USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1066 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 53 MET CE :methyl 159:sc= -2.17! (180deg=-2.53!) USER MOD Set 1.2: A 104 CYS SG : rot 73:sc= 0.403 USER MOD Set 1.3: A 105 CYS SG : rot -106:sc= 1.02 USER MOD Set 1.4: A 108 CYS SG : rot -10:sc= 0.606 USER MOD Set 1.5: A 120 CYS SG : rot -123:sc= 0.0553 USER MOD Set 1.6: A 122 CYS SG : rot 84:sc= 1.22 USER MOD Set 1.7: A 145 CYS SG : rot -135:sc= 1.09 USER MOD Set 1.8: A 147 HIS : no HD1:sc= -0.562 K(o=1.9,f=3.2) USER MOD Set 1.9: A 148 CYS SG : rot -35:sc= -0.819 USER MOD Set 1.10: A 150 CYS SG : rot -151:sc= -0.0852 USER MOD Set 1.11: A 153 CYS SG : rot 25:sc= 1.17 USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 62 TYR OH : rot 111:sc= -2.81! USER MOD Single : A 18 LYS NZ :NH3+ -133:sc=-0.00246 (180deg=-0.18) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 85:sc= 0.66 USER MOD Single : A 29 GLN : amide:sc= -0.139 K(o=-0.14,f=-1.7) USER MOD Single : A 34 GLN : amide:sc= -0.0267 X(o=-0.027,f=-0.071) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 20:sc= 0.708 USER MOD Single : A 46 ASN : amide:sc= -1.13 K(o=-1.1,f=-0.033) USER MOD Single : A 48 GLN : amide:sc= -3.78 K(o=-3.8,f=-7.1!) USER MOD Single : A 54 GLN : amide:sc= -0.127 K(o=-0.13,f=-1.6!) USER MOD Single : A 56 HIS : no HE2:sc= -1.95! C(o=-1.9!,f=-3.6!) USER MOD Single : A 57 HIS : no HD1:sc= -4.47! C(o=-4.5!,f=-5.1!) USER MOD Single : A 58 GLN : amide:sc= 0.0402 X(o=0.04,f=0) USER MOD Single : A 60 SER OG : rot -34:sc= 0.953 USER MOD Single : A 64 TYR OH : rot 180:sc= -2.14 USER MOD Single : A 65 THR OG1 : rot 72:sc= 0.845 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0.0571 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 160:sc= 0.826 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0647) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 119 THR OG1 : rot -76:sc= 0.963 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.389) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0637 USER MOD Single : A 139 GLN : amide:sc=-0.000256 X(o=-0.00026,f=-0.36) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 144 GLN : amide:sc= -1.25 K(o=-1.3,f=-2.5!) USER MOD Single : A 155 SER OG : rot 150:sc= -1.11 USER MOD ----------------------------------------------------------------- ATOM 216 N ALA A 12 -15.457 -8.146 18.128 1.00 0.00 N ATOM 217 CA ALA A 12 -14.004 -7.832 18.395 1.00 0.00 C ATOM 218 C ALA A 12 -13.721 -7.935 19.905 1.00 0.00 C ATOM 219 O ALA A 12 -14.566 -7.592 20.707 1.00 0.00 O ATOM 220 CB ALA A 12 -13.750 -6.392 17.908 1.00 0.00 C ATOM 0 HA ALA A 12 -13.351 -8.534 17.876 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.708 -6.127 18.084 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.966 -6.325 16.842 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.396 -5.704 18.453 1.00 0.00 H new ATOM 226 N PRO A 13 -12.542 -8.407 20.253 1.00 0.00 N ATOM 227 CA PRO A 13 -12.184 -8.545 21.687 1.00 0.00 C ATOM 228 C PRO A 13 -11.931 -7.170 22.318 1.00 0.00 C ATOM 229 O PRO A 13 -11.685 -6.201 21.624 1.00 0.00 O ATOM 230 CB PRO A 13 -10.902 -9.373 21.662 1.00 0.00 C ATOM 231 CG PRO A 13 -10.305 -9.124 20.316 1.00 0.00 C ATOM 232 CD PRO A 13 -11.446 -8.850 19.372 1.00 0.00 C ATOM 0 HA PRO A 13 -12.974 -9.008 22.278 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.221 -9.070 22.458 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.114 -10.432 21.810 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.620 -8.277 20.349 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -9.729 -9.988 19.984 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.185 -8.083 18.643 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.722 -9.742 18.810 1.00 0.00 H new ATOM 240 N ASP A 14 -11.993 -7.076 23.632 1.00 0.00 N ATOM 241 CA ASP A 14 -11.755 -5.743 24.311 1.00 0.00 C ATOM 242 C ASP A 14 -10.466 -5.072 23.795 1.00 0.00 C ATOM 243 O ASP A 14 -10.379 -3.861 23.739 1.00 0.00 O ATOM 244 CB ASP A 14 -11.623 -6.036 25.815 1.00 0.00 C ATOM 245 CG ASP A 14 -13.005 -5.992 26.467 1.00 0.00 C ATOM 246 OD1 ASP A 14 -13.757 -5.083 26.156 1.00 0.00 O ATOM 247 OD2 ASP A 14 -13.290 -6.869 27.266 1.00 0.00 O ATOM 0 H ASP A 14 -12.195 -7.853 24.261 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.578 -5.059 24.101 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.169 -7.015 25.967 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.965 -5.303 26.283 1.00 0.00 H new ATOM 252 N GLY A 15 -9.464 -5.843 23.414 1.00 0.00 N ATOM 253 CA GLY A 15 -8.192 -5.239 22.903 1.00 0.00 C ATOM 254 C GLY A 15 -8.483 -4.234 21.768 1.00 0.00 C ATOM 255 O GLY A 15 -7.788 -3.245 21.629 1.00 0.00 O ATOM 0 H GLY A 15 -9.478 -6.863 23.437 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.670 -4.735 23.717 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.531 -6.025 22.539 1.00 0.00 H new ATOM 259 N PHE A 16 -9.500 -4.470 20.956 1.00 0.00 N ATOM 260 CA PHE A 16 -9.805 -3.499 19.838 1.00 0.00 C ATOM 261 C PHE A 16 -9.998 -2.076 20.392 1.00 0.00 C ATOM 262 O PHE A 16 -9.660 -1.107 19.737 1.00 0.00 O ATOM 263 CB PHE A 16 -11.103 -3.980 19.166 1.00 0.00 C ATOM 264 CG PHE A 16 -11.401 -3.114 17.962 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.415 -2.892 16.991 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.666 -2.532 17.816 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.693 -2.088 15.879 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.945 -1.729 16.704 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.958 -1.507 15.735 1.00 0.00 C ATOM 0 H PHE A 16 -10.121 -5.277 21.016 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.980 -3.466 19.126 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.003 -5.022 18.862 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.930 -3.933 19.874 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.439 -3.342 17.101 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.428 -2.703 18.562 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.932 -1.916 15.133 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.921 -1.281 16.593 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.173 -0.888 14.877 1.00 0.00 H new ATOM 279 N GLU A 17 -10.533 -1.933 21.592 1.00 0.00 N ATOM 280 CA GLU A 17 -10.730 -0.548 22.164 1.00 0.00 C ATOM 281 C GLU A 17 -9.404 0.231 22.146 1.00 0.00 C ATOM 282 O GLU A 17 -9.383 1.419 21.884 1.00 0.00 O ATOM 283 CB GLU A 17 -11.213 -0.731 23.613 1.00 0.00 C ATOM 284 CG GLU A 17 -11.864 0.564 24.102 1.00 0.00 C ATOM 285 CD GLU A 17 -12.072 0.490 25.616 1.00 0.00 C ATOM 286 OE1 GLU A 17 -11.118 0.731 26.338 1.00 0.00 O ATOM 287 OE2 GLU A 17 -13.181 0.194 26.027 1.00 0.00 O ATOM 0 H GLU A 17 -10.837 -2.700 22.191 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.454 0.016 21.576 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.927 -1.553 23.668 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.374 -0.994 24.257 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.234 1.417 23.852 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.819 0.715 23.600 1.00 0.00 H new ATOM 294 N LYS A 18 -8.296 -0.429 22.413 1.00 0.00 N ATOM 295 CA LYS A 18 -6.973 0.294 22.396 1.00 0.00 C ATOM 296 C LYS A 18 -6.716 0.898 21.006 1.00 0.00 C ATOM 297 O LYS A 18 -6.172 1.982 20.892 1.00 0.00 O ATOM 298 CB LYS A 18 -5.891 -0.746 22.731 1.00 0.00 C ATOM 299 CG LYS A 18 -5.898 -1.023 24.236 1.00 0.00 C ATOM 300 CD LYS A 18 -5.543 -2.489 24.487 1.00 0.00 C ATOM 301 CE LYS A 18 -4.032 -2.620 24.695 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.800 -2.199 26.105 1.00 0.00 N ATOM 0 H LYS A 18 -8.248 -1.422 22.639 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.966 1.110 23.118 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.075 -1.668 22.180 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.912 -0.380 22.422 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -5.182 -0.373 24.739 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.880 -0.799 24.653 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -6.075 -2.858 25.364 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -5.859 -3.101 23.642 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -3.698 -3.644 24.529 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.481 -1.988 23.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.002 -1.533 26.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -4.655 -1.736 26.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.581 -3.034 26.685 1.00 0.00 H new ATOM 316 N ILE A 19 -7.103 0.215 19.947 1.00 0.00 N ATOM 317 CA ILE A 19 -6.875 0.773 18.573 1.00 0.00 C ATOM 318 C ILE A 19 -8.220 1.072 17.875 1.00 0.00 C ATOM 319 O ILE A 19 -8.339 0.923 16.674 1.00 0.00 O ATOM 320 CB ILE A 19 -6.085 -0.309 17.809 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.920 -1.599 17.675 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.786 -0.623 18.562 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.843 -2.124 16.237 1.00 0.00 C ATOM 0 H ILE A 19 -7.562 -0.695 19.976 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.328 1.715 18.607 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.856 0.067 16.812 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.550 -2.355 18.368 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.958 -1.400 17.944 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.228 -1.388 18.022 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.182 0.281 18.638 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.024 -0.986 19.562 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.435 -3.035 16.150 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.234 -1.371 15.553 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.805 -2.340 15.984 1.00 0.00 H new ATOM 335 N LYS A 20 -9.236 1.480 18.614 1.00 0.00 N ATOM 336 CA LYS A 20 -10.568 1.767 17.967 1.00 0.00 C ATOM 337 C LYS A 20 -10.656 3.190 17.363 1.00 0.00 C ATOM 338 O LYS A 20 -11.186 3.339 16.278 1.00 0.00 O ATOM 339 CB LYS A 20 -11.631 1.595 19.066 1.00 0.00 C ATOM 340 CG LYS A 20 -13.037 1.630 18.442 1.00 0.00 C ATOM 341 CD LYS A 20 -13.859 2.761 19.069 1.00 0.00 C ATOM 342 CE LYS A 20 -13.822 3.992 18.159 1.00 0.00 C ATOM 343 NZ LYS A 20 -14.571 5.043 18.902 1.00 0.00 N ATOM 0 H LYS A 20 -9.202 1.625 19.623 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.718 1.083 17.132 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.478 0.650 19.588 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.532 2.388 19.807 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.962 1.777 17.365 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.538 0.675 18.599 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.889 2.436 19.216 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.460 3.011 20.052 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.797 4.304 17.959 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.286 3.784 17.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.589 5.919 18.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.545 4.721 19.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -14.103 5.225 19.813 1.00 0.00 H new ATOM 357 N PRO A 21 -10.175 4.202 18.066 1.00 0.00 N ATOM 358 CA PRO A 21 -10.274 5.586 17.532 1.00 0.00 C ATOM 359 C PRO A 21 -9.244 5.837 16.418 1.00 0.00 C ATOM 360 O PRO A 21 -9.522 6.554 15.475 1.00 0.00 O ATOM 361 CB PRO A 21 -9.996 6.466 18.744 1.00 0.00 C ATOM 362 CG PRO A 21 -9.187 5.620 19.674 1.00 0.00 C ATOM 363 CD PRO A 21 -9.507 4.176 19.377 1.00 0.00 C ATOM 0 HA PRO A 21 -11.244 5.787 17.078 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.452 7.366 18.459 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.924 6.790 19.215 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.123 5.812 19.537 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.423 5.858 20.711 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.603 3.568 19.348 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.154 3.749 20.143 1.00 0.00 H new ATOM 371 N THR A 22 -8.059 5.261 16.507 1.00 0.00 N ATOM 372 CA THR A 22 -7.037 5.500 15.421 1.00 0.00 C ATOM 373 C THR A 22 -7.598 5.053 14.062 1.00 0.00 C ATOM 374 O THR A 22 -7.430 5.731 13.067 1.00 0.00 O ATOM 375 CB THR A 22 -5.794 4.670 15.783 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.327 5.056 17.069 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.694 4.910 14.746 1.00 0.00 C ATOM 0 H THR A 22 -7.759 4.649 17.266 1.00 0.00 H new ATOM 0 HA THR A 22 -6.787 6.558 15.346 1.00 0.00 H new ATOM 0 HB THR A 22 -6.055 3.612 15.792 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.536 4.527 17.302 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.815 4.321 15.005 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.052 4.613 13.760 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.431 5.968 14.733 1.00 0.00 H new ATOM 385 N LEU A 23 -8.273 3.926 14.016 1.00 0.00 N ATOM 386 CA LEU A 23 -8.851 3.460 12.705 1.00 0.00 C ATOM 387 C LEU A 23 -9.981 4.409 12.283 1.00 0.00 C ATOM 388 O LEU A 23 -10.087 4.767 11.125 1.00 0.00 O ATOM 389 CB LEU A 23 -9.392 2.039 12.935 1.00 0.00 C ATOM 390 CG LEU A 23 -8.218 1.061 13.063 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.549 -0.016 14.106 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.954 0.403 11.705 1.00 0.00 C ATOM 0 H LEU A 23 -8.448 3.315 14.814 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.102 3.456 11.913 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.002 2.012 13.838 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.036 1.745 12.106 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.328 1.603 13.383 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.711 -0.708 14.193 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.731 0.456 15.071 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.440 -0.562 13.795 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.120 -0.293 11.794 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.844 -0.137 11.383 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.710 1.170 10.970 1.00 0.00 H new ATOM 404 N THR A 24 -10.818 4.836 13.209 1.00 0.00 N ATOM 405 CA THR A 24 -11.922 5.788 12.826 1.00 0.00 C ATOM 406 C THR A 24 -11.320 7.082 12.252 1.00 0.00 C ATOM 407 O THR A 24 -11.887 7.685 11.361 1.00 0.00 O ATOM 408 CB THR A 24 -12.719 6.091 14.106 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.987 4.871 14.794 1.00 0.00 O ATOM 410 CG2 THR A 24 -14.041 6.766 13.736 1.00 0.00 C ATOM 0 H THR A 24 -10.787 4.573 14.194 1.00 0.00 H new ATOM 0 HA THR A 24 -12.569 5.354 12.064 1.00 0.00 H new ATOM 0 HB THR A 24 -12.140 6.754 14.748 1.00 0.00 H new ATOM 0 HG1 THR A 24 -12.219 4.637 15.356 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.606 6.981 14.643 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.838 7.696 13.206 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.622 6.102 13.095 1.00 0.00 H new ATOM 418 N ASP A 25 -10.170 7.515 12.744 1.00 0.00 N ATOM 419 CA ASP A 25 -9.547 8.776 12.193 1.00 0.00 C ATOM 420 C ASP A 25 -9.363 8.656 10.668 1.00 0.00 C ATOM 421 O ASP A 25 -9.503 9.630 9.952 1.00 0.00 O ATOM 422 CB ASP A 25 -8.178 8.928 12.877 1.00 0.00 C ATOM 423 CG ASP A 25 -7.529 10.240 12.433 1.00 0.00 C ATOM 424 OD1 ASP A 25 -7.974 11.282 12.887 1.00 0.00 O ATOM 425 OD2 ASP A 25 -6.597 10.181 11.648 1.00 0.00 O ATOM 0 H ASP A 25 -9.645 7.059 13.490 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.182 9.641 12.385 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.298 8.917 13.960 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.535 8.086 12.619 1.00 0.00 H new ATOM 430 N PHE A 26 -9.058 7.474 10.161 1.00 0.00 N ATOM 431 CA PHE A 26 -8.878 7.325 8.667 1.00 0.00 C ATOM 432 C PHE A 26 -10.129 7.821 7.921 1.00 0.00 C ATOM 433 O PHE A 26 -10.027 8.384 6.846 1.00 0.00 O ATOM 434 CB PHE A 26 -8.677 5.828 8.392 1.00 0.00 C ATOM 435 CG PHE A 26 -7.212 5.492 8.492 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.636 5.236 9.743 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.429 5.432 7.335 1.00 0.00 C ATOM 438 CE1 PHE A 26 -5.276 4.922 9.834 1.00 0.00 C ATOM 439 CE2 PHE A 26 -5.070 5.120 7.428 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.493 4.865 8.676 1.00 0.00 C ATOM 0 H PHE A 26 -8.928 6.621 10.704 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.027 7.913 8.323 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.247 5.236 9.108 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -9.052 5.576 7.400 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.241 5.281 10.636 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.874 5.627 6.370 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.831 4.724 10.798 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.465 5.076 6.535 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.443 4.624 8.746 1.00 0.00 H new ATOM 450 N GLU A 27 -11.310 7.611 8.471 1.00 0.00 N ATOM 451 CA GLU A 27 -12.557 8.077 7.762 1.00 0.00 C ATOM 452 C GLU A 27 -12.494 9.588 7.492 1.00 0.00 C ATOM 453 O GLU A 27 -12.919 10.046 6.449 1.00 0.00 O ATOM 454 CB GLU A 27 -13.741 