USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=28 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: B 58 LYS NZ :NH3+ 180:sc= 0.507 (180deg=-0.0879) USER MOD Set 1.2: B 72 HIS : no HE2:sc= -0.677 K(o=-0.17,f=-7.7!) USER MOD Set 2.1: A 92 GLN : amide:sc= -1.08 K(o=-4.2,f=-8.2!) USER MOD Set 2.2: B 87 HIS : no HD1:sc= -3.13! C(o=-4.2!,f=-6.4!) USER MOD Set 3.1: A 67 LYS NZ :NH3+ 161:sc= -0.743! (180deg=-2.54!) USER MOD Set 3.2: A 87 HIS : no HE2:sc= -1.76 K(o=-2.5,f=-18!) USER MOD Set 4.1: A 59 THR OG1 : rot 84:sc= 1.23 USER MOD Set 4.2: A 72 HIS : no HE2:sc= -0.162 K(o=1.1,f=-0.59) USER MOD Single : A 42 MET CE :methyl -165:sc= -0.0303 (180deg=-0.303) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= 0.965 K(o=0.97,f=-0.15) USER MOD Single : A 53 SER OG : rot 84:sc= 0.48 USER MOD Single : A 55 SER OG : rot 96:sc= 1.2 USER MOD Single : A 56 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.26) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ -178:sc= 1.17 (180deg=1.03) USER MOD Single : A 69 SER OG : rot 180:sc= 0.0374 USER MOD Single : A 70 SER OG : rot 80:sc= 1.22 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 1.27 (180deg=1.27) USER MOD Single : A 77 LYS NZ :NH3+ -108:sc= -1.48! (180deg=-3.7!) USER MOD Single : A 83 MET CE :methyl 165:sc= -0.274 (180deg=-0.928) USER MOD Single : A 84 THR OG1 : rot 102:sc= -0.276 USER MOD Single : A 86 LYS NZ :NH3+ 149:sc= 1.23 (180deg=0.465) USER MOD Single : A 90 ASN : amide:sc= -0.606 X(o=-0.61,f=-0.52) USER MOD Single : B 44 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0312) USER MOD Single : B 51 ASN : amide:sc= 0.683 K(o=0.68,f=-0.08) USER MOD Single : B 53 SER OG : rot 82:sc= 0.972 USER MOD Single : B 55 SER OG : rot -93:sc= 1.3 USER MOD Single : B 56 GLN : amide:sc= 0.0266 K(o=0.027,f=-6!) USER MOD Single : B 59 THR OG1 : rot 89:sc= 1.27 USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ -175:sc= -0.887 (180deg=-0.994) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 SER OG : rot 83:sc= 1.14 USER MOD Single : B 73 SER OG : rot 73:sc= 0.987 USER MOD Single : B 74 LYS NZ :NH3+ -138:sc= 1.45 (180deg=-0.95) USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 MET CE :methyl -154:sc= -1.47 (180deg=-2.81!) USER MOD Single : B 84 THR OG1 : rot 90:sc= -0.187 USER MOD Single : B 86 LYS NZ :NH3+ -114:sc= 0.64 (180deg=-0.0776) USER MOD Single : B 90 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : B 92 GLN : amide:sc= -1.12 K(o=-1.1,f=-1.8!) USER MOD Single : B 95 GLN : amide:sc= -1.61! K(o=-1.6!,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 268 N MET A 42 -18.777 4.046 8.632 1.00 0.00 N ATOM 269 CA MET A 42 -18.562 2.801 7.891 1.00 0.00 C ATOM 270 C MET A 42 -17.113 2.576 7.580 1.00 0.00 C ATOM 271 O MET A 42 -16.611 1.459 7.706 1.00 0.00 O ATOM 272 CB MET A 42 -19.369 2.783 6.607 1.00 0.00 C ATOM 273 CG MET A 42 -20.855 2.867 6.834 1.00 0.00 C ATOM 274 SD MET A 42 -21.532 1.439 7.712 1.00 0.00 S ATOM 275 CE MET A 42 -21.332 0.150 6.475 1.00 0.00 C ATOM 0 HA MET A 42 -18.901 1.991 8.537 1.00 0.00 H new ATOM 0 HB2 MET A 42 -19.057 3.617 5.979 1.00 0.00 H new ATOM 0 HB3 MET A 42 -19.144 1.869 6.058 1.00 0.00 H new ATOM 0 HG2 MET A 42 -21.077 3.771 7.401 1.00 0.00 H new ATOM 0 HG3 MET A 42 -21.357 2.963 5.871 1.00 0.00 H new ATOM 0 HE1 MET A 42 -21.933 -0.716 6.752 1.00 0.00 H new ATOM 0 HE2 MET A 42 -21.659 0.523 5.504 1.00 0.00 H new ATOM 0 HE3 MET A 42 -20.283 -0.140 6.418 1.00 0.00 H new ATOM 285 N GLU A 43 -16.421 3.637 7.228 1.00 0.00 N ATOM 286 CA GLU A 43 -15.038 3.490 6.842 1.00 0.00 C ATOM 287 C GLU A 43 -14.152 3.334 8.043 1.00 0.00 C ATOM 288 O GLU A 43 -13.058 2.826 7.934 1.00 0.00 O ATOM 289 CB GLU A 43 -14.541 4.615 5.967 1.00 0.00 C ATOM 290 CG GLU A 43 -14.542 5.965 6.623 1.00 0.00 C ATOM 291 CD GLU A 43 -13.830 6.961 5.794 1.00 0.00 C ATOM 292 OE1 GLU A 43 -14.401 7.450 4.809 1.00 0.00 O ATOM 293 OE2 GLU A 43 -12.669 7.248 6.096 1.00 0.00 O ATOM 0 H GLU A 43 -16.784 4.590 7.201 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.991 2.580 6.244 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.526 4.384 5.643 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -15.160 4.661 5.071 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.569 6.292 6.788 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.068 5.897 7.602 1.00 0.00 H new ATOM 300 N LYS A 44 -14.621 3.772 9.190 1.00 0.00 N ATOM 301 CA LYS A 44 -13.868 3.587 10.406 1.00 0.00 C ATOM 302 C LYS A 44 -13.942 2.151 10.839 1.00 0.00 C ATOM 303 O LYS A 44 -12.948 1.577 11.292 1.00 0.00 O ATOM 304 CB LYS A 44 -14.349 4.497 11.498 1.00 0.00 C ATOM 305 CG LYS A 44 -13.918 5.933 11.318 1.00 0.00 C ATOM 306 CD LYS A 44 -14.246 6.750 12.537 1.00 0.00 C ATOM 307 CE LYS A 44 -15.736 6.815 12.812 1.00 0.00 C ATOM 308 NZ LYS A 44 -16.029 7.537 14.064 1.00 0.00 N ATOM 0 H LYS A 44 -15.512 4.254 9.304 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.828 3.845 10.205 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -15.437 4.455 11.542 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -13.977 4.131 12.455 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.846 5.973 11.126 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -14.414 6.359 10.446 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -13.739 6.324 13.403 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -13.860 7.761 12.407 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.238 7.310 11.981 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.139 5.804 12.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.057 7.561 14.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.570 7.051 14.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.666 8.509 13.997 1.00 0.00 H new ATOM 322 N ARG A 45 -15.118 1.572 10.666 1.00 0.00 N ATOM 323 CA ARG A 45 -15.350 0.168 10.956 1.00 0.00 C ATOM 324 C ARG A 45 -14.514 -0.673 10.005 1.00 0.00 C ATOM 325 O ARG A 45 -13.831 -1.620 10.413 1.00 0.00 O ATOM 326 CB ARG A 45 -16.828 -0.154 10.783 1.00 0.00 C ATOM 327 CG ARG A 45 -17.732 0.618 11.728 1.00 0.00 C ATOM 328 CD ARG A 45 -19.188 0.391 11.402 1.00 0.00 C ATOM 329 NE ARG A 45 -19.568 -1.021 11.529 1.00 0.00 N ATOM 330 CZ ARG A 45 -20.474 -1.657 10.771 1.00 0.00 C ATOM 331 NH1 ARG A 45 -21.119 -1.014 9.803 1.00 0.00 N ATOM 332 NH2 ARG A 45 -20.742 -2.930 10.999 1.00 0.00 N ATOM 0 H ARG A 45 -15.941 2.064 10.319 1.00 0.00 H new ATOM 0 HA ARG A 45 -15.064 -0.053 11.984 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -17.121 0.062 9.756 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -16.980 -1.222 10.940 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -17.535 0.311 12.755 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -17.504 1.682 11.664 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -19.806 0.994 12.067 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -19.389 0.730 10.386 1.00 0.00 H new ATOM 0 HE ARG A 45 -19.103 -1.565 12.256 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -20.927 -0.027 9.630 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -21.806 -1.507 9.233 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.261 -3.426 11.749 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -21.430 -3.417 10.425 1.00 0.00 H new ATOM 346 N ARG A 46 -14.545 -0.275 8.733 1.00 0.00 N ATOM 347 CA ARG A 46 -13.765 -0.908 7.694 1.00 0.00 C ATOM 348 C ARG A 46 -12.287 -0.823 8.021 1.00 0.00 C ATOM 349 O ARG A 46 -11.622 -1.835 8.084 1.00 0.00 O ATOM 350 CB ARG A 46 -14.019 -0.245 6.347 1.00 0.00 C ATOM 351 CG ARG A 46 -13.233 -0.867 5.207 1.00 0.00 C ATOM 352 CD ARG A 46 -13.371 -0.056 3.944 1.00 0.00 C ATOM 353 NE ARG A 46 -14.738 -0.031 3.451 1.00 0.00 N ATOM 354 CZ ARG A 46 -15.287 0.929 2.717 1.00 0.00 C ATOM 355 NH1 ARG A 46 -14.607 2.037 2.408 1.00 0.00 N ATOM 356 NH2 ARG A 46 -16.531 0.778 2.302 1.00 0.00 N ATOM 0 H ARG A 46 -15.119 0.501 8.403 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.067 -1.954 7.638 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -15.083 -0.303 6.118 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -13.765 0.813 6.418 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.181 -0.938 5.483 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.586 -1.883 5.030 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -13.036 0.964 4.132 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -12.718 -0.470 3.176 1.00 0.00 H new ATOM 0 HE ARG A 46 -15.331 -0.825 3.692 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -13.649 2.156 2.737 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -15.046 2.764 1.843 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -17.051 -0.064 2.547 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -16.972 1.504 1.737 1.00 0.00 H new ATOM 370 N ARG A 47 -11.789 0.399 8.243 1.00 0.00 N ATOM 371 CA ARG A 47 -10.384 0.631 8.573 1.00 0.00 C ATOM 372 C ARG A 47 -9.934 -0.170 9.754 1.00 0.00 C ATOM 373 O ARG A 47 -8.862 -0.767 9.718 1.00 0.00 O ATOM 374 CB ARG A 47 -10.060 2.115 8.752 1.00 0.00 C ATOM 375 CG ARG A 47 -9.729 2.831 7.450 1.00 0.00 C ATOM 376 CD ARG A 47 -9.346 4.285 7.689 1.00 0.00 C ATOM 377 NE ARG A 47 -10.503 5.194 7.783 1.00 0.00 N ATOM 378 CZ ARG A 47 -10.718 6.099 8.757 1.00 0.00 C ATOM 379 NH1 ARG A 47 -10.063 6.030 9.924 1.00 0.00 N ATOM 380 NH2 ARG A 47 -11.613 7.062 8.562 1.00 0.00 N ATOM 0 H ARG A 47 -12.349 1.250 8.198 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.816 0.281 7.711 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -10.910 2.609 9.222 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -9.216 2.214 9.435 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.909 2.316 6.950 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.589 2.786 6.781 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -8.766 4.352 8.610 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -8.698 4.619 6.879 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.203 5.132 7.044 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -9.388 5.283 10.087 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -10.239 6.725 10.650 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -12.128 7.109 7.683 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -11.785 7.754 9.292 1.00 0.00 H new ATOM 394 N ALA A 48 -10.757 -0.217 10.779 1.00 0.00 N ATOM 395 CA ALA A 48 -10.469 -1.014 11.946 1.00 0.00 C ATOM 396 C ALA A 48 -10.255 -2.466 11.544 1.00 0.00 C ATOM 397 O ALA A 48 -9.182 -3.009 11.771 1.00 0.00 O ATOM 398 CB ALA A 48 -11.578 -0.893 12.965 1.00 0.00 C ATOM 0 H ALA A 48 -11.639 0.294 10.825 1.00 0.00 H new ATOM 0 HA ALA A 48 -9.553 -0.643 12.407 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -11.339 -1.502 13.837 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.682 0.149 13.268 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -12.514 -1.238 12.526 1.00 0.00 H new ATOM 404 N ARG A 49 -11.233 -3.045 10.842 1.00 0.00 N ATOM 405 CA ARG A 49 -11.150 -4.442 10.405 1.00 0.00 C ATOM 406 C ARG A 49 -9.959 -4.676 9.473 1.00 0.00 C ATOM 407 O ARG A 49 -9.372 -5.755 9.487 1.00 0.00 O ATOM 408 CB ARG A 49 -12.421 -4.900 9.712 1.00 0.00 C ATOM 409 CG ARG A 49 -13.649 -5.004 10.580 1.00 0.00 C ATOM 410 CD ARG A 49 -14.837 -5.465 9.749 1.00 0.00 C ATOM 411 NE ARG A 49 -14.629 -6.800 9.140 1.00 0.00 N ATOM 412 CZ ARG A 49 -15.000 -7.150 7.890 1.00 0.00 C ATOM 413 NH1 ARG A 49 -15.408 -6.214 7.022 1.00 0.00 N ATOM 414 NH2 ARG A 49 -14.906 -8.420 7.489 1.00 0.00 N ATOM 0 H ARG A 49 -12.091 -2.569 10.564 1.00 0.00 H new ATOM 0 HA ARG A 49 -11.014 -5.031 11.312 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -12.635 -4.209 8.896 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -12.235 -5.876 9.263 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -13.470 -5.706 11.394 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -13.866 -4.037 11.034 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -15.726 -5.493 10.379 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -15.027 -4.737 8.961 1.00 0.00 H new ATOM 0 HE ARG A 49 -14.169 -7.510 9.710 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -15.439 -5.235 7.305 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -15.688 -6.481 6.078 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.552 -9.132 8.128 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -15.188 -8.678 6.543 1.00 0.00 H new ATOM 428 N ILE A 50 -9.624 -3.674 8.650 1.00 0.00 N ATOM 429 CA ILE A 50 -8.464 -3.751 7.770 1.00 0.00 C ATOM 430 C ILE A 50 -7.212 -3.961 8.597 1.00 0.00 C ATOM 431 O ILE A 50 -6.511 -4.938 8.414 1.00 0.00 O ATOM 432 CB ILE A 50 -8.303 -2.470 6.893 1.00 0.00 C ATOM 433 CG1 ILE A 50 -9.500 -2.315 5.961 1.00 0.00 C ATOM 434 CG2 ILE A 50 -7.008 -2.531 6.066 1.00 0.00 C ATOM 435 CD1 ILE A 50 -9.547 -0.998 5.239 1.00 0.00 C ATOM 0 H ILE A 50 -10.145 -2.800 8.580 1.00 0.00 H new ATOM 0 HA ILE A 50 -8.618 -4.594 7.096 1.00 0.00 H new ATOM 0 HB ILE A 50 -8.251 -1.609 7.559 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -9.482 -3.120 5.226 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -10.416 -2.433 6.540 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -6.918 -1.627 5.463 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.152 -2.607 6.736 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.035 -3.402 5.412 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -10.427 -0.966 4.597 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -9.598 -0.187 5.965 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.650 -0.884 4.631 1.00 0.00 H new ATOM 447 N ASN A 51 -6.974 -3.072 9.550 1.00 0.00 N ATOM 448 CA ASN A 51 -5.786 -3.168 10.406 1.00 0.00 C ATOM 449 C ASN A 51 -5.796 -4.450 11.186 1.00 0.00 C ATOM 450 O ASN A 51 -4.795 -5.161 11.217 1.00 0.00 O ATOM 451 CB ASN A 51 -5.645 -1.984 11.377 1.00 0.00 C ATOM 452 CG ASN A 51 -5.370 -0.653 10.707 1.00 0.00 C ATOM 453 OD1 ASN A 51 -4.216 -0.285 10.472 1.00 0.00 O ATOM 454 ND2 ASN A 51 -6.415 0.082 10.410 1.00 0.00 N ATOM 0 H ASN A 51 -7.580 -2.278 9.755 1.00 0.00 H new ATOM 0 HA ASN A 51 -4.928 -3.146 9.734 