USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=16 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 Set 1.1: A 367 SER OG : rot 130:sc= 0 USER MOD Set 1.2: B 385 THR OG1 : rot -179:sc= -0.38 USER MOD Set 2.1: A 316 LYS NZ :NH3+ 173:sc= -0.521 (180deg=-0.0604) USER MOD Set 2.2: A 317 HIS : no HD1:sc= -2 K(o=-2.5,f=-1.7) USER MOD Single : A 311 SER OG : rot 29:sc= 0.357 USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 319 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 323 ASN : amide:sc=-0.000838 K(o=-0.00084,f=-1.6!) USER MOD Single : A 332 HIS : no HD1:sc= 0 X(o=0,f=-0.0068) USER MOD Single : A 338 GLN : amide:sc= -1.18! K(o=-1.2!,f=0) USER MOD Single : A 342 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 343 GLN : amide:sc= -2.73! C(o=-2.7!,f=-2.9!) USER MOD Single : A 345 MET CE :methyl 159:sc= -2.21 (180deg=-3.41) USER MOD Single : A 351 MET CE :methyl -162:sc= -1.07 (180deg=-2.32) USER MOD Single : A 354 HIS : no HD1:sc= -9.59! C(o=-9.6!,f=-11!) USER MOD Single : A 356 TYR OH : rot 0:sc= -0.395 USER MOD Single : A 363 SER OG : rot -56:sc= 0.234 USER MOD Single : A 364 SER OG : rot 180:sc= 0 USER MOD Single : A 372 TYR OH : rot 180:sc= 0 USER MOD Single : A 378 ASN : amide:sc= -0.103 K(o=-0.1,f=-2.2!) USER MOD Single : B 386 LYS NZ :NH3+ 165:sc= -2.34! (180deg=-3.34!) USER MOD Single : B 387 GLN : amide:sc= -0.337 K(o=-0.34,f=-1.4!) USER MOD Single : B 388 THR OG1 : rot -47:sc= 0.581 USER MOD Single : B 391 LYS NZ :NH3+ 141:sc= -1.42 (180deg=-4.03!) USER MOD Single : B 392 SER OG : rot -99:sc= -5.56! USER MOD Single : B 393 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 311 2.087 14.169 -14.188 1.00 0.00 N ATOM 2 CA SER A 311 0.692 13.653 -14.103 1.00 0.00 C ATOM 3 C SER A 311 0.175 13.819 -12.672 1.00 0.00 C ATOM 4 O SER A 311 0.792 13.376 -11.724 1.00 0.00 O ATOM 5 CB SER A 311 0.672 12.173 -14.484 1.00 0.00 C ATOM 6 OG SER A 311 1.446 11.982 -15.661 1.00 0.00 O ATOM 0 HA SER A 311 0.054 14.212 -14.788 1.00 0.00 H new ATOM 0 HB2 SER A 311 1.073 11.570 -13.669 1.00 0.00 H new ATOM 0 HB3 SER A 311 -0.353 11.842 -14.651 1.00 0.00 H new ATOM 0 HG SER A 311 2.155 12.658 -15.700 1.00 0.00 H new ATOM 14 N GLY A 312 -0.954 14.453 -12.510 1.00 0.00 N ATOM 15 CA GLY A 312 -1.510 14.647 -11.140 1.00 0.00 C ATOM 16 C GLY A 312 -1.934 13.293 -10.564 1.00 0.00 C ATOM 17 O GLY A 312 -2.214 12.361 -11.292 1.00 0.00 O ATOM 0 H GLY A 312 -1.515 14.845 -13.266 1.00 0.00 H new ATOM 0 HA2 GLY A 312 -0.763 15.111 -10.495 1.00 0.00 H new ATOM 0 HA3 GLY A 312 -2.364 15.323 -11.175 1.00 0.00 H new ATOM 21 N PRO A 313 -1.978 13.186 -9.261 1.00 0.00 N ATOM 22 CA PRO A 313 -2.372 11.927 -8.564 1.00 0.00 C ATOM 23 C PRO A 313 -3.866 11.633 -8.707 1.00 0.00 C ATOM 24 O PRO A 313 -4.319 10.532 -8.468 1.00 0.00 O ATOM 25 CB PRO A 313 -2.026 12.200 -7.101 1.00 0.00 C ATOM 26 CG PRO A 313 -2.112 13.681 -6.962 1.00 0.00 C ATOM 27 CD PRO A 313 -1.663 14.259 -8.304 1.00 0.00 C ATOM 0 HA PRO A 313 -1.863 11.058 -8.980 1.00 0.00 H new ATOM 0 HB2 PRO A 313 -2.722 11.698 -6.429 1.00 0.00 H new ATOM 0 HB3 PRO A 313 -1.028 11.836 -6.856 1.00 0.00 H new ATOM 0 HG2 PRO A 313 -3.129 13.992 -6.725 1.00 0.00 H new ATOM 0 HG3 PRO A 313 -1.474 14.034 -6.152 1.00 0.00 H new ATOM 0 HD2 PRO A 313 -2.195 15.180 -8.543 1.00 0.00 H new ATOM 0 HD3 PRO A 313 -0.599 14.497 -8.303 1.00 0.00 H new ATOM 35 N SER A 314 -4.636 12.616 -9.085 1.00 0.00 N ATOM 36 CA SER A 314 -6.100 12.397 -9.231 1.00 0.00 C ATOM 37 C SER A 314 -6.352 11.316 -10.281 1.00 0.00 C ATOM 38 O SER A 314 -5.657 11.220 -11.272 1.00 0.00 O ATOM 39 CB SER A 314 -6.768 13.700 -9.671 1.00 0.00 C ATOM 40 OG SER A 314 -6.498 14.713 -8.711 1.00 0.00 O ATOM 0 H SER A 314 -4.314 13.560 -9.299 1.00 0.00 H new ATOM 0 HA SER A 314 -6.517 12.079 -8.275 1.00 0.00 H new ATOM 0 HB2 SER A 314 -6.394 14.001 -10.650 1.00 0.00 H new ATOM 0 HB3 SER A 314 -7.844 13.555 -9.771 1.00 0.00 H new ATOM 0 HG SER A 314 -6.923 15.550 -8.991 1.00 0.00 H new ATOM 46 N CYS A 315 -7.346 10.501 -10.066 1.00 0.00 N ATOM 47 CA CYS A 315 -7.653 9.421 -11.047 1.00 0.00 C ATOM 48 C CYS A 315 -8.751 9.891 -11.998 1.00 0.00 C ATOM 49 O CYS A 315 -9.865 10.148 -11.587 1.00 0.00 O ATOM 50 CB CYS A 315 -8.175 8.187 -10.313 1.00 0.00 C ATOM 51 SG CYS A 315 -6.848 7.006 -10.013 1.00 0.00 S ATOM 0 H CYS A 315 -7.960 10.535 -9.253 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.742 9.182 -11.596 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -8.622 8.485 -9.365 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -8.961 7.714 -10.902 1.00 0.00 H new ATOM 56 N LYS A 316 -8.468 9.975 -13.264 1.00 0.00 N ATOM 57 CA LYS A 316 -9.529 10.393 -14.215 1.00 0.00 C ATOM 58 C LYS A 316 -10.440 9.190 -14.453 1.00 0.00 C ATOM 59 O LYS A 316 -11.500 9.297 -15.039 1.00 0.00 O ATOM 60 CB LYS A 316 -8.897 10.843 -15.531 1.00 0.00 C ATOM 61 CG LYS A 316 -8.315 9.634 -16.249 1.00 0.00 C ATOM 62 CD LYS A 316 -7.521 10.096 -17.472 1.00 0.00 C ATOM 63 CE LYS A 316 -7.221 8.896 -18.372 1.00 0.00 C ATOM 64 NZ LYS A 316 -6.268 7.982 -17.682 1.00 0.00 N ATOM 0 H LYS A 316 -7.558 9.775 -13.679 1.00 0.00 H new ATOM 0 HA LYS A 316 -10.102 11.227 -13.809 1.00 0.00 H new ATOM 0 HB2 LYS A 316 -9.644 11.329 -16.159 1.00 0.00 H new ATOM 0 HB3 LYS A 316 -8.115 11.578 -15.340 1.00 0.00 H new ATOM 0 HG2 LYS A 316 -7.668 9.074 -15.574 1.00 0.00 H new ATOM 0 HG3 LYS A 316 -9.115 8.961 -16.556 1.00 0.00 H new ATOM 0 HD2 LYS A 316 -8.088 10.845 -18.025 1.00 0.00 H new ATOM 0 HD3 LYS A 316 -6.591 10.569 -17.157 1.00 0.00 H new ATOM 0 HE2 LYS A 316 -8.144 8.366 -18.608 1.00 0.00 H new ATOM 0 HE3 LYS A 316 -6.797 9.234 -19.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 -6.156 7.112 -18.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 -5.345 8.452 -17.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 -6.637 7.744 -16.739 1.00 0.00 H new ATOM 78 N HIS A 317 -10.014 8.039 -14.001 1.00 0.00 N ATOM 79 CA HIS A 317 -10.817 6.804 -14.187 1.00 0.00 C ATOM 80 C HIS A 317 -11.239 6.233 -12.828 1.00 0.00 C ATOM 81 O HIS A 317 -11.819 5.168 -12.754 1.00 0.00 O ATOM 82 CB HIS A 317 -9.966 5.772 -14.925 1.00 0.00 C ATOM 83 CG HIS A 317 -10.064 6.006 -16.407 1.00 0.00 C ATOM 84 ND1 HIS A 317 -11.256 5.850 -17.104 1.00 0.00 N ATOM 85 CD2 HIS A 317 -9.131 6.384 -17.340 1.00 0.00 C ATOM 86 CE1 HIS A 317 -11.008 6.131 -18.397 1.00 0.00 C ATOM 87 NE2 HIS A 317 -9.731 6.460 -18.592 1.00 0.00 N ATOM 0 H HIS A 317 -9.132 7.906 -13.505 1.00 0.00 H new ATOM 0 HA HIS A 317 -11.712 7.039 -14.762 1.00 0.00 H new ATOM 0 HB2 HIS A 317 -8.927 5.845 -14.603 1.00 0.00 H new ATOM 0 HB3 HIS A 317 -10.305 4.765 -14.682 1.00 0.00 H new ATOM 0 HD2 HIS A 317 -8.091 6.591 -17.134 1.00 0.00 H new ATOM 0 HE1 HIS A 317 -11.752 6.094 -19.179 1.00 0.00 H new ATOM 0 HE2 HIS A 317 -9.287 6.714 -19.474 1.00 0.00 H new ATOM 96 N CYS A 318 -10.948 6.914 -11.750 1.00 0.00 N ATOM 97 CA CYS A 318 -11.337 6.370 -10.414 1.00 0.00 C ATOM 98 C CYS A 318 -12.796 5.937 -10.455 1.00 0.00 C ATOM 99 O CYS A 318 -13.698 6.730 -10.275 1.00 0.00 O ATOM 100 CB CYS A 318 -11.169 7.434 -9.327 1.00 0.00 C ATOM 101 SG CYS A 318 -10.060 6.810 -8.026 1.00 0.00 S ATOM 0 H CYS A 318 -10.464 7.812 -11.735 1.00 0.00 H new ATOM 0 HA CYS A 318 -10.693 5.521 -10.183 1.00 0.00 H new ATOM 0 HB2 CYS A 318 -10.761 8.348 -9.759 1.00 0.00 H new ATOM 0 HB3 CYS A 318 -12.139 7.689 -8.900 1.00 0.00 H new ATOM 106 N LYS A 319 -13.036 4.683 -10.684 1.00 0.00 N ATOM 107 CA LYS A 319 -14.433 4.202 -10.728 1.00 0.00 C ATOM 108 C LYS A 319 -15.077 4.474 -9.372 1.00 0.00 C ATOM 109 O LYS A 319 -16.278 4.625 -9.261 1.00 0.00 O ATOM 110 CB LYS A 319 -14.444 2.701 -10.997 1.00 0.00 C ATOM 111 CG LYS A 319 -13.506 2.367 -12.166 1.00 0.00 C ATOM 112 CD LYS A 319 -13.942 3.107 -13.435 1.00 0.00 C ATOM 113 CE LYS A 319 -13.073 2.649 -14.609 1.00 0.00 C ATOM 114 NZ LYS A 319 -13.946 2.253 -15.750 1.00 0.00 N ATOM 0 H LYS A 319 -12.323 3.971 -10.843 1.00 0.00 H new ATOM 0 HA LYS A 319 -14.982 4.714 -11.518 1.00 0.00 H new ATOM 0 HB2 LYS A 319 -14.130 2.161 -10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 319 -15.457 2.373 -11.228 1.00 0.00 H new ATOM 0 HG2 LYS A 319 -12.484 2.644 -11.910 1.00 0.00 H new ATOM 0 HG3 LYS A 319 -13.509 1.292 -12.346 1.00 0.00 H new ATOM 0 HD2 LYS A 319 -14.993 2.906 -13.645 1.00 0.00 H new ATOM 0 HD3 LYS A 319 -13.845 4.184 -13.294 1.00 0.00 H new ATOM 0 HE2 LYS A 319 -12.401 3.452 -14.913 1.00 0.00 H new ATOM 0 HE3 LYS A 319 -12.448 1.808 -14.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 319 -13.355 1.942 -16.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 319 -14.569 1.474 -15.