7.757 8.691 1.00 0.00 C ATOM 455 CG GLU A 27 -14.213 6.323 8.445 1.00 0.00 C ATOM 456 CD GLU A 27 -15.728 6.244 8.640 1.00 0.00 C ATOM 457 OE1 GLU A 27 -16.210 6.795 9.616 1.00 0.00 O ATOM 458 OE2 GLU A 27 -16.381 5.633 7.810 1.00 0.00 O ATOM 0 H GLU A 27 -11.464 7.145 9.365 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.662 7.577 6.799 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.443 7.879 9.732 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.558 8.456 8.510 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.949 6.010 7.435 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.711 5.641 9.131 1.00 0.00 H new ATOM 465 N ILE A 28 -11.962 10.365 8.412 1.00 0.00 N ATOM 466 CA ILE A 28 -11.883 11.850 8.168 1.00 0.00 C ATOM 467 C ILE A 28 -10.911 12.120 7.004 1.00 0.00 C ATOM 468 O ILE A 28 -11.181 12.950 6.155 1.00 0.00 O ATOM 469 CB ILE A 28 -11.397 12.501 9.487 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.528 12.441 10.525 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.021 13.971 9.251 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.325 11.238 11.445 1.00 0.00 C ATOM 0 H ILE A 28 -11.586 10.046 9.305 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.849 12.272 7.889 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.522 11.959 9.845 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.545 13.360 11.111 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.492 12.367 10.022 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -10.682 14.415 10.187 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.222 14.028 8.512 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -11.892 14.515 8.887 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.130 11.201 12.179 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.331 10.322 10.853 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.369 11.331 11.960 1.00 0.00 H new ATOM 484 N GLN A 29 -9.796 11.418 6.941 1.00 0.00 N ATOM 485 CA GLN A 29 -8.843 11.650 5.798 1.00 0.00 C ATOM 486 C GLN A 29 -9.475 11.109 4.511 1.00 0.00 C ATOM 487 O GLN A 29 -9.496 11.783 3.498 1.00 0.00 O ATOM 488 CB GLN A 29 -7.549 10.891 6.129 1.00 0.00 C ATOM 489 CG GLN A 29 -6.362 11.577 5.447 1.00 0.00 C ATOM 490 CD GLN A 29 -5.136 11.524 6.369 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.046 10.663 7.222 1.00 0.00 O ATOM 492 NE2 GLN A 29 -4.179 12.409 6.237 1.00 0.00 N ATOM 0 H GLN A 29 -9.509 10.709 7.616 1.00 0.00 H new ATOM 0 HA GLN A 29 -8.628 12.709 5.656 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.396 10.866 7.208 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.626 9.857 5.793 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.139 11.084 4.501 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.611 12.613 5.216 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.250 13.134 5.523 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -3.363 12.373 6.849 1.00 0.00 H new ATOM 501 N LEU A 30 -10.018 9.907 4.544 1.00 0.00 N ATOM 502 CA LEU A 30 -10.677 9.359 3.304 1.00 0.00 C ATOM 503 C LEU A 30 -11.863 10.261 2.917 1.00 0.00 C ATOM 504 O LEU A 30 -12.132 10.462 1.749 1.00 0.00 O ATOM 505 CB LEU A 30 -11.178 7.940 3.638 1.00 0.00 C ATOM 506 CG LEU A 30 -10.890 7.009 2.461 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.396 6.682 2.424 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.694 5.717 2.624 1.00 0.00 C ATOM 0 H LEU A 30 -10.034 9.293 5.358 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.978 9.328 2.468 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.685 7.571 4.537 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.248 7.960 3.847 1.00 0.00 H new ATOM 0 HG LEU A 30 -11.177 7.499 1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.190 6.018 1.585 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.825 7.603 2.307 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -9.108 6.192 3.354 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.489 5.053 1.785 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -11.408 5.226 3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.758 5.951 2.650 1.00 0.00 H new ATOM 520 N ARG A 31 -12.575 10.813 3.888 1.00 0.00 N ATOM 521 CA ARG A 31 -13.740 11.708 3.545 1.00 0.00 C ATOM 522 C ARG A 31 -13.277 12.872 2.653 1.00 0.00 C ATOM 523 O ARG A 31 -14.002 13.299 1.772 1.00 0.00 O ATOM 524 CB ARG A 31 -14.282 12.262 4.875 1.00 0.00 C ATOM 525 CG ARG A 31 -15.210 11.234 5.529 1.00 0.00 C ATOM 526 CD ARG A 31 -15.240 11.459 7.047 1.00 0.00 C ATOM 527 NE ARG A 31 -16.692 11.537 7.400 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.406 12.622 7.137 1.00 0.00 C ATOM 529 NH1 ARG A 31 -16.869 13.671 6.557 1.00 0.00 N ATOM 530 NH2 ARG A 31 -18.673 12.654 7.458 1.00 0.00 N ATOM 0 H ARG A 31 -12.402 10.684 4.885 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.505 11.153 3.003 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -13.455 12.496 5.545 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.822 13.192 4.698 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.216 11.324 5.118 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.864 10.224 5.308 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -14.749 10.643 7.576 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -14.718 12.376 7.320 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.141 10.740 7.852 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -15.882 13.662 6.299 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.439 14.495 6.365 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.106 11.847 7.908 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.229 13.486 7.259 1.00 0.00 H new ATOM 544 N ASP A 32 -12.084 13.397 2.868 1.00 0.00 N ATOM 545 CA ASP A 32 -11.617 14.541 2.003 1.00 0.00 C ATOM 546 C ASP A 32 -11.509 14.071 0.551 1.00 0.00 C ATOM 547 O ASP A 32 -12.080 14.677 -0.338 1.00 0.00 O ATOM 548 CB ASP A 32 -10.241 14.975 2.532 1.00 0.00 C ATOM 549 CG ASP A 32 -10.425 15.960 3.687 1.00 0.00 C ATOM 550 OD1 ASP A 32 -10.822 17.083 3.424 1.00 0.00 O ATOM 551 OD2 ASP A 32 -10.163 15.576 4.815 1.00 0.00 O ATOM 0 H ASP A 32 -11.428 13.092 3.587 1.00 0.00 H new ATOM 0 HA ASP A 32 -12.317 15.376 2.036 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.678 14.104 2.869 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.662 15.439 1.733 1.00 0.00 H new ATOM 556 N ALA A 33 -10.806 12.986 0.298 1.00 0.00 N ATOM 557 CA ALA A 33 -10.710 12.492 -1.120 1.00 0.00 C ATOM 558 C ALA A 33 -12.085 11.968 -1.549 1.00 0.00 C ATOM 559 O ALA A 33 -12.532 12.222 -2.651 1.00 0.00 O ATOM 560 CB ALA A 33 -9.675 11.360 -1.138 1.00 0.00 C ATOM 0 H ALA A 33 -10.306 12.432 0.993 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.408 13.284 -1.806 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.576 10.974 -2.152 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -8.712 11.742 -0.800 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.001 10.559 -0.475 1.00 0.00 H new ATOM 566 N GLN A 34 -12.771 11.247 -0.682 1.00 0.00 N ATOM 567 CA GLN A 34 -14.131 10.728 -1.060 1.00 0.00 C ATOM 568 C GLN A 34 -15.078 11.901 -1.379 1.00 0.00 C ATOM 569 O GLN A 34 -15.949 11.776 -2.220 1.00 0.00 O ATOM 570 CB GLN A 34 -14.660 9.941 0.151 1.00 0.00 C ATOM 571 CG GLN A 34 -14.105 8.515 0.115 1.00 0.00 C ATOM 572 CD GLN A 34 -14.931 7.668 -0.861 1.00 0.00 C ATOM 573 OE1 GLN A 34 -16.103 7.441 -0.638 1.00 0.00 O ATOM 574 NE2 GLN A 34 -14.370 7.188 -1.945 1.00 0.00 N ATOM 0 H GLN A 34 -12.453 11.000 0.255 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.073 10.095 -1.945 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.364 10.435 1.077 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.750 9.919 0.136 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.060 8.528 -0.193 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -14.138 8.076 1.112 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.386 7.376 -2.136 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.918 6.626 -2.597 1.00 0.00 H new ATOM 583 N LYS A 35 -14.921 13.042 -0.726 1.00 0.00 N ATOM 584 CA LYS A 35 -15.834 14.202 -1.022 1.00 0.00 C ATOM 585 C LYS A 35 -15.218 15.134 -2.084 1.00 0.00 C ATOM 586 O LYS A 35 -15.935 15.763 -2.839 1.00 0.00 O ATOM 587 CB LYS A 35 -16.019 14.950 0.304 1.00 0.00 C ATOM 588 CG LYS A 35 -16.976 14.165 1.204 1.00 0.00 C ATOM 589 CD LYS A 35 -16.753 14.569 2.663 1.00 0.00 C ATOM 590 CE LYS A 35 -17.166 16.029 2.858 1.00 0.00 C ATOM 591 NZ LYS A 35 -16.587 16.419 4.174 1.00 0.00 N ATOM 0 H LYS A 35 -14.212 13.215 -0.014 1.00 0.00 H new ATOM 0 HA LYS A 35 -16.787 13.856 -1.423 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.057 15.075 0.800 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -16.414 15.949 0.118 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.008 14.362 0.915 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -16.810 13.095 1.083 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.334 13.925 3.323 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -15.705 14.438 2.932 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -16.782 16.659 2.055 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -18.251 16.136 2.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -16.828 17.410 4.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -16.976 15.807 4.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -15.553 16.313 4.143 1.00 0.00 H new ATOM 605 N ASP A 36 -13.903 15.235 -2.157 1.00 0.00 N ATOM 606 CA ASP A 36 -13.275 16.144 -3.190 1.00 0.00 C ATOM 607 C ASP A 36 -13.788 15.791 -4.599 1.00 0.00 C ATOM 608 O ASP A 36 -13.975 16.663 -5.426 1.00 0.00 O ATOM 609 CB ASP A 36 -11.757 15.918 -3.115 1.00 0.00 C ATOM 610 CG ASP A 36 -11.042 16.958 -3.979 1.00 0.00 C ATOM 611 OD1 ASP A 36 -11.454 17.141 -5.113 1.00 0.00 O ATOM 612 OD2 ASP A 36 -10.094 17.553 -3.493 1.00 0.00 O ATOM 0 H ASP A 36 -13.245 14.737 -1.557 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.530 17.186 -2.995 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.418 15.993 -2.082 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.511 14.913 -3.459 1.00 0.00 H new ATOM 744 N SER A 45 -9.434 13.922 -10.514 1.00 0.00 N ATOM 745 CA SER A 45 -10.124 12.928 -9.622 1.00 0.00 C ATOM 746 C SER A 45 -9.253 11.678 -9.430 1.00 0.00 C ATOM 747 O SER A 45 -9.189 11.130 -8.344 1.00 0.00 O ATOM 748 CB SER A 45 -11.436 12.564 -10.328 1.00 0.00 C ATOM 749 OG SER A 45 -11.977 13.725 -10.942 1.00 0.00 O ATOM 0 HA SER A 45 -10.306 13.344 -8.631 1.00 0.00 H new ATOM 0 HB2 SER A 45 -11.257 11.792 -11.077 1.00 0.00 H new ATOM 0 HB3 SER A 45 -12.147 12.153 -9.611 1.00 0.00 H new ATOM 0 HG SER A 45 -11.271 14.395 -11.053 1.00 0.00 H new ATOM 755 N ASN A 46 -8.581 11.218 -10.465 1.00 0.00 N ATOM 756 CA ASN A 46 -7.717 9.991 -10.304 1.00 0.00 C ATOM 757 C ASN A 46 -6.616 10.266 -9.266 1.00 0.00 C ATOM 758 O ASN A 46 -6.314 9.421 -8.446 1.00 0.00 O ATOM 759 CB ASN A 46 -7.092 9.689 -11.678 1.00 0.00 C ATOM 760 CG ASN A 46 -7.030 8.171 -11.883 1.00 0.00 C ATOM 761 OD1 ASN A 46 -8.044 7.539 -12.103 1.00 0.00 O ATOM 762 ND2 ASN A 46 -5.878 7.549 -11.823 1.00 0.00 N ATOM 0 H ASN A 46 -8.590 11.628 -11.399 1.00 0.00 H new ATOM 0 HA ASN A 46 -8.304 9.141 -9.957 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -7.683 10.151 -12.469 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.091 10.117 -11.737 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -5.836 6.539 -11.961 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.024 8.075 -11.639 1.00 0.00 H new ATOM 769 N GLU A 47 -6.020 11.444 -9.286 1.00 0.00 N ATOM 770 CA GLU A 47 -4.945 11.750 -8.274 1.00 0.00 C ATOM 771 C GLU A 47 -5.530 11.674 -6.854 1.00 0.00 C ATOM 772 O GLU A 47 -4.891 11.180 -5.945 1.00 0.00 O ATOM 773 CB GLU A 47 -4.450 13.176 -8.566 1.00 0.00 C ATOM 774 CG GLU A 47 -3.785 13.214 -9.943 1.00 0.00 C ATOM 775 CD GLU A 47 -2.776 14.363 -9.992 1.00 0.00 C ATOM 776 OE1 GLU A 47 -1.627 14.131 -9.653 1.00 0.00 O ATOM 777 OE2 GLU A 47 -3.170 15.455 -10.366 1.00 0.00 O ATOM 0 H GLU A 47 -6.226 12.194 -9.946 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.126 11.033 -8.340 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.285 13.876 -8.534 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.742 13.490 -7.800 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.283 12.267 -10.142 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.539 13.345 -10.719 1.00 0.00 H new ATOM 784 N GLN A 48 -6.745 12.152 -6.655 1.00 0.00 N ATOM 785 CA GLN A 48 -7.358 12.090 -5.277 1.00 0.00 C ATOM 786 C GLN A 48 -7.441 10.623 -4.816 1.00 0.00 C ATOM 787 O GLN A 48 -7.116 10.310 -3.685 1.00 0.00 O ATOM 788 CB GLN A 48 -8.769 12.716 -5.400 1.00 0.00 C ATOM 789 CG GLN A 48 -9.602 12.437 -4.145 1.00 0.00 C ATOM 790 CD GLN A 48 -10.566 11.273 -4.422 1.00 0.00 C ATOM 791 OE1 GLN A 48 -10.260 10.135 -4.123 1.00 0.00 O ATOM 792 NE2 GLN A 48 -11.722 11.505 -4.996 1.00 0.00 N ATOM 0 H GLN A 48 -7.331 12.576 -7.374 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.763 12.630 -4.540 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.682 13.792 -5.552 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.276 12.311 -6.276 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -8.948 12.191 -3.308 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -10.162 13.328 -3.861 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -11.984 12.458 -5.249 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.359 10.733 -5.190 1.00 0.00 H new ATOM 801 N LEU A 49 -7.876 9.723 -5.676 1.00 0.00 N ATOM 802 CA LEU A 49 -7.973 8.280 -5.249 1.00 0.00 C ATOM 803 C LEU A 49 -6.595 7.758 -4.820 1.00 0.00 C ATOM 804 O LEU A 49 -6.495 6.979 -3.890 1.00 0.00 O ATOM 805 CB LEU A 49 -8.497 7.483 -6.455 1.00 0.00 C ATOM 806 CG LEU A 49 -10.022 7.611 -6.539 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.528 6.848 -7.764 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.663 7.023 -5.276 1.00 0.00 C ATOM 0 H LEU A 49 -8.163 9.918 -6.635 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.645 8.174 -4.397 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -8.041 7.853 -7.373 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -8.216 6.434 -6.359 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.290 8.664 -6.623 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.613 6.937 -7.826 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -10.077 7.266 -8.664 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -10.255 5.796 -7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.747 7.117 -5.341 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.394 5.970 -5.188 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.304 7.564 -4.400 1.00 0.00 H new ATOM 820 N TRP A 50 -5.523 8.183 -5.468 1.00 0.00 N ATOM 821 CA TRP A 50 -4.156 7.695 -5.049 1.00 0.00 C ATOM 822 C TRP A 50 -3.954 7.959 -3.546 1.00 0.00 C ATOM 823 O TRP A 50 -3.396 7.140 -2.840 1.00 0.00 O ATOM 824 CB TRP A 50 -3.122 8.493 -5.870 1.00 0.00 C ATOM 825 CG TRP A 50 -3.254 8.205 -7.345 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.988 7.207 -7.907 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.629 8.917 -8.455 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.850 7.269 -9.283 1.00 0.00 N ATOM 829 CE2 TRP A 50 -3.026 8.305 -9.667 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.765 10.025 -8.527 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.584 8.774 -10.902 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.315 10.498 -9.772 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.728 9.871 -10.957 1.00 0.00 C ATOM 0 H TRP A 50 -5.533 8.834 -6.253 1.00 0.00 H new ATOM 0 HA TRP A 50 -4.047 6.625 -5.225 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.258 9.560 -5.692 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.116 8.240 -5.536 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.582 6.484 -7.367 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.303 6.627 -9.933 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.445 10.516 -7.620 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.904 8.289 -11.813 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.649 11.347 -9.816 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.382 10.239 -11.912 1.00 0.00 H new ATOM 844 N GLU A 51 -4.425 9.087 -3.048 1.00 0.00 N ATOM 845 CA GLU A 51 -4.272 9.371 -1.579 1.00 0.00 C ATOM 846 C GLU A 51 -5.142 8.392 -0.772 1.00 0.00 C ATOM 847 O GLU A 51 -4.745 7.942 0.287 1.00 0.00 O ATOM 848 CB GLU A 51 -4.742 10.816 -1.349 1.00 0.00 C ATOM 849 CG GLU A 51 -3.740 11.786 -1.976 1.00 0.00 C ATOM 850 CD GLU A 51 -2.433 11.756 -1.181 1.00 0.00 C ATOM 851 OE1 GLU A 51 -2.485 11.995 0.014 1.00 0.00 O ATOM 852 OE2 GLU A 51 -1.403 11.495 -1.782 1.00 0.00 O ATOM 0 H GLU A 51 -4.901 9.811 -3.586 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.238 9.249 -1.257 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.729 10.962 -1.788 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.835 11.013 -0.281 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.553 11.511 -3.014 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.151 