USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=43 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 383 LYS NZ :NH3+ -177:sc= -1.85 (180deg=-1.98) USER MOD Set 1.2: A 393 LYS NZ :NH3+ -160:sc= -0.0359 (180deg=-0.374) USER MOD Single : A 378 TYR OH : rot 180:sc= 0 USER MOD Single : A 380 LYS NZ :NH3+ -154:sc= -0.0684 (180deg=-0.486) USER MOD Single : A 385 LYS NZ :NH3+ -96:sc= -0.0392 (180deg=-0.693) USER MOD Single : A 386 LYS NZ :NH3+ -133:sc= 0.67 (180deg=-0.0501) USER MOD Single : A 388 THR OG1 : rot 180:sc= -0.765 USER MOD Single : A 390 LYS NZ :NH3+ 149:sc= -0.21 (180deg=-1.07) USER MOD Single : A 392 TYR OH : rot 180:sc= -0.222 USER MOD Single : A 394 GLN :FLIP amide:sc= -0.12 F(o=-1.3!,f=-0.12) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 397 CYS SG : rot -89:sc= 0.366 USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 400 LYS NZ :NH3+ 167:sc= -2.13 (180deg=-2.48) USER MOD Single : A 402 THR OG1 : rot 2:sc= 0.295! USER MOD Single : A 403 SER OG : rot 180:sc= 0 USER MOD Single : A 405 SER OG : rot 179:sc= -2.67 USER MOD Single : A 406 CYS SG : rot -59:sc= -0.0237 USER MOD Single : A 407 TYR OH : rot 180:sc= -0.0474 USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 419 HIS : no HD1:sc= -6.97! C(o=-7!,f=-15!) USER MOD Single : A 420 GLN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : A 421 MET CE :methyl 161:sc= -0.0283 (180deg=-0.523) USER MOD Single : A 422 ASN :FLIP amide:sc= 0.229 F(o=-1.6,f=0.23) USER MOD Single : A 426 CYS SG : rot 90:sc= -5.02! USER MOD Single : A 429 THR OG1 : rot 3:sc= 0.521 USER MOD Single : A 433 ASN : amide:sc= -0.52 K(o=-0.52,f=-3.3!) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 437 GLN :FLIP amide:sc= -0.542 F(o=-2,f=-0.54) USER MOD Single : A 438 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 440 ASN : amide:sc=-0.000452 K(o=-0.00045,f=-1.4) USER MOD Single : A 442 LYS NZ :NH3+ 163:sc= 0.00315 (180deg=-0.00732) USER MOD Single : A 451 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 452 ASN : amide:sc= -2.54! C(o=-2.5!,f=-2.1!) USER MOD Single : A 458 CYS SG : rot 180:sc= 0.205 USER MOD Single : A 460 ASN :FLIP amide:sc= -3.62! C(o=-13!,f=-3.6!) USER MOD Single : A 462 LYS NZ :NH3+ -165:sc= -0.234 (180deg=-0.956) USER MOD Single : A 463 GLN :FLIP amide:sc= 0.652 F(o=-3.2,f=0.65) USER MOD Single : A 464 TYR OH : rot 40:sc= -4.23! USER MOD Single : A 466 HIS : no HD1:sc= -0.0249 X(o=-0.025,f=-0.31) USER MOD Single : A 468 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 471 CYS SG : rot -47:sc= -2.52 USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 476 LYS NZ :NH3+ 165:sc= -1.09 (180deg=-1.73) USER MOD Single : A 478 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.0333) USER MOD Single : A 479 THR OG1 : rot -140:sc= 0.161 USER MOD Single : A 480 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0.00502 USER MOD Single : A 484 SER OG : rot -24:sc= 0.0349 USER MOD Single : A 485 TYR OH : rot 180:sc= 0 USER MOD Single : A 486 ASN : amide:sc= -4.3! C(o=-4.3!,f=-4.9!) USER MOD Single : A 490 GLN :FLIP amide:sc= -0.128 F(o=-2.3!,f=-0.13) USER MOD Single : A 491 ASN : amide:sc= -4.26! C(o=-4.3!,f=-5.3!) USER MOD Single : A 494 SER OG : rot 122:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 119 N ILE A 372 0.880 -15.601 6.585 1.00 0.00 N ATOM 120 CA ILE A 372 2.353 -15.782 6.451 1.00 0.00 C ATOM 121 C ILE A 372 3.027 -14.465 6.020 1.00 0.00 C ATOM 122 O ILE A 372 4.120 -14.166 6.458 1.00 0.00 O ATOM 123 CB ILE A 372 2.668 -16.884 5.416 1.00 0.00 C ATOM 124 CG1 ILE A 372 1.688 -18.074 5.559 1.00 0.00 C ATOM 125 CG2 ILE A 372 4.110 -17.373 5.600 1.00 0.00 C ATOM 126 CD1 ILE A 372 2.030 -18.923 6.791 1.00 0.00 C ATOM 0 HA ILE A 372 2.746 -16.079 7.424 1.00 0.00 H new ATOM 0 HB ILE A 372 2.551 -16.461 4.418 1.00 0.00 H new ATOM 0 HG12 ILE A 372 0.667 -17.701 5.642 1.00 0.00 H new ATOM 0 HG13 ILE A 372 1.729 -18.693 4.663 1.00 0.00 H new ATOM 0 HG21 ILE A 372 4.327 -18.150 4.867 1.00 0.00 H new ATOM 0 HG22 ILE A 372 4.798 -16.539 5.459 1.00 0.00 H new ATOM 0 HG23 ILE A 372 4.232 -17.777 6.605 1.00 0.00 H new ATOM 0 HD11 ILE A 372 1.327 -19.752 6.868 1.00 0.00 H new ATOM 0 HD12 ILE A 372 3.043 -19.314 6.694 1.00 0.00 H new ATOM 0 HD13 ILE A 372 1.964 -18.306 7.687 1.00 0.00 H new ATOM 138 N PRO A 373 2.407 -13.683 5.159 1.00 0.00 N ATOM 139 CA PRO A 373 2.976 -12.408 4.665 1.00 0.00 C ATOM 140 C PRO A 373 2.320 -11.189 5.325 1.00 0.00 C ATOM 141 O PRO A 373 1.824 -10.306 4.654 1.00 0.00 O ATOM 142 CB PRO A 373 2.581 -12.477 3.201 1.00 0.00 C ATOM 143 CG PRO A 373 1.184 -13.031 3.246 1.00 0.00 C ATOM 144 CD PRO A 373 1.092 -13.893 4.532 1.00 0.00 C ATOM 0 HA PRO A 373 4.042 -12.297 4.864 1.00 0.00 H new ATOM 0 HB2 PRO A 373 2.609 -11.494 2.730 1.00 0.00 H new ATOM 0 HB3 PRO A 373 3.252 -13.122 2.633 1.00 0.00 H new ATOM 0 HG2 PRO A 373 0.448 -12.227 3.265 1.00 0.00 H new ATOM 0 HG3 PRO A 373 0.977 -13.632 2.361 1.00 0.00 H new ATOM 0 HD2 PRO A 373 0.278 -13.567 5.180 1.00 0.00 H new ATOM 0 HD3 PRO A 373 0.916 -14.944 4.303 1.00 0.00 H new ATOM 152 N GLU A 374 2.284 -11.145 6.625 1.00 0.00 N ATOM 153 CA GLU A 374 1.627 -9.996 7.307 1.00 0.00 C ATOM 154 C GLU A 374 2.419 -8.700 7.077 1.00 0.00 C ATOM 155 O GLU A 374 3.574 -8.586 7.435 1.00 0.00 O ATOM 156 CB GLU A 374 1.508 -10.296 8.809 1.00 0.00 C ATOM 157 CG GLU A 374 2.847 -10.048 9.511 1.00 0.00 C ATOM 158 CD GLU A 374 2.852 -10.744 10.873 1.00 0.00 C ATOM 159 OE1 GLU A 374 1.784 -11.127 11.323 1.00 0.00 O ATOM 160 OE2 GLU A 374 3.922 -10.884 11.442 1.00 0.00 O ATOM 0 H GLU A 374 2.679 -11.852 7.245 1.00 0.00 H new ATOM 0 HA GLU A 374 0.631 -9.856 6.888 1.00 0.00 H new ATOM 0 HB2 GLU A 374 0.736 -9.667 9.252 1.00 0.00 H new ATOM 0 HB3 GLU A 374 1.199 -11.331 8.956 1.00 0.00 H new ATOM 0 HG2 GLU A 374 3.666 -10.424 8.897 1.00 0.00 H new ATOM 0 HG3 GLU A 374 3.009 -8.978 9.638 1.00 0.00 H new ATOM 167 N LEU A 375 1.785 -7.720 6.491 1.00 0.00 N ATOM 168 CA LEU A 375 2.455 -6.406 6.239 1.00 0.00 C ATOM 169 C LEU A 375 1.394 -5.317 6.336 1.00 0.00 C ATOM 170 O LEU A 375 0.488 -5.264 5.535 1.00 0.00 O ATOM 171 CB LEU A 375 3.091 -6.401 4.830 1.00 0.00 C ATOM 172 CG LEU A 375 3.683 -5.009 4.465 1.00 0.00 C ATOM 173 CD1 LEU A 375 2.584 -3.980 4.106 1.00 0.00 C ATOM 174 CD2 LEU A 375 4.523 -4.477 5.630 1.00 0.00 C ATOM 0 H LEU A 375 0.818 -7.773 6.171 1.00 0.00 H new ATOM 0 HA LEU A 375 3.244 -6.234 6.971 1.00 0.00 H new ATOM 0 HB2 LEU A 375 3.878 -7.153 4.785 1.00 0.00 H new ATOM 0 HB3 LEU A 375 2.340 -6.681 4.092 1.00 0.00 H new ATOM 0 HG LEU A 375 4.309 -5.145 3.583 1.00 0.00 H new ATOM 0 HD11 LEU A 375 3.047 -3.025 3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 375 2.015 -4.340 3.249 1.00 0.00 H new ATOM 0 HD13 LEU A 375 1.915 -3.850 4.957 1.00 0.00 H new ATOM 0 HD21 LEU A 375 4.934 -3.502 5.367 1.00 0.00 H new ATOM 0 HD22 LEU A 375 3.896 -4.379 6.516 1.00 0.00 H new ATOM 0 HD23 LEU A 375 5.338 -5.170 5.837 1.00 0.00 H new ATOM 186 N ALA A 376 1.485 -4.442 7.303 1.00 0.00 N ATOM 187 CA ALA A 376 0.453 -3.370 7.423 1.00 0.00 C ATOM 188 C ALA A 376 1.058 -2.108 8.042 1.00 0.00 C ATOM 189 O ALA A 376 2.010 -2.161 8.795 1.00 0.00 O ATOM 190 CB ALA A 376 -0.686 -3.877 8.306 1.00 0.00 C ATOM 0 H ALA A 376 2.221 -4.422 8.008 1.00 0.00 H new ATOM 0 HA ALA A 376 0.078 -3.122 6.430 1.00 0.00 H new ATOM 0 HB1 ALA A 376 -1.446 -3.101 8.401 1.00 0.00 H new ATOM 0 HB2 ALA A 376 -1.128 -4.765 7.855 1.00 0.00 H new ATOM 0 HB3 ALA A 376 -0.298 -4.127 9.293 1.00 0.00 H new ATOM 196 N ASP A 377 0.495 -0.974 7.727 1.00 0.00 N ATOM 197 CA ASP A 377 1.007 0.308 8.285 1.00 0.00 C ATOM 198 C ASP A 377 -0.043 1.398 8.072 1.00 0.00 C ATOM 199 O ASP A 377 -0.923 1.271 7.243 1.00 0.00 O ATOM 200 CB ASP A 377 2.296 0.702 7.562 1.00 0.00 C ATOM 201 CG ASP A 377 2.752 2.081 8.042 1.00 0.00 C ATOM 202 OD1 ASP A 377 2.300 3.063 7.476 1.00 0.00 O ATOM 203 OD2 ASP A 377 3.546 2.132 8.967 1.00 0.00 O ATOM 0 H ASP A 377 -0.305 -0.881 7.101 1.00 0.00 H new ATOM 0 HA ASP A 377 1.210 0.190 9.349 1.00 0.00 H new ATOM 0 HB2 ASP A 377 3.074 -0.037 7.755 1.00 0.00 H new ATOM 0 HB3 ASP A 377 2.131 0.717 6.485 1.00 0.00 H new ATOM 208 N TYR A 378 0.046 2.474 8.800 1.00 0.00 N ATOM 209 CA TYR A 378 -0.944 3.573 8.620 1.00 0.00 C ATOM 210 C TYR A 378 -0.588 4.329 7.339 1.00 0.00 C ATOM 211 O TYR A 378 0.562 4.630 7.089 1.00 0.00 O ATOM 212 CB TYR A 378 -0.901 4.517 9.834 1.00 0.00 C ATOM 213 CG TYR A 378 0.500 4.567 10.398 1.00 0.00 C ATOM 214 CD1 TYR A 378 0.947 3.555 11.256 1.00 0.00 C ATOM 215 CD2 TYR A 378 1.349 5.630 10.068 1.00 0.00 C ATOM 216 CE1 TYR A 378 2.244 3.605 11.781 1.00 0.00 C ATOM 217 CE2 TYR A 378 2.645 5.681 10.595 1.00 0.00 C ATOM 218 CZ TYR A 378 3.093 4.668 11.452 1.00 0.00 C ATOM 219 OH TYR A 378 4.370 4.718 11.971 1.00 0.00 O ATOM 0 H TYR A 378 0.759 2.641 9.510 1.00 0.00 H new ATOM 0 HA TYR A 378 -1.953 3.169 8.541 1.00 0.00 H new ATOM 0 HB2 TYR A 378 -1.220 5.517 9.539 1.00 0.00 H new ATOM 0 HB3 TYR A 378 -1.598 4.173 10.598 1.00 0.00 H new ATOM 0 HD1 TYR A 378 0.292 2.736 11.513 1.00 0.00 H new ATOM 0 HD2 TYR A 378 1.004 6.411 9.407 1.00 0.00 H new ATOM 0 HE1 TYR A 378 2.590 2.823 12.440 1.00 0.00 H new ATOM 0 HE2 TYR A 378 3.299 6.502 10.341 1.00 0.00 H new ATOM 0 HH TYR A 378 4.826 5.520 11.641 1.00 0.00 H new ATOM 229 N ILE A 379 -1.552 4.618 6.503 1.00 0.00 N ATOM 230 CA ILE A 379 -1.231 5.325 5.231 1.00 0.00 C ATOM 231 C ILE A 379 -2.447 6.128 4.755 1.00 0.00 C ATOM 232 O ILE A 379 -3.567 5.820 5.098 1.00 0.00 O ATOM 233 CB ILE A 379 -0.814 4.253 4.198 1.00 0.00 C ATOM 234 CG1 ILE A 379 0.280 4.806 3.276 1.00 0.00 C ATOM 235 CG2 ILE A 379 -2.007 3.804 3.343 1.00 0.00 C ATOM 236 CD1 ILE A 379 0.766 3.720 2.318 1.00 0.00 C ATOM 0 H ILE A 379 -2.538 4.397 6.645 1.00 0.00 H new ATOM 0 HA ILE A 379 -0.416 6.035 5.369 1.00 0.00 H new ATOM 0 HB ILE A 379 -0.437 3.393 4.751 1.00 0.00 H new ATOM 0 HG12 ILE A 379 -0.106 5.653 2.710 1.00 0.00 H new ATOM 0 HG13 ILE A 379 1.115 5.175 3.872 1.00 0.00 H new ATOM 0 HG21 ILE A 379 -1.679 3.050 2.627 1.00 0.00 H new ATOM 0 HG22 ILE A 379 -2.778 3.381 3.987 1.00 0.00 H new ATOM 0 HG23 ILE A 379 -2.413 4.661 2.806 1.00 0.00 H new ATOM 0 HD11 ILE A 379 1.542 4.127 1.670 1.00 0.00 H new ATOM 0 HD12 ILE A 379 1.172 2.885 2.890 1.00 0.00 H new ATOM 0 HD13 ILE A 379 -0.069 3.371 1.710 1.00 0.00 H new ATOM 248 N LYS A 380 -2.223 7.152 3.962 1.00 0.00 N ATOM 249 CA LYS A 380 -3.351 7.998 3.446 1.00 0.00 C ATOM 250 C LYS A 380 -3.345 7.958 1.910 1.00 0.00 C ATOM 251 O LYS A 380 -2.312 8.046 1.277 1.00 0.00 O ATOM 252 CB LYS A 380 -3.208 9.470 3.947 1.00 0.00 C ATOM 253 CG LYS A 380 -1.875 9.681 4.692 1.00 0.00 C ATOM 254 CD LYS A 380 -1.979 9.147 6.136 1.00 0.00 C ATOM 255 CE LYS A 380 -2.515 10.242 7.067 1.00 0.00 C ATOM 256 NZ LYS A 380 -1.478 11.299 7.229 1.00 0.00 N ATOM 0 H LYS A 380 -1.297 7.441 3.647 1.00 0.00 H new ATOM 0 HA LYS A 380 -4.296 7.604 3.820 1.00 0.00 H new ATOM 0 HB2 LYS A 380 -3.265 10.152 3.099 1.00 0.00 H new ATOM 0 HB3 LYS A 380 -4.039 9.714 4.609 1.00 0.00 H new ATOM 0 HG2 LYS A 380 -1.071 9.169 4.164 1.00 0.00 H new ATOM 0 HG3 LYS A 380 -1.622 10.741 4.706 1.00 0.00 H new ATOM 0 HD2 LYS A 380 -2.639 8.280 6.164 1.00 0.00 H new ATOM 0 HD3 LYS A 380 -1.000 8.814 6.480 1.00 0.00 H new ATOM 0 HE2 LYS A 380 -3.428 10.672 6.655 1.00 0.00 H new ATOM 0 HE3 LYS A 380 -2.773 9.817 8.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 380 -1.616 11.784 8.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 380 -0.533 10.865 7.