USER MOD reduce.3.24.130724 H: found=0, std=0, add=837, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 823 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 317 LYS NZ :NH3+ 167:sc= -4.58! (180deg=-5.27!) USER MOD Set 1.2: B 20 LYS NZ :NH3+ 175:sc= -3.05! (180deg=-2.97!) USER MOD Set 2.1: A 319 CYS SG : rot -153:sc= -5.13! USER MOD Set 2.2: A 322 CYS SG : rot 180:sc= 0.214 USER MOD Set 2.3: A 342 HIS :FLIP no HE2:sc= -6.24! C(o=-17!,f=-16!) USER MOD Set 2.4: A 345 CYS SG : rot -143:sc= -4.45! USER MOD Set 3.1: A 341 TYR OH : rot -28:sc= -2.13 USER MOD Set 3.2: A 361 HIS :FLIP no HD1:sc= -5.51! C(o=-9.9!,f=-7.6!) USER MOD Set 4.1: A 334 CYS SG : rot 137:sc= -5.23! USER MOD Set 4.2: A 337 CYS SG : rot -20:sc= 0.102 USER MOD Set 4.3: A 360 CYS SG : rot -55:sc= -4.1! USER MOD Set 4.4: A 363 CYS SG : rot -83:sc= -5.9! USER MOD Set 5.1: A 330 GLN :FLIP amide:sc= -3.85! C(o=-9!,f=-7.5!) USER MOD Set 5.2: A 343 MET CE :methyl 148:sc= -3.66! (180deg=-6.32!) USER MOD Set 6.1: A 327 ASN :FLIP amide:sc= 0.0481 F(o=-0.81,f=0.14) USER MOD Set 6.2: A 344 TYR OH : rot 16:sc= 0.091 USER MOD Set 7.1: A 302 MET CE :methyl -156:sc= -2.3 (180deg=-1.41) USER MOD Set 7.2: B 18 HIS : no HD1:sc= -7.39! C(o=-9.7!,f=-15!) USER MOD Set 8.1: A 284 CYS SG : rot 117:sc= 1.6 USER MOD Set 8.2: A 287 CYS SG : rot 131:sc= 0.303 USER MOD Set 8.3: A 313 CYS SG : rot -23:sc= 0.513 USER MOD Set 8.4: A 316 CYS SG : rot -18:sc= -0.93 USER MOD Set 9.1: A 262 CYS SG : rot 70:sc= -7.37! USER MOD Set 9.2: A 265 CYS SG : rot 108:sc= -3.77! USER MOD Set 9.3: A 272 ASN : amide:sc= -0.869 K(o=-19,f=-29!) USER MOD Set 9.4: A 275 SER OG : rot 72:sc= 0.0134 USER MOD Set 9.5: A 292 HIS : no HD1:sc= -3.69 K(o=-19,f=-20) USER MOD Set 9.6: A 295 CYS SG : rot -154:sc= -3.49! USER MOD Set10.1: A 260 SER OG : rot -147:sc= 0.00163 USER MOD Set10.2: A 290 SER OG : rot 72:sc= -2.31! USER MOD Single : A 261 TYR OH : rot 180:sc= 0 USER MOD Single : A 269 SER OG : rot -179:sc= -2.51! USER MOD Single : A 270 ASN :FLIP amide:sc= -0.234 F(o=-5.2!,f=-0.23) USER MOD Single : A 271 MET CE :methyl -171:sc= -1.81! (180deg=-2.62!) USER MOD Single : A 273 LYS NZ :NH3+ 162:sc= 0.193 (180deg=0.1) USER MOD Single : A 274 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 283 SER OG : rot 180:sc= 0 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 297 GLN :FLIP amide:sc=-0.00454 F(o=-1.3!,f=-0.0045) USER MOD Single : A 299 THR OG1 : rot 180:sc= -0.0337 USER MOD Single : A 301 ASN : amide:sc= -0.44 K(o=-0.44,f=-4.4!) USER MOD Single : A 303 THR OG1 : rot 73:sc= -1.38 USER MOD Single : A 307 LYS NZ :NH3+ 166:sc= 0.0841 (180deg=-0.364) USER MOD Single : A 308 THR OG1 : rot 180:sc= 0 USER MOD Single : A 309 TYR OH : rot -36:sc= 1.11 USER MOD Single : A 310 LYS NZ :NH3+ 161:sc= -0.0767 (180deg=-0.416) USER MOD Single : A 312 GLN :FLIP amide:sc= -0.118 F(o=-0.78,f=-0.12) USER MOD Single : A 318 SER OG : rot -75:sc= 0.792 USER MOD Single : A 324 THR OG1 : rot 160:sc= -3.31! USER MOD Single : A 325 SER OG : rot 33:sc= 0.52 USER MOD Single : A 347 ASN : amide:sc= -0.229 K(o=-0.23,f=-2.4!) USER MOD Single : A 357 SER OG : rot 180:sc=-0.00877 USER MOD Single : A 359 SER OG : rot 180:sc= 0 USER MOD Single : A 368 LYS NZ :NH3+ 143:sc= 0.339 (180deg=-1.14) USER MOD ----------------------------------------------------------------- ATOM 108 N ARG B 17 -4.400 -4.191 5.540 1.00 0.00 N ATOM 109 CA ARG B 17 -3.359 -3.327 4.998 1.00 0.00 C ATOM 110 C ARG B 17 -2.828 -3.968 3.725 1.00 0.00 C ATOM 111 O ARG B 17 -3.454 -3.853 2.671 1.00 0.00 O ATOM 112 CB ARG B 17 -2.221 -3.099 6.000 1.00 0.00 C ATOM 113 CG ARG B 17 -1.039 -2.333 5.412 1.00 0.00 C ATOM 114 CD ARG B 17 -1.448 -0.936 4.961 1.00 0.00 C ATOM 115 NE ARG B 17 -1.768 -0.065 6.089 1.00 0.00 N ATOM 116 CZ ARG B 17 -0.854 0.468 6.895 1.00 0.00 C ATOM 117 NH1 ARG B 17 0.432 0.200 6.717 1.00 0.00 N ATOM 118 NH2 ARG B 17 -1.225 1.269 7.886 1.00 0.00 N ATOM 0 HA ARG B 17 -3.786 -2.347 4.785 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -2.608 -2.551 6.859 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -1.872 -4.064 6.368 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -0.246 -2.259 6.156 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -0.631 -2.885 4.565 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -0.640 -0.493 4.379 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -2.313 -1.007 4.302 1.00 0.00 H new ATOM 0 HE ARG B 17 -2.749 0.147 6.269 1.00 0.00 H new ATOM 0 HH11 ARG B 17 0.724 -0.417 5.959 1.00 0.00 H new ATOM 0 HH12 ARG B 17 1.129 0.611 7.338 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -2.213 1.477 8.031 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -0.522 1.676 8.503 1.00 0.00 H new ATOM 132 N HIS B 18 -1.691 -4.664 3.838 1.00 0.00 N ATOM 133 CA HIS B 18 -1.096 -5.365 2.709 1.00 0.00 C ATOM 134 C HIS B 18 0.326 -5.837 2.994 1.00 0.00 C ATOM 135 O HIS B 18 1.208 -5.059 3.359 1.00 0.00 O ATOM 136 CB HIS B 18 -1.113 -4.532 1.434 1.00 0.00 C ATOM 137 CG HIS B 18 -0.248 -3.329 1.414 1.00 0.00 C ATOM 138 ND1 HIS B 18 -0.329 -2.300 2.320 1.00 0.00 N ATOM 139 CD2 HIS B 18 0.708 -2.992 0.536 1.00 0.00 C ATOM 140 CE1 HIS B 18 0.552 -1.370 1.998 1.00 0.00 C ATOM 141 NE2 HIS B 18 1.196 -1.767 0.915 1.00 0.00 N ATOM 0 H HIS B 18 -1.166 -4.753 4.708 1.00 0.00 H new ATOM 0 HA HIS B 18 -1.723 -6.244 2.556 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -0.821 -5.175 0.604 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -2.139 -4.216 1.247 1.00 0.00 H new ATOM 0 HD2 HIS B 18 1.033 -3.576 -0.312 1.00 0.00 H new ATOM 0 HE1 HIS B 18 0.717 -0.444 2.529 1.00 0.00 H new ATOM 0 HE2 HIS B 18 1.934 -1.248 0.439 1.00 0.00 H new ATOM 150 N ARG B 19 0.509 -7.135 2.823 1.00 0.00 N ATOM 151 CA ARG B 19 1.792 -7.799 3.000 1.00 0.00 C ATOM 152 C ARG B 19 1.669 -9.218 2.465 1.00 0.00 C ATOM 153 O ARG B 19 2.606 -10.016 2.521 1.00 0.00 O ATOM 154 CB ARG B 19 2.228 -7.814 4.465 1.00 0.00 C ATOM 155 CG ARG B 19 3.676 -8.249 4.649 1.00 0.00 C ATOM 156 CD ARG B 19 3.993 -8.605 6.092 1.00 0.00 C ATOM 157 NE ARG B 19 5.171 -9.467 6.181 1.00 0.00 N ATOM 158 CZ ARG B 19 5.982 -9.513 7.234 1.00 0.00 C ATOM 159 NH1 ARG B 19 5.742 -8.754 8.296 1.00 0.00 N ATOM 160 NH2 ARG B 19 7.035 -10.322 7.225 1.00 0.00 N ATOM 0 H ARG B 19 -0.242 -7.770 2.552 1.00 0.00 H new ATOM 0 HA ARG B 19 2.557 -7.250 2.452 1.00 0.00 H new ATOM 0 HB2 ARG B 19 2.097 -6.818 4.888 1.00 0.00 H new ATOM 0 HB3 ARG B 19 1.578 -8.486 5.025 1.00 0.00 H new ATOM 0 HG2 ARG B 19 3.878 -9.110 4.012 1.00 0.00 H new ATOM 0 HG3 ARG B 19 4.338 -7.448 4.321 1.00 0.00 H new ATOM 0 HD2 ARG B 19 4.163 -7.693 6.665 1.00 0.00 H new ATOM 0 HD3 ARG B 19 3.137 -9.108 6.541 1.00 0.00 H new ATOM 0 HE ARG B 19 5.384 -10.070 5.386 1.00 0.00 H new ATOM 0 HH11 ARG B 19 4.933 -8.133 8.306 1.00 0.00 H new ATOM 0 HH12 ARG B 19 6.366 -8.792 9.102 1.00 0.00 H new ATOM 0 HH21 ARG B 19 7.221 -10.908 6.411 1.00 0.00 H new ATOM 0 HH22 ARG B 19 7.658 -10.358 8.032 1.00 0.00 H new ATOM 174 N LYS B 20 0.473 -9.502 1.949 1.00 0.00 N ATOM 175 CA LYS B 20 0.133 -10.789 1.362 1.00 0.00 C ATOM 176 C LYS B 20 0.617 -11.963 2.211 1.00 0.00 C ATOM 177 O LYS B 20 1.057 -12.986 1.686 1.00 0.00 O ATOM 178 CB LYS B 20 0.677 -10.867 -0.066 1.00 0.00 C ATOM 179 CG LYS B 20 2.172 -11.042 -0.170 1.00 0.00 C ATOM 180 CD LYS B 20 2.595 -11.048 -1.623 1.00 0.00 C ATOM 181 CE LYS B 20 4.091 -11.171 -1.760 1.00 0.00 C ATOM 182 NZ LYS B 20 4.511 -11.342 -3.177 1.00 0.00 N ATOM 0 H LYS B 20 -0.295 -8.831 1.929 1.00 0.00 H new ATOM 0 HA LYS B 20 -0.954 -10.867 1.331 1.00 0.00 H new ATOM 0 HB2 LYS B 20 0.192 -11.698 -0.578 1.00 0.00 H new ATOM 0 HB3 LYS B 20 0.395 -9.957 -0.596 1.00 0.00 H new ATOM 0 HG2 LYS B 20 2.678 -10.236 0.361 1.00 0.00 H new ATOM 0 HG3 LYS B 20 2.471 -11.975 0.308 1.00 0.00 H new ATOM 0 HD2 LYS B 20 2.111 -11.876 -2.141 1.00 0.00 H new ATOM 0 HD3 LYS B 20 2.258 -10.130 -2.105 1.00 0.00 H new ATOM 0 HE2 LYS B 20 4.567 -10.282 -1.346 1.00 0.00 H new ATOM 0 HE3 LYS B 20 4.440 -12.021 -1.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 5.549 -11.338 -3.234 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 4.148 -12.247 -3.540 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 4.129 -10.562 -3.749 1.00 0.00 H new ATOM 266 N SER A 260 -17.011 -1.406 -8.372 1.00 0.00 N ATOM 267 CA SER A 260 -16.187 -2.050 -7.357 1.00 0.00 C ATOM 268 C SER A 260 -16.669 -1.734 -5.958 1.00 0.00 C ATOM 269 O SER A 260 -17.735 -1.149 -5.763 1.00 0.00 O ATOM 270 CB SER A 260 -14.743 -1.609 -7.468 1.00 0.00 C ATOM 271 OG SER A 260 -14.102 -2.209 -8.579 1.00 0.00 O ATOM 0 HA SER A 260 -16.267 -3.123 -7.533 1.00 0.00 H new ATOM 0 HB2 SER A 260 -14.699 -0.524 -7.563 1.00 0.00 H new ATOM 0 HB3 SER A 260 -14.210 -1.871 -6.554 1.00 0.00 H new ATOM 0 HG SER A 260 -13.159 -2.368 -8.366 1.00 0.00 H new ATOM 277 N TYR A 261 -15.859 -2.134 -4.987 1.00 0.00 N ATOM 278 CA TYR A 261 -16.166 -1.904 -3.595 1.00 0.00 C ATOM 279 C TYR A 261 -14.977 -2.257 -2.712 1.00 0.00 C ATOM 280 O TYR A 261 -14.089 -3.010 -3.110 1.00 0.00 O ATOM 281 CB TYR A 261 -17.372 -2.745 -3.186 1.00 0.00 C ATOM 282 CG TYR A 261 -17.267 -4.203 -3.572 1.00 0.00 C ATOM 283 CD1 TYR A 261 -16.186 -4.959 -3.167 1.00 0.00 C ATOM 284 CD2 TYR A 261 -18.253 -4.823 -4.328 1.00 0.00 C ATOM 285 CE1 TYR A 261 -16.073 -6.286 -3.497 1.00 0.00 C ATOM 286 CE2 TYR A 261 -18.153 -6.160 -4.669 1.00 0.00 C ATOM 287 CZ TYR A 261 -17.059 -6.888 -4.251 1.00 0.00 C ATOM 288 OH TYR A 261 -16.951 -8.219 -4.583 1.00 0.00 O ATOM 0 H TYR A 261 -14.978 -2.623 -5.147 1.00 0.00 H new ATOM 0 HA TYR A 261 -16.394 -0.846 -3.465 1.00 0.00 H new ATOM 0 HB2 TYR A 261 -17.501 -2.675 -2.106 1.00 0.00 H new ATOM 0 HB3 TYR A 261 -18.267 -2.323 -3.642 1.00 0.00 H new ATOM 0 HD1 TYR A 261 -15.410 -4.495 -2.576 1.00 0.00 H new ATOM 0 HD2 TYR A 261 -19.110 -4.253 -4.655 1.00 0.00 H new ATOM 0 HE1 TYR A 261 -15.217 -6.856 -3.168 1.00 0.00 H new ATOM 0 HE2 TYR A 261 -18.926 -6.630 -5.258 1.00 0.00 H new ATOM 0 HH TYR A 261 -17.729 -8.488 -5.115 1.00 0.00 H new ATOM 298 N CYS A 262 -14.961 -1.694 -1.520 1.00 0.00 N ATOM 299 CA CYS A 262 -13.919 -1.976 -0.553 1.00 0.00 C ATOM 300 C CYS A 262 -13.986 -3.437 -0.136 1.00 0.00 C ATOM 301 O CYS A 262 -15.059 -3.957 0.134 1.00 0.00 O ATOM 302 CB CYS A 262 -14.130 -1.072 0.649 1.00 0.00 C ATOM 303 SG CYS A 262 -13.675 -1.761 2.266 1.00 0.00 S ATOM 0 H CYS A 262 -15.666 -1.032 -1.196 1.00 0.00 H new ATOM 0 HA CYS A 262 -12.937 -1.790 -0.987 1.00 0.00 H new ATOM 0 HB2 CYS A 262 -13.557 -0.158 0.494 1.00 0.00 H new ATOM 0 HB3 CYS A 262 -15.182 -0.788 0.682 1.00 0.00 H new ATOM 0 HG CYS A 262 -12.382 -1.874 2.341 1.00 0.00 H new ATOM 308 N ASP A 263 -12.847 -4.096 -0.086 1.00 0.00 N ATOM 309 CA ASP A 263 -12.806 -5.506 0.301 1.00 0.00 C ATOM 310 C ASP A 263 -13.089 -5.666 1.800 1.00 0.00 C ATOM 311 O ASP A 263 -13.069 -6.774 2.337 1.00 0.00 O ATOM 312 CB ASP A 263 -11.438 -6.095 -0.049 1.00 0.00 C ATOM 313 CG ASP A 263 -11.295 -7.546 0.364 1.00 0.00 C ATOM 314 OD1 ASP A 263 -12.023 -8.397 -0.189 1.00 0.00 O ATOM 315 OD2 ASP A 263 -10.452 -7.832 1.241 1.00 0.00 O ATOM 0 H ASP A 263 -11.938 -3.688 -0.306 1.00 0.00 H new ATOM 0 HA ASP A 263 -13.579 -6.044 -0.248 1.00 0.00 H new ATOM 0 HB2 ASP A 263 -11.277 -6.011 -1.124 1.00 0.00 H new ATOM 0 HB3 ASP A 263 -10.660 -5.506 0.437 1.00 0.00 H new ATOM 320 N PHE A 264 -13.362 -4.544 2.458 1.00 0.00 N ATOM 321 CA PHE A 264 -13.647 -4.521 3.897 1.00 0.00 C ATOM 322 C PHE A 264 -15.146 -4.315 4.172 1.00 0.00 C ATOM 323 O PHE A 264 -15.666 -4.835 5.160 1.00 0.00 O ATOM 324 CB PHE A 264 -12.824 -3.421 4.602 1.00 0.00 C ATOM 325 CG PHE A 264 -11.345 -3.486 4.341 1.00 0.00 C ATOM 326 CD1 PHE A 264 -10.838 -3.241 3.075 1.00 0.00 C ATOM 327 CD2 PHE A 264 -10.460 -3.766 5.369 1.00 0.00 C ATOM 328 CE1 PHE A 264 -9.480 -3.276 2.840 1.00 0.00 C ATOM 329 CE2 PHE A 264 -9.099 -3.806 5.139 1.00 0.00 C ATOM 330 CZ PHE A 264 -8.609 -3.558 3.871 1.00 0.00 C ATOM 0 H PHE A 264 -13.393 -3.626 2.015 1.00 0.00 H new ATOM 0 HA PHE A 264 -13.358 -5.491 4.301 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -13.194 -2.447 4.283 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -12.994 -3.490 5.676 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -11.515 -3.020 2.263 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -10.839 -3.955 6.362 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -9.098 -3.083 1.848 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -8.419 -4.030 5.948 1.00 0.00 H new ATOM 0 HZ PHE A 264 -7.545 -3.585 3.688 1.00 0.00 H new ATOM 340 N CYS A 265 -15.849 -3.564 3.307 