14.935 -35.037 11.598 1.00 0.00 H new ATOM 0 HA ARG A 42 -14.696 -36.184 8.894 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.001 -34.539 8.546 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -14.365 -33.728 9.290 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -13.244 -33.641 11.439 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.957 -34.688 10.876 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -10.997 -32.548 10.735 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.488 -32.873 9.085 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.774 -30.957 10.969 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.772 -32.470 7.761 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.684 -31.149 7.022 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.844 -29.236 9.974 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.285 -29.332 8.266 1.00 0.00 H new ATOM 704 N PRO A 43 -12.432 -37.448 9.263 1.00 0.00 N ATOM 705 CA PRO A 43 -11.382 -38.428 9.569 1.00 0.00 C ATOM 706 C PRO A 43 -10.196 -37.797 10.304 1.00 0.00 C ATOM 707 O PRO A 43 -9.769 -36.682 9.980 1.00 0.00 O ATOM 708 CB PRO A 43 -10.954 -38.951 8.186 1.00 0.00 C ATOM 709 CG PRO A 43 -11.359 -37.879 7.232 1.00 0.00 C ATOM 710 CD PRO A 43 -12.610 -37.272 7.806 1.00 0.00 C ATOM 0 HA PRO A 43 -11.740 -39.213 10.235 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -9.880 -39.131 8.146 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.444 -39.896 7.951 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.573 -37.131 7.128 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -11.543 -38.288 6.239 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.708 -36.220 7.536 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -13.505 -37.778 7.446 1.00 0.00 H new ATOM 718 N PHE A 44 -9.683 -38.514 11.302 1.00 0.00 N ATOM 719 CA PHE A 44 -8.523 -38.073 12.069 1.00 0.00 C ATOM 720 C PHE A 44 -7.716 -39.279 12.549 1.00 0.00 C ATOM 721 O PHE A 44 -8.266 -40.368 12.745 1.00 0.00 O ATOM 722 CB PHE A 44 -8.956 -37.207 13.266 1.00 0.00 C ATOM 723 CG PHE A 44 -9.830 -37.920 14.276 1.00 0.00 C ATOM 724 CD1 PHE A 44 -11.213 -37.924 14.142 1.00 0.00 C ATOM 725 CD2 PHE A 44 -9.267 -38.580 15.363 1.00 0.00 C ATOM 726 CE1 PHE A 44 -12.012 -38.571 15.067 1.00 0.00 C ATOM 727 CE2 PHE A 44 -10.063 -39.227 16.289 1.00 0.00 C ATOM 728 CZ PHE A 44 -11.436 -39.222 16.141 1.00 0.00 C ATOM 0 H PHE A 44 -10.059 -39.414 11.600 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.893 -37.466 11.419 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.064 -36.839 13.773 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.493 -36.335 12.892 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -11.669 -37.416 13.305 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.194 -38.587 15.485 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -13.086 -38.567 14.950 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -9.612 -39.736 17.128 1.00 0.00 H new ATOM 0 HZ PHE A 44 -12.059 -39.727 16.864 1.00 0.00 H new ATOM 738 N LYS A 45 -6.415 -39.082 12.731 1.00 0.00 N ATOM 739 CA LYS A 45 -5.522 -40.143 13.193 1.00 0.00 C ATOM 740 C LYS A 45 -5.146 -39.921 14.654 1.00 0.00 C ATOM 741 O LYS A 45 -4.529 -38.909 14.988 1.00 0.00 O ATOM 742 CB LYS A 45 -4.245 -40.174 12.341 1.00 0.00 C ATOM 743 CG LYS A 45 -3.272 -41.291 12.718 1.00 0.00 C ATOM 744 CD LYS A 45 -1.942 -41.172 11.971 1.00 0.00 C ATOM 745 CE LYS A 45 -1.161 -39.923 12.381 1.00 0.00 C ATOM 746 NZ LYS A 45 0.145 -39.823 11.675 1.00 0.00 N ATOM 0 H LYS A 45 -5.950 -38.189 12.564 1.00 0.00 H new ATOM 0 HA LYS A 45 -6.044 -41.095 13.096 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.523 -40.287 11.293 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -3.735 -39.215 12.434 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -3.088 -41.264 13.792 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -3.726 -42.257 12.497 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -1.337 -42.057 12.166 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -2.131 -41.145 10.898 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -1.757 -39.036 12.166 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -0.990 -39.940 13.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 0.641 -38.962 11.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.726 -40.656 11.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -0.018 -39.781 10.649 1.00 0.00 H new ATOM 760 N LEU A 46 -5.521 -40.859 15.516 1.00 0.00 N ATOM 761 CA LEU A 46 -5.112 -40.824 16.916 1.00 0.00 C ATOM 762 C LEU A 46 -3.780 -41.561 17.045 1.00 0.00 C ATOM 763 O LEU A 46 -3.710 -42.778 16.845 1.00 0.00 O ATOM 764 CB LEU A 46 -6.195 -41.464 17.811 1.00 0.00 C ATOM 765 CG LEU A 46 -6.149 -41.101 19.315 1.00 0.00 C ATOM 766 CD1 LEU A 46 -4.907 -41.669 20.003 1.00 0.00 C ATOM 767 CD2 LEU A 46 -6.221 -39.585 19.504 1.00 0.00 C ATOM 0 H LEU A 46 -6.109 -41.655 15.270 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.989 -39.793 17.247 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.172 -41.180 17.421 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.118 -42.547 17.719 1.00 0.00 H new ATOM 0 HG LEU A 46 -7.020 -41.557 19.786 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.915 -41.390 21.057 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.907 -42.755 19.915 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.012 -41.267 19.528 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -6.187 -39.349 20.568 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.376 -39.115 19.001 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.151 -39.209 19.078 1.00 0.00 H new ATOM 779 N GLU A 47 -2.726 -40.816 17.360 1.00 0.00 N ATOM 780 CA GLU A 47 -1.371 -41.358 17.390 1.00 0.00 C ATOM 781 C GLU A 47 -0.664 -41.009 18.699 1.00 0.00 C ATOM 782 O GLU A 47 -1.012 -40.034 19.367 1.00 0.00 O ATOM 783 CB GLU A 47 -0.578 -40.822 16.182 1.00 0.00 C ATOM 784 CG GLU A 47 -0.122 -41.905 15.210 1.00 0.00 C ATOM 785 CD GLU A 47 1.165 -42.590 15.642 