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 380 -1.560 11.988 6.454 1.00 0.00 H new ATOM 270 N VAL A 381 -4.503 7.822 1.316 1.00 0.00 N ATOM 271 CA VAL A 381 -4.602 7.770 -0.176 1.00 0.00 C ATOM 272 C VAL A 381 -5.795 8.626 -0.630 1.00 0.00 C ATOM 273 O VAL A 381 -6.785 8.749 0.065 1.00 0.00 O ATOM 274 CB VAL A 381 -4.796 6.302 -0.598 1.00 0.00 C ATOM 275 CG1 VAL A 381 -5.684 5.592 0.433 1.00 0.00 C ATOM 276 CG2 VAL A 381 -5.443 6.221 -1.990 1.00 0.00 C ATOM 0 H VAL A 381 -5.394 7.744 1.806 1.00 0.00 H new ATOM 0 HA VAL A 381 -3.696 8.162 -0.639 1.00 0.00 H new ATOM 0 HB VAL A 381 -3.823 5.814 -0.643 1.00 0.00 H new ATOM 0 HG11 VAL A 381 -5.824 4.552 0.138 1.00 0.00 H new ATOM 0 HG12 VAL A 381 -5.207 5.630 1.412 1.00 0.00 H new ATOM 0 HG13 VAL A 381 -6.653 6.089 0.482 1.00 0.00 H new ATOM 0 HG21 VAL A 381 -5.572 5.176 -2.271 1.00 0.00 H new ATOM 0 HG22 VAL A 381 -6.415 6.714 -1.969 1.00 0.00 H new ATOM 0 HG23 VAL A 381 -4.801 6.716 -2.719 1.00 0.00 H new ATOM 286 N PHE A 382 -5.706 9.211 -1.795 1.00 0.00 N ATOM 287 CA PHE A 382 -6.828 10.053 -2.307 1.00 0.00 C ATOM 288 C PHE A 382 -6.796 10.051 -3.839 1.00 0.00 C ATOM 289 O PHE A 382 -5.783 10.349 -4.441 1.00 0.00 O ATOM 290 CB PHE A 382 -6.664 11.483 -1.788 1.00 0.00 C ATOM 291 CG PHE A 382 -5.408 12.091 -2.368 1.00 0.00 C ATOM 292 CD1 PHE A 382 -4.157 11.762 -1.829 1.00 0.00 C ATOM 293 CD2 PHE A 382 -5.494 12.983 -3.444 1.00 0.00 C ATOM 294 CE1 PHE A 382 -2.993 12.325 -2.367 1.00 0.00 C ATOM 295 CE2 PHE A 382 -4.330 13.546 -3.981 1.00 0.00 C ATOM 296 CZ PHE A 382 -3.080 13.217 -3.443 1.00 0.00 C ATOM 0 H PHE A 382 -4.901 9.142 -2.417 1.00 0.00 H new ATOM 0 HA PHE A 382 -7.781 9.652 -1.963 1.00 0.00 H new ATOM 0 HB2 PHE A 382 -7.531 12.083 -2.064 1.00 0.00 H new ATOM 0 HB3 PHE A 382 -6.611 11.482 -0.699 1.00 0.00 H new ATOM 0 HD1 PHE A 382 -4.091 11.074 -0.999 1.00 0.00 H new ATOM 0 HD2 PHE A 382 -6.458 13.237 -3.860 1.00 0.00 H new ATOM 0 HE1 PHE A 382 -2.029 12.071 -1.952 1.00 0.00 H new ATOM 0 HE2 PHE A 382 -4.396 14.234 -4.811 1.00 0.00 H new ATOM 0 HZ PHE A 382 -2.182 13.651 -3.858 1.00 0.00 H new ATOM 306 N LYS A 383 -7.890 9.703 -4.482 1.00 0.00 N ATOM 307 CA LYS A 383 -7.906 9.669 -5.980 1.00 0.00 C ATOM 308 C LYS A 383 -9.286 10.141 -6.497 1.00 0.00 C ATOM 309 O LYS A 383 -10.262 10.084 -5.776 1.00 0.00 O ATOM 310 CB LYS A 383 -7.616 8.225 -6.485 1.00 0.00 C ATOM 311 CG LYS A 383 -7.628 7.204 -5.335 1.00 0.00 C ATOM 312 CD LYS A 383 -9.068 6.970 -4.876 1.00 0.00 C ATOM 313 CE LYS A 383 -9.075 6.272 -3.516 1.00 0.00 C ATOM 314 NZ LYS A 383 -8.755 7.255 -2.440 1.00 0.00 N ATOM 0 H LYS A 383 -8.768 9.442 -4.034 1.00 0.00 H new ATOM 0 HA LYS A 383 -7.133 10.337 -6.360 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -8.362 7.944 -7.229 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -6.646 8.202 -6.982 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -7.183 6.265 -5.664 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -7.025 7.569 -4.504 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -9.596 7.921 -4.809 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -9.598 6.362 -5.609 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -10.051 5.824 -3.332 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -8.346 5.462 -3.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -8.711 6.765 -1.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -7.836 7.700 -2.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -9.494 7.986 -2.406 1.00 0.00 H new ATOM 328 N PRO A 384 -9.379 10.591 -7.741 1.00 0.00 N ATOM 329 CA PRO A 384 -10.657 11.052 -8.343 1.00 0.00 C ATOM 330 C PRO A 384 -11.285 9.967 -9.224 1.00 0.00 C ATOM 331 O PRO A 384 -11.857 10.246 -10.259 1.00 0.00 O ATOM 332 CB PRO A 384 -10.184 12.209 -9.206 1.00 0.00 C ATOM 333 CG PRO A 384 -8.891 11.710 -9.783 1.00 0.00 C ATOM 334 CD PRO A 384 -8.298 10.728 -8.741 1.00 0.00 C ATOM 0 HA PRO A 384 -11.418 11.308 -7.606 1.00 0.00 H new ATOM 0 HB2 PRO A 384 -10.906 12.449 -9.987 1.00 0.00 H new ATOM 0 HB3 PRO A 384 -10.038 13.115 -8.618 1.00 0.00 H new ATOM 0 HG2 PRO A 384 -9.059 11.210 -10.737 1.00 0.00 H new ATOM 0 HG3 PRO A 384 -8.206 12.536 -9.972 1.00 0.00 H new ATOM 0 HD2 PRO A 384 -8.045 9.769 -9.192 1.00 0.00 H new ATOM 0 HD3 PRO A 384 -7.385 11.121 -8.294 1.00 0.00 H new ATOM 342 N LYS A 385 -11.144 8.733 -8.830 1.00 0.00 N ATOM 343 CA LYS A 385 -11.676 7.601 -9.619 1.00 0.00 C ATOM 344 C LYS A 385 -13.027 7.937 -10.272 1.00 0.00 C ATOM 345 O LYS A 385 -13.089 8.255 -11.443 1.00 0.00 O ATOM 346 CB LYS A 385 -11.816 6.385 -8.683 1.00 0.00 C ATOM 347 CG LYS A 385 -12.112 6.842 -7.249 1.00 0.00 C ATOM 348 CD LYS A 385 -12.423 5.619 -6.384 1.00 0.00 C ATOM 349 CE LYS A 385 -12.710 6.053 -4.938 1.00 0.00 C ATOM 350 NZ LYS A 385 -14.171 6.306 -4.777 1.00 0.00 N ATOM 0 H LYS A 385 -10.668 8.461 -7.970 1.00 0.00 H new ATOM 0 HA LYS A 385 -10.984 7.380 -10.432 1.00 0.00 H new ATOM 0 HB2 LYS A 385 -12.617 5.737 -9.037 1.00 0.00 H new ATOM 0 HB3 LYS A 385 -10.898 5.797 -8.701 1.00 0.00 H new ATOM 0 HG2 LYS A 385 -11.256 7.381 -6.843 1.00 0.00 H new ATOM 0 HG3 LYS A 385 -12.956 7.532 -7.241 1.00 0.00 H new ATOM 0 HD2 LYS A 385 -13.283 5.087 -6.789 1.00 0.00 H new ATOM 0 HD3 LYS A 385 -11.581 4.927 -6.404 1.00 0.00 H new ATOM 0 HE2 LYS A 385 -12.385 5.279 -4.243 1.00 0.00 H new ATOM 0 HE3 LYS A 385 -12.145 6.954 -4.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 385 -14.362 7.321 -4.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 385 -14.698 5.769 -5.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 385 -14.473 6.004 -3.829 1.00 0.00 H new ATOM 364 N LYS A 386 -14.110 7.809 -9.547 1.00 0.00 N ATOM 365 CA LYS A 386 -15.465 8.056 -10.154 1.00 0.00 C ATOM 366 C LYS A 386 -16.056 9.403 -9.736 1.00 0.00 C ATOM 367 O LYS A 386 -16.011 10.373 -10.466 1.00 0.00 O ATOM 368 CB LYS A 386 -16.413 6.951 -9.670 1.00 0.00 C ATOM 369 CG LYS A 386 -15.838 5.577 -10.042 1.00 0.00 C ATOM 370 CD LYS A 386 -16.463 4.448 -9.180 1.00 0.00 C ATOM 371 CE LYS A 386 -15.416 3.360 -8.893 1.00 0.00 C ATOM 372 NZ LYS A 386 -15.046 2.674 -10.167 1.00 0.00 N ATOM 0 H LYS A 386 -14.120 7.545 -8.562 1.00 0.00 H new ATOM 0 HA LYS A 386 -15.351 8.060 -11.238 1.00 0.00 H new ATOM 0 HB2 LYS A 386 -16.546 7.020 -8.590 1.00 0.00 H new ATOM 0 HB3 LYS A 386 -17.397 7.079 -10.122 1.00 0.00 H new ATOM 0 HG2 LYS A 386 -16.025 5.377 -11.097 1.00 0.00 H new ATOM 0 HG3 LYS A 386 -14.757 5.585 -9.905 1.00 0.00 H new ATOM 0 HD2 LYS A 386 -16.836 4.860 -8.243 1.00 0.00 H new ATOM 0 HD3 LYS A 386 -17.317 4.014 -9.700 1.00 0.00 H new ATOM 0 HE2 LYS A 386 -14.531 3.804 -8.437 1.00 0.00 H new ATOM 0 HE3 LYS A 386 -15.814 2.637 -8.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 386 -15.060 1.644 -10.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 386 -15.728 2.930 -10.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 386 -14.092 2.970 -10.456 1.00 0.00 H new ATOM 386 N LEU A 387 -16.648 9.444 -8.573 1.00 0.00 N ATOM 387 CA LEU A 387 -17.309 10.702 -8.084 1.00 0.00 C ATOM 388 C LEU A 387 -16.406 11.415 -7.064 1.00 0.00 C ATOM 389 O LEU A 387 -16.561 12.592 -6.807 1.00 0.00 O ATOM 390 CB LEU A 387 -18.666 10.317 -7.432 1.00 0.00 C ATOM 391 CG LEU A 387 -19.820 11.156 -8.006 1.00 0.00 C ATOM 392 CD1 LEU A 387 -21.154 10.569 -7.540 1.00 0.00 C ATOM 393 CD2 LEU A 387 -19.702 12.600 -7.509 1.00 0.00 C ATOM 0 H LEU A 387 -16.706 8.654 -7.930 1.00 0.00 H new ATOM 0 HA LEU A 387 -17.478 11.385 -8.917 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -18.865 9.258 -7.599 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -18.608 10.464 -6.353 1.00 0.00 H new ATOM 0 HG LEU A 387 -19.772 11.141 -9.095 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -21.974 11.162 -7.945 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -21.242 9.541 -7.891 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -21.198 10.586 -6.451 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -20.521 13.193 -7.917 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -19.750 12.615 -6.420 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -18.751 13.021 -7.836 1.00 0.00 H new ATOM 405 N THR A 388 -15.473 10.713 -6.482 1.00 0.00 N ATOM 406 CA THR A 388 -14.565 11.350 -5.481 1.00 0.00 C ATOM 407 C THR A 388 -15.371 11.835 -4.270 1.00 0.00 C ATOM 408 O THR A 388 -15.800 12.971 -4.217 1.00 0.00 O ATOM 409 CB THR A 388 -13.843 12.543 -6.124 1.00 0.00 C ATOM 410 OG1 THR A 388 -13.502 12.219 -7.463 1.00 0.00 O ATOM 411 CG2 THR A 388 -12.573 12.863 -5.332 1.00 0.00 C ATOM 0 H THR A 388 -15.298 9.723 -6.656 1.00 0.00 H new ATOM 0 HA THR A 388 -13.833 10.613 -5.151 1.00 0.00 H new ATOM 0 HB THR A 388 -14.499 13.414 -6.116 1.00 0.00 H new ATOM 0 HG1 THR A 388 -13.042 12.979 -7.877 1.00 0.00 H new ATOM 0 HG21 THR A 388 -12.062 13.710 -5.790 1.00 0.00 H new ATOM 0 HG22 THR A 388 -12.838 13.112 -4.304 1.00 0.00 H new ATOM 0 HG23 THR A 388 -11.913 11.996 -5.337 1.00 0.00 H new ATOM 419 N LEU A 389 -15.566 10.985 -3.291 1.00 0.00 N ATOM 420 CA LEU A 389 -16.332 11.386 -2.064 1.00 0.00 C ATOM 421 C LEU A 389 -15.332 11.601 -0.910 1.00 0.00 C ATOM 422 O LEU A 389 -14.814 12.685 -0.730 1.00 0.00 O ATOM 423 CB LEU A 389 -17.391 10.306 -1.699 1.00 0.00 C ATOM 424 CG LEU A 389 -17.257 9.038 -2.580 1.00 0.00 C ATOM 425 CD1 LEU A 389 -17.471 9.381 -4.078 1.00 0.00 C ATOM 426 CD2 LEU A 389 -15.883 8.351 -2.352 1.00 0.00 C ATOM 0 H LEU A 389 -15.226 10.023 -3.287 1.00 0.00 H new ATOM 0 HA LEU A 389 -16.872 12.314 -2.251 1.00 0.00 H new ATOM 0 HB2 LEU A 389 -17.282 10.031 -0.650 1.00 0.00 H new ATOM 0 HB3 LEU A 389 -18.391 10.725 -1.816 1.00 0.00 H new ATOM 0 HG LEU A 389 -18.035 8.334 -2.285 1.00 0.00 H new ATOM 0 HD11 LEU A 389 -17.372 8.475 -4.676 1.00 0.00 H new ATOM 0 HD12 LEU A 389 -18.468 9.800 -4.216 1.00 0.00 H new ATOM 0 HD13 LEU A 389 -16.724 10.109 -4.395 1.00 0.00 H new ATOM 0 HD21 LEU A 389 -15.811 7.463 -2.981 1.00 0.00 H new ATOM 0 HD22 LEU A 389 -15.082 9.044 -2.610 1.00 0.00 H new ATOM 0 HD23 LEU A 389 -15.790 8.063 -1.305 1.00 0.00 H new ATOM 438 N LYS A 390 -15.050 10.585 -0.139 1.00 0.00 N ATOM 439 CA LYS A 390 -14.076 10.747 0.981 1.00 0.00 C ATOM 440 C LYS A 390 -12.683 10.997 0.384 1.00 0.00 C ATOM 441 O LYS A 390 -12.122 12.065 0.525 1.00 0.00 O ATOM 442 CB LYS A 390 -14.065 9.476 1.879 1.00 0.00 C ATOM 443 CG LYS A 390 -14.936 8.373 1.257 1.00 0.00 C ATOM 444 CD LYS A 390 -14.823 7.075 2.081 1.00 0.00 C ATOM 445 CE LYS A 390 -15.814 7.104 3.250 1.00 0.00 C ATOM 446 NZ LYS A 390 -17.206 7.153 2.720 1.00 0.00 N ATOM 0 H LYS A 390 -15.450 9.652 -0.235 1.00 0.00 H new ATOM 0 HA LYS A 390 -14.366 11.593 1.604 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -13.043 9.117 1.999 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -14.435 9.723 2.874 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -15.976 8.699 1.219 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -14.622 8.188 0.230 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -15.024 6.213 1.445 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -13.807 6.962 2.459 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -15.682 6.220 3.875 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -15.623 7.972 3.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -17.846 6.667 3.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -17.503 8.144 2.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -17.241 6.682 1.793 1.00 0.00 H new ATOM 460 N GLY A 391 -12.122 10.023 -0.284 1.00 0.00 N ATOM 461 CA GLY A 391 -10.771 10.218 -0.887 1.00 0.00 C ATOM 462 C GLY A 391 -9.745 10.464 0.222 1.00 0.00 C ATOM 463 O GLY A 391 -8.944 9.608 0.540 1.00 0.00 O ATOM 0 H GLY A 391 -12.539 9.105 -0.437 1.00 0.00 H new ATOM 0 HA2 GLY A 391 -10.490 9.339 -1.468 1.00 0.00 H new ATOM 0 HA3 GLY A 391 -10.787 11.063 -1.575 1.00 0.00 H new ATOM 467 N TYR A 392 -9.764 11.627 0.815 1.00 0.00 N ATOM 468 CA TYR A 392 -8.791 11.926 1.904 1.00 0.00 C ATOM 469 C TYR A 392 -9.140 11.077 3.130 1.00 0.00 C ATOM 470 O TYR A 392 -10.058 11.376 3.869 1.00 0.00 O ATOM 471 CB TYR A 392 -8.862 13.430 2.258 1.00 0.00 C ATOM 472 CG TYR A 392 -7.683 14.179 1.660 1.00 0.00 C ATOM 473 CD1 TYR A 392 -7.535 14.255 0.269 1.00 0.00 C ATOM 474 CD2 TYR A 392 -6.741 14.793 2.497 1.00 0.00 C ATOM 475 CE1 TYR A 392 -6.448 14.944 -0.283 1.00 0.00 C ATOM 476 CE2 TYR A 392 -5.655 15.482 1.945 1.00 0.00 C ATOM 477 CZ TYR A 392 -5.509 15.557 0.556 1.00 0.00 C ATOM 478 OH TYR A 392 -4.436 16.233 0.012 1.00 0.00 O ATOM 0 H TYR A 392 -10.411 12.383 0.592 1.00 0.00 H new ATOM 0 HA TYR A 392 -7.779 11.688 1.577 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -9.795 13.853 1.885 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -8.866 13.554 3.341 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -8.259 13.782 -0.378 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -6.853 14.734 3.570 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -6.334 15.003 -1.355 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -4.930 15.955 2.591 1.00 0.00 H new ATOM 0 HH TYR A 392 -3.881 16.600 0.732 1.00 0.00 H new ATOM 488 N LYS A 393 -8.405 10.027 3.352 1.00 0.00 N ATOM 489 CA LYS A 393 -8.673 9.158 4.528 1.00 0.00 C ATOM 490 C LYS A 393 -7.398 8.420 4.917 1.00 0.00 C ATOM 491 O LYS A 393 -6.375 8.540 4.277 1.00 0.00 O ATOM 492 CB LYS A 393 -9.751 8.127 4.182 1.00 0.00 C ATOM 493 CG LYS A 393 -9.289 7.248 3.013 1.00 0.00 C ATOM 494 CD LYS A 393 -10.320 6.146 2.769 1.00 0.00 C ATOM 495 CE LYS A 393 -10.062 5.502 1.406 1.00 0.00 C ATOM 496 NZ LYS A 393 -10.480 6.442 0.328 1.00 0.00 N ATOM 0 H LYS A 393 -7.625 9.731 2.765 1.00 0.00 H new ATOM 0 HA LYS A 393 -9.013 9.781 5.356 1.00 0.00 H new ATOM 0 HB2 LYS A 393 -9.962 7.506 5.052 1.00 0.00 H new ATOM 0 HB3 LYS A 393 -10.679 8.635 3.920 1.00 0.00 H new ATOM 0 HG2 LYS A 393 -9.167 7.853 2.114 1.00 0.00 H new ATOM 0 HG3 LYS A 393 -8.317 6.809 3.236 1.00 0.00 H new ATOM 0 HD2 LYS A 393 -10.259 5.394 3.556 1.00 0.00 H new ATOM 0 HD3 LYS A 393 -11.327 6.561 2.803 1.00 0.00 H new ATOM 0 HE2 LYS A 393 -9.005 5.258 1.301 1.00 0.00 H new ATOM 0 HE3 LYS A 393 -10.615 4.567 1.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 393 -10.630 5.913 -0.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 393 -11.365 6.914 0.