1.00 0.00 N ATOM 341 CA CYS A 265 -17.290 -3.342 3.505 1.00 0.00 C ATOM 342 C CYS A 265 -18.079 -3.699 2.263 1.00 0.00 C ATOM 343 O CYS A 265 -19.283 -3.955 2.332 1.00 0.00 O ATOM 344 CB CYS A 265 -17.640 -1.896 3.882 1.00 0.00 C ATOM 345 SG CYS A 265 -16.441 -1.014 4.921 1.00 0.00 S ATOM 0 H CYS A 265 -15.454 -3.110 2.483 1.00 0.00 H new ATOM 0 HA CYS A 265 -17.560 -3.993 4.336 1.00 0.00 H new ATOM 0 HB2 CYS A 265 -17.777 -1.328 2.962 1.00 0.00 H new ATOM 0 HB3 CYS A 265 -18.600 -1.901 4.399 1.00 0.00 H new ATOM 0 HG CYS A 265 -15.823 -0.120 4.207 1.00 0.00 H new ATOM 350 N LEU A 266 -17.396 -3.702 1.134 1.00 0.00 N ATOM 351 CA LEU A 266 -18.000 -4.020 -0.130 1.00 0.00 C ATOM 352 C LEU A 266 -19.037 -2.980 -0.534 1.00 0.00 C ATOM 353 O LEU A 266 -20.155 -3.311 -0.929 1.00 0.00 O ATOM 354 CB LEU A 266 -18.596 -5.395 -0.045 1.00 0.00 C ATOM 355 CG LEU A 266 -17.676 -6.435 0.575 1.00 0.00 C ATOM 356 CD1 LEU A 266 -18.378 -7.771 0.673 1.00 0.00 C ATOM 357 CD2 LEU A 266 -16.388 -6.556 -0.223 1.00 0.00 C ATOM 0 H LEU A 266 -16.402 -3.482 1.076 1.00 0.00 H new ATOM 0 HA LEU A 266 -17.237 -4.006 -0.909 1.00 0.00 H new ATOM 0 HB2 LEU A 266 -19.515 -5.345 0.539 1.00 0.00 H new ATOM 0 HB3 LEU A 266 -18.872 -5.722 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 266 -17.418 -6.111 1.583 1.00 0.00 H new ATOM 0 HD11 LEU A 266 -17.705 -8.504 1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 266 -19.268 -7.670 1.295 1.00 0.00 H new ATOM 0 HD13 LEU A 266 -18.668 -8.104 -0.324 1.00 0.00 H new ATOM 0 HD21 LEU A 266 -15.744 -7.305 0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 266 -16.620 -6.855 -1.245 1.00 0.00 H new ATOM 0 HD23 LEU A 266 -15.875 -5.594 -0.234 1.00 0.00 H new ATOM 369 N GLY A 267 -18.638 -1.715 -0.436 1.00 0.00 N ATOM 370 CA GLY A 267 -19.516 -0.618 -0.813 1.00 0.00 C ATOM 371 C GLY A 267 -19.210 -0.084 -2.192 1.00 0.00 C ATOM 372 O GLY A 267 -19.685 -0.636 -3.186 1.00 0.00 O ATOM 0 H GLY A 267 -17.718 -1.428 -0.101 1.00 0.00 H new ATOM 0 HA2 GLY A 267 -20.551 -0.957 -0.779 1.00 0.00 H new ATOM 0 HA3 GLY A 267 -19.420 0.187 -0.085 1.00 0.00 H new ATOM 376 N GLY A 268 -18.423 0.989 -2.277 1.00 0.00 N ATOM 377 CA GLY A 268 -18.101 1.517 -3.592 1.00 0.00 C ATOM 378 C GLY A 268 -17.598 2.951 -3.605 1.00 0.00 C ATOM 379 O GLY A 268 -18.162 3.807 -4.287 1.00 0.00 O ATOM 0 H GLY A 268 -18.015 1.488 -1.486 1.00 0.00 H new ATOM 0 HA2 GLY A 268 -17.344 0.879 -4.047 1.00 0.00 H new ATOM 0 HA3 GLY A 268 -18.990 1.454 -4.219 1.00 0.00 H new ATOM 383 N SER A 269 -16.544 3.205 -2.843 1.00 0.00 N ATOM 384 CA SER A 269 -15.895 4.511 -2.808 1.00 0.00 C ATOM 385 C SER A 269 -16.748 5.597 -2.167 1.00 0.00 C ATOM 386 O SER A 269 -16.759 5.727 -0.944 1.00 0.00 O ATOM 387 CB SER A 269 -15.448 4.888 -4.218 1.00 0.00 C ATOM 388 OG SER A 269 -15.226 6.285 -4.343 1.00 0.00 O ATOM 0 H SER A 269 -16.113 2.512 -2.231 1.00 0.00 H new ATOM 0 HA SER A 269 -15.021 4.431 -2.162 1.00 0.00 H new ATOM 0 HB2 SER A 269 -14.533 4.351 -4.465 1.00 0.00 H new ATOM 0 HB3 SER A 269 -16.206 4.574 -4.936 1.00 0.00 H new ATOM 0 HG SER A 269 -14.955 6.492 -5.262 1.00 0.00 H new ATOM 394 N ASN A 270 -17.459 6.378 -2.977 1.00 0.00 N ATOM 395 CA ASN A 270 -18.294 7.457 -2.448 1.00 0.00 C ATOM 396 C ASN A 270 -19.445 6.929 -1.609 1.00 0.00 C ATOM 397 O ASN A 270 -20.426 7.637 -1.380 1.00 0.00 O ATOM 398 CB ASN A 270 -18.840 8.348 -3.561 1.00 0.00 C ATOM 399 CG ASN A 270 -19.668 7.606 -4.602 1.00 0.00 C ATOM 400 OD1 ASN A 270 -19.356 6.336 -4.840 1.00 0.00 O flip ATOM 401 ND2 ASN A 270 -20.587 8.176 -5.190 1.00 0.00 N flip ATOM 0 H ASN A 270 -17.475 6.287 -3.993 1.00 0.00 H new ATOM 0 HA ASN A 270 -17.645 8.054 -1.807 1.00 0.00 H new ATOM 0 HB2 ASN A 270 -19.453 9.132 -3.116 1.00 0.00 H new ATOM 0 HB3 ASN A 270 -18.005 8.840 -4.060 1.00 0.00 H new ATOM 0 HD21 ASN A 270 -20.798 9.152 -4.982 1.00 0.00 H new ATOM 0 HD22 ASN A 270 -21.137 7.672 -5.886 1.00 0.00 H new ATOM 408 N MET A 271 -19.332 5.691 -1.147 1.00 0.00 N ATOM 409 CA MET A 271 -20.377 5.117 -0.321 1.00 0.00 C ATOM 410 C MET A 271 -19.866 3.952 0.510 1.00 0.00 C ATOM 411 O MET A 271 -19.680 2.846 0.003 1.00 0.00 O ATOM 412 CB MET A 271 -21.557 4.657 -1.176 1.00 0.00 C ATOM 413 CG MET A 271 -22.684 4.027 -0.365 1.00 0.00 C ATOM 414 SD MET A 271 -23.977 5.202 0.105 1.00 0.00 S ATOM 415 CE MET A 271 -23.032 6.576 0.771 1.00 0.00 C ATOM 0 H MET A 271 -18.539 5.076 -1.328 1.00 0.00 H new ATOM 0 HA MET A 271 -20.709 5.902 0.359 1.00 0.00 H new ATOM 0 HB2 MET A 271 -21.950 5.510 -1.728 1.00 0.00 H new ATOM 0 HB3 MET A 271 -21.203 3.936 -1.913 1.00 0.00 H new ATOM 0 HG2 MET A 271 -23.131 3.219 -0.945 1.00 0.00 H new ATOM 0 HG3 MET A 271 -22.266 3.579 0.536 1.00 0.00 H new ATOM 0 HE1 MET A 271 -23.709 7.291 1.239 1.00 0.00 H new ATOM 0 HE2 MET A 271 -22.326 6.206 1.514 1.00 0.00 H new ATOM 0 HE3 MET A 271 -22.487 7.067 -0.035 1.00 0.00 H new ATOM 425 N ASN A 272 -19.639 4.209 1.790 1.00 0.00 N ATOM 426 CA ASN A 272 -19.188 3.169 2.697 1.00 0.00 C ATOM 427 C ASN A 272 -20.365 2.272 3.026 1.00 0.00 C ATOM 428 O ASN A 272 -21.519 2.679 2.907 1.00 0.00 O ATOM 429 CB ASN A 272 -18.598 3.764 3.982 1.00 0.00 C ATOM 430 CG ASN A 272 -17.817 2.747 4.791 1.00 0.00 C ATOM 431 OD1 ASN A 272 -18.379 2.019 5.605 1.00 0.00 O ATOM 432 ND2 ASN A 272 -16.508 2.701 4.577 1.00 0.00 N ATOM 0 H ASN A 272 -19.760 5.126 2.221 1.00 0.00 H new ATOM 0 HA ASN A 272 -18.399 2.593 2.214 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -17.944 4.598 3.725 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -19.404 4.168 4.594 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -15.929 2.043 5.098 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -16.081 3.324 3.891 1.00 0.00 H new ATOM 439 N LYS A 273 -20.076 1.050 3.413 1.00 0.00 N ATOM 440 CA LYS A 273 -21.111 0.094 3.736 1.00 0.00 C ATOM 441 C LYS A 273 -21.195 -0.169 5.227 1.00 0.00 C ATOM 442 O LYS A 273 -22.250 -0.528 5.751 1.00 0.00 O ATOM 443 CB LYS A 273 -20.810 -1.167 2.968 1.00 0.00 C ATOM 444 CG LYS A 273 -21.371 -1.119 1.585 1.00 0.00 C ATOM 445 CD LYS A 273 -22.874 -1.294 1.561 1.00 0.00 C ATOM 446 CE LYS A 273 -23.363 -1.511 0.142 1.00 0.00 C ATOM 447 NZ LYS A 273 -23.260 -2.937 -0.272 1.00 0.00 N ATOM 0 H LYS A 273 -19.126 0.693 3.512 1.00 0.00 H new ATOM 0 HA LYS A 273 -22.086 0.490 3.452 1.00 0.00 H new ATOM 0 HB2 LYS A 273 -19.731 -1.314 2.918 1.00 0.00 H new ATOM 0 HB3 LYS A 273 -21.224 -2.024 3.499 1.00 0.00 H new ATOM 0 HG2 LYS A 273 -21.112 -0.165 1.125 1.00 0.00 H new ATOM 0 HG3 LYS A 273 -20.908 -1.900 0.982 1.00 0.00 H new ATOM 0 HD2 LYS A 273 -23.157 -2.143 2.183 1.00 0.00 H new ATOM 0 HD3 LYS A 273 -23.355 -0.413 1.987 1.00 0.00 H new ATOM 0 HE2 LYS A 273 -24.400 -1.184 0.062 1.00 0.00 H new ATOM 0 HE3 LYS A 273 -22.780 -0.892 -0.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 -23.866 -3.103 -1.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 -22.273 -3.157 -0.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 -23.568 -3.549 0.510 1.00 0.00 H new ATOM 461 N LYS A 274 -20.077 0.008 5.901 1.00 0.00 N ATOM 462 CA LYS A 274 -20.014 -0.193 7.340 1.00 0.00 C ATOM 463 C LYS A 274 -20.292 1.115 8.089 1.00 0.00 C ATOM 464 O LYS A 274 -20.440 1.120 9.312 1.00 0.00 O ATOM 465 CB LYS A 274 -18.652 -0.770 7.714 1.00 0.00 C ATOM 466 CG LYS A 274 -18.401 -2.135 7.101 1.00 0.00 C ATOM 467 CD LYS A 274 -18.595 -3.254 8.112 1.00 0.00 C ATOM 468 CE LYS A 274 -18.136 -4.591 7.554 1.00 0.00 C ATOM 469 NZ LYS A 274 -18.209 -5.672 8.574 1.00 0.00 N ATOM 0 H LYS A 274 -19.194 0.292 5.476 1.00 0.00 H new ATOM 0 HA LYS A 274 -20.787 -0.903 7.636 1.00 0.00 H new ATOM 0 HB2 LYS A 274 -17.870 -0.083 7.390 1.00 0.00 H new ATOM 0 HB3 LYS A 274 -18.581 -0.846 8.799 1.00 0.00 H new ATOM 0 HG2 LYS A 274 -19.077 -2.285 6.259 1.00 0.00 H new ATOM 0 HG3 LYS A 274 -17.386 -2.175 6.706 1.00 0.00 H new ATOM 0 HD2 LYS A 274 -18.037 -3.026 9.020 1.00 0.00 H new ATOM 0 HD3 LYS A 274 -19.647 -3.316 8.391 1.00 0.00 H new ATOM 0 HE2 LYS A 274 -18.754 -4.858 6.697 1.00 0.00 H new ATOM 0 HE3 LYS A 274 -17.112 -4.501 7.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 274 -17.888 -6.568 8.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 274 -17.600 -5.430 9.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 274 -19.191 -5.775 8.901 1.00 0.00 H new ATOM 483 N SER A 275 -20.363 2.222 7.346 1.00 0.00 N ATOM 484 CA SER A 275 -20.652 3.531 7.921 1.00 0.00 C ATOM 485 C SER A 275 -21.710 4.232 7.109 1.00 0.00 C ATOM 486 O SER A 275 -22.489 5.038 7.618 1.00 0.00 O ATOM 487 CB SER A 275 -19.414 4.419 7.930 1.00 0.00 C ATOM 488 OG SER A 275 -18.264 3.707 8.352 1.00 0.00 O ATOM 0 H SER A 275 -20.222 2.233 6.336 1.00 0.00 H new ATOM 0 HA SER A 275 -20.992 3.365 8.943 1.00 0.00 H new ATOM 0 HB2 SER A 275 -19.247 4.821 6.931 1.00 0.00 H new ATOM 0 HB3 SER A 275 -19.580 5.269 8.592 1.00 0.00 H new ATOM 0 HG SER A 275 -17.989 3.082 7.648 1.00 0.00 H new ATOM 494 N GLY A 276 -21.719 3.905 5.838 1.00 0.00 N ATOM 495 CA GLY A 276 -22.641 4.521 4.921 1.00 0.00 C ATOM 496 C GLY A 276 -22.133 5.864 4.475 1.00 0.00 C ATOM 497 O GLY A 276 -22.872 6.662 3.898 1.00 0.00 O ATOM 0 H GLY A 276 -21.096 3.215 5.418 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -22.785 3.876 4.055 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -23.614 4.635 5.399 1.00 0.00 H new ATOM 501 N ARG A 277 -20.855 6.111 4.745 1.00 0.00 N ATOM 502 CA ARG A 277 -20.246 7.383 4.373 1.00 0.00 C ATOM 503 C ARG A 277 -19.359 7.298 3.145 1.00 0.00 C ATOM 504 O ARG A 277 -18.697 6.305 2.879 1.00 0.00 O ATOM 505 CB ARG A 277 -19.402 7.999 5.485 1.00 0.00 C ATOM 506 CG ARG A 277 -19.974 7.907 6.880 1.00 0.00 C ATOM 507 CD ARG A 277 -21.444 8.234 6.889 1.00 0.00 C ATOM 508 NE ARG A 277 -21.689 9.664 7.057 1.00 0.00 N ATOM 509 CZ ARG A 277 -22.778 10.165 7.635 1.00 0.00 C ATOM 510 NH1 ARG A 277 -23.716 9.354 8.106 1.00 0.00 N ATOM 511 NH2 ARG A 277 -22.926 11.478 7.745 1.00 0.00 N ATOM 0 H ARG A 277 -20.228 5.457 5.214 1.00 0.00 H new ATOM 0 HA ARG A 277 -21.111 8.013 4.164 1.00 0.00 H new ATOM 0 HB2 ARG A 277 -18.425 7.516 5.482 1.00 0.00 H new ATOM 0 HB3 ARG A 277 -19.239 9.051 5.250 1.00 0.00 H new ATOM 0 HG2 ARG A 277 -19.820 6.902 7.273 1.00 0.00 H new ATOM 0 HG3 ARG A 277 -19.442 8.593 7.540 1.00 0.00 H new ATOM 0 HD2 ARG A 277 -21.895 7.897 5.956 1.00 0.00 H new ATOM 0 HD3 ARG A 277 -21.932 7.686 7.695 1.00 0.00 H new ATOM 0 HE ARG A 277 -20.985 10.316 6.711 1.00 0.00 H new ATOM 0 HH11 ARG A 277 -23.604 8.343 8.026 1.00 0.00 H new ATOM 0 HH12 ARG A 277 -24.550 9.741 8.549 1.00 0.00 H new ATOM 0 HH21 ARG A 277 -22.205 12.104 7.387 1.00 0.00 H new ATOM 0 HH22 ARG A 277 -23.761 11.862 8.188 1.00 0.00 H new ATOM 525 N PRO A 278 -19.315 8.408 2.424 1.00 0.00 N ATOM 526 CA PRO A 278 -18.514 8.559 1.212 1.00 0.00 C ATOM 527 C PRO A 278 -17.018 8.399 1.463 1.00 0.00 C ATOM 528 O PRO A 278 -16.505 8.764 2.521 1.00 0.00 O ATOM 529 CB PRO A 278 -18.801 9.986 0.749 1.00 0.00 C ATOM 530 CG PRO A 278 -20.028 10.411 1.480 1.00 0.00 C ATOM 531 CD PRO A 278 -20.085 9.604 2.748 1.00 0.00 C ATOM 0 HA PRO A 278 -18.772 7.792 0.482 1.00 0.00 H new ATOM 0 HB2 PRO A 278 -17.963 10.646 0.974 1.00 0.00 H new ATOM 0 HB3 PRO A 278 -18.956 10.024 -0.329 1.00 0.00 H new ATOM 0 HG2 PRO A 278 -19.994 11.477 1.703 1.00 0.00 H new ATOM 0 HG3 PRO A 278 -20.917 10.240 0.873 1.00 0.00 H new ATOM 0 HD2 PRO A 278 -19.651 10.146 3.589 1.00 0.00 H new ATOM 0 HD3 PRO A 278 -21.111 9.359 3.022 1.00 0.00 H new ATOM 539 N GLU A 279 -16.334 7.851 0.471 1.00 0.00 N ATOM 540 CA GLU A 279 -14.895 7.642 0.525 1.00 0.00 C ATOM 541 C GLU A 279 -14.373 7.456 -0.893 1.00 0.00 C ATOM 542 O GLU A 279 -14.810 8.146 -1.814 1.00 0.00 O ATOM 543 CB GLU A 279 -14.562 6.415 1.369 1.00 0.00 C ATOM 544 CG GLU A 279 -13.245 6.540 2.112 1.00 0.00 C ATOM 545 CD GLU A 279 -13.212 7.730 3.051 1.00 0.00 C ATOM 546 OE1 GLU A 279 -13.613 7.574 4.223 1.00 0.00 O ATOM 547 OE2 GLU A 279 -12.784 8.820 2.614 1.00 0.00 O ATOM 0 H GLU A 279 -16.764 7.537 -0.399 1.00 0.00 H new ATOM 0 HA GLU A 279 -14.421 8.509 0.985 1.00 0.00 H new ATOM 0 HB2 GLU A 279 -15.363 6.249 2.089 1.00 0.00 H new ATOM 0 HB3 GLU A 279 -14.526 5.537 0.724 1.00 0.00 H new ATOM 0 HG2 GLU A 279 -13.066 5.628 2.682 1.00 0.00 H new ATOM 0 HG3 GLU A 279 -12.433 6.629 1.391 1.00 0.00 H new ATOM 554 N GLU A 280 -13.446 6.524 -1.068 1.00 0.00 N ATOM 555 CA GLU A 280 -12.899 6.239 -2.389 1.00 0.00 C ATOM 556 C GLU A 280 -11.942 5.058 -2.364 1.00 0.00 C ATOM 557 O GLU A 280 -10.755 5.196 -2.078 1.00 0.00 O ATOM 558 CB GLU A 280 -12.225 7.457 -3.003 1.00 0.00 C ATOM 559 CG GLU A 280 -12.167 7.379 -4.520 1.00 0.00 C ATOM 560 CD GLU A 280 -12.581 8.672 -5.191 1.00 0.00 C ATOM 561 OE1 GLU A 280 -13.795 8.853 -5.423 1.00 0.00 O ATOM 562 OE2 GLU A 280 -11.695 9.502 -5.487 1.00 0.00 O ATOM 0 H GLU A 280 -13.058 5.954 -0.316 1.00 0.00 H new ATOM 0 HA GLU A 280 -13.747 5.972 -3.020 1.00 0.00 H new ATOM 0 HB2 GLU A 280 -12.766 8.356 -2.708 1.00 0.00 H new ATOM 0 HB3 GLU A 280 -11.214 7.548 -2.607 1.00 0.00 H new ATOM 0 HG2 GLU A 280 -11.153 7.124 -4.827 1.00 0.00 H new ATOM 0 HG3 GLU A 280 -12.816 6.573 -4.863 1.00 0.00 H new ATOM 569 N LEU A 281 -12.496 3.903 -2.698 1.00 0.00 N ATOM 570 CA LEU A 281 -11.766 2.636 -2.733 1.00 0.00 C ATOM 571 C LEU A 281 -10.474 2.713 -3.508 1.00 0.00 C ATOM 572 O LEU A 281 -10.184 3.693 -4.195 1.00 0.00 O ATOM 573 CB LEU A 281 -12.622 1.571 -3.387 1.00 0.00 C ATOM 574 CG LEU A 281 -14.100 1.760 -3.206 1.00 0.00 C ATOM 575 CD1 LEU A 281 -14.816 1.265 -4.430 1.00 0.00 C ATOM 576 CD2 LEU A 281 -14.583 1.046 -1.954 1.00 0.00 C ATOM 0 H LEU A 281 -13.479 3.813 -2.957 1.00 0.00 H new ATOM 0 HA LEU A 281 -11.532 2.395 -1.696 1.00 0.00 H new ATOM 0 HB2 LEU A 281 -12.400 1.549 -4.454 1.00 0.00 H new ATOM 0 HB3 LEU A 281 -12.341 0.599 -2.983 1.00 0.00 H new ATOM 0 HG LEU A 281 -14.318 2.820 -3.078 1.00 0.00 H new ATOM 0 HD11 LEU A 281 -15.890 1.400 -4.303 1.00 0.00 H new ATOM 0 HD12 LEU A 281 -14.480 1.828 -5.301 1.00 0.00 H new ATOM 0 HD13 LEU A 281 -14.598 0.207 -4.576 1.00 0.00 H new ATOM 0 HD21 LEU A 281 -15.657 1.196 -1.841 1.00 0.00 H new ATOM 0 HD22 LEU A 281 -14.372 -0.020 -2.039 1.00 0.00 H new ATOM 0 HD23 LEU A 281 -14.067 1.450 -1.083 1.00 0.00 H new ATOM 588 N VAL A 282 -9.705 1.644 -3.384 1.00 0.00 N ATOM 589 CA VAL A 282 -8.467 1.511 -4.109 1.00 0.00 C ATOM 590 C VAL A 282 -8.626 0.352 -5.042 1.00 0.00 C ATOM 591 O VAL A 282 -8.567 -0.789 -4.607 1.00 0.00 O ATOM 592 CB VAL A 282 -7.263 1.230 -3.205 1.00 0.00 C ATOM 593 CG1 VAL A 282 -6.169 2.183 -3.530 1.00 0.00 C ATOM 594 CG2 VAL A 282 -7.610 1.350 -1.751 1.00 0.00 C ATOM 0 H VAL A 282 -9.925 0.852 -2.780 1.00 0.00 H new ATOM 0 HA VAL A 282 -8.272 2.453 -4.621 1.00 0.00 H new ATOM 0 HB VAL A 282 -6.943 0.204 -3.387 1.00 0.00 H new ATOM 0 HG11 VAL A 282 -5.311 1.985 -2.888 1.00 0.00 H new ATOM 0 HG12 VAL A 282 -5.877 2.060 -4.573 1.00 0.00 H new ATOM 0 HG13 VAL A 282 -6.515 3.204 -3.368 1.00 0.00 H new ATOM 0 HG21 VAL A 282 -6.726 1.142 -1.148 1.00 0.00 H new ATOM 0 HG22 VAL A 282 -7.962 2.360 -1.543 1.00 0.00 H new ATOM 0 HG23 VAL A 282 -8.394 0.635 -1.504 1.00 0.00 H new ATOM 604 N SER A 283 -8.779 0.640 -6.323 1.00 0.00 N ATOM 605 CA SER A 283 -8.971 -0.409 -7.305 1.00 0.00 C ATOM 606 C SER A 283 -7.646 -0.796 -7.922 1.00 0.00 C ATOM 607 O SER A 283 -6.943 0.041 -8.491 1.00 0.00 O ATOM 608 CB SER A 283 -9.948 0.034 -8.390 1.00 0.00 C ATOM 609 OG SER A 283 -9.554 -0.447 -9.663 1.00 0.00 O ATOM 0 H SER A 283 -8.774 1.586 -6.704 1.00 0.00 H new ATOM 0 HA SER A 283 -9.393 -1.277 -6.799 1.00 0.00 H new ATOM 0 HB2 SER A 283 -10.947 -0.331 -8.154 1.00 0.00 H new ATOM 0 HB3 SER A 283 -10.003 1.122 -8.411 1.00 0.00 H new ATOM 0 HG SER A 283 -10.198 -0.150 -10.339 1.00 0.00 H new ATOM 615 N CYS A 284 -7.308 -2.065 -7.807 1.00 0.00 N ATOM 616 CA CYS A 284 -6.065 -2.561 -8.350 1.00 0.00 C ATOM 617 C CYS A 284 -6.040 -2.401 -9.871 1.00 0.00 C ATOM 618 O CYS A 284 -7.063 -2.551 -10.538 1.00 0.00 O ATOM 619 CB CYS A 284 -5.867 -4.017 -7.953 1.00 0.00 C ATOM 620 SG CYS A 284 -4.683 -4.867 -9.014 1.00 0.00 S ATOM 0 H CYS A 284 -7.879 -2.770 -7.341 1.00 0.00 H new ATOM 0 HA CYS A 284 -5.243 -1.976 -7.938 1.00 0.00 H new ATOM 0 HB2 CYS A 284 -5.524 -4.065 -6.920 1.00 0.00 H new ATOM 0 HB3 CYS A 284 -6.825 -4.535 -7.995 1.00 0.00 H new ATOM 0 HG CYS A 284 -3.658 -5.241 -8.308 1.00 0.00 H new ATOM 625 N ALA A 285 -4.861 -2.099 -10.409 1.00 0.00 N ATOM 626 CA ALA A 285 -4.692 -1.889 -11.845 1.00 0.00 C ATOM 627 C ALA A 285 -4.255 -3.155 -12.569 1.00 0.00 C ATOM 628 O ALA A 285 -3.784 -3.096 -13.705 1.00 0.00 O ATOM 629 CB ALA A 285 -3.664 -0.805 -12.084 1.00 0.00 C ATOM 0 H ALA A 285 -4.003 -1.994 -9.868 1.00 0.00 H new ATOM 0 HA ALA A 285 -5.663 -1.594 -12.244 1.00 0.00 H new ATOM 0 HB1 ALA A 285 -3.540 -0.651 -13.156 1.00 0.00 H new ATOM 0 HB2 ALA A 285 -3.999 0.123 -11.620 1.00 0.00 H new ATOM 0 HB3 ALA A 285 -2.711 -1.105 -11.648 1.00 0.00 H new ATOM 635 N ASP A 286 -4.407 -4.293 -11.917 1.00 0.00 N ATOM 636 CA ASP A 286 -4.005 -5.559 -12.508 1.00 0.00 C ATOM 637 C ASP A 286 -5.087 -6.621 -12.330 1.00 0.00 C ATOM 638 O ASP A 286 -5.564 -7.209 -13.301 1.00 0.00 O ATOM 639 CB ASP A 286 -2.700 -6.041 -11.872 1.00 0.00 C ATOM 640 CG ASP A 286 -2.182 -7.318 -12.504 1.00 0.00 C ATOM 641 OD1 ASP A 286 -2.585 -8.409 -12.050 1.00 0.00 O ATOM 642 OD2 ASP A 286 -1.372 -7.226 -13.449 1.00 0.00 O ATOM 0 H ASP A 286 -4.805 -4.368 -10.981 1.00 0.00 H new ATOM 0 HA ASP A 286 -3.855 -5.400 -13.576 1.00 0.00 H new ATOM 0 HB2 ASP A 286 -1.944 -5.261 -11.966 1.00 0.00 H new ATOM 0 HB3 ASP A 286 -2.858 -6.205 -10.806 1.00 0.00 H new ATOM 647 N CYS A 287 -5.465 -6.858 -11.080 1.00 0.00 N ATOM 648 CA CYS A 287 -6.477 -7.847 -10.749 1.00 0.00 C ATOM 649 C CYS A 287 -7.866 -7.199 -10.679 1.00 0.00 C ATOM 650 O CYS A 287 -8.805 -7.665 -11.324 1.00 0.00 O ATOM 651 CB CYS A 287 -6.104 -8.520 -9.427 1.00 0.00 C ATOM 652 SG CYS A 287 -4.300 -8.586 -9.127 1.00 0.00 S ATOM 0 H CYS A 287 -5.079 -6.371 -10.271 1.00 0.00 H new ATOM 0 HA CYS A 287 -6.517 -8.606 -11.530 1.00 0.00 H new ATOM 0 HB2 CYS A 287 -6.581 -7.983 -8.607 1.00 0.00 H new ATOM 0 HB3 CYS A 287 -6.503 -9.534 -9.419 1.00 0.00 H new ATOM 0 HG CYS A 287 -4.043 -8.147 -7.931 1.00 0.00 H new ATOM 657 N GLY A 288 -7.992 -6.123 -9.895 1.00 0.00 N ATOM 658 CA GLY A 288 -9.267 -5.414 -9.804 1.00 0.00 C ATOM 659 C GLY A 288 -9.889 -5.373 -8.413 1.00 0.00 C ATOM 660 O GLY A 288 -11.101 -5.197 -8.290 1.00 0.00 O ATOM 0 H GLY A 288 -7.241 -5.732 -9.326 1.00 0.00 H new ATOM 0 HA2 GLY A 288 -9.121 -4.391 -10.149 1.00 0.00 H new ATOM 0 HA3 GLY A 288 -9.975 -5.883 -10.487 1.00 0.00 H new ATOM 664 N ARG A 289 -9.083 -5.527 -7.367 1.00 0.00 N ATOM 665 CA ARG A 289 -9.602 -5.480 -5.997 1.00 0.00 C ATOM 666 C ARG A 289 -9.655 -4.042 -5.483 1.00 0.00 C ATOM 667 O ARG A 289 -8.702 -3.284 -5.662 1.00 0.00 O ATOM 668 CB ARG A 289 -8.732 -6.318 -5.060 1.00 0.00 C ATOM 669 CG ARG A 289 -9.297 -7.696 -4.758 1.00 0.00 C ATOM 670 CD ARG A 289 -8.992 -8.110 -3.328 1.00 0.00 C ATOM 671 NE ARG A 289 -9.224 -9.535 -3.101 1.00 0.00 N ATOM 672 CZ ARG A 289 -8.758 -10.195 -2.045 1.00 0.00 C ATOM 673 NH1 ARG A 289 -8.042 -9.561 -1.126 1.00 0.00 N ATOM 674 NH2 ARG A 289 -9.008 -11.489 -1.907 1.00 0.00 N ATOM 0 H ARG A 289 -8.078 -5.684 -7.436 1.00 0.00 H new ATOM 0 HA ARG A 289 -10.612 -5.890 -6.014 1.00 0.00 H new ATOM 0 HB2 ARG A 289 -7.743 -6.432 -5.504 1.00 0.00 H new ATOM 0 HB3 ARG A 289 -8.600 -5.777 -4.123 1.00 0.00 H new ATOM 0 HG2 ARG A 289 -10.375 -7.693 -4.917 1.00 0.00 H new ATOM 0 HG3 ARG A 289 -8.875 -8.425 -5.449 1.00 0.00 H new ATOM 0 HD2 ARG A 289 -7.954 -7.872 -3.097 1.00 0.00 H new ATOM 0 HD3 ARG A 289 -9.612 -7.530 -2.644 1.00 0.00 H new ATOM 0 HE ARG A 289 -9.773 -10.051 -3.789 1.00 0.00 H new ATOM 0 HH11 ARG A 289 -7.848 -8.565 -1.228 1.00 0.00 H new ATOM 0 HH12 ARG A 289 -7.686 -10.070 -0.317 1.00 0.00 H new ATOM 0 HH21 ARG A 289 -9.559 -11.980 -2.611 1.00 0.00 H new ATOM 0 HH22 ARG A 289 -8.650 -11.994 -1.096 1.00 0.00 H new ATOM 688 N SER A 290 -10.763 -3.662 -4.841 1.00 0.00 N ATOM 689 CA SER A 290 -10.884 -2.307 -4.307 1.00 0.00 C ATOM 690 C SER A 290 -10.943 -2.305 -2.785 1.00 0.00 C ATOM 691 O SER A 290 -11.334 -3.295 -2.167 1.00 0.00 O ATOM 692 CB SER A 290 -12.090 -1.572 -4.883 1.00 0.00 C ATOM 693 OG SER A 290 -12.167 -1.757 -6.284 1.00 0.00 O ATOM 0 H SER A 290 -11.573 -4.261 -4.681 1.00 0.00 H new ATOM 0 HA SER A 290 -9.985 -1.773 -4.615 1.00 0.00 H new ATOM 0 HB2 SER A 290 -13.003 -1.937 -4.412 1.00 0.00 H new ATOM 0 HB3 SER A 290 -12.017 -0.509 -4.655 1.00 0.00 H new ATOM 0 HG SER A 290 -12.442 -2.677 -6.478 1.00 0.00 H new ATOM 699 N GLY A 291 -10.548 -1.181 -2.190 1.00 0.00 N ATOM 700 CA GLY A 291 -10.546 -1.070 -0.732 1.00 0.00 C ATOM 701 C GLY A 291 -10.714 0.352 -0.226 1.00 0.00 C ATOM 702 O GLY A 291 -10.190 1.280 -0.809 1.00 0.00 O ATOM 0 H GLY A 291 -10.230 -0.347 -2.684 1.00 0.00 H new ATOM 0 HA2 GLY A 291 -11.349 -1.687 -0.329 1.00 0.00 H new ATOM 0 HA3 GLY A 291 -9.610 -1.475 -0.347 1.00 0.00 H new ATOM 706 N HIS A 292 -11.420 0.551 0.879 1.00 0.00 N ATOM 707 CA HIS A 292 -11.556 1.910 1.388 1.00 0.00 C ATOM 708 C HIS A 292 -10.226 2.273 2.020 1.00 0.00 C ATOM 709 O HIS A 292 -9.793 1.578 2.934 1.00 0.00 O ATOM 710 CB HIS A 292 -12.642 2.033 2.458 1.00 0.00 C ATOM 711 CG HIS A 292 -14.063 2.112 1.955 1.00 0.00 C ATOM 712 ND1 HIS A 292 -15.019 1.260 2.425 1.00 0.00 N ATOM 713 CD2 HIS A 292 -14.672 2.873 1.011 1.00 0.00 C ATOM 714 CE1 HIS A 292 -16.159 1.470 1.804 1.00 0.00 C ATOM 715 NE2 HIS A 292 -15.979 2.453 0.942 1.00 0.00 N ATOM 0 H HIS A 292 -11.889 -0.175 1.421 1.00 0.00 H new ATOM 0 HA HIS A 292 -11.835 2.568 0.565 1.00 0.00 H new ATOM 0 HB2 HIS A 292 -12.562 1.177 3.128 1.00 0.00 H new ATOM 0 HB3 HIS A 292 -12.438 2.923 3.053 1.00 0.00 H new ATOM 0 HD2 HIS A 292 -14.217 3.658 0.426 1.00 0.00 H new ATOM 0 HE1 HIS A 292 -17.081 0.932 1.970 1.00 0.00 H new ATOM 0 HE2 HIS A 292 -16.694 2.838 0.325 1.00 0.00 H new ATOM 723 N PRO A 293 -9.553 3.339 1.576 1.00 0.00 N ATOM 724 CA PRO A 293 -8.260 3.705 2.141 1.00 0.00 C ATOM 725 C PRO A 293 -8.273 3.678 3.667 1.00 0.00 C ATOM 726 O PRO A 293 -7.387 3.092 4.296 1.00 0.00 O ATOM 727 CB PRO A 293 -8.040 5.124 1.630 1.00 0.00 C ATOM 728 CG PRO A 293 -8.809 5.201 0.356 1.00 0.00 C ATOM 729 CD PRO A 293 -9.953 4.230 0.474 1.00 0.00 C ATOM 0 HA PRO A 293 -7.472 3.010 1.850 1.00 0.00 H new ATOM 0 HB2 PRO A 293 -8.395 5.862 2.350 1.00 0.00 H new ATOM 0 HB3 PRO A 293 -6.981 5.324 1.464 1.00 0.00 H new ATOM 0 HG2 PRO A 293 -9.178 6.213 0.189 1.00 0.00 H new ATOM 0 HG3 PRO A 293 -8.175 4.948 -0.493 1.00 0.00 H new ATOM 0 HD2 PRO A 293 -10.890 4.742 0.695 1.00 0.00 H new ATOM 0 HD3 PRO A 293 -10.103 3.676 -0.453 1.00 0.00 H new ATOM 737 N THR A 294 -9.289 4.295 4.259 1.00 0.00 N ATOM 738 CA THR A 294 -9.419 4.317 5.709 1.00 0.00 C ATOM 739 C THR A 294 -9.547 2.897 6.251 1.00 0.00 C ATOM 740 O THR A 294 -9.141 2.610 7.378 1.00 0.00 O ATOM 741 CB THR A 294 -10.637 5.143 6.157 1.00 0.00 C ATOM 742 OG1 THR A 294 -11.814 4.706 5.466 1.00 0.00 O ATOM 743 CG2 THR A 294 -10.403 6.618 5.897 1.00 0.00 C ATOM 0 H THR A 294 -10.031 4.784 3.759 1.00 0.00 H new ATOM 0 HA THR A 294 -8.519 4.785 6.109 1.00 0.00 H new ATOM 0 HB THR A 294 -10.778 4.994 7.228 1.00 0.00 H new ATOM 0 HG1 THR A 294 -12.583 5.238 5.761 1.00 0.00 H new ATOM 0 HG21 THR A 294 -11.275 7.187 6.220 1.00 0.00 H new ATOM 0 HG22 THR A 294 -9.526 6.951 6.453 1.00 0.00 H new ATOM 0 HG23 THR A 294 -10.240 6.778 4.831 1.00 0.00 H new ATOM 751 N CYS A 295 -10.115 2.012 5.433 1.00 0.00 N ATOM 752 CA CYS A 295 -10.294 0.616 5.815 1.00 0.00 C ATOM 753 C CYS A 295 -8.985 -0.150 5.717 1.00 0.00 C ATOM 754 O CYS A 295 -8.727 -1.047 6.521 1.00 0.00 O ATOM 755 CB CYS A 295 -11.371 -0.052 4.950 1.00 0.00 C ATOM 756 SG CYS A 295 -13.034 0.575 5.287 1.00 0.00 S ATOM 0 H CYS A 295 -10.459 2.240 4.500 1.00 0.00 H new ATOM 0 HA CYS A 295 -10.623 0.595 6.854 1.00 0.00 H new ATOM 0 HB2 CYS A 295 -11.135 0.107 3.898 1.00 0.00 H new ATOM 0 HB3 CYS A 295 -11.352 -1.128 5.122 1.00 0.00 H new ATOM 0 HG CYS A 295 -13.911 -0.335 4.983 1.00 0.00 H new ATOM 761 N LEU A 296 -8.152 0.198 4.740 1.00 0.00 N ATOM 762 CA LEU A 296 -6.872 -0.483 4.589 1.00 0.00 C ATOM 763 C LEU A 296 -5.828 0.103 5.531 1.00 0.00 C ATOM 764 O LEU A 296 -4.676 -0.331 5.538 1.00 0.00 O ATOM 765 CB LEU A 296 -6.360 -0.376 3.168 1.00 0.00 C ATOM 766 CG LEU A 296 -7.356 -0.725 2.081 1.00 0.00 C ATOM 767 CD1 LEU A 296 -7.647 0.508 1.256 1.00 0.00 C ATOM 768 CD2 LEU A 296 -6.815 -1.842 1.210 1.00 0.00 C ATOM 0 H LEU A 296 -8.335 0.931 4.055 1.00 0.00 H new ATOM 0 HA LEU A 296 -7.037 -1.532 4.835 1.00 0.00 H new ATOM 0 HB2 LEU A 296 -6.013 0.644 3.003 1.00 0.00 H new ATOM 0 HB3 LEU A 296 -5.493 -1.029 3.064 1.00 0.00 H new ATOM 0 HG LEU A 296 -8.283 -1.074 2.535 1.00 0.00 H new ATOM 0 HD11 LEU A 296 -8.363 0.261 0.473 1.00 0.00 H new ATOM 0 HD12 LEU A 296 -8.064 1.285 1.897 1.00 0.00 H new ATOM 0 HD13 LEU A 296 -6.724 0.869 0.803 1.00 0.00 H new ATOM 0 HD21 LEU A 296 -7.541 -2.082 0.433 1.00 0.00 H new ATOM 0 HD22 LEU A 296 -5.881 -1.523 0.747 1.00 0.00 H new ATOM 0 HD23 LEU A 296 -6.633 -2.725 1.822 1.00 0.00 H new ATOM 