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 319 -14.524 3.066 -16.044 1.00 0.00 H new ATOM 128 N ASP A 320 -14.284 4.541 -8.338 1.00 0.00 N ATOM 129 CA ASP A 320 -14.855 4.806 -6.990 1.00 0.00 C ATOM 130 C ASP A 320 -16.078 3.911 -6.771 1.00 0.00 C ATOM 131 O ASP A 320 -17.056 4.317 -6.175 1.00 0.00 O ATOM 132 CB ASP A 320 -15.280 6.268 -6.915 1.00 0.00 C ATOM 133 CG ASP A 320 -14.043 7.167 -6.974 1.00 0.00 C ATOM 134 OD1 ASP A 320 -12.950 6.646 -6.822 1.00 0.00 O ATOM 135 OD2 ASP A 320 -14.209 8.359 -7.169 1.00 0.00 O ATOM 0 H ASP A 320 -13.271 4.424 -8.369 1.00 0.00 H new ATOM 0 HA ASP A 320 -14.110 4.595 -6.223 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -15.953 6.504 -7.739 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -15.830 6.450 -5.992 1.00 0.00 H new ATOM 140 N ASP A 321 -16.034 2.699 -7.251 1.00 0.00 N ATOM 141 CA ASP A 321 -17.196 1.784 -7.073 1.00 0.00 C ATOM 142 C ASP A 321 -16.924 0.826 -5.914 1.00 0.00 C ATOM 143 O ASP A 321 -15.874 0.225 -5.828 1.00 0.00 O ATOM 144 CB ASP A 321 -17.408 0.970 -8.348 1.00 0.00 C ATOM 145 CG ASP A 321 -18.714 0.180 -8.240 1.00 0.00 C ATOM 146 OD1 ASP A 321 -19.425 0.379 -7.269 1.00 0.00 O ATOM 147 OD2 ASP A 321 -18.981 -0.611 -9.129 1.00 0.00 O ATOM 0 H ASP A 321 -15.243 2.303 -7.759 1.00 0.00 H new ATOM 0 HA ASP A 321 -18.086 2.377 -6.860 1.00 0.00 H new ATOM 0 HB2 ASP A 321 -17.442 1.632 -9.213 1.00 0.00 H new ATOM 0 HB3 ASP A 321 -16.571 0.289 -8.501 1.00 0.00 H new ATOM 152 N VAL A 322 -17.860 0.657 -5.029 1.00 0.00 N ATOM 153 CA VAL A 322 -17.635 -0.287 -3.904 1.00 0.00 C ATOM 154 C VAL A 322 -17.585 -1.707 -4.466 1.00 0.00 C ATOM 155 O VAL A 322 -16.856 -2.552 -3.990 1.00 0.00 O ATOM 156 CB VAL A 322 -18.772 -0.167 -2.886 1.00 0.00 C ATOM 157 CG1 VAL A 322 -18.624 -1.258 -1.823 1.00 0.00 C ATOM 158 CG2 VAL A 322 -18.706 1.206 -2.214 1.00 0.00 C ATOM 0 H VAL A 322 -18.765 1.127 -5.034 1.00 0.00 H new ATOM 0 HA VAL A 322 -16.696 -0.052 -3.403 1.00 0.00 H new ATOM 0 HB VAL A 322 -19.729 -0.282 -3.394 1.00 0.00 H new ATOM 0 HG11 VAL A 322 -19.434 -1.172 -1.098 1.00 0.00 H new ATOM 0 HG12 VAL A 322 -18.665 -2.238 -2.299 1.00 0.00 H new ATOM 0 HG13 VAL A 322 -17.667 -1.142 -1.313 1.00 0.00 H new ATOM 0 HG21 VAL A 322 -19.514 1.295 -1.488 1.00 0.00 H new ATOM 0 HG22 VAL A 322 -17.748 1.317 -1.706 1.00 0.00 H new ATOM 0 HG23 VAL A 322 -18.808 1.986 -2.969 1.00 0.00 H new ATOM 168 N ASN A 323 -18.354 -1.969 -5.488 1.00 0.00 N ATOM 169 CA ASN A 323 -18.356 -3.324 -6.098 1.00 0.00 C ATOM 170 C ASN A 323 -17.048 -3.535 -6.852 1.00 0.00 C ATOM 171 O ASN A 323 -16.495 -4.617 -6.874 1.00 0.00 O ATOM 172 CB ASN A 323 -19.531 -3.436 -7.068 1.00 0.00 C ATOM 173 CG ASN A 323 -20.847 -3.334 -6.294 1.00 0.00 C ATOM 174 OD1 ASN A 323 -20.872 -3.510 -5.091 1.00 0.00 O ATOM 175 ND2 ASN A 323 -21.947 -3.057 -6.936 1.00 0.00 N ATOM 0 H ASN A 323 -18.983 -1.297 -5.927 1.00 0.00 H new ATOM 0 HA ASN A 323 -18.454 -4.081 -5.320 1.00 0.00 H new ATOM 0 HB2 ASN A 323 -19.475 -2.645 -7.816 1.00 0.00 H new ATOM 0 HB3 ASN A 323 -19.485 -4.384 -7.603 1.00 0.00 H new ATOM 0 HD21 ASN A 323 -22.830 -2.988 -6.429 1.00 0.00 H new ATOM 0 HD22 ASN A 323 -21.925 -2.909 -7.945 1.00 0.00 H new ATOM 182 N ARG A 324 -16.552 -2.500 -7.475 1.00 0.00 N ATOM 183 CA ARG A 324 -15.281 -2.619 -8.237 1.00 0.00 C ATOM 184 C ARG A 324 -14.289 -1.588 -7.702 1.00 0.00 C ATOM 185 O ARG A 324 -14.601 -0.422 -7.581 1.00 0.00 O ATOM 186 CB ARG A 324 -15.559 -2.341 -9.714 1.00 0.00 C ATOM 187 CG ARG A 324 -16.611 -3.320 -10.228 1.00 0.00 C ATOM 188 CD ARG A 324 -16.820 -3.105 -11.727 1.00 0.00 C ATOM 189 NE ARG A 324 -17.979 -3.917 -12.190 1.00 0.00 N ATOM 190 CZ ARG A 324 -18.243 -4.011 -13.464 1.00 0.00 C ATOM 191 NH1 ARG A 324 -17.491 -3.393 -14.334 1.00 0.00 N ATOM 192 NH2 ARG A 324 -19.257 -4.725 -13.870 1.00 0.00 N ATOM 0 H ARG A 324 -16.977 -1.573 -7.487 1.00 0.00 H new ATOM 0 HA ARG A 324 -14.867 -3.621 -8.126 1.00 0.00 H new ATOM 0 HB2 ARG A 324 -15.907 -1.316 -9.843 1.00 0.00 H new ATOM 0 HB3 ARG A 324 -14.641 -2.441 -10.293 1.00 0.00 H new ATOM 0 HG2 ARG A 324 -16.293 -4.345 -10.038 1.00 0.00 H new ATOM 0 HG3 ARG A 324 -17.550 -3.174 -9.695 1.00 0.00 H new ATOM 0 HD2 ARG A 324 -16.997 -2.049 -11.932 1.00 0.00 H new ATOM 0 HD3 ARG A 324 -15.921 -3.390 -12.274 1.00 0.00 H new ATOM 0 HE ARG A 324 -18.567 -4.400 -11.511 1.00 0.00 H new ATOM 0 HH11 ARG A 324 -16.697 -2.837 -14.018 1.00 0.00 H new ATOM 0 HH12 ARG A 324 -17.698 -3.467 -15.330 1.00 0.00 H new ATOM 0 HH21 ARG A 324 -19.844 -5.210 -13.191 1.00 0.00 H new ATOM 0 HH22 ARG A 324 -19.463 -4.798 -14.866 1.00 0.00 H new ATOM 206 N LEU A 325 -13.098 -1.996 -7.372 1.00 0.00 N ATOM 207 CA LEU A 325 -12.115 -1.018 -6.834 1.00 0.00 C ATOM 208 C LEU A 325 -11.270 -0.441 -7.969 1.00 0.00 C ATOM 209 O LEU A 325 -10.874 -1.134 -8.885 1.00 0.00 O ATOM 210 CB LEU A 325 -11.207 -1.708 -5.815 1.00 0.00 C ATOM 211 CG LEU A 325 -11.053 -0.813 -4.586 1.00 0.00 C ATOM 212 CD1 LEU A 325 -10.093 -1.472 -3.595 1.00 0.00 C ATOM 213 CD2 LEU A 325 -10.498 0.553 -5.000 1.00 0.00 C ATOM 0 H LEU A 325 -12.764 -2.957 -7.450 1.00 0.00 H new ATOM 0 HA LEU A 325 -12.655 -0.206 -6.347 1.00 0.00 H new ATOM 0 HB2 LEU A 325 -11.630 -2.670 -5.527 1.00 0.00 H new ATOM 0 HB3 LEU A 325 -10.231 -1.908 -6.258 1.00 0.00 H new ATOM 0 HG LEU A 325 -12.028 -0.676 -4.118 1.00 0.00 H new ATOM 0 HD11 LEU A 325 -9.982 -0.835 -2.718 1.00 0.00 H new ATOM 0 HD12 LEU A 325 -10.491 -2.441 -3.292 1.00 0.00 H new ATOM 0 HD13 LEU A 325 -9.121 -1.611 -4.068 1.00 0.00 H new ATOM 0 HD21 LEU A 325 -10.391 1.185 -4.118 1.00 0.00 H new ATOM 0 HD22 LEU A 325 -9.525 0.422 -5.473 1.00 0.00 H new ATOM 0 HD23 LEU A 325 -11.183 1.026 -5.704 1.00 0.00 H new ATOM 225 N CYS A 326 -10.994 0.830 -7.905 1.00 0.00 N ATOM 226 CA CYS A 326 -10.177 1.486 -8.960 1.00 0.00 C ATOM 227 C CYS A 326 -8.832 0.765 -9.097 1.00 0.00 C ATOM 228 O CYS A 326 -8.033 0.738 -8.183 1.00 0.00 O ATOM 229 CB CYS A 326 -9.947 2.940 -8.552 1.00 0.00 C ATOM 230 SG CYS A 326 -8.590 3.651 -9.511 1.00 0.00 S ATOM 0 H CYS A 326 -11.304 1.450 -7.157 1.00 0.00 H new ATOM 0 HA CYS A 326 -10.694 1.443 -9.918 1.00 0.00 H new ATOM 0 HB2 CYS A 326 -10.857 3.518 -8.712 1.00 0.00 H new ATOM 0 HB3 CYS A 326 -9.717 2.995 -7.488 1.00 0.00 H new ATOM 235 N ARG A 327 -8.584 0.175 -10.236 1.00 0.00 N ATOM 236 CA ARG A 327 -7.298 -0.554 -10.446 1.00 0.00 C ATOM 237 C ARG A 327 -6.106 0.390 -10.272 1.00 0.00 C ATOM 238 O ARG A 327 -5.066 0.000 -9.778 1.00 0.00 O ATOM 239 CB ARG A 327 -7.283 -1.153 -11.854 1.00 0.00 C ATOM 240 CG ARG A 327 -8.266 -2.322 -11.909 1.00 0.00 C ATOM 241 CD ARG A 327 -8.264 -2.942 -13.306 1.00 0.00 C ATOM 242 NE ARG A 327 -9.272 -4.038 -13.346 1.00 0.00 N ATOM 243 CZ ARG A 327 -9.677 -4.514 -14.492 1.00 0.00 C ATOM 244 NH1 ARG A 327 -9.200 -4.027 -15.605 1.00 0.00 N ATOM 245 NH2 ARG A 327 -10.557 -5.476 -14.525 1.00 0.00 N ATOM 0 H ARG A 327 -9.219 0.166 -11.034 1.00 0.00 H new ATOM 0 HA ARG A 327 -7.217 -1.349 -9.704 1.00 0.00 H new ATOM 0 HB2 ARG A 327 -7.558 -0.396 -12.588 1.00 0.00 H new ATOM 0 HB3 ARG A 327 -6.279 -1.493 -12.107 1.00 0.00 H new ATOM 0 HG2 ARG A 327 -7.992 -3.073 -11.168 1.00 0.00 H new ATOM 0 HG3 ARG A 327 -9.269 -1.977 -11.657 1.00 0.00 H new ATOM 0 HD2 ARG A 327 -8.499 -2.186 -14.055 1.00 0.00 H new ATOM 0 HD3 ARG A 327 -7.274 -3.331 -13.545 1.00 0.00 H new ATOM 0 HE ARG A 327 -9.646 -4.417 -12.476 1.00 0.00 H new ATOM 0 HH11 ARG A 327 -8.511 -3.275 -15.579 1.00 0.00 H new ATOM 0 HH12 ARG A 327 -9.516 -4.398 -16.501 1.00 0.00 H new ATOM 0 HH21 ARG A 327 -10.929 -5.857 -13.655 1.00 0.00 H new ATOM 0 HH22 ARG A 327 -10.873 -5.848 -15.421 1.00 0.00 H new ATOM 259 N VAL A 328 -6.237 1.625 -10.670 1.00 0.00 N ATOM 260 CA VAL A 328 -5.096 2.571 -10.517 1.00 0.00 C ATOM 261 C VAL A 328 -4.798 2.757 -9.030 1.00 0.00 C ATOM 262 O VAL A 328 -3.660 2.757 -8.608 1.00 0.00 O ATOM 263 CB VAL A 328 -5.448 3.918 -11.152 1.00 0.00 C ATOM 264 CG1 VAL A 328 -4.382 4.950 -10.788 1.00 0.00 C ATOM 265 CG2 VAL A 328 -5.502 3.762 -12.674 1.00 0.00 C ATOM 0 H VAL A 328 -7.078 2.018 -11.092 1.00 0.00 H new ATOM 0 HA VAL A 328 -4.216 2.167 -11.018 1.00 0.00 H new ATOM 0 HB VAL A 328 -6.418 4.251 -10.782 1.00 0.00 H new ATOM 0 HG11 VAL A 328 -4.634 5.909 -11.241 1.00 0.00 H new ATOM 0 HG12 VAL A 328 -4.338 5.061 -9.705 1.00 0.00 H new ATOM 0 HG13 VAL A 328 -3.412 4.618 -11.158 1.00 0.00 H new ATOM 0 HG21 VAL A 328 -5.753 4.720 -13.129 1.00 0.00 H new ATOM 0 HG22 VAL A 328 -4.531 3.429 -13.040 1.00 0.00 H new ATOM 0 HG23 VAL A 328 -6.261 3.025 -12.938 1.00 0.00 H new ATOM 275 N CYS A 329 -5.818 2.892 -8.231 1.00 0.00 N ATOM 276 CA CYS A 329 -5.602 3.051 -6.767 1.00 0.00 C ATOM 277 C CYS A 329 -5.451 1.664 -6.155 1.00 0.00 C ATOM 278 O CYS A 329 -4.832 1.483 -5.126 1.00 0.00 O ATOM 279 CB CYS A 329 -6.805 3.754 -6.137 1.00 0.00 C ATOM 280 SG CYS A 329 -6.849 5.480 -6.681 1.00 