USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 583 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 Single : A 311 SER OG : rot 31:sc= 0.31 USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 317 HIS : no HD1:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 319 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 323 ASN : amide:sc= -0.993 K(o=-0.99,f=-7.1!) USER MOD Single : A 332 HIS : no HD1:sc= -1.07 K(o=-1.1,f=-5.9!) USER MOD Single : A 338 GLN : amide:sc=-0.000701 X(o=-0.0007,f=0) USER MOD Single : A 342 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 343 GLN : amide:sc= -1.59 K(o=-1.6,f=-3!) USER MOD Single : A 345 MET CE :methyl -137:sc= -0.181 (180deg=-1.72) USER MOD Single : A 351 MET CE :methyl -163:sc= -1.17 (180deg=-2.11!) USER MOD Single : A 354 HIS : no HD1:sc= -2.39 K(o=-2.4,f=-3.5!) USER MOD Single : A 356 TYR OH : rot 52:sc= 0.632 USER MOD Single : A 363 SER OG : rot -78:sc= 0.0948 USER MOD Single : A 364 SER OG : rot 180:sc= 0 USER MOD Single : A 367 SER OG : rot 100:sc= -0.842 USER MOD Single : A 372 TYR OH : rot 180:sc= -0.644 USER MOD Single : A 378 ASN : amide:sc= -0.222 K(o=-0.22,f=-2.5!) USER MOD Single : B 385 THR OG1 : rot 73:sc= 0.222 USER MOD Single : B 386 LYS NZ :NH3+ 169:sc= -3.06! (180deg=-3.37!) USER MOD Single : B 387 GLN : amide:sc= -6.38! C(o=-6.4!,f=-5.1!) USER MOD Single : B 388 THR OG1 : rot -84:sc= 0.0214 USER MOD Single : B 391 LYS NZ :NH3+ -159:sc= 1.09 (180deg=0.147) USER MOD Single : B 392 SER OG : rot 112:sc= 0.395 USER MOD Single : B 393 THR OG1 : rot -128:sc= -2.83! USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 311 2.899 11.653 -13.026 1.00 0.00 N ATOM 2 CA SER A 311 2.568 12.170 -14.384 1.00 0.00 C ATOM 3 C SER A 311 1.051 12.296 -14.528 1.00 0.00 C ATOM 4 O SER A 311 0.505 13.382 -14.518 1.00 0.00 O ATOM 5 CB SER A 311 3.100 11.203 -15.442 1.00 0.00 C ATOM 6 OG SER A 311 4.455 10.887 -15.150 1.00 0.00 O ATOM 0 HA SER A 311 3.028 13.149 -14.520 1.00 0.00 H new ATOM 0 HB2 SER A 311 2.498 10.295 -15.457 1.00 0.00 H new ATOM 0 HB3 SER A 311 3.024 11.652 -16.432 1.00 0.00 H new ATOM 0 HG SER A 311 4.594 10.909 -14.180 1.00 0.00 H new ATOM 14 N GLY A 312 0.370 11.191 -14.660 1.00 0.00 N ATOM 15 CA GLY A 312 -1.114 11.233 -14.805 1.00 0.00 C ATOM 16 C GLY A 312 -1.758 10.342 -13.738 1.00 0.00 C ATOM 17 O GLY A 312 -2.305 9.301 -14.043 1.00 0.00 O ATOM 0 H GLY A 312 0.779 10.257 -14.674 1.00 0.00 H new ATOM 0 HA2 GLY A 312 -1.471 12.258 -14.702 1.00 0.00 H new ATOM 0 HA3 GLY A 312 -1.402 10.893 -15.800 1.00 0.00 H new ATOM 21 N PRO A 313 -1.692 10.746 -12.496 1.00 0.00 N ATOM 22 CA PRO A 313 -2.278 9.969 -11.365 1.00 0.00 C ATOM 23 C PRO A 313 -3.804 10.059 -11.339 1.00 0.00 C ATOM 24 O PRO A 313 -4.473 9.256 -10.720 1.00 0.00 O ATOM 25 CB PRO A 313 -1.685 10.634 -10.125 1.00 0.00 C ATOM 26 CG PRO A 313 -1.414 12.039 -10.537 1.00 0.00 C ATOM 27 CD PRO A 313 -1.058 11.992 -12.025 1.00 0.00 C ATOM 0 HA PRO A 313 -2.051 8.906 -11.439 1.00 0.00 H new ATOM 0 HB2 PRO A 313 -2.379 10.595 -9.286 1.00 0.00 H new ATOM 0 HB3 PRO A 313 -0.771 10.132 -9.806 1.00 0.00 H new ATOM 0 HG2 PRO A 313 -2.287 12.669 -10.366 1.00 0.00 H new ATOM 0 HG3 PRO A 313 -0.596 12.463 -9.955 1.00 0.00 H new ATOM 0 HD2 PRO A 313 -1.442 12.863 -12.557 1.00 0.00 H new ATOM 0 HD3 PRO A 313 0.021 11.975 -12.178 1.00 0.00 H new ATOM 35 N SER A 314 -4.358 11.036 -12.003 1.00 0.00 N ATOM 36 CA SER A 314 -5.837 11.182 -12.012 1.00 0.00 C ATOM 37 C SER A 314 -6.461 9.980 -12.720 1.00 0.00 C ATOM 38 O SER A 314 -5.965 9.512 -13.725 1.00 0.00 O ATOM 39 CB SER A 314 -6.219 12.464 -12.751 1.00 0.00 C ATOM 40 OG SER A 314 -7.622 12.670 -12.643 1.00 0.00 O ATOM 0 H SER A 314 -3.849 11.738 -12.539 1.00 0.00 H new ATOM 0 HA SER A 314 -6.204 11.232 -10.987 1.00 0.00 H new ATOM 0 HB2 SER A 314 -5.682 13.314 -12.330 1.00 0.00 H new ATOM 0 HB3 SER A 314 -5.930 12.392 -13.800 1.00 0.00 H new ATOM 0 HG SER A 314 -7.869 13.493 -13.115 1.00 0.00 H new ATOM 46 N CYS A 315 -7.546 9.480 -12.197 1.00 0.00 N ATOM 47 CA CYS A 315 -8.215 8.306 -12.830 1.00 0.00 C ATOM 48 C CYS A 315 -9.613 8.710 -13.302 1.00 0.00 C ATOM 49 O CYS A 315 -10.578 8.613 -12.570 1.00 0.00 O ATOM 50 CB CYS A 315 -8.332 7.179 -11.800 1.00 0.00 C ATOM 51 SG CYS A 315 -9.218 5.774 -12.525 1.00 0.00 S ATOM 0 H CYS A 315 -8.001 9.834 -11.355 1.00 0.00 H new ATOM 0 HA CYS A 315 -7.629 7.965 -13.683 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -7.340 6.866 -11.475 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -8.859 7.536 -10.915 1.00 0.00 H new ATOM 56 N LYS A 316 -9.731 9.159 -14.522 1.00 0.00 N ATOM 57 CA LYS A 316 -11.068 9.561 -15.040 1.00 0.00 C ATOM 58 C LYS A 316 -11.976 8.333 -15.101 1.00 0.00 C ATOM 59 O LYS A 316 -13.174 8.421 -14.915 1.00 0.00 O ATOM 60 CB LYS A 316 -10.915 10.167 -16.435 1.00 0.00 C ATOM 61 CG LYS A 316 -10.493 9.075 -17.409 1.00 0.00 C ATOM 62 CD LYS A 316 -10.169 9.697 -18.769 1.00 0.00 C ATOM 63 CE LYS A 316 -10.059 8.593 -19.822 1.00 0.00 C ATOM 64 NZ LYS A 316 -9.511 9.163 -21.085 1.00 0.00 N ATOM 0 H LYS A 316 -8.960 9.264 -15.181 1.00 0.00 H new ATOM 0 HA LYS A 316 -11.511 10.304 -14.377 1.00 0.00 H new ATOM 0 HB2 LYS A 316 -11.856 10.614 -16.756 1.00 0.00 H new ATOM 0 HB3 LYS A 316 -10.172 10.964 -16.419 1.00 0.00 H new ATOM 0 HG2 LYS A 316 -9.622 8.546 -17.023 1.00 0.00 H new ATOM 0 HG3 LYS A 316 -11.291 8.340 -17.515 1.00 0.00 H new ATOM 0 HD2 LYS A 316 -10.947 10.407 -19.051 1.00 0.00 H new ATOM 0 HD3 LYS A 316 -9.234 10.255 -18.712 1.00 0.00 H new ATOM 0 HE2 LYS A 316 -9.412 7.794 -19.460 1.00 0.00 H new ATOM 0 HE3 LYS A 316 -11.039 8.151 -20.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 -9.436 8.412 -21.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 -10.145 9.911 -21.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 -8.569 9.564 -20.905 1.00 0.00 H new ATOM 78 N HIS A 317 -11.411 7.186 -15.356 1.00 0.00 N ATOM 79 CA HIS A 317 -12.230 5.946 -15.425 1.00 0.00 C ATOM 80 C HIS A 317 -12.920 5.737 -14.083 1.00 0.00 C ATOM 81 O HIS A 317 -14.064 5.336 -14.009 1.00 0.00 O ATOM 82 CB HIS A 317 -11.322 4.750 -15.723 1.00 0.00 C ATOM 83 CG HIS A 317 -12.166 3.544 -16.030 1.00 0.00 C ATOM 84 ND1 HIS A 317 -12.475 2.592 -15.066 1.00 0.00 N ATOM 85 CD2 HIS A 317 -12.775 3.119 -17.185 1.00 0.00 C ATOM 86 CE1 HIS A 317 -13.237 1.652 -15.655 1.00 0.00 C ATOM 87 NE2 HIS A 317 -13.448 1.927 -16.943 1.00 0.00 N ATOM 0 H HIS A 317 -10.413 7.055 -15.520 1.00 0.00 H new ATOM 0 HA HIS A 317 -12.975 6.038 -16.215 1.00 0.00 H new ATOM 0 HB2 HIS A 317 -10.671 4.976 -16.567 1.00 0.00 H new ATOM 0 HB3 HIS A 317 -10.677 4.548 -14.868 1.00 0.00 H new ATOM 0 HD2 HIS A 317 -12.737 3.632 -18.135 1.00 0.00 H new ATOM 0 HE1 HIS A 317 -13.629 0.783 -15.148 1.00 0.00 H new ATOM 0 HE2 HIS A 317 -13.990 1.378 -17.610 1.00 0.00 H new ATOM 96 N CYS A 318 -12.226 6.018 -13.019 1.00 0.00 N ATOM 97 CA CYS A 318 -12.823 5.853 -11.674 1.00 0.00 C ATOM 98 C CYS A 318 -12.098 6.784 -10.703 1.00 0.00 C ATOM 99 O CYS A 318 -10.913 6.671 -10.468 1.00 0.00 O ATOM 100 CB CYS A 318 -12.701 4.388 -11.236 1.00 0.00 C ATOM 101 SG CYS A 318 -11.457 4.218 -9.933 1.00 0.00 S ATOM 0 H CYS A 318 -11.264 6.357 -13.026 1.00 0.00 H new ATOM 0 HA CYS A 318 -13.882 6.112 -11.688 1.00 0.00 H new ATOM 0 HB2 CYS A 318 -13.665 4.028 -10.876 1.00 0.00 H new ATOM 0 HB3 CYS A 318 -12.429 3.768 -12.090 1.00 0.00 H new ATOM 106 N LYS A 319 -12.804 7.730 -10.167 1.00 0.00 N ATOM 107 CA LYS A 319 -12.183 8.704 -9.233 1.00 0.00 C ATOM 108 C LYS A 319 -11.987 8.057 -7.864 1.00 0.00 C ATOM 109 O LYS A 319 -11.581 8.700 -6.917 1.00 0.00 O ATOM 110 CB LYS A 319 -13.108 9.906 -9.109 1.00 0.00 C ATOM 111 CG LYS A 319 -13.345 10.478 -10.503 1.00 0.00 C ATOM 112 CD LYS A 319 -14.386 11.592 -10.436 1.00 0.00 C ATOM 113 CE LYS A 319 -13.831 12.767 -9.627 1.00 0.00 C ATOM 114 NZ LYS A 319 -14.172 14.046 -10.311 1.00 0.00 N ATOM 0 H LYS A 319 -13.799 7.874 -10.337 1.00 0.00 H new ATOM 0 HA LYS A 319 -11.210 9.018 -9.612 1.00 0.00 H new ATOM 0 HB2 LYS A 319 -14.054 9.611 -8.654 1.00 0.00 H new ATOM 0 HB3 LYS A 319 -12.664 10.661 -8.460 1.00 0.00 H new ATOM 0 HG2 LYS A 319 -12.411 10.865 -10.911 1.00 0.00 H new ATOM 0 HG3 LYS A 319 -13.685 9.691 -11.176 1.00 0.00 H new ATOM 0 HD2 LYS A 319 -14.646 11.921 -11.442 1.00 0.00 H new ATOM 0 HD3 LYS A 319 -15.301 11.221 -9.975 1.00 0.00 H new ATOM 0 HE2 LYS A 319 -14.248 12.758 -8.620 1.00 0.00 H new ATOM 0 HE3 LYS A 319 -12.750 12.674 -9.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 319 -13.795 14.845 -9.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 319 -13.754 14.053 -11.