USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 942 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 485 TYR OH : rot -111:sc= 0.442 USER MOD Set 1.2: A 486 ASN :FLIP amide:sc= -5.85! C(o=-6.9!,f=-5.4!) USER MOD Set 2.1: A 402 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 403 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 400 LYS NZ :NH3+ 142:sc= -1.15! (180deg=-3.17!) USER MOD Set 3.2: A 405 SER OG : rot 169:sc= -4.06! USER MOD Set 4.1: A 393 LYS NZ :NH3+ 163:sc= 0.121 (180deg=-1.11) USER MOD Set 4.2: A 395 TYR OH : rot 165:sc= 0.26 USER MOD Single : A 378 TYR OH : rot 180:sc= 0 USER MOD Single : A 380 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 383 LYS NZ :NH3+ -171:sc= -4.4 (180deg=-5.02!) USER MOD Single : A 385 LYS NZ :NH3+ -152:sc= -0.0633 (180deg=-1.11) USER MOD Single : A 386 LYS NZ :NH3+ -115:sc= -0.167 (180deg=-1.07) USER MOD Single : A 388 THR OG1 : rot 180:sc=-0.00103 USER MOD Single : A 390 LYS NZ :NH3+ -159:sc= -1.16 (180deg=-2.12!) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 394 GLN : amide:sc= -0.0225 X(o=-0.023,f=-0.26) USER MOD Single : A 397 CYS SG : rot 31:sc= -3.15! USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 406 CYS SG : rot 180:sc= 0 USER MOD Single : A 407 TYR OH : rot 180:sc= 0 USER MOD Single : A 408 LYS NZ :NH3+ -144:sc= -2.16 (180deg=-4.73!) USER MOD Single : A 409 SER OG : rot -12:sc= 0.846 USER MOD Single : A 419 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 420 GLN : amide:sc= -0.869 K(o=-0.87,f=-5.9!) USER MOD Single : A 421 MET CE :methyl -121:sc= -0.0228 (180deg=-0.356) USER MOD Single : A 422 ASN : amide:sc= -2.03 X(o=-2,f=-2.5!) USER MOD Single : A 426 CYS SG : rot 140:sc= -0.848 USER MOD Single : A 429 THR OG1 : rot 37:sc= 1.08 USER MOD Single : A 433 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 437 GLN : amide:sc= -2.21 X(o=-2.2,f=-2) USER MOD Single : A 438 LYS NZ :NH3+ 155:sc= -5.2! (180deg=-7.58!) USER MOD Single : A 440 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 442 LYS NZ :NH3+ -131:sc= 1.26 (180deg=-0.505) USER MOD Single : A 451 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 452 ASN :FLIP amide:sc= -1.23 F(o=-3!,f=-1.2) USER MOD Single : A 458 CYS SG : rot 42:sc= 0.205 USER MOD Single : A 460 ASN :FLIP amide:sc= -2.92! C(o=-3.9!,f=-2.9!) USER MOD Single : A 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 GLN : amide:sc= -0.709 K(o=-0.71,f=-2.5) USER MOD Single : A 464 TYR OH : rot 165:sc= -3.75! USER MOD Single : A 466 HIS : no HE2:sc= 1.04 K(o=1,f=-3.9!) USER MOD Single : A 468 MET CE :methyl -161:sc= -0.0816 (180deg=-0.634) USER MOD Single : A 471 CYS SG : rot -58:sc= -2.21! USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 476 LYS NZ :NH3+ -174:sc= 0.863 (180deg=0.831) USER MOD Single : A 478 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 479 THR OG1 : rot 150:sc= 1.47 USER MOD Single : A 480 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 SER OG : rot 180:sc= 0 USER MOD Single : A 490 GLN : amide:sc= -0.036 K(o=-0.036,f=-2.3!) USER MOD Single : A 491 ASN :FLIP amide:sc= -3.07! C(o=-7!,f=-3.1!) USER MOD Single : A 494 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 119 N ILE A 372 2.544 -15.156 7.762 1.00 0.00 N ATOM 120 CA ILE A 372 4.022 -15.357 7.685 1.00 0.00 C ATOM 121 C ILE A 372 4.691 -14.116 7.074 1.00 0.00 C ATOM 122 O ILE A 372 5.703 -13.658 7.566 1.00 0.00 O ATOM 123 CB ILE A 372 4.366 -16.623 6.843 1.00 0.00 C ATOM 124 CG1 ILE A 372 3.166 -17.587 6.804 1.00 0.00 C ATOM 125 CG2 ILE A 372 5.572 -17.353 7.450 1.00 0.00 C ATOM 126 CD1 ILE A 372 2.849 -18.094 8.216 1.00 0.00 C ATOM 0 HA ILE A 372 4.402 -15.505 8.696 1.00 0.00 H new ATOM 0 HB ILE A 372 4.605 -16.301 5.829 1.00 0.00 H new ATOM 0 HG12 ILE A 372 2.296 -17.080 6.388 1.00 0.00 H new ATOM 0 HG13 ILE A 372 3.388 -18.429 6.148 1.00 0.00 H new ATOM 0 HG21 ILE A 372 5.802 -18.235 6.853 1.00 0.00 H new ATOM 0 HG22 ILE A 372 6.434 -16.686 7.459 1.00 0.00 H new ATOM 0 HG23 ILE A 372 5.338 -17.657 8.470 1.00 0.00 H new ATOM 0 HD11 ILE A 372 1.999 -18.775 8.176 1.00 0.00 H new ATOM 0 HD12 ILE A 372 3.716 -18.619 8.617 1.00 0.00 H new ATOM 0 HD13 ILE A 372 2.607 -17.249 8.860 1.00 0.00 H new ATOM 138 N PRO A 373 4.144 -13.567 6.016 1.00 0.00 N ATOM 139 CA PRO A 373 4.705 -12.372 5.359 1.00 0.00 C ATOM 140 C PRO A 373 3.991 -11.103 5.833 1.00 0.00 C ATOM 141 O PRO A 373 3.528 -10.303 5.044 1.00 0.00 O ATOM 142 CB PRO A 373 4.426 -12.655 3.876 1.00 0.00 C ATOM 143 CG PRO A 373 3.189 -13.532 3.856 1.00 0.00 C ATOM 144 CD PRO A 373 2.931 -13.995 5.307 1.00 0.00 C ATOM 0 HA PRO A 373 5.760 -12.202 5.575 1.00 0.00 H new ATOM 0 HB2 PRO A 373 4.260 -11.730 3.325 1.00 0.00 H new ATOM 0 HB3 PRO A 373 5.271 -13.158 3.407 1.00 0.00 H new ATOM 0 HG2 PRO A 373 2.332 -12.979 3.471 1.00 0.00 H new ATOM 0 HG3 PRO A 373 3.336 -14.389 3.199 1.00 0.00 H new ATOM 0 HD2 PRO A 373 2.036 -13.533 5.724 1.00 0.00 H new ATOM 0 HD3 PRO A 373 2.789 -15.074 5.366 1.00 0.00 H new ATOM 152 N GLU A 374 3.871 -10.931 7.121 1.00 0.00 N ATOM 153 CA GLU A 374 3.156 -9.733 7.644 1.00 0.00 C ATOM 154 C GLU A 374 3.872 -8.440 7.229 1.00 0.00 C ATOM 155 O GLU A 374 5.053 -8.244 7.436 1.00 0.00 O ATOM 156 CB GLU A 374 3.030 -9.819 9.177 1.00 0.00 C ATOM 157 CG GLU A 374 4.325 -9.341 9.856 1.00 0.00 C ATOM 158 CD GLU A 374 4.288 -7.822 10.058 1.00 0.00 C ATOM 159 OE1 GLU A 374 3.417 -7.188 9.487 1.00 0.00 O ATOM 160 OE2 GLU A 374 5.133 -7.320 10.781 1.00 0.00 O ATOM 0 H GLU A 374 4.236 -11.566 7.831 1.00 0.00 H new ATOM 0 HA GLU A 374 2.156 -9.713 7.212 1.00 0.00 H new ATOM 0 HB2 GLU A 374 2.191 -9.210 9.513 1.00 0.00 H new ATOM 0 HB3 GLU A 374 2.816 -10.846 9.472 1.00 0.00 H new ATOM 0 HG2 GLU A 374 4.446 -9.840 10.817 1.00 0.00 H new ATOM 0 HG3 GLU A 374 5.186 -9.613 9.245 1.00 0.00 H new ATOM 167 N LEU A 375 3.130 -7.560 6.650 1.00 0.00 N ATOM 168 CA LEU A 375 3.670 -6.243 6.209 1.00 0.00 C ATOM 169 C LEU A 375 2.529 -5.237 6.305 1.00 0.00 C ATOM 170 O LEU A 375 1.546 -5.339 5.598 1.00 0.00 O ATOM 171 CB LEU A 375 4.192 -6.362 4.765 1.00 0.00 C ATOM 172 CG LEU A 375 4.609 -4.987 4.175 1.00 0.00 C ATOM 173 CD1 LEU A 375 3.395 -4.201 3.636 1.00 0.00 C ATOM 174 CD2 LEU A 375 5.341 -4.139 5.229 1.00 0.00 C ATOM 0 H LEU A 375 2.138 -7.694 6.453 1.00 0.00 H new ATOM 0 HA LEU A 375 4.503 -5.918 6.833 1.00 0.00 H new ATOM 0 HB2 LEU A 375 5.047 -7.038 4.744 1.00 0.00 H new ATOM 0 HB3 LEU A 375 3.419 -6.805 4.137 1.00 0.00 H new ATOM 0 HG LEU A 375 5.282 -5.191 3.343 1.00 0.00 H new ATOM 0 HD11 LEU A 375 3.730 -3.246 3.232 1.00 0.00 H new ATOM 0 HD12 LEU A 375 2.909 -4.777 2.849 1.00 0.00 H new ATOM 0 HD13 LEU A 375 2.687 -4.024 4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 375 5.623 -3.181 4.793 1.00 0.00 H new ATOM 0 HD22 LEU A 375 4.683 -3.970 6.081 1.00 0.00 H new ATOM 0 HD23 LEU A 375 6.236 -4.664 5.561 1.00 0.00 H new ATOM 186 N ALA A 376 2.624 -4.277 7.187 1.00 0.00 N ATOM 187 CA ALA A 376 1.508 -3.296 7.322 1.00 0.00 C ATOM 188 C ALA A 376 2.020 -1.948 7.834 1.00 0.00 C ATOM 189 O ALA A 376 2.949 -1.869 8.613 1.00 0.00 O ATOM 190 CB ALA A 376 0.486 -3.852 8.313 1.00 0.00 C ATOM 0 H ALA A 376 3.416 -4.131 7.813 1.00 0.00 H new ATOM 0 HA ALA A 376 1.054 -3.142 6.343 1.00 0.00 H new ATOM 0 HB1 ALA A 376 -0.337 -3.145 8.422 1.00 0.00 H new ATOM 0 HB2 ALA A 376 0.101 -4.803 7.944 1.00 0.00 H new ATOM 0 HB3 ALA A 376 0.964 -4.005 9.281 1.00 0.00 H new ATOM 196 N ASP A 377 1.385 -0.891 7.409 1.00 0.00 N ATOM 197 CA ASP A 377 1.774 0.474 7.860 1.00 0.00 C ATOM 198 C ASP A 377 0.553 1.379 7.733 1.00 0.00 C ATOM 199 O ASP A 377 -0.437 1.013 7.129 1.00 0.00 O ATOM 200 CB ASP A 377 2.911 1.020 6.997 1.00 0.00 C ATOM 201 CG ASP A 377 3.469 2.294 7.634 1.00 0.00 C ATOM 202 OD1 ASP A 377 3.346 2.433 8.840 1.00 0.00 O ATOM 203 OD2 ASP A 377 4.010 3.109 6.905 1.00 0.00 O ATOM 0 H ASP A 377 0.600 -0.916 6.758 1.00 0.00 H new ATOM 0 HA ASP A 377 2.119 0.437 8.893 1.00 0.00 H new ATOM 0 HB2 ASP A 377 3.699 0.273 6.901 1.00 0.00 H new ATOM 0 HB3 ASP A 377 2.549 1.232 5.991 1.00 0.00 H new ATOM 208 N TYR A 378 0.605 2.549 8.308 1.00 0.00 N ATOM 209 CA TYR A 378 -0.564 3.484 8.241 1.00 0.00 C ATOM 210 C TYR A 378 -0.235 4.683 7.350 1.00 0.00 C ATOM 211 O TYR A 378 0.559 5.530 7.709 1.00 0.00 O ATOM 212 CB TYR A 378 -0.882 3.978 9.656 1.00 0.00 C ATOM 213 CG TYR A 378 0.406 4.299 10.378 1.00 0.00 C ATOM 214 CD1 TYR A 378 1.171 3.268 10.937 1.00 0.00 C ATOM 215 CD2 TYR A 378 0.834 5.628 10.492 1.00 0.00 C ATOM 216 CE1 TYR A 378 2.364 3.565 11.608 1.00 0.00 C ATOM 217 CE2 TYR A 378 2.026 5.925 11.163 1.00 0.00 C ATOM 218 CZ TYR A 378 2.791 4.893 11.721 1.00 0.00 C ATOM 219 OH TYR A 378 3.966 5.187 12.383 1.00 0.00 O ATOM 0 H TYR A 378 1.410 2.903 8.825 1.00 0.00 H new ATOM 0 HA TYR A 378 -1.422 2.959 7.821 1.00 0.00 H new ATOM 0 HB2 TYR A 378 -1.516 4.863 9.610 1.00 0.00 H new ATOM 0 HB3 TYR A 378 -1.438 3.216 10.203 1.00 0.00 H new ATOM 0 HD1 TYR A 378 0.841 2.243 10.851 1.00 0.00 H new ATOM 0 HD2 TYR A 378 0.244 6.424 10.062 1.00 0.00 H new ATOM 0 HE1 TYR A 378 2.954 2.769 12.038 1.00 0.00 H new ATOM 0 HE2 TYR A 378 2.356 6.950 11.250 1.00 0.00 H new ATOM 0 HH TYR A 378 4.116 6.155 12.369 1.00 0.00 H new ATOM 229 N ILE A 379 -0.870 4.782 6.202 1.00 0.00 N ATOM 230 CA ILE A 379 -0.629 5.954 5.301 1.00 0.00 C ATOM 231 C ILE A 379 -1.975 6.432 4.758 1.00 0.00 C ATOM 232 O ILE A 379 -2.944 5.700 4.745 1.00 0.00 O ATOM 233 CB ILE A 379 0.381 5.607 4.176 1.00 0.00 C ATOM 234 CG1 ILE A 379 -0.238 4.792 3.008 1.00 0.00 C ATOM 235 CG2 ILE A 379 1.551 4.832 4.790 1.00 0.00 C ATOM 236 CD1 ILE A 379 -0.353 3.305 3.372 1.00 0.00 C ATOM 0 H ILE A 379 -1.544 4.101 5.852 1.00 0.00 H new ATOM 0 HA ILE A 379 -0.171 6.768 5.863 1.00 0.00 H new ATOM 0 HB ILE A 379 0.715 6.549 3.740 1.00 0.00 H new ATOM 0 HG12 ILE A 379 -1.225 5.188 2.767 1.00 0.00 H new ATOM 0 HG13 ILE A 379 0.378 4.905 2.116 1.00 0.00 H new ATOM 0 HG21 ILE A 379 2.270 4.581 4.010 1.00 0.00 H new ATOM 0 HG22 ILE A 379 2.037 5.447 5.548 1.00 0.00 H new ATOM 0 HG23 ILE A 379 1.179 3.916 5.250 1.00 0.00 H new ATOM 0 HD11 ILE A 379 -0.790 2.758 2.536 1.00 0.00 H new ATOM 0 HD12 ILE A 379 0.638 2.906 3.589 1.00 0.00 H new ATOM 0 HD13 ILE A 379 -0.989 3.194 4.250 1.00 0.00 H new ATOM 248 N LYS A 380 -2.050 7.666 4.341 1.00 0.00 N ATOM 249 CA LYS A 380 -3.335 8.225 3.829 1.00 0.00 C ATOM 250 C LYS A 380 -3.337 8.176 2.308 1.00 0.00 C ATOM 251 O LYS A 380 -2.338 8.398 1.654 1.00 0.00 O ATOM 252 CB LYS A 380 -3.498 9.666 4.357 1.00 0.00 C ATOM 253 CG LYS A 380 -4.480 10.496 3.481 1.00 0.00 C ATOM 254 CD LYS A 380 -5.349 11.440 4.344 1.00 0.00 C ATOM 255 CE LYS A 380 -4.533 12.091 5.477 1.00 0.00 C ATOM 256 NZ LYS A 380 -5.025 13.481 5.696 1.00 0.00 N ATOM 0 H LYS A 380 -1.267 8.319 4.333 1.00 0.00 H new ATOM 0 HA LYS A 380 -4.181 7.634 4.181 1.00 0.00 H new ATOM 0 HB2 LYS A 380 -3.863 9.638 5.384 1.00 0.00 H new ATOM 0 HB3 LYS A 380 -2.525 10.158 4.378 1.00 0.00 H new ATOM 0 HG2 LYS A 380 -3.916 11.081 2.755 1.00 0.00 H new ATOM 0 HG3 LYS A 380 -5.124 9.822 2.916 1.00 0.00 H new ATOM 0 HD2 LYS A 380 -5.779 12.217 3.712 1.00 0.00 H new ATOM 0 HD3 LYS A 380 -6.181 10.880 4.771 1.00 0.00 H new ATOM 0 HE2 LYS A 380 -4.631 11.509 6.393 1.00 0.00 H new ATOM 0 HE3 LYS A 380 -3.474 12.103 5.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 380 -4.478 13.927 6.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 380 -4.910 14.032 4.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 380 -6.031 13.456 5.960 1.00 0.00 H new ATOM 270 N VAL A 381 -4.468 7.855 1.755 1.00 0.00 N ATOM 271 CA VAL A 381 -4.602 7.743 0.281 1.00 0.00 C ATOM 272 C VAL A 381 -5.923 8.393 -0.140 1.00 0.00 C ATOM 273 O VAL A 381 -6.905 8.339 0.574 1.00 0.00 O ATOM 274 CB VAL A 381 -4.604 6.242 -0.064 1.00 0.00 C ATOM 275 CG1 VAL A 381 -5.399 5.478 1.013 1.00 0.00 C ATOM 276 CG2 VAL A 381 -5.232 5.996 -1.444 1.00 0.00 C ATOM 0 H VAL A 381 -5.324 7.661 2.275 1.00 0.00 H new ATOM 0 HA VAL A 381 -3.786 8.244 -0.240 1.00 0.00 H new ATOM 0 HB VAL A 381 -3.574 5.886 -0.091 1.00 0.00 H new ATOM 0 HG11 VAL A 381 -5.405 4.414 0.775 1.00 0.00 H new ATOM 0 HG12 VAL A 381 -4.932 5.630 1.986 1.00 0.00 H new ATOM 0 HG13 VAL A 381 -6.424 5.849 1.041 1.00 0.00 H new ATOM 0 HG21 VAL A 381 -5.221 4.928 -1.664 1.00 0.00 H new ATOM 0 HG22 VAL A 381 -6.261 6.356 -1.445 1.00 0.00 H new ATOM 0 HG23 VAL A 381 -4.660 6.529 -2.204 1.00 0.00 H new ATOM 286 N PHE A 382 -5.958 8.985 -1.300 1.00 0.00 N ATOM 287 CA PHE A 382 -7.214 9.619 -1.796 1.00 0.00 C ATOM 288 C PHE A 382 -7.357 9.238 -3.277 1.00 0.00 C ATOM 289 O PHE A 382 -6.708 9.786 -4.146 1.00 0.00 O ATOM 290 CB PHE A 382 -7.138 11.158 -1.557 1.00 0.00 C ATOM 291 CG PHE A 382 -7.088 11.941 -2.854 1.00 0.00 C ATOM 292 CD1 PHE A 382 -8.277 12.339 -3.474 1.00 0.00 C ATOM 293 CD2 PHE A 382 -5.854 12.261 -3.432 1.00 0.00 C ATOM 294 CE1 PHE A 382 -8.233 13.058 -4.674 1.00 0.00 C ATOM 295 CE2 PHE A 382 -5.810 12.979 -4.632 1.00 0.00 C ATOM 296 CZ PHE A 382 -7.000 13.378 -5.253 1.00 0.00 C ATOM 0 H PHE A 382 -5.162 9.058 -1.934 1.00 0.00 H new ATOM 0 HA PHE A 382 -8.100 9.270 -1.265 1.00 0.00 H new ATOM 0 HB2 PHE A 382 -8.004 11.476 -0.976 1.00 0.00 H new ATOM 0 HB3 PHE A 382 -6.254 11.388 -0.962 1.00 0.00 H new ATOM 0 HD1 PHE A 382 -9.229 12.092 -3.027 1.00 0.00 H new ATOM 0 HD2 PHE A 382 -4.937 11.954 -2.952 1.00 0.00 H new ATOM 0 HE1 PHE A 382 -9.151 13.366 -5.153 1.00 0.00 H new ATOM 0 HE2 PHE A 382 -4.858 13.225 -5.079 1.00 0.00 H new ATOM 0 HZ PHE A 382 -6.966 13.933 -6.179 1.00 0.00 H new ATOM 306 N LYS A 383 -8.180 8.268 -3.563 1.00 0.00 N ATOM 307 CA LYS A 383 -8.342 7.831 -4.977 1.00 0.00 C ATOM 308 C LYS A 383 -9.214 8.863 -5.703 1.00 0.00 C ATOM 309 O LYS A 383 -9.660 9.817 -5.097 1.00 0.00 O ATOM 310 CB LYS A 383 -8.975 6.419 -5.032 1.00 0.00 C ATOM 311 CG LYS A 383 -8.650 5.621 -3.741 1.00 0.00 C ATOM 312 CD LYS A 383 -9.791 5.777 -2.713 1.00 0.00 C ATOM 313 CE LYS A 383 -9.252 5.632 -1.289 1.00 0.00 C ATOM 314 NZ LYS A 383 -8.531 6.875 -0.898 1.00 0.00 N ATOM 0 H LYS A 383 -8.745 7.761 -2.882 1.00 0.00 H new ATOM 0 HA LYS A 383 -7.372 7.770 -5.470 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -10.055 6.504 -5.151 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -8.600 5.881 -5.902 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -8.510 4.567 -3.982 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -7.713 5.977 -3.312 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -10.265 6.752 -2.831 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -10.559 5.025 -2.896 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -10.072 5.442 -0.597 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -8.580 4.776 -1.