USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 592 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 422 CYS SG : rot -154:sc= 0.325 USER MOD Set 1.2: A 425 CYS SG : rot -121:sc= 0.317 USER MOD Set 1.3: A 438 HIS : no HE2:sc= -3.16! C(o=-3.5!,f=-4.5!) USER MOD Set 1.4: A 443 HIS : no HE2:sc= -0.992 K(o=-3.5,f=-5.1) USER MOD Set 2.1: A 392 CYS SG : rot -150:sc= -0.347 USER MOD Set 2.2: A 395 CYS SG : rot 142:sc= 0.482 USER MOD Set 2.3: A 408 HIS : no HE2:sc= 1.03 K(o=2.1,f=-2.6) USER MOD Set 2.4: A 412 HIS : no HD1:sc= 0.915 K(o=2.1,f=-6.1!) USER MOD Set 3.1: A 364 CYS SG : rot -152:sc= -1.34 USER MOD Set 3.2: A 367 CYS SG : rot -131:sc= -0.277 USER MOD Set 3.3: A 380 HIS : no HE2:sc= 0.149 K(o=-1.5,f=-2.3) USER MOD Single : A 369 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0134) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 381 LYS NZ :NH3+ 153:sc= 0.0369 (180deg=0) USER MOD Single : A 388 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 390 TYR OH : rot 180:sc= 0 USER MOD Single : A 391 SER OG : rot 73:sc=-0.00416 USER MOD Single : A 400 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.569) USER MOD Single : A 402 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 MET CE :methyl -130:sc= -1.83 (180deg=-3.61!) USER MOD Single : A 406 SER OG : rot 180:sc= 0 USER MOD Single : A 407 TYR OH : rot 180:sc= 0 USER MOD Single : A 411 SER OG : rot 180:sc= 0 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 420 TYR OH : rot 180:sc= 0 USER MOD Single : A 423 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 427 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 SER OG : rot -81:sc= 0.159 USER MOD Single : A 434 HIS : no HD1:sc= -0.346 X(o=-0.35,f=-0.029) USER MOD Single : A 436 ASN : amide:sc= -0.187 X(o=-0.19,f=-0.0064) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 GLN : amide:sc= 0 X(o=0,f=-0.08) USER MOD ----------------------------------------------------------------- ATOM 66 N VAL A 362 -12.637 -21.390 -19.329 1.00 0.00 N ATOM 67 CA VAL A 362 -11.430 -20.779 -18.785 1.00 0.00 C ATOM 68 C VAL A 362 -11.762 -19.827 -17.642 1.00 0.00 C ATOM 69 O VAL A 362 -12.611 -18.947 -17.781 1.00 0.00 O ATOM 70 CB VAL A 362 -10.653 -20.009 -19.870 1.00 0.00 C ATOM 71 CG1 VAL A 362 -9.309 -19.540 -19.333 1.00 0.00 C ATOM 72 CG2 VAL A 362 -10.469 -20.874 -21.108 1.00 0.00 C ATOM 0 HA VAL A 362 -10.807 -21.590 -18.408 1.00 0.00 H new ATOM 0 HB VAL A 362 -11.232 -19.129 -20.152 1.00 0.00 H new ATOM 0 HG11 VAL A 362 -8.774 -18.998 -20.113 1.00 0.00 H new ATOM 0 HG12 VAL A 362 -9.468 -18.882 -18.478 1.00 0.00 H new ATOM 0 HG13 VAL A 362 -8.720 -20.403 -19.022 1.00 0.00 H new ATOM 0 HG21 VAL A 362 -9.918 -20.315 -21.864 1.00 0.00 H new ATOM 0 HG22 VAL A 362 -9.912 -21.773 -20.844 1.00 0.00 H new ATOM 0 HG23 VAL A 362 -11.445 -21.155 -21.504 1.00 0.00 H new ATOM 82 N ALA A 363 -11.087 -20.009 -16.512 1.00 0.00 N ATOM 83 CA ALA A 363 -11.309 -19.164 -15.345 1.00 0.00 C ATOM 84 C ALA A 363 -10.258 -18.064 -15.255 1.00 0.00 C ATOM 85 O ALA A 363 -9.068 -18.339 -15.094 1.00 0.00 O ATOM 86 CB ALA A 363 -11.305 -20.005 -14.077 1.00 0.00 C ATOM 0 H ALA A 363 -10.382 -20.734 -16.380 1.00 0.00 H new ATOM 0 HA ALA A 363 -12.285 -18.690 -15.451 1.00 0.00 H new ATOM 0 HB1 ALA A 363 -11.472 -19.362 -13.213 1.00 0.00 H new ATOM 0 HB2 ALA A 363 -12.098 -20.751 -14.133 1.00 0.00 H new ATOM 0 HB3 ALA A 363 -10.342 -20.506 -13.976 1.00 0.00 H new ATOM 92 N CYS A 364 -10.703 -16.816 -15.362 1.00 0.00 N ATOM 93 CA CYS A 364 -9.801 -15.673 -15.294 1.00 0.00 C ATOM 94 C CYS A 364 -9.023 -15.671 -13.981 1.00 0.00 C ATOM 95 O CYS A 364 -9.594 -15.875 -12.911 1.00 0.00 O ATOM 96 CB CYS A 364 -10.586 -14.368 -15.436 1.00 0.00 C ATOM 97 SG CYS A 364 -9.594 -12.965 -16.041 1.00 0.00 S ATOM 0 H CYS A 364 -11.684 -16.571 -15.496 1.00 0.00 H new ATOM 0 HA CYS A 364 -9.091 -15.753 -16.117 1.00 0.00 H new ATOM 0 HB2 CYS A 364 -11.420 -14.531 -16.119 1.00 0.00 H new ATOM 0 HB3 CYS A 364 -11.013 -14.106 -14.468 1.00 0.00 H new ATOM 0 HG CYS A 364 -10.096 -11.853 -15.593 1.00 0.00 H new ATOM 102 N GLU A 365 -7.717 -15.438 -14.074 1.00 0.00 N ATOM 103 CA GLU A 365 -6.862 -15.410 -12.894 1.00 0.00 C ATOM 104 C GLU A 365 -6.662 -13.980 -12.400 1.00 0.00 C ATOM 105 O GLU A 365 -5.646 -13.662 -11.782 1.00 0.00 O ATOM 106 CB GLU A 365 -5.506 -16.048 -13.204 1.00 0.00 C ATOM 107 CG GLU A 365 -4.663 -15.242 -14.179 1.00 0.00 C ATOM 108 CD GLU A 365 -4.384 -15.992 -15.467 1.00 0.00 C ATOM 109 OE1 GLU A 365 -3.427 -16.794 -15.490 1.00 0.00 O ATOM 110 OE2 GLU A 365 -5.122 -15.778 -16.451 1.00 0.00 O ATOM 0 H GLU A 365 -7.229 -15.266 -14.953 1.00 0.00 H new ATOM 0 HA GLU A 365 -7.354 -15.982 -12.107 1.00 0.00 H new ATOM 0 HB2 GLU A 365 -4.951 -16.173 -12.274 1.00 0.00 H new ATOM 0 HB3 GLU A 365 -5.668 -17.045 -13.614 1.00 0.00 H new ATOM 0 HG2 GLU A 365 -5.175 -14.308 -14.410 1.00 0.00 H new ATOM 0 HG3 GLU A 365 -3.718 -14.978 -13.704 1.00 0.00 H new ATOM 117 N ILE A 366 -7.639 -13.124 -12.677 1.00 0.00 N ATOM 118 CA ILE A 366 -7.572 -11.728 -12.261 1.00 0.00 C ATOM 119 C ILE A 366 -8.846 -11.309 -11.536 1.00 0.00 C ATOM 120 O ILE A 366 -8.799 -10.578 -10.546 1.00 0.00 O ATOM 121 CB ILE A 366 -7.347 -10.792 -13.463 1.00 0.00 C ATOM 122 CG1 ILE A 366 -6.103 -11.220 -14.244 1.00 0.00 C ATOM 123 CG2 ILE A 366 -7.216 -9.351 -12.995 1.00 0.00 C ATOM 124 CD1 ILE A 366 -6.374 -11.500 -15.706 1.00 0.00 C ATOM 0 H ILE A 366 -8.486 -13.372 -13.188 1.00 0.00 H new ATOM 0 HA ILE A 366 -6.725 -11.642 -11.581 1.00 0.00 H new ATOM 0 HB ILE A 366 -8.210 -10.861 -14.125 1.00 0.00 H new ATOM 0 HG12 ILE A 366 -5.348 -10.438 -14.166 1.00 0.00 H new ATOM 0 HG13 ILE A 366 -5.684 -12.114 -13.783 1.00 0.00 H new ATOM 0 HG21 ILE A 366 -7.057 -8.702 -13.856 1.00 0.00 H new ATOM 0 HG22 ILE A 366 -8.128 -9.052 -12.478 1.00 0.00 H new ATOM 0 HG23 ILE A 366 -6.369 -9.265 -12.315 1.00 0.00 H new ATOM 0 HD11 ILE A 366 -5.448 -11.798 -16.197 1.00 0.00 H new ATOM 0 HD12 ILE A 366 -7.106 -12.303 -15.793 1.00 0.00 H new ATOM 0 HD13 ILE A 366 -6.764 -10.601 -16.182 1.00 0.00 H new ATOM 136 N CYS A 367 -9.985 -11.778 -12.034 1.00 0.00 N ATOM 137 CA CYS A 367 -11.274 -11.453 -11.434 1.00 0.00 C ATOM 138 C CYS A 367 -11.987 -12.716 -10.960 1.00 0.00 C ATOM 139 O CYS A 367 -12.596 -12.734 -9.891 1.00 0.00 O ATOM 140 CB CYS A 367 -12.153 -10.704 -12.438 1.00 0.00 C ATOM 141 SG CYS A 367 -12.269 -11.507 -14.069 1.00 0.00 S ATOM 0 H CYS A 367 -10.042 -12.385 -12.852 1.00 0.00 H new ATOM 0 HA CYS A 367 -11.094 -10.813 -10.570 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -13.156 -10.603 -12.022 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -11.759 -9.696 -12.568 1.00 0.00 H new ATOM 0 HG CYS A 367 -12.039 -10.631 -15.001 1.00 0.00 H new ATOM 146 N GLY A 368 -11.905 -13.772 -11.764 1.00 0.00 N ATOM 147 CA GLY A 368 -12.547 -15.025 -11.410 1.00 0.00 C ATOM 148 C GLY A 368 -13.756 -15.322 -12.274 1.00 0.00 C ATOM 149 O GLY A 368 -14.669 -16.034 -11.855 1.00 0.00 O ATOM 0 H GLY A 368 -11.406 -13.782 -12.653 1.00 0.00 H new ATOM 0 HA2 GLY A 368 -11.827 -15.838 -11.506 1.00 0.00 H new ATOM 0 HA3 GLY A 368 -12.852 -14.991 -10.364 1.00 0.00 H new ATOM 153 N LYS A 369 -13.765 -14.774 -13.485 1.00 0.00 N ATOM 154 CA LYS A 369 -14.871 -14.983 -14.412 1.00 0.00 C ATOM 155 C LYS A 369 -14.600 -16.177 -15.322 1.00 0.00 C ATOM 156 O LYS A 369 -13.474 -16.378 -15.778 1.00 0.00 O ATOM 157 CB LYS A 369 -15.101 -13.727 -15.255 1.00 0.00 C ATOM 158 CG LYS A 369 -16.150 -12.792 -14.679 1.00 0.00 C ATOM 159 CD LYS A 369 -15.763 -12.305 -13.292 1.00 0.00 C ATOM 160 CE LYS A 369 -16.617 -12.955 -12.215 1.00 0.00 C ATOM 161 NZ LYS A 369 -18.006 -12.420 -12.210 1.00 0.00 N ATOM 0 H LYS A 369 -13.018 -14.181 -13.847 1.00 0.00 H new ATOM 0 HA LYS A 369 -15.768 -15.190 -13.828 1.00 0.00 H new ATOM 0 HB2 LYS A 369 -14.159 -13.187 -15.352 1.00 0.00 H new ATOM 0 HB3 LYS A 369 -15.403 -14.024 -16.259 1.00 0.00 H new ATOM 0 HG2 LYS A 369 -16.280 -11.937 -15.342 1.00 0.00 H new ATOM 0 HG3 LYS A 369 -17.110 -13.307 -14.630 1.00 0.00 H new ATOM 0 HD2 LYS A 369 -14.712 -12.527 -13.107 1.00 0.00 H new ATOM 0 HD3 LYS A 369 -15.874 -11.222 -13.241 1.00 0.00 H new ATOM 0 HE2 LYS A 369 -16.644 -14.033 -12.374 1.00 0.00 H new ATOM 0 HE3 LYS A 369 -16.160 -12.788 -11.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 369 -18.511 -12.772 -11.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 369 -17.978 -11.381 -12.