0.00 S ATOM 0 H CYS A 329 -6.793 2.899 -8.529 1.00 0.00 H new ATOM 0 HA CYS A 329 -4.709 3.649 -6.585 1.00 0.00 H new ATOM 0 HB2 CYS A 329 -7.727 3.248 -6.424 1.00 0.00 H new ATOM 0 HB3 CYS A 329 -6.740 3.706 -5.050 1.00 0.00 H new ATOM 285 N ALA A 330 -6.018 0.681 -6.796 1.00 0.00 N ATOM 286 CA ALA A 330 -5.921 -0.708 -6.275 1.00 0.00 C ATOM 287 C ALA A 330 -4.809 -1.441 -7.024 1.00 0.00 C ATOM 288 O ALA A 330 -3.725 -0.922 -7.205 1.00 0.00 O ATOM 289 CB ALA A 330 -7.258 -1.421 -6.502 1.00 0.00 C ATOM 0 H ALA A 330 -6.547 0.782 -7.662 1.00 0.00 H new ATOM 0 HA ALA A 330 -5.694 -0.696 -5.209 1.00 0.00 H new ATOM 0 HB1 ALA A 330 -7.195 -2.441 -6.123 1.00 0.00 H new ATOM 0 HB2 ALA A 330 -8.049 -0.886 -5.977 1.00 0.00 H new ATOM 0 HB3 ALA A 330 -7.482 -1.444 -7.569 1.00 0.00 H new ATOM 295 N CYS A 331 -5.069 -2.635 -7.470 1.00 0.00 N ATOM 296 CA CYS A 331 -4.029 -3.389 -8.216 1.00 0.00 C ATOM 297 C CYS A 331 -4.217 -3.138 -9.715 1.00 0.00 C ATOM 298 O CYS A 331 -5.284 -3.334 -10.260 1.00 0.00 O ATOM 299 CB CYS A 331 -4.165 -4.881 -7.917 1.00 0.00 C ATOM 300 SG CYS A 331 -3.369 -5.826 -9.234 1.00 0.00 S ATOM 0 H CYS A 331 -5.957 -3.122 -7.350 1.00 0.00 H new ATOM 0 HA CYS A 331 -3.037 -3.057 -7.910 1.00 0.00 H new ATOM 0 HB2 CYS A 331 -3.706 -5.115 -6.957 1.00 0.00 H new ATOM 0 HB3 CYS A 331 -5.217 -5.155 -7.842 1.00 0.00 H new ATOM 305 N HIS A 332 -3.190 -2.684 -10.379 1.00 0.00 N ATOM 306 CA HIS A 332 -3.306 -2.394 -11.837 1.00 0.00 C ATOM 307 C HIS A 332 -3.729 -3.648 -12.611 1.00 0.00 C ATOM 308 O HIS A 332 -4.601 -3.601 -13.456 1.00 0.00 O ATOM 309 CB HIS A 332 -1.950 -1.916 -12.361 1.00 0.00 C ATOM 310 CG HIS A 332 -2.078 -1.529 -13.808 1.00 0.00 C ATOM 311 ND1 HIS A 332 -2.840 -0.443 -14.220 1.00 0.00 N ATOM 312 CD2 HIS A 332 -1.549 -2.070 -14.954 1.00 0.00 C ATOM 313 CE1 HIS A 332 -2.746 -0.366 -15.561 1.00 0.00 C ATOM 314 NE2 HIS A 332 -1.971 -1.335 -16.054 1.00 0.00 N ATOM 0 H HIS A 332 -2.272 -2.501 -9.974 1.00 0.00 H new ATOM 0 HA HIS A 332 -4.063 -1.623 -11.981 1.00 0.00 H new ATOM 0 HB2 HIS A 332 -1.602 -1.065 -11.776 1.00 0.00 H new ATOM 0 HB3 HIS A 332 -1.207 -2.705 -12.249 1.00 0.00 H new ATOM 0 HD2 HIS A 332 -0.903 -2.935 -14.994 1.00 0.00 H new ATOM 0 HE1 HIS A 332 -3.236 0.385 -16.162 1.00 0.00 H new ATOM 0 HE2 HIS A 332 -1.738 -1.501 -17.033 1.00 0.00 H new ATOM 323 N LEU A 333 -3.105 -4.762 -12.349 1.00 0.00 N ATOM 324 CA LEU A 333 -3.457 -6.008 -13.093 1.00 0.00 C ATOM 325 C LEU A 333 -4.862 -6.494 -12.731 1.00 0.00 C ATOM 326 O LEU A 333 -5.591 -6.981 -13.572 1.00 0.00 O ATOM 327 CB LEU A 333 -2.449 -7.101 -12.746 1.00 0.00 C ATOM 328 CG LEU A 333 -1.033 -6.625 -13.082 1.00 0.00 C ATOM 329 CD1 LEU A 333 -0.036 -7.748 -12.791 1.00 0.00 C ATOM 330 CD2 LEU A 333 -0.956 -6.252 -14.565 1.00 0.00 C ATOM 0 H LEU A 333 -2.367 -4.866 -11.653 1.00 0.00 H new ATOM 0 HA LEU A 333 -3.432 -5.787 -14.160 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -2.518 -7.349 -11.687 1.00 0.00 H new ATOM 0 HB3 LEU A 333 -2.679 -8.010 -13.302 1.00 0.00 H new ATOM 0 HG LEU A 333 -0.791 -5.753 -12.474 1.00 0.00 H new ATOM 0 HD11 LEU A 333 0.972 -7.410 -13.030 1.00 0.00 H new ATOM 0 HD12 LEU A 333 -0.088 -8.017 -11.736 1.00 0.00 H new ATOM 0 HD13 LEU A 333 -0.281 -8.619 -13.400 1.00 0.00 H new ATOM 0 HD21 LEU A 333 0.052 -5.913 -14.803 1.00 0.00 H new ATOM 0 HD22 LEU A 333 -1.199 -7.124 -15.173 1.00 0.00 H new ATOM 0 HD23 LEU A 333 -1.667 -5.453 -14.777 1.00 0.00 H new ATOM 342 N CYS A 334 -5.250 -6.387 -11.493 1.00 0.00 N ATOM 343 CA CYS A 334 -6.604 -6.867 -11.106 1.00 0.00 C ATOM 344 C CYS A 334 -7.072 -6.161 -9.828 1.00 0.00 C ATOM 345 O CYS A 334 -6.756 -6.557 -8.727 1.00 0.00 O ATOM 346 CB CYS A 334 -6.561 -8.391 -10.902 1.00 0.00 C ATOM 347 SG CYS A 334 -5.718 -8.821 -9.352 1.00 0.00 S ATOM 0 H CYS A 334 -4.693 -5.991 -10.736 1.00 0.00 H new ATOM 0 HA CYS A 334 -7.315 -6.634 -11.899 1.00 0.00 H new ATOM 0 HB2 CYS A 334 -7.576 -8.788 -10.889 1.00 0.00 H new ATOM 0 HB3 CYS A 334 -6.046 -8.859 -11.741 1.00 0.00 H new ATOM 352 N GLY A 335 -7.832 -5.110 -9.971 1.00 0.00 N ATOM 353 CA GLY A 335 -8.321 -4.377 -8.772 1.00 0.00 C ATOM 354 C GLY A 335 -9.450 -5.160 -8.114 1.00 0.00 C ATOM 355 O GLY A 335 -10.467 -5.438 -8.719 1.00 0.00 O ATOM 0 H GLY A 335 -8.135 -4.728 -10.867 1.00 0.00 H new ATOM 0 HA2 GLY A 335 -7.505 -4.234 -8.064 1.00 0.00 H new ATOM 0 HA3 GLY A 335 -8.672 -3.386 -9.059 1.00 0.00 H new ATOM 359 N GLY A 336 -9.281 -5.509 -6.874 1.00 0.00 N ATOM 360 CA GLY A 336 -10.339 -6.264 -6.157 1.00 0.00 C ATOM 361 C GLY A 336 -10.175 -6.031 -4.661 1.00 0.00 C ATOM 362 O GLY A 336 -9.263 -5.356 -4.225 1.00 0.00 O ATOM 0 H GLY A 336 -8.449 -5.302 -6.322 1.00 0.00 H new ATOM 0 HA2 GLY A 336 -11.325 -5.936 -6.485 1.00 0.00 H new ATOM 0 HA3 GLY A 336 -10.265 -7.327 -6.384 1.00 0.00 H new ATOM 366 N ARG A 337 -11.045 -6.579 -3.868 1.00 0.00 N ATOM 367 CA ARG A 337 -10.926 -6.381 -2.401 1.00 0.00 C ATOM 368 C ARG A 337 -9.962 -7.424 -1.833 1.00 0.00 C ATOM 369 O ARG A 337 -9.999 -7.753 -0.664 1.00 0.00 O ATOM 370 CB ARG A 337 -12.302 -6.540 -1.751 1.00 0.00 C ATOM 371 CG ARG A 337 -12.780 -7.984 -1.924 1.00 0.00 C ATOM 372 CD ARG A 337 -14.253 -8.087 -1.526 1.00 0.00 C ATOM 373 NE ARG A 337 -14.684 -9.512 -1.584 1.00 0.00 N ATOM 374 CZ ARG A 337 -15.940 -9.807 -1.775 1.00 0.00 C ATOM 375 NH1 ARG A 337 -16.823 -8.855 -1.910 1.00 0.00 N ATOM 376 NH2 ARG A 337 -16.315 -11.056 -1.829 1.00 0.00 N ATOM 0 H ARG A 337 -11.832 -7.154 -4.170 1.00 0.00 H new ATOM 0 HA ARG A 337 -10.546 -5.381 -2.192 1.00 0.00 H new ATOM 0 HB2 ARG A 337 -12.248 -6.287 -0.692 1.00 0.00 H new ATOM 0 HB3 ARG A 337 -13.014 -5.852 -2.207 1.00 0.00 H new ATOM 0 HG2 ARG A 337 -12.649 -8.300 -2.959 1.00 0.00 H new ATOM 0 HG3 ARG A 337 -12.179 -8.653 -1.309 1.00 0.00 H new ATOM 0 HD2 ARG A 337 -14.398 -7.693 -0.520 1.00 0.00 H new ATOM 0 HD3 ARG A 337 -14.865 -7.483 -2.196 1.00 0.00 H new ATOM 0 HE ARG A 337 -13.996 -10.257 -1.474 1.00 0.00 H new ATOM 0 HH11 ARG A 337 -16.531 -7.879 -1.866 1.00 0.00 H new ATOM 0 HH12 ARG A 337 -17.805 -9.088 -2.059 1.00 0.00 H new ATOM 0 HH21 ARG A 337 -15.626 -11.800 -1.722 1.00 0.00 H new ATOM 0 HH22 ARG A 337 -17.297 -11.288 -1.978 1.00 0.00 H new ATOM 390 N GLN A 338 -9.107 -7.957 -2.663 1.00 0.00 N ATOM 391 CA GLN A 338 -8.144 -8.995 -2.196 1.00 0.00 C ATOM 392 C GLN A 338 -7.295 -8.455 -1.041 1.00 0.00 C ATOM 393 O GLN A 338 -6.972 -9.172 -0.114 1.00 0.00 O ATOM 394 CB GLN A 338 -7.229 -9.382 -3.358 1.00 0.00 C ATOM 395 CG GLN A 338 -8.059 -10.034 -4.466 1.00 0.00 C ATOM 396 CD GLN A 338 -7.141 -10.449 -5.616 1.00 0.00 C ATOM 397 OE1 GLN A 338 -7.581 -11.055 -6.572 1.00 0.00 O ATOM 398 NE2 GLN A 338 -5.874 -10.140 -5.565 1.00 0.00 N ATOM 0 H GLN A 338 -9.034 -7.716 -3.651 1.00 0.00 H new ATOM 0 HA GLN A 338 -8.699 -9.866 -1.847 1.00 0.00 H new ATOM 0 HB2 GLN A 338 -6.719 -8.499 -3.743 1.00 0.00 H new ATOM 0 HB3 GLN A 338 -6.458 -10.071 -3.014 1.00 0.00 H new ATOM 0 HG2 GLN A 338 -8.586 -10.905 -4.075 1.00 0.00 H new ATOM 0 HG3 GLN A 338 -8.817 -9.337 -4.825 1.00 0.00 H new ATOM 0 HE21 GLN A 338 -5.505 -9.631 -4.762 1.00 0.00 H new ATOM 0 HE22 GLN A 338 -5.253 -10.407 -6.328 1.00 0.00 H new ATOM 407 N ASP A 339 -6.927 -7.205 -1.082 1.00 0.00 N ATOM 408 CA ASP A 339 -6.096 -6.645 0.024 1.00 0.00 C ATOM 409 C ASP A 339 -5.803 -5.165 -0.239 1.00 0.00 C ATOM 410 O ASP A 339 -4.664 -4.742 -0.257 1.00 0.00 O ATOM 411 CB ASP A 339 -4.779 -7.421 0.109 1.00 0.00 C ATOM 412 CG ASP A 339 -4.357 -7.859 -1.296 1.00 0.00 C ATOM 413 OD1 ASP A 339 -4.190 -6.993 -2.139 1.00 0.00 O ATOM 414 OD2 ASP A 339 -4.206 -9.051 -1.502 1.00 0.00 O ATOM 0 H ASP A 339 -7.163 -6.550 -1.827 1.00 0.00 H new ATOM 0 HA ASP A 339 -6.639 -6.737 0.965 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -4.005 -6.797 0.556 1.00 0.00 H new ATOM 0 HB3 ASP A 339 -4.898 -8.292 0.753 1.00 0.00 H new ATOM 419 N PRO A 340 -6.831 -4.387 -0.433 1.00 0.00 N ATOM 420 CA PRO A 340 -6.706 -2.923 -0.693 1.00 0.00 C ATOM 421 C PRO A 340 -6.100 -2.177 0.500 1.00 0.00 C ATOM 422 O PRO A 340 -5.650 -1.056 0.381 1.00 0.00 O ATOM 423 CB PRO A 340 -8.145 -2.460 -0.939 1.00 0.00 C ATOM 424 CG PRO A 340 -9.018 -3.518 -0.352 1.00 0.00 C ATOM 425 CD PRO A 340 -8.232 -4.824 -0.424 1.00 0.00 C ATOM 0 HA PRO A 340 -6.041 -2.720 -1.532 1.00 0.00 H new ATOM 0 HB2 PRO A 340 -8.331 -1.494 -0.469 1.00 0.00 H new ATOM 0 HB3 PRO A 340 -8.340 -2.339 -2.005 1.00 0.00 H new ATOM 0 HG2 PRO A 340 -9.277 -3.278 0.679 1.00 0.00 H new ATOM 0 HG3 PRO A 340 -9.954 -3.598 -0.905 1.00 0.00 H new ATOM 0 HD2 PRO A 340 -8.445 -5.467 0.430 1.00 0.00 H new ATOM 0 HD3 PRO A 340 -8.480 -5.392 -1.321 1.00 0.00 H new ATOM 433 N ASP A 341 -6.101 -2.791 1.650 1.00 0.00 N ATOM 434 CA ASP A 341 -5.541 -2.122 2.858 1.00 0.00 C ATOM 435 C ASP