USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=31 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+ 168:sc=-0.00907 (180deg=-0.164) USER MOD Set 1.2: B 72 HIS : no HD1:sc= -0.149 K(o=-0.16,f=-2!) USER MOD Set 2.1: A 92 GLN : amide:sc= -1.11 K(o=-3.7,f=-8!) USER MOD Set 2.2: B 87 HIS : no HE2:sc= -2.62 K(o=-3.7,f=-5.5!) USER MOD Single : A 42 MET CE :methyl -168:sc= -0.0131 (180deg=-0.201) USER MOD Single : A 44 LYS NZ :NH3+ -170:sc= -0.0197 (180deg=-0.142) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 53 SER OG : rot 83:sc= 1.24 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0.696 K(o=0.7,f=-4.3!) USER MOD Single : A 58 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0308) USER MOD Single : A 59 THR OG1 : rot 95:sc= 1.26 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 159:sc= 0.175 (180deg=-0.0939) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HE2:sc= -13.7! C(o=-14!,f=-19!) USER MOD Single : A 73 SER OG : rot 66:sc= 1.29 USER MOD Single : A 74 LYS NZ :NH3+ -155:sc= 1.72 (180deg=1.07) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -129:sc= -2.68! (180deg=-3.15) USER MOD Single : A 84 THR OG1 : rot 91:sc= -0.249 USER MOD Single : A 86 LYS NZ :NH3+ 143:sc= 1.29 (180deg=0.854) USER MOD Single : A 87 HIS : no HD1:sc= -3.1! K(o=-3.1!,f=-4.1) USER MOD Single : A 90 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.74) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 ASN : amide:sc= 0.742 K(o=0.74,f=-0.18) USER MOD Single : B 53 SER OG : rot -88:sc= 1.25 USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 56 GLN : amide:sc= 0.784 K(o=0.78,f=-4.3!) USER MOD Single : B 59 THR OG1 : rot 86:sc= 1.22 USER MOD Single : B 66 LYS NZ :NH3+ -174:sc= 1.25 (180deg=1.14) USER MOD Single : B 67 LYS NZ :NH3+ -168:sc= -0.0077 (180deg=-0.158) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 SER OG : rot 180:sc= 0 USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 74 LYS NZ :NH3+ -170:sc= 0.526 (180deg=0.389) USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 MET CE :methyl 170:sc= -0.0398 (180deg=-0.295) USER MOD Single : B 84 THR OG1 : rot 82:sc= -1.19! USER MOD Single : B 86 LYS NZ :NH3+ 162:sc= 1.05 (180deg=0.844) USER MOD Single : B 90 ASN : amide:sc= -1.08 X(o=-1.1,f=-0.76) USER MOD Single : B 92 GLN :FLIP amide:sc= -0.28 F(o=-2,f=-0.28) USER MOD Single : B 95 GLN :FLIP amide:sc= -0.372 F(o=-1.2,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 268 N MET A 42 -18.398 5.082 9.879 1.00 0.00 N ATOM 269 CA MET A 42 -18.613 3.762 9.314 1.00 0.00 C ATOM 270 C MET A 42 -17.352 3.276 8.646 1.00 0.00 C ATOM 271 O MET A 42 -16.982 2.106 8.765 1.00 0.00 O ATOM 272 CB MET A 42 -19.767 3.763 8.319 1.00 0.00 C ATOM 273 CG MET A 42 -21.066 4.320 8.869 1.00 0.00 C ATOM 274 SD MET A 42 -21.678 3.438 10.332 1.00 0.00 S ATOM 275 CE MET A 42 -22.039 1.816 9.638 1.00 0.00 C ATOM 0 HA MET A 42 -18.875 3.086 10.128 1.00 0.00 H new ATOM 0 HB2 MET A 42 -19.477 4.346 7.445 1.00 0.00 H new ATOM 0 HB3 MET A 42 -19.939 2.742 7.979 1.00 0.00 H new ATOM 0 HG2 MET A 42 -20.922 5.370 9.123 1.00 0.00 H new ATOM 0 HG3 MET A 42 -21.826 4.282 8.089 1.00 0.00 H new ATOM 0 HE1 MET A 42 -22.617 1.233 10.356 1.00 0.00 H new ATOM 0 HE2 MET A 42 -22.614 1.933 8.719 1.00 0.00 H new ATOM 0 HE3 MET A 42 -21.105 1.298 9.418 1.00 0.00 H new ATOM 285 N GLU A 43 -16.643 4.192 8.000 1.00 0.00 N ATOM 286 CA GLU A 43 -15.431 3.805 7.328 1.00 0.00 C ATOM 287 C GLU A 43 -14.305 3.609 8.339 1.00 0.00 C ATOM 288 O GLU A 43 -13.407 2.806 8.120 1.00 0.00 O ATOM 289 CB GLU A 43 -15.019 4.783 6.226 1.00 0.00 C ATOM 290 CG GLU A 43 -14.437 6.098 6.696 1.00 0.00 C ATOM 291 CD GLU A 43 -13.831 6.852 5.549 1.00 0.00 C ATOM 292 OE1 GLU A 43 -14.530 7.037 4.519 1.00 0.00 O ATOM 293 OE2 GLU A 43 -12.640 7.197 5.617 1.00 0.00 O ATOM 0 H GLU A 43 -16.885 5.181 7.933 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.632 2.856 6.830 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.287 4.292 5.585 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -15.892 4.994 5.608 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.217 6.700 7.162 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -13.679 5.914 7.457 1.00 0.00 H new ATOM 300 N LYS A 44 -14.388 4.322 9.467 1.00 0.00 N ATOM 301 CA LYS A 44 -13.400 4.210 10.534 1.00 0.00 C ATOM 302 C LYS A 44 -13.544 2.828 11.191 1.00 0.00 C ATOM 303 O LYS A 44 -12.551 2.182 11.549 1.00 0.00 O ATOM 304 CB LYS A 44 -13.597 5.386 11.543 1.00 0.00 C ATOM 305 CG LYS A 44 -12.516 5.581 12.626 1.00 0.00 C ATOM 306 CD LYS A 44 -12.603 4.575 13.777 1.00 0.00 C ATOM 307 CE LYS A 44 -13.877 4.749 14.611 1.00 0.00 C ATOM 308 NZ LYS A 44 -13.942 6.071 15.284 1.00 0.00 N ATOM 0 H LYS A 44 -15.137 4.987 9.661 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.384 4.289 10.147 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -13.672 6.311 10.971 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -14.554 5.243 12.044 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.533 5.503 12.162 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.599 6.590 13.031 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -12.571 3.563 13.374 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -11.732 4.689 14.422 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.748 4.630 13.966 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.926 3.960 15.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.729 6.076 15.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.049 6.249 15.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.094 6.815 14.573 1.00 0.00 H new ATOM 322 N ARG A 45 -14.787 2.381 11.311 1.00 0.00 N ATOM 323 CA ARG A 45 -15.105 1.052 11.836 1.00 0.00 C ATOM 324 C ARG A 45 -14.605 -0.022 10.875 1.00 0.00 C ATOM 325 O ARG A 45 -13.989 -1.015 11.292 1.00 0.00 O ATOM 326 CB ARG A 45 -16.609 0.929 12.051 1.00 0.00 C ATOM 327 CG ARG A 45 -17.137 1.843 13.145 1.00 0.00 C ATOM 328 CD ARG A 45 -18.652 1.919 13.130 1.00 0.00 C ATOM 329 NE ARG A 45 -19.288 0.606 13.279 1.00 0.00 N ATOM 330 CZ ARG A 45 -20.568 0.401 13.623 1.00 0.00 C ATOM 331 NH1 ARG A 45 -21.379 1.430 13.871 1.00 0.00 N ATOM 332 NH2 ARG A 45 -21.031 -0.833 13.704 1.00 0.00 N ATOM 0 H ARG A 45 -15.607 2.927 11.048 1.00 0.00 H new ATOM 0 HA ARG A 45 -14.605 0.913 12.795 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -17.122 1.158 11.117 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -16.850 -0.104 12.303 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.800 1.480 14.116 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.721 2.842 13.016 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -18.986 2.573 13.935 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -18.979 2.372 12.194 1.00 0.00 H new ATOM 0 HE ARG A 45 -18.711 -0.217 13.107 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -21.028 2.385 13.800 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -22.351 1.262 14.132 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.416 -1.622 13.506 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -22.003 -0.997 13.965 1.00 0.00 H new ATOM 346 N ARG A 46 -14.853 0.200 9.583 1.00 0.00 N ATOM 347 CA ARG A 46 -14.359 -0.678 8.525 1.00 0.00 C ATOM 348 C ARG A 46 -12.848 -0.804 8.635 1.00 0.00 C ATOM 349 O ARG A 46 -12.304 -1.909 8.660 1.00 0.00 O ATOM 350 CB ARG A 46 -14.687 -0.082 7.155 1.00 0.00 C ATOM 351 CG ARG A 46 -14.118 -0.870 5.982 1.00 0.00 C ATOM 352 CD ARG A 46 -14.169 -0.055 4.704 1.00 0.00 C ATOM 353 NE ARG A 46 -13.353 1.182 4.787 1.00 0.00 N ATOM 354 CZ ARG A 46 -13.227 2.098 3.800 1.00 0.00 C ATOM 355 NH1 ARG A 46 -13.828 1.911 2.629 1.00 0.00 N ATOM 356 NH2 ARG A 46 -12.477 3.181 3.988 1.00 0.00 N ATOM 0 H ARG A 46 -15.400 0.991 9.243 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.833 -1.654 8.632 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -15.770 -0.021 7.047 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.305 0.938 7.113 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.088 -1.154 6.196 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -14.682 -1.793 5.852 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -13.815 -0.665 3.873 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.204 0.210 4.487 1.00 0.00 H new ATOM 0 HE ARG A 46 -12.848 1.355 5.656 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -14.388 1.073 2.471 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -13.729 2.605 1.888 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -11.997 3.321 4.877 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -12.382 3.871 3.243 1.00 0.00 H new ATOM 370 N ARG A 47 -12.199 0.353 8.711 1.00 0.00 N ATOM 371 CA ARG A 47 -10.752 0.491 8.787 1.00 0.00 C ATOM 372 C ARG A 47 -10.155 -0.338 9.918 1.00 0.00 C ATOM 373 O ARG A 47 -9.120 -0.982 9.739 1.00 0.00 O ATOM 374 CB ARG A 47 -10.393 1.966 8.933 1.00 0.00 C ATOM 375 CG ARG A 47 -8.920 2.258 8.856 1.00 0.00 C ATOM 376 CD ARG A 47 -8.656 3.744 8.931 1.00 0.00 C ATOM 377 NE ARG A 47 -7.242 4.043 8.747 1.00 0.00 N ATOM 378 CZ ARG A 47 -6.725 5.249 8.527 1.00 0.00 C ATOM 379 NH1 ARG A 47 -7.511 6.327 8.471 1.00 0.00 N ATOM 380 NH2 ARG A 47 -5.428 5.377 8.356 1.00 0.00 N ATOM 0 H ARG A 47 -12.684 1.250 8.722 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.321 0.105 7.863 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -10.904 2.531 8.153 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -10.773 2.327 9.889 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.403 1.752 9.671 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.515 1.860 7.926 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.240 4.258 8.168 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -8.987 4.126 9.897 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.591 3.259 8.791 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.519 6.231 8.597 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -7.104 7.247 8.302 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -4.825 4.555 8.392 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -5.024 6.298 8.187 1.00 0.00 H new ATOM 394 N ALA A 48 -10.838 -0.356 11.042 1.00 0.00 N ATOM 395 CA ALA A 48 -10.414 -1.098 12.193 1.00 0.00 C ATOM 396 C ALA A 48 -10.349 -2.567 11.876 1.00 0.00 C ATOM 397 O ALA A 48 -9.296 -3.176 12.011 1.00 0.00 O ATOM 398 CB ALA A 48 -11.347 -0.843 13.359 1.00 0.00 C ATOM 0 H ALA A 48 -11.712 0.152 11.176 1.00 0.00 H new ATOM 0 HA ALA A 48 -9.415 -0.764 12.474 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -11.011 -1.414 14.225 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.344 0.220 13.601 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -12.357 -1.151 13.091 1.00 0.00 H new ATOM 404 N ARG A 49 -11.449 -3.117 11.355 1.00 0.00 N ATOM 405 CA ARG A 49 -11.508 -4.551 11.088 1.00 0.00 C ATOM 406 C ARG A 49 -10.536 -4.934 9.958 1.00 0.00 C ATOM 407 O ARG A 49 -10.094 -6.084 9.876 1.00 0.00 O ATOM 408 CB ARG A 49 -12.943 -5.032 10.796 1.00 0.00 C ATOM 409 CG ARG A 49 -13.182 -6.521 11.141 1.00 0.00 C ATOM 410 CD ARG A 49 -13.521 -7.378 9.927 1.00 0.00 C ATOM 411 NE ARG A 49 -14.746 -6.921 9.251 1.00 0.00 N ATOM 412 CZ ARG A 49 -15.321 -7.529 8.203 1.00 0.00 C ATOM 413 NH1 ARG A 49 -14.980 -8.765 7.864 1.00 0.00 N ATOM 414 NH2 ARG A 49 -16.302 -6.926 7.546 1.00 0.00 N ATOM 0 H ARG A 49 -12.295 -2.600 11.114 1.00 0.00 H new ATOM 0 HA ARG A 49 -11.191 -5.067 11.995 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.644 -4.420 11.363 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -13.162 -4.873 9.740 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -12.290 -6.922 11.622 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -13.994 -6.593 11.865 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -12.689 -7.354 9.223 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -13.645 -8.415 10.239 1.00 0.00 H new ATOM 0 HE ARG A 49 -15.192 -6.076 9.607 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -14.273 -9.265 8.403 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -15.425 -9.216 7.065 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -16.618 -6.001 7.838 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -16.741 -7.387 6.749 1.00 0.00 H new ATOM 428 N ILE A 50 -10.222 -3.970 9.078 1.00 0.00 N ATOM 429 CA ILE A 50 -9.197 -4.158 8.061 1.00 0.00 C ATOM 430 C ILE A 50 -7.858 -4.444 8.748 1.00 0.00 C ATOM 431 O ILE A 50 -7.258 -5.505 8.557 1.00 0.00 O ATOM 432 CB ILE A 50 -9.070 -2.884 7.172 1.00 0.00 C ATOM 433 CG1 ILE A 50 -10.354 -2.687 6.371 1.00 0.00 C ATOM 434 CG2 ILE A 50 -7.849 -2.952 6.246 1.00 0.00 C ATOM 435 CD1 ILE A 50 -10.392 -1.431 5.551 1.00 0.00 C ATOM 0 H ILE A 50 -10.669 -3.054 9.057 1.00 0.00 H new ATOM 0 HA ILE A 50 -9.475 -4.998 7.424 1.00 0.00 H new ATOM 0 HB ILE A 50 -8.921 -2.025 7.826 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -10.488 -3.542 5.708 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -11.199 -2.682 7.059 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -7.798 -2.045 5.644 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.943 -3.042 6.845 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.938 -3.818 5.590 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -11.340 -1.374 5.016 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.293 -0.566 6.206 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -9.571 -1.439 4.834 1.00 0.00 H new ATOM 447 N ASN A 51 -7.452 -3.526 9.604 1.00 0.00 N ATOM 448 CA ASN A 51 -6.182 -3.617 10.334 1.00 0.00 C ATOM 449 C ASN A 51 -6.166 -4.836 11.222 1.00 0.00 C ATOM 450 O ASN A 51 -5.177 -5.552 11.284 1.00 0.00 O ATOM 451 CB ASN A 51 -5.953 -2.368 11.181 1.00 0.00 C ATOM 452 CG ASN A 51 -5.900 -1.110 10.358 1.00 0.00 C ATOM 453 OD1 ASN A 51 -5.438 -1.108 9.204 1.00 0.00 O ATOM 454 ND2 ASN A 51 -6.393 -0.045 10.904 1.00 0.00 N ATOM 0 H ASN A 51 -7.990 -2.687 9.821 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.381 -3.699 9.599 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -6.752 -2.282 11.918 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -5.020 -2.475 11.734 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -6.411 0.833 10.385 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -6.764 -0.084 11.853 1.00 0.00 H new ATOM 461 N GLU A 52 -7.276 -5.071 11.895 1.00 0.00 N ATOM 462 CA GLU A 52 -7.440 -6.246 12.760 1.00 0.00 C ATOM 463 C GLU A 52 -7.211 -7.555 11.993 1.00 0.00 C ATOM 464 O GLU A 52 -6.565 -8.483 12.508 1.00 0.00 O ATOM 465 CB GLU A 52 -8.820 -6.263 13.424 1.00 0.00 C ATOM 466 CG GLU A 52 -9.064 -5.113 14.391 1.00 0.00 C ATOM 467 CD GLU A 52 -10.423 -5.177 15.039 1.00 0.00 C ATOM 468 OE1 GLU A 52 -10.770 -6.220 15.636 1.00 0.00 O ATOM 469 OE2 GLU A 52 -11.178 -4.192 14.946 1.00 0.00 O ATOM 0 H GLU A 52 -8.093 -4.461 11.865 1.00 0.00 H new ATOM 0 HA GLU A 52 -6.680 -6.170 13.538 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.584 -6.238 12.647 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.941 -7.205 13.960 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.296 -5.125 15.165 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.964 -4.168 13.858 1.00 0.00 H new ATOM 476 N SER A 53 -7.687 -7.617 10.761 1.00 0.00 N ATOM 477 CA SER A 53 -7.536 -8.802 9.983 1.00 0.00 C ATOM 478 C SER A 53 -6.109 -8.900 9.447 1.00 0.00 C ATOM 479 O SER A 53 -5.516 -9.956 9.481 1.00 0.00 O ATOM 480 CB SER A 53 -8.579 -8.836 8.868 1.00 0.00 C ATOM 481 OG SER A 53 -9.894 -8.739 9.426 1.00 0.00 O ATOM 0 H SER A 53 -8.178 -6.855 10.292 1.00 0.00 H new ATOM 0 HA SER A 53 -7.707 -9.676 10.611 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.408 -8.014 8.173 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.484 -9.760 8.298 1.00 0.00 H new ATOM 0 HG SER A 53 -10.109 -7.798 9.594 1.00 0.00 H new ATOM 487 N LEU A 54 -5.553 -7.766 9.021 1.00 0.00 N ATOM 488 CA LEU A 54 -4.200 -7.691 8.480 1.00 0.00 C ATOM 489 C LEU A 54 -3.175 -8.088 9.565 1.00 0.00 C ATOM 490 O LEU A 54 -2.200 -8.801 9.296 1.00 0.00 O ATOM 491 CB LEU A 54 -3.952 -6.247 7.996 1.00 0.00 C ATOM 492 CG LEU A 54 -2.924 -6.030 6.870 1.00 0.00 C ATOM 493 CD1 LEU A 54 -2.966 -4.587 6.407 1.00 0.00 C ATOM 494 CD2 LEU A 54 -1.505 -6.393 7.287 1.00 0.00 C ATOM 0 H LEU A 54 -6.035 -6.867 9.043 1.00 0.00 H new ATOM 0 HA LEU A 54 -4.087 -8.381 7.644 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.905 -5.838 7.661 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.636 -5.656 8.856 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.200 -6.698 6.054 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.237 -4.439 5.610 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.963 -4.353 6.034 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.728 -3.930 7.243 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.825 -6.219 6.453 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.205 -5.776 8.134 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.467 -7.444 7.573 1.00 0.00 H new ATOM 506 N SER A 55 -3.416 -7.637 10.776 1.00 0.00 N ATOM 507 CA SER A 55 -2.547 -7.917 11.889 1.00 0.00 C ATOM 508 C SER A 55 -2.511 -9.426 12.175 1.00 0.00 C ATOM 509 O SER A 55 -1.425 -10.031 12.208 1.00 0.00 O ATOM 510 CB SER A 55 -2.986 -7.114 13.127 1.00 0.00 C ATOM 511 OG SER A 55 -2.059 -7.233 14.197 1.00 0.00 O ATOM 0 H SER A 55 -4.225 -7.063 11.014 1.00 0.00 H new ATOM 0 HA SER A 55 -1.534 -7.605 11.635 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.095 -6.064 12.857 1.00 0.00 H new ATOM 0 HB3 SER A 55 -3.965 -7.462 13.456 1.00 0.00 H new ATOM 0 HG SER A 55 -2.373 -6.708 14.962 1.00 0.00 H new ATOM 517 N GLN A 56 -3.684 -10.056 12.312 1.00 0.00 N ATOM 518 CA GLN A 56 -3.725 -11.490 12.589 1.00 0.00 C ATOM 519 C GLN A 56 -3.226 -12.285 11.378 1.00 0.00 C ATOM 520 O GLN A 56 -2.624 -13.339 11.529 1.00 0.00 O ATOM 521 CB GLN A 56 -5.116 -11.954 13.037 1.00 0.00 C ATOM 522 CG GLN A 56 -6.201 -11.779 12.003 1.00 0.00 C ATOM 523 CD GLN A 56 -7.547 -12.251 12.485 1.00 0.00 C ATOM 524 OE1 GLN A 56 -7.909 -13.422 12.323 1.00 0.00 O ATOM 525 NE2 GLN A 56 -8.296 -11.363 13.070 1.00 0.00 N ATOM 0 H GLN A 56 -4.596 -9.605 12.237 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.053 -11.684 13.425 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.062 -13.007 13.313 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -5.396 -11.404 13.935 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -6.267 -10.727 11.727 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -5.930 -12.328 11.102 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.959 -10.407 13.184 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.220 -11.623 13.415 1.00 0.00 H new ATOM 534 N LEU A 57 -3.460 -11.732 10.193 1.00 0.00 N ATOM 535 CA LEU A 57 -2.975 -12.265 8.923 1.00 0.00 C ATOM 536 C LEU A 57 -1.469 -12.468 9.007 1.00 0.00 C ATOM 537 O LEU A 57 -0.977 -13.590 8.894 1.00 0.00 O ATOM 538 CB LEU A 57 -3.389 -11.267 7.807 1.00 0.00 C ATOM 539 CG LEU A 57 -2.899 -11.457 6.374 1.00 0.00 C ATOM 540 CD1 LEU A 57 -3.945 -10.918 5.405 1.00 0.00 C ATOM 541 CD2 LEU A 57 -1.629 -10.665 6.167 1.00 0.00 C ATOM 0 H LEU A 57 -4.007 -10.878 10.085 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.410 -13.238 8.693 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.478 -11.255 7.775 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -3.068 -10.276 8.127 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.722 -12.518 6.198 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.596 -11.053 4.381 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.882 -11.458 5.544 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.106 -9.857 5.596 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.279 -10.800 5.144 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.826 -9.608 6.346 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.865 -11.015 6.861 1.00 0.00 H new ATOM 553 N LYS A 58 -0.767 -11.382 9.289 1.00 0.00 N ATOM 554 CA LYS A 58 0.684 -11.380 9.459 1.00 0.00 C ATOM 555 C LYS A 58 1.099 -12.382 10.524 1.00 0.00 C ATOM 556 O LYS A 58 1.991 -13.199 10.317 1.00 0.00 O ATOM 557 CB LYS A 58 1.139 -9.981 9.898 1.00 0.00 C ATOM 558 CG LYS A 58 2.647 -9.836 10.132 1.00 0.00 C ATOM 559 CD LYS A 58 3.011 -8.430 10.610 1.00 0.00 C ATOM 560 CE LYS A 58 2.462 -8.121 12.004 1.00 0.00 C ATOM 561 NZ LYS A 58 3.119 -8.911 13.061 1.00 0.00 N ATOM 0 H LYS A 58 -1.192 -10.462 9.409 1.00 0.00 H new ATOM 0 HA LYS A 58 1.146 -11.653 8.510 1.00 0.00 H new ATOM 0 HB2 LYS A 58 0.833 -9.261 9.139 1.00 0.00 H new ATOM 0 HB3 LYS A 58 0.616 -9.717 10.817 1.00 0.00 H new ATOM 0 HG2 LYS A 58 2.973 -10.568 10.871 1.00 0.00 H new ATOM 0 HG3 LYS A 58 3.182 -10.056 9.208 1.00 0.00 H new ATOM 0 HD2 LYS A 58 4.096 -8.323 10.619 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.624 -7.698 9.901 1.00 0.00 H new ATOM 0 HE2 LYS A 58 2.593 -7.060 12.215 1.00 0.00 H new ATOM 0 HE3 LYS A 58 1.390 -8.320 12.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 2.771 -8.603 13.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 2.902 -9.919 12.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 4.148 -8.769 13.012 1.00 0.00 H new ATOM 575 N THR A 59 0.401 -12.328 11.632 1.00 0.00 N ATOM 576 CA THR A 59 0.710 -13.118 12.799 1.00 0.00 C ATOM 577 C THR A 59 0.629 -14.645 12.519 1.00 0.00 C ATOM 578 O THR A 59 1.556 -15.411 12.861 1.00 0.00 O ATOM 579 CB THR A 59 -0.226 -12.716 13.966 1.00 0.00 C ATOM 580 OG1 THR A 59 -0.162 -11.288 14.148 1.00 0.00 O ATOM 581 CG2 THR A 59 0.220 -13.357 15.255 1.00 0.00 C ATOM 0 H THR A 59 -0.412 -11.723 11.750 1.00 0.00 H new ATOM 0 HA THR A 59 1.743 -12.910 13.079 1.00 0.00 H new ATOM 0 HB THR A 59 -1.237 -13.044 13.722 1.00 0.00 H new ATOM 0 HG1 THR A 59 -0.894 -10.862 13.655 1.00 0.00 H new ATOM 0 HG21 THR A 59 -0.452 -13.060 16.060 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.201 -14.442 15.148 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.234 -13.033 15.491 1.00 0.00 H new ATOM 589 N LEU A 60 -0.439 -15.079 11.882 1.00 0.00 N ATOM 590 CA LEU A 60 -0.613 -16.492 11.593 1.00 0.00 C ATOM 591 C LEU A 60 0.260 -16.969 10.441 1.00 0.00 C ATOM 592 O LEU A 60 0.800 -18.071 10.501 1.00 0.00 O ATOM 593 CB LEU A 60 -2.092 -16.893 11.409 1.00 0.00 C ATOM 594 CG LEU A 60 -2.944 -17.073 12.692 1.00 0.00 C ATOM 595 CD1 LEU A 60 -2.358 -18.155 13.585 1.00 0.00 C ATOM 596 CD2 LEU A 60 -3.107 -15.778 13.471 1.00 0.00 C ATOM 0 H LEU A 60 -1.197 -14.480 11.555 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.265 -17.017 12.483 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.572 -16.136 10.788 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.121 -17.829 10.851 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.937 -17.381 12.365 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.973 -18.262 14.478 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.336 -19.101 13.044 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.344 -17.879 13.874 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.712 -15.961 14.359 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.126 -15.407 13.770 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.600 -15.035 12.843 1.00 0.00 H new ATOM 608 N ILE A 61 0.431 -16.140 9.409 1.00 0.00 N ATOM 609 CA ILE A 61 1.310 -16.503 8.291 1.00 0.00 C ATOM 610 C ILE A 61 2.739 -16.679 8.792 1.00 0.00 C ATOM 611 O ILE A 61 3.408 -17.674 8.483 1.00 0.00 O ATOM 612 CB ILE A 61 1.286 -15.442 7.151 1.00 0.00 C ATOM 613 CG1 ILE A 61 -0.098 -15.377 6.517 1.00 0.00 C ATOM 614 CG2 ILE A 61 2.333 -15.763 6.077 1.00 0.00 C ATOM 615 CD1 ILE A 61 -0.504 -16.646 5.788 1.00 0.00 C ATOM 0 H ILE A 61 -0.018 -15.228 9.322 1.00 0.00 H new ATOM 0 HA ILE A 61 0.938 -17.440 7.878 1.00 0.00 H new ATOM 0 HB ILE A 61 1.526 -14.474 7.590 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.833 -15.166 7.294 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -0.126 -14.543 5.816 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.294 -15.006 5.293 1.00 0.00 H new ATOM 0 HG22 ILE A 61 3.326 -15.769 6.527 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.124 -16.742 5.646 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.501 -16.520 5.365 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.207 -16.849 4.987 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.510 -17.482 6.488 1.00 0.00 H new ATOM 627 N LEU A 62 3.173 -15.742 9.617 1.00 0.00 N ATOM 628 CA LEU A 62 4.511 -15.754 10.172 1.00 0.00 C ATOM 629 C LEU A 62 4.723 -16.999 11.010 1.00 0.00 C ATOM 630 O LEU A 62 5.775 -17.588 10.981 1.00 0.00 O ATOM 631 CB LEU A 62 4.734 -14.517 11.045 1.00 0.00 C ATOM 632 CG LEU A 62 5.993 -13.693 10.765 1.00 0.00 C ATOM 633 CD1 LEU A 62 7.271 -14.507 10.953 1.00 0.00 C ATOM 634 CD2 LEU A 62 5.926 -13.103 9.374 1.00 0.00 C ATOM 0 H LEU A 62 2.605 -14.951 9.920 1.00 0.00 H new ATOM 0 HA LEU A 62 5.223 -15.749 9.346 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.869 -13.863 10.935 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.762 -14.837 12.087 1.00 0.00 H new ATOM 0 HG LEU A 62 6.028 -12.883 11.494 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.137 -13.879 10.743 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.325 -14.867 11.980 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.265 -15.357 10.270 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.826 -12.518 9.183 1.00 0.00 H new ATOM 0 HD22 LEU A 62 5.853 -13.907 8.641 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.051 -12.458 9.294 1.00 0.00 H new ATOM 646 N ASP A 63 3.698 -17.415 11.706 1.00 0.00 N ATOM 647 CA ASP A 63 3.797 -18.560 12.604 1.00 0.00 C ATOM 648 C ASP A 63 3.803 -19.872 11.853 1.00 0.00 C ATOM 649 O ASP A 63 4.295 -20.863 12.337 1.00 0.00 O ATOM 650 CB ASP A 63 2.649 -18.571 13.554 1.00 0.00 C ATOM 651 CG ASP A 63 2.898 -19.472 14.741 1.00 0.00 C ATOM 652 OD1 ASP A 63 3.645 -19.071 15.657 1.00 0.00 O ATOM 653 OD2 ASP A 63 2.363 -20.590 14.791 1.00 0.00 O ATOM 0 H ASP A 63 2.775 -16.982 11.675 1.00 0.00 H new ATOM 0 HA ASP A 63 4.740 -18.458 13.141 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.460 -17.556 13.904 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.751 -18.901 13.032 1.00 0.00 H new ATOM 658 N ALA A 64 3.244 -19.873 10.691 1.00 0.00 N ATOM 659 CA ALA A 64 3.144 -21.065 9.907 1.00 0.00 C ATOM 660 C ALA A 64 4.429 -21.296 9.147 1.00 0.00 C ATOM 661 O ALA A 64 4.784 -22.436 8.807 1.00 0.00 O ATOM 662 CB ALA A 64 1.982 -20.935 8.955 1.00 0.00 C ATOM 0 H ALA A 64 2.840 -19.045 10.253 1.00 0.00 H new ATOM 0 HA ALA A 64 2.977 -21.921 10.561 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.901 -21.841 8.354 1.00 0.00 H new ATOM 0 HB2 ALA A 64 1.062 -20.791 9.521 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.142 -20.079 8.300 1.00 0.00 H new ATOM 668 N LEU A 65 5.143 -20.220 8.882 1.00 0.00 N ATOM 669 CA LEU A 65 6.347 -20.329 8.085 1.00 0.00 C ATOM 670 C LEU A 65 7.575 -20.212 8.956 1.00 0.00 C ATOM 671 O LEU A 65 8.521 -20.986 8.805 1.00 0.00 O ATOM 672 CB LEU A 65 6.358 -19.221 7.018 1.00 0.00 C ATOM 673 CG LEU A 65 5.047 -19.032 6.253 1.00 0.00 C ATOM 674 CD1 LEU A 65 5.180 -18.026 5.141 1.00 0.00 C ATOM 675 CD2 LEU A 65 4.520 -20.340 5.751 1.00 0.00 C ATOM 0 H LEU A 65 4.916 -19.278 9.200 1.00 0.00 H new ATOM 0 HA LEU A 65 6.359 -21.305 7.600 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.616 -18.278 7.500 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.149 -19.439 6.301 1.00 0.00 H new ATOM 0 HG LEU A 65 4.319 -18.628 6.957 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.225 -17.925 4.626 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.473 -17.061 5.556 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.939 -18.362 4.435 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.588 -20.174 5.211 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.251 -20.794 5.081 1.00 0.00 H new ATOM 0 HD23 LEU A 65 4.337 -21.006 6.594 1.00 0.00 H new ATOM 687 N LYS A 66 7.504 -19.298 9.932 1.00 0.00 N ATOM 688 CA LYS A 66 8.592 -18.990 10.859 1.00 0.00 C ATOM 689 C LYS A 66 9.909 -18.879 10.138 1.00 0.00 C ATOM 690 O LYS A 66 10.839 -19.651 10.365 1.00 0.00 O ATOM 691 CB LYS A 66 8.625 -19.983 12.003 1.00 0.00 C ATOM 692 CG LYS A 66 7.427 -19.848 12.925 1.00 0.00 C ATOM 693 CD LYS A 66 7.239 -21.073 13.784 1.00 0.00 C ATOM 694 CE LYS A 66 6.801 -22.257 12.935 1.00 0.00 C ATOM 695 NZ LYS A 66 6.481 -23.441 13.756 1.00 0.00 N ATOM 0 H LYS A 66 6.667 -18.741 10.100 1.00 0.00 H new ATOM 0 HA LYS A 66 8.404 -18.012 11.301 1.00 0.00 H new ATOM 0 HB2 LYS A 66 8.657 -20.995 11.600 1.00 0.00 H new ATOM 0 HB3 LYS A 66 9.540 -19.840 12.578 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.556 -18.974 13.563 1.00 0.00 H new ATOM 0 HG3 LYS A 66 6.529 -19.679 12.331 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.171 -21.311 14.297 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.493 -20.874 14.553 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.927 -21.977 12.347 1.00 0.00 H new ATOM 0 HE3 LYS A 66 7.593 -22.509 12.