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 369 -18.502 -12.733 -13.069 1.00 0.00 H new ATOM 175 N ILE A 370 -15.638 -16.963 -15.583 1.00 0.00 N ATOM 176 CA ILE A 370 -15.511 -18.135 -16.442 1.00 0.00 C ATOM 177 C ILE A 370 -15.896 -17.807 -17.880 1.00 0.00 C ATOM 178 O ILE A 370 -16.810 -17.019 -18.125 1.00 0.00 O ATOM 179 CB ILE A 370 -16.387 -19.298 -15.940 1.00 0.00 C ATOM 180 CG1 ILE A 370 -16.135 -19.550 -14.452 1.00 0.00 C ATOM 181 CG2 ILE A 370 -16.113 -20.556 -16.751 1.00 0.00 C ATOM 182 CD1 ILE A 370 -14.723 -19.999 -14.147 1.00 0.00 C ATOM 0 H ILE A 370 -16.576 -16.811 -15.213 1.00 0.00 H new ATOM 0 HA ILE A 370 -14.465 -18.439 -16.409 1.00 0.00 H new ATOM 0 HB ILE A 370 -17.435 -19.027 -16.070 1.00 0.00 H new ATOM 0 HG12 ILE A 370 -16.345 -18.636 -13.896 1.00 0.00 H new ATOM 0 HG13 ILE A 370 -16.834 -20.307 -14.096 1.00 0.00 H new ATOM 0 HG21 ILE A 370 -16.740 -21.369 -16.384 1.00 0.00 H new ATOM 0 HG22 ILE A 370 -16.339 -20.369 -17.801 1.00 0.00 H new ATOM 0 HG23 ILE A 370 -15.064 -20.833 -16.650 1.00 0.00 H new ATOM 0 HD11 ILE A 370 -14.616 -20.159 -13.074 1.00 0.00 H new ATOM 0 HD12 ILE A 370 -14.515 -20.930 -14.675 1.00 0.00 H new ATOM 0 HD13 ILE A 370 -14.019 -19.232 -14.472 1.00 0.00 H new ATOM 194 N PHE A 371 -15.194 -18.417 -18.829 1.00 0.00 N ATOM 195 CA PHE A 371 -15.462 -18.191 -20.244 1.00 0.00 C ATOM 196 C PHE A 371 -15.689 -19.512 -20.973 1.00 0.00 C ATOM 197 O PHE A 371 -14.999 -20.500 -20.719 1.00 0.00 O ATOM 198 CB PHE A 371 -14.301 -17.432 -20.890 1.00 0.00 C ATOM 199 CG PHE A 371 -14.101 -16.053 -20.330 1.00 0.00 C ATOM 200 CD1 PHE A 371 -13.473 -15.871 -19.108 1.00 0.00 C ATOM 201 CD2 PHE A 371 -14.542 -14.938 -21.025 1.00 0.00 C ATOM 202 CE1 PHE A 371 -13.287 -14.603 -18.590 1.00 0.00 C ATOM 203 CE2 PHE A 371 -14.358 -13.668 -20.512 1.00 0.00 C ATOM 204 CZ PHE A 371 -13.731 -13.500 -19.293 1.00 0.00 C ATOM 0 H PHE A 371 -14.435 -19.072 -18.643 1.00 0.00 H new ATOM 0 HA PHE A 371 -16.369 -17.592 -20.325 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -13.384 -18.006 -20.757 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -14.478 -17.358 -21.963 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -13.125 -16.730 -18.554 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -15.035 -15.063 -21.978 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -12.795 -14.475 -17.637 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -14.704 -12.807 -21.064 1.00 0.00 H new ATOM 0 HZ PHE A 371 -13.588 -12.508 -18.890 1.00 0.00 H new ATOM 214 N ARG A 372 -16.661 -19.522 -21.879 1.00 0.00 N ATOM 215 CA ARG A 372 -16.980 -20.722 -22.644 1.00 0.00 C ATOM 216 C ARG A 372 -15.868 -21.046 -23.637 1.00 0.00 C ATOM 217 O ARG A 372 -15.682 -22.201 -24.021 1.00 0.00 O ATOM 218 CB ARG A 372 -18.305 -20.541 -23.387 1.00 0.00 C ATOM 219 CG ARG A 372 -18.240 -19.515 -24.507 1.00 0.00 C ATOM 220 CD ARG A 372 -19.407 -18.543 -24.441 1.00 0.00 C ATOM 221 NE ARG A 372 -20.687 -19.208 -24.674 1.00 0.00 N ATOM 222 CZ ARG A 372 -21.847 -18.564 -24.744 1.00 0.00 C ATOM 223 NH1 ARG A 372 -21.888 -17.247 -24.601 1.00 0.00 N ATOM 224 NH2 ARG A 372 -22.969 -19.239 -24.959 1.00 0.00 N ATOM 0 H ARG A 372 -17.241 -18.713 -22.101 1.00 0.00 H new ATOM 0 HA ARG A 372 -17.073 -21.554 -21.946 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -18.613 -21.501 -23.802 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -19.073 -20.241 -22.675 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -17.302 -18.964 -24.443 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -18.244 -20.025 -25.470 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -19.422 -18.060 -23.464 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -19.266 -17.757 -25.183 1.00 0.00 H new ATOM 0 HE ARG A 372 -20.690 -20.221 -24.789 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -21.027 -16.725 -24.437 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -22.780 -16.756 -24.655 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -22.941 -20.252 -25.071 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -23.859 -18.744 -25.013 1.00 0.00 H new ATOM 238 N ASP A 373 -15.132 -20.020 -24.048 1.00 0.00 N ATOM 239 CA ASP A 373 -14.037 -20.195 -24.996 1.00 0.00 C ATOM 240 C ASP A 373 -12.841 -19.331 -24.610 1.00 0.00 C ATOM 241 O ASP A 373 -12.949 -18.445 -23.763 1.00 0.00 O ATOM 242 CB ASP A 373 -14.499 -19.845 -26.411 1.00 0.00 C ATOM 243 CG ASP A 373 -14.431 -21.032 -27.352 1.00 0.00 C ATOM 244 OD1 ASP A 373 -15.394 -21.827 -27.376 1.00 0.00 O ATOM 245 OD2 ASP A 373 -13.415 -21.165 -28.066 1.00 0.00 O ATOM 0 H ASP A 373 -15.273 -19.058 -23.740 1.00 0.00 H new ATOM 0 HA ASP A 373 -13.730 -21.241 -24.970 1.00 0.00 H new ATOM 0 HB2 ASP A 373 -15.523 -19.472 -26.374 1.00 0.00 H new ATOM 0 HB3 ASP A 373 -13.880 -19.038 -26.803 1.00 0.00 H new ATOM 250 N VAL A 374 -11.699 -19.597 -25.236 1.00 0.00 N ATOM 251 CA VAL A 374 -10.481 -18.845 -24.959 1.00 0.00 C ATOM 252 C VAL A 374 -10.435 -17.555 -25.770 1.00 0.00 C ATOM 253 O VAL A 374 -9.987 -16.518 -25.282 1.00 0.00 O ATOM 254 CB VAL A 374 -9.223 -19.678 -25.268 1.00 0.00 C ATOM 255 CG1 VAL A 374 -7.972 -18.949 -24.803 1.00 0.00 C ATOM 256 CG2 VAL A 374 -9.322 -21.051 -24.621 1.00 0.00 C ATOM 0 H VAL A 374 -11.592 -20.328 -25.939 1.00 0.00 H new ATOM 0 HA VAL A 374 -10.494 -18.603 -23.896 1.00 0.00 H new ATOM 0 HB VAL A 374 -9.154 -19.814 -26.347 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -7.093 -19.553 -25.030 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -7.897 -17.991 -25.318 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -8.028 -18.780 -23.728 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -8.425 -21.626 -24.849 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -9.416 -20.938 -23.541 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -10.197 -21.574 -25.008 1.00 0.00 H new ATOM 266 N TYR A 375 -10.902 -17.627 -27.012 1.00 0.00 N ATOM 267 CA TYR A 375 -10.913 -16.465 -27.893 1.00 0.00 C ATOM 268 C TYR A 375 -11.640 -15.293 -27.240 1.00 0.00 C ATOM 269 O TYR A 375 -11.344 -14.131 -27.519 1.00 0.00 O ATOM 270 CB TYR A 375 -11.578 -16.815 -29.225 1.00 0.00 C ATOM 271 CG TYR A 375 -10.603 -17.268 -30.288 1.00 0.00 C ATOM 272 CD1 TYR A 375 -9.659 -18.252 -30.018 1.00 0.00 C ATOM 273 CD2 TYR A 375 -10.626 -16.713 -31.561 1.00 0.00 C ATOM 274 CE1 TYR A 375 -8.766 -18.668 -30.986 1.00 0.00 C ATOM 275 CE2 TYR A 375 -9.737 -17.124 -32.535 1.00 0.00 C ATOM 276 CZ TYR A 375 -8.809 -18.102 -32.243 1.00 0.00 C ATOM 277 OH TYR A 375 -7.922 -18.514 -33.211 1.00 0.00 O ATOM 0 H TYR A 375 -11.278 -18.478 -27.431 1.00 0.00 H new ATOM 0 HA TYR A 375 -9.880 -16.170 -28.077 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -12.313 -17.603 -29.059 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -12.122 -15.944 -29.590 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -9.623 -18.698 -29.035 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -11.351 -15.947 -31.793 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -8.038 -19.433 -30.760 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -9.768 -16.682 -33.520 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.087 -18.017 -34.039 1.00 0.00 H new ATOM 287 N HIS A 376 -12.594 -15.608 -26.370 1.00 0.00 N ATOM 288 CA HIS A 376 -13.365 -14.582 -25.675 1.00 0.00 C ATOM 289 C HIS A 376 -12.562 -13.988 -24.522 1.00 0.00 C ATOM 290 O HIS A 376 -12.544 -12.772 -24.326 1.00 0.00 O ATOM 291 CB HIS A 376 -14.677 -15.167 -25.151 1.00 0.00 C ATOM 292 CG HIS A 376 -15.895 -14.503 -25.715 1.00 0.00 C ATOM 293 ND1 HIS A 376 -16.259 -13.210 -25.406 1.00 0.00 N ATOM 294 CD2 HIS A 376 -16.835 -14.961 -26.575 1.00 0.00 C ATOM 295 CE1 HIS A 376 -17.370 -12.901 -26.049 1.00 0.00 C ATOM 296 NE2 HIS A 376 -17.741 -13.947 -26.766 1.00 0.00 N ATOM 0 H HIS A 376 -12.852 -16.565 -26.129 1.00 0.00 H new ATOM 0 HA HIS A 376 -13.590 -13.787 -26.386 1.00 0.00 H new ATOM 0 HB2 HIS A 376 -14.711 -16.231 -25.387 1.00 0.00 H new ATOM 0 HB3 HIS A 376 -14.696 -15.080 -24.065 1.00 0.00 H new ATOM 0 HD2 HIS A 376 -16.866 -15.941 -27.027 1.00 0.00 H new ATOM 0 HE1 HIS A 376 -17.887 -11.954 -25.998 1.00 0.00 H new ATOM 0 HE2 HIS A 376 -18.566 -13.994 -27.364 1.00 0.00 H new ATOM 304 N LEU A 377 -11.901 -14.853 -23.760 1.00 0.00 N ATOM 305 CA LEU A 377 -11.097 -14.414 -22.625 1.00 0.00 C ATOM 306 C LEU A 377 -10.058 -13.385 -23.059 1.00 0.00 C ATOM 307 O LEU A 377 -9.696 -12.493 -22.293 1.00 0.00 O ATOM 308 CB LEU A 377 -10.404 -15.611 -21.973 1.00 0.00 C ATOM 309 CG LEU A 377 -9.420 -15.286 -20.847 1.00 0.00 C ATOM 310 CD1 LEU A 377 -10.168 -14.897 -19.582 1.00 0.00 C ATOM 311 CD2 LEU A 377 -8.501 -16.470 -20.584 1.00 0.00 C ATOM 0 H LEU A 377 -11.906 -15.862 -23.908 1.00 0.00 H new ATOM 0 HA LEU A 377 -11.762 -13.947 -21.899 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -11.170 -16.278 -21.578 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -9.870 -16.162 -22.747 1.00 0.00 H new ATOM 0 HG LEU A 377 -8.808 -14.439 -21.157 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -9.453 -14.669 -18.792 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -10.783 -14.019 -19.779 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -10.805 -15.723 -19.267 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.808 -16.221 -19.780 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -9.097 -17.336 -20.294 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -7.939 -16.702 -21.489 1.00 0.00 H new ATOM 323 N ASN A 378 -9.584 -13.514 -24.294 1.00 0.00 N ATOM 324 CA ASN A 378 -8.588 -12.594 -24.831 1.00 0.00 C ATOM 325 C ASN A 378 -9.102 -11.157 -24.800 1.00 0.00 C ATOM 326 O ASN A 378 -8.480 -10.277 -24.205 1.00 0.00 O ATOM 327 CB ASN A 378 -8.222 -12.985 -26.264 1.00 0.00 C ATOM 328 CG ASN A 378 -6.722 -13.074 -26.473 1.00 0.00 C ATOM 