A 341 -4.051 -1.835 2.660 1.00 0.00 C ATOM 436 O ASP A 341 -3.521 -0.890 3.210 1.00 0.00 O ATOM 437 CB ASP A 341 -5.725 -3.033 4.073 1.00 0.00 C ATOM 438 CG ASP A 341 -5.339 -2.275 5.344 1.00 0.00 C ATOM 439 OD1 ASP A 341 -5.055 -1.092 5.241 1.00 0.00 O ATOM 440 OD2 ASP A 341 -5.333 -2.888 6.398 1.00 0.00 O ATOM 0 H ASP A 341 -6.467 -3.730 1.806 1.00 0.00 H new ATOM 0 HA ASP A 341 -6.066 -1.180 3.018 1.00 0.00 H new ATOM 0 HB2 ASP A 341 -6.761 -3.367 4.137 1.00 0.00 H new ATOM 0 HB3 ASP A 341 -5.108 -3.926 3.968 1.00 0.00 H new ATOM 445 N LYS A 342 -3.368 -2.639 1.887 1.00 0.00 N ATOM 446 CA LYS A 342 -1.912 -2.401 1.668 1.00 0.00 C ATOM 447 C LYS A 342 -1.612 -2.374 0.170 1.00 0.00 C ATOM 448 O LYS A 342 -1.173 -3.351 -0.402 1.00 0.00 O ATOM 449 CB LYS A 342 -1.100 -3.522 2.321 1.00 0.00 C ATOM 450 CG LYS A 342 -1.396 -3.563 3.822 1.00 0.00 C ATOM 451 CD LYS A 342 -0.490 -4.597 4.492 1.00 0.00 C ATOM 452 CE LYS A 342 -0.866 -4.728 5.968 1.00 0.00 C ATOM 453 NZ LYS A 342 0.374 -4.770 6.794 1.00 0.00 N ATOM 0 H LYS A 342 -3.755 -3.447 1.400 1.00 0.00 H new ATOM 0 HA LYS A 342 -1.639 -1.444 2.113 1.00 0.00 H new ATOM 0 HB2 LYS A 342 -1.350 -4.480 1.864 1.00 0.00 H new ATOM 0 HB3 LYS A 342 -0.035 -3.358 2.154 1.00 0.00 H new ATOM 0 HG2 LYS A 342 -1.232 -2.580 4.263 1.00 0.00 H new ATOM 0 HG3 LYS A 342 -2.442 -3.817 3.990 1.00 0.00 H new ATOM 0 HD2 LYS A 342 -0.591 -5.561 3.994 1.00 0.00 H new ATOM 0 HD3 LYS A 342 0.554 -4.297 4.397 1.00 0.00 H new ATOM 0 HE2 LYS A 342 -1.490 -3.887 6.272 1.00 0.00 H new ATOM 0 HE3 LYS A 342 -1.452 -5.633 6.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 342 0.119 -4.859 7.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 342 0.953 -5.586 6.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 342 0.916 -3.894 6.651 1.00 0.00 H new ATOM 467 N GLN A 343 -1.834 -1.259 -0.465 1.00 0.00 N ATOM 468 CA GLN A 343 -1.547 -1.156 -1.923 1.00 0.00 C ATOM 469 C GLN A 343 -0.265 -0.344 -2.120 1.00 0.00 C ATOM 470 O GLN A 343 -0.086 0.696 -1.518 1.00 0.00 O ATOM 471 CB GLN A 343 -2.709 -0.455 -2.629 1.00 0.00 C ATOM 472 CG GLN A 343 -3.991 -1.266 -2.430 1.00 0.00 C ATOM 473 CD GLN A 343 -3.812 -2.658 -3.038 1.00 0.00 C ATOM 474 OE1 GLN A 343 -3.400 -2.790 -4.173 1.00 0.00 O ATOM 475 NE2 GLN A 343 -4.105 -3.710 -2.325 1.00 0.00 N ATOM 0 H GLN A 343 -2.203 -0.411 -0.036 1.00 0.00 H new ATOM 0 HA GLN A 343 -1.423 -2.154 -2.344 1.00 0.00 H new ATOM 0 HB2 GLN A 343 -2.837 0.551 -2.230 1.00 0.00 H new ATOM 0 HB3 GLN A 343 -2.493 -0.351 -3.692 1.00 0.00 H new ATOM 0 HG2 GLN A 343 -4.221 -1.348 -1.368 1.00 0.00 H new ATOM 0 HG3 GLN A 343 -4.833 -0.757 -2.900 1.00 0.00 H new ATOM 0 HE21 GLN A 343 -4.451 -3.600 -1.372 1.00 0.00 H new ATOM 0 HE22 GLN A 343 -3.988 -4.643 -2.721 1.00 0.00 H new ATOM 484 N LEU A 344 0.627 -0.810 -2.954 1.00 0.00 N ATOM 485 CA LEU A 344 1.897 -0.065 -3.185 1.00 0.00 C ATOM 486 C LEU A 344 1.913 0.494 -4.608 1.00 0.00 C ATOM 487 O LEU A 344 1.681 -0.223 -5.570 1.00 0.00 O ATOM 488 CB LEU A 344 3.085 -1.012 -2.989 1.00 0.00 C ATOM 489 CG LEU A 344 4.398 -0.226 -3.071 1.00 0.00 C ATOM 490 CD1 LEU A 344 4.618 0.561 -1.775 1.00 0.00 C ATOM 491 CD2 LEU A 344 5.560 -1.201 -3.275 1.00 0.00 C ATOM 0 H LEU A 344 0.530 -1.675 -3.485 1.00 0.00 H new ATOM 0 HA LEU A 344 1.969 0.759 -2.475 1.00 0.00 H new ATOM 0 HB2 LEU A 344 3.009 -1.510 -2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 344 3.069 -1.791 -3.751 1.00 0.00 H new ATOM 0 HG LEU A 344 4.348 0.470 -3.909 1.00 0.00 H new ATOM 0 HD11 LEU A 344 5.553 1.117 -1.841 1.00 0.00 H new ATOM 0 HD12 LEU A 344 3.792 1.257 -1.627 1.00 0.00 H new ATOM 0 HD13 LEU A 344 4.665 -0.130 -0.933 1.00 0.00 H new ATOM 0 HD21 LEU A 344 6.496 -0.645 -3.334 1.00 0.00 H new ATOM 0 HD22 LEU A 344 5.603 -1.896 -2.437 1.00 0.00 H new ATOM 0 HD23 LEU A 344 5.410 -1.757 -4.200 1.00 0.00 H new ATOM 503 N MET A 345 2.177 1.772 -4.742 1.00 0.00 N ATOM 504 CA MET A 345 2.200 2.407 -6.085 1.00 0.00 C ATOM 505 C MET A 345 3.527 3.136 -6.316 1.00 0.00 C ATOM 506 O MET A 345 4.129 3.659 -5.399 1.00 0.00 O ATOM 507 CB MET A 345 1.057 3.415 -6.162 1.00 0.00 C ATOM 508 CG MET A 345 -0.283 2.680 -6.120 1.00 0.00 C ATOM 509 SD MET A 345 -1.628 3.870 -6.349 1.00 0.00 S ATOM 510 CE MET A 345 -1.320 4.236 -8.094 1.00 0.00 C ATOM 0 H MET A 345 2.379 2.403 -3.966 1.00 0.00 H new ATOM 0 HA MET A 345 2.089 1.637 -6.848 1.00 0.00 H new ATOM 0 HB2 MET A 345 1.123 4.118 -5.332 1.00 0.00 H new ATOM 0 HB3 MET A 345 1.134 3.998 -7.080 1.00 0.00 H new ATOM 0 HG2 MET A 345 -0.318 1.920 -6.900 1.00 0.00 H new ATOM 0 HG3 MET A 345 -0.398 2.164 -5.167 1.00 0.00 H new ATOM 0 HE1 MET A 345 -2.224 4.646 -8.545 1.00 0.00 H new ATOM 0 HE2 MET A 345 -0.512 4.962 -8.176 1.00 0.00 H new ATOM 0 HE3 MET A 345 -1.039 3.320 -8.614 1.00 0.00 H new ATOM 520 N CYS A 346 3.972 3.190 -7.544 1.00 0.00 N ATOM 521 CA CYS A 346 5.249 3.909 -7.846 1.00 0.00 C ATOM 522 C CYS A 346 4.920 5.385 -8.097 1.00 0.00 C ATOM 523 O CYS A 346 4.168 5.720 -8.986 1.00 0.00 O ATOM 524 CB CYS A 346 5.909 3.284 -9.086 1.00 0.00 C ATOM 525 SG CYS A 346 7.212 4.374 -9.729 1.00 0.00 S ATOM 0 H CYS A 346 3.509 2.769 -8.350 1.00 0.00 H new ATOM 0 HA CYS A 346 5.944 3.827 -7.010 1.00 0.00 H new ATOM 0 HB2 CYS A 346 6.332 2.313 -8.830 1.00 0.00 H new ATOM 0 HB3 CYS A 346 5.158 3.111 -9.857 1.00 0.00 H new ATOM 530 N ASP A 347 5.455 6.272 -7.305 1.00 0.00 N ATOM 531 CA ASP A 347 5.138 7.719 -7.492 1.00 0.00 C ATOM 532 C ASP A 347 5.322 8.104 -8.956 1.00 0.00 C ATOM 533 O ASP A 347 4.525 8.824 -9.526 1.00 0.00 O ATOM 534 CB ASP A 347 6.082 8.559 -6.630 1.00 0.00 C ATOM 535 CG ASP A 347 5.483 9.953 -6.421 1.00 0.00 C ATOM 536 OD1 ASP A 347 4.332 10.143 -6.781 1.00 0.00 O ATOM 537 OD2 ASP A 347 6.184 10.806 -5.903 1.00 0.00 O ATOM 0 H ASP A 347 6.095 6.061 -6.539 1.00 0.00 H new ATOM 0 HA ASP A 347 4.105 7.901 -7.197 1.00 0.00 H new ATOM 0 HB2 ASP A 347 6.242 8.073 -5.668 1.00 0.00 H new ATOM 0 HB3 ASP A 347 7.056 8.639 -7.112 1.00 0.00 H new ATOM 542 N GLU A 348 6.361 7.633 -9.569 1.00 0.00 N ATOM 543 CA GLU A 348 6.601 7.969 -10.996 1.00 0.00 C ATOM 544 C GLU A 348 5.539 7.299 -11.877 1.00 0.00 C ATOM 545 O GLU A 348 5.146 7.831 -12.896 1.00 0.00 O ATOM 546 CB GLU A 348 7.987 7.476 -11.392 1.00 0.00 C ATOM 547 CG GLU A 348 8.298 7.912 -12.825 1.00 0.00 C ATOM 548 CD GLU A 348 8.436 9.434 -12.878 1.00 0.00 C ATOM 549 OE1 GLU A 348 8.750 10.017 -11.853 1.00 0.00 O ATOM 550 OE2 GLU A 348 8.226 9.992 -13.943 1.00 0.00 O ATOM 0 H GLU A 348 7.061 7.025 -9.143 1.00 0.00 H new ATOM 0 HA GLU A 348 6.540 9.048 -11.134 1.00 0.00 H new ATOM 0 HB2 GLU A 348 8.735 7.877 -10.709 1.00 0.00 H new ATOM 0 HB3 GLU A 348 8.034 6.390 -11.314 1.00 0.00 H new ATOM 0 HG2 GLU A 348 9.219 7.441 -13.168 1.00 0.00 H new ATOM 0 HG3 GLU A 348 7.504 7.585 -13.496 1.00 0.00 H new ATOM 557 N CYS A 349 5.081 6.136 -11.495 1.00 0.00 N ATOM 558 CA CYS A 349 4.050 5.427 -12.313 1.00 0.00 C ATOM 559 C CYS A 349 2.827 5.110 -11.450 1.00 0.00 C ATOM 560 O CYS A 349 2.931 4.496 -10.409 1.00 0.00 O ATOM 561 CB CYS A 349 4.637 4.122 -12.849 1.00 0.00 C ATOM 562 SG CYS A 349 6.321 4.416 -13.443 1.00 0.00 S ATOM 0 H CYS A 349 5.376 5.645 -10.651 1.00 0.00 H new ATOM 0 HA CYS A 349 3.751 6.067 -13.143 1.00 0.00 H new ATOM 0 HB2 CYS A 349 4.644 3.365 -12.065 1.00 0.00 H new ATOM 0 HB3 CYS A 349 4.017 3.737 -13.658 1.00 0.00 H new ATOM 567 N ASP A 350 1.665 5.518 -11.878 1.00 0.00 N ATOM 568 CA ASP A 350 0.441 5.239 -11.077 1.00 0.00 C ATOM 569 C ASP A 350 0.109 3.747 -11.129 1.00 0.00 C ATOM 570 O ASP A 350 -1.010 3.340 -10.889 1.00 0.00 O ATOM 571 CB ASP A 350 -0.731 6.055 -11.626 1.00 0.00 C ATOM 572 CG ASP A 350 -0.509 7.534 -11.305 1.00 0.00 C ATOM 573 OD1 ASP A 350 0.313 7.818 -10.447 1.00 0.00 O ATOM 574 OD2 ASP A 350 -1.164 8.358 -11.922 1.00 0.00 O ATOM 0 H ASP A 350 1.510 6.031 -12.746 1.00 0.00 H new ATOM 0 HA ASP A 350 0.621 5.523 -10.040 1.00 0.00 H new ATOM 0 HB2 ASP A 350 -0.815 5.913 -12.703 1.00 0.00 H new ATOM 0 HB3 ASP A 350 -1.667 5.711 -11.185 1.00 0.00 H new ATOM 579 N MET A 351 1.080 2.930 -11.421 1.00 0.00 N ATOM 580 CA MET A 351 0.830 1.461 -11.466 1.00 0.00 C ATOM 581 C MET A 351 1.177 0.859 -10.106 1.00 0.00 C ATOM 582 O MET A 351 2.031 1.362 -9.397 1.00 0.00 O ATOM 583 CB MET A 351 1.696 0.813 -12.548 1.00 0.00 C ATOM 584 CG MET A 351 1.133 1.161 -13.928 1.00 0.00 C ATOM 585 SD MET A 351 1.945 0.147 -15.189 1.00 0.00 S ATOM 586 CE MET A 351 3.633 0.721 -14.888 1.00 0.00 C ATOM 0 H MET A 351 2.037 3.214 -11.631 1.00 0.00 H new ATOM 0 HA MET A 351 -0.219 1.278 -11.699 1.00 0.00 H new ATOM 0 HB2 MET A 351 2.725 1.164 -12.464 1.00 0.00 H new ATOM 0 HB3 MET A 351 1.716 -0.269 -12.414 1.00 0.00 H new ATOM 0 HG2 MET A 351 0.057 0.989 -13.947 1.00 0.00 H new ATOM 0 HG3 MET A 