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 302 MET CE :methyl 145:sc= -1.38 (180deg=-6.26!) USER MOD Set 1.2: B 18 HIS : no HE2:sc= -4.55 K(o=-5.9,f=-10!) USER MOD Set 2.1: A 319 CYS SG : rot -153:sc= -5.67! USER MOD Set 2.2: A 322 CYS SG : rot 180:sc= 0.212 USER MOD Set 2.3: A 342 HIS :FLIP no HE2:sc= -6.99! C(o=-18!,f=-17!) USER MOD Set 2.4: A 345 CYS SG : rot -141:sc= -4.24! USER MOD Set 3.1: A 341 TYR OH : rot 23:sc= -4.76! USER MOD Set 3.2: A 361 HIS :FLIP no HD1:sc= -7.45! C(o=-14!,f=-12!) USER MOD Set 4.1: A 334 CYS SG : rot -145:sc= -5.55! USER MOD Set 4.2: A 337 CYS SG : rot -9:sc= 0.442 USER MOD Set 4.3: A 360 CYS SG : rot -57:sc= -3.03! USER MOD Set 4.4: A 363 CYS SG : rot -104:sc= -4.35! USER MOD Set 5.1: A 330 GLN :FLIP amide:sc= -1.86! F(o=-7.3,f=-5.5!) USER MOD Set 5.2: A 343 MET CE :methyl 152:sc= -3.67! (180deg=-6.3!) USER MOD Set 6.1: A 327 ASN :FLIP amide:sc= 0.0916 F(o=-0.78,f=0.2) USER MOD Set 6.2: A 344 TYR OH : rot 22:sc= 0.112 USER MOD Set 7.1: A 312 GLN : amide:sc= -0.225 K(o=-0.68,f=-4.1!) USER MOD Set 7.2: A 318 SER OG : rot 180:sc= -0.451 USER MOD Set 8.1: A 262 CYS SG : rot -140:sc= -6.4! USER MOD Set 8.2: A 265 CYS SG : rot 160:sc= -3.65! USER MOD Set 8.3: A 272 ASN :FLIP amide:sc= 0.333 F(o=-25!,f=-16) USER MOD Set 8.4: A 275 SER OG : rot 71:sc= 0.00201 USER MOD Set 8.5: A 292 HIS :FLIP no HE2:sc= -2.4 F(o=-17,f=-16) USER MOD Set 8.6: A 295 CYS SG : rot -149:sc= -3.8! USER MOD Set 9.1: A 284 CYS SG : rot 150:sc= 0.217 USER MOD Set 9.2: A 287 CYS SG : rot -45:sc= 0.42 USER MOD Set 9.3: A 313 CYS SG : rot -126:sc= -0.922 USER MOD Set 9.4: A 316 CYS SG : rot -132:sc= -0.0397 USER MOD Set10.1: A 260 SER OG : rot -22:sc= 0.203 USER MOD Set10.2: A 290 SER OG : rot -150:sc= -2.01! USER MOD Single : A 261 TYR OH : rot 180:sc= 0 USER MOD Single : A 269 SER OG : rot 51:sc= 1.16 USER MOD Single : A 270 ASN : amide:sc= -0.461 K(o=-0.46,f=-1.6!) USER MOD Single : A 271 MET CE :methyl -163:sc= -1.86! (180deg=-2.97) USER MOD Single : A 273 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 274 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 283 SER OG : rot 180:sc= 0.0164 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 297 GLN :FLIP amide:sc= -0.19 F(o=-6.9!,f=-0.19) USER MOD Single : A 299 THR OG1 : rot 180:sc= -0.184 USER MOD Single : A 301 ASN : amide:sc= 0.141 K(o=0.14,f=-1.5) USER MOD Single : A 303 THR OG1 : rot 97:sc= -0.065 USER MOD Single : A 307 LYS NZ :NH3+ 167:sc= -3.07! (180deg=-3.67!) USER MOD Single : A 308 THR OG1 : rot 180:sc= 0 USER MOD Single : A 309 TYR OH : rot -13:sc= 0.515 USER MOD Single : A 310 LYS NZ :NH3+ 161:sc= -0.0875 (180deg=-0.4) USER MOD Single : A 317 LYS NZ :NH3+ 162:sc= -0.386 (180deg=-1.17!) USER MOD Single : A 324 THR OG1 : rot -20:sc= -3.01! USER MOD Single : A 325 SER OG : rot 32:sc= 0.534 USER MOD Single : A 347 ASN : amide:sc= -0.0324 K(o=-0.032,f=-0.76) USER MOD Single : A 357 SER OG : rot 180:sc= 0 USER MOD Single : A 359 SER OG : rot 159:sc= 1.45 USER MOD Single : A 368 LYS NZ :NH3+ -121:sc= 0.245 (180deg=-0.0138) USER MOD Single : B 20 LYS NZ :NH3+ -162:sc= -4.35! (180deg=-5.69!) USER MOD ----------------------------------------------------------------- ATOM 108 N ARG B 17 -3.950 -5.003 5.440 1.00 0.00 N ATOM 109 CA ARG B 17 -2.993 -4.026 4.932 1.00 0.00 C ATOM 110 C ARG B 17 -2.248 -4.560 3.708 1.00 0.00 C ATOM 111 O ARG B 17 -2.779 -4.553 2.597 1.00 0.00 O ATOM 112 CB ARG B 17 -1.997 -3.630 6.027 1.00 0.00 C ATOM 113 CG ARG B 17 -0.951 -2.625 5.565 1.00 0.00 C ATOM 114 CD ARG B 17 -1.561 -1.250 5.338 1.00 0.00 C ATOM 115 NE ARG B 17 -1.847 -0.560 6.594 1.00 0.00 N ATOM 116 CZ ARG B 17 -0.931 0.101 7.296 1.00 0.00 C ATOM 117 NH1 ARG B 17 0.329 0.130 6.885 1.00 0.00 N ATOM 118 NH2 ARG B 17 -1.271 0.730 8.412 1.00 0.00 N ATOM 0 HA ARG B 17 -3.553 -3.142 4.627 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -2.545 -3.210 6.870 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -1.493 -4.526 6.389 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -0.159 -2.554 6.310 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -0.490 -2.977 4.642 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -0.879 -0.646 4.740 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -2.482 -1.353 4.764 1.00 0.00 H new ATOM 0 HE ARG B 17 -2.802 -0.587 6.952 1.00 0.00 H new ATOM 0 HH11 ARG B 17 0.597 -0.355 6.029 1.00 0.00 H new ATOM 0 HH12 ARG B 17 1.030 0.638 7.425 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -2.238 0.708 8.735 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -0.565 1.236 8.948 1.00 0.00 H new ATOM 132 N HIS B 18 -1.018 -5.027 3.920 1.00 0.00 N ATOM 133 CA HIS B 18 -0.198 -5.550 2.835 1.00 0.00 C ATOM 134 C HIS B 18 0.585 -6.781 3.295 1.00 0.00 C ATOM 135 O HIS B 18 0.093 -7.574 4.098 1.00 0.00 O ATOM 136 CB HIS B 18 0.786 -4.477 2.344 1.00 0.00 C ATOM 137 CG HIS B 18 0.174 -3.134 2.095 1.00 0.00 C ATOM 138 ND1 HIS B 18 0.554 -1.999 2.778 1.00 0.00 N ATOM 139 CD2 HIS B 18 -0.774 -2.738 1.212 1.00 0.00 C ATOM 140 CE1 HIS B 18 -0.134 -0.965 2.328 1.00 0.00 C ATOM 141 NE2 HIS B 18 -0.945 -1.388 1.378 1.00 0.00 N ATOM 0 H HIS B 18 -0.570 -5.053 4.836 1.00 0.00 H new ATOM 0 HA HIS B 18 -0.861 -5.834 2.018 1.00 0.00 H new ATOM 0 HB2 HIS B 18 1.581 -4.368 3.082 1.00 0.00 H new ATOM 0 HB3 HIS B 18 1.252 -4.825 1.422 1.00 0.00 H new ATOM 0 HD1 HIS B 18 1.257 -1.963 3.516 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -1.297 -3.368 0.508 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -0.047 0.053 2.678 1.00 0.00 H new ATOM 150 N ARG B 19 1.798 -6.930 2.749 1.00 0.00 N ATOM 151 CA ARG B 19 2.709 -8.024 3.089 1.00 0.00 C ATOM 152 C ARG B 19 2.395 -9.335 2.362 1.00 0.00 C ATOM 153 O ARG B 19 3.299 -10.138 2.127 1.00 0.00 O ATOM 154 CB ARG B 19 2.735 -8.256 4.597 1.00 0.00 C ATOM 155 CG ARG B 19 3.764 -9.283 5.042 1.00 0.00 C ATOM 156 CD ARG B 19 5.183 -8.776 4.835 1.00 0.00 C ATOM 157 NE ARG B 19 6.182 -9.768 5.226 1.00 0.00 N ATOM 158 CZ ARG B 19 7.488 -9.523 5.267 1.00 0.00 C ATOM 159 NH1 ARG B 19 7.952 -8.324 4.946 1.00 0.00 N ATOM 160 NH2 ARG B 19 8.332 -10.479 5.630 1.00 0.00 N ATOM 0 H ARG B 19 2.176 -6.288 2.053 1.00 0.00 H new ATOM 0 HA ARG B 19 3.694 -7.707 2.747 1.00 0.00 H new ATOM 0 HB2 ARG B 19 2.940 -7.310 5.097 1.00 0.00 H new ATOM 0 HB3 ARG B 19 1.747 -8.581 4.922 1.00 0.00 H new ATOM 0 HG2 ARG B 19 3.611 -9.520 6.095 1.00 0.00 H new ATOM 0 HG3 ARG B 19 3.622 -10.208 4.483 1.00 0.00 H new ATOM 0 HD2 ARG B 19 5.325 -8.513 3.787 1.00 0.00 H new ATOM 0 HD3 ARG B 19 5.331 -7.865 5.415 1.00 0.00 H new ATOM 0 HE ARG B 19 5.859 -10.701 5.482 1.00 0.00 H new ATOM 0 HH11 ARG B 19 7.306 -7.585 4.666 1.00 0.00 H new ATOM 0 HH12 ARG B 19 8.955 -8.140 4.979 1.00 0.00 H new ATOM 0 HH21 ARG B 19 7.979 -11.403 5.878 1.00 0.00 H new ATOM 0 HH22 ARG B 19 9.334 -10.290 5.661 1.00 0.00 H new ATOM 174 N LYS B 20 1.127 -9.552 2.018 1.00 0.00 N ATOM 175 CA LYS B 20 0.693 -10.773 1.322 1.00 0.00 C ATOM 176 C LYS B 20 1.293 -12.033 1.948 1.00 0.00 C ATOM 177 O LYS B 20 1.861 -11.990 3.039 1.00 0.00 O ATOM 178 CB LYS B 20 1.010 -10.715 -0.186 1.00 0.00 C ATOM 179 CG LYS B 20 2.482 -10.710 -0.553 1.00 0.00 C ATOM 180 CD LYS B 20 2.648 -10.362 -2.024 1.00 0.00 C ATOM 181 CE LYS B 20 4.054 -9.915 -2.347 1.00 0.00 C ATOM 182 NZ LYS B 20 4.535 -8.877 -1.398 1.00 0.00 N ATOM 0 H LYS B 20 0.372 -8.894 2.210 1.00 0.00 H new ATOM 0 HA LYS B 20 -0.390 -10.826 1.438 1.00 0.00 H new ATOM 0 HB2 LYS B 20 0.537 -11.570 -0.670 1.00 0.00 H new ATOM 0 HB3 LYS B 20 0.549 -9.819 -0.600 1.00 0.00 H new ATOM 0 HG2 LYS B 20 3.017 -9.987 0.063 1.00 0.00 H new ATOM 0 HG3 LYS B 20 2.920 -11.687 -0.350 1.00 0.00 H new ATOM 0 HD2 LYS B 20 2.395 -11.231 -2.632 1.00 0.00 H new ATOM 0 HD3 LYS B 20 1.947 -9.571 -2.290 1.00 0.00 H new ATOM 0 HE2 LYS B 20 4.724 -10.774 -2.317 1.00 0.00 H new ATOM 0 HE3 LYS B 20 4.086 -9.521 -3.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 5.351 -8.381 -1.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 3.772 -8.195 -1.214 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 4.819 -9.328 -0.505 1.00 0.00 H new ATOM 266 N SER A 260 -16.436 -2.033 -8.672 1.00 0.00 N ATOM 267 CA SER A 260 -15.630 -2.486 -7.545 1.00 0.00 C ATOM 268 C SER A 260 -16.232 -2.076 -6.217 1.00 0.00 C ATOM 269 O SER A 260 -17.354 -1.573 -6.147 1.00 0.00 O ATOM 270 CB SER A 260 -14.223 -1.927 -7.620 1.00 0.00 C ATOM 271 OG SER A 260 -14.234 -0.538 -7.901 1.00 0.00 O ATOM 0 HA SER A 260 -15.605 -3.574 -7.607 1.00 0.00 H new ATOM 0 HB2 SER A 260 -13.708 -2.105 -6.676 1.00 0.00 H new ATOM 0 HB3 SER A 260 -13.662 -2.452 -8.393 1.00 0.00 H new ATOM 0 HG SER A 260 -15.084 -0.297 -8.326 1.00 0.00 H new ATOM 277 N TYR A 261 -15.456 -2.299 -5.163 1.00 0.00 N ATOM 278 CA TYR A 261 -15.866 -1.968 -3.816 1.00 0.00 C ATOM 279 C TYR A 261 -14.744 -2.262 -2.835 1.00 0.00 C ATOM 280 O TYR A 261 -13.816 -3.008 -3.144 1.00 0.00 O ATOM 281 CB TYR A 261 -17.092 -2.791 -3.430 1.00 0.00 C ATOM 282 CG TYR A 261 -16.973 -4.260 -3.763 1.00 0.00 C ATOM 283 CD1 TYR A 261 -15.916 -5.006 -3.278 1.00 0.00 C ATOM 284 CD2 TYR A 261 -17.921 -4.902 -4.552 1.00 0.00 C ATOM 285 CE1 TYR A 261 -15.792 -6.343 -3.563 1.00 0.00 C ATOM 286 CE2 TYR A 261 -17.808 -6.248 -4.846 1.00 0.00 C ATOM 287 CZ TYR A 261 -16.739 -6.965 -4.349 1.00 0.00 C ATOM 288 OH TYR A 261 -16.618 -8.306 -4.637 1.00 0.00 O ATOM 0 H TYR A 261 -14.526 -2.714 -5.225 1.00 0.00 H new ATOM 0 HA TYR A 261 -16.108 -0.906 -3.780 1.00 0.00 H new ATOM 0 HB2 TYR A 261 -17.267 -2.684 -2.359 1.00 0.00 H new ATOM 0 HB3 TYR A 261 -17.966 -2.383 -3.938 1.00 0.00 H new ATOM 0 HD1 TYR A 261 -15.171 -4.526 -2.661 1.00 0.00 H new ATOM 0 HD2 TYR A 261 -18.758 -4.341 -4.941 1.00 0.00 H new ATOM 0 HE1 TYR A 261 -14.956 -6.905 -3.173 1.00 0.00 H new ATOM 0 HE2 TYR A 261 -18.551 -6.735 -5.460 1.00 0.00 H new ATOM 0 HH TYR A 261 -17.368 -8.589 -5.201 1.00 0.00 H new ATOM 298 N CYS A 262 -14.818 -1.658 -1.661 1.00 0.00 N ATOM 299 CA CYS A 262 -13.838 -1.910 -0.630 1.00 0.00 C ATOM 300 C CYS A 262 -13.913 -3.365 -0.191 1.00 0.00 C ATOM 301 O CYS A 262 -14.991 -3.893 0.044 1.00 0.00 O ATOM 302 CB CYS A 262 -14.113 -0.993 0.545 1.00 0.00 C ATOM 303 SG CYS A 262 -13.706 -1.654 2.190 1.00 0.00 S ATOM 0 H CYS A 262 -15.546 -0.992 -1.403 1.00 0.00 H new ATOM 0 HA CYS A 262 -12.837 -1.715 -1.015 1.00 0.00 H new ATOM 0 HB2 CYS A 262 -13.552 -0.070 0.398 1.00 0.00 H new ATOM 0 HB3 CYS A 262 -15.170 -0.729 0.534 1.00 0.00 H new ATOM 0 HG CYS A 262 -14.629 -1.308 3.037 1.00 0.00 H new ATOM 308 N ASP A 263 -12.769 -4.008 -0.086 1.00 0.00 N ATOM 309 CA ASP A 263 -12.716 -5.410 0.326 1.00 0.00 C ATOM 310 C ASP A 263 -13.077 -5.561 1.810 1.00 0.00 C ATOM 311 O ASP A 263 -13.046 -6.659 2.366 1.00 0.00 O ATOM 312 CB ASP A 263 -11.311 -5.958 0.060 1.00 0.00 C ATOM 313 CG ASP A 263 -11.094 -7.353 0.612 1.00 0.00 C ATOM 314 OD1 ASP A 263 -11.921 -8.243 0.323 1.00 0.00 O ATOM 315 OD2 ASP A 263 -10.093 -7.553 1.336 1.00 0.00 O ATOM 0 H ASP A 263 -11.859 -3.589 -0.278 1.00 0.00 H new ATOM 0 HA ASP A 263 -13.446 -5.978 -0.252 1.00 0.00 H new ATOM 0 HB2 ASP A 263 -11.131 -5.969 -1.015 1.00 0.00 H new ATOM 0 HB3 ASP A 263 -10.577 -5.283 0.500 1.00 0.00 H new ATOM 320 N PHE A 264 -13.432 -4.442 2.433 1.00 0.00 N ATOM 321 CA PHE A 264 -13.791 -4.414 3.854 1.00 0.00 C ATOM 322 C PHE A 264 -15.293 -4.149 4.064 1.00 0.00 C ATOM 323 O PHE A 264 -15.857 -4.591 5.065 1.00 0.00 O ATOM 324 CB PHE A 264 -12.936 -3.367 4.594 1.00 0.00 C ATOM 325 CG PHE A 264 -11.459 -3.587 4.431 1.00 0.00 C ATOM 326 CD1 PHE A 264 -10.841 -3.329 3.219 1.00 0.00 C ATOM 327 CD2 PHE A 264 -10.691 -4.052 5.485 1.00 0.00 C ATOM 328 CE1 PHE A 264 -9.486 -3.532 3.060 1.00 0.00 C ATOM 329 CE2 PHE A 264 -9.332 -4.256 5.332 1.00 0.00 C ATOM 330 CZ PHE A 264 -8.731 -3.995 4.117 1.00 0.00 C ATOM 0 H PHE A 264 -13.480 -3.532 1.974 1.00 0.00 H new ATOM 0 HA PHE A 264 -13.583 -5.399 4.271 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -13.192 -2.373 4.226 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -13.185 -3.388 5.655 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -11.427 -2.964 2.388 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -11.158 -4.258 6.437 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -9.017 -3.329 2.109 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -8.742 -4.619 6.161 1.00 0.00 H new ATOM 0 HZ PHE A 264 -7.670 -4.153 3.994 1.00 0.00 H new ATOM 340 N CYS A 265 -15.945 -3.434 3.134 1.00 0.00 N ATOM 341 CA CYS A 265 -17.388 -3.174 3.262 1.00 0.00 C ATOM 342 C CYS A 265 -18.128 -3.570 1.996 1.00 0.00 C