329 OD1 ASN A 378 -6.063 -13.970 -25.946 1.00 0.00 O ATOM 330 ND2 ASN A 378 -6.177 -12.142 -27.246 1.00 0.00 N ATOM 0 H ASN A 378 -9.874 -14.247 -24.942 1.00 0.00 H new ATOM 0 HA ASN A 378 -7.698 -12.657 -24.206 1.00 0.00 H new ATOM 0 HB2 ASN A 378 -8.677 -13.946 -26.503 1.00 0.00 H new ATOM 0 HB3 ASN A 378 -8.640 -12.253 -26.956 1.00 0.00 H new ATOM 0 HD21 ASN A 378 -5.173 -12.150 -27.424 1.00 0.00 H new ATOM 0 HD22 ASN A 378 -6.763 -11.418 -27.662 1.00 0.00 H new ATOM 337 N ARG A 379 -10.242 -10.928 -25.444 1.00 0.00 N ATOM 338 CA ARG A 379 -10.839 -9.599 -25.491 1.00 0.00 C ATOM 339 C ARG A 379 -11.031 -9.039 -24.084 1.00 0.00 C ATOM 340 O ARG A 379 -10.985 -7.826 -23.876 1.00 0.00 O ATOM 341 CB ARG A 379 -12.184 -9.647 -26.219 1.00 0.00 C ATOM 342 CG ARG A 379 -12.111 -10.300 -27.590 1.00 0.00 C ATOM 343 CD ARG A 379 -13.403 -10.108 -28.368 1.00 0.00 C ATOM 344 NE ARG A 379 -13.373 -10.793 -29.657 1.00 0.00 N ATOM 345 CZ ARG A 379 -12.723 -10.331 -30.720 1.00 0.00 C ATOM 346 NH1 ARG A 379 -12.053 -9.189 -30.647 1.00 0.00 N ATOM 347 NH2 ARG A 379 -12.742 -11.012 -31.859 1.00 0.00 N ATOM 0 H ARG A 379 -10.770 -11.646 -25.940 1.00 0.00 H new ATOM 0 HA ARG A 379 -10.161 -8.942 -26.036 1.00 0.00 H new ATOM 0 HB2 ARG A 379 -12.901 -10.191 -25.604 1.00 0.00 H new ATOM 0 HB3 ARG A 379 -12.564 -8.632 -26.329 1.00 0.00 H new ATOM 0 HG2 ARG A 379 -11.280 -9.875 -28.153 1.00 0.00 H new ATOM 0 HG3 ARG A 379 -11.908 -11.365 -27.477 1.00 0.00 H new ATOM 0 HD2 ARG A 379 -14.240 -10.482 -27.778 1.00 0.00 H new ATOM 0 HD3 ARG A 379 -13.575 -9.044 -28.527 1.00 0.00 H new ATOM 0 HE ARG A 379 -13.879 -11.674 -29.746 1.00 0.00 H new ATOM 0 HH11 ARG A 379 -12.036 -8.663 -29.773 1.00 0.00 H new ATOM 0 HH12 ARG A 379 -11.555 -8.837 -31.464 1.00 0.00 H new ATOM 0 HH21 ARG A 379 -13.256 -11.891 -31.919 1.00 0.00 H new ATOM 0 HH22 ARG A 379 -12.243 -10.656 -32.674 1.00 0.00 H new ATOM 361 N HIS A 380 -11.246 -9.931 -23.122 1.00 0.00 N ATOM 362 CA HIS A 380 -11.444 -9.526 -21.735 1.00 0.00 C ATOM 363 C HIS A 380 -10.123 -9.107 -21.097 1.00 0.00 C ATOM 364 O HIS A 380 -10.029 -8.050 -20.473 1.00 0.00 O ATOM 365 CB HIS A 380 -12.072 -10.666 -20.933 1.00 0.00 C ATOM 366 CG HIS A 380 -12.141 -10.397 -19.461 1.00 0.00 C ATOM 367 ND1 HIS A 380 -13.056 -9.534 -18.896 1.00 0.00 N ATOM 368 CD2 HIS A 380 -11.402 -10.883 -18.437 1.00 0.00 C ATOM 369 CE1 HIS A 380 -12.876 -9.501 -17.588 1.00 0.00 C ATOM 370 NE2 HIS A 380 -11.878 -10.311 -17.283 1.00 0.00 N ATOM 0 H HIS A 380 -11.287 -10.938 -23.277 1.00 0.00 H new ATOM 0 HA HIS A 380 -12.119 -8.670 -21.726 1.00 0.00 H new ATOM 0 HB2 HIS A 380 -13.079 -10.851 -21.308 1.00 0.00 H new ATOM 0 HB3 HIS A 380 -11.497 -11.577 -21.101 1.00 0.00 H new ATOM 0 HD1 HIS A 380 -13.761 -9.004 -19.408 1.00 0.00 H new ATOM 0 HD2 HIS A 380 -10.589 -11.590 -18.513 1.00 0.00 H new ATOM 0 HE1 HIS A 380 -13.448 -8.912 -16.887 1.00 0.00 H new ATOM 378 N LYS A 381 -9.103 -9.945 -21.256 1.00 0.00 N ATOM 379 CA LYS A 381 -7.786 -9.663 -20.697 1.00 0.00 C ATOM 380 C LYS A 381 -7.271 -8.309 -21.174 1.00 0.00 C ATOM 381 O LYS A 381 -6.601 -7.591 -20.431 1.00 0.00 O ATOM 382 CB LYS A 381 -6.797 -10.763 -21.088 1.00 0.00 C ATOM 383 CG LYS A 381 -7.088 -12.103 -20.433 1.00 0.00 C ATOM 384 CD LYS A 381 -6.303 -13.226 -21.089 1.00 0.00 C ATOM 385 CE LYS A 381 -6.032 -14.361 -20.113 1.00 0.00 C ATOM 386 NZ LYS A 381 -4.790 -14.130 -19.324 1.00 0.00 N ATOM 0 H LYS A 381 -9.164 -10.825 -21.768 1.00 0.00 H new ATOM 0 HA LYS A 381 -7.878 -9.635 -19.611 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -6.813 -10.886 -22.171 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -5.789 -10.447 -20.818 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -6.837 -12.053 -19.373 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -8.155 -12.317 -20.498 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.858 -13.607 -21.946 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -5.358 -12.837 -21.468 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -6.879 -14.467 -19.435 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -5.944 -15.299 -20.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -4.863 -14.622 -18.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -3.971 -14.497 -19.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -4.668 -13.110 -19.160 1.00 0.00 H new ATOM 400 N LEU A 382 -7.589 -7.965 -22.417 1.00 0.00 N ATOM 401 CA LEU A 382 -7.159 -6.695 -22.994 1.00 0.00 C ATOM 402 C LEU A 382 -7.939 -5.532 -22.391 1.00 0.00 C ATOM 403 O LEU A 382 -7.456 -4.400 -22.353 1.00 0.00 O ATOM 404 CB LEU A 382 -7.342 -6.714 -24.512 1.00 0.00 C ATOM 405 CG LEU A 382 -6.474 -7.712 -25.280 1.00 0.00 C ATOM 406 CD1 LEU A 382 -7.192 -8.191 -26.532 1.00 0.00 C ATOM 407 CD2 LEU A 382 -5.133 -7.087 -25.639 1.00 0.00 C ATOM 0 H LEU A 382 -8.143 -8.547 -23.045 1.00 0.00 H new ATOM 0 HA LEU A 382 -6.102 -6.558 -22.764 1.00 0.00 H new ATOM 0 HB2 LEU A 382 -8.388 -6.930 -24.729 1.00 0.00 H new ATOM 0 HB3 LEU A 382 -7.137 -5.714 -24.895 1.00 0.00 H new ATOM 0 HG LEU A 382 -6.291 -8.574 -24.638 1.00 0.00 H new ATOM 0 HD11 LEU A 382 -6.559 -8.900 -27.065 1.00 0.00 H new ATOM 0 HD12 LEU A 382 -8.126 -8.678 -26.252 1.00 0.00 H new ATOM 0 HD13 LEU A 382 -7.406 -7.339 -27.177 1.00 0.00 H new ATOM 0 HD21 LEU A 382 -4.529 -7.811 -26.185 1.00 0.00 H new ATOM 0 HD22 LEU A 382 -5.297 -6.208 -26.262 1.00 0.00 H new ATOM 0 HD23 LEU A 382 -4.612 -6.794 -24.727 1.00 0.00 H new ATOM 480 N LYS A 388 -6.340 4.257 -18.241 1.00 0.00 N ATOM 481 CA LYS A 388 -6.178 5.012 -17.004 1.00 0.00 C ATOM 482 C LYS A 388 -5.095 6.075 -17.153 1.00 0.00 C ATOM 483 O LYS A 388 -4.235 6.000 -18.030 1.00 0.00 O ATOM 484 CB LYS A 388 -5.829 4.071 -15.849 1.00 0.00 C ATOM 485 CG LYS A 388 -4.978 2.884 -16.269 1.00 0.00 C ATOM 486 CD LYS A 388 -4.346 2.199 -15.069 1.00 0.00 C ATOM 487 CE LYS A 388 -4.745 0.734 -14.988 1.00 0.00 C ATOM 488 NZ LYS A 388 -4.977 0.298 -13.584 1.00 0.00 N ATOM 0 HA LYS A 388 -7.123 5.510 -16.786 1.00 0.00 H new ATOM 0 HB2 LYS A 388 -5.299 4.634 -15.080 1.00 0.00 H new ATOM 0 HB3 LYS A 388 -6.751 3.705 -15.398 1.00 0.00 H new ATOM 0 HG2 LYS A 388 -5.593 2.169 -16.815 1.00 0.00 H new ATOM 0 HG3 LYS A 388 -4.197 3.219 -16.951 1.00 0.00 H new ATOM 0 HD2 LYS A 388 -3.261 2.278 -15.134 1.00 0.00 H new ATOM 0 HD3 LYS A 388 -4.649 2.711 -14.156 1.00 0.00 H new ATOM 0 HE2 LYS A 388 -5.650 0.572 -15.573 1.00 0.00 H new ATOM 0 HE3 LYS A 388 -3.963 0.120 -15.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 -5.247 -0.706 -13.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 -4.106 0.429 -13.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 -5.741 0.867 -13.166 1.00 0.00 H new ATOM 502 N PRO A 389 -5.135 7.089 -16.276 1.00 0.00 N ATOM 503 CA PRO A 389 -6.155 7.190 -15.228 1.00 0.00 C ATOM 504 C PRO A 389 -7.538 7.494 -15.792 1.00 0.00 C ATOM 505 O PRO A 389 -8.533 6.896 -15.381 1.00 0.00 O ATOM 506 CB PRO A 389 -5.662 8.353 -14.363 1.00 0.00 C ATOM 507 CG PRO A 389 -4.830 9.180 -15.280 1.00 0.00 C ATOM 508 CD PRO A 389 -4.188 8.216 -16.240 1.00 0.00 C ATOM 0 HA PRO A 389 -6.271 6.254 -14.681 1.00 0.00 H new ATOM 0 HB2 PRO A 389 -6.496 8.927 -13.959 1.00 0.00 H new ATOM 0 HB3 PRO A 389 -5.080 7.996 -13.514 1.00 0.00 H new ATOM 0 HG2 PRO A 389 -5.442 9.910 -15.810 1.00 0.00 H new ATOM 0 HG3 PRO A 389 -4.076 9.739 -14.726 1.00 0.00 H new ATOM 0 HD2 PRO A 389 -4.054 8.660 -17.226 1.00 0.00 H new ATOM 0 HD3 PRO A 389 -3.203 7.902 -15.896 1.00 0.00 H new ATOM 516 N TYR A 390 -7.595 8.427 -16.736 1.00 0.00 N ATOM 517 CA TYR A 390 -8.857 8.812 -17.356 1.00 0.00 C ATOM 518 C TYR A 390 -8.815 8.586 -18.864 1.00 0.00 C ATOM 519 O TYR A 390 -8.280 9.405 -19.611 1.00 0.00 O ATOM 520 CB TYR A 390 -9.169 10.280 -17.058 1.00 0.00 C ATOM 521 CG TYR A 390 -8.950 10.664 -15.612 1.00 0.00 C ATOM 522 CD1 TYR A 390 -9.933 10.438 -14.656 1.00 0.00 C ATOM 523 CD2 TYR A 390 -7.760 11.252 -15.201 1.00 0.00 C ATOM 524 CE1 TYR A 390 -9.737 10.787 -13.334 1.00 0.00 C ATOM 525 CE2 TYR A 390 -7.555 11.603 -13.881 1.00 0.00 C ATOM 526 CZ TYR A 390 -8.547 11.370 -12.951 1.00 0.00 C ATOM 527 OH TYR A 390 -8.348 11.718 -11.635 1.00 0.00 O ATOM 0 H TYR A 390 -6.781 8.931 -17.089 1.00 0.00 H new ATOM 0 HA TYR A 390 -9.644 8.187 -16.935 1.00 0.00 H new ATOM 0 HB2 TYR A 390 -8.545 10.911 -17.691 1.00 0.00 H new ATOM 0 HB3 TYR A 390 -10.205 10.484 -17.326 1.00 0.00 H new ATOM 0 HD1 TYR A 390 -10.866 9.982 -14.952 1.00 0.00 H new ATOM 0 HD2 TYR A 390 -6.982 11.438 -15.926 1.00 0.00 H new ATOM 0 HE1 TYR A 390 -10.512 10.604 -12.604 1.00 0.00 H new ATOM 0 HE2 TYR A 390 -6.623 12.057 -13.579 1.00 0.00 H new ATOM 0 HH TYR A 390 -7.458 12.116 -11.533 1.00 0.00 H new ATOM 537 N SER A 391 -9.384 7.468 -19.304 1.00 0.00 N ATOM 538 CA SER A 391 -9.409 7.131 -20.723 1.00 0.00 C ATOM 539 C SER A 391 -10.836 7.159 -21.262 1.00 0.00 C ATOM 540 O SER A 391 -11.800 7.016 -20.509 1.00 0.00 O ATOM 541 CB SER A 391 -8.793 5.749 -20.951 1.00 0.00 C ATOM 542 OG SER A 391 -9.507 5.030 -21.941 1.00 0.00 O ATOM 0 H SER A 391 -9.833 6.781 -18.699 1.00 0.00 H new ATOM 0 HA SER A 391 -8.821 7.876 -21.259 1.00 0.00 H new ATOM 0 