780 N GLN A 297 -6.241 1.107 6.302 1.00 0.00 N ATOM 781 CA GLN A 297 -5.358 1.780 7.252 1.00 0.00 C ATOM 782 C GLN A 297 -4.356 2.673 6.530 1.00 0.00 C ATOM 783 O GLN A 297 -3.420 3.189 7.141 1.00 0.00 O ATOM 784 CB GLN A 297 -4.626 0.783 8.154 1.00 0.00 C ATOM 785 CG GLN A 297 -5.463 0.285 9.310 1.00 0.00 C ATOM 786 CD GLN A 297 -4.703 -0.660 10.223 1.00 0.00 C ATOM 787 OE1 GLN A 297 -3.385 -0.496 10.291 1.00 0.00 O flip ATOM 788 NE2 GLN A 297 -5.295 -1.528 10.864 1.00 0.00 N flip ATOM 0 H GLN A 297 -7.192 1.475 6.286 1.00 0.00 H new ATOM 0 HA GLN A 297 -5.988 2.404 7.886 1.00 0.00 H new ATOM 0 HB2 GLN A 297 -4.306 -0.069 7.555 1.00 0.00 H new ATOM 0 HB3 GLN A 297 -3.724 1.254 8.546 1.00 0.00 H new ATOM 0 HG2 GLN A 297 -5.817 1.137 9.890 1.00 0.00 H new ATOM 0 HG3 GLN A 297 -6.345 -0.224 8.921 1.00 0.00 H new ATOM 0 HE21 GLN A 297 -6.308 -1.620 10.783 1.00 0.00 H new ATOM 0 HE22 GLN A 297 -4.773 -2.155 11.476 1.00 0.00 H new ATOM 797 N PHE A 298 -4.552 2.845 5.224 1.00 0.00 N ATOM 798 CA PHE A 298 -3.679 3.703 4.432 1.00 0.00 C ATOM 799 C PHE A 298 -3.642 5.101 5.032 1.00 0.00 C ATOM 800 O PHE A 298 -4.437 5.436 5.911 1.00 0.00 O ATOM 801 CB PHE A 298 -4.197 3.850 3.001 1.00 0.00 C ATOM 802 CG PHE A 298 -4.191 2.615 2.140 1.00 0.00 C ATOM 803 CD1 PHE A 298 -3.656 1.405 2.564 1.00 0.00 C ATOM 804 CD2 PHE A 298 -4.714 2.696 0.868 1.00 0.00 C ATOM 805 CE1 PHE A 298 -3.657 0.304 1.720 1.00 0.00 C ATOM 806 CE2 PHE A 298 -4.714 1.611 0.024 1.00 0.00 C ATOM 807 CZ PHE A 298 -4.188 0.415 0.445 1.00 0.00 C ATOM 0 H PHE A 298 -5.304 2.403 4.696 1.00 0.00 H new ATOM 0 HA PHE A 298 -2.691 3.242 4.430 1.00 0.00 H new ATOM 0 HB2 PHE A 298 -5.219 4.225 3.048 1.00 0.00 H new ATOM 0 HB3 PHE A 298 -3.600 4.613 2.502 1.00 0.00 H new ATOM 0 HD1 PHE A 298 -3.237 1.321 3.556 1.00 0.00 H new ATOM 0 HD2 PHE A 298 -5.133 3.631 0.527 1.00 0.00 H new ATOM 0 HE1 PHE A 298 -3.245 -0.636 2.056 1.00 0.00 H new ATOM 0 HE2 PHE A 298 -5.128 1.699 -0.970 1.00 0.00 H new ATOM 0 HZ PHE A 298 -4.188 -0.438 -0.217 1.00 0.00 H new ATOM 817 N THR A 299 -2.719 5.915 4.548 1.00 0.00 N ATOM 818 CA THR A 299 -2.616 7.295 4.987 1.00 0.00 C ATOM 819 C THR A 299 -3.166 8.188 3.886 1.00 0.00 C ATOM 820 O THR A 299 -3.232 7.762 2.737 1.00 0.00 O ATOM 821 CB THR A 299 -1.169 7.691 5.300 1.00 0.00 C ATOM 822 OG1 THR A 299 -1.104 9.078 5.654 1.00 0.00 O ATOM 823 CG2 THR A 299 -0.266 7.422 4.110 1.00 0.00 C ATOM 0 H THR A 299 -2.028 5.642 3.849 1.00 0.00 H new ATOM 0 HA THR A 299 -3.188 7.412 5.907 1.00 0.00 H new ATOM 0 HB THR A 299 -0.825 7.088 6.140 1.00 0.00 H new ATOM 0 HG1 THR A 299 -0.176 9.321 5.854 1.00 0.00 H new ATOM 0 HG21 THR A 299 0.756 7.711 4.356 1.00 0.00 H new ATOM 0 HG22 THR A 299 -0.294 6.360 3.865 1.00 0.00 H new ATOM 0 HG23 THR A 299 -0.611 8.001 3.253 1.00 0.00 H new ATOM 831 N LEU A 300 -3.572 9.403 4.219 1.00 0.00 N ATOM 832 CA LEU A 300 -4.119 10.301 3.207 1.00 0.00 C ATOM 833 C LEU A 300 -3.203 10.352 1.990 1.00 0.00 C ATOM 834 O LEU A 300 -3.667 10.225 0.860 1.00 0.00 O ATOM 835 CB LEU A 300 -4.341 11.701 3.783 1.00 0.00 C ATOM 836 CG LEU A 300 -5.403 12.542 3.065 1.00 0.00 C ATOM 837 CD1 LEU A 300 -4.884 13.033 1.732 1.00 0.00 C ATOM 838 CD2 LEU A 300 -6.681 11.746 2.866 1.00 0.00 C ATOM 0 H LEU A 300 -3.536 9.788 5.163 1.00 0.00 H new ATOM 0 HA LEU A 300 -5.087 9.913 2.891 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -4.625 11.604 4.831 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -3.395 12.241 3.757 1.00 0.00 H new ATOM 0 HG LEU A 300 -5.627 13.405 3.692 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -5.653 13.628 1.239 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -3.997 13.646 1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -4.627 12.179 1.105 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -7.419 12.364 2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -6.469 10.862 2.265 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -7.074 11.440 3.836 1.00 0.00 H new ATOM 850 N ASN A 301 -1.904 10.512 2.222 1.00 0.00 N ATOM 851 CA ASN A 301 -0.942 10.559 1.127 1.00 0.00 C ATOM 852 C ASN A 301 -1.028 9.284 0.294 1.00 0.00 C ATOM 853 O ASN A 301 -0.951 9.331 -0.929 1.00 0.00 O ATOM 854 CB ASN A 301 0.475 10.731 1.662 1.00 0.00 C ATOM 855 CG ASN A 301 0.649 11.979 2.504 1.00 0.00 C ATOM 856 OD1 ASN A 301 -0.302 12.473 3.109 1.00 0.00 O ATOM 857 ND2 ASN A 301 1.877 12.495 2.555 1.00 0.00 N ATOM 0 H ASN A 301 -1.496 10.611 3.151 1.00 0.00 H new ATOM 0 HA ASN A 301 -1.184 11.415 0.497 1.00 0.00 H new ATOM 0 HB2 ASN A 301 0.739 9.858 2.259 1.00 0.00 H new ATOM 0 HB3 ASN A 301 1.171 10.766 0.824 1.00 0.00 H new ATOM 0 HD21 ASN A 301 2.056 13.331 3.111 1.00 0.00 H new ATOM 0 HD22 ASN A 301 2.637 12.054 2.038 1.00 0.00 H new ATOM 864 N MET A 302 -1.163 8.145 0.970 1.00 0.00 N ATOM 865 CA MET A 302 -1.291 6.852 0.296 1.00 0.00 C ATOM 866 C MET A 302 -2.522 6.848 -0.548 1.00 0.00 C ATOM 867 O MET A 302 -2.489 6.472 -1.704 1.00 0.00 O ATOM 868 CB MET A 302 -1.434 5.734 1.315 1.00 0.00 C ATOM 869 CG MET A 302 -1.426 4.344 0.736 1.00 0.00 C ATOM 870 SD MET A 302 -1.154 3.102 2.005 1.00 0.00 S ATOM 871 CE MET A 302 -0.690 1.723 0.987 1.00 0.00 C ATOM 0 H MET A 302 -1.187 8.090 1.988 1.00 0.00 H new ATOM 0 HA MET A 302 -0.399 6.697 -0.311 1.00 0.00 H new ATOM 0 HB2 MET A 302 -0.623 5.815 2.038 1.00 0.00 H new ATOM 0 HB3 MET A 302 -2.365 5.878 1.863 1.00 0.00 H new ATOM 0 HG2 MET A 302 -2.375 4.152 0.235 1.00 0.00 H new ATOM 0 HG3 MET A 302 -0.645 4.269 -0.021 1.00 0.00 H new ATOM 0 HE1 MET A 302 -0.894 0.793 1.518 1.00 0.00 H new ATOM 0 HE2 MET A 302 -1.264 1.745 0.061 1.00 0.00 H new ATOM 0 HE3 MET A 302 0.374 1.783 0.756 1.00 0.00 H new ATOM 881 N THR A 303 -3.607 7.290 0.043 1.00 0.00 N ATOM 882 CA THR A 303 -4.861 7.329 -0.650 1.00 0.00 C ATOM 883 C THR A 303 -4.658 8.075 -1.956 1.00 0.00 C ATOM 884 O THR A 303 -4.877 7.525 -3.024 1.00 0.00 O ATOM 885 CB THR A 303 -5.932 8.015 0.217 1.00 0.00 C ATOM 886 OG1 THR A 303 -6.093 7.300 1.446 1.00 0.00 O ATOM 887 CG2 THR A 303 -7.266 8.098 -0.503 1.00 0.00 C ATOM 0 H THR A 303 -3.641 7.627 1.005 1.00 0.00 H new ATOM 0 HA THR A 303 -5.209 6.317 -0.857 1.00 0.00 H new ATOM 0 HB THR A 303 -5.595 9.031 0.421 1.00 0.00 H new ATOM 0 HG1 THR A 303 -5.316 7.459 2.021 1.00 0.00 H new ATOM 0 HG21 THR A 303 -7.997 8.588 0.140 1.00 0.00 H new ATOM 0 HG22 THR A 303 -7.148 8.672 -1.422 1.00 0.00 H new ATOM 0 HG23 THR A 303 -7.612 7.093 -0.745 1.00 0.00 H new ATOM 895 N GLU A 304 -4.149 9.298 -1.862 1.00 0.00 N ATOM 896 CA GLU A 304 -3.895 10.109 -3.046 1.00 0.00 C ATOM 897 C GLU A 304 -2.956 9.393 -4.018 1.00 0.00 C ATOM 898 O GLU A 304 -3.229 9.317 -5.214 1.00 0.00 O ATOM 899 CB GLU A 304 -3.269 11.450 -2.654 1.00 0.00 C ATOM 900 CG GLU A 304 -3.972 12.148 -1.511 1.00 0.00 C ATOM 901 CD GLU A 304 -3.390 13.517 -1.218 1.00 0.00 C ATOM 902 OE1 GLU A 304 -3.792 14.490 -1.889 1.00 0.00 O ATOM 903 OE2 GLU A 304 -2.532 13.615 -0.315 1.00 0.00 O ATOM 0 H GLU A 304 -3.905 9.749 -0.980 1.00 0.00 H new ATOM 0 HA GLU A 304 -4.854 10.277 -3.535 1.00 0.00 H new ATOM 0 HB2 GLU A 304 -2.227 11.286 -2.380 1.00 0.00 H new ATOM 0 HB3 GLU A 304 -3.270 12.108 -3.523 1.00 0.00 H new ATOM 0 HG2 GLU A 304 -5.031 12.251 -1.749 1.00 0.00 H new ATOM 0 HG3 GLU A 304 -3.905 11.530 -0.616 1.00 0.00 H new ATOM 910 N ALA A 305 -1.846 8.872 -3.490 1.00 0.00 N ATOM 911 CA ALA A 305 -0.848 8.181 -4.309 1.00 0.00 C ATOM 912 C ALA A 305 -1.482 7.052 -5.098 1.00 0.00 C ATOM 913 O ALA A 305 -1.475 7.043 -6.326 1.00 0.00 O ATOM 914 CB ALA A 305 0.280 7.631 -3.428 1.00 0.00 C ATOM 0 H ALA A 305 -1.616 8.916 -2.497 1.00 0.00 H new ATOM 0 HA ALA A 305 -0.432 8.903 -5.011 1.00 0.00 H new ATOM 0 HB1 ALA A 305 1.013 7.120 -4.052 1.00 0.00 H new ATOM 0 HB2 ALA A 305 0.763 8.453 -2.900 1.00 0.00 H new ATOM 0 HB3 ALA A 305 -0.133 6.928 -2.705 1.00 0.00 H new ATOM 920 N VAL A 306 -2.042 6.123 -4.356 1.00 0.00 N ATOM 921 CA VAL A 306 -2.695 4.956 -4.904 1.00 0.00 C ATOM 922 C VAL A 306 -3.902 5.312 -5.763 1.00 0.00 C ATOM 923 O VAL A 306 -4.337 4.514 -6.595 1.00 0.00 O ATOM 924 CB VAL A 306 -3.137 4.038 -3.771 1.00 0.00 C ATOM 925 CG1 VAL A 306 -1.996 3.776 -2.809 1.00 0.00 C ATOM 926 CG2 VAL A 306 -4.315 4.607 -3.036 1.00 0.00 C ATOM 0 H VAL A 306 -2.056 6.158 -3.337 1.00 0.00 H new ATOM 0 HA VAL A 306 -1.972 4.453 -5.545 1.00 0.00 H new ATOM 0 HB VAL A 306 -3.439 3.091 -4.217 1.00 0.00 H new ATOM 0 HG11 VAL A 306 -2.338 3.118 -2.010 1.00 0.00 H new ATOM 0 HG12 VAL A 306 -1.172 3.302 -3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 306 -1.656 4.720 -2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 306 -4.606 3.928 -2.234 1.00 0.00 H new ATOM 0 HG22 VAL A 306 -4.047 5.575 -2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 306 -5.149 4.731 -3.726 1.00 0.00 H new ATOM 936 N LYS A 307 -4.441 6.505 -5.559 1.00 0.00 N ATOM 937 CA LYS A 307 -5.609 6.942 -6.308 1.00 0.00 C ATOM 938 C LYS A 307 -5.278 7.242 -7.756 1.00 0.00 C ATOM 939 O LYS A 307 -5.978 6.820 -8.677 1.00 0.00 O ATOM 940 CB LYS A 307 -6.188 8.173 -5.686 1.00 0.00 C ATOM 941 CG LYS A 307 -7.071 7.815 -4.546 1.00 0.00 C ATOM 942 CD LYS A 307 -8.422 8.456 -4.657 1.00 0.00 C ATOM 943 CE LYS A 307 -9.013 8.478 -3.292 1.00 0.00 C ATOM 944 NZ LYS A 307 -9.975 9.596 -3.093 1.00 0.00 N ATOM 0 H LYS A 307 -4.090 7.185 -4.884 1.00 0.00 H new ATOM 0 HA LYS A 307 -6.329 6.124 -6.280 1.00 0.00 H new ATOM 0 HB2 LYS A 307 -5.385 8.825 -5.341 1.00 0.00 H new ATOM 0 HB3 LYS A 307 -6.755 8.732 -6.431 1.00 0.00 H new ATOM 0 HG2 LYS A 307 -7.186 6.732 -4.503 1.00 0.00 H new ATOM 0 HG3 LYS A 307 -6.600 8.122 -3.612 1.00 0.00 H new ATOM 0 HD2 LYS A 307 -8.336 9.467 -5.055 1.00 0.00 H new ATOM 0 HD3 LYS A 307 -9.058 7.896 -5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 307 -9.521 7.532 -3.107 1.00 0.00 H new ATOM 0 HE3 LYS A 307 -8.213 8.559 -2.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 307 -10.526 9.430 -2.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 307 -9.453 10.491 -3.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 307 -10.619 9.649 -3.908 1.00 0.00 H new ATOM 958 N THR A 308 -4.194 7.979 -7.934 1.00 0.00 N ATOM 959 CA THR A 308 -3.744 8.394 -9.253 1.00 0.00 C ATOM 960 C THR A 308 -2.951 7.312 -9.979 1.00 0.00 C ATOM 961 O THR A 308 -3.189 7.066 -11.161 1.00 0.00 O ATOM 962 CB THR A 308 -2.893 9.675 -9.179 1.00 0.00 C ATOM 963 OG1 THR A 308 -2.210 9.886 -10.420 1.00 0.00 O ATOM 964 CG2 THR A 308 -1.882 9.593 -8.045 1.00 0.00 C ATOM 0 H THR A 308 -3.602 8.306 -7.170 1.00 0.00 H new ATOM 0 HA THR A 308 -4.652 8.588 -9.823 1.00 0.00 H new ATOM 0 HB THR A 308 -3.562 10.514 -8.987 1.00 0.00 H new ATOM 0 HG1 THR A 308 -1.673 10.704 -10.363 1.00 0.00 H new ATOM 0 HG21 THR A 308 -1.294 10.510 -8.015 1.00 0.00 H new ATOM 0 HG22 THR A 308 -2.407 9.467 -7.098 1.00 0.00 H new ATOM 0 HG23 THR A 308 -1.220 8.743 -8.209 1.00 0.00 H new ATOM 972 N TYR A 309 -2.010 6.661 -9.293 1.00 0.00 N ATOM 973 CA TYR A 309 -1.213 5.639 -9.954 1.00 0.00 C ATOM 974 C TYR A 309 -1.833 4.246 -9.805 1.00 0.00 C ATOM 975 O TYR A 309 -2.993 4.111 -9.415 1.00 0.00 O ATOM 976 CB TYR A 309 0.261 5.708 -9.506 1.00 0.00 C ATOM 977 CG TYR A 309 0.688 4.699 -8.470 1.00 0.00 C ATOM 978 CD1 TYR A 309 0.031 4.605 -7.263 1.00 0.00 C ATOM 979 CD2 TYR A 309 1.769 3.858 -8.701 1.00 0.00 C ATOM 980 CE1 TYR A 309 0.430 3.698 -6.303 1.00 0.00 C ATOM 981 CE2 TYR A 309 2.176 2.944 -7.750 1.00 0.00 C ATOM 982 CZ TYR A 309 1.504 2.868 -6.551 1.00 0.00 C ATOM 983 OH TYR A 309 1.906 1.961 -5.599 1.00 0.00 O ATOM 0 H TYR A 309 -1.789 6.819 -8.310 1.00 0.00 H new ATOM 0 HA TYR A 309 -1.217 5.845 -11.024 1.00 0.00 H new ATOM 0 HB2 TYR A 309 0.893 5.585 -10.386 1.00 0.00 H new ATOM 0 HB3 TYR A 309 0.453 6.706 -9.112 1.00 0.00 H new ATOM 0 HD1 TYR A 309 -0.811 5.252 -7.065 1.00 0.00 H new ATOM 0 HD2 TYR A 309 2.300 3.920 -9.640 1.00 0.00 H new ATOM 0 HE1 TYR A 309 -0.096 3.638 -5.362 1.00 0.00 H new ATOM 0 HE2 TYR A 309 3.016 2.293 -7.945 1.00 0.00 H new ATOM 0 HH TYR A 309 1.792 2.351 -4.707 1.00 0.00 H new ATOM 993 N LYS A 310 -1.052 3.222 -10.116 1.00 0.00 N ATOM 994 CA LYS A 310 -1.526 1.838 -10.099 1.00 0.00 C ATOM 995 C LYS A 310 -1.960 1.340 -8.720 1.00 0.00 C ATOM 996 O LYS A 310 -3.119 0.973 -8.525 1.00 0.00 O ATOM 997 CB LYS A 310 -0.443 0.927 -10.654 1.00 0.00 C ATOM 998 CG LYS A 310 -0.018 1.278 -12.052 1.00 0.00 C ATOM 999 CD LYS A 310 -0.786 0.481 -13.082 1.00 0.00 C ATOM 1000 CE LYS A 310 -0.212 0.672 -14.467 1.00 0.00 C ATOM 1001 NZ LYS A 310 1.176 0.145 -14.575 1.00 0.00 N ATOM 0 H LYS A 310 -0.074 3.322 -10.387 1.00 0.00 H new ATOM 0 HA LYS A 310 -2.420 1.813 -10.723 1.00 0.00 H new ATOM 0 HB2 LYS A 310 0.426 0.969 -9.998 1.00 0.00 H new ATOM 0 HB3 LYS A 310 -0.803 -0.102 -10.640 1.00 0.00 H new ATOM 0 HG2 LYS A 310 -0.174 2.343 -12.224 1.00 0.00 H new ATOM 0 HG3 LYS A 310 1.049 1.090 -12.167 1.00 0.00 H new ATOM 0 HD2 LYS A 310 -0.761 -0.576 -12.819 1.00 0.00 H new ATOM 0 HD3 LYS A 310 -1.832 0.787 -13.075 1.00 0.00 H new ATOM 0 HE2 LYS A 310 -0.848 0.169 -15.195 1.00 0.00 H new ATOM 0 HE3 LYS A 310 -0.217 1.733 -14.