12.796 -1.983 1.00 0.00 H new ATOM 859 N ILE A 52 -6.325 8.048 -1.260 1.00 0.00 N ATOM 860 CA ILE A 52 -7.187 7.084 -0.489 1.00 0.00 C ATOM 861 C ILE A 52 -6.518 5.702 -0.472 1.00 0.00 C ATOM 862 O ILE A 52 -6.482 5.051 0.556 1.00 0.00 O ATOM 863 CB ILE A 52 -8.560 7.023 -1.197 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.205 8.423 -1.149 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.467 5.998 -0.487 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.676 8.371 -1.599 1.00 0.00 C ATOM 0 H ILE A 52 -6.720 8.386 -2.138 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.316 7.406 0.544 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.431 6.714 -2.234 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.145 8.820 -0.136 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.649 9.105 -1.792 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.434 5.958 -0.989 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -9.000 5.014 -0.521 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.610 6.296 0.552 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.105 9.372 -1.555 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.731 7.997 -2.621 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.235 7.707 -0.940 1.00 0.00 H new ATOM 878 N MET A 53 -5.975 5.248 -1.587 1.00 0.00 N ATOM 879 CA MET A 53 -5.306 3.903 -1.567 1.00 0.00 C ATOM 880 C MET A 53 -4.015 3.970 -0.714 1.00 0.00 C ATOM 881 O MET A 53 -3.626 2.990 -0.108 1.00 0.00 O ATOM 882 CB MET A 53 -5.050 3.487 -3.046 1.00 0.00 C ATOM 883 CG MET A 53 -3.760 4.100 -3.627 1.00 0.00 C ATOM 884 SD MET A 53 -2.668 2.767 -4.178 1.00 0.00 S ATOM 885 CE MET A 53 -3.741 2.183 -5.514 1.00 0.00 C ATOM 0 H MET A 53 -5.966 5.736 -2.483 1.00 0.00 H new ATOM 0 HA MET A 53 -5.932 3.142 -1.100 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.989 2.400 -3.107 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.899 3.794 -3.657 1.00 0.00 H new ATOM 0 HG2 MET A 53 -3.999 4.759 -4.461 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.260 4.708 -2.873 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.150 1.619 -6.236 1.00 0.00 H new ATOM 0 HE2 MET A 53 -4.519 1.541 -5.101 1.00 0.00 H new ATOM 0 HE3 MET A 53 -4.201 3.037 -6.011 1.00 0.00 H new ATOM 895 N GLN A 54 -3.360 5.122 -0.643 1.00 0.00 N ATOM 896 CA GLN A 54 -2.116 5.219 0.200 1.00 0.00 C ATOM 897 C GLN A 54 -2.491 5.044 1.680 1.00 0.00 C ATOM 898 O GLN A 54 -1.766 4.418 2.431 1.00 0.00 O ATOM 899 CB GLN A 54 -1.522 6.618 -0.037 1.00 0.00 C ATOM 900 CG GLN A 54 -0.612 6.584 -1.267 1.00 0.00 C ATOM 901 CD GLN A 54 0.389 7.744 -1.193 1.00 0.00 C ATOM 902 OE1 GLN A 54 0.839 8.101 -0.123 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.763 8.355 -2.292 1.00 0.00 N ATOM 0 H GLN A 54 -3.631 5.980 -1.124 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.393 4.447 -0.063 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.322 7.344 -0.183 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.957 6.938 0.838 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.081 5.633 -1.314 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.208 6.661 -2.176 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.388 8.059 -3.193 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.429 9.126 -2.245 1.00 0.00 H new ATOM 912 N LEU A 55 -3.626 5.576 2.112 1.00 0.00 N ATOM 913 CA LEU A 55 -4.031 5.405 3.558 1.00 0.00 C ATOM 914 C LEU A 55 -4.001 3.911 3.940 1.00 0.00 C ATOM 915 O LEU A 55 -3.689 3.565 5.064 1.00 0.00 O ATOM 916 CB LEU A 55 -5.464 5.952 3.689 1.00 0.00 C ATOM 917 CG LEU A 55 -5.419 7.445 4.029 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.812 8.056 3.848 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.973 7.626 5.484 1.00 0.00 C ATOM 0 H LEU A 55 -4.277 6.111 1.537 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.348 5.936 4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.009 5.798 2.758 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.001 5.408 4.466 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.713 7.944 3.365 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.778 9.118 4.090 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.133 7.930 2.814 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.518 7.555 4.511 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.941 8.688 5.725 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.679 7.125 6.146 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.981 7.194 5.617 1.00 0.00 H new ATOM 931 N HIS A 56 -4.307 3.018 3.010 1.00 0.00 N ATOM 932 CA HIS A 56 -4.271 1.548 3.345 1.00 0.00 C ATOM 933 C HIS A 56 -2.874 1.161 3.863 1.00 0.00 C ATOM 934 O HIS A 56 -2.752 0.357 4.769 1.00 0.00 O ATOM 935 CB HIS A 56 -4.583 0.793 2.043 1.00 0.00 C ATOM 936 CG HIS A 56 -5.145 -0.562 2.370 1.00 0.00 C ATOM 937 ND1 HIS A 56 -6.503 -0.775 2.548 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.547 -1.784 2.555 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.676 -2.079 2.827 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.516 -2.740 2.844 1.00 0.00 N ATOM 0 H HIS A 56 -4.575 3.241 2.051 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.994 1.302 4.123 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.296 1.359 1.444 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.678 0.688 1.445 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -7.238 -0.071 2.480 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.486 -1.974 2.487 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.636 -2.536 3.015 1.00 0.00 H new ATOM 948 N HIS A 57 -1.816 1.734 3.310 1.00 0.00 N ATOM 949 CA HIS A 57 -0.435 1.386 3.811 1.00 0.00 C ATOM 950 C HIS A 57 -0.339 1.735 5.300 1.00 0.00 C ATOM 951 O HIS A 57 0.075 0.921 6.106 1.00 0.00 O ATOM 952 CB HIS A 57 0.564 2.239 3.012 1.00 0.00 C ATOM 953 CG HIS A 57 0.993 1.499 1.777 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.176 1.794 1.116 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.414 0.474 1.072 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.270 0.962 0.063 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.222 0.137 -0.010 1.00 0.00 N ATOM 0 H HIS A 57 -1.848 2.413 2.550 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.223 0.324 3.685 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.106 3.189 2.737 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.433 2.470 3.628 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.525 0.001 1.319 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.092 0.961 -0.637 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.051 -0.586 -0.709 1.00 0.00 H new ATOM 965 N GLN A 58 -0.739 2.934 5.680 1.00 0.00 N ATOM 966 CA GLN A 58 -0.686 3.309 7.138 1.00 0.00 C ATOM 967 C GLN A 58 -1.544 2.323 7.952 1.00 0.00 C ATOM 968 O GLN A 58 -1.190 1.964 9.060 1.00 0.00 O ATOM 969 CB GLN A 58 -1.249 4.734 7.252 1.00 0.00 C ATOM 970 CG GLN A 58 -0.912 5.309 8.630 1.00 0.00 C ATOM 971 CD GLN A 58 -1.085 6.833 8.607 1.00 0.00 C ATOM 972 OE1 GLN A 58 -0.214 7.556 9.051 1.00 0.00 O ATOM 973 NE2 GLN A 58 -2.175 7.361 8.108 1.00 0.00 N ATOM 0 H GLN A 58 -1.094 3.658 5.055 1.00 0.00 H new ATOM 0 HA GLN A 58 0.332 3.268 7.526 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.828 5.366 6.470 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.329 4.722 7.106 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.562 4.870 9.387 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.112 5.053 8.902 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.909 6.759 7.734 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.290 8.374 8.093 1.00 0.00 H new ATOM 982 N ARG A 59 -2.661 1.864 7.407 1.00 0.00 N ATOM 983 CA ARG A 59 -3.508 0.881 8.170 1.00 0.00 C ATOM 984 C ARG A 59 -2.702 -0.402 8.400 1.00 0.00 C ATOM 985 O ARG A 59 -2.581 -0.869 9.519 1.00 0.00 O ATOM 986 CB ARG A 59 -4.738 0.574 7.302 1.00 0.00 C ATOM 987 CG ARG A 59 -5.607 1.823 7.181 1.00 0.00 C ATOM 988 CD ARG A 59 -6.375 2.036 8.486 1.00 0.00 C ATOM 989 NE ARG A 59 -7.547 1.112 8.400 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.548 1.348 7.565 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.550 2.398 6.777 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.559 0.519 7.518 1.00 0.00 N ATOM 0 H ARG A 59 -3.013 2.124 6.486 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.810 1.284 9.137 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.423 0.241 6.313 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.313 -0.240 7.744 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.986 2.692 6.966 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -6.304 1.716 6.350 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.754 1.806 9.352 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.696 3.072 8.590 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.576 0.284 8.995 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.769 3.054 6.799 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.332 2.558 6.143 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.573 -0.303 8.122 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.333 0.695 6.877 1.00 0.00 H new ATOM 1006 N SER A 60 -2.134 -0.975 7.353 1.00 0.00 N ATOM 1007 CA SER A 60 -1.323 -2.224 7.544 1.00 0.00 C ATOM 1008 C SER A 60 -0.110 -1.905 8.420 1.00 0.00 C ATOM 1009 O SER A 60 0.253 -2.688 9.266 1.00 0.00 O ATOM 1010 CB SER A 60 -0.873 -2.690 6.151 1.00 0.00 C ATOM 1011 OG SER A 60 -0.030 -1.700 5.574 1.00 0.00 O ATOM 0 H SER A 60 -2.197 -0.636 6.393 1.00 0.00 H new ATOM 0 HA SER A 60 -1.902 -3.007 8.034 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.341 -3.638 6.226 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.741 -2.861 5.514 1.00 0.00 H new ATOM 0 HG SER A 60 -0.332 -0.810 5.853 1.00 0.00 H new ATOM 1017 N ARG A 61 0.515 -0.757 8.241 1.00 0.00 N ATOM 1018 CA ARG A 61 1.699 -0.420 9.107 1.00 0.00 C ATOM 1019 C ARG A 61 1.246 -0.280 10.570 1.00 0.00 C ATOM 1020 O ARG A 61 1.948 -0.690 11.476 1.00 0.00 O ATOM 1021 CB ARG A 61 2.263 0.916 8.593 1.00 0.00 C ATOM 1022 CG ARG A 61 3.661 1.137 9.173 1.00 0.00 C ATOM 1023 CD ARG A 61 4.127 2.559 8.852 1.00 0.00 C ATOM 1024 NE ARG A 61 5.562 2.599 9.270 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.905 2.679 10.547 1.00 0.00 C ATOM 1026 NH1 ARG A 61 4.999 2.726 11.498 1.00 0.00 N ATOM 1027 NH2 ARG A 61 7.171 2.713 10.875 1.00 0.00 N ATOM 0 H ARG A 61 0.263 -0.053 7.548 1.00 0.00 H new ATOM 0 HA ARG A 61 2.458 -1.201 9.063 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.306 0.910 7.504 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.605 1.736 8.881 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.648 0.982 10.252 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.359 0.411 8.755 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.019 2.780 7.790 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.537 3.299 9.393 1.00 0.00 H new ATOM 0 HE ARG A 61 6.291 2.564 8.558 1.00 0.00 H new ATOM 0 HH11 ARG A 61 4.008 2.701 11.260 1.00 0.00 H new ATOM 0 HH12 ARG A 61 5.287 2.787 12.474 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.887 2.678 10.149 1.00 0.00 H new ATOM 0 HH22 ARG A 61 7.442 2.775 11.856 1.00 0.00 H new ATOM 1041 N TYR A 62 0.077 0.284 10.815 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.396 0.424 12.240 1.00 0.00 C ATOM 1043 C TYR A 62 -0.561 -0.971 12.865 1.00 0.00 C ATOM 1044 O TYR A 62 -0.060 -1.232 13.945 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.750 1.156 12.185 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.294 1.336 13.582 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.033 0.309 14.179 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.059 2.527 14.279 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.539 0.471 15.473 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.565 2.690 15.576 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.304 1.662 16.172 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.804 1.822 17.449 1.00 0.00 O ATOM 0 H TYR A 62 -0.559 0.647 10.105 1.00 0.00 H new ATOM 0 HA TYR A 62 0.317 0.980 12.849 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.629 2.127 11.705 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.457 0.587 11.581 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.213 -0.610 13.640 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.488 3.320 13.818 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.110 -0.322 15.933 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.385 3.608 16.115 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.064 1.827 18.092 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.246 -1.877 12.193 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.414 -3.257 12.771 1.00 0.00 C ATOM 1064 C ILE A 63 -0.097 -4.038 12.615 1.00 0.00 C ATOM 1065 O ILE A 63 0.324 -4.737 13.517 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.552 -3.928 11.980 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.843 -3.122 12.173 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.765 -5.353 12.490 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.949 -3.699 11.287 1.00 0.00 C ATOM 0 H ILE A 63 -1.688 -1.724 11.286 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.657 -3.229 13.833 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.289 -3.959 10.923 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.149 -3.152 13.219 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.671 -2.076 11.921 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.571 -5.824 11.928 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.848 -5.927 12.359 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.028 -5.325 13.547 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.864 -3.124 11.427 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.643 -3.646 10.242 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.129 -4.739 11.560 1.00 0.00 H new ATOM 1081 N TYR A 64 0.570 -3.905 11.486 1.00 0.00 N ATOM 1082 CA TYR A 64 1.879 -4.627 11.296 1.00 0.00 C ATOM 1083 C TYR A 64 2.921 -4.134 12.316 1.00 0.00 C ATOM 1084 O TYR A 64 3.871 -4.831 12.601 1.00 0.00 O ATOM 1085 CB TYR A 64 2.353 -4.303 9.868 1.00 0.00 C ATOM 1086 CG TYR A 64 3.558 -5.140 9.522 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.462 -6.534 9.531 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.765 -4.523 9.181 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.572 -7.314 9.202 1.00 0.00 C ATOM 1090 CE2 TYR A 64 5.880 -5.302 8.850 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.783 -6.699 8.859 1.00 0.00 C ATOM 1092 OH TYR A 64 6.882 -7.471 8.533 1.00 0.00 O ATOM 0 H TYR A 64 0.270 -3.335 10.696 1.00 0.00 H new ATOM 0 HA TYR A 64 1.755 -5.700 11.444 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.550 -4.496 9.157 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.601 -3.244 9.790 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.528 -7.009 9.793 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.837 -3.445 9.173 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.497 -8.391 9.212 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.814 -4.826 8.588 1.00 0.00 H new ATOM 0 HH TYR A 64 7.640 -6.888 8.319 1.00 0.00 H new ATOM 1102 N THR A 65 2.765 -2.946 12.874 1.00 0.00 N ATOM 1103 CA THR A 65 3.775 -2.467 13.871 1.00 0.00 C ATOM 1104 C THR A 65 3.361 -2.879 15.293 1.00 0.00 C ATOM 1105 O THR A 65 4.206 -3.177 16.115 1.00 0.00 O ATOM 1106 CB THR A 65 3.819 -0.936 13.744 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.141 -0.582 12.407 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.882 -0.373 14.691 1.00 0.00 C ATOM 0 H THR A 65 1.996 -2.303 12.683 1.00 0.00 H new ATOM 0 HA THR A 65 4.755 -2.904 13.682 1.00 0.00 H new ATOM 0 HB THR A 65 2.845 -0.522 14.006 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.378 -0.777 11.824 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.912 0.713 14.600 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.635 -0.644 15.717 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.857 -0.786 14.431 1.00 0.00 H new ATOM 1116 N LEU A 66 2.077 -2.889 15.605 1.00 0.00 N ATOM 1117 CA LEU A 66 1.666 -3.275 17.001 1.00 0.00 C ATOM 1118 C LEU A 66 1.590 -4.809 17.185 1.00 0.00 C ATOM 1119 O LEU A 66 1.841 -5.304 18.269 1.00 0.00 O ATOM 1120 CB LEU A 66 0.298 -2.601 17.270 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.822 -3.265 16.453 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.387 -4.467 17.225 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.942 -2.243 16.205 1.00 0.00 C ATOM 0 H LEU A 66 1.315 -2.653 14.970 1.00 0.00 H new ATOM 0 HA LEU A 66 2.412 -2.935 17.719 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.062 -2.663 18.332 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.356 -1.542 17.018 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.420 -3.609 15.500 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.180 -4.934 16.641 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.592 -5.192 17.402 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.790 -4.129 