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -8.037 6.721 0.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -7.839 7.121 -1.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -9.213 7.653 -0.791 1.00 0.00 H new ATOM 328 N PRO A 384 -9.457 8.703 -6.983 1.00 0.00 N ATOM 329 CA PRO A 384 -10.281 9.678 -7.740 1.00 0.00 C ATOM 330 C PRO A 384 -11.706 9.723 -7.202 1.00 0.00 C ATOM 331 O PRO A 384 -12.027 10.583 -6.426 1.00 0.00 O ATOM 332 CB PRO A 384 -10.233 9.197 -9.205 1.00 0.00 C ATOM 333 CG PRO A 384 -9.139 8.177 -9.255 1.00 0.00 C ATOM 334 CD PRO A 384 -8.998 7.604 -7.842 1.00 0.00 C ATOM 0 HA PRO A 384 -9.903 10.696 -7.646 1.00 0.00 H new ATOM 0 HB2 PRO A 384 -11.187 8.765 -9.508 1.00 0.00 H new ATOM 0 HB3 PRO A 384 -10.029 10.025 -9.884 1.00 0.00 H new ATOM 0 HG2 PRO A 384 -9.379 7.389 -9.969 1.00 0.00 H new ATOM 0 HG3 PRO A 384 -8.203 8.630 -9.583 1.00 0.00 H new ATOM 0 HD2 PRO A 384 -9.606 6.709 -7.709 1.00 0.00 H new ATOM 0 HD3 PRO A 384 -7.967 7.325 -7.622 1.00 0.00 H new ATOM 342 N LYS A 385 -12.553 8.803 -7.602 1.00 0.00 N ATOM 343 CA LYS A 385 -13.963 8.802 -7.103 1.00 0.00 C ATOM 344 C LYS A 385 -14.843 7.863 -7.941 1.00 0.00 C ATOM 345 O LYS A 385 -15.044 8.067 -9.122 1.00 0.00 O ATOM 346 CB LYS A 385 -14.530 10.238 -7.206 1.00 0.00 C ATOM 347 CG LYS A 385 -14.474 10.977 -5.831 1.00 0.00 C ATOM 348 CD LYS A 385 -13.903 12.411 -5.978 1.00 0.00 C ATOM 349 CE LYS A 385 -13.068 12.770 -4.745 1.00 0.00 C ATOM 350 NZ LYS A 385 -13.779 12.317 -3.518 1.00 0.00 N ATOM 0 H LYS A 385 -12.326 8.052 -8.254 1.00 0.00 H new ATOM 0 HA LYS A 385 -13.967 8.455 -6.070 1.00 0.00 H new ATOM 0 HB2 LYS A 385 -13.963 10.802 -7.946 1.00 0.00 H new ATOM 0 HB3 LYS A 385 -15.561 10.199 -7.557 1.00 0.00 H new ATOM 0 HG2 LYS A 385 -15.475 11.025 -5.402 1.00 0.00 H new ATOM 0 HG3 LYS A 385 -13.856 10.408 -5.136 1.00 0.00 H new ATOM 0 HD2 LYS A 385 -13.288 12.476 -6.876 1.00 0.00 H new ATOM 0 HD3 LYS A 385 -14.718 13.126 -6.097 1.00 0.00 H new ATOM 0 HE2 LYS A 385 -12.088 12.298 -4.806 1.00 0.00 H new ATOM 0 HE3 LYS A 385 -12.901 13.846 -4.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 385 -13.513 12.926 -2.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 385 -14.806 12.375 -3.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 385 -13.515 11.333 -3.307 1.00 0.00 H new ATOM 364 N LYS A 386 -15.411 6.868 -7.314 1.00 0.00 N ATOM 365 CA LYS A 386 -16.326 5.942 -8.013 1.00 0.00 C ATOM 366 C LYS A 386 -17.751 6.339 -7.612 1.00 0.00 C ATOM 367 O LYS A 386 -18.512 6.868 -8.398 1.00 0.00 O ATOM 368 CB LYS A 386 -16.013 4.529 -7.526 1.00 0.00 C ATOM 369 CG LYS A 386 -16.919 3.489 -8.212 1.00 0.00 C ATOM 370 CD LYS A 386 -16.207 2.865 -9.429 1.00 0.00 C ATOM 371 CE LYS A 386 -15.112 1.883 -8.979 1.00 0.00 C ATOM 372 NZ LYS A 386 -14.851 0.909 -10.075 1.00 0.00 N ATOM 0 H LYS A 386 -15.271 6.660 -6.325 1.00 0.00 H new ATOM 0 HA LYS A 386 -16.217 5.983 -9.097 1.00 0.00 H new ATOM 0 HB2 LYS A 386 -14.968 4.295 -7.729 1.00 0.00 H new ATOM 0 HB3 LYS A 386 -16.147 4.476 -6.446 1.00 0.00 H new ATOM 0 HG2 LYS A 386 -17.187 2.708 -7.501 1.00 0.00 H new ATOM 0 HG3 LYS A 386 -17.848 3.962 -8.531 1.00 0.00 H new ATOM 0 HD2 LYS A 386 -16.933 2.345 -10.053 1.00 0.00 H new ATOM 0 HD3 LYS A 386 -15.766 3.652 -10.041 1.00 0.00 H new ATOM 0 HE2 LYS A 386 -14.199 2.425 -8.732 1.00 0.00 H new ATOM 0 HE3 LYS A 386 -15.425 1.358 -8.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 386 -15.125 -0.045 -9.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 386 -15.407 1.173 -10.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 386 -13.839 0.918 -10.314 1.00 0.00 H new ATOM 386 N LEU A 387 -18.097 6.099 -6.371 1.00 0.00 N ATOM 387 CA LEU A 387 -19.443 6.460 -5.853 1.00 0.00 C ATOM 388 C LEU A 387 -19.308 7.755 -5.032 1.00 0.00 C ATOM 389 O LEU A 387 -20.189 8.114 -4.276 1.00 0.00 O ATOM 390 CB LEU A 387 -19.918 5.306 -4.951 1.00 0.00 C ATOM 391 CG LEU A 387 -20.823 4.336 -5.736 1.00 0.00 C ATOM 392 CD1 LEU A 387 -20.806 2.957 -5.068 1.00 0.00 C ATOM 393 CD2 LEU A 387 -22.262 4.867 -5.758 1.00 0.00 C ATOM 0 H LEU A 387 -17.485 5.658 -5.684 1.00 0.00 H new ATOM 0 HA LEU A 387 -20.159 6.618 -6.659 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -19.056 4.768 -4.557 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -20.462 5.707 -4.096 1.00 0.00 H new ATOM 0 HG LEU A 387 -20.450 4.253 -6.757 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -21.447 2.274 -5.626 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -19.787 2.571 -5.057 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -21.172 3.044 -4.045 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -22.896 4.177 -6.314 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -22.632 4.957 -4.737 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -22.282 5.845 -6.239 1.00 0.00 H new ATOM 405 N THR A 388 -18.194 8.434 -5.184 1.00 0.00 N ATOM 406 CA THR A 388 -17.918 9.706 -4.443 1.00 0.00 C ATOM 407 C THR A 388 -18.660 9.801 -3.102 1.00 0.00 C ATOM 408 O THR A 388 -19.832 10.111 -3.035 1.00 0.00 O ATOM 409 CB THR A 388 -18.263 10.918 -5.329 1.00 0.00 C ATOM 410 OG1 THR A 388 -17.704 12.091 -4.752 1.00 0.00 O ATOM 411 CG2 THR A 388 -19.785 11.101 -5.455 1.00 0.00 C ATOM 0 H THR A 388 -17.442 8.148 -5.811 1.00 0.00 H new ATOM 0 HA THR A 388 -16.854 9.707 -4.208 1.00 0.00 H new ATOM 0 HB THR A 388 -17.851 10.744 -6.323 1.00 0.00 H new ATOM 0 HG1 THR A 388 -17.919 12.866 -5.312 1.00 0.00 H new ATOM 0 HG21 THR A 388 -19.997 11.964 -6.086 1.00 0.00 H new ATOM 0 HG22 THR A 388 -20.223 10.209 -5.902 1.00 0.00 H new ATOM 0 HG23 THR A 388 -20.215 11.260 -4.466 1.00 0.00 H new ATOM 419 N LEU A 389 -17.946 9.579 -2.028 1.00 0.00 N ATOM 420 CA LEU A 389 -18.546 9.703 -0.660 1.00 0.00 C ATOM 421 C LEU A 389 -17.446 10.167 0.321 1.00 0.00 C ATOM 422 O LEU A 389 -17.713 10.900 1.252 1.00 0.00 O ATOM 423 CB LEU A 389 -19.215 8.383 -0.177 1.00 0.00 C ATOM 424 CG LEU A 389 -18.780 7.169 -1.015 1.00 0.00 C ATOM 425 CD1 LEU A 389 -17.394 6.713 -0.583 1.00 0.00 C ATOM 426 CD2 LEU A 389 -19.767 6.016 -0.791 1.00 0.00 C ATOM 0 H LEU A 389 -16.961 9.314 -2.038 1.00 0.00 H new ATOM 0 HA LEU A 389 -19.346 10.442 -0.698 1.00 0.00 H new ATOM 0 HB2 LEU A 389 -18.960 8.210 0.869 1.00 0.00 H new ATOM 0 HB3 LEU A 389 -20.299 8.488 -0.228 1.00 0.00 H new ATOM 0 HG LEU A 389 -18.763 7.452 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 389 -17.091 5.853 -1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 389 -16.682 7.525 -0.729 1.00 0.00 H new ATOM 0 HD13 LEU A 389 -17.415 6.434 0.471 1.00 0.00 H new ATOM 0 HD21 LEU A 389 -19.461 5.154 -1.384 1.00 0.00 H new ATOM 0 HD22 LEU A 389 -19.776 5.745 0.265 1.00 0.00 H new ATOM 0 HD23 LEU A 389 -20.766 6.328 -1.094 1.00 0.00 H new ATOM 438 N LYS A 390 -16.208 9.777 0.106 1.00 0.00 N ATOM 439 CA LYS A 390 -15.103 10.238 1.015 1.00 0.00 C ATOM 440 C LYS A 390 -13.778 10.295 0.225 1.00 0.00 C ATOM 441 O LYS A 390 -13.501 11.267 -0.449 1.00 0.00 O ATOM 442 CB LYS A 390 -14.977 9.298 2.241 1.00 0.00 C ATOM 443 CG LYS A 390 -15.653 7.957 1.942 1.00 0.00 C ATOM 444 CD LYS A 390 -15.454 6.969 3.116 1.00 0.00 C ATOM 445 CE LYS A 390 -16.621 7.074 4.107 1.00 0.00 C ATOM 446 NZ LYS A 390 -16.675 8.451 4.671 1.00 0.00 N ATOM 0 H LYS A 390 -15.916 9.163 -0.655 1.00 0.00 H new ATOM 0 HA LYS A 390 -15.336 11.236 1.386 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -13.926 9.139 2.482 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -15.438 9.761 3.114 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -16.718 8.112 1.767 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -15.239 7.531 1.028 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -15.383 5.950 2.734 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -14.515 7.184 3.626 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -17.560 6.839 3.605 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -16.497 6.346 4.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -17.201 8.438 5.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -15.708 8.794 4.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -17.153 9.083 3.998 1.00 0.00 H new ATOM 460 N GLY A 391 -12.953 9.275 0.305 1.00 0.00 N ATOM 461 CA GLY A 391 -11.648 9.300 -0.442 1.00 0.00 C ATOM 462 C GLY A 391 -10.533 9.770 0.498 1.00 0.00 C ATOM 463 O GLY A 391 -9.574 9.063 0.737 1.00 0.00 O ATOM 0 H GLY A 391 -13.124 8.431 0.851 1.00 0.00 H new ATOM 0 HA2 GLY A 391 -11.418 8.307 -0.829 1.00 0.00 H new ATOM 0 HA3 GLY A 391 -11.720 9.967 -1.301 1.00 0.00 H new ATOM 467 N TYR A 392 -10.647 10.956 1.033 1.00 0.00 N ATOM 468 CA TYR A 392 -9.589 11.462 1.956 1.00 0.00 C ATOM 469 C TYR A 392 -9.732 10.755 3.308 1.00 0.00 C ATOM 470 O TYR A 392 -10.528 11.135 4.143 1.00 0.00 O ATOM 471 CB TYR A 392 -9.748 12.992 2.124 1.00 0.00 C ATOM 472 CG TYR A 392 -8.500 13.715 1.658 1.00 0.00 C ATOM 473 CD1 TYR A 392 -8.324 13.999 0.299 1.00 0.00 C ATOM 474 CD2 TYR A 392 -7.525 14.097 2.586 1.00 0.00 C ATOM 475 CE1 TYR A 392 -7.171 14.665 -0.133 1.00 0.00 C ATOM 476 CE2 TYR A 392 -6.372 14.764 2.154 1.00 0.00 C ATOM 477 CZ TYR A 392 -6.194 15.047 0.796 1.00 0.00 C ATOM 478 OH TYR A 392 -5.057 15.704 0.371 1.00 0.00 O ATOM 0 H TYR A 392 -11.425 11.595 0.872 1.00 0.00 H new ATOM 0 HA TYR A 392 -8.599 11.256 1.549 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -10.609 13.338 1.553 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -9.943 13.230 3.170 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -9.078 13.704 -0.416 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.662 13.878 3.635 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -7.035 14.884 -1.182 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -5.620 15.060 2.870 1.00 0.00 H new ATOM 0 HH TYR A 392 -4.484 15.898 1.142 1.00 0.00 H new ATOM 488 N LYS A 393 -8.967 9.729 3.519 1.00 0.00 N ATOM 489 CA LYS A 393 -9.049 8.982 4.805 1.00 0.00 C ATOM 490 C LYS A 393 -7.744 8.221 5.034 1.00 0.00 C ATOM 491 O LYS A 393 -6.745 8.465 4.387 1.00 0.00 O ATOM 492 CB LYS A 393 -10.219 7.999 4.748 1.00 0.00 C ATOM 493 CG LYS A 393 -10.294 7.403 3.347 1.00 0.00 C ATOM 494 CD LYS A 393 -11.221 6.169 3.337 1.00 0.00 C ATOM 495 CE LYS A 393 -11.981 6.097 2.006 1.00 0.00 C ATOM 496 NZ LYS A 393 -12.526 4.727 1.823 1.00 0.00 N ATOM 0 H LYS A 393 -8.282 9.370 2.854 1.00 0.00 H new ATOM 0 HA LYS A 393 -9.207 9.681 5.626 1.00 0.00 H new ATOM 0 HB2 LYS A 393 -10.084 7.209 5.487 1.00 0.00 H new ATOM 0 HB3 LYS A 393 -11.152 8.508 4.992 1.00 0.00 H new ATOM 0 HG2 LYS A 393 -10.665 8.151 2.646 1.00 0.00 H new ATOM 0 HG3 LYS A 393 -9.296 7.119 3.012 1.00 0.00 H new ATOM 0 HD2 LYS A 393 -10.634 5.262 3.480 1.00 0.00 H new ATOM 0 HD3 LYS A 393 -11.927 6.227 4.166 1.00 0.00 H new ATOM 0 HE2 LYS A 393 -12.791 6.827 1.997 1.00 0.00 H new ATOM 0 HE3 LYS A 393 -11.315 6.349 1.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 393 -13.266 4.742 1.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 393 -11.762 4.086 1.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 393 -12.932 4.392 2.720 1.00 0.00 H new ATOM 510 N GLN A 394 -7.755 7.308 5.968 1.00 0.00 N ATOM 511 CA GLN A 394 -6.531 6.510 6.291 1.00 0.00 C ATOM 512 C GLN A 394 -6.814 5.006 6.177 1.00 0.00 C ATOM 513 O GLN A 394 -7.584 4.446 6.932 1.00 0.00 O ATOM 514 CB GLN A 394 -6.100 6.831 7.727 1.00 0.00 C ATOM 515 CG GLN A 394 -5.975 8.370 7.926 1.00 0.00 C ATOM 516 CD GLN A 394 -4.573 8.731 8.430 1.00 0.00 C ATOM 517 OE1 GLN A 394 -3.588 8.222 7.934 1.00 0.00 O ATOM 518 NE2 GLN A 394 -4.444 9.594 9.398 1.00 0.00 N ATOM 0 H GLN A 394 -8.573 7.076 6.531 1.00 0.00 H new ATOM 0 HA GLN A 394 -5.743 6.770 5.584 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -6.827 6.425 8.431 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -5.145 6.351 7.942 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -6.173 8.882 6.984 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -6.724 8.713 8.639 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -5.272 10.021 9.814 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -3.515 9.842 9.739 1.00 0.00 H new ATOM 527 N TYR A 395 -6.174 4.349 5.245 1.00 0.00 N ATOM 528 CA TYR A 395 -6.367 2.879 5.073 1.00 0.00 C ATOM 529 C TYR A 395 -5.302 2.135 5.893 1.00 0.00 C ATOM 530 O TYR A 395 -4.137 2.489 5.881 1.00 0.00 O ATOM 531 CB TYR A 395 -6.146 2.497 3.598 1.00 0.00 C ATOM 532 CG TYR A 395 -7.381 2.747 2.765 1.00 0.00 C ATOM 533 CD1 TYR A 395 -7.820 4.053 2.545 1.00 0.00 C ATOM 534 CD2 TYR A 395 -8.061 1.670 2.175 1.00 0.00 C ATOM 535 CE1 TYR A 395 -8.936 4.288 1.739 1.00 0.00 C ATOM 536 CE2 TYR A 395 -9.182 1.905 1.374 1.00 0.00 C ATOM 537 CZ TYR A 395 -9.618 3.214 1.153 1.00 0.00 C ATOM 538 OH TYR A 395 -10.721 3.445 0.360 1.00 0.00 O ATOM 0 H TYR A 395 -5.519 4.774 4.589 1.00 0.00 H new ATOM 0 HA TYR A 395 -7.374 2.616 5.395 1.00 0.00 H new ATOM 0 HB2 TYR A 395 -5.312 3.072 3.194 1.00 0.00 H new ATOM 0 HB3 TYR A 395 -5.869 1.445 3.532 1.00 0.00 H new ATOM 0 HD1 TYR A 395 -7.297 4.882 2.998 1.00 0.00 H new ATOM 0 HD2 TYR A 395 -7.718 0.659 2.340 1.00 0.00 H new ATOM 0 HE1 TYR A 395 -9.274 5.299 1.567 1.00 0.00 H new ATOM 0 HE2 TYR A 395 -9.710 1.076 0.927 1.00 0.00 H new ATOM 0 HH TYR A 395 -10.930 2.637 -0.153 1.00 0.00 H new ATOM 548 N TRP A 396 -5.694 1.078 6.555 1.00 0.00 N ATOM 549 CA TRP A 396 -4.722 0.244 7.333 1.00 0.00 C ATOM 550 C TRP A 396 -4.797 -1.167 6.740 1.00 0.00 C ATOM 551 O TRP A 396 -5.667 -1.946 7.073 1.00 0.00 O ATOM 552 CB TRP A 396 -5.092 0.230 8.837 1.00 0.00 C ATOM 553 CG TRP A 396 -6.505 0.685 9.033 1.00 0.00 C ATOM 554 CD1 TRP A 396 -7.574 0.237 8.337 1.00 0.00 C ATOM 555 CD2 TRP A 396 -7.015 1.665 9.983 1.00 0.00 C ATOM 556 NE1 TRP A 396 -8.710 0.878 8.800 1.00 0.00 N ATOM 557 CE2 TRP A 396 -8.416 1.769 9.814 1.00 0.00 C ATOM 558 CE3 TRP A 396 -6.403 2.466 10.965 1.00 0.00 C ATOM 559 CZ2 TRP A 396 -9.183 2.637 10.593 1.00 0.00 C ATOM 560 CZ3 TRP A 396 -7.172 3.340 11.750 1.00 0.00 C ATOM 561 CH2 TRP A 396 -8.559 3.425 11.564 1.00 0.00 C ATOM 0 H TRP A 396 -6.659 0.751 6.592 1.00 0.00 H new ATOM 0 HA TRP A 396 -3.712 0.647 7.263 1.00 0.00 H new ATOM 0 HB2 TRP A 396 -4.968 -0.776 9.239 1.00 0.00 H new ATOM 0 HB3 TRP A 396 -4.414 0.880 9.391 1.00 0.00 H new ATOM 0 HD1 TRP A 396 -7.546 -0.501 7.549 1.00 0.00 H new ATOM 0 HE1 TRP A 396 -9.649 0.713 8.437 1.00 0.00 H new ATOM 0 HE3 TRP A 396 -5.335 2.408 11.