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 310 1.414 -0.003 -15.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 310 1.840 0.828 -14.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 310 1.245 -0.759 -14.065 1.00 0.00 H new ATOM 1015 N TRP A 311 -1.016 1.314 -7.779 1.00 0.00 N ATOM 1016 CA TRP A 311 -1.256 0.813 -6.420 1.00 0.00 C ATOM 1017 C TRP A 311 -1.298 -0.714 -6.422 1.00 0.00 C ATOM 1018 O TRP A 311 -1.059 -1.333 -5.388 1.00 0.00 O ATOM 1019 CB TRP A 311 -2.544 1.382 -5.777 1.00 0.00 C ATOM 1020 CG TRP A 311 -2.980 0.635 -4.551 1.00 0.00 C ATOM 1021 CD1 TRP A 311 -2.467 0.737 -3.295 1.00 0.00 C ATOM 1022 CD2 TRP A 311 -4.019 -0.334 -4.475 1.00 0.00 C ATOM 1023 NE1 TRP A 311 -3.129 -0.105 -2.441 1.00 0.00 N ATOM 1024 CE2 TRP A 311 -4.088 -0.776 -3.144 1.00 0.00 C ATOM 1025 CE3 TRP A 311 -4.894 -0.864 -5.407 1.00 0.00 C ATOM 1026 CZ2 TRP A 311 -5.005 -1.727 -2.724 1.00 0.00 C ATOM 1027 CZ3 TRP A 311 -5.810 -1.815 -4.996 1.00 0.00 C ATOM 1028 CH2 TRP A 311 -5.860 -2.238 -3.661 1.00 0.00 C ATOM 0 H TRP A 311 -0.062 1.639 -7.935 1.00 0.00 H new ATOM 0 HA TRP A 311 -0.424 1.161 -5.808 1.00 0.00 H new ATOM 0 HB2 TRP A 311 -2.380 2.428 -5.517 1.00 0.00 H new ATOM 0 HB3 TRP A 311 -3.348 1.359 -6.512 1.00 0.00 H new ATOM 0 HD1 TRP A 311 -1.654 1.389 -3.012 1.00 0.00 H new ATOM 0 HE1 TRP A 311 -2.937 -0.213 -1.445 1.00 0.00 H new ATOM 0 HE3 TRP A 311 -4.862 -0.541 -6.437 1.00 0.00 H new ATOM 0 HZ2 TRP A 311 -5.043 -2.052 -1.695 1.00 0.00 H new ATOM 0 HZ3 TRP A 311 -6.497 -2.238 -5.714 1.00 0.00 H new ATOM 0 HH2 TRP A 311 -6.587 -2.981 -3.367 1.00 0.00 H new ATOM 1039 N GLN A 312 -1.577 -1.299 -7.604 1.00 0.00 N ATOM 1040 CA GLN A 312 -1.672 -2.759 -7.780 1.00 0.00 C ATOM 1041 C GLN A 312 -1.791 -3.467 -6.446 1.00 0.00 C ATOM 1042 O GLN A 312 -0.793 -3.667 -5.752 1.00 0.00 O ATOM 1043 CB GLN A 312 -0.471 -3.315 -8.560 1.00 0.00 C ATOM 1044 CG GLN A 312 0.270 -2.266 -9.378 1.00 0.00 C ATOM 1045 CD GLN A 312 1.652 -1.960 -8.830 1.00 0.00 C ATOM 1046 OE1 GLN A 312 1.805 -2.061 -7.515 1.00 0.00 O flip ATOM 1047 NE2 GLN A 312 2.571 -1.630 -9.581 1.00 0.00 N flip ATOM 0 H GLN A 312 -1.742 -0.772 -8.461 1.00 0.00 H new ATOM 0 HA GLN A 312 -2.576 -2.949 -8.359 1.00 0.00 H new ATOM 0 HB2 GLN A 312 0.226 -3.773 -7.858 1.00 0.00 H new ATOM 0 HB3 GLN A 312 -0.817 -4.105 -9.227 1.00 0.00 H new ATOM 0 HG2 GLN A 312 0.361 -2.613 -10.407 1.00 0.00 H new ATOM 0 HG3 GLN A 312 -0.318 -1.348 -9.401 1.00 0.00 H new ATOM 0 HE21 GLN A 312 2.410 -1.565 -10.586 1.00 0.00 H new ATOM 0 HE22 GLN A 312 3.493 -1.422 -9.198 1.00 0.00 H new ATOM 1056 N CYS A 313 -3.018 -3.848 -6.105 1.00 0.00 N ATOM 1057 CA CYS A 313 -3.302 -4.515 -4.843 1.00 0.00 C ATOM 1058 C CYS A 313 -2.165 -5.420 -4.403 1.00 0.00 C ATOM 1059 O CYS A 313 -1.423 -5.968 -5.209 1.00 0.00 O ATOM 1060 CB CYS A 313 -4.605 -5.304 -4.929 1.00 0.00 C ATOM 1061 SG CYS A 313 -4.468 -6.915 -5.764 1.00 0.00 S ATOM 0 H CYS A 313 -3.838 -3.703 -6.694 1.00 0.00 H new ATOM 0 HA CYS A 313 -3.409 -3.735 -4.089 1.00 0.00 H new ATOM 0 HB2 CYS A 313 -4.983 -5.465 -3.919 1.00 0.00 H new ATOM 0 HB3 CYS A 313 -5.345 -4.700 -5.454 1.00 0.00 H new ATOM 0 HG CYS A 313 -3.430 -6.911 -6.547 1.00 0.00 H new ATOM 1066 N ILE A 314 -2.069 -5.558 -3.100 1.00 0.00 N ATOM 1067 CA ILE A 314 -1.045 -6.341 -2.438 1.00 0.00 C ATOM 1068 C ILE A 314 -0.758 -7.685 -3.101 1.00 0.00 C ATOM 1069 O ILE A 314 0.394 -8.080 -3.230 1.00 0.00 O ATOM 1070 CB ILE A 314 -1.488 -6.567 -1.008 1.00 0.00 C ATOM 1071 CG1 ILE A 314 -0.560 -7.527 -0.314 1.00 0.00 C ATOM 1072 CG2 ILE A 314 -2.901 -7.072 -0.962 1.00 0.00 C ATOM 1073 CD1 ILE A 314 0.849 -7.007 -0.208 1.00 0.00 C ATOM 0 H ILE A 314 -2.720 -5.116 -2.451 1.00 0.00 H new ATOM 0 HA ILE A 314 -0.113 -5.779 -2.499 1.00 0.00 H new ATOM 0 HB ILE A 314 -1.451 -5.612 -0.484 1.00 0.00 H new ATOM 0 HG12 ILE A 314 -0.941 -7.735 0.686 1.00 0.00 H new ATOM 0 HG13 ILE A 314 -0.553 -8.473 -0.855 1.00 0.00 H new ATOM 0 HG21 ILE A 314 -3.198 -7.227 0.075 1.00 0.00 H new ATOM 0 HG22 ILE A 314 -3.564 -6.340 -1.424 1.00 0.00 H new ATOM 0 HG23 ILE A 314 -2.968 -8.015 -1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 314 1.471 -7.743 0.302 1.00 0.00 H new ATOM 0 HD12 ILE A 314 1.246 -6.825 -1.207 1.00 0.00 H new ATOM 0 HD13 ILE A 314 0.851 -6.076 0.358 1.00 0.00 H new ATOM 1085 N GLU A 315 -1.794 -8.406 -3.478 1.00 0.00 N ATOM 1086 CA GLU A 315 -1.613 -9.701 -4.118 1.00 0.00 C ATOM 1087 C GLU A 315 -0.717 -9.597 -5.355 1.00 0.00 C ATOM 1088 O GLU A 315 -0.315 -10.612 -5.925 1.00 0.00 O ATOM 1089 CB GLU A 315 -2.962 -10.293 -4.521 1.00 0.00 C ATOM 1090 CG GLU A 315 -3.985 -10.296 -3.398 1.00 0.00 C ATOM 1091 CD GLU A 315 -5.190 -11.161 -3.710 1.00 0.00 C ATOM 1092 OE1 GLU A 315 -6.065 -10.708 -4.478 1.00 0.00 O ATOM 1093 OE2 GLU A 315 -5.257 -12.295 -3.189 1.00 0.00 O ATOM 0 H GLU A 315 -2.766 -8.123 -3.355 1.00 0.00 H new ATOM 0 HA GLU A 315 -1.129 -10.355 -3.393 1.00 0.00 H new ATOM 0 HB2 GLU A 315 -3.361 -9.727 -5.363 1.00 0.00 H new ATOM 0 HB3 GLU A 315 -2.812 -11.316 -4.867 1.00 0.00 H new ATOM 0 HG2 GLU A 315 -3.513 -10.653 -2.483 1.00 0.00 H new ATOM 0 HG3 GLU A 315 -4.315 -9.274 -3.209 1.00 0.00 H new ATOM 1100 N CYS A 316 -0.409 -8.369 -5.761 1.00 0.00 N ATOM 1101 CA CYS A 316 0.414 -8.133 -6.939 1.00 0.00 C ATOM 1102 C CYS A 316 1.317 -6.904 -6.796 1.00 0.00 C ATOM 1103 O CYS A 316 2.058 -6.566 -7.714 1.00 0.00 O ATOM 1104 CB CYS A 316 -0.498 -7.882 -8.116 1.00 0.00 C ATOM 1105 SG CYS A 316 -1.420 -6.330 -7.972 1.00 0.00 S ATOM 0 H CYS A 316 -0.719 -7.520 -5.288 1.00 0.00 H new ATOM 0 HA CYS A 316 1.045 -9.011 -7.073 1.00 0.00 H new ATOM 0 HB2 CYS A 316 0.094 -7.864 -9.031 1.00 0.00 H new ATOM 0 HB3 CYS A 316 -1.201 -8.710 -8.208 1.00 0.00 H new ATOM 0 HG CYS A 316 -1.413 -5.934 -6.734 1.00 0.00 H new ATOM 1110 N LYS A 317 1.225 -6.239 -5.657 1.00 0.00 N ATOM 1111 CA LYS A 317 1.983 -5.007 -5.381 1.00 0.00 C ATOM 1112 C LYS A 317 3.397 -4.979 -5.979 1.00 0.00 C ATOM 1113 O LYS A 317 3.858 -3.940 -6.450 1.00 0.00 O ATOM 1114 CB LYS A 317 2.016 -4.728 -3.868 1.00 0.00 C ATOM 1115 CG LYS A 317 3.060 -5.489 -3.128 1.00 0.00 C ATOM 1116 CD LYS A 317 2.992 -6.938 -3.484 1.00 0.00 C ATOM 1117 CE LYS A 317 3.331 -7.806 -2.315 1.00 0.00 C ATOM 1118 NZ LYS A 317 4.755 -8.232 -2.320 1.00 0.00 N ATOM 0 H LYS A 317 0.623 -6.531 -4.887 1.00 0.00 H new ATOM 0 HA LYS A 317 1.446 -4.207 -5.891 1.00 0.00 H new ATOM 0 HB2 LYS A 317 2.180 -3.662 -3.710 1.00 0.00 H new ATOM 0 HB3 LYS A 317 1.040 -4.967 -3.445 1.00 0.00 H new ATOM 0 HG2 LYS A 317 4.047 -5.094 -3.368 1.00 0.00 H new ATOM 0 HG3 LYS A 317 2.919 -5.364 -2.054 1.00 0.00 H new ATOM 0 HD2 LYS A 317 1.990 -7.180 -3.840 1.00 0.00 H new ATOM 0 HD3 LYS A 317 3.680 -7.145 -4.304 1.00 0.00 H new ATOM 0 HE2 LYS A 317 3.119 -7.267 -1.392 1.00 0.00 H new ATOM 0 HE3 LYS A 317 2.691 -8.688 -2.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 317 4.999 -8.640 -1.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 317 4.901 -8.946 -3.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 317 5.363 -7.409 -2.507 1.00 0.00 H new ATOM 1132 N SER A 318 4.045 -6.123 -5.979 1.00 0.00 N ATOM 1133 CA SER A 318 5.420 -6.287 -6.487 1.00 0.00 C ATOM 1134 C SER A 318 6.377 -5.182 -6.036 1.00 0.00 C ATOM 1135 O SER A 318 5.994 -4.212 -5.383 1.00 0.00 O ATOM 1136 CB SER A 318 5.452 -6.363 -8.010 1.00 0.00 C ATOM 1137 OG SER A 318 4.235 -5.927 -8.586 1.00 0.00 O ATOM 0 H SER A 318 3.639 -6.989 -5.624 1.00 0.00 H new ATOM 0 HA SER A 318 5.763 -7.228 -6.056 1.00 0.00 H new ATOM 0 HB2 SER A 318 6.272 -5.751 -8.387 1.00 0.00 H new ATOM 0 HB3 SER A 318 5.652 -7.389 -8.318 1.00 0.00 H new ATOM 0 HG SER A 318 3.552 -6.620 -8.472 1.00 0.00 H new ATOM 1143 N CYS A 319 7.646 -5.377 -6.386 1.00 0.00 N ATOM 1144 CA CYS A 319 8.707 -4.431 -6.077 1.00 0.00 C ATOM 1145 C CYS A 319 8.819 -3.362 -7.159 1.00 0.00 C ATOM 1146 O CYS A 319 9.345 -3.629 -8.231 1.00 0.00 O ATOM 1147 CB CYS A 319 10.035 -5.177 -6.005 1.00 0.00 C ATOM 1148 SG CYS A 319 11.453 -4.205 -5.365 1.00 0.00 S ATOM 0 H CYS A 319 7.966 -6.201 -6.895 1.00 0.00 H new ATOM 0 HA CYS A 319 8.473 -3.954 -5.125 1.00 0.00 H new ATOM 0 HB2 CYS A 319 9.904 -6.056 -5.373 1.00 0.00 H new ATOM 0 HB3 CYS A 319 10.284 -5.537 -7.003 1.00 0.00 H new ATOM 0 HG CYS A 319 12.560 -4.681 -5.852 1.00 0.00 H new ATOM 1153 N ILE A 320 8.328 -2.155 -6.898 1.00 0.00 N ATOM 1154 CA ILE A 320 8.449 -1.074 -7.879 1.00 0.00 C ATOM 1155 C ILE A 320 9.873 -1.089 -8.424 1.00 0.00 C ATOM 1156 O ILE A 320 10.133 -0.709 -9.566 1.00 0.00 O ATOM 1157 CB ILE A 320 8.147 0.307 -7.245 1.00 0.00 C ATOM 1158 CG1 ILE A 320 9.182 1.360 -7.681 1.00 0.00 C ATOM 1159 CG2 ILE A 320 8.115 0.172 -5.745 1.00 0.00 C ATOM 1160 CD1 ILE A 320 9.110 2.657 -6.920 1.00 0.00 C ATOM 0 H ILE A 320 7.851 -1.900 -6.034 1.00 0.00 H new ATOM 0 HA ILE A 320 7.723 -1.233 -8.677 1.00 0.00 H new ATOM 0 HB ILE A 320 7.173 0.649 -7.594 1.00 0.00 H new ATOM 0 HG12 ILE A 320 10.181 0.940 -7.564 1.00 0.00 H new ATOM 0 HG13 ILE A 320 9.046 1.568 -8.742 1.00 0.00 H new ATOM 0 HG21 ILE A 320 7.903 1.143 -5.297 1.00 0.00 H new ATOM 0 HG22 ILE A 320 7.338 -0.537 -5.460 1.00 0.00 H new ATOM 0 HG23 ILE A 320 9.081 -0.187 -5.391 1.00 0.00 H new ATOM 0 HD11 ILE A 320 9.874 3.340 -7.292 1.00 0.00 H new ATOM 0 HD12 ILE A 320 8.126 3.105 -7.056 1.00 0.00 H new ATOM 0 HD13 ILE A 320 9.278 2.467 -5.860 1.00 0.00 H new ATOM 1172 N LEU A 321 10.782 -1.547 -7.568 1.00 0.00 N ATOM 1173 CA LEU A 321 12.190 -1.653 -7.900 1.00 0.00 C ATOM 1174 C LEU A 321 12.424 -2.842 -8.837 1.00 0.00 C ATOM 1175 O LEU A 321 12.974 -2.682 -9.928 1.00 0.00 O ATOM 1176 CB LEU A 321 12.994 -1.779 -6.598 1.00 0.00 C ATOM 1177 CG LEU A 321 12.596 -0.793 -5.474 1.00 0.00 C ATOM 1178 CD1 LEU A 321 13.774 -0.463 -4.588 1.00 0.00 C ATOM 1179 CD2 LEU A 321 12.009 0.497 -5.999 1.00 0.00 C ATOM 0 H LEU A 321 10.557 -1.855 -6.622 1.00 0.00 H new ATOM 0 HA LEU A 321 12.525 -0.760 -8.429 1.00 0.00 H new ATOM 0 HB2 LEU A 321 12.886 -2.796 -6.221 1.00 0.00 H new ATOM 0 HB3 LEU A 321 14.050 -1.635 -6.827 1.00 0.00 H new ATOM 0 HG LEU A 321 11.828 -1.308 -4.897 1.00 0.00 H new ATOM 0 HD11 LEU A 321 13.460 0.232 -3.809 1.00 0.00 H new ATOM 0 HD12 LEU A 321 14.151 -1.377 -4.129 1.00 0.00 H new ATOM 0 HD13 LEU A 321 14.562 -0.006 -5.186 1.00 0.00 H new ATOM 0 HD21 LEU A 321 11.750 1.146 -5.162 1.00 0.00 H new ATOM 0 HD22 LEU A 321 12.740 0.998 -6.634 1.00 0.00 H new ATOM 0 HD23 LEU A 321 11.113 0.279 -6.580 1.00 0.00 H new ATOM 1191 N CYS A 322 12.006 -4.030 -8.405 1.00 0.00 N ATOM 1192 CA CYS A 322 12.128 -5.235 -9.228 1.00 0.00 C ATOM 1193 C CYS A 322 10.891 -5.413 -10.089 1.00 0.00 C ATOM 1194 O CYS A 322 10.954 -5.404 -11.318 1.00 0.00 O ATOM 1195 CB CYS A 322 12.258 -6.499 -8.379 1.00 0.00 C ATOM 1196 SG CYS A 322 13.729 -6.593 -7.329 1.00 0.00 S ATOM 0 H CYS A 322 11.580 -4.186 -7.491 1.00 0.00 H new ATOM 0 HA CYS A 322 13.024 -5.101 -9.834 1.00 0.00 H new ATOM 0 HB2 CYS A 322 11.376 -6.580 -7.744 1.00 0.00 H new ATOM 0 HB3 CYS A 322 12.253 -7.363 -9.044 1.00 0.00 H new ATOM 0 HG CYS A 322 13.716 -7.709 -6.663 1.00 0.00 H new ATOM 1201 N GLY A 323 9.764 -5.572 -9.407 1.00 0.00 N ATOM 1202 CA GLY A 323 8.506 -5.799 -10.071 1.00 0.00 C ATOM 1203 C GLY A 323 8.267 -7.279 -10.212 1.00 0.00 C ATOM 1204 O GLY A 323 7.660 -7.732 -11.182 1.00 0.00 O ATOM 0 H GLY A 323 9.705 -5.546 -8.389 1.00 0.00 H new ATOM 0 HA2 GLY A 323 7.696 -5.342 -9.502 1.00 0.00 H new ATOM 0 HA3 GLY A 323 8.512 -5.326 -11.053 1.00 0.00 H new ATOM 1208 N THR A 324 8.755 -8.039 -9.229 1.00 0.00 N ATOM 1209 CA THR A 324 8.639 -9.484 -9.266 1.00 0.00 C ATOM 1210 C THR A 324 8.060 -10.058 -7.982 1.00 0.00 C ATOM 1211 O THR A 324 7.664 -11.223 -7.936 1.00 0.00 O ATOM 1212 CB THR A 324 10.018 -10.090 -9.496 1.00 0.00 C ATOM 1213 OG1 THR A 324 9.926 -11.507 -9.650 1.00 0.00 O ATOM 1214 CG2 THR A 324 10.953 -9.724 -8.360 1.00 0.00 C ATOM 0 H THR A 324 9.231 -7.672 -8.405 1.00 0.00 H new ATOM 0 HA THR A 324 7.956 -9.734 -10.078 1.00 0.00 H new ATOM 0 HB THR A 324 10.429 -9.679 -10.418 1.00 0.00 H new ATOM 0 HG1 THR A 324 10.729 -11.840 -10.103 1.00 0.00 