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 393 -9.737 7.155 0.182 1.00 0.00 H new ATOM 510 N GLN A 394 -7.474 7.634 5.954 1.00 0.00 N ATOM 511 CA GLN A 394 -6.296 6.836 6.409 1.00 0.00 C ATOM 512 C GLN A 394 -6.707 5.367 6.508 1.00 0.00 C ATOM 513 O GLN A 394 -7.583 5.028 7.280 1.00 0.00 O ATOM 514 CB GLN A 394 -5.850 7.326 7.787 1.00 0.00 C ATOM 515 CG GLN A 394 -5.800 8.853 7.790 1.00 0.00 C ATOM 516 CD GLN A 394 -5.269 9.346 9.138 1.00 0.00 C ATOM 517 OE1 GLN A 394 -4.502 8.567 9.850 1.00 0.00 O flip ATOM 518 NE2 GLN A 394 -5.557 10.453 9.549 1.00 0.00 N flip ATOM 0 H GLN A 394 -8.316 7.507 6.516 1.00 0.00 H new ATOM 0 HA GLN A 394 -5.476 6.950 5.700 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -6.541 6.972 8.552 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -4.869 6.918 8.030 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -5.159 9.208 6.983 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -6.795 9.260 7.609 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -6.157 11.063 8.993 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -5.199 10.772 10.449 1.00 0.00 H new ATOM 527 N TYR A 395 -6.096 4.484 5.746 1.00 0.00 N ATOM 528 CA TYR A 395 -6.482 3.035 5.828 1.00 0.00 C ATOM 529 C TYR A 395 -5.231 2.158 5.920 1.00 0.00 C ATOM 530 O TYR A 395 -4.252 2.374 5.242 1.00 0.00 O ATOM 531 CB TYR A 395 -7.344 2.653 4.603 1.00 0.00 C ATOM 532 CG TYR A 395 -6.478 2.222 3.432 1.00 0.00 C ATOM 533 CD1 TYR A 395 -5.456 3.060 2.970 1.00 0.00 C ATOM 534 CD2 TYR A 395 -6.701 0.984 2.811 1.00 0.00 C ATOM 535 CE1 TYR A 395 -4.660 2.662 1.889 1.00 0.00 C ATOM 536 CE2 TYR A 395 -5.903 0.587 1.731 1.00 0.00 C ATOM 537 CZ TYR A 395 -4.883 1.426 1.271 1.00 0.00 C ATOM 538 OH TYR A 395 -4.096 1.034 0.207 1.00 0.00 O ATOM 0 H TYR A 395 -5.356 4.701 5.079 1.00 0.00 H new ATOM 0 HA TYR A 395 -7.073 2.869 6.729 1.00 0.00 H new ATOM 0 HB2 TYR A 395 -8.024 1.845 4.872 1.00 0.00 H new ATOM 0 HB3 TYR A 395 -7.960 3.503 4.309 1.00 0.00 H new ATOM 0 HD1 TYR A 395 -5.282 4.013 3.447 1.00 0.00 H new ATOM 0 HD2 TYR A 395 -7.489 0.336 3.166 1.00 0.00 H new ATOM 0 HE1 TYR A 395 -3.873 3.309 1.532 1.00 0.00 H new ATOM 0 HE2 TYR A 395 -6.075 -0.366 1.254 1.00 0.00 H new ATOM 0 HH TYR A 395 -4.383 0.150 -0.104 1.00 0.00 H new ATOM 548 N TRP A 396 -5.271 1.170 6.775 1.00 0.00 N ATOM 549 CA TRP A 396 -4.104 0.253 6.956 1.00 0.00 C ATOM 550 C TRP A 396 -4.467 -1.149 6.460 1.00 0.00 C ATOM 551 O TRP A 396 -5.205 -1.872 7.101 1.00 0.00 O ATOM 552 CB TRP A 396 -3.759 0.179 8.443 1.00 0.00 C ATOM 553 CG TRP A 396 -5.003 -0.076 9.239 1.00 0.00 C ATOM 554 CD1 TRP A 396 -6.032 0.797 9.387 1.00 0.00 C ATOM 555 CD2 TRP A 396 -5.367 -1.265 10.002 1.00 0.00 C ATOM 556 NE1 TRP A 396 -6.998 0.218 10.191 1.00 0.00 N ATOM 557 CE2 TRP A 396 -6.634 -1.051 10.594 1.00 0.00 C ATOM 558 CE3 TRP A 396 -4.727 -2.496 10.234 1.00 0.00 C ATOM 559 CZ2 TRP A 396 -7.244 -2.022 11.391 1.00 0.00 C ATOM 560 CZ3 TRP A 396 -5.339 -3.476 11.035 1.00 0.00 C ATOM 561 CH2 TRP A 396 -6.595 -3.238 11.611 1.00 0.00 C ATOM 0 H TRP A 396 -6.075 0.956 7.365 1.00 0.00 H new ATOM 0 HA TRP A 396 -3.253 0.630 6.389 1.00 0.00 H new ATOM 0 HB2 TRP A 396 -3.034 -0.616 8.619 1.00 0.00 H new ATOM 0 HB3 TRP A 396 -3.294 1.111 8.765 1.00 0.00 H new ATOM 0 HD1 TRP A 396 -6.088 1.783 8.949 1.00 0.00 H new ATOM 0 HE1 TRP A 396 -7.872 0.673 10.454 1.00 0.00 H new ATOM 0 HE3 TRP A 396 -3.760 -2.689 9.794 1.00 0.00 H new ATOM 0 HZ2 TRP A 396 -8.211 -1.833 11.834 1.00 0.00 H new ATOM 0 HZ3 TRP A 396 -4.839 -4.418 11.208 1.00 0.00 H new ATOM 0 HH2 TRP A 396 -7.060 -3.995 12.225 1.00 0.00 H new ATOM 572 N CYS A 397 -3.951 -1.543 5.327 1.00 0.00 N ATOM 573 CA CYS A 397 -4.258 -2.899 4.788 1.00 0.00 C ATOM 574 C CYS A 397 -3.227 -3.902 5.312 1.00 0.00 C ATOM 575 O CYS A 397 -2.118 -3.540 5.650 1.00 0.00 O ATOM 576 CB CYS A 397 -4.190 -2.858 3.261 1.00 0.00 C ATOM 577 SG CYS A 397 -2.466 -2.664 2.740 1.00 0.00 S ATOM 0 H CYS A 397 -3.327 -0.981 4.749 1.00 0.00 H new ATOM 0 HA CYS A 397 -5.255 -3.202 5.106 1.00 0.00 H new ATOM 0 HB2 CYS A 397 -4.607 -3.774 2.843 1.00 0.00 H new ATOM 0 HB3 CYS A 397 -4.791 -2.032 2.881 1.00 0.00 H new ATOM 0 HG CYS A 397 -2.179 -1.399 2.653 1.00 0.00 H new ATOM 583 N THR A 398 -3.583 -5.163 5.369 1.00 0.00 N ATOM 584 CA THR A 398 -2.629 -6.213 5.859 1.00 0.00 C ATOM 585 C THR A 398 -2.523 -7.311 4.804 1.00 0.00 C ATOM 586 O THR A 398 -3.516 -7.731 4.243 1.00 0.00 O ATOM 587 CB THR A 398 -3.146 -6.813 7.168 1.00 0.00 C ATOM 588 OG1 THR A 398 -2.399 -7.982 7.477 1.00 0.00 O ATOM 589 CG2 THR A 398 -4.623 -7.174 7.024 1.00 0.00 C ATOM 0 H THR A 398 -4.501 -5.514 5.095 1.00 0.00 H new ATOM 0 HA THR A 398 -1.650 -5.767 6.034 1.00 0.00 H new ATOM 0 HB THR A 398 -3.033 -6.083 7.970 1.00 0.00 H new ATOM 0 HG1 THR A 398 -2.727 -8.368 8.316 1.00 0.00 H new ATOM 0 HG21 THR A 398 -4.986 -7.601 7.959 1.00 0.00 H new ATOM 0 HG22 THR A 398 -5.195 -6.277 6.788 1.00 0.00 H new ATOM 0 HG23 THR A 398 -4.743 -7.902 6.222 1.00 0.00 H new ATOM 597 N PHE A 399 -1.334 -7.780 4.505 1.00 0.00 N ATOM 598 CA PHE A 399 -1.210 -8.848 3.457 1.00 0.00 C ATOM 599 C PHE A 399 -1.312 -10.238 4.098 1.00 0.00 C ATOM 600 O PHE A 399 -0.519 -10.608 4.941 1.00 0.00 O ATOM 601 CB PHE A 399 0.137 -8.705 2.727 1.00 0.00 C ATOM 602 CG PHE A 399 0.009 -7.670 1.626 1.00 0.00 C ATOM 603 CD1 PHE A 399 -0.220 -6.327 1.953 1.00 0.00 C ATOM 604 CD2 PHE A 399 0.109 -8.055 0.283 1.00 0.00 C ATOM 605 CE1 PHE A 399 -0.348 -5.372 0.937 1.00 0.00 C ATOM 606 CE2 PHE A 399 -0.021 -7.100 -0.731 1.00 0.00 C ATOM 607 CZ PHE A 399 -0.249 -5.758 -0.405 1.00 0.00 C ATOM 0 H PHE A 399 -0.458 -7.477 4.931 1.00 0.00 H new ATOM 0 HA PHE A 399 -2.023 -8.734 2.739 1.00 0.00 H new ATOM 0 HB2 PHE A 399 0.914 -8.408 3.431 1.00 0.00 H new ATOM 0 HB3 PHE A 399 0.438 -9.664 2.306 1.00 0.00 H new ATOM 0 HD1 PHE A 399 -0.298 -6.029 2.988 1.00 0.00 H new ATOM 0 HD2 PHE A 399 0.287 -9.090 0.030 1.00 0.00 H new ATOM 0 HE1 PHE A 399 -0.523 -4.337 1.189 1.00 0.00 H new ATOM 0 HE2 PHE A 399 0.055 -7.398 -1.766 1.00 0.00 H new ATOM 0 HZ PHE A 399 -0.348 -5.021 -1.188 1.00 0.00 H new ATOM 617 N LYS A 400 -2.291 -11.014 3.687 1.00 0.00 N ATOM 618 CA LYS A 400 -2.464 -12.391 4.249 1.00 0.00 C ATOM 619 C LYS A 400 -1.913 -13.428 3.268 1.00 0.00 C ATOM 620 O LYS A 400 -1.361 -13.093 2.241 1.00 0.00 O ATOM 621 CB LYS A 400 -3.949 -12.686 4.484 1.00 0.00 C ATOM 622 CG LYS A 400 -4.659 -11.439 5.007 1.00 0.00 C ATOM 623 CD LYS A 400 -6.132 -11.782 5.299 1.00 0.00 C ATOM 624 CE LYS A 400 -7.002 -10.534 5.136 1.00 0.00 C ATOM 625 NZ LYS A 400 -7.173 -10.239 3.685 1.00 0.00 N ATOM 0 H LYS A 400 -2.980 -10.749 2.983 1.00 0.00 H new ATOM 0 HA LYS A 400 -1.924 -12.445 5.194 1.00 0.00 H new ATOM 0 HB2 LYS A 400 -4.413 -13.015 3.554 1.00 0.00 H new ATOM 0 HB3 LYS A 400 -4.056 -13.501 5.199 1.00 0.00 H new ATOM 0 HG2 LYS A 400 -4.170 -11.080 5.913 1.00 0.00 H new ATOM 0 HG3 LYS A 400 -4.599 -10.636 4.272 1.00 0.00 H new ATOM 0 HD2 LYS A 400 -6.473 -12.564 4.621 1.00 0.00 H new ATOM 0 HD3 LYS A 400 -6.229 -12.173 6.312 1.00 0.00 H new ATOM 0 HE2 LYS A 400 -7.974 -10.690 5.604 1.00 0.00 H new ATOM 0 HE3 LYS A 400 -6.539 -9.685 5.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 -7.931 -9.537 3.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 -6.284 -9.861 3.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 -7.424 -11.113 3.180 1.00 0.00 H new ATOM 639 N ASP A 401 -2.087 -14.687 3.597 1.00 0.00 N ATOM 640 CA ASP A 401 -1.605 -15.813 2.727 1.00 0.00 C ATOM 641 C ASP A 401 -1.573 -15.403 1.253 1.00 0.00 C ATOM 642 O ASP A 401 -0.617 -15.659 0.549 1.00 0.00 O ATOM 643 CB ASP A 401 -2.559 -16.995 2.885 1.00 0.00 C ATOM 644 CG ASP A 401 -2.594 -17.437 4.349 1.00 0.00 C ATOM 645 OD1 ASP A 401 -2.541 -16.574 5.210 1.00 0.00 O ATOM 646 OD2 ASP A 401 -2.673 -18.631 4.585 1.00 0.00 O ATOM 0 H ASP A 401 -2.554 -14.990 4.452 1.00 0.00 H new ATOM 0 HA ASP A 401 -0.594 -16.079 3.034 1.00 0.00 H new ATOM 0 HB2 ASP A 401 -3.559 -16.714 2.556 1.00 0.00 H new ATOM 0 HB3 ASP A 401 -2.236 -17.822 2.253 1.00 0.00 H new ATOM 651 N THR A 402 -2.609 -14.772 0.783 1.00 0.00 N ATOM 652 CA THR A 402 -2.631 -14.353 -0.643 1.00 0.00 C ATOM 653 C THR A 402 -3.729 -13.311 -0.854 1.00 0.00 C ATOM 654 O THR A 402 -3.781 -12.654 -1.873 1.00 0.00 O ATOM 655 CB THR A 402 -2.914 -15.573 -1.522 1.00 0.00 C ATOM 656 OG1 THR A 402 -3.495 -15.146 -2.745 1.00 0.00 O ATOM 657 CG2 THR A 402 -3.879 -16.513 -0.797 1.00 0.00 C ATOM 0 H THR A 402 -3.440 -14.529 1.323 1.00 0.00 H new ATOM 0 HA THR A 402 -1.667 -13.922 -0.911 1.00 0.00 H new ATOM 0 HB THR A 402 -1.982 -16.100 -1.726 1.00 0.00 H new ATOM 0 HG1 THR A 402 -3.552 -14.168 -2.756 1.00 0.00 H new ATOM 0 HG21 THR A 402 -4.080 -17.382 -1.424 1.00 0.00 H new ATOM 0 HG22 THR A 402 -3.433 -16.839 0.143 1.00 0.00 H new ATOM 0 HG23 THR A 402 -4.813 -15.989 -0.593 1.00 0.00 H new ATOM 665 N SER A 403 -4.613 -13.162 0.101 1.00 0.00 N ATOM 666 CA SER A 403 -5.724 -12.164 -0.040 1.00 0.00 C ATOM 667 C SER A 403 -5.454 -10.949 0.850 1.00 0.00 C ATOM 668 O SER A 403 -5.114 -11.075 2.008 1.00 0.00 O ATOM 669 CB SER A 403 -7.038 -12.816 0.386 1.00 0.00 C ATOM 670 OG SER A 403 -7.267 -13.970 -0.413 1.00 0.00 O ATOM 0 H SER A 403 -4.615 -13.688 0.975 1.00 0.00 H new ATOM 0 HA SER A 403 -5.786 -11.840 -1.079 1.00 0.00 H new ATOM 0 HB2 SER A 403 -6.997 -13.091 1.440 1.00 0.00 H new ATOM 0 HB3 SER A 403 -7.861 -12.111 0.273 1.00 0.00 H new ATOM 0 HG SER A 403 -8.108 -14.393 -0.143 1.00 0.00 H new ATOM 676 N ILE A 404 -5.604 -9.767 0.308 1.00 0.00 N ATOM 677 CA ILE A 404 -5.359 -8.527 1.104 1.00 0.00 C ATOM 678 C ILE A 404 -6.693 -7.992 1.642 1.00 0.00 C ATOM 679 O ILE A 404 -7.700 -8.015 0.962 1.00 0.00 O ATOM 680 CB ILE A 404 -4.726 -7.461 0.198 1.00 0.00 C ATOM 681 CG1 ILE A 404 -3.311 -7.887 -0.220 1.00 0.00 C ATOM 682 CG2 ILE A 404 -4.642 -6.133 0.957 1.00 0.00 C ATOM 683 CD1 ILE A 404 -3.348 -9.198 -1.015 1.00 0.00 C ATOM 0 H ILE A 404 -5.888 -9.607 -0.659 1.00 0.00 H new ATOM 0 HA ILE A 404 -4.691 -8.756 1.935 1.00 0.00 H new ATOM 0 HB ILE A 404 -5.344 -7.346 -0.693 1.00 0.00 H new ATOM 0 HG12 ILE A 404 -2.854 -7.103 -0.824 1.00 0.00 H new ATOM 0 HG13 ILE A 404 -2.688 -8.011 0.665 1.00 0.00 H new ATOM 0 HG21 ILE A 404 -4.193 -5.375 0.315 1.00 0.00 H new ATOM 0 HG22 ILE A 404 -5.644 -5.816 1.247 1.00 0.00 H new ATOM 0 HG23 ILE A 404 -4.030 -6.262 1.849 1.00 0.00 H new ATOM 0 HD11 ILE A 404 -2.334 -9.479 -1.300 1.00 0.00 H new ATOM 0 HD12 ILE A 404 -3.783 -9.985 -0.399 1.00 0.00 H new ATOM 0 HD13 ILE A 404 -3.953 -9.063 -1.912 1.00 0.00 H new ATOM 695 N SER A 405 -6.697 -7.485 2.852 1.00 0.00 N ATOM 696 CA SER A 405 -7.951 -6.914 3.443 1.00 0.00 C ATOM 697 C SER A 405 -7.822 -5.392 3.459 1.00 0.00 C ATOM 698 O SER A 405 -6.766 -4.852 3.195 1.00 0.00 O ATOM 699 CB SER A 405 -8.137 -7.422 4.873 1.00 0.00 C ATOM 700 OG SER A 405 -6.893 -7.373 5.554 1.00 0.00 O ATOM 0 H SER A 405 -5.880 -7.442 3.460 1.00 0.00 H new ATOM 0 HA SER A 405 -8.812 -7.219 2.849 1.00 0.00 H new ATOM 0 HB2 SER A 405 -8.874 -6.812 5.395 1.00 0.00 H new ATOM 0 HB3 SER A 405 -8.518 -8.443 4.862 1.00 0.00 H new ATOM 0 HG SER A 405 -7.013 -7.681 6.476 1.00 0.00 H new ATOM 706 N CYS A 406 -8.887 -4.693 3.754 1.00 0.00 N ATOM 707 CA CYS A 406 -8.823 -3.198 3.772 1.00 0.00 C ATOM 708 C CYS A 406 -9.644 -2.654 4.947 1.00 0.00 C ATOM 709 O CYS A 406 -10.854 -2.570 4.881 1.00 0.00 O ATOM 710 CB CYS A 406 -9.403 -2.683 2.449 1.00 0.00 C ATOM 711 SG CYS A 406 -9.833 -0.929 2.593 1.00 0.00 S ATOM 0 H CYS A 406 -9.798 -5.090 3.983 1.00 0.00 H new ATOM 0 HA CYS A 406 -7.792 -2.865 3.889 1.00 0.00 H new ATOM 0 HB2 CYS A 406 -8.678 -2.822 1.647 1.00 0.00 H new ATOM 0 HB3 CYS A 406 -10.288 -3.261 2.182 1.00 0.00 H new ATOM 0 HG CYS A 406 -10.702 -0.772 3.547 1.00 0.00 H new ATOM 717 N TYR A 407 -8.986 -2.255 6.015 1.00 0.00 N ATOM 718 CA TYR A 407 -9.713 -1.686 7.199 1.00 0.00 C ATOM 719 C TYR A 407 -9.378 -0.198 7.297 1.00 0.00 C ATOM 720 O TYR A 407 -8.236 0.206 7.210 1.00 0.00 O ATOM 721 CB TYR A 407 -9.275 -2.428 8.485 1.00 0.00 C ATOM 722 CG TYR A 407 -10.317 -3.461 8.875 1.00 0.00 C ATOM 723 CD1 TYR A 407 -11.610 -3.048 9.218 1.00 0.00 C ATOM 724 CD2 TYR A 407 -9.991 -4.824 8.894 1.00 0.00 C ATOM 725 CE1 TYR A 407 -12.575 -3.994 9.579 1.00 0.00 C ATOM 726 CE2 TYR A 407 -10.958 -5.770 9.256 1.00 0.00 C ATOM 727 CZ TYR A 407 -12.250 -5.354 9.597 1.00 0.00 C ATOM 728 OH TYR A 407 -13.202 -6.286 9.955 1.00 0.00 O ATOM 0 H TYR A 407 -7.972 -2.300 6.117 1.00 0.00 H new ATOM 0 HA TYR A 407 -10.789 -1.812 7.083 1.00 0.00 H new ATOM 0 HB2 TYR A 407 -8.313 -2.914 8.323 1.00 0.00 H new ATOM 0 HB3 TYR A 407 -9.139 -1.714 9.297 1.00 0.00 H new ATOM 0 HD1 TYR A 407 -11.863 -1.998 9.204 1.00 0.00 H new ATOM 0 HD2 TYR A 407 -8.994 -5.145 8.630 1.00 0.00 H new ATOM 0 HE1 TYR A 407 -13.572 -3.674 9.844 1.00 0.00 H new ATOM 0 HE2 TYR A 407 -10.707 -6.820 9.272 1.00 0.00 H new ATOM 0 HH TYR A 407 -12.812 -7.184 9.914 1.00 0.00 H new ATOM 738 N LYS A 408 -10.384 0.617 7.439 1.00 0.00 N ATOM 739 CA LYS A 408 -10.177 2.091 7.503 1.00 0.00 C ATOM 740 C LYS A 408 -10.190 2.592 8.950 1.00 0.00 C ATOM 741 O LYS A 408 -9.537 3.562 9.278 1.00 0.00 O ATOM 742 CB LYS A 408 -11.284 2.748 6.681 1.00 0.00 C ATOM 743 CG LYS A 408 -11.511 1.900 5.415 1.00 0.00 C ATOM 744 CD LYS A 408 -12.202 2.727 4.338 1.00 0.00 C ATOM 745 CE LYS A 408 -13.613 3.114 4.788 1.00 0.00 C ATOM 746 NZ LYS A 408 -14.422 3.488 3.594 1.00 0.00 N ATOM 0 H LYS A 408 -11.357 0.320 7.515 1.00 0.00 H new ATOM 0 HA LYS A 408 -9.200 2.351 7.096 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -12.202 2.814 7.264 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -11.004 3.766 6.411 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.556 1.530 5.042 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -12.118 1.028 5.658 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -11.620 3.625 4.130 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -12.252 2.158 3.410 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -14.081 2.282 5.313 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -13.569 3.948 5.