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 319 -15.205 14.135 -10.386 1.00 0.00 H new ATOM 128 N ASP A 320 -12.279 6.792 -7.755 1.00 0.00 N ATOM 129 CA ASP A 320 -12.115 6.093 -6.450 1.00 0.00 C ATOM 130 C ASP A 320 -12.931 6.806 -5.370 1.00 0.00 C ATOM 131 O ASP A 320 -12.430 7.111 -4.307 1.00 0.00 O ATOM 132 CB ASP A 320 -10.639 6.085 -6.042 1.00 0.00 C ATOM 133 CG ASP A 320 -9.822 5.289 -7.057 1.00 0.00 C ATOM 134 OD1 ASP A 320 -10.340 4.311 -7.568 1.00 0.00 O ATOM 135 OD2 ASP A 320 -8.690 5.670 -7.304 1.00 0.00 O ATOM 0 H ASP A 320 -12.626 6.209 -8.517 1.00 0.00 H new ATOM 0 HA ASP A 320 -12.468 5.067 -6.556 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -10.264 7.107 -5.982 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -10.530 5.646 -5.050 1.00 0.00 H new ATOM 140 N ASP A 321 -14.180 7.077 -5.627 1.00 0.00 N ATOM 141 CA ASP A 321 -15.007 7.770 -4.601 1.00 0.00 C ATOM 142 C ASP A 321 -14.936 6.989 -3.288 1.00 0.00 C ATOM 143 O ASP A 321 -14.857 7.560 -2.221 1.00 0.00 O ATOM 144 CB ASP A 321 -16.459 7.845 -5.076 1.00 0.00 C ATOM 145 CG ASP A 321 -17.252 8.771 -4.151 1.00 0.00 C ATOM 146 OD1 ASP A 321 -16.643 9.371 -3.281 1.00 0.00 O ATOM 147 OD2 ASP A 321 -18.456 8.865 -4.330 1.00 0.00 O ATOM 0 H ASP A 321 -14.661 6.850 -6.497 1.00 0.00 H new ATOM 0 HA ASP A 321 -14.628 8.780 -4.447 1.00 0.00 H new ATOM 0 HB2 ASP A 321 -16.499 8.216 -6.100 1.00 0.00 H new ATOM 0 HB3 ASP A 321 -16.903 6.850 -5.080 1.00 0.00 H new ATOM 152 N VAL A 322 -14.953 5.686 -3.367 1.00 0.00 N ATOM 153 CA VAL A 322 -14.874 4.841 -2.137 1.00 0.00 C ATOM 154 C VAL A 322 -15.246 3.405 -2.499 1.00 0.00 C ATOM 155 O VAL A 322 -14.559 2.468 -2.141 1.00 0.00 O ATOM 156 CB VAL A 322 -15.831 5.380 -1.051 1.00 0.00 C ATOM 157 CG1 VAL A 322 -16.686 4.244 -0.470 1.00 0.00 C ATOM 158 CG2 VAL A 322 -15.019 6.008 0.089 1.00 0.00 C ATOM 0 H VAL A 322 -15.019 5.164 -4.241 1.00 0.00 H new ATOM 0 HA VAL A 322 -13.859 4.870 -1.741 1.00 0.00 H new ATOM 0 HB VAL A 322 -16.481 6.125 -1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 322 -17.353 4.645 0.293 1.00 0.00 H new ATOM 0 HG12 VAL A 322 -17.276 3.789 -1.266 1.00 0.00 H new ATOM 0 HG13 VAL A 322 -16.036 3.491 -0.025 1.00 0.00 H new ATOM 0 HG21 VAL A 322 -15.698 6.387 0.853 1.00 0.00 H new ATOM 0 HG22 VAL A 322 -14.364 5.255 0.527 1.00 0.00 H new ATOM 0 HG23 VAL A 322 -14.418 6.829 -0.302 1.00 0.00 H new ATOM 168 N ASN A 323 -16.333 3.222 -3.197 1.00 0.00 N ATOM 169 CA ASN A 323 -16.754 1.845 -3.570 1.00 0.00 C ATOM 170 C ASN A 323 -16.423 1.567 -5.039 1.00 0.00 C ATOM 171 O ASN A 323 -16.806 0.550 -5.584 1.00 0.00 O ATOM 172 CB ASN A 323 -18.259 1.687 -3.338 1.00 0.00 C ATOM 173 CG ASN A 323 -19.030 2.512 -4.369 1.00 0.00 C ATOM 174 OD1 ASN A 323 -18.520 3.484 -4.888 1.00 0.00 O ATOM 175 ND2 ASN A 323 -20.246 2.164 -4.688 1.00 0.00 N ATOM 0 H ASN A 323 -16.947 3.968 -3.525 1.00 0.00 H new ATOM 0 HA ASN A 323 -16.214 1.130 -2.949 1.00 0.00 H new ATOM 0 HB2 ASN A 323 -18.540 0.637 -3.415 1.00 0.00 H new ATOM 0 HB3 ASN A 323 -18.517 2.013 -2.331 1.00 0.00 H new ATOM 0 HD21 ASN A 323 -20.769 2.709 -5.374 1.00 0.00 H new ATOM 0 HD22 ASN A 323 -20.674 1.347 -4.252 1.00 0.00 H new ATOM 182 N ARG A 324 -15.711 2.453 -5.683 1.00 0.00 N ATOM 183 CA ARG A 324 -15.351 2.228 -7.114 1.00 0.00 C ATOM 184 C ARG A 324 -13.846 1.989 -7.224 1.00 0.00 C ATOM 185 O ARG A 324 -13.081 2.908 -7.442 1.00 0.00 O ATOM 186 CB ARG A 324 -15.724 3.463 -7.940 1.00 0.00 C ATOM 187 CG ARG A 324 -17.239 3.661 -7.914 1.00 0.00 C ATOM 188 CD ARG A 324 -17.619 4.812 -8.849 1.00 0.00 C ATOM 189 NE ARG A 324 -19.056 5.155 -8.655 1.00 0.00 N ATOM 190 CZ ARG A 324 -19.428 5.840 -7.609 1.00 0.00 C ATOM 191 NH1 ARG A 324 -18.540 6.227 -6.734 1.00 0.00 N ATOM 192 NH2 ARG A 324 -20.687 6.138 -7.437 1.00 0.00 N ATOM 0 H ARG A 324 -15.363 3.323 -5.280 1.00 0.00 H new ATOM 0 HA ARG A 324 -15.893 1.361 -7.491 1.00 0.00 H new ATOM 0 HB2 ARG A 324 -15.225 4.345 -7.539 1.00 0.00 H new ATOM 0 HB3 ARG A 324 -15.381 3.343 -8.968 1.00 0.00 H new ATOM 0 HG2 ARG A 324 -17.742 2.745 -8.224 1.00 0.00 H new ATOM 0 HG3 ARG A 324 -17.571 3.878 -6.899 1.00 0.00 H new ATOM 0 HD2 ARG A 324 -16.995 5.682 -8.644 1.00 0.00 H new ATOM 0 HD3 ARG A 324 -17.439 4.527 -9.886 1.00 0.00 H new ATOM 0 HE ARG A 324 -19.749 4.854 -9.340 1.00 0.00 H new ATOM 0 HH11 ARG A 324 -17.556 5.994 -6.868 1.00 0.00 H new ATOM 0 HH12 ARG A 324 -18.830 6.763 -5.916 1.00 0.00 H new ATOM 0 HH21 ARG A 324 -21.381 5.835 -8.121 1.00 0.00 H new ATOM 0 HH22 ARG A 324 -20.977 6.674 -6.619 1.00 0.00 H new ATOM 206 N LEU A 325 -13.408 0.764 -7.083 1.00 0.00 N ATOM 207 CA LEU A 325 -11.954 0.483 -7.190 1.00 0.00 C ATOM 208 C LEU A 325 -11.661 -0.137 -8.553 1.00 0.00 C ATOM 209 O LEU A 325 -12.070 -1.243 -8.843 1.00 0.00 O ATOM 210 CB LEU A 325 -11.541 -0.487 -6.078 1.00 0.00 C ATOM 211 CG LEU A 325 -10.700 0.251 -5.033 1.00 0.00 C ATOM 212 CD1 LEU A 325 -10.681 -0.553 -3.732 1.00 0.00 C ATOM 213 CD2 LEU A 325 -9.269 0.415 -5.551 1.00 0.00 C ATOM 0 H LEU A 325 -13.996 -0.049 -6.899 1.00 0.00 H new ATOM 0 HA LEU A 325 -11.390 1.410 -7.086 1.00 0.00 H new ATOM 0 HB2 LEU A 325 -12.427 -0.915 -5.609 1.00 0.00 H new ATOM 0 HB3 LEU A 325 -10.971 -1.315 -6.498 1.00 0.00 H new ATOM 0 HG LEU A 325 -11.134 1.233 -4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 325 -10.082 -0.027 -2.988 1.00 0.00 H new ATOM 0 HD12 LEU A 325 -11.699 -0.670 -3.361 1.00 0.00 H new ATOM 0 HD13 LEU A 325 -10.248 -1.536 -3.918 1.00 0.00 H new ATOM 0 HD21 LEU A 325 -8.671 0.940 -4.807 1.00 0.00 H new ATOM 0 HD22 LEU A 325 -8.835 -0.567 -5.738 1.00 0.00 H new ATOM 0 HD23 LEU A 325 -9.281 0.989 -6.478 1.00 0.00 H new ATOM 225 N CYS A 326 -10.951 0.563 -9.393 1.00 0.00 N ATOM 226 CA CYS A 326 -10.633 0.004 -10.731 1.00 0.00 C ATOM 227 C CYS A 326 -9.242 -0.624 -10.685 1.00 0.00 C ATOM 228 O CYS A 326 -8.505 -0.453 -9.736 1.00 0.00 O ATOM 229 CB CYS A 326 -10.682 1.113 -11.782 1.00 0.00 C ATOM 230 SG CYS A 326 -9.115 2.011 -11.796 1.00 0.00 S ATOM 0 H CYS A 326 -10.579 1.495 -9.209 1.00 0.00 H new ATOM 0 HA CYS A 326 -11.366 -0.757 -11.000 1.00 0.00 H new ATOM 0 HB2 CYS A 326 -10.876 0.686 -12.766 1.00 0.00 H new ATOM 0 HB3 CYS A 326 -11.502 1.797 -11.564 1.00 0.00 H new ATOM 235 N ARG A 327 -8.886 -1.371 -11.688 1.00 0.00 N ATOM 236 CA ARG A 327 -7.555 -2.038 -11.686 1.00 0.00 C ATOM 237 C ARG A 327 -6.431 -1.006 -11.531 1.00 0.00 C ATOM 238 O ARG A 327 -5.452 -1.252 -10.855 1.00 0.00 O ATOM 239 CB ARG A 327 -7.385 -2.806 -12.995 1.00 0.00 C ATOM 240 CG ARG A 327 -8.449 -3.904 -13.063 1.00 0.00 C ATOM 241 CD ARG A 327 -8.274 -4.722 -14.341 1.00 0.00 C ATOM 242 NE ARG A 327 -9.412 -5.675 -14.475 1.00 0.00 N ATOM 243 CZ ARG A 327 -9.594 -6.321 -15.593 1.00 0.00 C ATOM 244 NH1 ARG A 327 -8.780 -6.134 -16.596 1.00 0.00 N ATOM 245 NH2 ARG A 327 -10.591 -7.155 -15.709 1.00 0.00 N ATOM 0 H ARG A 327 -9.460 -1.550 -12.512 1.00 0.00 H new ATOM 0 HA ARG A 327 -7.499 -2.726 -10.843 1.00 0.00 H new ATOM 0 HB2 ARG A 327 -7.485 -2.131 -13.845 1.00 0.00 H new ATOM 0 HB3 ARG A 327 -6.388 -3.243 -13.050 1.00 0.00 H new ATOM 0 HG2 ARG A 327 -8.369 -4.554 -12.192 1.00 0.00 H new ATOM 0 HG3 ARG A 327 -9.444 -3.460 -13.039 1.00 0.00 H new ATOM 0 HD2 ARG A 327 -8.234 -4.061 -15.207 1.00 0.00 H new ATOM 0 HD3 ARG A 327 -7.330 -5.266 -14.312 1.00 0.00 H new ATOM 0 HE ARG A 327 -10.049 -5.822 -13.692 1.00 0.00 H new ATOM 0 HH11 ARG A 327 -8.001 -5.482 -16.506 1.00 0.00 H new ATOM 0 HH12 ARG A 327 -8.923 -6.640 -17.470 1.00 0.00 H new ATOM 0 HH21 ARG A 327 -11.227 -7.301 -14.925 1.00 0.00 H new ATOM 0 HH22 ARG A 327 -10.734 -7.661 -16.583 1.00 0.00 H new ATOM 259 N VAL A 328 -6.559 0.143 -12.131 1.00 0.00 N ATOM 260 CA VAL A 328 -5.484 1.168 -11.985 1.00 0.00 C ATOM 261 C VAL A 328 -5.414 1.600 -10.522 1.00 0.00 C ATOM 262 O VAL A 328 -4.350 1.776 -9.963 1.00 0.00 O ATOM 263 CB VAL A 328 -5.788 2.379 -12.872 1.00 0.00 C ATOM 264 CG1 VAL A 328 -4.851 3.529 -12.506 1.00 0.00 C ATOM 265 CG2 VAL A 328 -5.577 1.999 -14.339 1.00 0.00 C ATOM 0 H VAL A 328 -7.352 0.417 -12.711 1.00 0.00 H new ATOM 0 HA VAL A 328 -4.528 0.744 -12.293 1.00 0.00 H new ATOM 0 HB VAL A 328 -6.821 2.691 -12.720 1.00 0.00 H new ATOM 0 HG11 VAL A 328 -5.068 4.390 -13.138 1.00 0.00 H new ATOM 0 HG12 VAL A 328 -4.998 3.800 -11.460 1.00 0.00 H new ATOM 0 HG13 VAL A 328 -3.817 3.219 -12.658 1.00 0.00 H new ATOM 0 HG21 VAL A 328 -5.793 2.859 -14.972 1.00 0.00 H new ATOM 0 HG22 VAL A 328 -4.543 1.688 -14.489 1.00 0.00 H new ATOM 0 HG23 VAL A 328 -6.245 1.178 -14.602 1.00 0.00 H new ATOM 275 N CYS A 329 -6.546 1.756 -9.896 1.00 0.00 N ATOM 276 CA CYS A 329 -6.561 2.160 -8.464 1.00 0.00 C ATOM 277 C CYS A 329 -6.732 0.908 -7.606 1.00 0.00 C ATOM 278 O CYS A 329 -6.893 0.982 -6.406 1.00 0.00 O ATOM 279 CB CYS A 329 -7.731 3.112 -8.205 1.00 0.00 C ATOM 280 SG CYS A 329 -7.693 4.460 -9.410 1.00 0.00 S ATOM 0 H CYS