H new ATOM 0 HG21 THR A 324 11.934 -10.165 -8.540 1.00 0.00 H new ATOM 0 HG22 THR A 324 11.048 -8.640 -8.302 1.00 0.00 H new ATOM 0 HG23 THR A 324 10.551 -10.104 -7.421 1.00 0.00 H new ATOM 1222 N SER A 325 8.030 -9.234 -6.942 1.00 0.00 N ATOM 1223 CA SER A 325 7.522 -9.639 -5.637 1.00 0.00 C ATOM 1224 C SER A 325 8.193 -10.926 -5.149 1.00 0.00 C ATOM 1225 O SER A 325 7.707 -11.568 -4.218 1.00 0.00 O ATOM 1226 CB SER A 325 5.996 -9.818 -5.658 1.00 0.00 C ATOM 1227 OG SER A 325 5.577 -10.604 -6.759 1.00 0.00 O ATOM 0 H SER A 325 8.356 -8.268 -6.979 1.00 0.00 H new ATOM 0 HA SER A 325 7.766 -8.837 -4.940 1.00 0.00 H new ATOM 0 HB2 SER A 325 5.672 -10.289 -4.730 1.00 0.00 H new ATOM 0 HB3 SER A 325 5.515 -8.841 -5.704 1.00 0.00 H new ATOM 0 HG SER A 325 6.262 -11.275 -6.962 1.00 0.00 H new ATOM 1233 N GLU A 326 9.310 -11.299 -5.782 1.00 0.00 N ATOM 1234 CA GLU A 326 10.047 -12.510 -5.404 1.00 0.00 C ATOM 1235 C GLU A 326 10.292 -12.593 -3.900 1.00 0.00 C ATOM 1236 O GLU A 326 9.545 -13.247 -3.172 1.00 0.00 O ATOM 1237 CB GLU A 326 11.387 -12.564 -6.130 1.00 0.00 C ATOM 1238 CG GLU A 326 11.272 -12.907 -7.590 1.00 0.00 C ATOM 1239 CD GLU A 326 11.133 -14.396 -7.837 1.00 0.00 C ATOM 1240 OE1 GLU A 326 12.168 -15.095 -7.846 1.00 0.00 O ATOM 1241 OE2 GLU A 326 9.990 -14.863 -8.024 1.00 0.00 O ATOM 0 H GLU A 326 9.723 -10.781 -6.557 1.00 0.00 H new ATOM 0 HA GLU A 326 9.428 -13.359 -5.694 1.00 0.00 H new ATOM 0 HB2 GLU A 326 11.883 -11.598 -6.031 1.00 0.00 H new ATOM 0 HB3 GLU A 326 12.025 -13.301 -5.642 1.00 0.00 H new ATOM 0 HG2 GLU A 326 10.409 -12.392 -8.012 1.00 0.00 H new ATOM 0 HG3 GLU A 326 12.153 -12.537 -8.115 1.00 0.00 H new ATOM 1248 N ASN A 327 11.352 -11.928 -3.445 1.00 0.00 N ATOM 1249 CA ASN A 327 11.723 -11.933 -2.034 1.00 0.00 C ATOM 1250 C ASN A 327 10.834 -11.017 -1.209 1.00 0.00 C ATOM 1251 O ASN A 327 11.314 -10.375 -0.291 1.00 0.00 O ATOM 1252 CB ASN A 327 13.179 -11.514 -1.873 1.00 0.00 C ATOM 1253 CG ASN A 327 14.098 -12.214 -2.843 1.00 0.00 C ATOM 1254 OD1 ASN A 327 14.345 -11.569 -3.974 1.00 0.00 O flip ATOM 1255 ND2 ASN A 327 14.584 -13.315 -2.581 1.00 0.00 N flip ATOM 0 H ASN A 327 11.972 -11.376 -4.038 1.00 0.00 H new ATOM 0 HA ASN A 327 11.589 -12.950 -1.666 1.00 0.00 H new ATOM 0 HB2 ASN A 327 13.260 -10.436 -2.015 1.00 0.00 H new ATOM 0 HB3 ASN A 327 13.503 -11.726 -0.854 1.00 0.00 H new ATOM 0 HD21 ASN A 327 14.364 -13.772 -1.696 1.00 0.00 H new ATOM 0 HD22 ASN A 327 15.207 -13.770 -3.249 1.00 0.00 H new ATOM 1262 N ASP A 328 9.546 -10.954 -1.546 1.00 0.00 N ATOM 1263 CA ASP A 328 8.588 -10.120 -0.837 1.00 0.00 C ATOM 1264 C ASP A 328 8.799 -10.092 0.669 1.00 0.00 C ATOM 1265 O ASP A 328 8.350 -9.164 1.343 1.00 0.00 O ATOM 1266 CB ASP A 328 7.172 -10.549 -1.155 1.00 0.00 C ATOM 1267 CG ASP A 328 6.632 -11.561 -0.161 1.00 0.00 C ATOM 1268 OD1 ASP A 328 6.188 -11.146 0.930 1.00 0.00 O ATOM 1269 OD2 ASP A 328 6.650 -12.769 -0.477 1.00 0.00 O ATOM 0 H ASP A 328 9.142 -11.482 -2.319 1.00 0.00 H new ATOM 0 HA ASP A 328 8.756 -9.103 -1.192 1.00 0.00 H new ATOM 0 HB2 ASP A 328 6.524 -9.673 -1.164 1.00 0.00 H new ATOM 0 HB3 ASP A 328 7.142 -10.978 -2.157 1.00 0.00 H new ATOM 1274 N ASP A 329 9.473 -11.096 1.202 1.00 0.00 N ATOM 1275 CA ASP A 329 9.737 -11.134 2.632 1.00 0.00 C ATOM 1276 C ASP A 329 10.606 -9.940 3.009 1.00 0.00 C ATOM 1277 O ASP A 329 10.814 -9.647 4.186 1.00 0.00 O ATOM 1278 CB ASP A 329 10.418 -12.441 3.036 1.00 0.00 C ATOM 1279 CG ASP A 329 10.541 -12.579 4.543 1.00 0.00 C ATOM 1280 OD1 ASP A 329 9.541 -12.313 5.248 1.00 0.00 O ATOM 1281 OD2 ASP A 329 11.636 -12.944 5.019 1.00 0.00 O ATOM 0 H ASP A 329 9.844 -11.887 0.675 1.00 0.00 H new ATOM 0 HA ASP A 329 8.789 -11.082 3.168 1.00 0.00 H new ATOM 0 HB2 ASP A 329 9.850 -13.283 2.641 1.00 0.00 H new ATOM 0 HB3 ASP A 329 11.410 -12.487 2.586 1.00 0.00 H new ATOM 1286 N GLN A 330 11.108 -9.259 1.979 1.00 0.00 N ATOM 1287 CA GLN A 330 11.932 -8.087 2.148 1.00 0.00 C ATOM 1288 C GLN A 330 11.218 -6.886 1.559 1.00 0.00 C ATOM 1289 O GLN A 330 11.551 -5.745 1.845 1.00 0.00 O ATOM 1290 CB GLN A 330 13.273 -8.277 1.454 1.00 0.00 C ATOM 1291 CG GLN A 330 13.696 -9.729 1.359 1.00 0.00 C ATOM 1292 CD GLN A 330 15.172 -9.897 1.120 1.00 0.00 C ATOM 1293 OE1 GLN A 330 15.956 -9.005 1.699 1.00 0.00 O flip ATOM 1294 NE2 GLN A 330 15.605 -10.823 0.434 1.00 0.00 N flip ATOM 0 H GLN A 330 10.947 -9.515 1.005 1.00 0.00 H new ATOM 0 HA GLN A 330 12.110 -7.926 3.211 1.00 0.00 H new ATOM 0 HB2 GLN A 330 13.218 -7.855 0.451 1.00 0.00 H new ATOM 0 HB3 GLN A 330 14.037 -7.717 1.994 1.00 0.00 H new ATOM 0 HG2 GLN A 330 13.422 -10.243 2.281 1.00 0.00 H new ATOM 0 HG3 GLN A 330 13.146 -10.210 0.550 1.00 0.00 H new ATOM 0 HE21 GLN A 330 14.959 -11.487 0.007 1.00 0.00 H new ATOM 0 HE22 GLN A 330 16.610 -10.926 0.292 1.00 0.00 H new ATOM 1303 N LEU A 331 10.219 -7.150 0.734 1.00 0.00 N ATOM 1304 CA LEU A 331 9.476 -6.096 0.111 1.00 0.00 C ATOM 1305 C LEU A 331 8.916 -5.162 1.146 1.00 0.00 C ATOM 1306 O LEU A 331 8.404 -5.577 2.185 1.00 0.00 O ATOM 1307 CB LEU A 331 8.389 -6.673 -0.766 1.00 0.00 C ATOM 1308 CG LEU A 331 8.902 -7.159 -2.114 1.00 0.00 C ATOM 1309 CD1 LEU A 331 7.774 -7.670 -2.955 1.00 0.00 C ATOM 1310 CD2 LEU A 331 9.621 -6.058 -2.838 1.00 0.00 C ATOM 0 H LEU A 331 9.912 -8.091 0.487 1.00 0.00 H new ATOM 0 HA LEU A 331 10.146 -5.516 -0.524 1.00 0.00 H new ATOM 0 HB2 LEU A 331 7.913 -7.503 -0.245 1.00 0.00 H new ATOM 0 HB3 LEU A 331 7.621 -5.916 -0.928 1.00 0.00 H new ATOM 0 HG LEU A 331 9.603 -7.974 -1.932 1.00 0.00 H new ATOM 0 HD11 LEU A 331 8.162 -8.013 -3.914 1.00 0.00 H new ATOM 0 HD12 LEU A 331 7.286 -8.500 -2.444 1.00 0.00 H new ATOM 0 HD13 LEU A 331 7.052 -6.870 -3.120 1.00 0.00 H new ATOM 0 HD21 LEU A 331 9.979 -6.428 -3.799 1.00 0.00 H new ATOM 0 HD22 LEU A 331 8.939 -5.224 -3.002 1.00 0.00 H new ATOM 0 HD23 LEU A 331 10.468 -5.722 -2.240 1.00 0.00 H new ATOM 1322 N LEU A 332 9.038 -3.898 0.843 1.00 0.00 N ATOM 1323 CA LEU A 332 8.591 -2.856 1.725 1.00 0.00 C ATOM 1324 C LEU A 332 7.416 -2.155 1.122 1.00 0.00 C ATOM 1325 O LEU A 332 7.519 -1.509 0.089 1.00 0.00 O ATOM 1326 CB LEU A 332 9.700 -1.850 1.979 1.00 0.00 C ATOM 1327 CG LEU A 332 10.902 -2.328 2.749 1.00 0.00 C ATOM 1328 CD1 LEU A 332 11.966 -1.275 2.734 1.00 0.00 C ATOM 1329 CD2 LEU A 332 10.548 -2.622 4.169 1.00 0.00 C ATOM 0 H LEU A 332 9.452 -3.561 -0.026 1.00 0.00 H new ATOM 0 HA LEU A 332 8.306 -3.309 2.674 1.00 0.00 H new ATOM 0 HB2 LEU A 332 10.044 -1.476 1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 332 9.271 -1.003 2.515 1.00 0.00 H new ATOM 0 HG LEU A 332 11.262 -3.240 2.273 1.00 0.00 H new ATOM 0 HD11 LEU A 332 12.833 -1.626 3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 332 12.257 -1.067 1.705 1.00 0.00 H new ATOM 0 HD13 LEU A 332 11.583 -0.364 3.194 1.00 0.00 H new ATOM 0 HD21 LEU A 332 11.435 -2.965 4.702 1.00 0.00 H new ATOM 0 HD22 LEU A 332 10.167 -1.718 4.644 1.00 0.00 H new ATOM 0 HD23 LEU A 332 9.783 -3.398 4.200 1.00 0.00 H new ATOM 1341 N PHE A 333 6.319 -2.252 1.807 1.00 0.00 N ATOM 1342 CA PHE A 333 5.090 -1.681 1.345 1.00 0.00 C ATOM 1343 C PHE A 333 4.924 -0.273 1.863 1.00 0.00 C ATOM 1344 O PHE A 333 4.445 -0.070 2.979 1.00 0.00 O ATOM 1345 CB PHE A 333 3.960 -2.583 1.825 1.00 0.00 C ATOM 1346 CG PHE A 333 4.342 -4.040 1.729 1.00 0.00 C ATOM 1347 CD1 PHE A 333 5.093 -4.643 2.728 1.00 0.00 C ATOM 1348 CD2 PHE A 333 3.992 -4.791 0.623 1.00 0.00 C ATOM 1349 CE1 PHE A 333 5.484 -5.963 2.623 1.00 0.00 C ATOM 1350 CE2 PHE A 333 4.386 -6.115 0.502 1.00 0.00 C ATOM 1351 CZ PHE A 333 5.139 -6.701 1.509 1.00 0.00 C ATOM 0 H PHE A 333 6.249 -2.731 2.705 1.00 0.00 H new ATOM 0 HA PHE A 333 5.083 -1.617 0.257 1.00 0.00 H new ATOM 0 HB2 PHE A 333 3.710 -2.338 2.857 1.00 0.00 H new ATOM 0 HB3 PHE A 333 3.067 -2.399 1.228 1.00 0.00 H new ATOM 0 HD1 PHE A 333 5.376 -4.072 3.600 1.00 0.00 H new ATOM 0 HD2 PHE A 333 3.402 -4.339 -0.160 1.00 0.00 H new ATOM 0 HE1 PHE A 333 6.061 -6.419 3.414 1.00 0.00 H new ATOM 0 HE2 PHE A 333 4.108 -6.687 -0.371 1.00 0.00 H new ATOM 0 HZ PHE A 333 5.454 -7.730 1.422 1.00 0.00 H new ATOM 1361 N CYS A 334 5.327 0.710 1.058 1.00 0.00 N ATOM 1362 CA CYS A 334 5.153 2.086 1.472 1.00 0.00 C ATOM 1363 C CYS A 334 3.688 2.284 1.725 1.00 0.00 C ATOM 1364 O CYS A 334 2.901 2.268 0.794 1.00 0.00 O ATOM 1365 CB CYS A 334 5.595 3.108 0.417 1.00 0.00 C ATOM 1366 SG CYS A 334 4.657 4.668 0.574 1.00 0.00 S ATOM 0 H CYS A 334 5.762 0.579 0.145 1.00 0.00 H new ATOM 0 HA CYS A 334 5.774 2.253 2.352 1.00 0.00 H new ATOM 0 HB2 CYS A 334 6.661 3.309 0.526 1.00 0.00 H new ATOM 0 HB3 CYS A 334 5.449 2.692 -0.580 1.00 0.00 H new ATOM 0 HG CYS A 334 5.468 5.676 0.447 1.00 0.00 H new ATOM 1371 N ASP A 335 3.288 2.445 2.961 1.00 0.00 N ATOM 1372 CA ASP A 335 1.872 2.631 3.201 1.00 0.00 C ATOM 1373 C ASP A 335 1.482 4.085 2.938 1.00 0.00 C ATOM 1374 O ASP A 335 0.619 4.650 3.610 1.00 0.00 O ATOM 1375 CB ASP A 335 1.459 2.201 4.597 1.00 0.00 C ATOM 1376 CG ASP A 335 1.783 3.238 5.657 1.00 0.00 C ATOM 1377 OD1 ASP A 335 2.980 3.542 5.843 1.00 0.00 O ATOM 1378 OD2 ASP A 335 0.841 3.744 6.300 1.00 0.00 O ATOM 0 H ASP A 335 3.888 2.452 3.786 1.00 0.00 H new ATOM 0 HA ASP A 335 1.334 1.986 2.506 1.00 0.00 H new ATOM 0 HB2 ASP A 335 0.388 2.001 4.608 1.00 0.00 H new ATOM 0 HB3 ASP A 335 1.960 1.266 4.846 1.00 0.00 H new ATOM 1383 N ASP A 336 2.145 4.676 1.952 1.00 0.00 N ATOM 1384 CA ASP A 336 1.902 6.049 1.538 1.00 0.00 C ATOM 1385 C ASP A 336 1.736 6.099 0.016 1.00 0.00 C ATOM 1386 O ASP A 336 1.569 7.170 -0.570 1.00 0.00 O ATOM 1387 CB ASP A 336 3.049 6.940 1.996 1.00 0.00 C ATOM 1388 CG ASP A 336 2.662 8.399 2.074 1.00 0.00 C ATOM 1389 OD1 ASP A 336 2.616 9.055 1.014 1.00 0.00 O ATOM 1390 OD2 ASP A 336 2.411 8.888 3.196 1.00 0.00 O ATOM 0 H ASP A 336 2.874 4.209 1.413 1.00 0.00 H new ATOM 0 HA ASP A 336 0.985 6.417 1.999 1.00 0.00 H new ATOM 0 HB2 ASP A 336 3.393 6.607 2.975 1.00 0.00 H new ATOM 0 HB3 ASP A 336 3.887 6.827 1.309 1.00 0.00 H new ATOM 1395 N CYS A 337 1.796 4.917 -0.611 1.00 0.00 N ATOM 1396 CA CYS A 337 1.594 4.757 -2.047 1.00 0.00 C ATOM 1397 C CYS A 337 1.383 3.288 -2.359 1.00 0.00 C ATOM 1398 O CYS A 337 0.808 2.936 -3.385 1.00 0.00 O ATOM 1399 CB CYS A 337 2.762 5.203 -2.924 1.00 0.00 C ATOM 1400 SG CYS A 337 3.642 6.729 -2.479 1.00 0.00 S ATOM 0 H CYS A 337 1.988 4.040 -0.127 1.00 0.00 H new ATOM 0 HA CYS A 337 0.738 5.392 -2.276 1.00 0.00 H new ATOM 0 HB2 CYS A 337 3.491 4.393 -2.944 1.00 0.00 H new ATOM 0 HB3 CYS A 337 2.388 5.320 -3.941 1.00 0.00 H new ATOM 0 HG CYS A 337 2.887 7.457 -1.711 1.00 0.00 H new ATOM 1405 N ASP A 338 1.919 2.451 -1.471 1.00 0.00 N ATOM 1406 CA ASP A 338 1.848 0.995 -1.582 1.00 0.00 C ATOM 1407 C ASP A 338 3.041 0.459 -2.375 1.00 0.00 C ATOM 1408 O ASP A 338 3.201 -0.751 -2.538 1.00 0.00 O ATOM 1409 CB ASP A 338 0.531 0.565 -2.217 1.00 0.00 C ATOM 1410 CG ASP A 338 0.235 -0.910 -2.044 1.00 0.00 C ATOM 1411 OD1 ASP A 338 0.845 -1.731 -2.762 1.00 0.00 O ATOM 1412 OD2 ASP A 338 -0.618 -1.244 -1.194 1.00 0.00 O ATOM 0 H ASP A 338 2.422 2.770 -0.643 1.00 0.00 H new ATOM 0 HA ASP A 338 1.890 0.571 -0.579 1.00 0.00 H new ATOM 0 HB2 ASP A 338 -0.282 1.145 -1.780 1.00 0.00 H new ATOM 0 HB3 ASP A 338 0.555 0.801 -3.281 1.00 0.00 H new ATOM 1417 N ARG A 339 3.876 1.376 -2.863 1.00 0.00 N ATOM 1418 CA ARG A 339 5.073 1.016 -3.619 1.00 0.00 C ATOM 1419 C ARG A 339 5.937 0.039 -2.826 1.00 0.00 C ATOM 1420 O ARG A 339 6.427 0.372 -1.747 1.00 0.00 O ATOM 1421 CB ARG A 339 5.871 2.276 -3.940 1.00 0.00 C ATOM 1422 CG ARG A 339 5.194 3.166 -4.962 1.00 0.00 C ATOM 1423 CD ARG A 339 5.935 3.152 -6.288 1.00 0.00 C ATOM 1424 NE ARG A 339 5.181 3.832 -7.338 1.00 0.00 N ATOM 1425 CZ ARG A 339 5.551 3.863 -8.615 1.00 0.00 C ATOM 1426 NH1 ARG A 339 6.651 3.233 -9.008 1.00 0.00 N ATOM 1427 NH2 ARG A 339 4.817 4.521 -9.503 1.00 0.00 N ATOM 0 H ARG A 339 3.743 2.381 -2.746 1.00 0.00 H new ATOM 0 HA ARG A 339 4.770 0.531 -4.547 1.00 0.00 H new ATOM 0 HB2 ARG A 339 6.029 2.842 -3.022 1.00 0.00 H new ATOM 0 HB3 ARG A 339 6.855 1.990 -4.311 1.00 0.00 H new ATOM 0 HG2 ARG A 339 4.167 2.832 -5.114 1.00 0.00 H new ATOM 0 HG3 ARG A 339 5.145 4.186 -4.582 1.00 0.00 H new ATOM 0 HD2 ARG A 339 6.905 3.634 -6.167 1.00 0.00 H new ATOM 0 HD3 ARG A 339 6.126 2.121 -6.587 1.00 0.00 H new ATOM 0 HE ARG A 339 4.320 4.312 -7.076 1.00 0.00 H new ATOM 0 HH11 ARG A 339 7.216 2.722 -8.330 1.00 0.00 H new ATOM 0 HH12 ARG A 339 6.931 3.259 -9.988 1.00 0.00 H new ATOM 0 HH21 ARG A 339 3.969 5.003 -9.206 1.00 0.00 H new ATOM 0 HH22 ARG A 339 5.101 4.545 -10.482 1.00 0.00 H new ATOM 1441 N GLY A 340 6.122 -1.167 -3.359 1.00 0.00 N ATOM 1442 CA GLY A 340 6.917 -2.160 -2.659 1.00 0.00 C ATOM 1443 C GLY A 340 8.363 -2.209 -3.113 1.00 0.00 C ATOM 1444 O GLY A 340 8.648 -2.228 -4.301 1.00 0.00 O ATOM 0 H GLY A 340 5.739 -1.471 -4.254 1.00 0.00 H new ATOM 0 HA2 GLY A 340 6.887 -1.949 -1.590 1.00 0.00 H new ATOM 0 HA3 GLY A 340 6.466 -3.142 -2.803 1.00 0.00 H new ATOM 1448 N TYR A 341 9.279 -2.191 -2.155 1.00 0.00 N ATOM 1449 CA TYR A 341 10.709 -2.277 -2.444 1.00 0.00 C ATOM 1450 C TYR A 341 11.340 -3.289 -1.510 1.00 0.00 C ATOM 1451 O TYR A 341 11.216 -3.150 -0.301 1.00 0.00 O ATOM 1452 CB TYR A 341 11.504 -1.005 -2.138 1.00 0.00 C ATOM 1453 CG TYR A 341 11.076 0.342 -2.678 1.00 0.00 C ATOM 1454 CD1 TYR A 341 9.819 0.597 -3.165 1.00 0.00 C ATOM 1455 CD2 TYR A 341 11.964 1.411 -2.577 1.00 0.00 C ATOM 1456 CE1 TYR A 341 9.453 1.871 -3.545 1.00 0.00 C ATOM 1457 CE2 TYR A 341 11.608 2.677 -2.970 1.00 0.00 C ATOM 1458 CZ TYR A 341 10.345 2.900 -3.450 1.00 0.00 C ATOM 1459 OH TYR A 341 9.959 4.161 -3.823 1.00 0.00 O ATOM 0 H TYR A 341 9.058 -2.117 -1.162 1.00 0.00 H new ATOM 0 HA TYR A 341 10.754 -2.510 -3.508 1.00 0.00 H new ATOM 0 HB2 TYR A 341 11.548 -0.912 -1.053 1.00 0.00 H new ATOM 0 HB3 TYR A 341 12.523 -1.177 -2.485 1.00 0.00 H new ATOM 0 HD1 TYR A 341 9.107 -0.210 -3.252 1.00 0.00 H new ATOM 0 HD2 TYR A 341 12.954 1.240 -2.181 1.00 0.00 H new ATOM 0 HE1 TYR A 341 8.457 2.055 -3.919 1.00 0.00 H new ATOM 0 HE2 TYR A 341 12.317 3.489 -2.901 1.00 0.00 H new ATOM 0 HH TYR A 341 9.260 4.100 -4.507 1.00 0.00 H new ATOM 1469 N HIS A 342 12.084 -4.239 -2.022 1.00 0.00 N ATOM 1470 CA HIS A 342 12.725 -5.180 -1.121 1.00 0.00 C ATOM 1471 C HIS A 342 13.711 -4.344 -0.317 1.00 0.00 C ATOM 1472 O HIS A 342 14.566 -3.746 -0.922 1.00 0.00 O ATOM 1473 CB HIS A 342 13.482 -6.289 -1.873 1.00 0.00 C ATOM 1474 CG HIS A 342 12.642 -7.258 -2.667 1.00 0.00 C ATOM 1475 ND1 HIS A 342 11.927 -8.328 -2.273 1.00 0.00 N flip ATOM 1476 CD2 HIS A 342 12.470 -7.183 -4.035 1.00 0.00 C flip ATOM 1477 CE1 HIS A 342 11.341 -8.873 -3.396 1.00 0.00 C flip ATOM 1478 NE2 HIS A 342 11.682 -8.154 -4.449 1.00 0.00 N flip ATOM 0 H HIS A 342 12.260 -4.384 -3.016 1.00 0.00 H new ATOM 0 HA HIS A 342 11.983 -5.686 -0.504 1.00 0.00 H new ATOM 0 HB2 HIS A 342 14.192 -5.817 -2.552 1.00 0.00 H new ATOM 0 HB3 HIS A 342 14.064 -6.857 -1.147 1.00 0.00 H new ATOM 0 HD1 HIS A 342 11.835 -8.673 -1.318 1.00 0.00 H new ATOM 0 HD2 HIS A 342 12.917 -6.436 -4.674 1.00 0.00 H new ATOM 0 HE1 HIS A 342 10.706 -9.746 -3.411 1.00 0.00 H new ATOM 1486 N MET A 343 13.557 -4.232 1.011 1.00 0.00 N ATOM 1487 CA MET A 343 14.464 -3.389 1.828 1.00 0.00 C ATOM 1488 C MET A 343 15.859 -3.279 1.252 1.00 0.00 C ATOM 1489 O MET A 343 16.539 -2.276 1.455 1.00 0.00 O ATOM 1490 CB MET A 343 14.608 -3.871 3.277 1.00 0.00 C ATOM 1491 CG MET A 343 13.326 -4.096 4.019 1.00 0.00 C ATOM 1492 SD MET A 343 12.810 -5.818 4.152 1.00 0.00 S ATOM 1493 CE MET A 343 14.358 -6.646 4.482 1.00 0.00 C ATOM 0 H MET A 343 12.826 -4.704 1.543 1.00 0.00 H new ATOM 0 HA MET A 343 13.977 -2.414 1.812 1.00 0.00 H new ATOM 0 HB2 MET A 343 15.174 -4.803 3.276 1.00 0.00 H new ATOM 0 HB3 MET A 343 15.200 -3.139 3.826 1.00 0.00 H new ATOM 0 HG2 MET A 343 13.429 -3.685 5.023 1.00 0.00 H new ATOM 0 HG3 MET A 343 12.535 -3.533 3.524 1.00 0.00 H new ATOM 0 HE1 MET A 343 14.178 -7.515 5.115 1.00 0.00 H new ATOM 0 HE2 MET A 343 14.806 -6.969 3.542 1.00 0.00 H new ATOM 0 HE3 MET A 343 15.036 -5.961 4.990 1.00 0.00 H new ATOM 1503 N TYR A 344 16.296 -4.300 0.555 1.00 0.00 N ATOM 1504 CA TYR A 344 17.623 -4.261 -0.029 1.00 0.00 C ATOM 1505 C TYR A 344 17.543 -3.860 -1.494 1.00 0.00 C ATOM 1506 O TYR A 344 18.391 -4.244 -2.301 1.00 0.00 O ATOM 1507 CB TYR A 344 18.350 -5.599 0.140 1.00 0.00 C ATOM 1508 CG TYR A 344 17.799 -6.716 -0.713 1.00 0.00 C ATOM 1509 CD1 TYR A 344 16.500 -7.165 -0.548 1.00 0.00 C ATOM 1510 CD2 TYR A 344 18.589 -7.327 -1.680 1.00 0.00 C ATOM 1511 CE1 TYR A 344 16.001 -8.190 -1.319 1.00 0.00 C ATOM 1512 CE2 TYR A 344 18.095 -8.354 -2.458 1.00 0.00 C ATOM 1513 CZ TYR A 344 16.799 -8.783 -2.274 1.00 0.00 C ATOM 1514 OH TYR A 344 16.300 -9.806 -3.046 1.00 0.00 O ATOM 0 H TYR A 344 15.768 -5.154 0.378 1.00 0.00 H new ATOM 0 HA TYR A 344 18.206 -3.509 0.503 1.00 0.00 H new ATOM 0 HB2 TYR A 344 19.404 -5.460 -0.100 1.00 0.00 H new ATOM 0 HB3 TYR A 344 18.299 -5.898 1.187 1.00 0.00 H new ATOM 0 HD1 TYR A 344 15.869 -6.704 0.197 1.00 0.00 H new ATOM 0 HD2 TYR A 344 19.606 -6.993 -1.825 1.00 0.00 H new ATOM 0 HE1 TYR A 344 14.986 -8.529 -1.176 1.00 0.00 H new ATOM 0 HE2 TYR A 344 18.720 -8.818 -3.206 1.00 0.00 H new ATOM 0 HH TYR A 344 15.323 -9.824 -2.974 1.00 0.00 H new ATOM 1524 N CYS A 345 16.519 -3.075 -1.835 1.00 0.00 N ATOM 1525 CA CYS A 345 16.345 -2.617 -3.197 1.00 0.00 C ATOM 1526 C CYS A 345 16.347 -1.117 -3.212 1.00 0.00 C ATOM 1527 O CYS A 345 16.694 -0.477 -4.207 1.00 0.00 O ATOM 1528 CB CYS A 345 15.041 -3.150 -3.800 1.00 0.00 C ATOM 1529 SG CYS A 345 15.177 -4.878 -4.297 1.00 0.00 S ATOM 0 H CYS A 345 15.805 -2.749 -1.183 1.00 0.00 H new ATOM 0 HA CYS A 345 17.168 -2.996 -3.803 1.00 0.00 H new ATOM 0 HB2 CYS A 345 14.237 -3.045 -3.072 1.00 0.00 H new ATOM 0 HB3 CYS A 345 14.769 -2.545 -4.665 1.00 0.00 H new ATOM 0 HG CYS A 345 14.511 -5.067 -5.398 1.00 0.00 H new ATOM 1534 N LEU A 346 15.959 -0.573 -2.078 1.00 0.00 N ATOM 1535 CA LEU A 346 15.863 0.859 -1.905 1.00 0.00 C ATOM 1536 C LEU A 346 17.178 1.560 -2.230 1.00 0.00 C ATOM 1537 O LEU A 346 18.179 0.921 -2.554 1.00 0.00 O ATOM 1538 CB LEU A 346 15.443 1.192 -0.468 1.00 0.00 C ATOM 1539 CG LEU A 346 15.001 -0.007 0.366 1.00 0.00 C ATOM 1540 CD1 LEU A 346 14.627 0.391 1.763 1.00 0.00 C ATOM 1541 CD2 LEU A 346 13.829 -0.699 -0.270 1.00 0.00 C ATOM 0 H LEU A 346 15.702 -1.112 -1.251 1.00 0.00 H new ATOM 0 HA LEU A 346 15.107 1.221 -2.602 1.00 0.00 H new ATOM 0 HB2 LEU A 346 16.278 1.678 0.036 1.00 0.00 H new ATOM 0 HB3 LEU A 346 14.627 1.914 -0.501 1.00 0.00 H new ATOM 0 HG LEU A 346 15.852 -0.686 0.410 1.00 0.00 H new ATOM 0 HD11 LEU A 346 14.318 -0.492 2.323 1.00 0.00 H new ATOM 0 HD12 LEU A 346 15.486 0.849 2.253 1.00 0.00 H new ATOM 0 HD13 LEU A 346 13.804 1.105 1.730 1.00 0.00 H new ATOM 0 HD21 LEU A 346 13.532 -1.550 0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 346 12.995 -0.002 -0.351 1.00 0.00 H new ATOM 0 HD23 LEU A 346 14.108 -1.048 -1.264 1.00 0.00 H new ATOM 1553 N ASN A 347 17.159 2.880 -2.137 1.00 0.00 N ATOM 1554 CA ASN A 347 18.339 3.690 -2.372 1.00 0.00 C ATOM 1555 C ASN A 347 19.129 3.739 -1.093 1.00 0.00 C ATOM 1556 O ASN A 347 20.358 3.627 -1.101 1.00 0.00 O ATOM 1557 CB ASN A 347 17.944 5.082 -2.821 1.00 0.00 C ATOM 1558 CG ASN A 347 18.960 5.717 -3.717 1.00 0.00 C ATOM 1559 OD1 ASN A 347 19.826 5.050 -4.285 1.00 0.00 O ATOM 1560 ND2 ASN A 347 18.845 7.017 -3.860 1.00 0.00 N ATOM 0 H ASN A 347 16.326 3.417 -1.897 1.00 0.00 H new ATOM 0 HA ASN A 347 18.947 3.255 -3.165 1.00 0.00 H new ATOM 0 HB2 ASN A 347 16.988 5.032 -3.343 1.00 0.00 H new ATOM 0 HB3 ASN A 347 17.796 5.712 -1.944 1.00 0.00 H new ATOM 0 HD21 ASN A 347 19.492 7.523 -4.465 1.00 0.00 H new ATOM 0 HD22 ASN A 347 18.109 7.521 -3.366 1.00 0.00 H new ATOM 1567 N PRO A 348 18.428 3.943 0.037 1.00 0.00 N ATOM 1568 CA PRO A 348 18.994 3.923 1.350 1.00 0.00 C ATOM 1569 C PRO A 348 18.430 2.739 2.138 1.00 0.00 C ATOM 1570 O PRO A 348 17.839 2.908 3.204 1.00 0.00 O ATOM 1571 CB PRO A 348 18.474 5.238 1.851 1.00 0.00 C ATOM 1572 CG PRO A 348 17.086 5.318 1.314 1.00 0.00 C ATOM 1573 CD PRO A 348 17.023 4.353 0.156 1.00 0.00 C ATOM 0 HA PRO A 348 20.076 3.809 1.417 1.00 0.00 H new ATOM 0 HB2 PRO A 348 18.481 5.279 2.940 1.00 0.00 H new ATOM 0 HB3 PRO A 348 19.085 6.068 1.497 1.00 0.00 H new ATOM 0 HG2 PRO A 348 16.357 5.054 2.080 1.00 0.00 H new ATOM 0 HG3 PRO A 348 16.853 6.332 0.988 1.00 0.00 H new ATOM 0 HD2 PRO A 348 16.366 3.508 0.362 1.00 0.00 H new ATOM 0 HD3 PRO A 348 16.656 4.828 -0.754 1.00 0.00 H new ATOM 1581 N PRO A 349 18.609 1.524 1.578 1.00 0.00 N ATOM 1582 CA PRO A 349 18.123 0.261 2.109 1.00 0.00 C ATOM 1583 C PRO A 349 17.960 0.202 3.622 1.00 0.00 C ATOM 1584 O PRO A 349 18.666 0.868 4.380 1.00 0.00 O ATOM 1585 CB PRO A 349 19.192 -0.736 1.653 1.00 0.00 C ATOM 1586 CG PRO A 349 20.089 0.009 0.720 1.00 0.00 C ATOM 1587 CD PRO A 349 19.355 1.260 0.359 1.00 0.00 C ATOM 0 HA PRO A 349 17.113 0.066 1.748 1.00 0.00 H new ATOM 0 HB2 PRO A 349 19.752 -1.123 2.505 1.00 0.00 H new ATOM 0 HB3 PRO A 349 18.738 -1.592 1.155 1.00 0.00 H new ATOM 0 HG2 PRO A 349 21.043 0.239 1.195 1.00 0.00 H new ATOM 0 HG3 PRO A 349 20.310 -0.584 -0.167 1.00 0.00 H new ATOM 0 HD2 PRO A 349 20.034 2.076 0.109 1.00 0.00 H new ATOM 0 HD3 PRO A 349 18.699 1.117 -0.500 1.00 0.00 H new ATOM 1595 N VAL A 350 17.019 -0.636 4.034 1.00 0.00 N ATOM 1596 CA VAL A 350 16.711 -0.860 5.431 1.00 0.00 C ATOM 1597 C VAL A 350 16.851 -2.349 5.710 1.00 0.00 C ATOM 1598 O VAL A 350 17.068 -3.140 4.790 1.00 0.00 O ATOM 1599 CB VAL A 350 15.298 -0.329 5.776 1.00 0.00 C ATOM 1600 CG1 VAL A 350 14.276 -0.825 4.780 1.00 0.00 C ATOM 1601 CG2 VAL A 350 14.873 -0.667 7.190 1.00 0.00 C ATOM 0 H VAL A 350 16.443 -1.184 3.395 1.00 0.00 H new ATOM 0 HA VAL A 350 17.404 -0.311 6.068 1.00 0.00 H new ATOM 0 HB VAL A 350 15.352 0.758 5.713 1.00 0.00 H new ATOM 0 HG11 VAL A 350 13.292 -0.438 5.045 1.00 0.00 H new ATOM 0 HG12 VAL A 350 14.545 -0.481 3.781 1.00 0.00 H new ATOM 0 HG13 VAL A 350 14.253 -1.915 4.794 1.00 0.00 H new ATOM 0 HG21 VAL A 350 13.875 -0.270 7.375 1.00 0.00 H new ATOM 0 HG22 VAL A 350 14.862 -1.749 7.318 1.00 0.00 H new ATOM 0 HG23 VAL A 350 15.576 -0.226 7.897 1.00 0.00 H new ATOM 1611 N ALA A 351 16.748 -2.731 6.960 1.00 0.00 N ATOM 1612 CA ALA A 351 16.928 -4.132 7.335 1.00 0.00 C ATOM 1613 C ALA A 351 15.623 -4.892 7.543 1.00 0.00 C ATOM 1614 O ALA A 351 15.520 -6.058 7.167 1.00 0.00 O ATOM 1615 CB ALA A 351 17.783 -4.230 8.588 1.00 0.00 C ATOM 0 H ALA A 351 16.542 -2.104 7.738 1.00 0.00 H new ATOM 0 HA ALA A 351 17.428 -4.606 6.491 1.00 0.00 H new ATOM 0 HB1 ALA A 351 17.912 -5.278 8.860 1.00 0.00 H new ATOM 0 HB2 ALA A 351 18.758 -3.782 8.399 1.00 0.00 H new ATOM 0 HB3 ALA A 351 17.293 -3.701 9.405 1.00 0.00 H new ATOM 1621 N GLU A 352 14.637 -4.250 8.160 1.00 0.00 N ATOM 1622 CA GLU A 352 13.353 -4.910 8.451 1.00 0.00 C ATOM 1623 C GLU A 352 12.294 -3.901 8.881 1.00 0.00 C ATOM 1624 O GLU A 352 11.185 -3.888 8.348 1.00 0.00 O ATOM 1625 CB GLU A 352 13.501 -5.948 9.581 1.00 0.00 C ATOM 1626 CG GLU A 352 14.928 -6.212 10.053 1.00 0.00 C ATOM 1627 CD GLU A 352 14.989 -7.232 11.172 1.00 0.00 C ATOM 1628 OE1 GLU A 352 14.905 -6.826 12.350 1.00 0.00 O ATOM 1629 OE2 GLU A 352 15.122 -8.437 10.871 1.00 0.00 O ATOM 0 H GLU A 352 14.693 -3.280 8.470 1.00 0.00 H new ATOM 0 HA GLU A 352 13.045 -5.403 7.529 1.00 0.00 H new ATOM 0 HB2 GLU A 352 12.911 -5.615 10.435 1.00 0.00 H new ATOM 0 HB3 GLU A 352 13.069 -6.890 9.243 1.00 0.00 H new ATOM 0 HG2 GLU A 352 15.526 -6.563 9.212 1.00 0.00 H new ATOM 0 HG3 GLU A 352 15.374 -5.277 10.393 1.00 0.00 H new ATOM 1636 N PRO A 353 12.635 -3.076 9.877 1.00 0.00 N ATOM 1637 CA PRO A 353 11.830 -2.021 10.449 1.00 0.00 C ATOM 1638 C PRO A 353 10.518 -1.690 9.728 1.00 0.00 C ATOM 1639 O PRO A 353 9.455 -1.775 10.344 1.00 0.00 O ATOM 1640 CB PRO A 353 12.853 -0.883 10.362 1.00 0.00 C ATOM 1641 CG PRO A 353 14.197 -1.573 10.433 1.00 0.00 C ATOM 1642 CD PRO A 353 13.909 -3.030 10.555 1.00 0.00 C ATOM 0 HA PRO A 353 11.436 -2.265 11.435 1.00 0.00 H new ATOM 0 HB2 PRO A 353 12.744 -0.322 9.434 1.00 0.00 H new ATOM 0 HB3 PRO A 353 12.728 -0.174 11.180 1.00 0.00 H new ATOM 0 HG2 PRO A 353 14.789 -1.366 9.541 1.00 0.00 H new ATOM 0 HG3 PRO A 353 14.773 -1.217 11.287 1.00 0.00 H new ATOM 0 HD2 PRO A 353 14.664 -3.649 10.071 1.00 0.00 H new ATOM 0 HD3 PRO A 353 13.844 -3.359 11.592 1.00 0.00 H new ATOM 1650 N PRO A 354 10.535 -1.310 8.434 1.00 0.00 N ATOM 1651 CA PRO A 354 9.319 -0.958 7.715 1.00 0.00 C ATOM 1652 C PRO A 354 8.423 -2.155 7.409 1.00 0.00 C ATOM 1653 O PRO A 354 8.290 -2.567 6.255 1.00 0.00 O ATOM 1654 CB PRO A 354 9.841 -0.331 6.423 1.00 0.00 C ATOM 1655 CG PRO A 354 11.273 -0.077 6.674 1.00 0.00 C ATOM 1656 CD PRO A 354 11.687 -1.184 7.548 1.00 0.00 C ATOM 0 HA PRO A 354 8.686 -0.297 8.307 1.00 0.00 H new ATOM 0 HB2 PRO A 354 9.702 -1.001 5.575 1.00 0.00 H new ATOM 0 HB3 PRO A 354 9.311 0.593 6.190 1.00 0.00 H new ATOM 0 HG2 PRO A 354 11.844 -0.067 5.746 1.00 0.00 H new ATOM 0 HG3 PRO A 354 11.428 0.889 7.154 1.00 0.00 H new ATOM 0 HD2 PRO A 354 11.874 -2.100 6.987 1.00 0.00 H new ATOM 0 HD3 PRO A 354 12.601 -0.953 8.095 1.00 0.00 H new