1.00 0.00 C ATOM 786 OE1 GLU A 47 1.171 -43.264 16.691 1.00 0.00 O ATOM 787 OE2 GLU A 47 2.180 -42.456 14.924 1.00 0.00 O ATOM 0 H GLU A 47 -2.785 -39.826 17.600 1.00 0.00 H new ATOM 0 HA GLU A 47 -1.427 -42.445 17.330 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.196 -40.103 15.645 1.00 0.00 H new ATOM 0 HB3 GLU A 47 0.297 -40.282 16.545 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -0.909 -42.652 15.112 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.022 -41.463 14.224 1.00 0.00 H new ATOM 794 N PHE A 48 0.329 -41.817 19.050 1.00 0.00 N ATOM 795 CA PHE A 48 1.119 -41.617 20.259 1.00 0.00 C ATOM 796 C PHE A 48 2.597 -41.544 19.887 1.00 0.00 C ATOM 797 O PHE A 48 3.171 -42.524 19.405 1.00 0.00 O ATOM 798 CB PHE A 48 0.859 -42.763 21.249 1.00 0.00 C ATOM 799 CG PHE A 48 1.684 -42.694 22.512 1.00 0.00 C ATOM 800 CD1 PHE A 48 1.367 -41.793 23.518 1.00 0.00 C ATOM 801 CD2 PHE A 48 2.777 -43.532 22.691 1.00 0.00 C ATOM 802 CE1 PHE A 48 2.122 -41.731 24.675 1.00 0.00 C ATOM 803 CE2 PHE A 48 3.533 -43.473 23.844 1.00 0.00 C ATOM 804 CZ PHE A 48 3.205 -42.573 24.837 1.00 0.00 C ATOM 0 H PHE A 48 0.610 -42.631 18.503 1.00 0.00 H new ATOM 0 HA PHE A 48 0.831 -40.682 20.739 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.197 -42.762 21.519 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.059 -43.711 20.750 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.521 -41.133 23.396 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.039 -44.239 21.918 1.00 0.00 H new ATOM 0 HE1 PHE A 48 1.865 -41.025 25.451 1.00 0.00 H new ATOM 0 HE2 PHE A 48 4.381 -44.131 23.969 1.00 0.00 H new ATOM 0 HZ PHE A 48 3.795 -42.527 25.741 1.00 0.00 H new ATOM 814 N LYS A 49 3.203 -40.377 20.096 1.00 0.00 N ATOM 815 CA LYS A 49 4.583 -40.136 19.676 1.00 0.00 C ATOM 816 C LYS A 49 5.581 -40.647 20.713 1.00 0.00 C ATOM 817 O LYS A 49 6.340 -41.577 20.448 1.00 0.00 O ATOM 818 CB LYS A 49 4.818 -38.637 19.423 1.00 0.00 C ATOM 819 CG LYS A 49 3.966 -38.019 18.306 1.00 0.00 C ATOM 820 CD LYS A 49 4.344 -38.526 16.904 1.00 0.00 C ATOM 821 CE LYS A 49 3.593 -39.798 16.514 1.00 0.00 C ATOM 822 NZ LYS A 49 3.954 -40.272 15.150 1.00 0.00 N ATOM 0 H LYS A 49 2.759 -39.581 20.555 1.00 0.00 H new ATOM 0 HA LYS A 49 4.742 -40.686 18.748 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.624 -38.094 20.348 1.00 0.00 H new ATOM 0 HB3 LYS A 49 5.870 -38.487 19.180 1.00 0.00 H new ATOM 0 HG2 LYS A 49 2.916 -38.241 18.494 1.00 0.00 H new ATOM 0 HG3 LYS A 49 4.073 -36.935 18.334 1.00 0.00 H new ATOM 0 HD2 LYS A 49 4.134 -37.746 16.172 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.417 -38.717 16.868 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.811 -40.583 17.238 1.00 0.00 H new ATOM 0 HE3 LYS A 49 2.520 -39.612 16.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 3.383 -41.107 14.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 3.769 -39.516 14.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 4.963 -40.524 15.126 1.00 0.00 H new ATOM 836 N ASN A 50 5.568 -40.042 21.896 1.00 0.00 N ATOM 837 CA ASN A 50 6.569 -40.332 22.923 1.00 0.00 C ATOM 838 C ASN A 50 6.053 -39.932 24.303 1.00 0.00 C ATOM 839 O ASN A 50 5.143 -39.110 24.417 1.00 0.00 O ATOM 840 CB ASN A 50 7.877 -39.583 22.603 1.00 0.00 C ATOM 841 CG ASN A 50 8.934 -39.725 23.690 1.00 0.00 C ATOM 842 OD1 ASN A 50 9.025 -38.896 24.596 1.00 0.00 O ATOM 843 ND2 ASN A 50 9.736 -40.776 23.617 1.00 0.00 N ATOM 0 H ASN A 50 4.875 -39.346 22.170 1.00 0.00 H new ATOM 0 HA ASN A 50 6.765 -41.404 22.929 1.00 0.00 H new ATOM 0 HB2 ASN A 50 8.281 -39.957 21.662 1.00 0.00 H new ATOM 0 HB3 ASN A 50 7.656 -38.526 22.457 1.00 0.00 H new ATOM 0 HD21 ASN A 50 10.456 -40.918 24.325 1.00 0.00 H new ATOM 0 HD22 ASN A 50 9.633 -41.444 22.853 1.00 0.00 H new ATOM 850 N THR A 51 6.633 -40.524 25.342 1.00 0.00 N ATOM 851 CA THR A 51 6.284 -40.203 26.721 1.00 0.00 C ATOM 852 C THR A 51 7.527 -39.730 27.474 1.00 0.00 C ATOM 853 O THR A 51 8.639 -40.192 27.203 1.00 0.00 O ATOM 854 CB THR A 51 5.656 -41.422 27.444 1.00 0.00 C ATOM 855 OG1 THR A 51 5.357 -41.103 28.812 1.00 0.00 O ATOM 856 CG2 THR A 51 6.579 -42.635 27.388 1.00 0.00 C ATOM 0 H THR A 51 7.356 -41.238 25.252 1.00 0.00 H new ATOM 0 HA THR A 51 5.542 -39.405 26.706 1.00 0.00 H new ATOM 0 HB THR A 51 4.730 -41.668 26.925 1.00 0.00 H new ATOM 0 HG1 THR A 51 5.130 -40.152 28.884 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.110 -43.473 27.904 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.762 -42.905 26.348 1.00 0.00 H new ATOM 0 HG23 THR A 51 7.525 -42.395 27.872 1.00 0.00 H new ATOM 864 N SER A 52 7.330 -38.792 28.395 1.00 0.00 N ATOM 865 CA SER A 52 8.418 -38.218 29.181 1.00 0.00 C ATOM 866 C SER A 52 9.208 -39.300 29.919 1.00 0.00 C ATOM 867 O SER A 52 8.708 -40.403 30.151 1.00 0.00 O ATOM 868 CB SER A 52 7.853 -37.205 30.189 1.00 0.00 C ATOM 869 OG SER A 52 8.835 -36.801 31.131 1.00 0.00 O ATOM 0 H SER A 52 6.412 -38.408 28.618 1.00 0.00 H new ATOM 0 HA SER A 52 9.099 -37.714 28.496 1.00 0.00 H new ATOM 0 HB2 SER A 52 7.478 -36.331 29.656 1.00 0.00 H new ATOM 0 HB3 SER A 52 7.005 -37.647 30.713 1.00 0.00 H new ATOM 0 HG SER A 52 8.443 -36.156 31.756 1.00 0.00 H new ATOM 875 N LYS A 53 10.441 -38.964 30.299 1.00 0.00 N ATOM 876 CA LYS A 53 11.284 -39.857 31.093 1.00 0.00 C ATOM 877 C LYS A 53 10.571 -40.232 32.391 1.00 0.00 C ATOM 878 O LYS A 53 10.728 -41.338 32.908 1.00 0.00 O ATOM 879 CB LYS A 53 12.622 -39.173 31.415 1.00 0.00 C ATOM 880 CG LYS A 53 13.425 -38.752 30.183 1.00 0.00 C ATOM 881 CD LYS A 53 14.014 -39.943 29.422 1.00 0.00 C ATOM 882 CE LYS A 53 15.267 -40.507 30.096 1.00 0.00 C ATOM 883 NZ LYS A 53 14.985 -41.104 31.429 1.00 0.00 N ATOM 0 H LYS A 53 10.880 -38.073 30.067 1.00 0.00 H new ATOM 0 HA LYS A 53 11.477 -40.762 30.517 1.00 0.00 H new ATOM 0 HB2 LYS A 53 12.429 -38.292 32.027 1.00 0.00 H new ATOM 0 HB3 LYS A 53 13.228 -39.851 32.015 1.00 0.00 H new ATOM 0 HG2 LYS A 53 12.782 -38.181 29.513 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.233 -38.088 30.491 1.00 0.00 H new ATOM 0 HD2 LYS A 53 13.262 -40.728 29.345 1.00 0.00 H new ATOM 0 HD3 LYS A 53 14.259 -39.635 28.406 1.00 0.00 H new ATOM 0 HE2 LYS A 53 15.712 -41.264 29.450 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.003 -39.711 30.