A 329 -7.465 1.620 -10.317 1.00 0.00 H new ATOM 0 HA CYS A 329 -5.628 2.665 -8.215 1.00 0.00 H new ATOM 0 HB2 CYS A 329 -8.675 2.572 -8.277 1.00 0.00 H new ATOM 0 HB3 CYS A 329 -7.670 3.513 -7.193 1.00 0.00 H new ATOM 285 N ALA A 330 -6.716 -0.243 -8.219 1.00 0.00 N ATOM 286 CA ALA A 330 -6.897 -1.502 -7.443 1.00 0.00 C ATOM 287 C ALA A 330 -5.862 -2.539 -7.880 1.00 0.00 C ATOM 288 O ALA A 330 -4.690 -2.248 -8.014 1.00 0.00 O ATOM 289 CB ALA A 330 -8.298 -2.049 -7.704 1.00 0.00 C ATOM 0 H ALA A 330 -6.586 -0.366 -9.223 1.00 0.00 H new ATOM 0 HA ALA A 330 -6.767 -1.294 -6.381 1.00 0.00 H new ATOM 0 HB1 ALA A 330 -8.440 -2.971 -7.140 1.00 0.00 H new ATOM 0 HB2 ALA A 330 -9.040 -1.314 -7.391 1.00 0.00 H new ATOM 0 HB3 ALA A 330 -8.417 -2.253 -8.768 1.00 0.00 H new ATOM 295 N CYS A 331 -6.293 -3.751 -8.103 1.00 0.00 N ATOM 296 CA CYS A 331 -5.346 -4.816 -8.531 1.00 0.00 C ATOM 297 C CYS A 331 -5.180 -4.762 -10.048 1.00 0.00 C ATOM 298 O CYS A 331 -6.120 -4.527 -10.778 1.00 0.00 O ATOM 299 CB CYS A 331 -5.901 -6.181 -8.125 1.00 0.00 C ATOM 300 SG CYS A 331 -4.725 -7.012 -7.027 1.00 0.00 S ATOM 0 H CYS A 331 -7.264 -4.049 -8.006 1.00 0.00 H new ATOM 0 HA CYS A 331 -4.379 -4.662 -8.053 1.00 0.00 H new ATOM 0 HB2 CYS A 331 -6.860 -6.060 -7.622 1.00 0.00 H new ATOM 0 HB3 CYS A 331 -6.080 -6.790 -9.011 1.00 0.00 H new ATOM 305 N HIS A 332 -3.989 -4.971 -10.527 1.00 0.00 N ATOM 306 CA HIS A 332 -3.760 -4.919 -11.997 1.00 0.00 C ATOM 307 C HIS A 332 -4.716 -5.874 -12.719 1.00 0.00 C ATOM 308 O HIS A 332 -5.140 -5.604 -13.824 1.00 0.00 O ATOM 309 CB HIS A 332 -2.312 -5.317 -12.301 1.00 0.00 C ATOM 310 CG HIS A 332 -2.056 -5.185 -13.777 1.00 0.00 C ATOM 311 ND1 HIS A 332 -2.226 -6.245 -14.656 1.00 0.00 N ATOM 312 CD2 HIS A 332 -1.641 -4.124 -14.546 1.00 0.00 C ATOM 313 CE1 HIS A 332 -1.918 -5.804 -15.890 1.00 0.00 C ATOM 314 NE2 HIS A 332 -1.556 -4.520 -15.875 1.00 0.00 N ATOM 0 H HIS A 332 -3.163 -5.176 -9.965 1.00 0.00 H new ATOM 0 HA HIS A 332 -3.945 -3.904 -12.348 1.00 0.00 H new ATOM 0 HB2 HIS A 332 -1.624 -4.682 -11.743 1.00 0.00 H new ATOM 0 HB3 HIS A 332 -2.130 -6.343 -11.980 1.00 0.00 H new ATOM 0 HD2 HIS A 332 -1.416 -3.135 -14.175 1.00 0.00 H new ATOM 0 HE1 HIS A 332 -1.959 -6.413 -16.781 1.00 0.00 H new ATOM 0 HE2 HIS A 332 -1.276 -3.949 -16.672 1.00 0.00 H new ATOM 323 N LEU A 333 -5.044 -6.995 -12.121 1.00 0.00 N ATOM 324 CA LEU A 333 -5.957 -7.964 -12.805 1.00 0.00 C ATOM 325 C LEU A 333 -7.191 -8.277 -11.946 1.00 0.00 C ATOM 326 O LEU A 333 -8.292 -8.382 -12.450 1.00 0.00 O ATOM 327 CB LEU A 333 -5.196 -9.266 -13.068 1.00 0.00 C ATOM 328 CG LEU A 333 -3.928 -8.972 -13.872 1.00 0.00 C ATOM 329 CD1 LEU A 333 -3.167 -10.276 -14.120 1.00 0.00 C ATOM 330 CD2 LEU A 333 -4.308 -8.348 -15.216 1.00 0.00 C ATOM 0 H LEU A 333 -4.722 -7.279 -11.196 1.00 0.00 H new ATOM 0 HA LEU A 333 -6.293 -7.514 -13.739 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -4.936 -9.743 -12.123 1.00 0.00 H new ATOM 0 HB3 LEU A 333 -5.830 -9.965 -13.614 1.00 0.00 H new ATOM 0 HG LEU A 333 -3.298 -8.281 -13.312 1.00 0.00 H new ATOM 0 HD11 LEU A 333 -2.264 -10.067 -14.693 1.00 0.00 H new ATOM 0 HD12 LEU A 333 -2.895 -10.726 -13.165 1.00 0.00 H new ATOM 0 HD13 LEU A 333 -3.799 -10.966 -14.679 1.00 0.00 H new ATOM 0 HD21 LEU A 333 -3.404 -8.139 -15.788 1.00 0.00 H new ATOM 0 HD22 LEU A 333 -4.938 -9.041 -15.774 1.00 0.00 H new ATOM 0 HD23 LEU A 333 -4.852 -7.419 -15.045 1.00 0.00 H new ATOM 342 N CYS A 334 -7.017 -8.468 -10.668 1.00 0.00 N ATOM 343 CA CYS A 334 -8.186 -8.821 -9.802 1.00 0.00 C ATOM 344 C CYS A 334 -9.216 -7.685 -9.758 1.00 0.00 C ATOM 345 O CYS A 334 -10.353 -7.858 -10.149 1.00 0.00 O ATOM 346 CB CYS A 334 -7.696 -9.124 -8.384 1.00 0.00 C ATOM 347 SG CYS A 334 -6.248 -10.206 -8.472 1.00 0.00 S ATOM 0 H CYS A 334 -6.122 -8.396 -10.184 1.00 0.00 H new ATOM 0 HA CYS A 334 -8.671 -9.700 -10.227 1.00 0.00 H new ATOM 0 HB2 CYS A 334 -7.442 -8.198 -7.869 1.00 0.00 H new ATOM 0 HB3 CYS A 334 -8.488 -9.602 -7.807 1.00 0.00 H new ATOM 352 N GLY A 335 -8.843 -6.534 -9.273 1.00 0.00 N ATOM 353 CA GLY A 335 -9.825 -5.409 -9.195 1.00 0.00 C ATOM 354 C GLY A 335 -10.822 -5.688 -8.075 1.00 0.00 C ATOM 355 O GLY A 335 -11.989 -5.366 -8.172 1.00 0.00 O ATOM 0 H GLY A 335 -7.907 -6.321 -8.928 1.00 0.00 H new ATOM 0 HA2 GLY A 335 -9.305 -4.469 -9.009 1.00 0.00 H new ATOM 0 HA3 GLY A 335 -10.348 -5.301 -10.145 1.00 0.00 H new ATOM 359 N GLY A 336 -10.362 -6.279 -7.009 1.00 0.00 N ATOM 360 CA GLY A 336 -11.267 -6.580 -5.866 1.00 0.00 C ATOM 361 C GLY A 336 -10.623 -6.065 -4.582 1.00 0.00 C ATOM 362 O GLY A 336 -9.445 -5.769 -4.545 1.00 0.00 O ATOM 0 H GLY A 336 -9.392 -6.568 -6.880 1.00 0.00 H new ATOM 0 HA2 GLY A 336 -12.237 -6.107 -6.018 1.00 0.00 H new ATOM 0 HA3 GLY A 336 -11.443 -7.653 -5.796 1.00 0.00 H new ATOM 366 N ARG A 337 -11.378 -5.948 -3.529 1.00 0.00 N ATOM 367 CA ARG A 337 -10.794 -5.445 -2.259 1.00 0.00 C ATOM 368 C ARG A 337 -10.276 -6.621 -1.425 1.00 0.00 C ATOM 369 O ARG A 337 -10.417 -6.648 -0.219 1.00 0.00 O ATOM 370 CB ARG A 337 -11.860 -4.688 -1.464 1.00 0.00 C ATOM 371 CG ARG A 337 -13.017 -5.633 -1.130 1.00 0.00 C ATOM 372 CD ARG A 337 -14.150 -4.843 -0.473 1.00 0.00 C ATOM 373 NE ARG A 337 -15.265 -5.768 -0.126 1.00 0.00 N ATOM 374 CZ ARG A 337 -16.010 -6.275 -1.071 1.00 0.00 C ATOM 375 NH1 ARG A 337 -15.776 -5.973 -2.319 1.00 0.00 N ATOM 376 NH2 ARG A 337 -16.988 -7.084 -0.768 1.00 0.00 N ATOM 0 H ARG A 337 -12.371 -6.178 -3.493 1.00 0.00 H new ATOM 0 HA ARG A 337 -9.968 -4.773 -2.489 1.00 0.00 H new ATOM 0 HB2 ARG A 337 -11.428 -4.287 -0.547 1.00 0.00 H new ATOM 0 HB3 ARG A 337 -12.225 -3.839 -2.042 1.00 0.00 H new ATOM 0 HG2 ARG A 337 -13.377 -6.119 -2.037 1.00 0.00 H new ATOM 0 HG3 ARG A 337 -12.674 -6.422 -0.461 1.00 0.00 H new ATOM 0 HD2 ARG A 337 -13.786 -4.343 0.424 1.00 0.00 H new ATOM 0 HD3 ARG A 337 -14.505 -4.066 -1.149 1.00 0.00 H new ATOM 0 HE ARG A 337 -15.446 -6.005 0.849 1.00 0.00 H new ATOM 0 HH11 ARG A 337 -15.011 -5.341 -2.556 1.00 0.00 H new ATOM 0 HH12 ARG A 337 -16.358 -6.369 -3.057 1.00 0.00 H new ATOM 0 HH21 ARG A 337 -17.171 -7.320 0.207 1.00 0.00 H new ATOM 0 HH22 ARG A 337 -17.570 -7.480 -1.506 1.00 0.00 H new ATOM 390 N GLN A 338 -9.681 -7.595 -2.056 1.00 0.00 N ATOM 391 CA GLN A 338 -9.165 -8.766 -1.293 1.00 0.00 C ATOM 392 C GLN A 338 -8.187 -8.297 -0.214 1.00 0.00 C ATOM 393 O GLN A 338 -8.148 -8.837 0.874 1.00 0.00 O ATOM 394 CB GLN A 338 -8.449 -9.722 -2.250 1.00 0.00 C ATOM 395 CG GLN A 338 -9.453 -10.281 -3.260 1.00 0.00 C ATOM 396 CD GLN A 338 -8.762 -11.318 -4.148 1.00 0.00 C ATOM 397 OE1 GLN A 338 -8.555 -12.443 -3.738 1.00 0.00 O ATOM 398 NE2 GLN A 338 -8.395 -10.984 -5.355 1.00 0.00 N ATOM 0 H GLN A 338 -9.530 -7.631 -3.064 1.00 0.00 H new ATOM 0 HA GLN A 338 -10.001 -9.280 -0.818 1.00 0.00 H new ATOM 0 HB2 GLN A 338 -7.647 -9.199 -2.770 1.00 0.00 H new ATOM 0 HB3 GLN A 338 -7.988 -10.536 -1.690 1.00 0.00 H new ATOM 0 HG2 GLN A 338 -10.294 -10.737 -2.738 1.00 0.00 H new ATOM 0 HG3 GLN A 338 -9.857 -9.474 -3.872 1.00 0.00 H new ATOM 0 HE21 GLN A 338 -8.569 -10.039 -5.698 1.00 0.00 H new ATOM 0 HE22 GLN A 338 -7.934 -11.668 -5.955 1.00 0.00 H new ATOM 407 N ASP A 339 -7.399 -7.297 -0.499 1.00 0.00 N ATOM 408 CA ASP A 339 -6.427 -6.802 0.521 1.00 0.00 C ATOM 409 C ASP A 339 -5.725 -5.543 -0.003 1.00 0.00 C ATOM 410 O ASP A 339 -4.523 -5.524 -0.181 1.00 0.00 O ATOM 411 CB ASP A 339 -5.387 -7.890 0.799 1.00 0.00 C ATOM 412 CG ASP A 339 -5.848 -8.751 1.976 1.00 0.00 C ATOM 413 OD1 ASP A 339 -5.771 -8.277 3.098 1.00 0.00 O ATOM 414 OD2 ASP A 339 -6.272 -9.869 1.737 1.00 0.00 O ATOM 0 H ASP A 339 -7.385 -6.802 -1.390 1.00 0.00 H new ATOM 0 HA ASP A 339 -6.958 -6.560 1.442 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -5.249 -8.510 -0.087 1.00 0.00 H new ATOM 0 HB3 ASP A 339 -4.422 -7.436 1.023 1.00 0.00 H new ATOM 419 N PRO A 340 -6.468 -4.497 -0.250 1.00 0.00 N ATOM 420 CA PRO A 340 -5.902 -3.216 -0.762 1.00 0.00 C ATOM 421 C PRO A 340 -4.945 -2.568 0.242 1.00 0.00 C ATOM 422 O PRO A 340 -4.082 -1.793 -0.118 1.00 0.00 O ATOM 423 CB PRO A 340 -7.126 -2.323 -0.993 1.00 0.00 C ATOM 424 CG PRO A 340 -8.234 -2.930 -0.197 1.00 0.00 C ATOM 425 CD PRO A 340 -7.924 -4.420 -0.067 1.00 0.00 C ATOM 0 HA PRO A 340 -5.313 -3.372 -1.666 1.00 0.00 H new ATOM 0 HB2 PRO A 340 -6.929 -1.300 -0.671 1.00 0.00 H new ATOM 0 HB3 PRO A 340 -7.384 -2.280 -2.051 1.00 0.00 H new ATOM 0 HG2 PRO A 340 -8.304 -2.463 0.786 1.00 0.00 H new ATOM 0 HG3 PRO A 340 -9.193 -2.777 -0.692 1.00 0.00 H new ATOM 0 HD2 PRO A 340 -8.225 -4.807 0.907 1.00 0.00 H new ATOM 0 HD3 PRO A 340 -8.452 -5.005 -0.820 1.00 0.00 H new ATOM 433 N ASP A 341 -5.094 -2.882 1.501 1.00 0.00 N ATOM 434 CA ASP A 341 -4.200 -2.288 2.529 1.00 0.00 C ATOM 435 C