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 396 -10.251 2.699 10.446 1.00 0.00 H new ATOM 0 HZ3 TRP A 396 -6.692 3.950 12.501 1.00 0.00 H new ATOM 0 HH2 TRP A 396 -9.145 4.099 12.171 1.00 0.00 H new ATOM 572 N CYS A 397 -3.913 -1.483 5.829 1.00 0.00 N ATOM 573 CA CYS A 397 -3.956 -2.826 5.169 1.00 0.00 C ATOM 574 C CYS A 397 -3.016 -3.814 5.860 1.00 0.00 C ATOM 575 O CYS A 397 -2.215 -3.455 6.698 1.00 0.00 O ATOM 576 CB CYS A 397 -3.529 -2.673 3.707 1.00 0.00 C ATOM 577 SG CYS A 397 -3.895 -4.201 2.812 1.00 0.00 S ATOM 0 H CYS A 397 -3.162 -0.870 5.512 1.00 0.00 H new ATOM 0 HA CYS A 397 -4.973 -3.213 5.238 1.00 0.00 H new ATOM 0 HB2 CYS A 397 -4.055 -1.835 3.249 1.00 0.00 H new ATOM 0 HB3 CYS A 397 -2.463 -2.451 3.649 1.00 0.00 H new ATOM 0 HG CYS A 397 -4.944 -4.768 3.331 1.00 0.00 H new ATOM 583 N THR A 398 -3.112 -5.066 5.490 1.00 0.00 N ATOM 584 CA THR A 398 -2.233 -6.119 6.087 1.00 0.00 C ATOM 585 C THR A 398 -1.980 -7.193 5.025 1.00 0.00 C ATOM 586 O THR A 398 -2.890 -7.653 4.365 1.00 0.00 O ATOM 587 CB THR A 398 -2.920 -6.750 7.313 1.00 0.00 C ATOM 588 OG1 THR A 398 -2.596 -8.133 7.379 1.00 0.00 O ATOM 589 CG2 THR A 398 -4.441 -6.589 7.208 1.00 0.00 C ATOM 0 H THR A 398 -3.771 -5.408 4.790 1.00 0.00 H new ATOM 0 HA THR A 398 -1.290 -5.677 6.409 1.00 0.00 H new ATOM 0 HB THR A 398 -2.570 -6.246 8.214 1.00 0.00 H new ATOM 0 HG1 THR A 398 -3.032 -8.534 8.160 1.00 0.00 H new ATOM 0 HG21 THR A 398 -4.916 -7.039 8.080 1.00 0.00 H new ATOM 0 HG22 THR A 398 -4.693 -5.529 7.164 1.00 0.00 H new ATOM 0 HG23 THR A 398 -4.798 -7.084 6.305 1.00 0.00 H new ATOM 597 N PHE A 399 -0.746 -7.581 4.837 1.00 0.00 N ATOM 598 CA PHE A 399 -0.425 -8.608 3.798 1.00 0.00 C ATOM 599 C PHE A 399 -0.422 -10.011 4.423 1.00 0.00 C ATOM 600 O PHE A 399 0.465 -10.363 5.176 1.00 0.00 O ATOM 601 CB PHE A 399 0.964 -8.285 3.217 1.00 0.00 C ATOM 602 CG PHE A 399 1.076 -8.728 1.771 1.00 0.00 C ATOM 603 CD1 PHE A 399 1.223 -10.085 1.464 1.00 0.00 C ATOM 604 CD2 PHE A 399 1.054 -7.777 0.740 1.00 0.00 C ATOM 605 CE1 PHE A 399 1.341 -10.494 0.129 1.00 0.00 C ATOM 606 CE2 PHE A 399 1.176 -8.186 -0.593 1.00 0.00 C ATOM 607 CZ PHE A 399 1.319 -9.545 -0.898 1.00 0.00 C ATOM 0 H PHE A 399 0.057 -7.231 5.359 1.00 0.00 H new ATOM 0 HA PHE A 399 -1.176 -8.589 3.009 1.00 0.00 H new ATOM 0 HB2 PHE A 399 1.148 -7.213 3.286 1.00 0.00 H new ATOM 0 HB3 PHE A 399 1.732 -8.780 3.811 1.00 0.00 H new ATOM 0 HD1 PHE A 399 1.246 -10.818 2.257 1.00 0.00 H new ATOM 0 HD2 PHE A 399 0.943 -6.729 0.975 1.00 0.00 H new ATOM 0 HE1 PHE A 399 1.449 -11.542 -0.107 1.00 0.00 H new ATOM 0 HE2 PHE A 399 1.160 -7.453 -1.386 1.00 0.00 H new ATOM 0 HZ PHE A 399 1.412 -9.860 -1.927 1.00 0.00 H new ATOM 617 N LYS A 400 -1.404 -10.817 4.109 1.00 0.00 N ATOM 618 CA LYS A 400 -1.449 -12.197 4.675 1.00 0.00 C ATOM 619 C LYS A 400 -0.602 -13.138 3.819 1.00 0.00 C ATOM 620 O LYS A 400 0.061 -12.726 2.890 1.00 0.00 O ATOM 621 CB LYS A 400 -2.880 -12.722 4.682 1.00 0.00 C ATOM 622 CG LYS A 400 -3.818 -11.703 5.327 1.00 0.00 C ATOM 623 CD LYS A 400 -5.169 -12.375 5.598 1.00 0.00 C ATOM 624 CE LYS A 400 -6.254 -11.312 5.774 1.00 0.00 C ATOM 625 NZ LYS A 400 -6.522 -10.657 4.462 1.00 0.00 N ATOM 0 H LYS A 400 -2.175 -10.579 3.486 1.00 0.00 H new ATOM 0 HA LYS A 400 -1.063 -12.158 5.694 1.00 0.00 H new ATOM 0 HB2 LYS A 400 -3.203 -12.929 3.662 1.00 0.00 H new ATOM 0 HB3 LYS A 400 -2.926 -13.664 5.228 1.00 0.00 H new ATOM 0 HG2 LYS A 400 -3.389 -11.331 6.257 1.00 0.00 H new ATOM 0 HG3 LYS A 400 -3.950 -10.843 4.670 1.00 0.00 H new ATOM 0 HD2 LYS A 400 -5.428 -13.037 4.772 1.00 0.00 H new ATOM 0 HD3 LYS A 400 -5.104 -12.993 6.494 1.00 0.00 H new ATOM 0 HE2 LYS A 400 -7.166 -11.768 6.159 1.00 0.00 H new ATOM 0 HE3 LYS A 400 -5.936 -10.569 6.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 -7.540 -10.467 4.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 -5.997 -9.761 4.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 -6.216 -11.285 3.692 1.00 0.00 H new ATOM 639 N ASP A 401 -0.633 -14.406 4.139 1.00 0.00 N ATOM 640 CA ASP A 401 0.148 -15.424 3.371 1.00 0.00 C ATOM 641 C ASP A 401 0.158 -15.089 1.875 1.00 0.00 C ATOM 642 O ASP A 401 1.201 -14.956 1.267 1.00 0.00 O ATOM 643 CB ASP A 401 -0.515 -16.786 3.556 1.00 0.00 C ATOM 644 CG ASP A 401 -0.667 -17.086 5.049 1.00 0.00 C ATOM 645 OD1 ASP A 401 -0.006 -16.429 5.837 1.00 0.00 O ATOM 646 OD2 ASP A 401 -1.442 -17.969 5.379 1.00 0.00 O ATOM 0 H ASP A 401 -1.176 -14.786 4.914 1.00 0.00 H new ATOM 0 HA ASP A 401 1.174 -15.431 3.739 1.00 0.00 H new ATOM 0 HB2 ASP A 401 -1.492 -16.795 3.072 1.00 0.00 H new ATOM 0 HB3 ASP A 401 0.084 -17.561 3.078 1.00 0.00 H new ATOM 651 N THR A 402 -0.999 -14.967 1.274 1.00 0.00 N ATOM 652 CA THR A 402 -1.063 -14.656 -0.187 1.00 0.00 C ATOM 653 C THR A 402 -2.234 -13.709 -0.466 1.00 0.00 C ATOM 654 O THR A 402 -2.330 -13.136 -1.534 1.00 0.00 O ATOM 655 CB THR A 402 -1.271 -15.954 -0.978 1.00 0.00 C ATOM 656 OG1 THR A 402 -2.632 -16.352 -0.879 1.00 0.00 O ATOM 657 CG2 THR A 402 -0.374 -17.061 -0.419 1.00 0.00 C ATOM 0 H THR A 402 -1.904 -15.070 1.733 1.00 0.00 H new ATOM 0 HA THR A 402 -0.130 -14.182 -0.491 1.00 0.00 H new ATOM 0 HB THR A 402 -1.012 -15.781 -2.023 1.00 0.00 H new ATOM 0 HG1 THR A 402 -2.768 -17.180 -1.385 1.00 0.00 H new ATOM 0 HG21 THR A 402 -0.530 -17.978 -0.988 1.00 0.00 H new ATOM 0 HG22 THR A 402 0.670 -16.758 -0.498 1.00 0.00 H new ATOM 0 HG23 THR A 402 -0.622 -17.237 0.628 1.00 0.00 H new ATOM 665 N SER A 403 -3.132 -13.547 0.478 1.00 0.00 N ATOM 666 CA SER A 403 -4.313 -12.640 0.257 1.00 0.00 C ATOM 667 C SER A 403 -4.158 -11.354 1.069 1.00 0.00 C ATOM 668 O SER A 403 -3.369 -11.274 1.988 1.00 0.00 O ATOM 669 CB SER A 403 -5.590 -13.357 0.697 1.00 0.00 C ATOM 670 OG SER A 403 -5.785 -14.508 -0.114 1.00 0.00 O ATOM 0 H SER A 403 -3.101 -14.001 1.391 1.00 0.00 H new ATOM 0 HA SER A 403 -4.369 -12.388 -0.802 1.00 0.00 H new ATOM 0 HB2 SER A 403 -5.516 -13.645 1.746 1.00 0.00 H new ATOM 0 HB3 SER A 403 -6.445 -12.687 0.610 1.00 0.00 H new ATOM 0 HG SER A 403 -6.602 -14.971 0.166 1.00 0.00 H new ATOM 676 N ILE A 404 -4.910 -10.338 0.715 1.00 0.00 N ATOM 677 CA ILE A 404 -4.831 -9.025 1.431 1.00 0.00 C ATOM 678 C ILE A 404 -6.149 -8.739 2.159 1.00 0.00 C ATOM 679 O ILE A 404 -7.155 -9.383 1.935 1.00 0.00 O ATOM 680 CB ILE A 404 -4.592 -7.913 0.405 1.00 0.00 C ATOM 681 CG1 ILE A 404 -3.442 -8.295 -0.533 1.00 0.00 C ATOM 682 CG2 ILE A 404 -4.266 -6.598 1.118 1.00 0.00 C ATOM 683 CD1 ILE A 404 -2.176 -8.632 0.263 1.00 0.00 C ATOM 0 H ILE A 404 -5.584 -10.364 -0.050 1.00 0.00 H new ATOM 0 HA ILE A 404 -4.017 -9.064 2.155 1.00 0.00 H new ATOM 0 HB ILE A 404 -5.500 -7.782 -0.184 1.00 0.00 H new ATOM 0 HG12 ILE A 404 -3.733 -9.151 -1.141 1.00 0.00 H new ATOM 0 HG13 ILE A 404 -3.237 -7.472 -1.218 1.00 0.00 H new ATOM 0 HG21 ILE A 404 -4.098 -5.815 0.378 1.00 0.00 H new ATOM 0 HG22 ILE A 404 -5.100 -6.317 1.761 1.00 0.00 H new ATOM 0 HG23 ILE A 404 -3.368 -6.725 1.722 1.00 0.00 H new ATOM 0 HD11 ILE A 404 -1.374 -8.900 -0.425 1.00 0.00 H new ATOM 0 HD12 ILE A 404 -1.875 -7.765 0.851 1.00 0.00 H new ATOM 0 HD13 ILE A 404 -2.378 -9.471 0.929 1.00 0.00 H new ATOM 695 N SER A 405 -6.141 -7.752 3.019 1.00 0.00 N ATOM 696 CA SER A 405 -7.377 -7.364 3.776 1.00 0.00 C ATOM 697 C SER A 405 -7.508 -5.832 3.704 1.00 0.00 C ATOM 698 O SER A 405 -6.525 -5.137 3.529 1.00 0.00 O ATOM 699 CB SER A 405 -7.248 -7.843 5.239 1.00 0.00 C ATOM 700 OG SER A 405 -5.996 -8.497 5.403 1.00 0.00 O ATOM 0 H SER A 405 -5.319 -7.188 3.234 1.00 0.00 H new ATOM 0 HA SER A 405 -8.267 -7.826 3.348 1.00 0.00 H new ATOM 0 HB2 SER A 405 -7.322 -6.996 5.921 1.00 0.00 H new ATOM 0 HB3 SER A 405 -8.063 -8.523 5.486 1.00 0.00 H new ATOM 0 HG SER A 405 -5.827 -8.646 6.357 1.00 0.00 H new ATOM 706 N CYS A 406 -8.707 -5.299 3.801 1.00 0.00 N ATOM 707 CA CYS A 406 -8.871 -3.810 3.693 1.00 0.00 C ATOM 708 C CYS A 406 -9.950 -3.276 4.648 1.00 0.00 C ATOM 709 O CYS A 406 -11.101 -3.655 4.571 1.00 0.00 O ATOM 710 CB CYS A 406 -9.287 -3.479 2.257 1.00 0.00 C ATOM 711 SG CYS A 406 -9.289 -1.684 2.023 1.00 0.00 S ATOM 0 H CYS A 406 -9.569 -5.823 3.949 1.00 0.00 H new ATOM 0 HA CYS A 406 -7.924 -3.341 3.961 1.00 0.00 H new ATOM 0 HB2 CYS A 406 -8.600 -3.947 1.552 1.00 0.00 H new ATOM 0 HB3 CYS A 406 -10.278 -3.884 2.053 1.00 0.00 H new ATOM 0 HG CYS A 406 -9.640 -1.406 0.803 1.00 0.00 H new ATOM 717 N TYR A 407 -9.591 -2.349 5.514 1.00 0.00 N ATOM 718 CA TYR A 407 -10.601 -1.728 6.440 1.00 0.00 C ATOM 719 C TYR A 407 -10.498 -0.207 6.312 1.00 0.00 C ATOM 720 O TYR A 407 -9.432 0.364 6.424 1.00 0.00 O ATOM 721 CB TYR A 407 -10.325 -2.117 7.905 1.00 0.00 C ATOM 722 CG TYR A 407 -9.850 -3.546 8.011 1.00 0.00 C ATOM 723 CD1 TYR A 407 -8.522 -3.865 7.707 1.00 0.00 C ATOM 724 CD2 TYR A 407 -10.727 -4.547 8.445 1.00 0.00 C ATOM 725 CE1 TYR A 407 -8.072 -5.183 7.836 1.00 0.00 C ATOM 726 CE2 TYR A 407 -10.277 -5.866 8.570 1.00 0.00 C ATOM 727 CZ TYR A 407 -8.949 -6.184 8.267 1.00 0.00 C ATOM 728 OH TYR A 407 -8.502 -7.485 8.396 1.00 0.00 O ATOM 0 H TYR A 407 -8.640 -1.996 5.619 1.00 0.00 H new ATOM 0 HA TYR A 407 -11.595 -2.084 6.168 1.00 0.00 H new ATOM 0 HB2 TYR A 407 -9.573 -1.449 8.326 1.00 0.00 H new ATOM 0 HB3 TYR A 407 -11.232 -1.988 8.495 1.00 0.00 H new ATOM 0 HD1 TYR A 407 -7.844 -3.093 7.373 1.00 0.00 H new ATOM 0 HD2 TYR A 407 -11.751 -4.301 8.683 1.00 0.00 H new ATOM 0 HE1 TYR A 407 -7.046 -5.428 7.603 1.00 0.00 H new ATOM 0 HE2 TYR A 407 -10.955 -6.639 8.901 1.00 0.00 H new ATOM 0 HH TYR A 407 -9.237 -8.054 8.707 1.00 0.00 H new ATOM 738 N LYS A 408 -11.599 0.448 6.065 1.00 0.00 N ATOM 739 CA LYS A 408 -11.584 1.934 5.913 1.00 0.00 C ATOM 740 C LYS A 408 -12.090 2.632 7.178 1.00 0.00 C ATOM 741 O LYS A 408 -12.168 3.843 7.229 1.00 0.00 O ATOM 742 CB LYS A 408 -12.463 2.291 4.723 1.00 0.00 C ATOM 743 CG LYS A 408 -11.796 1.754 3.452 1.00 0.00 C ATOM 744 CD LYS A 408 -12.828 1.675 2.317 1.00 0.00 C ATOM 745 CE LYS A 408 -13.771 0.464 2.486 1.00 0.00 C ATOM 746 NZ LYS A 408 -14.011 -0.159 1.153 1.00 0.00 N ATOM 0 H LYS A 408 -12.517 0.015 5.961 1.00 0.00 H new ATOM 0 HA LYS A 408 -10.561 2.273 5.750 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -13.456 1.859 4.842 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -12.591 3.371 4.657 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.971 2.404 3.161 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.373 0.767 3.641 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -13.415 2.593 2.294 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -12.312 1.603 1.360 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -13.330 -0.264 3.167 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -14.715 0.782 2.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -14.991 -0.503 1.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -13.853 0.547 0.