HB2 SER A 391 -7.752 5.857 -21.255 1.00 0.00 H new ATOM 0 HB3 SER A 391 -8.795 5.188 -20.017 1.00 0.00 H new ATOM 0 HG SER A 391 -9.314 5.409 -22.824 1.00 0.00 H new ATOM 548 N CYS A 392 -10.963 7.344 -22.572 1.00 0.00 N ATOM 549 CA CYS A 392 -12.271 7.391 -23.215 1.00 0.00 C ATOM 550 C CYS A 392 -12.794 5.984 -23.489 1.00 0.00 C ATOM 551 O CYS A 392 -12.106 5.140 -24.064 1.00 0.00 O ATOM 552 CB CYS A 392 -12.191 8.182 -24.522 1.00 0.00 C ATOM 553 SG CYS A 392 -13.813 8.616 -25.229 1.00 0.00 S ATOM 0 H CYS A 392 -10.176 7.464 -23.209 1.00 0.00 H new ATOM 0 HA CYS A 392 -12.964 7.890 -22.538 1.00 0.00 H new ATOM 0 HB2 CYS A 392 -11.627 9.098 -24.346 1.00 0.00 H new ATOM 0 HB3 CYS A 392 -11.632 7.599 -25.254 1.00 0.00 H new ATOM 0 HG CYS A 392 -13.717 8.686 -26.524 1.00 0.00 H new ATOM 558 N PRO A 393 -14.041 5.725 -23.068 1.00 0.00 N ATOM 559 CA PRO A 393 -14.685 4.421 -23.258 1.00 0.00 C ATOM 560 C PRO A 393 -15.015 4.146 -24.721 1.00 0.00 C ATOM 561 O PRO A 393 -15.210 2.996 -25.118 1.00 0.00 O ATOM 562 CB PRO A 393 -15.968 4.536 -22.432 1.00 0.00 C ATOM 563 CG PRO A 393 -16.256 5.997 -22.381 1.00 0.00 C ATOM 564 CD PRO A 393 -14.918 6.683 -22.376 1.00 0.00 C ATOM 0 HA PRO A 393 -14.038 3.598 -22.953 1.00 0.00 H new ATOM 0 HB2 PRO A 393 -16.788 3.987 -22.895 1.00 0.00 H new ATOM 0 HB3 PRO A 393 -15.833 4.124 -21.432 1.00 0.00 H new ATOM 0 HG2 PRO A 393 -16.851 6.308 -23.240 1.00 0.00 H new ATOM 0 HG3 PRO A 393 -16.828 6.251 -21.489 1.00 0.00 H new ATOM 0 HD2 PRO A 393 -14.956 7.641 -22.895 1.00 0.00 H new ATOM 0 HD3 PRO A 393 -14.573 6.883 -21.362 1.00 0.00 H new ATOM 572 N VAL A 394 -15.077 5.207 -25.519 1.00 0.00 N ATOM 573 CA VAL A 394 -15.383 5.078 -26.939 1.00 0.00 C ATOM 574 C VAL A 394 -14.110 4.928 -27.764 1.00 0.00 C ATOM 575 O VAL A 394 -13.883 3.894 -28.392 1.00 0.00 O ATOM 576 CB VAL A 394 -16.175 6.295 -27.454 1.00 0.00 C ATOM 577 CG1 VAL A 394 -16.479 6.145 -28.937 1.00 0.00 C ATOM 578 CG2 VAL A 394 -17.457 6.473 -26.655 1.00 0.00 C ATOM 0 H VAL A 394 -14.919 6.165 -25.207 1.00 0.00 H new ATOM 0 HA VAL A 394 -15.993 4.182 -27.052 1.00 0.00 H new ATOM 0 HB VAL A 394 -15.564 7.187 -27.321 1.00 0.00 H new ATOM 0 HG11 VAL A 394 -17.039 7.014 -29.283 1.00 0.00 H new ATOM 0 HG12 VAL A 394 -15.545 6.069 -29.494 1.00 0.00 H new ATOM 0 HG13 VAL A 394 -17.071 5.244 -29.098 1.00 0.00 H new ATOM 0 HG21 VAL A 394 -18.004 7.337 -27.032 1.00 0.00 H new ATOM 0 HG22 VAL A 394 -18.075 5.581 -26.755 1.00 0.00 H new ATOM 0 HG23 VAL A 394 -17.212 6.629 -25.604 1.00 0.00 H new ATOM 588 N CYS A 395 -13.281 5.967 -27.757 1.00 0.00 N ATOM 589 CA CYS A 395 -12.029 5.952 -28.504 1.00 0.00 C ATOM 590 C CYS A 395 -11.036 4.976 -27.881 1.00 0.00 C ATOM 591 O CYS A 395 -10.721 3.938 -28.462 1.00 0.00 O ATOM 592 CB CYS A 395 -11.422 7.355 -28.550 1.00 0.00 C ATOM 593 SG CYS A 395 -12.607 8.664 -29.002 1.00 0.00 S ATOM 0 H CYS A 395 -13.454 6.830 -27.242 1.00 0.00 H new ATOM 0 HA CYS A 395 -12.245 5.623 -29.521 1.00 0.00 H new ATOM 0 HB2 CYS A 395 -10.996 7.587 -27.574 1.00 0.00 H new ATOM 0 HB3 CYS A 395 -10.600 7.360 -29.266 1.00 0.00 H new ATOM 0 HG CYS A 395 -12.356 9.735 -28.308 1.00 0.00 H new ATOM 598 N GLY A 396 -10.544 5.317 -26.693 1.00 0.00 N ATOM 599 CA GLY A 396 -9.592 4.461 -26.011 1.00 0.00 C ATOM 600 C GLY A 396 -8.356 5.214 -25.559 1.00 0.00 C ATOM 601 O GLY A 396 -7.538 4.684 -24.807 1.00 0.00 O ATOM 0 H GLY A 396 -10.788 6.171 -26.191 1.00 0.00 H new ATOM 0 HA2 GLY A 396 -10.073 4.005 -25.146 1.00 0.00 H new ATOM 0 HA3 GLY A 396 -9.296 3.649 -26.676 1.00 0.00 H new ATOM 605 N LEU A 397 -8.219 6.452 -26.019 1.00 0.00 N ATOM 606 CA LEU A 397 -7.072 7.279 -25.659 1.00 0.00 C ATOM 607 C LEU A 397 -6.949 7.409 -24.144 1.00 0.00 C ATOM 608 O LEU A 397 -7.883 7.095 -23.406 1.00 0.00 O ATOM 609 CB LEU A 397 -7.200 8.666 -26.291 1.00 0.00 C ATOM 610 CG LEU A 397 -6.438 8.880 -27.600 1.00 0.00 C ATOM 611 CD1 LEU A 397 -7.365 9.425 -28.675 1.00 0.00 C ATOM 612 CD2 LEU A 397 -5.259 9.818 -27.383 1.00 0.00 C ATOM 0 H LEU A 397 -8.887 6.906 -26.642 1.00 0.00 H new ATOM 0 HA LEU A 397 -6.173 6.794 -26.039 1.00 0.00 H new ATOM 0 HB2 LEU A 397 -8.256 8.865 -26.472 1.00 0.00 H new ATOM 0 HB3 LEU A 397 -6.856 9.406 -25.568 1.00 0.00 H new ATOM 0 HG LEU A 397 -6.054 7.917 -27.936 1.00 0.00 H new ATOM 0 HD11 LEU A 397 -6.805 9.571 -29.599 1.00 0.00 H new ATOM 0 HD12 LEU A 397 -8.175 8.717 -28.850 1.00 0.00 H new ATOM 0 HD13 LEU A 397 -7.780 10.378 -28.348 1.00 0.00 H new ATOM 0 HD21 LEU A 397 -4.728 9.959 -28.325 1.00 0.00 H new ATOM 0 HD22 LEU A 397 -5.622 10.781 -27.023 1.00 0.00 H new ATOM 0 HD23 LEU A 397 -4.582 9.387 -26.646 1.00 0.00 H new ATOM 624 N ARG A 398 -5.790 7.874 -23.687 1.00 0.00 N ATOM 625 CA ARG A 398 -5.545 8.045 -22.261 1.00 0.00 C ATOM 626 C ARG A 398 -5.284 9.511 -21.926 1.00 0.00 C ATOM 627 O ARG A 398 -4.551 10.200 -22.636 1.00 0.00 O ATOM 628 CB ARG A 398 -4.355 7.191 -21.820 1.00 0.00 C ATOM 629 CG ARG A 398 -4.677 5.710 -21.709 1.00 0.00 C ATOM 630 CD ARG A 398 -4.090 4.924 -22.871 1.00 0.00 C ATOM 631 NE ARG A 398 -3.637 3.597 -22.462 1.00 0.00 N ATOM 632 CZ ARG A 398 -2.517 3.381 -21.782 1.00 0.00 C ATOM 633 NH1 ARG A 398 -1.740 4.398 -21.436 1.00 0.00 N ATOM 634 NH2 ARG A 398 -2.172 2.145 -21.446 1.00 0.00 N ATOM 0 H ARG A 398 -5.007 8.139 -24.284 1.00 0.00 H new ATOM 0 HA ARG A 398 -6.436 7.720 -21.724 1.00 0.00 H new ATOM 0 HB2 ARG A 398 -3.539 7.325 -22.531 1.00 0.00 H new ATOM 0 HB3 ARG A 398 -3.999 7.550 -20.855 1.00 0.00 H new ATOM 0 HG2 ARG A 398 -4.285 5.321 -20.770 1.00 0.00 H new ATOM 0 HG3 ARG A 398 -5.758 5.572 -21.684 1.00 0.00 H new ATOM 0 HD2 ARG A 398 -4.839 4.825 -23.657 1.00 0.00 H new ATOM 0 HD3 ARG A 398 -3.253 5.477 -23.297 1.00 0.00 H new ATOM 0 HE ARG A 398 -4.212 2.793 -22.712 1.00 0.00 H new ATOM 0 HH11 ARG A 398 -2.002 5.350 -21.692 1.00 0.00 H new ATOM 0 HH12 ARG A 398 -0.880 4.228 -20.914 1.00 0.00 H new ATOM 0 HH21 ARG A 398 -2.767 1.360 -21.710 1.00 0.00 H new ATOM 0 HH22 ARG A 398 -1.312 1.980 -20.924 1.00 0.00 H new ATOM 648 N PHE A 399 -5.890 9.982 -20.841 1.00 0.00 N ATOM 649 CA PHE A 399 -5.725 11.366 -20.414 1.00 0.00 C ATOM 650 C PHE A 399 -5.322 11.437 -18.944 1.00 0.00 C ATOM 651 O PHE A 399 -5.904 10.761 -18.095 1.00 0.00 O ATOM 652 CB PHE A 399 -7.020 12.150 -20.637 1.00 0.00 C ATOM 653 CG PHE A 399 -7.541 12.059 -22.043 1.00 0.00 C ATOM 654 CD1 PHE A 399 -7.146 12.977 -23.003 1.00 0.00 C ATOM 655 CD2 PHE A 399 -8.426 11.056 -22.404 1.00 0.00 C ATOM 656 CE1 PHE A 399 -7.622 12.896 -24.297 1.00 0.00 C ATOM 657 CE2 PHE A 399 -8.906 10.970 -23.698 1.00 0.00 C ATOM 658 CZ PHE A 399 -8.505 11.892 -24.645 1.00 0.00 C ATOM 0 H PHE A 399 -6.500 9.425 -20.242 1.00 0.00 H new ATOM 0 HA PHE A 399 -4.931 11.812 -21.013 1.00 0.00 H new ATOM 0 HB2 PHE A 399 -7.782 11.780 -19.951 1.00 0.00 H new ATOM 0 HB3 PHE A 399 -6.849 13.197 -20.389 1.00 0.00 H new ATOM 0 HD1 PHE A 399 -6.458 13.765 -22.736 1.00 0.00 H new ATOM 0 HD2 PHE A 399 -8.744 10.334 -21.667 1.00 0.00 H new ATOM 0 HE1 PHE A 399 -7.304 13.617 -25.036 1.00 0.00 H new ATOM 0 HE2 PHE A 399 -9.594 10.182 -23.968 1.00 0.00 H new ATOM 0 HZ PHE A 399 -8.881 11.828 -25.655 1.00 0.00 H new ATOM 668 N LYS A 400 -4.321 12.260 -18.650 1.00 0.00 N ATOM 669 CA LYS A 400 -3.838 12.421 -17.284 1.00 0.00 C ATOM 670 C LYS A 400 -4.488 13.628 -16.615 1.00 0.00 C ATOM 671 O LYS A 400 -3.924 14.218 -15.694 1.00 0.00 O ATOM 672 CB LYS A 400 -2.315 12.578 -17.274 1.00 0.00 C ATOM 673 CG LYS A 400 -1.611 11.620 -16.329 1.00 0.00 C ATOM 674 CD LYS A 400 -1.259 12.293 -15.013 1.00 0.00 C ATOM 675 CE LYS A 400 -1.015 11.272 -13.912 1.00 0.00 C ATOM 676 NZ LYS A 400 -2.197 11.127 -13.018 1.00 0.00 N ATOM 0 H LYS A 400 -3.828 12.826 -19.340 1.00 0.00 H new ATOM 0 HA LYS A 400 -4.109 11.527 -16.723 1.00 0.00 H new ATOM 0 HB2 LYS A 400 -1.936 12.423 -18.284 1.00 0.00 H new ATOM 0 HB3 LYS A 400 -2.065 13.601 -16.993 1.00 0.00 H new ATOM 0 HG2 LYS A 400 -2.252 10.759 -16.138 1.00 0.00 H new ATOM 0 HG3 LYS A 400 -0.703 11.244 -16.801 1.00 0.00 H new ATOM 0 HD2 LYS A 400 -0.369 12.908 -15.144 1.00 0.00 H new ATOM 0 HD3 LYS A 400 -2.067 12.962 -14.718 1.00 0.00 H new ATOM 0 HE2 LYS A 400 -0.777 10.307 -14.358 1.00 0.00 H new ATOM 0 HE3 LYS A 400 -0.149 11.573 -13.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 -2.212 10.168 -12.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 -2.138 11.825 -12.