ASP A 341 -2.758 -2.738 2.283 1.00 0.00 C ATOM 436 O ASP A 341 -1.818 -2.035 2.590 1.00 0.00 O ATOM 437 CB ASP A 341 -4.650 -2.754 3.914 1.00 0.00 C ATOM 438 CG ASP A 341 -6.024 -2.161 4.231 1.00 0.00 C ATOM 439 OD1 ASP A 341 -6.439 -1.264 3.518 1.00 0.00 O ATOM 440 OD2 ASP A 341 -6.638 -2.616 5.184 1.00 0.00 O ATOM 0 H ASP A 341 -5.799 -3.526 1.860 1.00 0.00 H new ATOM 0 HA ASP A 341 -4.250 -1.201 2.471 1.00 0.00 H new ATOM 0 HB2 ASP A 341 -4.696 -3.843 3.946 1.00 0.00 H new ATOM 0 HB3 ASP A 341 -3.926 -2.443 4.667 1.00 0.00 H new ATOM 445 N LYS A 342 -2.575 -3.908 1.736 1.00 0.00 N ATOM 446 CA LYS A 342 -1.191 -4.399 1.475 1.00 0.00 C ATOM 447 C LYS A 342 -0.789 -4.088 0.031 1.00 0.00 C ATOM 448 O LYS A 342 0.258 -4.495 -0.430 1.00 0.00 O ATOM 449 CB LYS A 342 -1.131 -5.909 1.711 1.00 0.00 C ATOM 450 CG LYS A 342 -1.426 -6.205 3.183 1.00 0.00 C ATOM 451 CD LYS A 342 -1.260 -7.702 3.449 1.00 0.00 C ATOM 452 CE LYS A 342 -1.641 -8.008 4.899 1.00 0.00 C ATOM 453 NZ LYS A 342 -0.878 -9.197 5.373 1.00 0.00 N ATOM 0 H LYS A 342 -3.322 -4.545 1.459 1.00 0.00 H new ATOM 0 HA LYS A 342 -0.500 -3.897 2.152 1.00 0.00 H new ATOM 0 HB2 LYS A 342 -1.855 -6.417 1.074 1.00 0.00 H new ATOM 0 HB3 LYS A 342 -0.146 -6.292 1.442 1.00 0.00 H new ATOM 0 HG2 LYS A 342 -0.751 -5.635 3.821 1.00 0.00 H new ATOM 0 HG3 LYS A 342 -2.440 -5.892 3.431 1.00 0.00 H new ATOM 0 HD2 LYS A 342 -1.889 -8.275 2.768 1.00 0.00 H new ATOM 0 HD3 LYS A 342 -0.230 -8.003 3.261 1.00 0.00 H new ATOM 0 HE2 LYS A 342 -1.425 -7.148 5.532 1.00 0.00 H new ATOM 0 HE3 LYS A 342 -2.712 -8.197 4.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 342 -1.137 -9.405 6.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 342 -1.106 -10.017 4.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 342 0.142 -9.000 5.317 1.00 0.00 H new ATOM 467 N GLN A 343 -1.610 -3.374 -0.691 1.00 0.00 N ATOM 468 CA GLN A 343 -1.264 -3.049 -2.103 1.00 0.00 C ATOM 469 C GLN A 343 -0.608 -1.669 -2.173 1.00 0.00 C ATOM 470 O GLN A 343 -1.165 -0.686 -1.729 1.00 0.00 O ATOM 471 CB GLN A 343 -2.535 -3.050 -2.955 1.00 0.00 C ATOM 472 CG GLN A 343 -3.118 -4.462 -3.005 1.00 0.00 C ATOM 473 CD GLN A 343 -4.420 -4.448 -3.809 1.00 0.00 C ATOM 474 OE1 GLN A 343 -4.993 -3.402 -4.041 1.00 0.00 O ATOM 475 NE2 GLN A 343 -4.914 -5.573 -4.248 1.00 0.00 N ATOM 0 H GLN A 343 -2.502 -3.003 -0.365 1.00 0.00 H new ATOM 0 HA GLN A 343 -0.569 -3.798 -2.482 1.00 0.00 H new ATOM 0 HB2 GLN A 343 -3.266 -2.359 -2.536 1.00 0.00 H new ATOM 0 HB3 GLN A 343 -2.309 -2.703 -3.963 1.00 0.00 H new ATOM 0 HG2 GLN A 343 -2.403 -5.146 -3.462 1.00 0.00 H new ATOM 0 HG3 GLN A 343 -3.306 -4.825 -1.995 1.00 0.00 H new ATOM 0 HE21 GLN A 343 -4.433 -6.451 -4.054 1.00 0.00 H new ATOM 0 HE22 GLN A 343 -5.781 -5.574 -4.786 1.00 0.00 H new ATOM 484 N LEU A 344 0.569 -1.591 -2.737 1.00 0.00 N ATOM 485 CA LEU A 344 1.265 -0.280 -2.847 1.00 0.00 C ATOM 486 C LEU A 344 1.327 0.142 -4.318 1.00 0.00 C ATOM 487 O LEU A 344 1.240 -0.683 -5.214 1.00 0.00 O ATOM 488 CB LEU A 344 2.686 -0.402 -2.293 1.00 0.00 C ATOM 489 CG LEU A 344 3.268 -1.765 -2.665 1.00 0.00 C ATOM 490 CD1 LEU A 344 4.746 -1.603 -3.025 1.00 0.00 C ATOM 491 CD2 LEU A 344 3.138 -2.717 -1.475 1.00 0.00 C ATOM 0 H LEU A 344 1.078 -2.384 -3.127 1.00 0.00 H new ATOM 0 HA LEU A 344 0.717 0.468 -2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 344 3.313 0.394 -2.695 1.00 0.00 H new ATOM 0 HB3 LEU A 344 2.676 -0.283 -1.210 1.00 0.00 H new ATOM 0 HG LEU A 344 2.725 -2.172 -3.518 1.00 0.00 H new ATOM 0 HD11 LEU A 344 5.164 -2.574 -3.291 1.00 0.00 H new ATOM 0 HD12 LEU A 344 4.842 -0.923 -3.871 1.00 0.00 H new ATOM 0 HD13 LEU A 344 5.286 -1.197 -2.170 1.00 0.00 H new ATOM 0 HD21 LEU A 344 3.553 -3.689 -1.740 1.00 0.00 H new ATOM 0 HD22 LEU A 344 3.682 -2.310 -0.623 1.00 0.00 H new ATOM 0 HD23 LEU A 344 2.086 -2.831 -1.213 1.00 0.00 H new ATOM 503 N MET A 345 1.469 1.420 -4.569 1.00 0.00 N ATOM 504 CA MET A 345 1.530 1.908 -5.977 1.00 0.00 C ATOM 505 C MET A 345 2.801 2.722 -6.202 1.00 0.00 C ATOM 506 O MET A 345 3.287 3.398 -5.318 1.00 0.00 O ATOM 507 CB MET A 345 0.310 2.780 -6.276 1.00 0.00 C ATOM 508 CG MET A 345 0.297 3.149 -7.761 1.00 0.00 C ATOM 509 SD MET A 345 -0.996 4.376 -8.070 1.00 0.00 S ATOM 510 CE MET A 345 -2.411 3.326 -7.662 1.00 0.00 C ATOM 0 H MET A 345 1.545 2.146 -3.857 1.00 0.00 H new ATOM 0 HA MET A 345 1.536 1.046 -6.644 1.00 0.00 H new ATOM 0 HB2 MET A 345 -0.604 2.247 -6.015 1.00 0.00 H new ATOM 0 HB3 MET A 345 0.337 3.683 -5.666 1.00 0.00 H new ATOM 0 HG2 MET A 345 1.268 3.547 -8.056 1.00 0.00 H new ATOM 0 HG3 MET A 345 0.120 2.259 -8.366 1.00 0.00 H new ATOM 0 HE1 MET A 345 -3.200 3.476 -8.399 1.00 0.00 H new ATOM 0 HE2 MET A 345 -2.102 2.281 -7.669 1.00 0.00 H new ATOM 0 HE3 MET A 345 -2.785 3.588 -6.672 1.00 0.00 H new ATOM 520 N CYS A 346 3.337 2.667 -7.393 1.00 0.00 N ATOM 521 CA CYS A 346 4.573 3.447 -7.690 1.00 0.00 C ATOM 522 C CYS A 346 4.163 4.863 -8.099 1.00 0.00 C ATOM 523 O CYS A 346 3.431 5.058 -9.045 1.00 0.00 O ATOM 524 CB CYS A 346 5.333 2.763 -8.829 1.00 0.00 C ATOM 525 SG CYS A 346 6.680 3.821 -9.423 1.00 0.00 S ATOM 0 H CYS A 346 2.973 2.117 -8.171 1.00 0.00 H new ATOM 0 HA CYS A 346 5.220 3.495 -6.814 1.00 0.00 H new ATOM 0 HB2 CYS A 346 5.736 1.811 -8.484 1.00 0.00 H new ATOM 0 HB3 CYS A 346 4.649 2.541 -9.648 1.00 0.00 H new ATOM 530 N ASP A 347 4.607 5.855 -7.381 1.00 0.00 N ATOM 531 CA ASP A 347 4.212 7.251 -7.723 1.00 0.00 C ATOM 532 C ASP A 347 4.498 7.529 -9.198 1.00 0.00 C ATOM 533 O ASP A 347 3.727 8.175 -9.880 1.00 0.00 O ATOM 534 CB ASP A 347 5.012 8.231 -6.862 1.00 0.00 C ATOM 535 CG ASP A 347 4.395 9.627 -6.970 1.00 0.00 C ATOM 536 OD1 ASP A 347 3.366 9.750 -7.614 1.00 0.00 O ATOM 537 OD2 ASP A 347 4.963 10.549 -6.407 1.00 0.00 O ATOM 0 H ASP A 347 5.224 5.762 -6.574 1.00 0.00 H new ATOM 0 HA ASP A 347 3.146 7.376 -7.534 1.00 0.00 H new ATOM 0 HB2 ASP A 347 5.013 7.902 -5.823 1.00 0.00 H new ATOM 0 HB3 ASP A 347 6.051 8.255 -7.190 1.00 0.00 H new ATOM 542 N GLU A 348 5.604 7.060 -9.690 1.00 0.00 N ATOM 543 CA GLU A 348 5.951 7.308 -11.116 1.00 0.00 C ATOM 544 C GLU A 348 5.051 6.487 -12.049 1.00 0.00 C ATOM 545 O GLU A 348 4.734 6.915 -13.141 1.00 0.00 O ATOM 546 CB GLU A 348 7.417 6.948 -11.337 1.00 0.00 C ATOM 547 CG GLU A 348 7.838 7.365 -12.748 1.00 0.00 C ATOM 548 CD GLU A 348 9.328 7.082 -12.938 1.00 0.00 C ATOM 549 OE1 GLU A 348 10.022 6.985 -11.939 1.00 0.00 O ATOM 550 OE2 GLU A 348 9.752 6.985 -14.077 1.00 0.00 O ATOM 0 H GLU A 348 6.287 6.513 -9.166 1.00 0.00 H new ATOM 0 HA GLU A 348 5.792 8.361 -11.347 1.00 0.00 H new ATOM 0 HB2 GLU A 348 8.041 7.449 -10.597 1.00 0.00 H new ATOM 0 HB3 GLU A 348 7.563 5.876 -11.204 1.00 0.00 H new ATOM 0 HG2 GLU A 348 7.255 6.819 -13.490 1.00 0.00 H new ATOM 0 HG3 GLU A 348 7.635 8.425 -12.901 1.00 0.00 H new ATOM 557 N CYS A 349 4.638 5.315 -11.636 1.00 0.00 N ATOM 558 CA CYS A 349 3.759 4.477 -12.514 1.00 0.00 C ATOM 559 C CYS A 349 2.402 4.269 -11.840 1.00 0.00 C ATOM 560 O CYS A 349 2.317 3.949 -10.672 1.00 0.00 O ATOM 561 CB CYS A 349 4.412 3.113 -12.754 1.00 0.00 C ATOM 562 SG CYS A 349 6.177 3.328 -13.086 1.00 0.00 S ATOM 0 H CYS A 349 4.869 4.902 -10.733 1.00 0.00 H new ATOM 0 HA CYS A 349 3.621 4.989 -13.466 1.00 0.00 H new ATOM 0 HB2 CYS A 349 4.272 2.474 -11.882 1.00 0.00 H new ATOM 0 HB3 CYS A 349 3.933 2.613 -13.596 1.00 0.00 H new ATOM 567 N ASP A 350 1.335 4.446 -12.569 1.00 0.00 N ATOM 568 CA ASP A 350 -0.016 4.260 -11.968 1.00 0.00 C ATOM 569 C ASP A 350 -0.308 2.769 -11.808 1.00 0.00 C ATOM 570 O ASP A 350 -1.448 2.350 -11.764 1.00 0.00 O ATOM 571 CB ASP A 350 -1.073 4.895 -12.874 1.00 0.00 C ATOM 572 CG ASP A 350 -0.881 6.413 -12.893 1.00 0.00 C ATOM 573 OD1 ASP A 350 -0.137 6.907 -12.063 1.00 0.00 O ATOM 574 OD2 ASP A 350 -1.482 7.055 -13.739 1.00 0.00 O ATOM 0 H ASP A 350 1.340 4.711 -13.554 1.00 0.00 H new ATOM 0 HA ASP A 350 -0.043 4.739 -10.989 1.00 0.00 H new ATOM 0 HB2 ASP A 350 -0.990 4.494 -13.884 1.00 0.00 H new ATOM 0 HB3 ASP A 350 -2.072 4.648 -12.514 1.00 0.00 H new ATOM 579 N MET A 351 0.713 1.965 -11.717 1.00 0.00 N ATOM 580 CA MET A 351 0.499 0.498 -11.557 1.00 0.00 C ATOM 581 C MET A 351 0.767 0.091 -10.107 1.00 0.00 C ATOM 582 O MET A 351 1.542 0.720 -9.400 1.00 0.00 O ATOM 583 CB MET A 351 1.447 -0.270 -12.482 1.00 0.00 C ATOM 584 CG MET A 351 1.068 -0.003 -13.939 1.00 0.00 C ATOM 585 SD MET A 351 2.010 -1.108 -15.021 1.00 0.00 S ATOM 586 CE MET A 351 3.663 -0.570 -14.520 1.00 0.00 C ATOM 0 H MET A 351 1.689 2.260 -11.746 1.00 0.00 H new ATOM 0 HA MET A 351 -0.532 0.260 -11.817 1.00 0.00 H new ATOM 0 HB2 MET A 351 2.477 0.038 -12.301 1.00 0.00 H new ATOM 0 HB3 MET A 351 1.392 -1.338 -12.271 1.00 0.00 H new ATOM 0 HG2 MET A 351 -0.001 -0.161 -14.082 1.00 