USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 955 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 87 HIS : no HE2:sc= -4.14 K(o=-3.8,f=-6.8!) USER MOD Set 1.2: B 92 GLN : amide:sc= 0.351 K(o=-3.8,f=-6!) USER MOD Set 2.1: B 58 LYS NZ :NH3+ 175:sc= 0.96 (180deg=0) USER MOD Set 2.2: B 72 HIS : no HE2:sc= -3.22! C(o=-1.6!,f=-3.7!) USER MOD Set 2.3: B 73 SER OG : rot -129:sc= 0.632 USER MOD Set 3.1: A 92 GLN : amide:sc= -0.518 K(o=-4.5,f=-5.3) USER MOD Set 3.2: B 87 HIS : no HE2:sc= -4.03! C(o=-4.5!,f=-5.9!) USER MOD Set 4.1: A 58 LYS NZ :NH3+ 137:sc= 0.317 (180deg=-0.0531) USER MOD Set 4.2: A 72 HIS : no HE2:sc= -1.29 K(o=-0.97,f=-3.9) USER MOD Single : A 42 MET CE :methyl -161:sc= -0.0776 (180deg=-0.528) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc=-0.00938 X(o=-0.0094,f=-0.38) USER MOD Single : A 53 SER OG : rot 59:sc= 1.26 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0.0893 X(o=0.089,f=0) USER MOD Single : A 59 THR OG1 : rot 91:sc= 1.26 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 86:sc= 0.533 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -169:sc= 1.07 (180deg=0.794) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl 163:sc= -0.148 (180deg=-0.695) USER MOD Single : A 84 THR OG1 : rot 91:sc= 0.305 USER MOD Single : A 86 LYS NZ :NH3+ 173:sc= 0.513 (180deg=0.374) USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 ASN : amide:sc= -0.0024 K(o=-0.0024,f=-0.51) USER MOD Single : B 53 SER OG : rot 68:sc= 1.28 USER MOD Single : B 55 SER OG : rot -84:sc= 0.734 USER MOD Single : B 56 GLN : amide:sc= -0.338 K(o=-0.34,f=-1) USER MOD Single : B 59 THR OG1 : rot 93:sc= 1.23 USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ -160:sc= -0.0788 (180deg=-0.455) USER MOD Single : B 69 SER OG : rot 180:sc= 0.0239 USER MOD Single : B 70 SER OG : rot 180:sc= 0 USER MOD Single : B 74 LYS NZ :NH3+ -156:sc= 1.3 (180deg=0.952) USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 MET CE :methyl 158:sc= -0.182 (180deg=-0.815) USER MOD Single : B 84 THR OG1 : rot 91:sc= -0.856! USER MOD Single : B 86 LYS NZ :NH3+ -172:sc= 0.267 (180deg=0.245) USER MOD Single : B 90 ASN : amide:sc= -0.863 K(o=-0.86,f=-2) USER MOD Single : B 95 GLN :FLIP amide:sc= -0.545 F(o=-1.6,f=-0.54) USER MOD ----------------------------------------------------------------- ATOM 268 N MET A 42 -19.522 3.588 9.759 1.00 0.00 N ATOM 269 CA MET A 42 -19.419 2.240 9.225 1.00 0.00 C ATOM 270 C MET A 42 -18.045 1.976 8.699 1.00 0.00 C ATOM 271 O MET A 42 -17.454 0.938 8.990 1.00 0.00 O ATOM 272 CB MET A 42 -20.448 1.995 8.126 1.00 0.00 C ATOM 273 CG MET A 42 -21.880 2.030 8.610 1.00 0.00 C ATOM 274 SD MET A 42 -22.261 0.736 9.810 1.00 0.00 S ATOM 275 CE MET A 42 -22.031 -0.730 8.801 1.00 0.00 C ATOM 0 HA MET A 42 -19.621 1.553 10.046 1.00 0.00 H new ATOM 0 HB2 MET A 42 -20.319 2.747 7.347 1.00 0.00 H new ATOM 0 HB3 MET A 42 -20.253 1.025 7.668 1.00 0.00 H new ATOM 0 HG2 MET A 42 -22.081 3.003 9.059 1.00 0.00 H new ATOM 0 HG3 MET A 42 -22.548 1.930 7.754 1.00 0.00 H new ATOM 0 HE1 MET A 42 -22.538 -1.575 9.266 1.00 0.00 H new ATOM 0 HE2 MET A 42 -22.448 -0.558 7.809 1.00 0.00 H new ATOM 0 HE3 MET A 42 -20.967 -0.949 8.714 1.00 0.00 H new ATOM 285 N GLU A 43 -17.504 2.933 7.978 1.00 0.00 N ATOM 286 CA GLU A 43 -16.207 2.745 7.388 1.00 0.00 C ATOM 287 C GLU A 43 -15.106 2.850 8.433 1.00 0.00 C ATOM 288 O GLU A 43 -14.015 2.322 8.242 1.00 0.00 O ATOM 289 CB GLU A 43 -15.952 3.700 6.235 1.00 0.00 C ATOM 290 CG GLU A 43 -15.787 5.150 6.611 1.00 0.00 C ATOM 291 CD GLU A 43 -15.412 5.974 5.419 1.00 0.00 C ATOM 292 OE1 GLU A 43 -16.299 6.377 4.655 1.00 0.00 O ATOM 293 OE2 GLU A 43 -14.224 6.202 5.189 1.00 0.00 O ATOM 0 H GLU A 43 -17.939 3.836 7.790 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.194 1.736 6.976 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -15.053 3.375 5.711 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -16.779 3.618 5.530 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -16.716 5.526 7.040 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.020 5.245 7.379 1.00 0.00 H new ATOM 300 N LYS A 44 -15.398 3.505 9.543 1.00 0.00 N ATOM 301 CA LYS A 44 -14.424 3.635 10.611 1.00 0.00 C ATOM 302 C LYS A 44 -14.353 2.299 11.321 1.00 0.00 C ATOM 303 O LYS A 44 -13.272 1.800 11.637 1.00 0.00 O ATOM 304 CB LYS A 44 -14.823 4.785 11.565 1.00 0.00 C ATOM 305 CG LYS A 44 -13.741 5.249 12.566 1.00 0.00 C ATOM 306 CD LYS A 44 -13.491 4.282 13.733 1.00 0.00 C ATOM 307 CE LYS A 44 -14.713 4.145 14.633 1.00 0.00 C ATOM 308 NZ LYS A 44 -14.448 3.274 15.798 1.00 0.00 N ATOM 0 H LYS A 44 -16.296 3.952 9.727 1.00 0.00 H new ATOM 0 HA LYS A 44 -13.439 3.890 10.220 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -15.122 5.642 10.962 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -15.701 4.472 12.130 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.805 5.396 12.027 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -14.031 6.218 12.971 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -13.219 3.302 13.340 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.645 4.636 14.322 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -15.020 5.132 14.980 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.544 3.737 14.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.305 3.208 16.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -14.180 2.325 15.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -13.673 3.676 16.363 1.00 0.00 H new ATOM 322 N ARG A 45 -15.520 1.712 11.533 1.00 0.00 N ATOM 323 CA ARG A 45 -15.631 0.389 12.130 1.00 0.00 C ATOM 324 C ARG A 45 -14.934 -0.625 11.248 1.00 0.00 C ATOM 325 O ARG A 45 -14.172 -1.484 11.733 1.00 0.00 O ATOM 326 CB ARG A 45 -17.086 0.001 12.290 1.00 0.00 C ATOM 327 CG ARG A 45 -17.859 0.837 13.287 1.00 0.00 C ATOM 328 CD ARG A 45 -19.323 0.475 13.234 1.00 0.00 C ATOM 329 NE ARG A 45 -19.521 -0.975 13.423 1.00 0.00 N ATOM 330 CZ ARG A 45 -20.568 -1.694 12.971 1.00 0.00 C ATOM 331 NH1 ARG A 45 -21.632 -1.090 12.427 1.00 0.00 N ATOM 332 NH2 ARG A 45 -20.553 -3.017 13.086 1.00 0.00 N ATOM 0 H ARG A 45 -16.416 2.138 11.297 1.00 0.00 H new ATOM 0 HA ARG A 45 -15.161 0.408 13.113 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -17.576 0.073 11.319 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -17.137 -1.044 12.596 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -17.471 0.672 14.292 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -17.729 1.896 13.065 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -19.864 1.022 14.006 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -19.741 0.780 12.275 1.00 0.00 H new ATOM 0 HE ARG A 45 -18.801 -1.478 13.942 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -21.657 -0.073 12.350 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -22.417 -1.647 12.089 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -19.753 -3.483 13.514 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -21.342 -3.567 12.746 1.00 0.00 H new ATOM 346 N ARG A 46 -15.202 -0.510 9.948 1.00 0.00 N ATOM 347 CA ARG A 46 -14.582 -1.334 8.938 1.00 0.00 C ATOM 348 C ARG A 46 -13.079 -1.210 9.020 1.00 0.00 C ATOM 349 O ARG A 46 -12.389 -2.198 9.126 1.00 0.00 O ATOM 350 CB ARG A 46 -15.033 -0.907 7.536 1.00 0.00 C ATOM 351 CG ARG A 46 -14.325 -1.661 6.420 1.00 0.00 C ATOM 352 CD ARG A 46 -14.712 -1.153 5.045 1.00 0.00 C ATOM 353 NE ARG A 46 -14.333 0.250 4.792 1.00 0.00 N ATOM 354 CZ ARG A 46 -14.743 0.981 3.726 1.00 0.00 C ATOM 355 NH1 ARG A 46 -15.411 0.408 2.718 1.00 0.00 N ATOM 356 NH2 ARG A 46 -14.412 2.262 3.649 1.00 0.00 N ATOM 0 H ARG A 46 -15.865 0.169 9.573 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.883 -2.366 9.116 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -16.108 -1.062 7.445 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.854 0.161 7.414 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.247 -1.567 6.549 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -14.564 -2.722 6.493 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.244 -1.786 4.291 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.790 -1.255 4.922 1.00 0.00 H new ATOM 0 HE ARG A 46 -13.718 0.703 5.468 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -15.618 -0.590 2.746 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -15.714 0.970 1.922 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -13.854 2.690 4.388 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -14.716 2.820 2.851 1.00 0.00 H new ATOM 370 N ARG A 47 -12.604 0.021 8.961 1.00 0.00 N ATOM 371 CA ARG A 47 -11.181 0.342 8.983 1.00 0.00 C ATOM 372 C ARG A 47 -10.451 -0.295 10.170 1.00 0.00 C ATOM 373 O ARG A 47 -9.376 -0.873 9.995 1.00 0.00 O ATOM 374 CB ARG A 47 -10.962 1.844 8.978 1.00 0.00 C ATOM 375 CG ARG A 47 -9.540 2.262 8.663 1.00 0.00 C ATOM 376 CD ARG A 47 -9.419 3.768 8.647 1.00 0.00 C ATOM 377 NE ARG A 47 -9.677 4.344 9.968 1.00 0.00 N ATOM 378 CZ ARG A 47 -10.280 5.509 10.199 1.00 0.00 C ATOM 379 NH1 ARG A 47 -10.810 6.205 9.198 1.00 0.00 N ATOM 380 NH2 ARG A 47 -10.369 5.966 11.434 1.00 0.00 N ATOM 0 H ARG A 47 -13.204 0.843 8.895 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.755 -0.083 8.074 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.632 2.295 8.247 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -11.239 2.244 9.953 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.860 1.845 9.406 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -9.242 1.858 7.696 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -8.420 4.050 8.316 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -10.123 4.182 7.925 1.00 0.00 H new ATOM 0 HE ARG A 47 -9.369 3.808 10.780 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.757 5.848 8.244 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -11.270 7.096 9.384 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -9.977 5.428 12.207 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -10.830 6.858 11.616 1.00 0.00 H new ATOM 394 N ALA A 48 -11.050 -0.218 11.356 1.00 0.00 N ATOM 395 CA ALA A 48 -10.473 -0.817 12.536 1.00 0.00 C ATOM 396 C ALA A 48 -10.379 -2.316 12.341 1.00 0.00 C ATOM 397 O ALA A 48 -9.333 -2.915 12.557 1.00 0.00 O ATOM 398 CB ALA A 48 -11.305 -0.480 13.766 1.00 0.00 C ATOM 0 H ALA A 48 -11.938 0.257 11.516 1.00 0.00 H new ATOM 0 HA ALA A 48 -9.471 -0.416 12.693 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.856 -0.940 14.646 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.338 0.601 13.898 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -12.318 -0.860 13.635 1.00 0.00 H new ATOM 404 N ARG A 49 -11.457 -2.899 11.831 1.00 0.00 N ATOM 405 CA ARG A 49 -11.520 -4.326 11.589 1.00 0.00 C ATOM 406 C ARG A 49 -10.483 -4.741 10.529 1.00 0.00 C ATOM 407 O ARG A 49 -9.946 -5.831 10.593 1.00 0.00 O ATOM 408 CB ARG A 49 -12.928 -4.750 11.165 1.00 0.00 C ATOM 409 CG ARG A 49 -13.070 -6.243 10.945 1.00 0.00 C ATOM 410 CD ARG A 49 -14.428 -6.598 10.393 1.00 0.00 C ATOM 411 NE ARG A 49 -14.488 -8.001 9.988 1.00 0.00 N ATOM 412 CZ ARG A 49 -15.101 -8.450 8.882 1.00 0.00 C ATOM 413 NH1 ARG A 49 -15.722 -7.597 8.056 1.00 0.00 N ATOM 414 NH2 ARG A 49 -15.073 -9.744 8.593 1.00 0.00 N ATOM 0 H ARG A 49 -12.306 -2.394 11.576 1.00 0.00 H new ATOM 0 HA ARG A 49 -11.283 -4.838 12.522 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.639 -4.434 11.928 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -13.194 -4.228 10.246 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -12.297 -6.585 10.257 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -12.912 -6.767 11.888 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -15.191 -6.402 11.146 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -14.653 -5.961 9.538 1.00 0.00 H new ATOM 0 HE ARG A 49 -14.032 -8.688 10.589 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -15.731 -6.599 8.266 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -16.186 -7.946 7.217 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.587 -10.394 9.211 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -15.538 -10.089 7.753 1.00 0.00 H new ATOM 428 N ILE A 50 -10.214 -3.859 9.562 1.00 0.00 N ATOM 429 CA ILE A 50 -9.186 -4.083 8.550 1.00 0.00 C ATOM 430 C ILE A 50 -7.843 -4.298 9.226 1.00 0.00 C ATOM 431 O ILE A 50 -7.207 -5.328 9.049 1.00 0.00 O ATOM 432 CB ILE A 50 -9.072 -2.858 7.608 1.00 0.00 C ATOM 433 CG1 ILE A 50 -10.377 -2.652 6.839 1.00 0.00 C ATOM 434 CG2 ILE A 50 -7.876 -2.986 6.672 1.00 0.00 C ATOM 435 CD1 ILE A 50 -10.402 -1.416 5.983 1.00 0.00 C ATOM 0 H ILE A 50 -10.705 -2.970 9.462 1.00 0.00 H new ATOM 0 HA ILE A 50 -9.464 -4.962 7.969 1.00 0.00 H new ATOM 0 HB ILE A 50 -8.901 -1.971 8.218 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -10.553 -3.522 6.206 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -11.201 -2.604 7.551 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -7.825 -2.110 6.025 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.960 -3.057 7.259 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.986 -3.882 6.062 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -11.363 -1.346 5.473 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.259 -0.536 6.610 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -9.602 -1.469 5.245 1.00 0.00 H new ATOM 447 N ASN A 51 -7.468 -3.343 10.042 1.00 0.00 N ATOM 448 CA ASN A 51 -6.188 -3.352 10.746 1.00 0.00 C ATOM 449 C ASN A 51 -6.108 -4.536 11.677 1.00 0.00 C ATOM 450 O ASN A 51 -5.064 -5.178 11.813 1.00 0.00 O ATOM 451 CB ASN A 51 -6.015 -2.050 11.526 1.00 0.00 C ATOM 452 CG ASN A 51 -6.066 -0.833 10.632 1.00 0.00 C ATOM 453 OD1 ASN A 51 -5.631 -0.863 9.471 1.00 0.00 O ATOM 454 ND2 ASN A 51 -6.630 0.221 11.127 1.00 0.00 N ATOM 0 H ASN A 51 -8.042 -2.525 10.245 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.384 -3.435 10.015 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -6.797 -1.976 12.282 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -5.062 -2.070 12.054 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -6.728 1.062 10.558 