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.680 -41.851 31.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.049 -40.367 32.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.028 -41.512 31.431 1.00 0.00 H new ATOM 897 N ASN A 54 9.771 -39.296 32.898 1.00 0.00 N ATOM 898 CA ASN A 54 9.037 -39.488 34.150 1.00 0.00 C ATOM 899 C ASN A 54 7.716 -40.210 33.899 1.00 0.00 C ATOM 900 O ASN A 54 7.015 -40.583 34.842 1.00 0.00 O ATOM 901 CB ASN A 54 8.752 -38.134 34.815 1.00 0.00 C ATOM 902 CG ASN A 54 10.006 -37.309 35.045 1.00 0.00 C ATOM 903 OD1 ASN A 54 11.095 -37.845 35.248 1.00 0.00 O ATOM 904 ND2 ASN A 54 9.859 -35.995 35.026 1.00 0.00 N ATOM 0 H ASN A 54 9.613 -38.390 32.458 1.00 0.00 H new ATOM 0 HA ASN A 54 9.656 -40.096 34.810 1.00 0.00 H new ATOM 0 HB2 ASN A 54 8.061 -37.568 34.191 1.00 0.00 H new ATOM 0 HB3 ASN A 54 8.254 -38.302 35.770 1.00 0.00 H new ATOM 0 HD21 ASN A 54 10.665 -35.389 35.183 1.00 0.00 H new ATOM 0 HD22 ASN A 54 8.940 -35.587 34.854 1.00 0.00 H new ATOM 911 N ALA A 55 7.378 -40.387 32.620 1.00 0.00 N ATOM 912 CA ALA A 55 6.106 -40.993 32.216 1.00 0.00 C ATOM 913 C ALA A 55 4.917 -40.171 32.723 1.00 0.00 C ATOM 914 O ALA A 55 3.789 -40.661 32.790 1.00 0.00 O ATOM 915 CB ALA A 55 6.019 -42.434 32.714 1.00 0.00 C ATOM 0 H ALA A 55 7.974 -40.116 31.838 1.00 0.00 H new ATOM 0 HA ALA A 55 6.066 -41.001 31.127 1.00 0.00 H new ATOM 0 HB1 ALA A 55 5.068 -42.869 32.405 1.00 0.00 H new ATOM 0 HB2 ALA A 55 6.838 -43.015 32.291 1.00 0.00 H new ATOM 0 HB3 ALA A 55 6.088 -42.448 33.802 1.00 0.00 H new ATOM 921 N LYS A 56 5.183 -38.915 33.075 1.00 0.00 N ATOM 922 CA LYS A 56 4.153 -38.011 33.578 1.00 0.00 C ATOM 923 C LYS A 56 3.459 -37.300 32.417 1.00 0.00 C ATOM 924 O LYS A 56 2.263 -37.023 32.471 1.00 0.00 O ATOM 925 CB LYS A 56 4.778 -36.982 34.534 1.00 0.00 C ATOM 926 CG LYS A 56 3.776 -36.005 35.150 1.00 0.00 C ATOM 927 CD LYS A 56 2.769 -36.705 36.066 1.00 0.00 C ATOM 928 CE LYS A 56 3.445 -37.357 37.270 1.00 0.00 C ATOM 929 NZ LYS A 56 2.464 -37.996 38.190 1.00 0.00 N ATOM 0 H LYS A 56 6.112 -38.498 33.020 1.00 0.00 H new ATOM 0 HA LYS A 56 3.410 -38.593 34.123 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.290 -37.513 35.336 1.00 0.00 H new ATOM 0 HB3 LYS A 56 5.536 -36.415 33.993 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.314 -35.246 35.718 1.00 0.00 H new ATOM 0 HG3 LYS A 56 3.241 -35.487 34.354 1.00 0.00 H new ATOM 0 HD2 LYS A 56 2.031 -35.982 36.413 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.230 -37.464 35.499 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.156 -38.107 36.923 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.015 -36.605 37.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.969 -38.425 38.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 1.800 -37.277 38.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.937 -38.732 37.678 1.00 0.00 H new ATOM 943 N PHE A 57 4.225 -37.025 31.362 1.00 0.00 N ATOM 944 CA PHE A 57 3.716 -36.306 30.194 1.00 0.00 C ATOM 945 C PHE A 57 3.696 -37.227 28.979 1.00 0.00 C ATOM 946 O PHE A 57 4.653 -37.963 28.736 1.00 0.00 O ATOM 947 CB PHE A 57 4.584 -35.074 29.899 1.00 0.00 C ATOM 948 CG PHE A 57 4.705 -34.123 31.064 1.00 0.00 C ATOM 949 CD1 PHE A 57 3.713 -33.189 31.323 1.00 0.00 C ATOM 950 CD2 PHE A 57 5.811 -34.166 31.902 1.00 0.00 C ATOM 951 CE1 PHE A 57 3.821 -32.319 32.391 1.00 0.00 C ATOM 952 CE2 PHE A 57 5.923 -33.298 32.971 1.00 0.00 C ATOM 953 CZ PHE A 57 4.928 -32.372 33.216 1.00 0.00 C ATOM 0 H PHE A 57 5.207 -37.291 31.292 1.00 0.00 H new ATOM 0 HA PHE A 57 2.700 -35.975 30.409 1.00 0.00 H new ATOM 0 HB2 PHE A 57 5.581 -35.405 29.607 1.00 0.00 H new ATOM 0 HB3 PHE A 57 4.163 -34.539 29.048 1.00 0.00 H new ATOM 0 HD1 PHE A 57 2.845 -33.141 30.682 1.00 0.00 H new ATOM 0 HD2 PHE A 57 6.593 -34.887 31.716 1.00 0.00 H new ATOM 0 HE1 PHE A 57 3.040 -31.598 32.581 1.00 0.00 H new ATOM 0 HE2 PHE A 57 6.789 -33.344 33.615 1.00 0.00 H new ATOM 0 HZ PHE A 57 5.015 -31.691 34.050 1.00 0.00 H new ATOM 963 N TYR A 58 2.605 -37.180 28.225 1.00 0.00 N ATOM 964 CA TYR A 58 2.427 -38.020 27.048 1.00 0.00 C ATOM 965 C TYR A 58 2.198 -37.150 25.818 1.00 0.00 C ATOM 966 O TYR A 58 1.303 -36.302 25.808 1.00 0.00 O ATOM 967 CB TYR A 58 1.232 -38.963 27.240 1.00 0.00 C ATOM 968 CG TYR A 58 1.329 -39.840 28.475 1.00 0.00 C ATOM 969 CD1 TYR A 58 0.967 -39.352 29.726 1.00 0.00 C ATOM 970 CD2 TYR A 58 1.781 -41.153 28.392 1.00 0.00 C ATOM 971 CE1 TYR A 58 1.052 -40.142 30.853 1.00 0.00 C ATOM 972 CE2 TYR A 58 1.867 -41.949 29.517 1.00 0.00 C ATOM 973 CZ TYR A 58 1.503 -41.438 30.744 1.00 0.00 C ATOM 974 OH TYR A 58 1.580 -42.230 31.868 1.00 0.00 O ATOM 0 H TYR A 58 1.819 -36.558 28.413 1.00 0.00 H new ATOM 0 HA TYR A 58 3.329 -38.616 26.907 1.00 0.00 H new ATOM 0 HB2 TYR A 58 0.320 -38.369 27.299 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.141 -39.601 26.361 1.00 0.00 H new ATOM 0 HD1 TYR A 58 0.613 -38.336 29.816 1.00 0.00 H new ATOM 0 HD2 TYR A 58 2.069 -41.556 27.432 1.00 0.00 H new ATOM 0 HE1 TYR A 58 0.766 -39.746 31.816 1.00 0.00 H new ATOM 0 HE2 TYR A 58 2.218 -42.967 29.436 1.00 0.00 H new ATOM 0 HH TYR A 58 2.312 -41.917 32.439 1.00 0.00 H new ATOM 984 N SER A 59 3.013 -37.358 24.792 1.00 0.00 N ATOM 985 CA SER A 59 2.882 -36.625 23.542 1.00 0.00 C ATOM 986 C SER A 59 1.974 -37.387 22.579 1.00 0.00 C ATOM 987 O SER A 59 2.329 -38.468 22.096 1.00 0.00 O ATOM 988 CB SER A 59 4.261 -36.414 22.910 1.00 0.00 C ATOM 989 OG SER A 59 5.149 -35.778 23.816 1.00 0.00 O ATOM 0 H SER A 59 3.777 -38.034 24.803 1.00 0.00 H new ATOM 0 HA SER A 59 2.437 -35.652 23.749 1.00 0.00 H new ATOM 0 HB2 SER A 59 4.675 -37.375 22.605 1.00 0.00 H new ATOM 0 HB3 SER A 59 4.162 -35.809 22.009 1.00 0.00 H new ATOM 0 HG SER A 59 6.022 -35.657 23.388 1.00 0.00 H new ATOM 995 N