0.00 H new ATOM 0 HG3 MET A 351 1.274 1.036 -14.195 1.00 0.00 H new ATOM 0 HE1 MET A 351 4.392 -0.895 -15.262 1.00 0.00 H new ATOM 0 HE2 MET A 351 3.684 0.517 -14.443 1.00 0.00 H new ATOM 0 HE3 MET A 351 3.910 -1.007 -13.553 1.00 0.00 H new ATOM 596 N ALA A 352 0.134 -0.963 -9.659 1.00 0.00 N ATOM 597 CA ALA A 352 0.349 -1.423 -8.261 1.00 0.00 C ATOM 598 C ALA A 352 1.222 -2.670 -8.262 1.00 0.00 C ATOM 599 O ALA A 352 1.687 -3.109 -9.295 1.00 0.00 O ATOM 600 CB ALA A 352 -1.000 -1.743 -7.616 1.00 0.00 C ATOM 0 H ALA A 352 -0.522 -1.523 -10.204 1.00 0.00 H new ATOM 0 HA ALA A 352 0.845 -0.636 -7.693 1.00 0.00 H new ATOM 0 HB1 ALA A 352 -0.843 -2.080 -6.591 1.00 0.00 H new ATOM 0 HB2 ALA A 352 -1.623 -0.848 -7.612 1.00 0.00 H new ATOM 0 HB3 ALA A 352 -1.498 -2.529 -8.184 1.00 0.00 H new ATOM 606 N PHE A 353 1.452 -3.241 -7.110 1.00 0.00 N ATOM 607 CA PHE A 353 2.303 -4.461 -7.044 1.00 0.00 C ATOM 608 C PHE A 353 1.477 -5.665 -6.584 1.00 0.00 C ATOM 609 O PHE A 353 0.861 -5.654 -5.536 1.00 0.00 O ATOM 610 CB PHE A 353 3.458 -4.208 -6.077 1.00 0.00 C ATOM 611 CG PHE A 353 4.338 -3.125 -6.655 1.00 0.00 C ATOM 612 CD1 PHE A 353 5.362 -3.460 -7.546 1.00 0.00 C ATOM 613 CD2 PHE A 353 4.123 -1.786 -6.308 1.00 0.00 C ATOM 614 CE1 PHE A 353 6.175 -2.459 -8.091 1.00 0.00 C ATOM 615 CE2 PHE A 353 4.935 -0.783 -6.854 1.00 0.00 C ATOM 616 CZ PHE A 353 5.960 -1.119 -7.745 1.00 0.00 C ATOM 0 H PHE A 353 1.088 -2.915 -6.215 1.00 0.00 H new ATOM 0 HA PHE A 353 2.699 -4.682 -8.035 1.00 0.00 H new ATOM 0 HB2 PHE A 353 3.076 -3.906 -5.102 1.00 0.00 H new ATOM 0 HB3 PHE A 353 4.032 -5.122 -5.925 1.00 0.00 H new ATOM 0 HD1 PHE A 353 5.526 -4.493 -7.814 1.00 0.00 H new ATOM 0 HD2 PHE A 353 3.332 -1.526 -5.620 1.00 0.00 H new ATOM 0 HE1 PHE A 353 6.967 -2.720 -8.777 1.00 0.00 H new ATOM 0 HE2 PHE A 353 4.769 0.250 -6.587 1.00 0.00 H new ATOM 0 HZ PHE A 353 6.585 -0.345 -8.166 1.00 0.00 H new ATOM 626 N HIS A 354 1.472 -6.707 -7.370 1.00 0.00 N ATOM 627 CA HIS A 354 0.705 -7.935 -7.014 1.00 0.00 C ATOM 628 C HIS A 354 1.380 -8.646 -5.840 1.00 0.00 C ATOM 629 O HIS A 354 1.110 -9.799 -5.568 1.00 0.00 O ATOM 630 CB HIS A 354 0.687 -8.876 -8.216 1.00 0.00 C ATOM 631 CG HIS A 354 -0.725 -9.194 -8.634 1.00 0.00 C ATOM 632 ND1 HIS A 354 -1.054 -10.407 -9.219 1.00 0.00 N ATOM 633 CD2 HIS A 354 -1.902 -8.482 -8.571 1.00 0.00 C ATOM 634 CE1 HIS A 354 -2.371 -10.391 -9.481 1.00 0.00 C ATOM 635 NE2 HIS A 354 -2.939 -9.244 -9.105 1.00 0.00 N ATOM 0 H HIS A 354 1.974 -6.760 -8.256 1.00 0.00 H new ATOM 0 HA HIS A 354 -0.312 -7.658 -6.736 1.00 0.00 H new ATOM 0 HB2 HIS A 354 1.222 -8.418 -9.048 1.00 0.00 H new ATOM 0 HB3 HIS A 354 1.213 -9.798 -7.968 1.00 0.00 H new ATOM 0 HD2 HIS A 354 -2.005 -7.485 -8.169 1.00 0.00 H new ATOM 0 HE1 HIS A 354 -2.906 -11.209 -9.941 1.00 0.00 H new ATOM 0 HE2 HIS A 354 -3.921 -8.981 -9.190 1.00 0.00 H new ATOM 643 N ILE A 355 2.265 -7.983 -5.152 1.00 0.00 N ATOM 644 CA ILE A 355 2.959 -8.646 -4.011 1.00 0.00 C ATOM 645 C ILE A 355 1.940 -9.426 -3.182 1.00 0.00 C ATOM 646 O ILE A 355 2.219 -10.498 -2.685 1.00 0.00 O ATOM 647 CB ILE A 355 3.617 -7.586 -3.127 1.00 0.00 C ATOM 648 CG1 ILE A 355 4.488 -8.270 -2.073 1.00 0.00 C ATOM 649 CG2 ILE A 355 2.535 -6.757 -2.432 1.00 0.00 C ATOM 650 CD1 ILE A 355 5.142 -7.209 -1.189 1.00 0.00 C ATOM 0 H ILE A 355 2.538 -7.016 -5.327 1.00 0.00 H new ATOM 0 HA ILE A 355 3.719 -9.325 -4.396 1.00 0.00 H new ATOM 0 HB ILE A 355 4.236 -6.934 -3.743 1.00 0.00 H new ATOM 0 HG12 ILE A 355 3.882 -8.942 -1.465 1.00 0.00 H new ATOM 0 HG13 ILE A 355 5.253 -8.878 -2.556 1.00 0.00 H new ATOM 0 HG21 ILE A 355 3.004 -6.001 -1.802 1.00 0.00 H new ATOM 0 HG22 ILE A 355 1.913 -6.269 -3.182 1.00 0.00 H new ATOM 0 HG23 ILE A 355 1.916 -7.410 -1.816 1.00 0.00 H new ATOM 0 HD11 ILE A 355 5.763 -7.695 -0.437 1.00 0.00 H new ATOM 0 HD12 ILE A 355 5.761 -6.555 -1.803 1.00 0.00 H new ATOM 0 HD13 ILE A 355 4.369 -6.620 -0.696 1.00 0.00 H new ATOM 662 N TYR A 356 0.760 -8.897 -3.031 1.00 0.00 N ATOM 663 CA TYR A 356 -0.278 -9.609 -2.237 1.00 0.00 C ATOM 664 C TYR A 356 -0.748 -10.868 -2.969 1.00 0.00 C ATOM 665 O TYR A 356 -0.880 -11.925 -2.383 1.00 0.00 O ATOM 666 CB TYR A 356 -1.476 -8.690 -2.019 1.00 0.00 C ATOM 667 CG TYR A 356 -2.572 -9.477 -1.350 1.00 0.00 C ATOM 668 CD1 TYR A 356 -2.620 -9.570 0.046 1.00 0.00 C ATOM 669 CD2 TYR A 356 -3.537 -10.123 -2.131 1.00 0.00 C ATOM 670 CE1 TYR A 356 -3.636 -10.311 0.662 1.00 0.00 C ATOM 671 CE2 TYR A 356 -4.552 -10.864 -1.516 1.00 0.00 C ATOM 672 CZ TYR A 356 -4.602 -10.958 -0.119 1.00 0.00 C ATOM 673 OH TYR A 356 -5.603 -11.690 0.488 1.00 0.00 O ATOM 0 H TYR A 356 0.469 -8.002 -3.423 1.00 0.00 H new ATOM 0 HA TYR A 356 0.157 -9.894 -1.279 1.00 0.00 H new ATOM 0 HB2 TYR A 356 -1.191 -7.838 -1.401 1.00 0.00 H new ATOM 0 HB3 TYR A 356 -1.825 -8.291 -2.972 1.00 0.00 H new ATOM 0 HD1 TYR A 356 -1.874 -9.071 0.647 1.00 0.00 H new ATOM 0 HD2 TYR A 356 -3.498 -10.050 -3.208 1.00 0.00 H new ATOM 0 HE1 TYR A 356 -3.675 -10.384 1.739 1.00 0.00 H new ATOM 0 HE2 TYR A 356 -5.297 -11.363 -2.118 1.00 0.00 H new ATOM 0 HH TYR A 356 -6.046 -11.139 1.166 1.00 0.00 H new ATOM 683 N CYS A 357 -1.024 -10.760 -4.237 1.00 0.00 N ATOM 684 CA CYS A 357 -1.511 -11.941 -4.998 1.00 0.00 C ATOM 685 C CYS A 357 -0.347 -12.883 -5.303 1.00 0.00 C ATOM 686 O CYS A 357 -0.424 -14.075 -5.078 1.00 0.00 O ATOM 687 CB CYS A 357 -2.156 -11.458 -6.296 1.00 0.00 C ATOM 688 SG CYS A 357 -3.588 -10.422 -5.893 1.00 0.00 S ATOM 0 H CYS A 357 -0.933 -9.902 -4.781 1.00 0.00 H new ATOM 0 HA CYS A 357 -2.246 -12.486 -4.406 1.00 0.00 H new ATOM 0 HB2 CYS A 357 -1.436 -10.892 -6.886 1.00 0.00 H new ATOM 0 HB3 CYS A 357 -2.466 -12.309 -6.902 1.00 0.00 H new ATOM 693 N LEU A 358 0.734 -12.360 -5.803 1.00 0.00 N ATOM 694 CA LEU A 358 1.906 -13.224 -6.112 1.00 0.00 C ATOM 695 C LEU A 358 2.519 -13.744 -4.814 1.00 0.00 C ATOM 696 O LEU A 358 2.994 -14.860 -4.740 1.00 0.00 O ATOM 697 CB LEU A 358 2.945 -12.407 -6.877 1.00 0.00 C ATOM 698 CG LEU A 358 2.510 -12.258 -8.339 1.00 0.00 C ATOM 699 CD1 LEU A 358 3.337 -11.159 -9.010 1.00 0.00 C ATOM 700 CD2 LEU A 358 2.731 -13.580 -9.082 1.00 0.00 C ATOM 0 H LEU A 358 0.858 -11.369 -6.012 1.00 0.00 H new ATOM 0 HA LEU A 358 1.585 -14.070 -6.720 1.00 0.00 H new ATOM 0 HB2 LEU A 358 3.058 -11.424 -6.419 1.00 0.00 H new ATOM 0 HB3 LEU A 358 3.917 -12.897 -6.825 1.00 0.00 H new ATOM 0 HG LEU A 358 1.453 -11.994 -8.372 1.00 0.00 H new ATOM 0 HD11 LEU A 358 3.027 -11.054 -10.050 1.00 0.00 H new ATOM 0 HD12 LEU A 358 3.180 -10.215 -8.487 1.00 0.00 H new ATOM 0 HD13 LEU A 358 4.394 -11.424 -8.972 1.00 0.00 H new ATOM 0 HD21 LEU A 358 2.420 -13.470 -10.121 1.00 0.00 H new ATOM 0 HD22 LEU A 358 3.787 -13.846 -9.045 1.00 0.00 H new ATOM 0 HD23 LEU A 358 2.142 -14.366 -8.609 1.00 0.00 H new ATOM 712 N ASP A 359 2.517 -12.941 -3.789 1.00 0.00 N ATOM 713 CA ASP A 359 3.103 -13.381 -2.493 1.00 0.00 C ATOM 714 C ASP A 359 4.544 -13.845 -2.722 1.00 0.00 C ATOM 715 O ASP A 359 4.889 -14.980 -2.460 1.00 0.00 O ATOM 716 CB ASP A 359 2.278 -14.537 -1.925 1.00 0.00 C ATOM 717 CG ASP A 359 2.844 -14.949 -0.565 1.00 0.00 C ATOM 718 OD1 ASP A 359 3.315 -14.078 0.147 1.00 0.00 O ATOM 719 OD2 ASP A 359 2.797 -16.130 -0.259 1.00 0.00 O ATOM 0 H ASP A 359 2.134 -11.996 -3.792 1.00 0.00 H new ATOM 0 HA ASP A 359 3.094 -12.550 -1.787 1.00 0.00 H new ATOM 0 HB2 ASP A 359 1.235 -14.237 -1.821 1.00 0.00 H new ATOM 0 HB3 ASP A 359 2.299 -15.384 -2.611 1.00 0.00 H new ATOM 724 N PRO A 360 5.375 -12.964 -3.207 1.00 0.00 N ATOM 725 CA PRO A 360 6.808 -13.267 -3.482 1.00 0.00 C ATOM 726 C PRO A 360 7.642 -13.324 -2.199 1.00 0.00 C ATOM 727 O PRO A 360 7.241 -12.825 -1.166 1.00 0.00 O ATOM 728 CB PRO A 360 7.262 -12.101 -4.359 1.00 0.00 C ATOM 729 CG PRO A 360 6.367 -10.964 -3.995 1.00 0.00 C ATOM 730 CD PRO A 360 5.036 -11.574 -3.550 1.00 0.00 C ATOM 0 HA PRO A 360 6.934 -14.242 -3.953 1.00 0.00 H new ATOM 0 HB2 PRO A 360 8.307 -11.854 -4.174 1.00 0.00 H new ATOM 0 HB3 PRO A 360 7.175 -12.347 -5.417 1.00 0.00 H new ATOM 0 HG2 PRO A 360 6.806 -10.368 -3.195 1.00 0.00 H new ATOM 0 HG3 PRO A 360 6.222 -10.298 -4.846 1.00 0.00 H new ATOM 0 HD2 PRO A 360 4.620 -11.042 -2.694 1.00 0.00 H new ATOM 0 HD3 PRO A 360 4.292 -11.530 -4.345 1.00 0.00 H new ATOM 738 N PRO A 361 8.797 -13.928 -2.269 1.00 0.00 N ATOM 739 CA PRO A 361 9.713 -14.055 -1.102 1.00 0.00 C ATOM 740 C PRO A 361 10.044 -12.694 -0.481 1.00 0.00 C ATOM 741 O PRO A 361 10.500 -12.608 0.641 1.00 0.00 O ATOM 742 CB PRO A 361 10.981 -14.704 -1.675 1.00 0.00 C ATOM 743 CG PRO A 361 10.849 -14.637 -3.163 1.00 0.00 C ATOM 744 CD PRO A 361 9.357 -14.555 -3.470 1.00 0.00 C ATOM 0 HA PRO A 361 9.259 -14.641 -0.303 1.00 0.00 H new ATOM 0 HB2 PRO A 361 11.874 -14.176 -1.339 1.00 0.00 H