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -15.382 3.752 3.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -13.976 4.294 3.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -14.473 2.679 2.942 1.00 0.00 H new ATOM 760 N SER A 409 -10.918 1.951 9.823 1.00 0.00 N ATOM 761 CA SER A 409 -10.943 2.421 11.239 1.00 0.00 C ATOM 762 C SER A 409 -11.660 1.399 12.125 1.00 0.00 C ATOM 763 O SER A 409 -12.202 0.420 11.652 1.00 0.00 O ATOM 764 CB SER A 409 -11.674 3.765 11.318 1.00 0.00 C ATOM 765 OG SER A 409 -11.346 4.405 12.543 1.00 0.00 O ATOM 0 H SER A 409 -11.491 1.131 9.622 1.00 0.00 H new ATOM 0 HA SER A 409 -9.918 2.537 11.591 1.00 0.00 H new ATOM 0 HB2 SER A 409 -11.390 4.397 10.477 1.00 0.00 H new ATOM 0 HB3 SER A 409 -12.751 3.611 11.252 1.00 0.00 H new ATOM 0 HG SER A 409 -11.810 5.266 12.597 1.00 0.00 H new ATOM 866 N PRO A 417 -14.413 -5.516 5.969 1.00 0.00 N ATOM 867 CA PRO A 417 -13.537 -4.561 5.238 1.00 0.00 C ATOM 868 C PRO A 417 -14.237 -3.975 4.005 1.00 0.00 C ATOM 869 O PRO A 417 -14.960 -4.657 3.307 1.00 0.00 O ATOM 870 CB PRO A 417 -12.325 -5.410 4.835 1.00 0.00 C ATOM 871 CG PRO A 417 -12.239 -6.495 5.872 1.00 0.00 C ATOM 872 CD PRO A 417 -13.655 -6.689 6.448 1.00 0.00 C ATOM 0 HA PRO A 417 -13.267 -3.699 5.848 1.00 0.00 H new ATOM 0 HB2 PRO A 417 -12.453 -5.829 3.837 1.00 0.00 H new ATOM 0 HB3 PRO A 417 -11.414 -4.811 4.815 1.00 0.00 H new ATOM 0 HG2 PRO A 417 -11.873 -7.422 5.430 1.00 0.00 H new ATOM 0 HG3 PRO A 417 -11.538 -6.219 6.660 1.00 0.00 H new ATOM 0 HD2 PRO A 417 -14.102 -7.620 6.098 1.00 0.00 H new ATOM 0 HD3 PRO A 417 -13.638 -6.733 7.537 1.00 0.00 H new ATOM 880 N ALA A 418 -14.030 -2.716 3.736 1.00 0.00 N ATOM 881 CA ALA A 418 -14.685 -2.091 2.554 1.00 0.00 C ATOM 882 C ALA A 418 -14.353 -2.897 1.295 1.00 0.00 C ATOM 883 O ALA A 418 -15.091 -2.890 0.330 1.00 0.00 O ATOM 884 CB ALA A 418 -14.172 -0.659 2.389 1.00 0.00 C ATOM 0 H ALA A 418 -13.436 -2.093 4.283 1.00 0.00 H new ATOM 0 HA ALA A 418 -15.765 -2.080 2.702 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -14.650 -0.199 1.524 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -14.408 -0.083 3.284 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -13.092 -0.674 2.242 1.00 0.00 H new ATOM 890 N HIS A 419 -13.241 -3.582 1.294 1.00 0.00 N ATOM 891 CA HIS A 419 -12.853 -4.378 0.095 1.00 0.00 C ATOM 892 C HIS A 419 -11.864 -5.474 0.527 1.00 0.00 C ATOM 893 O HIS A 419 -11.102 -5.303 1.455 1.00 0.00 O ATOM 894 CB HIS A 419 -12.224 -3.413 -0.942 1.00 0.00 C ATOM 895 CG HIS A 419 -11.095 -4.067 -1.701 1.00 0.00 C ATOM 896 ND1 HIS A 419 -9.932 -4.490 -1.072 1.00 0.00 N ATOM 897 CD2 HIS A 419 -10.929 -4.357 -3.033 1.00 0.00 C ATOM 898 CE1 HIS A 419 -9.124 -5.005 -2.016 1.00 0.00 C ATOM 899 NE2 HIS A 419 -9.685 -4.947 -3.226 1.00 0.00 N ATOM 0 H HIS A 419 -12.584 -3.624 2.073 1.00 0.00 H new ATOM 0 HA HIS A 419 -13.716 -4.864 -0.360 1.00 0.00 H new ATOM 0 HB2 HIS A 419 -12.990 -3.083 -1.643 1.00 0.00 H new ATOM 0 HB3 HIS A 419 -11.853 -2.523 -0.433 1.00 0.00 H new ATOM 0 HD2 HIS A 419 -11.652 -4.158 -3.810 1.00 0.00 H new ATOM 0 HE1 HIS A 419 -8.144 -5.414 -1.820 1.00 0.00 H new ATOM 0 HE2 HIS A 419 -9.285 -5.268 -4.107 1.00 0.00 H new ATOM 908 N GLN A 420 -11.870 -6.598 -0.138 1.00 0.00 N ATOM 909 CA GLN A 420 -10.927 -7.690 0.242 1.00 0.00 C ATOM 910 C GLN A 420 -10.773 -8.668 -0.921 1.00 0.00 C ATOM 911 O GLN A 420 -11.703 -9.347 -1.308 1.00 0.00 O ATOM 912 CB GLN A 420 -11.454 -8.433 1.473 1.00 0.00 C ATOM 913 CG GLN A 420 -12.886 -8.935 1.225 1.00 0.00 C ATOM 914 CD GLN A 420 -13.580 -9.198 2.564 1.00 0.00 C ATOM 915 OE1 GLN A 420 -12.856 -9.434 3.623 1.00 0.00 O flip ATOM 916 NE2 GLN A 420 -14.792 -9.187 2.645 1.00 0.00 N flip ATOM 0 H GLN A 420 -12.484 -6.807 -0.925 1.00 0.00 H new ATOM 0 HA GLN A 420 -9.956 -7.254 0.477 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -10.802 -9.275 1.704 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -11.439 -7.771 2.339 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -13.447 -8.196 0.653 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -12.864 -9.848 0.630 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -15.357 -9.002 1.816 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -15.245 -9.362 3.542 1.00 0.00 H new ATOM 925 N MET A 421 -9.603 -8.738 -1.487 1.00 0.00 N ATOM 926 CA MET A 421 -9.387 -9.668 -2.633 1.00 0.00 C ATOM 927 C MET A 421 -7.881 -9.899 -2.842 1.00 0.00 C ATOM 928 O MET A 421 -7.052 -9.216 -2.275 1.00 0.00 O ATOM 929 CB MET A 421 -10.010 -9.057 -3.901 1.00 0.00 C ATOM 930 CG MET A 421 -9.932 -7.529 -3.829 1.00 0.00 C ATOM 931 SD MET A 421 -10.457 -6.815 -5.410 1.00 0.00 S ATOM 932 CE MET A 421 -12.224 -7.197 -5.281 1.00 0.00 C ATOM 0 H MET A 421 -8.787 -8.194 -1.208 1.00 0.00 H new ATOM 0 HA MET A 421 -9.860 -10.627 -2.422 1.00 0.00 H new ATOM 0 HB2 MET A 421 -9.484 -9.416 -4.786 1.00 0.00 H new ATOM 0 HB3 MET A 421 -11.049 -9.374 -3.997 1.00 0.00 H new ATOM 0 HG2 MET A 421 -10.567 -7.160 -3.024 1.00 0.00 H new ATOM 0 HG3 MET A 421 -8.913 -7.218 -3.599 1.00 0.00 H new ATOM 0 HE1 MET A 421 -12.784 -6.565 -5.970 1.00 0.00 H new ATOM 0 HE2 MET A 421 -12.389 -8.244 -5.534 1.00 0.00 H new ATOM 0 HE3 MET A 421 -12.563 -7.012 -4.262 1.00 0.00 H new ATOM 942 N ASN A 422 -7.527 -10.862 -3.658 1.00 0.00 N ATOM 943 CA ASN A 422 -6.083 -11.152 -3.918 1.00 0.00 C ATOM 944 C ASN A 422 -5.661 -10.485 -5.228 1.00 0.00 C ATOM 945 O ASN A 422 -5.857 -11.020 -6.301 1.00 0.00 O ATOM 946 CB ASN A 422 -5.892 -12.668 -4.034 1.00 0.00 C ATOM 947 CG ASN A 422 -7.084 -13.272 -4.778 1.00 0.00 C ATOM 948 OD1 ASN A 422 -7.822 -14.167 -4.183 1.00 0.00 O flip ATOM 949 ND2 ASN A 422 -7.346 -12.924 -5.912 1.00 0.00 N flip ATOM 0 H ASN A 422 -8.182 -11.463 -4.158 1.00 0.00 H new ATOM 0 HA ASN A 422 -5.474 -10.765 -3.101 1.00 0.00 H new ATOM 0 HB2 ASN A 422 -4.967 -12.890 -4.565 1.00 0.00 H new ATOM 0 HB3 ASN A 422 -5.805 -13.112 -3.042 1.00 0.00 H new ATOM 0 HD21 ASN A 422 -6.768 -12.224 -6.377 1.00 0.00 H new ATOM 0 HD22 ASN A 422 -8.144 -13.332 -6.399 1.00 0.00 H new ATOM 956 N LEU A 423 -5.079 -9.322 -5.150 1.00 0.00 N ATOM 957 CA LEU A 423 -4.642 -8.628 -6.390 1.00 0.00 C ATOM 958 C LEU A 423 -3.276 -9.176 -6.803 1.00 0.00 C ATOM 959 O LEU A 423 -3.103 -9.687 -7.891 1.00 0.00 O ATOM 960 CB LEU A 423 -4.514 -7.121 -6.125 1.00 0.00 C ATOM 961 CG LEU A 423 -5.842 -6.528 -5.611 1.00 0.00 C ATOM 962 CD1 LEU A 423 -6.986 -6.883 -6.571 1.00 0.00 C ATOM 963 CD2 LEU A 423 -6.165 -7.049 -4.191 1.00 0.00 C ATOM 0 H LEU A 423 -4.887 -8.823 -4.281 1.00 0.00 H new ATOM 0 HA LEU A 423 -5.374 -8.795 -7.180 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -3.726 -6.944 -5.393 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -4.217 -6.612 -7.042 1.00 0.00 H new ATOM 0 HG LEU A 423 -5.736 -5.444 -5.565 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -7.919 -6.459 -6.198 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -6.772 -6.475 -7.559 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -7.081 -7.967 -6.638 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -7.106 -6.617 -3.850 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -6.252 -8.135 -4.213 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -5.366 -6.762 -3.508 1.00 0.00 H new ATOM 975 N ARG A 424 -2.314 -9.086 -5.922 1.00 0.00 N ATOM 976 CA ARG A 424 -0.944 -9.601 -6.225 1.00 0.00 C ATOM 977 C ARG A 424 -0.407 -8.991 -7.530 1.00 0.00 C ATOM 978 O ARG A 424 -1.147 -8.603 -8.410 1.00 0.00 O ATOM 979 CB ARG A 424 -0.988 -11.127 -6.358 1.00 0.00 C ATOM 980 CG ARG A 424 0.438 -11.692 -6.324 1.00 0.00 C ATOM 981 CD ARG A 424 0.412 -13.205 -6.565 1.00 0.00 C ATOM 982 NE ARG A 424 1.761 -13.651 -7.022 1.00 0.00 N ATOM 983 CZ ARG A 424 1.978 -14.908 -7.302 1.00 0.00 C ATOM 984 NH1 ARG A 424 1.024 -15.787 -7.156 1.00 0.00 N ATOM 985 NH2 ARG A 424 3.154 -15.289 -7.722 1.00 0.00 N ATOM 0 H ARG A 424 -2.420 -8.673 -4.995 1.00 0.00 H new ATOM 0 HA ARG A 424 -0.280 -9.317 -5.408 1.00 0.00 H new ATOM 0 HB2 ARG A 424 -1.578 -11.555 -5.548 1.00 0.00 H new ATOM 0 HB3 ARG A 424 -1.478 -11.406 -7.291 1.00 0.00 H new ATOM 0 HG2 ARG A 424 1.048 -11.205 -7.085 1.00 0.00 H new ATOM 0 HG3 ARG A 424 0.899 -11.478 -5.360 1.00 0.00 H new ATOM 0 HD2 ARG A 424 0.134 -13.727 -5.649 1.00 0.00 H new ATOM 0 HD3 ARG A 424 -0.340 -13.453 -7.314 1.00 0.00 H new ATOM 0 HE ARG A 424 2.516 -12.972 -7.116 1.00 0.00 H new ATOM 0 HH11 ARG A 424 0.106 -15.493 -6.822 1.00 0.00 H new ATOM 0 HH12 ARG A 424 1.196 -16.768 -7.376 1.00 0.00 H new ATOM 0 HH21 ARG A 424 3.903 -14.605 -7.831 1.00 0.00 H new ATOM 0 HH22 ARG A 424 3.324 -16.271 -7.941 1.00 0.00 H new ATOM 999 N GLY A 425 0.887 -8.928 -7.660 1.00 0.00 N ATOM 1000 CA GLY A 425 1.502 -8.378 -8.903 1.00 0.00 C ATOM 1001 C GLY A 425 1.073 -6.928 -9.142 1.00 0.00 C ATOM 1002 O GLY A 425 0.483 -6.607 -10.154 1.00 0.00 O ATOM 0 H GLY A 425 1.553 -9.237 -6.952 1.00 0.00 H new ATOM 0 HA2 GLY A 425 2.588 -8.430 -8.828 1.00 0.00 H new ATOM 0 HA3 GLY A 425 1.212 -8.991 -9.757 1.00 0.00 H new ATOM 1006 N CYS A 426 1.383 -6.044 -8.235 1.00 0.00 N ATOM 1007 CA CYS A 426 1.015 -4.611 -8.429 1.00 0.00 C ATOM 1008 C CYS A 426 2.099 -3.928 -9.264 1.00 0.00 C ATOM 1009 O CYS A 426 3.162 -4.475 -9.481 1.00 0.00 O ATOM 1010 CB CYS A 426 0.913 -3.915 -7.069 1.00 0.00 C ATOM 1011 SG CYS A 426 2.566 -3.659 -6.376 1.00 0.00 S ATOM 0 H CYS A 426 1.876 -6.251 -7.366 1.00 0.00 H new ATOM 0 HA CYS A 426 0.054 -4.547 -8.940 1.00 0.00 H new ATOM 0 HB2 CYS A 426 0.404 -2.957 -7.179 1.00 0.00 H new ATOM 0 HB3 CYS A 426 0.314 -4.518 -6.387 1.00 0.00 H new ATOM 0 HG CYS A 426 3.026 -2.507 -6.765 1.00 0.00 H new ATOM 1017 N GLU A 427 1.844 -2.732 -9.726 1.00 0.00 N ATOM 1018 CA GLU A 427 2.868 -2.003 -10.540 1.00 0.00 C ATOM 1019 C GLU A 427 3.626 -1.037 -9.625 1.00 0.00 C ATOM 1020 O GLU A 427 3.072 -0.070 -9.141 1.00 0.00 O ATOM 1021 CB GLU A 427 2.168 -1.216 -11.659 1.00 0.00 C ATOM 1022 CG GLU A 427 3.186 -0.829 -12.738 1.00 0.00 C ATOM 1023 CD GLU A 427 2.457 -0.226 -13.940 1.00 0.00 C ATOM 1024 OE1 GLU A 427 1.960 -0.990 -14.751 1.00 0.00 O ATOM 1025 OE2 GLU A 427 2.411 0.990 -14.030 1.00 0.00 O ATOM 0 H GLU A 427 0.971 -2.226 -9.576 1.00 0.00 H new ATOM 0 HA GLU A 427 3.565 -2.712 -10.986 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.372 -1.819 -12.097 1.00 0.00 H new ATOM 0 HB3 GLU A 427 1.701 -0.321 -11.249 1.00 0.00 H new ATOM 0 HG2 GLU A 427 3.901 -0.111 -12.336 1.00 0.00 H new ATOM 0 HG3 GLU A 427 3.754 -1.706 -13.047 1.00 0.00 H new ATOM 1032 N VAL A 428 4.885 -1.296 -9.368 1.00 0.00 N ATOM 1033 CA VAL A 428 5.665 -0.392 -8.465 1.00 0.00 C ATOM 1034 C VAL A 428 6.372 0.692 -9.282 1.00 0.00 C ATOM 1035 O VAL A 428 7.024 0.420 -10.272 1.00 0.00 O ATOM 1036 CB VAL A 428 6.698 -1.214 -7.671 1.00 0.00 C ATOM 1037 CG1 VAL A 428 6.056 -2.518 -7.182 1.00 0.00 C ATOM 1038 CG2 VAL A 428 7.915 -1.546 -8.550 1.00 0.00 C ATOM 0 H VAL A 428 5.404 -2.090 -9.742 1.00 0.00 H new ATOM 0 HA VAL A 428 4.979 0.089 -7.768 1.00 0.00 H new ATOM 0 HB VAL A 428 7.029 -0.622 -6.817 1.00 0.00 H new ATOM 0 HG11 VAL A 428 6.790 -3.097 -6.621 1.00 0.00 H new ATOM 0 HG12 VAL A 428 5.207 -2.287 -6.538 1.00 0.00 H new ATOM 0 HG13 VAL A 428 5.714 -3.099 -8.039 1.00 0.00 H new ATOM 0 HG21 VAL A 428 8.634 -2.127 -7.972 1.00 0.00 H new ATOM 0 HG22 VAL A 428 7.592 -2.125 -9.415 1.00 0.00 H new ATOM 0 HG23 VAL A 428 8.383 -0.621 -8.887 1.00 0.00 H new ATOM 1048 N THR A 429 6.246 1.920 -8.863 1.00 0.00 N ATOM 1049 CA THR A 429 6.901 3.044 -9.591 1.00 0.00 C ATOM 1050 C THR A 429 7.127 4.215 -8.610 1.00 0.00 C ATOM 1051 O THR A 429 6.176 4.832 -8.172 1.00 0.00 O ATOM 1052 CB THR A 429 5.981 3.499 -10.726 1.00 0.00 C ATOM 1053 OG1 THR A 429 5.889 2.466 -11.697 1.00 0.00 O ATOM 1054 CG2 THR A 429 6.549 4.761 -11.375 1.00 0.00 C ATOM 0 H THR A 429 5.712 2.196 -8.039 1.00 0.00 H new ATOM 0 HA THR A 429 7.858 2.721 -10.000 1.00 0.00 H new ATOM 0 HB THR A 429 4.990 3.716 -10.326 1.00 0.00 H new ATOM 0 HG1 THR A 429 6.392 1.683 -11.390 1.00 0.00 H new ATOM 0 HG21 THR A 429 5.891 5.082 -12.183 1.00 0.00 H new ATOM 0 HG22 THR A 429 6.621 5.553 -10.629 1.00 0.00 H new ATOM 0 HG23 THR A 429 7.540 4.549 -11.776 1.00 0.00 H new ATOM 1062 N PRO A 430 8.358 4.522 -8.244 1.00 0.00 N ATOM 1063 CA PRO A 430 8.651 5.630 -7.283 1.00 0.00 C ATOM 1064 C PRO A 430 8.717 7.016 -7.942 1.00 0.00 C ATOM 1065 