ATOM 343 O CYS A 265 -19.338 -3.801 2.015 1.00 0.00 O ATOM 344 CB CYS A 265 -17.720 -1.711 3.582 1.00 0.00 C ATOM 345 SG CYS A 265 -16.572 -0.861 4.699 1.00 0.00 S ATOM 0 H CYS A 265 -15.509 -3.034 2.303 1.00 0.00 H new ATOM 0 HA CYS A 265 -17.715 -3.785 4.104 1.00 0.00 H new ATOM 0 HB2 CYS A 265 -17.762 -1.156 2.645 1.00 0.00 H new ATOM 0 HB3 CYS A 265 -18.717 -1.673 4.020 1.00 0.00 H new ATOM 0 HG CYS A 265 -16.700 0.425 4.557 1.00 0.00 H new ATOM 350 N LEU A 266 -17.388 -3.636 0.901 1.00 0.00 N ATOM 351 CA LEU A 266 -17.926 -4.008 -0.382 1.00 0.00 C ATOM 352 C LEU A 266 -18.944 -3.001 -0.897 1.00 0.00 C ATOM 353 O LEU A 266 -20.049 -3.359 -1.306 1.00 0.00 O ATOM 354 CB LEU A 266 -18.512 -5.385 -0.273 1.00 0.00 C ATOM 355 CG LEU A 266 -17.608 -6.388 0.424 1.00 0.00 C ATOM 356 CD1 LEU A 266 -18.300 -7.727 0.546 1.00 0.00 C ATOM 357 CD2 LEU A 266 -16.287 -6.526 -0.315 1.00 0.00 C ATOM 0 H LEU A 266 -16.389 -3.430 0.886 1.00 0.00 H new ATOM 0 HA LEU A 266 -17.120 -4.011 -1.116 1.00 0.00 H new ATOM 0 HB2 LEU A 266 -19.456 -5.325 0.268 1.00 0.00 H new ATOM 0 HB3 LEU A 266 -18.741 -5.752 -1.274 1.00 0.00 H new ATOM 0 HG LEU A 266 -17.395 -6.021 1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 266 -17.639 -8.434 1.047 1.00 0.00 H new ATOM 0 HD12 LEU A 266 -19.215 -7.612 1.126 1.00 0.00 H new ATOM 0 HD13 LEU A 266 -18.545 -8.102 -0.448 1.00 0.00 H new ATOM 0 HD21 LEU A 266 -15.655 -7.249 0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 266 -16.474 -6.869 -1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 266 -15.784 -5.560 -0.344 1.00 0.00 H new ATOM 369 N GLY A 267 -18.546 -1.735 -0.876 1.00 0.00 N ATOM 370 CA GLY A 267 -19.402 -0.668 -1.369 1.00 0.00 C ATOM 371 C GLY A 267 -18.906 -0.093 -2.680 1.00 0.00 C ATOM 372 O GLY A 267 -19.280 -0.578 -3.748 1.00 0.00 O ATOM 0 H GLY A 267 -17.640 -1.425 -0.524 1.00 0.00 H new ATOM 0 HA2 GLY A 267 -20.414 -1.049 -1.502 1.00 0.00 H new ATOM 0 HA3 GLY A 267 -19.456 0.126 -0.624 1.00 0.00 H new ATOM 376 N GLY A 268 -18.068 0.941 -2.615 1.00 0.00 N ATOM 377 CA GLY A 268 -17.550 1.525 -3.835 1.00 0.00 C ATOM 378 C GLY A 268 -16.879 2.865 -3.615 1.00 0.00 C ATOM 379 O GLY A 268 -16.997 3.463 -2.545 1.00 0.00 O ATOM 0 H GLY A 268 -17.744 1.377 -1.751 1.00 0.00 H new ATOM 0 HA2 GLY A 268 -16.834 0.837 -4.285 1.00 0.00 H new ATOM 0 HA3 GLY A 268 -18.366 1.647 -4.547 1.00 0.00 H new ATOM 383 N SER A 269 -16.171 3.333 -4.639 1.00 0.00 N ATOM 384 CA SER A 269 -15.461 4.599 -4.568 1.00 0.00 C ATOM 385 C SER A 269 -16.410 5.755 -4.858 1.00 0.00 C ATOM 386 O SER A 269 -16.437 6.287 -5.967 1.00 0.00 O ATOM 387 CB SER A 269 -14.284 4.593 -5.539 1.00 0.00 C ATOM 388 OG SER A 269 -14.719 4.589 -6.888 1.00 0.00 O ATOM 0 H SER A 269 -16.076 2.848 -5.531 1.00 0.00 H new ATOM 0 HA SER A 269 -15.069 4.733 -3.560 1.00 0.00 H new ATOM 0 HB2 SER A 269 -13.660 5.469 -5.360 1.00 0.00 H new ATOM 0 HB3 SER A 269 -13.664 3.716 -5.354 1.00 0.00 H new ATOM 0 HG SER A 269 -15.369 5.310 -7.024 1.00 0.00 H new ATOM 394 N ASN A 270 -17.145 6.134 -3.811 1.00 0.00 N ATOM 395 CA ASN A 270 -18.174 7.188 -3.832 1.00 0.00 C ATOM 396 C ASN A 270 -19.368 6.724 -3.013 1.00 0.00 C ATOM 397 O ASN A 270 -20.364 7.438 -2.890 1.00 0.00 O ATOM 398 CB ASN A 270 -18.650 7.542 -5.242 1.00 0.00 C ATOM 399 CG ASN A 270 -19.433 6.426 -5.903 1.00 0.00 C ATOM 400 OD1 ASN A 270 -20.562 6.127 -5.513 1.00 0.00 O ATOM 401 ND2 ASN A 270 -18.848 5.815 -6.925 1.00 0.00 N ATOM 0 H ASN A 270 -17.041 5.704 -2.892 1.00 0.00 H new ATOM 0 HA ASN A 270 -17.721 8.086 -3.412 1.00 0.00 H new ATOM 0 HB2 ASN A 270 -19.272 8.436 -5.195 1.00 0.00 H new ATOM 0 HB3 ASN A 270 -17.786 7.787 -5.860 1.00 0.00 H new ATOM 0 HD21 ASN A 270 -19.335 5.067 -7.419 1.00 0.00 H new ATOM 0 HD22 ASN A 270 -17.911 6.093 -7.217 1.00 0.00 H new ATOM 408 N MET A 271 -19.264 5.517 -2.458 1.00 0.00 N ATOM 409 CA MET A 271 -20.333 4.965 -1.643 1.00 0.00 C ATOM 410 C MET A 271 -19.808 3.919 -0.672 1.00 0.00 C ATOM 411 O MET A 271 -19.267 2.891 -1.079 1.00 0.00 O ATOM 412 CB MET A 271 -21.413 4.339 -2.526 1.00 0.00 C ATOM 413 CG MET A 271 -22.591 3.779 -1.740 1.00 0.00 C ATOM 414 SD MET A 271 -23.965 4.946 -1.577 1.00 0.00 S ATOM 415 CE MET A 271 -23.148 6.414 -0.945 1.00 0.00 C ATOM 0 H MET A 271 -18.452 4.909 -2.560 1.00 0.00 H new ATOM 0 HA MET A 271 -20.762 5.787 -1.070 1.00 0.00 H new ATOM 0 HB2 MET A 271 -21.778 5.090 -3.227 1.00 0.00 H new ATOM 0 HB3 MET A 271 -20.968 3.539 -3.118 1.00 0.00 H new ATOM 0 HG2 MET A 271 -22.949 2.874 -2.231 1.00 0.00 H new ATOM 0 HG3 MET A 271 -22.250 3.489 -0.746 1.00 0.00 H new ATOM 0 HE1 MET A 271 -23.891 7.090 -0.521 1.00 0.00 H new ATOM 0 HE2 MET A 271 -22.434 6.129 -0.173 1.00 0.00 H new ATOM 0 HE3 MET A 271 -22.623 6.916 -1.757 1.00 0.00 H new ATOM 425 N ASN A 272 -19.973 4.190 0.616 1.00 0.00 N ATOM 426 CA ASN A 272 -19.539 3.263 1.649 1.00 0.00 C ATOM 427 C ASN A 272 -20.652 2.260 1.923 1.00 0.00 C ATOM 428 O ASN A 272 -21.778 2.430 1.458 1.00 0.00 O ATOM 429 CB ASN A 272 -19.181 4.018 2.934 1.00 0.00 C ATOM 430 CG ASN A 272 -18.164 3.281 3.784 1.00 0.00 C ATOM 431 OD1 ASN A 272 -18.642 2.374 4.625 1.00 0.00 O flip ATOM 432 ND2 ASN A 272 -16.962 3.526 3.685 1.00 0.00 N flip ATOM 0 H ASN A 272 -20.404 5.044 0.969 1.00 0.00 H new ATOM 0 HA ASN A 272 -18.649 2.736 1.305 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -18.787 5.001 2.675 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -20.086 4.181 3.518 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -16.638 4.232 3.024 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -16.290 3.023 4.264 1.00 0.00 H new ATOM 439 N LYS A 273 -20.332 1.213 2.663 1.00 0.00 N ATOM 440 CA LYS A 273 -21.305 0.183 2.987 1.00 0.00 C ATOM 441 C LYS A 273 -21.518 0.089 4.486 1.00 0.00 C ATOM 442 O LYS A 273 -22.601 -0.263 4.954 1.00 0.00 O ATOM 443 CB LYS A 273 -20.823 -1.144 2.433 1.00 0.00 C ATOM 444 CG LYS A 273 -21.292 -1.386 1.033 1.00 0.00 C ATOM 445 CD LYS A 273 -22.376 -2.437 0.957 1.00 0.00 C ATOM 446 CE LYS A 273 -22.951 -2.499 -0.445 1.00 0.00 C ATOM 447 NZ LYS A 273 -23.154 -3.900 -0.905 1.00 0.00 N ATOM 0 H LYS A 273 -19.403 1.053 3.052 1.00 0.00 H new ATOM 0 HA LYS A 273 -22.263 0.441 2.535 1.00 0.00 H new ATOM 0 HB2 LYS A 273 -19.734 -1.170 2.457 1.00 0.00 H new ATOM 0 HB3 LYS A 273 -21.175 -1.951 3.075 1.00 0.00 H new ATOM 0 HG2 LYS A 273 -21.666 -0.452 0.612 1.00 0.00 H new ATOM 0 HG3 LYS A 273 -20.447 -1.696 0.419 1.00 0.00 H new ATOM 0 HD2 LYS A 273 -21.969 -3.410 1.234 1.00 0.00 H new ATOM 0 HD3 LYS A 273 -23.166 -2.207 1.672 1.00 0.00 H new ATOM 0 HE2 LYS A 273 -23.903 -1.968 -0.470 1.00 0.00 H new ATOM 0 HE3 LYS A 273 -22.281 -1.985 -1.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 -23.548 -3.896 -1.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 -22.242 -4.400 -0.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 -23.814 -4.384 -0.263 1.00 0.00 H new ATOM 461 N LYS A 274 -20.473 0.402 5.226 1.00 0.00 N ATOM 462 CA LYS A 274 -20.522 0.368 6.673 1.00 0.00 C ATOM 463 C LYS A 274 -20.870 1.752 7.222 1.00 0.00 C ATOM 464 O LYS A 274 -21.088 1.924 8.422 1.00 0.00 O ATOM 465 CB LYS A 274 -19.187 -0.145 7.207 1.00 0.00 C ATOM 466 CG LYS A 274 -18.879 -1.559 6.752 1.00 0.00 C ATOM 467 CD LYS A 274 -19.200 -2.583 7.828 1.00 0.00 C ATOM 468 CE LYS A 274 -18.771 -3.978 7.406 1.00 0.00 C ATOM 469 NZ LYS A 274 -18.958 -4.973 8.498 1.00 0.00 N ATOM 0 H LYS A 274 -19.571 0.685 4.843 1.00 0.00 H new ATOM 0 HA LYS A 274 -21.305 -0.313 7.007 1.00 0.00 H new ATOM 0 HB2 LYS A 274 -18.389 0.520 6.878 1.00 0.00 H new ATOM 0 HB3 LYS A 274 -19.200 -0.113 8.296 1.00 0.00 H new ATOM 0 HG2 LYS A 274 -19.453 -1.784 5.853 1.00 0.00 H new ATOM 0 HG3 LYS A 274 -17.825 -1.633 6.484 1.00 0.00 H new ATOM 0 HD2 LYS A 274 -18.696 -2.310 8.755 1.00 0.00 H new ATOM 0 HD3 LYS A 274 -20.271 -2.575 8.033 1.00 0.00 H new ATOM 0 HE2 LYS A 274 -19.346 -4.286 6.533 1.00 0.00 H new ATOM 0 HE3 LYS A 274 -17.723 -3.960 7.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 274 -18.653 -5.911 8.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 274 -18.389 -4.694 9.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 274 -19.962 -5.009 8.766 1.00 0.00 H new ATOM 483 N SER A 275 -20.913 2.736 6.320 1.00 0.00 N ATOM 484 CA SER A 275 -21.271 4.104 6.665 1.00 0.00 C ATOM 485 C SER A 275 -22.263 4.637 5.661 1.00 0.00 C ATOM 486 O SER A 275 -23.111 5.473 5.969 1.00 0.00 O ATOM 487 CB SER A 275 -20.055 5.020 6.649 1.00 0.00 C ATOM 488 OG SER A 275 -18.918 4.387 7.210 1.00 0.00 O ATOM 0 H SER A 275 -20.700 2.601 5.332 1.00 0.00 H new ATOM 0 HA SER A 275 -21.696 4.087 7.668 1.00 0.00 H new ATOM 0 HB2 SER A 275 -19.837 5.319 5.624 1.00 0.00 H new ATOM 0 HB3 SER A 275 -20.277 5.930 7.206 1.00 0.00 H new ATOM 0 HG SER A 275 -18.601 3.686 6.603 1.00 0.00 H new ATOM 494 N GLY A 276 -22.137 4.126 4.455 1.00 0.00 N ATOM 495 CA GLY A 276 -22.982 4.556 3.371 1.00 0.00 C ATOM 496 C GLY A 276 -22.543 5.895 2.843 1.00 0.00 C ATOM 497 O GLY A 276 -23.290 6.573 2.136 1.00 0.00 O ATOM 0 H GLY A 276 -21.455 3.411 4.204 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -22.954 3.818 2.569 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -24.015 4.617 3.713 1.00 0.00 H new ATOM 501 N ARG A 277 -21.320 6.274 3.191 1.00 0.00 N ATOM 502 CA ARG A 277 -20.780 7.557 2.756 1.00 0.00 C ATOM 503 C ARG A 277 -19.850 7.452 1.560 1.00 0.00 C ATOM 504 O ARG A 277 -19.174 6.455 1.339 1.00 0.00 O ATOM 505 CB ARG A 277 -20.012 8.284 3.859 1.00 0.00 C ATOM 506 CG ARG A 277 -20.688 8.336 5.210 1.00 0.00 C ATOM 507 CD ARG A 277 -22.156 8.640 5.064 1.00 0.00 C ATOM 508 NE ARG A 277 -22.944 8.144 6.189 1.00 0.00 N ATOM 509 CZ ARG A 277 -24.270 8.228 6.257 1.00 0.00 C ATOM 510 NH1 ARG A 277 -24.955 8.782 5.265 1.00 0.00 N ATOM 511 NH2 ARG A 277 -24.913 7.755 7.316 1.00 0.00 N ATOM 0 H ARG A 277 -20.688 5.718 3.767 1.00 0.00 H new ATOM 0 HA ARG A 277 -21.670 8.122 2.478 1.00 0.00 H new ATOM 0 HB2 ARG A 277 -19.042 7.802 3.978 1.00 0.00 H new ATOM 0 HB3 ARG A 277 -19.822 9.306 3.530 1.00 0.00 H new ATOM 0 HG2 ARG A 277 -20.559 7.383 5.723 1.00 0.00 H new ATOM 0 HG3 ARG A 277 -20.214 9.098 5.829 1.00 0.00 H new ATOM 0 HD2 ARG A 277 -22.294 9.718 4.975 1.00 0.00 H new ATOM 0 HD3 ARG A 277 -22.526 8.194 4.141 1.00 0.00 H new ATOM 0 HE ARG A 277 -22.449 7.708 6.967 1.00 0.00 H new ATOM 0 HH11 ARG A 277 -24.465 9.145 4.447 1.00 0.00 H new ATOM 0 HH12 ARG A 277 -25.972 8.845 5.320 1.00 0.00 H new ATOM 0 HH21 ARG A 277 -24.391 7.326 8.080 1.00 0.00 H new ATOM 0 HH22 ARG A 277 -25.930 7.820 7.366 1.00 0.00 H new ATOM 525 N PRO A 278 -19.808 8.538 0.794 1.00 0.00 N ATOM 526 CA PRO A 278 -18.958 8.666 -0.386 1.00 0.00 C ATOM 527 C PRO A 278 -17.478 8.647 -0.033 1.00 0.00 C ATOM 528 O PRO A 278 -17.033 9.386 0.845 1.00 0.00 O ATOM 529 CB PRO A 278 -19.323 10.032 -0.967 1.00 0.00 C ATOM 530 CG PRO A 278 -20.599 10.421 -0.307 1.00 0.00 C ATOM 531 CD PRO A 278 -20.638 9.717 1.022 1.00 0.00 C ATOM 0 HA PRO A 278 -19.116 7.837 -1.076 1.00 0.00 H new ATOM 0 HB2 PRO A 278 -18.540 10.764 -0.768 1.00 0.00 H new ATOM 0 HB3 PRO A 278 -19.442 9.978 -2.049 1.00 0.00 H new ATOM 0 HG2 PRO A 278 -20.650 11.502 -0.173 1.00 0.00 H new ATOM 0 HG3 PRO A 278 -21.453 10.135 -0.920 1.00 0.00 H new ATOM 0 HD2 PRO A 278 -20.240 10.342 1.822 1.00 0.00 H new ATOM 0 HD3 PRO A 278 -21.655 9.446 1.305 1.00 0.00 H new ATOM 539 N GLU A 279 -16.719 7.805 -0.719 1.00 0.00 N ATOM 540 CA GLU A 279 -15.290 7.707 -0.477 1.00 0.00 C ATOM 541 C GLU A 279 -14.542 7.480 -1.783 1.00 0.00 C ATOM 542 O GLU A 279 -14.885 8.049 -2.820 1.00 0.00 O ATOM 543 CB GLU A 279 -14.999 6.566 0.501 1.00 0.00 C ATOM 544 CG GLU A 279 -13.813 6.831 1.415 1.00 0.00 C ATOM 545 CD GLU A 279 -12.512 6.261 0.893 1.00 0.00 C ATOM 546 OE1 GLU A 279 -12.461 5.039 0.645 1.00 0.00 O ATOM 547 OE2 GLU A 279 -11.545 7.035 0.727 1.00 0.00 O ATOM 0 H GLU A 279 -17.070 7.181 -1.446 1.00 0.00 H new ATOM 0 HA GLU A 279 -14.947 8.645 -0.040 1.00 0.00 H new ATOM 0 HB2 GLU A 279 -15.884 6.388 1.112 1.00 0.00 H new ATOM 0 HB3 GLU A 279 -14.813 5.653 -0.065 1.00 0.00 H new ATOM 0 HG2 GLU A 279 -13.701 7.907 1.550 1.00 0.00 H new ATOM 0 HG3 GLU A 279 -14.019 6.406 2.397 1.00 0.00 H new ATOM 554 N GLU A 280 -13.522 6.643 -1.718 1.00 0.00 N ATOM 555 CA GLU A 280 -12.710 6.324 -2.887 1.00 0.00 C ATOM 556 C GLU A 280 -11.806 5.130 -2.612 1.00 0.00 C ATOM 557 O GLU A 280 -10.708 5.270 -2.074 1.00 0.00 O ATOM 558 CB GLU A 280 -11.868 7.524 -3.310 1.00 0.00 C ATOM 559 CG GLU A 280 -11.080 7.285 -4.588 1.00 0.00 C ATOM 560 CD GLU A 280 -11.934 7.418 -5.836 1.00 0.00 C ATOM 561 OE1 