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -6.977 0.211 12.086 1.00 0.00 H new ATOM 461 N GLU A 52 -7.205 -4.830 12.305 1.00 0.00 N ATOM 462 CA GLU A 52 -7.290 -5.978 13.199 1.00 0.00 C ATOM 463 C GLU A 52 -7.178 -7.316 12.441 1.00 0.00 C ATOM 464 O GLU A 52 -6.537 -8.267 12.920 1.00 0.00 O ATOM 465 CB GLU A 52 -8.565 -5.921 14.028 1.00 0.00 C ATOM 466 CG GLU A 52 -8.644 -4.691 14.917 1.00 0.00 C ATOM 467 CD GLU A 52 -7.463 -4.577 15.854 1.00 0.00 C ATOM 468 OE1 GLU A 52 -7.492 -5.192 16.938 1.00 0.00 O ATOM 469 OE2 GLU A 52 -6.487 -3.869 15.534 1.00 0.00 O ATOM 0 H GLU A 52 -8.069 -4.294 12.223 1.00 0.00 H new ATOM 0 HA GLU A 52 -6.437 -5.926 13.875 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.426 -5.935 13.360 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.628 -6.815 14.648 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.696 -3.799 14.293 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.564 -4.727 15.500 1.00 0.00 H new ATOM 476 N SER A 53 -7.741 -7.382 11.249 1.00 0.00 N ATOM 477 CA SER A 53 -7.689 -8.594 10.476 1.00 0.00 C ATOM 478 C SER A 53 -6.310 -8.751 9.871 1.00 0.00 C ATOM 479 O SER A 53 -5.779 -9.837 9.827 1.00 0.00 O ATOM 480 CB SER A 53 -8.775 -8.597 9.399 1.00 0.00 C ATOM 481 OG SER A 53 -10.053 -8.411 9.990 1.00 0.00 O ATOM 0 H SER A 53 -8.236 -6.610 10.802 1.00 0.00 H new ATOM 0 HA SER A 53 -7.879 -9.445 11.130 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.582 -7.805 8.676 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.753 -9.540 8.853 1.00 0.00 H new ATOM 0 HG SER A 53 -10.067 -7.561 10.478 1.00 0.00 H new ATOM 487 N LEU A 54 -5.714 -7.637 9.472 1.00 0.00 N ATOM 488 CA LEU A 54 -4.391 -7.625 8.895 1.00 0.00 C ATOM 489 C LEU A 54 -3.368 -8.012 9.973 1.00 0.00 C ATOM 490 O LEU A 54 -2.358 -8.657 9.688 1.00 0.00 O ATOM 491 CB LEU A 54 -4.110 -6.228 8.321 1.00 0.00 C ATOM 492 CG LEU A 54 -3.178 -6.147 7.104 1.00 0.00 C ATOM 493 CD1 LEU A 54 -3.276 -4.775 6.479 1.00 0.00 C ATOM 494 CD2 LEU A 54 -1.726 -6.452 7.459 1.00 0.00 C ATOM 0 H LEU A 54 -6.143 -6.714 9.543 1.00 0.00 H new ATOM 0 HA LEU A 54 -4.316 -8.349 8.083 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.064 -5.776 8.047 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.683 -5.615 9.115 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.503 -6.908 6.394 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.613 -4.720 5.615 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -4.302 -4.593 6.161 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.983 -4.021 7.209 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.110 -6.381 6.563 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.374 -5.734 8.199 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.656 -7.460 7.869 1.00 0.00 H new ATOM 506 N SER A 55 -3.660 -7.636 11.210 1.00 0.00 N ATOM 507 CA SER A 55 -2.839 -7.989 12.342 1.00 0.00 C ATOM 508 C SER A 55 -2.755 -9.513 12.473 1.00 0.00 C ATOM 509 O SER A 55 -1.665 -10.085 12.477 1.00 0.00 O ATOM 510 CB SER A 55 -3.410 -7.358 13.632 1.00 0.00 C ATOM 511 OG SER A 55 -2.597 -7.647 14.774 1.00 0.00 O ATOM 0 H SER A 55 -4.478 -7.076 11.450 1.00 0.00 H new ATOM 0 HA SER A 55 -1.833 -7.600 12.188 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.486 -6.278 13.505 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.420 -7.731 13.802 1.00 0.00 H new ATOM 0 HG SER A 55 -2.990 -7.230 15.569 1.00 0.00 H new ATOM 517 N GLN A 56 -3.902 -10.169 12.527 1.00 0.00 N ATOM 518 CA GLN A 56 -3.931 -11.622 12.689 1.00 0.00 C ATOM 519 C GLN A 56 -3.440 -12.332 11.418 1.00 0.00 C ATOM 520 O GLN A 56 -2.804 -13.375 11.493 1.00 0.00 O ATOM 521 CB GLN A 56 -5.322 -12.093 13.131 1.00 0.00 C ATOM 522 CG GLN A 56 -6.435 -11.778 12.159 1.00 0.00 C ATOM 523 CD GLN A 56 -7.794 -11.975 12.766 1.00 0.00 C ATOM 524 OE1 GLN A 56 -8.363 -13.056 12.712 1.00 0.00 O ATOM 525 NE2 GLN A 56 -8.323 -10.934 13.351 1.00 0.00 N ATOM 0 H GLN A 56 -4.820 -9.728 12.462 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.237 -11.896 13.484 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.292 -13.171 13.290 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -5.557 -11.635 14.092 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -6.337 -10.747 11.820 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -6.337 -12.414 11.279 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.816 -10.049 13.374 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.244 -11.006 13.784 1.00 0.00 H new ATOM 534 N LEU A 57 -3.708 -11.712 10.281 1.00 0.00 N ATOM 535 CA LEU A 57 -3.258 -12.148 8.953 1.00 0.00 C ATOM 536 C LEU A 57 -1.724 -12.316 8.994 1.00 0.00 C ATOM 537 O LEU A 57 -1.198 -13.414 8.826 1.00 0.00 O ATOM 538 CB LEU A 57 -3.741 -11.009 7.993 1.00 0.00 C ATOM 539 CG LEU A 57 -3.509 -11.004 6.469 1.00 0.00 C ATOM 540 CD1 LEU A 57 -2.057 -10.970 6.080 1.00 0.00 C ATOM 541 CD2 LEU A 57 -4.261 -12.107 5.781 1.00 0.00 C ATOM 0 H LEU A 57 -4.265 -10.858 10.247 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.655 -13.107 8.620 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.819 -10.928 8.136 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -3.299 -10.087 8.370 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.923 -10.062 6.111 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.971 -10.968 4.993 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.594 -10.069 6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.552 -11.848 6.482 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.068 -12.065 4.709 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.932 -13.070 6.172 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.329 -11.987 5.962 1.00 0.00 H new ATOM 553 N LYS A 58 -1.055 -11.233 9.305 1.00 0.00 N ATOM 554 CA LYS A 58 0.394 -11.197 9.500 1.00 0.00 C ATOM 555 C LYS A 58 0.870 -12.156 10.605 1.00 0.00 C ATOM 556 O LYS A 58 1.911 -12.810 10.463 1.00 0.00 O ATOM 557 CB LYS A 58 0.875 -9.714 9.710 1.00 0.00 C ATOM 558 CG LYS A 58 1.993 -9.462 10.739 1.00 0.00 C ATOM 559 CD LYS A 58 1.410 -9.295 12.147 1.00 0.00 C ATOM 560 CE LYS A 58 2.477 -9.129 13.216 1.00 0.00 C ATOM 561 NZ LYS A 58 3.346 -7.957 12.972 1.00 0.00 N ATOM 0 H LYS A 58 -1.503 -10.326 9.435 1.00 0.00 H new ATOM 0 HA LYS A 58 0.869 -11.570 8.592 1.00 0.00 H new ATOM 0 HB2 LYS A 58 1.213 -9.332 8.747 1.00 0.00 H new ATOM 0 HB3 LYS A 58 0.010 -9.119 10.003 1.00 0.00 H new ATOM 0 HG2 LYS A 58 2.697 -10.294 10.729 1.00 0.00 H new ATOM 0 HG3 LYS A 58 2.552 -8.568 10.464 1.00 0.00 H new ATOM 0 HD2 LYS A 58 0.752 -8.426 12.161 1.00 0.00 H new ATOM 0 HD3 LYS A 58 0.797 -10.164 12.386 1.00 0.00 H new ATOM 0 HE2 LYS A 58 1.998 -9.026 14.190 1.00 0.00 H new ATOM 0 HE3 LYS A 58 3.090 -10.030 13.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 3.504 -7.450 13.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 4.259 -8.275 12.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.887 -7.321 12.289 1.00 0.00 H new ATOM 575 N THR A 59 0.093 -12.255 11.676 1.00 0.00 N ATOM 576 CA THR A 59 0.442 -13.100 12.803 1.00 0.00 C ATOM 577 C THR A 59 0.507 -14.575 12.387 1.00 0.00 C ATOM 578 O THR A 59 1.532 -15.224 12.565 1.00 0.00 O ATOM 579 CB THR A 59 -0.549 -12.913 13.983 1.00 0.00 C ATOM 580 OG1 THR A 59 -0.558 -11.529 14.385 1.00 0.00 O ATOM 581 CG2 THR A 59 -0.158 -13.773 15.180 1.00 0.00 C ATOM 0 H THR A 59 -0.789 -11.755 11.785 1.00 0.00 H new ATOM 0 HA THR A 59 1.431 -12.794 13.143 1.00 0.00 H new ATOM 0 HB THR A 59 -1.539 -13.220 13.645 1.00 0.00 H new ATOM 0 HG1 THR A 59 -1.248 -11.047 13.883 1.00 0.00 H new ATOM 0 HG21 THR A 59 -0.873 -13.618 15.988 1.00 0.00 H new ATOM 0 HG22 THR A 59 -0.161 -14.824 14.890 1.00 0.00 H new ATOM 0 HG23 THR A 59 0.839 -13.493 15.519 1.00 0.00 H new ATOM 589 N LEU A 60 -0.557 -15.077 11.778 1.00 0.00 N ATOM 590 CA LEU A 60 -0.598 -16.474 11.379 1.00 0.00 C ATOM 591 C LEU A 60 0.351 -16.772 10.234 1.00 0.00 C ATOM 592 O LEU A 60 0.862 -17.879 10.127 1.00 0.00 O ATOM 593 CB LEU A 60 -2.026 -16.987 11.086 1.00 0.00 C ATOM 594 CG LEU A 60 -2.940 -17.282 12.306 1.00 0.00 C ATOM 595 CD1 LEU A 60 -2.264 -18.233 13.280 1.00 0.00 C ATOM 596 CD2 LEU A 60 -3.393 -16.019 13.019 1.00 0.00 C ATOM 0 H LEU A 60 -1.396 -14.543 11.551 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.248 -17.034 12.246 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.527 -16.250 10.459 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.942 -17.901 10.498 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.835 -17.763 11.911 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.927 -18.421 14.124 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.042 -19.174 12.776 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.337 -17.787 13.640 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.029 -16.286 13.863 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.522 -15.472 13.380 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.954 -15.391 12.326 1.00 0.00 H new ATOM 608 N ILE A 61 0.609 -15.794 9.400 1.00 0.00 N ATOM 609 CA ILE A 61 1.558 -15.970 8.323 1.00 0.00 C ATOM 610 C ILE A 61 2.971 -16.157 8.858 1.00 0.00 C ATOM 611 O ILE A 61 3.660 -17.110 8.498 1.00 0.00 O ATOM 612 CB ILE A 61 1.488 -14.822 7.274 1.00 0.00 C ATOM 613 CG1 ILE A 61 0.191 -14.925 6.468 1.00 0.00 C ATOM 614 CG2 ILE A 61 2.701 -14.805 6.347 1.00 0.00 C ATOM 615 CD1 ILE A 61 0.018 -16.250 5.744 1.00 0.00 C ATOM 0 H ILE A 61 0.178 -14.871 9.444 1.00 0.00 H new ATOM 0 HA ILE A 61 1.276 -16.883 7.799 1.00 0.00 H new ATOM 0 HB ILE A 61 1.497 -13.879 7.821 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.655 -14.776 7.139 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.164 -14.117 5.737 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.603 -13.986 5.635 1.00 0.00 H new ATOM 0 HG22 ILE A 61 3.607 -14.667 6.936 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.760 -15.750 5.807 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.924 -16.245 5.196 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.843 -16.394 5.046 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.011 -17.063 6.470 1.00 0.00 H new ATOM 627 N LEU A 62 3.384 -15.318 9.761 1.00 0.00 N ATOM 628 CA LEU A 62 4.726 -15.431 10.285 1.00 0.00 C ATOM 629 C LEU A 62 4.801 -16.648 11.234 1.00 0.00 C ATOM 630 O LEU A 62 5.854 -17.199 11.463 1.00 0.00 O ATOM 631 CB LEU A 62 5.138 -14.117 10.986 1.00 0.00 C ATOM 632 CG LEU A 62 6.627 -13.673 10.867 1.00 0.00 C ATOM 633 CD1 LEU A 62 7.591 -14.644 11.533 1.00 0.00 C ATOM 634 CD2 LEU A 62 7.013 -13.462 9.404 1.00 0.00 C ATOM 0 H LEU A 62 2.827 -14.557 10.150 1.00 0.00 H new ATOM 0 HA LEU A 62 5.433 -15.593 9.472 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.515 -13.315 10.589 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.899 -14.212 12.045 1.00 0.00 H new ATOM 0 HG LEU A 62 6.711 -12.727 11.402 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.612 -14.280 11.417 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.353 -14.723 12.594 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.500 -15.625 11.066 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.056 -13.152 9.344 1.00 0.00 H new ATOM 0 HD22 LEU A 62 6.879 -14.394 8.854 1.00 0.00 H new ATOM 0 HD23 LEU A 62 6.380 -12.689 8.968 1.00 0.00 H new ATOM 646 N ASP A 63 3.667 -17.079 11.726 1.00 0.00 N ATOM 647 CA ASP A 63 3.588 -18.210 12.661 1.00 0.00 C ATOM 648 C ASP A 63 3.609 -19.549 11.937 1.00 0.00 C ATOM 649 O ASP A 63 4.159 -20.516 12.432 1.00 0.00 O ATOM 650 CB ASP A 63 2.314 -18.115 13.424 1.00 0.00 C ATOM 651 CG ASP A 63 2.286 -18.942 14.687 1.00 0.00 C ATOM 652 OD1 ASP A 63 3.072 -18.649 15.627 1.00 0.00 O ATOM 653 OD2 ASP A 63 1.446 -19.854 14.803 1.00 0.00 O ATOM 0 H ASP A 63 2.763 -16.666 11.499 1.00 0.00 H new ATOM 0 HA ASP A 63 4.455 -18.159 13.320 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.135 -17.071 13.682 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.493 -18.429 12.779 1.00 0.00 H new ATOM 658 N ALA A 64 2.962 -19.616 10.803 1.00 0.00 N ATOM 659 CA ALA A 64 2.913 -20.834 10.014 1.00 0.00 C ATOM 660 C ALA A 64 4.143 -20.951 9.155 1.00 0.00 C ATOM 661 O ALA A 64 4.781 -22.005 9.095 1.00 0.00 O ATOM 662 CB ALA A 64 1.659 -20.870 9.148 1.00 0.00 C ATOM 0 H ALA A 64 2.452 -18.832 10.395 1.00 0.00 H new ATOM 0 HA ALA A 64 2.880 -21.682 10.699 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.645 -21.792 8.566 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.776 -20.829 9.785 1.00 0.00 H new ATOM 0 HB3 ALA A 64 1.659 -20.015 8.472 1.00 0.00 H new ATOM 668 N LEU A 65 4.520 -19.848 8.532 1.00 0.00 N ATOM 669 CA LEU A 65 5.640 -19.868 7.609 1.00 0.00 C ATOM 670 C LEU A 65 6.935 -19.756 8.351 1.00 0.00 C ATOM 671 O LEU A 65 7.935 -20.316 7.928 1.00 0.00 O ATOM 672 CB LEU A 65 5.542 -18.792 6.495 1.00 0.00 C ATOM 673 CG LEU A 65 4.426 -18.971 5.434 1.00 0.00 C ATOM 674 CD1 LEU A 65 3.047 -18.780 6.017 1.00 0.00 C ATOM 675 CD2 LEU A 65 4.635 -18.036 4.259 1.00 0.00 C ATOM 0 H LEU A 65 4.073 -18.938 8.646 1.00 0.00 H new ATOM 0 HA LEU A 65 5.603 -20.831 7.099 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.401 -17.823 6.973 1.00 0.00 H new ATOM 0 HB3 LEU A 65 6.499 -18.755 5.975 1.00 0.00 H new ATOM 0 HG LEU A 65 4.493 -20.000 5.080 1.00 0.00 H new ATOM 0 HD11 LEU A 65 2.300 -18.915 5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.882 -19.512 6.808 1.00 0.00 H new ATOM 0 HD13 LEU A 65 2.962 -17.775 6.430 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.838 -18.183 3.531 1.00 0.00 H new ATOM 0 HD22 LEU A 65 4.621 -17.004 4.609 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.597 -18.248 3.792 1.00 0.00 H new ATOM 687 N LYS A 66 6.890 -19.050 9.483 1.00 0.00 N ATOM 688 CA LYS A 66 8.044 -18.838 10.354 1.00 0.00 C ATOM 689 C LYS A 66 9.262 -18.403 9.589 1.00 0.00 C ATOM 690 O LYS A 66 10.218 -19.160 9.372 1.00 0.00 O ATOM 691 CB LYS A 66 8.285 -20.029 11.257 1.00 0.00 C ATOM 692 CG LYS A 66 7.218 -20.172 12.343 1.00 0.00 C ATOM 693 CD LYS A 66 7.173 -21.575 12.891 1.00 0.00 C ATOM 694 CE LYS A 66 6.578 -22.523 11.862 1.00 0.00 C ATOM 695 NZ LYS A 66 6.619 -23.925 12.317 1.00 0.00 N ATOM 0 H LYS A 66 6.038 -18.604 9.823 1.00 0.00 H new ATOM 0 HA LYS A 66 7.810 -18.003 11.015 1.00 0.00 H new ATOM 0 HB2 LYS A 66 8.309 -20.937 10.655 1.00 0.00 H new ATOM 0 HB3 LYS A 66 9.264 -19.932 11.726 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.424 -19.471 13.152 1.00 0.00 H new ATOM 0 HG3 LYS A 66 6.243 -19.909 11.933 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.178 -21.901 13.158 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.578 -21.598 13.804 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.546 -22.237 11.659 1.00 0.00 H new ATOM 0 HE3 LYS A 66 7.125 -22.430 10.