O PRO A 430 9.104 7.153 -9.086 1.00 0.00 O ATOM 1066 CB PRO A 430 10.018 5.233 -6.727 1.00 0.00 C ATOM 1067 CG PRO A 430 10.707 4.568 -7.877 1.00 0.00 C ATOM 1068 CD PRO A 430 9.606 3.861 -8.686 1.00 0.00 C ATOM 0 HA PRO A 430 7.866 5.734 -6.534 1.00 0.00 H new ATOM 0 HB2 PRO A 430 10.574 6.104 -6.380 1.00 0.00 H new ATOM 0 HB3 PRO A 430 9.921 4.557 -5.877 1.00 0.00 H new ATOM 0 HG2 PRO A 430 11.233 5.299 -8.491 1.00 0.00 H new ATOM 0 HG3 PRO A 430 11.451 3.853 -7.525 1.00 0.00 H new ATOM 0 HD2 PRO A 430 9.761 3.978 -9.759 1.00 0.00 H new ATOM 0 HD3 PRO A 430 9.585 2.791 -8.481 1.00 0.00 H new ATOM 1076 N ASP A 431 8.353 8.046 -7.214 1.00 0.00 N ATOM 1077 CA ASP A 431 8.404 9.424 -7.781 1.00 0.00 C ATOM 1078 C ASP A 431 8.370 10.444 -6.635 1.00 0.00 C ATOM 1079 O ASP A 431 7.316 10.877 -6.210 1.00 0.00 O ATOM 1080 CB ASP A 431 7.194 9.647 -8.694 1.00 0.00 C ATOM 1081 CG ASP A 431 7.400 8.905 -10.017 1.00 0.00 C ATOM 1082 OD1 ASP A 431 8.390 9.174 -10.676 1.00 0.00 O ATOM 1083 OD2 ASP A 431 6.561 8.084 -10.349 1.00 0.00 O ATOM 0 H ASP A 431 8.023 7.987 -6.251 1.00 0.00 H new ATOM 0 HA ASP A 431 9.321 9.548 -8.357 1.00 0.00 H new ATOM 0 HB2 ASP A 431 6.287 9.292 -8.205 1.00 0.00 H new ATOM 0 HB3 ASP A 431 7.059 10.712 -8.881 1.00 0.00 H new ATOM 1088 N VAL A 432 9.515 10.822 -6.116 1.00 0.00 N ATOM 1089 CA VAL A 432 9.551 11.801 -4.991 1.00 0.00 C ATOM 1090 C VAL A 432 10.709 12.789 -5.168 1.00 0.00 C ATOM 1091 O VAL A 432 11.771 12.454 -5.654 1.00 0.00 O ATOM 1092 CB VAL A 432 9.683 11.039 -3.653 1.00 0.00 C ATOM 1093 CG1 VAL A 432 10.512 9.760 -3.803 1.00 0.00 C ATOM 1094 CG2 VAL A 432 10.333 11.926 -2.568 1.00 0.00 C ATOM 0 H VAL A 432 10.428 10.491 -6.427 1.00 0.00 H new ATOM 0 HA VAL A 432 8.624 12.374 -4.987 1.00 0.00 H new ATOM 0 HB VAL A 432 8.671 10.771 -3.351 1.00 0.00 H new ATOM 0 HG11 VAL A 432 10.580 9.255 -2.839 1.00 0.00 H new ATOM 0 HG12 VAL A 432 10.034 9.099 -4.526 1.00 0.00 H new ATOM 0 HG13 VAL A 432 11.513 10.014 -4.151 1.00 0.00 H new ATOM 0 HG21 VAL A 432 10.413 11.363 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 432 11.327 12.230 -2.895 1.00 0.00 H new ATOM 0 HG23 VAL A 432 9.718 12.811 -2.405 1.00 0.00 H new ATOM 1104 N ASN A 433 10.495 14.009 -4.740 1.00 0.00 N ATOM 1105 CA ASN A 433 11.554 15.060 -4.829 1.00 0.00 C ATOM 1106 C ASN A 433 12.108 15.299 -3.425 1.00 0.00 C ATOM 1107 O ASN A 433 11.365 15.464 -2.478 1.00 0.00 O ATOM 1108 CB ASN A 433 10.944 16.356 -5.366 1.00 0.00 C ATOM 1109 CG ASN A 433 10.410 16.119 -6.780 1.00 0.00 C ATOM 1110 OD1 ASN A 433 9.716 15.153 -7.026 1.00 0.00 O ATOM 1111 ND2 ASN A 433 10.707 16.966 -7.727 1.00 0.00 N ATOM 0 H ASN A 433 9.618 14.325 -4.327 1.00 0.00 H new ATOM 0 HA ASN A 433 12.351 14.739 -5.500 1.00 0.00 H new ATOM 0 HB2 ASN A 433 10.138 16.690 -4.712 1.00 0.00 H new ATOM 0 HB3 ASN A 433 11.694 17.147 -5.377 1.00 0.00 H new ATOM 0 HD21 ASN A 433 10.356 16.817 -8.673 1.00 0.00 H new ATOM 0 HD22 ASN A 433 11.290 17.777 -7.521 1.00 0.00 H new ATOM 1118 N ILE A 434 13.401 15.307 -3.273 1.00 0.00 N ATOM 1119 CA ILE A 434 13.983 15.520 -1.918 1.00 0.00 C ATOM 1120 C ILE A 434 13.915 17.002 -1.545 1.00 0.00 C ATOM 1121 O ILE A 434 14.030 17.364 -0.391 1.00 0.00 O ATOM 1122 CB ILE A 434 15.439 15.049 -1.912 1.00 0.00 C ATOM 1123 CG1 ILE A 434 15.552 13.740 -2.700 1.00 0.00 C ATOM 1124 CG2 ILE A 434 15.903 14.822 -0.472 1.00 0.00 C ATOM 1125 CD1 ILE A 434 14.517 12.729 -2.192 1.00 0.00 C ATOM 0 H ILE A 434 14.079 15.176 -4.024 1.00 0.00 H new ATOM 0 HA ILE A 434 13.412 14.947 -1.187 1.00 0.00 H new ATOM 0 HB ILE A 434 16.068 15.810 -2.375 1.00 0.00 H new ATOM 0 HG12 ILE A 434 15.395 13.931 -3.762 1.00 0.00 H new ATOM 0 HG13 ILE A 434 16.556 13.329 -2.595 1.00 0.00 H new ATOM 0 HG21 ILE A 434 16.940 14.487 -0.473 1.00 0.00 H new ATOM 0 HG22 ILE A 434 15.823 15.754 0.087 1.00 0.00 H new ATOM 0 HG23 ILE A 434 15.277 14.063 -0.003 1.00 0.00 H new ATOM 0 HD11 ILE A 434 14.605 11.802 -2.758 1.00 0.00 H new ATOM 0 HD12 ILE A 434 14.694 12.527 -1.136 1.00 0.00 H new ATOM 0 HD13 ILE A 434 13.515 13.138 -2.320 1.00 0.00 H new ATOM 1137 N SER A 435 13.734 17.862 -2.507 1.00 0.00 N ATOM 1138 CA SER A 435 13.665 19.318 -2.197 1.00 0.00 C ATOM 1139 C SER A 435 12.718 19.548 -1.015 1.00 0.00 C ATOM 1140 O SER A 435 13.059 20.224 -0.065 1.00 0.00 O ATOM 1141 CB SER A 435 13.151 20.079 -3.419 1.00 0.00 C ATOM 1142 OG SER A 435 13.404 21.467 -3.244 1.00 0.00 O ATOM 0 H SER A 435 13.631 17.621 -3.493 1.00 0.00 H new ATOM 0 HA SER A 435 14.661 19.679 -1.938 1.00 0.00 H new ATOM 0 HB2 SER A 435 13.644 19.718 -4.321 1.00 0.00 H new ATOM 0 HB3 SER A 435 12.083 19.905 -3.548 1.00 0.00 H new ATOM 0 HG SER A 435 13.078 21.960 -4.026 1.00 0.00 H new ATOM 1148 N GLY A 436 11.530 18.992 -1.071 1.00 0.00 N ATOM 1149 CA GLY A 436 10.541 19.173 0.043 1.00 0.00 C ATOM 1150 C GLY A 436 10.201 17.816 0.669 1.00 0.00 C ATOM 1151 O GLY A 436 9.188 17.664 1.321 1.00 0.00 O ATOM 0 H GLY A 436 11.200 18.416 -1.846 1.00 0.00 H new ATOM 0 HA2 GLY A 436 10.953 19.839 0.801 1.00 0.00 H new ATOM 0 HA3 GLY A 436 9.635 19.644 -0.337 1.00 0.00 H new ATOM 1155 N GLN A 437 11.033 16.825 0.481 1.00 0.00 N ATOM 1156 CA GLN A 437 10.737 15.485 1.074 1.00 0.00 C ATOM 1157 C GLN A 437 9.292 15.097 0.750 1.00 0.00 C ATOM 1158 O GLN A 437 8.481 14.892 1.631 1.00 0.00 O ATOM 1159 CB GLN A 437 10.913 15.548 2.593 1.00 0.00 C ATOM 1160 CG GLN A 437 12.403 15.624 2.936 1.00 0.00 C ATOM 1161 CD GLN A 437 13.045 14.245 2.762 1.00 0.00 C ATOM 1162 OE1 GLN A 437 13.471 13.879 1.584 1.00 0.00 O flip ATOM 1163 NE2 GLN A 437 13.164 13.494 3.710 1.00 0.00 N flip ATOM 0 H GLN A 437 11.900 16.883 -0.054 1.00 0.00 H new ATOM 0 HA GLN A 437 11.420 14.744 0.658 1.00 0.00 H new ATOM 0 HB2 GLN A 437 10.393 16.418 2.993 1.00 0.00 H new ATOM 0 HB3 GLN A 437 10.467 14.668 3.057 1.00 0.00 H new ATOM 0 HG2 GLN A 437 12.898 16.350 2.291 1.00 0.00 H new ATOM 0 HG3 GLN A 437 12.533 15.969 3.962 1.00 0.00 H new ATOM 0 HE21 GLN A 437 12.831 13.779 4.631 1.00 0.00 H new ATOM 0 HE22 GLN A 437 13.596 12.579 3.584 1.00 0.00 H new ATOM 1172 N LYS A 438 8.964 15.009 -0.512 1.00 0.00 N ATOM 1173 CA LYS A 438 7.570 14.649 -0.915 1.00 0.00 C ATOM 1174 C LYS A 438 7.514 13.170 -1.289 1.00 0.00 C ATOM 1175 O LYS A 438 7.710 12.804 -2.430 1.00 0.00 O ATOM 1176 CB LYS A 438 7.162 15.486 -2.132 1.00 0.00 C ATOM 1177 CG LYS A 438 7.525 16.957 -1.894 1.00 0.00 C ATOM 1178 CD LYS A 438 7.292 17.774 -3.177 1.00 0.00 C ATOM 1179 CE LYS A 438 8.143 19.047 -3.143 1.00 0.00 C ATOM 1180 NZ LYS A 438 7.869 19.859 -4.363 1.00 0.00 N ATOM 0 H LYS A 438 9.606 15.172 -1.288 1.00 0.00 H new ATOM 0 HA LYS A 438 6.891 14.845 -0.085 1.00 0.00 H new ATOM 0 HB2 LYS A 438 7.667 15.117 -3.025 1.00 0.00 H new ATOM 0 HB3 LYS A 438 6.091 15.390 -2.309 1.00 0.00 H new ATOM 0 HG2 LYS A 438 6.922 17.362 -1.081 1.00 0.00 H new ATOM 0 HG3 LYS A 438 8.568 17.037 -1.587 1.00 0.00 H new ATOM 0 HD2 LYS A 438 7.550 17.176 -4.051 1.00 0.00 H new ATOM 0 HD3 LYS A 438 6.237 18.033 -3.268 1.00 0.00 H new ATOM 0 HE2 LYS A 438 7.915 19.626 -2.248 1.00 0.00 H new ATOM 0 HE3 LYS A 438 9.201 18.789 -3.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 8.446 20.724 -4.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 8.108 19.305 -5.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 6.862 20.116 -4.390 1.00 0.00 H new ATOM 1194 N PHE A 439 7.235 12.317 -0.346 1.00 0.00 N ATOM 1195 CA PHE A 439 7.168 10.865 -0.674 1.00 0.00 C ATOM 1196 C PHE A 439 5.880 10.591 -1.445 1.00 0.00 C ATOM 1197 O PHE A 439 4.813 10.493 -0.872 1.00 0.00 O ATOM 1198 CB PHE A 439 7.200 10.022 0.604 1.00 0.00 C ATOM 1199 CG PHE A 439 8.209 10.601 1.562 1.00 0.00 C ATOM 1200 CD1 PHE A 439 9.580 10.470 1.304 1.00 0.00 C ATOM 1201 CD2 PHE A 439 7.772 11.274 2.706 1.00 0.00 C ATOM 1202 CE1 PHE A 439 10.510 11.019 2.195 1.00 0.00 C ATOM 1203 CE2 PHE A 439 8.698 11.820 3.593 1.00 0.00 C ATOM 1204 CZ PHE A 439 10.066 11.695 3.339 1.00 0.00 C ATOM 0 H PHE A 439 7.052 12.557 0.628 1.00 0.00 H new ATOM 0 HA PHE A 439 8.031 10.594 -1.283 1.00 0.00 H new ATOM 0 HB2 PHE A 439 6.213 10.004 1.066 1.00 0.00 H new ATOM 0 HB3 PHE A 439 7.459 8.990 0.366 1.00 0.00 H new ATOM 0 HD1 PHE A 439 9.918 9.948 0.421 1.00 0.00 H new ATOM 0 HD2 PHE A 439 6.715 11.371 2.903 1.00 0.00 H new ATOM 0 HE1 PHE A 439 11.568 10.922 2.001 1.00 0.00 H new ATOM 0 HE2 PHE A 439 8.358 12.340 4.477 1.00 0.00 H new ATOM 0 HZ PHE A 439 10.783 12.120 4.026 1.00 0.00 H new ATOM 1214 N ASN A 440 5.976 10.474 -2.752 1.00 0.00 N ATOM 1215 CA ASN A 440 4.767 10.206 -3.592 1.00 0.00 C ATOM 1216 C ASN A 440 5.026 8.961 -4.441 1.00 0.00 C ATOM 1217 O ASN A 440 5.663 9.028 -5.474 1.00 0.00 O ATOM 1218 CB ASN A 440 4.527 11.413 -4.514 1.00 0.00 C ATOM 1219 CG ASN A 440 3.048 11.486 -4.911 1.00 0.00 C ATOM 1220 OD1 ASN A 440 2.417 10.472 -5.135 1.00 0.00 O ATOM 1221 ND2 ASN A 440 2.466 12.650 -5.005 1.00 0.00 N ATOM 0 H ASN A 440 6.849 10.554 -3.274 1.00 0.00 H new ATOM 0 HA ASN A 440 3.893 10.047 -2.960 1.00 0.00 H new ATOM 0 HB2 ASN A 440 4.821 12.332 -4.007 1.00 0.00 H new ATOM 0 HB3 ASN A 440 5.147 11.328 -5.406 1.00 0.00 H new ATOM 0 HD21 ASN A 440 1.482 12.708 -5.266 1.00 0.00 H new ATOM 0 HD22 ASN A 440 2.995 13.501 -4.817 1.00 0.00 H new ATOM 1228 N ILE A 441 4.541 7.823 -4.018 1.00 0.00 N ATOM 1229 CA ILE A 441 4.763 6.576 -4.801 1.00 0.00 C ATOM 1230 C ILE A 441 3.579 6.357 -5.744 1.00 0.00 C ATOM 1231 O ILE A 441 2.430 6.401 -5.349 1.00 0.00 O ATOM 1232 CB ILE A 441 4.951 5.384 -3.814 1.00 0.00 C ATOM 1233 CG1 ILE A 441 6.098 4.475 -4.301 1.00 0.00 C ATOM 1234 CG2 ILE A 441 3.663 4.553 -3.660 1.00 0.00 C ATOM 1235 CD1 ILE A 441 7.439 5.080 -3.872 1.00 0.00 C ATOM 0 H ILE A 441 4.000 7.705 -3.162 1.00 0.00 H new ATOM 0 HA ILE A 441 5.664 6.655 -5.410 1.00 0.00 H new ATOM 0 HB ILE A 441 5.196 5.803 -2.838 1.00 0.00 H new ATOM 0 HG12 ILE A 441 5.987 3.474 -3.883 1.00 0.00 H new ATOM 0 HG13 ILE A 441 6.062 4.374 -5.386 1.00 0.00 H new ATOM 0 HG21 ILE A 441 3.840 3.733 -2.963 1.00 0.00 H new ATOM 0 HG22 ILE A 441 2.864 5.188 -3.278 1.00 0.00 H new ATOM 0 HG23 ILE A 441 3.373 4.149 -4.630 1.00 0.00 H new ATOM 0 HD11 ILE A 441 8.253 4.441 -4.214 1.00 0.00 H new ATOM 0 HD12 ILE A 441 7.548 6.072 -4.311 1.00 0.00 H new ATOM 0 HD13 ILE A 441 7.472 5.159 -2.785 1.00 0.00 H new ATOM 1247 N LYS A 442 3.863 6.113 -6.990 1.00 0.00 N ATOM 1248 CA LYS A 442 2.783 5.876 -7.980 1.00 0.00 C ATOM 1249 C LYS A 442 2.479 4.380 -8.002 1.00 0.00 C ATOM 1250 O LYS A 442 3.181 3.601 -8.615 1.00 0.00 O ATOM 1251 CB LYS A 442 3.264 6.348 -9.360 1.00 0.00 C ATOM 1252 CG LYS A 442 2.143 6.190 -10.420 1.00 0.00 C ATOM 1253 CD LYS A 442 2.358 4.919 -11.256 1.00 0.00 C ATOM 1254 CE LYS A 442 1.376 4.912 -12.426 1.00 0.00 C ATOM 1255 NZ LYS A 442 1.680 3.762 -13.325 1.00 0.00 N ATOM 0 H LYS A 442 4.809 6.067 -7.368 1.00 0.00 H new ATOM 0 HA LYS A 442 1.880 6.426 -7.716 1.00 0.00 H new ATOM 0 HB2 LYS A 442 3.573 7.392 -9.304 1.00 0.00 H new ATOM 0 HB3 LYS A 442 4.139 5.772 -9.661 1.00 0.00 H new ATOM 0 HG2 LYS A 442 1.173 6.146 -9.926 1.00 0.00 H new ATOM 0 HG3 LYS A 442 2.128 7.062 -11.073 1.00 0.00 H new ATOM 0 HD2 LYS A 442 3.383 4.882 -11.626 1.00 0.00 H new ATOM 0 HD3 LYS A 442 2.211 4.034 -10.637 1.00 0.00 H new ATOM 0 HE2 LYS A 442 0.354 4.837 -12.056 1.00 0.00 H new ATOM 0 HE3 LYS A 442 1.447 5.848 -12.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 0.865 3.581 -13.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 2.513 3.986 -13.