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -6.560 -1.900 11.963 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -4.837 -2.198 12.077 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -6.289 0.993 9.969 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -7.354 -0.257 10.620 1.00 0.00 H new ATOM 461 N GLU A 52 -6.934 -4.766 11.775 1.00 0.00 N ATOM 462 CA GLU A 52 -7.079 -5.973 12.582 1.00 0.00 C ATOM 463 C GLU A 52 -6.765 -7.243 11.777 1.00 0.00 C ATOM 464 O GLU A 52 -5.983 -8.105 12.231 1.00 0.00 O ATOM 465 CB GLU A 52 -8.488 -6.076 13.177 1.00 0.00 C ATOM 466 CG GLU A 52 -8.893 -4.895 14.048 1.00 0.00 C ATOM 467 CD GLU A 52 -7.972 -4.668 15.212 1.00 0.00 C ATOM 468 OE1 GLU A 52 -8.149 -5.336 16.247 1.00 0.00 O ATOM 469 OE2 GLU A 52 -7.062 -3.811 15.118 1.00 0.00 O ATOM 0 H GLU A 52 -7.781 -4.201 11.711 1.00 0.00 H new ATOM 0 HA GLU A 52 -6.355 -5.894 13.393 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.206 -6.174 12.363 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.552 -6.988 13.771 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.921 -3.994 13.435 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.904 -5.058 14.421 1.00 0.00 H new ATOM 476 N SER A 53 -7.335 -7.354 10.589 1.00 0.00 N ATOM 477 CA SER A 53 -7.162 -8.532 9.790 1.00 0.00 C ATOM 478 C SER A 53 -5.787 -8.575 9.106 1.00 0.00 C ATOM 479 O SER A 53 -5.184 -9.623 9.028 1.00 0.00 O ATOM 480 CB SER A 53 -8.309 -8.667 8.798 1.00 0.00 C ATOM 481 OG SER A 53 -9.553 -8.646 9.497 1.00 0.00 O ATOM 0 H SER A 53 -7.921 -6.635 10.165 1.00 0.00 H new ATOM 0 HA SER A 53 -7.188 -9.397 10.452 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.274 -7.853 8.074 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.211 -9.597 8.238 1.00 0.00 H new ATOM 0 HG SER A 53 -9.821 -7.718 9.660 1.00 0.00 H new ATOM 487 N LEU A 54 -5.282 -7.423 8.667 1.00 0.00 N ATOM 488 CA LEU A 54 -3.983 -7.337 7.984 1.00 0.00 C ATOM 489 C LEU A 54 -2.876 -7.721 8.952 1.00 0.00 C ATOM 490 O LEU A 54 -1.936 -8.448 8.606 1.00 0.00 O ATOM 491 CB LEU A 54 -3.760 -5.892 7.508 1.00 0.00 C ATOM 492 CG LEU A 54 -2.943 -5.682 6.219 1.00 0.00 C ATOM 493 CD1 LEU A 54 -3.019 -4.233 5.785 1.00 0.00 C ATOM 494 CD2 LEU A 54 -1.489 -6.094 6.380 1.00 0.00 C ATOM 0 H LEU A 54 -5.755 -6.525 8.772 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.972 -8.015 7.130 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.737 -5.431 7.365 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.265 -5.347 8.312 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.382 -6.323 5.454 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.438 -4.095 4.873 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -4.058 -3.963 5.597 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.615 -3.596 6.572 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.957 -5.926 5.443 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.028 -5.501 7.170 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.437 -7.151 6.642 1.00 0.00 H new ATOM 506 N SER A 55 -3.010 -7.249 10.162 1.00 0.00 N ATOM 507 CA SER A 55 -2.036 -7.499 11.173 1.00 0.00 C ATOM 508 C SER A 55 -1.989 -8.983 11.551 1.00 0.00 C ATOM 509 O SER A 55 -0.922 -9.568 11.594 1.00 0.00 O ATOM 510 CB SER A 55 -2.300 -6.603 12.370 1.00 0.00 C ATOM 511 OG SER A 55 -2.236 -5.237 11.984 1.00 0.00 O ATOM 0 H SER A 55 -3.800 -6.681 10.468 1.00 0.00 H new ATOM 0 HA SER A 55 -1.048 -7.256 10.783 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.281 -6.824 12.790 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.567 -6.802 13.151 1.00 0.00 H new ATOM 0 HG SER A 55 -3.140 -4.908 11.795 1.00 0.00 H new ATOM 517 N GLN A 56 -3.144 -9.608 11.752 1.00 0.00 N ATOM 518 CA GLN A 56 -3.154 -11.030 12.109 1.00 0.00 C ATOM 519 C GLN A 56 -2.699 -11.877 10.909 1.00 0.00 C ATOM 520 O GLN A 56 -2.073 -12.912 11.072 1.00 0.00 O ATOM 521 CB GLN A 56 -4.539 -11.475 12.606 1.00 0.00 C ATOM 522 CG GLN A 56 -5.630 -11.405 11.559 1.00 0.00 C ATOM 523 CD GLN A 56 -6.994 -11.750 12.093 1.00 0.00 C ATOM 524 OE1 GLN A 56 -7.400 -12.903 12.091 1.00 0.00 O ATOM 525 NE2 GLN A 56 -7.716 -10.755 12.538 1.00 0.00 N ATOM 0 H GLN A 56 -4.063 -9.172 11.678 1.00 0.00 H new ATOM 0 HA GLN A 56 -2.453 -11.182 12.930 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.469 -12.499 12.972 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -4.825 -10.852 13.454 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -5.656 -10.400 11.139 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -5.385 -12.085 10.743 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.341 -9.806 12.523 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -8.654 -10.927 12.900 1.00 0.00 H new ATOM 534 N LEU A 57 -2.987 -11.375 9.723 1.00 0.00 N ATOM 535 CA LEU A 57 -2.641 -12.006 8.465 1.00 0.00 C ATOM 536 C LEU A 57 -1.134 -12.249 8.384 1.00 0.00 C ATOM 537 O LEU A 57 -0.690 -13.393 8.258 1.00 0.00 O ATOM 538 CB LEU A 57 -3.181 -11.109 7.323 1.00 0.00 C ATOM 539 CG LEU A 57 -2.995 -11.544 5.875 1.00 0.00 C ATOM 540 CD1 LEU A 57 -4.142 -11.012 5.028 1.00 0.00 C ATOM 541 CD2 LEU A 57 -1.725 -10.965 5.342 1.00 0.00 C ATOM 0 H LEU A 57 -3.483 -10.491 9.606 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.100 -12.991 8.375 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.250 -10.977 7.489 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.718 -10.128 7.431 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.968 -12.633 5.835 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.006 -11.325 3.993 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.086 -11.406 5.405 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.157 -9.923 5.079 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.590 -11.275 4.306 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.772 -9.877 5.392 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.885 -11.320 5.939 1.00 0.00 H new ATOM 553 N LYS A 58 -0.364 -11.182 8.525 1.00 0.00 N ATOM 554 CA LYS A 58 1.095 -11.273 8.491 1.00 0.00 C ATOM 555 C LYS A 58 1.624 -12.150 9.638 1.00 0.00 C ATOM 556 O LYS A 58 2.579 -12.906 9.463 1.00 0.00 O ATOM 557 CB LYS A 58 1.755 -9.871 8.528 1.00 0.00 C ATOM 558 CG LYS A 58 1.522 -9.072 9.805 1.00 0.00 C ATOM 559 CD LYS A 58 2.219 -7.720 9.774 1.00 0.00 C ATOM 560 CE LYS A 58 1.996 -6.960 11.074 1.00 0.00 C ATOM 561 NZ LYS A 58 2.641 -5.628 11.067 1.00 0.00 N ATOM 0 H LYS A 58 -0.723 -10.237 8.665 1.00 0.00 H new ATOM 0 HA LYS A 58 1.366 -11.745 7.547 1.00 0.00 H new ATOM 0 HB2 LYS A 58 2.829 -9.990 8.385 1.00 0.00 H new ATOM 0 HB3 LYS A 58 1.383 -9.291 7.684 1.00 0.00 H new ATOM 0 HG2 LYS A 58 0.452 -8.924 9.948 1.00 0.00 H new ATOM 0 HG3 LYS A 58 1.882 -9.644 10.660 1.00 0.00 H new ATOM 0 HD2 LYS A 58 3.287 -7.862 9.610 1.00 0.00 H new ATOM 0 HD3 LYS A 58 1.843 -7.132 8.936 1.00 0.00 H new ATOM 0 HE2 LYS A 58 0.926 -6.841 11.243 1.00 0.00 H new ATOM 0 HE3 LYS A 58 2.387 -7.546 11.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 2.461 -5.150 11.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 3.666 -5.739 10.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.250 -5.057 10.291 1.00 0.00 H new ATOM 575 N THR A 59 0.967 -12.065 10.784 1.00 0.00 N ATOM 576 CA THR A 59 1.365 -12.792 11.970 1.00 0.00 C ATOM 577 C THR A 59 1.195 -14.316 11.811 1.00 0.00 C ATOM 578 O THR A 59 2.122 -15.090 12.106 1.00 0.00 O ATOM 579 CB THR A 59 0.572 -12.271 13.177 1.00 0.00 C ATOM 580 OG1 THR A 59 0.808 -10.858 13.280 1.00 0.00 O ATOM 581 CG2 THR A 59 1.026 -12.932 14.466 1.00 0.00 C ATOM 0 H THR A 59 0.138 -11.485 10.914 1.00 0.00 H new ATOM 0 HA THR A 59 2.429 -12.619 12.131 1.00 0.00 H new ATOM 0 HB THR A 59 -0.485 -12.496 13.032 1.00 0.00 H new ATOM 0 HG1 THR A 59 0.197 -10.380 12.681 1.00 0.00 H new ATOM 0 HG21 THR A 59 0.444 -12.540 15.300 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.878 -14.009 14.394 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.083 -12.722 14.630 1.00 0.00 H new ATOM 589 N LEU A 60 0.044 -14.746 11.324 1.00 0.00 N ATOM 590 CA LEU A 60 -0.197 -16.167 11.147 1.00 0.00 C ATOM 591 C LEU A 60 0.651 -16.736 10.036 1.00 0.00 C ATOM 592 O LEU A 60 1.123 -17.848 10.131 1.00 0.00 O ATOM 593 CB LEU A 60 -1.688 -16.520 10.975 1.00 0.00 C ATOM 594 CG LEU A 60 -2.548 -16.606 12.261 1.00 0.00 C ATOM 595 CD1 LEU A 60 -1.979 -17.632 13.225 1.00 0.00 C ATOM 596 CD2 LEU A 60 -2.703 -15.262 12.951 1.00 0.00 C ATOM 0 H LEU A 60 -0.729 -14.141 11.047 1.00 0.00 H new ATOM 0 HA LEU A 60 0.110 -16.645 12.078 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.138 -15.776 10.317 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.751 -17.479 10.462 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.543 -16.924 11.949 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.600 -17.674 14.120 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.965 -18.612 12.747 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.964 -17.348 13.501 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.314 -15.381 13.846 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.721 -14.881 13.231 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.185 -14.558 12.273 1.00 0.00 H new ATOM 608 N ILE A 61 0.877 -15.953 9.010 1.00 0.00 N ATOM 609 CA ILE A 61 1.752 -16.339 7.912 1.00 0.00 C ATOM 610 C ILE A 61 3.196 -16.527 8.405 1.00 0.00 C ATOM 611 O ILE A 61 3.940 -17.497 7.993 1.00 0.00 O ATOM 612 CB ILE A 61 1.694 -15.257 6.806 1.00 0.00 C ATOM 613 CG1 ILE A 61 0.391 -15.362 6.006 1.00 0.00 C ATOM 614 CG2 ILE A 61 2.920 -15.248 5.917 1.00 0.00 C ATOM 615 CD1 ILE A 61 0.175 -16.702 5.312 1.00 0.00 C ATOM 0 H ILE A 61 0.462 -15.027 8.905 1.00 0.00 H new ATOM 0 HA ILE A 61 1.412 -17.291 7.504 1.00 0.00 H new ATOM 0 HB ILE A 61 1.698 -14.289 7.308 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.447 -15.177 6.677 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.378 -14.573 5.254 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.817 -14.468 5.163 1.00 0.00 H new ATOM 0 HG22 ILE A 61 3.806 -15.054 6.521 1.00 0.00 H new ATOM 0 HG23 ILE A 61 3.020 -16.216 5.426 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.771 -16.683 4.771 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.990 -16.884 4.611 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.152 -17.498 6.057 1.00 0.00 H new ATOM 627 N LEU A 62 3.587 -15.629 9.282 1.00 0.00 N ATOM 628 CA LEU A 62 4.894 -15.613 9.850 1.00 0.00 C ATOM 629 C LEU A 62 5.100 -16.901 10.593 1.00 0.00 C ATOM 630 O LEU A 62 6.054 -17.606 10.323 1.00 0.00 O ATOM 631 CB LEU A 62 5.035 -14.402 10.796 1.00 0.00 C ATOM 632 CG LEU A 62 6.452 -13.891 11.113 1.00 0.00 C ATOM 633 CD1 LEU A 62 7.312 -14.918 11.840 1.00 0.00 C ATOM 634 CD2 LEU A 62 7.124 -13.413 9.841 1.00 0.00 C ATOM 0 H LEU A 62 2.984 -14.879 9.620 1.00 0.00 H new ATOM 0 HA LEU A 62 5.650 -15.520 9.071 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.471 -13.575 10.365 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.554 -14.658 11.740 1.00 0.00 H new ATOM 0 HG LEU A 62 6.346 -13.053 11.802 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.298 -14.495 12.034 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.839 -15.185 12.785 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.415 -15.810 11.222 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.126 -13.053 10.072 1.00 0.00 H new ATOM 0 HD22 LEU A 62 7.190 -14.238 9.132 1.00 0.00 H new ATOM 0 HD23 LEU A 62 6.540 -12.604 9.403 1.00 0.00 H new ATOM 646 N ASP A 63 4.162 -17.226 11.454 1.00 0.00 N ATOM 647 CA ASP A 63 4.241 -18.416 12.298 1.00 0.00 C ATOM 648 C ASP A 63 4.088 -19.661 11.497 1.00 0.00 C ATOM 649 O ASP A 63 4.785 -20.578 11.699 1.00 0.00 O ATOM 650 CB ASP A 63 3.131 -18.427 13.270 1.00 0.00 C ATOM 651 CG ASP A 63 3.286 -19.456 14.365 1.00 0.00 C ATOM 652 OD1 ASP A 63 4.127 -19.272 15.265 1.00 0.00 O ATOM 653 OD2 ASP A 63 2.541 -20.464 14.376 1.00 0.00 O ATOM 0 H ASP A 63 3.315 -16.675 11.596 1.00 0.00 H new ATOM 0 HA ASP A 63 5.214 -18.384 12.787 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.048 -17.439 13.723 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.198 -18.614 12.739 1.00 0.00 H new ATOM 658 N ALA A 64 3.162 -19.675 10.574 1.00 0.00 N ATOM 659 CA ALA A 64 2.879 -20.872 9.790 1.00 0.00 C ATOM 660 C ALA A 64 4.128 -21.414 9.121 1.00 0.00 C ATOM 661 O ALA A 64 4.263 -22.621 8.921 1.00 0.00 O ATOM 662 CB ALA A 64 1.799 -20.598 8.765 1.00 0.00 C ATOM 0 H ALA A 64 2.582 -18.870 10.338 1.00 0.00 H new ATOM 0 HA ALA A 64 2.518 -21.636 10.479 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.604 -21.504 8.191 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.886 -20.286 9.273 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.129 -19.806 8.092 1.00 0.00 H new ATOM 668 N LEU A 65 5.046 -20.523 8.769 1.00 0.00 N ATOM 669 CA LEU A 65 6.272 -20.970 8.151 1.00 0.00 C ATOM 670 C LEU A 65 7.494 -20.688 8.988 1.00 0.00 C ATOM 671 O LEU A 65 8.598 -21.134 8.650 1.00 0.00 O ATOM 672 CB LEU A 65 6.423 -20.441 6.741 1.00 0.00 C ATOM 673 CG LEU A 65 5.424 -21.014 5.731 1.00 0.00 C ATOM 674 CD1 LEU A 65 4.017 -20.516 5.976 1.00 0.00 C ATOM 675 CD2 LEU A 65 5.875 -20.785 4.312 1.00 0.00 C ATOM 0 H LEU A 65 4.964 -19.515 8.899 1.00 0.00 H new ATOM 0 HA LEU A 65 6.194 -22.055 8.085 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.316 -19.356 6.761 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.434 -20.656 6.393 1.00 0.00 H new ATOM 0 HG LEU A 65 5.397 -22.093 5.883 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.344 -20.949 5.236 1.00 0.00 H new ATOM 0 HD12 LEU A 65 3.696 -20.811 6.975 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.996 -19.429 5.894 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.141 -21.205 3.625 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.972 -19.715 4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.839 -21.269 4.154 1.00 0.00 H new ATOM 687 N LYS A 66 7.292 -19.928 10.061 1.00 0.00 N ATOM 688 CA LYS A 66 8.316 -19.620 11.062 1.00 0.00 C ATOM 689 C LYS A 66 9.479 -18.943 10.421 1.00 0.00 C ATOM 690 O LYS A 66 10.608 -19.438 10.416 1.00 0.00 O ATOM 691 CB LYS A 66 8.702 -20.886 11.778 1.00 0.00 C ATOM 692 CG LYS A 66 7.489 -21.588 12.320 1.00 0.00 C ATOM 693 CD LYS A 66 7.167 -21.269 13.723 1.00 0.00 C ATOM 694 CE LYS A 66 5.838 -21.891 13.984 1.00 0.00 C ATOM 695 NZ LYS A 66 5.356 -21.671 15.356 1.00 0.00 N ATOM 0 H LYS A 66 6.390 -19.497 10.266 1.00 0.00 H new ATOM 0 HA LYS A 66 7.923 -18.925 11.804 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.234 -21.547 11.094 1.00 0.00 H new ATOM 0 HB3 LYS A 66 9.387 -20.653 12.593 1.00 0.00 H new ATOM 0 HG2 LYS A 66 6.631 -21.334 11.698 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.639 -22.664 12.232 1.00 0.00 H new ATOM 0 HD2 LYS A 66 7.925 -21.666 14.399 1.00 0.00 H new ATOM 0 HD3 LYS A 66 7.133 -20.191 13.881 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.110 -21.487 13.281 1.00 0.00 H new ATOM 0 HE3 LYS A 66 5.902 -22.963 13.