GLU A 280 -12.420 8.537 -6.105 1.00 0.00 O ATOM 562 OE2 GLU A 280 -12.116 6.404 -6.543 1.00 0.00 O ATOM 0 H GLU A 280 -13.232 6.167 -0.864 1.00 0.00 H new ATOM 0 HA GLU A 280 -13.389 6.069 -3.700 1.00 0.00 H new ATOM 0 HB2 GLU A 280 -12.521 8.386 -3.450 1.00 0.00 H new ATOM 0 HB3 GLU A 280 -11.176 7.775 -2.506 1.00 0.00 H new ATOM 0 HG2 GLU A 280 -10.255 7.996 -4.640 1.00 0.00 H new ATOM 0 HG3 GLU A 280 -10.640 6.288 -4.558 1.00 0.00 H new ATOM 569 N LEU A 281 -12.288 3.962 -2.997 1.00 0.00 N ATOM 570 CA LEU A 281 -11.559 2.708 -2.812 1.00 0.00 C ATOM 571 C LEU A 281 -10.206 2.714 -3.494 1.00 0.00 C ATOM 572 O LEU A 281 -9.835 3.661 -4.188 1.00 0.00 O ATOM 573 CB LEU A 281 -12.348 1.561 -3.399 1.00 0.00 C ATOM 574 CG LEU A 281 -13.839 1.742 -3.426 1.00 0.00 C ATOM 575 CD1 LEU A 281 -14.364 1.107 -4.685 1.00 0.00 C ATOM 576 CD2 LEU A 281 -14.469 1.127 -2.182 1.00 0.00 C ATOM 0 H LEU A 281 -13.196 3.850 -3.448 1.00 0.00 H new ATOM 0 HA LEU A 281 -11.417 2.594 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU A 281 -12.003 1.391 -4.419 1.00 0.00 H new ATOM 0 HB3 LEU A 281 -12.120 0.659 -2.831 1.00 0.00 H new ATOM 0 HG LEU A 281 -14.097 2.801 -3.423 1.00 0.00 H new ATOM 0 HD11 LEU A 281 -15.447 1.225 -4.728 1.00 0.00 H new ATOM 0 HD12 LEU A 281 -13.912 1.589 -5.552 1.00 0.00 H new ATOM 0 HD13 LEU A 281 -14.115 0.046 -4.689 1.00 0.00 H new ATOM 0 HD21 LEU A 281 -15.550 1.266 -2.215 1.00 0.00 H new ATOM 0 HD22 LEU A 281 -14.241 0.062 -2.147 1.00 0.00 H new ATOM 0 HD23 LEU A 281 -14.068 1.613 -1.293 1.00 0.00 H new ATOM 588 N VAL A 282 -9.478 1.627 -3.278 1.00 0.00 N ATOM 589 CA VAL A 282 -8.193 1.426 -3.903 1.00 0.00 C ATOM 590 C VAL A 282 -8.347 0.274 -4.851 1.00 0.00 C ATOM 591 O VAL A 282 -8.412 -0.865 -4.413 1.00 0.00 O ATOM 592 CB VAL A 282 -7.078 1.081 -2.909 1.00 0.00 C ATOM 593 CG1 VAL A 282 -5.908 1.962 -3.159 1.00 0.00 C ATOM 594 CG2 VAL A 282 -7.512 1.241 -1.482 1.00 0.00 C ATOM 0 H VAL A 282 -9.767 0.865 -2.664 1.00 0.00 H new ATOM 0 HA VAL A 282 -7.903 2.356 -4.392 1.00 0.00 H new ATOM 0 HB VAL A 282 -6.818 0.033 -3.062 1.00 0.00 H new ATOM 0 HG11 VAL A 282 -5.113 1.720 -2.454 1.00 0.00 H new ATOM 0 HG12 VAL A 282 -5.549 1.810 -4.177 1.00 0.00 H new ATOM 0 HG13 VAL A 282 -6.203 3.003 -3.030 1.00 0.00 H new ATOM 0 HG21 VAL A 282 -6.686 0.984 -0.819 1.00 0.00 H new ATOM 0 HG22 VAL A 282 -7.810 2.274 -1.306 1.00 0.00 H new ATOM 0 HG23 VAL A 282 -8.356 0.581 -1.282 1.00 0.00 H new ATOM 604 N SER A 283 -8.363 0.556 -6.141 1.00 0.00 N ATOM 605 CA SER A 283 -8.555 -0.495 -7.126 1.00 0.00 C ATOM 606 C SER A 283 -7.233 -1.032 -7.626 1.00 0.00 C ATOM 607 O SER A 283 -6.391 -0.291 -8.136 1.00 0.00 O ATOM 608 CB SER A 283 -9.398 -0.003 -8.298 1.00 0.00 C ATOM 609 OG SER A 283 -9.027 1.309 -8.685 1.00 0.00 O ATOM 0 H SER A 283 -8.247 1.492 -6.529 1.00 0.00 H new ATOM 0 HA SER A 283 -9.088 -1.307 -6.631 1.00 0.00 H new ATOM 0 HB2 SER A 283 -9.280 -0.681 -9.143 1.00 0.00 H new ATOM 0 HB3 SER A 283 -10.452 -0.018 -8.022 1.00 0.00 H new ATOM 0 HG SER A 283 -9.583 1.597 -9.439 1.00 0.00 H new ATOM 615 N CYS A 284 -7.064 -2.331 -7.474 1.00 0.00 N ATOM 616 CA CYS A 284 -5.858 -3.000 -7.908 1.00 0.00 C ATOM 617 C CYS A 284 -5.774 -2.977 -9.427 1.00 0.00 C ATOM 618 O CYS A 284 -6.785 -3.129 -10.114 1.00 0.00 O ATOM 619 CB CYS A 284 -5.881 -4.427 -7.369 1.00 0.00 C ATOM 620 SG CYS A 284 -4.511 -5.493 -7.905 1.00 0.00 S ATOM 0 H CYS A 284 -7.756 -2.948 -7.048 1.00 0.00 H new ATOM 0 HA CYS A 284 -4.974 -2.491 -7.524 1.00 0.00 H new ATOM 0 HB2 CYS A 284 -5.880 -4.385 -6.280 1.00 0.00 H new ATOM 0 HB3 CYS A 284 -6.819 -4.894 -7.669 1.00 0.00 H new ATOM 0 HG CYS A 284 -4.263 -6.377 -6.984 1.00 0.00 H new ATOM 625 N ALA A 285 -4.571 -2.790 -9.949 1.00 0.00 N ATOM 626 CA ALA A 285 -4.374 -2.736 -11.390 1.00 0.00 C ATOM 627 C ALA A 285 -3.985 -4.096 -11.936 1.00 0.00 C ATOM 628 O ALA A 285 -3.589 -4.224 -13.094 1.00 0.00 O ATOM 629 CB ALA A 285 -3.325 -1.696 -11.743 1.00 0.00 C ATOM 0 H ALA A 285 -3.720 -2.674 -9.399 1.00 0.00 H new ATOM 0 HA ALA A 285 -5.318 -2.446 -11.852 1.00 0.00 H new ATOM 0 HB1 ALA A 285 -3.190 -1.668 -12.824 1.00 0.00 H new ATOM 0 HB2 ALA A 285 -3.651 -0.717 -11.393 1.00 0.00 H new ATOM 0 HB3 ALA A 285 -2.380 -1.956 -11.266 1.00 0.00 H new ATOM 635 N ASP A 286 -4.103 -5.112 -11.092 1.00 0.00 N ATOM 636 CA ASP A 286 -3.770 -6.467 -11.491 1.00 0.00 C ATOM 637 C ASP A 286 -5.025 -7.333 -11.556 1.00 0.00 C ATOM 638 O ASP A 286 -5.367 -7.865 -12.613 1.00 0.00 O ATOM 639 CB ASP A 286 -2.759 -7.079 -10.523 1.00 0.00 C ATOM 640 CG ASP A 286 -2.292 -8.452 -10.967 1.00 0.00 C ATOM 641 OD1 ASP A 286 -3.021 -9.435 -10.718 1.00 0.00 O ATOM 642 OD2 ASP A 286 -1.200 -8.543 -11.565 1.00 0.00 O ATOM 0 H ASP A 286 -4.426 -5.021 -10.129 1.00 0.00 H new ATOM 0 HA ASP A 286 -3.323 -6.428 -12.484 1.00 0.00 H new ATOM 0 HB2 ASP A 286 -1.898 -6.416 -10.434 1.00 0.00 H new ATOM 0 HB3 ASP A 286 -3.208 -7.153 -9.532 1.00 0.00 H new ATOM 647 N CYS A 287 -5.713 -7.470 -10.421 1.00 0.00 N ATOM 648 CA CYS A 287 -6.934 -8.267 -10.367 1.00 0.00 C ATOM 649 C CYS A 287 -8.170 -7.365 -10.400 1.00 0.00 C ATOM 650 O CYS A 287 -9.127 -7.643 -11.123 1.00 0.00 O ATOM 651 CB CYS A 287 -6.935 -9.171 -9.129 1.00 0.00 C ATOM 652 SG CYS A 287 -7.001 -8.298 -7.532 1.00 0.00 S ATOM 0 H CYS A 287 -5.446 -7.042 -9.535 1.00 0.00 H new ATOM 0 HA CYS A 287 -6.968 -8.909 -11.247 1.00 0.00 H new ATOM 0 HB2 CYS A 287 -7.789 -9.845 -9.192 1.00 0.00 H new ATOM 0 HB3 CYS A 287 -6.038 -9.790 -9.150 1.00 0.00 H new ATOM 0 HG CYS A 287 -6.169 -7.299 -7.549 1.00 0.00 H new ATOM 657 N GLY A 288 -8.145 -6.286 -9.618 1.00 0.00 N ATOM 658 CA GLY A 288 -9.257 -5.346 -9.615 1.00 0.00 C ATOM 659 C GLY A 288 -9.996 -5.246 -8.292 1.00 0.00 C ATOM 660 O GLY A 288 -11.114 -4.733 -8.251 1.00 0.00 O ATOM 0 H GLY A 288 -7.379 -6.046 -8.989 1.00 0.00 H new ATOM 0 HA2 GLY A 288 -8.881 -4.358 -9.882 1.00 0.00 H new ATOM 0 HA3 GLY A 288 -9.965 -5.638 -10.391 1.00 0.00 H new ATOM 664 N ARG A 289 -9.391 -5.724 -7.211 1.00 0.00 N ATOM 665 CA ARG A 289 -10.034 -5.642 -5.903 1.00 0.00 C ATOM 666 C ARG A 289 -9.834 -4.248 -5.327 1.00 0.00 C ATOM 667 O ARG A 289 -8.726 -3.715 -5.362 1.00 0.00 O ATOM 668 CB ARG A 289 -9.475 -6.688 -4.940 1.00 0.00 C ATOM 669 CG ARG A 289 -10.479 -7.120 -3.886 1.00 0.00 C ATOM 670 CD ARG A 289 -9.843 -8.006 -2.829 1.00 0.00 C ATOM 671 NE ARG A 289 -9.495 -9.326 -3.349 1.00 0.00 N ATOM 672 CZ ARG A 289 -9.460 -10.427 -2.601 1.00 0.00 C ATOM 673 NH1 ARG A 289 -9.760 -10.366 -1.310 1.00 0.00 N ATOM 674 NH2 ARG A 289 -9.126 -11.589 -3.145 1.00 0.00 N ATOM 0 H ARG A 289 -8.472 -6.166 -7.211 1.00 0.00 H new ATOM 0 HA ARG A 289 -11.098 -5.841 -6.031 1.00 0.00 H new ATOM 0 HB2 ARG A 289 -9.154 -7.561 -5.507 1.00 0.00 H new ATOM 0 HB3 ARG A 289 -8.590 -6.285 -4.448 1.00 0.00 H new ATOM 0 HG2 ARG A 289 -10.908 -6.238 -3.410 1.00 0.00 H new ATOM 0 HG3 ARG A 289 -11.299 -7.656 -4.364 1.00 0.00 H new ATOM 0 HD2 ARG A 289 -8.946 -7.522 -2.444 1.00 0.00 H new ATOM 0 HD3 ARG A 289 -10.530 -8.118 -1.990 1.00 0.00 H new ATOM 0 HE ARG A 289 -9.266 -9.409 -4.340 1.00 0.00 H new ATOM 0 HH11 ARG A 289 -10.018 -9.474 -0.888 1.00 0.00 H new ATOM 0 HH12 ARG A 289 -9.732 -11.211 -0.740 1.00 0.00 H new ATOM 0 HH21 ARG A 289 -8.896 -11.640 -4.137 1.00 0.00 H new ATOM 0 HH22 ARG A 289 -9.099 -12.432 -2.571 1.00 0.00 H new ATOM 688 N SER A 290 -10.900 -3.652 -4.798 1.00 0.00 N ATOM 689 CA SER A 290 -10.795 -2.308 -4.246 1.00 0.00 C ATOM 690 C SER A 290 -10.922 -2.294 -2.725 1.00 0.00 C ATOM 691 O SER A 290 -11.397 -3.254 -2.125 1.00 0.00 O ATOM 692 CB SER A 290 -11.831 -1.380 -4.867 1.00 0.00 C ATOM 693 OG SER A 290 -11.764 -1.424 -6.280 1.00 0.00 O ATOM 0 H SER A 290 -11.829 -4.070 -4.741 1.00 0.00 H new ATOM 0 HA SER A 290 -9.798 -1.945 -4.496 1.00 0.00 H new ATOM 0 HB2 SER A 290 -12.829 -1.669 -4.537 1.00 0.00 H new ATOM 0 HB3 SER A 290 -11.664 -0.359 -4.522 1.00 0.00 H new ATOM 0 HG SER A 290 -12.040 -0.559 -6.648 1.00 0.00 H new ATOM 699 N GLY A 291 -10.474 -1.194 -2.111 1.00 0.00 N ATOM 700 CA GLY A 291 -10.545 -1.063 -0.658 1.00 0.00 C ATOM 701 C GLY A 291 -10.695 0.378 -0.187 1.00 0.00 C ATOM 702 O GLY A 291 -10.158 1.282 -0.789 1.00 0.00 O ATOM 0 H GLY A 291 -10.064 -0.393 -2.592 1.00 0.00 H new ATOM 0 HA2 GLY A 291 -11.388 -1.648 -0.289 1.00 0.00 H new ATOM 0 HA3 GLY A 291 -9.644 -1.489 -0.218 1.00 0.00 H new ATOM 706 N HIS A 292 -11.426 0.623 0.888 1.00 0.00 N ATOM 707 CA HIS A 292 -11.527 1.996 1.372 1.00 0.00 C ATOM 708 C HIS A 292 -10.215 2.290 2.081 1.00 0.00 C ATOM 709 O HIS A 292 -9.900 1.587 3.035 1.00 0.00 O ATOM 710 CB HIS A 292 -12.663 2.157 2.383 1.00 0.00 C ATOM 711 CG HIS A 292 -14.060 2.224 1.812 1.00 0.00 C ATOM 712 ND1 HIS A 292 -14.629 2.970 0.830 1.00 0.00 N flip ATOM 713 CD2 HIS A 292 -15.038 1.381 2.255 1.00 0.00 C flip ATOM 714 CE1 HIS A 292 -15.933 2.551 0.713 1.00 0.00 C flip ATOM 715 NE2 HIS A 292 -16.152 1.582 1.582 1.00 0.00 N flip ATOM 0 H HIS A 292 -11.940 -0.075 1.425 1.00 0.00 H new ATOM 0 HA HIS A 292 -11.726 2.669 0.538 1.00 0.00 H new ATOM 0 HB2 HIS A 292 -12.619 1.323 3.083 1.00 0.00 H new ATOM 0 HB3 HIS A 292 -12.484 3.066 2.958 1.00 0.00 H new ATOM 0 HD1 HIS A 292 -14.175 3.702 0.283 1.00 0.00 H new ATOM 0 HD2 HIS A 292 -14.916 0.654 3.044 1.00 0.00 H new ATOM 0 HE1 HIS A 292 -16.661 2.950 0.022 1.00 0.00 H new ATOM 723 N PRO A 293 -9.420 3.299 1.683 1.00 0.00 N ATOM 724 CA PRO A 293 -8.138 3.544 2.352 1.00 0.00 C ATOM 725 C PRO A 293 -8.255 3.541 3.876 1.00 0.00 C ATOM 726 O PRO A 293 -7.463 2.890 4.566 1.00 0.00 O ATOM 727 CB PRO A 293 -7.736 4.907 1.809 1.00 0.00 C ATOM 728 CG PRO A 293 -8.298 4.906 0.431 1.00 0.00 C ATOM 729 CD PRO A 293 -9.630 4.233 0.547 1.00 0.00 C ATOM 0 HA PRO A 293 -7.402 2.765 2.155 1.00 0.00 H new ATOM 0 HB2 PRO A 293 -8.148 5.717 2.411 1.00 0.00 H new ATOM 0 HB3 PRO A 293 -6.653 5.034 1.802 1.00 0.00 H new ATOM 0 HG2 PRO A 293 -8.403 5.921 0.048 1.00 0.00 H new ATOM 0 HG3 PRO A 293 -7.646 4.371 -0.259 1.00 0.00 H new ATOM 0 HD2 PRO A 293 -10.429 4.946 0.750 1.00 0.00 H new ATOM 0 HD3 PRO A 293 -9.899 3.705 -0.368 1.00 0.00 H new ATOM 737 N THR A 294 -9.254 4.242 4.403 1.00 0.00 N ATOM 738 CA THR A 294 -9.463 4.276 5.845 1.00 0.00 C ATOM 739 C THR A 294 -9.673 2.864 6.381 1.00 0.00 C ATOM 740 O THR A 294 -9.360 2.569 7.534 1.00 0.00 O ATOM 741 CB THR A 294 -10.672 5.149 6.225 1.00 0.00 C ATOM 742 OG1 THR A 294 -11.823 4.762 5.468 1.00 0.00 O ATOM 743 CG2 THR A 294 -10.366 6.615 5.986 1.00 0.00 C ATOM 0 H THR A 294 -9.924 4.788 3.861 1.00 0.00 H new ATOM 0 HA THR A 294 -8.570 4.713 6.292 1.00 0.00 H new ATOM 0 HB THR A 294 -10.880 5.003 7.285 1.00 0.00 H new ATOM 0 HG1 THR A 294 -12.585 5.324 5.721 1.00 0.00 H new ATOM 0 HG21 THR A 294 -11.232 7.217 6.260 1.00 0.00 H new ATOM 0 HG22 THR A 294 -9.511 6.912 6.593 1.00 0.00 H new ATOM 0 HG23 THR A 294 -10.135 6.771 4.932 1.00 0.00 H new ATOM 751 N CYS A 295 -10.210 1.995 5.524 1.00 0.00 N ATOM 752 CA CYS A 295 -10.459 0.602 5.883 1.00 0.00 C ATOM 753 C CYS A 295 -9.170 -0.214 5.860 1.00 0.00 C ATOM 754 O CYS A 295 -8.963 -1.074 6.716 1.00 0.00 O ATOM 755 CB CYS A 295 -11.514 -0.008 4.952 1.00 0.00 C ATOM 756 SG CYS A 295 -13.160 0.703 5.198 1.00 0.00 S ATOM 0 H CYS A 295 -10.482 2.235 4.571 1.00 0.00 H new ATOM 0 HA CYS A 295 -10.844 0.577 6.903 1.00 0.00 H new ATOM 0 HB2 CYS A 295 -11.209 0.143 3.916 1.00 0.00 H new ATOM 0 HB3 CYS A 295 -11.560 -1.084 5.118 1.00 0.00 H new ATOM 0 HG CYS A 295 -14.064 -0.191 4.927 1.00 0.00 H new ATOM 761 N LEU A 296 -8.303 0.050 4.882 1.00 0.00 N ATOM 762 CA LEU A 296 -7.029 -0.670 4.802 1.00 0.00 C ATOM 763 C LEU A 296 -6.001 -0.021 5.716 1.00 0.00 C ATOM 764 O LEU A 296 -4.816 -0.344 5.647 1.00 0.00 O ATOM 765 CB LEU A 296 -6.460 -0.681 3.388 1.00 0.00 C ATOM 766 CG LEU A 296 -7.449 -0.955 2.270 1.00 0.00 C ATOM 767 CD1 LEU A 296 -7.734 0.329 1.529 1.00 0.00 C ATOM 768 CD2 LEU A 296 -6.901 -2.002 1.319 1.00 0.00 C ATOM 0 H LEU A 296 -8.453 0.742 4.148 1.00 0.00 H new ATOM 0 HA LEU A 296 -7.232 -1.696 5.109 1.00 0.00 H new ATOM 0 HB2 LEU A 296 -5.990 0.284 3.200 1.00 0.00 H new ATOM 0 HB3 LEU A 296 -5.673 -1.434 3.341 1.00 0.00 H new ATOM 0 HG LEU A 296 -8.375 -1.338 2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 296 -8.444 0.135 0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 296 -8.156 1.061 2.218 1.00 0.00 H new ATOM 0 HD13 LEU A 296 -6.807 0.720 1.108 1.00 0.00 H new ATOM 0 HD21 LEU A 296 -7.624 -2.185 0.524 1.00 0.00 H new ATOM 0 HD22 LEU A 296 -5.967 -1.646 0.885 1.00 0.00 H new ATOM 0 HD23 LEU A 296 -6.718 -2.928 1.864 1.00 0.00 H new ATOM 780 N GLN A 297 -6.473 