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -13.357 -0.956 1.019 1.00 0.00 H new ATOM 760 N SER A 409 -12.446 1.897 8.196 1.00 0.00 N ATOM 761 CA SER A 409 -12.952 2.559 9.434 1.00 0.00 C ATOM 762 C SER A 409 -12.754 1.643 10.643 1.00 0.00 C ATOM 763 O SER A 409 -12.547 0.454 10.512 1.00 0.00 O ATOM 764 CB SER A 409 -14.440 2.868 9.268 1.00 0.00 C ATOM 765 OG SER A 409 -14.610 3.784 8.194 1.00 0.00 O ATOM 0 H SER A 409 -12.410 0.878 8.226 1.00 0.00 H new ATOM 0 HA SER A 409 -12.397 3.483 9.597 1.00 0.00 H new ATOM 0 HB2 SER A 409 -14.994 1.951 9.071 1.00 0.00 H new ATOM 0 HB3 SER A 409 -14.841 3.291 10.189 1.00 0.00 H new ATOM 0 HG SER A 409 -13.739 4.153 7.937 1.00 0.00 H new ATOM 866 N PRO A 417 -13.641 -6.844 6.740 1.00 0.00 N ATOM 867 CA PRO A 417 -13.180 -5.736 5.846 1.00 0.00 C ATOM 868 C PRO A 417 -14.121 -5.520 4.654 1.00 0.00 C ATOM 869 O PRO A 417 -14.904 -6.380 4.301 1.00 0.00 O ATOM 870 CB PRO A 417 -11.786 -6.190 5.372 1.00 0.00 C ATOM 871 CG PRO A 417 -11.786 -7.681 5.518 1.00 0.00 C ATOM 872 CD PRO A 417 -12.732 -8.006 6.678 1.00 0.00 C ATOM 0 HA PRO A 417 -13.162 -4.779 6.367 1.00 0.00 H new ATOM 0 HB2 PRO A 417 -11.607 -5.896 4.338 1.00 0.00 H new ATOM 0 HB3 PRO A 417 -10.999 -5.736 5.973 1.00 0.00 H new ATOM 0 HG2 PRO A 417 -12.121 -8.161 4.598 1.00 0.00 H new ATOM 0 HG3 PRO A 417 -10.781 -8.051 5.722 1.00 0.00 H new ATOM 0 HD2 PRO A 417 -13.280 -8.931 6.498 1.00 0.00 H new ATOM 0 HD3 PRO A 417 -12.186 -8.135 7.613 1.00 0.00 H new ATOM 880 N ALA A 418 -14.042 -4.375 4.030 1.00 0.00 N ATOM 881 CA ALA A 418 -14.920 -4.098 2.860 1.00 0.00 C ATOM 882 C ALA A 418 -14.558 -5.052 1.722 1.00 0.00 C ATOM 883 O ALA A 418 -15.418 -5.590 1.053 1.00 0.00 O ATOM 884 CB ALA A 418 -14.719 -2.652 2.401 1.00 0.00 C ATOM 0 H ALA A 418 -13.405 -3.619 4.282 1.00 0.00 H new ATOM 0 HA ALA A 418 -15.963 -4.245 3.142 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -15.362 -2.449 1.544 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -14.974 -1.973 3.215 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -13.678 -2.502 2.116 1.00 0.00 H new ATOM 890 N HIS A 419 -13.287 -5.271 1.494 1.00 0.00 N ATOM 891 CA HIS A 419 -12.870 -6.195 0.398 1.00 0.00 C ATOM 892 C HIS A 419 -11.563 -6.886 0.809 1.00 0.00 C ATOM 893 O HIS A 419 -10.591 -6.239 1.144 1.00 0.00 O ATOM 894 CB HIS A 419 -12.669 -5.372 -0.902 1.00 0.00 C ATOM 895 CG HIS A 419 -13.597 -5.858 -1.992 1.00 0.00 C ATOM 896 ND1 HIS A 419 -13.419 -7.080 -2.629 1.00 0.00 N ATOM 897 CD2 HIS A 419 -14.712 -5.296 -2.566 1.00 0.00 C ATOM 898 CE1 HIS A 419 -14.403 -7.210 -3.540 1.00 0.00 C ATOM 899 NE2 HIS A 419 -15.215 -6.152 -3.539 1.00 0.00 N ATOM 0 H HIS A 419 -12.521 -4.850 2.020 1.00 0.00 H new ATOM 0 HA HIS A 419 -13.632 -6.954 0.220 1.00 0.00 H new ATOM 0 HB2 HIS A 419 -12.856 -4.317 -0.703 1.00 0.00 H new ATOM 0 HB3 HIS A 419 -11.634 -5.455 -1.235 1.00 0.00 H new ATOM 0 HD2 HIS A 419 -15.133 -4.337 -2.302 1.00 0.00 H new ATOM 0 HE1 HIS A 419 -14.520 -8.064 -4.190 1.00 0.00 H new ATOM 0 HE2 HIS A 419 -16.034 -6.002 -4.129 1.00 0.00 H new ATOM 908 N GLN A 420 -11.540 -8.195 0.783 1.00 0.00 N ATOM 909 CA GLN A 420 -10.303 -8.946 1.167 1.00 0.00 C ATOM 910 C GLN A 420 -10.000 -9.989 0.089 1.00 0.00 C ATOM 911 O GLN A 420 -10.729 -10.945 -0.087 1.00 0.00 O ATOM 912 CB GLN A 420 -10.533 -9.644 2.514 1.00 0.00 C ATOM 913 CG GLN A 420 -11.979 -10.144 2.594 1.00 0.00 C ATOM 914 CD GLN A 420 -12.163 -10.985 3.859 1.00 0.00 C ATOM 915 OE1 GLN A 420 -12.591 -10.483 4.878 1.00 0.00 O ATOM 916 NE2 GLN A 420 -11.857 -12.253 3.837 1.00 0.00 N ATOM 0 H GLN A 420 -12.330 -8.780 0.511 1.00 0.00 H new ATOM 0 HA GLN A 420 -9.461 -8.259 1.257 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -9.842 -10.480 2.625 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -10.331 -8.953 3.332 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -12.667 -9.298 2.604 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -12.218 -10.738 1.712 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -11.497 -12.676 2.981 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -11.978 -12.821 4.675 1.00 0.00 H new ATOM 925 N MET A 421 -8.934 -9.811 -0.637 1.00 0.00 N ATOM 926 CA MET A 421 -8.596 -10.791 -1.700 1.00 0.00 C ATOM 927 C MET A 421 -7.149 -10.584 -2.158 1.00 0.00 C ATOM 928 O MET A 421 -6.517 -9.599 -1.832 1.00 0.00 O ATOM 929 CB MET A 421 -9.544 -10.597 -2.886 1.00 0.00 C ATOM 930 CG MET A 421 -9.712 -9.104 -3.192 1.00 0.00 C ATOM 931 SD MET A 421 -10.866 -8.893 -4.575 1.00 0.00 S ATOM 932 CE MET A 421 -9.748 -9.375 -5.916 1.00 0.00 C ATOM 0 H MET A 421 -8.284 -9.031 -0.540 1.00 0.00 H new ATOM 0 HA MET A 421 -8.703 -11.802 -1.307 1.00 0.00 H new ATOM 0 HB2 MET A 421 -9.152 -11.113 -3.762 1.00 0.00 H new ATOM 0 HB3 MET A 421 -10.514 -11.041 -2.662 1.00 0.00 H new ATOM 0 HG2 MET A 421 -10.085 -8.582 -2.311 1.00 0.00 H new ATOM 0 HG3 MET A 421 -8.747 -8.662 -3.440 1.00 0.00 H new ATOM 0 HE1 MET A 421 -9.653 -8.552 -6.624 1.00 0.00 H new ATOM 0 HE2 MET A 421 -8.768 -9.615 -5.504 1.00 0.00 H new ATOM 0 HE3 MET A 421 -10.150 -10.249 -6.428 1.00 0.00 H new ATOM 942 N ASN A 422 -6.622 -11.511 -2.915 1.00 0.00 N ATOM 943 CA ASN A 422 -5.222 -11.380 -3.399 1.00 0.00 C ATOM 944 C ASN A 422 -5.193 -10.483 -4.635 1.00 0.00 C ATOM 945 O ASN A 422 -5.724 -10.823 -5.673 1.00 0.00 O ATOM 946 CB ASN A 422 -4.683 -12.764 -3.767 1.00 0.00 C ATOM 947 CG ASN A 422 -5.618 -13.429 -4.778 1.00 0.00 C ATOM 948 OD1 ASN A 422 -5.497 -13.215 -5.967 1.00 0.00 O ATOM 949 ND2 ASN A 422 -6.551 -14.237 -4.352 1.00 0.00 N ATOM 0 H ASN A 422 -7.106 -12.356 -3.218 1.00 0.00 H new ATOM 0 HA ASN A 422 -4.605 -10.941 -2.615 1.00 0.00 H new ATOM 0 HB2 ASN A 422 -3.681 -12.675 -4.187 1.00 0.00 H new ATOM 0 HB3 ASN A 422 -4.600 -13.382 -2.873 1.00 0.00 H new ATOM 0 HD21 ASN A 422 -7.178 -14.688 -5.018 1.00 0.00 H new ATOM 0 HD22 ASN A 422 -6.653 -14.417 -3.353 1.00 0.00 H new ATOM 956 N LEU A 423 -4.568 -9.342 -4.537 1.00 0.00 N ATOM 957 CA LEU A 423 -4.499 -8.432 -5.714 1.00 0.00 C ATOM 958 C LEU A 423 -3.357 -8.892 -6.618 1.00 0.00 C ATOM 959 O LEU A 423 -3.553 -9.188 -7.780 1.00 0.00 O ATOM 960 CB LEU A 423 -4.225 -6.997 -5.245 1.00 0.00 C ATOM 961 CG LEU A 423 -5.484 -6.380 -4.612 1.00 0.00 C ATOM 962 CD1 LEU A 423 -6.592 -6.200 -5.668 1.00 0.00 C ATOM 963 CD2 LEU A 423 -5.989 -7.282 -3.479 1.00 0.00 C ATOM 0 H LEU A 423 -4.103 -9.001 -3.695 1.00 0.00 H new ATOM 0 HA LEU A 423 -5.445 -8.457 -6.256 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -3.410 -6.995 -4.521 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -3.902 -6.389 -6.090 1.00 0.00 H new ATOM 0 HG LEU A 423 -5.226 -5.400 -4.210 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -7.474 -5.762 -5.199 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -6.236 -5.540 -6.460 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -6.851 -7.170 -6.093 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -6.881 -6.841 -3.033 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -6.232 -8.267 -3.879 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -5.214 -7.380 -2.719 1.00 0.00 H new ATOM 975 N ARG A 424 -2.171 -8.973 -6.077 1.00 0.00 N ATOM 976 CA ARG A 424 -0.992 -9.428 -6.879 1.00 0.00 C ATOM 977 C ARG A 424 -0.885 -8.640 -8.198 1.00 0.00 C ATOM 978 O ARG A 424 -1.802 -7.967 -8.622 1.00 0.00 O ATOM 979 CB ARG A 424 -1.147 -10.921 -7.192 1.00 0.00 C ATOM 980 CG ARG A 424 0.145 -11.462 -7.817 1.00 0.00 C ATOM 981 CD ARG A 424 0.134 -12.991 -7.777 1.00 0.00 C ATOM 982 NE ARG A 424 1.443 -13.508 -8.270 1.00 0.00 N ATOM 983 CZ ARG A 424 1.616 -14.790 -8.439 1.00 0.00 C ATOM 984 NH1 ARG A 424 0.642 -15.619 -8.179 1.00 0.00 N ATOM 985 NH2 ARG A 424 2.762 -15.245 -8.868 1.00 0.00 N ATOM 0 H ARG A 424 -1.964 -8.742 -5.105 1.00 0.00 H new ATOM 0 HA ARG A 424 -0.086 -9.253 -6.299 1.00 0.00 H new ATOM 0 HB2 ARG A 424 -1.377 -11.471 -6.279 1.00 0.00 H new ATOM 0 HB3 ARG A 424 -1.983 -11.073 -7.875 1.00 0.00 H new ATOM 0 HG2 ARG A 424 0.235 -11.116 -8.847 1.00 0.00 H new ATOM 0 HG3 ARG A 424 1.010 -11.080 -7.275 1.00 0.00 H new ATOM 0 HD2 ARG A 424 -0.047 -13.338 -6.760 1.00 0.00 H new ATOM 0 HD3 ARG A 424 -0.678 -13.376 -8.394 1.00 0.00 H new ATOM 0 HE ARG A 424 2.203 -12.859 -8.475 1.00 0.00 H new ATOM 0 HH11 ARG A 424 -0.254 -15.264 -7.844 1.00 0.00 H new ATOM 0 HH12 ARG A 424 0.777 -16.621 -8.311 1.00 0.00 H new ATOM 0 HH21 ARG A 424 3.524 -14.598 -9.072 1.00 0.00 H new ATOM 0 HH22 ARG A 424 2.896 -16.248 -9.000 1.00 0.00 H new ATOM 999 N GLY A 425 0.238 -8.743 -8.857 1.00 0.00 N ATOM 1000 CA GLY A 425 0.431 -8.040 -10.161 1.00 0.00 C ATOM 1001 C GLY A 425 0.132 -6.540 -10.047 1.00 0.00 C ATOM 1002 O GLY A 425 -0.347 -5.930 -10.982 1.00 0.00 O ATOM 0 H GLY A 425 1.040 -9.291 -8.544 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.456 -8.182 -10.502 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -0.220 -8.485 -10.914 1.00 0.00 H new ATOM 1006 N CYS A 426 0.422 -5.931 -8.930 1.00 0.00 N ATOM 1007 CA CYS A 426 0.164 -4.471 -8.798 1.00 0.00 C ATOM 1008 C CYS A 426 1.262 -3.701 -9.541 1.00 0.00 C ATOM 1009 O CYS A 426 2.387 -4.150 -9.643 1.00 0.00 O ATOM 1010 CB CYS A 426 0.173 -4.083 -7.317 1.00 0.00 C ATOM 1011 SG CYS A 426 1.541 -4.924 -6.481 1.00 0.00 S ATOM 0 H CYS A 426 0.825 -6.380 -8.107 1.00 0.00 H new ATOM 0 HA CYS A 426 -0.808 -4.226 -9.226 1.00 0.00 H new ATOM 0 HB2 CYS A 426 0.278 -3.003 -7.214 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -0.774 -4.357 -6.853 1.00 0.00 H new ATOM 0 HG CYS A 426 2.099 -4.110 -5.635 1.00 0.00 H new ATOM 1017 N GLU A 427 0.944 -2.544 -10.058 1.00 0.00 N ATOM 1018 CA GLU A 427 1.961 -1.741 -10.790 1.00 0.00 C ATOM 1019 C GLU A 427 2.722 -0.883 -9.784 1.00 0.00 C ATOM 1020 O GLU A 427 2.161 -0.395 -8.825 1.00 0.00 O ATOM 1021 CB GLU A 427 1.256 -0.839 -11.809 1.00 0.00 C ATOM 1022 CG GLU A 427 2.284 -0.213 -12.758 1.00 0.00 C ATOM 1023 CD GLU A 427 3.057 0.885 -12.025 1.00 0.00 C ATOM 1024 OE1 GLU A 427 2.421 1.799 -11.527 1.00 0.00 O ATOM 1025 OE2 GLU A 427 4.273 0.794 -11.975 1.00 0.00 O ATOM 0 H GLU A 427 0.018 -2.120 -10.003 1.00 0.00 H new ATOM 0 HA GLU A 427 2.655 -2.399 -11.313 1.00 0.00 H new ATOM 0 HB2 GLU A 427 0.530 -1.419 -12.378 1.00 0.00 H new ATOM 0 HB3 GLU A 427 0.703 -0.055 -11.291 1.00 0.00 H new ATOM 0 HG2 GLU A 427 2.972 -0.977 -13.120 1.00 0.00 H new ATOM 0 HG3 GLU A 427 1.782 0.203 -13.631 1.00 0.00 H new ATOM 1032 N VAL A 428 3.999 -0.707 -9.988 1.00 0.00 N ATOM 1033 CA VAL A 428 4.818 0.110 -9.035 1.00 0.00 C ATOM 1034 C VAL A 428 5.737 1.069 -9.802 1.00 0.00 C ATOM 1035 O VAL A 428 6.556 0.660 -10.601 1.00 0.00 O ATOM 1036 CB VAL A 428 5.669 -0.830 -8.171 1.00 0.00 C ATOM 1037 CG1 VAL A 428 4.747 -1.756 -7.372 1.00 0.00 C ATOM 1038 CG2 VAL A 428 6.590 -1.675 -9.066 1.00 0.00 C ATOM 0 H VAL A 428 4.517 -1.094 -10.777 1.00 0.00 H new ATOM 0 HA VAL A 428 4.149 0.696 -8.404 1.00 0.00 H new ATOM 0 HB VAL A 428 6.279 -0.238 -7.489 1.00 0.00 H new ATOM 0 HG11 VAL A 428 5.348 -2.426 -6.757 1.00 0.00 H new ATOM 0 HG12 VAL A 428 4.098 -1.159 -6.731 1.00 0.00 H new ATOM 0 HG13 VAL A 428 4.138 -2.344 -8.059 1.00 0.00 H new ATOM 0 HG21 VAL A 428 7.191 -2.340 -8.445 1.00 0.00 H new ATOM 0 HG22 VAL A 428 5.986 -2.268 -9.753 1.00 0.00 H new ATOM 0 HG23 VAL A 428 7.247 -1.018 -9.635 1.00 0.00 H new ATOM 1048 N THR A 429 5.611 2.349 -9.545 1.00 0.00 N ATOM 1049 CA THR A 429 6.483 3.361 -10.228 1.00 0.00 C ATOM 1050 C THR A 429 7.047 4.323 -9.163 1.00 0.00 C ATOM 1051 O THR A 429 6.400 5.284 -8.799 1.00 0.00 O ATOM 1052 CB THR A 429 5.629 4.159 -11.221 1.00 0.00 C ATOM 1053 OG1 THR A 429 5.241 3.313 -12.295 1.00 0.00 O ATOM 1054 CG2 THR A 429 6.433 5.342 -11.766 1.00 0.00 C ATOM 0 H THR A 429 4.937 2.740 -8.887 1.00 0.00 H new ATOM 0 HA THR A 429 7.299 2.865 -10.754 1.00 0.00 H new ATOM 0 HB THR A 429 4.742 4.535 -10.712 1.00 0.00 H new ATOM 0 HG1 THR A 429 5.064 2.412 -11.954 1.00 0.00 H new ATOM 0 HG21 THR A 429 5.820 5.904 -12.471 1.00 0.00 H new ATOM 0 HG22 THR A 429 6.728 5.992 -10.942 1.00 0.00 H new ATOM 0 HG23 THR A 429 7.324 4.973 -12.274 1.00 0.00 H new ATOM 1062 N PRO A 430 8.245 4.081 -8.667 1.00 0.00 N ATOM 1063 CA PRO A 430 8.882 4.963 -7.634 1.00 0.00 C ATOM 1064 C PRO A 430 9.178 6.384 -8.145 1.00 0.00 C ATOM 1065 O PRO A 430 9.577 6.579 -9.276 1.00 0.00 O ATOM 1066 CB PRO A 430 10.199 4.241 -7.271 1.00 0.00 C ATOM 1067 CG PRO A 430 10.060 2.849 -7.806 1.00 0.00 C ATOM 1068 CD PRO A 430 9.117 2.941 -9.004 1.00 0.00 C ATOM 0 HA PRO A 430 8.212 5.105 -6.786 1.00 0.00 H new ATOM 0 HB2 PRO A 430 11.057 4.746 -7.714 1.00 0.00 H new ATOM 0 HB3 PRO A 430 10.356 4.232 -6.192 1.00 0.00 H new ATOM 0 HG2 PRO A 430 11.029 2.449 -8.104 1.00 0.00 H new ATOM 0 HG3 PRO A 430 9.658 2.179 -7.046 1.00 0.00 H new ATOM 0 HD2 PRO A 430 9.662 3.113 -9.932 1.00 0.00 H new ATOM 0 HD3 PRO A 430 8.545 2.023 -9.136 1.00 0.00 H new ATOM 1076 N ASP A 431 9.008 7.371 -7.302 1.00 0.00 N ATOM 1077 CA ASP A 431 9.301 8.772 -7.713 1.00 0.00 C ATOM 1078 C ASP A 431 9.379 9.644 -6.456 1.00 0.00 C ATOM 1079 O ASP A 431 8.406 10.242 -6.042 1.00 0.00 O ATOM 1080 CB ASP A 431 8.186 9.279 -8.631 1.00 0.00 C ATOM 1081 CG ASP A 431 8.687 10.468 -9.455 1.00 0.00 C ATOM 1082 OD1 ASP A 431 8.746 11.559 -8.913 1.00 0.00 O ATOM 1083 OD2 ASP A 431 9.004 10.265 -10.616 1.00 0.00 O ATOM 0 H ASP A 431 8.677 7.263 -6.343 1.00 0.00 H new ATOM 0 HA ASP A 431 10.248 8.816 -8.251 1.00 0.00 H new ATOM 0 HB2 ASP A 431 7.858 8.479 -9.294 1.00 0.00 H new ATOM 0 HB3 ASP A 431 7.321 9.576 -8.037 1.00 0.00 H new ATOM 1088 N VAL A 432 10.533 9.706 -5.846 1.00 0.00 N ATOM 1089 CA VAL A 432 10.710 10.522 -4.599 1.00 0.00 C ATOM 1090 C VAL A 432 11.805 11.564 -4.813 1.00 0.00 C ATOM 1091 O VAL A 432 12.930 11.244 -5.141 1.00 0.00 O ATOM 1092 CB VAL A 432 11.091 9.593 -3.424 1.00 0.00 C ATOM 1093 CG1 VAL A 432 12.202 8.636 -3.838 1.00 0.00 C ATOM 1094 CG2 VAL A 432 11.585 10.408 -2.220 1.00 0.00 C ATOM 0 H VAL A 432 11.374 9.221 -6.160 1.00 0.00 H new ATOM 0 HA VAL A 432 9.776 11.033 -4.366 1.00 0.00 H new ATOM 0 HB VAL A 432 10.197 9.033 -3.149 1.00 0.00 H new ATOM 0 HG11 VAL A 432 12.457 7.990 -2.998 1.00 0.00 H new ATOM 0 HG12 VAL A 432 11.863 8.026 -4.676 1.00 0.00 H new ATOM 0 HG13 VAL A 432 13.081 9.207 -4.137 1.00 0.00 H new ATOM 0 HG21 VAL A 432 11.847 9.732 -1.406 1.00 0.00 H new ATOM 0 HG22 VAL A 432 12.463 10.987 -2.508 1.00 0.00 H new ATOM 0 HG23 VAL A 432 10.796 11.084 -1.890 1.00 0.00 H new ATOM 1104 N ASN A 433 11.482 12.814 -4.598 1.00 0.00 N ATOM 1105 CA ASN A 433 12.496 13.901 -4.746 1.00 0.00 C ATOM 1106 C ASN A 433 12.879 14.375 -3.347 1.00 0.00 C ATOM 1107 O ASN A 433 12.200 15.190 -2.755 1.00 0.00 O ATOM 1108 CB ASN A 433 11.888 15.065 -5.533 1.00 0.00 C ATOM 1109 CG ASN A 433 11.430 14.568 -6.906 1.00 0.00 C ATOM 1110 OD1 ASN A 433 12.190 14.584 -7.854 1.00 0.00 O ATOM 1111 ND2 ASN A 433 10.211 14.126 -7.056 1.00 0.00 N ATOM 0 H ASN A 433 10.552 13.130 -4.324 1.00 0.00 H new ATOM 0 HA ASN A 433 13.373 13.536 -5.280 1.00 0.00 H new ATOM 0 HB2 ASN A 433 11.044 15.486 -4.987 1.00 0.00 H new ATOM 0 HB3 ASN A 433 12.622 15.862 -5.649 1.00 0.00 H new ATOM 0 HD21 ASN A 433 9.897 13.795 -7.968 1.00 0.00 H new ATOM 0 HD22 ASN A 433 9.572 14.112 -6.261 1.00 0.00 H new ATOM 1118 N ILE A 434 13.948 13.866 -2.799 1.00 0.00 N ATOM 1119 CA ILE A 434 14.338 14.294 -1.426 1.00 0.00 C ATOM 1120 C