PHE A 60 0.807 -36.818 22.304 1.00 0.00 N ATOM 996 CA PHE A 60 -0.143 -37.404 21.368 1.00 0.00 C ATOM 997 C PHE A 60 -0.117 -36.635 20.055 1.00 0.00 C ATOM 998 O PHE A 60 0.267 -35.464 20.015 1.00 0.00 O ATOM 999 CB PHE A 60 -1.564 -37.399 21.951 1.00 0.00 C ATOM 1000 CG PHE A 60 -1.717 -38.247 23.190 1.00 0.00 C ATOM 1001 CD1 PHE A 60 -1.746 -39.632 23.098 1.00 0.00 C ATOM 1002 CD2 PHE A 60 -1.831 -37.662 24.444 1.00 0.00 C ATOM 1003 CE1 PHE A 60 -1.886 -40.414 24.229 1.00 0.00 C ATOM 1004 CE2 PHE A 60 -1.971 -38.441 25.577 1.00 0.00 C ATOM 1005 CZ PHE A 60 -1.999 -39.819 25.469 1.00 0.00 C ATOM 0 H PHE A 60 0.494 -35.942 22.721 1.00 0.00 H new ATOM 0 HA PHE A 60 0.148 -38.439 21.187 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -1.846 -36.373 22.187 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -2.260 -37.754 21.191 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -1.658 -40.104 22.131 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.810 -36.586 24.535 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.907 -41.490 24.142 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -2.059 -37.973 26.547 1.00 0.00 H new ATOM 0 HZ PHE A 60 -2.109 -40.429 26.354 1.00 0.00 H new ATOM 1015 N ASN A 61 -0.531 -37.304 18.993 1.00 0.00 N ATOM 1016 CA ASN A 61 -0.488 -36.748 17.647 1.00 0.00 C ATOM 1017 C ASN A 61 -1.836 -36.962 16.977 1.00 0.00 C ATOM 1018 O ASN A 61 -2.357 -38.077 16.971 1.00 0.00 O ATOM 1019 CB ASN A 61 0.633 -37.442 16.850 1.00 0.00 C ATOM 1020 CG ASN A 61 0.945 -36.817 15.490 1.00 0.00 C ATOM 1021 OD1 ASN A 61 2.105 -36.785 15.081 1.00 0.00 O ATOM 1022 ND2 ASN A 61 -0.063 -36.381 14.749 1.00 0.00 N ATOM 0 H ASN A 61 -0.908 -38.251 19.037 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.281 -35.679 17.685 1.00 0.00 H new ATOM 0 HB2 ASN A 61 1.542 -37.437 17.452 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.357 -38.485 16.698 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.114 -36.008 13.816 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -1.016 -36.418 15.111 1.00 0.00 H new ATOM 1029 N VAL A 62 -2.399 -35.894 16.421 1.00 0.00 N ATOM 1030 CA VAL A 62 -3.671 -35.977 15.707 1.00 0.00 C ATOM 1031 C VAL A 62 -3.553 -35.309 14.343 1.00 0.00 C ATOM 1032 O VAL A 62 -3.259 -34.122 14.254 1.00 0.00 O ATOM 1033 CB VAL A 62 -4.824 -35.307 16.502 1.00 0.00 C ATOM 1034 CG1 VAL A 62 -6.134 -35.370 15.715 1.00 0.00 C ATOM 1035 CG2 VAL A 62 -4.986 -35.955 17.876 1.00 0.00 C ATOM 0 H VAL A 62 -1.994 -34.958 16.451 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.905 -37.035 15.587 1.00 0.00 H new ATOM 0 HB VAL A 62 -4.567 -34.258 16.651 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.928 -34.895 16.291 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.013 -34.849 14.765 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.396 -36.411 15.527 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.800 -35.469 18.414 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.213 -37.014 17.754 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.061 -35.845 18.441 1.00 0.00 H new ATOM 1045 N SER A 63 -3.766 -36.078 13.285 1.00 0.00 N ATOM 1046 CA SER A 63 -3.767 -35.539 11.929 1.00 0.00 C ATOM 1047 C SER A 63 -5.180 -35.607 11.352 1.00 0.00 C ATOM 1048 O SER A 63 -5.779 -36.683 11.287 1.00 0.00 O ATOM 1049 CB SER A 63 -2.775 -36.316 11.052 1.00 0.00 C ATOM 1050 OG SER A 63 -2.981 -37.712 11.161 1.00 0.00 O ATOM 0 H SER A 63 -3.941 -37.081 13.338 1.00 0.00 H new ATOM 0 HA SER A 63 -3.452 -34.496 11.951 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.887 -36.009 10.012 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.755 -36.072 11.348 1.00 0.00 H new ATOM 0 HG SER A 63 -2.584 -38.163 10.387 1.00 0.00 H new ATOM 1056 N MET A 64 -5.716 -34.458 10.954 1.00 0.00 N ATOM 1057 CA MET A 64 -7.092 -34.370 10.465 1.00 0.00 C ATOM 1058 C MET A 64 -7.191 -33.347 9.336 1.00 0.00 C ATOM 1059 O MET A 64 -6.463 -32.351 9.331 1.00 0.00 O ATOM 1060 CB MET A 64 -8.033 -33.986 11.620 1.00 0.00 C ATOM 1061 CG MET A 64 -7.732 -32.623 12.233 1.00 0.00 C ATOM 1062 SD MET A 64 -8.618 -32.327 13.778 1.00 0.00 S ATOM 1063 CE MET A 64 -10.324 -32.474 13.253 1.00 0.00 C ATOM 0 H MET A 64 -5.217 -33.568 10.960 1.00 0.00 H new ATOM 0 HA MET A 64 -7.391 -35.343 10.074 1.00 0.00 H new ATOM 0 HB2 MET A 64 -9.060 -33.991 11.256 1.00 0.00 H new ATOM 0 HB3 MET A 64 -7.967 -34.746 12.398 1.00 0.00 H new ATOM 0 HG2 MET A 64 -6.660 -32.542 12.415 1.00 0.00 H new ATOM 0 HG3 MET A 64 -7.993 -31.844 11.517 1.00 0.00 H new ATOM 0 HE1 MET A 64 -10.979 -32.403 14.121 1.00 0.00 H new ATOM 0 HE2 MET A 64 -10.560 -31.672 12.554 1.00 0.00 H new ATOM 0 HE3 MET A 64 -10.473 -33.437 12.764 1.00 0.00 H new ATOM 1073 N GLU A 65 -8.077 -33.605 8.376 1.00 0.00 N ATOM 1074 CA GLU A 65 -8.287 -32.687 7.260 1.00 0.00 C ATOM 1075 C GLU A 65 -9.038 -31.447 7.724 1.00 0.00 C ATOM 1076 O GLU A 65 -10.233 -31.504 8.002 1.00 0.00 O ATOM 1077 CB GLU A 65 -9.067 -33.354 6.125 1.00 0.00 C ATOM 1078 CG GLU A 65 -8.373 -34.565 5.519 1.00 0.00 C ATOM 1079 CD GLU A 65 -9.132 -35.140 4.335 1.00 0.00 C ATOM 1080 OE1 GLU A 65 -8.995 -34.597 3.218 1.00 0.00 O ATOM 1081 OE2 GLU A 65 -9.870 -36.131 4.512 1.00 0.00 O ATOM 0 H GLU A 65 -8.660 -34.441 8.349 1.00 0.00 H new ATOM 0 HA GLU A 65 -7.304 -32.401 6.886 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -10.044 -33.659 6.501 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -9.243 -32.619 5.339 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -7.370 -34.283 5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -8.260 -35.335 6.282 1.00 0.00 H new ATOM 1088 N VAL A 66 -8.335 -30.332 7.796 1.00 0.00 N ATOM 1089 CA VAL A 66 -8.925 -29.077 8.248 1.00 0.00 C ATOM 1090 C VAL A 66 -9.502 -28.304 7.063 1.00 0.00 C ATOM 1091 O VAL A 66 -8.817 -28.088 6.063 1.00 0.00 O ATOM 1092 CB VAL A 66 -7.891 -28.208 9.010 1.00 0.00 C ATOM 1093 CG1 VAL A 66 -7.529 -28.861 10.342 1.00 0.00 C ATOM 1094 CG2 VAL A 66 -6.635 -27.983 8.169 1.00 0.00 C ATOM 0 H VAL A 66 -7.348 -30.266 7.546 