18.180 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.739 -2.710 15.626 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.340 -1.901 17.160 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.543 -1.392 15.653 1.00 0.00 H new ATOM 1135 N TYR A 67 1.242 -5.568 16.163 1.00 0.00 N ATOM 1136 CA TYR A 67 1.156 -7.065 16.345 1.00 0.00 C ATOM 1137 C TYR A 67 2.527 -7.734 16.129 1.00 0.00 C ATOM 1138 O TYR A 67 2.857 -8.688 16.809 1.00 0.00 O ATOM 1139 CB TYR A 67 0.132 -7.582 15.312 1.00 0.00 C ATOM 1140 CG TYR A 67 0.017 -9.094 15.408 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.941 -9.906 14.739 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -1.006 -9.682 16.167 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.845 -11.301 14.830 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.102 -11.077 16.258 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.175 -11.886 15.589 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.268 -13.260 15.677 1.00 0.00 O ATOM 0 H TYR A 67 1.018 -5.226 15.228 1.00 0.00 H new ATOM 0 HA TYR A 67 0.846 -7.308 17.361 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.840 -7.123 15.490 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.441 -7.295 14.307 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.729 -9.457 14.152 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.721 -9.058 16.682 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.559 -11.926 14.314 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.890 -11.528 16.843 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.031 -13.501 16.243 1.00 0.00 H new ATOM 1156 N TYR A 68 3.319 -7.272 15.180 1.00 0.00 N ATOM 1157 CA TYR A 68 4.649 -7.939 14.941 1.00 0.00 C ATOM 1158 C TYR A 68 5.782 -7.326 15.792 1.00 0.00 C ATOM 1159 O TYR A 68 6.788 -7.975 16.016 1.00 0.00 O ATOM 1160 CB TYR A 68 4.949 -7.772 13.445 1.00 0.00 C ATOM 1161 CG TYR A 68 4.305 -8.897 12.667 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.774 -10.208 12.819 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.241 -8.632 11.790 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.182 -11.252 12.098 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.650 -9.677 11.070 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.121 -10.987 11.224 1.00 0.00 C ATOM 1167 OH TYR A 68 2.539 -12.017 10.514 1.00 0.00 O ATOM 0 H TYR A 68 3.109 -6.480 14.573 1.00 0.00 H new ATOM 0 HA TYR A 68 4.597 -8.988 15.234 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.572 -6.812 13.094 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.026 -7.772 13.278 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.593 -10.414 13.493 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.878 -7.622 11.671 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.544 -12.263 12.216 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.831 -9.473 10.396 1.00 0.00 H new ATOM 0 HH TYR A 68 1.817 -11.662 9.955 1.00 0.00 H new ATOM 1177 N LYS A 69 5.656 -6.099 16.268 1.00 0.00 N ATOM 1178 CA LYS A 69 6.766 -5.509 17.088 1.00 0.00 C ATOM 1179 C LYS A 69 6.281 -5.148 18.505 1.00 0.00 C ATOM 1180 O LYS A 69 6.787 -5.669 19.481 1.00 0.00 O ATOM 1181 CB LYS A 69 7.209 -4.241 16.349 1.00 0.00 C ATOM 1182 CG LYS A 69 7.639 -4.581 14.919 1.00 0.00 C ATOM 1183 CD LYS A 69 7.282 -3.411 13.995 1.00 0.00 C ATOM 1184 CE LYS A 69 6.775 -3.950 12.654 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.003 -4.174 11.841 1.00 0.00 N ATOM 0 H LYS A 69 4.847 -5.495 16.125 1.00 0.00 H new ATOM 0 HA LYS A 69 7.582 -6.222 17.204 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.392 -3.520 16.328 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.035 -3.771 16.882 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.711 -4.773 14.885 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.141 -5.491 14.583 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.518 -2.788 14.460 1.00 0.00 H new ATOM 0 HD3 LYS A 69 8.156 -2.779 13.837 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.215 -4.876 12.787 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.105 -3.239 12.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 7.738 -4.544 10.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.512 -3.274 11.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 8.618 -4.860 12.323 1.00 0.00 H new ATOM 1199 N ARG A 70 5.315 -4.258 18.631 1.00 0.00 N ATOM 1200 CA ARG A 70 4.829 -3.878 20.009 1.00 0.00 C ATOM 1201 C ARG A 70 4.308 -5.112 20.764 1.00 0.00 C ATOM 1202 O ARG A 70 4.386 -5.170 21.976 1.00 0.00 O ATOM 1203 CB ARG A 70 3.691 -2.864 19.815 1.00 0.00 C ATOM 1204 CG ARG A 70 3.508 -2.049 21.098 1.00 0.00 C ATOM 1205 CD ARG A 70 4.420 -0.820 21.059 1.00 0.00 C ATOM 1206 NE ARG A 70 3.528 0.308 20.649 1.00 0.00 N ATOM 1207 CZ ARG A 70 2.647 0.830 21.490 1.00 0.00 C ATOM 1208 NH1 ARG A 70 2.523 0.379 22.718 1.00 0.00 N ATOM 1209 NH2 ARG A 70 1.883 1.815 21.096 1.00 0.00 N ATOM 0 H ARG A 70 4.849 -3.786 17.856 1.00 0.00 H new ATOM 0 HA ARG A 70 5.643 -3.454 20.598 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.919 -2.201 18.980 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.765 -3.383 19.566 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.468 -1.740 21.199 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.744 -2.662 21.968 1.00 0.00 H new ATOM 0 HD2 ARG A 70 4.872 -0.632 22.033 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.236 -0.956 20.350 1.00 0.00 H new ATOM 0 HE ARG A 70 3.599 0.683 19.703 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.112 -0.388 23.041 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.838 0.796 23.348 1.00 0.00 H new ATOM 0 HH21 ARG A 70 1.967 2.177 20.146 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.203 2.221 21.738 1.00 0.00 H new ATOM 1223 N LYS A 71 3.766 -6.100 20.071 1.00 0.00 N ATOM 1224 CA LYS A 71 3.235 -7.317 20.768 1.00 0.00 C ATOM 1225 C LYS A 71 2.169 -6.911 21.796 1.00 0.00 C ATOM 1226 O LYS A 71 2.122 -7.442 22.890 1.00 0.00 O ATOM 1227 CB LYS A 71 4.439 -7.971 21.457 1.00 0.00 C ATOM 1228 CG LYS A 71 4.135 -9.447 21.724 1.00 0.00 C ATOM 1229 CD LYS A 71 5.039 -9.960 22.846 1.00 0.00 C ATOM 1230 CE LYS A 71 6.417 -10.305 22.275 1.00 0.00 C ATOM 1231 NZ LYS A 71 6.295 -11.711 21.800 1.00 0.00 N ATOM 0 H LYS A 71 3.672 -6.110 19.055 1.00 0.00 H new ATOM 0 HA LYS A 71 2.761 -8.009 20.072 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.325 -7.879 20.829 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.658 -7.459 22.394 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.088 -9.569 22.002 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.295 -10.032 20.818 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.135 -9.203 23.624 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.595 -10.841 23.311 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.685 -9.634 21.459 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.194 -10.211 23.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.201 -12.020 21.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.045 -12.327 22.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.553 -11.769 21.074 1.00 0.00 H new ATOM 1245 N ALA A 72 1.304 -5.983 21.446 1.00 0.00 N ATOM 1246 CA ALA A 72 0.233 -5.557 22.398 1.00 0.00 C ATOM 1247 C ALA A 72 -1.146 -5.976 21.856 1.00 0.00 C ATOM 1248 O ALA A 72 -2.122 -5.272 22.030 1.00 0.00 O ATOM 1249 CB ALA A 72 0.342 -4.032 22.471 1.00 0.00 C ATOM 0 H ALA A 72 1.297 -5.506 20.544 1.00 0.00 H new ATOM 0 HA ALA A 72 0.346 -6.016 23.380 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.415 -3.645 23.153 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.332 -3.755 22.833 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.187 -3.608 21.479 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.235 -7.118 21.201 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.551 -7.572 20.653 1.00 0.00 C ATOM 1257 C ILE A 73 -2.557 -9.105 20.505 1.00 0.00 C ATOM 1258 O ILE A 73 -1.510 -9.727 20.501 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.675 -6.882 19.285 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.994 -7.293 18.618 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.503 -7.281 18.382 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.190 -6.491 17.329 1.00 0.00 C ATOM 0 H ILE A 73 -0.453 -7.749 21.026 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.387 -7.317 21.304 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.659 -5.802 19.433 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.984 -8.360 18.396 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.827 -7.117 19.298 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.603 -6.786 17.416 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.565 -6.980 18.849 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.506 -8.361 18.238 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.128 -6.785 16.857 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.219 -5.427 17.563 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.363 -6.690 16.648 1.00 0.00 H new ATOM 1274 N SER A 74 -3.713 -9.720 20.384 1.00 0.00 N ATOM 1275 CA SER A 74 -3.748 -11.208 20.238 1.00 0.00 C ATOM 1276 C SER A 74 -4.159 -11.592 18.810 1.00 0.00 C ATOM 1277 O SER A 74 -4.907 -10.880 18.168 1.00 0.00 O ATOM 1278 CB SER A 74 -4.791 -11.692 21.247 1.00 0.00 C ATOM 1279 OG SER A 74 -5.752 -10.666 21.460 1.00 0.00 O ATOM 0 H SER A 74 -4.623 -9.259 20.380 1.00 0.00 H new ATOM 0 HA SER A 74 -2.773 -11.659 20.420 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.280 -12.593 20.877 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.308 -11.955 22.188 1.00 0.00 H new ATOM 0 HG SER A 74 -6.422 -10.974 22.105 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.672 -12.714 18.303 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.042 -13.146 16.899 1.00 0.00 C ATOM 1287 C LYS A 75 -5.559 -13.024 16.650 1.00 0.00 C ATOM 1288 O LYS A 75 -5.979 -12.743 15.544 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.614 -14.616 16.769 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.439 -14.968 15.290 1.00 0.00 C ATOM 1291 CD LYS A 75 -3.478 -16.488 15.118 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.695 -16.881 13.864 1.00 0.00 C ATOM 1293 NZ LYS A 75 -3.476 -17.994 13.257 1.00 0.00 N ATOM 0 H LYS A 75 -3.040 -13.345 18.795 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.546 -12.509 16.167 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.680 -14.783 17.306 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.363 -15.265 17.222 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.229 -14.504 14.699 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.492 -14.574 14.921 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.050 -16.975 15.994 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.510 -16.829 15.037 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.604 -16.041 13.176 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.683 -17.199 14.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.002 -18.319 12.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.540 -18.782 13.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.433 -17.660 13.023 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.389 -13.223 17.660 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.873 -13.094 17.433 1.00 0.00 C ATOM 1309 C ASP A 76 -8.198 -11.659 17.000 1.00 0.00 C ATOM 1310 O ASP A 76 -8.858 -11.448 15.999 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.564 -13.421 18.767 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.288 -14.877 19.143 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -8.347 -15.718 18.260 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -8.020 -15.128 20.307 1.00 0.00 O ATOM 0 H ASP A 76 -6.109 -13.464 18.611 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.217 -13.771 16.651 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.198 -12.757 19.550 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.638 -13.254 18.683 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.724 -10.665 17.730 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.007 -9.247 17.310 1.00 0.00 C ATOM 1321 C LEU A 77 -7.285 -8.980 15.984 1.00 0.00 C ATOM 1322 O LEU A 77 -7.859 -8.433 15.061 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.460 -8.325 18.416 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.719 -6.861 18.042 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.226 -6.587 18.047 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.028 -5.937 19.055 1.00 0.00 C ATOM 0 H LEU A 77 -7.167 -10.771 18.578 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.073 -9.069 17.171 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.939 -8.558 19.367 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.391 -8.493 18.548 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.319 -6.670 17.046 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.407 -5.546 17.781 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.716 -7.237 17.323 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.628 -6.783 19.041 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.215 -4.897 18.786 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.423 -6.130 20.052 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.955 -6.127 19.047 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.032 -9.382 15.874 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.288 -9.160 14.584 1.00 0.00 C ATOM 1340 C TYR A 78 -6.020 -9.881 13.436 1.00 0.00 C ATOM 1341 O TYR A 78 -6.117 -9.360 12.340 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.871 -9.739 14.787 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.054 -9.606 13.516 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.053 -8.402 12.799 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.293 -10.689 13.061 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.294 -8.284 11.627 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.534 -10.571 11.891 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.534 -9.368 11.174 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.784 -9.252 10.020 1.00 0.00 O ATOM 0 H TYR A 78 -5.501 -9.847 16.610 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.233 -8.103 14.324 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.372 -9.216 15.603 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.939 -10.788 15.074 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.638 -7.564 13.150 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.291 -11.617 13.613 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.296 -7.357 11.074 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.948 -11.408 11.541 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.316 -10.096 9.848 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.561 -11.063 13.681 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.307 -11.777 12.586 1.00 0.00 C ATOM 1361 C ASP A 79 -8.657 -11.079 12.372 1.00 0.00 C ATOM 1362 O ASP A 79 -9.074 -10.859 11.250 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.520 -13.224 13.060 1.00 0.00 C ATOM 1364 CG ASP A 79 -8.022 -14.075 11.893 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.340 -14.117 10.881 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -9.078 -14.669 12.029 1.00 0.00 O ATOM 0 H ASP A 79 -6.518 -11.553 14.574 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.758 -11.764 11.644 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.586 -13.632 13.446 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.241 -13.248 13.877 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.339 -10.707 13.442 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.660 -9.996 13.279 1.00 0.00 C ATOM 1373 C TRP A 80 -10.462 -8.712 12.452 1.00 0.00 C ATOM 1374 O TRP A 80 -11.310 -8.351 11.657 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.150 -9.650 14.698 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.490 -8.987 14.629 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.662 -9.624 14.403 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.815 -7.575 14.788 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.685 -8.693 14.412 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.213 -7.416 14.646 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -12.040 -6.428 15.040 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.822 -6.165 14.749 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.649 -5.167 15.144 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -14.036 -5.036 14.999 1.00 0.00 C ATOM 0 H TRP A 80 -9.043 -10.862 14.406 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.387 -10.618 12.757 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.214 -10.556 15.301 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.434 -8.991 15.188 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.780 -10.685 14.242 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.668 -8.922 14.264 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.970 -6.518 15.154 