new ATOM 0 HB3 PRO A 361 11.076 -15.737 -1.339 1.00 0.00 H new ATOM 0 HG2 PRO A 361 11.373 -13.767 -3.559 1.00 0.00 H new ATOM 0 HG3 PRO A 361 11.292 -15.516 -3.630 1.00 0.00 H new ATOM 0 HD2 PRO A 361 9.162 -13.960 -4.362 1.00 0.00 H new ATOM 0 HD3 PRO A 361 8.928 -15.542 -3.645 1.00 0.00 H new ATOM 752 N LEU A 362 9.818 -11.629 -1.204 1.00 0.00 N ATOM 753 CA LEU A 362 10.121 -10.279 -0.651 1.00 0.00 C ATOM 754 C LEU A 362 9.357 -10.085 0.661 1.00 0.00 C ATOM 755 O LEU A 362 9.876 -9.535 1.611 1.00 0.00 O ATOM 756 CB LEU A 362 9.684 -9.207 -1.654 1.00 0.00 C ATOM 757 CG LEU A 362 10.377 -9.441 -2.997 1.00 0.00 C ATOM 758 CD1 LEU A 362 10.001 -8.319 -3.968 1.00 0.00 C ATOM 759 CD2 LEU A 362 11.893 -9.450 -2.795 1.00 0.00 C ATOM 0 H LEU A 362 9.438 -11.636 -2.150 1.00 0.00 H new ATOM 0 HA LEU A 362 11.192 -10.193 -0.468 1.00 0.00 H new ATOM 0 HB2 LEU A 362 8.602 -9.236 -1.783 1.00 0.00 H new ATOM 0 HB3 LEU A 362 9.933 -8.217 -1.273 1.00 0.00 H new ATOM 0 HG LEU A 362 10.058 -10.400 -3.406 1.00 0.00 H new ATOM 0 HD11 LEU A 362 10.495 -8.486 -4.925 1.00 0.00 H new ATOM 0 HD12 LEU A 362 8.921 -8.311 -4.114 1.00 0.00 H new ATOM 0 HD13 LEU A 362 10.319 -7.361 -3.557 1.00 0.00 H new ATOM 0 HD21 LEU A 362 12.387 -9.617 -3.752 1.00 0.00 H new ATOM 0 HD22 LEU A 362 12.211 -8.492 -2.385 1.00 0.00 H new ATOM 0 HD23 LEU A 362 12.163 -10.248 -2.104 1.00 0.00 H new ATOM 771 N SER A 363 8.131 -10.545 0.715 1.00 0.00 N ATOM 772 CA SER A 363 7.315 -10.402 1.959 1.00 0.00 C ATOM 773 C SER A 363 7.647 -9.082 2.660 1.00 0.00 C ATOM 774 O SER A 363 7.658 -8.998 3.872 1.00 0.00 O ATOM 775 CB SER A 363 7.622 -11.566 2.902 1.00 0.00 C ATOM 776 OG SER A 363 9.030 -11.684 3.060 1.00 0.00 O ATOM 0 H SER A 363 7.658 -11.017 -0.056 1.00 0.00 H new ATOM 0 HA SER A 363 6.258 -10.408 1.693 1.00 0.00 H new ATOM 0 HB2 SER A 363 7.149 -11.400 3.870 1.00 0.00 H new ATOM 0 HB3 SER A 363 7.211 -12.492 2.501 1.00 0.00 H new ATOM 0 HG SER A 363 9.411 -12.127 2.273 1.00 0.00 H new ATOM 782 N SER A 364 7.923 -8.051 1.910 1.00 0.00 N ATOM 783 CA SER A 364 8.258 -6.744 2.539 1.00 0.00 C ATOM 784 C SER A 364 7.606 -5.610 1.746 1.00 0.00 C ATOM 785 O SER A 364 7.428 -5.702 0.548 1.00 0.00 O ATOM 786 CB SER A 364 9.775 -6.556 2.546 1.00 0.00 C ATOM 787 OG SER A 364 10.097 -5.357 3.239 1.00 0.00 O ATOM 0 H SER A 364 7.931 -8.058 0.890 1.00 0.00 H new ATOM 0 HA SER A 364 7.885 -6.729 3.563 1.00 0.00 H new ATOM 0 HB2 SER A 364 10.256 -7.408 3.027 1.00 0.00 H new ATOM 0 HB3 SER A 364 10.152 -6.512 1.524 1.00 0.00 H new ATOM 0 HG SER A 364 11.069 -5.235 3.247 1.00 0.00 H new ATOM 793 N VAL A 365 7.250 -4.540 2.403 1.00 0.00 N ATOM 794 CA VAL A 365 6.614 -3.407 1.681 1.00 0.00 C ATOM 795 C VAL A 365 7.685 -2.350 1.352 1.00 0.00 C ATOM 796 O VAL A 365 8.203 -1.703 2.242 1.00 0.00 O ATOM 797 CB VAL A 365 5.546 -2.778 2.578 1.00 0.00 C ATOM 798 CG1 VAL A 365 5.181 -1.391 2.045 1.00 0.00 C ATOM 799 CG2 VAL A 365 4.299 -3.665 2.582 1.00 0.00 C ATOM 0 H VAL A 365 7.373 -4.403 3.406 1.00 0.00 H new ATOM 0 HA VAL A 365 6.157 -3.767 0.759 1.00 0.00 H new ATOM 0 HB VAL A 365 5.933 -2.686 3.593 1.00 0.00 H new ATOM 0 HG11 VAL A 365 4.420 -0.944 2.685 1.00 0.00 H new ATOM 0 HG12 VAL A 365 6.068 -0.758 2.040 1.00 0.00 H new ATOM 0 HG13 VAL A 365 4.794 -1.481 1.030 1.00 0.00 H new ATOM 0 HG21 VAL A 365 3.537 -3.218 3.221 1.00 0.00 H new ATOM 0 HG22 VAL A 365 3.914 -3.756 1.566 1.00 0.00 H new ATOM 0 HG23 VAL A 365 4.557 -4.654 2.962 1.00 0.00 H new ATOM 809 N PRO A 366 8.020 -2.168 0.093 1.00 0.00 N ATOM 810 CA PRO A 366 9.045 -1.169 -0.324 1.00 0.00 C ATOM 811 C PRO A 366 8.483 0.257 -0.383 1.00 0.00 C ATOM 812 O PRO A 366 9.216 1.217 -0.516 1.00 0.00 O ATOM 813 CB PRO A 366 9.456 -1.642 -1.715 1.00 0.00 C ATOM 814 CG PRO A 366 8.256 -2.339 -2.264 1.00 0.00 C ATOM 815 CD PRO A 366 7.471 -2.889 -1.069 1.00 0.00 C ATOM 0 HA PRO A 366 9.873 -1.116 0.383 1.00 0.00 H new ATOM 0 HB2 PRO A 366 9.746 -0.802 -2.346 1.00 0.00 H new ATOM 0 HB3 PRO A 366 10.313 -2.314 -1.665 1.00 0.00 H new ATOM 0 HG2 PRO A 366 7.642 -1.650 -2.845 1.00 0.00 H new ATOM 0 HG3 PRO A 366 8.552 -3.145 -2.935 1.00 0.00 H new ATOM 0 HD2 PRO A 366 6.402 -2.709 -1.179 1.00 0.00 H new ATOM 0 HD3 PRO A 366 7.604 -3.966 -0.968 1.00 0.00 H new ATOM 823 N SER A 367 7.190 0.399 -0.290 1.00 0.00 N ATOM 824 CA SER A 367 6.579 1.755 -0.344 1.00 0.00 C ATOM 825 C SER A 367 7.065 2.584 0.847 1.00 0.00 C ATOM 826 O SER A 367 6.850 3.778 0.912 1.00 0.00 O ATOM 827 CB SER A 367 5.059 1.623 -0.286 1.00 0.00 C ATOM 828 OG SER A 367 4.675 1.207 1.018 1.00 0.00 O ATOM 0 H SER A 367 6.528 -0.369 -0.179 1.00 0.00 H new ATOM 0 HA SER A 367 6.870 2.250 -1.270 1.00 0.00 H new ATOM 0 HB2 SER A 367 4.590 2.576 -0.529 1.00 0.00 H new ATOM 0 HB3 SER A 367 4.716 0.901 -1.027 1.00 0.00 H new ATOM 0 HG SER A 367 4.369 1.983 1.532 1.00 0.00 H new ATOM 834 N GLU A 368 7.713 1.961 1.791 1.00 0.00 N ATOM 835 CA GLU A 368 8.205 2.714 2.979 1.00 0.00 C ATOM 836 C GLU A 368 9.105 3.864 2.524 1.00 0.00 C ATOM 837 O GLU A 368 9.138 4.913 3.138 1.00 0.00 O ATOM 838 CB GLU A 368 9.003 1.771 3.884 1.00 0.00 C ATOM 839 CG GLU A 368 8.079 0.678 4.426 1.00 0.00 C ATOM 840 CD GLU A 368 8.863 -0.223 5.381 1.00 0.00 C ATOM 841 OE1 GLU A 368 10.073 -0.079 5.444 1.00 0.00 O ATOM 842 OE2 GLU A 368 8.240 -1.042 6.036 1.00 0.00 O ATOM 0 H GLU A 368 7.923 0.963 1.792 1.00 0.00 H new ATOM 0 HA GLU A 368 7.354 3.117 3.529 1.00 0.00 H new ATOM 0 HB2 GLU A 368 9.825 1.323 3.325 1.00 0.00 H new ATOM 0 HB3 GLU A 368 9.445 2.330 4.709 1.00 0.00 H new ATOM 0 HG2 GLU A 368 7.232 1.127 4.945 1.00 0.00 H new ATOM 0 HG3 GLU A 368 7.673 0.089 3.604 1.00 0.00 H new ATOM 849 N ASP A 369 9.833 3.681 1.453 1.00 0.00 N ATOM 850 CA ASP A 369 10.727 4.764 0.958 1.00 0.00 C ATOM 851 C ASP A 369 10.343 5.120 -0.477 1.00 0.00 C ATOM 852 O ASP A 369 9.568 4.432 -1.111 1.00 0.00 O ATOM 853 CB ASP A 369 12.180 4.289 0.989 1.00 0.00 C ATOM 854 CG ASP A 369 12.594 4.004 2.434 1.00 0.00 C ATOM 855 OD1 ASP A 369 11.896 4.449 3.329 1.00 0.00 O ATOM 856 OD2 ASP A 369 13.604 3.344 2.621 1.00 0.00 O ATOM 0 H ASP A 369 9.845 2.824 0.900 1.00 0.00 H new ATOM 0 HA ASP A 369 10.620 5.641 1.597 1.00 0.00 H new ATOM 0 HB2 ASP A 369 12.293 3.390 0.383 1.00 0.00 H new ATOM 0 HB3 ASP A 369 12.831 5.048 0.556 1.00 0.00 H new ATOM 861 N GLU A 370 10.880 6.188 -0.995 1.00 0.00 N ATOM 862 CA GLU A 370 10.547 6.583 -2.391 1.00 0.00 C ATOM 863 C GLU A 370 11.112 5.539 -3.354 1.00 0.00 C ATOM 864 O GLU A 370 12.067 5.787 -4.062 1.00 0.00 O ATOM 865 CB GLU A 370 11.164 7.949 -2.697 1.00 0.00 C ATOM 866 CG GLU A 370 10.568 9.002 -1.762 1.00 0.00 C ATOM 867 CD GLU A 370 11.130 10.380 -2.118 1.00 0.00 C ATOM 868 OE1 GLU A 370 12.045 10.434 -2.923 1.00 0.00 O ATOM 869 OE2 GLU A 370 10.634 11.357 -1.581 1.00 0.00 O ATOM 0 H GLU A 370 11.534 6.804 -0.513 1.00 0.00 H new ATOM 0 HA GLU A 370 9.465 6.643 -2.508 1.00 0.00 H new ATOM 0 HB2 GLU A 370 12.246 7.907 -2.571 1.00 0.00 H new ATOM 0 HB3 GLU A 370 10.974 8.221 -3.735 1.00 0.00 H new ATOM 0 HG2 GLU A 370 9.482 9.007 -1.849 1.00 0.00 H new ATOM 0 HG3 GLU A 370 10.803 8.758 -0.726 1.00 0.00 H new ATOM 876 N TRP A 371 10.530 4.370 -3.382 1.00 0.00 N ATOM 877 CA TRP A 371 11.038 3.309 -4.295 1.00 0.00 C ATOM 878 C TRP A 371 10.112 3.190 -5.508 1.00 0.00 C ATOM 879 O TRP A 371 8.904 3.254 -5.388 1.00 0.00 O ATOM 880 CB TRP A 371 11.080 1.975 -3.553 1.00 0.00 C ATOM 881 CG TRP A 371 9.913 1.145 -3.965 1.00 0.00 C ATOM 882 CD1 TRP A 371 8.627 1.408 -3.644 1.00 0.00 C ATOM 883 CD2 TRP A 371 9.896 -0.071 -4.767 1.00 0.00 C ATOM 884 NE1 TRP A 371 7.821 0.432 -4.197 1.00 0.00 N ATOM 885 CE2 TRP A 371 8.556 -0.503 -4.899 1.00 0.00 C ATOM 886 CE3 TRP A 371 10.903 -0.832 -5.387 1.00 0.00 C ATOM 887 CZ2 TRP A 371 8.225 -1.650 -5.618 1.00 0.00 C ATOM 888 CZ3 TRP A 371 10.574 -1.988 -6.113 1.00 0.00 C ATOM 889 CH2 TRP A 371 9.237 -2.396 -6.228 1.00 0.00 C ATOM 0 H TRP A 371 9.726 4.105 -2.813 1.00 0.00 H new ATOM 0 HA TRP A 371 12.042 3.570 -4.630 1.00 0.00 H new ATOM 0 HB2 TRP A 371 12.010 1.451 -3.775 1.00 0.00 H new ATOM 0 HB3 TRP A 371 11.059 2.144 -2.476 1.00 0.00 H new ATOM 0 HD1 TRP A 371 8.285 2.244 -3.052 1.00 0.00 H new ATOM 0 HE1 TRP A 371 6.806 0.405 -4.099 1.00 0.00 H new ATOM 0 HE3 TRP A 371 11.935 -0.526 -5.