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.187 -24.224 13.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 7.322 -23.725 14.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 5.708 -23.210 14.412 1.00 0.00 H new ATOM 709 N LYS A 67 9.930 -17.963 9.205 1.00 0.00 N ATOM 710 CA LYS A 67 11.090 -17.724 8.390 1.00 0.00 C ATOM 711 C LYS A 67 12.211 -17.148 9.240 1.00 0.00 C ATOM 712 O LYS A 67 13.226 -17.800 9.459 1.00 0.00 O ATOM 713 CB LYS A 67 10.765 -16.770 7.234 1.00 0.00 C ATOM 714 CG LYS A 67 9.605 -17.200 6.334 1.00 0.00 C ATOM 715 CD LYS A 67 9.425 -16.216 5.195 1.00 0.00 C ATOM 716 CE LYS A 67 8.256 -16.586 4.314 1.00 0.00 C ATOM 717 NZ LYS A 67 8.090 -15.639 3.202 1.00 0.00 N ATOM 0 H LYS A 67 9.137 -17.359 8.989 1.00 0.00 H new ATOM 0 HA LYS A 67 11.411 -18.675 7.966 1.00 0.00 H new ATOM 0 HB2 LYS A 67 10.536 -15.788 7.649 1.00 0.00 H new ATOM 0 HB3 LYS A 67 11.657 -16.655 6.618 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.796 -18.196 5.935 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.687 -17.261 6.918 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.273 -15.215 5.600 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.335 -16.183 4.596 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.403 -17.590 3.917 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.344 -16.610 4.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.541 -16.089 2.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.587 -14.793 3.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.025 -15.364 2.838 1.00 0.00 H new ATOM 731 N ASP A 68 12.011 -15.937 9.744 1.00 0.00 N ATOM 732 CA ASP A 68 13.024 -15.261 10.555 1.00 0.00 C ATOM 733 C ASP A 68 12.402 -14.067 11.151 1.00 0.00 C ATOM 734 O ASP A 68 11.701 -13.333 10.477 1.00 0.00 O ATOM 735 CB ASP A 68 14.169 -14.801 9.683 1.00 0.00 C ATOM 736 CG ASP A 68 15.431 -14.387 10.419 1.00 0.00 C ATOM 737 OD1 ASP A 68 15.351 -13.865 11.538 1.00 0.00 O ATOM 738 OD2 ASP A 68 16.536 -14.548 9.842 1.00 0.00 O ATOM 0 H ASP A 68 11.155 -15.399 9.607 1.00 0.00 H new ATOM 0 HA ASP A 68 13.398 -15.946 11.316 1.00 0.00 H new ATOM 0 HB2 ASP A 68 14.421 -15.605 8.991 1.00 0.00 H new ATOM 0 HB3 ASP A 68 13.828 -13.958 9.082 1.00 0.00 H new ATOM 743 N SER A 69 12.686 -13.831 12.358 1.00 0.00 N ATOM 744 CA SER A 69 12.112 -12.732 13.023 1.00 0.00 C ATOM 745 C SER A 69 12.819 -11.411 12.623 1.00 0.00 C ATOM 746 O SER A 69 12.223 -10.332 12.693 1.00 0.00 O ATOM 747 CB SER A 69 12.104 -12.968 14.530 1.00 0.00 C ATOM 748 OG SER A 69 11.392 -14.172 14.862 1.00 0.00 O ATOM 0 H SER A 69 13.324 -14.391 12.923 1.00 0.00 H new ATOM 0 HA SER A 69 11.072 -12.630 12.711 1.00 0.00 H new ATOM 0 HB2 SER A 69 13.129 -13.035 14.896 1.00 0.00 H new ATOM 0 HB3 SER A 69 11.641 -12.118 15.032 1.00 0.00 H new ATOM 0 HG SER A 69 11.403 -14.301 15.833 1.00 0.00 H new ATOM 754 N SER A 70 14.054 -11.524 12.135 1.00 0.00 N ATOM 755 CA SER A 70 14.840 -10.377 11.733 1.00 0.00 C ATOM 756 C SER A 70 14.206 -9.684 10.511 1.00 0.00 C ATOM 757 O SER A 70 13.877 -8.487 10.567 1.00 0.00 O ATOM 758 CB SER A 70 16.294 -10.810 11.450 1.00 0.00 C ATOM 759 OG SER A 70 17.121 -9.714 11.095 1.00 0.00 O ATOM 0 H SER A 70 14.530 -12.417 12.010 1.00 0.00 H new ATOM 0 HA SER A 70 14.854 -9.651 12.546 1.00 0.00 H new ATOM 0 HB2 SER A 70 16.703 -11.301 12.333 1.00 0.00 H new ATOM 0 HB3 SER A 70 16.302 -11.545 10.645 1.00 0.00 H new ATOM 0 HG SER A 70 18.032 -10.033 10.926 1.00 0.00 H new ATOM 765 N ARG A 71 13.977 -10.444 9.431 1.00 0.00 N ATOM 766 CA ARG A 71 13.381 -9.880 8.214 1.00 0.00 C ATOM 767 C ARG A 71 11.946 -9.448 8.462 1.00 0.00 C ATOM 768 O ARG A 71 11.496 -8.422 7.967 1.00 0.00 O ATOM 769 CB ARG A 71 13.412 -10.882 7.056 1.00 0.00 C ATOM 770 CG ARG A 71 12.740 -12.198 7.387 1.00 0.00 C ATOM 771 CD ARG A 71 12.048 -12.790 6.194 1.00 0.00 C ATOM 772 NE ARG A 71 12.969 -13.333 5.193 1.00 0.00 N ATOM 773 CZ ARG A 71 13.053 -12.946 3.912 1.00 0.00 C ATOM 774 NH1 ARG A 71 12.462 -11.828 3.488 1.00 0.00 N ATOM 775 NH2 ARG A 71 13.771 -13.667 3.067 1.00 0.00 N ATOM 0 H ARG A 71 14.193 -11.439 9.376 1.00 0.00 H new ATOM 0 HA ARG A 71 13.979 -9.010 7.941 1.00 0.00 H new ATOM 0 HB2 ARG A 71 12.922 -10.440 6.188 1.00 0.00 H new ATOM 0 HB3 ARG A 71 14.448 -11.071 6.775 1.00 0.00 H new ATOM 0 HG2 ARG A 71 13.484 -12.901 7.761 1.00 0.00 H new ATOM 0 HG3 ARG A 71 12.016 -12.045 8.187 1.00 0.00 H new ATOM 0 HD2 ARG A 71 11.379 -13.583 6.529 1.00 0.00 H new ATOM 0 HD3 ARG A 71 11.427 -12.025 5.728 1.00 0.00 H new ATOM 0 HE ARG A 71 13.603 -14.072 5.498 1.00 0.00 H new ATOM 0 HH11 ARG A 71 11.934 -11.250 4.142 1.00 0.00 H new ATOM 0 HH12 ARG A 71 12.538 -11.551 2.509 1.00 0.00 H new ATOM 0 HH21 ARG A 71 14.252 -14.505 3.393 1.00 0.00 H new ATOM 0 HH22 ARG A 71 13.844 -13.385 2.090 1.00 0.00 H new ATOM 789 N HIS A 72 11.242 -10.211 9.272 1.00 0.00 N ATOM 790 CA HIS A 72 9.860 -9.955 9.540 1.00 0.00 C ATOM 791 C HIS A 72 9.614 -8.818 10.522 1.00 0.00 C ATOM 792 O HIS A 72 8.485 -8.584 10.935 1.00 0.00 O ATOM 793 CB HIS A 72 9.151 -11.237 9.923 1.00 0.00 C ATOM 794 CG HIS A 72 9.066 -12.190 8.771 1.00 0.00 C ATOM 795 ND1 HIS A 72 8.522 -11.869 7.559 1.00 0.00 N ATOM 796 CD2 HIS A 72 9.470 -13.466 8.660 1.00 0.00 C ATOM 797 CE1 HIS A 72 8.605 -12.929 6.774 1.00 0.00 C ATOM 798 NE2 HIS A 72 9.176 -13.928 7.398 1.00 0.00 N ATOM 0 H HIS A 72 11.620 -11.024 9.758 1.00 0.00 H new ATOM 0 HA HIS A 72 9.421 -9.591 8.611 1.00 0.00 H new ATOM 0 HB2 HIS A 72 9.680 -11.712 10.750 1.00 0.00 H new ATOM 0 HB3 HIS A 72 8.147 -11.005 10.278 1.00 0.00 H new ATOM 0 HD1 HIS A 72 8.121 -10.966 7.304 1.00 0.00 H new ATOM 0 HD2 HIS A 72 9.950 -14.039 9.439 1.00 0.00 H new ATOM 0 HE1 HIS A 72 8.250 -12.966 5.755 1.00 0.00 H new ATOM 806 N SER A 73 10.656 -8.102 10.868 1.00 0.00 N ATOM 807 CA SER A 73 10.518 -6.906 11.660 1.00 0.00 C ATOM 808 C SER A 73 10.714 -5.682 10.760 1.00 0.00 C ATOM 809 O SER A 73 10.797 -4.547 11.219 1.00 0.00 O ATOM 810 CB SER A 73 11.502 -6.919 12.829 1.00 0.00 C ATOM 811 OG SER A 73 11.241 -8.032 13.687 1.00 0.00 O ATOM 0 H SER A 73 11.616 -8.330 10.611 1.00 0.00 H new ATOM 0 HA SER A 73 9.517 -6.861 12.089 1.00 0.00 H new ATOM 0 HB2 SER A 73 12.523 -6.974 12.452 1.00 0.00 H new ATOM 0 HB3 SER A 73 11.419 -5.990 13.393 1.00 0.00 H new ATOM 0 HG SER A 73 11.422 -8.866 13.205 1.00 0.00 H new ATOM 817 N LYS A 74 10.774 -5.940 9.468 1.00 0.00 N ATOM 818 CA LYS A 74 10.907 -4.901 8.466 1.00 0.00 C ATOM 819 C LYS A 74 9.932 -5.216 7.327 1.00 0.00 C ATOM 820 O LYS A 74 10.068 -4.742 6.192 1.00 0.00 O ATOM 821 CB LYS A 74 12.374 -4.843 7.968 1.00 0.00 C ATOM 822 CG LYS A 74 12.741 -3.779 6.883 1.00 0.00 C ATOM 823 CD LYS A 74 12.542 -2.319 7.329 1.00 0.00 C ATOM 824 CE LYS A 74 11.086 -1.844 7.226 1.00 0.00 C ATOM 825 NZ LYS A 74 10.579 -1.924 5.844 1.00 0.00 N ATOM 0 H LYS A 74 10.732 -6.883 9.082 1.00 0.00 H new ATOM 0 HA LYS A 74 10.666 -3.922 8.879 1.00 0.00 H new ATOM 0 HB2 LYS A 74 13.014 -4.671 8.834 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.631 -5.826 7.572 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.782 -3.918 6.593 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.136 -3.960 5.995 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.879 -2.213 8.360 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.172 -1.671 6.719 1.00 0.00 H new ATOM 0 HE2 LYS A 74 10.459 -2.451 7.879 1.00 0.00 H new ATOM 0 HE3 LYS A 74 11.013 -0.816 7.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.805 -1.241 5.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 11.348 -1.703 5.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 10.226 -2.885 5.659 1.00 0.00 H new ATOM 839 N LEU A 75 8.906 -5.943 7.653 1.00 0.00 N ATOM 840 CA LEU A 75 7.988 -6.374 6.653 1.00 0.00 C ATOM 841 C LEU A 75 6.943 -5.327 6.386 1.00 0.00 C ATOM 842 O LEU A 75 6.190 -4.909 7.285 1.00 0.00 O ATOM 843 CB LEU A 75 7.374 -7.738 6.947 1.00 0.00 C ATOM 844 CG LEU A 75 7.449 -8.704 5.763 1.00 0.00 C ATOM 845 CD1 LEU A 75 8.883 -9.160 5.500 1.00 0.00 C ATOM 846 CD2 LEU A 75 6.500 -9.879 5.908 1.00 0.00 C ATOM 0 H LEU A 75 8.687 -6.247 8.602 1.00 0.00 H new ATOM 0 HA LEU A 75 8.566 -6.507 5.739 1.00 0.00 H new ATOM 0 HB2 LEU A 75 7.884 -8.182 7.802 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.331 -7.605 7.233 1.00 0.00 H new ATOM 0 HG LEU A 75 7.117 -8.149 4.886 1.00 0.00 H new ATOM 0 HD11 LEU A 75 8.897 -9.845 4.652 1.00 0.00 H new ATOM 0 HD12 LEU A 75 9.505 -8.293 5.277 1.00 0.00 H new ATOM 0 HD13 LEU A 75 9.271 -9.668 6.383 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.595 -10.532 5.041 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.747 -10.437 6.811 1.00 0.00 H new ATOM 0 HD23 LEU A 75 5.476 -9.513 5.977 1.00 0.00 H new ATOM 858 N GLU A 76 6.945 -4.878 5.163 1.00 0.00 N ATOM 859 CA GLU A 76 6.033 -3.888 4.677 1.00 0.00 C ATOM 860 C GLU A 76 4.682 -4.526 4.448 1.00 0.00 C ATOM 861 O GLU A 76 4.595 -5.742 4.270 1.00 0.00 O ATOM 862 CB GLU A 76 6.567 -3.339 3.361 1.00 0.00 C ATOM 863 CG GLU A 76 7.913 -2.655 3.488 1.00 0.00 C ATOM 864 CD GLU A 76 7.812 -1.327 4.166 1.00 0.00 C ATOM 865 OE1 GLU A 76 7.466 -0.349 3.494 1.00 0.00 O ATOM 866 OE2 GLU A 76 8.097 -1.230 5.363 1.00 0.00 O ATOM 0 H GLU A 76 7.604 -5.203 4.456 1.00 0.00 H new ATOM 0 HA GLU A 76 5.932 -3.080 5.402 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.651 -4.156 2.644 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.846 -2.630 2.954 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.593 -3.296 4.049 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.346 -2.522 2.496 1.00 0.00 H new ATOM 873 N LYS A 77 3.642 -3.714 4.440 1.00 0.00 N ATOM 874 CA LYS A 77 2.275 -4.171 4.211 1.00 0.00 C ATOM 875 C LYS A 77 2.188 -5.010 2.937 1.00 0.00 C ATOM 876 O LYS A 77 1.636 -6.102 2.929 1.00 0.00 O ATOM 877 CB LYS A 77 1.339 -2.960 4.124 1.00 0.00 C ATOM 878 CG LYS A 77 -0.064 -3.312 3.666 1.00 0.00 C ATOM 879 CD LYS A 77 -1.050 -2.140 3.748 1.00 0.00 C ATOM 880 CE LYS A 77 -1.179 -1.540 5.145 1.00 0.00 C ATOM 881 NZ LYS A 77 -2.146 -0.417 5.167 1.00 0.00 N ATOM 0 H LYS A 77 3.718 -2.708 4.593 1.00 0.00 H new ATOM 0 HA LYS A 77 1.969 -4.801 5.046 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.284 -2.482 5.102 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.765 -2.230 3.436 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.022 -3.669 2.637 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.440 -4.135 4.274 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.732 -1.360 3.056 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.031 -2.479 3.416 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.500 -2.311 5.845 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.204 -1.189 5.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.209 -0.032 6.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.826 0.329 4.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.082 -0.759 4.868 1.00 0.00 H new ATOM 895 N ALA A 78 2.797 -4.495 1.907 1.00 0.00 N ATOM 896 CA ALA A 78 2.863 -5.129 0.598 1.00 0.00 C ATOM 897 C ALA A 78 3.511 -6.522 0.663 1.00 0.00 C ATOM 898 O ALA A 78 3.141 -7.434 -0.076 1.00 0.00 O ATOM 899 CB ALA A 78 3.660 -4.235 -0.316 1.00 0.00 C ATOM 0 H ALA A 78 3.279 -3.597 1.944 1.00 0.00 H new ATOM 0 HA ALA A 78 1.849 -5.267 0.223 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.724 -4.689 -1.305 1.00 0.00 H new ATOM 0 HB2 ALA A 78 3.170 -3.264 -0.394 1.00 0.00 H new ATOM 0 HB3 ALA A 78 4.664 -4.104 0.088 1.00 0.00 H new ATOM 905 N ASP A 79 4.432 -6.680 1.588 1.00 0.00 N ATOM 906 CA ASP A 79 5.184 -7.932 1.743 1.00 0.00 C ATOM 907 C ASP A 79 4.355 -8.926 2.464 1.00 0.00 C ATOM 908 O ASP A 79 4.302 -10.106 2.100 1.00 0.00 O ATOM 909 CB ASP A 79 6.479 -7.722 2.527 1.00 0.00 C ATOM 910 CG ASP A 79 7.586 -7.082 1.740 1.00 0.00 C ATOM 911 OD1 ASP A 79 8.367 -7.824 1.094 1.00 0.00 O ATOM 912 OD2 ASP A 79 7.730 -5.854 1.782 1.00 0.00 O ATOM 0 H ASP A 79 4.689 -5.955 2.258 1.00 0.00 H new ATOM 0 HA ASP A 79 5.435 -8.288 0.744 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.265 -7.103 3.398 1.00 0.00 H new ATOM 0 HB3 ASP A 79 6.825 -8.687 2.898 1.00 0.00 H new ATOM 917 N ILE A 80 3.697 -8.437 3.472 1.00 0.00 N ATOM 918 CA ILE A 80 2.845 -9.214 4.329 1.00 0.00 C ATOM 919 C ILE A 80 1.667 -9.783 3.539 1.00 0.00 C ATOM 920 O ILE A 80 1.391 -10.987 3.612 1.00 0.00 O ATOM 921 CB ILE A 80 2.385 -8.332 5.518 1.00 0.00 C ATOM 922 CG1 ILE A 80 3.625 -7.882 6.292 1.00 0.00 C ATOM 923 CG2 ILE A 80 1.444 -9.090 6.427 1.00 0.00 C ATOM 924 CD1 ILE A 80 3.422 -6.730 7.237 1.00 0.00 C ATOM 0 H ILE A 80 3.739 -7.451 3.731 1.00 0.00 H new ATOM 0 HA ILE A 80 3.394 -10.067 4.730 1.00 0.00 H new ATOM 0 HB ILE A 80 1.843 -7.466 5.138 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.004 -8.731 6.860 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.399 -7.608 5.575 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.138 -8.447 7.252 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.564 -9.400 5.863 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.951 -9.970 6.822 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.364 -6.495 7.732 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.077 -5.859 6.680 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.677 -7.000 7.985 1.00 0.00 H new ATOM 936 N LEU A 81 1.016 -8.935 2.752 1.00 0.00 N ATOM 937 CA LEU A 81 -0.083 -9.372 1.883 1.00 0.00 C ATOM 938 C LEU A 81 0.385 -10.472 0.937 1.00 0.00 C ATOM 939 O LEU A 81 -0.191 -11.559 0.914 1.00 0.00 O ATOM 940 CB LEU A 81 -0.662 -8.203 1.075 1.00 0.00 C ATOM 941 CG LEU A 81 -1.798 -7.369 1.699 1.00 0.00 C ATOM 942 CD1 LEU A 81 -1.432 -6.834 3.073 1.00 0.00 C ATOM 943 CD2 LEU A 81 -2.148 -6.219 0.764 1.00 0.00 C ATOM 0 H LEU A 81 1.226 -7.939 2.694 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.870 -9.764 2.527 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.158 -7.524 0.841 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.026 -8.602 0.128 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.661 -8.022 1.831 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.264 -6.253 3.471 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.218 -7.667 3.743 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.551 -6.197 2.993 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.951 -5.626 1.201 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.271 -5.589 0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.473 -6.617 -0.197 1.00 0.00 H new ATOM 955 N GLU A 82 1.474 -10.205 0.211 1.00 0.00 N ATOM 956 CA GLU A 82 2.049 -11.168 -0.731 1.00 0.00 C ATOM 957 C GLU A 82 2.391 -12.498 -0.070 1.00 0.00 C ATOM 958 O GLU A 82 2.106 -13.543 -0.620 1.00 0.00 O ATOM 959 CB GLU A 82 3.280 -10.573 -1.462 1.00 0.00 C ATOM 960 CG GLU A 82 4.272 -11.604 -1.990 1.00 0.00 C ATOM 961 CD GLU A 82 5.502 -11.013 -2.649 1.00 0.00 C ATOM 962 OE1 GLU A 82 6.286 -10.299 -1.978 1.00 0.00 O ATOM 963 OE2 GLU A 82 5.762 -11.323 -3.827 1.00 0.00 O ATOM 0 H GLU A 82 1.979 -9.320 0.259 1.00 0.00 H new ATOM 0 HA GLU A 82 1.280 -11.375 -1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.930 -9.966 -2.297 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.803 -9.904 -0.778 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.589 -12.241 -1.164 1.00 0.00 H new ATOM 0 HG3 GLU A 82 3.762 -12.245 -2.710 1.00 0.00 H new ATOM 970 N MET A 83 2.918 -12.448 1.130 1.00 0.00 N ATOM 971 CA MET A 83 3.394 -13.641 1.810 1.00 0.00 C ATOM 972 C MET A 83 2.220 -14.532 2.164 1.00 0.00 C ATOM 973 O MET A 83 2.306 -15.747 2.096 1.00 0.00 O ATOM 974 CB MET A 83 4.184 -13.255 3.058 1.00 0.00 C ATOM 975 CG MET A 83 4.870 -14.416 3.772 1.00 0.00 C ATOM 976 SD MET A 83 5.845 -13.869 5.178 1.00 0.00 S ATOM 977 CE MET A 83 4.599 -12.997 6.135 1.00 0.00 C ATOM 0 H MET A 83 3.031 -11.587 1.665 1.00 0.00 H new ATOM 0 HA MET A 83 4.059 -14.194 1.147 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.941 -12.522 2.778 1.00 0.00 H new ATOM 0 HB3 MET A 83 3.509 -12.765 3.760 1.00 0.00 H new ATOM 0 HG2 MET A 83 4.117 -15.128 4.110 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.514 -14.943 3.068 1.00 0.00 H new ATOM 0 HE1 MET A 83 4.967 -12.004 6.392 1.00 0.00 H new ATOM 0 HE2 MET A 83 3.687 -12.905 5.546 1.00 0.00 H new ATOM 0 HE3 MET A 83 4.387 -13.553 7.048 1.00 0.00 H new ATOM 987 N THR A 84 1.127 -13.900 2.477 1.00 0.00 N ATOM 988 CA THR A 84 -0.102 -14.559 2.810 1.00 0.00 C ATOM 989 C THR A 84 -0.696 -15.232 1.561 1.00 0.00 C ATOM 990 O THR A 84 -1.082 -16.405 1.593 1.00 0.00 O ATOM 991 CB THR A 84 -1.067 -13.507 3.381 1.00 0.00 C ATOM 992 OG1 THR A 84 -0.372 -12.815 4.417 1.00 0.00 O ATOM 993 CG2 THR A 84 -2.313 -14.139 3.978 1.00 0.00 C ATOM 0 H THR A 84 1.064 -12.882 2.509 1.00 0.00 H new ATOM 0 HA THR A 84 0.071 -15.338 3.552 1.00 0.00 H new ATOM 0 HB THR A 84 -1.384 -12.845 2.576 1.00 0.00 H new ATOM 0 HG1 THR A 84 0.076 -12.029 4.041 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.965 -13.358 4.369 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.841 -14.701 3.207 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.028 -14.812 4.787 1.00 0.00 H new ATOM 1001 N VAL A 85 -0.697 -14.504 0.459 1.00 0.00 N ATOM 1002 CA VAL A 85 -1.236 -15.003 -0.802 1.00 0.00 C ATOM 1003 C VAL A 85 -0.360 -16.142 -1.344 1.00 0.00 C ATOM 1004 O VAL A 85 -0.854 -17.161 -1.842 1.00 0.00 O ATOM 1005 CB VAL A 85 -1.281 -13.889 -1.866 1.00 0.00 C ATOM 1006 CG1 VAL A 85 -1.959 -14.366 -3.130 1.00 0.00 C ATOM 1007 CG2 VAL A 85 -1.962 -12.663 -1.339 1.00 0.00 C ATOM 0 H VAL A 85 -0.327 -13.555 0.408 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.246 -15.361 -0.603 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.251 -13.629 -2.109 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -1.975 -13.558 -3.861 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -1.411 -15.215 -3.539 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.981 -14.670 -2.902 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.978 -11.895 -2.112 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.984 -12.910 -1.051 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.420 -12.291 -0.470 1.00 0.00 H new ATOM 1017 N LYS A 86 0.935 -15.975 -1.238 1.00 0.00 N ATOM 1018 CA LYS A 86 1.847 -16.960 -1.736 1.00 0.00 C ATOM 1019 C LYS A 86 1.842 -18.197 -0.860 1.00 0.00 C ATOM 1020 O LYS A 86 1.999 -19.316 -1.352 1.00 0.00 O ATOM 1021 CB LYS A 86 3.247 -16.369 -1.971 1.00 0.00 C ATOM 1022 CG LYS A 86 3.190 -15.172 -2.926 1.00 0.00 C ATOM 1023 CD LYS A 86 4.512 -14.842 -3.578 1.00 0.00 C ATOM 1024 CE LYS A 86 4.267 -13.969 -4.812 1.00 0.00 C ATOM 1025 NZ LYS A 86 5.509 -13.479 -5.432 1.00 0.00 N ATOM 0 H LYS A 86 1.377 -15.162 -0.809 1.00 0.00 H new ATOM 0 HA LYS A 86 1.504 -17.286 -2.718 1.00 0.00 H new ATOM 0 HB2 LYS A 86 3.678 -16.058 -1.019 1.00 0.00 H new ATOM 0 HB3 LYS A 86 3.904 -17.135 -2.383 1.00 0.00 H new ATOM 0 HG2 LYS A 86 2.454 -15.376 -3.704 1.00 0.00 H new ATOM 0 HG3 LYS A 86 2.840 -14.298 -2.376 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.158 -14.320 -2.872 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.028 -15.759 -3.864 1.00 0.00 H new ATOM 0 HE2 LYS A 86 3.703 -14.542 -5.548 1.00 0.00 H new ATOM 0 HE3 LYS A 86 3.649 -13.117 -4.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 5.400 -13.469 -6.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.708 -12.515 -5.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 6.297 -14.106 -5.173 1.00 0.00 H new ATOM 1039 N HIS A 87 1.572 -18.007 0.428 1.00 0.00 N ATOM 1040 CA HIS A 87 1.431 -19.125 1.342 1.00 0.00 C ATOM 1041 C HIS A 87 0.144 -19.886 1.021 1.00 0.00 C ATOM 1042 O HIS A 87 0.067 -21.093 1.226 1.00 0.00 O ATOM 1043 CB HIS A 87 1.453 -18.665 2.813 1.00 0.00 C ATOM 1044 CG HIS A 87 1.351 -19.781 3.821 1.00 0.00 C ATOM 1045 ND1 HIS A 87 0.655 -19.687 5.002 1.00 0.00 N ATOM 1046 CD2 HIS A 87 1.894 -21.023 3.812 1.00 0.00 C ATOM 1047 CE1 HIS A 87 0.793 -20.835 5.656 1.00 0.00 C ATOM 1048 NE2 HIS A 87 1.534 -21.685 4.979 1.00 0.00 N ATOM 0 H HIS A 87 1.448 -17.090 0.857 1.00 0.00 H new ATOM 0 HA HIS A 87 2.283 -19.792 1.208 1.00 0.00 H new ATOM 0 HB2 HIS A 87 2.375 -18.113 2.994 1.00 0.00 H new ATOM 0 HB3 HIS A 87 0.629 -17.970 2.975 1.00 0.00 H new ATOM 0 HD2 HIS A 87 2.508 -21.432 3.024 1.00 0.00 H new ATOM 0 HE1 HIS A 87 0.353 -21.044 6.620 1.00 0.00 H new ATOM 0 HE2 HIS A 87 1.791 -22.633 5.254 1.00 0.00 H new ATOM 1056 N LEU A 88 -0.849 -19.174 0.477 1.00 0.00 N ATOM 1057 CA LEU A 88 -2.100 -19.784 0.056 1.00 0.00 C ATOM 1058 C LEU A 88 -1.764 -20.830 -0.976 1.00 0.00 C ATOM 1059 O LEU A 88 -2.145 -21.985 -0.841 1.00 0.00 O ATOM 1060 CB LEU A 88 -3.053 -18.692 -0.502 1.00 0.00 C ATOM 1061 CG LEU A 88 -4.476 -19.076 -0.992 1.00 0.00 C ATOM 1062 CD1 LEU A 88 -5.265 -17.817 -1.212 1.00 0.00 C ATOM 1063 CD2 LEU A 88 -4.452 -19.848 -2.312 1.00 0.00 C ATOM 0 H LEU A 88 -0.802 -18.167 0.320 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.619 -20.258 0.889 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.171 -17.938 0.276 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -2.542 -18.212 -1.337 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.923 -19.714 -0.229 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.267 -18.071 -1.557 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -5.333 -17.262 -0.276 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.768 -17.203 -1.963 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.472 -20.092 -2.610 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -3.986 -19.235 -3.083 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.881 -20.768 -2.185 1.00 0.00 H new ATOM 1075 N ARG A 89 -0.978 -20.434 -1.979 1.00 0.00 N ATOM 1076 CA ARG A 89 -0.560 -21.381 -3.000 1.00 0.00 C ATOM 1077 C ARG A 89 0.292 -22.502 -2.424 1.00 0.00 C ATOM 1078 O ARG A 89 0.167 -23.635 -2.843 1.00 0.00 O ATOM 1079 CB ARG A 89 0.126 -20.739 -4.224 1.00 0.00 C ATOM 1080 CG ARG A 89 -0.830 -20.061 -5.207 1.00 0.00 C ATOM 1081 CD ARG A 89 -1.243 -18.671 -4.769 1.00 0.00 C ATOM 1082 NE ARG A 89 -0.135 -17.714 -4.915 1.00 0.00 N ATOM 1083 CZ ARG A 89 -0.250 -16.467 -5.397 1.00 0.00 C ATOM 1084 NH1 ARG A 89 -1.335 -16.098 -6.059 1.00 0.00 N ATOM 1085 NH2 ARG A 89 0.777 -15.644 -5.330 1.00 0.00 N ATOM 0 H ARG A 89 -0.627 -19.484 -2.101 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.490 -21.810 -3.373 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.849 -20.002 -3.874 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.687 -21.508 -4.755 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.353 -20.001 -6.185 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.721 -20.679 -5.324 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.095 -18.338 -5.363 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.570 -18.697 -3.729 1.00 0.00 H new ATOM 0 HE ARG A 89 0.794 -18.023 -4.627 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.093 -16.764 -6.207 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.413 -15.148 -6.421 1.00 0.00 H new ATOM 0 HH21 ARG A 89 1.654 -15.956 -4.913 1.00 0.00 H new ATOM 0 HH22 ARG A 89 0.695 -14.695 -5.695 1.00 0.00 H new ATOM 1099 N ASN A 90 1.111 -22.189 -1.424 1.00 0.00 N ATOM 1100 CA ASN A 90 1.981 -23.194 -0.783 1.00 0.00 C ATOM 1101 C ASN A 90 1.161 -24.260 -0.109 1.00 0.00 C ATOM 1102 O ASN A 90 1.458 -25.451 -0.208 1.00 0.00 O ATOM 1103 CB ASN A 90 2.943 -22.584 0.246 1.00 0.00 C ATOM 1104 CG ASN A 90 3.973 -21.631 -0.336 1.00 0.00 C ATOM 1105 OD1 ASN A 90 4.330 -21.728 -1.509 1.00 0.00 O ATOM 1106 ND2 ASN A 90 4.500 -20.745 0.483 1.00 0.00 N ATOM 0 H ASN A 90 1.197 -21.250 -1.034 1.00 0.00 H new ATOM 0 HA ASN A 90 2.577 -23.628 -1.586 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.360 -22.052 0.998 1.00 0.00 H new ATOM 0 HB3 ASN A 90 3.464 -23.392 0.759 1.00 0.00 H new ATOM 0 HD21 ASN A 90 5.228 -20.112 0.150 1.00 0.00 H new ATOM 0 HD22 ASN A 90 4.181 -20.691 1.450 1.00 0.00 H new ATOM 1113 N LEU A 91 0.132 -23.838 0.563 1.00 0.00 N ATOM 1114 CA LEU A 91 -0.762 -24.746 1.218 1.00 0.00 C ATOM 1115 C LEU A 91 -1.558 -25.514 0.192 1.00 0.00 C ATOM 1116 O LEU A 91 -1.673 -26.723 0.268 1.00 0.00 O ATOM 1117 CB LEU A 91 -1.688 -23.986 2.152 1.00 0.00 C ATOM 1118 CG LEU A 91 -1.018 -23.314 3.346 1.00 0.00 C ATOM 1119 CD1 LEU A 91 -1.986 -22.387 4.046 1.00 0.00 C ATOM 1120 CD2 LEU A 91 -0.516 -24.361 4.318 1.00 0.00 C ATOM 0 H LEU A 91 -0.112 -22.854 0.673 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.181 -25.454 1.809 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -2.210 -23.223 1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -2.445 -24.676 2.525 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.174 -22.728 2.983 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.490 -21.917 4.895 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.321 -21.618 3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.846 -22.957 4.398 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -0.039 -23.871 5.167 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.354 -24.962 4.670 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.207 -25.005 3.818 1.00 0.00 H new ATOM 1132 N GLN A 92 -2.027 -24.817 -0.816 1.00 0.00 N ATOM 1133 CA GLN A 92 -2.883 -25.408 -1.846 1.00 0.00 C ATOM 1134 C GLN A 92 -2.156 -26.446 -2.690 1.00 0.00 C ATOM 1135 O GLN A 92 -2.766 -27.371 -3.207 1.00 0.00 O ATOM 1136 CB GLN A 92 -3.497 -24.323 -2.728 1.00 0.00 C ATOM 1137 CG GLN A 92 -4.605 -23.515 -2.064 1.00 0.00 C ATOM 1138 CD GLN A 92 -5.863 -24.305 -1.820 1.00 0.00 C ATOM 1139 OE1 GLN A 92 -5.842 -25.520 -1.611 1.00 0.00 O ATOM 1140 NE2 GLN A 92 -6.965 -23.630 -1.838 1.00 0.00 N ATOM 0 H GLN A 92 -1.833 -23.825 -0.955 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.684 -25.933 -1.326 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -2.708 -23.641 -3.044 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -3.896 -24.789 -3.629 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -4.240 -23.126 -1.113 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -4.842 -22.655 -2.691 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -6.945 -22.626 -2.014 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -7.855 -24.102 -1.676 1.00 0.00 H new ATOM 1149 N ARG A 93 -0.855 -26.330 -2.777 1.00 0.00 N ATOM 1150 CA ARG A 93 -0.061 -27.252 -3.581 1.00 0.00 C ATOM 1151 C ARG A 93 0.357 -28.465 -2.755 1.00 0.00 C ATOM 1152 O ARG A 93 1.002 -29.378 -3.250 1.00 0.00 O ATOM 1153 CB ARG A 93 1.157 -26.522 -4.189 1.00 0.00 C ATOM 1154 CG ARG A 93 2.163 -25.983 -3.173 1.00 0.00 C ATOM 1155 CD ARG A 93 3.234 -26.999 -2.816 1.00 0.00 C ATOM 1156 NE ARG A 93 4.058 -27.325 -3.982 1.00 0.00 N ATOM 1157 CZ ARG A 93 4.496 -28.549 -4.309 1.00 0.00 C ATOM 1158 NH1 ARG A 93 4.142 -29.621 -3.593 1.00 0.00 N ATOM 1159 NH2 ARG A 93 5.267 -28.694 -5.370 1.00 0.00 N ATOM 0 H ARG A 93 -0.313 -25.607 -2.303 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.672 -27.618 -4.406 1.00 0.00 H new ATOM 0 HB2 ARG A 93 1.674 -27.208 -4.860 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.797 -25.692 -4.797 1.00 0.00 H new ATOM 0 HG2 ARG A 93 2.637 -25.088 -3.576 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.635 -25.684 -2.268 1.00 0.00 H new