ILE A 434 14.889 15.723 -1.498 1.00 0.00 C ATOM 1121 O ILE A 434 14.955 16.421 -0.507 1.00 0.00 O ATOM 1122 CB ILE A 434 15.395 13.319 -0.807 1.00 0.00 C ATOM 1123 CG1 ILE A 434 15.696 12.148 -1.763 1.00 0.00 C ATOM 1124 CG2 ILE A 434 14.875 12.744 0.519 1.00 0.00 C ATOM 1125 CD1 ILE A 434 16.612 12.625 -2.893 1.00 0.00 C ATOM 0 H ILE A 434 14.563 13.180 -3.237 1.00 0.00 H new ATOM 0 HA ILE A 434 13.463 14.269 -0.777 1.00 0.00 H new ATOM 0 HB ILE A 434 16.308 13.889 -0.637 1.00 0.00 H new ATOM 0 HG12 ILE A 434 16.171 11.333 -1.217 1.00 0.00 H new ATOM 0 HG13 ILE A 434 14.767 11.756 -2.176 1.00 0.00 H new ATOM 0 HG21 ILE A 434 15.619 12.068 0.939 1.00 0.00 H new ATOM 0 HG22 ILE A 434 14.687 13.558 1.220 1.00 0.00 H new ATOM 0 HG23 ILE A 434 13.949 12.198 0.340 1.00 0.00 H new ATOM 0 HD11 ILE A 434 16.822 11.794 -3.566 1.00 0.00 H new ATOM 0 HD12 ILE A 434 16.121 13.425 -3.446 1.00 0.00 H new ATOM 0 HD13 ILE A 434 17.546 12.996 -2.472 1.00 0.00 H new ATOM 1137 N SER A 435 15.265 16.174 -2.662 1.00 0.00 N ATOM 1138 CA SER A 435 15.783 17.562 -2.772 1.00 0.00 C ATOM 1139 C SER A 435 14.703 18.510 -2.251 1.00 0.00 C ATOM 1140 O SER A 435 14.982 19.596 -1.784 1.00 0.00 O ATOM 1141 CB SER A 435 16.101 17.882 -4.235 1.00 0.00 C ATOM 1142 OG SER A 435 17.005 18.977 -4.288 1.00 0.00 O ATOM 0 H SER A 435 15.236 15.645 -3.534 1.00 0.00 H new ATOM 0 HA SER A 435 16.697 17.675 -2.189 1.00 0.00 H new ATOM 0 HB2 SER A 435 16.537 17.011 -4.724 1.00 0.00 H new ATOM 0 HB3 SER A 435 15.185 18.125 -4.774 1.00 0.00 H new ATOM 0 HG SER A 435 17.213 19.185 -5.223 1.00 0.00 H new ATOM 1148 N GLY A 436 13.464 18.086 -2.328 1.00 0.00 N ATOM 1149 CA GLY A 436 12.322 18.923 -1.840 1.00 0.00 C ATOM 1150 C GLY A 436 11.593 18.177 -0.713 1.00 0.00 C ATOM 1151 O GLY A 436 10.688 18.700 -0.098 1.00 0.00 O ATOM 0 H GLY A 436 13.192 17.182 -2.714 1.00 0.00 H new ATOM 0 HA2 GLY A 436 12.688 19.884 -1.478 1.00 0.00 H new ATOM 0 HA3 GLY A 436 11.633 19.132 -2.659 1.00 0.00 H new ATOM 1155 N GLN A 437 12.012 16.962 -0.440 1.00 0.00 N ATOM 1156 CA GLN A 437 11.406 16.127 0.657 1.00 0.00 C ATOM 1157 C GLN A 437 10.005 15.599 0.294 1.00 0.00 C ATOM 1158 O GLN A 437 9.089 15.698 1.086 1.00 0.00 O ATOM 1159 CB GLN A 437 11.313 16.922 1.972 1.00 0.00 C ATOM 1160 CG GLN A 437 12.657 17.589 2.287 1.00 0.00 C ATOM 1161 CD GLN A 437 13.674 16.517 2.670 1.00 0.00 C ATOM 1162 OE1 GLN A 437 13.922 16.282 3.836 1.00 0.00 O ATOM 1163 NE2 GLN A 437 14.278 15.850 1.728 1.00 0.00 N ATOM 0 H GLN A 437 12.769 16.500 -0.944 1.00 0.00 H new ATOM 0 HA GLN A 437 12.071 15.273 0.786 1.00 0.00 H new ATOM 0 HB2 GLN A 437 10.533 17.679 1.893 1.00 0.00 H new ATOM 0 HB3 GLN A 437 11.029 16.257 2.788 1.00 0.00 H new ATOM 0 HG2 GLN A 437 13.010 18.149 1.421 1.00 0.00 H new ATOM 0 HG3 GLN A 437 12.540 18.303 3.102 1.00 0.00 H new ATOM 0 HE21 GLN A 437 14.070 16.047 0.749 1.00 0.00 H new ATOM 0 HE22 GLN A 437 14.959 15.130 1.969 1.00 0.00 H new ATOM 1172 N LYS A 438 9.827 15.019 -0.877 1.00 0.00 N ATOM 1173 CA LYS A 438 8.478 14.463 -1.254 1.00 0.00 C ATOM 1174 C LYS A 438 8.618 13.026 -1.769 1.00 0.00 C ATOM 1175 O LYS A 438 9.379 12.762 -2.676 1.00 0.00 O ATOM 1176 CB LYS A 438 7.884 15.299 -2.378 1.00 0.00 C ATOM 1177 CG LYS A 438 7.581 16.735 -1.890 1.00 0.00 C ATOM 1178 CD LYS A 438 7.812 17.738 -3.039 1.00 0.00 C ATOM 1179 CE LYS A 438 9.250 18.249 -3.003 1.00 0.00 C ATOM 1180 NZ LYS A 438 10.191 17.104 -3.161 1.00 0.00 N ATOM 0 H LYS A 438 10.553 14.907 -1.585 1.00 0.00 H new ATOM 0 HA LYS A 438 7.840 14.483 -0.371 1.00 0.00 H new ATOM 0 HB2 LYS A 438 8.578 15.334 -3.218 1.00 0.00 H new ATOM 0 HB3 LYS A 438 6.968 14.832 -2.740 1.00 0.00 H new ATOM 0 HG2 LYS A 438 6.551 16.800 -1.540 1.00 0.00 H new ATOM 0 HG3 LYS A 438 8.221 16.984 -1.044 1.00 0.00 H new ATOM 0 HD2 LYS A 438 7.611 17.259 -3.997 1.00 0.00 H new ATOM 0 HD3 LYS A 438 7.118 18.574 -2.949 1.00 0.00 H new ATOM 0 HE2 LYS A 438 9.408 18.976 -3.800 1.00 0.00 H new ATOM 0 HE3 LYS A 438 9.441 18.762 -2.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 11.091 17.446 -3.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 10.362 16.665 -2.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 9.777 16.401 -3.806 1.00 0.00 H new ATOM 1194 N PHE A 439 7.838 12.110 -1.234 1.00 0.00 N ATOM 1195 CA PHE A 439 7.867 10.685 -1.719 1.00 0.00 C ATOM 1196 C PHE A 439 6.526 10.406 -2.420 1.00 0.00 C ATOM 1197 O PHE A 439 5.500 10.309 -1.778 1.00 0.00 O ATOM 1198 CB PHE A 439 8.061 9.680 -0.547 1.00 0.00 C ATOM 1199 CG PHE A 439 8.823 10.289 0.613 1.00 0.00 C ATOM 1200 CD1 PHE A 439 8.255 11.330 1.351 1.00 0.00 C ATOM 1201 CD2 PHE A 439 10.088 9.789 0.970 1.00 0.00 C ATOM 1202 CE1 PHE A 439 8.942 11.879 2.438 1.00 0.00 C ATOM 1203 CE2 PHE A 439 10.776 10.342 2.058 1.00 0.00 C ATOM 1204 CZ PHE A 439 10.202 11.387 2.790 1.00 0.00 C ATOM 0 H PHE A 439 7.178 12.289 -0.477 1.00 0.00 H new ATOM 0 HA PHE A 439 8.708 10.554 -2.400 1.00 0.00 H new ATOM 0 HB2 PHE A 439 7.086 9.339 -0.199 1.00 0.00 H new ATOM 0 HB3 PHE A 439 8.596 8.802 -0.909 1.00 0.00 H new ATOM 0 HD1 PHE A 439 7.282 11.712 1.081 1.00 0.00 H new ATOM 0 HD2 PHE A 439 10.528 8.980 0.406 1.00 0.00 H new ATOM 0 HE1 PHE A 439 8.499 12.684 3.006 1.00 0.00 H new ATOM 0 HE2 PHE A 439 11.749 9.962 2.332 1.00 0.00 H new ATOM 0 HZ PHE A 439 10.733 11.814 3.628 1.00 0.00 H new ATOM 1214 N ASN A 440 6.517 10.308 -3.733 1.00 0.00 N ATOM 1215 CA ASN A 440 5.226 10.078 -4.476 1.00 0.00 C ATOM 1216 C ASN A 440 5.188 8.689 -5.126 1.00 0.00 C ATOM 1217 O ASN A 440 5.736 8.485 -6.192 1.00 0.00 O ATOM 1218 CB ASN A 440 5.117 11.143 -5.580 1.00 0.00 C ATOM 1219 CG ASN A 440 3.649 11.356 -5.966 1.00 0.00 C ATOM 1220 OD1 ASN A 440 2.889 11.937 -5.217 1.00 0.00 O ATOM 1221 ND2 ASN A 440 3.218 10.908 -7.113 1.00 0.00 N ATOM 0 H ASN A 440 7.346 10.377 -4.323 1.00 0.00 H new ATOM 0 HA ASN A 440 4.398 10.144 -3.770 1.00 0.00 H new ATOM 0 HB2 ASN A 440 5.550 12.082 -5.234 1.00 0.00 H new ATOM 0 HB3 ASN A 440 5.689 10.831 -6.454 1.00 0.00 H new ATOM 0 HD21 ASN A 440 2.243 11.046 -7.381 1.00 0.00 H new ATOM 0 HD22 ASN A 440 3.856 10.420 -7.742 1.00 0.00 H new ATOM 1228 N ILE A 441 4.523 7.736 -4.513 1.00 0.00 N ATOM 1229 CA ILE A 441 4.429 6.374 -5.122 1.00 0.00 C ATOM 1230 C ILE A 441 3.114 6.281 -5.909 1.00 0.00 C ATOM 1231 O ILE A 441 2.054 6.625 -5.417 1.00 0.00 O ATOM 1232 CB ILE A 441 4.500 5.304 -3.994 1.00 0.00 C ATOM 1233 CG1 ILE A 441 5.404 4.128 -4.426 1.00 0.00 C ATOM 1234 CG2 ILE A 441 3.109 4.757 -3.626 1.00 0.00 C ATOM 1235 CD1 ILE A 441 6.869 4.492 -4.180 1.00 0.00 C ATOM 0 H ILE A 441 4.043 7.845 -3.619 1.00 0.00 H new ATOM 0 HA ILE A 441 5.257 6.194 -5.808 1.00 0.00 H new ATOM 0 HB ILE A 441 4.918 5.796 -3.116 1.00 0.00 H new ATOM 0 HG12 ILE A 441 5.143 3.230 -3.866 1.00 0.00 H new ATOM 0 HG13 ILE A 441 5.247 3.903 -5.481 1.00 0.00 H new ATOM 0 HG21 ILE A 441 3.208 4.014 -2.835 1.00 0.00 H new ATOM 0 HG22 ILE A 441 2.477 5.574 -3.279 1.00 0.00 H new ATOM 0 HG23 ILE A 441 2.656 4.295 -4.503 1.00 0.00 H new ATOM 0 HD11 ILE A 441 7.506 3.662 -4.485 1.00 0.00 H new ATOM 0 HD12 ILE A 441 7.126 5.379 -4.760 1.00 0.00 H new ATOM 0 HD13 ILE A 441 7.020 4.695 -3.120 1.00 0.00 H new ATOM 1247 N LYS A 442 3.182 5.812 -7.125 1.00 0.00 N ATOM 1248 CA LYS A 442 1.963 5.678 -7.968 1.00 0.00 C ATOM 1249 C LYS A 442 1.560 4.199 -8.009 1.00 0.00 C ATOM 1250 O LYS A 442 2.141 3.408 -8.725 1.00 0.00 O ATOM 1251 CB LYS A 442 2.299 6.180 -9.383 1.00 0.00 C ATOM 1252 CG LYS A 442 1.036 6.646 -10.116 1.00 0.00 C ATOM 1253 CD LYS A 442 0.171 5.433 -10.484 1.00 0.00 C ATOM 1254 CE LYS A 442 -0.985 5.847 -11.420 1.00 0.00 C ATOM 1255 NZ LYS A 442 -2.269 5.799 -10.664 1.00 0.00 N ATOM 0 H LYS A 442 4.046 5.511 -7.576 1.00 0.00 H new ATOM 0 HA LYS A 442 1.137 6.262 -7.563 1.00 0.00 H new ATOM 0 HB2 LYS A 442 3.012 7.002 -9.321 1.00 0.00 H new ATOM 0 HB3 LYS A 442 2.780 5.383 -9.951 1.00 0.00 H new ATOM 0 HG2 LYS A 442 0.469 7.330 -9.484 1.00 0.00 H new ATOM 0 HG3 LYS A 442 1.309 7.196 -11.017 1.00 0.00 H new ATOM 0 HD2 LYS A 442 0.786 4.677 -10.971 1.00 0.00 H new ATOM 0 HD3 LYS A 442 -0.233 4.981 -9.578 1.00 0.00 H new ATOM 0 HE2 LYS A 442 -0.814 6.852 -11.806 1.00 0.00 H new ATOM 0 HE3 LYS A 442 -1.030 5.178 -12.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 -2.976 5.271 -11.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 -2.117 5.325 -9.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 -2.611 6.767 -10.499 1.00 0.00 H new ATOM 1269 N LEU A 443 0.564 3.824 -7.249 1.00 0.00 N ATOM 1270 CA LEU A 443 0.110 2.398 -7.238 1.00 0.00 C ATOM 1271 C LEU A 443 -1.080 2.253 -8.193 1.00 0.00 C ATOM 1272 O LEU A 443 -2.119 2.857 -8.006 1.00 0.00 O ATOM 1273 CB LEU A 443 -0.297 2.011 -5.790 1.00 0.00 C ATOM 1274 CG LEU A 443 0.524 0.808 -5.267 1.00 0.00 C ATOM 1275 CD1 LEU A 443 0.161 -0.465 -6.050 1.00 0.00 C ATOM 1276 CD2 LEU A 443 2.040 1.092 -5.387 1.00 0.00 C ATOM 0 H LEU A 443 0.042 4.446 -6.632 1.00 0.00 H new ATOM 0 HA LEU A 443 0.910 1.735 -7.567 1.00 0.00 H new ATOM 0 HB2 LEU A 443 -0.151 2.866 -5.130 1.00 0.00 H new ATOM 0 HB3 LEU A 443 -1.359 1.766 -5.764 1.00 0.00 H new ATOM 0 HG LEU A 443 0.281 0.656 -4.215 1.00 0.00 H new ATOM 0 HD11 LEU A 443 0.746 -1.304 -5.672 1.00 0.00 H new ATOM 0 HD12 LEU A 443 -0.901 -0.678 -5.926 1.00 0.00 H new ATOM 0 HD13 LEU A 443 0.381 -0.317 -7.107 1.00 0.00 H new ATOM 0 HD21 LEU A 443 2.601 0.235 -5.014 1.00 0.00 H new ATOM 0 HD22 LEU A 443 2.296 1.267 -6.432 1.00 0.00 H new ATOM 0 HD23 LEU A 443 2.293 1.974 -4.799 1.00 0.00 H new ATOM 1288 N LEU A 444 -0.926 1.451 -9.213 1.00 0.00 N ATOM 1289 CA LEU A 444 -2.033 1.240 -10.205 1.00 0.00 C ATOM 1290 C LEU A 444 -2.227 -0.268 -10.398 1.00 0.00 C ATOM 1291 O LEU A 444 -1.309 -1.045 -10.232 1.00 0.00 O ATOM 1292 CB LEU A 444 -1.647 1.943 -11.530 1.00 0.00 C ATOM 1293 CG LEU A 444 -2.313 1.303 -12.769 1.00 0.00 C ATOM 1294 CD1 LEU A 444 -3.848 1.491 -12.749 1.00 0.00 C ATOM 1295 CD2 LEU A 444 -1.732 1.968 -14.025 1.00 0.00 C ATOM 0 H LEU A 444 -0.074 0.926 -9.407 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.973 1.666 -9.854 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -1.931 2.994 -11.474 1.00 0.00 H new ATOM 0 HB3 LEU A 444 -0.564 1.912 -11.650 1.00 0.00 H new ATOM 0 HG LEU A 444 -2.111 0.232 -12.765 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -4.283 1.029 -13.635 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -4.260 1.022 -11.856 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -4.084 2.555 -12.742 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -2.189 1.531 -14.913 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -1.940 3.038 -14.000 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -0.654 1.808 -14.056 1.00 0.00 H new ATOM 1307 N ILE A 445 -3.417 -0.689 -10.744 1.00 0.00 N ATOM 1308 CA ILE A 445 -3.670 -2.150 -10.942 1.00 0.00 C ATOM 1309 C ILE A 445 -4.721 -2.347 -12.051 1.00 0.00 C ATOM 1310 O ILE A 445 -5.790 -1.771 -11.985 1.00 0.00 O ATOM 1311 CB ILE A 445 -4.212 -2.744 -9.639 1.00 0.00 C ATOM 1312 CG1 ILE A 445 -3.357 -2.264 -8.461 1.00 0.00 C ATOM 1313 CG2 ILE A 445 -4.164 -4.272 -9.720 1.00 0.00 C ATOM 1314 CD1 ILE A 445 -3.780 -2.992 -7.183 1.00 0.00 C ATOM 0 H ILE A 445 -4.224 -0.085 -10.898 1.00 0.00 H new ATOM 0 HA ILE A 445 -2.740 -2.644 -11.224 1.00 0.00 H new ATOM 0 HB ILE A 445 -5.242 -2.420 -9.491 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -2.303 -2.451 -8.665 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -3.471 -1.188 -8.332 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -4.549 -4.698 -8.794 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -4.775 -4.611 -10.557 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -3.134 -4.596 -9.867 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -3.169 -2.647 -6.349 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -4.829 -2.783 -6.975 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -3.643 -4.065 -7.313 1.00 0.00 H new ATOM 1326 N PRO A 446 -4.449 -3.154 -13.062 1.00 0.00 N ATOM 1327 CA PRO A 446 -5.430 -3.394 -14.161 1.00 0.00 C ATOM 1328 C PRO A 446 -6.531 -4.371 -13.734 1.00 0.00 C ATOM 1329 O PRO A 446 -6.277 -5.349 -13.060 1.00 0.00 O ATOM 1330 CB PRO A 446 -4.569 -3.989 -15.279 1.00 0.00 C ATOM 1331 CG PRO A 446 -3.481 -4.721 -14.564 1.00 0.00 C ATOM 1332 CD PRO A 446 -3.202 -3.921 -13.283 1.00 0.00 C ATOM 0 HA PRO A 446 -5.955 -2.487 -14.460 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -5.149 -4.660 -15.912 1.00 0.00 H new ATOM 0 HB3 PRO A 446 -4.165 -3.210 -15.926 1.00 0.00 H new ATOM 0 HG2 PRO A 446 -3.786 -5.740 -14.328 1.00 0.00 H new ATOM 0 HG3 PRO A 446 -2.586 -4.791 -15.183 1.00 0.00 H new ATOM 0 HD2 PRO A 446 -2.983 -4.578 -12.441 1.00 0.00 H new ATOM 0 HD3 PRO A 446 -2.343 -3.261 -13.404 1.00 0.00 H new ATOM 1340 N VAL A 447 -7.753 -4.109 -14.117 1.00 0.00 N ATOM 1341 CA VAL A 447 -8.875 -5.017 -13.730 1.00 0.00 C ATOM 1342 C VAL A 447 -9.887 -5.104 -14.873 1.00 0.00 C ATOM 1343 O VAL A 447 -9.697 -4.537 -15.931 1.00 0.00 O ATOM 1344 CB VAL A 447 -9.559 -4.462 -12.478 1.00 0.00 C ATOM 1345 CG1 VAL A 447 -8.504 -4.178 -11.412 1.00 0.00 C ATOM 1346 CG2 VAL A 447 -10.294 -3.160 -12.819 1.00 0.00 C ATOM 0 H VAL A 447 -8.024 -3.304 -14.682 1.00 0.00 H new ATOM 0 HA VAL A 447 -8.485 -6.014 -13.524 1.00 0.00 H new ATOM 0 HB VAL A 447 -10.276 -5.194 -12.106 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -8.987 -3.782 -10.518 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -7.981 -5.101 -11.163 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -7.790 -3.447 -11.792 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -10.779 -2.770 -11.924 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -9.580 -2.426 -13.194 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -11.047 -3.356 -13.583 1.00 0.00 H new ATOM 1356 N