0.912 6.546 1.00 0.00 N ATOM 781 CA GLN A 297 -5.622 1.666 7.468 1.00 0.00 C ATOM 782 C GLN A 297 -4.946 2.785 6.701 1.00 0.00 C ATOM 783 O GLN A 297 -5.202 3.964 6.949 1.00 0.00 O ATOM 784 CB GLN A 297 -4.571 0.792 8.159 1.00 0.00 C ATOM 785 CG GLN A 297 -5.137 -0.030 9.286 1.00 0.00 C ATOM 786 CD GLN A 297 -4.088 -0.844 10.031 1.00 0.00 C ATOM 787 OE1 GLN A 297 -2.963 -1.134 9.377 1.00 0.00 O flip ATOM 788 NE2 GLN A 297 -4.280 -1.194 11.195 1.00 0.00 N flip ATOM 0 H GLN A 297 -7.459 1.166 6.597 1.00 0.00 H new ATOM 0 HA GLN A 297 -6.257 2.067 8.258 1.00 0.00 H new ATOM 0 HB2 GLN A 297 -4.119 0.127 7.423 1.00 0.00 H new ATOM 0 HB3 GLN A 297 -3.775 1.428 8.545 1.00 0.00 H new ATOM 0 HG2 GLN A 297 -5.640 0.632 9.991 1.00 0.00 H new ATOM 0 HG3 GLN A 297 -5.894 -0.706 8.888 1.00 0.00 H new ATOM 0 HE21 GLN A 297 -5.154 -0.953 11.662 1.00 0.00 H new ATOM 0 HE22 GLN A 297 -3.565 -1.725 11.692 1.00 0.00 H new ATOM 797 N PHE A 298 -4.109 2.384 5.745 1.00 0.00 N ATOM 798 CA PHE A 298 -3.378 3.309 4.881 1.00 0.00 C ATOM 799 C PHE A 298 -3.116 4.658 5.558 1.00 0.00 C ATOM 800 O PHE A 298 -2.863 4.735 6.760 1.00 0.00 O ATOM 801 CB PHE A 298 -4.173 3.522 3.585 1.00 0.00 C ATOM 802 CG PHE A 298 -4.159 2.352 2.623 1.00 0.00 C ATOM 803 CD1 PHE A 298 -3.552 1.147 2.955 1.00 0.00 C ATOM 804 CD2 PHE A 298 -4.735 2.478 1.365 1.00 0.00 C ATOM 805 CE1 PHE A 298 -3.524 0.098 2.054 1.00 0.00 C ATOM 806 CE2 PHE A 298 -4.701 1.436 0.462 1.00 0.00 C ATOM 807 CZ PHE A 298 -4.097 0.247 0.804 1.00 0.00 C ATOM 0 H PHE A 298 -3.918 1.402 5.547 1.00 0.00 H new ATOM 0 HA PHE A 298 -2.406 2.866 4.664 1.00 0.00 H new ATOM 0 HB2 PHE A 298 -5.208 3.747 3.844 1.00 0.00 H new ATOM 0 HB3 PHE A 298 -3.775 4.398 3.073 1.00 0.00 H new ATOM 0 HD1 PHE A 298 -3.097 1.028 3.927 1.00 0.00 H new ATOM 0 HD2 PHE A 298 -5.216 3.405 1.090 1.00 0.00 H new ATOM 0 HE1 PHE A 298 -3.055 -0.836 2.326 1.00 0.00 H new ATOM 0 HE2 PHE A 298 -5.148 1.553 -0.514 1.00 0.00 H new ATOM 0 HZ PHE A 298 -4.071 -0.569 0.097 1.00 0.00 H new ATOM 817 N THR A 299 -3.154 5.710 4.751 1.00 0.00 N ATOM 818 CA THR A 299 -2.952 7.070 5.215 1.00 0.00 C ATOM 819 C THR A 299 -3.326 8.030 4.100 1.00 0.00 C ATOM 820 O THR A 299 -3.511 7.607 2.964 1.00 0.00 O ATOM 821 CB THR A 299 -1.505 7.327 5.653 1.00 0.00 C ATOM 822 OG1 THR A 299 -1.371 8.667 6.141 1.00 0.00 O ATOM 823 CG2 THR A 299 -0.540 7.102 4.503 1.00 0.00 C ATOM 0 H THR A 299 -3.328 5.639 3.748 1.00 0.00 H new ATOM 0 HA THR A 299 -3.586 7.226 6.088 1.00 0.00 H new ATOM 0 HB THR A 299 -1.262 6.624 6.450 1.00 0.00 H new ATOM 0 HG1 THR A 299 -0.445 8.822 6.420 1.00 0.00 H new ATOM 0 HG21 THR A 299 0.479 7.291 4.841 1.00 0.00 H new ATOM 0 HG22 THR A 299 -0.622 6.072 4.155 1.00 0.00 H new ATOM 0 HG23 THR A 299 -0.783 7.781 3.686 1.00 0.00 H new ATOM 831 N LEU A 300 -3.431 9.310 4.409 1.00 0.00 N ATOM 832 CA LEU A 300 -3.807 10.293 3.401 1.00 0.00 C ATOM 833 C LEU A 300 -2.904 10.219 2.172 1.00 0.00 C ATOM 834 O LEU A 300 -3.395 10.054 1.059 1.00 0.00 O ATOM 835 CB LEU A 300 -3.795 11.700 4.003 1.00 0.00 C ATOM 836 CG LEU A 300 -4.665 12.730 3.275 1.00 0.00 C ATOM 837 CD1 LEU A 300 -4.000 13.164 1.990 1.00 0.00 C ATOM 838 CD2 LEU A 300 -6.043 12.168 2.983 1.00 0.00 C ATOM 0 H LEU A 300 -3.264 9.693 5.339 1.00 0.00 H new ATOM 0 HA LEU A 300 -4.819 10.061 3.070 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -4.126 11.637 5.040 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -2.767 12.062 4.018 1.00 0.00 H new ATOM 0 HG LEU A 300 -4.779 13.596 3.927 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -4.630 13.896 1.484 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -3.032 13.612 2.215 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -3.858 12.298 1.343 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -6.640 12.919 2.466 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -5.949 11.283 2.354 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -6.531 11.897 3.919 1.00 0.00 H new ATOM 850 N ASN A 301 -1.593 10.312 2.366 1.00 0.00 N ATOM 851 CA ASN A 301 -0.660 10.272 1.239 1.00 0.00 C ATOM 852 C ASN A 301 -0.818 8.994 0.415 1.00 0.00 C ATOM 853 O ASN A 301 -0.958 9.067 -0.800 1.00 0.00 O ATOM 854 CB ASN A 301 0.783 10.402 1.726 1.00 0.00 C ATOM 855 CG ASN A 301 1.128 11.789 2.235 1.00 0.00 C ATOM 856 OD1 ASN A 301 0.244 12.577 2.571 1.00 0.00 O ATOM 857 ND2 ASN A 301 2.427 12.090 2.309 1.00 0.00 N ATOM 0 H ASN A 301 -1.153 10.415 3.281 1.00 0.00 H new ATOM 0 HA ASN A 301 -0.898 11.119 0.596 1.00 0.00 H new ATOM 0 HB2 ASN A 301 0.956 9.678 2.522 1.00 0.00 H new ATOM 0 HB3 ASN A 301 1.458 10.145 0.910 1.00 0.00 H new ATOM 0 HD21 ASN A 301 2.720 13.004 2.655 1.00 0.00 H new ATOM 0 HD22 ASN A 301 3.126 11.406 2.020 1.00 0.00 H new ATOM 864 N MET A 302 -0.775 7.825 1.063 1.00 0.00 N ATOM 865 CA MET A 302 -0.939 6.558 0.341 1.00 0.00 C ATOM 866 C MET A 302 -2.224 6.574 -0.412 1.00 0.00 C ATOM 867 O MET A 302 -2.272 6.222 -1.580 1.00 0.00 O ATOM 868 CB MET A 302 -0.951 5.356 1.294 1.00 0.00 C ATOM 869 CG MET A 302 -2.164 4.446 1.145 1.00 0.00 C ATOM 870 SD MET A 302 -1.993 3.242 -0.171 1.00 0.00 S ATOM 871 CE MET A 302 -1.060 1.969 0.660 1.00 0.00 C ATOM 0 H MET A 302 -0.631 7.729 2.068 1.00 0.00 H new ATOM 0 HA MET A 302 -0.092 6.457 -0.337 1.00 0.00 H new ATOM 0 HB2 MET A 302 -0.048 4.768 1.129 1.00 0.00 H new ATOM 0 HB3 MET A 302 -0.910 5.721 2.320 1.00 0.00 H new ATOM 0 HG2 MET A 302 -2.334 3.923 2.086 1.00 0.00 H new ATOM 0 HG3 MET A 302 -3.046 5.057 0.956 1.00 0.00 H new ATOM 0 HE1 MET A 302 -1.374 0.991 0.295 1.00 0.00 H new ATOM 0 HE2 MET A 302 0.002 2.107 0.459 1.00 0.00 H new ATOM 0 HE3 MET A 302 -1.237 2.030 1.734 1.00 0.00 H new ATOM 881 N THR A 303 -3.257 7.002 0.274 1.00 0.00 N ATOM 882 CA THR A 303 -4.563 7.045 -0.310 1.00 0.00 C ATOM 883 C THR A 303 -4.484 7.798 -1.618 1.00 0.00 C ATOM 884 O THR A 303 -4.756 7.242 -2.669 1.00 0.00 O ATOM 885 CB THR A 303 -5.565 7.732 0.630 1.00 0.00 C ATOM 886 OG1 THR A 303 -5.670 7.009 1.859 1.00 0.00 O ATOM 887 CG2 THR A 303 -6.922 7.831 -0.017 1.00 0.00 C ATOM 0 H THR A 303 -3.211 7.325 1.240 1.00 0.00 H new ATOM 0 HA THR A 303 -4.911 6.026 -0.482 1.00 0.00 H new ATOM 0 HB THR A 303 -5.200 8.738 0.836 1.00 0.00 H new ATOM 0 HG1 THR A 303 -5.089 7.421 2.532 1.00 0.00 H new ATOM 0 HG21 THR A 303 -7.616 8.321 0.666 1.00 0.00 H new ATOM 0 HG22 THR A 303 -6.846 8.413 -0.935 1.00 0.00 H new ATOM 0 HG23 THR A 303 -7.288 6.831 -0.250 1.00 0.00 H new ATOM 895 N GLU A 304 -4.015 9.034 -1.559 1.00 0.00 N ATOM 896 CA GLU A 304 -3.899 9.855 -2.752 1.00 0.00 C ATOM 897 C GLU A 304 -3.021 9.176 -3.807 1.00 0.00 C ATOM 898 O GLU A 304 -3.370 9.130 -4.987 1.00 0.00 O ATOM 899 CB GLU A 304 -3.286 11.214 -2.414 1.00 0.00 C ATOM 900 CG GLU A 304 -3.940 11.909 -1.244 1.00 0.00 C ATOM 901 CD GLU A 304 -3.590 13.382 -1.172 1.00 0.00 C ATOM 902 OE1 GLU A 304 -2.495 13.709 -0.668 1.00 0.00 O ATOM 903 OE2 GLU A 304 -4.412 14.209 -1.620 1.00 0.00 O ATOM 0 H GLU A 304 -3.709 9.490 -0.699 1.00 0.00 H new ATOM 0 HA GLU A 304 -4.905 9.989 -3.149 1.00 0.00 H new ATOM 0 HB2 GLU A 304 -2.226 11.079 -2.197 1.00 0.00 H new ATOM 0 HB3 GLU A 304 -3.353 11.859 -3.290 1.00 0.00 H new ATOM 0 HG2 GLU A 304 -5.022 11.800 -1.319 1.00 0.00 H new ATOM 0 HG3 GLU A 304 -3.634 11.421 -0.319 1.00 0.00 H new ATOM 910 N ALA A 305 -1.874 8.654 -3.363 1.00 0.00 N ATOM 911 CA ALA A 305 -0.924 7.991 -4.255 1.00 0.00 C ATOM 912 C ALA A 305 -1.615 6.910 -5.055 1.00 0.00 C ATOM 913 O ALA A 305 -1.652 6.941 -6.283 1.00 0.00 O ATOM 914 CB ALA A 305 0.243 7.396 -3.454 1.00 0.00 C ATOM 0 H ALA A 305 -1.582 8.679 -2.386 1.00 0.00 H new ATOM 0 HA ALA A 305 -0.527 8.735 -4.946 1.00 0.00 H new ATOM 0 HB1 ALA A 305 0.940 6.907 -4.135 1.00 0.00 H new ATOM 0 HB2 ALA A 305 0.759 8.192 -2.917 1.00 0.00 H new ATOM 0 HB3 ALA A 305 -0.140 6.666 -2.741 1.00 0.00 H new ATOM 920 N VAL A 306 -2.179 5.975 -4.324 1.00 0.00 N ATOM 921 CA VAL A 306 -2.884 4.848 -4.885 1.00 0.00 C ATOM 922 C VAL A 306 -4.169 5.254 -5.584 1.00 0.00 C ATOM 923 O VAL A 306 -4.701 4.504 -6.403 1.00 0.00 O ATOM 924 CB VAL A 306 -3.198 3.853 -3.785 1.00 0.00 C ATOM 925 CG1 VAL A 306 -1.925 3.453 -3.096 1.00 0.00 C ATOM 926 CG2 VAL A 306 -4.195 4.430 -2.802 1.00 0.00 C ATOM 0 H VAL A 306 -2.159 5.978 -3.304 1.00 0.00 H new ATOM 0 HA VAL A 306 -2.235 4.397 -5.636 1.00 0.00 H new ATOM 0 HB VAL A 306 -3.654 2.966 -4.225 1.00 0.00 H new ATOM 0 HG11 VAL A 306 -2.149 2.738 -2.305 1.00 0.00 H new ATOM 0 HG12 VAL A 306 -1.249 2.996 -3.818 1.00 0.00 H new ATOM 0 HG13 VAL A 306 -1.452 4.335 -2.664 1.00 0.00 H new ATOM 0 HG21 VAL A 306 -4.404 3.697 -2.023 1.00 0.00 H new ATOM 0 HG22 VAL A 306 -3.781 5.332 -2.351 1.00 0.00 H new ATOM 0 HG23 VAL A 306 -5.119 4.677 -3.324 1.00 0.00 H new ATOM 936 N LYS A 307 -4.668 6.438 -5.262 1.00 0.00 N ATOM 937 CA LYS A 307 -5.898 6.915 -5.865 1.00 0.00 C ATOM 938 C LYS A 307 -5.692 7.163 -7.347 1.00 0.00 C ATOM 939 O LYS A 307 -6.542 6.838 -8.176 1.00 0.00 O ATOM 940 CB LYS A 307 -6.358 8.218 -5.221 1.00 0.00 C ATOM 941 CG LYS A 307 -7.097 8.031 -3.927 1.00 0.00 C ATOM 942 CD LYS A 307 -7.801 9.297 -3.509 1.00 0.00 C ATOM 943 CE LYS A 307 -8.726 8.985 -2.373 1.00 0.00 C ATOM 944 NZ LYS A 307 -10.028 9.698 -2.487 1.00 0.00 N ATOM 0 H LYS A 307 -4.243 7.079 -4.592 1.00 0.00 H new ATOM 0 HA LYS A 307 -6.657 6.148 -5.710 1.00 0.00 H new ATOM 0 HB2 LYS A 307 -5.488 8.850 -5.043 1.00 0.00 H new ATOM 0 HB3 LYS A 307 -7.001 8.751 -5.922 1.00 0.00 H new ATOM 0 HG2 LYS A 307 -7.825 7.227 -4.035 1.00 0.00 H new ATOM 0 HG3 LYS A 307 -6.398 7.727 -3.148 1.00 0.00 H new ATOM 0 HD2 LYS A 307 -7.074 10.051 -3.207 1.00 0.00 H new ATOM 0 HD3 LYS A 307 -8.360 9.712 -4.348 1.00 0.00 H new ATOM 0 HE2 LYS A 307 -8.905 7.910 -2.339 1.00 0.00 H new ATOM 0 HE3 LYS A 307 -8.247 9.258 -1.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 307 -10.707 9.290 -1.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 307 -9.891 10.707 -2.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 307 -10.396 9.596 -3.454 1.00 0.00 H new ATOM 958 N THR A 308 -4.543 7.746 -7.662 1.00 0.00 N ATOM 959 CA THR A 308 -4.204 8.083 -9.038 1.00 0.00 C ATOM 960 C THR A 308 -3.409 6.995 -9.768 1.00 0.00 C ATOM 961 O THR A 308 -3.579 6.831 -10.977 1.00 0.00 O ATOM 962 CB THR A 308 -3.411 9.401 -9.103 1.00 0.00 C ATOM 963 OG1 THR A 308 -2.867 9.585 -10.417 1.00 0.00 O ATOM 964 CG2 THR A 308 -2.290 9.413 -8.076 1.00 0.00 C ATOM 0 H THR A 308 -3.827 7.996 -6.980 1.00 0.00 H new ATOM 0 HA THR A 308 -5.162 8.185 -9.548 1.00 0.00 H new ATOM 0 HB THR A 308 -4.095 10.219 -8.877 1.00 0.00 H new ATOM 0 HG1 THR A 308 -2.366 10.427 -10.449 1.00 0.00 H new ATOM 0 HG21 THR A 308 -1.745 10.355 -8.143 1.00 0.00 H new ATOM 0 HG22 THR A 308 -2.711 9.308 -7.076 1.00 0.00 H new ATOM 0 HG23 THR A 308 -1.608 8.585 -8.272 1.00 0.00 H new ATOM 972 N TYR A 309 -2.547 6.246 -9.070 1.00 0.00 N ATOM 973 CA TYR A 309 -1.752 5.227 -9.762 1.00 0.00 C ATOM 974 C TYR A 309 -2.221 3.789 -9.490 1.00 0.00 C ATOM 975 O TYR A 309 -3.316 3.561 -8.974 1.00 0.00 O ATOM 976 CB TYR A 309 -0.249 5.426 -9.491 1.00 0.00 C ATOM 977 CG TYR A 309 0.356 4.526 -8.442 1.00 0.00 C ATOM 978 CD1 TYR A 309 -0.156 4.492 -7.164 1.00 0.00 C ATOM 979 CD2 TYR A 309 1.457 3.729 -8.734 1.00 0.00 C ATOM 980 CE1 TYR A 309 0.405 3.687 -6.192 1.00 0.00 C ATOM 981 CE2 TYR A 309 2.023 2.916 -7.772 1.00 0.00 C ATOM 982 CZ TYR A 309 1.493 2.900 -6.501 1.00 0.00 C ATOM 983 OH TYR A 309 2.053 2.096 -5.536 1.00 0.00 O ATOM 0 H TYR A 309 -2.386 6.320 -8.066 1.00 0.00 H new ATOM 0 HA TYR A 309 -1.918 5.371 -10.830 1.00 0.00 H new ATOM 0 HB2 TYR A 309 0.292 5.277 -10.426 1.00 0.00 H new ATOM 0 HB3 TYR A 309 -0.088 6.461 -9.191 1.00 0.00 H new ATOM 0 HD1 TYR A 309 -1.010 5.105 -6.918 1.00 0.00 H new ATOM 0 HD2 TYR A 309 1.876 3.746 -9.729 1.00 0.00 H new ATOM 0 HE1 TYR A 309 -0.007 3.674 -5.194 1.00 0.00 H new ATOM 0 HE2 TYR A 309 2.875 2.298 -8.014 1.00 0.00 H new ATOM 0 HH TYR A 309 1.702 2.348 -4.656 1.00 0.00 H new ATOM 993 N LYS A 310 -1.367 2.831 -9.849 1.00 0.00 N ATOM 994 CA LYS A 310 -1.662 1.400 -9.742 1.00 0.00 C ATOM 995 C LYS A 310 -2.024 0.941 -8.332 1.00 0.00 C ATOM 996 O LYS A 310 -3.174 0.591 -8.066 1.00 0.00 O ATOM 997 CB LYS A 310 -0.466 0.599 -10.233 1.00 0.00 C ATOM 998 CG LYS A 310 -0.062 0.920 -11.643 1.00 0.00 C ATOM 999 CD LYS A 310 -0.657 -0.064 -12.623 1.00 0.00 C ATOM 1000 CE LYS A 310 -0.099 0.130 -14.014 1.00 0.00 C ATOM 1001 NZ LYS A 310 1.365 -0.132 -14.073 1.00 0.00 N ATOM 0 H LYS A 310 -0.440 3.028 -10.227 1.00 0.00 H new ATOM 0 HA LYS A 310 -2.542 1.225 -10.361 1.00 0.00 H new ATOM 0 HB2 LYS A 310 0.380 0.784 -9.571 1.00 0.00 H new ATOM 0 HB3 LYS A 310 -0.699 -0.464 -10.164 1.00 0.00 H new ATOM 0 HG2 LYS A 310 -0.387 1.929 -11.896 1.00 0.00 H new ATOM 0 HG3 LYS A 310 1.025 0.905 -11.724 1.00 0.00 H new ATOM 0 HD2 LYS A 310 -0.454 -1.081 -12.287 1.00 0.00 H new ATOM 0 HD3 LYS A 310 -1.740 0.054 -12.645 1.00 0.00 H new ATOM 0 HE2 LYS A 310 -0.614 -0.536 -14.707 1.00 0.00 H new ATOM 0 HE3 LYS A 310 -0.298 1.149 -14.