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 -3.067 11.286 -13.565 1.00 0.00 H new ATOM 690 N ARG A 401 -5.679 13.988 -17.084 1.00 0.00 N ATOM 691 CA ARG A 401 -6.406 15.124 -16.531 1.00 0.00 C ATOM 692 C ARG A 401 -7.912 14.934 -16.687 1.00 0.00 C ATOM 693 O ARG A 401 -8.381 14.407 -17.696 1.00 0.00 O ATOM 694 CB ARG A 401 -5.971 16.419 -17.220 1.00 0.00 C ATOM 695 CG ARG A 401 -5.768 16.273 -18.719 1.00 0.00 C ATOM 696 CD ARG A 401 -4.322 15.942 -19.056 1.00 0.00 C ATOM 697 NE ARG A 401 -3.830 16.728 -20.185 1.00 0.00 N ATOM 698 CZ ARG A 401 -4.066 16.418 -21.455 1.00 0.00 C ATOM 699 NH1 ARG A 401 -4.785 15.346 -21.756 1.00 0.00 N ATOM 700 NH2 ARG A 401 -3.584 17.183 -22.426 1.00 0.00 N ATOM 0 H ARG A 401 -6.160 13.509 -17.845 1.00 0.00 H new ATOM 0 HA ARG A 401 -6.173 15.190 -15.468 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -6.722 17.188 -17.037 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -5.042 16.767 -16.768 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -6.421 15.488 -19.101 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -6.056 17.198 -19.218 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -3.695 16.128 -18.184 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -4.238 14.881 -19.289 1.00 0.00 H new ATOM 0 HE ARG A 401 -3.275 17.560 -19.987 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -5.158 14.757 -21.012 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -4.965 15.110 -22.732 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -3.032 18.010 -22.198 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -3.766 16.944 -23.401 1.00 0.00 H new ATOM 714 N LYS A 402 -8.664 15.365 -15.681 1.00 0.00 N ATOM 715 CA LYS A 402 -10.117 15.244 -15.704 1.00 0.00 C ATOM 716 C LYS A 402 -10.749 16.420 -16.442 1.00 0.00 C ATOM 717 O LYS A 402 -11.888 16.336 -16.903 1.00 0.00 O ATOM 718 CB LYS A 402 -10.666 15.168 -14.278 1.00 0.00 C ATOM 719 CG LYS A 402 -12.075 14.607 -14.198 1.00 0.00 C ATOM 720 CD LYS A 402 -12.286 13.810 -12.921 1.00 0.00 C ATOM 721 CE LYS A 402 -12.754 12.394 -13.219 1.00 0.00 C ATOM 722 NZ LYS A 402 -14.234 12.318 -13.365 1.00 0.00 N ATOM 0 H LYS A 402 -8.291 15.802 -14.838 1.00 0.00 H new ATOM 0 HA LYS A 402 -10.372 14.326 -16.234 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -10.002 14.548 -13.675 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -10.656 16.166 -13.840 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -12.796 15.423 -14.242 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -12.263 13.969 -15.062 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -11.355 13.775 -12.355 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -13.022 14.313 -12.294 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -12.280 12.040 -14.135 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -12.434 11.729 -12.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -14.513 11.337 -13.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -14.686 12.632 -12.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -14.538 12.933 -14.147 1.00 0.00 H new ATOM 736 N ASP A 403 -10.004 17.514 -16.551 1.00 0.00 N ATOM 737 CA ASP A 403 -10.491 18.706 -17.236 1.00 0.00 C ATOM 738 C ASP A 403 -10.516 18.493 -18.746 1.00 0.00 C ATOM 739 O ASP A 403 -11.175 19.233 -19.476 1.00 0.00 O ATOM 740 CB ASP A 403 -9.614 19.911 -16.893 1.00 0.00 C ATOM 741 CG ASP A 403 -10.203 21.216 -17.390 1.00 0.00 C ATOM 742 OD1 ASP A 403 -11.373 21.502 -17.059 1.00 0.00 O ATOM 743 OD2 ASP A 403 -9.496 21.952 -18.110 1.00 0.00 O ATOM 0 H ASP A 403 -9.060 17.600 -16.174 1.00 0.00 H new ATOM 0 HA ASP A 403 -11.509 18.899 -16.898 1.00 0.00 H new ATOM 0 HB2 ASP A 403 -9.481 19.964 -15.812 1.00 0.00 H new ATOM 0 HB3 ASP A 403 -8.625 19.773 -17.329 1.00 0.00 H new ATOM 748 N ARG A 404 -9.794 17.477 -19.208 1.00 0.00 N ATOM 749 CA ARG A 404 -9.732 17.168 -20.631 1.00 0.00 C ATOM 750 C ARG A 404 -10.704 16.047 -20.987 1.00 0.00 C ATOM 751 O ARG A 404 -11.605 16.230 -21.806 1.00 0.00 O ATOM 752 CB ARG A 404 -8.310 16.768 -21.027 1.00 0.00 C ATOM 753 CG ARG A 404 -7.394 17.954 -21.288 1.00 0.00 C ATOM 754 CD ARG A 404 -7.790 18.694 -22.556 1.00 0.00 C ATOM 755 NE ARG A 404 -6.843 18.464 -23.643 1.00 0.00 N ATOM 756 CZ ARG A 404 -7.079 18.797 -24.907 1.00 0.00 C ATOM 757 NH1 ARG A 404 -8.225 19.373 -25.241 1.00 0.00 N ATOM 758 NH2 ARG A 404 -6.167 18.555 -25.840 1.00 0.00 N ATOM 0 H ARG A 404 -9.244 16.854 -18.617 1.00 0.00 H new ATOM 0 HA ARG A 404 -10.018 18.063 -21.184 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -7.880 16.155 -20.235 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -8.352 16.148 -21.923 1.00 0.00 H new ATOM 0 HG2 ARG A 404 -7.431 18.637 -20.440 1.00 0.00 H new ATOM 0 HG3 ARG A 404 -6.364 17.608 -21.374 1.00 0.00 H new ATOM 0 HD2 ARG A 404 -8.784 18.373 -22.867 1.00 0.00 H new ATOM 0 HD3 ARG A 404 -7.851 19.762 -22.348 1.00 0.00 H new ATOM 0 HE ARG A 404 -5.951 18.023 -23.419 1.00 0.00 H new ATOM 0 HH11 ARG A 404 -8.928 19.562 -24.527 1.00 0.00 H new ATOM 0 HH12 ARG A 404 -8.404 19.628 -26.212 1.00 0.00 H new ATOM 0 HH21 ARG A 404 -5.283 18.113 -25.587 1.00 0.00 H new ATOM 0 HH22 ARG A 404 -6.350 18.811 -26.810 1.00 0.00 H new ATOM 772 N MET A 405 -10.515 14.888 -20.366 1.00 0.00 N ATOM 773 CA MET A 405 -11.376 13.737 -20.617 1.00 0.00 C ATOM 774 C MET A 405 -12.846 14.114 -20.463 1.00 0.00 C ATOM 775 O MET A 405 -13.709 13.587 -21.164 1.00 0.00 O ATOM 776 CB MET A 405 -11.027 12.594 -19.662 1.00 0.00 C ATOM 777 CG MET A 405 -11.279 12.926 -18.200 1.00 0.00 C ATOM 778 SD MET A 405 -12.913 12.408 -17.641 1.00 0.00 S ATOM 779 CE MET A 405 -12.807 10.636 -17.883 1.00 0.00 C ATOM 0 H MET A 405 -9.774 14.720 -19.686 1.00 0.00 H new ATOM 0 HA MET A 405 -11.210 13.407 -21.642 1.00 0.00 H new ATOM 0 HB2 MET A 405 -11.611 11.714 -19.932 1.00 0.00 H new ATOM 0 HB3 MET A 405 -9.977 12.331 -19.791 1.00 0.00 H new ATOM 0 HG2 MET A 405 -10.519 12.443 -17.586 1.00 0.00 H new ATOM 0 HG3 MET A 405 -11.173 14.001 -18.052 1.00 0.00 H new ATOM 0 HE1 MET A 405 -13.679 10.292 -18.439 1.00 0.00 H new ATOM 0 HE2 MET A 405 -11.903 10.399 -18.444 1.00 0.00 H new ATOM 0 HE3 MET A 405 -12.774 10.138 -16.914 1.00 0.00 H new ATOM 789 N SER A 406 -13.124 15.030 -19.540 1.00 0.00 N ATOM 790 CA SER A 406 -14.490 15.474 -19.291 1.00 0.00 C ATOM 791 C SER A 406 -15.067 16.172 -20.519 1.00 0.00 C ATOM 792 O SER A 406 -16.259 16.065 -20.805 1.00 0.00 O ATOM 793 CB SER A 406 -14.531 16.418 -18.087 1.00 0.00 C ATOM 794 OG SER A 406 -15.720 17.188 -18.083 1.00 0.00 O ATOM 0 H SER A 406 -12.421 15.479 -18.953 1.00 0.00 H new ATOM 0 HA SER A 406 -15.098 14.595 -19.075 1.00 0.00 H new ATOM 0 HB2 SER A 406 -14.465 15.840 -17.165 1.00 0.00 H new ATOM 0 HB3 SER A 406 -13.665 17.080 -18.110 1.00 0.00 H new ATOM 0 HG SER A 406 -15.723 17.782 -17.303 1.00 0.00 H new ATOM 800 N TYR A 407 -14.211 16.888 -21.240 1.00 0.00 N ATOM 801 CA TYR A 407 -14.635 17.607 -22.436 1.00 0.00 C ATOM 802 C TYR A 407 -14.508 16.725 -23.675 1.00 0.00 C ATOM 803 O TYR A 407 -15.143 16.978 -24.700 1.00 0.00 O ATOM 804 CB TYR A 407 -13.803 18.878 -22.614 1.00 0.00 C ATOM 805 CG TYR A 407 -14.425 20.102 -21.982 1.00 0.00 C ATOM 806 CD1 TYR A 407 -15.725 20.484 -22.293 1.00 0.00 C ATOM 807 CD2 TYR A 407 -13.715 20.878 -21.075 1.00 0.00 C ATOM 808 CE1 TYR A 407 -16.298 21.602 -21.719 1.00 0.00 C ATOM 809 CE2 TYR A 407 -14.280 21.997 -20.495 1.00 0.00 C ATOM 810 CZ TYR A 407 -15.572 22.355 -20.820 1.00 0.00 C ATOM 811 OH TYR A 407 -16.138 23.469 -20.245 1.00 0.00 O ATOM 0 H TYR A 407 -13.220 16.986 -21.017 1.00 0.00 H new ATOM 0 HA TYR A 407 -15.683 17.881 -22.313 1.00 0.00 H new ATOM 0 HB2 TYR A 407 -12.815 18.719 -22.182 1.00 0.00 H new ATOM 0 HB3 TYR A 407 -13.660 19.062 -23.679 1.00 0.00 H new ATOM 0 HD1 TYR A 407 -16.297 19.896 -22.996 1.00 0.00 H new ATOM 0 HD2 TYR A 407 -12.703 20.602 -20.819 1.00 0.00 H new ATOM 0 HE1 TYR A 407 -17.309 21.885 -21.973 1.00 0.00 H new ATOM 0 HE2 TYR A 407 -13.713 22.588 -19.791 1.00 0.00 H new ATOM 0 HH TYR A 407 -15.494 23.885 -19.635 1.00 0.00 H new ATOM 821 N HIS A 408 -13.683 15.687 -23.573 1.00 0.00 N ATOM 822 CA HIS A 408 -13.473 14.766 -24.684 1.00 0.00 C ATOM 823 C HIS A 408 -14.596 13.735 -24.755 1.00 0.00 C ATOM 824 O HIS A 408 -15.108 13.434 -25.833 1.00 0.00 O ATOM 825 CB HIS A 408 -12.125 14.059 -24.540 1.00 0.00 C ATOM 826 CG HIS A 408 -11.914 12.962 -25.537 1.00 0.00 C ATOM 827 ND1 HIS A 408 -11.311 13.163 -26.761 1.00 0.00 N ATOM 828 CD2 HIS A 408 -12.228 11.647 -25.486 1.00 0.00 C ATOM 829 CE1 HIS A 408 -11.264 12.019 -27.420 1.00 0.00 C ATOM 830 NE2 HIS A 408 -11.814 11.083 -26.668 1.00 0.00 N ATOM 0 H HIS A 408 -13.150 15.463 -22.733 1.00 0.00 H new ATOM 0 HA HIS A 408 -13.475 15.344 -25.608 1.00 0.00 H new ATOM 0 HB2 HIS A 408 -11.326 14.793 -24.645 1.00 0.00 H new ATOM 0 HB3 HIS A 408 -12.047 13.645 -23.535 1.00 0.00 H new ATOM 0 HD1 HIS A 408 -10.957 14.056 -27.104 1.00 0.00 H new ATOM 0 HD2 HIS A 408 -12.714 11.136 -24.668 1.00 0.00 H new ATOM 0 HE1 HIS A 408 -10.847 11.874 -28.406 1.00 0.00 H new ATOM 838 N VAL A 409 -14.973 13.197 -23.600 1.00 0.00 N ATOM 839 CA VAL A 409 -16.035 12.201 -23.531 1.00 0.00 C ATOM 840 C VAL A 409 -17.376 12.798 -23.942 1.00 0.00 C ATOM 841 O VAL A 409 -18.064 12.263 -24.812 1.00 0.00 O ATOM 842 CB VAL A 409 -16.161 11.611 -22.113 1.00 0.00 C ATOM 843 CG1 VAL A 409 -17.299 10.604 -22.053 1.00 0.00 C ATOM 844 CG2 VAL A 409 -14.849 10.972 -21.684 1.00 0.00 C ATOM 0 H VAL A 409 -14.558 13.434 -22.699 1.00 0.00 H new ATOM 0 HA VAL A 409 -15.767 11.405 -24.225 1.00 0.00 H new ATOM 0 HB VAL A 409 -16.388 12.421 -21.420 1.00 0.00 H new ATOM 0 HG11 VAL A 409 -17.373 10.198 -21.044 1.00 0.00 H new ATOM 0 HG12 VAL A 409 -18.235 11.097 -22.315 1.00 0.00 H new ATOM 0 HG13 VAL A 409 -17.106 9.794 -22.757 1.00 0.00 H new ATOM 0 HG21 VAL A 409 -14.956 10.560 -20.680 1.00 0.00 H new ATOM 0 HG22 VAL