ALA A 448 -10.963 -5.811 -14.666 1.00 0.00 N ATOM 1357 CA ALA A 448 -11.991 -5.938 -15.735 1.00 0.00 C ATOM 1358 C ALA A 448 -12.698 -4.594 -15.927 1.00 0.00 C ATOM 1359 O ALA A 448 -12.962 -4.175 -17.036 1.00 0.00 O ATOM 1360 CB ALA A 448 -13.015 -7.000 -15.334 1.00 0.00 C ATOM 0 H ALA A 448 -11.175 -6.307 -13.800 1.00 0.00 H new ATOM 0 HA ALA A 448 -11.510 -6.231 -16.668 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -13.768 -7.093 -16.117 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -12.512 -7.957 -15.198 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -13.496 -6.707 -14.401 1.00 0.00 H new ATOM 1366 N GLU A 449 -13.006 -3.914 -14.857 1.00 0.00 N ATOM 1367 CA GLU A 449 -13.694 -2.600 -14.987 1.00 0.00 C ATOM 1368 C GLU A 449 -12.801 -1.645 -15.784 1.00 0.00 C ATOM 1369 O GLU A 449 -13.276 -0.824 -16.544 1.00 0.00 O ATOM 1370 CB GLU A 449 -13.971 -2.026 -13.586 1.00 0.00 C ATOM 1371 CG GLU A 449 -14.244 -3.175 -12.602 1.00 0.00 C ATOM 1372 CD GLU A 449 -15.042 -2.658 -11.401 1.00 0.00 C ATOM 1373 OE1 GLU A 449 -14.821 -1.523 -11.012 1.00 0.00 O ATOM 1374 OE2 GLU A 449 -15.860 -3.407 -10.894 1.00 0.00 O ATOM 0 H GLU A 449 -12.811 -4.211 -13.901 1.00 0.00 H new ATOM 0 HA GLU A 449 -14.642 -2.725 -15.510 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -13.117 -1.439 -13.247 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -14.827 -1.353 -13.621 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -14.798 -3.969 -13.102 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -13.302 -3.607 -12.264 1.00 0.00 H new ATOM 1381 N GLY A 450 -11.509 -1.753 -15.626 1.00 0.00 N ATOM 1382 CA GLY A 450 -10.591 -0.857 -16.385 1.00 0.00 C ATOM 1383 C GLY A 450 -9.225 -0.800 -15.694 1.00 0.00 C ATOM 1384 O GLY A 450 -8.370 -1.632 -15.920 1.00 0.00 O ATOM 0 H GLY A 450 -11.051 -2.421 -15.006 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -10.476 -1.221 -17.406 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -11.017 0.144 -16.449 1.00 0.00 H new ATOM 1388 N MET A 451 -9.009 0.186 -14.863 1.00 0.00 N ATOM 1389 CA MET A 451 -7.710 0.319 -14.167 1.00 0.00 C ATOM 1390 C MET A 451 -7.955 0.998 -12.820 1.00 0.00 C ATOM 1391 O MET A 451 -8.544 2.059 -12.750 1.00 0.00 O ATOM 1392 CB MET A 451 -6.791 1.187 -15.030 1.00 0.00 C ATOM 1393 CG MET A 451 -6.247 0.363 -16.198 1.00 0.00 C ATOM 1394 SD MET A 451 -4.988 1.321 -17.078 1.00 0.00 S ATOM 1395 CE MET A 451 -5.133 0.476 -18.670 1.00 0.00 C ATOM 0 H MET A 451 -9.691 0.911 -14.639 1.00 0.00 H new ATOM 0 HA MET A 451 -7.247 -0.655 -14.006 1.00 0.00 H new ATOM 0 HB2 MET A 451 -7.339 2.051 -15.406 1.00 0.00 H new ATOM 0 HB3 MET A 451 -5.967 1.570 -14.428 1.00 0.00 H new ATOM 0 HG2 MET A 451 -5.819 -0.570 -15.831 1.00 0.00 H new ATOM 0 HG3 MET A 451 -7.057 0.096 -16.877 1.00 0.00 H new ATOM 0 HE1 MET A 451 -4.432 0.914 -19.380 1.00 0.00 H new ATOM 0 HE2 MET A 451 -4.906 -0.582 -18.542 1.00 0.00 H new ATOM 0 HE3 MET A 451 -6.149 0.586 -19.049 1.00 0.00 H new ATOM 1405 N ASN A 452 -7.518 0.398 -11.747 1.00 0.00 N ATOM 1406 CA ASN A 452 -7.737 1.018 -10.407 1.00 0.00 C ATOM 1407 C ASN A 452 -6.581 1.973 -10.119 1.00 0.00 C ATOM 1408 O ASN A 452 -5.531 1.579 -9.651 1.00 0.00 O ATOM 1409 CB ASN A 452 -7.785 -0.088 -9.342 1.00 0.00 C ATOM 1410 CG ASN A 452 -9.211 -0.641 -9.230 1.00 0.00 C ATOM 1411 OD1 ASN A 452 -9.413 -1.921 -9.363 1.00 0.00 O flip ATOM 1412 ND2 ASN A 452 -10.148 0.103 -9.018 1.00 0.00 N flip ATOM 0 H ASN A 452 -7.020 -0.492 -11.739 1.00 0.00 H new ATOM 0 HA ASN A 452 -8.678 1.568 -10.390 1.00 0.00 H new ATOM 0 HB2 ASN A 452 -7.094 -0.889 -9.605 1.00 0.00 H new ATOM 0 HB3 ASN A 452 -7.462 0.308 -8.379 1.00 0.00 H new ATOM 0 HD21 ASN A 452 -9.990 1.105 -8.914 1.00 0.00 H new ATOM 0 HD22 ASN A 452 -11.093 -0.275 -8.944 1.00 0.00 H new ATOM 1419 N GLU A 453 -6.771 3.229 -10.405 1.00 0.00 N ATOM 1420 CA GLU A 453 -5.692 4.227 -10.166 1.00 0.00 C ATOM 1421 C GLU A 453 -5.696 4.647 -8.695 1.00 0.00 C ATOM 1422 O GLU A 453 -6.709 5.046 -8.156 1.00 0.00 O ATOM 1423 CB GLU A 453 -5.911 5.442 -11.077 1.00 0.00 C ATOM 1424 CG GLU A 453 -7.024 6.351 -10.533 1.00 0.00 C ATOM 1425 CD GLU A 453 -7.447 7.328 -11.635 1.00 0.00 C ATOM 1426 OE1 GLU A 453 -6.700 8.257 -11.896 1.00 0.00 O ATOM 1427 OE2 GLU A 453 -8.509 7.128 -12.200 1.00 0.00 O ATOM 0 H GLU A 453 -7.632 3.610 -10.796 1.00 0.00 H new ATOM 0 HA GLU A 453 -4.723 3.785 -10.397 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -4.984 6.009 -11.161 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -6.171 5.105 -12.081 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -7.877 5.753 -10.212 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -6.671 6.898 -9.659 1.00 0.00 H new ATOM 1434 N ILE A 454 -4.566 4.539 -8.043 1.00 0.00 N ATOM 1435 CA ILE A 454 -4.481 4.909 -6.589 1.00 0.00 C ATOM 1436 C ILE A 454 -3.258 5.798 -6.330 1.00 0.00 C ATOM 1437 O ILE A 454 -2.276 5.752 -7.043 1.00 0.00 O ATOM 1438 CB ILE A 454 -4.354 3.634 -5.752 1.00 0.00 C ATOM 1439 CG1 ILE A 454 -5.614 2.782 -5.928 1.00 0.00 C ATOM 1440 CG2 ILE A 454 -4.195 4.008 -4.277 1.00 0.00 C ATOM 1441 CD1 ILE A 454 -5.369 1.382 -5.362 1.00 0.00 C ATOM 0 H ILE A 454 -3.692 4.209 -8.453 1.00 0.00 H new ATOM 0 HA ILE A 454 -5.383 5.456 -6.313 1.00 0.00 H new ATOM 0 HB ILE A 454 -3.482 3.068 -6.080 1.00 0.00 H new ATOM 0 HG12 ILE A 454 -6.456 3.250 -5.417 1.00 0.00 H new ATOM 0 HG13 ILE A 454 -5.877 2.718 -6.984 1.00 0.00 H new ATOM 0 HG21 ILE A 454 -4.104 3.101 -3.679 1.00 0.00 H new ATOM 0 HG22 ILE A 454 -3.300 4.617 -4.150 1.00 0.00 H new ATOM 0 HG23 ILE A 454 -5.067 4.573 -3.949 1.00 0.00 H new ATOM 0 HD11 ILE A 454 -6.267 0.776 -5.488 1.00 0.00 H new ATOM 0 HD12 ILE A 454 -4.539 0.915 -5.892 1.00 0.00 H new ATOM 0 HD13 ILE A 454 -5.127 1.455 -4.302 1.00 0.00 H new ATOM 1453 N TRP A 455 -3.324 6.609 -5.301 1.00 0.00 N ATOM 1454 CA TRP A 455 -2.190 7.517 -4.954 1.00 0.00 C ATOM 1455 C TRP A 455 -2.081 7.629 -3.424 1.00 0.00 C ATOM 1456 O TRP A 455 -3.010 8.050 -2.765 1.00 0.00 O ATOM 1457 CB TRP A 455 -2.470 8.904 -5.541 1.00 0.00 C ATOM 1458 CG TRP A 455 -3.039 8.759 -6.915 1.00 0.00 C ATOM 1459 CD1 TRP A 455 -4.302 8.367 -7.203 1.00 0.00 C ATOM 1460 CD2 TRP A 455 -2.386 9.003 -8.188 1.00 0.00 C ATOM 1461 NE1 TRP A 455 -4.461 8.356 -8.579 1.00 0.00 N ATOM 1462 CE2 TRP A 455 -3.305 8.742 -9.228 1.00 0.00 C ATOM 1463 CE3 TRP A 455 -1.096 9.423 -8.531 1.00 0.00 C ATOM 1464 CZ2 TRP A 455 -2.953 8.893 -10.570 1.00 0.00 C ATOM 1465 CZ3 TRP A 455 -0.733 9.578 -9.879 1.00 0.00 C ATOM 1466 CH2 TRP A 455 -1.660 9.314 -10.897 1.00 0.00 C ATOM 0 H TRP A 455 -4.129 6.679 -4.679 1.00 0.00 H new ATOM 0 HA TRP A 455 -1.259 7.121 -5.359 1.00 0.00 H new ATOM 0 HB2 TRP A 455 -3.167 9.447 -4.903 1.00 0.00 H new ATOM 0 HB3 TRP A 455 -1.550 9.488 -5.577 1.00 0.00 H new ATOM 0 HD1 TRP A 455 -5.060 8.106 -6.480 1.00 0.00 H new ATOM 0 HE1 TRP A 455 -5.325 8.095 -9.054 1.00 0.00 H new ATOM 0 HE3 TRP A 455 -0.375 9.629 -7.754 1.00 0.00 H new ATOM 0 HZ2 TRP A 455 -3.672 8.687 -11.349 1.00 0.00 H new ATOM 0 HZ3 TRP A 455 0.265 9.902 -10.133 1.00 0.00 H new ATOM 0 HH2 TRP A 455 -1.376 9.436 -11.932 1.00 0.00 H new ATOM 1477 N LEU A 456 -0.963 7.260 -2.847 1.00 0.00 N ATOM 1478 CA LEU A 456 -0.829 7.352 -1.362 1.00 0.00 C ATOM 1479 C LEU A 456 -0.326 8.744 -0.962 1.00 0.00 C ATOM 1480 O LEU A 456 0.177 9.498 -1.771 1.00 0.00 O ATOM 1481 CB LEU A 456 0.173 6.300 -0.870 1.00 0.00 C ATOM 1482 CG LEU A 456 0.000 5.001 -1.655 1.00 0.00 C ATOM 1483 CD1 LEU A 456 0.959 3.944 -1.097 1.00 0.00 C ATOM 1484 CD2 LEU A 456 -1.444 4.510 -1.521 1.00 0.00 C ATOM 0 H LEU A 456 -0.144 6.902 -3.337 1.00 0.00 H new ATOM 0 HA LEU A 456 -1.805 7.176 -0.910 1.00 0.00 H new ATOM 0 HB2 LEU A 456 1.190 6.673 -0.988 1.00 0.00 H new ATOM 0 HB3 LEU A 456 0.023 6.114 0.194 1.00 0.00 H new ATOM 0 HG LEU A 456 0.222 5.176 -2.708 1.00 0.00 H new ATOM 0 HD11 LEU A 456 0.840 3.014 -1.654 1.00 0.00 H new ATOM 0 HD12 LEU A 456 1.986 4.296 -1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 456 0.734 3.768 -0.045 1.00 0.00 H new ATOM 0 HD21 LEU A 456 -1.567 3.583 -2.081 1.00 0.00 H new ATOM 0 HD22 LEU A 456 -1.672 4.331 -0.470 1.00 0.00 H new ATOM 0 HD23 LEU A 456 -2.123 5.265 -1.916 1.00 0.00 H new ATOM 1496 N ARG A 457 -0.464 9.078 0.291 1.00 0.00 N ATOM 1497 CA ARG A 457 -0.014 10.395 0.788 1.00 0.00 C ATOM 1498 C ARG A 457 1.478 10.348 1.094 1.00 0.00 C ATOM 1499 O ARG A 457 1.997 9.370 1.595 1.00 0.00 O ATOM 1500 CB ARG A 457 -0.764 10.678 2.086 1.00 0.00 C ATOM 1501 CG ARG A 457 -0.282 11.982 2.730 1.00 0.00 C ATOM 1502 CD ARG A 457 -0.397 13.146 1.742 1.00 0.00 C ATOM 1503 NE ARG A 457 -1.624 12.991 0.902 1.00 0.00 N ATOM 1504 CZ ARG A 457 -2.811 13.051 1.445 1.00 0.00 C ATOM 1505 NH1 ARG A 457 -2.934 13.282 2.722 1.00 0.00 N ATOM 1506 NH2 ARG A 457 -3.875 12.885 0.706 1.00 0.00 N ATOM 0 H ARG A 457 -0.880 8.476 1.002 1.00 0.00 H new ATOM 0 HA ARG A 457 -0.205 11.165 0.040 1.00 0.00 H new ATOM 0 HB2 ARG A 457 -1.833 10.742 1.885 1.00 0.00 H new ATOM 0 HB3 ARG A 457 -0.619 9.851 2.781 1.00 0.00 H new ATOM 0 HG2 ARG A 457 -0.873 12.194 3.621 1.00 0.00 H new ATOM 0 HG3 ARG A 457 0.753 11.873 3.053 1.00 0.00 H new ATOM 0 HD2 ARG A 457 -0.436 14.091 2.285 1.00 0.00 H new ATOM 0 HD3 ARG A 457 0.487 13.180 1.105 1.00 0.00 H new ATOM 0 HE ARG A 457 -1.534 12.837 -0.102 1.00 0.00 H new ATOM 0 HH11 ARG A 457 -2.103 13.416 3.298 1.00 0.00 H new ATOM 0 HH12 ARG A 457 -3.861 13.329 3.145 1.00 0.00 H new ATOM 0 HH21 ARG A 457 -3.779 12.709 -0.294 1.00 0.00 H new ATOM 0 HH22 ARG A 457 -4.802 12.932 1.129 1.00 0.00 H new ATOM 1520 N CYS A 458 2.155 11.421 0.835 1.00 0.00 N ATOM 1521 CA CYS A 458 3.608 11.488 1.145 1.00 0.00 C ATOM 1522 C CYS A 458 3.726 11.859 2.621 1.00 0.00 C ATOM 1523 O CYS A 458 2.970 12.675 3.110 1.00 0.00 O ATOM 1524 CB CYS A 458 4.273 12.565 0.276 1.00 0.00 C ATOM 1525 SG CYS A 458 3.089 13.897 -0.043 1.00 0.00 S ATOM 0 H CYS A 458 1.764 12.266 0.418 1.00 0.00 H new ATOM 0 HA CYS A 458 4.101 10.537 0.942 1.00 0.00 H new ATOM 0 HB2 CYS A 458 5.155 12.961 0.780 1.00 0.00 H new ATOM 0 HB3 CYS A 458 4.611 12.131 -0.665 1.00 0.00 H new ATOM 0 HG CYS A 458 2.429 14.161 1.045 1.00 0.00 H new ATOM 1531 N ASP A 459 4.636 11.263 3.349 1.00 0.00 N ATOM 1532 CA ASP A 459 4.744 11.591 4.798 1.00 0.00 C ATOM 1533 C ASP A 459 6.207 11.604 5.248 1.00 0.00 C ATOM 1534 O ASP A 459 6.660 12.566 5.834 1.00 0.00 O ATOM 1535 CB ASP A 459 3.968 10.542 5.595 1.00 0.00 C ATOM 1536 CG ASP A 459 3.732 11.047 7.020 1.00 0.00 C ATOM 1537 OD1 ASP A 459 2.960 11.979 7.177 1.00 0.00 O ATOM 1538 OD2 ASP A 459 4.324 10.491 7.930 1.00 0.00 O ATOM 0 H ASP A 459 5.301 10.571 3.005 1.00 0.00 H new ATOM 0 HA ASP A 459 4.329 12.584 4.972 1.00 0.00 H new ATOM 0 HB2 ASP A 459 3.014 10.335 5.110 1.00 0.00 H new ATOM 0 HB3 ASP A 459 4.524 9.605 5.618 1.00 0.00 H new ATOM 1543 N ASN A 460 6.954 10.557 4.996 1.00 0.00 N ATOM 1544 CA ASN A 460 8.383 10.552 5.448 1.00 0.00 C ATOM 1545 C ASN A 460 9.134 9.375 4.806 1.00 0.00 C ATOM 1546 O ASN A 460 8.668 8.758 3.869 1.00 0.00 O ATOM 1547 CB ASN A 460 8.425 10.420 6.988 1.00 0.00 C ATOM 1548 CG ASN A 460 8.339 11.802 7.643 1.00 0.00 C ATOM 1549 OD1 ASN A 460 7.221 12.177 8.203 1.00 0.00 O flip ATOM 1550 ND2 ASN A 460 9.298 12.547 7.645 1.00 0.00 N flip ATOM 0 H ASN A 460 6.644 9.718 4.505 1.00 0.00 H new ATOM 0 HA ASN A 460 8.863 11.482 5.144 1.00 0.00 H new ATOM 0 HB2 ASN A 460 7.598 9.796 7.329 1.00 0.00 H new ATOM 0 HB3 ASN A 460 9.346 9.923 7.292 1.00 0.00 H new ATOM 0 HD21 ASN A 460 10.172 12.255 7.208 1.00 0.00 H new ATOM 0 HD22 ASN A 460 9.230 13.465 8.084 1.00 0.00 H new ATOM 1557 N GLU A 461 10.302 9.070 5.312 1.00 0.00 N ATOM 1558 CA GLU A 461 11.102 7.948 4.748 1.00 0.00 C ATOM 1559 C GLU A 461 10.598 6.611 5.306 1.00 0.00 C ATOM 1560 O GLU A 461 10.498 5.632 4.594 1.00 0.00 O ATOM 1561 CB GLU A 461 12.579 8.141 5.119 1.00 0.00 C ATOM 1562 CG GLU A 461 12.700 8.645 6.568 1.00 0.00 C ATOM 1563 CD GLU A 461 12.576 10.172 6.607 1.00 0.00 C ATOM 1564 OE1 GLU A 461 13.478 10.832 6.117 1.00 0.00 O ATOM 1565 OE2 GLU A 461 11.584 10.654 7.127 1.00 0.00 O ATOM 0 H GLU A 461 10.736 9.555 6.097 1.00 0.00 H new ATOM 0 HA GLU A 461 10.996 7.940 3.663 1.00 0.00 H new ATOM 0 HB2 GLU A 461 13.116 7.199 5.008 1.00 0.00 H new ATOM 0 HB3 GLU A 461 13.043 8.855 4.438 1.00 0.00 H new ATOM 0 HG2 GLU A 461 11.923 8.193 7.184 1.00 0.00 H new ATOM 0 HG3 GLU A 461 13.658 8.339 6.989 1.00 0.00 H new ATOM 1572 N LYS A 462 10.282 6.561 6.571 1.00 0.00 N ATOM 1573 CA LYS A 462 9.790 5.290 7.166 1.00 0.00 C ATOM 1574 C LYS A 462 8.638 4.756 6.323 1.00 0.00 C ATOM 1575 O LYS A 462 8.617 3.609 5.923 1.00 0.00 O ATOM 1576 CB LYS A 462 9.278 5.564 8.579 1.00 0.00 C ATOM 1577 CG LYS A 462 10.405 6.139 9.444 1.00 0.00 C ATOM 1578 CD LYS A 462 9.798 6.827 10.669 1.00 0.00 C ATOM 1579 CE LYS A 462 10.898 7.139 11.686 1.00 0.00 C ATOM 1580 NZ LYS A 462 10.388 8.125 12.682 1.00 0.00 N ATOM 0 H LYS A 462 10.344 7.347 7.218 1.00 0.00 H new ATOM 0 HA LYS A 462 10.600 4.561 7.196 1.00 0.00 H new ATOM 0 HB2 LYS A 462 8.443 6.264 8.543 1.00 0.00 H new ATOM 0 HB3 LYS A 462 8.902 4.642 9.023 1.00 0.00 H new ATOM 0 HG2 LYS A 462 11.082 5.344 9.757 1.00 0.00 H new ATOM 0 HG3 LYS A 462 10.995 6.851 8.867 1.00 0.00 H new ATOM 0 HD2 LYS A 462 9.296 7.747 10.369 1.00 0.00 H new ATOM 0 HD3 LYS A 462 9.043 6.184 11.122 1.00 0.00 H new ATOM 0 HE2 LYS A 462 11.212 6.225 12.191 1.00 0.00 H new ATOM 0 HE3 LYS A 462 11.775 7.540 11.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 11.135 8.338 13.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 10.109 9.000 12.