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 310 1.647 -0.305 -15.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 310 1.880 0.693 -13.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 310 1.592 -0.967 -13.496 1.00 0.00 H new ATOM 1015 N TRP A 311 -1.024 0.931 -7.450 1.00 0.00 N ATOM 1016 CA TRP A 311 -1.180 0.468 -6.067 1.00 0.00 C ATOM 1017 C TRP A 311 -1.149 -1.054 -6.026 1.00 0.00 C ATOM 1018 O TRP A 311 -0.461 -1.633 -5.191 1.00 0.00 O ATOM 1019 CB TRP A 311 -2.452 1.030 -5.396 1.00 0.00 C ATOM 1020 CG TRP A 311 -2.932 0.262 -4.198 1.00 0.00 C ATOM 1021 CD1 TRP A 311 -2.446 0.351 -2.932 1.00 0.00 C ATOM 1022 CD2 TRP A 311 -4.008 -0.686 -4.141 1.00 0.00 C ATOM 1023 NE1 TRP A 311 -3.148 -0.458 -2.089 1.00 0.00 N ATOM 1024 CE2 TRP A 311 -4.109 -1.108 -2.801 1.00 0.00 C ATOM 1025 CE3 TRP A 311 -4.899 -1.221 -5.078 1.00 0.00 C ATOM 1026 CZ2 TRP A 311 -5.055 -2.020 -2.374 1.00 0.00 C ATOM 1027 CZ3 TRP A 311 -5.841 -2.139 -4.647 1.00 0.00 C ATOM 1028 CH2 TRP A 311 -5.915 -2.526 -3.305 1.00 0.00 C ATOM 0 H TRP A 311 -0.079 1.244 -7.673 1.00 0.00 H new ATOM 0 HA TRP A 311 -0.341 0.853 -5.488 1.00 0.00 H new ATOM 0 HB2 TRP A 311 -2.261 2.060 -5.095 1.00 0.00 H new ATOM 0 HB3 TRP A 311 -3.252 1.057 -6.135 1.00 0.00 H new ATOM 0 HD1 TRP A 311 -1.617 0.977 -2.635 1.00 0.00 H new ATOM 0 HE1 TRP A 311 -2.981 -0.560 -1.088 1.00 0.00 H new ATOM 0 HE3 TRP A 311 -4.853 -0.924 -6.115 1.00 0.00 H new ATOM 0 HZ2 TRP A 311 -5.112 -2.322 -1.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 311 -6.532 -2.564 -5.360 1.00 0.00 H new ATOM 0 HH2 TRP A 311 -6.667 -3.239 -3.000 1.00 0.00 H new ATOM 1039 N GLN A 312 -1.862 -1.691 -6.959 1.00 0.00 N ATOM 1040 CA GLN A 312 -1.915 -3.152 -7.044 1.00 0.00 C ATOM 1041 C GLN A 312 -2.104 -3.775 -5.671 1.00 0.00 C ATOM 1042 O GLN A 312 -1.163 -3.837 -4.880 1.00 0.00 O ATOM 1043 CB GLN A 312 -0.634 -3.705 -7.677 1.00 0.00 C ATOM 1044 CG GLN A 312 -0.163 -2.923 -8.891 1.00 0.00 C ATOM 1045 CD GLN A 312 1.141 -2.191 -8.640 1.00 0.00 C ATOM 1046 OE1 GLN A 312 1.147 -1.045 -8.191 1.00 0.00 O ATOM 1047 NE2 GLN A 312 2.256 -2.852 -8.930 1.00 0.00 N ATOM 0 H GLN A 312 -2.414 -1.213 -7.671 1.00 0.00 H new ATOM 0 HA GLN A 312 -2.769 -3.411 -7.670 1.00 0.00 H new ATOM 0 HB2 GLN A 312 0.158 -3.708 -6.928 1.00 0.00 H new ATOM 0 HB3 GLN A 312 -0.802 -4.742 -7.967 1.00 0.00 H new ATOM 0 HG2 GLN A 312 -0.037 -3.605 -9.732 1.00 0.00 H new ATOM 0 HG3 GLN A 312 -0.931 -2.204 -9.176 1.00 0.00 H new ATOM 0 HE21 GLN A 312 2.205 -3.801 -9.300 1.00 0.00 H new ATOM 0 HE22 GLN A 312 3.164 -2.411 -8.782 1.00 0.00 H new ATOM 1056 N CYS A 313 -3.315 -4.250 -5.395 1.00 0.00 N ATOM 1057 CA CYS A 313 -3.604 -4.862 -4.108 1.00 0.00 C ATOM 1058 C CYS A 313 -2.452 -5.736 -3.664 1.00 0.00 C ATOM 1059 O CYS A 313 -1.740 -6.319 -4.479 1.00 0.00 O ATOM 1060 CB CYS A 313 -4.900 -5.673 -4.143 1.00 0.00 C ATOM 1061 SG CYS A 313 -4.699 -7.411 -4.650 1.00 0.00 S ATOM 0 H CYS A 313 -4.104 -4.222 -6.041 1.00 0.00 H new ATOM 0 HA CYS A 313 -3.736 -4.055 -3.387 1.00 0.00 H new ATOM 0 HB2 CYS A 313 -5.355 -5.648 -3.153 1.00 0.00 H new ATOM 0 HB3 CYS A 313 -5.597 -5.188 -4.826 1.00 0.00 H new ATOM 0 HG CYS A 313 -5.505 -7.671 -5.636 1.00 0.00 H new ATOM 1066 N ILE A 314 -2.284 -5.805 -2.367 1.00 0.00 N ATOM 1067 CA ILE A 314 -1.216 -6.567 -1.764 1.00 0.00 C ATOM 1068 C ILE A 314 -1.058 -7.951 -2.401 1.00 0.00 C ATOM 1069 O ILE A 314 0.053 -8.381 -2.696 1.00 0.00 O ATOM 1070 CB ILE A 314 -1.484 -6.709 -0.270 1.00 0.00 C ATOM 1071 CG1 ILE A 314 -0.501 -7.676 0.324 1.00 0.00 C ATOM 1072 CG2 ILE A 314 -2.899 -7.180 -0.026 1.00 0.00 C ATOM 1073 CD1 ILE A 314 0.933 -7.269 0.087 1.00 0.00 C ATOM 0 H ILE A 314 -2.887 -5.332 -1.695 1.00 0.00 H new ATOM 0 HA ILE A 314 -0.283 -6.029 -1.932 1.00 0.00 H new ATOM 0 HB ILE A 314 -1.365 -5.736 0.207 1.00 0.00 H new ATOM 0 HG12 ILE A 314 -0.679 -7.756 1.396 1.00 0.00 H new ATOM 0 HG13 ILE A 314 -0.669 -8.665 -0.102 1.00 0.00 H new ATOM 0 HG21 ILE A 314 -3.071 -7.275 1.046 1.00 0.00 H new ATOM 0 HG22 ILE A 314 -3.600 -6.457 -0.443 1.00 0.00 H new ATOM 0 HG23 ILE A 314 -3.048 -8.148 -0.505 1.00 0.00 H new ATOM 0 HD11 ILE A 314 1.599 -8.004 0.538 1.00 0.00 H new ATOM 0 HD12 ILE A 314 1.124 -7.216 -0.985 1.00 0.00 H new ATOM 0 HD13 ILE A 314 1.113 -6.292 0.536 1.00 0.00 H new ATOM 1085 N GLU A 315 -2.163 -8.650 -2.589 1.00 0.00 N ATOM 1086 CA GLU A 315 -2.132 -9.973 -3.201 1.00 0.00 C ATOM 1087 C GLU A 315 -1.324 -9.955 -4.500 1.00 0.00 C ATOM 1088 O GLU A 315 -0.605 -10.906 -4.809 1.00 0.00 O ATOM 1089 CB GLU A 315 -3.551 -10.468 -3.477 1.00 0.00 C ATOM 1090 CG GLU A 315 -4.460 -10.416 -2.260 1.00 0.00 C ATOM 1091 CD GLU A 315 -5.861 -10.908 -2.560 1.00 0.00 C ATOM 1092 OE1 GLU A 315 -6.652 -10.131 -3.132 1.00 0.00 O ATOM 1093 OE2 GLU A 315 -6.167 -12.071 -2.223 1.00 0.00 O ATOM 0 H GLU A 315 -3.094 -8.327 -2.328 1.00 0.00 H new ATOM 0 HA GLU A 315 -1.649 -10.655 -2.502 1.00 0.00 H new ATOM 0 HB2 GLU A 315 -3.989 -9.866 -4.273 1.00 0.00 H new ATOM 0 HB3 GLU A 315 -3.505 -11.494 -3.842 1.00 0.00 H new ATOM 0 HG2 GLU A 315 -4.029 -11.021 -1.463 1.00 0.00 H new ATOM 0 HG3 GLU A 315 -4.510 -9.391 -1.891 1.00 0.00 H new ATOM 1100 N CYS A 316 -1.451 -8.867 -5.255 1.00 0.00 N ATOM 1101 CA CYS A 316 -0.730 -8.718 -6.521 1.00 0.00 C ATOM 1102 C CYS A 316 0.418 -7.729 -6.391 1.00 0.00 C ATOM 1103 O CYS A 316 0.801 -7.073 -7.362 1.00 0.00 O ATOM 1104 CB CYS A 316 -1.655 -8.214 -7.609 1.00 0.00 C ATOM 1105 SG CYS A 316 -3.264 -9.058 -7.720 1.00 0.00 S ATOM 0 H CYS A 316 -2.046 -8.074 -5.014 1.00 0.00 H new ATOM 0 HA CYS A 316 -0.341 -9.703 -6.780 1.00 0.00 H new ATOM 0 HB2 CYS A 316 -1.832 -7.151 -7.448 1.00 0.00 H new ATOM 0 HB3 CYS A 316 -1.146 -8.311 -8.568 1.00 0.00 H new ATOM 0 HG CYS A 316 -3.499 -9.383 -8.957 1.00 0.00 H new ATOM 1110 N LYS A 317 0.953 -7.622 -5.195 1.00 0.00 N ATOM 1111 CA LYS A 317 2.038 -6.717 -4.903 1.00 0.00 C ATOM 1112 C LYS A 317 3.216 -6.878 -5.854 1.00 0.00 C ATOM 1113 O LYS A 317 3.242 -7.778 -6.693 1.00 0.00 O ATOM 1114 CB LYS A 317 2.503 -6.970 -3.496 1.00 0.00 C ATOM 1115 CG LYS A 317 3.070 -5.763 -2.865 1.00 0.00 C ATOM 1116 CD LYS A 317 1.972 -5.046 -2.173 1.00 0.00 C ATOM 1117 CE LYS A 317 2.087 -3.563 -2.308 1.00 0.00 C ATOM 1118 NZ LYS A 317 2.203 -3.131 -3.727 1.00 0.00 N ATOM 0 H LYS A 317 0.643 -8.167 -4.391 1.00 0.00 H new ATOM 0 HA LYS A 317 1.665 -5.700 -5.026 1.00 0.00 H new ATOM 0 HB2 LYS A 317 1.665 -7.329 -2.899 1.00 0.00 H new ATOM 0 HB3 LYS A 317 3.253 -7.761 -3.501 1.00 0.00 H new ATOM 0 HG2 LYS A 317 3.852 -6.036 -2.157 1.00 0.00 H new ATOM 0 HG3 LYS A 317 3.530 -5.121 -3.616 1.00 0.00 H new ATOM 0 HD2 LYS A 317 1.015 -5.372 -2.581 1.00 0.00 H new ATOM 0 HD3 LYS A 317 1.976 -5.313 -1.116 1.00 0.00 H new ATOM 0 HE2 LYS A 317 1.214 -3.091 -1.857 1.00 0.00 H new ATOM 0 HE3 LYS A 317 2.959 -3.217 -1.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 317 1.976 -2.119 -3.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 317 3.174 -3.294 -4.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 317 1.540 -3.678 -4.312 1.00 0.00 H new ATOM 1132 N SER A 318 4.195 -5.991 -5.696 1.00 0.00 N ATOM 1133 CA SER A 318 5.411 -6.012 -6.505 1.00 0.00 C ATOM 1134 C SER A 318 6.353 -4.888 -6.121 1.00 0.00 C ATOM 1135 O SER A 318 5.962 -3.903 -5.494 1.00 0.00 O ATOM 1136 CB SER A 318 5.116 -5.926 -7.998 1.00 0.00 C ATOM 1137 OG SER A 318 3.773 -5.549 -8.249 1.00 0.00 O ATOM 0 H SER A 318 4.168 -5.240 -5.006 1.00 0.00 H new ATOM 0 HA SER A 318 5.889 -6.971 -6.302 1.00 0.00 H new ATOM 0 HB2 SER A 318 5.789 -5.203 -8.460 1.00 0.00 H new ATOM 0 HB3 SER A 318 5.316 -6.891 -8.464 1.00 0.00 H new ATOM 0 HG SER A 318 3.621 -5.503 -9.216 1.00 0.00 H new ATOM 1143 N CYS A 319 7.603 -5.060 -6.512 1.00 0.00 N ATOM 1144 CA CYS A 319 8.652 -4.098 -6.235 1.00 0.00 C ATOM 1145 C CYS A 319 8.704 -2.992 -7.289 1.00 0.00 C ATOM 1146 O CYS A 319 9.175 -3.220 -8.392 1.00 0.00 O ATOM 1147 CB CYS A 319 9.983 -4.833 -6.230 1.00 0.00 C ATOM 1148 SG CYS A 319 11.412 -3.893 -5.584 1.00 0.00 S ATOM 0 H CYS A 319 7.920 -5.877 -7.034 1.00 0.00 H new ATOM 0 HA CYS A 319 8.448 -3.633 -5.271 1.00 0.00 H new ATOM 0 HB2 CYS A 319 9.872 -5.741 -5.637 1.00 0.00 H new ATOM 0 HB3 CYS A 319 10.208 -5.144 -7.250 1.00 0.00 H new ATOM 0 HG CYS A 319 12.507 -4.348 -6.117 1.00 0.00 H new ATOM 1153 N ILE A 320 8.217 -1.795 -6.964 1.00 0.00 N ATOM 1154 CA ILE A 320 8.294 -0.680 -7.913 1.00 0.00 C ATOM 1155 C ILE A 320 9.693 -0.681 -8.516 1.00 0.00 C ATOM 1156 O ILE A 320 9.910 -0.267 -9.656 1.00 0.00 O ATOM 1157 CB ILE A 320 8.026 0.684 -7.222 1.00 0.00 C ATOM 1158 CG1 ILE A 320 9.040 1.747 -7.676 1.00 0.00 C ATOM 1159 CG2 ILE A 320 8.069 0.509 -5.729 1.00 0.00 C ATOM 1160 CD1 ILE A 320 9.009 3.028 -6.885 1.00 0.00 C ATOM 0 H ILE A 320 7.774 -1.573 -6.072 1.00 0.00 H new ATOM 0 HA ILE A 320 7.531 -0.809 -8.680 1.00 0.00 H new ATOM 0 HB ILE A 320 7.035 1.034 -7.513 1.00 0.00 H new ATOM 0 HG12 ILE A 320 10.042 1.323 -7.614 1.00 0.00 H new ATOM 0 HG13 ILE A 320 8.856 1.980 -8.725 1.00 0.00 H new ATOM 0 HG21 ILE A 320 7.881 1.467 -5.245 1.00 0.00 H new ATOM 0 HG22 ILE A 320 7.306 -0.208 -5.425 1.00 0.00 H new ATOM 0 HG23 ILE A 320 9.051 0.140 -5.434 1.00 0.00 H new ATOM 0 HD11 ILE A 320 9.758 3.716 -7.277 1.00 0.00 H new ATOM 0 HD12 ILE A 320 8.021 3.482 -6.966 1.00 0.00 H new ATOM 0 HD13 ILE A 320 9.226 2.815 -5.838 1.00 0.00 H new ATOM 1172 N LEU A 321 10.634 -1.167 -7.709 1.00 0.00 N ATOM 1173 CA LEU A 321 12.027 -1.273 -8.094 1.00 0.00 C ATOM 1174 C LEU A 321 12.212 -2.433 -9.077 1.00 0.00 C ATOM 1175 O LEU A 321 12.736 -2.249 -10.176 1.00 0.00 O ATOM 1176 CB LEU A 321 12.876 -1.454 -6.828 1.00 0.00 C ATOM 1177 CG LEU A 321 12.526 -0.519 -5.647 1.00 0.00 C ATOM 1178 CD1 LEU A 321 13.739 -0.231 -4.794 1.00 0.00 C ATOM 1179 CD2 LEU A 321 11.921 0.794 -6.089 1.00 0.00 C ATOM 0 H LEU A 321 10.443 -1.499 -6.764 1.00 0.00 H new ATOM 0 HA LEU A 321 12.352 -0.365 -8.602 1.00 0.00 H new ATOM 0 HB2 LEU A 321 12.778 -2.486 -6.492 1.00 0.00 H new ATOM 0 HB3 LEU A 321 13.923 -1.302 -7.090 1.00 0.00 H new ATOM 0 HG LEU A 321 11.780 -1.058 -5.064 1.00 0.00 H new ATOM 0 HD11 LEU A 321 13.458 0.429 -3.973 1.00 0.00 H new ATOM 0 HD12 LEU A 321 14.131 -1.165 -4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 321 14.505 0.251 -5.401 1.00 0.00 H new ATOM 0 HD21 LEU A 321 11.698 1.405 -5.214 1.00 0.00 H new ATOM 0 HD22 LEU A 321 12.627 1.322 -6.730 1.00 0.00 H new ATOM 0 HD23 LEU A 321 11.001 0.603 -6.642 1.00 0.00 H new ATOM 1191 N CYS A 322 11.779 -3.624 -8.671 1.00 0.00 N ATOM 1192 CA CYS A 322 11.850 -4.808 -9.533 1.00 0.00 C ATOM 1193 C CYS A 322 10.560 -4.968 -10.322 1.00 0.00 C ATOM 1194 O CYS A 322 10.553 -4.931 -11.552 1.00 0.00 O ATOM 1195 CB CYS A 322 12.054 -6.091 -8.727 1.00 0.00 C ATOM 1196 SG CYS A 322 13.589 -6.173 -7.766 1.00 0.00 S ATOM 0 H CYS A 322 11.375 -3.798 -7.751 1.00 0.00 H new ATOM 0 HA CYS A 322 12.701 -4.655 -10.197 1.00 0.00 H new ATOM 0 HB2 CYS A 322 11.212 -6.209 -8.045 1.00 0.00 H new ATOM 0 HB3 CYS A 322 12.029 -6.938 -9.413 1.00 0.00 H new ATOM 0 HG CYS A 322 13.642 -7.305 -7.128 1.00 0.00 H new ATOM 1201 N GLY A 323 9.468 -5.146 -9.585 1.00 0.00 N ATOM 1202 CA GLY A 323 8.175 -5.349 -10.190 1.00 0.00 C ATOM 1203 C GLY A 323 7.928 -6.820 -10.386 1.00 0.00 C ATOM 1204 O GLY A 323 7.291 -7.236 -11.353 1.00 0.00 O ATOM 0 H GLY A 323 9.463 -5.152 -8.565 1.00 0.00 H new ATOM 0 HA2 GLY A 323 7.397 -4.922 -9.558 1.00 0.00 H new ATOM 0 HA3 GLY A 323 8.127 -4.832 -11.148 1.00 0.00 H new ATOM 1208 N THR A 324 8.444 -7.613 -9.449 1.00 0.00 N ATOM 1209 CA THR A 324 8.329 -9.057 -9.530 1.00 0.00 C ATOM 1210 C THR A 324 7.762 -9.669 -8.259 1.00 0.00 C ATOM 1211 O THR A 324 7.395 -10.843 -8.236 1.00 0.00 O ATOM 1212 CB THR A 324 9.707 -9.651 -9.784 1.00 0.00 C ATOM 1213 OG1 THR A 324 9.627 -11.070 -9.929 1.00 0.00 O ATOM 1214 CG2 THR A 324 10.656 -9.269 -8.666 1.00 0.00 C ATOM 0 H THR A 324 8.945 -7.274 -8.627 1.00 0.00 H new ATOM 0 HA THR A 324 7.642 -9.285 -10.345 1.00 0.00 H new ATOM 0 HB THR A 324 10.096 -9.243 -10.717 1.00 0.00 H new ATOM 0 HG1 THR A 324 8.791 -11.393 -9.533 1.00 0.00 H new ATOM 0 HG21 THR A 324 11.638 -9.700 -8.859 1.00 