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 371 7.194 -1.960 -5.703 1.00 0.00 H new ATOM 0 HZ3 TRP A 371 11.355 -2.566 -6.585 1.00 0.00 H new ATOM 0 HH2 TRP A 371 8.990 -3.286 -6.788 1.00 0.00 H new ATOM 900 N TYR A 372 10.674 3.021 -6.675 1.00 0.00 N ATOM 901 CA TYR A 372 9.838 2.900 -7.904 1.00 0.00 C ATOM 902 C TYR A 372 10.155 1.569 -8.593 1.00 0.00 C ATOM 903 O TYR A 372 11.267 1.083 -8.530 1.00 0.00 O ATOM 904 CB TYR A 372 10.170 4.052 -8.853 1.00 0.00 C ATOM 905 CG TYR A 372 10.272 5.338 -8.069 1.00 0.00 C ATOM 906 CD1 TYR A 372 9.115 6.034 -7.704 1.00 0.00 C ATOM 907 CD2 TYR A 372 11.530 5.834 -7.708 1.00 0.00 C ATOM 908 CE1 TYR A 372 9.215 7.226 -6.975 1.00 0.00 C ATOM 909 CE2 TYR A 372 11.632 7.025 -6.980 1.00 0.00 C ATOM 910 CZ TYR A 372 10.475 7.722 -6.614 1.00 0.00 C ATOM 911 OH TYR A 372 10.574 8.897 -5.897 1.00 0.00 O ATOM 0 H TYR A 372 11.680 2.961 -6.830 1.00 0.00 H new ATOM 0 HA TYR A 372 8.781 2.937 -7.640 1.00 0.00 H new ATOM 0 HB2 TYR A 372 11.109 3.853 -9.369 1.00 0.00 H new ATOM 0 HB3 TYR A 372 9.399 4.140 -9.618 1.00 0.00 H new ATOM 0 HD1 TYR A 372 8.144 5.652 -7.984 1.00 0.00 H new ATOM 0 HD2 TYR A 372 12.423 5.297 -7.992 1.00 0.00 H new ATOM 0 HE1 TYR A 372 8.322 7.762 -6.691 1.00 0.00 H new ATOM 0 HE2 TYR A 372 12.603 7.406 -6.701 1.00 0.00 H new ATOM 0 HH TYR A 372 11.518 9.099 -5.728 1.00 0.00 H new ATOM 921 N CYS A 373 9.198 0.971 -9.251 1.00 0.00 N ATOM 922 CA CYS A 373 9.480 -0.325 -9.932 1.00 0.00 C ATOM 923 C CYS A 373 10.786 -0.194 -10.723 1.00 0.00 C ATOM 924 O CYS A 373 11.217 0.892 -11.044 1.00 0.00 O ATOM 925 CB CYS A 373 8.333 -0.681 -10.889 1.00 0.00 C ATOM 926 SG CYS A 373 6.948 0.467 -10.667 1.00 0.00 S ATOM 0 H CYS A 373 8.244 1.319 -9.346 1.00 0.00 H new ATOM 0 HA CYS A 373 9.572 -1.115 -9.186 1.00 0.00 H new ATOM 0 HB2 CYS A 373 8.685 -0.642 -11.920 1.00 0.00 H new ATOM 0 HB3 CYS A 373 8.000 -1.703 -10.705 1.00 0.00 H new ATOM 931 N PRO A 374 11.419 -1.292 -11.025 1.00 0.00 N ATOM 932 CA PRO A 374 12.703 -1.290 -11.785 1.00 0.00 C ATOM 933 C PRO A 374 12.546 -0.727 -13.205 1.00 0.00 C ATOM 934 O PRO A 374 13.507 -0.324 -13.830 1.00 0.00 O ATOM 935 CB PRO A 374 13.115 -2.766 -11.838 1.00 0.00 C ATOM 936 CG PRO A 374 11.878 -3.547 -11.537 1.00 0.00 C ATOM 937 CD PRO A 374 10.987 -2.652 -10.679 1.00 0.00 C ATOM 0 HA PRO A 374 13.445 -0.652 -11.304 1.00 0.00 H new ATOM 0 HB2 PRO A 374 13.512 -3.026 -12.819 1.00 0.00 H new ATOM 0 HB3 PRO A 374 13.898 -2.979 -11.111 1.00 0.00 H new ATOM 0 HG2 PRO A 374 11.368 -3.832 -12.457 1.00 0.00 H new ATOM 0 HG3 PRO A 374 12.122 -4.469 -11.009 1.00 0.00 H new ATOM 0 HD2 PRO A 374 9.931 -2.806 -10.903 1.00 0.00 H new ATOM 0 HD3 PRO A 374 11.120 -2.856 -9.617 1.00 0.00 H new ATOM 945 N GLU A 375 11.348 -0.712 -13.724 1.00 0.00 N ATOM 946 CA GLU A 375 11.143 -0.192 -15.109 1.00 0.00 C ATOM 947 C GLU A 375 11.269 1.334 -15.140 1.00 0.00 C ATOM 948 O GLU A 375 11.871 1.895 -16.035 1.00 0.00 O ATOM 949 CB GLU A 375 9.756 -0.600 -15.604 1.00 0.00 C ATOM 950 CG GLU A 375 8.709 0.320 -14.987 1.00 0.00 C ATOM 951 CD GLU A 375 7.309 -0.223 -15.281 1.00 0.00 C ATOM 952 OE1 GLU A 375 7.215 -1.195 -16.012 1.00 0.00 O ATOM 953 OE2 GLU A 375 6.357 0.341 -14.769 1.00 0.00 O ATOM 0 H GLU A 375 10.504 -1.036 -13.252 1.00 0.00 H new ATOM 0 HA GLU A 375 11.909 -0.616 -15.758 1.00 0.00 H new ATOM 0 HB2 GLU A 375 9.713 -0.540 -16.692 1.00 0.00 H new ATOM 0 HB3 GLU A 375 9.551 -1.636 -15.333 1.00 0.00 H new ATOM 0 HG2 GLU A 375 8.863 0.392 -13.910 1.00 0.00 H new ATOM 0 HG3 GLU A 375 8.812 1.327 -15.392 1.00 0.00 H new ATOM 960 N CYS A 376 10.696 2.015 -14.186 1.00 0.00 N ATOM 961 CA CYS A 376 10.779 3.504 -14.191 1.00 0.00 C ATOM 962 C CYS A 376 12.238 3.935 -14.052 1.00 0.00 C ATOM 963 O CYS A 376 12.670 4.904 -14.643 1.00 0.00 O ATOM 964 CB CYS A 376 9.972 4.082 -13.024 1.00 0.00 C ATOM 965 SG CYS A 376 9.631 2.790 -11.806 1.00 0.00 S ATOM 0 H CYS A 376 10.177 1.609 -13.408 1.00 0.00 H new ATOM 0 HA CYS A 376 10.370 3.876 -15.130 1.00 0.00 H new ATOM 0 HB2 CYS A 376 10.526 4.896 -12.557 1.00 0.00 H new ATOM 0 HB3 CYS A 376 9.036 4.503 -13.392 1.00 0.00 H new ATOM 970 N ARG A 377 12.995 3.225 -13.268 1.00 0.00 N ATOM 971 CA ARG A 377 14.424 3.592 -13.076 1.00 0.00 C ATOM 972 C ARG A 377 15.173 3.456 -14.403 1.00 0.00 C ATOM 973 O ARG A 377 16.186 4.090 -14.622 1.00 0.00 O ATOM 974 CB ARG A 377 15.038 2.658 -12.036 1.00 0.00 C ATOM 975 CG ARG A 377 14.238 2.771 -10.738 1.00 0.00 C ATOM 976 CD ARG A 377 14.928 1.972 -9.633 1.00 0.00 C ATOM 977 NE ARG A 377 14.032 1.894 -8.447 1.00 0.00 N ATOM 978 CZ ARG A 377 14.164 0.916 -7.593 1.00 0.00 C ATOM 979 NH1 ARG A 377 15.083 0.008 -7.779 1.00 0.00 N ATOM 980 NH2 ARG A 377 13.377 0.847 -6.555 1.00 0.00 N ATOM 0 H ARG A 377 12.685 2.403 -12.749 1.00 0.00 H new ATOM 0 HA ARG A 377 14.499 4.624 -12.733 1.00 0.00 H new ATOM 0 HB2 ARG A 377 15.026 1.630 -12.398 1.00 0.00 H new ATOM 0 HB3 ARG A 377 16.081 2.922 -11.861 1.00 0.00 H new ATOM 0 HG2 ARG A 377 14.152 3.817 -10.443 1.00 0.00 H new ATOM 0 HG3 ARG A 377 13.225 2.398 -10.891 1.00 0.00 H new ATOM 0 HD2 ARG A 377 15.167 0.970 -9.989 1.00 0.00 H new ATOM 0 HD3 ARG A 377 15.871 2.447 -9.360 1.00 0.00 H new ATOM 0 HE ARG A 377 13.315 2.605 -8.302 1.00 0.00 H new ATOM 0 HH11 ARG A 377 15.697 0.063 -8.591 1.00 0.00 H new ATOM 0 HH12 ARG A 377 15.187 -0.757 -7.112 1.00 0.00 H new ATOM 0 HH21 ARG A 377 12.659 1.557 -6.411 1.00 0.00 H new ATOM 0 HH22 ARG A 377 13.480 0.083 -5.887 1.00 0.00 H new ATOM 994 N ASN A 378 14.681 2.637 -15.291 1.00 0.00 N ATOM 995 CA ASN A 378 15.365 2.463 -16.604 1.00 0.00 C ATOM 996 C ASN A 378 16.816 2.038 -16.372 1.00 0.00 C ATOM 997 O ASN A 378 17.729 2.547 -16.990 1.00 0.00 O ATOM 998 CB ASN A 378 15.339 3.787 -17.372 1.00 0.00 C ATOM 999 CG ASN A 378 15.592 3.522 -18.857 1.00 0.00 C ATOM 1000 OD1 ASN A 378 15.448 2.408 -19.319 1.00 0.00 O ATOM 1001 ND2 ASN A 378 15.966 4.505 -19.629 1.00 0.00 N ATOM 0 H ASN A 378 13.835 2.081 -15.165 1.00 0.00 H new ATOM 0 HA ASN A 378 14.850 1.696 -17.182 1.00 0.00 H new ATOM 0 HB2 ASN A 378 14.375 4.278 -17.239 1.00 0.00 H new ATOM 0 HB3 ASN A 378 16.098 4.463 -16.978 1.00 0.00 H new ATOM 0 HD21 ASN A 378 16.137 4.338 -20.621 1.00 0.00 H new ATOM 0 HD22 ASN A 378 16.087 5.441 -19.241 1.00 0.00 H new ATOM 1008 N ASP A 379 17.037 1.106 -15.485 1.00 0.00 N ATOM 1009 CA ASP A 379 18.426 0.649 -15.213 1.00 0.00 C ATOM 1010 C ASP A 379 18.962 -0.111 -16.428 1.00 0.00 C ATOM 1011 O ASP A 379 19.679 -1.078 -16.228 1.00 0.00 O ATOM 1012 CB ASP A 379 18.421 -0.270 -13.991 1.00 0.00 C ATOM 1013 CG ASP A 379 17.582 -1.515 -14.285 1.00 0.00 C ATOM 1014 OD1 ASP A 379 17.259 -1.731 -15.442 1.00 0.00 O ATOM 1015 OD2 ASP A 379 17.273 -2.232 -13.347 1.00 0.00 O ATOM 1016 OXT ASP A 379 18.649 0.287 -17.538 1.00 0.00 O ATOM 0 H ASP A 379 16.313 0.642 -14.937 1.00 0.00 H new ATOM 0 HA ASP A 379 19.065 1.510 -15.019 1.00 0.00 H new ATOM 0 HB2 ASP A 379 19.441 -0.559 -13.737 1.00 0.00 H new ATOM 0 HB3 ASP A 379 18.015 0.258 -13.128 1.00 0.00 H new TER 1021 ASP A 379 ATOM 1022 N ALA B 383 6.639 5.870 -0.521 1.00 0.00 N ATOM 1023 CA ALA B 383 6.244 6.202 -1.919 1.00 0.00 C ATOM 1024 C ALA B 383 4.761 6.576 -1.953 1.00 0.00 C ATOM 1025 O ALA B 383 4.151 6.828 -0.933 1.00 0.00 O ATOM 1026 CB ALA B 383 6.485 4.989 -2.819 1.00 0.00 C ATOM 0 HA ALA B 383 6.840 7.042 -2.276 1.00 0.00 H new ATOM 0 HB1 ALA B 383 6.196 5.232 -3.842 1.00 0.00 H new ATOM 0 HB2 ALA B 383 7.541 4.722 -2.794 1.00 0.00 H new ATOM 0 HB3 ALA B 383 5.889 4.148 -2.464 1.00 0.00 H new ATOM 1034 N ARG B 384 4.175 6.614 -3.120 1.00 0.00 N ATOM 1035 CA ARG B 384 2.732 6.973 -3.214 1.00 0.00 C ATOM 1036 C ARG B 384 1.911 6.043 -2.319 1.00 0.00 C ATOM 1037 O ARG B 384 0.969 6.463 -1.675 1.00 0.00 O ATOM 1038 CB ARG B 384 2.266 6.834 -4.668 1.00 0.00 C ATOM 1039 CG ARG B 384 0.772 7.161 -4.759 1.00 0.00 C ATOM 1040 CD ARG B 384 0.296 7.008 -6.204 1.00 0.00 C ATOM 1041 NE ARG B 384 0.964 8.028 -7.059 1.00 0.00 N ATOM 1042 CZ ARG B 384 0.695 8.087 -8.335 1.00 0.00 C ATOM 1043 NH1 ARG B 384 -0.160 7.253 -8.860 1.00 0.00 N ATOM 1044 NH2 ARG B 384 1.281 8.979 -9.085 1.00 0.00 N ATOM 0 H ARG B 384 4.632 6.412 -4.009 1.00 0.00 H new ATOM 0 HA ARG B 384 2.592 8.003 -2.885 1.00 0.00 H new ATOM 0 HB2 ARG B 384 2.836 7.506 -5.310 1.00 0.00 H new ATOM 0 HB3 ARG B 384 2.450 5.821 -5.025 1.00 0.00 H new ATOM 0 HG2 ARG B 384 0.205 6.497 -4.107 1.00 0.00 H new ATOM 0 HG3 ARG B 384 0.591 8.179 -4.413 1.00 0.00 H new ATOM 0 HD2 ARG B 384 0.524 6.007 -6.569 1.00 0.00 H new ATOM 0 HD3 ARG B 384 -0.786 7.127 -6.256 1.00 0.00 H new ATOM 0 HE ARG B 384 1.632 8.680 -6.648 1.00 0.00 H new ATOM 0 HH11 ARG B 384 -0.618 6.555 -8.273 1.00 0.00 H new ATOM 0 HH12 ARG B 384 -0.371 7.299 -9.857 1.00 0.00 H new ATOM 0 HH21 ARG B 384 1.950 9.631 -8.674 1.00 0.00 H new ATOM 0 HH22 ARG B 384 1.071 9.025 -10.082 1.00 0.00 H new ATOM 1058 N THR B 385 2.258 4.788 -2.275 1.00 0.00 N ATOM 1059 CA THR B 385 1.499 3.826 -1.426 1.00 0.00 C ATOM 1060 C THR B 385 -0.002 4.119 -1.520 1.00 0.00 C ATOM 1061 O THR B 385 -0.530 4.943 -0.800 1.00 0.00 O ATOM 1062 CB THR B 385 1.949 3.960 0.030 1.00 0.00 C ATOM 1063 OG1 THR B 385 3.306 4.377 0.069 1.00 0.00 O ATOM 1064 CG2 THR B 385 1.805 2.608 0.731 1.00 