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.892 -6.069 14.637 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -12.044 -4.293 15.337 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.498 -4.063 15.080 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.344 -8.025 12.618 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.116 -6.776 11.810 1.00 0.00 C ATOM 1397 C LEU A 81 -8.891 -7.169 10.342 1.00 0.00 C ATOM 1398 O LEU A 81 -9.527 -6.641 9.449 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.853 -6.099 12.375 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.062 -5.743 13.851 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.707 -5.701 14.560 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.727 -4.371 13.955 1.00 0.00 C ATOM 0 H LEU A 81 -8.595 -8.271 13.265 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.969 -6.100 11.864 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.997 -6.765 12.271 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.627 -5.198 11.804 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.698 -6.494 14.319 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.853 -5.448 15.610 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.227 -6.677 14.485 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.074 -4.948 14.090 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.876 -4.117 15.005 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.089 -3.621 13.487 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.691 -4.395 13.447 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.000 -8.109 10.084 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.754 -8.540 8.656 1.00 0.00 C ATOM 1416 C ILE A 82 -9.074 -9.026 8.012 1.00 0.00 C ATOM 1417 O ILE A 82 -9.257 -8.894 6.815 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.719 -9.693 8.711 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.365 -9.167 9.226 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.519 -10.301 7.314 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.830 -8.058 8.309 1.00 0.00 C ATOM 0 H ILE A 82 -7.440 -8.591 10.787 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.381 -7.713 8.052 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.098 -10.458 9.389 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.480 -8.784 10.240 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.646 -9.985 9.274 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.789 -11.109 7.370 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.468 -10.694 6.949 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.157 -9.532 6.631 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.874 -7.700 8.690 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.695 -8.452 7.302 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.542 -7.233 8.283 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.989 -9.592 8.780 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.277 -10.081 8.169 1.00 0.00 C ATOM 1435 C LYS A 83 -12.364 -8.985 8.147 1.00 0.00 C ATOM 1436 O LYS A 83 -13.302 -9.076 7.376 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.737 -11.264 9.033 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.423 -12.306 8.147 1.00 0.00 C ATOM 1439 CD LYS A 83 -13.237 -13.263 9.020 1.00 0.00 C ATOM 1440 CE LYS A 83 -14.420 -13.807 8.217 1.00 0.00 C ATOM 1441 NZ LYS A 83 -13.892 -15.018 7.530 1.00 0.00 N ATOM 0 H LYS A 83 -9.901 -9.734 9.786 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.115 -10.368 7.130 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.883 -11.710 9.543 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.424 -10.919 9.805 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.074 -11.813 7.425 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.678 -12.861 7.577 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.607 -14.085 9.362 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -13.595 -12.745 9.909 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -15.258 -14.056 8.868 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -14.782 -13.071 7.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.646 -15.449 6.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -13.099 -14.749 6.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -13.561 -15.703 8.239 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.267 -7.957 8.972 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.330 -6.891 8.954 1.00 0.00 C ATOM 1457 C GLU A 84 -12.873 -5.626 8.186 1.00 0.00 C ATOM 1458 O GLU A 84 -13.411 -4.555 8.392 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.586 -6.552 10.415 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.239 -7.740 11.119 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.625 -7.992 10.523 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.364 -7.034 10.364 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.926 -9.140 10.237 1.00 0.00 O ATOM 0 H GLU A 84 -11.513 -7.813 9.643 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.224 -7.247 8.443 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.648 -6.297 10.908 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.231 -5.677 10.486 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.617 -8.628 11.007 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.322 -7.541 12.188 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.899 -5.741 7.297 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.402 -4.568 6.487 1.00 0.00 C ATOM 1472 C LYS A 85 -10.567 -3.608 7.337 1.00 0.00 C ATOM 1473 O LYS A 85 -11.031 -2.560 7.745 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.635 -3.857 5.900 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.340 -3.414 4.465 1.00 0.00 C ATOM 1476 CD LYS A 85 -12.809 -4.496 3.490 1.00 0.00 C ATOM 1477 CE LYS A 85 -13.160 -3.855 2.145 1.00 0.00 C ATOM 1478 NZ LYS A 85 -14.637 -3.669 2.183 1.00 0.00 N ATOM 0 H LYS A 85 -11.419 -6.618 7.096 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.746 -4.918 5.690 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.495 -4.527 5.915 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.894 -2.993 6.512 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -12.847 -2.473 4.252 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.272 -3.236 4.341 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -12.027 -5.243 3.356 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.678 -5.014 3.896 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -12.645 -2.903 2.015 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -12.864 -4.494 1.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -14.955 -3.233 1.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.100 -4.593 2.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -14.889 -3.051 2.981 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.326 -3.962 7.602 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.446 -3.081 8.417 1.00 0.00 C ATOM 1494 C TYR A 86 -7.069 -2.976 7.750 1.00 0.00 C ATOM 1495 O TYR A 86 -6.672 -1.919 7.301 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.336 -3.782 9.770 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.571 -3.496 10.583 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.795 -4.105 10.260 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.490 -2.615 11.668 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.933 -3.821 11.030 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.626 -2.336 12.432 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.848 -2.938 12.113 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.969 -2.663 12.868 1.00 0.00 O ATOM 0 H TYR A 86 -8.891 -4.828 7.284 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.836 -2.068 8.517 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.222 -4.857 9.627 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.449 -3.435 10.301 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.860 -4.787 9.425 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.547 -2.150 11.915 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.877 -4.285 10.786 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.561 -1.656 13.268 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.697 -2.313 13.742 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.345 -4.070 7.667 1.00 0.00 N ATOM 1514 CA ALA A 87 -5.004 -4.038 7.017 1.00 0.00 C ATOM 1515 C ALA A 87 -4.986 -5.012 5.830 1.00 0.00 C ATOM 1516 O ALA A 87 -6.007 -5.578 5.483 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.025 -4.491 8.101 1.00 0.00 C ATOM 0 H ALA A 87 -6.630 -4.982 8.024 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.747 -3.051 6.632 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.012 -4.494 7.698 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.077 -3.806 8.947 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.287 -5.496 8.431 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.848 -5.213 5.200 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.797 -6.151 4.041 1.00 0.00 C ATOM 1525 C ASP A 88 -2.728 -7.231 4.274 1.00 0.00 C ATOM 1526 O ASP A 88 -1.548 -6.979 4.118 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.425 -5.277 2.845 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.957 -5.915 1.561 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.800 -7.115 1.409 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.513 -5.192 0.750 1.00 0.00 O ATOM 0 H ASP A 88 -2.962 -4.769 5.440 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.742 -6.672 3.889 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.843 -4.278 2.967 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.342 -5.164 2.786 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.128 -8.434 4.639 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.105 -9.519 4.868 1.00 0.00 C ATOM 1537 C LYS A 89 -1.314 -9.770 3.575 1.00 0.00 C ATOM 1538 O LYS A 89 -0.114 -9.966 3.610 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.877 -10.786 5.270 1.00 0.00 C ATOM 1540 CG LYS A 89 -3.039 -10.826 6.790 1.00 0.00 C ATOM 1541 CD LYS A 89 -1.830 -11.526 7.414 1.00 0.00 C ATOM 1542 CE LYS A 89 -2.090 -13.033 7.481 1.00 0.00 C ATOM 1543 NZ LYS A 89 -0.741 -13.658 7.395 1.00 0.00 N ATOM 0 H LYS A 89 -4.099 -8.709 4.786 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.397 -9.234 5.646 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.855 -10.796 4.789 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.344 -11.673 4.927 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -3.129 -9.814 7.183 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.955 -11.354 7.055 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -0.936 -11.327 6.823 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.645 -11.133 8.414 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.594 -13.306 8.408 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -2.730 -13.360 6.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -0.835 -14.693 7.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -0.288 -13.385 6.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -0.156 -13.333 8.191 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.973 -9.764 2.431 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.227 -10.003 1.143 1.00 0.00 C ATOM 1559 C LEU A 90 -0.152 -8.921 0.948 1.00 0.00 C ATOM 1560 O LEU A 90 0.935 -9.211 0.484 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.261 -9.936 0.007 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.683 -10.589 -1.249 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.661 -12.109 -1.073 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.551 -10.229 -2.457 1.00 0.00 C ATOM 0 H LEU A 90 -2.976 -9.607 2.334 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.726 -10.971 1.155 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.178 -10.445 0.305 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.525 -8.898 -0.198 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.667 -10.228 -1.410 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.249 -12.573 -1.969 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.042 -12.367 -0.213 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.676 -12.471 -0.911 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.139 -10.694 -3.353 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.567 -10.589 -2.295 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.566 -9.147 -2.585 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.430 -7.681 1.311 1.00 0.00 N ATOM 1577 CA LEU A 91 0.619 -6.612 1.144 1.00 0.00 C ATOM 1578 C LEU A 91 1.735 -6.851 2.166 1.00 0.00 C ATOM 1579 O LEU A 91 2.901 -6.883 1.817 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.063 -5.260 1.400 1.00 0.00 C ATOM 1581 CG LEU A 91 0.937 -4.130 1.143 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.304 -4.091 -0.342 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.309 -2.794 1.546 1.00 0.00 C ATOM 0 H LEU A 91 -1.317 -7.369 1.707 1.00 0.00 H new ATOM 0 HA LEU A 91 1.054 -6.628 0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.930 -5.148 0.749 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.427 -5.212 2.426 1.00 0.00 H new ATOM 0 HG LEU A 91 1.837 -4.305 1.732 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.016 -3.285 -0.520 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.752 -5.042 -0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.405 -3.919 -0.934 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.020 -1.988 1.364 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.592 -2.623 0.957 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.051 -2.818 2.605 1.00 0.00 H new ATOM 1595 N ILE A 92 1.391 -7.049 3.426 1.00 0.00 N ATOM 1596 CA ILE A 92 2.460 -7.320 4.454 1.00 0.00 C ATOM 1597 C ILE A 92 3.247 -8.588 4.044 1.00 0.00 C ATOM 1598 O ILE A 92 4.441 -8.670 4.267 1.00 0.00 O ATOM 1599 CB ILE A 92 1.733 -7.501 5.812 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.230 -6.125 6.286 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.689 -8.086 6.864 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.531 -6.243 7.648 1.00 0.00 C ATOM 0 H ILE A 92 0.435 -7.035 3.781 1.00 0.00 H new ATOM 0 HA ILE A 92 3.181 -6.506 4.531 1.00 0.00 H new ATOM 0 HB ILE A 92 0.898 -8.190 5.684 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.068 -5.432 6.360 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.539 -5.712 5.551 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.160 -8.205 7.810 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.052 -9.057 6.526 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.534 -7.411 7.003 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.183 -5.260 7.965 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.320 -6.919 7.563 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.233 -6.634 8.384 1.00 0.00 H new ATOM 1614 N ALA A 93 2.598 -9.564 3.430 1.00 0.00 N ATOM 1615 CA ALA A 93 3.350 -10.796 3.001 1.00 0.00 C ATOM 1616 C ALA A 93 4.358 -10.421 1.903 1.00 0.00 C ATOM 1617 O ALA A 93 5.509 -10.810 1.961 1.00 0.00 O ATOM 1618 CB ALA A 93 2.310 -11.788 2.455 1.00 0.00 C ATOM 0 H ALA A 93 1.601 -9.560 3.212 1.00 0.00 H new ATOM 0 HA ALA A 93 3.901 -11.237 3.832 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.812 -12.700 2.131 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.591 -12.028 3.238 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.789 -11.340 1.609 1.00 0.00 H new ATOM 1624 N LYS A 94 3.943 -9.658 0.904 1.00 0.00 N ATOM 1625 CA LYS A 94 4.915 -9.262 -0.179 1.00 0.00 C ATOM 1626 C LYS A 94 6.073 -8.466 0.429 1.00 0.00 C ATOM 1627 O LYS A 94 7.224 -8.712 0.113 1.00 0.00 O ATOM 1628 CB LYS A 94 4.142 -8.399 -1.194 1.00 0.00 C ATOM 1629 CG LYS A 94 3.545 -9.298 -2.281 1.00 0.00 C ATOM 1630 CD LYS A 94 2.185 -8.751 -2.711 1.00 0.00 C ATOM 1631 CE LYS A 94 1.850 -9.260 -4.115 1.00 0.00 C ATOM 1632 NZ LYS A 94 1.501 -10.696 -3.931 1.00 0.00 N ATOM 0 H LYS A 94 2.994 -9.300 0.794 1.00 0.00 H new ATOM 0 HA LYS A 94 5.334 -10.141 -0.669 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.350 -7.847 -0.689 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.808 -7.662 -1.642 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.217 -9.344 -3.138 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.437 -10.316 -1.906 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.416 -9.065 -2.006 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.200 -7.661 -2.702 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.019 -8.704 -4.548 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.698 -9.143 -4.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.052 -11.058 -4.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.365 -11.241 -3.