A 409 -14.589 10.173 -22.378 1.00 0.00 H new ATOM 0 HG23 VAL A 409 -14.060 11.724 -21.686 1.00 0.00 H new ATOM 854 N ARG A 410 -17.741 13.909 -23.311 1.00 0.00 N ATOM 855 CA ARG A 410 -19.001 14.579 -23.611 1.00 0.00 C ATOM 856 C ARG A 410 -19.043 15.030 -25.068 1.00 0.00 C ATOM 857 O ARG A 410 -20.100 15.029 -25.699 1.00 0.00 O ATOM 858 CB ARG A 410 -19.195 15.783 -22.687 1.00 0.00 C ATOM 859 CG ARG A 410 -19.063 15.445 -21.211 1.00 0.00 C ATOM 860 CD ARG A 410 -20.309 14.750 -20.685 1.00 0.00 C ATOM 861 NE ARG A 410 -20.364 14.756 -19.225 1.00 0.00 N ATOM 862 CZ ARG A 410 -21.236 14.045 -18.520 1.00 0.00 C ATOM 863 NH1 ARG A 410 -22.122 13.275 -19.137 1.00 0.00 N ATOM 864 NH2 ARG A 410 -21.223 14.103 -17.194 1.00 0.00 N ATOM 0 H ARG A 410 -17.182 14.364 -22.589 1.00 0.00 H new ATOM 0 HA ARG A 410 -19.811 13.868 -23.445 1.00 0.00 H new ATOM 0 HB2 ARG A 410 -18.462 16.548 -22.943 1.00 0.00 H new ATOM 0 HB3 ARG A 410 -20.181 16.213 -22.866 1.00 0.00 H new ATOM 0 HG2 ARG A 410 -18.196 14.803 -21.060 1.00 0.00 H new ATOM 0 HG3 ARG A 410 -18.887 16.358 -20.642 1.00 0.00 H new ATOM 0 HD2 ARG A 410 -21.195 15.244 -21.083 1.00 0.00 H new ATOM 0 HD3 ARG A 410 -20.329 13.721 -21.044 1.00 0.00 H new ATOM 0 HE ARG A 410 -19.696 15.338 -18.720 1.00 0.00 H new ATOM 0 HH11 ARG A 410 -22.135 13.228 -20.156 1.00 0.00 H new ATOM 0 HH12 ARG A 410 -22.791 12.730 -18.593 1.00 0.00 H new ATOM 0 HH21 ARG A 410 -20.543 14.694 -16.716 1.00 0.00 H new ATOM 0 HH22 ARG A 410 -21.893 13.557 -16.653 1.00 0.00 H new ATOM 878 N SER A 411 -17.886 15.417 -25.596 1.00 0.00 N ATOM 879 CA SER A 411 -17.792 15.876 -26.977 1.00 0.00 C ATOM 880 C SER A 411 -18.418 14.862 -27.930 1.00 0.00 C ATOM 881 O SER A 411 -18.938 15.224 -28.986 1.00 0.00 O ATOM 882 CB SER A 411 -16.330 16.115 -27.358 1.00 0.00 C ATOM 883 OG SER A 411 -16.072 15.689 -28.685 1.00 0.00 O ATOM 0 H SER A 411 -17.001 15.422 -25.089 1.00 0.00 H new ATOM 0 HA SER A 411 -18.340 16.814 -27.061 1.00 0.00 H new ATOM 0 HB2 SER A 411 -16.094 17.175 -27.261 1.00 0.00 H new ATOM 0 HB3 SER A 411 -15.679 15.579 -26.668 1.00 0.00 H new ATOM 0 HG SER A 411 -15.131 15.854 -28.905 1.00 0.00 H new ATOM 889 N HIS A 412 -18.364 13.589 -27.550 1.00 0.00 N ATOM 890 CA HIS A 412 -18.926 12.522 -28.369 1.00 0.00 C ATOM 891 C HIS A 412 -20.428 12.392 -28.137 1.00 0.00 C ATOM 892 O HIS A 412 -21.197 12.198 -29.078 1.00 0.00 O ATOM 893 CB HIS A 412 -18.233 11.194 -28.059 1.00 0.00 C ATOM 894 CG HIS A 412 -16.739 11.263 -28.148 1.00 0.00 C ATOM 895 ND1 HIS A 412 -16.074 11.853 -29.202 1.00 0.00 N ATOM 896 CD2 HIS A 412 -15.781 10.813 -27.305 1.00 0.00 C ATOM 897 CE1 HIS A 412 -14.771 11.761 -29.004 1.00 0.00 C ATOM 898 NE2 HIS A 412 -14.567 11.134 -27.860 1.00 0.00 N ATOM 0 H HIS A 412 -17.937 13.272 -26.680 1.00 0.00 H new ATOM 0 HA HIS A 412 -18.759 12.775 -29.416 1.00 0.00 H new ATOM 0 HB2 HIS A 412 -18.515 10.872 -27.056 1.00 0.00 H new ATOM 0 HB3 HIS A 412 -18.595 10.434 -28.751 1.00 0.00 H new ATOM 0 HD2 HIS A 412 -15.941 10.297 -26.370 1.00 0.00 H new ATOM 0 HE1 HIS A 412 -14.003 12.135 -29.665 1.00 0.00 H new ATOM 0 HE2 HIS A 412 -13.655 10.922 -27.454 1.00 0.00 H new ATOM 959 N LYS A 418 -26.925 7.951 -21.685 1.00 0.00 N ATOM 960 CA LYS A 418 -27.469 7.208 -20.554 1.00 0.00 C ATOM 961 C LYS A 418 -28.939 6.869 -20.784 1.00 0.00 C ATOM 962 O LYS A 418 -29.654 7.558 -21.511 1.00 0.00 O ATOM 963 CB LYS A 418 -27.317 8.018 -19.265 1.00 0.00 C ATOM 964 CG LYS A 418 -25.957 8.679 -19.118 1.00 0.00 C ATOM 965 CD LYS A 418 -24.846 7.649 -19.002 1.00 0.00 C ATOM 966 CE LYS A 418 -23.717 8.145 -18.112 1.00 0.00 C ATOM 967 NZ LYS A 418 -22.542 8.598 -18.907 1.00 0.00 N ATOM 0 HA LYS A 418 -26.910 6.277 -20.459 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -28.090 8.786 -19.235 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -27.487 7.362 -18.411 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -25.769 9.323 -19.978 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -25.956 9.318 -18.235 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -25.249 6.721 -18.597 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -24.455 7.420 -19.994 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -24.076 8.968 -17.494 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -23.412 7.348 -17.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -21.794 8.928 -18.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -22.183 7.806 -19.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -22.827 9.376 -19.535 1.00 0.00 H new ATOM 981 N PRO A 419 -29.402 5.782 -20.148 1.00 0.00 N ATOM 982 CA PRO A 419 -30.791 5.328 -20.266 1.00 0.00 C ATOM 983 C PRO A 419 -31.769 6.271 -19.574 1.00 0.00 C ATOM 984 O PRO A 419 -32.790 6.653 -20.148 1.00 0.00 O ATOM 985 CB PRO A 419 -30.778 3.965 -19.569 1.00 0.00 C ATOM 986 CG PRO A 419 -29.640 4.039 -18.611 1.00 0.00 C ATOM 987 CD PRO A 419 -28.606 4.914 -19.264 1.00 0.00 C ATOM 0 HA PRO A 419 -31.121 5.288 -21.304 1.00 0.00 H new ATOM 0 HB2 PRO A 419 -31.719 3.776 -19.052 1.00 0.00 H new ATOM 0 HB3 PRO A 419 -30.640 3.155 -20.286 1.00 0.00 H new ATOM 0 HG2 PRO A 419 -29.960 4.458 -17.657 1.00 0.00 H new ATOM 0 HG3 PRO A 419 -29.238 3.047 -18.405 1.00 0.00 H new ATOM 0 HD2 PRO A 419 -28.048 5.493 -18.529 1.00 0.00 H new ATOM 0 HD3 PRO A 419 -27.879 4.327 -19.826 1.00 0.00 H new ATOM 995 N TYR A 420 -31.452 6.643 -18.339 1.00 0.00 N ATOM 996 CA TYR A 420 -32.305 7.540 -17.568 1.00 0.00 C ATOM 997 C TYR A 420 -31.815 8.981 -17.672 1.00 0.00 C ATOM 998 O TYR A 420 -30.629 9.260 -17.492 1.00 0.00 O ATOM 999 CB TYR A 420 -32.343 7.107 -16.102 1.00 0.00 C ATOM 1000 CG TYR A 420 -32.747 5.663 -15.907 1.00 0.00 C ATOM 1001 CD1 TYR A 420 -34.028 5.231 -16.228 1.00 0.00 C ATOM 1002 CD2 TYR A 420 -31.849 4.732 -15.401 1.00 0.00 C ATOM 1003 CE1 TYR A 420 -34.402 3.913 -16.051 1.00 0.00 C ATOM 1004 CE2 TYR A 420 -32.213 3.412 -15.222 1.00 0.00 C ATOM 1005 CZ TYR A 420 -33.491 3.007 -15.549 1.00 0.00 C ATOM 1006 OH TYR A 420 -33.859 1.693 -15.371 1.00 0.00 O ATOM 0 H TYR A 420 -30.611 6.337 -17.850 1.00 0.00 H new ATOM 0 HA TYR A 420 -33.312 7.487 -17.982 1.00 0.00 H new ATOM 0 HB2 TYR A 420 -31.359 7.263 -15.660 1.00 0.00 H new ATOM 0 HB3 TYR A 420 -33.040 7.747 -15.561 1.00 0.00 H new ATOM 0 HD1 TYR A 420 -34.743 5.937 -16.623 1.00 0.00 H new ATOM 0 HD2 TYR A 420 -30.848 5.046 -15.143 1.00 0.00 H new ATOM 0 HE1 TYR A 420 -35.402 3.594 -16.304 1.00 0.00 H new ATOM 0 HE2 TYR A 420 -31.502 2.701 -14.828 1.00 0.00 H new ATOM 0 HH TYR A 420 -33.101 1.187 -15.011 1.00 0.00 H new ATOM 1016 N ILE A 421 -32.736 9.893 -17.964 1.00 0.00 N ATOM 1017 CA ILE A 421 -32.399 11.306 -18.090 1.00 0.00 C ATOM 1018 C ILE A 421 -33.349 12.173 -17.270 1.00 0.00 C ATOM 1019 O ILE A 421 -34.525 11.846 -17.112 1.00 0.00 O ATOM 1020 CB ILE A 421 -32.442 11.765 -19.559 1.00 0.00 C ATOM 1021 CG1 ILE A 421 -33.790 11.409 -20.189 1.00 0.00 C ATOM 1022 CG2 ILE A 421 -31.302 11.135 -20.345 1.00 0.00 C ATOM 1023 CD1 ILE A 421 -33.826 10.025 -20.798 1.00 0.00 C ATOM 0 H ILE A 421 -33.721 9.679 -18.118 1.00 0.00 H new ATOM 0 HA ILE A 421 -31.384 11.424 -17.710 1.00 0.00 H new ATOM 0 HB ILE A 421 -32.323 12.848 -19.588 1.00 0.00 H new ATOM 0 HG12 ILE A 421 -34.568 11.483 -19.429 1.00 0.00 H new ATOM 0 HG13 ILE A 421 -34.027 12.142 -20.960 1.00 0.00 H new ATOM 0 HG21 ILE A 421 -31.346 11.469 -21.382 1.00 0.00 H new ATOM 0 HG22 ILE A 421 -30.350 11.434 -19.908 1.00 0.00 H new ATOM 0 HG23 ILE A 421 -31.392 10.049 -20.310 1.00 0.00 H new ATOM 0 HD11 ILE A 421 -34.812 9.841 -21.226 1.00 0.00 H new ATOM 0 HD12 ILE A 421 -33.071 9.952 -21.581 1.00 0.00 H new ATOM 0 HD13 ILE A 421 -33.621 9.283 -20.027 1.00 0.00 H new ATOM 1035 N CYS A 422 -32.830 13.281 -16.751 1.00 0.00 N ATOM 1036 CA CYS A 422 -33.631 14.197 -15.949 1.00 0.00 C ATOM 1037 C CYS A 422 -34.914 14.582 -16.679 1.00 0.00 C ATOM 1038 O CYS A 422 -35.003 14.464 -17.901 1.00 0.00 O ATOM 1039 CB CYS A 422 -32.824 15.454 -15.616 1.00 0.00 C ATOM 1040 SG CYS A 422 -33.473 16.401 -14.201 1.00 0.00 S ATOM 0 H CYS A 422 -31.858 13.566 -16.872 1.00 0.00 H new ATOM 0 HA CYS A 422 -33.900 13.689 -15.023 1.00 0.00 H new ATOM 0 HB2 CYS A 422 -31.794 15.166 -15.405 1.00 0.00 H new ATOM 0 HB3 CYS A 422 -32.801 16.101 -16.493 1.00 0.00 H new ATOM 0 HG CYS A 422 -33.126 17.648 -14.318 1.00 0.00 H new ATOM 1045 N GLN A 423 -35.904 15.042 -15.921 1.00 0.00 N ATOM 1046 CA GLN A 423 -37.183 15.443 -16.497 1.00 0.00 C ATOM 1047 C GLN A 423 -37.194 16.935 -16.810 1.00 0.00 C ATOM 1048 O GLN A 423 -38.140 17.446 -17.410 1.00 0.00 O ATOM 1049 CB GLN A 423 -38.326 15.102 -15.540 1.00 0.00 C ATOM 1050 CG GLN A 423 -38.998 13.772 -15.844 1.00 0.00 C ATOM 1051 CD GLN A 423 -40.457 13.748 -15.435 1.00 0.00 C ATOM 1052 OE1 GLN A 423 -41.350 13.704 -16.282 1.00 0.00 O ATOM 1053 NE2 GLN A 423 -40.708 13.777 -14.132 1.00 0.00 N ATOM 0 H GLN A 423 -35.846 15.146 -14.908 1.00 0.00 H new ATOM 0 HA GLN A 423 -37.322 14.894 -17.428 1.00 0.00 H new ATOM 0 HB2 GLN A 423 -37.941 15.080 -14.520 1.00 0.00 H new ATOM 0 HB3 GLN A 423 -39.073 15.895 -15.582 1.00 0.00 H new ATOM 0 HG2 GLN A 423 -38.921 13.566 -16.912 1.00 