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 1.875 2.916 -12.753 1.00 0.00 H new ATOM 1269 N LEU A 443 1.446 3.972 -7.313 1.00 0.00 N ATOM 1270 CA LEU A 443 1.080 2.524 -7.263 1.00 0.00 C ATOM 1271 C LEU A 443 -0.106 2.290 -8.204 1.00 0.00 C ATOM 1272 O LEU A 443 -1.122 2.947 -8.101 1.00 0.00 O ATOM 1273 CB LEU A 443 0.693 2.168 -5.805 1.00 0.00 C ATOM 1274 CG LEU A 443 1.340 0.841 -5.362 1.00 0.00 C ATOM 1275 CD1 LEU A 443 0.850 -0.305 -6.263 1.00 0.00 C ATOM 1276 CD2 LEU A 443 2.887 0.945 -5.418 1.00 0.00 C ATOM 0 H LEU A 443 0.833 4.586 -6.777 1.00 0.00 H new ATOM 0 HA LEU A 443 1.914 1.896 -7.577 1.00 0.00 H new ATOM 0 HB2 LEU A 443 1.008 2.970 -5.137 1.00 0.00 H new ATOM 0 HB3 LEU A 443 -0.391 2.092 -5.723 1.00 0.00 H new ATOM 0 HG LEU A 443 1.047 0.634 -4.333 1.00 0.00 H new ATOM 0 HD11 LEU A 443 1.311 -1.240 -5.945 1.00 0.00 H new ATOM 0 HD12 LEU A 443 -0.234 -0.390 -6.186 1.00 0.00 H new ATOM 0 HD13 LEU A 443 1.125 -0.098 -7.297 1.00 0.00 H new ATOM 0 HD21 LEU A 443 3.327 -0.001 -5.102 1.00 0.00 H new ATOM 0 HD22 LEU A 443 3.200 1.168 -6.438 1.00 0.00 H new ATOM 0 HD23 LEU A 443 3.222 1.741 -4.753 1.00 0.00 H new ATOM 1288 N LEU A 444 0.012 1.361 -9.119 1.00 0.00 N ATOM 1289 CA LEU A 444 -1.116 1.083 -10.069 1.00 0.00 C ATOM 1290 C LEU A 444 -1.309 -0.432 -10.168 1.00 0.00 C ATOM 1291 O LEU A 444 -0.384 -1.197 -9.986 1.00 0.00 O ATOM 1292 CB LEU A 444 -0.776 1.708 -11.444 1.00 0.00 C ATOM 1293 CG LEU A 444 -1.510 1.014 -12.617 1.00 0.00 C ATOM 1294 CD1 LEU A 444 -3.049 1.166 -12.497 1.00 0.00 C ATOM 1295 CD2 LEU A 444 -1.029 1.652 -13.930 1.00 0.00 C ATOM 0 H LEU A 444 0.840 0.781 -9.252 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.048 1.525 -9.716 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -1.039 2.766 -11.432 1.00 0.00 H new ATOM 0 HB3 LEU A 444 0.300 1.649 -11.609 1.00 0.00 H new ATOM 0 HG LEU A 444 -1.283 -0.052 -12.596 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -3.531 0.666 -13.338 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -3.388 0.715 -11.564 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -3.312 2.224 -12.505 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -1.534 1.178 -14.771 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -1.259 2.717 -13.923 1.00 0.00 H new ATOM 0 HD23 LEU A 444 0.048 1.514 -14.028 1.00 0.00 H new ATOM 1307 N ILE A 445 -2.513 -0.871 -10.445 1.00 0.00 N ATOM 1308 CA ILE A 445 -2.779 -2.338 -10.543 1.00 0.00 C ATOM 1309 C ILE A 445 -3.811 -2.603 -11.656 1.00 0.00 C ATOM 1310 O ILE A 445 -4.859 -1.989 -11.671 1.00 0.00 O ATOM 1311 CB ILE A 445 -3.362 -2.819 -9.211 1.00 0.00 C ATOM 1312 CG1 ILE A 445 -2.538 -2.221 -8.064 1.00 0.00 C ATOM 1313 CG2 ILE A 445 -3.316 -4.349 -9.156 1.00 0.00 C ATOM 1314 CD1 ILE A 445 -2.887 -2.907 -6.738 1.00 0.00 C ATOM 0 H ILE A 445 -3.324 -0.274 -10.608 1.00 0.00 H new ATOM 0 HA ILE A 445 -1.852 -2.865 -10.769 1.00 0.00 H new ATOM 0 HB ILE A 445 -4.399 -2.496 -9.117 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -1.475 -2.339 -8.272 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -2.731 -1.151 -7.989 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -3.731 -4.692 -8.208 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -3.902 -4.760 -9.978 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -2.283 -4.685 -9.243 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -2.293 -2.470 -5.935 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -3.946 -2.766 -6.523 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -2.670 -3.973 -6.811 1.00 0.00 H new ATOM 1326 N PRO A 446 -3.547 -3.511 -12.575 1.00 0.00 N ATOM 1327 CA PRO A 446 -4.518 -3.827 -13.666 1.00 0.00 C ATOM 1328 C PRO A 446 -5.677 -4.680 -13.136 1.00 0.00 C ATOM 1329 O PRO A 446 -5.462 -5.690 -12.495 1.00 0.00 O ATOM 1330 CB PRO A 446 -3.673 -4.604 -14.681 1.00 0.00 C ATOM 1331 CG PRO A 446 -2.619 -5.276 -13.860 1.00 0.00 C ATOM 1332 CD PRO A 446 -2.319 -4.330 -12.692 1.00 0.00 C ATOM 0 HA PRO A 446 -4.982 -2.940 -14.097 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -4.276 -5.332 -15.224 1.00 0.00 H new ATOM 0 HB3 PRO A 446 -3.233 -3.938 -15.423 1.00 0.00 H new ATOM 0 HG2 PRO A 446 -2.966 -6.244 -13.498 1.00 0.00 H new ATOM 0 HG3 PRO A 446 -1.723 -5.460 -14.452 1.00 0.00 H new ATOM 0 HD2 PRO A 446 -2.117 -4.881 -11.773 1.00 0.00 H new ATOM 0 HD3 PRO A 446 -1.444 -3.712 -12.893 1.00 0.00 H new ATOM 1340 N VAL A 447 -6.903 -4.274 -13.375 1.00 0.00 N ATOM 1341 CA VAL A 447 -8.068 -5.057 -12.849 1.00 0.00 C ATOM 1342 C VAL A 447 -9.232 -5.047 -13.851 1.00 0.00 C ATOM 1343 O VAL A 447 -9.142 -4.487 -14.925 1.00 0.00 O ATOM 1344 CB VAL A 447 -8.511 -4.430 -11.521 1.00 0.00 C ATOM 1345 CG1 VAL A 447 -7.273 -4.131 -10.683 1.00 0.00 C ATOM 1346 CG2 VAL A 447 -9.261 -3.117 -11.776 1.00 0.00 C ATOM 0 H VAL A 447 -7.146 -3.439 -13.908 1.00 0.00 H new ATOM 0 HA VAL A 447 -7.770 -6.094 -12.697 1.00 0.00 H new ATOM 0 HB VAL A 447 -9.171 -5.124 -11.001 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -7.574 -3.685 -9.735 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -6.731 -5.057 -10.492 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -6.628 -3.437 -11.222 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -9.569 -2.683 -10.825 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -8.606 -2.419 -12.298 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -10.142 -3.314 -12.387 1.00 0.00 H new ATOM 1356 N ALA A 448 -10.326 -5.676 -13.495 1.00 0.00 N ATOM 1357 CA ALA A 448 -11.509 -5.725 -14.406 1.00 0.00 C ATOM 1358 C ALA A 448 -12.022 -4.310 -14.673 1.00 0.00 C ATOM 1359 O ALA A 448 -12.352 -3.961 -15.789 1.00 0.00 O ATOM 1360 CB ALA A 448 -12.621 -6.547 -13.751 1.00 0.00 C ATOM 0 H ALA A 448 -10.449 -6.160 -12.606 1.00 0.00 H new ATOM 0 HA ALA A 448 -11.214 -6.185 -15.349 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -13.485 -6.584 -14.414 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -12.263 -7.560 -13.564 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -12.908 -6.084 -12.807 1.00 0.00 H new ATOM 1366 N GLU A 449 -12.090 -3.489 -13.660 1.00 0.00 N ATOM 1367 CA GLU A 449 -12.578 -2.097 -13.866 1.00 0.00 C ATOM 1368 C GLU A 449 -11.677 -1.424 -14.895 1.00 0.00 C ATOM 1369 O GLU A 449 -12.064 -0.482 -15.558 1.00 0.00 O ATOM 1370 CB GLU A 449 -12.499 -1.320 -12.542 1.00 0.00 C ATOM 1371 CG GLU A 449 -13.446 -1.943 -11.487 1.00 0.00 C ATOM 1372 CD GLU A 449 -14.774 -1.173 -11.434 1.00 0.00 C ATOM 1373 OE1 GLU A 449 -14.780 -0.080 -10.889 1.00 0.00 O ATOM 1374 OE2 GLU A 449 -15.758 -1.690 -11.934 1.00 0.00 O ATOM 0 H GLU A 449 -11.829 -3.722 -12.702 1.00 0.00 H new ATOM 0 HA GLU A 449 -13.612 -2.110 -14.212 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -11.475 -1.329 -12.169 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -12.768 -0.277 -12.709 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -13.635 -2.988 -11.731 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -12.970 -1.926 -10.507 1.00 0.00 H new ATOM 1381 N GLY A 450 -10.471 -1.912 -15.034 1.00 0.00 N ATOM 1382 CA GLY A 450 -9.519 -1.325 -16.022 1.00 0.00 C ATOM 1383 C GLY A 450 -8.142 -1.220 -15.375 1.00 0.00 C ATOM 1384 O GLY A 450 -7.315 -2.101 -15.497 1.00 0.00 O ATOM 0 H GLY A 450 -10.103 -2.699 -14.500 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -9.470 -1.948 -16.915 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -9.863 -0.341 -16.339 1.00 0.00 H new ATOM 1388 N MET A 451 -7.897 -0.146 -14.678 1.00 0.00 N ATOM 1389 CA MET A 451 -6.591 0.046 -14.007 1.00 0.00 C ATOM 1390 C MET A 451 -6.852 0.801 -12.705 1.00 0.00 C ATOM 1391 O MET A 451 -7.456 1.856 -12.701 1.00 0.00 O ATOM 1392 CB MET A 451 -5.673 0.860 -14.931 1.00 0.00 C ATOM 1393 CG MET A 451 -5.896 0.426 -16.379 1.00 0.00 C ATOM 1394 SD MET A 451 -4.710 1.275 -17.455 1.00 0.00 S ATOM 1395 CE MET A 451 -3.485 -0.054 -17.557 1.00 0.00 C ATOM 0 H MET A 451 -8.561 0.617 -14.546 1.00 0.00 H new ATOM 0 HA MET A 451 -6.106 -0.906 -13.792 1.00 0.00 H new ATOM 0 HB2 MET A 451 -5.881 1.924 -14.823 1.00 0.00 H new ATOM 0 HB3 MET A 451 -4.630 0.709 -14.651 1.00 0.00 H new ATOM 0 HG2 MET A 451 -5.776 -0.654 -16.469 1.00 0.00 H new ATOM 0 HG3 MET A 451 -6.915 0.660 -16.687 1.00 0.00 H new ATOM 0 HE1 MET A 451 -2.653 0.265 -18.185 1.00 0.00 H new ATOM 0 HE2 MET A 451 -3.117 -0.287 -16.558 1.00 0.00 H new ATOM 0 HE3 MET A 451 -3.946 -0.942 -17.989 1.00 0.00 H new ATOM 1405 N ASN A 452 -6.428 0.265 -11.596 1.00 0.00 N ATOM 1406 CA ASN A 452 -6.684 0.953 -10.295 1.00 0.00 C ATOM 1407 C ASN A 452 -5.565 1.953 -10.024 1.00 0.00 C ATOM 1408 O ASN A 452 -4.521 1.618 -9.501 1.00 0.00 O ATOM 1409 CB ASN A 452 -6.742 -0.093 -9.164 1.00 0.00 C ATOM 1410 CG ASN A 452 -8.183 -0.585 -8.973 1.00 0.00 C ATOM 1411 OD1 ASN A 452 -9.121 0.176 -9.103 1.00 0.00 O ATOM 1412 ND2 ASN A 452 -8.398 -1.833 -8.662 1.00 0.00 N ATOM 0 H ASN A 452 -5.917 -0.616 -11.531 1.00 0.00 H new ATOM 0 HA ASN A 452 -7.635 1.483 -10.339 1.00 0.00 H new ATOM 0 HB2 ASN A 452 -6.091 -0.934 -9.403 1.00 0.00 H new ATOM 0 HB3 ASN A 452 -6.372 0.343 -8.236 1.00 0.00 H new ATOM 0 HD21 ASN A 452 -9.352 -2.168 -8.528 1.00 0.00 H new ATOM 0 HD22 ASN A 452 -7.612 -2.474 -8.552 1.00 0.00 H new ATOM 1419 N GLU A 453 -5.794 3.188 -10.363 1.00 0.00 N ATOM 1420 CA GLU A 453 -4.766 4.228 -10.122 1.00 0.00 C ATOM 1421 C GLU A 453 -4.776 4.572 -8.635 1.00 0.00 C ATOM 1422 O GLU A 453 -5.800 4.924 -8.081 1.00 0.00 O ATOM 1423 CB GLU A 453 -5.079 5.475 -10.970 1.00 0.00 C ATOM 1424 CG GLU A 453 -6.184 6.320 -10.316 1.00 0.00 C ATOM 1425 CD GLU A 453 -6.695 7.356 -11.318 1.00 0.00 C ATOM 1426 OE1 GLU A 453 -5.913 8.206 -11.711 1.00 0.00 O ATOM 1427 OE2 GLU A 453 -7.860 7.284 -11.673 1.00 0.00 O ATOM 0 H GLU A 453 -6.654 3.521 -10.799 1.00 0.00 H new ATOM 0 HA GLU A 453 -3.779 3.864 -10.407 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -4.177 6.076 -11.087 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.391 5.171 -11.969 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -7.003 5.678 -9.991 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -5.797 6.818 -9.427 1.00 0.00 H new ATOM 1434 N ILE A 454 -3.651 4.460 -7.985 1.00 0.00 N ATOM 1435 CA ILE A 454 -3.584 4.766 -6.524 1.00 0.00 C ATOM 1436 C ILE A 454 -2.464 5.767 -6.261 1.00 0.00 C ATOM 1437 O ILE A 454 -1.409 5.718 -6.862 1.00 0.00 O ATOM 1438 CB ILE A 454 -3.320 3.472 -5.748 1.00 0.00 C ATOM 1439 CG1 ILE A 454 -4.566 2.582 -5.828 1.00 0.00 C ATOM 1440 CG2 ILE A 454 -3.007 3.803 -4.282 1.00 0.00 C ATOM 1441 CD1 ILE A 454 -4.263 1.215 -5.214 1.00 0.00 C ATOM 0 H ILE A 454 -2.768 4.168 -8.404 1.00 0.00 H new ATOM 0 HA ILE A 454 -4.530 5.197 -6.196 1.00 0.00 H new ATOM 0 HB ILE A 454 -2.468 2.948 -6.180 1.00 0.00 H new ATOM 0 HG12 ILE A 454 -5.395 3.053 -5.300 1.00 0.00 H new ATOM 0 HG13 ILE A 454 -4.875 2.465 -6.867 1.00 0.00 H new ATOM 0 HG21 ILE A 454 -2.820 2.880 -3.733 1.00 0.00 H new ATOM 0 HG22 ILE A 454 -2.124 4.440 -4.233 1.00 0.00 H new ATOM 0 HG23 ILE A 454 -3.855 4.324 -3.838 1.00 0.00 H new ATOM 0 HD11 ILE A 454 -5.151 0.585 -5.272 1.00 0.00 H new ATOM 0 HD12 ILE A 454 -3.447 0.743 -5.761 1.00 0.00 H new ATOM 0 HD13 ILE A 454 -3.975 1.341 -4.170 1.00 0.00 H new ATOM 1453 N TRP A 455 -2.698 6.672 -5.354 1.00 0.00 N ATOM 1454 CA TRP A 455 -1.675 7.697 -5.006 1.00 0.00 C ATOM 1455 C TRP A 455 -1.634 7.820 -3.487 1.00 0.00 C ATOM 1456 O TRP A 455 -2.580 8.252 -2.860 1.00 0.00 O ATOM 1457 CB TRP A 455 -2.064 9.036 -5.635 1.00 0.00 C ATOM 1458 CG TRP A 455 -2.252 8.849 -7.108 1.00 0.00 C ATOM 1459 CD1 TRP A 455 -3.415 8.506 -7.708 1.00 0.00 C ATOM 1460 CD2 TRP A 455 -1.269 8.980 -8.173 1.00 0.00 C ATOM 1461 NE1 TRP A 455 -3.207 8.424 -9.073 1.00 0.00 N ATOM 1462 CE2 TRP A 455 -1.901 8.709 -9.409 1.00 0.00 C ATOM 1463 CE3 TRP A 455 0.095 9.309 -8.184 1.00 0.00 C ATOM 1464 CZ2 TRP A 455 -1.202 8.761 -10.615 1.00 0.00 C ATOM 1465 CZ3 TRP A 455 0.805 9.362 -9.395 1.00 0.00 C ATOM 1466 CH2 TRP A 455 0.156 9.090 -10.609 1.00 0.00 C ATOM 0 H TRP A 455 -3.570 6.746 -4.830 1.00 0.00 H new ATOM 0 HA TRP A 455 -0.694 7.410 -5.383 1.00 0.00 H new ATOM 0 HB2 TRP A 455 -2.982 9.411 -5.183 1.00 0.00 H new ATOM 0 HB3 TRP A 455 -1.289 9.779 -5.446 1.00 0.00 H new ATOM 0 HD1 TRP A 455 -4.353 8.326 -7.204 1.00 0.00 H new ATOM 0 HE1 TRP A 455 -3.932 8.182 -9.749 1.00 0.00 H new ATOM 0 HE3 TRP A 455 0.603 9.523 -7.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 455 -1.706 8.549 -11.546 1.00 0.00 H new ATOM 0 HZ3 TRP A 455 1.855 9.613 -9.392 1.00 0.00 H new ATOM 0 HH2 TRP A 455 0.705 9.135 -11.538 1.00 0.00 H new ATOM 1477 N LEU A 456 -0.552 7.414 -2.888 1.00 0.00 N ATOM 1478 CA LEU A 456 -0.443 7.467 -1.405 1.00 0.00 C ATOM 1479 C LEU A 456 0.090 8.838 -0.981 1.00 0.00 C ATOM 1480 O LEU A 456 0.867 9.455 -1.682 1.00 0.00 O ATOM 1481 CB LEU A 456 0.516 6.359 -0.943 1.00 0.00 C ATOM 1482 CG LEU A 456 0.274 5.086 -1.774 1.00 0.00 C ATOM 1483 CD1 LEU A 456 1.238 3.980 -1.333 1.00 0.00 C ATOM 1484 CD2 LEU A 456 -1.173 4.617 -1.575 1.00 0.00 C ATOM 0 H LEU A 456 0.269 7.044 -3.367 1.00 0.00 H new ATOM 0 HA LEU A 456 -1.421 7.316 -0.949 1.00 0.00 H new ATOM 0 HB2 LEU A 456 1.549 6.688 -1.056 1.00 0.00 H new ATOM 0 HB3 LEU A 456 0.362 6.149 0.115 1.00 0.00 H new ATOM 0 HG LEU A 456 0.447 5.307 -2.827 1.00 0.00 H new ATOM 0 HD11 LEU A 456 1.059 3.083 -1.927 1.00 0.00 H new ATOM 0 HD12 LEU A 456 2.265 4.313 -1.479 1.00 0.00 H new ATOM 0 HD13 LEU A 456 1.076 3.755 -0.279 1.00 0.00 H new ATOM 0 HD21 LEU A 456 -1.347 3.716 -2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 456 -1.344 4.402 -0.520 1.00 0.00 H new ATOM 0 HD23 LEU A 456 -1.857 5.400 -1.901 1.00 0.00 H new ATOM 1496 N ARG A 457 -0.329 9.328 0.159 1.00 0.00 N ATOM 1497 CA ARG A 457 0.150 10.668 0.613 1.00 0.00 C ATOM 1498 C ARG A 457 1.512 10.530 1.298 1.00 0.00 C ATOM 1499 O ARG A 457 1.867 9.480 1.796 1.00 0.00 O ATOM 1500 CB ARG A 457 -0.857 11.269 1.597 1.00 0.00 C ATOM 1501 CG ARG A 457 -0.609 12.773 1.722 1.00 0.00 C ATOM 1502 CD ARG A 457 -1.517 13.349 2.804 1.00 0.00 C ATOM 1503 NE ARG A 457 -2.890 12.791 2.647 1.00 0.00 N ATOM 1504 CZ ARG A 457 -3.604 13.097 1.597 1.00 0.00 C ATOM 1505 NH1 ARG A 457 -3.133 13.925 0.707 1.00 0.00 N ATOM 1506 NH2 ARG A 457 -4.794 12.585 1.443 1.00 0.00 N ATOM 0 H ARG A 457 -0.979 8.860 0.791 1.00 0.00 H new ATOM 0 HA ARG A 457 0.248 11.323 -0.253 1.00 0.00 H new ATOM 0 HB2 ARG A 457 -1.874 11.084 1.252 1.00 0.00 H new ATOM 0 HB3 ARG A 457 -0.760 10.791 2.572 1.00 0.00 H new ATOM 0 HG2 ARG A 457 0.436 12.961 1.971 1.00 0.00 H new ATOM 0 HG3 ARG A 457 -0.803 13.265 0.769 1.00 0.00 H new ATOM 0 HD2 ARG A 457 -1.124 13.106 3.791 1.00 0.00 H new ATOM 0 HD3 ARG A 457 -1.544 14.436 2.731 1.00 0.00 H new ATOM 0 HE ARG A 457 -3.272 12.170 3.360 1.00 0.00 H new ATOM 0 HH11 ARG A 457 -2.207 14.334 0.831 1.00 0.00 H new ATOM 0 HH12 ARG A 457 -3.691 14.164 -0.113 1.00 0.00 H new ATOM 0 HH21 ARG A 457 -5.168 11.945 2.143 1.00 0.00 H new ATOM 0 HH22 ARG A 457 -5.350 12.825 0.622 1.00 0.00 H new ATOM 1520 N CYS A 458 2.281 11.585 1.312 1.00 0.00 N ATOM 1521 CA CYS A 458 3.628 11.527 1.947 1.00 0.00 C ATOM 1522 C CYS A 458 3.490 11.603 3.474 1.00 0.00 C ATOM 1523 O CYS A 458 2.507 12.093 3.993 1.00 0.00 O ATOM 1524 CB CYS A 458 4.470 12.704 1.430 1.00 0.00 C ATOM 1525 SG CYS A 458 3.397 14.133 1.148 1.00 0.00 S ATOM 0 H CYS A 458 2.033 12.488 0.909 1.00 0.00 H new ATOM 0 HA CYS A 458 4.118 10.588 1.692 1.00 0.00 H new ATOM 0 HB2 CYS A 458 5.246 12.955 2.153 1.00 0.00 H new ATOM 0 HB3 CYS A 458 4.974 12.426 0.505 1.00 0.00 H new ATOM 0 HG CYS A 458 4.108 15.130 0.713 1.00 0.00 H new ATOM 1531 N ASP A 459 4.469 11.111 4.199 1.00 0.00 N ATOM 1532 CA ASP A 459 4.394 11.147 5.687 1.00 0.00 C ATOM 1533 C ASP A 459 5.811 11.242 6.280 1.00 0.00 C ATOM 1534 O ASP A 459 6.143 12.199 6.951 1.00 0.00 O ATOM 1535 CB ASP A 459 3.696 9.877 6.171 1.00 0.00 C ATOM 1536 CG ASP A 459 3.262 10.049 7.629 1.00 0.00 C ATOM 1537 OD1 ASP A 459 4.129 10.060 8.487 1.00 0.00 O ATOM 1538 OD2 ASP A 459 2.070 10.166 7.862 1.00 0.00 O ATOM 0 H ASP A 459 5.315 10.687 3.819 1.00 0.00 H new ATOM 0 HA ASP A 459 3.828 12.020 6.013 1.00 0.00 H new ATOM 0 HB2 ASP A 459 2.828 9.667 5.546 1.00 0.00 H new ATOM 0 HB3 ASP A 459 4.368 9.024 6.080 1.00 0.00 H new ATOM 1543 N ASN A 460 6.653 10.268 6.041 1.00 0.00 N ATOM 1544 CA ASN A 460 8.029 10.314 6.585 1.00 0.00 C ATOM 1545 C ASN A 460 8.903 9.391 5.723 1.00 0.00 C ATOM 1546 O ASN A 460 8.407 8.688 4.864 1.00 0.00 O ATOM 1547 CB ASN A 460 7.992 9.849 8.045 1.00 0.00 C ATOM 1548 CG ASN A 460 9.377 9.416 8.496 1.00 0.00 C ATOM 1549 OD1 ASN A 460 9.595 8.156 8.689 1.00 0.00 O flip ATOM 1550 ND2 ASN A 460 10.262 10.229 8.677 1.00 0.00 N flip ATOM 0 H ASN A 460 6.437 9.439 5.487 1.00 0.00 H new ATOM 0 HA ASN A 460 8.443 11.322 6.559 1.00 0.00 H new ATOM 0 HB2 ASN A 460 7.631 10.656 8.682 1.00 0.00 H new ATOM 0 HB3 ASN A 460 7.292 9.021 8.152 1.00 0.00 H new ATOM 0 HD21 ASN A 460 10.082 11.221 8.523 1.00 0.00 H new ATOM 0 HD22 ASN A 460 11.184 9.919 8.983 1.00 0.00 H new ATOM 1557 N GLU A 461 10.191 9.393 5.924 1.00 0.00 N ATOM 1558 CA GLU A 461 11.065 8.518 5.087 1.00 0.00 C ATOM 1559 C GLU A 461 10.917 7.056 5.519 1.00 0.00 C ATOM 1560 O GLU A 461 10.931 6.158 4.700 1.00 0.00 O ATOM 1561 CB GLU A 461 12.527 8.960 5.209 1.00 0.00 C ATOM 1562 CG GLU A 461 12.936 9.033 6.678 1.00 0.00 C ATOM 1563 CD GLU A 461 14.292 9.733 6.793 1.00 0.00 C ATOM 1564 OE1 GLU A 461 14.421 10.823 6.258 1.00 0.00 O ATOM 1565 OE2 GLU A 461 15.179 9.167 7.409 1.00 0.00 O ATOM 0 H GLU A 461 10.675 9.956 6.624 1.00 0.00 H new ATOM 0 HA GLU A 461 10.757 8.609 4.045 1.00 0.00 H new ATOM 0 HB2 GLU A 461 13.172 8.259 4.679 1.00 0.00 H new ATOM 0 HB3 GLU A 461 12.660 9.934 4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 461 12.184 9.577 7.250 1.00 0.00 H new ATOM 0 HG3 GLU A 461 12.995 8.030 7.101 1.00 0.00 H new ATOM 1572 N LYS A 462 10.761 6.802 6.790 1.00 0.00 N ATOM 1573 CA LYS A 462 10.597 5.392 7.244 1.00 0.00 C ATOM 1574 C LYS A 462 9.313 4.835 6.635 1.00 0.00 C ATOM 1575 O LYS A 462 9.218 3.673 6.297 1.00 0.00 O ATOM 1576 CB LYS A 462 10.478 5.348 8.770 1.00 0.00 C ATOM 1577 CG LYS A 462 11.671 6.071 9.427 1.00 0.00 C ATOM 1578 CD LYS A 462 11.275 6.576 10.820 1.00 0.00 C ATOM 1579 CE LYS A 462 12.394 7.462 11.376 1.00 0.00 C ATOM 1580 NZ LYS A 462 13.716 6.919 10.954 1.00 0.00 N ATOM 0 H LYS A 462 10.740 7.505 7.529 1.00 0.00 H new ATOM 0 HA LYS A 462 11.459 4.803 6.932 1.00 0.00 H new ATOM 0 HB2 LYS A 462 9.545 5.817 9.081 1.00 0.00 H new ATOM 0 HB3 LYS A 462 10.442 4.312 9.108 1.00 0.00 H new ATOM 0 HG2 LYS A 462 12.520 5.392 9.505 1.00 0.00 H new ATOM 0 HG3 LYS A 462 11.988 6.908 8.804 1.00 0.00 H new ATOM 0 HD2 LYS A 462 10.344 7.140 10.764 1.00 0.00 H new ATOM 0 HD3 LYS A 462 11.098 5.733 11.488 1.00 0.00 H new ATOM 0 HE2 LYS A 462 12.277 8.484 11.014 1.00 0.00 H new ATOM 0 HE3 LYS A 462 12.335 7.500 12.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 14.468 7.354 11.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 13.728 5.888 11.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 13.876 7.136 9.949 1.00 0.00 H new ATOM 1594 N GLN A 463 8.316 5.666 6.505 1.00 0.00 N ATOM 1595 CA GLN A 463 7.023 5.207 5.931 1.00 0.00 C ATOM 1596 C GLN A 463 7.258 4.527 4.577 1.00 0.00 C ATOM 1597 O GLN A 463 6.956 3.365 4.396 1.00 0.00 O ATOM 1598 CB GLN A 463 6.101 6.420 5.745 1.00 0.00 C ATOM 1599 CG GLN A 463 4.640 5.960 5.652 1.00 0.00 C ATOM 1600 CD GLN A 463 4.087 5.692 7.054 1.00 0.00 C ATOM 1601 OE1 GLN A 463 4.394 4.581 7.665 1.00 0.00 O flip ATOM 1602 NE2 GLN A 463 3.369 6.505 7.600 1.00 0.00 N flip ATOM 0 H GLN A 463 8.343 6.650 6.774 1.00 0.00 H new ATOM 0 HA GLN A 463 6.561 4.489 6.608 1.00 0.00 H new ATOM 0 HB2 GLN A 463 6.221 7.110 6.580 1.00 0.00 H new ATOM 0 HB3 GLN A 463 6.378 6.963 4.841 1.00 0.00 H new ATOM 0 HG2 GLN A 463 4.041 6.723 5.155 1.00 0.00 H new ATOM 0 HG3 GLN A 463 4.572 5.056 5.046 1.00 0.00 H new ATOM 0 HE21 GLN A 463 3.128 7.374 7.123 1.00 0.00 H new ATOM 0 HE22 GLN A 463 3.007 6.319 8.535 1.00 0.00 H new ATOM 1611 N TYR A 464 7.773 5.248 3.617 1.00 0.00 N ATOM 1612 CA TYR A 464 8.000 4.642 2.272 1.00 0.00 C ATOM 1613 C TYR A 464 8.858 3.373 2.385 1.00 0.00 C ATOM 1614 O TYR A 464 8.608 2.394 1.715 1.00 0.00 O ATOM 1615 CB TYR A 464 8.686 5.689 1.359 1.00 0.00 C ATOM 1616 CG TYR A 464 7.634 6.420 0.550 1.00 0.00 C ATOM 1617 CD1 TYR A 464 6.420 6.773 1.152 1.00 0.00 C ATOM 1618 CD2 TYR A 464 7.855 6.710 -0.802 1.00 0.00 C ATOM 1619 CE1 TYR A 464 5.427 7.405 0.406 1.00 0.00 C ATOM 1620 CE2 TYR A 464 6.861 7.354 -1.546 1.00 0.00 C ATOM 1621 CZ TYR A 464 5.646 7.697 -0.940 1.00 0.00 C ATOM 1622 OH TYR A 464 4.655 8.304 -1.674 1.00 0.00 O ATOM 0 H TYR A 464 8.046 6.227 3.705 1.00 0.00 H new ATOM 0 HA TYR A 464 7.043 4.354 1.838 1.00 0.00 H new ATOM 0 HB2 TYR A 464 9.253 6.398 1.963 1.00 0.00 H new ATOM 0 HB3 TYR A 464 9.396 5.198 0.693 1.00 0.00 H new ATOM 0 HD1 TYR A 464 6.253 6.555 2.196 1.00 0.00 H new ATOM 0 HD2 TYR A 464 8.790 6.437 -1.269 1.00 0.00 H new ATOM 0 HE1 TYR A 464 4.488 7.669 0.870 1.00 0.00 H new ATOM 0 HE2 TYR A 464 7.030 7.587 -2.587 1.00 0.00 H new ATOM 0 HH TYR A 464 4.220 8.993 -1.130 1.00 0.00 H new ATOM 1632 N ALA A 465 9.866 3.381 3.204 1.00 0.00 N ATOM 1633 CA ALA A 465 10.739 2.175 3.326 1.00 0.00 C ATOM 1634 C ALA A 465 9.908 0.892 3.523 1.00 0.00 C ATOM 1635 O ALA A 465 10.298 -0.171 3.082 1.00 0.00 O ATOM 1636 CB ALA A 465 11.682 2.353 4.517 1.00 0.00 C ATOM 0 H ALA A 465 10.128 4.168 3.797 1.00 0.00 H new ATOM 0 HA ALA A 465 11.307 2.073 2.402 1.00 0.00 H new ATOM 0 HB1 ALA A 465 12.321 1.475 4.610 1.00 0.00 H new ATOM 0 HB2 ALA A 465 12.300 3.237 4.362 1.00 0.00 H new ATOM 0 HB3 ALA A 465 11.097 2.474 5.429 1.00 0.00 H new ATOM 1642 N HIS A 466 8.792 0.962 4.204 1.00 0.00 N ATOM 1643 CA HIS A 466 7.988 -0.282 4.443 1.00 0.00 C ATOM 1644 C HIS A 466 7.065 -0.602 3.255 1.00 0.00 C ATOM 1645 O HIS A 466 7.182 -1.641 2.636 1.00 0.00 O ATOM 1646 CB HIS A 466 7.135 -0.090 5.710 1.00 0.00 C ATOM 1647 CG HIS A 466 7.960 -0.383 6.934 1.00 0.00 C ATOM 1648 ND1 HIS A 466 9.249 0.107 7.095 1.00 0.00 N ATOM 1649 CD2 HIS A 466 7.695 -1.119 8.061 1.00 0.00 C ATOM 1650 CE1 HIS A 466 9.706 -0.337 8.281 1.00 0.00 C ATOM 1651 NE2 HIS A 466 8.797 -1.087 8.906 1.00 0.00 N ATOM 0 H HIS A 466 8.403 1.817 4.603 1.00 0.00 H new ATOM 0 HA HIS A 466 8.679 -1.116 4.564 1.00 0.00 H new ATOM 0 HB2 HIS A 466 6.756 0.931 5.752 1.00 0.00 H new ATOM 0 HB3 HIS A 466 6.268 -0.750 5.679 1.00 0.00 H new ATOM 0 HD2 HIS A 466 6.772 -1.643 8.261 1.00 0.00 H new ATOM 0 HE1 HIS A 466 10.686 -0.114 8.677 1.00 0.00 H new ATOM 0 HE2 HIS A 466 8.891 -1.542 9.814 1.00 0.00 H new ATOM 1660 N TRP A 467 6.127 0.254 2.959 1.00 0.00 N ATOM 1661 CA TRP A 467 5.180 -0.039 1.847 1.00 0.00 C ATOM 1662 C TRP A 467 5.952 -0.342 0.558 1.00 0.00 C ATOM 1663 O TRP A 467 5.655 -1.302 -0.121 1.00 0.00 O ATOM 1664 CB TRP A 467 4.204 1.146 1.663 1.00 0.00 C ATOM 1665 CG TRP A 467 2.927 0.852 2.400 1.00 0.00 C ATOM 1666 CD1 TRP A 467 2.791 0.839 3.748 1.00 0.00 C ATOM 1667 CD2 TRP A 467 1.622 0.501 1.856 1.00 0.00 C ATOM 1668 NE1 TRP A 467 1.487 0.501 4.063 1.00 0.00 N ATOM 1669 CE2 TRP A 467 0.726 0.290 2.931 1.00 0.00 C ATOM 1670 CE3 TRP A 467 1.133 0.352 0.546 1.00 0.00 C ATOM 1671 CZ2 TRP A 467 -0.606 -0.060 2.713 1.00 0.00 C ATOM 1672 CZ3 TRP A 467 -0.207 -0.001 0.323 1.00 0.00 C ATOM 1673 CH2 TRP A 467 -1.075 -0.205 1.405 1.00 0.00 C ATOM 0 H TRP A 467 5.975 1.142 3.438 1.00 0.00 H new ATOM 0 HA TRP A 467 4.593 -0.924 2.094 1.00 0.00 H new ATOM 0 HB2 TRP A 467 4.653 2.065 2.041 1.00 0.00 H new ATOM 0 HB3 TRP A 467 3.999 1.303 0.604 1.00 0.00 H new ATOM 0 HD1 TRP A 467 3.573 1.057 4.460 1.00 0.00 H new ATOM 0 HE1 TRP A 467 1.131 0.418 5.015 1.00 0.00 H new ATOM 0 HE3 TRP A 467 1.793 0.510 -0.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 467 -1.271 -0.218 3.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 467 -0.571 -0.116 -0.687 1.00 0.00 H new ATOM 0 HH2 TRP A 467 -2.106 -0.474 1.227 1.00 0.00 H new ATOM 1684 N MET A 468 6.929 0.452 0.207 1.00 0.00 N ATOM 1685 CA MET A 468 7.698 0.155 -1.053 1.00 0.00 C ATOM 1686 C MET A 468 8.018 -1.349 -1.113 1.00 0.00 C ATOM 1687 O MET A 468 7.679 -2.027 -2.060 1.00 0.00 O ATOM 1688 CB MET A 468 9.023 0.958 -1.102 1.00 0.00 C ATOM 1689 CG MET A 468 8.807 2.274 -1.855 1.00 0.00 C ATOM 1690 SD MET A 468 8.496 1.909 -3.601 1.00 0.00 S ATOM 1691 CE MET A 468 10.219 1.906 -4.150 1.00 0.00 C ATOM 0 H MET A 468 7.229 1.280 0.722 1.00 0.00 H new ATOM 0 HA MET A 468 7.084 0.446 -1.905 1.00 0.00 H new ATOM 0 HB2 MET A 468 9.373 1.161 -0.090 1.00 0.00 H new ATOM 0 HB3 MET A 468 9.797 0.370 -1.595 1.00 0.00 H new ATOM 0 HG2 MET A 468 7.965 2.818 -1.428 1.00 0.00 H new ATOM 0 HG3 MET A 468 9.684 2.914 -1.754 1.00 0.00 H new ATOM 0 HE1 MET A 468 10.260 1.697 -5.219 1.00 0.00 H new ATOM 0 HE2 MET A 468 10.665 2.881 -3.954 1.00 0.00 H new ATOM 0 HE3 MET A 468 10.772 1.138 -3.609 1.00 0.00 H new ATOM 1701 N ALA A 469 8.657 -1.878 -0.110 1.00 0.00 N ATOM 1702 CA ALA A 469 8.972 -3.332 -0.132 1.00 0.00 C ATOM 1703 C ALA A 469 7.658 -4.119 -0.214 1.00 0.00 C ATOM 1704 O ALA A 469 7.631 -5.259 -0.633 1.00 0.00 O ATOM 1705 CB ALA A 469 9.742 -3.714 1.138 1.00 0.00 C ATOM 0 H ALA A 469 8.973 -1.372 0.718 1.00 0.00 H new ATOM 0 HA ALA A 469 9.592 -3.568 -0.997 1.00 0.00 H new ATOM 0 HB1 ALA A 469 9.971 -4.780 1.118 1.00 0.00 H new ATOM 0 HB2 ALA A 469 10.670 -3.144 1.186 1.00 0.00 H new ATOM 0 HB3 ALA A 469 9.133 -3.490 2.014 1.00 0.00 H new ATOM 1711 N ALA A 470 6.569 -3.512 0.185 1.00 0.00 N ATOM 1712 CA ALA A 470 5.255 -4.217 0.134 1.00 0.00 C ATOM 1713 C ALA A 470 4.708 -4.210 -1.303 1.00 0.00 C ATOM 1714 O ALA A 470 3.957 -5.073 -1.703 1.00 0.00 O ATOM 1715 CB ALA A 470 4.260 -3.513 1.043 1.00 0.00 C ATOM 0 H ALA A 470 6.534 -2.558 0.544 1.00 0.00 H new ATOM 0 HA ALA A 470 5.397 -5.246 0.465 1.00 0.00 H new ATOM 0 HB1 ALA A 470 3.302 -4.031 1.003 1.00 0.00 H new ATOM 0 HB2 ALA A 470 4.634 -3.520 2.067 1.00 0.00 H new ATOM 0 HB3 ALA A 470 4.130 -2.483 0.712 1.00 0.00 H new ATOM 1721 N CYS A 471 5.076 -3.229 -2.076 1.00 0.00 N ATOM 1722 CA CYS A 471 4.596 -3.154 -3.476 1.00 0.00 C ATOM 1723 C CYS A 471 5.491 -4.069 -4.307 1.00 0.00 C ATOM 1724 O CYS A 471 5.046 -4.777 -5.187 1.00 0.00 O ATOM 1725 CB CYS A 471 4.677 -1.704 -3.960 1.00 0.00 C ATOM 1726 SG CYS A 471 6.398 -1.255 -4.283 1.00 0.00 S ATOM 0 H CYS A 471 5.695 -2.470 -1.792 1.00 0.00 H new ATOM 0 HA CYS A 471 3.558 -3.474 -3.567 1.00 0.00 H new ATOM 0 HB2 CYS A 471 4.084 -1.581 -4.866 1.00 0.00 H new ATOM 0 HB3 CYS A 471 4.253 -1.037 -3.209 1.00 0.00 H new ATOM 0 HG CYS A 471 7.141 -1.641 -3.288 1.00 0.00 H new ATOM 1732 N ARG A 472 6.752 -4.111 -3.993 1.00 0.00 N ATOM 1733 CA ARG A 472 7.639 -5.038 -4.727 1.00 0.00 C ATOM 1734 C ARG A 472 7.281 -6.447 -4.245 1.00 0.00 C ATOM 1735 O ARG A 472 7.394 -7.411 -4.972 1.00 0.00 O ATOM 1736 CB ARG A 472 9.103 -4.716 -4.433 1.00 0.00 C ATOM 1737 CG ARG A 472 9.492 -3.404 -5.117 1.00 0.00 C ATOM 1738 CD ARG A 472 11.013 -3.255 -5.109 1.00 0.00 C ATOM 1739 NE ARG A 472 11.621 -4.317 -5.960 1.00 0.00 N ATOM 1740 CZ ARG A 472 12.913 -4.353 -6.134 1.00 0.00 C ATOM 1741 NH1 ARG A 472 13.672 -3.461 -5.558 1.00 0.00 N ATOM 1742 NH2 ARG A 472 13.448 -5.278 -6.883 1.00 0.00 N ATOM 0 H ARG A 472 7.200 -3.550 -3.268 1.00 0.00 H new ATOM 0 HA ARG A 472 7.505 -4.950 -5.805 1.00 0.00 H new ATOM 0 HB2 ARG A 472 9.258 -4.636 -3.357 1.00 0.00 H new ATOM 0 HB3 ARG A 472 9.741 -5.525 -4.788 1.00 0.00 H new ATOM 0 HG2 ARG A 472 9.120 -3.392 -6.142 1.00 0.00 H new ATOM 0 HG3 ARG A 472 9.031 -2.562 -4.601 1.00 0.00 H new ATOM 0 HD2 ARG A 472 11.295 -2.270 -5.482 1.00 0.00 H new ATOM 0 HD3 ARG A 472 11.391 -3.330 -4.089 