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.204 -24.539 11.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 7.606 -24.206 12.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 6.076 -24.020 13.199 1.00 0.00 H new ATOM 709 N LYS A 67 9.143 -17.217 9.079 1.00 0.00 N ATOM 710 CA LYS A 67 10.186 -16.595 8.309 1.00 0.00 C ATOM 711 C LYS A 67 11.382 -16.293 9.205 1.00 0.00 C ATOM 712 O LYS A 67 12.374 -17.032 9.199 1.00 0.00 O ATOM 713 CB LYS A 67 9.652 -15.321 7.648 1.00 0.00 C ATOM 714 CG LYS A 67 8.519 -15.549 6.643 1.00 0.00 C ATOM 715 CD LYS A 67 9.029 -16.246 5.407 1.00 0.00 C ATOM 716 CE LYS A 67 7.956 -16.370 4.336 1.00 0.00 C ATOM 717 NZ LYS A 67 8.477 -16.977 3.090 1.00 0.00 N ATOM 0 H LYS A 67 8.308 -16.641 9.185 1.00 0.00 H new ATOM 0 HA LYS A 67 10.515 -17.274 7.523 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.299 -14.645 8.426 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.475 -14.819 7.139 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.733 -16.147 7.104 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.073 -14.593 6.369 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.879 -15.695 5.005 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.390 -17.239 5.674 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.133 -16.975 4.717 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.550 -15.383 4.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.712 -17.042 2.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.245 -16.387 2.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.841 -17.930 3.294 1.00 0.00 H new ATOM 731 N ASP A 68 11.266 -15.247 9.992 1.00 0.00 N ATOM 732 CA ASP A 68 12.283 -14.850 10.945 1.00 0.00 C ATOM 733 C ASP A 68 11.723 -13.703 11.671 1.00 0.00 C ATOM 734 O ASP A 68 10.917 -12.964 11.099 1.00 0.00 O ATOM 735 CB ASP A 68 13.558 -14.382 10.269 1.00 0.00 C ATOM 736 CG ASP A 68 14.749 -14.446 11.185 1.00 0.00 C ATOM 737 OD1 ASP A 68 14.934 -13.537 12.013 1.00 0.00 O ATOM 738 OD2 ASP A 68 15.502 -15.437 11.120 1.00 0.00 O ATOM 0 H ASP A 68 10.449 -14.637 9.989 1.00 0.00 H new ATOM 0 HA ASP A 68 12.536 -15.700 11.579 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.746 -14.997 9.389 1.00 0.00 H new ATOM 0 HB3 ASP A 68 13.426 -13.358 9.920 1.00 0.00 H new ATOM 743 N SER A 69 12.133 -13.510 12.870 1.00 0.00 N ATOM 744 CA SER A 69 11.616 -12.448 13.644 1.00 0.00 C ATOM 745 C SER A 69 12.349 -11.136 13.294 1.00 0.00 C ATOM 746 O SER A 69 11.791 -10.041 13.409 1.00 0.00 O ATOM 747 CB SER A 69 11.699 -12.790 15.143 1.00 0.00 C ATOM 748 OG SER A 69 11.025 -11.840 15.961 1.00 0.00 O ATOM 0 H SER A 69 12.834 -14.083 13.340 1.00 0.00 H new ATOM 0 HA SER A 69 10.561 -12.302 13.410 1.00 0.00 H new ATOM 0 HB2 SER A 69 11.269 -13.778 15.311 1.00 0.00 H new ATOM 0 HB3 SER A 69 12.746 -12.843 15.442 1.00 0.00 H new ATOM 0 HG SER A 69 11.106 -12.103 16.902 1.00 0.00 H new ATOM 754 N SER A 70 13.562 -11.261 12.803 1.00 0.00 N ATOM 755 CA SER A 70 14.375 -10.120 12.464 1.00 0.00 C ATOM 756 C SER A 70 13.844 -9.437 11.192 1.00 0.00 C ATOM 757 O SER A 70 13.671 -8.215 11.145 1.00 0.00 O ATOM 758 CB SER A 70 15.802 -10.600 12.268 1.00 0.00 C ATOM 759 OG SER A 70 16.204 -11.389 13.386 1.00 0.00 O ATOM 0 H SER A 70 14.011 -12.160 12.628 1.00 0.00 H new ATOM 0 HA SER A 70 14.341 -9.382 13.265 1.00 0.00 H new ATOM 0 HB2 SER A 70 15.876 -11.186 11.352 1.00 0.00 H new ATOM 0 HB3 SER A 70 16.470 -9.746 12.155 1.00 0.00 H new ATOM 0 HG SER A 70 15.918 -12.317 13.252 1.00 0.00 H new ATOM 765 N ARG A 71 13.534 -10.247 10.187 1.00 0.00 N ATOM 766 CA ARG A 71 13.063 -9.731 8.901 1.00 0.00 C ATOM 767 C ARG A 71 11.558 -9.464 8.934 1.00 0.00 C ATOM 768 O ARG A 71 11.011 -8.842 8.027 1.00 0.00 O ATOM 769 CB ARG A 71 13.475 -10.689 7.755 1.00 0.00 C ATOM 770 CG ARG A 71 12.768 -12.039 7.754 1.00 0.00 C ATOM 771 CD ARG A 71 11.637 -12.062 6.747 1.00 0.00 C ATOM 772 NE ARG A 71 12.144 -12.067 5.364 1.00 0.00 N ATOM 773 CZ ARG A 71 11.552 -11.509 4.302 1.00 0.00 C ATOM 774 NH1 ARG A 71 10.466 -10.765 4.454 1.00 0.00 N ATOM 775 NH2 ARG A 71 12.076 -11.673 3.096 1.00 0.00 N ATOM 0 H ARG A 71 13.599 -11.264 10.234 1.00 0.00 H new ATOM 0 HA ARG A 71 13.541 -8.771 8.707 1.00 0.00 H new ATOM 0 HB2 ARG A 71 13.282 -10.195 6.803 1.00 0.00 H new ATOM 0 HB3 ARG A 71 14.550 -10.860 7.814 1.00 0.00 H new ATOM 0 HG2 ARG A 71 13.483 -12.827 7.520 1.00 0.00 H new ATOM 0 HG3 ARG A 71 12.377 -12.249 8.750 1.00 0.00 H new ATOM 0 HD2 ARG A 71 11.020 -12.945 6.912 1.00 0.00 H new ATOM 0 HD3 ARG A 71 10.997 -11.193 6.898 1.00 0.00 H new ATOM 0 HE ARG A 71 13.032 -12.542 5.200 1.00 0.00 H new ATOM 0 HH11 ARG A 71 10.077 -10.615 5.385 1.00 0.00 H new ATOM 0 HH12 ARG A 71 10.019 -10.342 3.640 1.00 0.00 H new ATOM 0 HH21 ARG A 71 12.927 -12.223 2.980 1.00 0.00 H new ATOM 0 HH22 ARG A 71 11.628 -11.249 2.283 1.00 0.00 H new ATOM 789 N HIS A 72 10.904 -9.947 9.994 1.00 0.00 N ATOM 790 CA HIS A 72 9.467 -9.738 10.229 1.00 0.00 C ATOM 791 C HIS A 72 9.156 -8.238 10.266 1.00 0.00 C ATOM 792 O HIS A 72 8.221 -7.764 9.611 1.00 0.00 O ATOM 793 CB HIS A 72 9.062 -10.415 11.563 1.00 0.00 C ATOM 794 CG HIS A 72 7.586 -10.393 11.927 1.00 0.00 C ATOM 795 ND1 HIS A 72 7.092 -10.915 13.103 1.00 0.00 N ATOM 796 CD2 HIS A 72 6.502 -9.923 11.250 1.00 0.00 C ATOM 797 CE1 HIS A 72 5.774 -10.757 13.111 1.00 0.00 C ATOM 798 NE2 HIS A 72 5.357 -10.155 12.006 1.00 0.00 N ATOM 0 H HIS A 72 11.358 -10.499 10.721 1.00 0.00 H new ATOM 0 HA HIS A 72 8.893 -10.186 9.417 1.00 0.00 H new ATOM 0 HB2 HIS A 72 9.387 -11.455 11.528 1.00 0.00 H new ATOM 0 HB3 HIS A 72 9.617 -9.935 12.369 1.00 0.00 H new ATOM 0 HD1 HIS A 72 7.645 -11.349 13.842 1.00 0.00 H new ATOM 0 HD2 HIS A 72 6.527 -9.446 10.281 1.00 0.00 H new ATOM 0 HE1 HIS A 72 5.126 -11.077 13.913 1.00 0.00 H new ATOM 806 N SER A 73 10.003 -7.494 10.936 1.00 0.00 N ATOM 807 CA SER A 73 9.812 -6.068 11.119 1.00 0.00 C ATOM 808 C SER A 73 10.212 -5.243 9.875 1.00 0.00 C ATOM 809 O SER A 73 10.333 -4.014 9.937 1.00 0.00 O ATOM 810 CB SER A 73 10.554 -5.625 12.372 1.00 0.00 C ATOM 811 OG SER A 73 10.124 -6.411 13.486 1.00 0.00 O ATOM 0 H SER A 73 10.849 -7.859 11.373 1.00 0.00 H new ATOM 0 HA SER A 73 8.747 -5.876 11.250 1.00 0.00 H new ATOM 0 HB2 SER A 73 11.629 -5.736 12.229 1.00 0.00 H new ATOM 0 HB3 SER A 73 10.365 -4.569 12.565 1.00 0.00 H new ATOM 0 HG SER A 73 10.604 -6.126 14.292 1.00 0.00 H new ATOM 817 N LYS A 74 10.387 -5.912 8.748 1.00 0.00 N ATOM 818 CA LYS A 74 10.628 -5.218 7.513 1.00 0.00 C ATOM 819 C LYS A 74 9.651 -5.717 6.449 1.00 0.00 C ATOM 820 O LYS A 74 9.780 -5.438 5.256 1.00 0.00 O ATOM 821 CB LYS A 74 12.101 -5.302 7.055 1.00 0.00 C ATOM 822 CG LYS A 74 12.495 -4.416 5.822 1.00 0.00 C ATOM 823 CD LYS A 74 12.206 -2.905 6.015 1.00 0.00 C ATOM 824 CE LYS A 74 10.747 -2.529 5.679 1.00 0.00 C ATOM 825 NZ LYS A 74 10.422 -1.115 5.976 1.00 0.00 N ATOM 0 H LYS A 74 10.365 -6.929 8.671 1.00 0.00 H new ATOM 0 HA LYS A 74 10.448 -4.156 7.677 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.737 -5.023 7.895 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.327 -6.341 6.816 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.557 -4.549 5.616 1.00 0.00 H new ATOM 0 HG3 LYS A 74 11.953 -4.770 4.945 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.420 -2.628 7.047 1.00 0.00 H new ATOM 0 HD3 LYS A 74 12.880 -2.327 5.383 1.00 0.00 H new ATOM 0 HE2 LYS A 74 10.564 -2.722 4.622 1.00 0.00 H new ATOM 0 HE3 LYS A 74 10.074 -3.175 6.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.394 -0.973 5.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 10.740 -0.880 6.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 10.903 -0.497 5.292 1.00 0.00 H new ATOM 839 N LEU A 75 8.665 -6.441 6.876 1.00 0.00 N ATOM 840 CA LEU A 75 7.623 -6.802 5.986 1.00 0.00 C ATOM 841 C LEU A 75 6.669 -5.671 5.862 1.00 0.00 C ATOM 842 O LEU A 75 6.001 -5.297 6.826 1.00 0.00 O ATOM 843 CB LEU A 75 6.904 -8.087 6.362 1.00 0.00 C ATOM 844 CG LEU A 75 7.525 -9.382 5.853 1.00 0.00 C ATOM 845 CD1 LEU A 75 8.296 -10.101 6.940 1.00 0.00 C ATOM 846 CD2 LEU A 75 6.460 -10.272 5.220 1.00 0.00 C ATOM 0 H LEU A 75 8.565 -6.789 7.830 1.00 0.00 H new ATOM 0 HA LEU A 75 8.086 -7.010 5.022 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.845 -8.140 7.449 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.881 -8.028 5.989 1.00 0.00 H new ATOM 0 HG LEU A 75 8.250 -9.129 5.079 1.00 0.00 H new ATOM 0 HD11 LEU A 75 8.723 -11.019 6.537 1.00 0.00 H new ATOM 0 HD12 LEU A 75 9.097 -9.458 7.304 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.624 -10.344 7.763 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.921 -11.193 4.862 1.00 0.00 H new ATOM 0 HD22 LEU A 75 5.699 -10.512 5.962 1.00 0.00 H new ATOM 0 HD23 LEU A 75 5.998 -9.748 4.383 1.00 0.00 H new ATOM 858 N GLU A 76 6.658 -5.089 4.701 1.00 0.00 N ATOM 859 CA GLU A 76 5.781 -4.016 4.401 1.00 0.00 C ATOM 860 C GLU A 76 4.418 -4.585 4.134 1.00 0.00 C ATOM 861 O GLU A 76 4.278 -5.784 3.893 1.00 0.00 O ATOM 862 CB GLU A 76 6.292 -3.264 3.188 1.00 0.00 C ATOM 863 CG GLU A 76 7.584 -2.492 3.442 1.00 0.00 C ATOM 864 CD GLU A 76 7.403 -1.307 4.378 1.00 0.00 C ATOM 865 OE1 GLU A 76 7.039 -0.207 3.903 1.00 0.00 O ATOM 866 OE2 GLU A 76 7.656 -1.439 5.586 1.00 0.00 O ATOM 0 H GLU A 76 7.270 -5.356 3.930 1.00 0.00 H new ATOM 0 HA GLU A 76 5.729 -3.318 5.237 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.456 -3.972 2.376 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.523 -2.568 2.853 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.327 -3.169 3.864 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.980 -2.137 2.490 1.00 0.00 H new ATOM 873 N LYS A 77 3.432 -3.740 4.162 1.00 0.00 N ATOM 874 CA LYS A 77 2.052 -4.131 3.974 1.00 0.00 C ATOM 875 C LYS A 77 1.840 -4.951 2.692 1.00 0.00 C ATOM 876 O LYS A 77 1.200 -5.991 2.711 1.00 0.00 O ATOM 877 CB LYS A 77 1.178 -2.885 4.025 1.00 0.00 C ATOM 878 CG LYS A 77 -0.290 -3.140 3.781 1.00 0.00 C ATOM 879 CD LYS A 77 -1.176 -2.063 4.423 1.00 0.00 C ATOM 880 CE LYS A 77 -1.036 -2.054 5.954 1.00 0.00 C ATOM 881 NZ LYS A 77 -1.901 -1.050 6.603 1.00 0.00 N ATOM 0 H LYS A 77 3.558 -2.740 4.318 1.00 0.00 H new ATOM 0 HA LYS A 77 1.760 -4.800 4.783 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.295 -2.414 5.001 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.539 -2.173 3.283 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.479 -3.172 2.708 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.560 -4.117 4.182 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.905 -1.084 4.027 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.217 -2.239 4.153 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.281 -3.043 6.342 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.003 -1.856 6.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.765 -1.089 7.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.652 -0.101 6.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.896 -1.251 6.377 1.00 0.00 H new ATOM 895 N ALA A 78 2.447 -4.510 1.625 1.00 0.00 N ATOM 896 CA ALA A 78 2.377 -5.196 0.333 1.00 0.00 C ATOM 897 C ALA A 78 3.039 -6.585 0.380 1.00 0.00 C ATOM 898 O ALA A 78 2.631 -7.505 -0.335 1.00 0.00 O ATOM 899 CB ALA A 78 3.037 -4.344 -0.728 1.00 0.00 C ATOM 0 H ALA A 78 3.012 -3.661 1.611 1.00 0.00 H new ATOM 0 HA ALA A 78 1.325 -5.345 0.090 1.00 0.00 H new ATOM 0 HB1 ALA A 78 2.985 -4.855 -1.689 1.00 0.00 H new ATOM 0 HB2 ALA A 78 2.522 -3.386 -0.798 1.00 0.00 H new ATOM 0 HB3 ALA A 78 4.081 -4.176 -0.463 1.00 0.00 H new ATOM 905 N ASP A 79 4.010 -6.738 1.270 1.00 0.00 N ATOM 906 CA ASP A 79 4.777 -7.980 1.378 1.00 0.00 C ATOM 907 C ASP A 79 3.961 -8.983 2.120 1.00 0.00 C ATOM 908 O ASP A 79 3.861 -10.139 1.737 1.00 0.00 O ATOM 909 CB ASP A 79 6.106 -7.763 2.126 1.00 0.00 C ATOM 910 CG ASP A 79 7.135 -6.975 1.369 1.00 0.00 C ATOM 911 OD1 ASP A 79 7.729 -7.513 0.399 1.00 0.00 O ATOM 912 OD2 ASP A 79 7.438 -5.836 1.774 1.00 0.00 O ATOM 0 H ASP A 79 4.289 -6.015 1.933 1.00 0.00 H new ATOM 0 HA ASP A 79 5.008 -8.330 0.372 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.898 -7.253 3.066 1.00 0.00 H new ATOM 0 HB3 ASP A 79 6.528 -8.736 2.378 1.00 0.00 H new ATOM 917 N ILE A 80 3.360 -8.508 3.172 1.00 0.00 N ATOM 918 CA ILE A 80 2.513 -9.294 4.036 1.00 0.00 C ATOM 919 C ILE A 80 1.305 -9.808 3.263 1.00 0.00 C ATOM 920 O ILE A 80 0.980 -10.994 3.318 1.00 0.00 O ATOM 921 CB ILE A 80 2.082 -8.421 5.229 1.00 0.00 C ATOM 922 CG1 ILE A 80 3.344 -7.978 5.963 1.00 0.00 C ATOM 923 CG2 ILE A 80 1.152 -9.186 6.157 1.00 0.00 C ATOM 924 CD1 ILE A 80 3.163 -6.869 6.959 1.00 0.00 C ATOM 0 H ILE A 80 3.445 -7.535 3.465 1.00 0.00 H new ATOM 0 HA ILE A 80 3.058 -10.162 4.408 1.00 0.00 H new ATOM 0 HB ILE A 80 1.529 -7.551 4.875 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.763 -8.841 6.480 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.080 -7.661 5.224 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.863 -8.546 6.991 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.261 -9.492 5.608 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.664 -10.069 6.538 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.122 -6.635 7.421 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.778 -5.984 6.452 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.457 -7.182 7.728 1.00 0.00 H new ATOM 936 N LEU A 81 0.681 -8.921 2.513 1.00 0.00 N ATOM 937 CA LEU A 81 -0.464 -9.268 1.689 1.00 0.00 C ATOM 938 C LEU A 81 -0.129 -10.375 0.705 1.00 0.00 C ATOM 939 O LEU A 81 -0.786 -11.424 0.699 1.00 0.00 O ATOM 940 CB LEU A 81 -0.985 -8.042 0.943 1.00 0.00 C ATOM 941 CG LEU A 81 -2.111 -7.225 1.605 1.00 0.00 C ATOM 942 CD1 LEU A 81 -1.794 -6.858 3.050 1.00 0.00 C ATOM 943 CD2 LEU A 81 -2.342 -5.970 0.798 1.00 0.00 C ATOM 0 H LEU A 81 0.952 -7.939 2.457 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.245 -9.634 2.355 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.143 -7.372 0.769 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.339 -8.370 -0.035 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.008 -7.844 1.623 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.620 -6.283 3.469 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.652 -7.768 3.634 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.883 -6.260 3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.138 -5.383 1.257 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.425 -5.381 0.771 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.630 -6.239 -0.218 1.00 0.00 H new ATOM 955 N GLU A 82 0.938 -10.186 -0.072 1.00 0.00 N ATOM 956 CA GLU A 82 1.299 -11.147 -1.083 1.00 0.00 C ATOM 957 C GLU A 82 1.750 -12.456 -0.449 1.00 0.00 C ATOM 958 O GLU A 82 1.574 -13.491 -1.029 1.00 0.00 O ATOM 959 CB GLU A 82 2.397 -10.607 -2.019 1.00 0.00 C ATOM 960 CG GLU A 82 3.808 -10.888 -1.564 1.00 0.00 C ATOM 961 CD GLU A 82 4.867 -10.345 -2.491 1.00 0.00 C ATOM 962 OE1 GLU A 82 4.983 -10.853 -3.634 1.00 0.00 O ATOM 963 OE2 GLU A 82 5.633 -9.451 -2.094 1.00 0.00 O ATOM 0 H GLU A 82 1.557 -9.377 -0.012 1.00 0.00 H new ATOM 0 HA GLU A 82 0.408 -11.333 -1.683 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.256 -11.040 -3.009 1.00 0.00 H new ATOM 0 HB3 GLU A 82 2.271 -9.529 -2.121 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.952 -10.459 -0.572 1.00 0.00 H new ATOM 0 HG3 GLU A 82 3.941 -11.966 -1.468 1.00 0.00 H new ATOM 970 N MET A 83 2.276 -12.398 0.772 1.00 0.00 N ATOM 971 CA MET A 83 2.832 -13.570 1.430 1.00 0.00 C ATOM 972 C MET A 83 1.723 -14.524 1.791 1.00 0.00 C ATOM 973 O MET A 83 1.861 -15.738 1.675 1.00 0.00 O ATOM 974 CB MET A 83 3.611 -13.160 2.679 1.00 0.00 C ATOM 975 CG MET A 83 4.412 -14.285 3.306 1.00 0.00 C ATOM 976 SD MET A 83 5.632 -14.988 2.173 1.00 0.00 S ATOM 977 CE MET A 83 6.608 -13.536 1.777 1.00 0.00 C ATOM 0 H MET A 83 2.327 -11.543 1.326 1.00 0.00 H new ATOM 0 HA MET A 83 3.520 -14.068 0.747 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.288 -12.346 2.421 1.00 0.00 H new ATOM 0 HB3 MET A 83 2.912 -12.770 3.419 1.00 0.00 H new ATOM 0 HG2 MET A 83 4.920 -13.912 4.195 1.00 0.00 H new ATOM 0 HG3 MET A 83 3.732 -15.071 3.634 1.00 0.00 H new ATOM 0 HE1 MET A 83 7.559 -13.844 1.343 1.00 0.00 H new ATOM 0 HE2 MET A 83 6.066 -12.918 1.061 1.00 0.00 H new ATOM 0 HE3 MET A 83 6.792 -12.963 2.685 1.00 0.00 H new ATOM 987 N THR A 84 0.617 -13.954 2.171 1.00 0.00 N ATOM 988 CA THR A 84 -0.566 -14.690 2.523 1.00 0.00 C ATOM 989 C THR A 84 -1.138 -15.344 1.249 1.00 0.00 C ATOM 990 O THR A 84 -1.596 -16.493 1.261 1.00 0.00 O ATOM 991 CB THR A 84 -1.575 -13.711 3.130 1.00 0.00 C ATOM 992 OG1 THR A 84 -0.841 -12.841 3.993 1.00 0.00 O ATOM 993 CG2 THR A 84 -2.582 -14.431 3.999 1.00 0.00 C ATOM 0 H THR A 84 0.508 -12.943 2.247 1.00 0.00 H new ATOM 0 HA THR A 84 -0.344 -15.472 3.249 1.00 0.00 H new ATOM 0 HB THR A 84 -2.096 -13.191 2.326 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.541 -12.056 3.488 1.00 0.00 H new ATOM 0 HG21 THR A 84 -3.285 -13.709 4.416 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.125 -15.161 3.399 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.063 -14.942 4.810 1.00 0.00 H new ATOM 1001 N VAL A 85 -1.044 -14.606 0.151 1.00 0.00 N ATOM 1002 CA VAL A 85 -1.444 -15.079 -1.169 1.00 0.00 C ATOM 1003 C VAL A 85 -0.554 -16.263 -1.572 1.00 0.00 C ATOM 1004 O VAL A 85 -1.043 -17.295 -2.024 1.00 0.00 O ATOM 1005 CB VAL A 85 -1.269 -13.950 -2.213 1.00 0.00 C ATOM 1006 CG1 VAL A 85 -1.578 -14.397 -3.632 1.00 0.00 C ATOM 1007 CG2 VAL A 85 -2.096 -12.757 -1.853 1.00 0.00 C ATOM 0 H VAL A 85 -0.684 -13.652 0.151 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.490 -15.385 -1.135 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.214 -13.676 -2.190 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -1.437 -13.560 -4.316 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.909 -15.211 -3.911 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.611 -14.741 -3.688 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.956 -11.978 -2.602 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -3.148 -13.041 -1.817 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.788 -12.382 -0.877 1.00 0.00 H new ATOM 1017 N LYS A 86 0.752 -16.107 -1.373 1.00 0.00 N ATOM 1018 CA LYS A 86 1.723 -17.143 -1.711 1.00 0.00 C ATOM 1019 C LYS A 86 1.471 -18.387 -0.879 1.00 0.00 C ATOM 1020 O LYS A 86 1.520 -19.503 -1.382 1.00 0.00 O ATOM 1021 CB LYS A 86 3.168 -16.680 -1.485 1.00 0.00 C ATOM 1022 CG LYS A 86 3.540 -15.356 -2.128 1.00 0.00 C ATOM 1023 CD LYS A 86 5.039 -15.210 -2.217 1.00 0.00 C ATOM 1024 CE LYS A 86 5.449 -13.873 -2.777 1.00 0.00 C ATOM 1025 NZ LYS A 86 4.814 -13.563 -4.083 1.00 0.00 N ATOM 0 H LYS A 86 1.165 -15.264 -0.975 1.00 0.00 H new ATOM 0 HA LYS A 86 1.597 -17.362 -2.771 1.00 0.00 H new ATOM 0 HB2 LYS A 86 3.343 -16.604 -0.412 1.00 0.00 H new ATOM 0 HB3 LYS A 86 3.841 -17.449 -1.864 1.00 0.00 H new ATOM 0 HG2 LYS A 86 3.104 -15.295 -3.125 1.00 0.00 H new ATOM 0 HG3 LYS A 86 3.123 -14.534 -1.547 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.474 -15.335 -1.225 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.443 -16.004 -2.845 1.00 0.00 H new ATOM 0 HE2 LYS A 86 5.191 -13.093 -2.061 1.00 0.00 H new ATOM 0 HE3 LYS A 86 6.533 -13.853 -2.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 5.042 -12.586 -4.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.172 -14.218 -4.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 3.783 -13.668 -4.001 1.00 0.00 H new ATOM 1039 N HIS A 87 1.164 -18.173 0.392 1.00 0.00 N ATOM 1040 CA HIS A 87 0.867 -19.246 1.335 1.00 0.00 C ATOM 1041 C HIS A 87 -0.349 -20.047 0.874 1.00 0.00 C ATOM 1042 O HIS A 87 -0.393 -21.268 1.042 1.00 0.00 O ATOM 1043 CB HIS A 87 0.625 -18.655 2.734 1.00 0.00 C ATOM 1044 CG HIS A 87 0.407 -19.659 3.834 1.00 0.00 C ATOM 1045 ND1 HIS A 87 -0.500 -19.487 4.854 1.00 0.00 N ATOM 1046 CD2 HIS A 87 1.060 -20.810 4.112 1.00 0.00 C ATOM 1047 CE1 HIS A 87 -0.367 -20.506 5.706 1.00 0.00 C ATOM 1048 NE2 HIS A 87 0.568 -21.341 5.306 1.00 0.00 N ATOM 0 H HIS A 87 1.113 -17.241 0.804 1.00 0.00 H new ATOM 0 HA HIS A 87 1.720 -19.923 1.379 1.00 0.00 H new ATOM 0 HB2 HIS A 87 1.479 -18.032 2.999 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -0.245 -18.000 2.687 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -1.160 -18.714 4.944 1.00 0.00 H new ATOM 0 HD2 HIS A 87 1.839 -21.249 3.506 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -0.951 -20.629 6.606 1.00 0.00 H new ATOM 1056 N LEU A 88 -1.291 -19.361 0.229 1.00 0.00 N ATOM 1057 CA LEU A 88 -2.500 -19.969 -0.262 1.00 0.00 C ATOM 1058 C LEU A 88 -2.088 -20.942 -1.340 1.00 0.00 C ATOM 1059 O LEU A 88 -2.512 -22.088 -1.355 1.00 0.00 O ATOM 1060 CB LEU A 88 -3.407 -18.841 -0.837 1.00 0.00 C ATOM 1061 CG LEU A 88 -4.871 -19.139 -1.239 1.00 0.00 C ATOM 1062 CD1 LEU A 88 -5.526 -17.851 -1.674 1.00 0.00 C ATOM 1063 CD2 LEU A 88 -4.984 -20.136 -2.371 1.00 0.00 C ATOM 0 H LEU A 88 -1.225 -18.361 0.037 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.055 -20.494 0.515 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.433 -18.041 -0.097 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -2.906 -18.443 -1.719 1.00 0.00 H new ATOM 0 HG LEU A 88 -5.362 -19.573 -0.368 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.559 -18.047 -1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -5.507 -17.137 -0.851 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.986 -17.438 -2.526 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.035 -20.302 -2.606 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -4.473 -19.746 -3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.525 -21.079 -2.073 1.00 0.00 H new ATOM 1075 N ARG A 89 -1.189 -20.484 -2.189 1.00 0.00 N ATOM 1076 CA ARG A 89 -0.722 -21.255 -3.316 1.00 0.00 C ATOM 1077 C ARG A 89 0.046 -22.455 -2.810 1.00 0.00 C ATOM 1078 O ARG A 89 -0.214 -23.576 -3.217 1.00 0.00 O ATOM 1079 CB ARG A 89 0.192 -20.413 -4.228 1.00 0.00 C ATOM 1080 CG ARG A 89 -0.305 -18.996 -4.513 1.00 0.00 C ATOM 1081 CD ARG A 89 -1.761 -18.971 -4.933 1.00 0.00 C ATOM 1082 NE ARG A 89 -1.982 -19.702 -6.192 1.00 0.00 N ATOM 1083 CZ ARG A 89 -3.134 -20.257 -6.599 1.00 0.00 C ATOM 1084 NH1 ARG A 89 -4.193 -20.289 -5.791 1.00 0.00 N ATOM 1085 NH2 ARG A 89 -3.211 -20.794 -7.808 1.00 0.00 N ATOM 0 H ARG A 89 -0.762 -19.561 -2.113 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.586 -21.574 -3.899 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.179 -20.350 -3.769 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.314 -20.936 -5.176 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.176 -18.382 -3.622 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.305 -18.550 -5.299 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.374 -19.410 -4.146 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.087 -17.938 -5.051 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.181 -19.796 -6.816 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -4.132 -19.890 -4.854 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -5.065 -20.713 -6.109 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.398 -20.784 -8.423 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -4.084 -21.217 -8.123 1.00 0.00 H new ATOM 1099 N ASN A 90 0.943 -22.200 -1.862 1.00 0.00 N ATOM 1100 CA ASN A 90 1.818 -23.221 -1.286 1.00 0.00 C ATOM 1101 C ASN A 90 1.029 -24.327 -0.678 1.00 0.00 C ATOM 1102 O ASN A 90 1.333 -25.508 -0.888 1.00 0.00 O ATOM 1103 CB ASN A 90 2.776 -22.672 -0.218 1.00 0.00 C ATOM 1104 CG ASN A 90 3.737 -21.593 -0.688 1.00 0.00 C ATOM 1105 OD1 ASN A 90 4.070 -21.501 -1.869 1.00 0.00 O ATOM 1106 ND2 ASN A 90 4.236 -20.811 0.241 1.00 0.00 N ATOM 0 H ASN A 90 1.086 -21.270 -1.467 1.00 0.00 H new ATOM 0 HA ASN A 90 2.412 -23.589 -2.122 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.183 -22.272 0.604 1.00 0.00 H new ATOM 0 HB3 ASN A 90 3.358 -23.502 0.183 1.00 0.00 H new ATOM 0 HD21 ASN A 90 4.923 -20.099 -0.007 1.00 0.00 H new ATOM 0 HD22 ASN A 90 3.937 -20.916 1.210 1.00 0.00 H new ATOM 1113 N LEU A 91 0.028 -23.968 0.076 1.00 0.00 N ATOM 1114 CA LEU A 91 -0.815 -24.942 0.684 1.00 0.00 C ATOM 1115 C LEU A 91 -1.646 -25.648 -0.353 1.00 0.00 C ATOM 1116 O LEU A 91 -1.748 -26.849 -0.327 1.00 0.00 O ATOM 1117 CB LEU A 91 -1.686 -24.319 1.750 1.00 0.00 C ATOM 1118 CG LEU A 91 -0.961 -23.799 2.987 1.00 0.00 C ATOM 1119 CD1 LEU A 91 -1.912 -23.024 3.859 1.00 0.00 C ATOM 1120 CD2 LEU A 91 -0.373 -24.953 3.780 1.00 0.00 C ATOM 0 H LEU A 91 -0.220 -23.000 0.281 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.180 -25.683 1.169 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -2.238 -23.492 1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -2.421 -25.058 2.068 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.154 -23.142 2.661 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.383 -22.658 4.739 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.313 -22.179 3.299 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.730 -23.673 4.172 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.141 -24.565 4.660 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.173 -25.624 4.093 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.335 -25.499 3.157 1.00 0.00 H new ATOM 1132 N GLN A 92 -2.160 -24.910 -1.323 1.00 0.00 N ATOM 1133 CA GLN A 92 -3.019 -25.485 -2.376 1.00 0.00 C ATOM 1134 C GLN A 92 -2.285 -26.524 -3.216 1.00 0.00 C ATOM 1135 O GLN A 92 -2.885 -27.459 -3.728 1.00 0.00 O ATOM 1136 CB GLN A 92 -3.588 -24.397 -3.284 1.00 0.00 C ATOM 1137 CG GLN A 92 -4.817 -23.689 -2.766 1.00 0.00 C ATOM 1138 CD GLN A 92 -6.021 -24.600 -2.738 1.00 0.00 C ATOM 1139 OE1 GLN A 92 -6.115 -25.561 -3.508 1.00 0.00 O ATOM 1140 NE2 GLN A 92 -6.965 -24.289 -1.930 1.00 0.00 N ATOM 0 H GLN A 92 -2.004 -23.906 -1.414 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.840 -25.985 -1.863 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -2.811 -23.654 -3.461 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -3.828 -24.843 -4.249 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -4.623 -23.313 -1.762 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -5.030 -22.825 -3.395 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -6.859 -23.490 -1.305 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -7.823 -24.841 -1.911 1.00 0.00 H new ATOM 1149 N ARG A 93 -0.991 -26.379 -3.324 1.00 0.00 N ATOM 1150 CA ARG A 93 -0.191 -27.301 -4.102 1.00 0.00 C ATOM 1151 C ARG A 93 0.445 -28.361 -3.200 1.00 0.00 C ATOM 1152 O ARG A 93 1.288 -29.149 -3.622 1.00 0.00 O ATOM 1153 CB ARG A 93 0.819 -26.526 -4.964 1.00 0.00 C ATOM 1154 CG ARG A 93 1.778 -25.643 -4.196 1.00 0.00 C ATOM 1155 CD ARG A 93 3.016 -26.379 -3.727 1.00 0.00 C ATOM 1156 NE ARG A 93 3.772 -26.987 -4.842 1.00 0.00 N ATOM 1157 CZ ARG A 93 5.093 -26.834 -5.061 1.00 0.00 C ATOM 1158 NH1 ARG A 93 5.799 -25.959 -4.357 1.00 0.00 N ATOM 1159 NH2 ARG A 93 5.694 -27.534 -6.017 1.00 0.00 N ATOM 0 H ARG A 93 -0.461 -25.628 -2.882 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.828 -27.850 -4.796 1.00 0.00 H new ATOM 0 HB2 ARG A 93 1.398 -27.241 -5.548 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.268 -25.907 -5.672 1.00 0.00 H new ATOM 0 HG2 ARG A 93 2.077 -24.806 -4.827 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.263 -25.223 -3.332 1.00 0.00 H new ATOM 0 HD2 ARG A 93 3.664 -25.687 -3.189 1.00 0.00 H new ATOM 0 HD3 ARG A 93 2.726 -27.158 -3.022 1.00 0.00 H new ATOM 