351 1.291 2.218 -14.140 1.00 0.00 H new ATOM 0 HE1 MET A 351 4.259 0.478 -15.747 1.00 0.00 H new ATOM 0 HE2 MET A 351 3.629 1.800 -14.736 1.00 0.00 H new ATOM 0 HE3 MET A 351 4.031 0.231 -13.999 1.00 0.00 H new ATOM 596 N ALA A 352 0.516 -0.205 -9.730 1.00 0.00 N ATOM 597 CA ALA A 352 0.809 -0.823 -8.408 1.00 0.00 C ATOM 598 C ALA A 352 1.615 -2.103 -8.585 1.00 0.00 C ATOM 599 O ALA A 352 2.012 -2.457 -9.677 1.00 0.00 O ATOM 600 CB ALA A 352 -0.506 -1.140 -7.691 1.00 0.00 C ATOM 0 H ALA A 352 -0.209 -0.668 -10.279 1.00 0.00 H new ATOM 0 HA ALA A 352 1.393 -0.121 -7.813 1.00 0.00 H new ATOM 0 HB1 ALA A 352 -0.293 -1.593 -6.723 1.00 0.00 H new ATOM 0 HB2 ALA A 352 -1.072 -0.220 -7.545 1.00 0.00 H new ATOM 0 HB3 ALA A 352 -1.091 -1.834 -8.295 1.00 0.00 H new ATOM 606 N PHE A 353 1.871 -2.793 -7.504 1.00 0.00 N ATOM 607 CA PHE A 353 2.671 -4.049 -7.590 1.00 0.00 C ATOM 608 C PHE A 353 1.817 -5.266 -7.228 1.00 0.00 C ATOM 609 O PHE A 353 1.067 -5.255 -6.272 1.00 0.00 O ATOM 610 CB PHE A 353 3.849 -3.949 -6.626 1.00 0.00 C ATOM 611 CG PHE A 353 4.739 -2.817 -7.066 1.00 0.00 C ATOM 612 CD1 PHE A 353 4.503 -1.520 -6.597 1.00 0.00 C ATOM 613 CD2 PHE A 353 5.794 -3.064 -7.947 1.00 0.00 C ATOM 614 CE1 PHE A 353 5.328 -0.469 -7.010 1.00 0.00 C ATOM 615 CE2 PHE A 353 6.619 -2.013 -8.361 1.00 0.00 C ATOM 616 CZ PHE A 353 6.386 -0.715 -7.891 1.00 0.00 C ATOM 0 H PHE A 353 1.560 -2.540 -6.566 1.00 0.00 H new ATOM 0 HA PHE A 353 3.027 -4.173 -8.613 1.00 0.00 H new ATOM 0 HB2 PHE A 353 3.492 -3.776 -5.611 1.00 0.00 H new ATOM 0 HB3 PHE A 353 4.407 -4.885 -6.613 1.00 0.00 H new ATOM 0 HD1 PHE A 353 3.685 -1.331 -5.917 1.00 0.00 H new ATOM 0 HD2 PHE A 353 5.973 -4.066 -8.308 1.00 0.00 H new ATOM 0 HE1 PHE A 353 5.148 0.533 -6.649 1.00 0.00 H new ATOM 0 HE2 PHE A 353 7.435 -2.203 -9.043 1.00 0.00 H new ATOM 0 HZ PHE A 353 7.024 0.097 -8.209 1.00 0.00 H new ATOM 626 N HIS A 354 1.943 -6.322 -7.986 1.00 0.00 N ATOM 627 CA HIS A 354 1.163 -7.559 -7.700 1.00 0.00 C ATOM 628 C HIS A 354 1.697 -8.216 -6.425 1.00 0.00 C ATOM 629 O HIS A 354 1.322 -9.318 -6.079 1.00 0.00 O ATOM 630 CB HIS A 354 1.301 -8.531 -8.875 1.00 0.00 C ATOM 631 CG HIS A 354 -0.068 -8.923 -9.364 1.00 0.00 C ATOM 632 ND1 HIS A 354 -0.458 -10.247 -9.506 1.00 0.00 N ATOM 633 CD2 HIS A 354 -1.151 -8.172 -9.740 1.00 0.00 C ATOM 634 CE1 HIS A 354 -1.731 -10.249 -9.947 1.00 0.00 C ATOM 635 NE2 HIS A 354 -2.203 -9.010 -10.106 1.00 0.00 N ATOM 0 H HIS A 354 2.558 -6.380 -8.798 1.00 0.00 H new ATOM 0 HA HIS A 354 0.112 -7.304 -7.562 1.00 0.00 H new ATOM 0 HB2 HIS A 354 1.868 -8.066 -9.681 1.00 0.00 H new ATOM 0 HB3 HIS A 354 1.856 -9.417 -8.565 1.00 0.00 H new ATOM 0 HD2 HIS A 354 -1.184 -7.093 -9.751 1.00 0.00 H new ATOM 0 HE1 HIS A 354 -2.301 -11.144 -10.148 1.00 0.00 H new ATOM 0 HE2 HIS A 354 -3.132 -8.736 -10.426 1.00 0.00 H new ATOM 643 N ILE A 355 2.576 -7.550 -5.725 1.00 0.00 N ATOM 644 CA ILE A 355 3.137 -8.142 -4.477 1.00 0.00 C ATOM 645 C ILE A 355 1.998 -8.615 -3.578 1.00 0.00 C ATOM 646 O ILE A 355 2.098 -9.626 -2.911 1.00 0.00 O ATOM 647 CB ILE A 355 3.945 -7.074 -3.733 1.00 0.00 C ATOM 648 CG1 ILE A 355 4.635 -7.696 -2.516 1.00 0.00 C ATOM 649 CG2 ILE A 355 3.006 -5.960 -3.266 1.00 0.00 C ATOM 650 CD1 ILE A 355 5.117 -6.582 -1.587 1.00 0.00 C ATOM 0 H ILE A 355 2.929 -6.623 -5.963 1.00 0.00 H new ATOM 0 HA ILE A 355 3.778 -8.986 -4.733 1.00 0.00 H new ATOM 0 HB ILE A 355 4.699 -6.664 -4.404 1.00 0.00 H new ATOM 0 HG12 ILE A 355 3.944 -8.353 -1.988 1.00 0.00 H new ATOM 0 HG13 ILE A 355 5.477 -8.310 -2.835 1.00 0.00 H new ATOM 0 HG21 ILE A 355 3.579 -5.199 -2.736 1.00 0.00 H new ATOM 0 HG22 ILE A 355 2.517 -5.510 -4.130 1.00 0.00 H new ATOM 0 HG23 ILE A 355 2.252 -6.376 -2.598 1.00 0.00 H new ATOM 0 HD11 ILE A 355 5.609 -7.020 -0.719 1.00 0.00 H new ATOM 0 HD12 ILE A 355 5.822 -5.943 -2.120 1.00 0.00 H new ATOM 0 HD13 ILE A 355 4.264 -5.987 -1.259 1.00 0.00 H new ATOM 662 N TYR A 356 0.921 -7.888 -3.546 1.00 0.00 N ATOM 663 CA TYR A 356 -0.220 -8.287 -2.684 1.00 0.00 C ATOM 664 C TYR A 356 -0.980 -9.443 -3.334 1.00 0.00 C ATOM 665 O TYR A 356 -1.505 -10.309 -2.662 1.00 0.00 O ATOM 666 CB TYR A 356 -1.130 -7.077 -2.497 1.00 0.00 C ATOM 667 CG TYR A 356 -0.302 -5.951 -1.927 1.00 0.00 C ATOM 668 CD1 TYR A 356 0.038 -5.952 -0.569 1.00 0.00 C ATOM 669 CD2 TYR A 356 0.145 -4.918 -2.759 1.00 0.00 C ATOM 670 CE1 TYR A 356 0.822 -4.920 -0.043 1.00 0.00 C ATOM 671 CE2 TYR A 356 0.927 -3.884 -2.233 1.00 0.00 C ATOM 672 CZ TYR A 356 1.268 -3.885 -0.874 1.00 0.00 C ATOM 673 OH TYR A 356 2.041 -2.867 -0.356 1.00 0.00 O ATOM 0 H TYR A 356 0.781 -7.031 -4.082 1.00 0.00 H new ATOM 0 HA TYR A 356 0.138 -8.624 -1.711 1.00 0.00 H new ATOM 0 HB2 TYR A 356 -1.570 -6.781 -3.449 1.00 0.00 H new ATOM 0 HB3 TYR A 356 -1.954 -7.321 -1.827 1.00 0.00 H new ATOM 0 HD1 TYR A 356 -0.305 -6.750 0.073 1.00 0.00 H new ATOM 0 HD2 TYR A 356 -0.114 -4.919 -3.808 1.00 0.00 H new ATOM 0 HE1 TYR A 356 1.084 -4.921 1.005 1.00 0.00 H new ATOM 0 HE2 TYR A 356 1.268 -3.085 -2.875 1.00 0.00 H new ATOM 0 HH TYR A 356 2.184 -3.019 0.602 1.00 0.00 H new ATOM 683 N CYS A 357 -1.035 -9.473 -4.637 1.00 0.00 N ATOM 684 CA CYS A 357 -1.747 -10.580 -5.325 1.00 0.00 C ATOM 685 C CYS A 357 -0.850 -11.820 -5.330 1.00 0.00 C ATOM 686 O CYS A 357 -1.237 -12.886 -4.895 1.00 0.00 O ATOM 687 CB CYS A 357 -2.048 -10.161 -6.764 1.00 0.00 C ATOM 688 SG CYS A 357 -3.060 -8.659 -6.768 1.00 0.00 S ATOM 0 H CYS A 357 -0.616 -8.777 -5.254 1.00 0.00 H new ATOM 0 HA CYS A 357 -2.680 -10.805 -4.808 1.00 0.00 H new ATOM 0 HB2 CYS A 357 -1.117 -9.985 -7.303 1.00 0.00 H new ATOM 0 HB3 CYS A 357 -2.571 -10.964 -7.284 1.00 0.00 H new ATOM 693 N LEU A 358 0.350 -11.675 -5.819 1.00 0.00 N ATOM 694 CA LEU A 358 1.299 -12.821 -5.860 1.00 0.00 C ATOM 695 C LEU A 358 1.730 -13.199 -4.444 1.00 0.00 C ATOM 696 O LEU A 358 1.930 -14.355 -4.130 1.00 0.00 O ATOM 697 CB LEU A 358 2.535 -12.405 -6.653 1.00 0.00 C ATOM 698 CG LEU A 358 2.166 -12.199 -8.123 1.00 0.00 C ATOM 699 CD1 LEU A 358 3.329 -11.515 -8.846 1.00 0.00 C ATOM 700 CD2 LEU A 358 1.884 -13.552 -8.785 1.00 0.00 C ATOM 0 H LEU A 358 0.717 -10.801 -6.196 1.00 0.00 H new ATOM 0 HA LEU A 358 0.810 -13.676 -6.328 1.00 0.00 H new ATOM 0 HB2 LEU A 358 2.949 -11.485 -6.241 1.00 0.00 H new ATOM 0 HB3 LEU A 358 3.307 -13.169 -6.567 1.00 0.00 H new ATOM 0 HG LEU A 358 1.274 -11.576 -8.185 1.00 0.00 H new ATOM 0 HD11 LEU A 358 3.069 -11.367 -9.894 1.00 0.00 H new ATOM 0 HD12 LEU A 358 3.529 -10.549 -8.382 1.00 0.00 H new ATOM 0 HD13 LEU A 358 4.219 -12.141 -8.778 1.00 0.00 H new ATOM 0 HD21 LEU A 358 1.622 -13.397 -9.832 1.00 0.00 H new ATOM 0 HD22 LEU A 358 2.773 -14.180 -8.722 1.00 0.00 H new ATOM 0 HD23 LEU A 358 1.056 -14.042 -8.272 1.00 0.00 H new ATOM 712 N ASP A 359 1.897 -12.224 -3.600 1.00 0.00 N ATOM 713 CA ASP A 359 2.343 -12.502 -2.205 1.00 0.00 C ATOM 714 C ASP A 359 3.704 -13.204 -2.246 1.00 0.00 C ATOM 715 O ASP A 359 3.854 -14.315 -1.780 1.00 0.00 O ATOM 716 CB ASP A 359 1.321 -13.401 -1.503 1.00 0.00 C ATOM 717 CG ASP A 359 -0.084 -12.830 -1.702 1.00 0.00 C ATOM 718 OD1 ASP A 359 -0.493 -12.019 -0.887 1.00 0.00 O ATOM 719 OD2 ASP A 359 -0.727 -13.214 -2.664 1.00 0.00 O ATOM 0 H ASP A 359 1.743 -11.239 -3.815 1.00 0.00 H new ATOM 0 HA ASP A 359 2.428 -11.565 -1.655 1.00 0.00 H new ATOM 0 HB2 ASP A 359 1.374 -14.413 -1.905 1.00 0.00 H new ATOM 0 HB3 ASP A 359 1.550 -13.468 -0.440 1.00 0.00 H new ATOM 724 N PRO A 360 4.690 -12.549 -2.807 1.00 0.00 N ATOM 725 CA PRO A 360 6.070 -13.099 -2.923 1.00 0.00 C ATOM 726 C PRO A 360 6.856 -12.967 -1.614 1.00 0.00 C ATOM 727 O PRO A 360 6.477 -12.221 -0.734 1.00 0.00 O ATOM 728 CB PRO A 360 6.702 -12.233 -4.012 1.00 0.00 C ATOM 729 CG PRO A 360 6.004 -10.918 -3.918 1.00 0.00 C ATOM 730 CD PRO A 360 4.593 -11.203 -3.395 1.00 0.00 C ATOM 0 HA PRO A 360 6.070 -14.165 -3.152 1.00 0.00 H new ATOM 0 HB2 PRO A 360 7.775 -12.122 -3.854 1.00 0.00 H new ATOM 0 HB3 PRO A 360 6.570 -12.680 -4.997 1.00 0.00 H new ATOM 0 HG2 PRO A 360 6.537 -10.245 -3.246 1.00 0.00 H new ATOM 0 HG3 PRO A 360 5.964 -10.431 -4.892 1.00 0.00 H new ATOM 0 HD2 PRO A 360 4.287 -10.466 -2.653 1.00 0.00 H new ATOM 0 HD3 PRO A 360 3.857 -11.172 -4.198 1.00 0.00 H new ATOM 738 N PRO A 361 7.949 -13.677 -1.488 1.00 0.00 N ATOM 739 CA PRO A 361 8.797 -13.617 -0.265 1.00 0.00 C ATOM 740 C PRO A 361 9.068 -12.176 0.178 1.00 0.00 C ATOM 741 O PRO A 361 9.432 -11.927 1.310 1.00 0.00 O ATOM 742 CB PRO A 361 10.101 -14.292 -0.688 1.00 0.00 C ATOM 743 CG PRO A 361 9.746 -15.192 -1.825 1.00 0.00 C ATOM 744 CD PRO A 361 8.493 -14.615 -2.486 1.00 0.00 C ATOM 0 HA PRO A 361 8.313 -14.099 0.584 1.00 0.00 H new ATOM 0 HB2 PRO A 361 10.843 -13.553 -0.992 1.00 0.00 H new ATOM 0 HB3 PRO A 361 10.534 -14.857 0.137 1.00 0.00 H new ATOM 