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.733 -29.317 8.940 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.344 -27.236 9.206 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.802 -28.240 10.866 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.426 -28.964 10.953 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.100 -29.846 10.159 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.928 -27.371 8.728 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.177 -28.944 7.935 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.903 -27.474 7.243 1.00 0.00 H new ATOM 1104 N SER A 67 -10.767 -27.906 7.185 1.00 0.00 N ATOM 1105 CA SER A 67 -11.491 -27.237 6.102 1.00 0.00 C ATOM 1106 C SER A 67 -10.826 -25.914 5.713 1.00 0.00 C ATOM 1107 O SER A 67 -10.797 -25.539 4.536 1.00 0.00 O ATOM 1108 CB SER A 67 -12.947 -26.994 6.525 1.00 0.00 C ATOM 1109 OG SER A 67 -13.672 -26.301 5.525 1.00 0.00 O ATOM 0 H SER A 67 -11.318 -28.037 8.033 1.00 0.00 H new ATOM 0 HA SER A 67 -11.469 -27.887 5.227 1.00 0.00 H new ATOM 0 HB2 SER A 67 -13.431 -27.949 6.730 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.966 -26.421 7.452 1.00 0.00 H new ATOM 0 HG SER A 67 -14.595 -26.164 5.826 1.00 0.00 H new ATOM 1115 N ASN A 68 -10.282 -25.222 6.708 1.00 0.00 N ATOM 1116 CA ASN A 68 -9.700 -23.899 6.504 1.00 0.00 C ATOM 1117 C ASN A 68 -8.763 -23.547 7.657 1.00 0.00 C ATOM 1118 O ASN A 68 -8.503 -24.377 8.533 1.00 0.00 O ATOM 1119 CB ASN A 68 -10.808 -22.841 6.381 1.00 0.00 C ATOM 1120 CG ASN A 68 -11.698 -22.789 7.611 1.00 0.00 C ATOM 1121 OD1 ASN A 68 -11.383 -22.115 8.587 1.00 0.00 O ATOM 1122 ND2 ASN A 68 -12.815 -23.500 7.573 1.00 0.00 N ATOM 0 H ASN A 68 -10.232 -25.557 7.670 1.00 0.00 H new ATOM 0 HA ASN A 68 -9.125 -23.913 5.578 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -10.356 -21.862 6.221 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.418 -23.057 5.504 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -13.447 -23.499 8.373 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -13.043 -24.048 6.743 1.00 0.00 H new ATOM 1129 N GLU A 69 -8.266 -22.314 7.658 1.00 0.00 N ATOM 1130 CA GLU A 69 -7.309 -21.869 8.666 1.00 0.00 C ATOM 1131 C GLU A 69 -7.988 -21.679 10.023 1.00 0.00 C ATOM 1132 O GLU A 69 -7.413 -22.005 11.059 1.00 0.00 O ATOM 1133 CB GLU A 69 -6.630 -20.568 8.221 1.00 0.00 C ATOM 1134 CG GLU A 69 -5.575 -20.052 9.197 1.00 0.00 C ATOM 1135 CD GLU A 69 -4.903 -18.777 8.714 1.00 0.00 C ATOM 1136 OE1 GLU A 69 -5.485 -17.688 8.899 1.00 0.00 O ATOM 1137 OE2 GLU A 69 -3.792 -18.858 8.148 1.00 0.00 O ATOM 0 H GLU A 69 -8.511 -21.603 6.969 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.548 -22.642 8.774 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.163 -20.728 7.249 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -7.392 -19.800 8.086 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.041 -19.868 10.165 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.818 -20.822 9.348 1.00 0.00 H new ATOM 1144 N SER A 70 -9.211 -21.164 10.024 1.00 0.00 N ATOM 1145 CA SER A 70 -9.940 -20.957 11.272 1.00 0.00 C ATOM 1146 C SER A 70 -10.122 -22.287 12.008 1.00 0.00 C ATOM 1147 O SER A 70 -10.103 -22.330 13.236 1.00 0.00 O ATOM 1148 CB SER A 70 -11.289 -20.289 10.998 1.00 0.00 C ATOM 1149 OG SER A 70 -11.108 -19.055 10.319 1.00 0.00 O ATOM 0 H SER A 70 -9.717 -20.884 9.184 1.00 0.00 H new ATOM 0 HA SER A 70 -9.360 -20.293 11.912 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.914 -20.951 10.399 1.00 0.00 H new ATOM 0 HB3 SER A 70 -11.814 -20.119 11.938 1.00 0.00 H new ATOM 0 HG SER A 70 -11.981 -18.643 10.151 1.00 0.00 H new ATOM 1155 N GLU A 71 -10.262 -23.373 11.242 1.00 0.00 N ATOM 1156 CA GLU A 71 -10.337 -24.720 11.811 1.00 0.00 C ATOM 1157 C GLU A 71 -9.130 -24.989 12.713 1.00 0.00 C ATOM 1158 O GLU A 71 -9.281 -25.295 13.895 1.00 0.00 O ATOM 1159 CB GLU A 71 -10.366 -25.781 10.694 1.00 0.00 C ATOM 1160 CG GLU A 71 -11.616 -25.774 9.820 1.00 0.00 C ATOM 1161 CD GLU A 71 -12.786 -26.524 10.440 1.00 0.00 C ATOM 1162 OE1 GLU A 71 -12.706 -27.768 10.550 1.00 0.00 O ATOM 1163 OE2 GLU A 71 -13.790 -25.878 10.798 1.00 0.00 O ATOM 0 H GLU A 71 -10.326 -23.344 10.224 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.254 -24.782 12.397 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.495 -25.636 10.055 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -10.266 -26.766 11.149 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.913 -24.743 9.631 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.378 -26.219 8.854 1.00 0.00 H new ATOM 1170 N ARG A 72 -7.929 -24.843 12.150 1.00 0.00 N ATOM 1171 CA ARG A 72 -6.696 -25.199 12.859 1.00 0.00 C ATOM 1172 C ARG A 72 -6.486 -24.336 14.104 1.00 0.00 C ATOM 1173 O ARG A 72 -5.651 -24.654 14.953 1.00 0.00 O ATOM 1174 CB ARG A 72 -5.469 -25.098 11.936 1.00 0.00 C ATOM 1175 CG ARG A 72 -5.148 -23.683 11.470 1.00 0.00 C ATOM 1176 CD ARG A 72 -3.774 -23.593 10.817 1.00 0.00 C ATOM 1177 NE ARG A 72 -2.707 -23.948 11.754 1.00 0.00 N ATOM 1178 CZ ARG A 72 -1.447 -23.523 11.654 1.00 0.00 C ATOM 1179 NH1 ARG A 72 -1.084 -22.714 10.671 1.00 0.00 N ATOM 1180 NH2 ARG A 72 -0.548 -23.911 12.545 1.00 0.00 N ATOM 0 H ARG A 72 -7.783 -24.482 11.207 1.00 0.00 H new ATOM 0 HA ARG A 72 -6.807 -26.235 13.179 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -4.602 -25.501 12.459 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -5.634 -25.727 11.061 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -5.908 -23.354 10.761 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -5.190 -23.003 12.321 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -3.737 -24.257 9.954 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -3.612 -22.581 10.447 1.00 0.00 H new ATOM 0 HE ARG A 72 -2.943 -24.561 12.535 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -1.771 -22.410 9.981 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -0.118 -22.395 10.604 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -0.820 -24.534 13.306 1.00 0.00 