ATOM 0 HD2 ARG A 93 3.865 -26.603 -2.020 1.00 0.00 H new ATOM 0 HD3 ARG A 93 2.767 -27.906 -2.432 1.00 0.00 H new ATOM 0 HE ARG A 93 4.321 -26.555 -4.598 1.00 0.00 H new ATOM 0 HH11 ARG A 93 3.530 -29.515 -2.784 1.00 0.00 H new ATOM 0 HH12 ARG A 93 4.484 -30.545 -3.856 1.00 0.00 H new ATOM 0 HH21 ARG A 93 5.523 -27.880 -5.930 1.00 0.00 H new ATOM 0 HH22 ARG A 93 5.607 -29.620 -5.630 1.00 0.00 H new ATOM 1173 N ALA A 94 -0.003 -28.446 -1.490 1.00 0.00 N ATOM 1174 CA ALA A 94 0.319 -29.529 -0.584 1.00 0.00 C ATOM 1175 C ALA A 94 -0.705 -30.646 -0.723 1.00 0.00 C ATOM 1176 O ALA A 94 -0.464 -31.804 -0.346 1.00 0.00 O ATOM 1177 CB ALA A 94 0.331 -29.011 0.847 1.00 0.00 C ATOM 0 H ALA A 94 -0.526 -27.682 -1.061 1.00 0.00 H new ATOM 0 HA ALA A 94 1.305 -29.922 -0.832 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.573 -29.827 1.527 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.079 -28.224 0.943 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.651 -28.610 1.097 1.00 0.00 H new ATOM 1485 N GLU B 43 7.058 5.334 -1.225 1.00 0.00 N ATOM 1486 CA GLU B 43 5.637 5.261 -0.941 1.00 0.00 C ATOM 1487 C GLU B 43 4.907 4.746 -2.149 1.00 0.00 C ATOM 1488 O GLU B 43 3.948 4.008 -2.022 1.00 0.00 O ATOM 1489 CB GLU B 43 5.042 6.614 -0.515 1.00 0.00 C ATOM 1490 CG GLU B 43 5.077 7.665 -1.600 1.00 0.00 C ATOM 1491 CD GLU B 43 4.361 8.920 -1.238 1.00 0.00 C ATOM 1492 OE1 GLU B 43 4.939 9.756 -0.528 1.00 0.00 O ATOM 1493 OE2 GLU B 43 3.200 9.102 -1.681 1.00 0.00 O ATOM 0 HA GLU B 43 5.513 4.578 -0.100 1.00 0.00 H new ATOM 0 HB2 GLU B 43 4.009 6.463 -0.201 1.00 0.00 H new ATOM 0 HB3 GLU B 43 5.588 6.983 0.353 1.00 0.00 H new ATOM 0 HG2 GLU B 43 6.115 7.903 -1.831 1.00 0.00 H new ATOM 0 HG3 GLU B 43 4.635 7.253 -2.507 1.00 0.00 H new ATOM 1500 N LYS B 44 5.407 5.093 -3.331 1.00 0.00 N ATOM 1501 CA LYS B 44 4.763 4.689 -4.554 1.00 0.00 C ATOM 1502 C LYS B 44 4.949 3.214 -4.784 1.00 0.00 C ATOM 1503 O LYS B 44 3.999 2.513 -5.156 1.00 0.00 O ATOM 1504 CB LYS B 44 5.275 5.489 -5.727 1.00 0.00 C ATOM 1505 CG LYS B 44 4.765 6.921 -5.765 1.00 0.00 C ATOM 1506 CD LYS B 44 5.097 7.598 -7.082 1.00 0.00 C ATOM 1507 CE LYS B 44 6.598 7.693 -7.323 1.00 0.00 C ATOM 1508 NZ LYS B 44 6.916 8.271 -8.649 1.00 0.00 N ATOM 0 H LYS B 44 6.252 5.650 -3.457 1.00 0.00 H new ATOM 0 HA LYS B 44 3.696 4.888 -4.459 1.00 0.00 H new ATOM 0 HB2 LYS B 44 6.365 5.502 -5.697 1.00 0.00 H new ATOM 0 HB3 LYS B 44 4.987 4.986 -6.650 1.00 0.00 H new ATOM 0 HG2 LYS B 44 3.686 6.927 -5.614 1.00 0.00 H new ATOM 0 HG3 LYS B 44 5.205 7.486 -4.944 1.00 0.00 H new ATOM 0 HD2 LYS B 44 4.635 7.044 -7.899 1.00 0.00 H new ATOM 0 HD3 LYS B 44 4.666 8.599 -7.092 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.051 8.305 -6.543 1.00 0.00 H new ATOM 0 HE3 LYS B 44 7.040 6.700 -7.246 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.948 8.317 -8.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 6.506 7.674 -9.395 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 6.517 9.229 -8.715 1.00 0.00 H new ATOM 1522 N ARG B 45 6.172 2.752 -4.531 1.00 0.00 N ATOM 1523 CA ARG B 45 6.522 1.340 -4.625 1.00 0.00 C ATOM 1524 C ARG B 45 5.648 0.532 -3.694 1.00 0.00 C ATOM 1525 O ARG B 45 4.980 -0.425 -4.116 1.00 0.00 O ATOM 1526 CB ARG B 45 7.974 1.133 -4.222 1.00 0.00 C ATOM 1527 CG ARG B 45 8.998 1.716 -5.169 1.00 0.00 C ATOM 1528 CD ARG B 45 10.382 1.611 -4.569 1.00 0.00 C ATOM 1529 NE ARG B 45 10.716 0.220 -4.182 1.00 0.00 N ATOM 1530 CZ ARG B 45 11.903 -0.211 -3.713 1.00 0.00 C ATOM 1531 NH1 ARG B 45 12.941 0.616 -3.629 1.00 0.00 N ATOM 1532 NH2 ARG B 45 12.042 -1.483 -3.340 1.00 0.00 N ATOM 0 H ARG B 45 6.950 3.351 -4.254 1.00 0.00 H new ATOM 0 HA ARG B 45 6.374 1.016 -5.655 1.00 0.00 H new ATOM 0 HB2 ARG B 45 8.126 1.571 -3.235 1.00 0.00 H new ATOM 0 HB3 ARG B 45 8.158 0.063 -4.128 1.00 0.00 H new ATOM 0 HG2 ARG B 45 8.966 1.188 -6.122 1.00 0.00 H new ATOM 0 HG3 ARG B 45 8.761 2.760 -5.375 1.00 0.00 H new ATOM 0 HD2 ARG B 45 11.117 1.974 -5.288 1.00 0.00 H new ATOM 0 HD3 ARG B 45 10.447 2.256 -3.693 1.00 0.00 H new ATOM 0 HE ARG B 45 9.978 -0.477 -4.280 1.00 0.00 H new ATOM 0 HH11 ARG B 45 12.843 1.588 -3.921 1.00 0.00 H new ATOM 0 HH12 ARG B 45 13.835 0.278 -3.272 1.00 0.00 H new ATOM 0 HH21 ARG B 45 11.252 -2.124 -3.410 1.00 0.00 H new ATOM 0 HH22 ARG B 45 12.938 -1.815 -2.984 1.00 0.00 H new ATOM 1546 N ARG B 46 5.640 0.941 -2.427 1.00 0.00 N ATOM 1547 CA ARG B 46 4.869 0.281 -1.405 1.00 0.00 C ATOM 1548 C ARG B 46 3.393 0.255 -1.778 1.00 0.00 C ATOM 1549 O ARG B 46 2.804 -0.806 -1.868 1.00 0.00 O ATOM 1550 CB ARG B 46 5.038 0.983 -0.051 1.00 0.00 C ATOM 1551 CG ARG B 46 4.227 0.327 1.052 1.00 0.00 C ATOM 1552 CD ARG B 46 4.152 1.178 2.302 1.00 0.00 C ATOM 1553 NE ARG B 46 5.422 1.276 3.023 1.00 0.00 N ATOM 1554 CZ ARG B 46 5.729 2.211 3.925 1.00 0.00 C ATOM 1555 NH1 ARG B 46 4.949 3.271 4.090 1.00 0.00 N ATOM 1556 NH2 ARG B 46 6.846 2.077 4.643 1.00 0.00 N ATOM 0 H ARG B 46 6.173 1.743 -2.091 1.00 0.00 H new ATOM 0 HA ARG B 46 5.238 -0.741 -1.323 1.00 0.00 H new ATOM 0 HB2 ARG B 46 6.092 0.979 0.227 1.00 0.00 H new ATOM 0 HB3 ARG B 46 4.737 2.026 -0.147 1.00 0.00 H new ATOM 0 HG2 ARG B 46 3.218 0.131 0.689 1.00 0.00 H new ATOM 0 HG3 ARG B 46 4.670 -0.638 1.299 1.00 0.00 H new ATOM 0 HD2 ARG B 46 3.821 2.180 2.030 1.00 0.00 H new ATOM 0 HD3 ARG B 46 3.397 0.763 2.969 1.00 0.00 H new ATOM 0 HE ARG B 46 6.131 0.572 2.819 1.00 0.00 H new ATOM 0 HH11 ARG B 46 4.106 3.377 3.525 1.00 0.00 H new ATOM 0 HH12 ARG B 46 5.192 3.980 4.782 1.00 0.00 H new ATOM 0 HH21 ARG B 46 7.451 1.269 4.499 1.00 0.00 H new ATOM 0 HH22 ARG B 46 7.094 2.783 5.336 1.00 0.00 H new ATOM 1570 N ARG B 47 2.833 1.433 -2.025 1.00 0.00 N ATOM 1571 CA ARG B 47 1.416 1.613 -2.332 1.00 0.00 C ATOM 1572 C ARG B 47 0.975 0.731 -3.487 1.00 0.00 C ATOM 1573 O ARG B 47 -0.001 0.001 -3.372 1.00 0.00 O ATOM 1574 CB ARG B 47 1.146 3.093 -2.615 1.00 0.00 C ATOM 1575 CG ARG B 47 -0.303 3.480 -2.814 1.00 0.00 C ATOM 1576 CD ARG B 47 -0.450 4.992 -2.738 1.00 0.00 C ATOM 1577 NE ARG B 47 0.278 5.704 -3.801 1.00 0.00 N ATOM 1578 CZ ARG B 47 1.091 6.768 -3.600 1.00 0.00 C ATOM 1579 NH1 ARG B 47 1.403 7.170 -2.356 1.00 0.00 N ATOM 1580 NH2 ARG B 47 1.601 7.404 -4.642 1.00 0.00 N ATOM 0 H ARG B 47 3.359 2.307 -2.018 1.00 0.00 H new ATOM 0 HA ARG B 47 0.826 1.305 -1.469 1.00 0.00 H new ATOM 0 HB2 ARG B 47 1.547 3.679 -1.788 1.00 0.00 H new ATOM 0 HB3 ARG B 47 1.703 3.379 -3.507 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -0.655 3.120 -3.781 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -0.923 3.007 -2.052 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -1.507 5.250 -2.796 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -0.091 5.336 -1.768 1.00 0.00 H new ATOM 0 HE ARG B 47 0.162 5.372 -4.758 1.00 0.00 H new ATOM 0 HH11 ARG B 47 1.026 6.672 -1.550 1.00 0.00 H new ATOM 0 HH12 ARG B 47 2.017 7.973 -2.218 1.00 0.00 H new ATOM 0 HH21 ARG B 47 1.381 7.092 -5.588 1.00 0.00 H new ATOM 0 HH22 ARG B 47 2.214 8.206 -4.500 1.00 0.00 H new ATOM 1594 N ALA B 48 1.723 0.763 -4.566 1.00 0.00 N ATOM 1595 CA ALA B 48 1.429 -0.049 -5.729 1.00 0.00 C ATOM 1596 C ALA B 48 1.422 -1.524 -5.355 1.00 0.00 C ATOM 1597 O ALA B 48 0.444 -2.221 -5.600 1.00 0.00 O ATOM 1598 CB ALA B 48 2.438 0.214 -6.828 1.00 0.00 C ATOM 0 H ALA B 48 2.551 1.351 -4.664 1.00 0.00 H new ATOM 0 HA ALA B 48 0.440 0.220 -6.099 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.202 -0.404 -7.694 1.00 0.00 H new ATOM 0 HB2 ALA B 48 2.401 1.266 -7.112 1.00 0.00 H new ATOM 0 HB3 ALA B 48 3.438 -0.030 -6.470 1.00 0.00 H new ATOM 1604 N ARG B 49 2.482 -1.970 -4.688 1.00 0.00 N ATOM 1605 CA ARG B 49 2.610 -3.364 -4.287 1.00 0.00 C ATOM 1606 C ARG B 49 1.514 -3.802 -3.315 1.00 0.00 C ATOM 1607 O ARG B 49 1.103 -4.954 -3.344 1.00 0.00 O ATOM 1608 CB ARG B 49 4.000 -3.673 -3.724 1.00 0.00 C ATOM 1609 CG ARG B 49 5.114 -3.692 -4.753 1.00 0.00 C ATOM 1610 CD ARG B 49 4.931 -4.847 -5.726 1.00 0.00 C ATOM 1611 NE ARG B 49 6.009 -4.919 -6.707 1.00 0.00 N ATOM 1612 CZ ARG B 49 6.131 -5.861 -7.651 1.00 0.00 C ATOM 1613 NH1 ARG B 49 5.270 -6.888 -7.699 1.00 0.00 N ATOM 1614 NH2 ARG B 49 7.124 -5.785 -8.529 1.00 0.00 N ATOM 0 H ARG B 49 3.268 -1.381 -4.413 1.00 0.00 H new ATOM 0 HA ARG B 49 2.481 -3.950 -5.197 1.00 0.00 H new ATOM 0 HB2 ARG B 49 4.241 -2.932 -2.962 1.00 0.00 H new ATOM 0 HB3 ARG B 49 3.968 -4.642 -3.226 1.00 0.00 H new ATOM 0 HG2 ARG B 49 5.127 -2.749 -5.299 1.00 0.00 H new ATOM 0 HG3 ARG B 49 6.077 -3.783 -4.251 1.00 0.00 H new ATOM 0 HD2 ARG B 49 4.885 -5.784 -5.170 1.00 0.00 H new ATOM 0 HD3 ARG B 49 3.978 -4.736 -6.244 1.00 0.00 H new ATOM 0 HE ARG B 49 6.726 -4.195 -6.671 1.00 0.00 H new ATOM 0 HH11 ARG B 49 4.517 -6.955 -7.014 1.00 0.00 H new ATOM 0 HH12 ARG B 49 5.368 -7.602 -8.420 1.00 0.00 H new ATOM 0 HH21 ARG B 49 7.788 -5.012 -8.482 1.00 0.00 H new ATOM 0 HH22 ARG B 49 7.223 -6.499 -9.251 1.00 0.00 H new ATOM 1628 N ILE B 50 1.052 -2.891 -2.457 1.00 0.00 N ATOM 1629 CA ILE B 50 -0.054 -3.185 -1.537 1.00 0.00 C ATOM 1630 C ILE B 50 -1.305 -3.525 -2.335 1.00 0.00 C ATOM 1631 O ILE B 50 -1.929 -4.560 -2.124 1.00 0.00 O ATOM 1632 CB ILE B 50 -0.362 -1.978 -0.603 1.00 0.00 C ATOM 1633 CG1 ILE B 50 0.843 -1.670 0.276 1.00 0.00 C ATOM 1634 CG2 ILE B 50 -1.582 -2.273 0.279 1.00 0.00 C ATOM 1635 CD1 ILE B 50 0.739 -0.360 1.011 1.00 0.00 C ATOM 0 H ILE B 50 1.424 -1.945 -2.378 1.00 0.00 H new ATOM 0 HA ILE B 50 0.245 -4.031 -0.918 1.00 0.00 H new ATOM 0 HB ILE B 50 -0.581 -1.112 -1.228 1.00 0.00 H new ATOM 0 HG12 ILE B 50 0.967 -2.474 1.001 1.00 0.00 H new ATOM 0 HG13 ILE B 50 1.740 -1.658 -0.344 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -1.780 -1.417 0.924 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -2.451 -2.460 -0.352 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -1.383 -3.152 0.893 1.00 0.00 H new ATOM 0 HD11 ILE B 50 1.633 -0.210 1.616 1.00 0.00 H new ATOM 0 HD12 ILE B 50 0.646 0.454 0.292 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -0.138 -0.374 1.658 1.00 0.00 H new ATOM 1647 N ASN B 51 -1.625 -2.680 -3.292 1.00 0.00 N ATOM 1648 CA ASN B 51 -2.811 -2.888 -4.115 1.00 0.00 C ATOM 1649 C ASN B 51 -2.667 -4.122 -4.956 1.00 0.00 C ATOM 1650 O ASN B 51 -3.615 -4.883 -5.103 1.00 0.00 O ATOM 1651 CB ASN B 51 -3.128 -1.687 -5.010 1.00 0.00 C ATOM 1652 CG ASN B 51 -3.527 -0.454 -4.242 1.00 0.00 C ATOM 1653 OD1 ASN B 51 -4.695 -0.259 -3.917 1.00 0.00 O ATOM 1654 ND2 ASN B 51 -2.576 0.385 -3.957 1.00 0.00 N ATOM 0 H ASN B 51 -1.087 -1.845 -3.523 1.00 0.00 H new ATOM 0 HA ASN B 51 -3.645 -3.012 -3.425 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -2.254 -1.458 -5.620 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -3.933 -1.956 -5.694 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -2.788 1.242 -3.446 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -1.618 0.187 -4.245 1.00 0.00 H new ATOM 1661 N GLU B 52 -1.475 -4.329 -5.481 1.00 0.00 N ATOM 1662 CA GLU B 52 -1.183 -5.491 -6.317 1.00 0.00 C ATOM 1663 C GLU B 52 -1.315 -6.806 -5.549 1.00 0.00 C ATOM 1664 O GLU B 52 -1.879 -7.780 -6.065 1.00 0.00 O ATOM 1665 CB GLU B 52 0.211 -5.401 -6.944 1.00 0.00 C ATOM 1666 CG GLU B 52 0.396 -4.230 -7.885 1.00 0.00 C ATOM 1667 CD GLU B 52 -0.657 -4.190 -8.958 1.00 0.00 C ATOM 1668 OE1 GLU B 52 -0.656 -5.071 -9.848 1.00 0.00 O ATOM 1669 OE2 GLU B 52 -1.516 -3.290 -8.924 1.00 0.00 O ATOM 0 H GLU B 52 -0.681 -3.703 -5.345 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.929 -5.484 -7.112 1.00 0.00 H new ATOM 0 HB2 GLU B 52 0.951 -5.332 -6.147 1.00 0.00 H new ATOM 0 HB3 GLU B 52 0.413 -6.324 -7.487 1.00 0.00 H new ATOM 0 HG2 GLU B 52 0.367 -3.301 -7.316 1.00 0.00 H new ATOM 0 HG3 GLU B 52 1.381 -4.290 -8.348 1.00 0.00 H new ATOM 1676 N SER B 53 -0.843 -6.834 -4.316 1.00 0.00 N ATOM 1677 CA SER B 53 -0.881 -8.041 -3.552 1.00 0.00 C ATOM 1678 C SER B 53 -2.292 -8.306 -3.053 1.00 0.00 C ATOM 1679 O SER B 53 -2.759 -9.435 -3.089 1.00 0.00 O ATOM 1680 CB SER B 53 0.156 -7.998 -2.431 1.00 0.00 C ATOM 1681 OG SER B 53 0.070 -6.783 -1.714 1.00 0.00 O ATOM 0 H SER B 53 -0.433 -6.033 -3.835 1.00 0.00 H new ATOM 0 HA SER B 53 -0.612 -8.884 -4.189 1.00 0.00 H new ATOM 0 HB2 SER B 53 0.000 -8.837 -1.753 1.00 0.00 H new ATOM 0 HB3 SER B 53 1.156 -8.108 -2.850 1.00 0.00 H new ATOM 0 HG SER B 53 0.641 -6.110 -2.141 1.00 0.00 H new ATOM 1687 N LEU B 54 -2.988 -7.241 -2.661 1.00 0.00 N ATOM 1688 CA LEU B 54 -4.367 -7.321 -2.216 1.00 0.00 C ATOM 1689 C LEU B 54 -5.244 -7.772 -3.396 1.00 0.00 C ATOM 1690 O LEU B 54 -6.192 -8.525 -3.226 1.00 0.00 O ATOM 1691 CB LEU B 54 -4.803 -5.929 -1.713 1.00 0.00 C ATOM 1692 CG LEU B 54 -5.903 -5.862 -0.639 1.00 0.00 C ATOM 1693 CD1 LEU B 54 -6.034 -4.439 -0.130 1.00 0.00 C ATOM 1694 CD2 LEU B 54 -7.253 -6.354 -1.146 1.00 0.00 C ATOM 0 H LEU B 54 -2.604 -6.296 -2.645 1.00 0.00 H new ATOM 0 HA LEU B 54 -4.473 -8.041 -1.405 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.921 -5.424 -1.319 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -5.142 -5.353 -2.574 1.00 0.00 H new ATOM 0 HG LEU B 54 -5.603 -6.528 0.170 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -6.814 -4.395 0.630 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -5.086 -4.119 0.303 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -6.296 -3.779 -0.957 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -7.990 -6.284 -0.346 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -7.572 -5.739 -1.988 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -7.165 -7.392 -1.468 1.00 0.00 H new ATOM 1706 N SER B 55 -4.885 -7.327 -4.587 1.00 0.00 N ATOM 1707 CA SER B 55 -5.607 -7.654 -5.794 1.00 0.00 C ATOM 1708 C SER B 55 -5.525 -9.160 -6.069 1.00 0.00 C ATOM 1709 O SER B 55 -6.561 -9.826 -6.219 1.00 0.00 O ATOM 1710 CB SER B 55 -5.051 -6.841 -6.973 1.00 0.00 C ATOM 1711 OG SER B 55 -5.889 -6.903 -8.116 1.00 0.00 O ATOM 0 H SER B 55 -4.077 -6.724 -4.740 1.00 0.00 H new ATOM 0 HA SER B 55 -6.658 -7.394 -5.667 1.00 0.00 H new ATOM 0 HB2 SER B 55 -4.932 -5.801 -6.669 1.00 0.00 H new ATOM 0 HB3 SER B 55 -4.060 -7.213 -7.232 1.00 0.00 H new