0 HE ARG A 93 3.252 -27.569 -5.499 1.00 0.00 H new ATOM 0 HH11 ARG A 93 5.343 -25.393 -3.641 1.00 0.00 H new ATOM 0 HH12 ARG A 93 6.798 -25.852 -4.531 1.00 0.00 H new ATOM 0 HH21 ARG A 93 5.156 -28.188 -6.586 1.00 0.00 H new ATOM 0 HH22 ARG A 93 6.694 -27.418 -6.182 1.00 0.00 H new ATOM 1173 N ALA A 94 0.008 -28.375 -1.958 1.00 0.00 N ATOM 1174 CA ALA A 94 0.414 -29.378 -0.982 1.00 0.00 C ATOM 1175 C ALA A 94 -0.640 -30.476 -0.973 1.00 0.00 C ATOM 1176 O ALA A 94 -0.645 -31.365 -0.126 1.00 0.00 O ATOM 1177 CB ALA A 94 0.506 -28.752 0.403 1.00 0.00 C ATOM 0 H ALA A 94 -0.646 -27.685 -1.589 1.00 0.00 H new ATOM 0 HA ALA A 94 1.391 -29.783 -1.246 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.810 -29.510 1.125 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.241 -27.947 0.390 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.467 -28.351 0.686 1.00 0.00 H new ATOM 1485 N GLU B 43 6.416 5.370 -1.823 1.00 0.00 N ATOM 1486 CA GLU B 43 5.411 4.721 -1.019 1.00 0.00 C ATOM 1487 C GLU B 43 4.093 4.615 -1.764 1.00 0.00 C ATOM 1488 O GLU B 43 3.254 3.793 -1.421 1.00 0.00 O ATOM 1489 CB GLU B 43 5.241 5.350 0.358 1.00 0.00 C ATOM 1490 CG GLU B 43 4.641 6.732 0.400 1.00 0.00 C ATOM 1491 CD GLU B 43 4.524 7.204 1.820 1.00 0.00 C ATOM 1492 OE1 GLU B 43 5.541 7.602 2.416 1.00 0.00 O ATOM 1493 OE2 GLU B 43 3.420 7.134 2.393 1.00 0.00 O ATOM 0 HA GLU B 43 5.772 3.709 -0.834 1.00 0.00 H new ATOM 0 HB2 GLU B 43 4.617 4.689 0.959 1.00 0.00 H new ATOM 0 HB3 GLU B 43 6.219 5.389 0.838 1.00 0.00 H new ATOM 0 HG2 GLU B 43 5.261 7.423 -0.171 1.00 0.00 H new ATOM 0 HG3 GLU B 43 3.658 6.724 -0.070 1.00 0.00 H new ATOM 1500 N LYS B 44 3.924 5.444 -2.791 1.00 0.00 N ATOM 1501 CA LYS B 44 2.775 5.342 -3.680 1.00 0.00 C ATOM 1502 C LYS B 44 2.889 4.050 -4.455 1.00 0.00 C ATOM 1503 O LYS B 44 1.912 3.335 -4.653 1.00 0.00 O ATOM 1504 CB LYS B 44 2.756 6.504 -4.652 1.00 0.00 C ATOM 1505 CG LYS B 44 1.556 6.512 -5.566 1.00 0.00 C ATOM 1506 CD LYS B 44 1.540 7.738 -6.434 1.00 0.00 C ATOM 1507 CE LYS B 44 2.691 7.747 -7.437 1.00 0.00 C ATOM 1508 NZ LYS B 44 2.684 8.965 -8.269 1.00 0.00 N ATOM 0 H LYS B 44 4.572 6.196 -3.027 1.00 0.00 H new ATOM 0 HA LYS B 44 1.857 5.362 -3.093 1.00 0.00 H new ATOM 0 HB2 LYS B 44 2.779 7.437 -4.089 1.00 0.00 H new ATOM 0 HB3 LYS B 44 3.662 6.475 -5.257 1.00 0.00 H new ATOM 0 HG2 LYS B 44 1.567 5.620 -6.193 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.643 6.472 -4.972 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.592 7.790 -6.970 1.00 0.00 H new ATOM 0 HD3 LYS B 44 1.600 8.627 -5.806 1.00 0.00 H new ATOM 0 HE2 LYS B 44 3.639 7.677 -6.903 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.621 6.868 -8.078 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.480 8.934 -8.937 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 1.790 9.019 -8.798 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.776 9.802 -7.659 1.00 0.00 H new ATOM 1522 N ARG B 45 4.110 3.749 -4.851 1.00 0.00 N ATOM 1523 CA ARG B 45 4.434 2.526 -5.568 1.00 0.00 C ATOM 1524 C ARG B 45 4.219 1.328 -4.659 1.00 0.00 C ATOM 1525 O ARG B 45 3.652 0.311 -5.070 1.00 0.00 O ATOM 1526 CB ARG B 45 5.869 2.590 -6.063 1.00 0.00 C ATOM 1527 CG ARG B 45 6.097 3.688 -7.089 1.00 0.00 C ATOM 1528 CD ARG B 45 7.569 3.907 -7.349 1.00 0.00 C ATOM 1529 NE ARG B 45 8.235 2.690 -7.798 1.00 0.00 N ATOM 1530 CZ ARG B 45 9.535 2.573 -8.040 1.00 0.00 C ATOM 1531 NH1 ARG B 45 10.339 3.625 -7.946 1.00 0.00 N ATOM 1532 NH2 ARG B 45 10.032 1.402 -8.381 1.00 0.00 N ATOM 0 H ARG B 45 4.916 4.352 -4.683 1.00 0.00 H new ATOM 0 HA ARG B 45 3.779 2.419 -6.433 1.00 0.00 H new ATOM 0 HB2 ARG B 45 6.533 2.751 -5.214 1.00 0.00 H new ATOM 0 HB3 ARG B 45 6.139 1.629 -6.502 1.00 0.00 H new ATOM 0 HG2 ARG B 45 5.597 3.425 -8.021 1.00 0.00 H new ATOM 0 HG3 ARG B 45 5.647 4.616 -6.736 1.00 0.00 H new ATOM 0 HD2 ARG B 45 7.692 4.685 -8.102 1.00 0.00 H new ATOM 0 HD3 ARG B 45 8.048 4.267 -6.438 1.00 0.00 H new ATOM 0 HE ARG B 45 7.656 1.862 -7.937 1.00 0.00 H new ATOM 0 HH11 ARG B 45 9.960 4.535 -7.685 1.00 0.00 H new ATOM 0 HH12 ARG B 45 11.336 3.523 -8.134 1.00 0.00 H new ATOM 0 HH21 ARG B 45 9.419 0.591 -8.458 1.00 0.00 H new ATOM 0 HH22 ARG B 45 11.030 1.307 -8.568 1.00 0.00 H new ATOM 1546 N ARG B 46 4.651 1.463 -3.414 1.00 0.00 N ATOM 1547 CA ARG B 46 4.405 0.448 -2.397 1.00 0.00 C ATOM 1548 C ARG B 46 2.909 0.231 -2.242 1.00 0.00 C ATOM 1549 O ARG B 46 2.433 -0.892 -2.261 1.00 0.00 O ATOM 1550 CB ARG B 46 4.976 0.878 -1.051 1.00 0.00 C ATOM 1551 CG ARG B 46 4.613 -0.070 0.079 1.00 0.00 C ATOM 1552 CD ARG B 46 5.045 0.463 1.420 1.00 0.00 C ATOM 1553 NE ARG B 46 4.452 1.772 1.750 1.00 0.00 N ATOM 1554 CZ ARG B 46 4.746 2.482 2.859 1.00 0.00 C ATOM 1555 NH1 ARG B 46 5.611 2.016 3.761 1.00 0.00 N ATOM 1556 NH2 ARG B 46 4.172 3.658 3.058 1.00 0.00 N ATOM 0 H ARG B 46 5.177 2.271 -3.081 1.00 0.00 H new ATOM 0 HA ARG B 46 4.892 -0.474 -2.714 1.00 0.00 H new ATOM 0 HB2 ARG B 46 6.061 0.944 -1.128 1.00 0.00 H new ATOM 0 HB3 ARG B 46 4.612 1.877 -0.811 1.00 0.00 H new ATOM 0 HG2 ARG B 46 3.535 -0.234 0.083 1.00 0.00 H new ATOM 0 HG3 ARG B 46 5.082 -1.039 -0.095 1.00 0.00 H new ATOM 0 HD2 ARG B 46 4.773 -0.256 2.193 1.00 0.00 H new ATOM 0 HD3 ARG B 46 6.131 0.551 1.435 1.00 0.00 H new ATOM 0 HE ARG B 46 3.775 2.167 1.097 1.00 0.00 H new ATOM 0 HH11 ARG B 46 6.060 1.112 3.617 1.00 0.00 H new ATOM 0 HH12 ARG B 46 5.823 2.564 4.595 1.00 0.00 H new ATOM 0 HH21 ARG B 46 3.510 4.025 2.374 1.00 0.00 H new ATOM 0 HH22 ARG B 46 4.392 4.198 3.895 1.00 0.00 H new ATOM 1570 N ARG B 47 2.193 1.325 -2.057 1.00 0.00 N ATOM 1571 CA ARG B 47 0.749 1.320 -1.929 1.00 0.00 C ATOM 1572 C ARG B 47 0.073 0.666 -3.136 1.00 0.00 C ATOM 1573 O ARG B 47 -0.902 -0.066 -2.979 1.00 0.00 O ATOM 1574 CB ARG B 47 0.208 2.733 -1.660 1.00 0.00 C ATOM 1575 CG ARG B 47 -1.302 2.822 -1.522 1.00 0.00 C ATOM 1576 CD ARG B 47 -1.748 4.219 -1.118 1.00 0.00 C ATOM 1577 NE ARG B 47 -3.211 4.350 -1.182 1.00 0.00 N ATOM 1578 CZ ARG B 47 -3.980 5.102 -0.387 1.00 0.00 C ATOM 1579 NH1 ARG B 47 -3.436 5.854 0.570 1.00 0.00 N ATOM 1580 NH2 ARG B 47 -5.304 5.109 -0.570 1.00 0.00 N ATOM 0 H ARG B 47 2.606 2.255 -1.991 1.00 0.00 H new ATOM 0 HA ARG B 47 0.499 0.708 -1.062 1.00 0.00 H new ATOM 0 HB2 ARG B 47 0.665 3.114 -0.747 1.00 0.00 H new ATOM 0 HB3 ARG B 47 0.524 3.388 -2.472 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -1.771 2.549 -2.468 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -1.643 2.102 -0.778 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -1.405 4.435 -0.106 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -1.285 4.955 -1.775 1.00 0.00 H new ATOM 0 HE ARG B 47 -3.688 3.813 -1.906 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -2.424 5.859 0.701 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -4.031 6.424 1.171 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -5.719 4.544 -1.311 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -5.899 5.679 0.031 1.00 0.00 H new ATOM 1594 N ALA B 48 0.614 0.900 -4.321 1.00 0.00 N ATOM 1595 CA ALA B 48 0.133 0.264 -5.527 1.00 0.00 C ATOM 1596 C ALA B 48 0.260 -1.236 -5.372 1.00 0.00 C ATOM 1597 O ALA B 48 -0.680 -1.967 -5.610 1.00 0.00 O ATOM 1598 CB ALA B 48 0.927 0.733 -6.731 1.00 0.00 C ATOM 0 H ALA B 48 1.398 1.536 -4.469 1.00 0.00 H new ATOM 0 HA ALA B 48 -0.911 0.533 -5.685 1.00 0.00 H new ATOM 0 HB1 ALA B 48 0.550 0.243 -7.629 1.00 0.00 H new ATOM 0 HB2 ALA B 48 0.824 1.813 -6.837 1.00 0.00 H new ATOM 0 HB3 ALA B 48 1.978 0.480 -6.594 1.00 0.00 H new ATOM 1604 N ARG B 49 1.416 -1.670 -4.891 1.00 0.00 N ATOM 1605 CA ARG B 49 1.678 -3.083 -4.658 1.00 0.00 C ATOM 1606 C ARG B 49 0.776 -3.640 -3.576 1.00 0.00 C ATOM 1607 O ARG B 49 0.403 -4.794 -3.632 1.00 0.00 O ATOM 1608 CB ARG B 49 3.163 -3.360 -4.361 1.00 0.00 C ATOM 1609 CG ARG B 49 4.039 -3.547 -5.602 1.00 0.00 C ATOM 1610 CD ARG B 49 3.936 -2.386 -6.576 1.00 0.00 C ATOM 1611 NE ARG B 49 4.733 -2.609 -7.778 1.00 0.00 N ATOM 1612 CZ ARG B 49 4.345 -2.323 -9.031 1.00 0.00 C ATOM 1613 NH1 ARG B 49 3.107 -1.878 -9.280 1.00 0.00 N ATOM 1614 NH2 ARG B 49 5.190 -2.505 -10.028 1.00 0.00 N ATOM 0 H ARG B 49 2.195 -1.056 -4.652 1.00 0.00 H new ATOM 0 HA ARG B 49 1.443 -3.607 -5.584 1.00 0.00 H new ATOM 0 HB2 ARG B 49 3.562 -2.534 -3.772 1.00 0.00 H new ATOM 0 HB3 ARG B 49 3.235 -4.255 -3.744 1.00 0.00 H new ATOM 0 HG2 ARG B 49 5.078 -3.665 -5.293 1.00 0.00 H new ATOM 0 HG3 ARG B 49 3.750 -4.468 -6.109 1.00 0.00 H new ATOM 0 HD2 ARG B 49 2.893 -2.238 -6.855 1.00 0.00 H new ATOM 0 HD3 ARG B 49 4.268 -1.471 -6.086 1.00 0.00 H new ATOM 0 HE ARG B 49 5.661 -3.015 -7.656 1.00 0.00 H new ATOM 0 HH11 ARG B 49 2.446 -1.753 -8.513 1.00 0.00 H new ATOM 0 HH12 ARG B 49 2.825 -1.664 -10.237 1.00 0.00 H new ATOM 0 HH21 ARG B 49 6.128 -2.860 -9.843 1.00 0.00 H new ATOM 0 HH22 ARG B 49 4.905 -2.291 -10.984 1.00 0.00 H new ATOM 1628 N ILE B 50 0.426 -2.814 -2.595 1.00 0.00 N ATOM 1629 CA ILE B 50 -0.537 -3.192 -1.573 1.00 0.00 C ATOM 1630 C ILE B 50 -1.868 -3.548 -2.240 1.00 0.00 C ATOM 1631 O ILE B 50 -2.396 -4.645 -2.070 1.00 0.00 O ATOM 1632 CB ILE B 50 -0.749 -2.021 -0.577 1.00 0.00 C ATOM 1633 CG1 ILE B 50 0.555 -1.738 0.181 1.00 0.00 C ATOM 1634 CG2 ILE B 50 -1.923 -2.277 0.369 1.00 0.00 C ATOM 1635 CD1 ILE B 50 0.497 -0.557 1.113 1.00 0.00 C ATOM 0 H ILE B 50 0.800 -1.871 -2.488 1.00 0.00 H new ATOM 0 HA ILE B 50 -0.158 -4.055 -1.025 1.00 0.00 H new ATOM 0 HB ILE B 50 -1.013 -1.130 -1.146 1.00 0.00 H new ATOM 0 HG12 ILE B 50 0.825 -2.624 0.756 1.00 0.00 H new ATOM 0 HG13 ILE B 50 1.352 -1.573 -0.544 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -2.034 -1.432 1.048 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -2.838 -2.399 -0.211 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -1.735 -3.183 0.945 1.00 0.00 H new ATOM 0 HD11 ILE B 50 1.462 -0.434 1.604 1.00 0.00 H new ATOM 0 HD12 ILE B 50 0.261 0.343 0.545 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -0.274 -0.724 1.865 1.00 0.00 H new ATOM 1647 N ASN B 51 -2.346 -2.634 -3.055 1.00 0.00 N ATOM 1648 CA ASN B 51 -3.615 -2.781 -3.765 1.00 0.00 C ATOM 1649 C ASN B 51 -3.571 -3.976 -4.680 1.00 0.00 C ATOM 1650 O ASN B 51 -4.487 -4.802 -4.692 1.00 0.00 O ATOM 1651 CB ASN B 51 -3.910 -1.518 -4.575 1.00 0.00 C ATOM 1652 CG ASN B 51 -4.049 -0.298 -3.700 1.00 0.00 C ATOM 1653 OD1 ASN B 51 -4.536 -0.370 -2.571 1.00 0.00 O ATOM 1654 ND2 ASN B 51 -3.589 0.815 -4.171 1.00 0.00 N ATOM 0 H ASN B 51 -1.866 -1.756 -3.251 1.00 0.00 H new ATOM 0 HA ASN B 51 -4.408 -2.931 -3.032 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -3.109 -1.356 -5.296 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -4.828 -1.660 -5.145 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -3.624 1.662 -3.604 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -3.191 0.846 -5.110 1.00 0.00 H new ATOM 1661 N GLU B 52 -2.491 -4.088 -5.418 1.00 0.00 N ATOM 1662 CA GLU B 52 -2.305 -5.196 -6.345 1.00 0.00 C ATOM 1663 C GLU B 52 -2.204 -6.547 -5.617 1.00 0.00 C ATOM 1664 O GLU B 52 -2.680 -7.564 -6.119 1.00 0.00 O ATOM 1665 CB GLU B 52 -1.085 -4.988 -7.251 1.00 0.00 C ATOM 1666 CG GLU B 52 -1.106 -3.691 -8.059 1.00 0.00 C ATOM 1667 CD GLU B 52 -2.411 -3.461 -8.788 1.00 0.00 C ATOM 1668 OE1 GLU B 52 -2.794 -4.290 -9.643 1.00 0.00 O ATOM 1669 OE2 GLU B 52 -3.086 -2.447 -8.511 1.00 0.00 O ATOM 0 H GLU B 52 -1.718 -3.423 -5.398 1.00 0.00 H new ATOM 0 HA GLU B 52 -3.195 -5.218 -6.975 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -0.185 -5.003 -6.636 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -1.013 -5.829 -7.941 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -0.919 -2.851 -7.390 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -0.292 -3.709 -8.783 1.00 0.00 H new ATOM 1676 N SER B 53 -1.607 -6.563 -4.439 1.00 0.00 N ATOM 1677 CA SER B 53 -1.469 -7.798 -3.703 1.00 0.00 C ATOM 1678 C SER B 53 -2.785 -8.192 -3.033 1.00 0.00 C ATOM 1679 O SER B 53 -3.096 -9.363 -2.927 1.00 0.00 O ATOM 1680 CB SER B 53 -0.323 -7.711 -2.691 1.00 0.00 C ATOM 1681 OG SER B 53 0.899 -7.380 -3.350 1.00 0.00 O ATOM 0 H SER B 53 -1.215 -5.742 -3.978 1.00 0.00 H new ATOM 0 HA SER B 53 -1.218 -8.586 -4.413 1.00 0.00 H new ATOM 0 HB2 SER B 53 -0.552 -6.958 -1.937 1.00 0.00 H new ATOM 0 HB3 SER B 53 -0.216 -8.662 -2.170 1.00 0.00 H new ATOM 0 HG SER B 53 0.848 -6.464 -3.693 1.00 0.00 H new ATOM 1687 N LEU B 54 -3.572 -7.203 -2.632 1.00 0.00 N ATOM 1688 CA LEU B 54 -4.831 -7.444 -1.961 1.00 0.00 C ATOM 1689 C LEU B 54 -5.874 -7.904 -2.984 1.00 0.00 C ATOM 1690 O LEU B 54 -6.713 -8.760 -2.707 1.00 0.00 O ATOM 1691 CB LEU B 54 -5.271 -6.139 -1.284 1.00 0.00 C ATOM 1692 CG LEU B 54 -6.122 -6.254 -0.016 1.00 0.00 C ATOM 1693 CD1 LEU B 54 -6.236 -4.899 0.639 1.00 0.00 C ATOM 1694 CD2 LEU B 54 -7.513 -6.806 -0.292 1.00 0.00 C ATOM 0 H LEU B 54 -3.352 -6.216 -2.765 1.00 0.00 H new ATOM 0 HA LEU B 54 -4.725 -8.225 -1.208 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -4.375 -5.569 -1.038 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -5.831 -5.554 -2.013 1.00 0.00 H new ATOM 0 HG LEU B 54 -5.621 -6.958 0.648 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -6.842 -4.981 1.541 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -5.242 -4.537 0.901 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -6.707 -4.199 -0.052 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -8.072 -6.866 0.642 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -8.035 -6.147 -0.986 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -7.429 -7.801 -0.730 1.00 0.00 H new ATOM 1706 N SER B 55 -5.791 -7.362 -4.166 1.00 0.00 N ATOM 1707 CA SER B 55 -6.729 -7.683 -5.198 1.00 0.00 C ATOM 1708 C SER B 55 -6.525 -9.112 -5.735 1.00 0.00 C ATOM 1709 O SER B 55 -7.497 -9.853 -5.927 1.00 0.00 O ATOM 1710 CB SER B 55 -6.682 -6.620 -6.282 1.00 0.00 C ATOM 1711 OG SER B 55 -5.361 -6.430 -6.751 1.00 0.00 O ATOM 0 H SER B 55 -5.074 -6.689 -4.438 1.00 0.00 H new ATOM 0 HA SER B 55 -7.735 -7.678 -4.779 1.00 0.00 H new ATOM 0 HB2 SER B 55 -7.327 -6.912 -7.111 1.00 0.00 H new ATOM 0 HB3 SER B 55 -7.071 -5.680 -5.891 1.00 