H new ATOM 0 HH22 ARG A 72 0.416 -23.587 12.471 1.00 0.00 H new ATOM 1194 N ASN A 73 -7.233 -23.242 14.203 1.00 0.00 N ATOM 1195 CA ASN A 73 -7.154 -22.362 15.368 1.00 0.00 C ATOM 1196 C ASN A 73 -8.251 -22.703 16.373 1.00 0.00 C ATOM 1197 O ASN A 73 -8.008 -22.743 17.581 1.00 0.00 O ATOM 1198 CB ASN A 73 -7.254 -20.886 14.951 1.00 0.00 C ATOM 1199 CG ASN A 73 -6.038 -20.412 14.167 1.00 0.00 C ATOM 1200 OD1 ASN A 73 -5.041 -19.978 14.747 1.00 0.00 O ATOM 1201 ND2 ASN A 73 -6.113 -20.474 12.847 1.00 0.00 N ATOM 0 H ASN A 73 -7.900 -22.942 13.492 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.185 -22.518 15.842 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -8.149 -20.744 14.346 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -7.370 -20.268 15.842 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -5.330 -20.157 12.276 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -6.954 -20.839 12.401 1.00 0.00 H new ATOM 1208 N GLU A 74 -9.454 -22.975 15.870 1.00 0.00 N ATOM 1209 CA GLU A 74 -10.597 -23.263 16.731 1.00 0.00 C ATOM 1210 C GLU A 74 -10.407 -24.609 17.425 1.00 0.00 C ATOM 1211 O GLU A 74 -10.600 -24.730 18.636 1.00 0.00 O ATOM 1212 CB GLU A 74 -11.910 -23.229 15.924 1.00 0.00 C ATOM 1213 CG GLU A 74 -12.183 -24.435 15.037 1.00 0.00 C ATOM 1214 CD GLU A 74 -13.480 -24.281 14.254 1.00 0.00 C ATOM 1215 OE1 GLU A 74 -13.530 -23.430 13.336 1.00 0.00 O ATOM 1216 OE2 GLU A 74 -14.459 -24.997 14.561 1.00 0.00 O ATOM 0 H GLU A 74 -9.661 -23.002 14.872 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.662 -22.491 17.498 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -12.740 -23.123 16.623 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.905 -22.337 15.298 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -11.354 -24.570 14.343 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -12.234 -25.334 15.652 1.00 0.00 H new ATOM 1223 N ILE A 75 -9.993 -25.604 16.647 1.00 0.00 N ATOM 1224 CA ILE A 75 -9.718 -26.942 17.160 1.00 0.00 C ATOM 1225 C ILE A 75 -8.608 -26.879 18.203 1.00 0.00 C ATOM 1226 O ILE A 75 -8.676 -27.533 19.243 1.00 0.00 O ATOM 1227 CB ILE A 75 -9.314 -27.891 16.001 1.00 0.00 C ATOM 1228 CG1 ILE A 75 -10.449 -27.951 14.965 1.00 0.00 C ATOM 1229 CG2 ILE A 75 -8.979 -29.290 16.524 1.00 0.00 C ATOM 1230 CD1 ILE A 75 -10.061 -28.596 13.655 1.00 0.00 C ATOM 0 H ILE A 75 -9.839 -25.506 15.644 1.00 0.00 H new ATOM 0 HA ILE A 75 -10.621 -27.333 17.628 1.00 0.00 H new ATOM 0 HB ILE A 75 -8.417 -27.498 15.523 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.287 -28.501 15.393 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -10.799 -26.938 14.768 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -8.700 -29.933 15.690 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -8.149 -29.226 17.227 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -9.850 -29.708 17.028 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -10.919 -28.597 12.982 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -9.244 -28.035 13.201 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.740 -29.622 13.836 1.00 0.00 H new ATOM 1242 N PHE A 76 -7.609 -26.048 17.918 1.00 0.00 N ATOM 1243 CA PHE A 76 -6.479 -25.834 18.816 1.00 0.00 C ATOM 1244 C PHE A 76 -6.963 -25.419 20.208 1.00 0.00 C ATOM 1245 O PHE A 76 -6.422 -25.862 21.225 1.00 0.00 O ATOM 1246 CB PHE A 76 -5.552 -24.761 18.224 1.00 0.00 C ATOM 1247 CG PHE A 76 -4.373 -24.401 19.093 1.00 0.00 C ATOM 1248 CD1 PHE A 76 -3.268 -25.236 19.168 1.00 0.00 C ATOM 1249 CD2 PHE A 76 -4.367 -23.223 19.830 1.00 0.00 C ATOM 1250 CE1 PHE A 76 -2.185 -24.904 19.959 1.00 0.00 C ATOM 1251 CE2 PHE A 76 -3.285 -22.888 20.620 1.00 0.00 C ATOM 1252 CZ PHE A 76 -2.193 -23.729 20.685 1.00 0.00 C ATOM 0 H PHE A 76 -7.561 -25.504 17.057 1.00 0.00 H new ATOM 0 HA PHE A 76 -5.926 -26.768 18.920 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.183 -25.110 17.260 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -6.135 -23.860 18.034 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -3.254 -26.156 18.602 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -5.219 -22.561 19.784 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.331 -25.564 20.010 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.294 -21.969 21.186 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.346 -23.469 21.303 1.00 0.00 H new ATOM 1262 N GLN A 77 -7.996 -24.581 20.241 1.00 0.00 N ATOM 1263 CA GLN A 77 -8.562 -24.104 21.500 1.00 0.00 C ATOM 1264 C GLN A 77 -9.350 -25.218 22.184 1.00 0.00 C ATOM 1265 O GLN A 77 -9.283 -25.385 23.404 1.00 0.00 O ATOM 1266 CB GLN A 77 -9.464 -22.889 21.252 1.00 0.00 C ATOM 1267 CG GLN A 77 -8.734 -21.700 20.640 1.00 0.00 C ATOM 1268 CD GLN A 77 -9.651 -20.516 20.401 1.00 0.00 C ATOM 1269 OE1 GLN A 77 -10.246 -20.378 19.332 1.00 0.00 O ATOM 1270 NE2 GLN A 77 -9.778 -19.656 21.398 1.00 0.00 N ATOM 0 H GLN A 77 -8.459 -24.217 19.408 1.00 0.00 H new ATOM 0 HA GLN A 77 -7.745 -23.803 22.156 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -10.280 -23.182 20.592 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -9.913 -22.582 22.197 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.921 -21.398 21.300 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -8.282 -22.002 19.695 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -9.268 -19.805 22.269 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -10.386 -18.843 21.296 1.00 0.00 H new ATOM 1279 N LYS A 78 -10.079 -25.993 21.387 1.00 0.00 N ATOM 1280 CA LYS A 78 -10.890 -27.086 21.917 1.00 0.00 C ATOM 1281 C LYS A 78 -9.992 -28.140 22.564 1.00 0.00 C ATOM 1282 O LYS A 78 -10.389 -28.815 23.516 1.00 0.00 O ATOM 1283 CB LYS A 78 -11.743 -27.720 20.807 1.00 0.00 C ATOM 1284 CG LYS A 78 -12.507 -26.703 19.965 1.00 0.00 C ATOM 1285 CD LYS A 78 -13.569 -27.355 19.085 1.00 0.00 C ATOM 1286 CE LYS A 78 -14.379 -26.308 18.323 1.00 0.00 C ATOM 1287 NZ LYS A 78 -15.399 -26.926 17.439 1.00 0.00 N ATOM 0 H LYS A 78 -10.125 -25.886 20.374 1.00 0.00 H new ATOM 0 HA LYS A 78 -11.562 -26.681 22.674 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -11.096 -28.307 20.154 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -12.454 -28.413 21.258 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -12.981 -25.975 20.623 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -11.805 -26.155 19.336 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -13.092 -28.034 18.378 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -14.237 -27.956 19.702 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.870 -25.643 19.033 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.706 -25.694 17.