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.842 -10.794 -3.132 1.00 0.00 H new ATOM 1646 N TRP A 95 5.795 -7.526 1.313 1.00 0.00 N ATOM 1647 CA TRP A 95 6.925 -6.749 1.940 1.00 0.00 C ATOM 1648 C TRP A 95 7.886 -7.711 2.666 1.00 0.00 C ATOM 1649 O TRP A 95 9.069 -7.442 2.763 1.00 0.00 O ATOM 1650 CB TRP A 95 6.298 -5.750 2.933 1.00 0.00 C ATOM 1651 CG TRP A 95 5.994 -4.448 2.243 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.766 -3.862 1.292 1.00 0.00 C ATOM 1653 CD2 TRP A 95 4.857 -3.556 2.444 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.170 -2.681 0.894 1.00 0.00 N ATOM 1655 CE2 TRP A 95 4.995 -2.446 1.575 1.00 0.00 C ATOM 1656 CE3 TRP A 95 3.730 -3.602 3.285 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.050 -1.421 1.540 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 2.777 -2.569 3.252 1.00 0.00 C ATOM 1659 CH2 TRP A 95 2.938 -1.482 2.381 1.00 0.00 C ATOM 0 H TRP A 95 4.858 -7.267 1.622 1.00 0.00 H new ATOM 0 HA TRP A 95 7.501 -6.217 1.183 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.383 -6.169 3.352 1.00 0.00 H new ATOM 0 HB3 TRP A 95 6.980 -5.578 3.765 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.696 -4.256 0.909 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.553 -2.058 0.183 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.596 -4.435 3.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.178 -0.586 0.867 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 1.915 -2.613 3.902 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.202 -0.692 2.361 1.00 0.00 H new ATOM 1670 N ARG A 96 7.403 -8.841 3.156 1.00 0.00 N ATOM 1671 CA ARG A 96 8.322 -9.809 3.841 1.00 0.00 C ATOM 1672 C ARG A 96 8.720 -10.960 2.888 1.00 0.00 C ATOM 1673 O ARG A 96 9.111 -12.021 3.337 1.00 0.00 O ATOM 1674 CB ARG A 96 7.533 -10.359 5.036 1.00 0.00 C ATOM 1675 CG ARG A 96 7.432 -9.288 6.126 1.00 0.00 C ATOM 1676 CD ARG A 96 6.048 -9.343 6.784 1.00 0.00 C ATOM 1677 NE ARG A 96 6.279 -9.956 8.131 1.00 0.00 N ATOM 1678 CZ ARG A 96 6.319 -11.269 8.301 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.154 -12.102 7.300 1.00 0.00 N ATOM 1680 NH2 ARG A 96 6.528 -11.757 9.497 1.00 0.00 N ATOM 0 H ARG A 96 6.425 -9.127 3.110 1.00 0.00 H new ATOM 0 HA ARG A 96 9.246 -9.323 4.153 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.536 -10.662 4.717 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.025 -11.248 5.431 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.207 -9.445 6.876 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.601 -8.301 5.695 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.614 -8.347 6.874 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.354 -9.941 6.193 1.00 0.00 H new ATOM 0 HE ARG A 96 6.409 -9.346 8.938 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.990 -11.743 6.360 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.190 -13.108 7.463 1.00 0.00 H new ATOM 0 HH21 ARG A 96 6.658 -11.128 10.289 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.560 -12.767 9.637 1.00 0.00 H new ATOM 1694 N LYS A 97 8.639 -10.767 1.579 1.00 0.00 N ATOM 1695 CA LYS A 97 9.031 -11.858 0.631 1.00 0.00 C ATOM 1696 C LYS A 97 10.340 -11.485 -0.081 1.00 0.00 C ATOM 1697 O LYS A 97 10.945 -10.475 0.224 1.00 0.00 O ATOM 1698 CB LYS A 97 7.887 -11.944 -0.386 1.00 0.00 C ATOM 1699 CG LYS A 97 6.824 -12.939 0.080 1.00 0.00 C ATOM 1700 CD LYS A 97 7.433 -14.347 0.191 1.00 0.00 C ATOM 1701 CE LYS A 97 7.586 -14.732 1.665 1.00 0.00 C ATOM 1702 NZ LYS A 97 7.340 -16.200 1.705 1.00 0.00 N ATOM 0 H LYS A 97 8.320 -9.905 1.138 1.00 0.00 H new ATOM 0 HA LYS A 97 9.192 -12.807 1.143 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.438 -10.960 -0.520 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.278 -12.250 -1.356 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.423 -12.630 1.046 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.991 -12.949 -0.622 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.796 -15.070 -0.319 1.00 0.00 H new ATOM 0 HD3 LYS A 97 8.404 -14.373 -0.304 1.00 0.00 H new ATOM 0 HE2 LYS A 97 8.582 -14.488 2.036 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.873 -14.195 2.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 7.427 -16.540 2.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 6.382 -16.401 1.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 8.038 -16.685 1.106 1.00 0.00 H new ATOM 1716 N THR A 98 10.776 -12.280 -1.039 1.00 0.00 N ATOM 1717 CA THR A 98 12.037 -11.943 -1.771 1.00 0.00 C ATOM 1718 C THR A 98 11.690 -11.402 -3.163 1.00 0.00 C ATOM 1719 O THR A 98 10.805 -11.916 -3.823 1.00 0.00 O ATOM 1720 CB THR A 98 12.823 -13.254 -1.877 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.951 -13.834 -0.587 1.00 0.00 O ATOM 1722 CG2 THR A 98 14.212 -12.974 -2.453 1.00 0.00 C ATOM 0 H THR A 98 10.314 -13.138 -1.340 1.00 0.00 H new ATOM 0 HA THR A 98 12.621 -11.178 -1.259 1.00 0.00 H new ATOM 0 HB THR A 98 12.292 -13.943 -2.534 1.00 0.00 H new ATOM 0 HG1 THR A 98 13.452 -14.674 -0.654 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.770 -13.907 -2.528 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.112 -12.530 -3.444 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.745 -12.284 -1.799 1.00 0.00 H new ATOM 1730 N GLY A 99 12.359 -10.360 -3.612 1.00 0.00 N ATOM 1731 CA GLY A 99 12.034 -9.791 -4.954 1.00 0.00 C ATOM 1732 C GLY A 99 11.188 -8.511 -4.799 1.00 0.00 C ATOM 1733 O GLY A 99 11.210 -7.655 -5.664 1.00 0.00 O ATOM 0 H GLY A 99 13.109 -9.886 -3.108 1.00 0.00 H new ATOM 0 HA2 GLY A 99 12.954 -9.565 -5.494 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.489 -10.526 -5.547 1.00 0.00 H new ATOM 1737 N TYR A 100 10.446 -8.359 -3.712 1.00 0.00 N ATOM 1738 CA TYR A 100 9.619 -7.114 -3.543 1.00 0.00 C ATOM 1739 C TYR A 100 10.418 -6.053 -2.765 1.00 0.00 C ATOM 1740 O TYR A 100 9.994 -5.597 -1.718 1.00 0.00 O ATOM 1741 CB TYR A 100 8.376 -7.526 -2.741 1.00 0.00 C ATOM 1742 CG TYR A 100 7.588 -8.573 -3.490 1.00 0.00 C ATOM 1743 CD1 TYR A 100 6.906 -8.236 -4.664 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.529 -9.879 -2.996 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.162 -9.208 -5.344 1.00 0.00 C ATOM 1746 CE2 TYR A 100 6.789 -10.855 -3.673 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.103 -10.519 -4.848 1.00 0.00 C ATOM 1748 OH TYR A 100 5.371 -11.477 -5.518 1.00 0.00 O ATOM 0 H TYR A 100 10.381 -9.034 -2.950 1.00 0.00 H new ATOM 0 HA TYR A 100 9.346 -6.686 -4.507 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.676 -7.915 -1.768 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.749 -6.654 -2.556 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.953 -7.227 -5.046 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.056 -10.136 -2.089 1.00 0.00 H new ATOM 0 HE1 TYR A 100 5.634 -8.949 -6.250 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.747 -11.864 -3.291 1.00 0.00 H new ATOM 0 HH TYR A 100 5.436 -12.331 -5.042 1.00 0.00 H new ATOM 1758 N GLU A 101 11.568 -5.650 -3.264 1.00 0.00 N ATOM 1759 CA GLU A 101 12.373 -4.610 -2.526 1.00 0.00 C ATOM 1760 C GLU A 101 11.707 -3.230 -2.659 1.00 0.00 C ATOM 1761 O GLU A 101 11.705 -2.452 -1.722 1.00 0.00 O ATOM 1762 CB GLU A 101 13.774 -4.589 -3.160 1.00 0.00 C ATOM 1763 CG GLU A 101 14.697 -5.533 -2.386 1.00 0.00 C ATOM 1764 CD GLU A 101 16.119 -4.968 -2.381 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.854 -5.258 -3.312 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.449 -4.256 -1.447 1.00 0.00 O ATOM 0 H GLU A 101 11.980 -5.987 -4.134 1.00 0.00 H new ATOM 0 HA GLU A 101 12.433 -4.848 -1.464 1.00 0.00 H new ATOM 0 HB2 GLU A 101 13.717 -4.894 -4.205 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.177 -3.576 -3.145 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.338 -5.652 -1.364 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.689 -6.522 -2.844 1.00 0.00 H new ATOM 1773 N LYS A 102 11.142 -2.912 -3.809 1.00 0.00 N ATOM 1774 CA LYS A 102 10.484 -1.580 -3.975 1.00 0.00 C ATOM 1775 C LYS A 102 9.061 -1.749 -4.529 1.00 0.00 C ATOM 1776 O LYS A 102 8.842 -1.619 -5.720 1.00 0.00 O ATOM 1777 CB LYS A 102 11.365 -0.826 -4.978 1.00 0.00 C ATOM 1778 CG LYS A 102 12.527 -0.157 -4.239 1.00 0.00 C ATOM 1779 CD LYS A 102 12.173 1.305 -3.921 1.00 0.00 C ATOM 1780 CE LYS A 102 13.181 2.246 -4.591 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.101 2.666 -3.498 1.00 0.00 N ATOM 0 H LYS A 102 11.112 -3.517 -4.630 1.00 0.00 H new ATOM 0 HA LYS A 102 10.391 -1.047 -3.029 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.748 -1.515 -5.731 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.775 -0.075 -5.504 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.742 -0.697 -3.317 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.429 -0.197 -4.850 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.166 1.528 -4.272 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.177 1.463 -2.842 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.723 1.740 -5.390 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.682 3.105 -5.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.821 3.313 -3.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.559 3.151 -2.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.567 1.828 -3.095 1.00 0.00 H new ATOM 1795 N LEU A 103 8.088 -2.034 -3.682 1.00 0.00 N ATOM 1796 CA LEU A 103 6.690 -2.200 -4.186 1.00 0.00 C ATOM 1797 C LEU A 103 5.753 -1.163 -3.524 1.00 0.00 C ATOM 1798 O LEU A 103 5.966 -0.765 -2.394 1.00 0.00 O ATOM 1799 CB LEU A 103 6.307 -3.664 -3.846 1.00 0.00 C ATOM 1800 CG LEU A 103 5.658 -3.785 -2.455 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.156 -3.503 -2.570 1.00 0.00 C ATOM 1802 CD2 LEU A 103 5.869 -5.200 -1.914 1.00 0.00 C ATOM 0 H LEU A 103 8.206 -2.156 -2.676 1.00 0.00 H new ATOM 0 HA LEU A 103 6.601 -2.023 -5.258 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.618 -4.043 -4.601 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.199 -4.290 -3.885 1.00 0.00 H new ATOM 0 HG LEU A 103 6.115 -3.065 -1.776 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.694 -3.588 -1.587 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.004 -2.495 -2.957 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.701 -4.225 -3.248 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.409 -5.285 -0.929 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.411 -5.921 -2.592 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.937 -5.404 -1.835 1.00 0.00 H new ATOM 1814 N CYS A 104 4.729 -0.717 -4.222 1.00 0.00 N ATOM 1815 CA CYS A 104 3.799 0.300 -3.621 1.00 0.00 C ATOM 1816 C CYS A 104 2.375 -0.246 -3.366 1.00 0.00 C ATOM 1817 O CYS A 104 1.697 0.239 -2.483 1.00 0.00 O ATOM 1818 CB CYS A 104 3.790 1.496 -4.588 1.00 0.00 C ATOM 1819 SG CYS A 104 3.254 1.025 -6.261 1.00 0.00 S ATOM 0 H CYS A 104 4.499 -1.010 -5.172 1.00 0.00 H new ATOM 0 HA CYS A 104 4.152 0.589 -2.631 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.127 2.269 -4.200 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.789 1.929 -4.637 1.00 0.00 H new ATOM 0 HG CYS A 104 1.973 0.801 -6.259 1.00 0.00 H new ATOM 1824 N CYS A 105 1.900 -1.239 -4.095 1.00 0.00 N ATOM 1825 CA CYS A 105 0.518 -1.769 -3.815 1.00 0.00 C ATOM 1826 C CYS A 105 0.497 -3.296 -4.022 1.00 0.00 C ATOM 1827 O CYS A 105 1.534 -3.919 -4.148 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.443 -1.115 -4.823 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.168 0.675 -4.992 1.00 0.00 S ATOM 0 H CYS A 105 2.399 -1.697 -4.857 1.00 0.00 H new ATOM 0 HA CYS A 105 0.224 -1.544 -2.790 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.322 -1.591 -5.796 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.471 -1.293 -4.507 1.00 0.00 H new ATOM 0 HG CYS A 105 -1.131 1.320 -4.403 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.677 -3.905 -4.073 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.739 -5.390 -4.291 1.00 0.00 C ATOM 1836 C LEU A 106 -0.988 -5.702 -5.779 1.00 0.00 C ATOM 1837 O LEU A 106 -0.406 -6.623 -6.322 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.900 -5.896 -3.428 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.396 -6.197 -2.014 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.581 -6.601 -1.137 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.362 -7.338 -2.057 1.00 0.00 C ATOM 0 H LEU A 106 -1.580 -3.441 -3.974 1.00 0.00 H new ATOM 0 HA LEU A 106 0.197 -5.876 -4.016 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.692 -5.148 -3.391 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.331 -6.794 -3.870 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.920 -5.309 -1.599 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.230 -6.817 -0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.303 -5.785 -1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.056 -7.489 -1.554 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.008 -7.546 -1.047 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.825 -8.233 -2.471 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.480 -7.043 -2.683 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.815 -4.925 -6.460 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.048 -5.177 -7.925 1.00 0.00 C ATOM 1855 C ARG A 107 -1.258 -4.145 -8.763 1.00 0.00 C ATOM 1856 O ARG A 107 -1.682 -3.745 -9.829 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.555 -5.007 -8.142 1.00 0.00 C ATOM 1858 CG ARG A 107 -3.984 -5.788 -9.386 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.490 -5.622 -9.600 1.00 0.00 C ATOM 1860 NE ARG A 107 -5.882 -6.766 -10.478 1.00 0.00 N ATOM 1861 CZ ARG A 107 -5.961 -8.001 -10.006 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -5.700 -8.270 -8.747 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -6.309 -8.978 -10.804 1.00 0.00 N ATOM 0 H ARG A 107 -2.331 -4.138 -6.067 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.714 -6.169 -8.229 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.101 -5.364 -7.269 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.799 -3.951 -8.260 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.440 -5.428 -10.259 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.737 -6.843 -9.269 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -6.029 -5.648 -8.653 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.719 -4.666 -10.071 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.093 -6.592 -11.461 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.430 -7.520 -8.111 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -5.767 -9.229 -8.406 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -6.518 -8.786 -11.784 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -6.372 -9.931 -10.446 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.117 -3.703 -8.274 1.00 0.00 N ATOM 1878 CA CYS A 108 0.711 -2.690 -9.005 1.00 0.00 C ATOM 1879 C CYS A 108 2.169 -3.227 -9.136 1.00 0.00 C ATOM 1880 O CYS A 108 3.081 -2.471 -9.400 1.00 0.00 O ATOM 1881 CB CYS A 108 0.643 -1.505 -8.028 1.00 0.00 C ATOM 1882 SG CYS A 108 0.727 0.133 -8.791 1.00 0.00 S ATOM 0 H CYS A 108 0.278 -4.009 -7.385 1.00 0.00 H new ATOM 0 HA CYS A 108 0.382 -2.447 -10.015 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.285 -1.576 -7.461 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.461 -1.597 -7.314 1.00 0.00 H new ATOM 0 HG CYS A 108 1.039 0.011 -10.047 1.00 0.00 H new ATOM 1887 N ILE A 109 2.393 -4.532 -8.932 1.00 0.00 N ATOM 1888 CA ILE A 109 3.782 -5.110 -9.011 1.00 0.00 C ATOM 1889 C ILE A 109 3.724 -6.637 -9.256 1.00 0.00 C ATOM 1890 O ILE A 109 4.506 -7.378 -8.689 1.00 0.00 O ATOM 1891 CB ILE A 109 4.405 -4.870 -7.617 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.474 -5.440 -6.521 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.622 -3.376 -7.376 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.246 -6.406 -5.617 1.00 0.00 C ATOM 0 H ILE A 109 1.663 -5.211 -8.715 1.00 0.00 H new ATOM 0 HA ILE A 109 4.349 -4.654 -9.822 1.00 0.00 H new ATOM 0 HB ILE A 109 5.369 -5.377 -7.577 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.061 -4.626 -5.926 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.632 -5.957 -6.982 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.061 -3.227 -6.390 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.294 -2.979 -8.137 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.665 -2.856 -7.430 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.578 -6.799 -4.850 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.637 -7.229 -6.215 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.073 -5.878 -5.142 1.00 0.00 H new ATOM 1906 N GLN A 110 2.799 -7.122 -10.063 1.00 0.00 N ATOM 1907 CA GLN A 110 2.711 -8.605 -10.282 1.00 0.00 C ATOM 1908 C GLN A 110 3.067 -8.978 -11.729 1.00 0.00 C ATOM 1909 O GLN A 110 2.521 -8.430 -12.665 1.00 0.00 O ATOM 1910 CB GLN A 110 1.252 -8.965 -9.982 1.00 0.00 C ATOM 1911 CG GLN A 110 1.149 -9.598 -8.592 1.00 0.00 C ATOM 1912 CD GLN A 110 1.336 -11.115 -8.706 1.00 0.00 C ATOM 1913 OE1 GLN A 110 2.284 -11.573 -9.314 1.00 0.00 O ATOM 1914 NE2 GLN A 110 0.472 -11.926 -8.145 1.00 0.00 N ATOM 0 H GLN A 110 2.113 -6.563 -10.570 1.00 0.00 H new ATOM 0 HA GLN A 110 3.412 -9.145 -9.646 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.630 -8.071 -10.032 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.876 -9.657 -10.736 1.00 0.00 H new ATOM 0 HG2 GLN A 110 1.907 -9.176 -7.932 1.00 