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 4.445 -22.155 15.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.049 -22.050 16.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 5.233 -20.652 15.521 1.00 0.00 H new ATOM 709 N LYS A 67 9.159 -17.865 9.779 1.00 0.00 N ATOM 710 CA LYS A 67 10.152 -17.026 9.132 1.00 0.00 C ATOM 711 C LYS A 67 11.131 -16.428 10.130 1.00 0.00 C ATOM 712 O LYS A 67 12.203 -16.982 10.366 1.00 0.00 O ATOM 713 CB LYS A 67 9.470 -15.930 8.358 1.00 0.00 C ATOM 714 CG LYS A 67 8.624 -16.449 7.251 1.00 0.00 C ATOM 715 CD LYS A 67 7.730 -15.391 6.688 1.00 0.00 C ATOM 716 CE LYS A 67 6.951 -15.942 5.548 1.00 0.00 C ATOM 717 NZ LYS A 67 6.267 -17.204 5.897 1.00 0.00 N ATOM 0 H LYS A 67 8.201 -17.529 9.681 1.00 0.00 H new ATOM 0 HA LYS A 67 10.724 -17.656 8.451 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.852 -15.342 9.037 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.223 -15.257 7.949 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.263 -16.843 6.460 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.019 -17.279 7.615 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.053 -15.026 7.460 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.324 -14.539 6.356 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.213 -15.208 5.226 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.618 -16.114 4.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 5.501 -17.383 5.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.949 -17.989 5.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 5.869 -17.130 6.855 1.00 0.00 H new ATOM 731 N ASP A 68 10.732 -15.338 10.749 1.00 0.00 N ATOM 732 CA ASP A 68 11.583 -14.614 11.678 1.00 0.00 C ATOM 733 C ASP A 68 10.795 -13.484 12.176 1.00 0.00 C ATOM 734 O ASP A 68 10.044 -12.863 11.409 1.00 0.00 O ATOM 735 CB ASP A 68 12.802 -14.033 10.976 1.00 0.00 C ATOM 736 CG ASP A 68 13.957 -13.699 11.904 1.00 0.00 C ATOM 737 OD1 ASP A 68 13.777 -12.912 12.860 1.00 0.00 O ATOM 738 OD2 ASP A 68 15.078 -14.227 11.690 1.00 0.00 O ATOM 0 H ASP A 68 9.808 -14.925 10.624 1.00 0.00 H new ATOM 0 HA ASP A 68 11.917 -15.291 12.464 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.148 -14.744 10.226 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.504 -13.129 10.445 1.00 0.00 H new ATOM 743 N SER A 69 10.960 -13.173 13.396 1.00 0.00 N ATOM 744 CA SER A 69 10.234 -12.118 13.968 1.00 0.00 C ATOM 745 C SER A 69 10.833 -10.752 13.584 1.00 0.00 C ATOM 746 O SER A 69 10.148 -9.723 13.635 1.00 0.00 O ATOM 747 CB SER A 69 10.102 -12.340 15.458 1.00 0.00 C ATOM 748 OG SER A 69 11.369 -12.696 16.019 1.00 0.00 O ATOM 0 H SER A 69 11.605 -13.644 14.030 1.00 0.00 H new ATOM 0 HA SER A 69 9.222 -12.103 13.563 1.00 0.00 H new ATOM 0 HB2 SER A 69 9.726 -11.435 15.936 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.375 -13.129 15.652 1.00 0.00 H new ATOM 0 HG SER A 69 11.272 -12.836 16.984 1.00 0.00 H new ATOM 754 N SER A 70 12.083 -10.766 13.136 1.00 0.00 N ATOM 755 CA SER A 70 12.757 -9.561 12.699 1.00 0.00 C ATOM 756 C SER A 70 12.147 -9.108 11.355 1.00 0.00 C ATOM 757 O SER A 70 11.807 -7.946 11.164 1.00 0.00 O ATOM 758 CB SER A 70 14.257 -9.844 12.543 1.00 0.00 C ATOM 759 OG SER A 70 14.757 -10.569 13.668 1.00 0.00 O ATOM 0 H SER A 70 12.651 -11.611 13.068 1.00 0.00 H new ATOM 0 HA SER A 70 12.629 -8.767 13.435 1.00 0.00 H new ATOM 0 HB2 SER A 70 14.431 -10.415 11.631 1.00 0.00 H new ATOM 0 HB3 SER A 70 14.800 -8.905 12.440 1.00 0.00 H new ATOM 0 HG SER A 70 14.531 -11.518 13.572 1.00 0.00 H new ATOM 765 N ARG A 71 11.919 -10.067 10.461 1.00 0.00 N ATOM 766 CA ARG A 71 11.333 -9.781 9.147 1.00 0.00 C ATOM 767 C ARG A 71 9.820 -9.641 9.251 1.00 0.00 C ATOM 768 O ARG A 71 9.143 -9.374 8.270 1.00 0.00 O ATOM 769 CB ARG A 71 11.791 -10.821 8.098 1.00 0.00 C ATOM 770 CG ARG A 71 11.223 -12.218 8.264 1.00 0.00 C ATOM 771 CD ARG A 71 9.980 -12.388 7.422 1.00 0.00 C ATOM 772 NE ARG A 71 10.297 -12.392 5.980 1.00 0.00 N ATOM 773 CZ ARG A 71 9.817 -11.537 5.060 1.00 0.00 C ATOM 774 NH1 ARG A 71 9.134 -10.480 5.426 1.00 0.00 N ATOM 775 NH2 ARG A 71 10.080 -11.718 3.775 1.00 0.00 N ATOM 0 H ARG A 71 12.130 -11.052 10.620 1.00 0.00 H new ATOM 0 HA ARG A 71 11.702 -8.819 8.792 1.00 0.00 H new ATOM 0 HB2 ARG A 71 11.521 -10.454 7.108 1.00 0.00 H new ATOM 0 HB3 ARG A 71 12.879 -10.885 8.128 1.00 0.00 H new ATOM 0 HG2 ARG A 71 11.970 -12.957 7.974 1.00 0.00 H new ATOM 0 HG3 ARG A 71 10.986 -12.398 9.313 1.00 0.00 H new ATOM 0 HD2 ARG A 71 9.484 -13.321 7.689 1.00 0.00 H new ATOM 0 HD3 ARG A 71 9.280 -11.581 7.639 1.00 0.00 H new ATOM 0 HE ARG A 71 10.941 -13.111 5.651 1.00 0.00 H new ATOM 0 HH11 ARG A 71 8.963 -10.301 6.415 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.774 -9.837 4.721 1.00 0.00 H new ATOM 0 HH21 ARG A 71 10.650 -12.510 3.478 1.00 0.00 H new ATOM 0 HH22 ARG A 71 9.713 -11.066 3.082 1.00 0.00 H new ATOM 789 N HIS A 72 9.308 -9.861 10.450 1.00 0.00 N ATOM 790 CA HIS A 72 7.916 -9.571 10.771 1.00 0.00 C ATOM 791 C HIS A 72 7.803 -8.085 11.158 1.00 0.00 C ATOM 792 O HIS A 72 6.739 -7.484 11.081 1.00 0.00 O ATOM 793 CB HIS A 72 7.429 -10.472 11.927 1.00 0.00 C ATOM 794 CG HIS A 72 5.970 -10.308 12.307 1.00 0.00 C ATOM 795 ND1 HIS A 72 5.543 -9.820 13.522 1.00 0.00 N ATOM 796 CD2 HIS A 72 4.839 -10.602 11.611 1.00 0.00 C ATOM 797 CE1 HIS A 72 4.211 -9.828 13.534 1.00 0.00 C ATOM 798 NE2 HIS A 72 3.726 -10.293 12.396 1.00 0.00 N ATOM 0 H HIS A 72 9.843 -10.245 11.229 1.00 0.00 H new ATOM 0 HA HIS A 72 7.287 -9.774 9.905 1.00 0.00 H new ATOM 0 HB2 HIS A 72 7.601 -11.513 11.652 1.00 0.00 H new ATOM 0 HB3 HIS A 72 8.041 -10.270 12.806 1.00 0.00 H new ATOM 0 HD1 HIS A 72 6.145 -9.506 14.283 1.00 0.00 H new ATOM 0 HD2 HIS A 72 4.807 -11.009 10.611 1.00 0.00 H new ATOM 0 HE1 HIS A 72 3.606 -9.498 14.365 1.00 0.00 H new ATOM 806 N SER A 73 8.920 -7.511 11.571 1.00 0.00 N ATOM 807 CA SER A 73 8.982 -6.105 11.943 1.00 0.00 C ATOM 808 C SER A 73 9.346 -5.273 10.720 1.00 0.00 C ATOM 809 O SER A 73 8.967 -4.119 10.577 1.00 0.00 O ATOM 810 CB SER A 73 9.982 -5.915 13.104 1.00 0.00 C ATOM 811 OG SER A 73 10.069 -4.565 13.532 1.00 0.00 O ATOM 0 H SER A 73 9.809 -8.004 11.658 1.00 0.00 H new ATOM 0 HA SER A 73 8.009 -5.763 12.296 1.00 0.00 H new ATOM 0 HB2 SER A 73 9.681 -6.540 13.944 1.00 0.00 H new ATOM 0 HB3 SER A 73 10.968 -6.257 12.789 1.00 0.00 H new ATOM 0 HG SER A 73 10.712 -4.496 14.268 1.00 0.00 H new ATOM 817 N LYS A 74 10.011 -5.916 9.829 1.00 0.00 N ATOM 818 CA LYS A 74 10.459 -5.338 8.563 1.00 0.00 C ATOM 819 C LYS A 74 9.542 -5.881 7.452 1.00 0.00 C ATOM 820 O LYS A 74 9.938 -6.088 6.301 1.00 0.00 O ATOM 821 CB LYS A 74 11.950 -5.731 8.342 1.00 0.00 C ATOM 822 CG LYS A 74 12.680 -5.169 7.090 1.00 0.00 C ATOM 823 CD LYS A 74 12.666 -3.639 7.001 1.00 0.00 C ATOM 824 CE LYS A 74 11.429 -3.127 6.265 1.00 0.00 C ATOM 825 NZ LYS A 74 11.354 -1.658 6.233 1.00 0.00 N ATOM 0 H LYS A 74 10.280 -6.894 9.942 1.00 0.00 H new ATOM 0 HA LYS A 74 10.399 -4.250 8.560 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.511 -5.418 9.223 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.005 -6.819 8.299 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.714 -5.514 7.099 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.214 -5.580 6.194 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.693 -3.216 8.005 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.564 -3.296 6.486 1.00 0.00 H new ATOM 0 HE2 LYS A 74 11.435 -3.509 5.244 1.00 0.00 H new ATOM 0 HE3 LYS A 74 10.535 -3.522 6.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 10.497 -1.365 5.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 11.320 -1.291 7.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 12.192 -1.278 5.749 1.00 0.00 H new ATOM 839 N LEU A 75 8.308 -6.051 7.801 1.00 0.00 N ATOM 840 CA LEU A 75 7.343 -6.623 6.935 1.00 0.00 C ATOM 841 C LEU A 75 6.483 -5.536 6.331 1.00 0.00 C ATOM 842 O LEU A 75 5.611 -4.958 6.982 1.00 0.00 O ATOM 843 CB LEU A 75 6.551 -7.634 7.732 1.00 0.00 C ATOM 844 CG LEU A 75 5.688 -8.611 7.007 1.00 0.00 C ATOM 845 CD1 LEU A 75 6.376 -9.133 5.770 1.00 0.00 C ATOM 846 CD2 LEU A 75 5.372 -9.769 7.923 1.00 0.00 C ATOM 0 H LEU A 75 7.941 -5.789 8.716 1.00 0.00 H new ATOM 0 HA LEU A 75 7.811 -7.138 6.096 1.00 0.00 H new ATOM 0 HB2 LEU A 75 7.258 -8.204 8.335 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.914 -7.082 8.423 1.00 0.00 H new ATOM 0 HG LEU A 75 4.772 -8.103 6.704 1.00 0.00 H new ATOM 0 HD11 LEU A 75 5.723 -9.843 5.263 1.00 0.00 H new ATOM 0 HD12 LEU A 75 6.599 -8.303 5.100 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.303 -9.631 6.052 1.00 0.00 H new ATOM 0 HD21 LEU A 75 4.741 -10.486 7.398 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.299 -10.255 8.228 1.00 0.00 H new ATOM 0 HD23 LEU A 75 4.848 -9.402 8.805 1.00 0.00 H new ATOM 858 N GLU A 76 6.790 -5.244 5.101 1.00 0.00 N ATOM 859 CA GLU A 76 6.121 -4.217 4.338 1.00 0.00 C ATOM 860 C GLU A 76 4.797 -4.742 3.818 1.00 0.00 C ATOM 861 O GLU A 76 4.651 -5.930 3.602 1.00 0.00 O ATOM 862 CB GLU A 76 7.019 -3.762 3.175 1.00 0.00 C ATOM 863 CG GLU A 76 8.388 -3.228 3.618 1.00 0.00 C ATOM 864 CD GLU A 76 8.329 -1.909 4.382 1.00 0.00 C ATOM 865 OE1 GLU A 76 7.263 -1.554 4.950 1.00 0.00 O ATOM 866 OE2 GLU A 76 9.366 -1.218 4.469 1.00 0.00 O ATOM 0 H GLU A 76 7.528 -5.721 4.584 1.00 0.00 H new ATOM 0 HA GLU A 76 5.925 -3.359 4.981 1.00 0.00 H new ATOM 0 HB2 GLU A 76 7.170 -4.601 2.496 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.502 -2.985 2.612 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.871 -3.977 4.245 1.00 0.00 H new ATOM 0 HG3 GLU A 76 9.016 -3.097 2.737 1.00 0.00 H new ATOM 873 N LYS A 77 3.852 -3.849 3.598 1.00 0.00 N ATOM 874 CA LYS A 77 2.502 -4.192 3.171 1.00 0.00 C ATOM 875 C LYS A 77 2.458 -5.105 1.942 1.00 0.00 C ATOM 876 O LYS A 77 1.767 -6.118 1.940 1.00 0.00 O ATOM 877 CB LYS A 77 1.713 -2.920 2.943 1.00 0.00 C ATOM 878 CG LYS A 77 0.321 -3.157 2.430 1.00 0.00 C ATOM 879 CD LYS A 77 -0.617 -1.967 2.633 1.00 0.00 C ATOM 880 CE LYS A 77 -0.920 -1.651 4.118 1.00 0.00 C ATOM 881 NZ LYS A 77 0.158 -0.900 4.833 1.00 0.00 N ATOM 0 H LYS A 77 4.000 -2.846 3.712 1.00 0.00 H new ATOM 0 HA LYS A 77 2.045 -4.774 3.972 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.656 -2.365 3.880 1.00 0.00 H new ATOM 0 HB3 LYS A 77 2.251 -2.292 2.233 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.370 -3.393 1.367 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.098 -4.029 2.931 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.176 -1.086 2.167 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.556 -2.165 2.115 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.842 -1.073 4.171 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -1.101 -2.588 4.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.636 -1.534 5.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.848 -0.542 4.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.260 -0.101 5.350 1.00 0.00 H new ATOM 895 N ALA A 78 3.214 -4.755 0.938 1.00 0.00 N ATOM 896 CA ALA A 78 3.282 -5.533 -0.295 1.00 0.00 C ATOM 897 C ALA A 78 3.882 -6.910 -0.037 1.00 0.00 C ATOM 898 O ALA A 78 3.491 -7.896 -0.652 1.00 0.00 O ATOM 899 CB ALA A 78 4.118 -4.792 -1.316 1.00 0.00 C ATOM 0 H ALA A 78 3.805 -3.924 0.939 1.00 0.00 H new ATOM 0 HA ALA A 78 2.270 -5.667 -0.677 1.00 0.00 H new ATOM 0 HB1 ALA A 78 4.168 -5.374 -2.236 1.00 0.00 H new ATOM 0 HB2 ALA A 78 3.664 -3.823 -1.524 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.125 -4.645 -0.924 1.00 0.00 H new ATOM 905 N ASP A 79 4.760 -6.961 0.949 1.00 0.00 N ATOM 906 CA ASP A 79 5.520 -8.160 1.286 1.00 0.00 C ATOM 907 C ASP A 79 4.605 -9.110 2.014 1.00 0.00 C ATOM 908 O ASP A 79 4.648 -10.310 1.834 1.00 0.00 O ATOM 909 CB ASP A 79 6.691 -7.740 2.175 1.00 0.00 C ATOM 910 CG ASP A 79 7.822 -8.741 2.226 1.00 0.00 C ATOM 911 OD1 ASP A 79 8.409 -9.026 1.160 1.00 0.00 O ATOM 912 OD2 ASP A 79 8.244 -9.135 3.329 1.00 0.00 O ATOM 0 H ASP A 79 4.971 -6.163 1.548 1.00 0.00 H new ATOM 0 HA ASP A 79 5.907 -8.657 0.396 1.00 0.00 H new ATOM 0 HB2 ASP A 79 7.080 -6.787 1.817 1.00 0.00 H new ATOM 0 HB3 ASP A 79 6.322 -7.574 3.187 1.00 0.00 H new ATOM 917 N ILE A 80 3.741 -8.518 2.799 1.00 0.00 N ATOM 918 CA ILE A 80 2.721 -9.198 3.563 1.00 0.00 C ATOM 919 C ILE A 80 1.678 -9.817 2.648 1.00 0.00 C ATOM 920 O ILE A 80 1.394 -11.015 2.742 1.00 0.00 O ATOM 921 CB ILE A 80 2.047 -8.180 4.518 1.00 0.00 C ATOM 922 CG1 ILE A 80 3.037 -7.736 5.559 1.00 0.00 C ATOM 923 CG2 ILE A 80 0.817 -8.762 5.180 1.00 0.00 C ATOM 924 CD1 ILE A 80 2.684 -6.474 6.281 1.00 0.00 C ATOM 0 H ILE A 80 3.727 -7.507 2.930 1.00 0.00 H new ATOM 0 HA ILE A 80 3.184 -10.001 4.137 1.00 0.00 H new ATOM 0 HB ILE A 80 1.725 -7.322 3.928 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.151 -8.535 6.292 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.007 -7.602 5.080 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.373 -8.018 5.841 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.093 -9.046 4.416 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.097 -9.641 5.760 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.461 -6.242 7.009 