0 HG2 PRO A 361 10.566 -15.250 -2.540 1.00 0.00 H new ATOM 0 HG3 PRO A 361 9.561 -16.206 -1.470 1.00 0.00 H new ATOM 0 HD2 PRO A 361 8.735 -14.106 -3.419 1.00 0.00 H new ATOM 0 HD3 PRO A 361 7.775 -15.399 -2.727 1.00 0.00 H new ATOM 752 N LEU A 362 8.897 -11.225 -0.702 1.00 0.00 N ATOM 753 CA LEU A 362 9.150 -9.808 -0.316 1.00 0.00 C ATOM 754 C LEU A 362 8.326 -9.472 0.929 1.00 0.00 C ATOM 755 O LEU A 362 8.824 -8.884 1.867 1.00 0.00 O ATOM 756 CB LEU A 362 8.731 -8.879 -1.461 1.00 0.00 C ATOM 757 CG LEU A 362 9.502 -9.240 -2.733 1.00 0.00 C ATOM 758 CD1 LEU A 362 9.140 -8.253 -3.847 1.00 0.00 C ATOM 759 CD2 LEU A 362 11.006 -9.162 -2.459 1.00 0.00 C ATOM 0 H LEU A 362 8.595 -11.368 -1.666 1.00 0.00 H new ATOM 0 HA LEU A 362 10.211 -9.673 -0.108 1.00 0.00 H new ATOM 0 HB2 LEU A 362 7.659 -8.966 -1.638 1.00 0.00 H new ATOM 0 HB3 LEU A 362 8.926 -7.842 -1.189 1.00 0.00 H new ATOM 0 HG LEU A 362 9.238 -10.252 -3.040 1.00 0.00 H new ATOM 0 HD11 LEU A 362 9.689 -8.510 -4.753 1.00 0.00 H new ATOM 0 HD12 LEU A 362 8.069 -8.304 -4.045 1.00 0.00 H new ATOM 0 HD13 LEU A 362 9.404 -7.242 -3.537 1.00 0.00 H new ATOM 0 HD21 LEU A 362 11.555 -9.419 -3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 362 11.268 -8.150 -2.151 1.00 0.00 H new ATOM 0 HD23 LEU A 362 11.268 -9.862 -1.665 1.00 0.00 H new ATOM 771 N SER A 363 7.074 -9.859 0.938 1.00 0.00 N ATOM 772 CA SER A 363 6.189 -9.584 2.113 1.00 0.00 C ATOM 773 C SER A 363 6.589 -8.271 2.791 1.00 0.00 C ATOM 774 O SER A 363 6.461 -8.119 3.990 1.00 0.00 O ATOM 775 CB SER A 363 6.314 -10.730 3.118 1.00 0.00 C ATOM 776 OG SER A 363 5.232 -10.668 4.038 1.00 0.00 O ATOM 0 H SER A 363 6.622 -10.359 0.172 1.00 0.00 H new ATOM 0 HA SER A 363 5.159 -9.501 1.766 1.00 0.00 H new ATOM 0 HB2 SER A 363 6.309 -11.688 2.597 1.00 0.00 H new ATOM 0 HB3 SER A 363 7.263 -10.661 3.650 1.00 0.00 H new ATOM 0 HG SER A 363 5.221 -9.789 4.471 1.00 0.00 H new ATOM 782 N SER A 364 7.078 -7.321 2.040 1.00 0.00 N ATOM 783 CA SER A 364 7.486 -6.030 2.656 1.00 0.00 C ATOM 784 C SER A 364 7.345 -4.901 1.637 1.00 0.00 C ATOM 785 O SER A 364 7.329 -5.127 0.443 1.00 0.00 O ATOM 786 CB SER A 364 8.942 -6.115 3.111 1.00 0.00 C ATOM 787 OG SER A 364 9.228 -5.025 3.978 1.00 0.00 O ATOM 0 H SER A 364 7.211 -7.384 1.031 1.00 0.00 H new ATOM 0 HA SER A 364 6.844 -5.828 3.514 1.00 0.00 H new ATOM 0 HB2 SER A 364 9.120 -7.060 3.625 1.00 0.00 H new ATOM 0 HB3 SER A 364 9.607 -6.092 2.247 1.00 0.00 H new ATOM 0 HG SER A 364 10.161 -5.078 4.273 1.00 0.00 H new ATOM 793 N VAL A 365 7.249 -3.687 2.100 1.00 0.00 N ATOM 794 CA VAL A 365 7.117 -2.542 1.162 1.00 0.00 C ATOM 795 C VAL A 365 8.471 -1.817 1.059 1.00 0.00 C ATOM 796 O VAL A 365 8.919 -1.217 2.015 1.00 0.00 O ATOM 797 CB VAL A 365 6.069 -1.568 1.702 1.00 0.00 C ATOM 798 CG1 VAL A 365 4.701 -1.909 1.107 1.00 0.00 C ATOM 799 CG2 VAL A 365 6.004 -1.682 3.227 1.00 0.00 C ATOM 0 H VAL A 365 7.256 -3.439 3.089 1.00 0.00 H new ATOM 0 HA VAL A 365 6.814 -2.903 0.179 1.00 0.00 H new ATOM 0 HB VAL A 365 6.343 -0.550 1.425 1.00 0.00 H new ATOM 0 HG11 VAL A 365 3.954 -1.215 1.492 1.00 0.00 H new ATOM 0 HG12 VAL A 365 4.746 -1.828 0.021 1.00 0.00 H new ATOM 0 HG13 VAL A 365 4.427 -2.927 1.384 1.00 0.00 H new ATOM 0 HG21 VAL A 365 5.257 -0.988 3.612 1.00 0.00 H new ATOM 0 HG22 VAL A 365 5.731 -2.700 3.504 1.00 0.00 H new ATOM 0 HG23 VAL A 365 6.978 -1.439 3.652 1.00 0.00 H new ATOM 809 N PRO A 366 9.128 -1.863 -0.081 1.00 0.00 N ATOM 810 CA PRO A 366 10.444 -1.190 -0.260 1.00 0.00 C ATOM 811 C PRO A 366 10.304 0.332 -0.368 1.00 0.00 C ATOM 812 O PRO A 366 11.279 1.050 -0.459 1.00 0.00 O ATOM 813 CB PRO A 366 10.999 -1.777 -1.558 1.00 0.00 C ATOM 814 CG PRO A 366 9.821 -2.292 -2.317 1.00 0.00 C ATOM 815 CD PRO A 366 8.696 -2.551 -1.312 1.00 0.00 C ATOM 0 HA PRO A 366 11.099 -1.358 0.595 1.00 0.00 H new ATOM 0 HB2 PRO A 366 11.531 -1.019 -2.132 1.00 0.00 H new ATOM 0 HB3 PRO A 366 11.709 -2.577 -1.351 1.00 0.00 H new ATOM 0 HG2 PRO A 366 9.504 -1.568 -3.068 1.00 0.00 H new ATOM 0 HG3 PRO A 366 10.079 -3.209 -2.847 1.00 0.00 H new ATOM 0 HD2 PRO A 366 7.745 -2.158 -1.672 1.00 0.00 H new ATOM 0 HD3 PRO A 366 8.556 -3.618 -1.141 1.00 0.00 H new ATOM 823 N SER A 367 9.096 0.826 -0.356 1.00 0.00 N ATOM 824 CA SER A 367 8.886 2.295 -0.454 1.00 0.00 C ATOM 825 C SER A 367 9.554 2.987 0.735 1.00 0.00 C ATOM 826 O SER A 367 9.750 4.186 0.740 1.00 0.00 O ATOM 827 CB SER A 367 7.387 2.592 -0.444 1.00 0.00 C ATOM 828 OG SER A 367 6.857 2.282 0.838 1.00 0.00 O ATOM 0 H SER A 367 8.243 0.271 -0.282 1.00 0.00 H new ATOM 0 HA SER A 367 9.325 2.666 -1.380 1.00 0.00 H new ATOM 0 HB2 SER A 367 7.211 3.642 -0.679 1.00 0.00 H new ATOM 0 HB3 SER A 367 6.883 2.004 -1.211 1.00 0.00 H new ATOM 0 HG SER A 367 6.329 3.040 1.166 1.00 0.00 H new ATOM 834 N GLU A 368 9.902 2.242 1.748 1.00 0.00 N ATOM 835 CA GLU A 368 10.554 2.858 2.938 1.00 0.00 C ATOM 836 C GLU A 368 11.706 3.754 2.482 1.00 0.00 C ATOM 837 O GLU A 368 11.979 4.777 3.080 1.00 0.00 O ATOM 838 CB GLU A 368 11.097 1.754 3.849 1.00 0.00 C ATOM 839 CG GLU A 368 11.643 2.376 5.136 1.00 0.00 C ATOM 840 CD GLU A 368 12.278 1.285 6.000 1.00 0.00 C ATOM 841 OE1 GLU A 368 12.286 0.144 5.568 1.00 0.00 O ATOM 842 OE2 GLU A 368 12.744 1.609 7.081 1.00 0.00 O ATOM 0 H GLU A 368 9.763 1.233 1.803 1.00 0.00 H new ATOM 0 HA GLU A 368 9.824 3.455 3.484 1.00 0.00 H new ATOM 0 HB2 GLU A 368 10.307 1.041 4.084 1.00 0.00 H new ATOM 0 HB3 GLU A 368 11.885 1.200 3.338 1.00 0.00 H new ATOM 0 HG2 GLU A 368 12.381 3.142 4.898 1.00 0.00 H new ATOM 0 HG3 GLU A 368 10.839 2.867 5.684 1.00 0.00 H new ATOM 849 N ASP A 369 12.381 3.383 1.426 1.00 0.00 N ATOM 850 CA ASP A 369 13.512 4.213 0.924 1.00 0.00 C ATOM 851 C ASP A 369 13.195 4.690 -0.494 1.00 0.00 C ATOM 852 O ASP A 369 12.248 4.244 -1.109 1.00 0.00 O ATOM 853 CB ASP A 369 14.796 3.378 0.914 1.00 0.00 C ATOM 854 CG ASP A 369 14.641 2.204 -0.054 1.00 0.00 C ATOM 855 OD1 ASP A 369 13.691 2.211 -0.819 1.00 0.00 O ATOM 856 OD2 ASP A 369 15.477 1.317 -0.015 1.00 0.00 O ATOM 0 H ASP A 369 12.196 2.536 0.888 1.00 0.00 H new ATOM 0 HA ASP A 369 13.652 5.076 1.575 1.00 0.00 H new ATOM 0 HB2 ASP A 369 15.642 3.998 0.616 1.00 0.00 H new ATOM 0 HB3 ASP A 369 15.009 3.009 1.917 1.00 0.00 H new ATOM 861 N GLU A 370 13.978 5.591 -1.020 1.00 0.00 N ATOM 862 CA GLU A 370 13.711 6.084 -2.398 1.00 0.00 C ATOM 863 C GLU A 370 13.811 4.912 -3.376 1.00 0.00 C ATOM 864 O GLU A 370 14.853 4.657 -3.947 1.00 0.00 O ATOM 865 CB GLU A 370 14.743 7.150 -2.771 1.00 0.00 C ATOM 866 CG GLU A 370 14.609 8.346 -1.825 1.00 0.00 C ATOM 867 CD GLU A 370 13.226 8.979 -1.990 1.00 0.00 C ATOM 868 OE1 GLU A 370 12.599 8.729 -3.006 1.00 0.00 O ATOM 869 OE2 GLU A 370 12.819 9.707 -1.100 1.00 0.00 O ATOM 0 H GLU A 370 14.787 6.005 -0.557 1.00 0.00 H new ATOM 0 HA GLU A 370 12.713 6.519 -2.445 1.00 0.00 H new ATOM 0 HB2 GLU A 370 15.749 6.735 -2.709 1.00 0.00 H new ATOM 0 HB3 GLU A 370 14.594 7.470 -3.802 1.00 0.00 H new ATOM 0 HG2 GLU A 370 14.752 8.024 -0.793 1.00 0.00 H new ATOM 0 HG3 GLU A 370 15.384 9.081 -2.040 1.00 0.00 H new ATOM 876 N TRP A 371 12.734 4.195 -3.567 1.00 0.00 N ATOM 877 CA TRP A 371 12.761 3.034 -4.503 1.00 0.00 C ATOM 878 C TRP A 371 11.804 3.293 -5.669 1.00 0.00 C ATOM 879 O TRP A 371 10.753 3.875 -5.503 1.00 0.00 O ATOM 880 CB TRP A 371 12.356 1.764 -3.747 1.00 0.00 C ATOM 881 CG TRP A 371 10.976 1.341 -4.133 1.00 0.00 C ATOM 882 CD1 TRP A 371 9.858 2.084 -3.971 1.00 0.00 C ATOM 883 CD2 TRP A 371 10.547 0.081 -4.724 1.00 0.00 C ATOM 884 NE1 TRP A 371 8.773 1.365 -4.432 1.00 0.00 N ATOM 885 CE2 TRP A 371 9.145 0.124 -4.903 1.00 0.00 C ATOM 886 CE3 TRP A 371 11.232 -1.082 -5.122 1.00 0.00 C ATOM 887 CZ2 TRP A 371 8.447 -0.950 -5.455 1.00 0.00 C ATOM 888 CZ3 TRP A 371 10.531 -2.165 -5.678 1.00 0.00 C ATOM 889 CH2 TRP A 371 9.140 -2.098 -5.842 1.00 0.00 C ATOM 0 H TRP A 371 11.836 4.364 -3.114 1.00 0.00 H new ATOM 0 HA TRP A 371 13.767 2.902 -4.901 1.00 0.00 H new ATOM 0 HB2 TRP A 371 13.062 0.963 -3.966 1.00 0.00 H new ATOM 0 HB3 TRP A 371 12.400 1.944 -2.673 1.00 0.00 H new ATOM 0 HD1 TRP A 371 9.820 3.078 -3.550 1.00 0.00 H new ATOM 0 HE1 TRP A 371 7.813 1.710 -4.425 1.00 0.00 H new ATOM 0 HE3 TRP A 371 12.303 -1.142 -4.