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 9.563 7.726 13.175 1.00 0.00 H new ATOM 1594 N GLN A 463 7.673 5.589 6.067 1.00 0.00 N ATOM 1595 CA GLN A 463 6.496 5.168 5.267 1.00 0.00 C ATOM 1596 C GLN A 463 6.950 4.541 3.942 1.00 0.00 C ATOM 1597 O GLN A 463 6.700 3.380 3.686 1.00 0.00 O ATOM 1598 CB GLN A 463 5.624 6.412 5.002 1.00 0.00 C ATOM 1599 CG GLN A 463 4.598 6.605 6.131 1.00 0.00 C ATOM 1600 CD GLN A 463 5.296 7.156 7.372 1.00 0.00 C ATOM 1601 OE1 GLN A 463 5.902 8.206 7.326 1.00 0.00 O ATOM 1602 NE2 GLN A 463 5.236 6.486 8.491 1.00 0.00 N ATOM 0 H GLN A 463 7.650 6.558 6.383 1.00 0.00 H new ATOM 0 HA GLN A 463 5.921 4.419 5.812 1.00 0.00 H new ATOM 0 HB2 GLN A 463 6.257 7.296 4.923 1.00 0.00 H new ATOM 0 HB3 GLN A 463 5.107 6.304 4.048 1.00 0.00 H new ATOM 0 HG2 GLN A 463 3.813 7.290 5.809 1.00 0.00 H new ATOM 0 HG3 GLN A 463 4.117 5.655 6.364 1.00 0.00 H new ATOM 0 HE21 GLN A 463 4.727 5.603 8.530 1.00 0.00 H new ATOM 0 HE22 GLN A 463 5.698 6.845 9.326 1.00 0.00 H new ATOM 1611 N TYR A 464 7.595 5.296 3.094 1.00 0.00 N ATOM 1612 CA TYR A 464 8.040 4.735 1.785 1.00 0.00 C ATOM 1613 C TYR A 464 8.679 3.353 1.990 1.00 0.00 C ATOM 1614 O TYR A 464 8.251 2.374 1.412 1.00 0.00 O ATOM 1615 CB TYR A 464 9.052 5.726 1.146 1.00 0.00 C ATOM 1616 CG TYR A 464 8.547 6.241 -0.193 1.00 0.00 C ATOM 1617 CD1 TYR A 464 7.229 6.711 -0.322 1.00 0.00 C ATOM 1618 CD2 TYR A 464 9.398 6.241 -1.306 1.00 0.00 C ATOM 1619 CE1 TYR A 464 6.770 7.176 -1.556 1.00 0.00 C ATOM 1620 CE2 TYR A 464 8.939 6.711 -2.539 1.00 0.00 C ATOM 1621 CZ TYR A 464 7.626 7.175 -2.666 1.00 0.00 C ATOM 1622 OH TYR A 464 7.180 7.630 -3.885 1.00 0.00 O ATOM 0 H TYR A 464 7.833 6.275 3.250 1.00 0.00 H new ATOM 0 HA TYR A 464 7.186 4.608 1.119 1.00 0.00 H new ATOM 0 HB2 TYR A 464 9.219 6.565 1.822 1.00 0.00 H new ATOM 0 HB3 TYR A 464 10.013 5.230 1.009 1.00 0.00 H new ATOM 0 HD1 TYR A 464 6.571 6.713 0.534 1.00 0.00 H new ATOM 0 HD2 TYR A 464 10.410 5.877 -1.211 1.00 0.00 H new ATOM 0 HE1 TYR A 464 5.757 7.536 -1.655 1.00 0.00 H new ATOM 0 HE2 TYR A 464 9.598 6.716 -3.394 1.00 0.00 H new ATOM 0 HH TYR A 464 7.946 7.787 -4.476 1.00 0.00 H new ATOM 1632 N ALA A 465 9.701 3.267 2.788 1.00 0.00 N ATOM 1633 CA ALA A 465 10.369 1.954 3.004 1.00 0.00 C ATOM 1634 C ALA A 465 9.345 0.844 3.295 1.00 0.00 C ATOM 1635 O ALA A 465 9.580 -0.309 2.990 1.00 0.00 O ATOM 1636 CB ALA A 465 11.338 2.076 4.181 1.00 0.00 C ATOM 0 H ALA A 465 10.105 4.050 3.302 1.00 0.00 H new ATOM 0 HA ALA A 465 10.907 1.686 2.094 1.00 0.00 H new ATOM 0 HB1 ALA A 465 11.832 1.119 4.346 1.00 0.00 H new ATOM 0 HB2 ALA A 465 12.086 2.837 3.959 1.00 0.00 H new ATOM 0 HB3 ALA A 465 10.787 2.360 5.078 1.00 0.00 H new ATOM 1642 N HIS A 466 8.226 1.159 3.897 1.00 0.00 N ATOM 1643 CA HIS A 466 7.235 0.081 4.216 1.00 0.00 C ATOM 1644 C HIS A 466 6.440 -0.338 2.965 1.00 0.00 C ATOM 1645 O HIS A 466 6.515 -1.470 2.533 1.00 0.00 O ATOM 1646 CB HIS A 466 6.262 0.586 5.296 1.00 0.00 C ATOM 1647 CG HIS A 466 6.910 0.508 6.656 1.00 0.00 C ATOM 1648 ND1 HIS A 466 8.041 1.244 6.983 1.00 0.00 N ATOM 1649 CD2 HIS A 466 6.595 -0.214 7.783 1.00 0.00 C ATOM 1650 CE1 HIS A 466 8.361 0.953 8.258 1.00 0.00 C ATOM 1651 NE2 HIS A 466 7.512 0.071 8.788 1.00 0.00 N ATOM 0 H HIS A 466 7.956 2.101 4.179 1.00 0.00 H new ATOM 0 HA HIS A 466 7.782 -0.789 4.579 1.00 0.00 H new ATOM 0 HB2 HIS A 466 5.971 1.614 5.082 1.00 0.00 H new ATOM 0 HB3 HIS A 466 5.351 -0.012 5.284 1.00 0.00 H new ATOM 0 HD1 HIS A 466 8.539 1.888 6.369 1.00 0.00 H new ATOM 0 HD2 HIS A 466 5.763 -0.897 7.873 1.00 0.00 H new ATOM 0 HE1 HIS A 466 9.201 1.380 8.786 1.00 0.00 H new ATOM 1660 N TRP A 467 5.657 0.544 2.397 1.00 0.00 N ATOM 1661 CA TRP A 467 4.846 0.156 1.203 1.00 0.00 C ATOM 1662 C TRP A 467 5.695 0.136 -0.078 1.00 0.00 C ATOM 1663 O TRP A 467 5.577 -0.767 -0.883 1.00 0.00 O ATOM 1664 CB TRP A 467 3.692 1.154 1.035 1.00 0.00 C ATOM 1665 CG TRP A 467 2.614 0.837 2.021 1.00 0.00 C ATOM 1666 CD1 TRP A 467 2.756 0.873 3.365 1.00 0.00 C ATOM 1667 CD2 TRP A 467 1.241 0.426 1.765 1.00 0.00 C ATOM 1668 NE1 TRP A 467 1.558 0.512 3.951 1.00 0.00 N ATOM 1669 CE2 TRP A 467 0.591 0.228 3.006 1.00 0.00 C ATOM 1670 CE3 TRP A 467 0.502 0.211 0.587 1.00 0.00 C ATOM 1671 CZ2 TRP A 467 -0.743 -0.172 3.077 1.00 0.00 C ATOM 1672 CZ3 TRP A 467 -0.842 -0.192 0.655 1.00 0.00 C ATOM 1673 CH2 TRP A 467 -1.463 -0.383 1.897 1.00 0.00 C ATOM 0 H TRP A 467 5.544 1.510 2.706 1.00 0.00 H new ATOM 0 HA TRP A 467 4.461 -0.851 1.365 1.00 0.00 H new ATOM 0 HB2 TRP A 467 4.052 2.172 1.187 1.00 0.00 H new ATOM 0 HB3 TRP A 467 3.298 1.104 0.020 1.00 0.00 H new ATOM 0 HD1 TRP A 467 3.659 1.140 3.894 1.00 0.00 H new ATOM 0 HE1 TRP A 467 1.406 0.461 4.958 1.00 0.00 H new ATOM 0 HE3 TRP A 467 0.971 0.357 -0.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 467 -1.217 -0.318 4.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 467 -1.400 -0.356 -0.255 1.00 0.00 H new ATOM 0 HH2 TRP A 467 -2.497 -0.693 1.943 1.00 0.00 H new ATOM 1684 N MET A 468 6.519 1.124 -0.303 1.00 0.00 N ATOM 1685 CA MET A 468 7.319 1.134 -1.564 1.00 0.00 C ATOM 1686 C MET A 468 7.997 -0.229 -1.777 1.00 0.00 C ATOM 1687 O MET A 468 7.890 -0.822 -2.830 1.00 0.00 O ATOM 1688 CB MET A 468 8.349 2.293 -1.531 1.00 0.00 C ATOM 1689 CG MET A 468 9.745 1.821 -1.089 1.00 0.00 C ATOM 1690 SD MET A 468 10.840 3.255 -0.958 1.00 0.00 S ATOM 1691 CE MET A 468 11.041 3.587 -2.729 1.00 0.00 C ATOM 0 H MET A 468 6.673 1.915 0.322 1.00 0.00 H new ATOM 0 HA MET A 468 6.655 1.304 -2.412 1.00 0.00 H new ATOM 0 HB2 MET A 468 8.417 2.744 -2.521 1.00 0.00 H new ATOM 0 HB3 MET A 468 7.998 3.069 -0.851 1.00 0.00 H new ATOM 0 HG2 MET A 468 9.682 1.307 -0.130 1.00 0.00 H new ATOM 0 HG3 MET A 468 10.146 1.106 -1.808 1.00 0.00 H new ATOM 0 HE1 MET A 468 11.926 4.204 -2.885 1.00 0.00 H new ATOM 0 HE2 MET A 468 11.156 2.645 -3.265 1.00 0.00 H new ATOM 0 HE3 MET A 468 10.162 4.112 -3.103 1.00 0.00 H new ATOM 1701 N ALA A 469 8.698 -0.729 -0.799 1.00 0.00 N ATOM 1702 CA ALA A 469 9.370 -2.043 -0.983 1.00 0.00 C ATOM 1703 C ALA A 469 8.302 -3.126 -1.156 1.00 0.00 C ATOM 1704 O ALA A 469 8.280 -3.836 -2.138 1.00 0.00 O ATOM 1705 CB ALA A 469 10.243 -2.351 0.244 1.00 0.00 C ATOM 0 H ALA A 469 8.834 -0.289 0.111 1.00 0.00 H new ATOM 0 HA ALA A 469 10.006 -2.016 -1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 469 10.735 -3.314 0.108 1.00 0.00 H new ATOM 0 HB2 ALA A 469 10.996 -1.572 0.359 1.00 0.00 H new ATOM 0 HB3 ALA A 469 9.618 -2.386 1.136 1.00 0.00 H new ATOM 1711 N ALA A 470 7.419 -3.249 -0.206 1.00 0.00 N ATOM 1712 CA ALA A 470 6.347 -4.283 -0.290 1.00 0.00 C ATOM 1713 C ALA A 470 5.649 -4.240 -1.656 1.00 0.00 C ATOM 1714 O ALA A 470 5.503 -5.250 -2.316 1.00 0.00 O ATOM 1715 CB ALA A 470 5.321 -4.020 0.818 1.00 0.00 C ATOM 0 H ALA A 470 7.393 -2.672 0.635 1.00 0.00 H new ATOM 0 HA ALA A 470 6.795 -5.269 -0.167 1.00 0.00 H new ATOM 0 HB1 ALA A 470 4.531 -4.769 0.768 1.00 0.00 H new ATOM 0 HB2 ALA A 470 5.812 -4.075 1.789 1.00 0.00 H new ATOM 0 HB3 ALA A 470 4.889 -3.028 0.686 1.00 0.00 H new ATOM 1721 N CYS A 471 5.195 -3.090 -2.076 1.00 0.00 N ATOM 1722 CA CYS A 471 4.485 -3.007 -3.386 1.00 0.00 C ATOM 1723 C CYS A 471 5.278 -3.760 -4.458 1.00 0.00 C ATOM 1724 O CYS A 471 4.733 -4.550 -5.202 1.00 0.00 O ATOM 1725 CB CYS A 471 4.301 -1.537 -3.791 1.00 0.00 C ATOM 1726 SG CYS A 471 5.821 -0.886 -4.530 1.00 0.00 S ATOM 0 H CYS A 471 5.284 -2.208 -1.572 1.00 0.00 H new ATOM 0 HA CYS A 471 3.502 -3.468 -3.289 1.00 0.00 H new ATOM 0 HB2 CYS A 471 3.478 -1.450 -4.501 1.00 0.00 H new ATOM 0 HB3 CYS A 471 4.032 -0.944 -2.917 1.00 0.00 H new ATOM 0 HG CYS A 471 6.801 -1.006 -3.684 1.00 0.00 H new ATOM 1732 N ARG A 472 6.558 -3.536 -4.541 1.00 0.00 N ATOM 1733 CA ARG A 472 7.362 -4.259 -5.563 1.00 0.00 C ATOM 1734 C ARG A 472 7.247 -5.762 -5.301 1.00 0.00 C ATOM 1735 O ARG A 472 7.047 -6.550 -6.208 1.00 0.00 O ATOM 1736 CB ARG A 472 8.830 -3.823 -5.473 1.00 0.00 C ATOM 1737 CG ARG A 472 8.969 -2.339 -5.872 1.00 0.00 C ATOM 1738 CD ARG A 472 10.387 -2.058 -6.393 1.00 0.00 C ATOM 1739 NE ARG A 472 10.449 -2.384 -7.846 1.00 0.00 N ATOM 1740 CZ ARG A 472 11.563 -2.221 -8.507 1.00 0.00 C ATOM 1741 NH1 ARG A 472 12.627 -1.779 -7.894 1.00 0.00 N ATOM 1742 NH2 ARG A 472 11.611 -2.499 -9.781 1.00 0.00 N ATOM 0 H ARG A 472 7.080 -2.888 -3.950 1.00 0.00 H new ATOM 0 HA ARG A 472 6.990 -4.028 -6.561 1.00 0.00 H new ATOM 0 HB2 ARG A 472 9.200 -3.971 -4.458 1.00 0.00 H new ATOM 0 HB3 ARG A 472 9.442 -4.443 -6.128 1.00 0.00 H new ATOM 0 HG2 ARG A 472 8.236 -2.092 -6.640 1.00 0.00 H new ATOM 0 HG3 ARG A 472 8.757 -1.703 -5.013 1.00 0.00 H new ATOM 0 HD2 ARG A 472 10.646 -1.012 -6.232 1.00 0.00 H new ATOM 0 HD3 ARG A 472 11.114 -2.655 -5.843 1.00 0.00 H new ATOM 0 HE ARG A 472 9.620 -2.735 -8.325 1.00 0.00 H new ATOM 0 HH11 ARG A 472 12.588 -1.561 -6.898 1.00 0.00 H new ATOM 0 HH12 ARG A 472 13.497 -1.652 -8.411 1.00 0.00 H new ATOM 0 HH21 ARG A 472 10.779 -2.843 -10.260 1.00 0.00 H new ATOM 0 HH22 ARG A 472 12.481 -2.372 -10.298 1.00 0.00 H new ATOM 1756 N LEU A 473 7.347 -6.169 -4.065 1.00 0.00 N ATOM 1757 CA LEU A 473 7.218 -7.618 -3.759 1.00 0.00 C ATOM 1758 C LEU A 473 5.779 -8.042 -4.045 1.00 0.00 C ATOM 1759 O LEU A 473 5.524 -9.087 -4.607 1.00 0.00 O ATOM 1760 CB LEU A 473 7.545 -7.887 -2.286 1.00 0.00 C ATOM 1761 CG LEU A 473 8.828 -7.154 -1.891 1.00 0.00 C ATOM 1762 CD1 LEU A 473 9.236 -7.566 -0.478 1.00 0.00 C ATOM 1763 CD2 LEU A 473 9.950 -7.509 -2.873 1.00 0.00 C ATOM 0 H LEU A 473 7.511 -5.564 -3.260 1.00 0.00 H new ATOM 0 HA LEU A 473 7.915 -8.185 -4.376 1.00 0.00 H new ATOM 0 HB2 LEU A 473 6.719 -7.557 -1.656 1.00 0.00 H new ATOM 0 HB3 LEU A 473 7.663 -8.958 -2.121 1.00 0.00 H new ATOM 0 HG LEU A 473 8.652 -6.079 -1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 473 10.150 -7.044 -0.196 1.00 0.00 H new ATOM 0 HD12 LEU A 473 8.440 -7.307 0.221 1.00 0.00 H new ATOM 0 HD13 LEU A 473 9.409 -8.642 -0.448 1.00 0.00 H new ATOM 0 HD21 LEU A 473 10.862 -6.985 -2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 473 10.127 -8.584 -2.850 1.00 0.00 H new ATOM 0 HD23 LEU A 473 9.660 -7.211 -3.880 1.00 0.00 H new ATOM 1775 N ALA A 474 4.834 -7.227 -3.669 1.00 0.00 N ATOM 1776 CA ALA A 474 3.409 -7.566 -3.924 1.00 0.00 C ATOM 1777 C ALA A 474 3.240 -7.950 -5.396 1.00 0.00 C ATOM 1778 O ALA A 474 2.299 -8.623 -5.770 1.00 0.00 O ATOM 1779 CB ALA A 474 2.536 -6.352 -3.602 1.00 0.00 C ATOM 0 H ALA A 474 4.989 -6.338 -3.194 1.00 0.00 H new ATOM 0 HA ALA A 474 3.108 -8.403 -3.294 1.00 0.00 H new ATOM 0 HB1 ALA A 474 1.490 -6.596 -3.788 1.00 0.00 H new ATOM 0 HB2 ALA A 474 2.664 -6.079 -2.555 1.00 0.00 H new ATOM 0 HB3 ALA A 474 2.831 -5.514 -4.234 1.00 0.00 H new ATOM 1785 N SER A 475 4.145 -7.525 -6.237 1.00 0.00 N ATOM 1786 CA SER A 475 4.039 -7.862 -7.685 1.00 0.00 C ATOM 1787 C SER A 475 4.323 -9.353 -7.894 1.00 0.00 C ATOM 1788 O SER A 475 3.651 -10.017 -8.658 1.00 0.00 O ATOM 1789 CB SER A 475 5.054 -7.036 -8.478 1.00 0.00 C ATOM 1790 OG SER A 475 4.730 -7.094 -9.860 1.00 0.00 O ATOM 0 H SER A 475 4.954 -6.958 -5.982 1.00 0.00 H new ATOM 0 HA SER A 475 3.031 -7.635 -8.032 1.00 0.00 H new ATOM 0 HB2 SER A 475 5.046 -6.002 -8.134 1.00 0.00 H new ATOM 0 HB3 SER A 475 6.061 -7.419 -8.312 1.00 0.00 H new ATOM 0 HG SER A 475 5.378 -6.564 -10.370 1.00 0.00 H new ATOM 1796 N LYS A 476 5.313 -9.890 -7.227 1.00 0.00 N ATOM 1797 CA LYS A 476 5.621 -11.341 -7.404 1.00 0.00 C ATOM 1798 C LYS A 476 4.619 -12.173 -6.598 1.00 0.00 C ATOM 1799 O LYS A 476 4.531 -13.374 -6.755 1.00 0.00 O ATOM 1800 CB LYS A 476 7.060 -11.650 -6.949 1.00 0.00 C ATOM 1801 CG LYS A 476 7.422 -10.826 -5.709 1.00 0.00 C ATOM 1802 CD LYS A 476 8.855 -11.166 -5.254 1.00 0.00 C ATOM 1803 CE LYS A 476 9.903 -10.438 -6.131 1.00 0.00 C ATOM 1804 NZ LYS A 476 10.938 -11.417 -6.572 1.00 0.00 N ATOM 0 H LYS A 476 5.916 -9.391 -6.573 1.00 0.00 H new ATOM 0 HA LYS A 476 5.538 -11.597 -8.460 1.00 0.00 H new ATOM 0 HB2 LYS A 476 7.157 -12.713 -6.727 1.00 0.00 H new ATOM 0 HB3 LYS A 476 7.758 -11.428 -7.756 1.00 0.00 H new ATOM 0 HG2 LYS A 476 7.345 -9.762 -5.933 1.00 0.00 H new ATOM 0 HG3 LYS A 476 6.717 -11.034 -4.905 1.00 0.00 H new ATOM 0 HD2 LYS A 476 8.987 -10.880 -4.211 1.00 0.00 H new ATOM 0 HD3 LYS A 476 9.013 -12.243 -5.311 1.00 0.00 H new ATOM 0 HE2 LYS A 476 9.419 -9.987 -6.997 1.00 0.00 H new ATOM 0 HE3 LYS A 476 10.367 -9.629 -5.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 11.698 -10.916 -7.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 11.334 -11.901 -5.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 10.505 -12.117 -7.207 1.00 0.00 H new ATOM 1818 N GLY A 477 3.849 -11.538 -5.749 1.00 0.00 N ATOM 1819 CA GLY A 477 2.829 -12.281 -4.941 1.00 0.00 C ATOM 1820 C GLY A 477 3.320 -12.475 -3.504 1.00 0.00 C ATOM 1821 O GLY A 477 2.540 -12.463 -2.573 1.00 0.00 O ATOM 0 H GLY A 477 3.882 -10.533 -5.579 1.00 0.00 H new ATOM 0 HA2 GLY A 477 1.888 -11.731 -4.939 1.00 0.00 H new ATOM 0 HA3 GLY A 477 2.631 -13.251 -5.398 1.00 0.00 H new ATOM 1825 N LYS A 478 4.601 -12.665 -3.308 1.00 0.00 N ATOM 1826 CA LYS A 478 5.125 -12.873 -1.919 1.00 0.00 C ATOM 1827 C LYS A 478 5.560 -11.520 -1.339 1.00 0.00 C ATOM 1828 O LYS A 478 5.733 -10.556 -2.060 1.00 0.00 O ATOM 1829 CB LYS A 478 6.310 -13.867 -1.979 1.00 0.00 C ATOM 1830 CG LYS A 478 7.205 -13.809 -0.719 1.00 0.00 C ATOM 1831 CD LYS A 478 6.425 -14.254 0.540 1.00 0.00 C ATOM 1832 CE LYS A 478 6.484 -15.781 0.685 1.00 0.00 C ATOM 1833 NZ LYS A 478 5.800 -16.184 1.946 1.00 0.00 N ATOM 0 H LYS A 478 5.306 -12.685 -4.045 1.00 0.00 H new ATOM 0 HA LYS A 478 4.354 -13.290 -1.271 1.00 0.00 H new ATOM 0 HB2 LYS A 478 5.924 -14.879 -2.098 1.00 0.00 H new ATOM 0 HB3 LYS A 478 6.915 -13.651 -2.859 1.00 0.00 H new ATOM 0 HG2 LYS A 478 8.075 -14.451 -0.857 1.00 0.00 H new ATOM 0 HG3 LYS A 478 7.577 -12.794 -0.580 1.00 0.00 H new ATOM 0 HD2 LYS A 478 6.848 -13.780 1.426 1.00 0.00 H new ATOM 0 HD3 LYS A 478 5.387 -13.928 0.469 1.00 0.00 H new ATOM 0 HE2 LYS A 478 6.005 -16.258 -0.170 1.00 0.00 H new ATOM 0 HE3 LYS A 478 7.521 -16.117 0.