0.00 H new ATOM 0 HG3 GLN A 110 0.179 -9.373 -8.149 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -0.325 -11.547 -7.634 1.00 0.00 H new ATOM 0 HE22 GLN A 110 0.597 -12.936 -8.220 1.00 0.00 H new ATOM 2034 N THR A 119 1.144 -6.858 -14.930 1.00 0.00 N ATOM 2035 CA THR A 119 2.013 -6.082 -13.994 1.00 0.00 C ATOM 2036 C THR A 119 1.830 -4.577 -14.224 1.00 0.00 C ATOM 2037 O THR A 119 1.172 -4.167 -15.163 1.00 0.00 O ATOM 2038 CB THR A 119 3.448 -6.490 -14.334 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.468 -7.843 -14.771 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.329 -6.336 -13.091 1.00 0.00 C ATOM 0 HA THR A 119 1.766 -6.286 -12.952 1.00 0.00 H new ATOM 0 HB THR A 119 3.830 -5.850 -15.130 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.370 -8.438 -13.998 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.352 -6.626 -13.332 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.315 -5.297 -12.761 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.949 -6.975 -12.294 1.00 0.00 H new ATOM 2048 N CYS A 120 2.416 -3.750 -13.384 1.00 0.00 N ATOM 2049 CA CYS A 120 2.281 -2.277 -13.577 1.00 0.00 C ATOM 2050 C CYS A 120 3.609 -1.703 -14.101 1.00 0.00 C ATOM 2051 O CYS A 120 4.659 -2.282 -13.891 1.00 0.00 O ATOM 2052 CB CYS A 120 1.946 -1.707 -12.201 1.00 0.00 C ATOM 2053 SG CYS A 120 1.597 0.053 -12.378 1.00 0.00 S ATOM 0 H CYS A 120 2.977 -4.034 -12.581 1.00 0.00 H new ATOM 0 HA CYS A 120 1.509 -2.023 -14.303 1.00 0.00 H new ATOM 0 HB2 CYS A 120 1.084 -2.223 -11.777 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.779 -1.861 -11.515 1.00 0.00 H new ATOM 0 HG CYS A 120 2.393 0.733 -11.608 1.00 0.00 H new ATOM 2058 N ILE A 121 3.577 -0.581 -14.792 1.00 0.00 N ATOM 2059 CA ILE A 121 4.857 -0.001 -15.336 1.00 0.00 C ATOM 2060 C ILE A 121 5.718 0.608 -14.210 1.00 0.00 C ATOM 2061 O ILE A 121 6.932 0.543 -14.266 1.00 0.00 O ATOM 2062 CB ILE A 121 4.441 1.066 -16.379 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.663 1.487 -17.228 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.807 2.289 -15.694 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.668 2.329 -16.421 1.00 0.00 C ATOM 0 H ILE A 121 2.733 -0.048 -15.001 1.00 0.00 H new ATOM 0 HA ILE A 121 5.475 -0.772 -15.797 1.00 0.00 H new ATOM 0 HB ILE A 121 3.692 0.628 -17.039 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.162 0.597 -17.611 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.324 2.058 -18.092 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.524 3.023 -16.449 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.921 1.978 -15.141 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.526 2.734 -15.007 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.509 2.601 -17.059 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.178 3.234 -16.061 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.029 1.749 -15.572 1.00 0.00 H new ATOM 2077 N CYS A 122 5.119 1.212 -13.200 1.00 0.00 N ATOM 2078 CA CYS A 122 5.961 1.832 -12.109 1.00 0.00 C ATOM 2079 C CYS A 122 6.950 0.807 -11.513 1.00 0.00 C ATOM 2080 O CYS A 122 8.044 1.170 -11.122 1.00 0.00 O ATOM 2081 CB CYS A 122 4.988 2.422 -11.053 1.00 0.00 C ATOM 2082 SG CYS A 122 4.303 1.143 -9.951 1.00 0.00 S ATOM 0 H CYS A 122 4.110 1.302 -13.083 1.00 0.00 H new ATOM 0 HA CYS A 122 6.587 2.631 -12.506 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.512 3.169 -10.457 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.172 2.935 -11.561 1.00 0.00 H new ATOM 0 HG CYS A 122 5.135 0.917 -8.978 1.00 0.00 H new ATOM 2087 N ARG A 123 6.600 -0.465 -11.465 1.00 0.00 N ATOM 2088 CA ARG A 123 7.578 -1.478 -10.917 1.00 0.00 C ATOM 2089 C ARG A 123 8.884 -1.440 -11.737 1.00 0.00 C ATOM 2090 O ARG A 123 9.955 -1.662 -11.206 1.00 0.00 O ATOM 2091 CB ARG A 123 6.918 -2.860 -11.050 1.00 0.00 C ATOM 2092 CG ARG A 123 7.398 -3.766 -9.915 1.00 0.00 C ATOM 2093 CD ARG A 123 7.452 -5.215 -10.404 1.00 0.00 C ATOM 2094 NE ARG A 123 8.770 -5.340 -11.098 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.908 -5.330 -10.420 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.926 -5.206 -9.112 1.00 0.00 N ATOM 2097 NH2 ARG A 123 11.043 -5.445 -11.061 1.00 0.00 N ATOM 0 H ARG A 123 5.703 -0.840 -11.773 1.00 0.00 H new ATOM 0 HA ARG A 123 7.822 -1.262 -9.877 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.833 -2.761 -11.017 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.168 -3.303 -12.014 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.384 -3.449 -9.575 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.725 -3.684 -9.061 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.376 -5.915 -9.572 1.00 0.00 H new ATOM 0 HD3 ARG A 123 6.627 -5.434 -11.082 1.00 0.00 H new ATOM 0 HE ARG A 123 8.794 -5.435 -12.113 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.051 -5.115 -8.596 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.815 -5.201 -8.612 1.00 0.00 H new ATOM 0 HH21 ARG A 123 11.048 -5.542 -12.076 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.923 -5.438 -10.545 1.00 0.00 H new ATOM 2111 N VAL A 124 8.806 -1.156 -13.027 1.00 0.00 N ATOM 2112 CA VAL A 124 10.061 -1.103 -13.857 1.00 0.00 C ATOM 2113 C VAL A 124 10.749 0.265 -13.682 1.00 0.00 C ATOM 2114 O VAL A 124 10.131 1.287 -13.903 1.00 0.00 O ATOM 2115 CB VAL A 124 9.621 -1.285 -15.321 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.851 -1.283 -16.233 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.878 -2.616 -15.470 1.00 0.00 C ATOM 0 H VAL A 124 7.941 -0.962 -13.531 1.00 0.00 H new ATOM 0 HA VAL A 124 10.769 -1.875 -13.556 1.00 0.00 H new ATOM 0 HB VAL A 124 8.960 -0.465 -15.603 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.536 -1.412 -17.269 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.379 -0.335 -16.130 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.514 -2.101 -15.951 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.566 -2.745 -16.507 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.538 -3.435 -15.185 1.00 0.00 H new ATOM 0 HG23 VAL A 124 8.000 -2.617 -14.824 1.00 0.00 H new ATOM 2127 N PRO A 125 12.012 0.255 -13.300 1.00 0.00 N ATOM 2128 CA PRO A 125 12.752 1.533 -13.121 1.00 0.00 C ATOM 2129 C PRO A 125 12.936 2.244 -14.472 1.00 0.00 C ATOM 2130 O PRO A 125 12.517 1.744 -15.499 1.00 0.00 O ATOM 2131 CB PRO A 125 14.098 1.095 -12.542 1.00 0.00 C ATOM 2132 CG PRO A 125 14.251 -0.326 -12.976 1.00 0.00 C ATOM 2133 CD PRO A 125 12.864 -0.908 -13.003 1.00 0.00 C ATOM 0 HA PRO A 125 12.231 2.242 -12.477 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.912 1.714 -12.919 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.109 1.181 -11.455 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.717 -0.385 -13.960 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.891 -0.877 -12.287 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.768 -1.682 -13.765 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.601 -1.365 -12.049 1.00 0.00 H new ATOM 2141 N ARG A 126 13.559 3.408 -14.483 1.00 0.00 N ATOM 2142 CA ARG A 126 13.758 4.136 -15.789 1.00 0.00 C ATOM 2143 C ARG A 126 14.874 3.470 -16.613 1.00 0.00 C ATOM 2144 O ARG A 126 14.782 3.386 -17.822 1.00 0.00 O ATOM 2145 CB ARG A 126 14.147 5.584 -15.438 1.00 0.00 C ATOM 2146 CG ARG A 126 13.417 6.554 -16.372 1.00 0.00 C ATOM 2147 CD ARG A 126 14.009 6.456 -17.779 1.00 0.00 C ATOM 2148 NE ARG A 126 15.438 6.870 -17.627 1.00 0.00 N ATOM 2149 CZ ARG A 126 15.771 8.140 -17.450 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.860 9.086 -17.401 1.00 0.00 N ATOM 2151 NH2 ARG A 126 17.030 8.465 -17.318 1.00 0.00 N ATOM 0 H ARG A 126 13.933 3.879 -13.659 1.00 0.00 H new ATOM 0 HA ARG A 126 12.849 4.109 -16.389 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.890 5.799 -14.401 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.225 5.715 -15.532 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.353 6.319 -16.397 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.509 7.574 -15.998 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.931 5.442 -18.170 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.481 7.107 -18.476 1.00 0.00 H new ATOM 0 HE ARG A 126 16.170 6.161 -17.660 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.873 8.849 -17.500 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.140 10.057 -17.264 1.00 0.00 H new ATOM 0 HH21 ARG A 126 17.749 7.743 -17.352 1.00 0.00 H new ATOM 0 HH22 ARG A 126 17.293 9.441 -17.181 1.00 0.00 H new ATOM 2165 N ALA A 127 15.931 2.999 -15.977 1.00 0.00 N ATOM 2166 CA ALA A 127 17.044 2.346 -16.761 1.00 0.00 C ATOM 2167 C ALA A 127 16.496 1.158 -17.566 1.00 0.00 C ATOM 2168 O ALA A 127 16.862 0.964 -18.710 1.00 0.00 O ATOM 2169 CB ALA A 127 18.083 1.858 -15.740 1.00 0.00 C ATOM 0 H ALA A 127 16.071 3.037 -14.967 1.00 0.00 H new ATOM 0 HA ALA A 127 17.490 3.049 -17.465 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.909 1.377 -16.263 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.460 2.707 -15.170 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.618 1.143 -15.061 1.00 0.00 H new ATOM 2175 N GLN A 128 15.615 0.367 -16.987 1.00 0.00 N ATOM 2176 CA GLN A 128 15.051 -0.800 -17.756 1.00 0.00 C ATOM 2177 C GLN A 128 14.189 -0.277 -18.912 1.00 0.00 C ATOM 2178 O GLN A 128 14.248 -0.790 -20.014 1.00 0.00 O ATOM 2179 CB GLN A 128 14.190 -1.610 -16.774 1.00 0.00 C ATOM 2180 CG GLN A 128 15.073 -2.163 -15.653 1.00 0.00 C ATOM 2181 CD GLN A 128 15.678 -3.503 -16.092 1.00 0.00 C ATOM 2182 OE1 GLN A 128 16.849 -3.573 -16.409 1.00 0.00 O ATOM 2183 NE2 GLN A 128 14.931 -4.580 -16.124 1.00 0.00 N ATOM 0 H GLN A 128 15.267 0.474 -16.034 1.00 0.00 H new ATOM 0 HA GLN A 128 15.842 -1.422 -18.174 1.00 0.00 H new ATOM 0 HB2 GLN A 128 13.406 -0.979 -16.355 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.695 -2.428 -17.298 1.00 0.00 H new ATOM 0 HG2 GLN A 128 15.866 -1.454 -15.417 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.485 -2.297 -14.745 1.00 0.00 H new ATOM 0 HE21 GLN A 128 13.948 -4.527 -15.859 1.00 0.00 H new ATOM 0 HE22 GLN A 128 15.333 -5.471 -16.414 1.00 0.00 H new ATOM 2192 N LEU A 129 13.391 0.747 -18.676 1.00 0.00 N ATOM 2193 CA LEU A 129 12.536 1.296 -19.788 1.00 0.00 C ATOM 2194 C LEU A 129 13.433 1.853 -20.904 1.00 0.00 C ATOM 2195 O LEU A 129 13.146 1.677 -22.074 1.00 0.00 O ATOM 2196 CB LEU A 129 11.687 2.422 -19.178 1.00 0.00 C ATOM 2197 CG LEU A 129 10.436 1.827 -18.525 1.00 0.00 C ATOM 2198 CD1 LEU A 129 10.092 2.618 -17.261 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.266 1.899 -19.510 1.00 0.00 C ATOM 0 H LEU A 129 13.295 1.219 -17.777 1.00 0.00 H new ATOM 0 HA LEU A 129 11.902 0.522 -20.221 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.270 2.970 -18.438 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.402 3.135 -19.951 1.00 0.00 H new ATOM 0 HG LEU A 129 10.624 0.787 -18.259 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.202 2.194 -16.797 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.926 2.566 -16.561 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.903 3.659 -17.523 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.374 1.476 -19.047 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.078 2.939 -19.776 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.512 1.333 -20.409 1.00 0.00 H new ATOM 2211 N GLU A 130 14.520 2.520 -20.559 1.00 0.00 N ATOM 2212 CA GLU A 130 15.422 3.074 -21.633 1.00 0.00 C ATOM 2213 C GLU A 130 15.954 1.932 -22.513 1.00 0.00 C ATOM 2214 O GLU A 130 16.071 2.080 -23.716 1.00 0.00 O ATOM 2215 CB GLU A 130 16.588 3.776 -20.916 1.00 0.00 C ATOM 2216 CG GLU A 130 16.188 5.215 -20.583 1.00 0.00 C ATOM 2217 CD GLU A 130 17.440 6.027 -20.246 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.872 5.970 -19.107 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.946 6.695 -21.135 1.00 0.00 O ATOM 0 H GLU A 130 14.817 2.702 -19.600 1.00 0.00 H new ATOM 0 HA GLU A 130 14.884 3.770 -22.277 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.845 3.238 -20.004 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.475 3.771 -21.550 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.667 5.664 -21.429 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.497 5.226 -19.740 1.00 0.00 H new ATOM 2226 N GLU A 131 16.273 0.788 -21.932 1.00 0.00 N ATOM 2227 CA GLU A 131 16.794 -0.354 -22.770 1.00 0.00 C ATOM 2228 C GLU A 131 15.775 -0.726 -23.862 1.00 0.00 C ATOM 2229 O GLU A 131 16.151 -1.079 -24.965 1.00 0.00 O ATOM 2230 CB GLU A 131 17.005 -1.543 -21.819 1.00 0.00 C ATOM 2231 CG GLU A 131 18.349 -1.393 -21.105 1.00 0.00 C ATOM 2232 CD GLU A 131 18.848 -2.769 -20.659 1.00 0.00 C ATOM 2233 OE1 GLU A 131 18.237 -3.339 -19.770 1.00 0.00 O ATOM 2234 OE2 GLU A 131 19.832 -3.230 -21.214 1.00 0.00 O ATOM 0 H GLU A 131 16.197 0.598 -20.933 1.00 0.00 H new ATOM 0 HA GLU A 131 17.724 -0.078 -23.267 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.196 -1.587 -21.089 1.00 0.00 H new ATOM 0 HB3 GLU A 131 16.981 -2.478 -22.378 1.00 0.00 H new ATOM 0 HG2 GLU A 131 19.077 -0.929 -21.771 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.243 -0.736 -20.242 1.00 0.00 H new ATOM 2241 N GLU A 132 14.490 -0.652 -23.572 1.00 0.00 N ATOM 2242 CA GLU A 132 13.469 -1.008 -24.622 1.00 0.00 C ATOM 2243 C GLU A 132 13.575 -0.030 -25.802 1.00 0.00 C ATOM 2244 O GLU A 132 13.646 -0.443 -26.944 1.00 0.00 O ATOM 2245 CB GLU A 132 12.087 -0.892 -23.959 1.00 0.00 C ATOM 2246 CG GLU A 132 11.740 -2.211 -23.266 1.00 0.00 C ATOM 2247 CD GLU A 132 12.546 -2.336 -21.972 1.00 0.00 C ATOM 2248 OE1 GLU A 132 13.704 -2.708 -22.053 1.00 0.00 O ATOM 2249 OE2 GLU A 132 11.989 -2.059 -20.922 1.00 0.00 O ATOM 0 H GLU A 132 14.109 -0.366 -22.670 1.00 0.00 H new ATOM 0 HA GLU A 132 13.631 -2.016 -25.004 1.00 0.00 H new ATOM 0 HB2 GLU A 132 12.087 -0.078 -23.235 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.332 -0.653 -24.708 1.00 0.00 H new ATOM 0 HG2 GLU A 132 10.673 -2.249 -23.047 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.960 -3.050 -23.926 1.00 0.00 H new ATOM 2256 N ALA A 133 13.592 1.262 -25.542 1.00 0.00 N ATOM 2257 CA ALA A 133 13.701 2.247 -26.680 1.00 0.00 C ATOM 2258 C ALA A 133 15.033 2.039 -27.424 1.00 0.00 C ATOM 2259 O ALA A 133 15.085 2.125 -28.636 1.00 0.00 O ATOM 2260 CB ALA A 133 13.650 3.660 -26.070 1.00 0.00 C ATOM 0 H ALA A 133 13.536 1.673 -24.610 1.00 0.00 H new ATOM 0 HA ALA A 133 12.889 2.108 -27.393 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.726 4.402 -26.865 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.708 3.793 -25.538 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.480 3.786 -25.375 1.00 0.00 H new ATOM 2266 N ARG A 134 16.110 1.763 -26.712 1.00 0.00 N ATOM 2267 CA ARG A 134 17.431 1.548 -27.409 1.00 0.00 C ATOM 2268 C ARG A 134 17.387 0.267 -28.262 1.00 0.00 C ATOM 2269 O ARG A 134 17.975 0.216 -29.327 1.00 0.00 O ATOM 2270 CB ARG A 134 18.495 1.413 -26.309 1.00 0.00 C ATOM 2271 CG ARG A 134 19.890 1.526 -26.929 1.00 0.00 C ATOM 2272 CD ARG A 134 20.947 1.473 -25.824 1.00 0.00 C ATOM 2273 NE ARG A 134 21.196 0.016 -25.599 1.00 0.00 N ATOM 2274 CZ ARG A 134 21.880 -0.708 -26.472 1.00 0.00 C ATOM 2275 NH1 ARG A 134 22.366 -0.176 -27.571 1.00 0.00 N ATOM 2276 NH2 ARG A 134 22.078 -1.980 -26.242 1.00 0.00 N ATOM 0 H ARG A 134 16.133 1.678 -25.696 1.00 0.00 H new ATOM 0 HA ARG A 134 17.657 2.380 -28.076 1.00 0.00 H new ATOM 0 HB2 ARG A 134 18.356 2.190 -25.557 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.388 0.455 -25.801 1.00 0.00 H new ATOM 0 HG2 ARG A 134 20.050 0.715 -27.639 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.977 2.459 -27.486 1.00 0.00 H new ATOM 0 HD2 ARG A 134 21.859 1.988 -26.125 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.592 1.958 -24.915 1.00 0.00 H new ATOM 0 HE ARG A 134 20.832 -0.429 -24.757 1.00 0.00 H new ATOM 0 HH11 ARG A 134 22.220 0.814 -27.766 1.00 0.00 H new ATOM 0 HH12 ARG A 134 22.890 -0.753 -28.229 1.00 0.00 H new ATOM 0 HH21 ARG A 134 21.707 -2.409 -25.394 1.00 0.00 H new ATOM 0 HH22 ARG A 134 22.604 -2.543 -26.910 1.00 0.00 H new ATOM 2290 N LYS A 135 16.697 -0.766 -27.815 1.00 0.00 N ATOM 2291 CA LYS A 135 16.635 -2.031 -28.632 1.00 0.00 C ATOM 2292 C LYS A 135 15.485 -1.957 -29.653 1.00 0.00 C ATOM 2293 O LYS A 135 15.605 -2.466 -30.752 1.00 0.00 O ATOM 2294 CB LYS A 135 16.391 -3.176 -27.637 1.00 0.00 C ATOM 2295 CG LYS A 135 17.677 -3.457 -26.857 1.00 0.00 C ATOM 2296 CD LYS A 135 17.329 -4.093 -25.510 1.00 0.00 C ATOM 2297 CE LYS A 135 18.435 -3.786 -24.498 1.00 0.00 C ATOM 2298 NZ LYS A 135 19.652 -4.444 -25.048 1.00 0.00 N ATOM 0 H LYS A 135 16.182 -0.789 -26.935 1.00 0.00 H new ATOM 0 HA LYS A 135 17.557 -2.183 -29.193 1.00 0.00 H new ATOM 0 HB2 LYS A 135 15.587 -2.910 -26.950 1.00 0.00 H new ATOM 0 HB3 LYS A 135 16.072 -4.073 -28.169 1.00 0.00 H new ATOM 0 HG2 LYS A 135 18.324 -4.122 -27.429 1.00 0.00 H new ATOM 0 HG3 LYS A 135 18.230 -2.531 -26.702 1.00 0.00 H new ATOM 0 HD2 LYS A 135 16.375 -3.708 -25.150 1.00 0.00 H new ATOM 0 HD3 LYS A 135 17.215 -5.171 -25.624 1.00 0.00 H new ATOM 0 HE2 LYS A 135 18.582 -2.712 -24.388 1.00 0.00 H new ATOM 0 HE3 LYS A 135 18.187 -4.176 -23.