0.00 H new ATOM 0 HG3 GLN A 423 -38.466 12.974 -15.326 1.00 0.00 H new ATOM 0 HE21 GLN A 423 -39.937 13.813 -13.465 1.00 0.00 H new ATOM 0 HE22 GLN A 423 -41.672 13.763 -13.798 1.00 0.00 H new ATOM 1062 N SER A 424 -36.137 17.629 -16.401 1.00 0.00 N ATOM 1063 CA SER A 424 -36.028 19.064 -16.634 1.00 0.00 C ATOM 1064 C SER A 424 -34.950 19.365 -17.671 1.00 0.00 C ATOM 1065 O SER A 424 -35.251 19.678 -18.824 1.00 0.00 O ATOM 1066 CB SER A 424 -35.710 19.792 -15.327 1.00 0.00 C ATOM 1067 OG SER A 424 -36.898 20.173 -14.654 1.00 0.00 O ATOM 0 H SER A 424 -35.344 17.221 -15.907 1.00 0.00 H new ATOM 0 HA SER A 424 -36.985 19.419 -17.016 1.00 0.00 H new ATOM 0 HB2 SER A 424 -35.114 19.146 -14.682 1.00 0.00 H new ATOM 0 HB3 SER A 424 -35.107 20.676 -15.536 1.00 0.00 H new ATOM 0 HG SER A 424 -36.668 20.635 -13.821 1.00 0.00 H new ATOM 1073 N CYS A 425 -33.692 19.269 -17.254 1.00 0.00 N ATOM 1074 CA CYS A 425 -32.568 19.530 -18.144 1.00 0.00 C ATOM 1075 C CYS A 425 -32.336 18.354 -19.087 1.00 0.00 C ATOM 1076 O CYS A 425 -31.651 18.483 -20.101 1.00 0.00 O ATOM 1077 CB CYS A 425 -31.301 19.805 -17.332 1.00 0.00 C ATOM 1078 SG CYS A 425 -30.794 18.426 -16.255 1.00 0.00 S ATOM 0 H CYS A 425 -33.426 19.012 -16.304 1.00 0.00 H new ATOM 0 HA CYS A 425 -32.807 20.410 -18.742 1.00 0.00 H new ATOM 0 HB2 CYS A 425 -30.486 20.035 -18.018 1.00 0.00 H new ATOM 0 HB3 CYS A 425 -31.461 20.691 -16.718 1.00 0.00 H new ATOM 0 HG CYS A 425 -30.769 18.828 -15.019 1.00 0.00 H new ATOM 1083 N GLY A 426 -32.912 17.205 -18.745 1.00 0.00 N ATOM 1084 CA GLY A 426 -32.757 16.022 -19.571 1.00 0.00 C ATOM 1085 C GLY A 426 -31.310 15.758 -19.938 1.00 0.00 C ATOM 1086 O GLY A 426 -30.974 15.623 -21.115 1.00 0.00 O ATOM 0 H GLY A 426 -33.483 17.073 -17.910 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -33.158 15.158 -19.042 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -33.344 16.139 -20.482 1.00 0.00 H new ATOM 1090 N LYS A 427 -30.449 15.684 -18.929 1.00 0.00 N ATOM 1091 CA LYS A 427 -29.029 15.434 -19.150 1.00 0.00 C ATOM 1092 C LYS A 427 -28.766 13.948 -19.371 1.00 0.00 C ATOM 1093 O LYS A 427 -28.544 13.508 -20.498 1.00 0.00 O ATOM 1094 CB LYS A 427 -28.211 15.936 -17.959 1.00 0.00 C ATOM 1095 CG LYS A 427 -26.721 15.667 -18.087 1.00 0.00 C ATOM 1096 CD LYS A 427 -25.936 16.328 -16.967 1.00 0.00 C ATOM 1097 CE LYS A 427 -24.453 16.002 -17.058 1.00 0.00 C ATOM 1098 NZ LYS A 427 -23.737 16.317 -15.791 1.00 0.00 N ATOM 0 H LYS A 427 -30.710 15.794 -17.949 1.00 0.00 H new ATOM 0 HA LYS A 427 -28.725 15.976 -20.046 1.00 0.00 H new ATOM 0 HB2 LYS A 427 -28.370 17.009 -17.846 1.00 0.00 H new ATOM 0 HB3 LYS A 427 -28.580 15.462 -17.050 1.00 0.00 H new ATOM 0 HG2 LYS A 427 -26.542 14.592 -18.072 1.00 0.00 H new ATOM 0 HG3 LYS A 427 -26.365 16.036 -19.049 1.00 0.00 H new ATOM 0 HD2 LYS A 427 -26.076 17.408 -17.012 1.00 0.00 H new ATOM 0 HD3 LYS A 427 -26.324 15.996 -16.004 1.00 0.00 H new ATOM 0 HE2 LYS A 427 -24.327 14.945 -17.293 1.00 0.00 H new ATOM 0 HE3 LYS A 427 -24.007 16.566 -17.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 427 -22.729 16.081 -15.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 427 -23.835 17.331 -15.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 427 -24.146 15.760 -15.014 1.00 0.00 H new ATOM 1112 N GLY A 428 -28.795 13.179 -18.287 1.00 0.00 N ATOM 1113 CA GLY A 428 -28.559 11.750 -18.384 1.00 0.00 C ATOM 1114 C GLY A 428 -27.513 11.267 -17.400 1.00 0.00 C ATOM 1115 O GLY A 428 -26.401 11.793 -17.357 1.00 0.00 O ATOM 0 H GLY A 428 -28.978 13.520 -17.343 1.00 0.00 H new ATOM 0 HA2 GLY A 428 -29.493 11.218 -18.206 1.00 0.00 H new ATOM 0 HA3 GLY A 428 -28.240 11.505 -19.397 1.00 0.00 H new ATOM 1119 N PHE A 429 -27.869 10.262 -16.606 1.00 0.00 N ATOM 1120 CA PHE A 429 -26.952 9.709 -15.616 1.00 0.00 C ATOM 1121 C PHE A 429 -26.811 8.200 -15.788 1.00 0.00 C ATOM 1122 O PHE A 429 -27.771 7.511 -16.135 1.00 0.00 O ATOM 1123 CB PHE A 429 -27.443 10.028 -14.202 1.00 0.00 C ATOM 1124 CG PHE A 429 -27.310 11.478 -13.834 1.00 0.00 C ATOM 1125 CD1 PHE A 429 -28.230 12.409 -14.290 1.00 0.00 C ATOM 1126 CD2 PHE A 429 -26.266 11.911 -13.033 1.00 0.00 C ATOM 1127 CE1 PHE A 429 -28.109 13.744 -13.954 1.00 0.00 C ATOM 1128 CE2 PHE A 429 -26.141 13.245 -12.693 1.00 0.00 C ATOM 1129 CZ PHE A 429 -27.064 14.162 -13.153 1.00 0.00 C ATOM 0 H PHE A 429 -28.785 9.814 -16.629 1.00 0.00 H new ATOM 0 HA PHE A 429 -25.974 10.167 -15.767 1.00 0.00 H new ATOM 0 HB2 PHE A 429 -28.489 9.734 -14.114 1.00 0.00 H new ATOM 0 HB3 PHE A 429 -26.881 9.427 -13.487 1.00 0.00 H new ATOM 0 HD1 PHE A 429 -29.050 12.088 -14.915 1.00 0.00 H new ATOM 0 HD2 PHE A 429 -25.541 11.198 -12.670 1.00 0.00 H new ATOM 0 HE1 PHE A 429 -28.831 14.460 -14.317 1.00 0.00 H new ATOM 0 HE2 PHE A 429 -25.322 13.569 -12.068 1.00 0.00 H new ATOM 0 HZ PHE A 429 -26.970 15.205 -12.887 1.00 0.00 H new ATOM 1139 N SER A 430 -25.607 7.692 -15.545 1.00 0.00 N ATOM 1140 CA SER A 430 -25.337 6.265 -15.678 1.00 0.00 C ATOM 1141 C SER A 430 -26.352 5.445 -14.887 1.00 0.00 C ATOM 1142 O SER A 430 -27.039 4.587 -15.441 1.00 0.00 O ATOM 1143 CB SER A 430 -23.920 5.946 -15.197 1.00 0.00 C ATOM 1144 OG SER A 430 -23.313 7.083 -14.609 1.00 0.00 O ATOM 0 H SER A 430 -24.802 8.248 -15.255 1.00 0.00 H new ATOM 0 HA SER A 430 -25.423 6.000 -16.732 1.00 0.00 H new ATOM 0 HB2 SER A 430 -23.953 5.132 -14.473 1.00 0.00 H new ATOM 0 HB3 SER A 430 -23.317 5.601 -16.037 1.00 0.00 H new ATOM 0 HG SER A 430 -22.959 7.666 -15.313 1.00 0.00 H new ATOM 1150 N ARG A 431 -26.440 5.716 -13.589 1.00 0.00 N ATOM 1151 CA ARG A 431 -27.369 5.003 -12.721 1.00 0.00 C ATOM 1152 C ARG A 431 -28.606 5.850 -12.436 1.00 0.00 C ATOM 1153 O ARG A 431 -28.603 7.071 -12.596 1.00 0.00 O ATOM 1154 CB ARG A 431 -26.683 4.624 -11.406 1.00 0.00 C ATOM 1155 CG ARG A 431 -26.274 3.162 -11.332 1.00 0.00 C ATOM 1156 CD ARG A 431 -24.972 2.910 -12.076 1.00 0.00 C ATOM 1157 NE ARG A 431 -24.405 1.602 -11.759 1.00 0.00 N ATOM 1158 CZ ARG A 431 -23.162 1.247 -12.064 1.00 0.00 C ATOM 1159 NH1 ARG A 431 -22.360 2.098 -12.689 1.00 0.00 N ATOM 1160 NH2 ARG A 431 -22.718 0.038 -11.742 1.00 0.00 N ATOM 0 H ARG A 431 -25.879 6.424 -13.115 1.00 0.00 H new ATOM 0 HA ARG A 431 -27.683 4.094 -13.235 1.00 0.00 H new ATOM 0 HB2 ARG A 431 -25.798 5.247 -11.275 1.00 0.00 H new ATOM 0 HB3 ARG A 431 -27.356 4.847 -10.578 1.00 0.00 H new ATOM 0 HG2 ARG A 431 -26.161 2.867 -10.289 1.00 0.00 H new ATOM 0 HG3 ARG A 431 -27.063 2.540 -11.756 1.00 0.00 H new ATOM 0 HD2 ARG A 431 -25.149 2.978 -13.149 1.00 0.00 H new ATOM 0 HD3 ARG A 431 -24.253 3.688 -11.822 1.00 0.00 H new ATOM 0 HE ARG A 431 -24.996 0.924 -11.277 1.00 0.00 H new ATOM 0 HH11 ARG A 431 -22.697 3.028 -12.937 1.00 0.00 H new ATOM 0 HH12 ARG A 431 -21.406 1.822 -12.922 1.00 0.00 H new ATOM 0 HH21 ARG A 431 -23.332 -0.619 -11.260 1.00 0.00 H new ATOM 0 HH22 ARG A 431 -21.763 -0.234 -11.977 1.00 0.00 H new ATOM 1174 N PRO A 432 -29.689 5.188 -12.004 1.00 0.00 N ATOM 1175 CA PRO A 432 -30.953 5.860 -11.688 1.00 0.00 C ATOM 1176 C PRO A 432 -30.855 6.719 -10.431 1.00 0.00 C ATOM 1177 O PRO A 432 -31.274 7.876 -10.424 1.00 0.00 O ATOM 1178 CB PRO A 432 -31.927 4.700 -11.468 1.00 0.00 C ATOM 1179 CG PRO A 432 -31.066 3.556 -11.057 1.00 0.00 C ATOM 1180 CD PRO A 432 -29.764 3.733 -11.789 1.00 0.00 C ATOM 0 HA PRO A 432 -31.258 6.546 -12.478 1.00 0.00 H new ATOM 0 HB2 PRO A 432 -32.661 4.940 -10.699 1.00 0.00 H new ATOM 0 HB3 PRO A 432 -32.482 4.471 -12.378 1.00 0.00 H new ATOM 0 HG2 PRO A 432 -30.910 3.553 -9.978 1.00 0.00 H new ATOM 0 HG3 PRO A 432 -31.532 2.605 -11.314 1.00 0.00 H new ATOM 0 HD2 PRO A 432 -28.920 3.369 -11.202 1.00 0.00 H new ATOM 0 HD3 PRO A 432 -29.756 3.186 -12.732 1.00 0.00 H new ATOM 1188 N ASP A 433 -30.299 6.144 -9.370 1.00 0.00 N ATOM 1189 CA ASP A 433 -30.145 6.857 -8.107 1.00 0.00 C ATOM 1190 C ASP A 433 -29.405 8.175 -8.315 1.00 0.00 C ATOM 1191 O ASP A 433 -29.728 9.186 -7.689 1.00 0.00 O ATOM 1192 CB ASP A 433 -29.394 5.990 -7.096 1.00 0.00 C ATOM 1193 CG ASP A 433 -30.312 5.040 -6.353 1.00 0.00 C ATOM 1194 OD1 ASP A 433 -31.275 4.540 -6.972 1.00 0.00 O ATOM 1195 OD2 ASP A 433 -30.068 4.795 -5.153 1.00 0.00 O ATOM 0 H ASP A 433 -29.948 5.187 -9.359 1.00 0.00 H new ATOM 0 HA ASP A 433 -31.139 7.076 -7.718 1.00 0.00 H new ATOM 0 HB2 ASP A 433 -28.625 5.417 -7.614 1.00 0.00 H new ATOM 0 HB3 ASP A 433 -28.884 6.633 -6.379 1.00 0.00 H new ATOM 1200 N HIS A 434 -28.410 8.157 -9.196 1.00 0.00 N ATOM 1201 CA HIS A 434 -27.623 9.351 -9.485 1.00 0.00 C ATOM 1202 C HIS A 434 -28.512 10.472 -10.016 1.00 0.00 C ATOM 1203 O HIS A 434 -28.205 11.653 -9.850 1.00 0.00 O ATOM 1204 CB HIS A 434 -26.526 9.031 -10.501 1.00 0.00 C ATOM 1205 CG HIS A 434 -25.475 8.103 -9.974 1.00 0.00 C ATOM 1206 ND1 HIS A 434 -24.153 8.165 -10.362 1.00 0.00 N ATOM 1207 CD2 HIS A 434 -25.556 7.087 -9.084 1.00 0.00 C ATOM 1208 CE1 HIS A 434 -23.468 7.227 -9.734 1.00 0.00 C ATOM 1209 NE2 HIS A 434 -24.296 6.559 -8.952 1.00 0.00 N ATOM 0 H HIS A 434 -28.129 7.329 -9.722 1.00 0.00 H new ATOM 0 HA HIS A 434 -27.161 9.685 -8.556 1.00 0.00 H new ATOM 0 HB2 HIS A 434 -26.981 8.587 -11.387 1.00 0.00 H new