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.601 -5.656 5.565 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.732 -6.603 6.796 1.00 0.00 H new ATOM 936 N LEU A 81 1.127 -9.009 1.759 1.00 0.00 N ATOM 937 CA LEU A 81 0.081 -9.464 0.861 1.00 0.00 C ATOM 938 C LEU A 81 0.587 -10.602 0.002 1.00 0.00 C ATOM 939 O LEU A 81 -0.003 -11.686 -0.008 1.00 0.00 O ATOM 940 CB LEU A 81 -0.412 -8.327 -0.023 1.00 0.00 C ATOM 941 CG LEU A 81 -0.923 -7.073 0.682 1.00 0.00 C ATOM 942 CD1 LEU A 81 -1.378 -6.069 -0.344 1.00 0.00 C ATOM 943 CD2 LEU A 81 -2.054 -7.396 1.659 1.00 0.00 C ATOM 0 H LEU A 81 1.388 -8.030 1.640 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.754 -9.816 1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.403 -8.035 -0.685 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.213 -8.711 -0.654 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.105 -6.650 1.265 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.743 -5.174 0.160 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.542 -5.806 -0.991 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.180 -6.500 -0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.391 -6.479 2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.885 -7.848 1.117 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.693 -8.092 2.416 1.00 0.00 H new ATOM 955 N GLU A 82 1.720 -10.372 -0.656 1.00 0.00 N ATOM 956 CA GLU A 82 2.349 -11.362 -1.512 1.00 0.00 C ATOM 957 C GLU A 82 2.627 -12.657 -0.774 1.00 0.00 C ATOM 958 O GLU A 82 2.359 -13.722 -1.288 1.00 0.00 O ATOM 959 CB GLU A 82 3.637 -10.788 -2.138 1.00 0.00 C ATOM 960 CG GLU A 82 4.665 -11.818 -2.559 1.00 0.00 C ATOM 961 CD GLU A 82 5.930 -11.231 -3.131 1.00 0.00 C ATOM 962 OE1 GLU A 82 5.952 -10.885 -4.332 1.00 0.00 O ATOM 963 OE2 GLU A 82 6.944 -11.150 -2.413 1.00 0.00 O ATOM 0 H GLU A 82 2.227 -9.488 -0.607 1.00 0.00 H new ATOM 0 HA GLU A 82 1.650 -11.601 -2.313 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.364 -10.193 -3.010 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.099 -10.109 -1.421 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.921 -12.433 -1.696 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.217 -12.480 -3.300 1.00 0.00 H new ATOM 970 N MET A 83 3.056 -12.539 0.452 1.00 0.00 N ATOM 971 CA MET A 83 3.490 -13.659 1.251 1.00 0.00 C ATOM 972 C MET A 83 2.325 -14.601 1.442 1.00 0.00 C ATOM 973 O MET A 83 2.386 -15.760 1.099 1.00 0.00 O ATOM 974 CB MET A 83 3.959 -13.148 2.607 1.00 0.00 C ATOM 975 CG MET A 83 4.835 -14.101 3.379 1.00 0.00 C ATOM 976 SD MET A 83 6.425 -14.407 2.586 1.00 0.00 S ATOM 977 CE MET A 83 7.097 -12.746 2.540 1.00 0.00 C ATOM 0 H MET A 83 3.116 -11.644 0.937 1.00 0.00 H new ATOM 0 HA MET A 83 4.308 -14.182 0.755 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.505 -12.216 2.458 1.00 0.00 H new ATOM 0 HB3 MET A 83 3.084 -12.912 3.212 1.00 0.00 H new ATOM 0 HG2 MET A 83 5.006 -13.699 4.378 1.00 0.00 H new ATOM 0 HG3 MET A 83 4.310 -15.048 3.502 1.00 0.00 H new ATOM 0 HE1 MET A 83 8.166 -12.792 2.330 1.00 0.00 H new ATOM 0 HE2 MET A 83 6.597 -12.173 1.759 1.00 0.00 H new ATOM 0 HE3 MET A 83 6.937 -12.262 3.504 1.00 0.00 H new ATOM 987 N THR A 84 1.254 -14.038 1.899 1.00 0.00 N ATOM 988 CA THR A 84 0.031 -14.727 2.202 1.00 0.00 C ATOM 989 C THR A 84 -0.557 -15.405 0.939 1.00 0.00 C ATOM 990 O THR A 84 -0.903 -16.591 0.963 1.00 0.00 O ATOM 991 CB THR A 84 -0.925 -13.684 2.786 1.00 0.00 C ATOM 992 OG1 THR A 84 -0.161 -12.935 3.734 1.00 0.00 O ATOM 993 CG2 THR A 84 -2.088 -14.321 3.532 1.00 0.00 C ATOM 0 H THR A 84 1.201 -13.036 2.082 1.00 0.00 H new ATOM 0 HA THR A 84 0.200 -15.531 2.918 1.00 0.00 H new ATOM 0 HB THR A 84 -1.338 -13.081 1.978 1.00 0.00 H new ATOM 0 HG1 THR A 84 0.101 -12.077 3.339 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.738 -13.540 3.928 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.655 -14.954 2.849 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.705 -14.926 4.354 1.00 0.00 H new ATOM 1001 N VAL A 85 -0.603 -14.667 -0.167 1.00 0.00 N ATOM 1002 CA VAL A 85 -1.100 -15.205 -1.437 1.00 0.00 C ATOM 1003 C VAL A 85 -0.197 -16.346 -1.931 1.00 0.00 C ATOM 1004 O VAL A 85 -0.663 -17.409 -2.365 1.00 0.00 O ATOM 1005 CB VAL A 85 -1.073 -14.134 -2.534 1.00 0.00 C ATOM 1006 CG1 VAL A 85 -1.594 -14.662 -3.846 1.00 0.00 C ATOM 1007 CG2 VAL A 85 -1.804 -12.906 -2.137 1.00 0.00 C ATOM 0 H VAL A 85 -0.303 -13.693 -0.213 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.117 -15.553 -1.253 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.026 -13.864 -2.672 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -1.558 -13.872 -4.596 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.978 -15.500 -4.172 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.624 -14.996 -3.720 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.757 -12.177 -2.946 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.846 -13.153 -1.931 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.347 -12.484 -1.242 1.00 0.00 H new ATOM 1017 N LYS A 86 1.091 -16.127 -1.872 1.00 0.00 N ATOM 1018 CA LYS A 86 2.026 -17.084 -2.389 1.00 0.00 C ATOM 1019 C LYS A 86 2.110 -18.324 -1.494 1.00 0.00 C ATOM 1020 O LYS A 86 2.423 -19.423 -1.942 1.00 0.00 O ATOM 1021 CB LYS A 86 3.375 -16.433 -2.698 1.00 0.00 C ATOM 1022 CG LYS A 86 3.214 -15.260 -3.667 1.00 0.00 C ATOM 1023 CD LYS A 86 4.511 -14.792 -4.259 1.00 0.00 C ATOM 1024 CE LYS A 86 4.236 -13.810 -5.403 1.00 0.00 C ATOM 1025 NZ LYS A 86 5.463 -13.167 -5.910 1.00 0.00 N ATOM 0 H LYS A 86 1.514 -15.291 -1.469 1.00 0.00 H new ATOM 0 HA LYS A 86 1.658 -17.450 -3.348 1.00 0.00 H new ATOM 0 HB2 LYS A 86 3.834 -16.084 -1.773 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.049 -17.174 -3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 86 2.541 -15.554 -4.472 1.00 0.00 H new ATOM 0 HG3 LYS A 86 2.741 -14.429 -3.144 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.118 -14.311 -3.492 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.081 -15.644 -4.629 1.00 0.00 H new ATOM 0 HE2 LYS A 86 3.744 -14.339 -6.219 1.00 0.00 H new ATOM 0 HE3 LYS A 86 3.544 -13.042 -5.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 5.353 -12.959 -6.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.631 -12.281 -5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 6.272 -13.807 -5.774 1.00 0.00 H new ATOM 1039 N HIS A 87 1.760 -18.147 -0.244 1.00 0.00 N ATOM 1040 CA HIS A 87 1.660 -19.251 0.692 1.00 0.00 C ATOM 1041 C HIS A 87 0.407 -20.046 0.456 1.00 0.00 C ATOM 1042 O HIS A 87 0.359 -21.236 0.763 1.00 0.00 O ATOM 1043 CB HIS A 87 1.764 -18.795 2.131 1.00 0.00 C ATOM 1044 CG HIS A 87 3.130 -18.329 2.500 1.00 0.00 C ATOM 1045 ND1 HIS A 87 4.177 -18.186 1.603 1.00 0.00 N ATOM 1046 CD2 HIS A 87 3.613 -17.966 3.685 1.00 0.00 C ATOM 1047 CE1 HIS A 87 5.227 -17.750 2.263 1.00 0.00 C ATOM 1048 NE2 HIS A 87 4.939 -17.597 3.543 1.00 0.00 N ATOM 0 H HIS A 87 1.536 -17.237 0.158 1.00 0.00 H new ATOM 0 HA HIS A 87 2.513 -19.904 0.510 1.00 0.00 H new ATOM 0 HB2 HIS A 87 1.053 -17.987 2.302 1.00 0.00 H new ATOM 0 HB3 HIS A 87 1.477 -19.616 2.788 1.00 0.00 H new ATOM 0 HD1 HIS A 87 4.139 -18.385 0.603 1.00 0.00 H new ATOM 0 HD2 HIS A 87 3.058 -17.960 4.611 1.00 0.00 H new ATOM 0 HE1 HIS A 87 6.191 -17.545 1.820 1.00 0.00 H new ATOM 1056 N LEU A 88 -0.608 -19.390 -0.108 1.00 0.00 N ATOM 1057 CA LEU A 88 -1.845 -20.044 -0.468 1.00 0.00 C ATOM 1058 C LEU A 88 -1.493 -21.090 -1.493 1.00 0.00 C ATOM 1059 O LEU A 88 -1.909 -22.225 -1.391 1.00 0.00 O ATOM 1060 CB LEU A 88 -2.851 -18.982 -1.021 1.00 0.00 C ATOM 1061 CG LEU A 88 -4.251 -19.424 -1.530 1.00 0.00 C ATOM 1062 CD1 LEU A 88 -5.119 -18.201 -1.686 1.00 0.00 C ATOM 1063 CD2 LEU A 88 -4.178 -20.114 -2.888 1.00 0.00 C ATOM 0 H LEU A 88 -0.586 -18.393 -0.323 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.330 -20.519 0.385 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.011 -18.247 -0.232 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -2.356 -18.465 -1.843 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.658 -20.126 -0.803 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.105 -18.498 -2.043 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -5.217 -17.699 -0.723 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.663 -17.520 -2.405 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.180 -20.405 -3.203 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -3.752 -19.430 -3.621 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.550 -21.001 -2.812 1.00 0.00 H new ATOM 1075 N ARG A 89 -0.637 -20.694 -2.433 1.00 0.00 N ATOM 1076 CA ARG A 89 -0.176 -21.589 -3.503 1.00 0.00 C ATOM 1077 C ARG A 89 0.539 -22.784 -2.873 1.00 0.00 C ATOM 1078 O ARG A 89 0.281 -23.931 -3.215 1.00 0.00 O ATOM 1079 CB ARG A 89 0.840 -20.904 -4.424 1.00 0.00 C ATOM 1080 CG ARG A 89 0.653 -19.416 -4.664 1.00 0.00 C ATOM 1081 CD ARG A 89 -0.689 -19.038 -5.221 1.00 0.00 C ATOM 1082 NE ARG A 89 -0.703 -17.615 -5.591 1.00 0.00 N ATOM 1083 CZ ARG A 89 -1.075 -17.129 -6.790 1.00 0.00 C ATOM 1084 NH1 ARG A 89 -1.522 -17.946 -7.742 1.00 0.00 N ATOM 1085 NH2 ARG A 89 -0.995 -15.820 -7.039 1.00 0.00 N ATOM 0 H ARG A 89 -0.244 -19.754 -2.479 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.052 -21.883 -4.082 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.835 -21.058 -4.006 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.818 -21.409 -5.390 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.803 -18.888 -3.723 1.00 0.00 H new ATOM 0 HG3 ARG A 89 1.427 -19.072 -5.350 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -0.914 -19.650 -6.094 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.466 -19.237 -4.483 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.407 -16.943 -4.883 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -1.585 -18.949 -7.566 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.802 -17.569 -8.648 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -0.651 -15.184 -6.319 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -1.278 -15.456 -7.949 1.00 0.00 H new ATOM 1099 N ASN A 90 1.408 -22.476 -1.908 1.00 0.00 N ATOM 1100 CA ASN A 90 2.229 -23.472 -1.208 1.00 0.00 C ATOM 1101 C ASN A 90 1.379 -24.495 -0.508 1.00 0.00 C ATOM 1102 O ASN A 90 1.683 -25.677 -0.518 1.00 0.00 O ATOM 1103 CB ASN A 90 3.164 -22.847 -0.168 1.00 0.00 C ATOM 1104 CG ASN A 90 4.222 -21.897 -0.712 1.00 0.00 C ATOM 1105 OD1 ASN A 90 4.657 -22.012 -1.857 1.00 0.00 O ATOM 1106 ND2 ASN A 90 4.690 -20.989 0.125 1.00 0.00 N ATOM 0 H ASN A 90 1.565 -21.521 -1.586 1.00 0.00 H new ATOM 0 HA ASN A 90 2.828 -23.945 -1.986 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.558 -22.307 0.559 1.00 0.00 H new ATOM 0 HB3 ASN A 90 3.667 -23.651 0.370 1.00 0.00 H new ATOM 0 HD21 ASN A 90 5.434 -20.357 -0.172 1.00 0.00 H new ATOM 0 HD22 ASN A 90 4.308 -20.919 1.068 1.00 0.00 H new ATOM 1113 N LEU A 91 0.332 -24.052 0.111 1.00 0.00 N ATOM 1114 CA LEU A 91 -0.549 -24.961 0.778 1.00 0.00 C ATOM 1115 C LEU A 91 -1.397 -25.706 -0.234 1.00 0.00 C ATOM 1116 O LEU A 91 -1.589 -26.906 -0.126 1.00 0.00 O ATOM 1117 CB LEU A 91 -1.410 -24.220 1.785 1.00 0.00 C ATOM 1118 CG LEU A 91 -0.652 -23.565 2.941 1.00 0.00 C ATOM 1119 CD1 LEU A 91 -1.580 -22.694 3.751 1.00 0.00 C ATOM 1120 CD2 LEU A 91 -0.018 -24.625 3.832 1.00 0.00 C ATOM 0 H LEU A 91 0.065 -23.069 0.170 1.00 0.00 H new ATOM 0 HA LEU A 91 0.044 -25.695 1.324 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.973 -23.449 1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -2.137 -24.918 2.199 1.00 0.00 H new ATOM 0 HG LEU A 91 0.139 -22.942 2.524 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.026 -22.235 4.570 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -1.997 -21.915 3.113 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.389 -23.302 4.156 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.517 -24.141 4.649 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.796 -25.270 4.240 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.679 -25.223 3.246 1.00 0.00 H new ATOM 1132 N GLN A 92 -1.817 -25.014 -1.266 1.00 0.00 N ATOM 1133 CA GLN A 92 -2.698 -25.577 -2.289 1.00 0.00 C ATOM 1134 C GLN A 92 -2.025 -26.643 -3.133 1.00 0.00 C ATOM 1135 O GLN A 92 -2.697 -27.467 -3.743 1.00 0.00 O ATOM 1136 CB GLN A 92 -3.296 -24.480 -3.168 1.00 0.00 C ATOM 1137 CG GLN A 92 -4.410 -23.690 -2.503 1.00 0.00 C ATOM 1138 CD GLN A 92 -5.674 -24.484 -2.303 1.00 0.00 C ATOM 1139 OE1 GLN A 92 -5.663 -25.711 -2.140 1.00 0.00 O ATOM 1140 NE2 GLN A 92 -6.765 -23.809 -2.287 1.00 0.00 N ATOM 0 H GLN A 92 -1.562 -24.040 -1.430 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.508 -26.073 -1.754 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -2.503 -23.792 -3.462 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -3.681 -24.932 -4.082 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -4.061 -23.329 -1.536 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -4.634 -22.812 -3.109 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -6.742 -22.799 -2.424 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -7.656 -24.283 -2.137 1.00 0.00 H new ATOM 1149 N ARG A 93 -0.722 -26.654 -3.142 1.00 0.00 N ATOM 1150 CA ARG A 93 0.013 -27.649 -3.909 1.00 0.00 C ATOM 1151 C ARG A 93 0.253 -28.901 -3.070 1.00 0.00 C ATOM 1152 O ARG A 93 0.649 -29.941 -3.579 1.00 0.00 O ATOM 1153 CB ARG A 93 1.331 -27.047 -4.443 1.00 0.00 C ATOM 1154 CG ARG A 93 2.265 -26.509 -3.367 1.00 0.00 C ATOM 1155 CD ARG A 93 3.093 -27.598 -2.694 1.00 0.00 C ATOM 1156 NE ARG A 93 3.873 -27.081 -1.578 1.00 0.00 N ATOM 1157 CZ ARG A 93 5.199 -27.180 -1.465 1.00 0.00 C ATOM 1158 NH1 ARG A 93 5.920 -27.700 -2.457 1.00 0.00 N ATOM 1159 NH2 ARG A 93 5.807 -26.743 -0.366 1.00 0.00 N ATOM 0 H ARG A 93 -0.138 -25.991 -2.632 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.584 -27.947 -4.771 1.00 0.00 H new ATOM 0 HB2 ARG A 93 1.858 -27.811 -5.015 1.00 0.00 H new ATOM 0 HB3 ARG A 93 1.092 -26.239 -5.135 1.00 0.00 H new ATOM 0 HG2 ARG A 93 2.936 -25.773 -3.811 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.677 -25.989 -2.611 1.00 0.00 H new ATOM 0 HD2 ARG A 93 2.432 -28.388 -2.339 1.00 0.00 H new ATOM 0 HD3 ARG A 93 3.763 -28.048 -3.426 1.00 0.00 H new ATOM 0 HE ARG A 93 3.369 -26.609 -0.828 1.00 0.00 H new ATOM 0 HH11 ARG A 93 5.459 -28.024 -3.307 1.00 0.00 H new ATOM 0 HH12 ARG A 93 6.933 -27.774 -2.367 1.00 0.00 H new ATOM 0 HH21 ARG A 93 5.260 -26.332 0.390 1.00 0.00 H new ATOM 0 HH22 ARG A 93 6.821 -26.819 -0.280 1.00 0.00 H new ATOM 1173 N ALA A 94 -0.005 -28.777 -1.779 1.00 0.00 N ATOM 1174 CA ALA A 94 0.239 -29.840 -0.821 1.00 0.00 C ATOM 1175 C ALA A 94 -0.861 -30.882 -0.867 1.00 0.00 C ATOM 1176 O ALA A 94 -0.658 -32.040 -0.484 1.00 0.00 O ATOM 1177 CB ALA A 94 0.318 -29.253 0.577 1.00 0.00 C ATOM 0 H ALA A 94 -0.392 -27.930 -1.364 1.00 0.00 H new ATOM 0 HA ALA A 94 1.181 -30.323 -1.079 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.501 -30.051 1.297 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.132 -28.529 0.622 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.622 -28.757 0.817 1.00 0.00 H new ATOM 1485 N GLU B 43 7.445 4.740 -3.186 1.00 0.00 N ATOM 1486 CA GLU B 43 6.092 4.490 -2.765 1.00 0.00 C ATOM 1487 C GLU B 43 5.348 3.844 -3.887 1.00 0.00 C ATOM 1488 O GLU B 43 4.620 2.930 -3.662 1.00 0.00 O ATOM 1489 CB GLU B 43 5.373 5.759 -2.213 1.00 0.00 C ATOM 1490 CG GLU B 43 4.652 6.682 -3.210 1.00 0.00 C ATOM 1491 CD GLU B 43 3.220 6.213 -3.593 1.00 0.00 C ATOM 1492 OE1 GLU B 43 2.473 5.739 -2.701 1.00 0.00 O ATOM 1493 OE2 GLU B 43 2.807 6.379 -4.762 1.00 0.00 O ATOM 0 HA GLU B 43 6.115 3.807 -1.916 1.00 0.00 H new ATOM 0 HB2 GLU B 43 4.641 5.431 -1.475 1.00 0.00 H new ATOM 0 HB3 GLU B 43 6.115 6.357 -1.683 1.00 0.00 H new ATOM 0 HG2 GLU B 43 4.592 7.683 -2.783 1.00 0.00 H new ATOM 0 HG3 GLU B 43 5.252 6.758 -4.117 1.00 0.00 H new ATOM 1500 N LYS B 44 5.652 4.263 -5.112 1.00 0.00 N ATOM 1501 CA LYS B 44 5.000 3.753 -6.292 1.00 0.00 C ATOM 1502 C LYS B 44 5.342 2.305 -6.549 1.00 0.00 C ATOM 1503 O LYS B 44 4.472 1.498 -6.870 1.00 0.00 O ATOM 1504 CB LYS B 44 5.340 4.622 -7.468 1.00 0.00 C ATOM 1505 CG LYS B 44 4.486 5.866 -7.493 1.00 0.00 C ATOM 1506 CD LYS B 44 4.987 6.897 -8.462 1.00 0.00 C ATOM 1507 CE LYS B 44 5.110 6.378 -9.889 1.00 0.00 C ATOM 1508 NZ LYS B 44 3.848 5.794 -10.399 1.00 0.00 N ATOM 0 H LYS B 44 6.362 4.969 -5.304 1.00 0.00 H new ATOM 0 HA LYS B 44 3.922 3.784 -6.131 1.00 0.00 H new ATOM 0 HB2 LYS B 44 6.393 4.901 -7.425 1.00 0.00 H new ATOM 0 HB3 LYS B 44 5.197 4.061 -8.391 1.00 0.00 H new ATOM 0 HG2 LYS B 44 3.464 5.594 -7.756 1.00 0.00 H new ATOM 0 HG3 LYS B 44 4.454 6.299 -6.493 1.00 0.00 H new ATOM 0 HD2 LYS B 44 4.312 7.753 -8.452 1.00 0.00 H new ATOM 0 HD3 LYS B 44 5.961 7.255 -8.128 1.00 0.00 H new ATOM 0 HE2 LYS B 44 5.417 7.195 -10.542 1.00 0.00 H new ATOM 0 HE3 LYS B 44 5.896 5.624 -9.930 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.959 5.550 -11.404 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 3.619 4.936 -9.858 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 3.078 6.485 -10.294 1.00 0.00 H new ATOM 1522 N ARG B 45 6.606 1.981 -6.367 1.00 0.00 N ATOM 1523 CA ARG B 45 7.106 0.617 -6.504 1.00 0.00 C ATOM 1524 C ARG B 45 6.396 -0.316 -5.534 1.00 0.00 C ATOM 1525 O ARG B 45 5.887 -1.382 -5.917 1.00 0.00 O ATOM 1526 CB ARG B 45 8.602 0.597 -6.226 1.00 0.00 C ATOM 1527 CG ARG B 45 9.454 1.180 -7.328 1.00 0.00 C ATOM 1528 CD ARG B 45 10.860 1.433 -6.833 1.00 0.00 C ATOM 1529 NE ARG B 45 11.813 1.621 -7.931 1.00 0.00 N ATOM 1530 CZ ARG B 45 13.132 1.803 -7.791 1.00 0.00 C ATOM 1531 NH1 ARG B 45 13.668 1.992 -6.583 1.00 0.00 N ATOM 1532 NH2 ARG B 45 13.904 1.812 -8.871 1.00 0.00 N ATOM 0 H ARG B 45 7.326 2.659 -6.117 1.00 0.00 H new ATOM 0 HA ARG B 45 6.913 0.274 -7.520 1.00 0.00 H new ATOM 0 HB2 ARG B 45 8.795 1.148 -5.306 1.00 0.00 H new ATOM 0 HB3 ARG B 45 8.912 -0.433 -6.051 1.00 0.00 H new ATOM 0 HG2 ARG B 45 9.478 0.497 -8.177 1.00 0.00 H new ATOM 0 HG3 ARG B 45 9.013 2.112 -7.682 1.00 0.00 H new ATOM 0 HD2 ARG B 45 10.864 2.317 -6.196 1.00 0.00 H new ATOM 0 HD3 ARG B 45 11.182 0.594 -6.216 1.00 0.00 H new ATOM 0 HE ARG B 45 11.440 1.612 -8.880 1.00 0.00 H new ATOM 0 HH11 ARG B 45 13.071 1.999 -5.756 1.00 0.00 H new ATOM 0 HH12 ARG B 45 14.674 2.130 -6.487 1.00 0.00 H new ATOM 0 HH21 ARG B 45 13.491 1.681 -9.794 1.00 0.00 H new ATOM 0 HH22 ARG B 45 14.910 1.950 -8.777 1.00 0.00 H new ATOM 1546 N ARG B 46 6.341 0.101 -4.287 1.00 0.00 N ATOM 1547 CA ARG B 46 5.722 -0.684 -3.250 1.00 0.00 C ATOM 1548 C ARG B 46 4.221 -0.757 -3.468 1.00 0.00 C ATOM 1549 O ARG B 46 3.640 -1.817 -3.400 1.00 0.00 O ATOM 1550 CB ARG B 46 6.033 -0.084 -1.891 1.00 0.00 C ATOM 1551 CG ARG B 46 5.428 -0.836 -0.719 1.00 0.00 C ATOM 1552 CD ARG B 46 5.868 -0.213 0.578 1.00 0.00 C ATOM 1553 NE ARG B 46 7.321 -0.322 0.735 1.00 0.00 N ATOM 1554 CZ ARG B 46 8.085 0.425 1.534 1.00 0.00 C ATOM 1555 NH1 ARG B 46 7.559 1.402 2.277 1.00 0.00 N ATOM 1556 NH2 ARG B 46 9.389 0.188 1.574 1.00 0.00 N ATOM 0 H ARG B 46 6.724 0.991 -3.968 1.00 0.00 H new ATOM 0 HA ARG B 46 6.124 -1.697 -3.286 1.00 0.00 H new ATOM 0 HB2 ARG B 46 7.115 -0.046 -1.763 1.00 0.00 H new ATOM 0 HB3 ARG B 46 5.674 0.945 -1.871 1.00 0.00 H new ATOM 0 HG2 ARG B 46 4.340 -0.819 -0.789 1.00 0.00 H new ATOM 0 HG3 ARG B 46 5.734 -1.882 -0.751 1.00 0.00 H new ATOM 0 HD2 ARG B 46 5.572 0.836 0.603 1.00 0.00 H new ATOM 0 HD3 ARG B 46 5.369 -0.706 1.412 1.00 0.00 H new ATOM 0 HE ARG B 46 7.793 -1.037 0.181 1.00 0.00 H new ATOM 0 HH11 ARG B 46 6.557 1.588 2.240 1.00 0.00 H new ATOM 0 HH12 ARG B 46 8.159 1.962 2.882 1.00 0.00 H new ATOM 0 HH21 ARG B 46 9.790 -0.554 1.001 1.00 0.00 H new ATOM 0 HH22 ARG B 46 9.991 0.748 2.178 1.00 0.00 H new ATOM 1570 N ARG B 47 3.635 0.383 -3.761 1.00 0.00 N ATOM 1571 CA ARG B 47 2.210 0.555 -3.995 1.00 0.00 C ATOM 1572 C ARG B 47 1.741 -0.352 -5.103 1.00 0.00 C ATOM 1573 O ARG B 47 0.703 -1.001 -4.977 1.00 0.00 O ATOM 1574 CB ARG B 47 1.970 1.994 -4.368 1.00 0.00 C ATOM 1575 CG ARG B 47 0.552 2.430 -4.561 1.00 0.00 C ATOM 1576 CD ARG B 47 0.586 3.876 -4.945 1.00 0.00 C ATOM 1577 NE ARG B 47 -0.723 4.471 -5.122 1.00 0.00 N ATOM 1578 CZ ARG B 47 -0.895 5.773 -5.324 1.00 0.00 C ATOM 1579 NH1 ARG B 47 0.156 6.595 -5.291 1.00 0.00 N ATOM 1580 NH2 ARG B 47 -2.110 6.261 -5.536 1.00 0.00 N ATOM 0 H ARG B 47 4.157 1.255 -3.847 1.00 0.00 H new ATOM 0 HA ARG B 47 1.652 0.297 -3.095 1.00 0.00 H new ATOM 0 HB2 ARG B 47 2.412 2.621 -3.593 1.00 0.00 H new ATOM 0 HB3 ARG B 47 2.513 2.197 -5.291 1.00 0.00 H new ATOM 0 HG2 ARG B 47 0.068 1.836 -5.337 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -0.023 2.288 -3.646 1.00 0.00 H new ATOM 0 HD2 ARG B 47 1.126 4.432 -4.178 1.00 0.00 H new ATOM 0 HD3 ARG B 47 1.150 3.982 -5.872 1.00 0.00 H new ATOM 0 HE ARG B 47 -1.544 3.867 -5.090 1.00 0.00 H new ATOM 0 HH11 ARG B 47 1.089 6.223 -5.111 1.00 0.00 H new ATOM 0 HH12 ARG B 47 0.027 7.595 -5.446 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -2.916 5.636 -5.544 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -2.238 7.261 -5.691 1.00 0.00 H new ATOM 1594 N ALA B 48 2.512 -0.399 -6.178 1.00 0.00 N ATOM 1595 CA ALA B 48 2.225 -1.271 -7.292 1.00 0.00 C ATOM 1596 C ALA B 48 2.119 -2.697 -6.797 1.00 0.00 C ATOM 1597 O ALA B 48 1.090 -3.326 -6.962 1.00 0.00 O ATOM 1598 CB ALA B 48 3.296 -1.151 -8.365 1.00 0.00 C ATOM 0 H ALA B 48 3.352 0.168 -6.297 1.00 0.00 H new ATOM 0 HA ALA B 48 1.276 -0.976 -7.740 1.00 0.00 H new ATOM 0 HB1 ALA B 48 3.057 -1.818 -9.194 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.336 -0.123 -8.726 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.264 -1.426 -7.945 1.00 0.00 H new ATOM 1604 N ARG B 49 3.144 -3.153 -6.079 1.00 0.00 N ATOM 1605 CA ARG B 49 3.159 -4.515 -5.551 1.00 0.00 C ATOM 1606 C ARG B 49 2.030 -4.750 -4.550 1.00 0.00 C ATOM 1607 O ARG B 49 1.513 -5.857 -4.464 1.00 0.00 O ATOM 1608 CB ARG B 49 4.509 -4.886 -4.936 1.00 0.00 C ATOM 1609 CG ARG B 49 5.656 -5.072 -5.927 1.00 0.00 C ATOM 1610 CD ARG B 49 5.371 -6.201 -6.923 1.00 0.00 C ATOM 1611 NE ARG B 49 6.582 -6.608 -7.657 1.00 0.00 N ATOM 1612 CZ ARG B 49 6.612 -7.373 -8.763 1.00 0.00 C ATOM 1613 NH1 ARG B 49 5.490 -7.684 -9.412 1.00 0.00 N ATOM 1614 NH2 ARG B 49 7.777 -7.809 -9.230 1.00 0.00 N ATOM 0 H ARG B 49 3.971 -2.602 -5.851 1.00 0.00 H new ATOM 0 HA ARG B 49 2.996 -5.172 -6.405 1.00 0.00 H new ATOM 0 HB2 ARG B 49 4.790 -4.110 -4.224 1.00 0.00 H new ATOM 0 HB3 ARG B 49 4.389 -5.809 -4.369 1.00 0.00 H new ATOM 0 HG2 ARG B 49 5.821 -4.142 -6.470 1.00 0.00 H new ATOM 0 HG3 ARG B 49 6.575 -5.291 -5.383 1.00 0.00 H new ATOM 0 HD2 ARG B 49 4.964 -7.060 -6.390 1.00 0.00 H new ATOM 0 HD3 ARG B 49 4.610 -5.876 -7.632 1.00 0.00 H new ATOM 0 HE ARG B 49 7.477 -6.281 -7.294 1.00 0.00 H new ATOM 0 HH11 ARG B 49 4.592 -7.341 -9.071 1.00 0.00 H new ATOM 0 HH12 ARG B 49 5.530 -8.265 -10.249 1.00 0.00 H new ATOM 0 HH21 ARG B 49 8.643 -7.563 -8.750 1.00 0.00 H new ATOM 0 HH22 ARG B 49 7.805 -8.389 -10.068 1.00 0.00 H new ATOM 1628 N ILE B 50 1.656 -3.714 -3.792 1.00 0.00 N ATOM 1629 CA ILE B 50 0.529 -3.794 -2.876 1.00 0.00 C ATOM 1630 C ILE B 50 -0.738 -4.120 -3.659 1.00 0.00 C ATOM 1631 O ILE B 50 -1.376 -5.132 -3.408 1.00 0.00 O ATOM 1632 CB ILE B 50 0.340 -2.467 -2.073 1.00 0.00 C ATOM 1633 CG1 ILE B 50 1.567 -2.220 -1.200 1.00 0.00 C ATOM 1634 CG2 ILE B 50 -0.927 -2.514 -1.208 1.00 0.00 C ATOM 1635 CD1 ILE B 50 1.577 -0.892 -0.503 1.00 0.00 C ATOM 0 H ILE B 50 2.125 -2.808 -3.800 1.00 0.00 H new ATOM 0 HA ILE B 50 0.732 -4.585 -2.155 1.00 0.00 H new ATOM 0 HB ILE B 50 0.226 -1.647 -2.783 1.00 0.00 H new ATOM 0 HG12 ILE B 50 1.629 -3.010 -0.451 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.460 -2.297 -1.820 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -1.030 -1.576 -0.662 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -1.798 -2.660 -1.847 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -0.854 -3.340 -0.500 1.00 0.00 H new ATOM 0 HD11 ILE B 50 2.484 -0.802 0.095 1.00 0.00 H new ATOM 0 HD12 ILE B 50 1.549 -0.092 -1.243 1.00 0.00 H new ATOM 0 HD13 ILE B 50 0.705 -0.816 0.147 1.00 0.00 H new ATOM 1647 N ASN B 51 -1.046 -3.298 -4.655 1.00 0.00 N ATOM 1648 CA ASN B 51 -2.247 -3.507 -5.479 1.00 0.00 C ATOM 1649 C ASN B 51 -2.185 -4.841 -6.187 1.00 0.00 C ATOM 1650 O ASN B 51 -3.151 -5.599 -6.179 1.00 0.00 O ATOM 1651 CB ASN B 51 -2.464 -2.394 -6.519 1.00 0.00 C ATOM 1652 CG ASN B 51 -2.780 -1.033 -5.929 1.00 0.00 C ATOM 1653 OD1 ASN B 51 -3.940 -0.708 -5.651 1.00 0.00 O ATOM 1654 ND2 ASN B 51 -1.773 -0.220 -5.760 1.00 0.00 N ATOM 0 H ASN B 51 -0.490 -2.484 -4.916 1.00 0.00 H new ATOM 0 HA ASN B 51 -3.091 -3.487 -4.790 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -1.568 -2.310 -7.134 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -3.279 -2.687 -7.181 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -1.931 0.717 -5.388 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -0.829 -0.521 -6.000 1.00 0.00 H new ATOM 1661 N GLU B 52 -1.031 -5.142 -6.761 1.00 0.00 N ATOM 1662 CA GLU B 52 -0.818 -6.402 -7.487 1.00 0.00 C ATOM 1663 C GLU B 52 -1.042 -7.620 -6.594 1.00 0.00 C ATOM 1664 O GLU B 52 -1.678 -8.607 -7.010 1.00 0.00 O ATOM 1665 CB GLU B 52 0.589 -6.472 -8.090 1.00 0.00 C ATOM 1666 CG GLU B 52 0.894 -5.373 -9.089 1.00 0.00 C ATOM 1667 CD GLU B 52 -0.062 -5.350 -10.238 1.00 0.00 C ATOM 1668 OE1 GLU B 52 0.153 -6.088 -11.211 1.00 0.00 O ATOM 1669 OE2 GLU B 52 -1.048 -4.582 -10.188 1.00 0.00 O ATOM 0 H GLU B 52 -0.215 -4.530 -6.742 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.553 -6.418 -8.291 1.00 0.00 H new ATOM 0 HB2 GLU B 52 1.320 -6.427 -7.283 1.00 0.00 H new ATOM 0 HB3 GLU B 52 0.714 -7.438 -8.580 1.00 0.00 H new ATOM 0 HG2 GLU B 52 0.867 -4.409 -8.581 1.00 0.00 H new ATOM 0 HG3 GLU B 52 1.907 -5.505 -9.468 1.00 0.00 H new ATOM 1676 N SER B 53 -0.541 -7.565 -5.384 1.00 0.00 N ATOM 1677 CA SER B 53 -0.671 -8.666 -4.500 1.00 0.00 C ATOM 1678 C SER B 53 -2.072 -8.738 -3.900 1.00 0.00 C ATOM 1679 O SER B 53 -2.590 -9.807 -3.726 1.00 0.00 O ATOM 1680 CB SER B 53 0.418 -8.624 -3.440 1.00 0.00 C ATOM 1681 OG SER B 53 1.705 -8.584 -4.056 1.00 0.00 O ATOM 0 H SER B 53 -0.041 -6.763 -5.001 1.00 0.00 H new ATOM 0 HA SER B 53 -0.537 -9.587 -5.068 1.00 0.00 H new ATOM 0 HB2 SER B 53 0.284 -7.748 -2.805 1.00 0.00 H new ATOM 0 HB3 SER B 53 0.342 -9.500 -2.796 1.00 0.00 H new ATOM 0 HG SER B 53 1.911 -7.664 -4.324 1.00 0.00 H new ATOM 1687 N LEU B 54 -2.707 -7.583 -3.667 1.00 0.00 N ATOM 1688 CA LEU B 54 -4.020 -7.523 -3.034 1.00 0.00 C ATOM 1689 C LEU B 54 -5.080 -8.015 -4.018 1.00 0.00 C ATOM 1690 O LEU B 54 -6.045 -8.681 -3.643 1.00 0.00 O ATOM 1691 CB LEU B 54 -4.307 -6.068 -2.612 1.00 0.00 C ATOM 1692 CG LEU B 54 -5.183 -5.849 -1.364 1.00 0.00 C ATOM 1693 CD1 LEU B 54 -5.204 -4.380 -0.994 1.00 0.00 C ATOM 1694 CD2 LEU B 54 -6.609 -6.355 -1.548 1.00 0.00 C ATOM 0 H LEU B 54 -2.323 -6.670 -3.912 1.00 0.00 H new ATOM 0 HA LEU B 54 -4.042 -8.161 -2.150 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.351 -5.572 -2.443 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -4.785 -5.562 -3.451 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.736 -6.431 -0.558 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -5.826 -4.236 -0.111 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -4.189 -4.044 -0.782 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -5.612 -3.802 -1.823 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -7.180 -6.174 -0.637 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -7.077 -5.829 -2.380 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -6.591 -7.424 -1.759 1.00 0.00 H new ATOM 1706 N SER B 55 -4.875 -7.713 -5.266 1.00 0.00 N ATOM 1707 CA SER B 55 -5.788 -8.104 -6.287 1.00 0.00 C ATOM 1708 C SER B 55 -5.752 -9.620 -6.506 1.00 0.00 C ATOM 1709 O SER B 55 -6.800 -10.271 -6.529 1.00 0.00 O ATOM 1710 CB SER B 55 -5.494 -7.319 -7.548 1.00 0.00 C ATOM 1711 OG SER B 55 -4.123 -7.403 -7.879 1.00 0.00 O ATOM 0 H SER B 55 -4.067 -7.188 -5.600 1.00 0.00 H new ATOM 0 HA SER B 55 -6.807 -7.871 -5.980 1.00 0.00 H new ATOM 0 HB2 SER B 55 -6.096 -7.704 -8.371 1.00 0.00 