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 20.348 -4.578 -24.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 19.395 -5.369 -25.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 20.064 -3.846 -25.793 1.00 0.00 H new ATOM 2312 N LYS A 136 14.377 -1.328 -29.311 1.00 0.00 N ATOM 2313 CA LYS A 136 13.238 -1.235 -30.295 1.00 0.00 C ATOM 2314 C LYS A 136 13.466 -0.103 -31.317 1.00 0.00 C ATOM 2315 O LYS A 136 12.895 -0.124 -32.392 1.00 0.00 O ATOM 2316 CB LYS A 136 11.972 -0.954 -29.470 1.00 0.00 C ATOM 2317 CG LYS A 136 11.538 -2.230 -28.746 1.00 0.00 C ATOM 2318 CD LYS A 136 10.453 -1.892 -27.722 1.00 0.00 C ATOM 2319 CE LYS A 136 9.496 -3.077 -27.581 1.00 0.00 C ATOM 2320 NZ LYS A 136 8.376 -2.781 -28.518 1.00 0.00 N ATOM 0 H LYS A 136 14.213 -0.882 -28.409 1.00 0.00 H new ATOM 0 HA LYS A 136 13.152 -2.160 -30.865 1.00 0.00 H new ATOM 0 HB2 LYS A 136 12.165 -0.161 -28.747 1.00 0.00 H new ATOM 0 HB3 LYS A 136 11.172 -0.603 -30.121 1.00 0.00 H new ATOM 0 HG2 LYS A 136 11.161 -2.958 -29.464 1.00 0.00 H new ATOM 0 HG3 LYS A 136 12.393 -2.687 -28.248 1.00 0.00 H new ATOM 0 HD2 LYS A 136 10.907 -1.661 -26.758 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.905 -1.004 -28.037 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.988 -4.015 -27.838 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.138 -3.175 -26.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.677 -3.550 -28.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.922 -1.886 -28.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.746 -2.700 -29.487 1.00 0.00 H new ATOM 2334 N GLY A 137 14.279 0.887 -31.003 1.00 0.00 N ATOM 2335 CA GLY A 137 14.510 2.001 -31.969 1.00 0.00 C ATOM 2336 C GLY A 137 13.476 3.116 -31.731 1.00 0.00 C ATOM 2337 O GLY A 137 13.063 3.784 -32.659 1.00 0.00 O ATOM 0 H GLY A 137 14.787 0.965 -30.122 1.00 0.00 H new ATOM 0 HA2 GLY A 137 15.519 2.396 -31.849 1.00 0.00 H new ATOM 0 HA3 GLY A 137 14.432 1.631 -32.991 1.00 0.00 H new ATOM 2341 N THR A 138 13.051 3.326 -30.498 1.00 0.00 N ATOM 2342 CA THR A 138 12.049 4.398 -30.220 1.00 0.00 C ATOM 2343 C THR A 138 12.466 5.189 -28.967 1.00 0.00 C ATOM 2344 O THR A 138 13.613 5.144 -28.564 1.00 0.00 O ATOM 2345 CB THR A 138 10.725 3.653 -29.992 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.702 4.595 -29.704 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.866 2.678 -28.818 1.00 0.00 C ATOM 0 H THR A 138 13.358 2.799 -29.681 1.00 0.00 H new ATOM 0 HA THR A 138 11.965 5.119 -31.033 1.00 0.00 H new ATOM 0 HB THR A 138 10.469 3.092 -30.891 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.855 4.124 -29.559 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.922 2.155 -28.664 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.651 1.954 -29.038 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.126 3.231 -27.915 1.00 0.00 H new ATOM 2355 N GLN A 139 11.554 5.910 -28.345 1.00 0.00 N ATOM 2356 CA GLN A 139 11.921 6.690 -27.125 1.00 0.00 C ATOM 2357 C GLN A 139 10.908 6.416 -26.003 1.00 0.00 C ATOM 2358 O GLN A 139 9.727 6.268 -26.257 1.00 0.00 O ATOM 2359 CB GLN A 139 11.864 8.155 -27.557 1.00 0.00 C ATOM 2360 CG GLN A 139 13.235 8.584 -28.086 1.00 0.00 C ATOM 2361 CD GLN A 139 13.137 9.993 -28.683 1.00 0.00 C ATOM 2362 OE1 GLN A 139 12.245 10.269 -29.462 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.017 10.906 -28.353 1.00 0.00 N ATOM 0 H GLN A 139 10.578 5.988 -28.632 1.00 0.00 H new ATOM 0 HA GLN A 139 12.905 6.421 -26.740 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.106 8.288 -28.329 1.00 0.00 H new ATOM 0 HB3 GLN A 139 11.575 8.783 -26.714 1.00 0.00 H new ATOM 0 HG2 GLN A 139 13.968 8.570 -27.279 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.581 7.880 -28.843 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.767 10.679 -27.700 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.952 11.844 -28.749 1.00 0.00 H new ATOM 2372 N VAL A 140 11.354 6.348 -24.765 1.00 0.00 N ATOM 2373 CA VAL A 140 10.404 6.083 -23.643 1.00 0.00 C ATOM 2374 C VAL A 140 10.600 7.116 -22.520 1.00 0.00 C ATOM 2375 O VAL A 140 11.634 7.752 -22.437 1.00 0.00 O ATOM 2376 CB VAL A 140 10.739 4.667 -23.153 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.198 4.601 -22.683 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.809 4.300 -21.991 1.00 0.00 C ATOM 0 H VAL A 140 12.329 6.465 -24.490 1.00 0.00 H new ATOM 0 HA VAL A 140 9.364 6.161 -23.959 1.00 0.00 H new ATOM 0 HB VAL A 140 10.600 3.963 -23.973 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.424 3.592 -22.338 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.859 4.858 -23.511 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.349 5.306 -21.866 1.00 0.00 H new ATOM 0 HG21 VAL A 140 10.044 3.295 -21.640 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.947 5.010 -21.176 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.773 4.333 -22.329 1.00 0.00 H new ATOM 2388 N SER A 141 9.619 7.289 -21.656 1.00 0.00 N ATOM 2389 CA SER A 141 9.768 8.285 -20.545 1.00 0.00 C ATOM 2390 C SER A 141 8.625 8.147 -19.522 1.00 0.00 C ATOM 2391 O SER A 141 7.610 8.809 -19.631 1.00 0.00 O ATOM 2392 CB SER A 141 9.708 9.645 -21.234 1.00 0.00 C ATOM 2393 OG SER A 141 9.799 10.674 -20.257 1.00 0.00 O ATOM 0 H SER A 141 8.731 6.787 -21.674 1.00 0.00 H new ATOM 0 HA SER A 141 10.695 8.140 -19.989 1.00 0.00 H new ATOM 0 HB2 SER A 141 10.523 9.737 -21.952 1.00 0.00 H new ATOM 0 HB3 SER A 141 8.777 9.741 -21.793 1.00 0.00 H new ATOM 0 HG SER A 141 9.762 11.548 -20.698 1.00 0.00 H new ATOM 2399 N PHE A 142 8.779 7.292 -18.531 1.00 0.00 N ATOM 2400 CA PHE A 142 7.694 7.121 -17.513 1.00 0.00 C ATOM 2401 C PHE A 142 8.022 7.921 -16.234 1.00 0.00 C ATOM 2402 O PHE A 142 9.162 8.256 -15.974 1.00 0.00 O ATOM 2403 CB PHE A 142 7.646 5.608 -17.222 1.00 0.00 C ATOM 2404 CG PHE A 142 6.774 5.322 -16.012 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.378 5.383 -16.104 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.377 5.007 -14.792 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.591 5.124 -14.970 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.596 4.755 -13.671 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.206 4.809 -13.751 1.00 0.00 C ATOM 0 H PHE A 142 9.605 6.711 -18.387 1.00 0.00 H new ATOM 0 HA PHE A 142 6.733 7.491 -17.871 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.256 5.078 -18.091 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.655 5.234 -17.046 1.00 0.00 H new ATOM 0 HD1 PHE A 142 4.908 5.629 -17.045 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.454 4.959 -14.720 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.514 5.168 -15.037 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.070 4.515 -12.731 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.605 4.609 -12.877 1.00 0.00 H new ATOM 2419 N HIS A 143 7.020 8.206 -15.432 1.00 0.00 N ATOM 2420 CA HIS A 143 7.247 8.958 -14.160 1.00 0.00 C ATOM 2421 C HIS A 143 6.400 8.323 -13.045 1.00 0.00 C ATOM 2422 O HIS A 143 6.922 7.846 -12.055 1.00 0.00 O ATOM 2423 CB HIS A 143 6.783 10.388 -14.450 1.00 0.00 C ATOM 2424 CG HIS A 143 7.729 11.366 -13.807 1.00 0.00 C ATOM 2425 ND1 HIS A 143 7.373 12.119 -12.700 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.021 11.724 -14.105 1.00 0.00 C ATOM 2427 CE1 HIS A 143 8.430 12.885 -12.373 1.00 0.00 C ATOM 2428 NE2 HIS A 143 9.462 12.684 -13.198 1.00 0.00 N ATOM 0 H HIS A 143 6.049 7.947 -15.608 1.00 0.00 H new ATOM 0 HA HIS A 143 8.287 8.939 -13.834 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.745 10.557 -15.526 1.00 0.00 H new ATOM 0 HB3 HIS A 143 5.773 10.538 -14.068 1.00 0.00 H new ATOM 0 HD2 HIS A 143 9.606 11.322 -14.919 1.00 0.00 H new ATOM 0 HE1 HIS A 143 8.443 13.578 -11.545 1.00 0.00 H new ATOM 0 HE2 HIS A 143 10.376 13.136 -13.169 1.00 0.00 H new ATOM 2436 N GLN A 144 5.096 8.292 -13.213 1.00 0.00 N ATOM 2437 CA GLN A 144 4.210 7.667 -12.186 1.00 0.00 C ATOM 2438 C GLN A 144 3.104 6.869 -12.896 1.00 0.00 C ATOM 2439 O GLN A 144 2.721 7.200 -14.003 1.00 0.00 O ATOM 2440 CB GLN A 144 3.618 8.836 -11.383 1.00 0.00 C ATOM 2441 CG GLN A 144 2.840 9.781 -12.307 1.00 0.00 C ATOM 2442 CD GLN A 144 2.306 10.964 -11.491 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.237 10.883 -10.921 1.00 0.00 O ATOM 2444 NE2 GLN A 144 3.005 12.070 -11.407 1.00 0.00 N ATOM 0 H GLN A 144 4.609 8.676 -14.023 1.00 0.00 H new ATOM 0 HA GLN A 144 4.744 6.978 -11.532 1.00 0.00 H new ATOM 0 HB2 GLN A 144 2.958 8.453 -10.605 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.417 9.383 -10.883 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.487 10.140 -13.107 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.015 9.248 -12.779 1.00 0.00 H new ATOM 0 HE21 GLN A 144 3.904 12.143 -11.884 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.650 12.858 -10.865 1.00 0.00 H new ATOM 2453 N CYS A 145 2.593 5.820 -12.284 1.00 0.00 N ATOM 2454 CA CYS A 145 1.518 5.024 -12.973 1.00 0.00 C ATOM 2455 C CYS A 145 0.120 5.540 -12.596 1.00 0.00 C ATOM 2456 O CYS A 145 -0.070 6.130 -11.549 1.00 0.00 O ATOM 2457 CB CYS A 145 1.706 3.549 -12.562 1.00 0.00 C ATOM 2458 SG CYS A 145 1.393 3.298 -10.788 1.00 0.00 S ATOM 0 H CYS A 145 2.865 5.486 -11.359 1.00 0.00 H new ATOM 0 HA CYS A 145 1.600 5.126 -14.055 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.031 2.921 -13.143 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.721 3.232 -12.801 1.00 0.00 H new ATOM 0 HG CYS A 145 2.325 2.544 -10.285 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.861 5.329 -13.454 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.250 5.824 -13.142 1.00 0.00 C ATOM 2465 C VAL A 146 -2.916 4.983 -12.035 1.00 0.00 C ATOM 2466 O VAL A 146 -3.781 5.474 -11.334 1.00 0.00 O ATOM 2467 CB VAL A 146 -3.062 5.741 -14.454 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -3.195 4.284 -14.918 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -4.458 6.326 -14.224 1.00 0.00 C ATOM 0 H VAL A 146 -0.762 4.842 -14.345 1.00 0.00 H new ATOM 0 HA VAL A 146 -2.210 6.847 -12.769 1.00 0.00 H new ATOM 0 HB VAL A 146 -2.539 6.308 -15.224 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.770 4.248 -15.843 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.204 3.865 -15.090 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.706 3.703 -14.150 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -5.033 6.269 -15.148 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.966 5.759 -13.444 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -4.370 7.368 -13.916 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.536 3.724 -11.862 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.183 2.885 -10.778 1.00 0.00 C ATOM 2481 C HIS A 147 -3.146 3.635 -9.431 1.00 0.00 C ATOM 2482 O HIS A 147 -4.160 3.781 -8.774 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.373 1.574 -10.681 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.449 0.790 -11.978 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.374 1.065 -12.983 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.708 -0.275 -12.442 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.162 0.186 -13.980 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.160 -0.650 -13.703 1.00 0.00 N ATOM 0 H HIS A 147 -1.821 3.249 -12.412 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.227 2.681 -11.015 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.332 1.802 -10.450 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.756 0.966 -9.861 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.898 -0.748 -11.907 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.735 0.161 -14.895 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.802 -1.403 -14.290 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.989 4.111 -9.017 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.900 4.848 -7.725 1.00 0.00 C ATOM 2498 C CYS A 148 -1.055 6.128 -7.873 1.00 0.00 C ATOM 2499 O CYS A 148 -0.699 6.517 -8.970 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.227 3.859 -6.776 1.00 0.00 C ATOM 2501 SG CYS A 148 0.473 3.495 -7.310 1.00 0.00 S ATOM 0 H CYS A 148 -1.108 4.017 -9.523 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.876 5.175 -7.366 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.215 4.270 -5.766 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.805 2.936 -6.738 1.00 0.00 H new ATOM 0 HG CYS A 148 0.526 3.482 -8.609 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.705 6.763 -6.773 1.00 0.00 N ATOM 2507 CA GLY A 149 0.143 7.987 -6.848 1.00 0.00 C ATOM 2508 C GLY A 149 1.593 7.570 -6.565 1.00 0.00 C ATOM 2509 O GLY A 149 2.195 8.014 -5.606 1.00 0.00 O ATOM 0 H GLY A 149 -0.974 6.481 -5.830 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.063 8.448 -7.833 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.190 8.728 -6.121 1.00 0.00 H new ATOM 2513 N CYS A 150 2.152 6.703 -7.385 1.00 0.00 N ATOM 2514 CA CYS A 150 3.557 6.239 -7.151 1.00 0.00 C ATOM 2515 C CYS A 150 4.518 6.983 -8.089 1.00 0.00 C ATOM 2516 O CYS A 150 4.192 7.246 -9.229 1.00 0.00 O ATOM 2517 CB CYS A 150 3.516 4.728 -7.459 1.00 0.00 C ATOM 2518 SG CYS A 150 5.174 3.995 -7.478 1.00 0.00 S ATOM 0 H CYS A 150 1.694 6.300 -8.203 1.00 0.00 H new ATOM 0 HA CYS A 150 3.911 6.433 -6.139 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.904 4.222 -6.712 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.037 4.568 -8.425 1.00 0.00 H new ATOM 0 HG CYS A 150 5.188 2.974 -8.282 1.00 0.00 H new ATOM 2523 N ARG A 151 5.708 7.309 -7.626 1.00 0.00 N ATOM 2524 CA ARG A 151 6.686 8.017 -8.514 1.00 0.00 C ATOM 2525 C ARG A 151 7.656 6.992 -9.120 1.00 0.00 C ATOM 2526 O ARG A 151 8.860 7.147 -9.038 1.00 0.00 O ATOM 2527 CB ARG A 151 7.436 9.010 -7.616 1.00 0.00 C ATOM 2528 CG ARG A 151 6.501 10.159 -7.232 1.00 0.00 C ATOM 2529 CD ARG A 151 7.287 11.219 -6.457 1.00 0.00 C ATOM 2530 NE ARG A 151 7.148 10.829 -5.021 1.00 0.00 N ATOM 2531 CZ ARG A 151 6.024 11.047 -4.354 1.00 0.00 C ATOM 2532 NH1 ARG A 151 4.987 11.616 -4.926 1.00 0.00 N ATOM 2533 NH2 ARG A 151 5.939 10.693 -3.099 1.00 0.00 N ATOM 0 H ARG A 151 6.039 7.116 -6.681 1.00 0.00 H new ATOM 0 HA ARG A 151 6.194 8.535 -9.337 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.796 8.505 -6.720 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.311 9.398 -8.137 1.00 0.00 H new ATOM 0 HG2 ARG A 151 6.061 10.599 -8.127 1.00 0.00 H new ATOM 0 HG3 ARG A 151 5.678 9.784 -6.624 1.00 0.00 H new ATOM 0 HD2 ARG A 151 8.333 11.236 -6.762 1.00 0.00 H new ATOM 0 HD3 ARG A 151 6.886 12.217 -6.636 1.00 0.00 H new ATOM 0 HE ARG A 151 7.934 10.386 -4.545 1.00 0.00 H new ATOM 0 HH11 ARG A 151 5.036 11.900 -5.904 1.00 0.00 H new ATOM 0 HH12 ARG A 151 4.132 11.773 -4.392 1.00 0.00 H new ATOM 0 HH21 ARG A 151 6.735 10.252 -2.639 1.00 0.00 H new ATOM 0 HH22 ARG A 151 5.077 10.858 -2.580 1.00 0.00 H new ATOM 2547 N GLY A 152 7.139 5.941 -9.724 1.00 0.00 N ATOM 2548 CA GLY A 152 8.025 4.909 -10.326 1.00 0.00 C ATOM 2549 C GLY A 152 8.806 4.186 -9.219 1.00 0.00 C ATOM 2550 O GLY A 152 9.833 4.661 -8.771 1.00 0.00 O ATOM 0 H GLY A 152 6.140 5.762 -9.821 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.431 4.192 -10.893 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.717 5.375 -11.028 1.00 0.00 H new ATOM 2554 N CYS A 153 8.335 3.036 -8.776 1.00 0.00 N ATOM 2555 CA CYS A 153 9.068 2.292 -7.702 1.00 0.00 C ATOM 2556 C CYS A 153 9.774 1.057 -8.295 1.00 0.00 C ATOM 2557 O CYS A 153 9.160 0.232 -8.942 1.00 0.00 O ATOM 2558 CB CYS A 153 8.009 1.905 -6.644 1.00 0.00 C ATOM 2559 SG CYS A 153 6.825 0.683 -7.287 1.00 0.00 S ATOM 0 H CYS A 153 7.482 2.588 -9.111 1.00 0.00 H new ATOM 0 HA CYS A 153 9.851 2.898 -7.246 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.507 1.500 -5.763 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.472 2.798 -6.324 1.00 0.00 H new ATOM 0 HG CYS A 153 7.376 0.013 -8.255 1.00 0.00 H new ATOM 2564 N ALA A 154 11.069 0.935 -8.087 1.00 0.00 N ATOM 2565 CA ALA A 154 11.812 -0.237 -8.644 1.00 0.00 C ATOM 2566 C ALA A 154 12.991 -0.599 -7.730 1.00 0.00 C ATOM 2567 O ALA A 154 13.535 0.256 -7.054 1.00 0.00 O ATOM 2568 CB ALA A 154 12.314 0.230 -10.009 1.00 0.00 C ATOM 0 H ALA A 154 11.637 1.596 -7.557 1.00 0.00 H new ATOM 0 HA ALA A 154 11.187 -1.127 -8.721 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.872 -0.575 -10.486 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.465 0.503 -10.635 1.00 0.00 H new ATOM 0 HB3 ALA A 154 12.964 1.096 -9.881 1.00 0.00 H new ATOM 2574 N SER A 155 13.390 -1.851 -7.699 1.00 0.00 N ATOM 2575 CA SER A 155 14.538 -2.241 -6.815 1.00 0.00 C ATOM 2576 C SER A 155 15.847 -2.285 -7.621 1.00 0.00 C ATOM 2577 O SER A 155 16.882 -1.856 -7.143 1.00 0.00 O ATOM 2578 CB SER A 155 14.200 -3.631 -6.268 1.00 0.00 C ATOM 2579 OG SER A 155 12.842 -3.651 -5.838 1.00 0.00 O ATOM 0 H SER A 155 12.977 -2.611 -8.240 1.00 0.00 H new ATOM 0 HA SER A 155 14.681 -1.521 -6.010 1.00 0.00 H new ATOM 0 HB2 SER A 155 14.361 -4.386 -7.037 1.00 0.00 H new ATOM 0 HB3 SER A 155 14.860 -3.878 -5.437 1.00 0.00 H new ATOM 0 HG SER A 155 12.478 -4.555 -5.945 1.00 0.00 H new