ATOM 0 HB3 HIS A 434 -26.053 9.961 -10.818 1.00 0.00 H new ATOM 0 HD2 HIS A 434 -26.447 6.753 -8.572 1.00 0.00 H new ATOM 0 HE1 HIS A 434 -22.410 7.038 -9.842 1.00 0.00 H new ATOM 0 HE2 HIS A 434 -24.041 5.778 -8.348 1.00 0.00 H new ATOM 1217 N LEU A 435 -29.614 10.094 -10.655 1.00 0.00 N ATOM 1218 CA LEU A 435 -30.548 11.068 -11.211 1.00 0.00 C ATOM 1219 C LEU A 435 -31.456 11.633 -10.124 1.00 0.00 C ATOM 1220 O LEU A 435 -31.826 12.806 -10.158 1.00 0.00 O ATOM 1221 CB LEU A 435 -31.391 10.424 -12.312 1.00 0.00 C ATOM 1222 CG LEU A 435 -32.491 11.299 -12.914 1.00 0.00 C ATOM 1223 CD1 LEU A 435 -31.889 12.517 -13.599 1.00 0.00 C ATOM 1224 CD2 LEU A 435 -33.335 10.497 -13.893 1.00 0.00 C ATOM 0 H LEU A 435 -29.883 9.121 -10.801 1.00 0.00 H new ATOM 0 HA LEU A 435 -29.969 11.887 -11.637 1.00 0.00 H new ATOM 0 HB2 LEU A 435 -30.724 10.109 -13.115 1.00 0.00 H new ATOM 0 HB3 LEU A 435 -31.852 9.522 -11.909 1.00 0.00 H new ATOM 0 HG LEU A 435 -33.137 11.644 -12.107 1.00 0.00 H new ATOM 0 HD11 LEU A 435 -32.687 13.128 -14.022 1.00 0.00 H new ATOM 0 HD12 LEU A 435 -31.329 13.104 -12.871 1.00 0.00 H new ATOM 0 HD13 LEU A 435 -31.220 12.193 -14.396 1.00 0.00 H new ATOM 0 HD21 LEU A 435 -34.113 11.136 -14.311 1.00 0.00 H new ATOM 0 HD22 LEU A 435 -32.702 10.122 -14.697 1.00 0.00 H new ATOM 0 HD23 LEU A 435 -33.796 9.657 -13.373 1.00 0.00 H new ATOM 1236 N ASN A 436 -31.811 10.790 -9.159 1.00 0.00 N ATOM 1237 CA ASN A 436 -32.675 11.206 -8.060 1.00 0.00 C ATOM 1238 C ASN A 436 -32.047 12.357 -7.280 1.00 0.00 C ATOM 1239 O ASN A 436 -32.715 13.337 -6.954 1.00 0.00 O ATOM 1240 CB ASN A 436 -32.946 10.027 -7.123 1.00 0.00 C ATOM 1241 CG ASN A 436 -33.510 10.469 -5.786 1.00 0.00 C ATOM 1242 OD1 ASN A 436 -34.722 10.623 -5.631 1.00 0.00 O ATOM 1243 ND2 ASN A 436 -32.631 10.677 -4.813 1.00 0.00 N ATOM 0 H ASN A 436 -31.514 9.815 -9.116 1.00 0.00 H new ATOM 0 HA ASN A 436 -33.619 11.550 -8.483 1.00 0.00 H new ATOM 0 HB2 ASN A 436 -33.645 9.340 -7.600 1.00 0.00 H new ATOM 0 HB3 ASN A 436 -32.020 9.476 -6.959 1.00 0.00 H new ATOM 0 HD21 ASN A 436 -32.951 10.977 -3.892 1.00 0.00 H new ATOM 0 HD22 ASN A 436 -31.636 10.537 -4.986 1.00 0.00 H new ATOM 1250 N GLY A 437 -30.757 12.229 -6.983 1.00 0.00 N ATOM 1251 CA GLY A 437 -30.060 13.266 -6.243 1.00 0.00 C ATOM 1252 C GLY A 437 -29.968 14.567 -7.016 1.00 0.00 C ATOM 1253 O GLY A 437 -30.022 15.649 -6.431 1.00 0.00 O ATOM 0 H GLY A 437 -30.183 11.427 -7.241 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -30.575 13.443 -5.299 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -29.056 12.921 -5.998 1.00 0.00 H new ATOM 1257 N HIS A 438 -29.828 14.462 -8.334 1.00 0.00 N ATOM 1258 CA HIS A 438 -29.727 15.640 -9.187 1.00 0.00 C ATOM 1259 C HIS A 438 -31.004 16.473 -9.118 1.00 0.00 C ATOM 1260 O HIS A 438 -30.961 17.701 -9.201 1.00 0.00 O ATOM 1261 CB HIS A 438 -29.453 15.226 -10.633 1.00 0.00 C ATOM 1262 CG HIS A 438 -29.602 16.347 -11.616 1.00 0.00 C ATOM 1263 ND1 HIS A 438 -28.530 17.053 -12.121 1.00 0.00 N ATOM 1264 CD2 HIS A 438 -30.706 16.882 -12.188 1.00 0.00 C ATOM 1265 CE1 HIS A 438 -28.968 17.974 -12.960 1.00 0.00 C ATOM 1266 NE2 HIS A 438 -30.285 17.891 -13.019 1.00 0.00 N ATOM 0 H HIS A 438 -29.782 13.574 -8.834 1.00 0.00 H new ATOM 0 HA HIS A 438 -28.897 16.248 -8.827 1.00 0.00 H new ATOM 0 HB2 HIS A 438 -28.442 14.825 -10.702 1.00 0.00 H new ATOM 0 HB3 HIS A 438 -30.134 14.421 -10.907 1.00 0.00 H new ATOM 0 HD1 HIS A 438 -27.552 16.889 -11.883 1.00 0.00 H new ATOM 0 HD2 HIS A 438 -31.727 16.573 -12.022 1.00 0.00 H new ATOM 0 HE1 HIS A 438 -28.354 18.676 -13.505 1.00 0.00 H new ATOM 1274 N ILE A 439 -32.137 15.797 -8.965 1.00 0.00 N ATOM 1275 CA ILE A 439 -33.425 16.475 -8.884 1.00 0.00 C ATOM 1276 C ILE A 439 -33.583 17.198 -7.551 1.00 0.00 C ATOM 1277 O ILE A 439 -34.285 18.205 -7.457 1.00 0.00 O ATOM 1278 CB ILE A 439 -34.593 15.487 -9.060 1.00 0.00 C ATOM 1279 CG1 ILE A 439 -34.486 14.771 -10.408 1.00 0.00 C ATOM 1280 CG2 ILE A 439 -35.925 16.214 -8.945 1.00 0.00 C ATOM 1281 CD1 ILE A 439 -35.318 13.511 -10.491 1.00 0.00 C ATOM 0 H ILE A 439 -32.190 14.781 -8.895 1.00 0.00 H new ATOM 0 HA ILE A 439 -33.450 17.203 -9.695 1.00 0.00 H new ATOM 0 HB ILE A 439 -34.539 14.740 -8.268 1.00 0.00 H new ATOM 0 HG12 ILE A 439 -34.796 15.454 -11.199 1.00 0.00 H new ATOM 0 HG13 ILE A 439 -33.442 14.520 -10.595 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -36.740 15.502 -9.072 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -36.001 16.681 -7.963 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -35.989 16.980 -9.718 1.00 0.00 H new ATOM 0 HD11 ILE A 439 -35.193 13.057 -11.474 1.00 0.00 H new ATOM 0 HD12 ILE A 439 -34.993 12.809 -9.723 1.00 0.00 H new ATOM 0 HD13 ILE A 439 -36.368 13.758 -10.336 1.00 0.00 H new ATOM 1293 N LYS A 440 -32.923 16.680 -6.521 1.00 0.00 N ATOM 1294 CA LYS A 440 -32.986 17.277 -5.192 1.00 0.00 C ATOM 1295 C LYS A 440 -31.859 18.286 -4.995 1.00 0.00 C ATOM 1296 O LYS A 440 -31.912 19.121 -4.093 1.00 0.00 O ATOM 1297 CB LYS A 440 -32.905 16.190 -4.118 1.00 0.00 C ATOM 1298 CG LYS A 440 -34.111 16.156 -3.195 1.00 0.00 C ATOM 1299 CD LYS A 440 -35.227 15.299 -3.768 1.00 0.00 C ATOM 1300 CE LYS A 440 -36.375 15.147 -2.782 1.00 0.00 C ATOM 1301 NZ LYS A 440 -36.593 13.724 -2.399 1.00 0.00 N ATOM 0 H LYS A 440 -32.338 15.847 -6.581 1.00 0.00 H new ATOM 0 HA LYS A 440 -33.938 17.800 -5.100 1.00 0.00 H new ATOM 0 HB2 LYS A 440 -32.801 15.219 -4.603 1.00 0.00 H new ATOM 0 HB3 LYS A 440 -32.006 16.346 -3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 440 -33.814 15.766 -2.221 1.00 0.00 H new ATOM 0 HG3 LYS A 440 -34.476 17.170 -3.034 1.00 0.00 H new ATOM 0 HD2 LYS A 440 -35.595 15.748 -4.690 1.00 0.00 H new ATOM 0 HD3 LYS A 440 -34.835 14.315 -4.027 1.00 0.00 H new ATOM 0 HE2 LYS A 440 -36.167 15.736 -1.889 1.00 0.00 H new ATOM 0 HE3 LYS A 440 -37.288 15.548 -3.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 440 -37.384 13.663 -1.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 440 -36.817 13.166 -3.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 440 -35.731 13.348 -1.955 1.00 0.00 H new ATOM 1315 N GLN A 441 -30.841 18.203 -5.846 1.00 0.00 N ATOM 1316 CA GLN A 441 -29.702 19.110 -5.765 1.00 0.00 C ATOM 1317 C GLN A 441 -29.881 20.295 -6.708 1.00 0.00 C ATOM 1318 O GLN A 441 -30.021 21.436 -6.269 1.00 0.00 O ATOM 1319 CB GLN A 441 -28.407 18.368 -6.099 1.00 0.00 C ATOM 1320 CG GLN A 441 -27.172 18.979 -5.457 1.00 0.00 C ATOM 1321 CD GLN A 441 -25.924 18.790 -6.296 1.00 0.00 C ATOM 1322 OE1 GLN A 441 -25.882 19.179 -7.464 1.00 0.00 O ATOM 1323 NE2 GLN A 441 -24.897 18.191 -5.704 1.00 0.00 N ATOM 0 H GLN A 441 -30.782 17.517 -6.599 1.00 0.00 H new ATOM 0 HA GLN A 441 -29.643 19.488 -4.744 1.00 0.00 H new ATOM 0 HB2 GLN A 441 -28.499 17.331 -5.776 1.00 0.00 H new ATOM 0 HB3 GLN A 441 -28.275 18.354 -7.181 1.00 0.00 H new ATOM 0 HG2 GLN A 441 -27.340 20.044 -5.297 1.00 0.00 H new ATOM 0 HG3 GLN A 441 -27.017 18.530 -4.476 1.00 0.00 H new ATOM 0 HE21 GLN A 441 -24.975 17.885 -4.734 1.00 0.00 H new ATOM 0 HE22 GLN A 441 -24.030 18.037 -6.219 1.00 0.00 H new ATOM 1332 N VAL A 442 -29.876 20.016 -8.008 1.00 0.00 N ATOM 1333 CA VAL A 442 -30.038 21.058 -9.014 1.00 0.00 C ATOM 1334 C VAL A 442 -31.445 21.645 -8.975 1.00 0.00 C ATOM 1335 O VAL A 442 -31.633 22.812 -8.630 1.00 0.00 O ATOM 1336 CB VAL A 442 -29.757 20.520 -10.430 1.00 0.00 C ATOM 1337 CG1 VAL A 442 -29.948 21.618 -11.466 1.00 0.00 C ATOM 1338 CG2 VAL A 442 -28.354 19.938 -10.510 1.00 0.00 C ATOM 0 H VAL A 442 -29.761 19.077 -8.389 1.00 0.00 H new ATOM 0 HA VAL A 442 -29.315 21.839 -8.780 1.00 0.00 H new ATOM 0 HB VAL A 442 -30.469 19.723 -10.645 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -29.745 21.220 -12.460 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -30.974 21.983 -11.424 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -29.262 22.439 -11.257 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -28.173 19.563 -11.517 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -27.625 20.713 -10.275 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -28.258 19.121 -9.795 1.00 0.00 H new ATOM 1348 N HIS A 443 -32.431 20.828 -9.331 1.00 0.00 N ATOM 1349 CA HIS A 443 -33.822 21.265 -9.336 1.00 0.00 C ATOM 1350 C HIS A 443 -34.433 21.150 -7.942 1.00 0.00 C ATOM 1351 O HIS A 443 -35.461 20.500 -7.756 1.00 0.00 O ATOM 1352 CB HIS A 443 -34.636 20.438 -10.332 1.00 0.00 C ATOM 1353 CG HIS A 443 -33.991 20.317 -11.678 1.00 0.00 C ATOM 1354 ND1 HIS A 443 -33.849 21.382 -12.542 1.00 0.00 N ATOM 1355 CD2 HIS A 443 -33.448 19.249 -12.307 1.00 0.00 C ATOM 1356 CE1 HIS A 443 -33.247 20.974 -13.645 1.00 0.00 C ATOM 1357 NE2 HIS A 443 -32.992 19.683 -13.527 1.00 0.00 N ATOM 0 H HIS A 443 -32.292 19.860 -9.620 1.00 0.00 H new ATOM 0 HA HIS A 443 -33.846 22.312 -9.639 1.00 0.00 H new ATOM 0 HB2 HIS A 443 -34.791 19.440 -9.922 1.00 0.00 H new ATOM 0 HB3 HIS A 443 -35.620 20.891 -10.449 1.00 0.00 H new ATOM 0 HD1 HIS A 443 -34.160 22.336 -12.358 1.00 0.00 H new ATOM 0 HD2 HIS A 443 -33.385 18.242 -11.921 1.00 0.00 H new ATOM 0 HE1 HIS A 443 -33.005 21.591 -14.498 1.00 0.00 H new