0.00 C ATOM 0 H THR B 385 3.038 4.384 -2.793 1.00 0.00 H new ATOM 0 HA THR B 385 1.692 2.813 -1.778 1.00 0.00 H new ATOM 0 HB THR B 385 1.330 4.699 0.538 1.00 0.00 H new ATOM 0 HG1 THR B 385 3.365 5.321 -0.186 1.00 0.00 H new ATOM 0 HG21 THR B 385 2.125 2.700 1.769 1.00 0.00 H new ATOM 0 HG22 THR B 385 0.763 2.291 0.700 1.00 0.00 H new ATOM 0 HG23 THR B 385 2.425 1.868 0.225 1.00 0.00 H new ATOM 1072 N LYS B 386 -0.691 3.441 -2.394 1.00 0.00 N ATOM 1073 CA LYS B 386 -2.156 3.664 -2.530 1.00 0.00 C ATOM 1074 C LYS B 386 -2.829 3.334 -1.200 1.00 0.00 C ATOM 1075 O LYS B 386 -3.936 3.754 -0.926 1.00 0.00 O ATOM 1076 CB LYS B 386 -2.716 2.751 -3.622 1.00 0.00 C ATOM 1077 CG LYS B 386 -4.182 3.102 -3.880 1.00 0.00 C ATOM 1078 CD LYS B 386 -4.774 2.133 -4.906 1.00 0.00 C ATOM 1079 CE LYS B 386 -5.136 0.810 -4.222 1.00 0.00 C ATOM 1080 NZ LYS B 386 -6.615 0.713 -4.081 1.00 0.00 N ATOM 0 H LYS B 386 -0.300 2.739 -3.023 1.00 0.00 H new ATOM 0 HA LYS B 386 -2.348 4.703 -2.798 1.00 0.00 H new ATOM 0 HB2 LYS B 386 -2.137 2.866 -4.538 1.00 0.00 H new ATOM 0 HB3 LYS B 386 -2.629 1.708 -3.318 1.00 0.00 H new ATOM 0 HG2 LYS B 386 -4.747 3.051 -2.949 1.00 0.00 H new ATOM 0 HG3 LYS B 386 -4.262 4.126 -4.245 1.00 0.00 H new ATOM 0 HD2 LYS B 386 -5.661 2.571 -5.364 1.00 0.00 H new ATOM 0 HD3 LYS B 386 -4.057 1.954 -5.707 1.00 0.00 H new ATOM 0 HE2 LYS B 386 -4.760 -0.029 -4.807 1.00 0.00 H new ATOM 0 HE3 LYS B 386 -4.662 0.753 -3.242 1.00 0.00 H new ATOM 0 HZ1 LYS B 386 -6.874 -0.252 -3.792 1.00 0.00 H new ATOM 0 HZ2 LYS B 386 -6.940 1.389 -3.361 1.00 0.00 H new ATOM 0 HZ3 LYS B 386 -7.066 0.934 -4.992 1.00 0.00 H new ATOM 1094 N GLN B 387 -2.168 2.565 -0.382 1.00 0.00 N ATOM 1095 CA GLN B 387 -2.759 2.177 0.926 1.00 0.00 C ATOM 1096 C GLN B 387 -3.295 3.420 1.637 1.00 0.00 C ATOM 1097 O GLN B 387 -4.235 3.353 2.403 1.00 0.00 O ATOM 1098 CB GLN B 387 -1.680 1.532 1.797 1.00 0.00 C ATOM 1099 CG GLN B 387 -1.139 0.285 1.099 1.00 0.00 C ATOM 1100 CD GLN B 387 -0.031 -0.336 1.951 1.00 0.00 C ATOM 1101 OE1 GLN B 387 0.506 0.306 2.831 1.00 0.00 O ATOM 1102 NE2 GLN B 387 0.336 -1.568 1.726 1.00 0.00 N ATOM 0 H GLN B 387 -1.239 2.187 -0.565 1.00 0.00 H new ATOM 0 HA GLN B 387 -3.573 1.472 0.759 1.00 0.00 H new ATOM 0 HB2 GLN B 387 -0.871 2.240 1.977 1.00 0.00 H new ATOM 0 HB3 GLN B 387 -2.094 1.266 2.770 1.00 0.00 H new ATOM 0 HG2 GLN B 387 -1.942 -0.436 0.946 1.00 0.00 H new ATOM 0 HG3 GLN B 387 -0.752 0.546 0.114 1.00 0.00 H new ATOM 0 HE21 GLN B 387 -0.115 -2.108 0.987 1.00 0.00 H new ATOM 0 HE22 GLN B 387 1.074 -1.991 2.289 1.00 0.00 H new ATOM 1111 N THR B 388 -2.700 4.554 1.395 1.00 0.00 N ATOM 1112 CA THR B 388 -3.168 5.800 2.063 1.00 0.00 C ATOM 1113 C THR B 388 -4.625 6.073 1.679 1.00 0.00 C ATOM 1114 O THR B 388 -5.368 6.681 2.425 1.00 0.00 O ATOM 1115 CB THR B 388 -2.292 6.971 1.613 1.00 0.00 C ATOM 1116 OG1 THR B 388 -2.555 7.257 0.246 1.00 0.00 O ATOM 1117 CG2 THR B 388 -0.819 6.599 1.780 1.00 0.00 C ATOM 0 H THR B 388 -1.909 4.672 0.762 1.00 0.00 H new ATOM 0 HA THR B 388 -3.098 5.684 3.144 1.00 0.00 H new ATOM 0 HB THR B 388 -2.516 7.848 2.220 1.00 0.00 H new ATOM 0 HG1 THR B 388 -2.017 6.666 -0.321 1.00 0.00 H new ATOM 0 HG21 THR B 388 -0.195 7.433 1.460 1.00 0.00 H new ATOM 0 HG22 THR B 388 -0.617 6.376 2.828 1.00 0.00 H new ATOM 0 HG23 THR B 388 -0.594 5.723 1.172 1.00 0.00 H new ATOM 1125 N ALA B 389 -5.041 5.631 0.524 1.00 0.00 N ATOM 1126 CA ALA B 389 -6.450 5.871 0.100 1.00 0.00 C ATOM 1127 C ALA B 389 -7.406 5.162 1.065 1.00 0.00 C ATOM 1128 O ALA B 389 -8.440 5.688 1.427 1.00 0.00 O ATOM 1129 CB ALA B 389 -6.657 5.326 -1.314 1.00 0.00 C ATOM 0 H ALA B 389 -4.468 5.115 -0.143 1.00 0.00 H new ATOM 0 HA ALA B 389 -6.653 6.942 0.111 1.00 0.00 H new ATOM 0 HB1 ALA B 389 -7.687 5.501 -1.624 1.00 0.00 H new ATOM 0 HB2 ALA B 389 -5.980 5.832 -2.002 1.00 0.00 H new ATOM 0 HB3 ALA B 389 -6.452 4.256 -1.325 1.00 0.00 H new ATOM 1135 N ARG B 390 -7.068 3.974 1.487 1.00 0.00 N ATOM 1136 CA ARG B 390 -7.957 3.235 2.429 1.00 0.00 C ATOM 1137 C ARG B 390 -9.393 3.226 1.892 1.00 0.00 C ATOM 1138 O ARG B 390 -10.325 3.567 2.592 1.00 0.00 O ATOM 1139 CB ARG B 390 -7.931 3.919 3.798 1.00 0.00 C ATOM 1140 CG ARG B 390 -6.520 3.834 4.384 1.00 0.00 C ATOM 1141 CD ARG B 390 -6.520 4.417 5.799 1.00 0.00 C ATOM 1142 NE ARG B 390 -5.118 4.516 6.294 1.00 0.00 N ATOM 1143 CZ ARG B 390 -4.820 5.360 7.244 1.00 0.00 C ATOM 1144 NH1 ARG B 390 -5.750 6.117 7.759 1.00 0.00 N ATOM 1145 NH2 ARG B 390 -3.593 5.447 7.679 1.00 0.00 N ATOM 0 H ARG B 390 -6.215 3.483 1.220 1.00 0.00 H new ATOM 0 HA ARG B 390 -7.603 2.209 2.525 1.00 0.00 H new ATOM 0 HB2 ARG B 390 -8.234 4.962 3.701 1.00 0.00 H new ATOM 0 HB3 ARG B 390 -8.644 3.441 4.469 1.00 0.00 H new ATOM 0 HG2 ARG B 390 -6.186 2.797 4.406 1.00 0.00 H new ATOM 0 HG3 ARG B 390 -5.819 4.381 3.754 1.00 0.00 H new ATOM 0 HD2 ARG B 390 -6.987 5.402 5.798 1.00 0.00 H new ATOM 0 HD3 ARG B 390 -7.108 3.785 6.464 1.00 0.00 H new ATOM 0 HE ARG B 390 -4.392 3.924 5.891 1.00 0.00 H new ATOM 0 HH11 ARG B 390 -6.709 6.049 7.419 1.00 0.00 H new ATOM 0 HH12 ARG B 390 -5.518 6.777 8.501 1.00 0.00 H new ATOM 0 HH21 ARG B 390 -2.866 4.855 7.277 1.00 0.00 H new ATOM 0 HH22 ARG B 390 -3.361 6.107 8.421 1.00 0.00 H new ATOM 1159 N LYS B 391 -9.574 2.840 0.656 1.00 0.00 N ATOM 1160 CA LYS B 391 -10.948 2.807 0.070 1.00 0.00 C ATOM 1161 C LYS B 391 -11.323 1.361 -0.272 1.00 0.00 C ATOM 1162 O LYS B 391 -10.481 0.560 -0.626 1.00 0.00 O ATOM 1163 CB LYS B 391 -10.978 3.666 -1.195 1.00 0.00 C ATOM 1164 CG LYS B 391 -10.670 5.117 -0.822 1.00 0.00 C ATOM 1165 CD LYS B 391 -10.801 6.002 -2.060 1.00 0.00 C ATOM 1166 CE LYS B 391 -10.399 7.436 -1.708 1.00 0.00 C ATOM 1167 NZ LYS B 391 -11.347 8.390 -2.351 1.00 0.00 N ATOM 0 H LYS B 391 -8.828 2.545 0.025 1.00 0.00 H new ATOM 0 HA LYS B 391 -11.665 3.201 0.790 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -10.247 3.300 -1.916 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -11.956 3.600 -1.671 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -11.355 5.457 -0.045 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -9.662 5.192 -0.414 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -10.167 5.622 -2.861 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -11.827 5.981 -2.428 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -10.407 7.572 -0.627 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -9.382 7.633 -2.047 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -10.901 9.327 -2.423 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -11.591 8.049 -3.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -12.211 8.461 -1.777 1.00 0.00 H new ATOM 1181 N SER B 392 -12.579 1.018 -0.158 1.00 0.00 N ATOM 1182 CA SER B 392 -13.001 -0.381 -0.465 1.00 0.00 C ATOM 1183 C SER B 392 -14.473 -0.400 -0.891 1.00 0.00 C ATOM 1184 O SER B 392 -15.153 0.606 -0.851 1.00 0.00 O ATOM 1185 CB SER B 392 -12.819 -1.245 0.783 1.00 0.00 C ATOM 1186 OG SER B 392 -13.815 -0.905 1.738 1.00 0.00 O ATOM 0 H SER B 392 -13.330 1.644 0.134 1.00 0.00 H new ATOM 0 HA SER B 392 -12.390 -0.774 -1.278 1.00 0.00 H new ATOM 0 HB2 SER B 392 -12.894 -2.301 0.523 1.00 0.00 H new ATOM 0 HB3 SER B 392 -11.826 -1.090 1.205 1.00 0.00 H new ATOM 0 HG SER B 392 -14.437 -1.655 1.843 1.00 0.00 H new ATOM 1192 N THR B 393 -14.971 -1.540 -1.298 1.00 0.00 N ATOM 1193 CA THR B 393 -16.399 -1.624 -1.726 1.00 0.00 C ATOM 1194 C THR B 393 -17.297 -1.065 -0.621 1.00 0.00 C ATOM 1195 O THR B 393 -18.267 -0.381 -0.883 1.00 0.00 O ATOM 1196 CB THR B 393 -16.775 -3.084 -1.991 1.00 0.00 C ATOM 1197 OG1 THR B 393 -15.868 -3.642 -2.932 1.00 0.00 O ATOM 1198 CG2 THR B 393 -18.197 -3.152 -2.551 1.00 0.00 C ATOM 0 H THR B 393 -14.450 -2.415 -1.352 1.00 0.00 H new ATOM 0 HA THR B 393 -16.534 -1.043 -2.638 1.00 0.00 H new ATOM 0 HB THR B 393 -16.725 -3.647 -1.059 1.00 0.00 H new ATOM 0 HG1 THR B 393 -16.370 -4.058 -3.664 1.00 0.00 H new ATOM 0 HG21 THR B 393 -18.464 -4.192 -2.740 1.00 0.00 H new ATOM 0 HG22 THR B 393 -18.893 -2.723 -1.830 1.00 0.00 H new ATOM 0 HG23 THR B 393 -18.248 -2.589 -3.483 1.00 0.00 H new ATOM 1206 N GLY B 394 -16.983 -1.348 0.614 1.00 0.00 N ATOM 1207 CA GLY B 394 -17.821 -0.832 1.733 1.00 0.00 C ATOM 1208 C GLY B 394 -17.121 -1.107 3.064 1.00 0.00 C ATOM 1209 O GLY B 394 -15.935 -1.396 3.040 1.00 0.00 O ATOM 1210 OXT GLY B 394 -17.781 -1.023 4.087 1.00 0.00 O ATOM 0 H GLY B 394 -16.183 -1.914 0.896 1.00 0.00 H new ATOM 0 HA2 GLY B 394 -17.988 0.238 1.612 1.00 0.00 H new ATOM 0 HA3 GLY B 394 -18.800 -1.311 1.719 1.00 0.00 H new TER 1214 GLY B 394 HETATM 1215 ZN ZN A 380 -9.384 4.123 -10.929 1.00 0.00 ZN HETATM 1216 ZN ZN A 381 -4.341 -9.187 -7.683 1.00 0.00 ZN HETATM 1217 ZN ZN A 382 7.401 2.641 -11.264 1.00 0.00 ZN