ATOM 0 HG SER B 55 -5.496 -6.370 -8.839 1.00 0.00 H new ATOM 1717 N GLN B 56 -4.311 -9.718 -6.079 1.00 0.00 N ATOM 1718 CA GLN B 56 -4.162 -11.150 -6.327 1.00 0.00 C ATOM 1719 C GLN B 56 -4.744 -11.956 -5.160 1.00 0.00 C ATOM 1720 O GLN B 56 -5.288 -13.029 -5.360 1.00 0.00 O ATOM 1721 CB GLN B 56 -2.704 -11.552 -6.625 1.00 0.00 C ATOM 1722 CG GLN B 56 -1.733 -11.312 -5.489 1.00 0.00 C ATOM 1723 CD GLN B 56 -0.325 -11.786 -5.804 1.00 0.00 C ATOM 1724 OE1 GLN B 56 0.036 -12.943 -5.546 1.00 0.00 O ATOM 1725 NE2 GLN B 56 0.479 -10.921 -6.358 1.00 0.00 N ATOM 0 H GLN B 56 -3.439 -9.213 -5.922 1.00 0.00 H new ATOM 0 HA GLN B 56 -4.729 -11.386 -7.228 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -2.680 -12.610 -6.887 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -2.361 -10.999 -7.500 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -1.709 -10.247 -5.257 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -2.092 -11.824 -4.597 1.00 0.00 H new ATOM 0 HE21 GLN B 56 0.152 -9.976 -6.558 1.00 0.00 H new ATOM 0 HE22 GLN B 56 1.435 -11.190 -6.591 1.00 0.00 H new ATOM 1734 N LEU B 57 -4.657 -11.388 -3.962 1.00 0.00 N ATOM 1735 CA LEU B 57 -5.224 -11.960 -2.741 1.00 0.00 C ATOM 1736 C LEU B 57 -6.726 -12.154 -2.925 1.00 0.00 C ATOM 1737 O LEU B 57 -7.242 -13.270 -2.865 1.00 0.00 O ATOM 1738 CB LEU B 57 -4.894 -10.992 -1.573 1.00 0.00 C ATOM 1739 CG LEU B 57 -5.447 -11.271 -0.177 1.00 0.00 C ATOM 1740 CD1 LEU B 57 -4.440 -10.796 0.865 1.00 0.00 C ATOM 1741 CD2 LEU B 57 -6.746 -10.506 0.028 1.00 0.00 C ATOM 0 H LEU B 57 -4.181 -10.499 -3.807 1.00 0.00 H new ATOM 0 HA LEU B 57 -4.800 -12.939 -2.517 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -3.808 -10.942 -1.489 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -5.237 -10.000 -1.866 1.00 0.00 H new ATOM 0 HG LEU B 57 -5.628 -12.341 -0.074 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -4.830 -10.993 1.864 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -3.499 -11.329 0.731 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -4.271 -9.726 0.746 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -7.135 -10.710 1.026 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -6.559 -9.437 -0.077 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -7.476 -10.822 -0.717 1.00 0.00 H new ATOM 1753 N LYS B 58 -7.379 -11.054 -3.214 1.00 0.00 N ATOM 1754 CA LYS B 58 -8.810 -10.963 -3.494 1.00 0.00 C ATOM 1755 C LYS B 58 -9.226 -11.988 -4.561 1.00 0.00 C ATOM 1756 O LYS B 58 -10.288 -12.637 -4.461 1.00 0.00 O ATOM 1757 CB LYS B 58 -9.077 -9.555 -4.033 1.00 0.00 C ATOM 1758 CG LYS B 58 -10.529 -9.197 -4.257 1.00 0.00 C ATOM 1759 CD LYS B 58 -10.665 -7.854 -4.967 1.00 0.00 C ATOM 1760 CE LYS B 58 -10.207 -7.925 -6.430 1.00 0.00 C ATOM 1761 NZ LYS B 58 -11.092 -8.780 -7.253 1.00 0.00 N ATOM 0 H LYS B 58 -6.913 -10.148 -3.265 1.00 0.00 H new ATOM 0 HA LYS B 58 -9.378 -11.165 -2.586 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -8.648 -8.834 -3.337 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -8.545 -9.442 -4.978 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -11.010 -9.975 -4.850 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -11.048 -9.159 -3.299 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -11.704 -7.528 -4.928 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -10.076 -7.104 -4.439 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -10.183 -6.920 -6.850 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -9.189 -8.313 -6.472 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -10.872 -8.640 -8.260 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -10.943 -9.778 -7.001 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -12.084 -8.523 -7.077 1.00 0.00 H new ATOM 1775 N THR B 59 -8.395 -12.110 -5.570 1.00 0.00 N ATOM 1776 CA THR B 59 -8.627 -13.005 -6.674 1.00 0.00 C ATOM 1777 C THR B 59 -8.544 -14.469 -6.208 1.00 0.00 C ATOM 1778 O THR B 59 -9.515 -15.223 -6.321 1.00 0.00 O ATOM 1779 CB THR B 59 -7.586 -12.731 -7.786 1.00 0.00 C ATOM 1780 OG1 THR B 59 -7.623 -11.331 -8.127 1.00 0.00 O ATOM 1781 CG2 THR B 59 -7.896 -13.537 -9.029 1.00 0.00 C ATOM 0 H THR B 59 -7.526 -11.581 -5.646 1.00 0.00 H new ATOM 0 HA THR B 59 -9.628 -12.833 -7.070 1.00 0.00 H new ATOM 0 HB THR B 59 -6.601 -13.016 -7.416 1.00 0.00 H new ATOM 0 HG1 THR B 59 -7.037 -10.831 -7.521 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.150 -13.326 -9.795 1.00 0.00 H new ATOM 0 HG22 THR B 59 -7.878 -14.600 -8.787 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.884 -13.266 -9.401 1.00 0.00 H new ATOM 1789 N LEU B 60 -7.416 -14.824 -5.613 1.00 0.00 N ATOM 1790 CA LEU B 60 -7.152 -16.182 -5.160 1.00 0.00 C ATOM 1791 C LEU B 60 -8.147 -16.659 -4.142 1.00 0.00 C ATOM 1792 O LEU B 60 -8.547 -17.809 -4.170 1.00 0.00 O ATOM 1793 CB LEU B 60 -5.724 -16.323 -4.620 1.00 0.00 C ATOM 1794 CG LEU B 60 -4.642 -16.733 -5.626 1.00 0.00 C ATOM 1795 CD1 LEU B 60 -4.885 -18.158 -6.096 1.00 0.00 C ATOM 1796 CD2 LEU B 60 -4.590 -15.781 -6.820 1.00 0.00 C ATOM 0 H LEU B 60 -6.652 -14.174 -5.429 1.00 0.00 H new ATOM 0 HA LEU B 60 -7.258 -16.820 -6.037 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -5.433 -15.371 -4.177 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -5.736 -17.058 -3.815 1.00 0.00 H new ATOM 0 HG LEU B 60 -3.677 -16.678 -5.122 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -4.112 -18.442 -6.810 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -4.855 -18.833 -5.241 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -5.862 -18.222 -6.574 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -3.811 -16.105 -7.510 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -5.553 -15.786 -7.331 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -4.369 -14.772 -6.472 1.00 0.00 H new ATOM 1808 N ILE B 61 -8.554 -15.785 -3.268 1.00 0.00 N ATOM 1809 CA ILE B 61 -9.499 -16.140 -2.243 1.00 0.00 C ATOM 1810 C ILE B 61 -10.867 -16.461 -2.804 1.00 0.00 C ATOM 1811 O ILE B 61 -11.422 -17.526 -2.525 1.00 0.00 O ATOM 1812 CB ILE B 61 -9.574 -15.064 -1.140 1.00 0.00 C ATOM 1813 CG1 ILE B 61 -8.264 -15.052 -0.366 1.00 0.00 C ATOM 1814 CG2 ILE B 61 -10.756 -15.287 -0.199 1.00 0.00 C ATOM 1815 CD1 ILE B 61 -7.945 -16.376 0.316 1.00 0.00 C ATOM 0 H ILE B 61 -8.245 -14.813 -3.243 1.00 0.00 H new ATOM 0 HA ILE B 61 -9.129 -17.056 -1.782 1.00 0.00 H new ATOM 0 HB ILE B 61 -9.731 -14.096 -1.615 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.452 -14.799 -1.047 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -8.304 -14.265 0.388 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.768 -14.506 0.561 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.685 -15.255 -0.768 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.659 -16.260 0.283 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -6.997 -16.292 0.848 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.738 -16.621 1.023 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.872 -17.163 -0.434 1.00 0.00 H new ATOM 1827 N LEU B 62 -11.394 -15.602 -3.635 1.00 0.00 N ATOM 1828 CA LEU B 62 -12.722 -15.841 -4.140 1.00 0.00 C ATOM 1829 C LEU B 62 -12.688 -17.068 -5.069 1.00 0.00 C ATOM 1830 O LEU B 62 -13.635 -17.861 -5.107 1.00 0.00 O ATOM 1831 CB LEU B 62 -13.290 -14.575 -4.818 1.00 0.00 C ATOM 1832 CG LEU B 62 -14.836 -14.369 -4.781 1.00 0.00 C ATOM 1833 CD1 LEU B 62 -15.593 -15.426 -5.569 1.00 0.00 C ATOM 1834 CD2 LEU B 62 -15.343 -14.309 -3.332 1.00 0.00 C ATOM 0 H LEU B 62 -10.940 -14.752 -3.970 1.00 0.00 H new ATOM 0 HA LEU B 62 -13.405 -16.064 -3.320 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -12.824 -13.707 -4.353 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -12.977 -14.584 -5.862 1.00 0.00 H new ATOM 0 HG LEU B 62 -15.034 -13.414 -5.267 1.00 0.00 H new ATOM 0 HD11 LEU B 62 -16.663 -15.230 -5.506 1.00 0.00 H new ATOM 0 HD12 LEU B 62 -15.279 -15.396 -6.612 1.00 0.00 H new ATOM 0 HD13 LEU B 62 -15.380 -16.411 -5.154 1.00 0.00 H new ATOM 0 HD21 LEU B 62 -16.423 -14.165 -3.330 1.00 0.00 H new ATOM 0 HD22 LEU B 62 -15.100 -15.242 -2.823 1.00 0.00 H new ATOM 0 HD23 LEU B 62 -14.865 -13.478 -2.813 1.00 0.00 H new ATOM 1846 N ASP B 63 -11.554 -17.281 -5.727 1.00 0.00 N ATOM 1847 CA ASP B 63 -11.408 -18.413 -6.609 1.00 0.00 C ATOM 1848 C ASP B 63 -11.115 -19.724 -5.900 1.00 0.00 C ATOM 1849 O ASP B 63 -11.361 -20.794 -6.453 1.00 0.00 O ATOM 1850 CB ASP B 63 -10.395 -18.216 -7.706 1.00 0.00 C ATOM 1851 CG ASP B 63 -10.822 -17.228 -8.776 1.00 0.00 C ATOM 1852 OD1 ASP B 63 -11.985 -17.313 -9.241 1.00 0.00 O ATOM 1853 OD2 ASP B 63 -10.018 -16.358 -9.180 1.00 0.00 O ATOM 0 H ASP B 63 -10.731 -16.683 -5.661 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.397 -18.481 -7.062 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -9.459 -17.874 -7.264 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -10.193 -19.179 -8.176 1.00 0.00 H new ATOM 1858 N ALA B 64 -10.549 -19.673 -4.735 1.00 0.00 N ATOM 1859 CA ALA B 64 -10.210 -20.905 -4.047 1.00 0.00 C ATOM 1860 C ALA B 64 -11.391 -21.489 -3.298 1.00 0.00 C ATOM 1861 O ALA B 64 -11.508 -22.707 -3.170 1.00 0.00 O ATOM 1862 CB ALA B 64 -9.023 -20.721 -3.123 1.00 0.00 C ATOM 0 H ALA B 64 -10.311 -18.815 -4.238 1.00 0.00 H new ATOM 0 HA ALA B 64 -9.929 -21.622 -4.819 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -8.799 -21.665 -2.626 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -8.157 -20.402 -3.703 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.258 -19.964 -2.375 1.00 0.00 H new ATOM 1868 N LEU B 65 -12.255 -20.636 -2.806 1.00 0.00 N ATOM 1869 CA LEU B 65 -13.402 -21.116 -2.037 1.00 0.00 C ATOM 1870 C LEU B 65 -14.617 -21.203 -2.915 1.00 0.00 C ATOM 1871 O LEU B 65 -15.551 -21.972 -2.637 1.00 0.00 O ATOM 1872 CB LEU B 65 -13.703 -20.249 -0.789 1.00 0.00 C ATOM 1873 CG LEU B 65 -12.614 -20.174 0.296 1.00 0.00 C ATOM 1874 CD1 LEU B 65 -11.436 -19.358 -0.174 1.00 0.00 C ATOM 1875 CD2 LEU B 65 -13.179 -19.601 1.580 1.00 0.00 C ATOM 0 H LEU B 65 -12.199 -19.623 -2.915 1.00 0.00 H new ATOM 0 HA LEU B 65 -13.140 -22.109 -1.672 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -13.914 -19.234 -1.126 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -14.615 -20.628 -0.327 1.00 0.00 H new ATOM 0 HG LEU B 65 -12.265 -21.188 0.493 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -10.682 -19.322 0.612 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -11.009 -19.816 -1.066 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -11.765 -18.346 -0.408 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -12.394 -19.556 2.335 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -13.561 -18.597 1.393 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -13.989 -20.237 1.937 1.00 0.00 H new ATOM 1887 N LYS B 66 -14.597 -20.404 -3.986 1.00 0.00 N ATOM 1888 CA LYS B 66 -15.665 -20.360 -4.976 1.00 0.00 C ATOM 1889 C LYS B 66 -16.992 -20.008 -4.344 1.00 0.00 C ATOM 1890 O LYS B 66 -17.931 -20.805 -4.335 1.00 0.00 O ATOM 1891 CB LYS B 66 -15.739 -21.674 -5.762 1.00 0.00 C ATOM 1892 CG LYS B 66 -14.531 -22.003 -6.653 1.00 0.00 C ATOM 1893 CD LYS B 66 -14.568 -21.275 -7.980 1.00 0.00 C ATOM 1894 CE LYS B 66 -13.882 -19.952 -7.881 1.00 0.00 C ATOM 1895 NZ LYS B 66 -13.841 -19.234 -9.169 1.00 0.00 N ATOM 0 H LYS B 66 -13.828 -19.765 -4.188 1.00 0.00 H new ATOM 0 HA LYS B 66 -15.431 -19.566 -5.685 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -15.873 -22.490 -5.052 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -16.630 -21.648 -6.389 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -13.614 -21.742 -6.125 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -14.500 -23.077 -6.833 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -14.086 -21.882 -8.746 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -15.603 -21.130 -8.291 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -14.395 -19.336 -7.142 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -12.864 -20.101 -7.520 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -13.268 -18.372 -9.068 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -13.419 -19.847 -9.