0.00 H new ATOM 0 HG SER B 55 -4.892 -5.802 -6.162 1.00 0.00 H new ATOM 1717 N GLN B 56 -5.266 -9.522 -5.934 1.00 0.00 N ATOM 1718 CA GLN B 56 -4.983 -10.897 -6.369 1.00 0.00 C ATOM 1719 C GLN B 56 -5.370 -11.866 -5.245 1.00 0.00 C ATOM 1720 O GLN B 56 -5.860 -12.960 -5.490 1.00 0.00 O ATOM 1721 CB GLN B 56 -3.505 -11.063 -6.775 1.00 0.00 C ATOM 1722 CG GLN B 56 -2.517 -10.825 -5.654 1.00 0.00 C ATOM 1723 CD GLN B 56 -1.085 -10.794 -6.114 1.00 0.00 C ATOM 1724 OE1 GLN B 56 -0.396 -11.816 -6.144 1.00 0.00 O ATOM 1725 NE2 GLN B 56 -0.627 -9.631 -6.480 1.00 0.00 N ATOM 0 H GLN B 56 -4.442 -8.936 -5.804 1.00 0.00 H new ATOM 0 HA GLN B 56 -5.577 -11.124 -7.254 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -3.359 -12.071 -7.164 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -3.285 -10.373 -7.589 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -2.754 -9.880 -5.166 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -2.633 -11.609 -4.905 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -1.230 -8.810 -6.440 1.00 0.00 H new ATOM 0 HE22 GLN B 56 0.335 -9.542 -6.807 1.00 0.00 H new ATOM 1734 N LEU B 57 -5.196 -11.399 -4.021 1.00 0.00 N ATOM 1735 CA LEU B 57 -5.562 -12.111 -2.812 1.00 0.00 C ATOM 1736 C LEU B 57 -7.061 -12.419 -2.846 1.00 0.00 C ATOM 1737 O LEU B 57 -7.462 -13.581 -2.808 1.00 0.00 O ATOM 1738 CB LEU B 57 -5.133 -11.217 -1.622 1.00 0.00 C ATOM 1739 CG LEU B 57 -5.462 -11.624 -0.196 1.00 0.00 C ATOM 1740 CD1 LEU B 57 -4.402 -11.062 0.742 1.00 0.00 C ATOM 1741 CD2 LEU B 57 -6.786 -11.025 0.193 1.00 0.00 C ATOM 0 H LEU B 57 -4.783 -10.485 -3.837 1.00 0.00 H new ATOM 0 HA LEU B 57 -5.062 -13.075 -2.714 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -4.051 -11.099 -1.682 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -5.571 -10.232 -1.785 1.00 0.00 H new ATOM 0 HG LEU B 57 -5.496 -12.711 -0.128 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -4.633 -11.351 1.767 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -3.425 -11.457 0.465 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -4.388 -9.975 0.666 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -7.029 -11.313 1.216 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -6.728 -9.939 0.126 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -7.562 -11.389 -0.480 1.00 0.00 H new ATOM 1753 N LYS B 58 -7.858 -11.368 -2.998 1.00 0.00 N ATOM 1754 CA LYS B 58 -9.320 -11.456 -3.146 1.00 0.00 C ATOM 1755 C LYS B 58 -9.691 -12.444 -4.267 1.00 0.00 C ATOM 1756 O LYS B 58 -10.598 -13.277 -4.114 1.00 0.00 O ATOM 1757 CB LYS B 58 -9.872 -10.061 -3.514 1.00 0.00 C ATOM 1758 CG LYS B 58 -11.397 -9.986 -3.660 1.00 0.00 C ATOM 1759 CD LYS B 58 -11.858 -8.635 -4.231 1.00 0.00 C ATOM 1760 CE LYS B 58 -11.339 -8.425 -5.656 1.00 0.00 C ATOM 1761 NZ LYS B 58 -11.855 -7.187 -6.289 1.00 0.00 N ATOM 0 H LYS B 58 -7.508 -10.410 -3.023 1.00 0.00 H new ATOM 0 HA LYS B 58 -9.749 -11.805 -2.206 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -9.560 -9.350 -2.749 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -9.416 -9.742 -4.451 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -11.738 -10.790 -4.312 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -11.862 -10.146 -2.687 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -12.947 -8.590 -4.228 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -11.504 -7.827 -3.590 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -10.250 -8.389 -5.637 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -11.619 -9.282 -6.268 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -11.403 -7.057 -7.217 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -12.885 -7.264 -6.413 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -11.639 -6.371 -5.682 1.00 0.00 H new ATOM 1775 N THR B 59 -8.957 -12.357 -5.361 1.00 0.00 N ATOM 1776 CA THR B 59 -9.198 -13.163 -6.539 1.00 0.00 C ATOM 1777 C THR B 59 -9.000 -14.659 -6.251 1.00 0.00 C ATOM 1778 O THR B 59 -9.928 -15.459 -6.438 1.00 0.00 O ATOM 1779 CB THR B 59 -8.281 -12.713 -7.698 1.00 0.00 C ATOM 1780 OG1 THR B 59 -8.481 -11.305 -7.922 1.00 0.00 O ATOM 1781 CG2 THR B 59 -8.607 -13.468 -8.983 1.00 0.00 C ATOM 0 H THR B 59 -8.168 -11.717 -5.456 1.00 0.00 H new ATOM 0 HA THR B 59 -10.237 -13.016 -6.833 1.00 0.00 H new ATOM 0 HB THR B 59 -7.246 -12.923 -7.427 1.00 0.00 H new ATOM 0 HG1 THR B 59 -7.825 -10.795 -7.403 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.946 -13.130 -9.781 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.466 -14.537 -8.823 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.643 -13.277 -9.265 1.00 0.00 H new ATOM 1789 N LEU B 60 -7.823 -15.025 -5.747 1.00 0.00 N ATOM 1790 CA LEU B 60 -7.516 -16.422 -5.480 1.00 0.00 C ATOM 1791 C LEU B 60 -8.343 -16.980 -4.331 1.00 0.00 C ATOM 1792 O LEU B 60 -8.661 -18.166 -4.320 1.00 0.00 O ATOM 1793 CB LEU B 60 -6.001 -16.690 -5.284 1.00 0.00 C ATOM 1794 CG LEU B 60 -5.102 -16.721 -6.559 1.00 0.00 C ATOM 1795 CD1 LEU B 60 -5.610 -17.733 -7.570 1.00 0.00 C ATOM 1796 CD2 LEU B 60 -4.946 -15.356 -7.206 1.00 0.00 C ATOM 0 H LEU B 60 -7.072 -14.374 -5.517 1.00 0.00 H new ATOM 0 HA LEU B 60 -7.803 -16.965 -6.381 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -5.608 -15.925 -4.615 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -5.892 -17.647 -4.773 1.00 0.00 H new ATOM 0 HG LEU B 60 -4.112 -17.030 -6.222 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -4.961 -17.729 -8.446 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -5.609 -18.727 -7.122 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -6.625 -17.471 -7.869 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -4.311 -15.442 -8.087 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -5.925 -14.979 -7.500 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -4.490 -14.667 -6.496 1.00 0.00 H new ATOM 1808 N ILE B 61 -8.706 -16.128 -3.387 1.00 0.00 N ATOM 1809 CA ILE B 61 -9.582 -16.529 -2.294 1.00 0.00 C ATOM 1810 C ILE B 61 -10.964 -16.902 -2.827 1.00 0.00 C ATOM 1811 O ILE B 61 -11.455 -18.001 -2.594 1.00 0.00 O ATOM 1812 CB ILE B 61 -9.670 -15.434 -1.186 1.00 0.00 C ATOM 1813 CG1 ILE B 61 -8.358 -15.378 -0.403 1.00 0.00 C ATOM 1814 CG2 ILE B 61 -10.853 -15.651 -0.242 1.00 0.00 C ATOM 1815 CD1 ILE B 61 -8.022 -16.660 0.345 1.00 0.00 C ATOM 0 H ILE B 61 -8.408 -15.153 -3.354 1.00 0.00 H new ATOM 0 HA ILE B 61 -9.148 -17.412 -1.825 1.00 0.00 H new ATOM 0 HB ILE B 61 -9.837 -14.478 -1.683 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.546 -15.150 -1.093 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -8.409 -14.557 0.312 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.868 -14.862 0.510 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.782 -15.627 -0.812 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.753 -16.619 0.250 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -7.077 -16.536 0.874 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.813 -16.881 1.062 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.936 -17.483 -0.364 1.00 0.00 H new ATOM 1827 N LEU B 62 -11.560 -16.034 -3.596 1.00 0.00 N ATOM 1828 CA LEU B 62 -12.868 -16.324 -4.175 1.00 0.00 C ATOM 1829 C LEU B 62 -12.804 -17.466 -5.181 1.00 0.00 C ATOM 1830 O LEU B 62 -13.799 -18.061 -5.501 1.00 0.00 O ATOM 1831 CB LEU B 62 -13.530 -15.083 -4.775 1.00 0.00 C ATOM 1832 CG LEU B 62 -14.513 -14.319 -3.866 1.00 0.00 C ATOM 1833 CD1 LEU B 62 -15.768 -15.146 -3.630 1.00 0.00 C ATOM 1834 CD2 LEU B 62 -13.874 -13.990 -2.536 1.00 0.00 C ATOM 0 H LEU B 62 -11.175 -15.122 -3.843 1.00 0.00 H new ATOM 0 HA LEU B 62 -13.502 -16.651 -3.351 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -12.745 -14.393 -5.084 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -14.063 -15.383 -5.677 1.00 0.00 H new ATOM 0 HG LEU B 62 -14.779 -13.390 -4.370 1.00 0.00 H new ATOM 0 HD11 LEU B 62 -16.452 -14.593 -2.986 1.00 0.00 H new ATOM 0 HD12 LEU B 62 -16.253 -15.351 -4.584 1.00 0.00 H new ATOM 0 HD13 LEU B 62 -15.499 -16.087 -3.150 1.00 0.00 H new ATOM 0 HD21 LEU B 62 -14.588 -13.451 -1.913 1.00 0.00 H new ATOM 0 HD22 LEU B 62 -13.580 -14.913 -2.036 1.00 0.00 H new ATOM 0 HD23 LEU B 62 -12.993 -13.369 -2.699 1.00 0.00 H new ATOM 1846 N ASP B 63 -11.633 -17.742 -5.675 1.00 0.00 N ATOM 1847 CA ASP B 63 -11.410 -18.836 -6.617 1.00 0.00 C ATOM 1848 C ASP B 63 -11.259 -20.162 -5.897 1.00 0.00 C ATOM 1849 O ASP B 63 -11.628 -21.199 -6.408 1.00 0.00 O ATOM 1850 CB ASP B 63 -10.144 -18.578 -7.346 1.00 0.00 C ATOM 1851 CG ASP B 63 -9.849 -19.585 -8.432 1.00 0.00 C ATOM 1852 OD1 ASP B 63 -10.394 -19.445 -9.550 1.00 0.00 O ATOM 1853 OD2 ASP B 63 -9.036 -20.520 -8.192 1.00 0.00 O ATOM 0 H ASP B 63 -10.789 -17.219 -5.443 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.266 -18.888 -7.289 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -10.187 -17.583 -7.788 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -9.319 -18.575 -6.633 1.00 0.00 H new ATOM 1858 N ALA B 64 -10.668 -20.121 -4.739 1.00 0.00 N ATOM 1859 CA ALA B 64 -10.441 -21.308 -3.959 1.00 0.00 C ATOM 1860 C ALA B 64 -11.674 -21.659 -3.164 1.00 0.00 C ATOM 1861 O ALA B 64 -12.025 -22.826 -3.029 1.00 0.00 O ATOM 1862 CB ALA B 64 -9.244 -21.114 -3.045 1.00 0.00 C ATOM 0 H ALA B 64 -10.328 -19.263 -4.305 1.00 0.00 H new ATOM 0 HA ALA B 64 -10.226 -22.137 -4.634 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -9.082 -22.019 -2.460 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -8.358 -20.907 -3.645 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.431 -20.276 -2.373 1.00 0.00 H new ATOM 1868 N LEU B 65 -12.362 -20.654 -2.664 1.00 0.00 N ATOM 1869 CA LEU B 65 -13.539 -20.934 -1.851 1.00 0.00 C ATOM 1870 C LEU B 65 -14.786 -20.908 -2.695 1.00 0.00 C ATOM 1871 O LEU B 65 -15.697 -21.675 -2.449 1.00 0.00 O ATOM 1872 CB LEU B 65 -13.702 -20.022 -0.596 1.00 0.00 C ATOM 1873 CG LEU B 65 -12.613 -20.091 0.493 1.00 0.00 C ATOM 1874 CD1 LEU B 65 -11.334 -19.465 0.027 1.00 0.00 C ATOM 1875 CD2 LEU B 65 -13.086 -19.427 1.774 1.00 0.00 C ATOM 0 H LEU B 65 -12.142 -19.667 -2.796 1.00 0.00 H new ATOM 0 HA LEU B 65 -13.381 -21.937 -1.455 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -13.767 -18.989 -0.939 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -14.657 -20.263 -0.129 1.00 0.00 H new ATOM 0 HG LEU B 65 -12.421 -21.144 0.696 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -10.587 -19.530 0.818 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -10.973 -19.990 -0.857 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -11.510 -18.418 -0.220 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -12.300 -19.488 2.527 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -13.319 -18.381 1.577 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -13.979 -19.935 2.139 1.00 0.00 H new ATOM 1887 N LYS B 66 -14.789 -20.038 -3.715 1.00 0.00 N ATOM 1888 CA LYS B 66 -15.917 -19.874 -4.656 1.00 0.00 C ATOM 1889 C LYS B 66 -17.229 -19.704 -3.958 1.00 0.00 C ATOM 1890 O LYS B 66 -18.092 -20.585 -3.945 1.00 0.00 O ATOM 1891 CB LYS B 66 -15.939 -20.979 -5.701 1.00 0.00 C ATOM 1892 CG LYS B 66 -14.776 -20.905 -6.684 1.00 0.00 C ATOM 1893 CD LYS B 66 -14.500 -22.243 -7.335 1.00 0.00 C ATOM 1894 CE LYS B 66 -13.915 -23.217 -6.320 1.00 0.00 C ATOM 1895 NZ LYS B 66 -13.505 -24.487 -6.948 1.00 0.00 N ATOM 0 H LYS B 66 -14.003 -19.420 -3.916 1.00 0.00 H new ATOM 0 HA LYS B 66 -15.751 -18.940 -5.193 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -15.919 -21.946 -5.198 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -16.877 -20.927 -6.254 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -14.998 -20.166 -7.454 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -13.882 -20.564 -6.163 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -15.422 -22.650 -7.749 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -13.807 -22.114 -8.166 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -13.055 -22.759 -5.832 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -14.653 -23.418 -5.543 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -13.112 -25.122 -6.224 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -14.331 -24.937 -7.392 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -12.782 -24.299 -7.672 1.00 0.00 H new ATOM 1909 N LYS B 67 -17.330 -18.598 -3.315 1.00 0.00 N ATOM 1910 CA LYS B 67 -18.521 -18.248 -2.608 1.00 0.00 C ATOM 1911 C LYS B 67 -19.526 -17.654 -3.543 1.00 0.00 C ATOM 1912 O LYS B 67 -20.432 -18.340 -4.008 1.00 0.00 O ATOM 1913 CB LYS B 67 -18.217 -17.289 -1.480 1.00 0.00 C ATOM 1914 CG LYS B 67 -17.331 -17.884 -0.429 1.00 0.00 C ATOM 1915 CD LYS B 67 -17.039 -16.904 0.669 1.00 0.00 C ATOM 1916 CE LYS B 67 -16.250 -17.570 1.764 1.00 0.00 C ATOM 1917 NZ LYS B 67 -17.024 -18.652 2.435 1.00 0.00 N ATOM 0 H LYS B 67 -16.587 -17.901 -3.260 1.00 0.00 H new ATOM 0 HA LYS B 67 -18.940 -19.157 -2.176 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -17.740 -16.397 -1.887 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -19.152 -16.969 -1.021 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -17.808 -18.770 -0.009 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -16.396 -18.211 -0.884 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -16.480 -16.057 0.271 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -17.972 -16.509 1.072 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -15.333 -17.986 1.347 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -15.955 -16.824 2.503 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -16.608 -18.850 3.367 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -18.012 -18.349 2.554 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -16.994 -19.513 1.853 1.00 0.00 H new ATOM 1931 N ASP B 68 -19.335 -16.394 -3.872 1.00 0.00 N ATOM 1932 CA ASP B 68 -20.261 -15.679 -4.714 1.00 0.00 C ATOM 1933 C ASP B 68 -19.524 -14.596 -5.429 1.00 0.00 C ATOM 1934 O ASP B 68 -18.640 -13.959 -4.855 1.00 0.00 O ATOM 1935 CB ASP B 68 -21.396 -15.018 -3.905 1.00 0.00 C ATOM 1936 CG ASP B 68 -22.318 -15.955 -3.165 1.00 0.00 C ATOM 1937 OD1 ASP