0.00 H new ATOM 0 HG22 THR A 324 10.740 -8.183 -8.615 1.00 0.00 H new ATOM 0 HG23 THR A 324 10.273 -9.648 -7.718 1.00 0.00 H new ATOM 1222 N SER A 325 7.708 -8.864 -7.204 1.00 0.00 N ATOM 1223 CA SER A 325 7.210 -9.312 -5.910 1.00 0.00 C ATOM 1224 C SER A 325 7.920 -10.588 -5.454 1.00 0.00 C ATOM 1225 O SER A 325 7.446 -11.281 -4.557 1.00 0.00 O ATOM 1226 CB SER A 325 5.691 -9.529 -5.934 1.00 0.00 C ATOM 1227 OG SER A 325 5.291 -10.319 -7.041 1.00 0.00 O ATOM 0 H SER A 325 8.006 -7.889 -7.221 1.00 0.00 H new ATOM 0 HA SER A 325 7.428 -8.521 -5.193 1.00 0.00 H new ATOM 0 HB2 SER A 325 5.378 -10.014 -5.009 1.00 0.00 H new ATOM 0 HB3 SER A 325 5.186 -8.564 -5.975 1.00 0.00 H new ATOM 0 HG SER A 325 5.999 -10.962 -7.257 1.00 0.00 H new ATOM 1233 N GLU A 326 9.059 -10.891 -6.082 1.00 0.00 N ATOM 1234 CA GLU A 326 9.838 -12.085 -5.740 1.00 0.00 C ATOM 1235 C GLU A 326 10.074 -12.226 -4.239 1.00 0.00 C ATOM 1236 O GLU A 326 9.332 -12.922 -3.547 1.00 0.00 O ATOM 1237 CB GLU A 326 11.188 -12.066 -6.449 1.00 0.00 C ATOM 1238 CG GLU A 326 11.110 -12.432 -7.906 1.00 0.00 C ATOM 1239 CD GLU A 326 11.052 -13.930 -8.135 1.00 0.00 C ATOM 1240 OE1 GLU A 326 9.949 -14.506 -8.023 1.00 0.00 O ATOM 1241 OE2 GLU A 326 12.109 -14.527 -8.427 1.00 0.00 O ATOM 0 H GLU A 326 9.463 -10.327 -6.830 1.00 0.00 H new ATOM 0 HA GLU A 326 9.247 -12.939 -6.072 1.00 0.00 H new ATOM 0 HB2 GLU A 326 11.623 -11.071 -6.356 1.00 0.00 H new ATOM 0 HB3 GLU A 326 11.863 -12.758 -5.945 1.00 0.00 H new ATOM 0 HG2 GLU A 326 10.227 -11.968 -8.345 1.00 0.00 H new ATOM 0 HG3 GLU A 326 11.977 -12.023 -8.425 1.00 0.00 H new ATOM 1248 N ASN A 327 11.115 -11.561 -3.745 1.00 0.00 N ATOM 1249 CA ASN A 327 11.477 -11.643 -2.337 1.00 0.00 C ATOM 1250 C ASN A 327 10.619 -10.752 -1.448 1.00 0.00 C ATOM 1251 O ASN A 327 11.150 -10.012 -0.634 1.00 0.00 O ATOM 1252 CB ASN A 327 12.950 -11.302 -2.145 1.00 0.00 C ATOM 1253 CG ASN A 327 13.862 -12.122 -3.025 1.00 0.00 C ATOM 1254 OD1 ASN A 327 14.227 -11.555 -4.164 1.00 0.00 O flip ATOM 1255 ND2 ASN A 327 14.242 -13.241 -2.682 1.00 0.00 N flip ATOM 0 H ASN A 327 11.722 -10.959 -4.302 1.00 0.00 H new ATOM 0 HA ASN A 327 11.293 -12.673 -2.031 1.00 0.00 H new ATOM 0 HB2 ASN A 327 13.103 -10.244 -2.357 1.00 0.00 H new ATOM 0 HB3 ASN A 327 13.221 -11.460 -1.101 1.00 0.00 H new ATOM 0 HD21 ASN A 327 13.932 -13.635 -1.794 1.00 0.00 H new ATOM 0 HD22 ASN A 327 14.867 -13.775 -3.286 1.00 0.00 H new ATOM 1262 N ASP A 328 9.298 -10.815 -1.611 1.00 0.00 N ATOM 1263 CA ASP A 328 8.382 -10.044 -0.784 1.00 0.00 C ATOM 1264 C ASP A 328 8.675 -10.193 0.706 1.00 0.00 C ATOM 1265 O ASP A 328 8.055 -9.523 1.533 1.00 0.00 O ATOM 1266 CB ASP A 328 6.941 -10.429 -1.067 1.00 0.00 C ATOM 1267 CG ASP A 328 6.790 -11.880 -1.473 1.00 0.00 C ATOM 1268 OD1 ASP A 328 7.318 -12.755 -0.756 1.00 0.00 O ATOM 1269 OD2 ASP A 328 6.145 -12.141 -2.507 1.00 0.00 O ATOM 0 H ASP A 328 8.840 -11.396 -2.313 1.00 0.00 H new ATOM 0 HA ASP A 328 8.534 -8.997 -1.047 1.00 0.00 H new ATOM 0 HB2 ASP A 328 6.338 -10.240 -0.179 1.00 0.00 H new ATOM 0 HB3 ASP A 328 6.548 -9.792 -1.860 1.00 0.00 H new ATOM 1274 N ASP A 329 9.614 -11.067 1.050 1.00 0.00 N ATOM 1275 CA ASP A 329 9.993 -11.248 2.439 1.00 0.00 C ATOM 1276 C ASP A 329 10.937 -10.116 2.782 1.00 0.00 C ATOM 1277 O ASP A 329 11.446 -9.996 3.897 1.00 0.00 O ATOM 1278 CB ASP A 329 10.670 -12.603 2.652 1.00 0.00 C ATOM 1279 CG ASP A 329 11.007 -12.862 4.106 1.00 0.00 C ATOM 1280 OD1 ASP A 329 10.131 -13.371 4.837 1.00 0.00 O ATOM 1281 OD2 ASP A 329 12.146 -12.554 4.516 1.00 0.00 O ATOM 0 H ASP A 329 10.121 -11.655 0.389 1.00 0.00 H new ATOM 0 HA ASP A 329 9.115 -11.234 3.084 1.00 0.00 H new ATOM 0 HB2 ASP A 329 10.014 -13.394 2.288 1.00 0.00 H new ATOM 0 HB3 ASP A 329 11.583 -12.647 2.058 1.00 0.00 H new ATOM 1286 N GLN A 330 11.149 -9.286 1.766 1.00 0.00 N ATOM 1287 CA GLN A 330 12.014 -8.136 1.846 1.00 0.00 C ATOM 1288 C GLN A 330 11.293 -6.906 1.315 1.00 0.00 C ATOM 1289 O GLN A 330 11.616 -5.779 1.667 1.00 0.00 O ATOM 1290 CB GLN A 330 13.266 -8.382 1.028 1.00 0.00 C ATOM 1291 CG GLN A 330 13.643 -9.848 0.955 1.00 0.00 C ATOM 1292 CD GLN A 330 14.230 -10.387 2.245 1.00 0.00 C ATOM 1293 OE1 GLN A 330 15.134 -9.629 2.852 1.00 0.00 O flip ATOM 1294 NE2 GLN A 330 13.900 -11.491 2.674 1.00 0.00 N flip ATOM 0 H GLN A 330 10.712 -9.404 0.852 1.00 0.00 H new ATOM 0 HA GLN A 330 12.288 -7.969 2.888 1.00 0.00 H new ATOM 0 HB2 GLN A 330 13.115 -8.000 0.018 1.00 0.00 H new ATOM 0 HB3 GLN A 330 14.093 -7.820 1.461 1.00 0.00 H new ATOM 0 HG2 GLN A 330 12.758 -10.430 0.697 1.00 0.00 H new ATOM 0 HG3 GLN A 330 14.364 -9.990 0.150 1.00 0.00 H new ATOM 0 HE21 GLN A 330 13.201 -12.043 2.177 1.00 0.00 H new ATOM 0 HE22 GLN A 330 14.326 -11.855 3.527 1.00 0.00 H new ATOM 1303 N LEU A 331 10.306 -7.128 0.458 1.00 0.00 N ATOM 1304 CA LEU A 331 9.563 -6.036 -0.115 1.00 0.00 C ATOM 1305 C LEU A 331 9.052 -5.118 0.961 1.00 0.00 C ATOM 1306 O LEU A 331 8.617 -5.550 2.028 1.00 0.00 O ATOM 1307 CB LEU A 331 8.422 -6.551 -0.970 1.00 0.00 C ATOM 1308 CG LEU A 331 8.875 -7.096 -2.316 1.00 0.00 C ATOM 1309 CD1 LEU A 331 7.711 -7.653 -3.074 1.00 0.00 C ATOM 1310 CD2 LEU A 331 9.560 -6.021 -3.123 1.00 0.00 C ATOM 0 H LEU A 331 10.009 -8.054 0.151 1.00 0.00 H new ATOM 0 HA LEU A 331 10.236 -5.467 -0.756 1.00 0.00 H new ATOM 0 HB2 LEU A 331 7.896 -7.336 -0.427 1.00 0.00 H new ATOM 0 HB3 LEU A 331 7.708 -5.744 -1.135 1.00 0.00 H new ATOM 0 HG LEU A 331 9.590 -7.899 -2.136 1.00 0.00 H new ATOM 0 HD11 LEU A 331 8.053 -8.039 -4.034 1.00 0.00 H new ATOM 0 HD12 LEU A 331 7.256 -8.460 -2.500 1.00 0.00 H new ATOM 0 HD13 LEU A 331 6.975 -6.866 -3.240 1.00 0.00 H new ATOM 0 HD21 LEU A 331 9.876 -6.432 -4.082 1.00 0.00 H new ATOM 0 HD22 LEU A 331 8.868 -5.196 -3.292 1.00 0.00 H new ATOM 0 HD23 LEU A 331 10.432 -5.657 -2.579 1.00 0.00 H new ATOM 1322 N LEU A 332 9.125 -3.847 0.664 1.00 0.00 N ATOM 1323 CA LEU A 332 8.706 -2.825 1.583 1.00 0.00 C ATOM 1324 C LEU A 332 7.514 -2.103 1.028 1.00 0.00 C ATOM 1325 O LEU A 332 7.592 -1.401 0.029 1.00 0.00 O ATOM 1326 CB LEU A 332 9.831 -1.842 1.849 1.00 0.00 C ATOM 1327 CG LEU A 332 11.032 -2.370 2.592 1.00 0.00 C ATOM 1328 CD1 LEU A 332 12.079 -1.306 2.707 1.00 0.00 C ATOM 1329 CD2 LEU A 332 10.666 -2.793 3.971 1.00 0.00 C ATOM 0 H LEU A 332 9.478 -3.492 -0.225 1.00 0.00 H new ATOM 0 HA LEU A 332 8.436 -3.298 2.527 1.00 0.00 H new ATOM 0 HB2 LEU A 332 10.170 -1.447 0.892 1.00 0.00 H new ATOM 0 HB3 LEU A 332 9.423 -1.004 2.414 1.00 0.00 H new ATOM 0 HG LEU A 332 11.410 -3.224 2.030 1.00 0.00 H new ATOM 0 HD11 LEU A 332 12.941 -1.700 3.246 1.00 0.00 H new ATOM 0 HD12 LEU A 332 12.387 -0.990 1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 332 11.672 -0.452 3.249 1.00 0.00 H new ATOM 0 HD21 LEU A 332 11.551 -3.169 4.483 1.00 0.00 H new ATOM 0 HD22 LEU A 332 10.265 -1.940 4.519 1.00 0.00 H new ATOM 0 HD23 LEU A 332 9.913 -3.580 3.922 1.00 0.00 H new ATOM 1341 N PHE A 333 6.429 -2.256 1.727 1.00 0.00 N ATOM 1342 CA PHE A 333 5.169 -1.696 1.328 1.00 0.00 C ATOM 1343 C PHE A 333 5.007 -0.293 1.859 1.00 0.00 C ATOM 1344 O PHE A 333 4.594 -0.103 3.004 1.00 0.00 O ATOM 1345 CB PHE A 333 4.078 -2.621 1.864 1.00 0.00 C ATOM 1346 CG PHE A 333 4.480 -4.067 1.709 1.00 0.00 C ATOM 1347 CD1 PHE A 333 5.280 -4.687 2.658 1.00 0.00 C ATOM 1348 CD2 PHE A 333 4.107 -4.782 0.592 1.00 0.00 C ATOM 1349 CE1 PHE A 333 5.696 -5.994 2.490 1.00 0.00 C ATOM 1350 CE2 PHE A 333 4.526 -6.090 0.407 1.00 0.00 C ATOM 1351 CZ PHE A 333 5.326 -6.697 1.361 1.00 0.00 C ATOM 0 H PHE A 333 6.392 -2.780 2.602 1.00 0.00 H new ATOM 0 HA PHE A 333 5.107 -1.623 0.242 1.00 0.00 H new ATOM 0 HB2 PHE A 333 3.892 -2.401 2.915 1.00 0.00 H new ATOM 0 HB3 PHE A 333 3.145 -2.439 1.330 1.00 0.00 H new ATOM 0 HD1 PHE A 333 5.582 -4.141 3.540 1.00 0.00 H new ATOM 0 HD2 PHE A 333 3.478 -4.316 -0.152 1.00 0.00 H new ATOM 0 HE1 PHE A 333 6.311 -6.466 3.242 1.00 0.00 H new ATOM 0 HE2 PHE A 333 4.230 -6.634 -0.478 1.00 0.00 H new ATOM 0 HZ PHE A 333 5.659 -7.715 1.222 1.00 0.00 H new ATOM 1361 N CYS A 334 5.344 0.700 1.034 1.00 0.00 N ATOM 1362 CA CYS A 334 5.174 2.067 1.466 1.00 0.00 C ATOM 1363 C CYS A 334 3.730 2.239 1.845 1.00 0.00 C ATOM 1364 O CYS A 334 2.862 2.225 0.991 1.00 0.00 O ATOM 1365 CB CYS A 334 5.526 3.106 0.390 1.00 0.00 C ATOM 1366 SG CYS A 334 4.841 4.745 0.817 1.00 0.00 S ATOM 0 H CYS A 334 5.723 0.580 0.095 1.00 0.00 H new ATOM 0 HA CYS A 334 5.857 2.241 2.297 1.00 0.00 H new ATOM 0 HB2 CYS A 334 6.609 3.176 0.287 1.00 0.00 H new ATOM 0 HB3 CYS A 334 5.134 2.784 -0.575 1.00 0.00 H new ATOM 0 HG CYS A 334 4.478 5.360 -0.269 1.00 0.00 H new ATOM 1371 N ASP A 335 3.446 2.381 3.113 1.00 0.00 N ATOM 1372 CA ASP A 335 2.062 2.546 3.503 1.00 0.00 C ATOM 1373 C ASP A 335 1.632 3.981 3.218 1.00 0.00 C ATOM 1374 O ASP A 335 0.671 4.488 3.793 1.00 0.00 O ATOM 1375 CB ASP A 335 1.849 2.203 4.970 1.00 0.00 C ATOM 1376 CG ASP A 335 2.673 1.008 5.411 1.00 0.00 C ATOM 1377 OD1 ASP A 335 2.357 -0.121 4.981 1.00 0.00 O ATOM 1378 OD2 ASP A 335 3.635 1.204 6.181 1.00 0.00 O ATOM 0 H ASP A 335 4.125 2.387 3.874 1.00 0.00 H new ATOM 0 HA ASP A 335 1.450 1.857 2.921 1.00 0.00 H new ATOM 0 HB2 ASP A 335 2.109 3.066 5.583 1.00 0.00 H new ATOM 0 HB3 ASP A 335 0.793 1.996 5.142 1.00 0.00 H new ATOM 1383 N ASP A 336 2.372 4.618 2.312 1.00 0.00 N ATOM 1384 CA ASP A 336 2.133 5.996 1.920 1.00 0.00 C ATOM 1385 C ASP A 336 1.981 6.115 0.388 1.00 0.00 C ATOM 1386 O ASP A 336 1.926 7.219 -0.155 1.00 0.00 O ATOM 1387 CB ASP A 336 3.280 6.864 2.430 1.00 0.00 C ATOM 1388 CG ASP A 336 2.833 8.229 2.914 1.00 0.00 C ATOM 1389 OD1 ASP A 336 2.032 8.287 3.868 1.00 0.00 O ATOM 1390 OD2 ASP A 336 3.298 9.241 2.351 1.00 0.00 O ATOM 0 H ASP A 336 3.159 4.185 1.829 1.00 0.00 H new ATOM 0 HA ASP A 336 1.199 6.342 2.363 1.00 0.00 H new ATOM 0 HB2 ASP A 336 3.784 6.345 3.245 1.00 0.00 H new ATOM 0 HB3 ASP A 336 4.012 6.991 1.632 1.00 0.00 H new ATOM 1395 N CYS A 337 1.906 4.956 -0.288 1.00 0.00 N ATOM 1396 CA CYS A 337 1.691 4.854 -1.736 1.00 0.00 C ATOM 1397 C CYS A 337 1.446 3.406 -2.092 1.00 0.00 C ATOM 1398 O CYS A 337 0.816 3.093 -3.098 1.00 0.00 O ATOM 1399 CB CYS A 337 2.861 5.262 -2.622 1.00 0.00 C ATOM 1400 SG CYS A 337 3.741 6.798 -2.239 1.00 0.00 S ATOM 0 H CYS A 337 1.995 4.048 0.168 1.00 0.00 H new ATOM 0 HA CYS A 337 0.863 5.537 -1.923 1.00 0.00 H new ATOM 0 HB2 CYS A 337 3.588 4.450 -2.605 1.00 0.00 H new ATOM 0 HB3 CYS A 337 2.492 5.338 -3.645 1.00 0.00 H new ATOM 0 HG CYS A 337 3.089 7.456 -1.327 1.00 0.00 H new ATOM 1405 N ASP A 338 2.041 2.547 -1.277 1.00 0.00 N ATOM 1406 CA ASP A 338 1.976 1.099 -1.429 1.00 0.00 C ATOM 1407 C ASP A 338 3.146 0.613 -2.275 1.00 0.00 C ATOM 1408 O ASP A 338 3.296 -0.583 -2.526 1.00 0.00 O ATOM 1409 CB ASP A 338 0.661 0.656 -2.048 1.00 0.00 C ATOM 1410 CG ASP A 338 0.407 -0.820 -1.833 1.00 0.00 C ATOM 1411 OD1 ASP A 338 0.769 -1.327 -0.751 1.00 0.00 O ATOM 1412 OD2 ASP A 338 -0.142 -1.472 -2.742 1.00 0.00 O ATOM 0 H ASP A 338 2.595 2.843 -0.473 1.00 0.00 H new ATOM 0 HA ASP A 338 2.037 0.656 -0.435 1.00 0.00 H new ATOM 0 HB2 ASP A 338 -0.157 1.232 -1.615 1.00 0.00 H new ATOM 0 HB3 ASP A 338 0.672 0.871 -3.117 1.00 0.00 H new ATOM 1417 N ARG A 339 3.969 1.562 -2.711 1.00 0.00 N ATOM 1418 CA ARG A 339 5.144 1.262 -3.518 1.00 0.00 C ATOM 1419 C ARG A 339 6.043 0.254 -2.805 1.00 0.00 C ATOM 1420 O ARG A 339 6.659 0.572 -1.787 1.00 0.00 O ATOM 1421 CB ARG A 339 5.906 2.553 -3.802 1.00 0.00 C ATOM 1422 CG ARG A 339 5.177 3.473 -4.765 1.00 0.00 C ATOM 1423 CD ARG A 339 5.836 3.479 -6.135 1.00 0.00 C ATOM 1424 NE ARG A 339 4.976 4.067 -7.164 1.00 0.00 N ATOM 1425 CZ ARG A 339 4.498 5.310 -7.123 1.00 0.00 C ATOM 1426 NH1 ARG A 339 4.779 6.107 -6.102 1.00 0.00 N ATOM 1427 NH2 ARG A 339 3.733 5.757 -8.110 1.00 0.00 N ATOM 0 H ARG A 339 3.840 2.555 -2.516 1.00 0.00 H new ATOM 0 HA ARG A 339 4.826 0.819 -4.462 1.00 0.00 H new ATOM 0 HB2 ARG A 339 6.078 3.081 -2.864 1.00 0.00 H new ATOM 0 HB3 ARG A 339 6.885 2.307 -4.214 1.00 0.00 H new ATOM 0 HG2 ARG A 339 4.139 3.153 -4.860 1.00 0.00 H new ATOM 0 HG3 ARG A 339 5.163 4.486 -4.362 1.00 0.00 H new ATOM 0 HD2 ARG A 339 6.771 4.037 -6.083 1.00 0.00 H new ATOM 0 HD3 ARG A 339 6.090 2.457 -6.418 1.00 0.00 H new ATOM 0 HE ARG A 339 4.726 3.487 -7.965 1.00 0.00 H new ATOM 0 HH11 ARG A 339 5.366 5.770 -5.339 1.00 0.00 H new ATOM 0 HH12 ARG A 339 4.408 7.057 -6.080 1.00 0.00 H new ATOM 0 HH21 ARG A 339 3.511 5.149 -8.899 1.00 0.00 H new ATOM 0 HH22 ARG A 339 3.366 6.708 -8.080 1.00 0.00 H new ATOM 1441 N GLY A 340 6.114 -0.961 -3.345 1.00 0.00 N ATOM 1442 CA GLY A 340 6.924 -1.998 -2.728 1.00 0.00 C ATOM 1443 C GLY A 340 8.358 -2.020 -3.217 1.00 0.00 C ATOM 1444 O GLY A 340 8.614 -1.965 -4.410 1.00 0.00 O ATOM 0 H GLY A 340 5.627 -1.245 -4.195 1.00 0.00 H new ATOM 0 HA2 GLY A 340 6.920 -1.856 -1.647 1.00 0.00 H new ATOM 0 HA3 GLY A 340 6.467 -2.968 -2.924 1.00 0.00 H new ATOM 1448 N TYR A 341 9.299 -2.052 -2.283 1.00 0.00 N ATOM 1449 CA TYR A 341 10.721 -2.136 -2.621 1.00 0.00 C ATOM 1450 C TYR A 341 11.364 -3.186 -1.747 1.00 0.00 C ATOM 1451 O TYR A 341 11.268 -3.099 -0.530 1.00 0.00 O ATOM 1452 CB TYR A 341 11.542 -0.887 -2.293 1.00 0.00 C ATOM 1453 CG TYR A 341 11.113 0.484 -2.762 1.00 0.00 C ATOM 1454 CD1 TYR A 341 9.838 0.777 -3.176 1.00 0.00 C ATOM 1455 CD2 TYR A 341 12.022 1.534 -2.658 1.00 0.00 C ATOM 1456 CE1 TYR A 341 9.474 2.070 -3.480 1.00 0.00 C ATOM 1457 CE2 TYR A 341 11.669 2.821 -2.979 1.00 0.00 C ATOM 1458 CZ TYR A 341 10.389 3.082 -3.385 1.00 0.00 C ATOM 1459 OH TYR A 341 10.010 4.362 -3.680 1.00 0.00 O ATOM 0 H TYR A 341 9.107 -2.021 -1.282 1.00 0.00 H new ATOM 0 HA TYR A 341 10.730 -2.323 -3.695 1.00 0.00 H new ATOM 0 HB2 TYR A 341 11.626 -0.839 -1.207 1.00 0.00 H new ATOM 0 HB3 TYR A 341 12.546 -1.056 -2.683 1.00 0.00 H new ATOM 0 HD1 TYR A 341 9.111 -0.016 -3.265 1.00 0.00 H new ATOM 0 HD2 TYR A 341 13.027 1.331 -2.317 1.00 0.00 H new ATOM 0 HE1 TYR A 341 8.463 2.285 -3.794 1.00 0.00 H new ATOM 0 HE2 TYR A 341 12.394 3.619 -2.912 1.00 0.00 H new ATOM 0 HH TYR A 341 9.039 4.447 -3.578 1.00 0.00 H new ATOM 1469 N HIS A 342 12.091 -4.116 -2.317 1.00 0.00 N ATOM 1470 CA HIS A 342 12.746 -5.094 -1.468 1.00 0.00 C ATOM 1471 C HIS A 342 13.743 -4.288 -0.648 1.00 0.00 C ATOM 1472 O HIS A 342 14.589 -3.664 -1.245 1.00 0.00 O ATOM 1473 CB HIS A 342 13.485 -6.176 -2.279 1.00 0.00 C ATOM 1474 CG HIS A 342 12.629 -7.091 -3.112 1.00 0.00 C ATOM 1475 ND1 HIS A 342 11.916 -8.178 -2.763 1.00 0.00 N flip ATOM 1476 CD2 HIS A 342 12.443 -6.949 -4.472 1.00 0.00 C flip ATOM 1477 CE1 HIS A 342 11.319 -8.668 -3.904 1.00 0.00 C flip ATOM 1478 NE2 HIS A 342 11.652 -7.901 -4.923 1.00 0.00 N flip ATOM 0 H HIS A 342 12.244 -4.221 -3.320 1.00 0.00 H new ATOM 0 HA HIS A 342 12.018 -5.628 -0.858 1.00 0.00 H new ATOM 0 HB2 HIS A 342 14.198 -5.681 -2.939 1.00 0.00 H new ATOM 0 HB3 HIS A 342 14.063 -6.787 -1.586 1.00 0.00 H new ATOM 0 HD1 HIS A 342 11.833 -8.568 -1.824 1.00 0.00 H new ATOM 0 HD2 HIS A 342 12.882 -6.171 -5.078 1.00 0.00 H new ATOM 0 HE1 HIS A 342 10.682 -9.539 -3.955 1.00 0.00 H new ATOM 1486 N MET A 343 13.609 -4.226 0.686 1.00 0.00 N ATOM 1487 CA MET A 343 14.528 -3.410 1.520 1.00 0.00 C ATOM 1488 C MET A 343 15.909 -3.273 0.917 1.00 0.00 C ATOM 1489 O MET A 343 16.589 -2.276 1.138 1.00 0.00 O ATOM 1490 CB MET A 343 14.735 -3.953 2.936 1.00 0.00 C ATOM 1491 CG MET A 343 13.498 -4.218 3.739 1.00 0.00 C ATOM 1492 SD MET A 343 13.017 -5.949 3.866 1.00 0.00 S ATOM 1493 CE MET A 343 14.600 -6.775 3.912 1.00 0.00 C ATOM 0 H MET A 343 12.887 -4.720 1.211 1.00 0.00 H new ATOM 0 HA MET A 343 14.020 -2.447 1.561 1.00 0.00 H new ATOM 0 HB2 MET A 343 15.301 -4.882 2.866 1.00 0.00 H new ATOM 0 HB3 MET A 343 15.353 -3.244 3.486 1.00 0.00 H new ATOM 0 HG2 MET A 343 13.647 -3.825 4.745 1.00 0.00 H new ATOM 0 HG3 MET A 343 12.672 -3.660 3.298 1.00 0.00 H new ATOM 0 HE1 MET A 343 14.506 -7.711 4.463 1.00 0.00 H new ATOM 0 HE2 MET A 343 14.931 -6.984 2.895 1.00 0.00 H new ATOM 0 HE3 MET A 343 15.330 -6.135 4.406 1.00 0.00 H new ATOM 1503 N TYR A 344 16.335 -4.272 0.185 1.00 0.00 N ATOM 1504 CA TYR A 344 17.652 -4.216 -0.423 1.00 0.00 C ATOM 1505 C TYR A 344 17.549 -3.770 -1.872 1.00 0.00 C ATOM 1506 O TYR A 344 18.365 -4.150 -2.711 1.00 0.00 O ATOM 1507 CB TYR A 344 18.392 -5.555 -0.293 1.00 0.00 C ATOM 1508 CG TYR A 344 17.802 -6.697 -1.087 1.00 0.00 C ATOM 1509 CD1 TYR A 344 16.493 -7.108 -0.886 1.00 0.00 C ATOM 1510 CD2 TYR A 344 18.567 -7.383 -2.022 1.00 0.00 C ATOM 1511 CE1 TYR A 344 15.964 -8.165 -1.591 1.00 0.00 C ATOM 1512 CE2 TYR A 344 18.042 -8.442 -2.738 1.00 0.00 C ATOM 1513 CZ TYR A 344 16.739 -8.829 -2.517 1.00 0.00 C ATOM 1514 OH TYR A 344 16.210 -9.886 -3.224 1.00 0.00 O ATOM 0 H TYR A 344 15.804 -5.122 -0.006 1.00 0.00 H new ATOM 0 HA TYR A 344 18.243 -3.476 0.117 1.00 0.00 H new ATOM 0 HB2 TYR A 344 19.426 -5.412 -0.606 1.00 0.00 H new ATOM 0 HB3 TYR A 344 18.414 -5.839 0.759 1.00 0.00 H new ATOM 0 HD1 TYR A 344 15.879 -6.590 -0.164 1.00 0.00 H new ATOM 0 HD2 TYR A 344 19.590 -7.083 -2.192 1.00 0.00 H new ATOM 0 HE1 TYR A 344 14.943 -8.473 -1.419 1.00 0.00 H new ATOM 0 HE2 TYR A 344 18.649 -8.962 -3.465 1.00 0.00 H new ATOM 0 HH TYR A 344 15.232 -9.821 -3.226 1.00 0.00 H new ATOM 1524 N CYS A 345 16.533 -2.950 -2.162 1.00 0.00 N ATOM 1525 CA CYS A 345 16.343 -2.432 -3.499 1.00 0.00 C ATOM 1526 C CYS A 345 16.345 -0.930 -3.446 1.00 0.00 C ATOM 1527 O CYS A 345 16.662 -0.245 -4.421 1.00 0.00 O ATOM 1528 CB CYS A 345 15.032 -2.936 -4.110 1.00 0.00 C ATOM 1529 SG CYS A 345 15.153 -4.645 -4.675 1.00 0.00 S ATOM 0 H CYS A 345 15.838 -2.638 -1.484 1.00 0.00 H new ATOM 0 HA CYS A 345 17.158 -2.784 -4.131 1.00 0.00 H new ATOM 0 HB2 CYS A 345 14.235 -2.855 -3.371 1.00 0.00 H new ATOM 0 HB3 CYS A 345 14.755 -2.297 -4.949 1.00 0.00 H new ATOM 0 HG CYS A 345 14.496 -4.782 -5.788 1.00 0.00 H new ATOM 1534 N LEU A 346 15.998 -0.437 -2.275 1.00 0.00 N ATOM 1535 CA LEU A 346 15.908 0.988 -2.033 1.00 0.00 C ATOM 1536 C LEU A 346 17.217 1.710 -2.344 1.00 0.00 C ATOM 1537 O LEU A 346 18.210 1.099 -2.740 1.00 0.00 O ATOM 1538 CB LEU A 346 15.508 1.256 -0.577 1.00 0.00 C ATOM 1539 CG LEU A 346 15.064 0.023 0.203 1.00 0.00 C ATOM 1540 CD1 LEU A 346 14.715 0.350 1.625 1.00 0.00 C ATOM 1541 CD2 LEU A 346 13.877 -0.626 -0.450 1.00 0.00 C ATOM 0 H LEU A 346 15.770 -1.013 -1.464 1.00 0.00 H new ATOM 0 HA LEU A 346 15.144 1.378 -2.705 1.00 0.00 H new ATOM 0 HB2 LEU A 346 16.354 1.710 -0.061 1.00 0.00 H new ATOM 0 HB3 LEU A 346 14.699 1.986 -0.566 1.00 0.00 H new ATOM 0 HG LEU A 346 15.910 -0.664 0.201 1.00 0.00 H new ATOM 0 HD11 LEU A 346 14.405 -0.558 2.142 1.00 0.00 H new ATOM 0 HD12 LEU A 346 15.586 0.772 2.126 1.00 0.00 H new ATOM 0 HD13 LEU A 346 13.900 1.074 1.642 1.00 0.00 H new ATOM 0 HD21 LEU A 346 13.580 -1.503 0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 346 13.049 0.082 -0.486 1.00 0.00 H new ATOM 0 HD23 LEU A 346 14.140 -0.929 -1.464 1.00 0.00 H new ATOM 1553 N ASN A 347 17.195 3.019 -2.149 1.00 0.00 N ATOM 1554 CA ASN A 347 18.360 3.860 -2.355 1.00 0.00 C ATOM 1555 C ASN A 347 19.167 3.808 -1.088 1.00 0.00 C ATOM 1556 O ASN A 347 20.392 3.685 -1.120 1.00 0.00 O ATOM 1557 CB ASN A 347 17.951 5.287 -2.690 1.00 0.00 C ATOM 1558 CG ASN A 347 18.971 6.006 -3.517 1.00 0.00 C ATOM 1559 OD1 ASN A 347 20.137 5.614 -3.587 1.00 0.00 O ATOM 1560 ND2 ASN A 347 18.535 7.082 -4.133 1.00 0.00 N ATOM 0 H ASN A 347 16.366 3.528 -1.843 1.00 0.00 H new ATOM 0 HA ASN A 347 18.950 3.503 -3.199 1.00 0.00 H new ATOM 0 HB2 ASN A 347 17.002 5.271 -3.226 1.00 0.00 H new ATOM 0 HB3 ASN A 347 17.786 5.839 -1.765 1.00 0.00 H new ATOM 0 HD21 ASN A 347 19.173 7.637 -4.703 1.00 0.00 H new ATOM 0 HD22 ASN A 347 17.558 7.362 -4.041 1.00 0.00 H new ATOM 1567 N PRO A 348 18.479 3.929 0.061 1.00 0.00 N ATOM 1568 CA PRO A 348 19.059 3.788 1.357 1.00 0.00 C ATOM 1569 C PRO A 348 18.443 2.577 2.045 1.00 0.00 C ATOM 1570 O PRO A 348 17.706 2.683 3.026 1.00 0.00 O ATOM 1571 CB PRO A 348 18.615 5.075 1.955 1.00 0.00 C ATOM 1572 CG PRO A 348 17.215 5.243 1.467 1.00 0.00 C ATOM 1573 CD PRO A 348 17.092 4.372 0.240 1.00 0.00 C ATOM 0 HA PRO A 348 20.135 3.624 1.410 1.00 0.00 H new ATOM 0 HB2 PRO A 348 18.656 5.043 3.044 1.00 0.00 H new ATOM 0 HB3 PRO A 348 19.250 5.902 1.636 1.00 0.00 H new ATOM 0 HG2 PRO A 348 16.497 4.944 2.231 1.00 0.00 H new ATOM 0 HG3 PRO A 348 17.008 6.286 1.227 1.00 0.00 H new ATOM 0 HD2 PRO A 348 16.410 3.536 0.396 1.00 0.00 H new ATOM 0 HD3 PRO A 348 16.723 4.927 -0.623 1.00 0.00 H new ATOM 1581 N PRO A 349 18.771 1.414 1.492 1.00 0.00 N ATOM 1582 CA PRO A 349 18.245 0.117 1.901 1.00 0.00 C ATOM 1583 C PRO A 349 18.158 -0.081 3.410 1.00 0.00 C ATOM 1584 O PRO A 349 18.950 0.464 4.179 1.00 0.00 O ATOM 1585 CB PRO A 349 19.216 -0.862 1.267 1.00 0.00 C ATOM 1586 CG PRO A 349 19.724 -0.155 0.059 1.00 0.00 C ATOM 1587 CD PRO A 349 19.749 1.295 0.413 1.00 0.00 C ATOM 0 HA PRO A 349 17.211 -0.009 1.581 1.00 0.00 H new ATOM 0 HB2 PRO A 349 20.027 -1.114 1.950 1.00 0.00 H new ATOM 0 HB3 PRO A 349 18.721 -1.796 1.001 1.00 0.00 H new ATOM 0 HG2 PRO A 349 20.719 -0.508 -0.211 1.00 0.00 H new ATOM 0 HG3 PRO A 349 19.078 -0.336 -0.800 1.00 0.00 H new ATOM 0 HD2 PRO A 349 20.741 1.609 0.737 1.00 0.00 H new ATOM 0 HD3 PRO A 349 19.480 1.918 -0.440 1.00 0.00 H new ATOM 1595 N VAL A 350 17.174 -0.879 3.809 1.00 0.00 N ATOM 1596 CA VAL A 350 16.916 -1.192 5.200 1.00 0.00 C ATOM 1597 C VAL A 350 16.984 -2.704 5.383 1.00 0.00 C ATOM 1598 O VAL A 350 17.172 -3.443 4.418 1.00 0.00 O ATOM 1599 CB VAL A 350 15.543 -0.610 5.617 1.00 0.00 C ATOM 1600 CG1 VAL A 350 14.487 -0.962 4.599 1.00 0.00 C ATOM 1601 CG2 VAL A 350 15.105 -1.034 7.005 1.00 0.00 C ATOM 0 H VAL A 350 16.527 -1.330 3.162 1.00 0.00 H new ATOM 0 HA VAL A 350 17.668 -0.739 5.846 1.00 0.00 H new ATOM 0 HB VAL A 350 15.668 0.472 5.652 1.00 0.00 H new ATOM 0 HG11 VAL A 350 13.529 -0.544 4.909 1.00 0.00 H new ATOM 0 HG12 VAL A 350 14.765 -0.550 3.629 1.00 0.00 H new ATOM 0 HG13 VAL A 350 14.403 -2.046 4.522 1.00 0.00 H new ATOM 0 HG21 VAL A 350 14.136 -0.590 7.232 1.00 0.00 H new ATOM 0 HG22 VAL A 350 15.025 -2.120 7.045 1.00 0.00 H new ATOM 0 HG23 VAL A 350 15.839 -0.697 7.737 1.00 0.00 H new ATOM 1611 N ALA A 351 16.867 -3.156 6.611 1.00 0.00 N ATOM 1612 CA ALA A 351 16.963 -4.586 6.905 1.00 0.00 C ATOM 1613 C ALA A 351 15.614 -5.276 7.118 1.00 0.00 C ATOM 1614 O ALA A 351 15.426 -6.410 6.683 1.00 0.00 O ATOM 1615 CB ALA A 351 17.846 -4.807 8.122 1.00 0.00 C ATOM 0 H ALA A 351 16.706 -2.565 7.426 1.00 0.00 H new ATOM 0 HA ALA A 351 17.402 -5.043 6.018 1.00 0.00 H new ATOM 0 HB1 ALA A 351 17.912 -5.874 8.334 1.00 0.00 H new ATOM 0 HB2 ALA A 351 18.843 -4.414 7.924 1.00 0.00 H new ATOM 0 HB3 ALA A 351 17.417 -4.292 8.981 1.00 0.00 H new ATOM 1621 N GLU A 352 14.684 -4.612 7.801 1.00 0.00 N ATOM 1622 CA GLU A 352 13.370 -5.218 8.100 1.00 0.00 C ATOM 1623 C GLU A 352 12.358 -4.177 8.584 1.00 0.00 C ATOM 1624 O GLU A 352 11.215 -4.139 8.129 1.00 0.00 O ATOM 1625 CB GLU A 352 13.491 -6.305 9.186 1.00 0.00 C ATOM 1626 CG GLU A 352 14.912 -6.668 9.599 1.00 0.00 C ATOM 1627 CD GLU A 352 14.954 -7.791 10.616 1.00 0.00 C ATOM 1628 OE1 GLU A 352 14.981 -8.969 10.200 1.00 0.00 O ATOM 1629 OE2 GLU A 352 14.958 -7.495 11.829 1.00 0.00 O ATOM 0 H GLU A 352 14.805 -3.664 8.158 1.00 0.00 H new ATOM 0 HA GLU A 352 13.020 -5.657 7.166 1.00 0.00 H new ATOM 0 HB2 GLU A 352 12.949 -5.971 10.071 1.00 0.00 H new ATOM 0 HB3 GLU A 352 12.994 -7.207 8.829 1.00 0.00 H new ATOM 0 HG2 GLU A 352 15.480 -6.961 8.716 1.00 0.00 H new ATOM 0 HG3 GLU A 352 15.402 -5.788 10.015 1.00 0.00 H new ATOM 1636 N PRO A 353 12.786 -3.369 9.565 1.00 0.00 N ATOM 1637 CA PRO A 353 12.085 -2.263 10.188 1.00 0.00 C ATOM 1638 C PRO A 353 10.786 -1.753 9.549 1.00 0.00 C ATOM 1639 O PRO A 353 9.813 -1.558 10.275 1.00 0.00 O ATOM 1640 CB PRO A 353 13.195 -1.214 10.093 1.00 0.00 C ATOM 1641 CG PRO A 353 14.479 -2.011 10.166 1.00 0.00 C ATOM 1642 CD PRO A 353 14.073 -3.445 10.230 1.00 0.00 C ATOM 0 HA PRO A 353 11.694 -2.538 11.168 1.00 0.00 H new ATOM 0 HB2 PRO A 353 13.130 -0.651 9.162 1.00 0.00 H new ATOM 0 HB3 PRO A 353 13.129 -0.492 10.907 1.00 0.00 H new ATOM 0 HG2 PRO A 353 15.105 -1.822 9.294 1.00 0.00 H new ATOM 0 HG3 PRO A 353 15.062 -1.731 11.044 1.00 0.00 H new ATOM 0 HD2 PRO A 353 14.773 -4.100 9.711 1.00 0.00 H new ATOM 0 HD3 PRO A 353 13.993 -3.811 11.254 1.00 0.00 H new ATOM 1650 N PRO A 354 10.719 -1.475 8.225 1.00 0.00 N ATOM 1651 CA PRO A 354 9.511 -0.941 7.618 1.00 0.00 C ATOM 1652 C PRO A 354 8.358 -1.932 7.509 1.00 0.00 C ATOM 1653 O PRO A 354 7.741 -2.067 6.451 1.00 0.00 O ATOM 1654 CB PRO A 354 9.969 -0.500 6.239 1.00 0.00 C ATOM 1655 CG PRO A 354 11.432 -0.501 6.291 1.00 0.00 C ATOM 1656 CD PRO A 354 11.773 -1.589 7.217 1.00 0.00 C ATOM 0 HA PRO A 354 9.098 -0.143 8.235 1.00 0.00 H new ATOM 0 HB2 PRO A 354 9.604 -1.179 5.469 1.00 0.00 H new ATOM 0 HB3 PRO A 354 9.586 0.491 5.997 1.00 0.00 H new ATOM 0 HG2 PRO A 354 11.863 -0.671 5.304 1.00 0.00 H new ATOM 0 HG3 PRO A 354 11.816 0.455 6.646 1.00 0.00 H new ATOM 0 HD2 PRO A 354 11.763 -2.561 6.725 1.00 0.00 H new ATOM 0 HD3 PRO A 354 12.766 -1.461 7.649 1.00 0.00 H new ATOM 1664 N GLU A 355 8.071 -2.617 8.600 