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -14.807 -18.975 -9.453 1.00 0.00 H new ATOM 1909 N LYS B 67 -17.048 -18.833 -3.778 1.00 0.00 N ATOM 1910 CA LYS B 67 -18.258 -18.367 -3.154 1.00 0.00 C ATOM 1911 C LYS B 67 -19.261 -17.916 -4.194 1.00 0.00 C ATOM 1912 O LYS B 67 -20.165 -18.676 -4.550 1.00 0.00 O ATOM 1913 CB LYS B 67 -17.978 -17.274 -2.114 1.00 0.00 C ATOM 1914 CG LYS B 67 -17.216 -17.776 -0.901 1.00 0.00 C ATOM 1915 CD LYS B 67 -16.937 -16.671 0.098 1.00 0.00 C ATOM 1916 CE LYS B 67 -16.249 -17.222 1.343 1.00 0.00 C ATOM 1917 NZ LYS B 67 -17.132 -18.111 2.136 1.00 0.00 N ATOM 0 H LYS B 67 -16.267 -18.178 -3.736 1.00 0.00 H new ATOM 0 HA LYS B 67 -18.698 -19.205 -2.613 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -17.409 -16.472 -2.585 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -18.924 -16.844 -1.787 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -17.789 -18.566 -0.416 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -16.273 -18.218 -1.224 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -16.308 -15.909 -0.363 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -17.871 -16.185 0.379 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -15.356 -17.773 1.047 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -15.919 -16.393 1.968 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -16.698 -18.294 3.063 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -18.056 -17.652 2.271 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -17.263 -19.011 1.631 1.00 0.00 H new ATOM 1931 N ASP B 68 -19.060 -16.727 -4.728 1.00 0.00 N ATOM 1932 CA ASP B 68 -19.952 -16.139 -5.726 1.00 0.00 C ATOM 1933 C ASP B 68 -19.432 -14.785 -6.015 1.00 0.00 C ATOM 1934 O ASP B 68 -18.835 -14.147 -5.132 1.00 0.00 O ATOM 1935 CB ASP B 68 -21.362 -15.970 -5.178 1.00 0.00 C ATOM 1936 CG ASP B 68 -22.436 -15.818 -6.244 1.00 0.00 C ATOM 1937 OD1 ASP B 68 -22.346 -14.903 -7.078 1.00 0.00 O ATOM 1938 OD2 ASP B 68 -23.424 -16.576 -6.207 1.00 0.00 O ATOM 0 H ASP B 68 -18.268 -16.132 -4.484 1.00 0.00 H new ATOM 0 HA ASP B 68 -19.989 -16.785 -6.603 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -21.603 -16.833 -4.557 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -21.384 -15.094 -4.530 1.00 0.00 H new ATOM 1943 N SER B 69 -19.653 -14.328 -7.186 1.00 0.00 N ATOM 1944 CA SER B 69 -19.213 -13.040 -7.556 1.00 0.00 C ATOM 1945 C SER B 69 -20.243 -11.958 -7.170 1.00 0.00 C ATOM 1946 O SER B 69 -19.898 -10.779 -7.049 1.00 0.00 O ATOM 1947 CB SER B 69 -18.869 -13.015 -9.025 1.00 0.00 C ATOM 1948 OG SER B 69 -17.819 -13.940 -9.306 1.00 0.00 O ATOM 0 H SER B 69 -20.146 -14.838 -7.919 1.00 0.00 H new ATOM 0 HA SER B 69 -18.306 -12.804 -7.000 1.00 0.00 H new ATOM 0 HB2 SER B 69 -19.750 -13.265 -9.616 1.00 0.00 H new ATOM 0 HB3 SER B 69 -18.565 -12.010 -9.317 1.00 0.00 H new ATOM 0 HG SER B 69 -17.608 -13.914 -10.263 1.00 0.00 H new ATOM 1954 N SER B 70 -21.480 -12.376 -6.930 1.00 0.00 N ATOM 1955 CA SER B 70 -22.550 -11.478 -6.536 1.00 0.00 C ATOM 1956 C SER B 70 -22.258 -10.905 -5.144 1.00 0.00 C ATOM 1957 O SER B 70 -22.231 -9.683 -4.947 1.00 0.00 O ATOM 1958 CB SER B 70 -23.893 -12.238 -6.562 1.00 0.00 C ATOM 1959 OG SER B 70 -25.000 -11.431 -6.179 1.00 0.00 O ATOM 0 H SER B 70 -21.767 -13.352 -7.004 1.00 0.00 H new ATOM 0 HA SER B 70 -22.615 -10.645 -7.236 1.00 0.00 H new ATOM 0 HB2 SER B 70 -24.064 -12.626 -7.566 1.00 0.00 H new ATOM 0 HB3 SER B 70 -23.830 -13.098 -5.895 1.00 0.00 H new ATOM 0 HG SER B 70 -25.822 -11.964 -6.216 1.00 0.00 H new ATOM 1965 N ARG B 71 -21.984 -11.793 -4.185 1.00 0.00 N ATOM 1966 CA ARG B 71 -21.666 -11.375 -2.823 1.00 0.00 C ATOM 1967 C ARG B 71 -20.347 -10.601 -2.798 1.00 0.00 C ATOM 1968 O ARG B 71 -20.175 -9.660 -2.033 1.00 0.00 O ATOM 1969 CB ARG B 71 -21.590 -12.586 -1.887 1.00 0.00 C ATOM 1970 CG ARG B 71 -20.551 -13.605 -2.295 1.00 0.00 C ATOM 1971 CD ARG B 71 -19.788 -14.116 -1.109 1.00 0.00 C ATOM 1972 NE ARG B 71 -20.591 -14.967 -0.223 1.00 0.00 N ATOM 1973 CZ ARG B 71 -20.885 -14.711 1.066 1.00 0.00 C ATOM 1974 NH1 ARG B 71 -20.649 -13.503 1.599 1.00 0.00 N ATOM 1975 NH2 ARG B 71 -21.465 -15.653 1.800 1.00 0.00 N ATOM 0 H ARG B 71 -21.977 -12.803 -4.329 1.00 0.00 H new ATOM 0 HA ARG B 71 -22.463 -10.720 -2.472 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -21.370 -12.240 -0.877 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -22.566 -13.069 -1.853 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -21.037 -14.438 -2.803 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -19.860 -13.156 -3.008 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -18.924 -14.681 -1.458 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -19.406 -13.269 -0.539 1.00 0.00 H new ATOM 0 HE ARG B 71 -20.960 -15.831 -0.620 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -20.242 -12.764 1.026 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -20.877 -13.324 2.577 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -21.683 -16.560 1.387 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -21.692 -15.470 2.777 1.00 0.00 H new ATOM 1989 N HIS B 72 -19.447 -10.983 -3.685 1.00 0.00 N ATOM 1990 CA HIS B 72 -18.134 -10.370 -3.786 1.00 0.00 C ATOM 1991 C HIS B 72 -18.207 -8.962 -4.403 1.00 0.00 C ATOM 1992 O HIS B 72 -17.269 -8.174 -4.267 1.00 0.00 O ATOM 1993 CB HIS B 72 -17.194 -11.284 -4.592 1.00 0.00 C ATOM 1994 CG HIS B 72 -15.759 -10.840 -4.622 1.00 0.00 C ATOM 1995 ND1 HIS B 72 -14.928 -10.878 -3.526 1.00 0.00 N ATOM 1996 CD2 HIS B 72 -15.017 -10.337 -5.634 1.00 0.00 C ATOM 1997 CE1 HIS B 72 -13.746 -10.411 -3.886 1.00 0.00 C ATOM 1998 NE2 HIS B 72 -13.736 -10.067 -5.160 1.00 0.00 N ATOM 0 H HIS B 72 -19.606 -11.731 -4.360 1.00 0.00 H new ATOM 0 HA HIS B 72 -17.733 -10.251 -2.779 1.00 0.00 H new ATOM 0 HB2 HIS B 72 -17.240 -12.289 -4.173 1.00 0.00 H new ATOM 0 HB3 HIS B 72 -17.562 -11.348 -5.616 1.00 0.00 H new ATOM 0 HD2 HIS B 72 -15.361 -10.172 -6.644 1.00 0.00 H new ATOM 0 HE1 HIS B 72 -12.898 -10.322 -3.224 1.00 0.00 H new ATOM 0 HE2 HIS B 72 -12.952 -9.683 -5.688 1.00 0.00 H new ATOM 2006 N SER B 73 -19.337 -8.631 -5.034 1.00 0.00 N ATOM 2007 CA SER B 73 -19.505 -7.330 -5.681 1.00 0.00 C ATOM 2008 C SER B 73 -19.514 -6.204 -4.659 1.00 0.00 C ATOM 2009 O SER B 73 -19.302 -5.028 -4.983 1.00 0.00 O ATOM 2010 CB SER B 73 -20.746 -7.309 -6.578 1.00 0.00 C ATOM 2011 OG SER B 73 -20.873 -6.077 -7.274 1.00 0.00 O ATOM 0 H SER B 73 -20.147 -9.246 -5.110 1.00 0.00 H new ATOM 0 HA SER B 73 -18.645 -7.164 -6.329 1.00 0.00 H new ATOM 0 HB2 SER B 73 -20.690 -8.128 -7.295 1.00 0.00 H new ATOM 0 HB3 SER B 73 -21.636 -7.477 -5.971 1.00 0.00 H new ATOM 0 HG SER B 73 -21.675 -6.101 -7.837 1.00 0.00 H new ATOM 2017 N LYS B 74 -19.735 -6.581 -3.454 1.00 0.00 N ATOM 2018 CA LYS B 74 -19.667 -5.699 -2.342 1.00 0.00 C ATOM 2019 C LYS B 74 -19.071 -6.443 -1.174 1.00 0.00 C ATOM 2020 O LYS B 74 -19.774 -6.920 -0.283 1.00 0.00 O ATOM 2021 CB LYS B 74 -21.029 -5.036 -1.999 1.00 0.00 C ATOM 2022 CG LYS B 74 -21.094 -4.126 -0.725 1.00 0.00 C ATOM 2023 CD LYS B 74 -20.310 -2.784 -0.799 1.00 0.00 C ATOM 2024 CE LYS B 74 -18.794 -2.944 -0.755 1.00 0.00 C ATOM 2025 NZ LYS B 74 -18.097 -1.649 -0.559 1.00 0.00 N ATOM 0 H LYS B 74 -19.976 -7.540 -3.204 1.00 0.00 H new ATOM 0 HA LYS B 74 -19.021 -4.860 -2.602 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -21.336 -4.436 -2.856 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -21.768 -5.828 -1.884 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -22.140 -3.901 -0.518 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -20.717 -4.697 0.123 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -20.583 -2.266 -1.719 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -20.621 -2.148 0.029 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -18.526 -3.624 0.053 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -18.452 -3.401 -1.683 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -17.075 -1.779 -0.704 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -18.458 -0.953 -1.243 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -18.268 -1.305 0.408 1.00 0.00 H new ATOM 2039 N LEU B 75 -17.796 -6.657 -1.266 1.00 0.00 N ATOM 2040 CA LEU B 75 -17.060 -7.223 -0.207 1.00 0.00 C ATOM 2041 C LEU B 75 -16.096 -6.167 0.219 1.00 0.00 C ATOM 2042 O LEU B 75 -15.397 -5.585 -0.624 1.00 0.00 O ATOM 2043 CB LEU B 75 -16.332 -8.506 -0.636 1.00 0.00 C ATOM 2044 CG LEU B 75 -16.335 -9.609 0.426 1.00 0.00 C ATOM 2045 CD1 LEU B 75 -17.726 -10.175 0.606 1.00 0.00 C ATOM 2046 CD2 LEU B 75 -15.323 -10.708 0.142 1.00 0.00 C ATOM 0 H LEU B 75 -17.241 -6.437 -2.093 1.00 0.00 H new ATOM 0 HA LEU B 75 -17.715 -7.524 0.611 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -16.797 -8.889 -1.544 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -15.300 -8.260 -0.886 1.00 0.00 H new ATOM 0 HG LEU B 75 -16.025 -9.146 1.363 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -17.705 -10.957 1.365 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -18.404 -9.382 0.921 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -18.073 -10.595 -0.338 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -15.372 -11.460 0.929 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -15.549 -11.172 -0.818 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -14.321 -10.281 0.111 1.00 0.00 H new ATOM 2058 N GLU B 76 -16.095 -5.859 1.477 1.00 0.00 N ATOM 2059 CA GLU B 76 -15.260 -4.815 1.977 1.00 0.00 C ATOM 2060 C GLU B 76 -13.849 -5.321 2.116 1.00 0.00 C ATOM 2061 O GLU B 76 -13.621 -6.528 2.179 1.00 0.00 O ATOM 2062 CB GLU B 76 -15.790 -4.326 3.322 1.00 0.00 C ATOM 2063 CG GLU B 76 -17.201 -3.726 3.254 1.00 0.00 C ATOM 2064 CD GLU B 76 -17.290 -2.432 2.453 1.00 0.00 C ATOM 2065 OE1 GLU B 76 -16.266 -1.925 1.978 1.00 0.00 O ATOM 2066 OE2 GLU B 76 -18.407 -1.893 2.282 1.00 0.00 O ATOM 0 H GLU B 76 -16.669 -6.321 2.182 1.00 0.00 H new ATOM 0 HA GLU B 76 -15.266 -3.978 1.279 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -15.794 -5.159 4.025 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -15.106 -3.577 3.720 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -17.875 -4.460 2.814 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -17.553 -3.538 4.268 1.00 0.00 H new ATOM 2073 N LYS B 77 -12.913 -4.410 2.167 1.00 0.00 N ATOM 2074 CA LYS B 77 -11.506 -4.721 2.316 1.00 0.00 C ATOM 2075 C LYS B 77 -11.271 -5.599 3.547 1.00 0.00 C ATOM 2076 O LYS B 77 -10.502 -6.552 3.518 1.00 0.00 O ATOM 2077 CB LYS B 77 -10.730 -3.413 2.401 1.00 0.00 C ATOM 2078 CG LYS B 77 -9.267 -3.581 2.729 1.00 0.00 C ATOM 2079 CD LYS B 77 -8.438 -2.317 2.433 1.00 0.00 C ATOM 2080 CE LYS B 77 -8.520 -1.883 0.968 1.00 0.00 C ATOM 2081 NZ LYS B 77 -7.741 -0.652 0.696 1.00 0.00 N ATOM 0 H LYS B 77 -13.106 -3.410 2.105 1.00 0.00 H new ATOM 0 HA LYS B 77 -11.155 -5.289 1.454 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -10.819 -2.888 1.450 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -11.190 -2.779 3.159 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -9.163 -3.839 3.783 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -8.865 -4.416 2.155 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -8.786 -1.503 3.068 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -7.396 -2.502 2.695 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -8.153 -2.689 0.333 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -9.563 -1.716 0.700 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -7.829 -0.400 -0.309 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -8.106 0.126 1.281 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -6.740 -0.817 0.925 1.00 0.00 H new ATOM 2095 N ALA B 78 -11.989 -5.278 4.584 1.00 0.00 N ATOM 2096 CA ALA B 78 -11.967 -6.017 5.832 1.00 0.00 C ATOM 2097 C ALA B 78 -12.473 -7.453 5.644 1.00 0.00 C ATOM 2098 O ALA B 78 -12.006 -8.365 6.302 1.00 0.00 O ATOM 2099 CB ALA B 78 -12.818 -5.296 6.857 1.00 0.00 C ATOM 0 H ALA B 78 -12.623 -4.479 4.595 1.00 0.00 H new ATOM 0 HA ALA B 78 -10.936 -6.073 6.180 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.803 -5.849 7.796 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.421 -4.294 7.020 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -13.843 -5.225 6.494 1.00 0.00 H new ATOM 2105 N ASP B 79 -13.382 -7.636 4.699 1.00 0.00 N ATOM 2106 CA ASP B 79 -14.002 -8.947 4.451 1.00 0.00 C ATOM 2107 C ASP B 79 -13.063 -9.785 3.664 1.00 0.00 C ATOM 2108 O ASP B 79 -12.854 -10.952 3.945 1.00 0.00 O ATOM 2109 CB ASP B 79 -15.314 -8.820 3.671 1.00 0.00 C ATOM 2110 CG ASP B 79 -16.423 -8.147 4.416 1.00 0.00 C ATOM 2111 OD1 ASP B 79 -16.761 -8.584 5.540 1.00 0.00 O ATOM 2112 OD2 ASP B 79 -17.009 -7.198 3.877 1.00 0.00 O ATOM 0 H ASP B 79 -13.714 -6.894 4.083 1.00 0.00 H new ATOM 0 HA ASP B 79 -14.221 -9.401 5.417 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.122 -8.265 2.753 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -15.644 -9.817 3.378 1.00 0.00 H new ATOM 2117 N ILE B 80 -12.489 -9.160 2.678 1.00 0.00 N ATOM 2118 CA ILE B 80 -11.543 -9.779 1.789 1.00 0.00 C ATOM 2119 C ILE B 80 -10.290 -10.207 2.565 1.00 0.00 C ATOM 2120 O ILE B 80 -9.880 -11.361 2.475 1.00 0.00 O ATOM 2121 CB ILE B 80 -11.225 -8.804 0.624 1.00 0.00 C ATOM 2122 CG1 ILE B 80 -12.549 -8.468 -0.083 1.00 0.00 C ATOM 2123 CG2 ILE B 80 -10.241 -9.435 -0.355 1.00 0.00 C ATOM 2124 CD1 ILE B 80 -12.545 -7.242 -0.959 1.00 0.00 C ATOM 0 H ILE B 80 -12.669 -8.179 2.462 1.00 0.00 H new ATOM 0 HA ILE B 80 -11.966 -10.685 1.355 1.00 0.00 H new ATOM 0 HB ILE B 80 -10.762 -7.896 1.011 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -12.838 -9.324 -0.693 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -13.321 -8.343 0.677 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -10.032 -8.734 -1.163 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -9.314 -9.675 0.165 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -10.673 -10.347 -0.768 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -13.532 -7.108 -1.402 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -12.295 -6.367 -0.359 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -11.805 -7.363 -1.750 1.00 0.00 H new ATOM 2136 N LEU B 81 -9.733 -9.299 3.369 1.00 0.00 N ATOM 2137 CA LEU B 81 -8.578 -9.626 4.222 1.00 0.00 C ATOM 2138 C LEU B 81 -8.896 -10.789 5.140 1.00 0.00 C ATOM 2139 O LEU B 81 -8.168 -11.779 5.178 1.00 0.00 O ATOM 2140 CB LEU B 81 -8.144 -8.430 5.074 1.00 0.00 C ATOM 2141 CG LEU B 81 -7.001 -7.557 4.552 1.00 0.00 C ATOM 2142 CD1 LEU B 81 -7.324 -6.945 3.195 1.00 0.00 C ATOM 2143 CD2 LEU B 81 -6.691 -6.477 5.569 1.00 0.00 C ATOM 0 H LEU B 81 -10.057 -8.335 3.451 1.00 0.00 H new ATOM 0 HA LEU B 81 -7.762 -9.897 3.552 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -9.014 -7.790 5.220 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -7.856 -8.806 6.056 1.00 0.00 H new ATOM 0 HG LEU B 81 -6.124 -8.189 4.411 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -6.485 -6.333 2.863 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -7.503 -7.740 2.471 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -8.215 -6.323 3.279 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -5.877 -5.853 5.200 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -7.577 -5.862 5.728 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.396 -6.939 6.511 1.00 0.00 H new ATOM 2155 N GLU B 82 -10.009 -10.678 5.838 1.00 0.00 N ATOM 2156 CA GLU B 82 -10.451 -11.690 6.766 1.00 0.00 C ATOM 2157 C GLU B 82 -10.671 -13.022 6.095 1.00 0.00 C ATOM 2158 O GLU B 82 -10.297 -14.036 6.635 1.00 0.00 O ATOM 2159 CB GLU B 82 -11.708 -11.227 7.485 1.00 0.00 C ATOM 2160 CG GLU B 82 -12.475 -12.278 8.208 1.00 0.00 C ATOM 2161 CD GLU B 82 -13.755 -11.754 8.785 1.00 0.00 C ATOM 2162 OE1 GLU B 82 -13.734 -10.706 9.466 1.00 0.00 O ATOM 2163 OE2 GLU B 82 -14.810 -12.401 8.606 1.00 0.00 O ATOM 0 H GLU B 82 -10.634 -9.875 5.774 1.00 0.00 H new ATOM 0 HA GLU B 82 -9.658 -11.836 7.499 