B 68 -23.322 -16.386 -3.733 1.00 0.00 O ATOM 1938 OD2 ASP B 68 -22.058 -16.244 -1.968 1.00 0.00 O ATOM 0 H ASP B 68 -18.535 -15.841 -3.563 1.00 0.00 H new ATOM 0 HA ASP B 68 -20.700 -16.400 -5.404 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -20.949 -14.335 -3.182 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -21.996 -14.414 -4.586 1.00 0.00 H new ATOM 1943 N SER B 69 -19.885 -14.364 -6.642 1.00 0.00 N ATOM 1944 CA SER B 69 -19.268 -13.351 -7.430 1.00 0.00 C ATOM 1945 C SER B 69 -19.936 -11.984 -7.217 1.00 0.00 C ATOM 1946 O SER B 69 -19.374 -10.944 -7.558 1.00 0.00 O ATOM 1947 CB SER B 69 -19.285 -13.785 -8.883 1.00 0.00 C ATOM 1948 OG SER B 69 -20.599 -14.165 -9.277 1.00 0.00 O ATOM 0 H SER B 69 -20.625 -14.877 -7.122 1.00 0.00 H new ATOM 0 HA SER B 69 -18.232 -13.224 -7.116 1.00 0.00 H new ATOM 0 HB2 SER B 69 -18.931 -12.971 -9.515 1.00 0.00 H new ATOM 0 HB3 SER B 69 -18.600 -14.621 -9.027 1.00 0.00 H new ATOM 0 HG SER B 69 -20.592 -14.440 -10.217 1.00 0.00 H new ATOM 1954 N SER B 70 -21.128 -11.992 -6.644 1.00 0.00 N ATOM 1955 CA SER B 70 -21.840 -10.766 -6.362 1.00 0.00 C ATOM 1956 C SER B 70 -21.297 -10.103 -5.089 1.00 0.00 C ATOM 1957 O SER B 70 -21.288 -8.874 -4.982 1.00 0.00 O ATOM 1958 CB SER B 70 -23.354 -11.035 -6.261 1.00 0.00 C ATOM 1959 OG SER B 70 -24.108 -9.837 -6.046 1.00 0.00 O ATOM 0 H SER B 70 -21.621 -12.840 -6.366 1.00 0.00 H new ATOM 0 HA SER B 70 -21.680 -10.071 -7.186 1.00 0.00 H new ATOM 0 HB2 SER B 70 -23.696 -11.517 -7.177 1.00 0.00 H new ATOM 0 HB3 SER B 70 -23.543 -11.731 -5.444 1.00 0.00 H new ATOM 0 HG SER B 70 -25.062 -10.056 -5.990 1.00 0.00 H new ATOM 1965 N ARG B 71 -20.845 -10.917 -4.132 1.00 0.00 N ATOM 1966 CA ARG B 71 -20.251 -10.386 -2.910 1.00 0.00 C ATOM 1967 C ARG B 71 -18.855 -9.877 -3.239 1.00 0.00 C ATOM 1968 O ARG B 71 -18.396 -8.894 -2.686 1.00 0.00 O ATOM 1969 CB ARG B 71 -20.166 -11.460 -1.825 1.00 0.00 C ATOM 1970 CG ARG B 71 -19.218 -12.564 -2.171 1.00 0.00 C ATOM 1971 CD ARG B 71 -18.980 -13.493 -1.056 1.00 0.00 C ATOM 1972 NE ARG B 71 -20.141 -14.337 -0.707 1.00 0.00 N ATOM 1973 CZ ARG B 71 -20.357 -14.882 0.501 1.00 0.00 C ATOM 1974 NH1 ARG B 71 -19.741 -14.404 1.570 1.00 0.00 N ATOM 1975 NH2 ARG B 71 -21.262 -15.835 0.636 1.00 0.00 N ATOM 0 H ARG B 71 -20.880 -11.935 -4.181 1.00 0.00 H new ATOM 0 HA ARG B 71 -20.876 -9.578 -2.530 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -19.852 -10.999 -0.888 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -21.158 -11.879 -1.657 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -19.613 -13.120 -3.021 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -18.268 -12.133 -2.486 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -18.140 -14.139 -1.310 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -18.686 -12.919 -0.177 1.00 0.00 H new ATOM 0 HE ARG B 71 -20.829 -14.519 -1.437 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -19.098 -13.617 1.479 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -19.909 -14.822 2.485 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -21.792 -16.153 -0.175 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -21.430 -16.253 1.551 1.00 0.00 H new ATOM 1989 N HIS B 72 -18.186 -10.609 -4.129 1.00 0.00 N ATOM 1990 CA HIS B 72 -16.880 -10.272 -4.653 1.00 0.00 C ATOM 1991 C HIS B 72 -16.866 -8.801 -5.117 1.00 0.00 C ATOM 1992 O HIS B 72 -17.751 -8.360 -5.848 1.00 0.00 O ATOM 1993 CB HIS B 72 -16.562 -11.235 -5.819 1.00 0.00 C ATOM 1994 CG HIS B 72 -15.140 -11.225 -6.323 1.00 0.00 C ATOM 1995 ND1 HIS B 72 -14.437 -12.365 -6.626 1.00 0.00 N ATOM 1996 CD2 HIS B 72 -14.303 -10.199 -6.596 1.00 0.00 C ATOM 1997 CE1 HIS B 72 -13.223 -12.008 -7.049 1.00 0.00 C ATOM 1998 NE2 HIS B 72 -13.093 -10.700 -7.052 1.00 0.00 N ATOM 0 H HIS B 72 -18.557 -11.479 -4.512 1.00 0.00 H new ATOM 0 HA HIS B 72 -16.116 -10.380 -3.883 1.00 0.00 H new ATOM 0 HB2 HIS B 72 -16.806 -12.249 -5.502 1.00 0.00 H new ATOM 0 HB3 HIS B 72 -17.222 -10.994 -6.652 1.00 0.00 H new ATOM 0 HD1 HIS B 72 -14.783 -13.321 -6.542 1.00 0.00 H new ATOM 0 HD2 HIS B 72 -14.540 -9.152 -6.477 1.00 0.00 H new ATOM 0 HE1 HIS B 72 -12.451 -12.701 -7.349 1.00 0.00 H new ATOM 2006 N SER B 73 -15.895 -8.066 -4.604 1.00 0.00 N ATOM 2007 CA SER B 73 -15.673 -6.641 -4.870 1.00 0.00 C ATOM 2008 C SER B 73 -16.466 -5.721 -3.965 1.00 0.00 C ATOM 2009 O SER B 73 -16.019 -4.644 -3.629 1.00 0.00 O ATOM 2010 CB SER B 73 -15.664 -6.261 -6.357 1.00 0.00 C ATOM 2011 OG SER B 73 -14.613 -6.974 -7.031 1.00 0.00 O ATOM 0 H SER B 73 -15.205 -8.456 -3.962 1.00 0.00 H new ATOM 0 HA SER B 73 -14.639 -6.461 -4.576 1.00 0.00 H new ATOM 0 HB2 SER B 73 -16.627 -6.499 -6.809 1.00 0.00 H new ATOM 0 HB3 SER B 73 -15.517 -5.187 -6.467 1.00 0.00 H new ATOM 0 HG SER B 73 -14.068 -6.343 -7.546 1.00 0.00 H new ATOM 2017 N LYS B 74 -17.583 -6.198 -3.500 1.00 0.00 N ATOM 2018 CA LYS B 74 -18.356 -5.484 -2.466 1.00 0.00 C ATOM 2019 C LYS B 74 -17.856 -5.985 -1.114 1.00 0.00 C ATOM 2020 O LYS B 74 -18.251 -5.537 -0.017 1.00 0.00 O ATOM 2021 CB LYS B 74 -19.869 -5.725 -2.589 1.00 0.00 C ATOM 2022 CG LYS B 74 -20.751 -4.982 -1.540 1.00 0.00 C ATOM 2023 CD LYS B 74 -20.625 -3.455 -1.633 1.00 0.00 C ATOM 2024 CE LYS B 74 -19.425 -2.888 -0.852 1.00 0.00 C ATOM 2025 NZ LYS B 74 -19.623 -2.956 0.611 1.00 0.00 N ATOM 0 H LYS B 74 -17.999 -7.078 -3.806 1.00 0.00 H new ATOM 0 HA LYS B 74 -18.209 -4.410 -2.582 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -20.188 -5.423 -3.586 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -20.058 -6.795 -2.505 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -21.794 -5.265 -1.683 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -20.467 -5.305 -0.539 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -20.534 -3.169 -2.681 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -21.541 -2.999 -1.257 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -18.526 -3.442 -1.120 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -19.260 -1.851 -1.146 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -19.033 -2.236 1.075 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -20.623 -2.780 0.834 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -19.352 -3.900 0.954 1.00 0.00 H new ATOM 2039 N LEU B 75 -17.014 -6.923 -1.228 1.00 0.00 N ATOM 2040 CA LEU B 75 -16.364 -7.515 -0.152 1.00 0.00 C ATOM 2041 C LEU B 75 -15.434 -6.465 0.364 1.00 0.00 C ATOM 2042 O LEU B 75 -14.662 -5.874 -0.396 1.00 0.00 O ATOM 2043 CB LEU B 75 -15.640 -8.784 -0.624 1.00 0.00 C ATOM 2044 CG LEU B 75 -15.298 -9.810 0.456 1.00 0.00 C ATOM 2045 CD1 LEU B 75 -16.566 -10.281 1.150 1.00 0.00 C ATOM 2046 CD2 LEU B 75 -14.580 -11.000 -0.142 1.00 0.00 C ATOM 0 H LEU B 75 -16.747 -7.319 -2.129 1.00 0.00 H new ATOM 0 HA LEU B 75 -17.038 -7.840 0.641 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -16.260 -9.272 -1.376 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -14.715 -8.486 -1.118 1.00 0.00 H new ATOM 0 HG LEU B 75 -14.641 -9.331 1.183 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -16.311 -11.012 1.917 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -17.066 -9.429 1.612 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -17.232 -10.740 0.419 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -14.346 -11.717 0.645 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -15.219 -11.474 -0.887 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -13.656 -10.667 -0.615 1.00 0.00 H new ATOM 2058 N GLU B 76 -15.584 -6.154 1.594 1.00 0.00 N ATOM 2059 CA GLU B 76 -14.862 -5.103 2.184 1.00 0.00 C ATOM 2060 C GLU B 76 -13.496 -5.563 2.506 1.00 0.00 C ATOM 2061 O GLU B 76 -13.268 -6.756 2.668 1.00 0.00 O ATOM 2062 CB GLU B 76 -15.618 -4.603 3.399 1.00 0.00 C ATOM 2063 CG GLU B 76 -16.942 -3.958 3.008 1.00 0.00 C ATOM 2064 CD GLU B 76 -16.772 -2.604 2.382 1.00 0.00 C ATOM 2065 OE1 GLU B 76 -15.632 -2.194 2.096 1.00 0.00 O ATOM 2066 OE2 GLU B 76 -17.776 -1.917 2.176 1.00 0.00 O ATOM 0 H GLU B 76 -16.224 -6.633 2.228 1.00 0.00 H new ATOM 0 HA GLU B 76 -14.761 -4.264 1.495 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -15.804 -5.434 4.080 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -15.005 -3.880 3.938 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -17.466 -4.611 2.311 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -17.571 -3.867 3.894 1.00 0.00 H new ATOM 2073 N LYS B 77 -12.582 -4.631 2.578 1.00 0.00 N ATOM 2074 CA LYS B 77 -11.188 -4.922 2.842 1.00 0.00 C ATOM 2075 C LYS B 77 -11.021 -5.814 4.077 1.00 0.00 C ATOM 2076 O LYS B 77 -10.291 -6.788 4.060 1.00 0.00 O ATOM 2077 CB LYS B 77 -10.406 -3.622 2.975 1.00 0.00 C ATOM 2078 CG LYS B 77 -8.965 -3.845 3.334 1.00 0.00 C ATOM 2079 CD LYS B 77 -8.081 -2.593 3.182 1.00 0.00 C ATOM 2080 CE LYS B 77 -8.085 -2.009 1.776 1.00 0.00 C ATOM 2081 NZ LYS B 77 -7.219 -0.810 1.683 1.00 0.00 N ATOM 0 H LYS B 77 -12.781 -3.638 2.455 1.00 0.00 H new ATOM 0 HA LYS B 77 -10.785 -5.483 1.999 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -10.461 -3.072 2.035 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -10.873 -2.998 3.737 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -8.908 -4.195 4.365 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -8.563 -4.640 2.705 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -8.421 -1.831 3.883 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -7.057 -2.846 3.458 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -7.742 -2.763 1.067 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -9.104 -1.746 1.493 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -7.245 -0.438 0.712 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -7.562 -0.082 2.342 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -6.242 -1.068 1.929 1.00 0.00 H new ATOM 2095 N ALA B 78 -11.762 -5.492 5.094 1.00 0.00 N ATOM 2096 CA ALA B 78 -11.788 -6.246 6.344 1.00 0.00 C ATOM 2097 C ALA B 78 -12.326 -7.674 6.142 1.00 0.00 C ATOM 2098 O ALA B 78 -11.911 -8.606 6.827 1.00 0.00 O ATOM 2099 CB ALA B 78 -12.647 -5.514 7.348 1.00 0.00 C ATOM 0 H ALA B 78 -12.384 -4.684 5.094 1.00 0.00 H new ATOM 0 HA ALA B 78 -10.765 -6.329 6.711 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.670 -6.073 8.283 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.232 -4.522 7.528 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -13.660 -5.418 6.958 1.00 0.00 H new ATOM 2105 N ASP B 79 -13.196 -7.842 5.156 1.00 0.00 N ATOM 2106 CA ASP B 79 -13.831 -9.143 4.903 1.00 0.00 C ATOM 2107 C ASP B 79 -12.846 -9.998 4.182 1.00 0.00 C ATOM 2108 O ASP B 79 -12.572 -11.123 4.571 1.00 0.00 O ATOM 2109 CB ASP B 79 -15.076 -9.043 3.999 1.00 0.00 C ATOM 2110 CG ASP B 79 -16.238 -8.242 4.521 1.00 0.00 C ATOM 2111 OD1 ASP B 79 -16.628 -8.391 5.704 1.00 0.00 O ATOM 2112 OD2 ASP B 79 -16.805 -7.460 3.743 1.00 0.00 O ATOM 0 H ASP B 79 -13.482 -7.101 4.516 1.00 0.00 H new ATOM 0 HA ASP B 79 -14.138 -9.547 5.868 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -14.769 -8.612 3.046 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -15.427 -10.054 3.793 1.00 0.00 H new ATOM 2117 N ILE B 80 -12.329 -9.430 3.111 1.00 0.00 N ATOM 2118 CA ILE B 80 -11.326 -10.035 2.252 1.00 0.00 C ATOM 2119 C ILE B 80 -10.127 -10.507 3.073 1.00 0.00 C ATOM 2120 O ILE B 80 -9.728 -11.665 2.975 1.00 0.00 O ATOM 2121 CB ILE B 80 -10.867 -9.010 1.183 1.00 0.00 C ATOM 2122 CG1 ILE B 80 -12.085 -8.504 0.433 1.00 0.00 C ATOM 2123 CG2 ILE B 80 -9.908 -9.663 0.210 1.00 0.00 C ATOM 2124 CD1 ILE B 80 -11.856 -7.303 -0.426 1.00 0.00 C ATOM 0 H ILE B 80 -12.606 -8.498 2.802 1.00 0.00 H new ATOM 0 HA ILE B 80 -11.766 -10.901 1.757 1.00 0.00 H new ATOM 0 HB ILE B 80 -10.358 -8.180 1.673 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -12.466 -9.311 -0.194 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -12.865 -8.268 1.157 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -9.593 -8.933 -0.536 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -9.035 -10.030 0.750 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -10.405 -10.497 -0.286 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -12.788 -7.024 -0.917 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -11.509 -6.475 0.192 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -11.104 -7.533 -1.180 1.00 0.00 H new ATOM 2136 N LEU B 81 -9.591 -9.621 3.904 1.00 0.00 N ATOM 2137 CA LEU B 81 -8.461 -9.948 4.782 1.00 0.00 C ATOM 2138 C LEU B 81 -8.760 -11.159 5.645 1.00 0.00 C ATOM 2139 O LEU B 81 -8.015 -12.140 5.612 1.00 0.00 O ATOM 2140 CB LEU B 81 -8.096 -8.757 5.670 1.00 0.00 C ATOM 2141 CG LEU B 81 -6.991 -7.809 5.175 1.00 0.00 C ATOM 2142 CD1 LEU B 81 -7.220 -7.351 3.742 1.00 0.00 C ATOM 2143 CD2 LEU B 81 -6.924 -6.610 6.093 1.00 0.00 C ATOM 0 H LEU B 81 -9.921 -8.660 3.992 1.00 0.00 H new ATOM 0 HA LEU B 81 -7.613 -10.184 4.140 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.999 -8.167 5.827 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -7.795 -9.144 6.643 1.00 0.00 H new ATOM 0 HG LEU B 81 -6.048 -8.355 5.189 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -6.413 -6.684 3.440 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -7.240 -8.218 3.082 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -8.171 -6.823 3.676 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -6.143 -5.932 5.750 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -7.883 -6.092 6.086 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.698 -6.940 7.107 1.00 0.00 H new ATOM 2155 N GLU B 82 -9.883 -11.117 6.356 1.00 0.00 N ATOM 2156 CA GLU B 82 -10.289 -12.195 7.231 1.00 0.00 C ATOM 2157 C GLU B 82 -10.493 -13.474 6.455 1.00 0.00 C ATOM 2158 O GLU B 82 -10.087 -14.520 6.895 1.00 0.00 O ATOM 2159 CB GLU B 82 -11.565 -11.803 7.976 1.00 0.00 C ATOM 2160 CG GLU B 82 -12.216 -12.867 8.805 1.00 0.00 C ATOM 2161 CD GLU B 82 -13.518 -12.382 9.396 1.00 0.00 C ATOM 2162 OE1 GLU B 82 -13.517 -11.416 10.186 1.00 0.00 O ATOM 2163 OE2 GLU B 82 -14.579 -12.926 9.058 1.00 0.00 O ATOM 0 H GLU B 82 -10.533 -10.331 6.337 1.00 0.00 H new ATOM 0 HA GLU B 82 -9.496 -12.373 