H new ATOM 0 HB3 SER B 55 -5.776 -6.276 -7.407 1.00 0.00 H new ATOM 0 HG SER B 55 -3.644 -6.646 -7.482 1.00 0.00 H new ATOM 1717 N GLN B 56 -4.551 -10.197 -6.601 1.00 0.00 N ATOM 1718 CA GLN B 56 -4.433 -11.647 -6.769 1.00 0.00 C ATOM 1719 C GLN B 56 -4.876 -12.368 -5.480 1.00 0.00 C ATOM 1720 O GLN B 56 -5.412 -13.469 -5.533 1.00 0.00 O ATOM 1721 CB GLN B 56 -3.007 -12.050 -7.164 1.00 0.00 C ATOM 1722 CG GLN B 56 -1.986 -11.749 -6.100 1.00 0.00 C ATOM 1723 CD GLN B 56 -0.582 -12.078 -6.501 1.00 0.00 C ATOM 1724 OE1 GLN B 56 -0.102 -13.202 -6.307 1.00 0.00 O ATOM 1725 NE2 GLN B 56 0.092 -11.111 -7.038 1.00 0.00 N ATOM 0 H GLN B 56 -3.664 -9.695 -6.565 1.00 0.00 H new ATOM 0 HA GLN B 56 -5.092 -11.952 -7.582 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -2.987 -13.117 -7.385 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -2.731 -11.529 -8.081 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -2.043 -10.691 -5.844 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -2.238 -12.309 -5.199 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -0.346 -10.201 -7.178 1.00 0.00 H new ATOM 0 HE22 GLN B 56 1.061 -11.260 -7.320 1.00 0.00 H new ATOM 1734 N LEU B 57 -4.651 -11.699 -4.347 1.00 0.00 N ATOM 1735 CA LEU B 57 -5.060 -12.139 -3.006 1.00 0.00 C ATOM 1736 C LEU B 57 -6.557 -12.444 -3.056 1.00 0.00 C ATOM 1737 O LEU B 57 -6.982 -13.581 -2.873 1.00 0.00 O ATOM 1738 CB LEU B 57 -4.705 -10.934 -2.048 1.00 0.00 C ATOM 1739 CG LEU B 57 -4.921 -10.948 -0.524 1.00 0.00 C ATOM 1740 CD1 LEU B 57 -6.346 -11.110 -0.142 1.00 0.00 C ATOM 1741 CD2 LEU B 57 -4.031 -11.937 0.174 1.00 0.00 C ATOM 0 H LEU B 57 -4.162 -10.804 -4.335 1.00 0.00 H new ATOM 0 HA LEU B 57 -4.562 -13.041 -2.651 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -3.646 -10.725 -2.203 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -5.258 -10.074 -2.425 1.00 0.00 H new ATOM 0 HG LEU B 57 -4.624 -9.959 -0.174 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -6.433 -11.112 0.944 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -6.928 -10.285 -0.551 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -6.724 -12.052 -0.538 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -4.224 -11.906 1.246 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -4.235 -12.939 -0.203 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -2.988 -11.684 -0.014 1.00 0.00 H new ATOM 1753 N LYS B 58 -7.310 -11.433 -3.403 1.00 0.00 N ATOM 1754 CA LYS B 58 -8.752 -11.521 -3.562 1.00 0.00 C ATOM 1755 C LYS B 58 -9.130 -12.564 -4.629 1.00 0.00 C ATOM 1756 O LYS B 58 -10.012 -13.393 -4.399 1.00 0.00 O ATOM 1757 CB LYS B 58 -9.317 -10.105 -3.912 1.00 0.00 C ATOM 1758 CG LYS B 58 -10.860 -9.966 -4.013 1.00 0.00 C ATOM 1759 CD LYS B 58 -11.454 -10.569 -5.294 1.00 0.00 C ATOM 1760 CE LYS B 58 -11.056 -9.789 -6.553 1.00 0.00 C ATOM 1761 NZ LYS B 58 -11.639 -8.423 -6.573 1.00 0.00 N ATOM 0 H LYS B 58 -6.937 -10.502 -3.589 1.00 0.00 H new ATOM 0 HA LYS B 58 -9.199 -11.855 -2.626 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -8.963 -9.403 -3.157 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -8.886 -9.794 -4.864 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -11.316 -10.450 -3.149 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -11.124 -8.910 -3.963 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -11.123 -11.603 -5.392 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -12.541 -10.589 -5.212 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -9.970 -9.720 -6.607 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -11.385 -10.336 -7.437 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -11.344 -7.932 -7.441 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -12.677 -8.488 -6.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -11.305 -7.891 -5.744 1.00 0.00 H new ATOM 1775 N THR B 59 -8.440 -12.524 -5.765 1.00 0.00 N ATOM 1776 CA THR B 59 -8.751 -13.388 -6.906 1.00 0.00 C ATOM 1777 C THR B 59 -8.653 -14.879 -6.544 1.00 0.00 C ATOM 1778 O THR B 59 -9.606 -15.648 -6.759 1.00 0.00 O ATOM 1779 CB THR B 59 -7.834 -13.065 -8.117 1.00 0.00 C ATOM 1780 OG1 THR B 59 -7.941 -11.667 -8.440 1.00 0.00 O ATOM 1781 CG2 THR B 59 -8.228 -13.885 -9.344 1.00 0.00 C ATOM 0 H THR B 59 -7.652 -11.896 -5.923 1.00 0.00 H new ATOM 0 HA THR B 59 -9.784 -13.183 -7.186 1.00 0.00 H new ATOM 0 HB THR B 59 -6.810 -13.317 -7.842 1.00 0.00 H new ATOM 0 HG1 THR B 59 -7.282 -11.160 -7.922 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.568 -13.637 -10.175 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.140 -14.947 -9.115 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.258 -13.657 -9.618 1.00 0.00 H new ATOM 1789 N LEU B 60 -7.535 -15.277 -5.956 1.00 0.00 N ATOM 1790 CA LEU B 60 -7.336 -16.669 -5.591 1.00 0.00 C ATOM 1791 C LEU B 60 -8.278 -17.086 -4.483 1.00 0.00 C ATOM 1792 O LEU B 60 -8.825 -18.173 -4.514 1.00 0.00 O ATOM 1793 CB LEU B 60 -5.865 -16.993 -5.242 1.00 0.00 C ATOM 1794 CG LEU B 60 -4.885 -17.233 -6.425 1.00 0.00 C ATOM 1795 CD1 LEU B 60 -5.317 -18.428 -7.264 1.00 0.00 C ATOM 1796 CD2 LEU B 60 -4.726 -16.000 -7.304 1.00 0.00 C ATOM 0 H LEU B 60 -6.757 -14.660 -5.723 1.00 0.00 H new ATOM 0 HA LEU B 60 -7.576 -17.260 -6.475 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -5.473 -16.173 -4.641 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -5.856 -17.882 -4.612 1.00 0.00 H new ATOM 0 HG LEU B 60 -3.912 -17.449 -5.983 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -4.613 -18.571 -8.083 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -5.335 -19.322 -6.641 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -6.313 -18.247 -7.669 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -4.032 -16.219 -8.115 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -5.695 -15.722 -7.720 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -4.338 -15.175 -6.707 1.00 0.00 H new ATOM 1808 N ILE B 61 -8.512 -16.201 -3.540 1.00 0.00 N ATOM 1809 CA ILE B 61 -9.431 -16.471 -2.448 1.00 0.00 C ATOM 1810 C ILE B 61 -10.871 -16.624 -2.958 1.00 0.00 C ATOM 1811 O ILE B 61 -11.672 -17.446 -2.453 1.00 0.00 O ATOM 1812 CB ILE B 61 -9.349 -15.357 -1.367 1.00 0.00 C ATOM 1813 CG1 ILE B 61 -8.001 -15.402 -0.656 1.00 0.00 C ATOM 1814 CG2 ILE B 61 -10.484 -15.445 -0.367 1.00 0.00 C ATOM 1815 CD1 ILE B 61 -7.715 -16.710 0.050 1.00 0.00 C ATOM 0 H ILE B 61 -8.076 -15.279 -3.505 1.00 0.00 H new ATOM 0 HA ILE B 61 -9.134 -17.415 -1.991 1.00 0.00 H new ATOM 0 HB ILE B 61 -9.447 -14.400 -1.880 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.212 -15.215 -1.385 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -7.960 -14.592 0.073 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.384 -14.646 0.368 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.436 -15.342 -0.887 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.449 -16.410 0.139 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -6.738 -16.658 0.530 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.480 -16.891 0.805 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.721 -17.524 -0.675 1.00 0.00 H new ATOM 1827 N LEU B 62 -11.223 -15.859 -3.939 1.00 0.00 N ATOM 1828 CA LEU B 62 -12.544 -15.935 -4.466 1.00 0.00 C ATOM 1829 C LEU B 62 -12.714 -17.258 -5.208 1.00 0.00 C ATOM 1830 O LEU B 62 -13.677 -17.956 -4.973 1.00 0.00 O ATOM 1831 CB LEU B 62 -12.858 -14.724 -5.366 1.00 0.00 C ATOM 1832 CG LEU B 62 -14.303 -14.161 -5.296 1.00 0.00 C ATOM 1833 CD1 LEU B 62 -15.341 -15.197 -5.681 1.00 0.00 C ATOM 1834 CD2 LEU B 62 -14.601 -13.614 -3.906 1.00 0.00 C ATOM 0 H LEU B 62 -10.615 -15.176 -4.390 1.00 0.00 H new ATOM 0 HA LEU B 62 -13.261 -15.903 -3.646 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -12.167 -13.921 -5.110 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -12.652 -15.005 -6.399 1.00 0.00 H new ATOM 0 HG LEU B 62 -14.363 -13.349 -6.021 1.00 0.00 H new ATOM 0 HD11 LEU B 62 -16.336 -14.756 -5.617 1.00 0.00 H new ATOM 0 HD12 LEU B 62 -15.158 -15.533 -6.702 1.00 0.00 H new ATOM 0 HD13 LEU B 62 -15.276 -16.047 -5.002 1.00 0.00 H new ATOM 0 HD21 LEU B 62 -15.619 -13.224 -3.879 1.00 0.00 H new ATOM 0 HD22 LEU B 62 -14.498 -14.412 -3.171 1.00 0.00 H new ATOM 0 HD23 LEU B 62 -13.900 -12.813 -3.672 1.00 0.00 H new ATOM 1846 N ASP B 63 -11.717 -17.639 -5.978 1.00 0.00 N ATOM 1847 CA ASP B 63 -11.785 -18.847 -6.822 1.00 0.00 C ATOM 1848 C ASP B 63 -11.581 -20.128 -6.021 1.00 0.00 C ATOM 1849 O ASP B 63 -12.082 -21.164 -6.368 1.00 0.00 O ATOM 1850 CB ASP B 63 -10.704 -18.787 -7.860 1.00 0.00 C ATOM 1851 CG ASP B 63 -10.942 -19.717 -9.041 1.00 0.00 C ATOM 1852 OD1 ASP B 63 -10.604 -20.917 -8.971 1.00 0.00 O ATOM 1853 OD2 ASP B 63 -11.447 -19.240 -10.092 1.00 0.00 O ATOM 0 H ASP B 63 -10.834 -17.133 -6.047 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.779 -18.868 -7.269 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -10.619 -17.764 -8.225 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -9.751 -19.040 -7.395 1.00 0.00 H new ATOM 1858 N ALA B 64 -10.821 -20.057 -4.974 1.00 0.00 N ATOM 1859 CA ALA B 64 -10.533 -21.228 -4.169 1.00 0.00 C ATOM 1860 C ALA B 64 -11.692 -21.575 -3.274 1.00 0.00 C ATOM 1861 O ALA B 64 -11.913 -22.744 -2.955 1.00 0.00 O ATOM 1862 CB ALA B 64 -9.271 -21.027 -3.353 1.00 0.00 C ATOM 0 H ALA B 64 -10.380 -19.198 -4.645 1.00 0.00 H new ATOM 0 HA ALA B 64 -10.372 -22.064 -4.850 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -9.077 -21.919 -2.758 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -8.430 -20.847 -4.022 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.398 -20.170 -2.691 1.00 0.00 H new ATOM 1868 N LEU B 65 -12.437 -20.569 -2.863 1.00 0.00 N ATOM 1869 CA LEU B 65 -13.576 -20.828 -1.998 1.00 0.00 C ATOM 1870 C LEU B 65 -14.881 -20.836 -2.768 1.00 0.00 C ATOM 1871 O LEU B 65 -15.791 -21.563 -2.414 1.00 0.00 O ATOM 1872 CB LEU B 65 -13.664 -19.858 -0.792 1.00 0.00 C ATOM 1873 CG LEU B 65 -12.546 -19.942 0.271 1.00 0.00 C ATOM 1874 CD1 LEU B 65 -11.228 -19.428 -0.246 1.00 0.00 C ATOM 1875 CD2 LEU B 65 -12.948 -19.214 1.537 1.00 0.00 C ATOM 0 H LEU B 65 -12.284 -19.590 -3.104 1.00 0.00 H new ATOM 0 HA LEU B 65 -13.408 -21.825 -1.592 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -13.684 -18.839 -1.180 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -14.618 -20.028 -0.292 1.00 0.00 H new ATOM 0 HG LEU B 65 -12.409 -20.997 0.506 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -10.474 -19.508 0.537 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -10.920 -20.020 -1.108 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -11.335 -18.384 -0.542 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -12.144 -19.288 2.270 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -13.136 -18.165 1.309 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -13.853 -19.665 1.944 1.00 0.00 H new ATOM 1887 N LYS B 66 -14.955 -20.017 -3.826 1.00 0.00 N ATOM 1888 CA LYS B 66 -16.155 -19.871 -4.664 1.00 0.00 C ATOM 1889 C LYS B 66 -17.380 -19.627 -3.848 1.00 0.00 C ATOM 1890 O LYS B 66 -18.225 -20.496 -3.627 1.00 0.00 O ATOM 1891 CB LYS B 66 -16.276 -20.990 -5.668 1.00 0.00 C ATOM 1892 CG LYS B 66 -15.226 -20.863 -6.759 1.00 0.00 C ATOM 1893 CD LYS B 66 -14.951 -22.167 -7.452 1.00 0.00 C ATOM 1894 CE LYS B 66 -14.223 -23.115 -6.519 1.00 0.00 C ATOM 1895 NZ LYS B 66 -13.729 -24.315 -7.225 1.00 0.00 N ATOM 0 H LYS B 66 -14.176 -19.431 -4.128 1.00 0.00 H new ATOM 0 HA LYS B 66 -16.041 -18.969 -5.265 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -16.165 -21.949 -5.163 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -17.271 -20.977 -6.113 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -15.557 -20.129 -7.493 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -14.301 -20.484 -6.325 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -15.888 -22.617 -7.780 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -14.351 -21.993 -8.345 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -13.384 -22.595 -6.056 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -14.893 -23.418 -5.714 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -13.238 -24.936 -6.551 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -14.532 -24.826 -7.645 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -13.069 -24.029 -7.976 1.00 0.00 H new ATOM 1909 N LYS B 67 -17.372 -18.460 -3.300 1.00 0.00 N ATOM 1910 CA LYS B 67 -18.389 -17.997 -2.433 1.00 0.00 C ATOM 1911 C LYS B 67 -19.589 -17.473 -3.199 1.00 0.00 C ATOM 1912 O LYS B 67 -20.591 -18.165 -3.306 1.00 0.00 O ATOM 1913 CB LYS B 67 -17.788 -16.951 -1.534 1.00 0.00 C ATOM 1914 CG LYS B 67 -16.684 -17.504 -0.645 1.00 0.00 C ATOM 1915 CD LYS B 67 -16.057 -16.427 0.202 1.00 0.00 C ATOM 1916 CE LYS B 67 -15.121 -15.517 -0.580 1.00 0.00 C ATOM 1917 NZ LYS B 67 -13.901 -16.236 -1.042 1.00 0.00 N ATOM 0 H LYS B 67 -16.627 -17.780 -3.452 1.00 0.00 H new ATOM 0 HA LYS B 67 -18.768 -18.823 -1.831 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -17.387 -16.141 -2.143 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -18.571 -16.522 -0.909 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -17.092 -18.282 -0.000 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -15.918 -17.972 -1.264 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -16.845 -15.825 0.654 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -15.503 -16.892 1.018 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -15.649 -15.108 -1.442 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -14.830 -14.673 0.045 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -13.252 -15.562 -1.496 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -13.428 -16.677 -0.227 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -14.170 -16.972 -1.726 1.00 0.00 H new ATOM 1931 N ASP B 68 -19.462 -16.282 -3.773 1.00 0.00 N ATOM 1932 CA ASP B 68 -20.549 -15.661 -4.532 1.00 0.00 C ATOM 1933 C ASP B 68 -20.061 -14.358 -5.016 1.00 0.00 C ATOM 1934 O ASP B 68 -19.161 -13.761 -4.393 1.00 0.00 O ATOM 1935 CB ASP B 68 -21.760 -15.411 -3.653 1.00 0.00 C ATOM 1936 CG ASP B 68 -23.052 -15.165 -4.408 1.00 0.00 C ATOM 1937 OD1 ASP B 68 -23.224 -14.086 -4.995 1.00 0.00 O ATOM 1938 OD2 ASP B 68 -23.935 -16.051 -4.386 1.00 0.00 O ATOM 0 H ASP B 68 -18.611 -15.721 -3.728 1.00 0.00 H new ATOM 0 HA ASP B 68 -20.841 -16.323 -5.347 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -21.898 -16.269 -2.995 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -21.558 -14.550 -3.016 1.00 0.00 H new ATOM 1943 N SER B 69 -20.634 -13.892 -6.068 1.00 0.00 N ATOM 1944 CA SER B 69 -20.232 -12.671 -6.642 1.00 0.00 C ATOM 1945 C SER B 69 -20.910 -11.469 -5.958 1.00 0.00 C ATOM 1946 O SER B 69 -20.401 -10.338 -6.003 1.00 0.00 O ATOM 1947 CB SER B 69 -20.470 -12.697 -8.131 1.00 0.00 C ATOM 1948 OG SER B 69 -19.732 -13.757 -8.735 1.00 0.00 O ATOM 0 H SER B 69 -21.401 -14.356 -6.554 1.00 0.00 H new ATOM 0 HA SER B 69 -19.162 -12.545 -6.478 1.00 0.00 H new ATOM 0 HB2 SER B 69 -21.533 -12.825 -8.333 1.00 0.00 H new ATOM 0 HB3 SER B 69 -20.174 -11.744 -8.569 1.00 0.00 H new ATOM 0 HG SER B 69 -19.898 -13.762 -9.701 1.00 0.00 H new ATOM 1954 N SER B 70 -22.010 -11.723 -5.284 1.00 0.00 N ATOM 1955 CA SER B 70 -22.715 -10.695 -4.554 1.00 0.00 C ATOM 1956 C SER B 70 -21.850 -10.252 -3.377 1.00 0.00 C ATOM 1957 O SER B 70 -21.534 -9.075 -3.218 1.00 0.00 O ATOM 1958 CB SER B 70 -24.034 -11.263 -4.058 1.00 0.00 C ATOM 1959 OG SER B 70 -24.752 -11.852 -5.137 1.00 0.00 O ATOM 0 H SER B 70 -22.440 -12.646 -5.227 1.00 0.00 H new ATOM 0 HA SER B 70 -22.917 -9.836 -5.194 1.00 0.00 H new ATOM 0 HB2 SER B 70 -23.849 -12.008 -3.284 1.00 0.00 H new ATOM 0 HB3 SER B 70 -24.631 -10.472 -3.603 1.00 0.00 H new ATOM 0 HG SER B 70 -24.419 -12.760 -5.294 1.00 0.00 H new ATOM 1965 N ARG B 71 -21.375 -11.236 -2.631 1.00 0.00 N ATOM 1966 CA ARG B 71 -20.530 -11.004 -1.471 1.00 0.00 C ATOM 1967 C ARG B 71 -19.087 -10.690 -1.902 1.00 0.00 C ATOM 1968 O ARG B 71 -18.229 -10.431 -1.076 1.00 0.00 O ATOM 1969 CB ARG B 71 -20.641 -12.203 -0.507 1.00 0.00 C ATOM 1970 CG ARG B 71 -20.082 -13.509 -1.037 1.00 0.00 C ATOM 1971 CD ARG B 71 -18.651 -13.709 -0.594 1.00 0.00 C ATOM 1972 NE ARG B 71 -18.562 -14.066 0.824 1.00 0.00 N ATOM 1973 CZ ARG B 71 -18.091 -13.279 1.797 1.00 0.00 C ATOM 1974 NH1 ARG B 71 -17.867 -11.993 1.571 1.00 0.00 N ATOM 1975 NH2 ARG B 71 -17.896 -13.769 3.004 1.00 0.00 N ATOM 0 H ARG B 71 -21.565 -12.221 -2.814 1.00 0.00 H new ATOM 0 HA ARG B 71 -20.872 -10.124 -0.927 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -20.123 -11.954 0.419 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -21.691 -12.351 -0.255 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -20.694 -14.339 -0.685 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -20.133 -13.515 -2.126 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -18.191 -14.493 -1.195 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -18.084 -12.796 -0.774 1.00 0.00 H new ATOM 0 HE ARG B 71 -18.887 -14.995 1.092 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -18.054 -11.597 0.650 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -17.508 -11.399 2.318 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -18.104 -14.749 3.196 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -17.537 -13.169 3.746 1.00 0.00 H new ATOM 1989 N HIS B 72 -18.847 -10.761 -3.206 1.00 0.00 N ATOM 1990 CA HIS B 72 -17.601 -10.326 -3.831 1.00 0.00 C ATOM 1991 C HIS B 72 -17.687 -8.814 -4.078 1.00 0.00 C ATOM 1992 O HIS B 72 -16.698 -8.089 -3.987 1.00 0.00 O ATOM 1993 CB HIS B 72 -17.388 -11.091 -5.168 1.00 0.00 C ATOM 1994 CG HIS B 72 -16.228 -10.634 -6.029 1.00 0.00 C ATOM 1995 ND1 HIS B 72 -16.245 -10.657 -7.411 1.00 0.00 N ATOM 1996 CD2 HIS B 72 -15.012 -10.146 -5.684 1.00 0.00 C ATOM 1997 CE1 HIS B 72 -15.079 -10.191 -7.849 1.00 0.00 C ATOM 1998 NE2 HIS B 72 -14.289 -9.863 -6.840 1.00 0.00 N ATOM 0 H HIS B 72 -19.525 -11.130 -3.873 1.00 0.00 H new ATOM 0 HA HIS B 72 -16.753 -10.541 -3.180 1.00 0.00 H new ATOM 0 HB2 HIS B 72 -17.248 -12.147 -4.938 1.00 0.00 H new ATOM 0 HB3 HIS B 72 -18.302 -11.011 -5.756 1.00 0.00 H new ATOM 0 HD1 HIS B 72 -17.018 -10.976 -7.994 1.00 0.00 H new ATOM 0 HD2 HIS B 72 -14.660 -10.000 -4.674 1.00 0.00 H new ATOM 0 HE1 HIS B 72 -14.812 -10.093 -8.891 1.00 0.00 H new ATOM 2006 N SER B 73 -18.890 -8.345 -4.326 1.00 0.00 N ATOM 2007 CA SER B 73 -19.131 -6.937 -4.584 1.00 0.00 C ATOM 2008 C SER B 73 -19.343 -6.190 -3.255 1.00 0.00 C ATOM 2009 O SER B 73 -19.453 -4.975 -3.196 1.00 0.00 O ATOM 2010 CB SER B 73 -20.331 -6.800 -5.512 1.00 0.00 C ATOM 2011 OG SER B 73 -20.148 -7.603 -6.690 1.00 0.00 O ATOM 0 H SER B 73 -19.729 -8.925 -4.355 1.00 0.00 H new ATOM 0 HA SER B 73 -18.267 -6.488 -5.075 1.00 0.00 H new ATOM 0 HB2 SER B 73 -21.238 -7.108 -4.992 1.00 0.00 H new ATOM 0 HB3 SER B 73 -20.464 -5.755 -5.793 1.00 0.00 H new ATOM 0 HG SER B 73 -20.249 -8.550 -6.459 1.00 0.00 H new ATOM 2017 N LYS B 74 -19.362 -6.962 -2.207 1.00 0.00 N ATOM 2018 CA LYS B 74 -19.494 -6.485 -0.842 1.00 0.00 C ATOM 2019 C LYS B 74 -18.242 -6.936 -0.083 1.00 0.00 C ATOM 2020 O LYS B 74 -18.179 -6.988 1.150 1.00 0.00 O ATOM 2021 CB LYS B 74 -20.797 -7.060 -0.228 1.00 0.00 C ATOM 2022 CG LYS B 74 -21.122 -6.700 1.242 1.00 0.00 C ATOM 2023 CD LYS B 74 -21.267 -5.200 1.511 1.00 0.00 C ATOM 2024 CE LYS B 74 -19.930 -4.559 1.880 1.00 0.00 C ATOM 2025 NZ LYS B 74 -19.324 -5.203 3.082 1.00 0.00 N ATOM 0 H LYS B 74 -19.284 -7.977 -2.271 1.00 0.00 H new ATOM 0 HA LYS B 74 -19.568 -5.399 -0.789 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -21.632 -6.731 -0.846 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -20.753 -8.146 -0.305 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -22.048 -7.199 1.529 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -20.334 -7.097 1.883 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -21.674 -4.710 0.627 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -21.981 -5.043 2.319 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -19.243 -4.640 1.038 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -20.076 -3.496 2.071 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -18.927 -4.471 3.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -20.055 -5.736 3.596 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -18.568 -5.852 2.784 1.00 0.00 H new ATOM 2039 N LEU B 75 -17.234 -7.195 -0.838 1.00 0.00 N ATOM 2040 CA LEU B 75 -15.999 -7.660 -0.312 1.00 0.00 C ATOM 2041 C LEU B 75 -15.078 -6.487 -0.226 1.00 0.00 C ATOM 2042 O LEU B 75 -14.518 -6.027 -1.236 1.00 0.00 O ATOM 2043 CB LEU B 75 -15.431 -8.754 -1.200 1.00 0.00 C ATOM 2044 CG LEU B 75 -14.555 -9.801 -0.541 1.00 0.00 C ATOM 2045 CD1 LEU B 75 -15.290 -10.469 0.588 1.00 0.00 C ATOM 2046 CD2 LEU B 75 -14.115 -10.826 -1.562 1.00 0.00 C ATOM 0 H LEU B 75 -17.243 -7.089 -1.852 1.00 0.00 H new ATOM 0 HA LEU B 75 -16.133 -8.094 0.679 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -16.265 -9.266 -1.680 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -14.851 -8.279 -1.991 1.00 0.00 H new ATOM 0 HG LEU B 75 -13.672 -9.310 -0.132 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -14.646 -11.218 1.049 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -15.570 -9.723 1.332 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -16.188 -10.951 0.202 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -13.486 -11.574 -1.079 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -14.991 -11.311 -1.991 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -13.550 -10.333 -2.353 1.00 0.00 H new ATOM 2058 N GLU B 76 -15.012 -5.957 0.946 1.00 0.00 N ATOM 2059 CA GLU B 76 -14.213 -4.803 1.244 1.00 0.00 C ATOM 2060 C GLU B 76 -12.825 -5.280 1.579 1.00 0.00 C ATOM 2061 O GLU B 76 -12.658 -6.454 1.871 1.00 0.00 O ATOM 2062 CB GLU B 76 -14.816 -4.106 2.450 1.00 0.00 C ATOM 2063 CG GLU B 76 -16.293 -3.780 2.286 1.00 0.00 C ATOM 2064 CD GLU B 76 -16.858 -3.048 3.465 1.00 0.00 C ATOM 2065 OE1 GLU B 76 -16.709 -1.820 3.557 1.00 0.00 O ATOM 2066 OE2 GLU B 76 -17.502 -3.692 4.303 1.00 0.00 O ATOM 0 H GLU B 76 -15.524 -6.319 1.751 1.00 0.00 H new ATOM 0 HA GLU B 76 -14.180 -4.113 0.401 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -14.687 -4.739 3.328 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -14.267 -3.183 2.639 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -16.430 -3.176 1.389 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -16.851 -4.705 2.136 1.00 0.00 H new ATOM 2073 N LYS B 77 -11.843 -4.388 1.564 1.00 0.00 N ATOM 2074 CA LYS B 77 -10.457 -4.742 1.893 1.00 0.00 C ATOM 2075 C LYS B 77 -10.368 -5.488 3.215 1.00 0.00 C ATOM 2076 O LYS B 77 -9.697 -6.499 3.320 1.00 0.00 O ATOM 2077 CB LYS B 77 -9.585 -3.493 1.897 1.00 0.00 C ATOM 2078 CG LYS B 77 -8.179 -3.695 2.453 1.00 0.00 C ATOM 2079 CD LYS B 77 -7.193 -2.675 1.905 1.00 0.00 C ATOM 2080 CE LYS B 77 -7.714 -1.278 2.082 1.00 0.00 C ATOM 2081 NZ LYS B 77 -6.756 -0.253 1.626 1.00 0.00 N ATOM 0 H LYS B 77 -11.977 -3.405 1.326 1.00 0.00 H new ATOM 0 HA LYS B 77 -10.085 -5.419 1.124 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -9.506 -3.119 0.876 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -10.084 -2.721 2.482 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -8.206 -3.624 3.540 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -7.834 -4.700 2.208 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -6.236 -2.778 2.416 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -7.013 -2.869 0.848 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -8.647 -1.169 1.529 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -7.946 -1.111 3.134 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -7.164 0.693 1.770 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -5.874 -0.336 2.170 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -6.554 -0.392 0.615 1.00 0.00 H new ATOM 2095 N ALA B 78 -11.121 -5.015 4.177 1.00 0.00 N ATOM 2096 CA ALA B 78 -11.199 -5.620 5.503 1.00 0.00 C ATOM 2097 C ALA B 78 -11.671 -7.072 5.429 1.00 0.00 C ATOM 2098 O ALA B 78 -11.153 -7.952 6.122 1.00 0.00 O ATOM 2099 CB ALA B 78 -12.171 -4.829 6.333 1.00 0.00 C ATOM 0 H ALA B 78 -11.709 -4.188 4.069 1.00 0.00 H new ATOM 0 HA ALA B 78 -10.205 -5.610 5.949 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.241 -5.268 7.328 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -11.825 -3.799 6.415 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -13.152 -4.846 5.859 1.00 0.00 H new ATOM 2105 N ASP B 79 -12.595 -7.308 4.526 1.00 0.00 N ATOM 2106 CA ASP B 79 -13.235 -8.611 4.365 1.00 0.00 C ATOM 2107 C ASP B 79 -12.309 -9.547 3.673 1.00 0.00 C ATOM 2108 O ASP B 79 -12.063 -10.657 4.125 1.00 0.00 O ATOM 2109 CB ASP B 79 -14.537 -8.487 3.565 1.00 0.00 C ATOM 2110 CG ASP B 79 -15.704 -8.021 4.395 1.00 0.00 C ATOM 2111 OD1 ASP B 79 -16.311 -8.848 5.091 1.00 0.00 O ATOM 2112 OD2 ASP B 79 -16.026 -6.822 4.390 1.00 0.00 O ATOM 0 H ASP B 79 -12.932 -6.601 3.873 1.00 0.00 H new ATOM 0 HA ASP B 79 -13.474 -8.999 5.355 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -14.384 -7.789 2.741 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -14.777 -9.454 3.123 1.00 0.00 H new ATOM 2117 N ILE B 80 -11.799 -9.072 2.572 1.00 0.00 N ATOM 2118 CA ILE B 80 -10.838 -9.769 1.747 1.00 0.00 C ATOM 2119 C ILE B 80 -9.645 -10.259 2.594 1.00 0.00 C ATOM 2120 O ILE B 80 -9.294 -11.437 2.546 1.00 0.00 O ATOM 2121 CB ILE B 80 -10.372 -8.819 0.614 1.00 0.00 C ATOM 2122 CG1 ILE B 80 -11.584 -8.400 -0.215 1.00 0.00 C ATOM 2123 CG2 ILE B 80 -9.344 -9.488 -0.264 1.00 0.00 C ATOM 2124 CD1 ILE B 80 -11.368 -7.227 -1.117 1.00 0.00 C ATOM 0 H ILE B 80 -12.047 -8.153 2.206 1.00 0.00 H new ATOM 0 HA ILE B 80 -11.302 -10.651 1.306 1.00 0.00 H new ATOM 0 HB ILE B 80 -9.907 -7.939 1.058 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -11.900 -9.249 -0.821 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -12.405 -8.169 0.464 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -9.034 -8.800 -1.051 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -8.478 -9.766 0.337 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -9.776 -10.382 -0.714 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -12.288 -7.011 -1.660 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -11.085 -6.358 -0.523 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -10.573 -7.455 -1.827 1.00 0.00 H new ATOM 2136 N LEU B 81 -9.084 -9.367 3.404 1.00 0.00 N ATOM 2137 CA LEU B 81 -7.967 -9.701 4.305 1.00 0.00 C ATOM 2138 C LEU B 81 -8.321 -10.868 5.223 1.00 0.00 C ATOM 2139 O LEU B 81 -7.626 -11.889 5.239 1.00 0.00 O ATOM 2140 CB LEU B 81 -7.598 -8.480 5.154 1.00 0.00 C ATOM 2141 CG LEU B 81 -6.520 -7.514 4.626 1.00 0.00 C ATOM 2142 CD1 LEU B 81 -6.693 -7.195 3.144 1.00 0.00 C ATOM 2143 CD2 LEU B 81 -6.580 -6.232 5.437 1.00 0.00 C ATOM 0 H LEU B 81 -9.384 -8.394 3.461 1.00 0.00 H new ATOM 0 HA LEU B 81 -7.118 -9.995 3.688 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.508 -7.903 5.317 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -7.270 -8.841 6.129 1.00 0.00 H new ATOM 0 HG LEU B 81 -5.550 -7.999 4.733 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -5.907 -6.511 2.825 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -6.630 -8.116 2.564 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -7.666 -6.731 2.983 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -5.822 -5.537 5.075 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -7.567 -5.781 5.332 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.394 -6.457 6.487 1.00 0.00 H new ATOM 2155 N GLU B 82 -9.438 -10.741 5.925 1.00 0.00 N ATOM 2156 CA GLU B 82 -9.914 -11.771 6.844 1.00 0.00 C ATOM 2157 C GLU B 82 -10.183 -13.085 6.136 1.00 0.00 C ATOM 2158 O GLU B 82 -9.809 -14.143 6.633 1.00 0.00 O ATOM 2159 CB GLU B 82 -11.158 -11.276 7.615 1.00 0.00 C ATOM 2160 CG GLU B 82 -12.135 -12.351 8.041 1.00 0.00 C ATOM 2161 CD GLU B 82 -13.327 -11.808 8.790 1.00 0.00 C ATOM 2162 OE1 GLU B 82 -14.071 -10.959 8.241 1.00 0.00 O ATOM 2163 OE2 GLU B 82 -13.538 -12.200 9.944 1.00 0.00 O ATOM 0 H GLU B 82 -10.042 -9.921 5.875 1.00 0.00 H new ATOM 0 HA GLU B 82 -9.120 -11.964 7.566 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -10.823 -10.742 8.504 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -11.687 -10.556 6.991 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -12.482 -12.888 7.158 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -11.617 -13.075 8.671 1.00 0.00 H new ATOM 2170 N MET B 83 -10.729 -13.009 4.948 1.00 0.00 N ATOM 2171 CA MET B 83 -11.155 -14.185 4.227 1.00 0.00 C ATOM 2172 C MET B 83 -9.949 -15.021 3.829 1.00 0.00 C ATOM 2173 O MET B 83 -10.011 -16.249 3.769 1.00 0.00 O ATOM 2174 CB MET B 83 -11.960 -13.779 2.993 1.00 0.00 C ATOM 2175 CG MET B 83 -12.595 -14.933 2.225 1.00 0.00 C ATOM 2176 SD MET B 83 -14.202 -15.525 2.849 1.00 0.00 S ATOM 2177 CE MET B 83 -13.837 -16.151 4.497 1.00 0.00 C ATOM 0 H MET B 83 -10.891 -12.132 4.453 1.00 0.00 H new ATOM 0 HA MET B 83 -11.793 -14.787 4.874 1.00 0.00 H new ATOM 0 HB2 MET B 83 -12.748 -13.092 3.302 1.00 0.00 H new ATOM 0 HB3 MET B 83 -11.306 -13.229 2.316 1.00 0.00 H new ATOM 0 HG2 MET B 83 -12.722 -14.625 1.187 1.00 0.00 H new ATOM 0 HG3 MET B 83 -11.897 -15.770 2.226 1.00 0.00 H new ATOM 0 HE1 MET B 83 -14.569 -16.913 4.767 1.00 0.00 H new ATOM 0 HE2 MET B 83 -12.838 -16.587 4.508 1.00 0.00 H new ATOM 0 HE3 MET B 83 -13.883 -15.333 5.216 1.00 0.00 H new ATOM 2187 N THR B 84 -8.858 -14.347 3.621 1.00 0.00 N ATOM 2188 CA THR B 84 -7.620 -14.956 3.227 1.00 0.00 C ATOM 2189 C THR B 84 -6.945 -15.617 4.440 1.00 0.00 C ATOM 2190 O THR B 84 -6.432 -16.732 4.350 1.00 0.00 O ATOM 2191 CB THR B 84 -6.730 -13.876 2.616 1.00 0.00 C ATOM 2192 OG1 THR B 84 -7.537 -13.170 1.684 1.00 0.00 O ATOM 2193 CG2 THR B 84 -5.566 -14.469 1.849 1.00 0.00 C ATOM 0 H THR B 84 -8.801 -13.334 3.723 1.00 0.00 H new ATOM 0 HA THR B 84 -7.797 -15.738 2.488 1.00 0.00 H new ATOM 0 HB THR B 84 -6.331 -13.248 3.412 1.00 0.00 H new ATOM 0 HG1 THR B 84 -7.974 -12.417 2.134 1.00 0.00 H new ATOM 0 HG21 THR B 84 -4.959 -13.666 1.431 1.00 0.00 H new ATOM 0 HG22 THR B 84 -4.957 -15.072 2.522 1.00 0.00 H new ATOM 0 HG23 THR B 84 -5.944 -15.096 1.041 1.00 0.00 H new ATOM 2201 N VAL B 85 -7.008 -14.948 5.583 1.00 0.00 N ATOM 2202 CA VAL B 85 -6.446 -15.483 6.825 1.00 0.00 C ATOM 2203 C VAL B 85 -7.263 -16.705 7.257 1.00 0.00 C ATOM 2204 O VAL B 85 -6.727 -17.712 7.740 1.00 0.00 O ATOM 2205 CB VAL B 85 -6.494 -14.428 7.956 1.00 0.00 C ATOM 2206 CG1 VAL B 85 -5.874 -14.928 9.258 1.00 0.00 C ATOM 2207 CG2 VAL B 85 -5.850 -13.151 7.527 1.00 0.00 C ATOM 0 H VAL B 85 -7.443 -14.031 5.680 1.00 0.00 H new ATOM 0 HA VAL B 85 -5.406 -15.757 6.644 1.00 0.00 H new ATOM 0 HB VAL B 85 -7.549 -14.241 8.157 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -5.936 -14.146 10.015 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -6.414 -15.810 9.603 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -4.829 -15.186 9.088 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -5.898 -12.428 8.341 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -4.808 -13.338 7.269 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -6.374 -12.754 6.657 1.00 0.00 H new ATOM 2217 N LYS B 86 -8.562 -16.619 7.056 1.00 0.00 N ATOM 2218 CA LYS B 86 -9.449 -17.704 7.385 1.00 0.00 C ATOM 2219 C LYS B 86 -9.220 -18.904 6.458 1.00 0.00 C ATOM 2220 O LYS B 86 -9.256 -20.057 6.890 1.00 0.00 O ATOM 2221 CB LYS B 86 -10.908 -17.246 7.404 1.00 0.00 C ATOM 2222 CG LYS B 86 -11.175 -16.149 8.436 1.00 0.00 C ATOM 2223 CD LYS B 86 -12.649 -16.014 8.749 1.00 0.00 C ATOM 2224 CE LYS B 86 -12.855 -15.237 10.037 1.00 0.00 C ATOM 2225 NZ LYS B 86 -14.278 -14.945 10.289 1.00 0.00 N ATOM 0 H LYS B 86 -9.025 -15.800 6.663 1.00 0.00 H new ATOM 0 HA LYS B 86 -9.217 -18.038 8.396 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.182 -16.881 6.414 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -11.549 -18.101 7.617 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -10.628 -16.372 9.352 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -10.795 -15.198 8.062 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -13.155 -15.507 7.928 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -13.099 -17.003 8.839 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -12.449 -15.808 10.872 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -12.297 -14.302 9.989 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -14.437 -13.919 10.234 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -14.863 -15.425 9.575 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -14.540 -15.286 11.236 1.00 0.00 H new ATOM 2239 N HIS B 87 -8.912 -18.625 5.204 1.00 0.00 N ATOM 2240 CA HIS B 87 -8.587 -19.673 4.235 1.00 0.00 C ATOM 2241 C HIS B 87 -7.252 -20.336 4.610 1.00 0.00 C ATOM 2242 O HIS B 87 -7.033 -21.523 4.332 1.00 0.00 O ATOM 2243 CB HIS B 87 -8.554 -19.098 2.804 1.00 0.00 C ATOM 2244 CG HIS B 87 -8.282 -20.098 1.694 1.00 0.00 C ATOM 2245 ND1 HIS B 87 -9.060 -21.208 1.432 1.00 0.00 N ATOM 2246 CD2 HIS B 87 -7.314 -20.105 0.749 1.00 0.00 C ATOM 2247 CE1 HIS B 87 -8.557 -21.828 0.365 1.00 0.00 C ATOM 2248 NE2 HIS B 87 -7.498 -21.201 -0.094 1.00 0.00 N ATOM 0 H HIS B 87 -8.878 -17.679 4.825 1.00 0.00 H new ATOM 0 HA HIS B 87 -9.364 -20.437 4.260 1.00 0.00 H new ATOM 0 HB2 HIS B 87 -9.511 -18.615 2.605 1.00 0.00 H new ATOM 0 HB3 HIS B 87 -7.790 -18.322 2.763 1.00 0.00 H new ATOM 0 HD2 HIS B 87 -6.522 -19.376 0.661 1.00 0.00 H new ATOM 0 HE1 HIS B 87 -8.967 -22.729 -0.066 1.00 0.00 H new ATOM 0 HE2 HIS B 87 -6.929 -21.461 -0.899 1.00 0.00 H new ATOM 2256 N LEU B 88 -6.394 -19.581 5.300 1.00 0.00 N ATOM 2257 CA LEU B 88 -5.110 -20.072 5.733 1.00 0.00 C ATOM 2258 C LEU B 88 -5.324 -21.153 6.744 1.00 0.00 C ATOM 2259 O LEU B 88 -4.691 -22.194 6.683 1.00 0.00 O ATOM 2260 CB LEU B 88 -4.277 -18.929 6.333 1.00 0.00 C ATOM 2261 CG LEU B 88 -3.006 -19.318 7.098 1.00 0.00 C ATOM 2262 CD1 LEU B 88 -2.025 -20.063 6.219 1.00 0.00 C ATOM 2263 CD2 LEU B 88 -2.366 -18.093 7.713 1.00 0.00 C ATOM 0 H LEU B 88 -6.582 -18.615 5.568 1.00 0.00 H new ATOM 0 HA LEU B 88 -4.563 -20.475 4.881 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.992 -18.257 5.524 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -4.918 -18.362 7.008 1.00 0.00 H new ATOM 0 HG LEU B 88 -3.295 -19.998 7.899 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.139 -20.320 6.799 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -2.491 -20.975 5.845 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -1.738 -19.432 5.378 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -1.465 -18.385 8.253 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -2.104 -17.385 6.926 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -3.067 -17.624 8.404 1.00 0.00 H new ATOM 2275 N ARG B 89 -6.266 -20.917 7.643 1.00 0.00 N ATOM 2276 CA ARG B 89 -6.592 -21.887 8.689 1.00 0.00 C ATOM 2277 C ARG B 89 -7.037 -23.174 8.032 1.00 0.00 C ATOM 2278 O ARG B 89 -6.565 -24.260 8.363 1.00 0.00 O ATOM 2279 CB ARG B 89 -7.750 -21.410 9.567 1.00 0.00 C ATOM 2280 CG ARG B 89 -7.724 -19.955 9.988 1.00 0.00 C ATOM 2281 CD ARG B 89 -6.404 -19.521 10.559 1.00 0.00 C ATOM 2282 NE ARG B 89 -6.548 -18.236 11.248 1.00 0.00 N ATOM 2283 CZ ARG B 89 -6.013 -17.933 12.444 1.00 0.00 C ATOM 2284 NH1 ARG B 89 -5.232 -18.804 13.075 1.00 0.00 N ATOM 2285 NH2 ARG B 89 -6.287 -16.766 13.014 1.00 0.00 N ATOM 0 H ARG B 89 -6.822 -20.062 7.674 1.00 0.00 H new ATOM 0 HA ARG B 89 -5.703 -22.019 9.306 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -8.682 -21.594 9.032 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -7.772 -22.025 10.467 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -7.961 -19.331 9.126 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -8.505 -19.785 10.729 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -6.035 -20.275 11.254 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -5.666 -19.434 9.762 1.00 0.00 H new ATOM 0 HE ARG B 89 -7.098 -17.513 10.783 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -5.034 -19.711 12.652 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -4.831 -18.565 13.982 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -6.902 -16.101 12.545 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -5.882 -16.534 13.921 1.00 0.00 H new ATOM 2299 N ASN B 90 -7.912 -23.015 7.054 1.00 0.00 N ATOM 2300 CA ASN B 90 -8.503 -24.124 6.327 1.00 0.00 C ATOM 2301 C ASN B 90 -7.444 -24.978 5.669 1.00 0.00 C ATOM 2302 O ASN B 90 -7.419 -26.189 5.861 1.00 0.00 O ATOM 2303 CB ASN B 90 -9.507 -23.645 5.272 1.00 0.00 C ATOM 2304 CG ASN B 90 -10.723 -22.915 5.850 1.00 0.00 C ATOM 2305 OD1 ASN B 90 -11.111 -23.139 6.994 1.00 0.00 O ATOM 2306 ND2 ASN B 90 -11.378 -22.103 5.050 1.00 0.00 N ATOM 0 H ASN B 90 -8.236 -22.100 6.739 1.00 0.00 H new ATOM 0 HA ASN B 90 -9.037 -24.727 7.061 1.00 0.00 H new ATOM 0 HB2 ASN B 90 -8.996 -22.981 4.575 1.00 0.00 H new ATOM 0 HB3 ASN B 90 -9.852 -24.505 4.698 1.00 0.00 H new ATOM 0 HD21 ASN B 90 -12.228 -21.643 5.375 1.00 0.00 H new ATOM 0 HD22 ASN B 90 -11.036 -21.933 4.104 1.00 0.00 H new ATOM 2313 N LEU B 91 -6.547 -24.356 4.930 1.00 0.00 N ATOM 2314 CA LEU B 91 -5.497 -25.089 4.228 1.00 0.00 C ATOM 2315 C LEU B 91 -4.451 -25.621 5.175 1.00 0.00 C ATOM 2316 O LEU B 91 -3.827 -26.625 4.891 1.00 0.00 O ATOM 2317 CB LEU B 91 -4.842 -24.217 3.187 1.00 0.00 C ATOM 2318 CG LEU B 91 -5.738 -23.657 2.102 1.00 0.00 C ATOM 2319 CD1 LEU B 91 -4.929 -22.730 1.229 1.00 0.00 C ATOM 2320 CD2 LEU B 91 -6.349 -24.773 1.270 1.00 0.00 C ATOM 0 H LEU B 91 -6.519 -23.345 4.796 1.00 0.00 H new ATOM 0 HA LEU B 91 -5.975 -25.938 3.740 1.00 0.00 H new ATOM 0 HB2 LEU B 91 -4.363 -23.381 3.697 1.00 0.00 H new ATOM 0 HB3 LEU B 91 -4.051 -24.795 2.709 1.00 0.00 H new ATOM 0 HG LEU B 91 -6.557 -23.105 2.564 1.00 0.00 H new ATOM 0 HD11 LEU B 91 -5.566 -22.321 0.444 1.00 0.00 H new ATOM 0 HD12 LEU B 91 -4.531 -21.915 1.834 1.00 0.00 H new ATOM 0 HD13 LEU B 91 -4.105 -23.282 0.777 1.00 0.00 H new ATOM 0 HD21 LEU B 91 -6.988 -24.344 0.498 1.00 0.00 H new ATOM 0 HD22 LEU B 91 -5.555 -25.354 0.802 1.00 0.00 H new ATOM 0 HD23 LEU B 91 -6.943 -25.423 1.913 1.00 0.00 H new ATOM 2332 N GLN B 92 -4.271 -24.964 6.292 1.00 0.00 N ATOM 2333 CA GLN B 92 -3.314 -25.407 7.283 1.00 0.00 C ATOM 2334 C GLN B 92 -3.758 -26.688 7.985 1.00 0.00 C ATOM 2335 O GLN B 92 -2.921 -27.506 8.387 1.00 0.00 O ATOM 2336 CB GLN B 92 -2.995 -24.294 8.283 1.00 0.00 C ATOM 2337 CG GLN B 92 -1.926 -23.340 7.826 1.00 0.00 C ATOM 2338 CD GLN B 92 -0.579 -24.004 7.815 1.00 0.00 C ATOM 2339 OE1 GLN B 92 -0.315 -24.923 8.601 1.00 0.00 O ATOM 2340 NE2 GLN B 92 0.284 -23.566 6.973 1.00 0.00 N ATOM 0 H GLN B 92 -4.777 -24.114 6.542 1.00 0.00 H new ATOM 0 HA GLN B 92 -2.393 -25.648 6.752 1.00 0.00 H new ATOM 0 HB2 GLN B 92 -3.906 -23.731 8.485 1.00 0.00 H new ATOM 0 HB3 GLN B 92 -2.684 -24.746 9.225 1.00 0.00 H new ATOM 0 HG2 GLN B 92 -2.163 -22.975 6.827 1.00 0.00 H new ATOM 0 HG3 GLN B 92 -1.902 -22.472 8.485 1.00 0.00 H new ATOM 0 HE21 GLN B 92 0.037 -22.807 6.338 1.00 0.00 H new ATOM 0 HE22 GLN B 92 1.217 -23.977 6.939 1.00 0.00 H new ATOM 2349 N ARG B 93 -5.050 -26.898 8.096 1.00 0.00 N ATOM 2350 CA ARG B 93 -5.541 -28.096 8.773 1.00 0.00 C ATOM 2351 C ARG B 93 -6.356 -29.009 7.859 1.00 0.00 C ATOM 2352 O ARG B 93 -7.027 -29.929 8.329 1.00 0.00 O ATOM 2353 CB ARG B 93 -6.275 -27.759 10.098 1.00 0.00 C ATOM 2354 CG ARG B 93 -7.409 -26.739 10.016 1.00 0.00 C ATOM 2355 CD ARG B 93 -8.597 -27.231 9.208 1.00 0.00 C ATOM 2356 NE ARG B 93 -9.692 -26.265 9.205 1.00 0.00 N ATOM 2357 CZ ARG B 93 -10.932 -26.500 8.763 1.00 0.00 C ATOM 2358 NH1 ARG B 93 -11.246 -27.669 8.208 1.00 0.00 N ATOM 2359 NH2 ARG B 93 -11.845 -25.554 8.865 1.00 0.00 N ATOM 0 H ARG B 93 -5.774 -26.275 7.738 1.00 0.00 H new ATOM 0 HA ARG B 93 -4.659 -28.674 9.047 1.00 0.00 H new ATOM 0 HB2 ARG B 93 -6.679 -28.685 10.507 1.00 0.00 H new ATOM 0 HB3 ARG B 93 -5.537 -27.391 10.811 1.00 0.00 H new ATOM 0 HG2 ARG B 93 -7.741 -26.492 11.024 1.00 0.00 H new ATOM 0 HG3 ARG B 93 -7.030 -25.819 9.571 1.00 0.00 H new ATOM 0 HD2 ARG B 93 -8.283 -27.426 8.183 1.00 0.00 H new ATOM 0 HD3 ARG B 93 -8.949 -28.177 9.619 1.00 0.00 H new ATOM 0 HE ARG B 93 -9.495 -25.333 9.570 1.00 0.00 H new ATOM 0 HH11 ARG B 93 -10.537 -28.397 8.116 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -12.195 -27.837 7.875 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -11.602 -24.653 9.278 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -12.794 -25.723 8.531 1.00 0.00 H new ATOM 2373 N ALA B 94 -6.279 -28.755 6.553 1.00 0.00 N ATOM 2374 CA ALA B 94 -6.985 -29.556 5.528 1.00 0.00 C ATOM 2375 C ALA B 94 -6.572 -31.008 5.626 1.00 0.00 C ATOM 2376 O ALA B 94 -7.374 -31.930 5.489 1.00 0.00 O ATOM 2377 CB ALA B 94 -6.645 -29.027 4.154 1.00 0.00 C ATOM 0 H ALA B 94 -5.727 -27.989 6.166 1.00 0.00 H new ATOM 0 HA ALA B 94 -8.059 -29.480 5.695 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -7.164 -29.616 3.398 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -6.956 -27.985 4.078 1.00 0.00 H new ATOM 0 HB3 ALA B 94 -5.569 -29.098 3.993 1.00 0.00 H new ATOM 2383 N GLN B 95 -5.323 -31.169 5.853 1.00 0.00 N ATOM 2384 CA GLN B 95 -4.717 -32.425 6.077 1.00 0.00 C ATOM 2385 C GLN B 95 -4.657 -32.665 7.570 1.00 0.00 C ATOM 2386 O GLN B 95 -4.019 -31.864 8.279 1.00 0.00 O ATOM 2387 CB GLN B 95 -3.320 -32.532 5.414 1.00 0.00 C ATOM 2388 CG GLN B 95 -2.320 -31.399 5.709 1.00 0.00 C ATOM 2389 CD GLN B 95 -2.542 -30.125 4.904 1.00 0.00 C ATOM 2390 OE1 GLN B 95 -2.035 -29.994 3.799 1.00 0.00 O ATOM 2391 NE2 GLN B 95 -3.212 -29.147 5.476 1.00 0.00 N ATOM 0 H GLN B 95 -4.664 -30.391 5.889 1.00 0.00 H new ATOM 0 HA GLN B 95 -5.319 -33.203 5.607 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -2.868 -33.473 5.726 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -3.460 -32.588 4.335 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -2.372 -31.155 6.770 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -1.311 -31.764 5.514 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -3.625 -29.283 6.399 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -3.318 -28.253 4.997 1.00 0.00 H new