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -16.148 -26.234 17.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -14.952 -27.223 16.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.812 -27.755 17.912 1.00 0.00 H new ATOM 1301 N ILE A 79 -8.772 -28.257 22.046 1.00 0.00 N ATOM 1302 CA ILE A 79 -7.790 -29.206 22.563 1.00 0.00 C ATOM 1303 C ILE A 79 -7.402 -28.876 24.007 1.00 0.00 C ATOM 1304 O ILE A 79 -7.070 -29.763 24.787 1.00 0.00 O ATOM 1305 CB ILE A 79 -6.518 -29.247 21.671 1.00 0.00 C ATOM 1306 CG1 ILE A 79 -6.865 -29.776 20.268 1.00 0.00 C ATOM 1307 CG2 ILE A 79 -5.425 -30.104 22.309 1.00 0.00 C ATOM 1308 CD1 ILE A 79 -5.700 -29.765 19.300 1.00 0.00 C ATOM 0 H ILE A 79 -8.437 -27.700 21.260 1.00 0.00 H new ATOM 0 HA ILE A 79 -8.258 -30.190 22.545 1.00 0.00 H new ATOM 0 HB ILE A 79 -6.137 -28.230 21.579 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -7.240 -30.796 20.358 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.674 -29.174 19.854 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.547 -30.114 21.663 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.156 -29.687 23.280 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.791 -31.122 22.440 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -6.026 -30.152 18.335 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.338 -28.744 19.178 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.897 -30.391 19.690 1.00 0.00 H new ATOM 1320 N SER A 80 -7.451 -27.600 24.375 1.00 0.00 N ATOM 1321 CA SER A 80 -7.087 -27.198 25.733 1.00 0.00 C ATOM 1322 C SER A 80 -8.277 -27.311 26.693 1.00 0.00 C ATOM 1323 O SER A 80 -8.196 -26.891 27.848 1.00 0.00 O ATOM 1324 CB SER A 80 -6.502 -25.781 25.738 1.00 0.00 C ATOM 1325 OG SER A 80 -7.375 -24.841 25.129 1.00 0.00 O ATOM 0 H SER A 80 -7.735 -26.835 23.763 1.00 0.00 H new ATOM 0 HA SER A 80 -6.319 -27.885 26.090 1.00 0.00 H new ATOM 0 HB2 SER A 80 -6.301 -25.476 26.765 1.00 0.00 H new ATOM 0 HB3 SER A 80 -5.547 -25.782 25.213 1.00 0.00 H new ATOM 0 HG SER A 80 -8.178 -25.301 24.806 1.00 0.00 H new ATOM 1331 N GLN A 81 -9.371 -27.908 26.219 1.00 0.00 N ATOM 1332 CA GLN A 81 -10.568 -28.102 27.044 1.00 0.00 C ATOM 1333 C GLN A 81 -10.528 -29.445 27.775 1.00 0.00 C ATOM 1334 O GLN A 81 -11.464 -29.794 28.493 1.00 0.00 O ATOM 1335 CB GLN A 81 -11.834 -28.022 26.179 1.00 0.00 C ATOM 1336 CG GLN A 81 -12.107 -26.639 25.596 1.00 0.00 C ATOM 1337 CD GLN A 81 -13.335 -26.606 24.697 1.00 0.00 C ATOM 1338 OE1 GLN A 81 -14.045 -25.603 24.632 1.00 0.00 O ATOM 1339 NE2 GLN A 81 -13.585 -27.694 23.981 1.00 0.00 N ATOM 0 H GLN A 81 -9.455 -28.266 25.268 1.00 0.00 H new ATOM 0 HA GLN A 81 -10.588 -27.306 27.788 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -11.748 -28.738 25.362 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -12.691 -28.326 26.780 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -12.240 -25.927 26.410 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -11.237 -26.312 25.026 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -12.975 -28.508 24.060 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -14.387 -27.717 23.351 1.00 0.00 H new ATOM 1348 N LEU A 82 -9.446 -30.200 27.592 1.00 0.00 N ATOM 1349 CA LEU A 82 -9.322 -31.521 28.217 1.00 0.00 C ATOM 1350 C LEU A 82 -8.973 -31.383 29.693 1.00 0.00 C ATOM 1351 O LEU A 82 -9.211 -32.300 30.480 1.00 0.00 O ATOM 1352 CB LEU A 82 -8.241 -32.363 27.518 1.00 0.00 C ATOM 1353 CG LEU A 82 -8.177 -32.200 25.994 1.00 0.00 C ATOM 1354 CD1 LEU A 82 -7.036 -33.018 25.399 1.00 0.00 C ATOM 1355 CD2 LEU A 82 -9.510 -32.568 25.355 1.00 0.00 C ATOM 0 H LEU A 82 -8.647 -29.925 27.021 1.00 0.00 H new ATOM 0 HA LEU A 82 -10.283 -32.025 28.116 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.270 -32.101 27.937 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.415 -33.414 27.749 1.00 0.00 H new ATOM 0 HG LEU A 82 -7.977 -31.151 25.776 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.016 -32.882 24.318 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.089 -32.685 25.824 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -7.186 -34.073 25.629 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -9.442 -32.445 24.274 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.751 -33.605 25.588 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.293 -31.917 25.745 1.00 0.00 H new ATOM 1367 N ASP A 83 -8.379 -30.237 30.040 1.00 0.00 N ATOM 1368 CA ASP A 83 -7.908 -29.947 31.404 1.00 0.00 C ATOM 1369 C ASP A 83 -6.639 -30.745 31.734 1.00 0.00 C ATOM 1370 O ASP A 83 -5.706 -30.222 32.345 1.00 0.00 O ATOM 1371 CB ASP A 83 -9.004 -30.223 32.447 1.00 0.00 C ATOM 1372 CG ASP A 83 -8.614 -29.762 33.844 1.00 0.00 C ATOM 1373 OD1 ASP A 83 -8.899 -28.595 34.191 1.00 0.00 O ATOM 1374 OD2 ASP A 83 -8.028 -30.561 34.605 1.00 0.00 O ATOM 0 H ASP A 83 -8.209 -29.478 29.380 1.00 0.00 H new ATOM 0 HA ASP A 83 -7.664 -28.885 31.444 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.922 -29.719 32.145 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -9.219 -31.291 32.468 1.00 0.00 H new ATOM 1379 N LYS A 84 -6.609 -32.002 31.299 1.00 0.00 N ATOM 1380 CA LYS A 84 -5.475 -32.899 31.523 1.00 0.00 C ATOM 1381 C LYS A 84 -4.296 -32.556 30.609 1.00 0.00 C ATOM 1382 O LYS A 84 -3.211 -33.133 30.733 1.00 0.00 O ATOM 1383 CB LYS A 84 -5.924 -34.343 31.271 1.00 0.00 C ATOM 1384 CG LYS A 84 -6.983 -34.842 32.256 1.00 0.00 C ATOM 1385 CD LYS A 84 -8.056 -35.677 31.559 1.00 0.00 C ATOM 1386 CE LYS A 84 -8.844 -36.529 32.552 1.00 0.00 C ATOM 1387 NZ LYS A 84 -9.965 -37.264 31.904 1.00 0.00 N ATOM 0 H LYS A 84 -7.374 -32.431 30.778 1.00 0.00 H new ATOM 0 HA LYS A 84 -5.140 -32.781 32.553 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -6.319 -34.419 30.258 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -5.055 -34.998 31.324 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -6.505 -35.439 33.032 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -7.449 -33.990 32.751 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -8.739 -35.018 31.023 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -7.588 -36.323 30.816 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -8.172 -37.243 33.028 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -9.240 -35.890 33.