ATOM 1664 N GLU A 355 7.809 -2.710 8.446 1.00 0.00 N ATOM 1665 CA GLU A 355 6.912 -3.848 8.286 1.00 0.00 C ATOM 1666 C GLU A 355 5.478 -3.369 8.082 1.00 0.00 C ATOM 1667 O GLU A 355 4.572 -4.168 7.845 1.00 0.00 O ATOM 1668 CB GLU A 355 6.985 -4.764 9.509 1.00 0.00 C ATOM 1669 CG GLU A 355 8.364 -5.345 9.758 1.00 0.00 C ATOM 1670 CD GLU A 355 8.360 -6.409 10.837 1.00 0.00 C ATOM 1671 OE1 GLU A 355 8.512 -6.052 12.024 1.00 0.00 O ATOM 1672 OE2 GLU A 355 8.207 -7.601 10.496 1.00 0.00 O ATOM 0 H GLU A 355 7.916 -2.390 9.409 1.00 0.00 H new ATOM 0 HA GLU A 355 7.226 -4.410 7.407 1.00 0.00 H new ATOM 0 HB2 GLU A 355 6.673 -4.203 10.390 1.00 0.00 H new ATOM 0 HB3 GLU A 355 6.274 -5.581 9.382 1.00 0.00 H new ATOM 0 HG2 GLU A 355 8.747 -5.773 8.832 1.00 0.00 H new ATOM 0 HG3 GLU A 355 9.046 -4.544 10.045 1.00 0.00 H new ATOM 1679 N GLY A 356 5.287 -2.056 8.174 1.00 0.00 N ATOM 1680 CA GLY A 356 3.974 -1.477 8.005 1.00 0.00 C ATOM 1681 C GLY A 356 4.029 -0.061 7.498 1.00 0.00 C ATOM 1682 O GLY A 356 3.510 0.248 6.425 1.00 0.00 O ATOM 0 H GLY A 356 6.028 -1.381 8.364 1.00 0.00 H new ATOM 0 HA2 GLY A 356 3.399 -2.087 7.308 1.00 0.00 H new ATOM 0 HA3 GLY A 356 3.446 -1.498 8.958 1.00 0.00 H new ATOM 1686 N SER A 357 4.658 0.801 8.283 1.00 0.00 N ATOM 1687 CA SER A 357 4.777 2.205 7.931 1.00 0.00 C ATOM 1688 C SER A 357 5.596 2.392 6.652 1.00 0.00 C ATOM 1689 O SER A 357 5.164 1.994 5.571 1.00 0.00 O ATOM 1690 CB SER A 357 5.401 2.996 9.084 1.00 0.00 C ATOM 1691 OG SER A 357 5.326 4.390 8.843 1.00 0.00 O ATOM 0 H SER A 357 5.094 0.550 9.170 1.00 0.00 H new ATOM 0 HA SER A 357 3.773 2.587 7.745 1.00 0.00 H new ATOM 0 HB2 SER A 357 4.887 2.756 10.015 1.00 0.00 H new ATOM 0 HB3 SER A 357 6.443 2.701 9.210 1.00 0.00 H new ATOM 0 HG SER A 357 5.729 4.874 9.594 1.00 0.00 H new ATOM 1697 N TRP A 358 6.778 3.006 6.780 1.00 0.00 N ATOM 1698 CA TRP A 358 7.647 3.246 5.641 1.00 0.00 C ATOM 1699 C TRP A 358 6.999 4.229 4.692 1.00 0.00 C ATOM 1700 O TRP A 358 5.784 4.433 4.720 1.00 0.00 O ATOM 1701 CB TRP A 358 7.972 1.941 4.935 1.00 0.00 C ATOM 1702 CG TRP A 358 9.258 1.980 4.183 1.00 0.00 C ATOM 1703 CD1 TRP A 358 10.495 2.345 4.640 1.00 0.00 C ATOM 1704 CD2 TRP A 358 9.431 1.606 2.836 1.00 0.00 C ATOM 1705 NE1 TRP A 358 11.414 2.248 3.624 1.00 0.00 N ATOM 1706 CE2 TRP A 358 10.780 1.795 2.514 1.00 0.00 C ATOM 1707 CE3 TRP A 358 8.564 1.134 1.865 1.00 0.00 C ATOM 1708 CZ2 TRP A 358 11.278 1.528 1.261 1.00 0.00 C ATOM 1709 CZ3 TRP A 358 9.067 0.863 0.620 1.00 0.00 C ATOM 1710 CH2 TRP A 358 10.411 1.063 0.338 1.00 0.00 C ATOM 0 H TRP A 358 7.148 3.344 7.668 1.00 0.00 H new ATOM 0 HA TRP A 358 8.583 3.677 5.996 1.00 0.00 H new ATOM 0 HB2 TRP A 358 8.014 1.139 5.672 1.00 0.00 H new ATOM 0 HB3 TRP A 358 7.163 1.698 4.245 1.00 0.00 H new ATOM 0 HD1 TRP A 358 10.716 2.662 5.649 1.00 0.00 H new ATOM 0 HE1 TRP A 358 12.405 2.478 3.693 1.00 0.00 H new ATOM 0 HE3 TRP A 358 7.517 0.983 2.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 358 12.320 1.684 1.025 1.00 0.00 H new ATOM 0 HZ3 TRP A 358 8.410 0.489 -0.151 1.00 0.00 H new ATOM 0 HH2 TRP A 358 10.775 0.839 -0.654 1.00 0.00 H new ATOM 1721 N SER A 359 7.811 4.841 3.857 1.00 0.00 N ATOM 1722 CA SER A 359 7.295 5.849 2.934 1.00 0.00 C ATOM 1723 C SER A 359 7.766 5.708 1.496 1.00 0.00 C ATOM 1724 O SER A 359 7.261 6.400 0.635 1.00 0.00 O ATOM 1725 CB SER A 359 7.682 7.237 3.446 1.00 0.00 C ATOM 1726 OG SER A 359 6.872 7.625 4.542 1.00 0.00 O ATOM 0 H SER A 359 8.814 4.668 3.792 1.00 0.00 H new ATOM 0 HA SER A 359 6.215 5.702 2.910 1.00 0.00 H new ATOM 0 HB2 SER A 359 8.730 7.237 3.747 1.00 0.00 H new ATOM 0 HB3 SER A 359 7.582 7.965 2.641 1.00 0.00 H new ATOM 0 HG SER A 359 7.143 8.515 4.850 1.00 0.00 H new ATOM 1732 N CYS A 360 8.691 4.812 1.234 1.00 0.00 N ATOM 1733 CA CYS A 360 9.248 4.651 -0.121 1.00 0.00 C ATOM 1734 C CYS A 360 10.051 5.895 -0.474 1.00 0.00 C ATOM 1735 O CYS A 360 9.863 6.938 0.142 1.00 0.00 O ATOM 1736 CB CYS A 360 8.162 4.419 -1.193 1.00 0.00 C ATOM 1737 SG CYS A 360 7.371 5.941 -1.865 1.00 0.00 S ATOM 0 H CYS A 360 9.083 4.177 1.930 1.00 0.00 H new ATOM 0 HA CYS A 360 9.881 3.764 -0.113 1.00 0.00 H new ATOM 0 HB2 CYS A 360 8.606 3.866 -2.021 1.00 0.00 H new ATOM 0 HB3 CYS A 360 7.385 3.785 -0.766 1.00 0.00 H new ATOM 0 HG CYS A 360 6.895 6.651 -0.886 1.00 0.00 H new ATOM 1742 N HIS A 361 10.929 5.812 -1.470 1.00 0.00 N ATOM 1743 CA HIS A 361 11.730 6.960 -1.831 1.00 0.00 C ATOM 1744 C HIS A 361 10.868 8.050 -2.428 1.00 0.00 C ATOM 1745 O HIS A 361 11.127 9.228 -2.218 1.00 0.00 O ATOM 1746 CB HIS A 361 12.861 6.597 -2.799 1.00 0.00 C ATOM 1747 CG HIS A 361 12.454 5.857 -4.042 1.00 0.00 C ATOM 1748 ND1 HIS A 361 11.467 6.088 -4.937 1.00 0.00 N flip ATOM 1749 CD2 HIS A 361 13.127 4.745 -4.507 1.00 0.00 C flip ATOM 1750 CE1 HIS A 361 11.563 5.131 -5.912 1.00 0.00 C flip ATOM 1751 NE2 HIS A 361 12.568 4.333 -5.632 1.00 0.00 N flip ATOM 0 H HIS A 361 11.097 4.975 -2.028 1.00 0.00 H new ATOM 0 HA HIS A 361 12.187 7.327 -0.912 1.00 0.00 H new ATOM 0 HB2 HIS A 361 13.366 7.516 -3.096 1.00 0.00 H new ATOM 0 HB3 HIS A 361 13.591 5.991 -2.262 1.00 0.00 H new ATOM 0 HD2 HIS A 361 13.977 4.284 -4.027 1.00 0.00 H new ATOM 0 HE1 HIS A 361 10.916 5.046 -6.773 1.00 0.00 H new ATOM 0 HE2 HIS A 361 12.866 3.532 -6.188 1.00 0.00 H new ATOM 1760 N LEU A 362 9.817 7.651 -3.132 1.00 0.00 N ATOM 1761 CA LEU A 362 8.939 8.609 -3.780 1.00 0.00 C ATOM 1762 C LEU A 362 8.397 9.627 -2.806 1.00 0.00 C ATOM 1763 O LEU A 362 8.326 10.803 -3.110 1.00 0.00 O ATOM 1764 CB LEU A 362 7.717 7.932 -4.401 1.00 0.00 C ATOM 1765 CG LEU A 362 7.963 6.744 -5.306 1.00 0.00 C ATOM 1766 CD1 LEU A 362 6.637 6.149 -5.715 1.00 0.00 C ATOM 1767 CD2 LEU A 362 8.764 7.145 -6.524 1.00 0.00 C ATOM 0 H LEU A 362 9.555 6.675 -3.267 1.00 0.00 H new ATOM 0 HA LEU A 362 9.555 9.085 -4.543 1.00 0.00 H new ATOM 0 HB2 LEU A 362 7.063 7.609 -3.591 1.00 0.00 H new ATOM 0 HB3 LEU A 362 7.170 8.682 -4.972 1.00 0.00 H new ATOM 0 HG LEU A 362 8.544 5.999 -4.762 1.00 0.00 H new ATOM 0 HD11 LEU A 362 6.808 5.293 -6.367 1.00 0.00 H new ATOM 0 HD12 LEU A 362 6.094 5.826 -4.827 1.00 0.00 H new ATOM 0 HD13 LEU A 362 6.050 6.898 -6.247 1.00 0.00 H new ATOM 0 HD21 LEU A 362 8.926 6.272 -7.156 1.00 0.00 H new ATOM 0 HD22 LEU A 362 8.218 7.903 -7.085 1.00 0.00 H new ATOM 0 HD23 LEU A 362 9.726 7.549 -6.210 1.00 0.00 H new ATOM 1779 N CYS A 363 8.054 9.155 -1.626 1.00 0.00 N ATOM 1780 CA CYS A 363 7.386 9.992 -0.620 1.00 0.00 C ATOM 1781 C CYS A 363 8.203 11.087 0.026 1.00 0.00 C ATOM 1782 O CYS A 363 7.909 12.265 -0.141 1.00 0.00 O ATOM 1783 CB CYS A 363 6.917 9.114 0.516 1.00 0.00 C ATOM 1784 SG CYS A 363 5.278 8.384 0.308 1.00 0.00 S ATOM 0 H CYS A 363 8.222 8.194 -1.328 1.00 0.00 H new ATOM 0 HA CYS A 363 6.597 10.483 -1.190 1.00 0.00 H new ATOM 0 HB2 CYS A 363 7.639 8.309 0.652 1.00 0.00 H new ATOM 0 HB3 CYS A 363 6.919 9.704 1.433 1.00 0.00 H new ATOM 0 HG CYS A 363 4.371 9.246 0.661 1.00 0.00 H new ATOM 1789 N TRP A 364 9.213 10.709 0.770 1.00 0.00 N ATOM 1790 CA TRP A 364 10.003 11.687 1.469 1.00 0.00 C ATOM 1791 C TRP A 364 10.789 12.527 0.507 1.00 0.00 C ATOM 1792 O TRP A 364 11.041 13.681 0.769 1.00 0.00 O ATOM 1793 CB TRP A 364 10.859 11.098 2.582 1.00 0.00 C ATOM 1794 CG TRP A 364 11.627 9.898 2.216 1.00 0.00 C ATOM 1795 CD1 TRP A 364 11.106 8.743 1.808 1.00 0.00 C ATOM 1796 CD2 TRP A 364 13.030 9.723 2.268 1.00 0.00 C ATOM 1797 NE1 TRP A 364 12.094 7.824 1.580 1.00 0.00 N ATOM 1798 CE2 TRP A 364 13.305 8.419 1.848 1.00 0.00 C ATOM 1799 CE3 TRP A 364 14.074 10.555 2.619 1.00 0.00 C ATOM 1800 CZ2 TRP A 364 14.604 7.931 1.772 1.00 0.00 C ATOM 1801 CZ3 TRP A 364 15.363 10.080 2.547 1.00 0.00 C ATOM 1802 CH2 TRP A 364 15.620 8.779 2.122 1.00 0.00 C ATOM 0 H TRP A 364 9.504 9.741 0.905 1.00 0.00 H new ATOM 0 HA TRP A 364 9.304 12.346 1.985 1.00 0.00 H new ATOM 0 HB2 TRP A 364 11.554 11.863 2.927 1.00 0.00 H new ATOM 0 HB3 TRP A 364 10.212 10.852 3.424 1.00 0.00 H new ATOM 0 HD1 TRP A 364 10.050 8.557 1.675 1.00 0.00 H new ATOM 0 HE1 TRP A 364 11.956 6.863 1.266 1.00 0.00 H new ATOM 0 HE3 TRP A 364 13.881 11.566 2.946 1.00 0.00 H new ATOM 0 HZ2 TRP A 364 14.804 6.920 1.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 364 16.185 10.723 2.823 1.00 0.00 H new ATOM 0 HH2 TRP A 364 16.641 8.432 2.067 1.00 0.00 H new ATOM 1813 N GLU A 365 11.185 11.946 -0.600 1.00 0.00 N ATOM 1814 CA GLU A 365 11.892 12.708 -1.610 1.00 0.00 C ATOM 1815 C GLU A 365 10.916 13.725 -2.173 1.00 0.00 C ATOM 1816 O GLU A 365 11.290 14.823 -2.584 1.00 0.00 O ATOM 1817 CB GLU A 365 12.440 11.796 -2.690 1.00 0.00 C ATOM 1818 CG GLU A 365 11.462 11.468 -3.808 1.00 0.00 C ATOM 1819 CD GLU A 365 12.090 10.621 -4.898 1.00 0.00 C ATOM 1820 OE1 GLU A 365 12.067 9.380 -4.775 1.00 0.00 O ATOM 1821 OE2 GLU A 365 12.606 11.202 -5.878 1.00 0.00 O ATOM 0 H GLU A 365 11.034 10.963 -0.826 1.00 0.00 H new ATOM 0 HA GLU A 365 12.752 13.219 -1.178 1.00 0.00 H new ATOM 0 HB2 GLU A 365 13.324 12.263 -3.125 1.00 0.00 H new ATOM 0 HB3 GLU A 365 12.766 10.864 -2.228 1.00 0.00 H new ATOM 0 HG2 GLU A 365 10.603 10.941 -3.392 1.00 0.00 H new ATOM 0 HG3 GLU A 365 11.088 12.395 -4.243 1.00 0.00 H new ATOM 1828 N LEU A 366 9.646 13.319 -2.180 1.00 0.00 N ATOM 1829 CA LEU A 366 8.553 14.165 -2.615 1.00 0.00 C ATOM 1830 C LEU A 366 8.351 15.241 -1.577 1.00 0.00 C ATOM 1831 O LEU A 366 7.873 16.333 -1.857 1.00 0.00 O ATOM 1832 CB LEU A 366 7.290 13.337 -2.776 1.00 0.00 C ATOM 1833 CG LEU A 366 6.141 13.985 -3.531 1.00 0.00 C ATOM 1834 CD1 LEU A 366 5.351 14.887 -2.608 1.00 0.00 C ATOM 1835 CD2 LEU A 366 6.685 14.735 -4.724 1.00 0.00 C ATOM 0 H LEU A 366 9.353 12.389 -1.881 1.00 0.00 H new ATOM 0 HA LEU A 366 8.784 14.619 -3.579 1.00 0.00 H new ATOM 0 HB2 LEU A 366 7.553 12.411 -3.287 1.00 0.00 H new ATOM 0 HB3 LEU A 366 6.933 13.064 -1.783 1.00 0.00 H new ATOM 0 HG LEU A 366 5.457 13.218 -3.896 1.00 0.00 H new ATOM 0 HD11 LEU A 366 4.531 15.345 -3.161 1.00 0.00 H new ATOM 0 HD12 LEU A 366 4.949 14.300 -1.782 1.00 0.00 H new ATOM 0 HD13 LEU A 366 6.004 15.667 -2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 366 5.863 15.201 -5.267 1.00 0.00 H new ATOM 0 HD22 LEU A 366 7.378 15.505 -4.385 1.00 0.00 H new ATOM 0 HD23 LEU A 366 7.208 14.041 -5.382 1.00 0.00 H new ATOM 1847 N LEU A 367 8.721 14.880 -0.361 1.00 0.00 N ATOM 1848 CA LEU A 367 8.643 15.749 0.790 1.00 0.00 C ATOM 1849 C LEU A 367 9.675 16.848 0.647 1.00 0.00 C ATOM 1850 O LEU A 367 9.376 18.036 0.729 1.00 0.00 O ATOM 1851 CB LEU A 367 8.966 14.913 2.003 1.00 0.00 C ATOM 1852 CG LEU A 367 7.839 14.551 2.954 1.00 0.00 C ATOM 1853 CD1 LEU A 367 6.678 13.919 2.201 1.00 0.00 C ATOM 1854 CD2 LEU A 367 8.403 13.598 3.995 1.00 0.00 C ATOM 0 H LEU A 367 9.091 13.954 -0.146 1.00 0.00 H new ATOM 0 HA LEU A 367 7.654 16.197 0.881 1.00 0.00 H new ATOM 0 HB2 LEU A 367 9.417 13.984 1.655 1.00 0.00 H new ATOM 0 HB3 LEU A 367 9.727 15.442 2.577 1.00 0.00 H new ATOM 0 HG LEU A 367 7.449 15.446 3.440 1.00 0.00 H new ATOM 0 HD11 LEU A 367 5.883 13.668 2.903 1.00 0.00 H new ATOM 0 HD12 LEU A 367 6.299 14.622 1.460 1.00 0.00 H new ATOM 0 HD13 LEU A 367 7.019 13.013 1.700 1.00 0.00 H new ATOM 0 HD21 LEU A 367 7.617 13.318 4.696 1.00 0.00 H new ATOM 0 HD22 LEU A 367 8.785 12.704 3.501 1.00 0.00 H new ATOM 0 HD23 LEU A 367 9.213 14.088 4.536 1.00 0.00 H new ATOM 1866 N LYS A 368 10.903 16.401 0.429 1.00 0.00 N ATOM 1867 CA LYS A 368 12.045 17.282 0.245 1.00 0.00 C ATOM 1868 C LYS A 368 11.825 18.194 -0.954 1.00 0.00 C ATOM 1869 O LYS A 368 12.306 19.328 -0.987 1.00 0.00 O ATOM 1870 CB LYS A 368 13.301 16.433 0.028 1.00 0.00 C ATOM 1871 CG LYS A 368 13.295 15.142 0.833 1.00 0.00 C ATOM 1872 CD LYS A 368 14.681 14.551 0.995 1.00 0.00 C ATOM 1873 CE LYS A 368 14.736 13.663 2.220 1.00 0.00 C ATOM 1874 NZ LYS A 368 16.072 13.028 2.386 1.00 0.00 N ATOM 0 H LYS A 368 11.136 15.409 0.375 1.00 0.00 H new ATOM 0 HA LYS A 368 12.166 17.903 1.133 1.00 0.00 H new ATOM 0 HB2 LYS A 368 13.392 16.193 -1.031 1.00 0.00 H new ATOM 0 HB3 LYS A 368 14.180 17.019 0.298 1.00 0.00 H new ATOM 0 HG2 LYS A 368 12.868 15.334 1.817 1.00 0.00 H new ATOM 0 HG3 LYS A 368 12.649 14.415 0.342 1.00 0.00 H new ATOM 0 HD2 LYS A 368 14.943 13.974 0.108 1.00 0.00 H new ATOM 0 HD3 LYS A 368 15.416 15.351 1.084 1.00 0.00 H new ATOM 0 HE2 LYS A 368 14.502 14.252 3.106 1.00 0.00 H new ATOM 0 HE3 LYS A 368 13.973 12.888 2.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 368 16.310 12.978 3.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 368 16.052 12.068 1.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 368 16.789 13.594 1.889 1.00 0.00 H new