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 371 7.376 -0.894 -5.582 1.00 0.00 H new ATOM 0 HZ3 TRP A 371 11.066 -3.053 -5.980 1.00 0.00 H new ATOM 0 HH2 TRP A 371 8.605 -2.934 -6.268 1.00 0.00 H new ATOM 900 N TYR A 372 12.173 2.882 -6.852 1.00 0.00 N ATOM 901 CA TYR A 372 11.296 3.113 -8.037 1.00 0.00 C ATOM 902 C TYR A 372 11.004 1.777 -8.721 1.00 0.00 C ATOM 903 O TYR A 372 11.815 0.873 -8.704 1.00 0.00 O ATOM 904 CB TYR A 372 12.002 4.041 -9.023 1.00 0.00 C ATOM 905 CG TYR A 372 12.529 5.250 -8.292 1.00 0.00 C ATOM 906 CD1 TYR A 372 11.698 6.356 -8.072 1.00 0.00 C ATOM 907 CD2 TYR A 372 13.852 5.266 -7.836 1.00 0.00 C ATOM 908 CE1 TYR A 372 12.192 7.477 -7.395 1.00 0.00 C ATOM 909 CE2 TYR A 372 14.346 6.386 -7.161 1.00 0.00 C ATOM 910 CZ TYR A 372 13.516 7.493 -6.939 1.00 0.00 C ATOM 911 OH TYR A 372 14.003 8.598 -6.273 1.00 0.00 O ATOM 0 H TYR A 372 13.047 2.395 -7.050 1.00 0.00 H new ATOM 0 HA TYR A 372 10.362 3.571 -7.712 1.00 0.00 H new ATOM 0 HB2 TYR A 372 12.821 3.513 -9.512 1.00 0.00 H new ATOM 0 HB3 TYR A 372 11.310 4.350 -9.806 1.00 0.00 H new ATOM 0 HD1 TYR A 372 10.677 6.344 -8.424 1.00 0.00 H new ATOM 0 HD2 TYR A 372 14.492 4.413 -8.006 1.00 0.00 H new ATOM 0 HE1 TYR A 372 11.552 8.330 -7.224 1.00 0.00 H new ATOM 0 HE2 TYR A 372 15.367 6.398 -6.811 1.00 0.00 H new ATOM 0 HH TYR A 372 14.938 8.444 -6.024 1.00 0.00 H new ATOM 921 N CYS A 373 9.855 1.643 -9.326 1.00 0.00 N ATOM 922 CA CYS A 373 9.527 0.365 -10.008 1.00 0.00 C ATOM 923 C CYS A 373 10.700 -0.031 -10.922 1.00 0.00 C ATOM 924 O CYS A 373 11.421 0.817 -11.405 1.00 0.00 O ATOM 925 CB CYS A 373 8.255 0.555 -10.838 1.00 0.00 C ATOM 926 SG CYS A 373 8.587 1.678 -12.211 1.00 0.00 S ATOM 0 H CYS A 373 9.133 2.362 -9.376 1.00 0.00 H new ATOM 0 HA CYS A 373 9.362 -0.424 -9.274 1.00 0.00 H new ATOM 0 HB2 CYS A 373 7.910 -0.407 -11.217 1.00 0.00 H new ATOM 0 HB3 CYS A 373 7.457 0.956 -10.212 1.00 0.00 H new ATOM 931 N PRO A 374 10.904 -1.310 -11.147 1.00 0.00 N ATOM 932 CA PRO A 374 12.024 -1.804 -12.003 1.00 0.00 C ATOM 933 C PRO A 374 12.162 -1.046 -13.331 1.00 0.00 C ATOM 934 O PRO A 374 13.256 -0.748 -13.769 1.00 0.00 O ATOM 935 CB PRO A 374 11.662 -3.262 -12.284 1.00 0.00 C ATOM 936 CG PRO A 374 10.747 -3.684 -11.182 1.00 0.00 C ATOM 937 CD PRO A 374 10.101 -2.421 -10.607 1.00 0.00 C ATOM 0 HA PRO A 374 12.979 -1.666 -11.496 1.00 0.00 H new ATOM 0 HB2 PRO A 374 11.175 -3.362 -13.254 1.00 0.00 H new ATOM 0 HB3 PRO A 374 12.555 -3.887 -12.309 1.00 0.00 H new ATOM 0 HG2 PRO A 374 9.985 -4.367 -11.558 1.00 0.00 H new ATOM 0 HG3 PRO A 374 11.300 -4.217 -10.409 1.00 0.00 H new ATOM 0 HD2 PRO A 374 9.057 -2.338 -10.909 1.00 0.00 H new ATOM 0 HD3 PRO A 374 10.118 -2.429 -9.517 1.00 0.00 H new ATOM 945 N GLU A 375 11.074 -0.747 -13.987 1.00 0.00 N ATOM 946 CA GLU A 375 11.173 -0.028 -15.293 1.00 0.00 C ATOM 947 C GLU A 375 11.644 1.415 -15.081 1.00 0.00 C ATOM 948 O GLU A 375 12.344 1.970 -15.905 1.00 0.00 O ATOM 949 CB GLU A 375 9.813 -0.025 -15.984 1.00 0.00 C ATOM 950 CG GLU A 375 8.792 0.575 -15.037 1.00 0.00 C ATOM 951 CD GLU A 375 7.422 0.628 -15.715 1.00 0.00 C ATOM 952 OE1 GLU A 375 7.354 0.317 -16.893 1.00 0.00 O ATOM 953 OE2 GLU A 375 6.465 0.977 -15.045 1.00 0.00 O ATOM 0 H GLU A 375 10.127 -0.967 -13.680 1.00 0.00 H new ATOM 0 HA GLU A 375 11.901 -0.545 -15.919 1.00 0.00 H new ATOM 0 HB2 GLU A 375 9.859 0.553 -16.907 1.00 0.00 H new ATOM 0 HB3 GLU A 375 9.525 -1.040 -16.257 1.00 0.00 H new ATOM 0 HG2 GLU A 375 8.734 -0.021 -14.126 1.00 0.00 H new ATOM 0 HG3 GLU A 375 9.101 1.578 -14.743 1.00 0.00 H new ATOM 960 N CYS A 376 11.276 2.029 -13.991 1.00 0.00 N ATOM 961 CA CYS A 376 11.718 3.434 -13.752 1.00 0.00 C ATOM 962 C CYS A 376 13.243 3.495 -13.798 1.00 0.00 C ATOM 963 O CYS A 376 13.829 4.372 -14.402 1.00 0.00 O ATOM 964 CB CYS A 376 11.254 3.898 -12.370 1.00 0.00 C ATOM 965 SG CYS A 376 9.811 4.979 -12.529 1.00 0.00 S ATOM 0 H CYS A 376 10.692 1.623 -13.259 1.00 0.00 H new ATOM 0 HA CYS A 376 11.288 4.078 -14.519 1.00 0.00 H new ATOM 0 HB2 CYS A 376 11.005 3.035 -11.753 1.00 0.00 H new ATOM 0 HB3 CYS A 376 12.062 4.428 -11.866 1.00 0.00 H new ATOM 970 N ARG A 377 13.884 2.570 -13.147 1.00 0.00 N ATOM 971 CA ARG A 377 15.372 2.555 -13.122 1.00 0.00 C ATOM 972 C ARG A 377 15.911 2.331 -14.537 1.00 0.00 C ATOM 973 O ARG A 377 17.024 2.703 -14.853 1.00 0.00 O ATOM 974 CB ARG A 377 15.832 1.422 -12.208 1.00 0.00 C ATOM 975 CG ARG A 377 15.222 1.628 -10.820 1.00 0.00 C ATOM 976 CD ARG A 377 15.716 0.535 -9.871 1.00 0.00 C ATOM 977 NE ARG A 377 14.907 0.565 -8.620 1.00 0.00 N ATOM 978 CZ ARG A 377 14.663 -0.540 -7.965 1.00 0.00 C ATOM 979 NH1 ARG A 377 15.141 -1.678 -8.390 1.00 0.00 N ATOM 980 NH2 ARG A 377 13.940 -0.504 -6.879 1.00 0.00 N ATOM 0 H ARG A 377 13.438 1.816 -12.625 1.00 0.00 H new ATOM 0 HA ARG A 377 15.748 3.508 -12.750 1.00 0.00 H new ATOM 0 HB2 ARG A 377 15.524 0.459 -12.616 1.00 0.00 H new ATOM 0 HB3 ARG A 377 16.920 1.408 -12.143 1.00 0.00 H new ATOM 0 HG2 ARG A 377 15.497 2.610 -10.434 1.00 0.00 H new ATOM 0 HG3 ARG A 377 14.134 1.603 -10.883 1.00 0.00 H new ATOM 0 HD2 ARG A 377 15.633 -0.442 -10.348 1.00 0.00 H new ATOM 0 HD3 ARG A 377 16.770 0.688 -9.640 1.00 0.00 H new ATOM 0 HE ARG A 377 14.542 1.452 -8.273 1.00 0.00 H new ATOM 0 HH11 ARG A 377 15.708 -1.708 -9.237 1.00 0.00 H new ATOM 0 HH12 ARG A 377 14.947 -2.537 -7.875 1.00 0.00 H new ATOM 0 HH21 ARG A 377 13.567 0.384 -6.544 1.00 0.00 H new ATOM 0 HH22 ARG A 377 13.748 -1.364 -6.366 1.00 0.00 H new ATOM 994 N ASN A 378 15.131 1.726 -15.390 1.00 0.00 N ATOM 995 CA ASN A 378 15.601 1.480 -16.782 1.00 0.00 C ATOM 996 C ASN A 378 16.889 0.655 -16.747 1.00 0.00 C ATOM 997 O ASN A 378 17.845 0.947 -17.439 1.00 0.00 O ATOM 998 CB ASN A 378 15.872 2.818 -17.474 1.00 0.00 C ATOM 999 CG ASN A 378 15.919 2.609 -18.988 1.00 0.00 C ATOM 1000 OD1 ASN A 378 15.686 1.518 -19.470 1.00 0.00 O ATOM 1001 ND2 ASN A 378 16.212 3.615 -19.765 1.00 0.00 N ATOM 0 H ASN A 378 14.190 1.392 -15.183 1.00 0.00 H new ATOM 0 HA ASN A 378 14.834 0.935 -17.333 1.00 0.00 H new ATOM 0 HB2 ASN A 378 15.092 3.536 -17.219 1.00 0.00 H new ATOM 0 HB3 ASN A 378 16.816 3.236 -17.124 1.00 0.00 H new ATOM 0 HD21 ASN A 378 16.245 3.486 -20.776 1.00 0.00 H new ATOM 0 HD22 ASN A 378 16.408 4.531 -19.361 1.00 0.00 H new ATOM 1008 N ASP A 379 16.925 -0.373 -15.944 1.00 0.00 N ATOM 1009 CA ASP A 379 18.151 -1.215 -15.863 1.00 0.00 C ATOM 1010 C ASP A 379 18.324 -1.991 -17.170 1.00 0.00 C ATOM 1011 O ASP A 379 17.492 -2.841 -17.446 1.00 0.00 O ATOM 1012 CB ASP A 379 18.019 -2.199 -14.699 1.00 0.00 C ATOM 1013 CG ASP A 379 18.017 -1.430 -13.377 1.00 0.00 C ATOM 1014 OD1 ASP A 379 18.347 -0.256 -13.397 1.00 0.00 O ATOM 1015 OD2 ASP A 379 17.685 -2.028 -12.367 1.00 0.00 O ATOM 1016 OXT ASP A 379 19.285 -1.725 -17.873 1.00 0.00 O ATOM 0 H ASP A 379 16.157 -0.666 -15.340 1.00 0.00 H new ATOM 0 HA ASP A 379 19.020 -0.577 -15.702 1.00 0.00 H new ATOM 0 HB2 ASP A 379 17.099 -2.775 -14.798 1.00 0.00 H new ATOM 0 HB3 ASP A 379 18.844 -2.911 -14.716 1.00 0.00 H new TER 1021 ASP A 379 ATOM 1022 N ALA B 383 9.025 5.545 -2.685 1.00 0.00 N ATOM 1023 CA ALA B 383 8.187 6.164 -3.751 1.00 0.00 C ATOM 1024 C ALA B 383 6.926 6.761 -3.126 1.00 0.00 C ATOM 1025 O ALA B 383 6.987 7.488 -2.154 1.00 0.00 O ATOM 1026 CB ALA B 383 7.786 5.096 -4.770 1.00 0.00 C ATOM 0 HA ALA B 383 8.757 6.949 -4.248 1.00 0.00 H new ATOM 0 HB1 ALA B 383 7.173 5.549 -5.549 1.00 0.00 H new ATOM 0 HB2 ALA B 383 8.682 4.665 -5.217 1.00 0.00 H new ATOM 0 HB3 ALA B 383 7.217 4.312 -4.271 1.00 0.00 H new ATOM 1034 N ARG B 384 5.785 6.455 -3.681 1.00 0.00 N ATOM 1035 CA ARG B 384 4.509 6.995 -3.132 1.00 0.00 C ATOM 1036 C ARG B 384 3.592 5.832 -2.753 1.00 0.00 C ATOM 1037 O ARG B 384 3.290 4.980 -3.566 1.00 0.00 O ATOM 1038 CB ARG B 384 3.831 7.859 -4.195 1.00 0.00 C ATOM 1039 CG ARG B 384 2.477 8.348 -3.680 1.00 0.00 C ATOM 1040 CD ARG B 384 1.935 9.430 -4.620 1.00 0.00 C ATOM 1041 NE ARG B 384 1.724 8.856 -5.981 1.00 0.00 N ATOM 1042 CZ ARG B 384 0.624 8.208 -6.256 1.00 0.00 C ATOM 1043 NH1 ARG B 384 -0.280 8.034 -5.331 1.00 0.00 N ATOM 1044 NH2 ARG B 384 0.428 7.732 -7.458 1.00 0.00 N ATOM 0 H ARG B 384 5.682 5.850 -4.496 1.00 0.00 H new ATOM 0 HA ARG B 384 4.712 7.599 -2.248 1.00 0.00 H new ATOM 0 HB2 ARG B 384 4.465 8.710 -4.443 1.00 0.00 H new ATOM 0 HB3 ARG B 384 3.696 7.285 -5.111 1.00 0.00 H new ATOM 0 HG2 ARG B 384 1.775 7.516 -3.623 1.00 0.00 H new ATOM 0 HG3 ARG B 384 2.582 8.747 -2.671 1.00 0.00 H new ATOM 0 HD2 ARG B 384 0.996 9.825 -4.232 1.00 0.00 H new ATOM 0 HD3 ARG B 384 2.635 10.264 -4.671 1.00 0.00 H new ATOM 0 HE ARG B 384 2.440 8.970 -6.698 1.00 0.00 H new ATOM 0 HH11 ARG B 384 -0.128 8.404 -4.393 1.00 0.00 H new ATOM 0 HH12 ARG B 384 -1.139 7.528 -5.546 1.00 0.00 H new ATOM 0 HH21 ARG B 384 1.134 7.867 -8.181 1.00 0.00 H new ATOM 0 HH22 ARG B 384 -0.431 7.226 -7.672 1.00 0.00 H new ATOM 1058 N THR B 385 3.149 5.793 -1.526 1.00 0.00 N ATOM 1059 CA THR B 385 2.249 4.689 -1.088 1.00 0.00 C ATOM 1060 C THR B 385 0.996 5.283 -0.446 1.00 0.00 C ATOM 1061 O THR B 385 1.069 6.211 0.335 1.00 0.00 O ATOM 1062 CB THR B 385 2.979 3.810 -0.069 1.00 0.00 C ATOM 1063 OG1 THR B 385 4.208 3.364 -0.626 1.00 0.00 O ATOM 1064 CG2 THR B 385 2.109 2.605 0.285 1.00 0.00 C ATOM 0 H THR B 385 3.372 6.480 -0.806 1.00 0.00 