7.958 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -11.333 -10.960 8.626 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -12.291 -11.451 7.244 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -12.399 -13.749 8.191 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -11.542 -13.171 9.606 1.00 0.00 H new ATOM 2170 N MET B 83 -11.026 -13.355 5.253 1.00 0.00 N ATOM 2171 CA MET B 83 -11.393 -14.497 4.437 1.00 0.00 C ATOM 2172 C MET B 83 -10.143 -15.277 4.082 1.00 0.00 C ATOM 2173 O MET B 83 -10.121 -16.503 4.113 1.00 0.00 O ATOM 2174 CB MET B 83 -12.080 -14.018 3.161 1.00 0.00 C ATOM 2175 CG MET B 83 -12.995 -15.044 2.530 1.00 0.00 C ATOM 2176 SD MET B 83 -14.453 -15.373 3.547 1.00 0.00 S ATOM 2177 CE MET B 83 -15.254 -13.758 3.546 1.00 0.00 C ATOM 0 H MET B 83 -11.218 -12.455 4.812 1.00 0.00 H new ATOM 0 HA MET B 83 -12.079 -15.138 4.992 1.00 0.00 H new ATOM 0 HB2 MET B 83 -12.658 -13.122 3.387 1.00 0.00 H new ATOM 0 HB3 MET B 83 -11.318 -13.732 2.436 1.00 0.00 H new ATOM 0 HG2 MET B 83 -13.311 -14.692 1.548 1.00 0.00 H new ATOM 0 HG3 MET B 83 -12.445 -15.972 2.374 1.00 0.00 H new ATOM 0 HE1 MET B 83 -16.313 -13.877 3.777 1.00 0.00 H new ATOM 0 HE2 MET B 83 -14.788 -13.120 4.297 1.00 0.00 H new ATOM 0 HE3 MET B 83 -15.146 -13.299 2.563 1.00 0.00 H new ATOM 2187 N THR B 84 -9.105 -14.533 3.821 1.00 0.00 N ATOM 2188 CA THR B 84 -7.822 -15.052 3.453 1.00 0.00 C ATOM 2189 C THR B 84 -7.158 -15.716 4.664 1.00 0.00 C ATOM 2190 O THR B 84 -6.582 -16.807 4.552 1.00 0.00 O ATOM 2191 CB THR B 84 -6.975 -13.894 2.923 1.00 0.00 C ATOM 2192 OG1 THR B 84 -7.799 -13.163 2.025 1.00 0.00 O ATOM 2193 CG2 THR B 84 -5.783 -14.388 2.128 1.00 0.00 C ATOM 0 H THR B 84 -9.132 -13.514 3.861 1.00 0.00 H new ATOM 0 HA THR B 84 -7.923 -15.811 2.678 1.00 0.00 H new ATOM 0 HB THR B 84 -6.614 -13.303 3.765 1.00 0.00 H new ATOM 0 HG1 THR B 84 -8.266 -12.453 2.513 1.00 0.00 H new ATOM 0 HG21 THR B 84 -5.207 -13.535 1.769 1.00 0.00 H new ATOM 0 HG22 THR B 84 -5.153 -15.009 2.765 1.00 0.00 H new ATOM 0 HG23 THR B 84 -6.131 -14.975 1.278 1.00 0.00 H new ATOM 2201 N VAL B 85 -7.276 -15.068 5.827 1.00 0.00 N ATOM 2202 CA VAL B 85 -6.765 -15.620 7.076 1.00 0.00 C ATOM 2203 C VAL B 85 -7.452 -16.962 7.345 1.00 0.00 C ATOM 2204 O VAL B 85 -6.794 -17.989 7.477 1.00 0.00 O ATOM 2205 CB VAL B 85 -7.048 -14.684 8.285 1.00 0.00 C ATOM 2206 CG1 VAL B 85 -6.488 -15.248 9.577 1.00 0.00 C ATOM 2207 CG2 VAL B 85 -6.525 -13.298 8.061 1.00 0.00 C ATOM 0 H VAL B 85 -7.724 -14.157 5.925 1.00 0.00 H new ATOM 0 HA VAL B 85 -5.686 -15.735 6.970 1.00 0.00 H new ATOM 0 HB VAL B 85 -8.133 -14.625 8.376 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -6.707 -14.564 10.397 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -6.945 -16.216 9.780 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -5.409 -15.369 9.484 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -6.746 -12.681 8.932 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -5.447 -13.336 7.908 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -7.002 -12.867 7.180 1.00 0.00 H new ATOM 2217 N LYS B 86 -8.782 -16.937 7.358 1.00 0.00 N ATOM 2218 CA LYS B 86 -9.610 -18.108 7.641 1.00 0.00 C ATOM 2219 C LYS B 86 -9.289 -19.269 6.688 1.00 0.00 C ATOM 2220 O LYS B 86 -9.157 -20.417 7.113 1.00 0.00 O ATOM 2221 CB LYS B 86 -11.088 -17.752 7.525 1.00 0.00 C ATOM 2222 CG LYS B 86 -11.537 -16.557 8.377 1.00 0.00 C ATOM 2223 CD LYS B 86 -13.033 -16.414 8.354 1.00 0.00 C ATOM 2224 CE LYS B 86 -13.525 -15.979 6.982 1.00 0.00 C ATOM 2225 NZ LYS B 86 -14.999 -15.940 6.894 1.00 0.00 N ATOM 0 H LYS B 86 -9.323 -16.093 7.170 1.00 0.00 H new ATOM 0 HA LYS B 86 -9.388 -18.427 8.659 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.314 -17.539 6.480 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -11.679 -18.623 7.808 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -11.196 -16.689 9.404 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.075 -15.644 8.002 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -13.495 -17.363 8.625 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -13.342 -15.684 9.102 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -13.125 -14.991 6.753 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -13.137 -16.663 6.227 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -15.284 -15.771 5.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -15.390 -16.848 7.217 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -15.363 -15.173 7.495 1.00 0.00 H new ATOM 2239 N HIS B 87 -9.112 -18.955 5.416 1.00 0.00 N ATOM 2240 CA HIS B 87 -8.817 -19.968 4.411 1.00 0.00 C ATOM 2241 C HIS B 87 -7.432 -20.585 4.598 1.00 0.00 C ATOM 2242 O HIS B 87 -7.247 -21.786 4.347 1.00 0.00 O ATOM 2243 CB HIS B 87 -8.990 -19.406 2.991 1.00 0.00 C ATOM 2244 CG HIS B 87 -8.665 -20.377 1.870 1.00 0.00 C ATOM 2245 ND1 HIS B 87 -9.353 -21.552 1.623 1.00 0.00 N ATOM 2246 CD2 HIS B 87 -7.712 -20.305 0.915 1.00 0.00 C ATOM 2247 CE1 HIS B 87 -8.812 -22.136 0.557 1.00 0.00 C ATOM 2248 NE2 HIS B 87 -7.809 -21.421 0.081 1.00 0.00 N ATOM 0 H HIS B 87 -9.167 -18.004 5.052 1.00 0.00 H new ATOM 0 HA HIS B 87 -9.541 -20.772 4.548 1.00 0.00 H new ATOM 0 HB2 HIS B 87 -10.020 -19.071 2.873 1.00 0.00 H new ATOM 0 HB3 HIS B 87 -8.354 -18.527 2.885 1.00 0.00 H new ATOM 0 HD1 HIS B 87 -10.140 -21.909 2.165 1.00 0.00 H new ATOM 0 HD2 HIS B 87 -6.989 -19.509 0.813 1.00 0.00 H new ATOM 0 HE1 HIS B 87 -9.149 -23.072 0.136 1.00 0.00 H new ATOM 2256 N LEU B 88 -6.468 -19.811 5.096 1.00 0.00 N ATOM 2257 CA LEU B 88 -5.143 -20.354 5.252 1.00 0.00 C ATOM 2258 C LEU B 88 -5.168 -21.289 6.431 1.00 0.00 C ATOM 2259 O LEU B 88 -4.415 -22.242 6.491 1.00 0.00 O ATOM 2260 CB LEU B 88 -4.053 -19.240 5.387 1.00 0.00 C ATOM 2261 CG LEU B 88 -3.933 -18.477 6.725 1.00 0.00 C ATOM 2262 CD1 LEU B 88 -3.044 -19.220 7.724 1.00 0.00 C ATOM 2263 CD2 LEU B 88 -3.420 -17.077 6.498 1.00 0.00 C ATOM 0 H LEU B 88 -6.584 -18.840 5.386 1.00 0.00 H new ATOM 0 HA LEU B 88 -4.861 -20.905 4.355 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.086 -19.697 5.180 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -4.233 -18.505 4.602 1.00 0.00 H new ATOM 0 HG LEU B 88 -4.932 -18.416 7.156 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -2.985 -18.651 8.652 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -3.468 -20.203 7.928 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -2.044 -19.336 7.305 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -3.343 -16.558 7.454 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -2.437 -17.121 6.029 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -4.108 -16.538 5.847 1.00 0.00 H new ATOM 2275 N ARG B 89 -6.089 -21.019 7.356 1.00 0.00 N ATOM 2276 CA ARG B 89 -6.270 -21.848 8.522 1.00 0.00 C ATOM 2277 C ARG B 89 -6.803 -23.181 8.058 1.00 0.00 C ATOM 2278 O ARG B 89 -6.285 -24.216 8.437 1.00 0.00 O ATOM 2279 CB ARG B 89 -7.259 -21.230 9.537 1.00 0.00 C ATOM 2280 CG ARG B 89 -7.042 -19.761 9.869 1.00 0.00 C ATOM 2281 CD ARG B 89 -5.603 -19.453 10.208 1.00 0.00 C ATOM 2282 NE ARG B 89 -5.144 -20.140 11.421 1.00 0.00 N ATOM 2283 CZ ARG B 89 -4.025 -20.878 11.533 1.00 0.00 C ATOM 2284 NH1 ARG B 89 -3.304 -21.181 10.456 1.00 0.00 N ATOM 2285 NH2 ARG B 89 -3.646 -21.330 12.719 1.00 0.00 N ATOM 0 H ARG B 89 -6.722 -20.221 7.308 1.00 0.00 H new ATOM 0 HA ARG B 89 -5.311 -21.949 9.030 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -8.270 -21.349 9.148 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -7.205 -21.803 10.463 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -7.351 -19.150 9.021 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -7.678 -19.484 10.710 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -4.968 -19.741 9.370 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -5.488 -18.377 10.340 1.00 0.00 H new ATOM 0 HE ARG B 89 -5.726 -20.050 12.254 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -3.599 -20.853 9.536 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -2.457 -21.741 10.550 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -4.203 -21.118 13.547 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -2.798 -21.890 12.804 1.00 0.00 H new ATOM 2299 N ASN B 90 -7.816 -23.131 7.183 1.00 0.00 N ATOM 2300 CA ASN B 90 -8.438 -24.328 6.594 1.00 0.00 C ATOM 2301 C ASN B 90 -7.377 -25.186 5.945 1.00 0.00 C ATOM 2302 O ASN B 90 -7.211 -26.368 6.277 1.00 0.00 O ATOM 2303 CB ASN B 90 -9.470 -23.959 5.514 1.00 0.00 C ATOM 2304 CG ASN B 90 -10.622 -23.093 6.001 1.00 0.00 C ATOM 2305 OD1 ASN B 90 -10.977 -23.113 7.173 1.00 0.00 O ATOM 2306 ND2 ASN B 90 -11.258 -22.373 5.097 1.00 0.00 N ATOM 0 H ASN B 90 -8.230 -22.256 6.861 1.00 0.00 H new ATOM 0 HA ASN B 90 -8.939 -24.863 7.401 1.00 0.00 H new ATOM 0 HB2 ASN B 90 -8.958 -23.437 4.706 1.00 0.00 H new ATOM 0 HB3 ASN B 90 -9.878 -24.878 5.092 1.00 0.00 H new ATOM 0 HD21 ASN B 90 -12.067 -21.814 5.367 1.00 0.00 H new ATOM 0 HD22 ASN B 90 -10.940 -22.375 4.128 1.00 0.00 H new ATOM 2313 N LEU B 91 -6.610 -24.569 5.064 1.00 0.00 N ATOM 2314 CA LEU B 91 -5.541 -25.235 4.338 1.00 0.00 C ATOM 2315 C LEU B 91 -4.422 -25.733 5.265 1.00 0.00 C ATOM 2316 O LEU B 91 -3.609 -26.572 4.875 1.00 0.00 O ATOM 2317 CB LEU B 91 -4.977 -24.317 3.284 1.00 0.00 C ATOM 2318 CG LEU B 91 -5.895 -23.910 2.146 1.00 0.00 C ATOM 2319 CD1 LEU B 91 -5.178 -22.919 1.262 1.00 0.00 C ATOM 2320 CD2 LEU B 91 -6.319 -25.125 1.335 1.00 0.00 C ATOM 0 H LEU B 91 -6.712 -23.582 4.829 1.00 0.00 H new ATOM 0 HA LEU B 91 -5.975 -26.113 3.861 1.00 0.00 H new ATOM 0 HB2 LEU B 91 -4.631 -23.409 3.779 1.00 0.00 H new ATOM 0 HB3 LEU B 91 -4.100 -24.799 2.853 1.00 0.00 H new ATOM 0 HG LEU B 91 -6.793 -23.450 2.560 1.00 0.00 H new ATOM 0 HD11 LEU B 91 -5.832 -22.623 0.442 1.00 0.00 H new ATOM 0 HD12 LEU B 91 -4.907 -22.040 1.846 1.00 0.00 H new ATOM 0 HD13 LEU B 91 -4.276 -23.378 0.858 1.00 0.00 H new ATOM 0 HD21 LEU B 91 -6.977 -24.810 0.525 1.00 0.00 H new ATOM 0 HD22 LEU B 91 -5.436 -25.610 0.918 1.00 0.00 H new ATOM 0 HD23 LEU B 91 -6.848 -25.826 1.980 1.00 0.00 H new ATOM 2332 N GLN B 92 -4.380 -25.215 6.462 1.00 0.00 N ATOM 2333 CA GLN B 92 -3.424 -25.649 7.438 1.00 0.00 C ATOM 2334 C GLN B 92 -3.841 -26.930 8.182 1.00 0.00 C ATOM 2335 O GLN B 92 -2.996 -27.802 8.416 1.00 0.00 O ATOM 2336 CB GLN B 92 -3.064 -24.510 8.397 1.00 0.00 C ATOM 2337 CG GLN B 92 -1.993 -23.578 7.888 1.00 0.00 C ATOM 2338 CD GLN B 92 -0.623 -24.187 8.011 1.00 0.00 C ATOM 2339 OE1 GLN B 92 -0.378 -25.004 8.893 1.00 0.00 O ATOM 2340 NE2 GLN B 92 0.275 -23.787 7.180 1.00 0.00 N ATOM 0 H GLN B 92 -5.009 -24.480 6.786 1.00 0.00 H new ATOM 0 HA GLN B 92 -2.523 -25.923 6.889 1.00 0.00 H new ATOM 0 HB2 GLN B 92 -3.963 -23.930 8.606 1.00 0.00 H new ATOM 0 HB3 GLN B 92 -2.735 -24.939 9.343 1.00 0.00 H new ATOM 0 HG2 GLN B 92 -2.190 -23.332 6.844 1.00 0.00 H new ATOM 0 HG3 GLN B 92 -2.028 -22.643 8.448 1.00 0.00 H new ATOM 0 HE21 GLN B 92 0.036 -23.106 6.459 1.00 0.00 H new ATOM 0 HE22 GLN B 92 1.226 -24.151 7.243 1.00 0.00 H new ATOM 2349 N ARG B 93 -5.123 -27.102 8.502 1.00 0.00 N ATOM 2350 CA ARG B 93 -5.474 -28.263 9.328 1.00 0.00 C ATOM 2351 C ARG B 93 -6.404 -29.284 8.643 1.00 0.00 C ATOM 2352 O ARG B 93 -6.467 -30.417 9.071 1.00 0.00 O ATOM 2353 CB ARG B 93 -6.078 -27.862 10.695 1.00 0.00 C ATOM 2354 CG ARG B 93 -7.551 -27.480 10.649 1.00 0.00 C ATOM 2355 CD ARG B 93 -7.815 -26.150 10.028 1.00 0.00 C ATOM 2356 NE ARG B 93 -9.255 -25.877 9.910 1.00 0.00 N ATOM 2357 CZ ARG B 93 -9.840 -24.674 10.046 1.00 0.00 C ATOM 2358 NH1 ARG B 93 -9.152 -23.643 10.522 1.00 0.00 N ATOM 2359 NH2 ARG B 93 -11.126 -24.529 9.771 1.00 0.00 N ATOM 0 H ARG B 93 -5.895 -26.496 8.225 1.00 0.00 H new ATOM 0 HA ARG B 93 -4.515 -28.756 9.485 1.00 0.00 H new ATOM 0 HB2 ARG B 93 -5.953 -28.692 11.390 1.00 0.00 H new ATOM 0 HB3 ARG B 93 -5.511 -27.022 11.096 1.00 0.00 H new ATOM 0 HG2 ARG B 93 -8.096 -28.243 10.094 1.00 0.00 H new ATOM 0 HG3 ARG B 93 -7.947 -27.480 11.664 1.00 0.00 H new ATOM 0 HD2 ARG B 93 -7.345 -25.370 10.627 1.00 0.00 H new ATOM 0 HD3 ARG B 93 -7.356 -26.113 9.040 1.00 0.00 H new ATOM 0 HE ARG B 93 -9.864 -26.670 9.707 1.00 0.00 H new ATOM 0 HH11 ARG B 93 -8.174 -23.761 10.787 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -9.601 -22.733 10.623 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -11.674 -25.330 9.456 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -11.570 -23.616 9.874 1.00 0.00 H new ATOM 2373 N ALA B 94 -7.083 -28.898 7.558 1.00 0.00 N ATOM 2374 CA ALA B 94 -8.113 -29.776 6.931 1.00 0.00 C ATOM 2375 C ALA B 94 -7.500 -30.932 6.152 1.00 0.00 C ATOM 2376 O ALA B 94 -8.202 -31.774 5.580 1.00 0.00 O ATOM 2377 CB ALA B 94 -9.025 -28.969 6.025 1.00 0.00 C ATOM 0 H ALA B 94 -6.951 -28.001 7.091 1.00 0.00 H new ATOM 0 HA ALA B 94 -8.696 -30.204 7.746 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -9.769 -29.628 5.577 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -9.528 -28.198 6.608 1.00 0.00 H new ATOM 0 HB3 ALA B 94 -8.434 -28.501 5.237 1.00 0.00 H new ATOM 2383 N GLN B 95 -6.214 -30.954 6.137 1.00 0.00 N ATOM 2384 CA GLN B 95 -5.448 -31.917 5.431 1.00 0.00 C ATOM 2385 C GLN B 95 -4.098 -32.051 6.075 1.00 0.00 C ATOM 2386 O GLN B 95 -3.332 -31.079 6.087 1.00 0.00 O ATOM 2387 CB GLN B 95 -5.368 -31.653 3.901 1.00 0.00 C ATOM 2388 CG GLN B 95 -4.938 -30.261 3.437 1.00 0.00 C ATOM 2389 CD GLN B 95 -5.968 -29.180 3.677 1.00 0.00 C ATOM 2390 OE1 GLN B 95 -5.800 -28.438 4.724 1.00 0.00 O flip ATOM 2391 NE2 GLN B 95 -6.860 -28.966 2.875 1.00 0.00 N flip ATOM 0 H GLN B 95 -5.644 -30.272 6.638 1.00 0.00 H new ATOM 0 HA GLN B 95 -5.965 -32.874 5.504 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -4.675 -32.377 3.472 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -6.349 -31.859 3.474 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -4.016 -29.988 3.950 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -4.710 -30.300 2.372 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -6.967 -29.568 2.059 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -7.499 -28.184 3.020 1.00 0.00 H new