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.579 -37.676 32.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.518 -36.607 31.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -9.582 -38.024 31.306 1.00 0.00 H new ATOM 1401 N VAL A 85 -4.519 -31.628 29.684 1.00 0.00 N ATOM 1402 CA VAL A 85 -3.490 -31.216 28.735 1.00 0.00 C ATOM 1403 C VAL A 85 -2.667 -30.062 29.304 1.00 0.00 C ATOM 1404 O VAL A 85 -3.219 -29.099 29.839 1.00 0.00 O ATOM 1405 CB VAL A 85 -4.117 -30.808 27.376 1.00 0.00 C ATOM 1406 CG1 VAL A 85 -5.139 -29.689 27.556 1.00 0.00 C ATOM 1407 CG2 VAL A 85 -3.036 -30.409 26.371 1.00 0.00 C ATOM 0 H VAL A 85 -5.410 -31.144 29.571 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.830 -32.067 28.565 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.641 -31.676 26.976 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.562 -29.423 26.587 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -5.935 -30.027 28.219 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -4.651 -28.817 27.990 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -3.503 -30.128 25.427 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.470 -29.564 26.762 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.364 -31.251 26.206 1.00 0.00 H new ATOM 1417 N VAL A 86 -1.347 -30.171 29.204 1.00 0.00 N ATOM 1418 CA VAL A 86 -0.448 -29.150 29.737 1.00 0.00 C ATOM 1419 C VAL A 86 0.147 -28.297 28.621 1.00 0.00 C ATOM 1420 O VAL A 86 0.478 -27.129 28.834 1.00 0.00 O ATOM 1421 CB VAL A 86 0.698 -29.775 30.572 1.00 0.00 C ATOM 1422 CG1 VAL A 86 0.139 -30.467 31.813 1.00 0.00 C ATOM 1423 CG2 VAL A 86 1.519 -30.749 29.728 1.00 0.00 C ATOM 0 H VAL A 86 -0.874 -30.957 28.758 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.049 -28.516 30.388 1.00 0.00 H new ATOM 0 HB VAL A 86 1.361 -28.973 30.897 1.00 0.00 H new ATOM 0 HG11 VAL A 86 0.958 -30.900 32.388 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -0.391 -29.739 32.428 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.549 -31.256 31.511 1.00 0.00 H new ATOM 0 HG21 VAL A 86 2.317 -31.174 30.336 1.00 0.00 H new ATOM 0 HG22 VAL A 86 0.874 -31.549 29.365 1.00 0.00 H new ATOM 0 HG23 VAL A 86 1.953 -30.219 28.880 1.00 0.00 H new ATOM 1433 N GLN A 87 0.276 -28.877 27.430 1.00 0.00 N ATOM 1434 CA GLN A 87 0.873 -28.171 26.302 1.00 0.00 C ATOM 1435 C GLN A 87 0.154 -28.516 25.002 1.00 0.00 C ATOM 1436 O GLN A 87 0.110 -29.679 24.588 1.00 0.00 O ATOM 1437 CB GLN A 87 2.368 -28.509 26.193 1.00 0.00 C ATOM 1438 CG GLN A 87 3.112 -27.713 25.123 1.00 0.00 C ATOM 1439 CD GLN A 87 3.033 -26.211 25.339 1.00 0.00 C ATOM 1440 OE1 GLN A 87 2.925 -25.737 26.471 1.00 0.00 O ATOM 1441 NE2 GLN A 87 3.094 -25.449 24.258 1.00 0.00 N ATOM 0 H GLN A 87 -0.024 -29.830 27.223 1.00 0.00 H new ATOM 0 HA GLN A 87 0.767 -27.100 26.475 1.00 0.00 H new ATOM 0 HB2 GLN A 87 2.841 -28.330 27.158 1.00 0.00 H new ATOM 0 HB3 GLN A 87 2.474 -29.572 25.979 1.00 0.00 H new ATOM 0 HG2 GLN A 87 4.158 -28.019 25.112 1.00 0.00 H new ATOM 0 HG3 GLN A 87 2.699 -27.956 24.144 1.00 0.00 H new ATOM 0 HE21 GLN A 87 3.183 -25.877 23.337 1.00 0.00 H new ATOM 0 HE22 GLN A 87 3.052 -24.434 24.347 1.00 0.00 H new ATOM 1450 N THR A 88 -0.420 -27.497 24.376 1.00 0.00 N ATOM 1451 CA THR A 88 -1.099 -27.645 23.098 1.00 0.00 C ATOM 1452 C THR A 88 -0.240 -27.075 21.966 1.00 0.00 C ATOM 1453 O THR A 88 0.219 -25.929 22.038 1.00 0.00 O ATOM 1454 CB THR A 88 -2.468 -26.926 23.125 1.00 0.00 C ATOM 1455 OG1 THR A 88 -2.298 -25.575 23.579 1.00 0.00 O ATOM 1456 CG2 THR A 88 -3.450 -27.647 24.041 1.00 0.00 C ATOM 0 H THR A 88 -0.427 -26.545 24.741 1.00 0.00 H new ATOM 0 HA THR A 88 -1.260 -28.708 22.921 1.00 0.00 H new ATOM 0 HB THR A 88 -2.872 -26.930 22.113 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.256 -24.973 22.807 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.403 -27.119 24.040 1.00 0.00 H new ATOM 0 HG22 THR A 88 -3.599 -28.666 23.684 1.00 0.00 H new ATOM 0 HG23 THR A 88 -3.050 -27.672 25.055 1.00 0.00 H new ATOM 1464 N LEU A 89 0.001 -27.881 20.932 1.00 0.00 N ATOM 1465 CA LEU A 89 0.776 -27.439 19.773 1.00 0.00 C ATOM 1466 C LEU A 89 -0.050 -27.591 18.498 1.00 0.00 C ATOM 1467 O LEU A 89 -0.525 -28.683 18.184 1.00 0.00 O ATOM 1468 CB LEU A 89 2.086 -28.235 19.625 1.00 0.00 C ATOM 1469 CG LEU A 89 3.033 -28.240 20.843 1.00 0.00 C ATOM 1470 CD1 LEU A 89 2.526 -29.182 21.935 1.00 0.00 C ATOM 1471 CD2 LEU A 89 4.449 -28.622 20.419 1.00 0.00 C ATOM 0 H LEU A 89 -0.330 -28.844 20.873 1.00 0.00 H new ATOM 0 HA LEU A 89 1.027 -26.390 19.931 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.832 -29.268 19.387 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.632 -27.836 18.770 1.00 0.00 H new ATOM 0 HG LEU A 89 3.054 -27.231 21.255 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.214 -29.164 22.780 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.539 -28.859 22.265 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.463 -30.196 21.540 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.103 -28.620 21.291 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.440 -29.617 19.974 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.817 -27.902 19.688 1.00 0.00 H new