H new ATOM 0 HA THR B 385 1.965 4.085 -1.950 1.00 0.00 H new ATOM 0 HB THR B 385 3.177 4.388 0.834 1.00 0.00 H new ATOM 0 HG1 THR B 385 4.670 2.789 0.019 1.00 0.00 H new ATOM 0 HG21 THR B 385 2.630 1.980 1.010 1.00 0.00 H new ATOM 0 HG22 THR B 385 1.167 2.949 0.713 1.00 0.00 H new ATOM 0 HG23 THR B 385 1.908 2.024 -0.615 1.00 0.00 H new ATOM 1072 N LYS B 386 -0.152 4.754 -0.767 1.00 0.00 N ATOM 1073 CA LYS B 386 -1.410 5.284 -0.172 1.00 0.00 C ATOM 1074 C LYS B 386 -2.281 4.118 0.293 1.00 0.00 C ATOM 1075 O LYS B 386 -2.220 3.030 -0.248 1.00 0.00 O ATOM 1076 CB LYS B 386 -2.164 6.109 -1.221 1.00 0.00 C ATOM 1077 CG LYS B 386 -2.652 5.195 -2.348 1.00 0.00 C ATOM 1078 CD LYS B 386 -3.288 6.042 -3.451 1.00 0.00 C ATOM 1079 CE LYS B 386 -4.054 5.133 -4.414 1.00 0.00 C ATOM 1080 NZ LYS B 386 -3.559 3.735 -4.277 1.00 0.00 N ATOM 0 H LYS B 386 -0.273 3.977 -1.416 1.00 0.00 H new ATOM 0 HA LYS B 386 -1.172 5.920 0.681 1.00 0.00 H new ATOM 0 HB2 LYS B 386 -3.011 6.615 -0.758 1.00 0.00 H new ATOM 0 HB3 LYS B 386 -1.512 6.883 -1.625 1.00 0.00 H new ATOM 0 HG2 LYS B 386 -1.818 4.620 -2.751 1.00 0.00 H new ATOM 0 HG3 LYS B 386 -3.377 4.478 -1.962 1.00 0.00 H new ATOM 0 HD2 LYS B 386 -3.963 6.779 -3.015 1.00 0.00 H new ATOM 0 HD3 LYS B 386 -2.518 6.594 -3.990 1.00 0.00 H new ATOM 0 HE2 LYS B 386 -5.122 5.175 -4.199 1.00 0.00 H new ATOM 0 HE3 LYS B 386 -3.922 5.478 -5.439 1.00 0.00 H new ATOM 0 HZ1 LYS B 386 -4.232 3.083 -4.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 386 -2.631 3.649 -4.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 386 -3.469 3.496 -3.269 1.00 0.00 H new ATOM 1094 N GLN B 387 -3.095 4.332 1.290 1.00 0.00 N ATOM 1095 CA GLN B 387 -3.970 3.233 1.784 1.00 0.00 C ATOM 1096 C GLN B 387 -5.328 3.329 1.090 1.00 0.00 C ATOM 1097 O GLN B 387 -5.948 4.374 1.067 1.00 0.00 O ATOM 1098 CB GLN B 387 -4.155 3.365 3.296 1.00 0.00 C ATOM 1099 CG GLN B 387 -4.942 2.162 3.821 1.00 0.00 C ATOM 1100 CD GLN B 387 -5.093 2.272 5.339 1.00 0.00 C ATOM 1101 OE1 GLN B 387 -4.509 3.140 5.958 1.00 0.00 O ATOM 1102 NE2 GLN B 387 -5.856 1.422 5.970 1.00 0.00 N ATOM 0 H GLN B 387 -3.192 5.220 1.783 1.00 0.00 H new ATOM 0 HA GLN B 387 -3.511 2.269 1.563 1.00 0.00 H new ATOM 0 HB2 GLN B 387 -3.184 3.421 3.788 1.00 0.00 H new ATOM 0 HB3 GLN B 387 -4.684 4.289 3.529 1.00 0.00 H new ATOM 0 HG2 GLN B 387 -5.924 2.123 3.349 1.00 0.00 H new ATOM 0 HG3 GLN B 387 -4.427 1.237 3.563 1.00 0.00 H new ATOM 0 HE21 GLN B 387 -6.346 0.694 5.451 1.00 0.00 H new ATOM 0 HE22 GLN B 387 -5.962 1.486 6.982 1.00 0.00 H new ATOM 1111 N THR B 388 -5.791 2.248 0.521 1.00 0.00 N ATOM 1112 CA THR B 388 -7.106 2.278 -0.180 1.00 0.00 C ATOM 1113 C THR B 388 -8.061 1.284 0.485 1.00 0.00 C ATOM 1114 O THR B 388 -7.641 0.294 1.052 1.00 0.00 O ATOM 1115 CB THR B 388 -6.901 1.883 -1.645 1.00 0.00 C ATOM 1116 OG1 THR B 388 -6.934 0.466 -1.760 1.00 0.00 O ATOM 1117 CG2 THR B 388 -5.543 2.401 -2.127 1.00 0.00 C ATOM 0 H THR B 388 -5.315 1.346 0.512 1.00 0.00 H new ATOM 0 HA THR B 388 -7.530 3.281 -0.124 1.00 0.00 H new ATOM 0 HB THR B 388 -7.693 2.318 -2.254 1.00 0.00 H new ATOM 0 HG1 THR B 388 -6.369 0.068 -1.065 1.00 0.00 H new ATOM 0 HG21 THR B 388 -5.396 2.120 -3.170 1.00 0.00 H new ATOM 0 HG22 THR B 388 -5.515 3.487 -2.036 1.00 0.00 H new ATOM 0 HG23 THR B 388 -4.751 1.965 -1.519 1.00 0.00 H new ATOM 1125 N ALA B 389 -9.341 1.542 0.414 1.00 0.00 N ATOM 1126 CA ALA B 389 -10.336 0.617 1.035 1.00 0.00 C ATOM 1127 C ALA B 389 -11.637 1.374 1.305 1.00 0.00 C ATOM 1128 O ALA B 389 -12.630 0.794 1.697 1.00 0.00 O ATOM 1129 CB ALA B 389 -9.793 0.073 2.357 1.00 0.00 C ATOM 0 H ALA B 389 -9.742 2.357 -0.050 1.00 0.00 H new ATOM 0 HA ALA B 389 -10.522 -0.212 0.352 1.00 0.00 H new ATOM 0 HB1 ALA B 389 -10.526 -0.600 2.802 1.00 0.00 H new ATOM 0 HB2 ALA B 389 -8.866 -0.470 2.174 1.00 0.00 H new ATOM 0 HB3 ALA B 389 -9.600 0.901 3.039 1.00 0.00 H new ATOM 1135 N ARG B 390 -11.645 2.662 1.101 1.00 0.00 N ATOM 1136 CA ARG B 390 -12.890 3.441 1.352 1.00 0.00 C ATOM 1137 C ARG B 390 -14.035 2.804 0.568 1.00 0.00 C ATOM 1138 O ARG B 390 -15.160 2.747 1.025 1.00 0.00 O ATOM 1139 CB ARG B 390 -12.694 4.887 0.890 1.00 0.00 C ATOM 1140 CG ARG B 390 -11.605 5.550 1.735 1.00 0.00 C ATOM 1141 CD ARG B 390 -11.493 7.028 1.354 1.00 0.00 C ATOM 1142 NE ARG B 390 -10.307 7.627 2.028 1.00 0.00 N ATOM 1143 CZ ARG B 390 -9.125 7.523 1.485 1.00 0.00 C ATOM 1144 NH1 ARG B 390 -8.981 6.892 0.352 1.00 0.00 N ATOM 1145 NH2 ARG B 390 -8.087 8.048 2.075 1.00 0.00 N ATOM 0 H ARG B 390 -10.848 3.207 0.773 1.00 0.00 H new ATOM 0 HA ARG B 390 -13.121 3.436 2.417 1.00 0.00 H new ATOM 0 HB2 ARG B 390 -12.415 4.909 -0.164 1.00 0.00 H new ATOM 0 HB3 ARG B 390 -13.629 5.440 0.984 1.00 0.00 H new ATOM 0 HG2 ARG B 390 -11.843 5.453 2.794 1.00 0.00 H new ATOM 0 HG3 ARG B 390 -10.650 5.049 1.575 1.00 0.00 H new ATOM 0 HD2 ARG B 390 -11.400 7.130 0.273 1.00 0.00 H new ATOM 0 HD3 ARG B 390 -12.398 7.560 1.647 1.00 0.00 H new ATOM 0 HE ARG B 390 -10.419 8.119 2.915 1.00 0.00 H new ATOM 0 HH11 ARG B 390 -9.792 6.480 -0.109 1.00 0.00 H new ATOM 0 HH12 ARG B 390 -8.057 6.811 -0.073 1.00 0.00 H new ATOM 0 HH21 ARG B 390 -8.199 8.540 2.961 1.00 0.00 H new ATOM 0 HH22 ARG B 390 -7.163 7.966 1.650 1.00 0.00 H new ATOM 1159 N LYS B 391 -13.751 2.313 -0.607 1.00 0.00 N ATOM 1160 CA LYS B 391 -14.809 1.663 -1.428 1.00 0.00 C ATOM 1161 C LYS B 391 -14.301 0.297 -1.896 1.00 0.00 C ATOM 1162 O LYS B 391 -13.195 0.174 -2.378 1.00 0.00 O ATOM 1163 CB LYS B 391 -15.121 2.543 -2.641 1.00 0.00 C ATOM 1164 CG LYS B 391 -15.677 3.886 -2.165 1.00 0.00 C ATOM 1165 CD LYS B 391 -16.092 4.726 -3.373 1.00 0.00 C ATOM 1166 CE LYS B 391 -16.529 6.115 -2.901 1.00 0.00 C ATOM 1167 NZ LYS B 391 -17.069 6.885 -4.057 1.00 0.00 N ATOM 0 H LYS B 391 -12.826 2.335 -1.035 1.00 0.00 H new ATOM 0 HA LYS B 391 -15.716 1.534 -0.837 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -14.219 2.699 -3.232 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -15.844 2.046 -3.288 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -16.533 3.725 -1.510 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -14.924 4.416 -1.582 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -15.261 4.813 -4.072 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -16.908 4.238 -3.906 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -17.288 6.025 -2.124 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -15.684 6.644 -2.461 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -17.893 7.441 -3.750 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -16.335 7.526 -4.420 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -17.357 6.226 -4.809 1.00 0.00 H new ATOM 1181 N SER B 392 -15.093 -0.730 -1.752 1.00 0.00 N ATOM 1182 CA SER B 392 -14.647 -2.087 -2.187 1.00 0.00 C ATOM 1183 C SER B 392 -15.648 -3.124 -1.683 1.00 0.00 C ATOM 1184 O SER B 392 -16.063 -4.008 -2.407 1.00 0.00 O ATOM 1185 CB SER B 392 -13.267 -2.389 -1.600 1.00 0.00 C ATOM 1186 OG SER B 392 -12.306 -2.413 -2.647 1.00 0.00 O ATOM 0 H SER B 392 -16.030 -0.690 -1.352 1.00 0.00 H new ATOM 0 HA SER B 392 -14.591 -2.122 -3.275 1.00 0.00 H new ATOM 0 HB2 SER B 392 -12.999 -1.632 -0.863 1.00 0.00 H new ATOM 0 HB3 SER B 392 -13.281 -3.348 -1.082 1.00 0.00 H new ATOM 0 HG SER B 392 -12.126 -3.341 -2.905 1.00 0.00 H new ATOM 1192 N THR B 393 -16.041 -3.014 -0.445 1.00 0.00 N ATOM 1193 CA THR B 393 -17.023 -3.978 0.123 1.00 0.00 C ATOM 1194 C THR B 393 -18.218 -3.197 0.666 1.00 0.00 C ATOM 1195 O THR B 393 -18.126 -2.016 0.936 1.00 0.00 O ATOM 1196 CB THR B 393 -16.365 -4.770 1.255 1.00 0.00 C ATOM 1197 OG1 THR B 393 -16.226 -3.933 2.396 1.00 0.00 O ATOM 1198 CG2 THR B 393 -14.987 -5.257 0.807 1.00 0.00 C ATOM 0 H THR B 393 -15.722 -2.293 0.202 1.00 0.00 H new ATOM 0 HA THR B 393 -17.355 -4.672 -0.649 1.00 0.00 H new ATOM 0 HB THR B 393 -16.986 -5.630 1.506 1.00 0.00 H new ATOM 0 HG1 THR B 393 -15.806 -4.438 3.123 1.00 0.00 H new ATOM 0 HG21 THR B 393 -14.520 -5.821 1.615 1.00 0.00 H new ATOM 0 HG22 THR B 393 -15.094 -5.898 -0.068 1.00 0.00 H new ATOM 0 HG23 THR B 393 -14.363 -4.400 0.555 1.00 0.00 H new ATOM 1206 N GLY B 394 -19.340 -3.839 0.827 1.00 0.00 N ATOM 1207 CA GLY B 394 -20.531 -3.118 1.351 1.00 0.00 C ATOM 1208 C GLY B 394 -21.389 -4.075 2.177 1.00 0.00 C ATOM 1209 O GLY B 394 -21.237 -4.082 3.388 1.00 0.00 O ATOM 1210 OXT GLY B 394 -22.185 -4.787 1.587 1.00 0.00 O ATOM 0 H GLY B 394 -19.484 -4.827 0.619 1.00 0.00 H new ATOM 0 HA2 GLY B 394 -20.216 -2.274 1.965 1.00 0.00 H new ATOM 0 HA3 GLY B 394 -21.115 -2.711 0.525 1.00 0.00 H new TER 1214 GLY B 394 HETATM 1215 ZN ZN A 380 -8.104 5.708 -8.593 1.00 0.00 ZN HETATM 1216 ZN ZN A 381 -3.562 -8.101 -8.946 1.00 0.00 ZN HETATM 1217 ZN ZN A 382 7.914 3.851 -11.880 1.00 0.00 ZN