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -11.429 -10.453 8.200 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -12.369 -10.762 6.754 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -12.696 -13.098 7.525 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -11.859 -12.688 9.009 1.00 0.00 H new ATOM 2170 N MET B 83 -11.205 -13.018 4.894 1.00 0.00 N ATOM 2171 CA MET B 83 -11.533 -14.259 4.235 1.00 0.00 C ATOM 2172 C MET B 83 -10.266 -14.977 3.829 1.00 0.00 C ATOM 2173 O MET B 83 -10.210 -16.198 3.795 1.00 0.00 O ATOM 2174 CB MET B 83 -12.471 -14.027 3.047 1.00 0.00 C ATOM 2175 CG MET B 83 -13.061 -15.305 2.463 1.00 0.00 C ATOM 2176 SD MET B 83 -13.855 -16.355 3.712 1.00 0.00 S ATOM 2177 CE MET B 83 -15.045 -15.220 4.438 1.00 0.00 C ATOM 0 H MET B 83 -11.419 -12.177 4.359 1.00 0.00 H new ATOM 0 HA MET B 83 -12.072 -14.898 4.935 1.00 0.00 H new ATOM 0 HB2 MET B 83 -13.285 -13.374 3.362 1.00 0.00 H new ATOM 0 HB3 MET B 83 -11.925 -13.500 2.264 1.00 0.00 H new ATOM 0 HG2 MET B 83 -13.792 -15.044 1.698 1.00 0.00 H new ATOM 0 HG3 MET B 83 -12.271 -15.871 1.970 1.00 0.00 H new ATOM 0 HE1 MET B 83 -15.721 -15.771 5.092 1.00 0.00 H new ATOM 0 HE2 MET B 83 -14.518 -14.462 5.017 1.00 0.00 H new ATOM 0 HE3 MET B 83 -15.618 -14.738 3.646 1.00 0.00 H new ATOM 2187 N THR B 84 -9.238 -14.201 3.610 1.00 0.00 N ATOM 2188 CA THR B 84 -7.939 -14.704 3.274 1.00 0.00 C ATOM 2189 C THR B 84 -7.318 -15.383 4.504 1.00 0.00 C ATOM 2190 O THR B 84 -6.795 -16.499 4.430 1.00 0.00 O ATOM 2191 CB THR B 84 -7.059 -13.534 2.794 1.00 0.00 C ATOM 2192 OG1 THR B 84 -7.785 -12.813 1.805 1.00 0.00 O ATOM 2193 CG2 THR B 84 -5.778 -14.024 2.159 1.00 0.00 C ATOM 0 H THR B 84 -9.284 -13.183 3.662 1.00 0.00 H new ATOM 0 HA THR B 84 -8.015 -15.442 2.475 1.00 0.00 H new ATOM 0 HB THR B 84 -6.808 -12.915 3.656 1.00 0.00 H new ATOM 0 HG1 THR B 84 -8.412 -12.200 2.242 1.00 0.00 H new ATOM 0 HG21 THR B 84 -5.184 -13.170 1.833 1.00 0.00 H new ATOM 0 HG22 THR B 84 -5.210 -14.605 2.886 1.00 0.00 H new ATOM 0 HG23 THR B 84 -6.015 -14.651 1.299 1.00 0.00 H new ATOM 2201 N VAL B 85 -7.452 -14.729 5.639 1.00 0.00 N ATOM 2202 CA VAL B 85 -6.914 -15.233 6.890 1.00 0.00 C ATOM 2203 C VAL B 85 -7.711 -16.453 7.358 1.00 0.00 C ATOM 2204 O VAL B 85 -7.154 -17.421 7.860 1.00 0.00 O ATOM 2205 CB VAL B 85 -6.968 -14.153 7.981 1.00 0.00 C ATOM 2206 CG1 VAL B 85 -6.298 -14.610 9.260 1.00 0.00 C ATOM 2207 CG2 VAL B 85 -6.366 -12.868 7.502 1.00 0.00 C ATOM 0 H VAL B 85 -7.935 -13.835 5.723 1.00 0.00 H new ATOM 0 HA VAL B 85 -5.876 -15.517 6.717 1.00 0.00 H new ATOM 0 HB VAL B 85 -8.021 -13.977 8.203 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -6.358 -13.817 10.006 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -6.801 -15.501 9.636 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -5.252 -14.841 9.060 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -6.419 -12.123 8.296 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -5.324 -13.034 7.229 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -6.917 -12.510 6.632 1.00 0.00 H new ATOM 2217 N LYS B 86 -9.009 -16.410 7.183 1.00 0.00 N ATOM 2218 CA LYS B 86 -9.851 -17.510 7.590 1.00 0.00 C ATOM 2219 C LYS B 86 -9.626 -18.736 6.703 1.00 0.00 C ATOM 2220 O LYS B 86 -9.605 -19.870 7.190 1.00 0.00 O ATOM 2221 CB LYS B 86 -11.325 -17.097 7.675 1.00 0.00 C ATOM 2222 CG LYS B 86 -11.570 -15.938 8.653 1.00 0.00 C ATOM 2223 CD LYS B 86 -13.031 -15.788 9.001 1.00 0.00 C ATOM 2224 CE LYS B 86 -13.201 -14.932 10.249 1.00 0.00 C ATOM 2225 NZ LYS B 86 -14.599 -14.525 10.469 1.00 0.00 N ATOM 0 H LYS B 86 -9.506 -15.625 6.762 1.00 0.00 H new ATOM 0 HA LYS B 86 -9.561 -17.798 8.601 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.673 -16.808 6.683 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -11.920 -17.957 7.983 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -10.996 -16.106 9.564 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.205 -15.010 8.213 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -13.564 -15.333 8.166 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -13.474 -16.770 9.164 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -12.847 -15.488 11.117 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -12.577 -14.043 10.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -14.720 -14.218 11.455 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -14.836 -13.739 9.830 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -15.229 -15.330 10.277 1.00 0.00 H new ATOM 2239 N HIS B 87 -9.379 -18.496 5.414 1.00 0.00 N ATOM 2240 CA HIS B 87 -9.038 -19.566 4.473 1.00 0.00 C ATOM 2241 C HIS B 87 -7.691 -20.177 4.863 1.00 0.00 C ATOM 2242 O HIS B 87 -7.467 -21.382 4.696 1.00 0.00 O ATOM 2243 CB HIS B 87 -9.018 -19.026 3.028 1.00 0.00 C ATOM 2244 CG HIS B 87 -8.660 -20.024 1.949 1.00 0.00 C ATOM 2245 ND1 HIS B 87 -9.345 -21.198 1.708 1.00 0.00 N ATOM 2246 CD2 HIS B 87 -7.681 -19.976 1.015 1.00 0.00 C ATOM 2247 CE1 HIS B 87 -8.780 -21.804 0.666 1.00 0.00 C ATOM 2248 NE2 HIS B 87 -7.763 -21.102 0.202 1.00 0.00 N ATOM 0 H HIS B 87 -9.409 -17.566 4.996 1.00 0.00 H new ATOM 0 HA HIS B 87 -9.796 -20.348 4.518 1.00 0.00 H new ATOM 0 HB2 HIS B 87 -10.002 -18.615 2.802 1.00 0.00 H new ATOM 0 HB3 HIS B 87 -8.308 -18.200 2.980 1.00 0.00 H new ATOM 0 HD1 HIS B 87 -10.146 -21.542 2.237 1.00 0.00 H new ATOM 0 HD2 HIS B 87 -6.950 -19.187 0.916 1.00 0.00 H new ATOM 0 HE1 HIS B 87 -9.110 -22.746 0.254 1.00 0.00 H new ATOM 2256 N LEU B 88 -6.822 -19.340 5.426 1.00 0.00 N ATOM 2257 CA LEU B 88 -5.538 -19.772 5.939 1.00 0.00 C ATOM 2258 C LEU B 88 -5.735 -20.835 6.998 1.00 0.00 C ATOM 2259 O LEU B 88 -5.100 -21.872 6.944 1.00 0.00 O ATOM 2260 CB LEU B 88 -4.757 -18.583 6.512 1.00 0.00 C ATOM 2261 CG LEU B 88 -3.562 -18.909 7.409 1.00 0.00 C ATOM 2262 CD1 LEU B 88 -2.489 -19.669 6.660 1.00 0.00 C ATOM 2263 CD2 LEU B 88 -3.014 -17.647 8.034 1.00 0.00 C ATOM 0 H LEU B 88 -6.996 -18.341 5.536 1.00 0.00 H new ATOM 0 HA LEU B 88 -4.959 -20.195 5.118 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -4.401 -17.978 5.679 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -5.450 -17.964 7.082 1.00 0.00 H new ATOM 0 HG LEU B 88 -3.910 -19.563 8.209 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.657 -19.882 7.332 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -2.901 -20.606 6.285 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -2.134 -19.068 5.823 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -2.164 -17.895 8.670 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -2.693 -16.962 7.249 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -3.790 -17.172 8.635 1.00 0.00 H new ATOM 2275 N ARG B 89 -6.649 -20.587 7.936 1.00 0.00 N ATOM 2276 CA ARG B 89 -6.937 -21.566 8.985 1.00 0.00 C ATOM 2277 C ARG B 89 -7.414 -22.874 8.385 1.00 0.00 C ATOM 2278 O ARG B 89 -6.973 -23.940 8.789 1.00 0.00 O ATOM 2279 CB ARG B 89 -7.971 -21.075 10.008 1.00 0.00 C ATOM 2280 CG ARG B 89 -7.464 -20.139 11.096 1.00 0.00 C ATOM 2281 CD ARG B 89 -7.106 -18.767 10.595 1.00 0.00 C ATOM 2282 NE ARG B 89 -6.695 -17.891 11.705 1.00 0.00 N ATOM 2283 CZ ARG B 89 -7.225 -16.683 11.971 1.00 0.00 C ATOM 2284 NH1 ARG B 89 -8.341 -16.285 11.361 1.00 0.00 N ATOM 2285 NH2 ARG B 89 -6.698 -15.919 12.916 1.00 0.00 N ATOM 0 H ARG B 89 -7.197 -19.728 7.992 1.00 0.00 H new ATOM 0 HA ARG B 89 -5.997 -21.716 9.515 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -8.770 -20.568 9.468 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -8.415 -21.947 10.489 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -8.228 -20.046 11.868 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -6.588 -20.584 11.567 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -6.298 -18.841 9.867 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -7.961 -18.330 10.079 1.00 0.00 H new ATOM 0 HE ARG B 89 -5.952 -18.225 12.319 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -8.800 -16.898 10.687 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -8.736 -15.368 11.568 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -5.889 -16.246 13.444 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -7.101 -15.004 13.116 1.00 0.00 H new ATOM 2299 N ASN B 90 -8.272 -22.775 7.384 1.00 0.00 N ATOM 2300 CA ASN B 90 -8.841 -23.943 6.711 1.00 0.00 C ATOM 2301 C ASN B 90 -7.739 -24.791 6.099 1.00 0.00 C ATOM 2302 O ASN B 90 -7.679 -25.997 6.316 1.00 0.00 O ATOM 2303 CB ASN B 90 -9.833 -23.530 5.618 1.00 0.00 C ATOM 2304 CG ASN B 90 -10.961 -22.644 6.120 1.00 0.00 C ATOM 2305 OD1 ASN B 90 -11.360 -22.713 7.287 1.00 0.00 O ATOM 2306 ND2 ASN B 90 -11.501 -21.841 5.250 1.00 0.00 N ATOM 0 H ASN B 90 -8.598 -21.884 7.010 1.00 0.00 H new ATOM 0 HA ASN B 90 -9.375 -24.526 7.461 1.00 0.00 H new ATOM 0 HB2 ASN B 90 -9.294 -23.005 4.830 1.00 0.00 H new ATOM 0 HB3 ASN B 90 -10.260 -24.427 5.169 1.00 0.00 H new ATOM 0 HD21 ASN B 90 -12.280 -21.242 5.524 1.00 0.00 H new ATOM 0 HD22 ASN B 90 -11.145 -21.811 4.295 1.00 0.00 H new ATOM 2313 N LEU B 91 -6.846 -24.146 5.375 1.00 0.00 N ATOM 2314 CA LEU B 91 -5.731 -24.827 4.736 1.00 0.00 C ATOM 2315 C LEU B 91 -4.688 -25.267 5.732 1.00 0.00 C ATOM 2316 O LEU B 91 -3.970 -26.203 5.476 1.00 0.00 O ATOM 2317 CB LEU B 91 -5.101 -23.943 3.692 1.00 0.00 C ATOM 2318 CG LEU B 91 -5.976 -23.509 2.533 1.00 0.00 C ATOM 2319 CD1 LEU B 91 -5.196 -22.559 1.658 1.00 0.00 C ATOM 2320 CD2 LEU B 91 -6.446 -24.711 1.725 1.00 0.00 C ATOM 0 H LEU B 91 -6.870 -23.139 5.212 1.00 0.00 H new ATOM 0 HA LEU B 91 -6.133 -25.721 4.260 1.00 0.00 H new ATOM 0 HB2 LEU B 91 -4.728 -23.047 4.188 1.00 0.00 H new ATOM 0 HB3 LEU B 91 -4.235 -24.465 3.285 1.00 0.00 H new ATOM 0 HG LEU B 91 -6.861 -23.006 2.923 1.00 0.00 H new ATOM 0 HD11 LEU B 91 -5.818 -22.241 0.821 1.00 0.00 H new ATOM 0 HD12 LEU B 91 -4.900 -21.687 2.241 1.00 0.00 H new ATOM 0 HD13 LEU B 91 -4.306 -23.061 1.279 1.00 0.00 H new ATOM 0 HD21 LEU B 91 -7.072 -24.372 0.900 1.00 0.00 H new ATOM 0 HD22 LEU B 91 -5.581 -25.244 1.330 1.00 0.00 H new ATOM 0 HD23 LEU B 91 -7.022 -25.378 2.367 1.00 0.00 H new ATOM 2332 N GLN B 92 -4.597 -24.602 6.849 1.00 0.00 N ATOM 2333 CA GLN B 92 -3.666 -24.991 7.893 1.00 0.00 C ATOM 2334 C GLN B 92 -4.134 -26.248 8.616 1.00 0.00 C ATOM 2335 O GLN B 92 -3.322 -27.071 9.043 1.00 0.00 O ATOM 2336 CB GLN B 92 -3.405 -23.828 8.851 1.00 0.00 C ATOM 2337 CG GLN B 92 -2.351 -22.855 8.361 1.00 0.00 C ATOM 2338 CD GLN B 92 -0.946 -23.383 8.525 1.00 0.00 C ATOM 2339 OE1 GLN B 92 -0.436 -24.046 7.536 1.00 0.00 O flip ATOM 2340 NE2 GLN B 92 -0.325 -23.177 9.550 1.00 0.00 N flip ATOM 0 H GLN B 92 -5.158 -23.779 7.069 1.00 0.00 H new ATOM 0 HA GLN B 92 -2.714 -25.240 7.425 1.00 0.00 H new ATOM 0 HB2 GLN B 92 -4.337 -23.287 9.013 1.00 0.00 H new ATOM 0 HB3 GLN B 92 -3.096 -24.228 9.817 1.00 0.00 H new ATOM 0 HG2 GLN B 92 -2.530 -22.632 7.309 1.00 0.00 H new ATOM 0 HG3 GLN B 92 -2.448 -21.916 8.907 1.00 0.00 H new ATOM 0 HE21 GLN B 92 -0.756 -22.651 10.310 1.00 0.00 H new ATOM 0 HE22 GLN B 92 0.627 -23.530 9.649 1.00 0.00 H new ATOM 2349 N ARG B 93 -5.429 -26.426 8.710 1.00 0.00 N ATOM 2350 CA ARG B 93 -5.981 -27.618 9.347 1.00 0.00 C ATOM 2351 C ARG B 93 -6.343 -28.674 8.298 1.00 0.00 C ATOM 2352 O ARG B 93 -6.944 -29.690 8.611 1.00 0.00 O ATOM 2353 CB ARG B 93 -7.196 -27.249 10.252 1.00 0.00 C ATOM 2354 CG ARG B 93 -8.381 -26.623 9.520 1.00 0.00 C ATOM 2355 CD ARG B 93 -9.316 -27.657 8.889 1.00 0.00 C ATOM 2356 NE ARG B 93 -10.117 -28.390 9.889 1.00 0.00 N ATOM 2357 CZ ARG B 93 -10.251 -29.734 9.951 1.00 0.00 C ATOM 2358 NH1 ARG B 93 -9.397 -30.528 9.327 1.00 0.00 N ATOM 2359 NH2 ARG B 93 -11.184 -30.277 10.713 1.00 0.00 N ATOM 0 H ARG B 93 -6.126 -25.769 8.358 1.00 0.00 H new ATOM 0 HA ARG B 93 -5.219 -28.053 9.994 1.00 0.00 H new ATOM 0 HB2 ARG B 93 -7.538 -28.151 10.760 1.00 0.00 H new ATOM 0 HB3 ARG B 93 -6.858 -26.557 11.023 1.00 0.00 H new ATOM 0 HG2 ARG B 93 -8.948 -26.009 10.220 1.00 0.00 H new ATOM 0 HG3 ARG B 93 -8.008 -25.957 8.742 1.00 0.00 H new ATOM 0 HD2 ARG B 93 -9.986 -27.156 8.190 1.00 0.00 H new ATOM 0 HD3 ARG B 93 -8.726 -28.368 8.311 1.00 0.00 H new ATOM 0 HE ARG B 93 -10.610 -27.837 10.591 1.00 0.00 H new ATOM 0 HH11 ARG B 93 -8.627 -30.128 8.791 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -9.509 -31.540 9.381 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -11.808 -29.682 11.258 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -11.281 -31.291 10.756 1.00 0.00 H new ATOM 2373 N ALA B 94 -5.959 -28.430 7.045 1.00 0.00 N ATOM 2374 CA ALA B 94 -6.267 -29.358 5.951 1.00 0.00 C ATOM 2375 C ALA B 94 -5.562 -30.673 6.193 1.00 0.00 C ATOM 2376 O ALA B 94 -6.051 -31.737 5.845 1.00 0.00 O ATOM 2377 CB ALA B 94 -5.860 -28.776 4.611 1.00 0.00 C ATOM 0 H ALA B 94 -5.436 -27.602 6.761 1.00 0.00 H new ATOM 0 HA ALA B 94 -7.344 -29.525 5.926 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -6.100 -29.485 3.818 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -6.399 -27.844 4.440 1.00 0.00 H new ATOM 0 HB3 ALA B 94 -4.788 -28.580 4.610 1.00 0.00 H new ATOM 2383 N GLN B 95 -4.445 -30.577 6.819 1.00 0.00 N ATOM 2384 CA GLN B 95 -3.679 -31.692 7.205 1.00 0.00 C ATOM 2385 C GLN B 95 -3.561 -31.692 8.716 1.00 0.00 C ATOM 2386 O GLN B 95 -4.407 -32.321 9.367 1.00 0.00 O ATOM 2387 CB GLN B 95 -2.307 -31.745 6.489 1.00 0.00 C ATOM 2388 CG GLN B 95 -1.456 -30.465 6.518 1.00 0.00 C ATOM 2389 CD GLN B 95 -1.869 -29.399 5.519 1.00 0.00 C ATOM 2390 OE1 GLN B 95 -2.649 -28.425 5.951 1.00 0.00 O flip ATOM 2391 NE2 GLN B 95 -1.424 -29.415 4.376 1.00 0.00 N flip ATOM 0 H GLN B 95 -4.029 -29.684 7.083 1.00 0.00 H new ATOM 0 HA GLN B 95 -4.184 -32.606 6.892 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -1.723 -32.550 6.934 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -2.479 -32.014 5.447 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -1.501 -30.039 7.520 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -0.416 -30.733 6.332 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -0.824 -30.182 4.073 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -1.654 -28.661 3.729 1.00 0.00 H new