1.00 0.00 N ATOM 1665 CA GLU A 355 6.970 -3.567 8.636 1.00 0.00 C ATOM 1666 C GLU A 355 5.642 -2.834 8.816 1.00 0.00 C ATOM 1667 O GLU A 355 4.578 -3.452 8.850 1.00 0.00 O ATOM 1668 CB GLU A 355 7.172 -4.564 9.762 1.00 0.00 C ATOM 1669 CG GLU A 355 8.285 -5.556 9.482 1.00 0.00 C ATOM 1670 CD GLU A 355 8.312 -6.025 8.038 1.00 0.00 C ATOM 1671 OE1 GLU A 355 7.613 -7.011 7.722 1.00 0.00 O ATOM 1672 OE2 GLU A 355 9.030 -5.407 7.225 1.00 0.00 O ATOM 0 H GLU A 355 8.586 -2.534 9.477 1.00 0.00 H new ATOM 0 HA GLU A 355 6.947 -4.107 7.689 1.00 0.00 H new ATOM 0 HB2 GLU A 355 7.397 -4.024 10.682 1.00 0.00 H new ATOM 0 HB3 GLU A 355 6.242 -5.107 9.930 1.00 0.00 H new ATOM 0 HG2 GLU A 355 9.243 -5.098 9.727 1.00 0.00 H new ATOM 0 HG3 GLU A 355 8.168 -6.420 10.137 1.00 0.00 H new ATOM 1679 N GLY A 356 5.721 -1.509 8.932 1.00 0.00 N ATOM 1680 CA GLY A 356 4.528 -0.699 9.114 1.00 0.00 C ATOM 1681 C GLY A 356 4.833 0.725 9.520 1.00 0.00 C ATOM 1682 O GLY A 356 4.562 1.123 10.654 1.00 0.00 O ATOM 0 H GLY A 356 6.593 -0.981 8.903 1.00 0.00 H new ATOM 0 HA2 GLY A 356 3.957 -0.691 8.186 1.00 0.00 H new ATOM 0 HA3 GLY A 356 3.896 -1.159 9.873 1.00 0.00 H new ATOM 1686 N SER A 357 5.383 1.497 8.583 1.00 0.00 N ATOM 1687 CA SER A 357 5.717 2.897 8.835 1.00 0.00 C ATOM 1688 C SER A 357 6.412 3.527 7.629 1.00 0.00 C ATOM 1689 O SER A 357 6.272 4.723 7.371 1.00 0.00 O ATOM 1690 CB SER A 357 6.628 3.028 10.058 1.00 0.00 C ATOM 1691 OG SER A 357 6.714 4.376 10.488 1.00 0.00 O ATOM 0 H SER A 357 5.607 1.175 7.641 1.00 0.00 H new ATOM 0 HA SER A 357 4.780 3.422 9.021 1.00 0.00 H new ATOM 0 HB2 SER A 357 6.245 2.408 10.869 1.00 0.00 H new ATOM 0 HB3 SER A 357 7.623 2.656 9.815 1.00 0.00 H new ATOM 0 HG SER A 357 7.300 4.433 11.271 1.00 0.00 H new ATOM 1697 N TRP A 358 7.175 2.702 6.919 1.00 0.00 N ATOM 1698 CA TRP A 358 7.930 3.099 5.747 1.00 0.00 C ATOM 1699 C TRP A 358 7.217 4.127 4.889 1.00 0.00 C ATOM 1700 O TRP A 358 5.992 4.251 4.907 1.00 0.00 O ATOM 1701 CB TRP A 358 8.227 1.864 4.929 1.00 0.00 C ATOM 1702 CG TRP A 358 9.504 1.930 4.172 1.00 0.00 C ATOM 1703 CD1 TRP A 358 10.747 2.271 4.627 1.00 0.00 C ATOM 1704 CD2 TRP A 358 9.653 1.594 2.817 1.00 0.00 C ATOM 1705 NE1 TRP A 358 11.651 2.193 3.597 1.00 0.00 N ATOM 1706 CE2 TRP A 358 10.997 1.782 2.481 1.00 0.00 C ATOM 1707 CE3 TRP A 358 8.766 1.162 1.851 1.00 0.00 C ATOM 1708 CZ2 TRP A 358 11.469 1.548 1.215 1.00 0.00 C ATOM 1709 CZ3 TRP A 358 9.240 0.925 0.592 1.00 0.00 C ATOM 1710 CH2 TRP A 358 10.579 1.119 0.292 1.00 0.00 C ATOM 0 H TRP A 358 7.285 1.715 7.153 1.00 0.00 H new ATOM 0 HA TRP A 358 8.847 3.577 6.092 1.00 0.00 H new ATOM 0 HB2 TRP A 358 8.255 1.000 5.593 1.00 0.00 H new ATOM 0 HB3 TRP A 358 7.409 1.701 4.227 1.00 0.00 H new ATOM 0 HD1 TRP A 358 10.982 2.558 5.641 1.00 0.00 H new ATOM 0 HE1 TRP A 358 12.646 2.408 3.660 1.00 0.00 H new ATOM 0 HE3 TRP A 358 7.722 1.015 2.085 1.00 0.00 H new ATOM 0 HZ2 TRP A 358 12.509 1.700 0.965 1.00 0.00 H new ATOM 0 HZ3 TRP A 358 8.564 0.583 -0.178 1.00 0.00 H new ATOM 0 HH2 TRP A 358 10.923 0.921 -0.712 1.00 0.00 H new ATOM 1721 N SER A 359 8.018 4.842 4.121 1.00 0.00 N ATOM 1722 CA SER A 359 7.506 5.906 3.259 1.00 0.00 C ATOM 1723 C SER A 359 7.948 5.844 1.793 1.00 0.00 C ATOM 1724 O SER A 359 7.423 6.579 0.977 1.00 0.00 O ATOM 1725 CB SER A 359 7.955 7.241 3.847 1.00 0.00 C ATOM 1726 OG SER A 359 9.351 7.237 4.086 1.00 0.00 O ATOM 0 H SER A 359 9.028 4.710 4.072 1.00 0.00 H new ATOM 0 HA SER A 359 6.423 5.782 3.238 1.00 0.00 H new ATOM 0 HB2 SER A 359 7.700 8.050 3.162 1.00 0.00 H new ATOM 0 HB3 SER A 359 7.422 7.432 4.778 1.00 0.00 H new ATOM 0 HG SER A 359 9.677 8.160 4.136 1.00 0.00 H new ATOM 1732 N CYS A 360 8.878 4.971 1.463 1.00 0.00 N ATOM 1733 CA CYS A 360 9.405 4.870 0.081 1.00 0.00 C ATOM 1734 C CYS A 360 10.164 6.141 -0.307 1.00 0.00 C ATOM 1735 O CYS A 360 10.147 7.130 0.426 1.00 0.00 O ATOM 1736 CB CYS A 360 8.302 4.616 -0.963 1.00 0.00 C ATOM 1737 SG CYS A 360 7.483 6.131 -1.612 1.00 0.00 S ATOM 0 H CYS A 360 9.297 4.313 2.120 1.00 0.00 H new ATOM 0 HA CYS A 360 10.078 4.013 0.080 1.00 0.00 H new ATOM 0 HB2 CYS A 360 8.734 4.068 -1.800 1.00 0.00 H new ATOM 0 HB3 CYS A 360 7.543 3.973 -0.518 1.00 0.00 H new ATOM 0 HG CYS A 360 6.983 6.811 -0.624 1.00 0.00 H new ATOM 1742 N HIS A 361 10.834 6.111 -1.464 1.00 0.00 N ATOM 1743 CA HIS A 361 11.594 7.254 -1.932 1.00 0.00 C ATOM 1744 C HIS A 361 10.688 8.343 -2.505 1.00 0.00 C ATOM 1745 O HIS A 361 11.000 9.526 -2.392 1.00 0.00 O ATOM 1746 CB HIS A 361 12.669 6.836 -2.948 1.00 0.00 C ATOM 1747 CG HIS A 361 12.177 6.156 -4.192 1.00 0.00 C ATOM 1748 ND1 HIS A 361 11.197 6.488 -5.058 1.00 0.00 N flip ATOM 1749 CD2 HIS A 361 12.740 4.999 -4.690 1.00 0.00 C flip ATOM 1750 CE1 HIS A 361 11.186 5.546 -6.052 1.00 0.00 C flip ATOM 1751 NE2 HIS A 361 12.122 4.658 -5.809 1.00 0.00 N flip ATOM 0 H HIS A 361 10.860 5.304 -2.087 1.00 0.00 H new ATOM 0 HA HIS A 361 12.102 7.676 -1.065 1.00 0.00 H new ATOM 0 HB2 HIS A 361 13.227 7.725 -3.242 1.00 0.00 H new ATOM 0 HB3 HIS A 361 13.372 6.169 -2.448 1.00 0.00 H new ATOM 0 HD2 HIS A 361 13.557 4.457 -4.237 1.00 0.00 H new ATOM 0 HE1 HIS A 361 10.516 5.535 -6.899 1.00 0.00 H new ATOM 0 HE2 HIS A 361 12.336 3.844 -6.385 1.00 0.00 H new ATOM 1760 N LEU A 362 9.564 7.947 -3.112 1.00 0.00 N ATOM 1761 CA LEU A 362 8.638 8.918 -3.695 1.00 0.00 C ATOM 1762 C LEU A 362 8.212 9.928 -2.647 1.00 0.00 C ATOM 1763 O LEU A 362 8.269 11.143 -2.849 1.00 0.00 O ATOM 1764 CB LEU A 362 7.371 8.242 -4.252 1.00 0.00 C ATOM 1765 CG LEU A 362 7.563 7.312 -5.450 1.00 0.00 C ATOM 1766 CD1 LEU A 362 8.509 7.901 -6.454 1.00 0.00 C ATOM 1767 CD2 LEU A 362 8.024 5.944 -4.991 1.00 0.00 C ATOM 0 H LEU A 362 9.278 6.973 -3.211 1.00 0.00 H new ATOM 0 HA LEU A 362 9.166 9.408 -4.513 1.00 0.00 H new ATOM 0 HB2 LEU A 362 6.908 7.671 -3.448 1.00 0.00 H new ATOM 0 HB3 LEU A 362 6.665 9.022 -4.536 1.00 0.00 H new ATOM 0 HG LEU A 362 6.600 7.195 -5.947 1.00 0.00 H new ATOM 0 HD11 LEU A 362 8.623 7.214 -7.293 1.00 0.00 H new ATOM 0 HD12 LEU A 362 8.113 8.851 -6.814 1.00 0.00 H new ATOM 0 HD13 LEU A 362 9.479 8.067 -5.986 1.00 0.00 H new ATOM 0 HD21 LEU A 362 8.156 5.295 -5.857 1.00 0.00 H new ATOM 0 HD22 LEU A 362 8.972 6.038 -4.461 1.00 0.00 H new ATOM 0 HD23 LEU A 362 7.277 5.513 -4.325 1.00 0.00 H new ATOM 1779 N CYS A 363 7.824 9.388 -1.513 1.00 0.00 N ATOM 1780 CA CYS A 363 7.329 10.181 -0.392 1.00 0.00 C ATOM 1781 C CYS A 363 8.354 11.068 0.199 1.00 0.00 C ATOM 1782 O CYS A 363 8.086 12.210 0.522 1.00 0.00 O ATOM 1783 CB CYS A 363 6.900 9.296 0.761 1.00 0.00 C ATOM 1784 SG CYS A 363 5.301 8.476 0.565 1.00 0.00 S ATOM 0 H CYS A 363 7.840 8.384 -1.334 1.00 0.00 H new ATOM 0 HA CYS A 363 6.510 10.758 -0.821 1.00 0.00 H new ATOM 0 HB2 CYS A 363 7.663 8.533 0.913 1.00 0.00 H new ATOM 0 HB3 CYS A 363 6.869 9.901 1.667 1.00 0.00 H new ATOM 0 HG CYS A 363 4.410 9.082 1.293 1.00 0.00 H new ATOM 1789 N TRP A 364 9.503 10.508 0.382 1.00 0.00 N ATOM 1790 CA TRP A 364 10.559 11.191 1.042 1.00 0.00 C ATOM 1791 C TRP A 364 11.076 12.348 0.300 1.00 0.00 C ATOM 1792 O TRP A 364 11.199 13.417 0.849 1.00 0.00 O ATOM 1793 CB TRP A 364 11.647 10.233 1.353 1.00 0.00 C ATOM 1794 CG TRP A 364 11.754 10.111 2.798 1.00 0.00 C ATOM 1795 CD1 TRP A 364 10.728 9.911 3.633 1.00 0.00 C ATOM 1796 CD2 TRP A 364 12.910 10.256 3.572 1.00 0.00 C ATOM 1797 NE1 TRP A 364 11.171 9.873 4.917 1.00 0.00 N ATOM 1798 CE2 TRP A 364 12.537 10.087 4.911 1.00 0.00 C ATOM 1799 CE3 TRP A 364 14.224 10.494 3.243 1.00 0.00 C ATOM 1800 CZ2 TRP A 364 13.468 10.160 5.944 1.00 0.00 C ATOM 1801 CZ3 TRP A 364 15.157 10.573 4.255 1.00 0.00 C ATOM 1802 CH2 TRP A 364 14.776 10.405 5.594 1.00 0.00 C ATOM 0 H TRP A 364 9.734 9.563 0.077 1.00 0.00 H new ATOM 0 HA TRP A 364 10.144 11.602 1.963 1.00 0.00 H new ATOM 0 HB2 TRP A 364 11.436 9.262 0.905 1.00 0.00 H new ATOM 0 HB3 TRP A 364 12.590 10.581 0.931 1.00 0.00 H new ATOM 0 HD1 TRP A 364 9.698 9.796 3.331 1.00 0.00 H new ATOM 0 HE1 TRP A 364 10.595 9.714 5.743 1.00 0.00 H new ATOM 0 HE3 TRP A 364 14.519 10.617 2.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 364 13.176 10.030 6.976 1.00 0.00 H new ATOM 0 HZ3 TRP A 364 16.192 10.766 4.014 1.00 0.00 H new ATOM 0 HH2 TRP A 364 15.526 10.469 6.368 1.00 0.00 H new ATOM 1813 N GLU A 365 11.388 12.155 -0.932 1.00 0.00 N ATOM 1814 CA GLU A 365 11.891 13.253 -1.691 1.00 0.00 C ATOM 1815 C GLU A 365 10.805 14.305 -1.740 1.00 0.00 C ATOM 1816 O GLU A 365 11.062 15.507 -1.826 1.00 0.00 O ATOM 1817 CB GLU A 365 12.269 12.770 -3.059 1.00 0.00 C ATOM 1818 CG GLU A 365 11.084 12.233 -3.828 1.00 0.00 C ATOM 1819 CD GLU A 365 11.375 12.024 -5.300 1.00 0.00 C ATOM 1820 OE1 GLU A 365 11.834 10.921 -5.664 1.00 0.00 O ATOM 1821 OE2 GLU A 365 11.145 12.964 -6.090 1.00 0.00 O ATOM 0 H GLU A 365 11.308 11.269 -1.431 1.00 0.00 H new ATOM 0 HA GLU A 365 12.784 13.686 -1.240 1.00 0.00 H new ATOM 0 HB2 GLU A 365 12.721 13.589 -3.619 1.00 0.00 H new ATOM 0 HB3 GLU A 365 13.025 11.990 -2.970 1.00 0.00 H new ATOM 0 HG2 GLU A 365 10.772 11.286 -3.388 1.00 0.00 H new ATOM 0 HG3 GLU A 365 10.248 12.924 -3.724 1.00 0.00 H new ATOM 1828 N LEU A 366 9.574 13.812 -1.652 1.00 0.00 N ATOM 1829 CA LEU A 366 8.410 14.659 -1.633 1.00 0.00 C ATOM 1830 C LEU A 366 8.316 15.324 -0.272 1.00 0.00 C ATOM 1831 O LEU A 366 7.786 16.420 -0.124 1.00 0.00 O ATOM 1832 CB LEU A 366 7.176 13.826 -1.939 1.00 0.00 C ATOM 1833 CG LEU A 366 5.934 14.591 -2.388 1.00 0.00 C ATOM 1834 CD1 LEU A 366 5.138 15.053 -1.193 1.00 0.00 C ATOM 1835 CD2 LEU A 366 6.330 15.758 -3.254 1.00 0.00 C ATOM 0 H LEU A 366 9.366 12.815 -1.592 1.00 0.00 H new ATOM 0 HA LEU A 366 8.483 15.437 -2.393 1.00 0.00 H new ATOM 0 HB2 LEU A 366 7.434 13.107 -2.716 1.00 0.00 H new ATOM 0 HB3 LEU A 366 6.921 13.254 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 366 5.303 13.924 -2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 366 4.256 15.597 -1.531 1.00 0.00 H new ATOM 0 HD12 LEU A 366 4.828 14.188 -0.606 1.00 0.00 H new ATOM 0 HD13 LEU A 366 5.754 15.708 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 366 5.437 16.297 -3.569 1.00 0.00 H new ATOM 0 HD22 LEU A 366 6.977 16.428 -2.688 1.00 0.00 H new ATOM 0 HD23 LEU A 366 6.863 15.395 -4.133 1.00 0.00 H new ATOM 1847 N LEU A 367 8.872 14.616 0.701 1.00 0.00 N ATOM 1848 CA LEU A 367 8.922 15.023 2.092 1.00 0.00 C ATOM 1849 C LEU A 367 9.873 16.182 2.251 1.00 0.00 C ATOM 1850 O LEU A 367 9.537 17.229 2.801 1.00 0.00 O ATOM 1851 CB LEU A 367 9.436 13.857 2.892 1.00 0.00 C ATOM 1852 CG LEU A 367 8.654 13.471 4.127 1.00 0.00 C ATOM 1853 CD1 LEU A 367 7.933 12.150 3.886 1.00 0.00 C ATOM 1854 CD2 LEU A 367 9.616 13.377 5.299 1.00 0.00 C ATOM 0 H LEU A 367 9.315 13.712 0.535 1.00 0.00 H new ATOM 0 HA LEU A 367 7.932 15.326 2.432 1.00 0.00 H new ATOM 0 HB2 LEU A 367 9.480 12.989 2.234 1.00 0.00 H new ATOM 0 HB3 LEU A 367 10.459 14.079 3.195 1.00 0.00 H new ATOM 0 HG LEU A 367 7.898 14.223 4.354 1.00 0.00 H new ATOM 0 HD11 LEU A 367 7.370 11.875 4.778 1.00 0.00 H new ATOM 0 HD12 LEU A 367 7.249 12.257 3.044 1.00 0.00 H new ATOM 0 HD13 LEU A 367 8.663 11.372 3.663 1.00 0.00 H new ATOM 0 HD21 LEU A 367 9.067 13.099 6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 367 10.373 12.622 5.088 1.00 0.00 H new ATOM 0 HD23 LEU A 367 10.099 14.342 5.452 1.00 0.00 H new ATOM 1866 N LYS A 368 11.084 15.956 1.776 1.00 0.00 N ATOM 1867 CA LYS A 368 12.125 16.957 1.808 1.00 0.00 C ATOM 1868 C LYS A 368 11.589 18.205 1.131 1.00 0.00 C ATOM 1869 O LYS A 368 11.958 19.331 1.466 1.00 0.00 O ATOM 1870 CB LYS A 368 13.362 16.412 1.099 1.00 0.00 C ATOM 1871 CG LYS A 368 13.449 14.898 1.207 1.00 0.00 C ATOM 1872 CD LYS A 368 14.856 14.367 1.070 1.00 0.00 C ATOM 1873 CE LYS A 368 14.836 12.854 1.034 1.00 0.00 C ATOM 1874 NZ LYS A 368 16.184 12.270 1.278 1.00 0.00 N ATOM 0 H LYS A 368 11.370 15.071 1.357 1.00 0.00 H new ATOM 0 HA LYS A 368 12.413 17.206 2.829 1.00 0.00 H new ATOM 0 HB2 LYS A 368 13.337 16.701 0.048 1.00 0.00 H new ATOM 0 HB3 LYS A 368 14.257 16.860 1.531 1.00 0.00 H new ATOM 0 HG2 LYS A 368 13.043 14.586 2.169 1.00 0.00 H new ATOM 0 HG3 LYS A 368 12.823 14.450 0.436 1.00 0.00 H new ATOM 0 HD2 LYS A 368 15.313 14.755 0.160 1.00 0.00 H new ATOM 0 HD3 LYS A 368 15.467 14.711 1.905 1.00 0.00 H new ATOM 0 HE2 LYS A 368 14.139 12.483 1.786 1.00 0.00 H new ATOM 0 HE3 LYS A 368 14.467 12.520 0.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 368 16.463 11.687 0.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 368 16.876 13.036 1.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 368 16.157 11.679 2.133 1.00 0.00 H new