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 478 5.839 -17.218 2.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 478 6.276 -15.739 2.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 478 4.807 -15.876 1.916 1.00 0.00 H new ATOM 1847 N THR A 479 5.733 -11.435 -0.040 1.00 0.00 N ATOM 1848 CA THR A 479 6.149 -10.140 0.580 1.00 0.00 C ATOM 1849 C THR A 479 7.078 -10.385 1.777 1.00 0.00 C ATOM 1850 O THR A 479 6.992 -11.390 2.444 1.00 0.00 O ATOM 1851 CB THR A 479 4.904 -9.389 1.058 1.00 0.00 C ATOM 1852 OG1 THR A 479 3.918 -9.412 0.037 1.00 0.00 O ATOM 1853 CG2 THR A 479 5.271 -7.940 1.384 1.00 0.00 C ATOM 0 H THR A 479 5.604 -12.206 0.615 1.00 0.00 H new ATOM 0 HA THR A 479 6.684 -9.551 -0.165 1.00 0.00 H new ATOM 0 HB THR A 479 4.511 -9.871 1.954 1.00 0.00 H new ATOM 0 HG1 THR A 479 3.026 -9.383 0.443 1.00 0.00 H new ATOM 0 HG21 THR A 479 4.383 -7.407 1.724 1.00 0.00 H new ATOM 0 HG22 THR A 479 6.027 -7.924 2.169 1.00 0.00 H new ATOM 0 HG23 THR A 479 5.665 -7.455 0.491 1.00 0.00 H new ATOM 1861 N MET A 480 7.935 -9.426 2.039 1.00 0.00 N ATOM 1862 CA MET A 480 8.904 -9.459 3.189 1.00 0.00 C ATOM 1863 C MET A 480 9.728 -10.763 3.286 1.00 0.00 C ATOM 1864 O MET A 480 10.773 -10.772 3.905 1.00 0.00 O ATOM 1865 CB MET A 480 8.144 -9.157 4.507 1.00 0.00 C ATOM 1866 CG MET A 480 7.766 -10.436 5.279 1.00 0.00 C ATOM 1867 SD MET A 480 9.093 -10.862 6.438 1.00 0.00 S ATOM 1868 CE MET A 480 8.404 -10.045 7.900 1.00 0.00 C ATOM 0 H MET A 480 8.006 -8.579 1.475 1.00 0.00 H new ATOM 0 HA MET A 480 9.648 -8.683 3.006 1.00 0.00 H new ATOM 0 HB2 MET A 480 8.763 -8.523 5.142 1.00 0.00 H new ATOM 0 HB3 MET A 480 7.239 -8.593 4.279 1.00 0.00 H new ATOM 0 HG2 MET A 480 6.832 -10.284 5.820 1.00 0.00 H new ATOM 0 HG3 MET A 480 7.600 -11.258 4.582 1.00 0.00 H new ATOM 0 HE1 MET A 480 9.076 -10.186 8.746 1.00 0.00 H new ATOM 0 HE2 MET A 480 8.289 -8.979 7.701 1.00 0.00 H new ATOM 0 HE3 MET A 480 7.431 -10.477 8.134 1.00 0.00 H new ATOM 1878 N ALA A 481 9.296 -11.857 2.708 1.00 0.00 N ATOM 1879 CA ALA A 481 10.101 -13.118 2.820 1.00 0.00 C ATOM 1880 C ALA A 481 11.026 -13.250 1.612 1.00 0.00 C ATOM 1881 O ALA A 481 11.852 -14.138 1.542 1.00 0.00 O ATOM 1882 CB ALA A 481 9.156 -14.324 2.889 1.00 0.00 C ATOM 0 H ALA A 481 8.433 -11.934 2.170 1.00 0.00 H new ATOM 0 HA ALA A 481 10.705 -13.082 3.726 1.00 0.00 H new ATOM 0 HB1 ALA A 481 9.741 -15.240 2.970 1.00 0.00 H new ATOM 0 HB2 ALA A 481 8.508 -14.229 3.760 1.00 0.00 H new ATOM 0 HB3 ALA A 481 8.547 -14.361 1.986 1.00 0.00 H new ATOM 1888 N ASP A 482 10.896 -12.373 0.667 1.00 0.00 N ATOM 1889 CA ASP A 482 11.766 -12.441 -0.535 1.00 0.00 C ATOM 1890 C ASP A 482 13.193 -12.049 -0.137 1.00 0.00 C ATOM 1891 O ASP A 482 13.405 -11.306 0.801 1.00 0.00 O ATOM 1892 CB ASP A 482 11.207 -11.469 -1.599 1.00 0.00 C ATOM 1893 CG ASP A 482 10.658 -12.247 -2.803 1.00 0.00 C ATOM 1894 OD1 ASP A 482 9.669 -12.942 -2.633 1.00 0.00 O ATOM 1895 OD2 ASP A 482 11.236 -12.132 -3.871 1.00 0.00 O ATOM 0 H ASP A 482 10.222 -11.607 0.672 1.00 0.00 H new ATOM 0 HA ASP A 482 11.784 -13.450 -0.948 1.00 0.00 H new ATOM 0 HB2 ASP A 482 10.417 -10.858 -1.162 1.00 0.00 H new ATOM 0 HB3 ASP A 482 11.993 -10.788 -1.926 1.00 0.00 H new ATOM 1900 N SER A 483 14.171 -12.538 -0.844 1.00 0.00 N ATOM 1901 CA SER A 483 15.577 -12.187 -0.508 1.00 0.00 C ATOM 1902 C SER A 483 15.857 -10.756 -0.972 1.00 0.00 C ATOM 1903 O SER A 483 16.808 -10.130 -0.549 1.00 0.00 O ATOM 1904 CB SER A 483 16.525 -13.152 -1.219 1.00 0.00 C ATOM 1905 OG SER A 483 16.287 -14.472 -0.751 1.00 0.00 O ATOM 0 H SER A 483 14.058 -13.166 -1.640 1.00 0.00 H new ATOM 0 HA SER A 483 15.731 -12.260 0.569 1.00 0.00 H new ATOM 0 HB2 SER A 483 16.372 -13.103 -2.297 1.00 0.00 H new ATOM 0 HB3 SER A 483 17.560 -12.868 -1.031 1.00 0.00 H new ATOM 0 HG SER A 483 16.892 -15.094 -1.206 1.00 0.00 H new ATOM 1911 N SER A 484 15.032 -10.237 -1.842 1.00 0.00 N ATOM 1912 CA SER A 484 15.243 -8.849 -2.341 1.00 0.00 C ATOM 1913 C SER A 484 14.702 -7.843 -1.321 1.00 0.00 C ATOM 1914 O SER A 484 15.112 -6.700 -1.291 1.00 0.00 O ATOM 1915 CB SER A 484 14.509 -8.669 -3.670 1.00 0.00 C ATOM 1916 OG SER A 484 15.002 -9.615 -4.611 1.00 0.00 O ATOM 0 H SER A 484 14.219 -10.717 -2.229 1.00 0.00 H new ATOM 0 HA SER A 484 16.310 -8.677 -2.485 1.00 0.00 H new ATOM 0 HB2 SER A 484 13.437 -8.805 -3.528 1.00 0.00 H new ATOM 0 HB3 SER A 484 14.655 -7.656 -4.045 1.00 0.00 H new ATOM 0 HG SER A 484 14.532 -9.503 -5.464 1.00 0.00 H new ATOM 1922 N TYR A 485 13.783 -8.257 -0.486 1.00 0.00 N ATOM 1923 CA TYR A 485 13.214 -7.325 0.531 1.00 0.00 C ATOM 1924 C TYR A 485 14.358 -6.540 1.199 1.00 0.00 C ATOM 1925 O TYR A 485 14.444 -5.334 1.090 1.00 0.00 O ATOM 1926 CB TYR A 485 12.398 -8.160 1.565 1.00 0.00 C ATOM 1927 CG TYR A 485 12.887 -7.948 2.989 1.00 0.00 C ATOM 1928 CD1 TYR A 485 12.783 -6.684 3.577 1.00 0.00 C ATOM 1929 CD2 TYR A 485 13.441 -9.013 3.714 1.00 0.00 C ATOM 1930 CE1 TYR A 485 13.230 -6.479 4.888 1.00 0.00 C ATOM 1931 CE2 TYR A 485 13.888 -8.809 5.026 1.00 0.00 C ATOM 1932 CZ TYR A 485 13.783 -7.542 5.612 1.00 0.00 C ATOM 1933 OH TYR A 485 14.225 -7.340 6.905 1.00 0.00 O ATOM 0 H TYR A 485 13.402 -9.203 -0.466 1.00 0.00 H new ATOM 0 HA TYR A 485 12.544 -6.600 0.068 1.00 0.00 H new ATOM 0 HB2 TYR A 485 11.345 -7.887 1.500 1.00 0.00 H new ATOM 0 HB3 TYR A 485 12.469 -9.218 1.312 1.00 0.00 H new ATOM 0 HD1 TYR A 485 12.357 -5.864 3.019 1.00 0.00 H new ATOM 0 HD2 TYR A 485 13.523 -9.990 3.261 1.00 0.00 H new ATOM 0 HE1 TYR A 485 13.148 -5.502 5.340 1.00 0.00 H new ATOM 0 HE2 TYR A 485 14.314 -9.629 5.585 1.00 0.00 H new ATOM 0 HH TYR A 485 15.202 -7.415 6.932 1.00 0.00 H new ATOM 1943 N ASN A 486 15.224 -7.219 1.895 1.00 0.00 N ATOM 1944 CA ASN A 486 16.348 -6.520 2.579 1.00 0.00 C ATOM 1945 C ASN A 486 17.071 -5.590 1.601 1.00 0.00 C ATOM 1946 O ASN A 486 17.519 -4.524 1.965 1.00 0.00 O ATOM 1947 CB ASN A 486 17.340 -7.557 3.105 1.00 0.00 C ATOM 1948 CG ASN A 486 16.739 -8.281 4.311 1.00 0.00 C ATOM 1949 OD1 ASN A 486 16.505 -7.613 5.407 1.00 0.00 O flip ATOM 1950 ND2 ASN A 486 16.478 -9.466 4.255 1.00 0.00 N flip ATOM 0 H ASN A 486 15.203 -8.231 2.021 1.00 0.00 H new ATOM 0 HA ASN A 486 15.947 -5.930 3.403 1.00 0.00 H new ATOM 0 HB2 ASN A 486 17.580 -8.275 2.321 1.00 0.00 H new ATOM 0 HB3 ASN A 486 18.273 -7.070 3.389 1.00 0.00 H new ATOM 0 HD21 ASN A 486 16.661 -9.989 3.398 1.00 0.00 H new ATOM 0 HD22 ASN A 486 16.076 -9.938 5.065 1.00 0.00 H new ATOM 1957 N LEU A 487 17.211 -5.988 0.372 1.00 0.00 N ATOM 1958 CA LEU A 487 17.931 -5.123 -0.605 1.00 0.00 C ATOM 1959 C LEU A 487 17.116 -3.856 -0.905 1.00 0.00 C ATOM 1960 O LEU A 487 17.627 -2.756 -0.860 1.00 0.00 O ATOM 1961 CB LEU A 487 18.163 -5.912 -1.905 1.00 0.00 C ATOM 1962 CG LEU A 487 19.324 -5.288 -2.711 1.00 0.00 C ATOM 1963 CD1 LEU A 487 20.667 -5.853 -2.229 1.00 0.00 C ATOM 1964 CD2 LEU A 487 19.155 -5.614 -4.199 1.00 0.00 C ATOM 0 H LEU A 487 16.861 -6.871 -0.001 1.00 0.00 H new ATOM 0 HA LEU A 487 18.889 -4.825 -0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 487 18.391 -6.952 -1.671 1.00 0.00 H new ATOM 0 HB3 LEU A 487 17.253 -5.912 -2.505 1.00 0.00 H new ATOM 0 HG LEU A 487 19.309 -4.208 -2.563 1.00 0.00 H new ATOM 0 HD11 LEU A 487 21.477 -5.406 -2.804 1.00 0.00 H new ATOM 0 HD12 LEU A 487 20.801 -5.621 -1.172 1.00 0.00 H new ATOM 0 HD13 LEU A 487 20.678 -6.934 -2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 487 19.976 -5.172 -4.764 1.00 0.00 H new ATOM 0 HD22 LEU A 487 19.160 -6.695 -4.337 1.00 0.00 H new ATOM 0 HD23 LEU A 487 18.209 -5.207 -4.555 1.00 0.00 H new ATOM 1976 N GLU A 488 15.862 -4.002 -1.231 1.00 0.00 N ATOM 1977 CA GLU A 488 15.028 -2.807 -1.561 1.00 0.00 C ATOM 1978 C GLU A 488 15.033 -1.787 -0.414 1.00 0.00 C ATOM 1979 O GLU A 488 15.187 -0.603 -0.637 1.00 0.00 O ATOM 1980 CB GLU A 488 13.591 -3.255 -1.838 1.00 0.00 C ATOM 1981 CG GLU A 488 13.581 -4.236 -3.012 1.00 0.00 C ATOM 1982 CD GLU A 488 12.211 -4.909 -3.108 1.00 0.00 C ATOM 1983 OE1 GLU A 488 11.533 -4.976 -2.095 1.00 0.00 O ATOM 1984 OE2 GLU A 488 11.862 -5.348 -4.192 1.00 0.00 O ATOM 0 H GLU A 488 15.376 -4.897 -1.284 1.00 0.00 H new ATOM 0 HA GLU A 488 15.451 -2.327 -2.443 1.00 0.00 H new ATOM 0 HB2 GLU A 488 13.169 -3.728 -0.951 1.00 0.00 H new ATOM 0 HB3 GLU A 488 12.967 -2.391 -2.067 1.00 0.00 H new ATOM 0 HG2 GLU A 488 13.805 -3.710 -3.940 1.00 0.00 H new ATOM 0 HG3 GLU A 488 14.358 -4.988 -2.877 1.00 0.00 H new ATOM 1991 N VAL A 489 14.855 -2.220 0.804 1.00 0.00 N ATOM 1992 CA VAL A 489 14.841 -1.243 1.936 1.00 0.00 C ATOM 1993 C VAL A 489 16.264 -0.756 2.200 1.00 0.00 C ATOM 1994 O VAL A 489 16.512 0.410 2.410 1.00 0.00 O ATOM 1995 CB VAL A 489 14.265 -1.911 3.195 1.00 0.00 C ATOM 1996 CG1 VAL A 489 13.052 -2.749 2.802 1.00 0.00 C ATOM 1997 CG2 VAL A 489 15.309 -2.828 3.846 1.00 0.00 C ATOM 0 H VAL A 489 14.720 -3.197 1.066 1.00 0.00 H new ATOM 0 HA VAL A 489 14.213 -0.391 1.676 1.00 0.00 H new ATOM 0 HB VAL A 489 13.982 -1.135 3.906 1.00 0.00 H new ATOM 0 HG11 VAL A 489 12.637 -3.227 3.689 1.00 0.00 H new ATOM 0 HG12 VAL A 489 12.297 -2.106 2.349 1.00 0.00 H new ATOM 0 HG13 VAL A 489 13.354 -3.513 2.086 1.00 0.00 H new ATOM 0 HG21 VAL A 489 14.882 -3.291 4.735 1.00 0.00 H new ATOM 0 HG22 VAL A 489 15.604 -3.603 3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 489 16.184 -2.242 4.127 1.00 0.00 H new ATOM 2007 N GLN A 490 17.197 -1.650 2.185 1.00 0.00 N ATOM 2008 CA GLN A 490 18.611 -1.252 2.428 1.00 0.00 C ATOM 2009 C GLN A 490 19.068 -0.303 1.318 1.00 0.00 C ATOM 2010 O GLN A 490 20.075 0.367 1.434 1.00 0.00 O ATOM 2011 CB GLN A 490 19.499 -2.501 2.423 1.00 0.00 C ATOM 2012 CG GLN A 490 19.177 -3.388 3.641 1.00 0.00 C ATOM 2013 CD GLN A 490 19.995 -2.940 4.854 1.00 0.00 C ATOM 2014 OE1 GLN A 490 20.340 -1.782 4.978 1.00 0.00 O ATOM 2015 NE2 GLN A 490 20.322 -3.820 5.759 1.00 0.00 N ATOM 0 H GLN A 490 17.048 -2.645 2.015 1.00 0.00 H new ATOM 0 HA GLN A 490 18.688 -0.752 3.393 1.00 0.00 H new ATOM 0 HB2 GLN A 490 19.342 -3.064 1.503 1.00 0.00 H new ATOM 0 HB3 GLN A 490 20.549 -2.210 2.444 1.00 0.00 H new ATOM 0 HG2 GLN A 490 18.113 -3.331 3.870 1.00 0.00 H new ATOM 0 HG3 GLN A 490 19.398 -4.430 3.409 1.00 0.00 H new ATOM 0 HE21 GLN A 490 20.032 -4.792 5.654 1.00 0.00 H new ATOM 0 HE22 GLN A 490 20.868 -3.536 6.572 1.00 0.00 H new ATOM 2024 N ASN A 491 18.352 -0.269 0.226 1.00 0.00 N ATOM 2025 CA ASN A 491 18.765 0.604 -0.916 1.00 0.00 C ATOM 2026 C ASN A 491 18.340 2.070 -0.710 1.00 0.00 C ATOM 2027 O ASN A 491 19.106 2.977 -0.970 1.00 0.00 O ATOM 2028 CB ASN A 491 18.126 0.074 -2.203 1.00 0.00 C ATOM 2029 CG ASN A 491 18.831 -1.213 -2.633 1.00 0.00 C ATOM 2030 OD1 ASN A 491 19.630 -1.814 -1.796 1.00 0.00 O flip ATOM 2031 ND2 ASN A 491 18.652 -1.677 -3.741 1.00 0.00 N flip ATOM 0 H ASN A 491 17.499 -0.807 0.073 1.00 0.00 H new ATOM 0 HA ASN A 491 19.853 0.579 -0.980 1.00 0.00 H new ATOM 0 HB2 ASN A 491 17.065 -0.117 -2.042 1.00 0.00 H new ATOM 0 HB3 ASN A 491 18.199 0.822 -2.992 1.00 0.00 H new ATOM 0 HD21 ASN A 491 18.027 -1.207 -4.396 1.00 0.00 H new ATOM 0 HD22 ASN A 491 19.127 -2.537 -4.017 1.00 0.00 H new ATOM 2038 N ILE A 492 17.128 2.324 -0.293 1.00 0.00 N ATOM 2039 CA ILE A 492 16.681 3.747 -0.137 1.00 0.00 C ATOM 2040 C ILE A 492 17.427 4.441 1.010 1.00 0.00 C ATOM 2041 O ILE A 492 18.149 5.388 0.785 1.00 0.00 O ATOM 2042 CB ILE A 492 15.151 3.784 0.117 1.00 0.00 C ATOM 2043 CG1 ILE A 492 14.673 2.369 0.457 1.00 0.00 C ATOM 2044 CG2 ILE A 492 14.410 4.274 -1.136 1.00 0.00 C ATOM 2045 CD1 ILE A 492 13.232 2.373 0.959 1.00 0.00 C ATOM 0 H ILE A 492 16.431 1.618 -0.055 1.00 0.00 H new ATOM 0 HA ILE A 492 16.911 4.285 -1.056 1.00 0.00 H new ATOM 0 HB ILE A 492 14.943 4.467 0.940 1.00 0.00 H new ATOM 0 HG12 ILE A 492 14.750 1.735 -0.426 1.00 0.00 H new ATOM 0 HG13 ILE A 492 15.323 1.937 1.217 1.00 0.00 H new ATOM 0 HG21 ILE A 492 13.338 4.294 -0.940 1.00 0.00 H new ATOM 0 HG22 ILE A 492 14.751 5.277 -1.391 1.00 0.00 H new ATOM 0 HG23 ILE A 492 14.615 3.599 -1.967 1.00 0.00 H new ATOM 0 HD11 ILE A 492 12.925 1.353 1.191 1.00 0.00 H new ATOM 0 HD12 ILE A 492 13.161 2.987 1.857 1.00 0.00 H new ATOM 0 HD13 ILE A 492 12.579 2.782 0.188 1.00 0.00 H new ATOM 2057 N LEU A 493 17.240 4.001 2.228 1.00 0.00 N ATOM 2058 CA LEU A 493 17.923 4.666 3.387 1.00 0.00 C ATOM 2059 C LEU A 493 19.374 4.994 3.018 1.00 0.00 C ATOM 2060 O LEU A 493 19.792 6.133 3.082 1.00 0.00 O ATOM 2061 CB LEU A 493 17.924 3.743 4.623 1.00 0.00 C ATOM 2062 CG LEU A 493 16.499 3.463 5.196 1.00 0.00 C ATOM 2063 CD1 LEU A 493 15.565 4.673 5.071 1.00 0.00 C ATOM 2064 CD2 LEU A 493 15.856 2.276 4.476 1.00 0.00 C ATOM 0 H LEU A 493 16.644 3.210 2.474 1.00 0.00 H new ATOM 0 HA LEU A 493 17.379 5.581 3.621 1.00 0.00 H new ATOM 0 HB2 LEU A 493 18.392 2.795 4.358 1.00 0.00 H new ATOM 0 HB3 LEU A 493 18.538 4.195 5.403 1.00 0.00 H new ATOM 0 HG LEU A 493 16.633 3.241 6.255 1.00 0.00 H new ATOM 0 HD11 LEU A 493 14.588 4.423 5.485 1.00 0.00 H new ATOM 0 HD12 LEU A 493 15.986 5.516 5.619 1.00 0.00 H new ATOM 0 HD13 LEU A 493 15.456 4.942 4.020 1.00 0.00 H new ATOM 0 HD21 LEU A 493 14.863 2.095 4.888 1.00 0.00 H new ATOM 0 HD22 LEU A 493 15.772 2.498 3.412 1.00 0.00 H new ATOM 0 HD23 LEU A 493 16.474 1.389 4.614 1.00 0.00 H new ATOM 2076 N SER A 494 20.143 4.019 2.625 1.00 0.00 N ATOM 2077 CA SER A 494 21.558 4.304 2.250 1.00 0.00 C ATOM 2078 C SER A 494 21.582 5.455 1.241 1.00 0.00 C ATOM 2079 O SER A 494 22.561 6.161 1.103 1.00 0.00 O ATOM 2080 CB SER A 494 22.181 3.058 1.620 1.00 0.00 C ATOM 2081 OG SER A 494 23.532 3.333 1.272 1.00 0.00 O ATOM 0 H SER A 494 19.857 3.043 2.547 1.00 0.00 H new ATOM 0 HA SER A 494 22.127 4.579 3.138 1.00 0.00 H new ATOM 0 HB2 SER A 494 22.136 2.222 2.318 1.00 0.00 H new ATOM 0 HB3 SER A 494 21.618 2.764 0.734 1.00 0.00 H new ATOM 0 HG SER A 494 23.935 2.536 0.869 1.00 0.00 H new