1.00 0.00 H new ATOM 0 HE ARG A 472 11.027 -5.016 -6.406 1.00 0.00 H new ATOM 0 HH11 ARG A 472 13.254 -2.737 -4.973 1.00 0.00 H new ATOM 0 HH12 ARG A 472 14.683 -3.488 -5.693 1.00 0.00 H new ATOM 0 HH21 ARG A 472 12.855 -5.975 -7.334 1.00 0.00 H new ATOM 0 HH22 ARG A 472 14.459 -5.304 -7.018 1.00 0.00 H new ATOM 1756 N LEU A 473 6.783 -6.559 -3.028 1.00 0.00 N ATOM 1757 CA LEU A 473 6.345 -7.896 -2.519 1.00 0.00 C ATOM 1758 C LEU A 473 5.310 -8.387 -3.512 1.00 0.00 C ATOM 1759 O LEU A 473 5.298 -9.526 -3.922 1.00 0.00 O ATOM 1760 CB LEU A 473 5.732 -7.737 -1.109 1.00 0.00 C ATOM 1761 CG LEU A 473 4.592 -8.763 -0.825 1.00 0.00 C ATOM 1762 CD1 LEU A 473 4.370 -8.911 0.708 1.00 0.00 C ATOM 1763 CD2 LEU A 473 3.262 -8.331 -1.510 1.00 0.00 C ATOM 0 H LEU A 473 6.664 -5.785 -2.374 1.00 0.00 H new ATOM 0 HA LEU A 473 7.171 -8.602 -2.432 1.00 0.00 H new ATOM 0 HB2 LEU A 473 6.516 -7.856 -0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 473 5.340 -6.726 -1.001 1.00 0.00 H new ATOM 0 HG LEU A 473 4.896 -9.724 -1.240 1.00 0.00 H new ATOM 0 HD11 LEU A 473 3.572 -9.630 0.892 1.00 0.00 H new ATOM 0 HD12 LEU A 473 5.290 -9.262 1.177 1.00 0.00 H new ATOM 0 HD13 LEU A 473 4.093 -7.945 1.130 1.00 0.00 H new ATOM 0 HD21 LEU A 473 2.486 -9.066 -1.294 1.00 0.00 H new ATOM 0 HD22 LEU A 473 2.956 -7.357 -1.128 1.00 0.00 H new ATOM 0 HD23 LEU A 473 3.412 -8.268 -2.588 1.00 0.00 H new ATOM 1775 N ALA A 474 4.467 -7.487 -3.934 1.00 0.00 N ATOM 1776 CA ALA A 474 3.435 -7.823 -4.949 1.00 0.00 C ATOM 1777 C ALA A 474 4.124 -8.603 -6.071 1.00 0.00 C ATOM 1778 O ALA A 474 3.518 -9.372 -6.791 1.00 0.00 O ATOM 1779 CB ALA A 474 2.853 -6.501 -5.469 1.00 0.00 C ATOM 0 H ALA A 474 4.451 -6.519 -3.613 1.00 0.00 H new ATOM 0 HA ALA A 474 2.629 -8.431 -4.539 1.00 0.00 H new ATOM 0 HB1 ALA A 474 2.090 -6.709 -6.219 1.00 0.00 H new ATOM 0 HB2 ALA A 474 2.408 -5.949 -4.641 1.00 0.00 H new ATOM 0 HB3 ALA A 474 3.648 -5.905 -5.917 1.00 0.00 H new ATOM 1785 N SER A 475 5.403 -8.396 -6.198 1.00 0.00 N ATOM 1786 CA SER A 475 6.188 -9.106 -7.251 1.00 0.00 C ATOM 1787 C SER A 475 6.488 -10.555 -6.818 1.00 0.00 C ATOM 1788 O SER A 475 6.200 -11.489 -7.541 1.00 0.00 O ATOM 1789 CB SER A 475 7.508 -8.365 -7.498 1.00 0.00 C ATOM 1790 OG SER A 475 7.986 -8.686 -8.799 1.00 0.00 O ATOM 0 H SER A 475 5.946 -7.760 -5.614 1.00 0.00 H new ATOM 0 HA SER A 475 5.599 -9.127 -8.168 1.00 0.00 H new ATOM 0 HB2 SER A 475 7.358 -7.289 -7.407 1.00 0.00 H new ATOM 0 HB3 SER A 475 8.245 -8.648 -6.746 1.00 0.00 H new ATOM 0 HG SER A 475 8.829 -8.214 -8.964 1.00 0.00 H new ATOM 1796 N LYS A 476 7.083 -10.759 -5.660 1.00 0.00 N ATOM 1797 CA LYS A 476 7.412 -12.151 -5.219 1.00 0.00 C ATOM 1798 C LYS A 476 6.303 -12.700 -4.316 1.00 0.00 C ATOM 1799 O LYS A 476 6.324 -13.850 -3.925 1.00 0.00 O ATOM 1800 CB LYS A 476 8.746 -12.136 -4.458 1.00 0.00 C ATOM 1801 CG LYS A 476 8.581 -11.427 -3.109 1.00 0.00 C ATOM 1802 CD LYS A 476 9.948 -11.248 -2.429 1.00 0.00 C ATOM 1803 CE LYS A 476 10.861 -10.334 -3.266 1.00 0.00 C ATOM 1804 NZ LYS A 476 10.043 -9.341 -4.017 1.00 0.00 N ATOM 0 H LYS A 476 7.352 -10.023 -5.007 1.00 0.00 H new ATOM 0 HA LYS A 476 7.495 -12.795 -6.094 1.00 0.00 H new ATOM 0 HB2 LYS A 476 9.094 -13.157 -4.300 1.00 0.00 H new ATOM 0 HB3 LYS A 476 9.506 -11.629 -5.053 1.00 0.00 H new ATOM 0 HG2 LYS A 476 8.111 -10.455 -3.257 1.00 0.00 H new ATOM 0 HG3 LYS A 476 7.920 -12.006 -2.465 1.00 0.00 H new ATOM 0 HD2 LYS A 476 9.812 -10.821 -1.435 1.00 0.00 H new ATOM 0 HD3 LYS A 476 10.423 -12.220 -2.296 1.00 0.00 H new ATOM 0 HE2 LYS A 476 11.567 -9.818 -2.615 1.00 0.00 H new ATOM 0 HE3 LYS A 476 11.449 -10.933 -3.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 10.658 -8.581 -4.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 9.577 -9.811 -4.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 9.322 -8.937 -3.386 1.00 0.00 H new ATOM 1818 N GLY A 477 5.333 -11.894 -3.987 1.00 0.00 N ATOM 1819 CA GLY A 477 4.225 -12.381 -3.116 1.00 0.00 C ATOM 1820 C GLY A 477 4.682 -12.459 -1.652 1.00 0.00 C ATOM 1821 O GLY A 477 3.909 -12.221 -0.745 1.00 0.00 O ATOM 0 H GLY A 477 5.258 -10.921 -4.282 1.00 0.00 H new ATOM 0 HA2 GLY A 477 3.368 -11.712 -3.200 1.00 0.00 H new ATOM 0 HA3 GLY A 477 3.896 -13.364 -3.453 1.00 0.00 H new ATOM 1825 N LYS A 478 5.921 -12.806 -1.407 1.00 0.00 N ATOM 1826 CA LYS A 478 6.398 -12.912 0.008 1.00 0.00 C ATOM 1827 C LYS A 478 6.628 -11.514 0.589 1.00 0.00 C ATOM 1828 O LYS A 478 6.741 -10.538 -0.122 1.00 0.00 O ATOM 1829 CB LYS A 478 7.714 -13.727 0.057 1.00 0.00 C ATOM 1830 CG LYS A 478 7.558 -14.980 0.931 1.00 0.00 C ATOM 1831 CD LYS A 478 7.496 -14.575 2.408 1.00 0.00 C ATOM 1832 CE LYS A 478 7.564 -15.828 3.281 1.00 0.00 C ATOM 1833 NZ LYS A 478 8.980 -16.277 3.394 1.00 0.00 N ATOM 0 H LYS A 478 6.619 -13.019 -2.119 1.00 0.00 H new ATOM 0 HA LYS A 478 5.640 -13.421 0.603 1.00 0.00 H new ATOM 0 HB2 LYS A 478 8.002 -14.018 -0.953 1.00 0.00 H new ATOM 0 HB3 LYS A 478 8.517 -13.103 0.450 1.00 0.00 H new ATOM 0 HG2 LYS A 478 6.652 -15.518 0.653 1.00 0.00 H new ATOM 0 HG3 LYS A 478 8.395 -15.658 0.765 1.00 0.00 H new ATOM 0 HD2 LYS A 478 8.322 -13.906 2.648 1.00 0.00 H new ATOM 0 HD3 LYS A 478 6.575 -14.028 2.608 1.00 0.00 H new ATOM 0 HE2 LYS A 478 7.158 -15.618 4.270 1.00 0.00 H new ATOM 0 HE3 LYS A 478 6.953 -16.620 2.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 478 9.029 -17.307 3.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 478 9.553 -15.804 2.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 478 9.347 -16.034 4.336 1.00 0.00 H new ATOM 1847 N THR A 479 6.701 -11.432 1.890 1.00 0.00 N ATOM 1848 CA THR A 479 6.921 -10.113 2.579 1.00 0.00 C ATOM 1849 C THR A 479 8.329 -10.069 3.179 1.00 0.00 C ATOM 1850 O THR A 479 9.178 -10.874 2.850 1.00 0.00 O ATOM 1851 CB THR A 479 5.858 -9.918 3.685 1.00 0.00 C ATOM 1852 OG1 THR A 479 5.817 -8.549 4.060 1.00 0.00 O ATOM 1853 CG2 THR A 479 6.180 -10.768 4.920 1.00 0.00 C ATOM 0 H THR A 479 6.617 -12.230 2.519 1.00 0.00 H new ATOM 0 HA THR A 479 6.825 -9.306 1.853 1.00 0.00 H new ATOM 0 HB THR A 479 4.892 -10.234 3.291 1.00 0.00 H new ATOM 0 HG1 THR A 479 5.710 -8.479 5.032 1.00 0.00 H new ATOM 0 HG21 THR A 479 5.415 -10.610 5.680 1.00 0.00 H new ATOM 0 HG22 THR A 479 6.202 -11.821 4.641 1.00 0.00 H new ATOM 0 HG23 THR A 479 7.152 -10.478 5.318 1.00 0.00 H new ATOM 1861 N MET A 480 8.583 -9.124 4.050 1.00 0.00 N ATOM 1862 CA MET A 480 9.933 -9.012 4.677 1.00 0.00 C ATOM 1863 C MET A 480 10.430 -10.397 5.093 1.00 0.00 C ATOM 1864 O MET A 480 11.607 -10.606 5.316 1.00 0.00 O ATOM 1865 CB MET A 480 9.853 -8.111 5.914 1.00 0.00 C ATOM 1866 CG MET A 480 8.739 -8.598 6.851 1.00 0.00 C ATOM 1867 SD MET A 480 9.074 -8.013 8.531 1.00 0.00 S ATOM 1868 CE MET A 480 8.321 -6.376 8.365 1.00 0.00 C ATOM 0 H MET A 480 7.908 -8.422 4.354 1.00 0.00 H new ATOM 0 HA MET A 480 10.626 -8.581 3.954 1.00 0.00 H new ATOM 0 HB2 MET A 480 10.808 -8.116 6.439 1.00 0.00 H new ATOM 0 HB3 MET A 480 9.660 -7.082 5.612 1.00 0.00 H new ATOM 0 HG2 MET A 480 7.773 -8.227 6.510 1.00 0.00 H new ATOM 0 HG3 MET A 480 8.685 -9.687 6.836 1.00 0.00 H new ATOM 0 HE1 MET A 480 8.418 -5.834 9.306 1.00 0.00 H new ATOM 0 HE2 MET A 480 8.826 -5.822 7.574 1.00 0.00 H new ATOM 0 HE3 MET A 480 7.266 -6.485 8.116 1.00 0.00 H new ATOM 1878 N ALA A 481 9.542 -11.348 5.188 1.00 0.00 N ATOM 1879 CA ALA A 481 9.964 -12.716 5.575 1.00 0.00 C ATOM 1880 C ALA A 481 10.914 -13.229 4.509 1.00 0.00 C ATOM 1881 O ALA A 481 11.483 -14.297 4.615 1.00 0.00 O ATOM 1882 CB ALA A 481 8.737 -13.627 5.682 1.00 0.00 C ATOM 0 H ALA A 481 8.544 -11.233 5.014 1.00 0.00 H new ATOM 0 HA ALA A 481 10.462 -12.705 6.544 1.00 0.00 H new ATOM 0 HB1 ALA A 481 9.053 -14.631 5.967 1.00 0.00 H new ATOM 0 HB2 ALA A 481 8.056 -13.233 6.437 1.00 0.00 H new ATOM 0 HB3 ALA A 481 8.228 -13.666 4.719 1.00 0.00 H new ATOM 1888 N ASP A 482 11.086 -12.458 3.480 1.00 0.00 N ATOM 1889 CA ASP A 482 12.000 -12.860 2.382 1.00 0.00 C ATOM 1890 C ASP A 482 13.431 -12.445 2.747 1.00 0.00 C ATOM 1891 O ASP A 482 13.643 -11.511 3.494 1.00 0.00 O ATOM 1892 CB ASP A 482 11.537 -12.154 1.103 1.00 0.00 C ATOM 1893 CG ASP A 482 11.864 -13.009 -0.127 1.00 0.00 C ATOM 1894 OD1 ASP A 482 11.064 -13.869 -0.456 1.00 0.00 O ATOM 1895 OD2 ASP A 482 12.908 -12.788 -0.717 1.00 0.00 O ATOM 0 H ASP A 482 10.628 -11.556 3.350 1.00 0.00 H new ATOM 0 HA ASP A 482 11.984 -13.939 2.228 1.00 0.00 H new ATOM 0 HB2 ASP A 482 10.464 -11.969 1.150 1.00 0.00 H new ATOM 0 HB3 ASP A 482 12.025 -11.183 1.019 1.00 0.00 H new ATOM 1900 N SER A 483 14.413 -13.133 2.234 1.00 0.00 N ATOM 1901 CA SER A 483 15.823 -12.776 2.563 1.00 0.00 C ATOM 1902 C SER A 483 16.295 -11.639 1.655 1.00 0.00 C ATOM 1903 O SER A 483 17.250 -10.950 1.954 1.00 0.00 O ATOM 1904 CB SER A 483 16.715 -14.001 2.357 1.00 0.00 C ATOM 1905 OG SER A 483 16.493 -14.532 1.058 1.00 0.00 O ATOM 0 H SER A 483 14.301 -13.926 1.602 1.00 0.00 H new ATOM 0 HA SER A 483 15.882 -12.451 3.602 1.00 0.00 H new ATOM 0 HB2 SER A 483 17.763 -13.726 2.475 1.00 0.00 H new ATOM 0 HB3 SER A 483 16.496 -14.755 3.113 1.00 0.00 H new ATOM 0 HG SER A 483 17.065 -15.316 0.923 1.00 0.00 H new ATOM 1911 N SER A 484 15.640 -11.438 0.543 1.00 0.00 N ATOM 1912 CA SER A 484 16.057 -10.346 -0.388 1.00 0.00 C ATOM 1913 C SER A 484 15.379 -9.030 0.007 1.00 0.00 C ATOM 1914 O SER A 484 15.802 -7.963 -0.392 1.00 0.00 O ATOM 1915 CB SER A 484 15.651 -10.715 -1.815 1.00 0.00 C ATOM 1916 OG SER A 484 16.225 -9.785 -2.725 1.00 0.00 O ATOM 0 H SER A 484 14.833 -11.983 0.238 1.00 0.00 H new ATOM 0 HA SER A 484 17.138 -10.222 -0.330 1.00 0.00 H new ATOM 0 HB2 SER A 484 15.986 -11.725 -2.050 1.00 0.00 H new ATOM 0 HB3 SER A 484 14.565 -10.709 -1.909 1.00 0.00 H new ATOM 0 HG SER A 484 16.416 -8.945 -2.258 1.00 0.00 H new ATOM 1922 N TYR A 485 14.329 -9.089 0.783 1.00 0.00 N ATOM 1923 CA TYR A 485 13.632 -7.833 1.190 1.00 0.00 C ATOM 1924 C TYR A 485 14.672 -6.816 1.688 1.00 0.00 C ATOM 1925 O TYR A 485 14.611 -5.645 1.373 1.00 0.00 O ATOM 1926 CB TYR A 485 12.582 -8.166 2.285 1.00 0.00 C ATOM 1927 CG TYR A 485 13.038 -7.721 3.666 1.00 0.00 C ATOM 1928 CD1 TYR A 485 14.004 -8.459 4.360 1.00 0.00 C ATOM 1929 CD2 TYR A 485 12.481 -6.574 4.249 1.00 0.00 C ATOM 1930 CE1 TYR A 485 14.414 -8.049 5.635 1.00 0.00 C ATOM 1931 CE2 TYR A 485 12.893 -6.165 5.522 1.00 0.00 C ATOM 1932 CZ TYR A 485 13.859 -6.902 6.216 1.00 0.00 C ATOM 1933 OH TYR A 485 14.266 -6.499 7.471 1.00 0.00 O ATOM 0 H TYR A 485 13.925 -9.950 1.152 1.00 0.00 H new ATOM 0 HA TYR A 485 13.108 -7.391 0.342 1.00 0.00 H new ATOM 0 HB2 TYR A 485 11.637 -7.680 2.041 1.00 0.00 H new ATOM 0 HB3 TYR A 485 12.395 -9.240 2.293 1.00 0.00 H new ATOM 0 HD1 TYR A 485 14.433 -9.344 3.913 1.00 0.00 H new ATOM 0 HD2 TYR A 485 11.734 -6.006 3.715 1.00 0.00 H new ATOM 0 HE1 TYR A 485 15.159 -8.618 6.171 1.00 0.00 H new ATOM 0 HE2 TYR A 485 12.465 -5.280 5.969 1.00 0.00 H new ATOM 0 HH TYR A 485 13.783 -5.685 7.726 1.00 0.00 H new ATOM 1943 N ASN A 486 15.624 -7.264 2.460 1.00 0.00 N ATOM 1944 CA ASN A 486 16.667 -6.334 2.975 1.00 0.00 C ATOM 1945 C ASN A 486 17.239 -5.524 1.814 1.00 0.00 C ATOM 1946 O ASN A 486 17.506 -4.346 1.933 1.00 0.00 O ATOM 1947 CB ASN A 486 17.794 -7.143 3.616 1.00 0.00 C ATOM 1948 CG ASN A 486 17.269 -7.870 4.853 1.00 0.00 C ATOM 1949 OD1 ASN A 486 17.046 -7.261 5.880 1.00 0.00 O ATOM 1950 ND2 ASN A 486 17.063 -9.158 4.798 1.00 0.00 N ATOM 0 H ASN A 486 15.724 -8.235 2.756 1.00 0.00 H new ATOM 0 HA ASN A 486 16.225 -5.664 3.713 1.00 0.00 H new ATOM 0 HB2 ASN A 486 18.190 -7.863 2.900 1.00 0.00 H new ATOM 0 HB3 ASN A 486 18.616 -6.483 3.892 1.00 0.00 H new ATOM 0 HD21 ASN A 486 16.714 -9.654 5.618 1.00 0.00 H new ATOM 0 HD22 ASN A 486 17.251 -9.668 3.935 1.00 0.00 H new ATOM 1957 N LEU A 487 17.440 -6.156 0.694 1.00 0.00 N ATOM 1958 CA LEU A 487 18.007 -5.438 -0.479 1.00 0.00 C ATOM 1959 C LEU A 487 16.962 -4.457 -1.033 1.00 0.00 C ATOM 1960 O LEU A 487 17.290 -3.510 -1.717 1.00 0.00 O ATOM 1961 CB LEU A 487 18.400 -6.478 -1.556 1.00 0.00 C ATOM 1962 CG LEU A 487 19.754 -6.123 -2.186 1.00 0.00 C ATOM 1963 CD1 LEU A 487 20.196 -7.253 -3.119 1.00 0.00 C ATOM 1964 CD2 LEU A 487 19.621 -4.826 -2.988 1.00 0.00 C ATOM 0 H LEU A 487 17.235 -7.143 0.540 1.00 0.00 H new ATOM 0 HA LEU A 487 18.891 -4.873 -0.186 1.00 0.00 H new ATOM 0 HB2 LEU A 487 18.451 -7.471 -1.108 1.00 0.00 H new ATOM 0 HB3 LEU A 487 17.633 -6.516 -2.329 1.00 0.00 H new ATOM 0 HG LEU A 487 20.495 -5.990 -1.398 1.00 0.00 H new ATOM 0 HD11 LEU A 487 21.157 -7.001 -3.566 1.00 0.00 H new ATOM 0 HD12 LEU A 487 20.292 -8.178 -2.550 1.00 0.00 H new ATOM 0 HD13 LEU A 487 19.454 -7.386 -3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 487 20.583 -4.574 -3.435 1.00 0.00 H new ATOM 0 HD22 LEU A 487 18.879 -4.959 -3.775 1.00 0.00 H new ATOM 0 HD23 LEU A 487 19.307 -4.019 -2.326 1.00 0.00 H new ATOM 1976 N GLU A 488 15.708 -4.683 -0.749 1.00 0.00 N ATOM 1977 CA GLU A 488 14.650 -3.769 -1.269 1.00 0.00 C ATOM 1978 C GLU A 488 14.563 -2.518 -0.389 1.00 0.00 C ATOM 1979 O GLU A 488 14.516 -1.408 -0.878 1.00 0.00 O ATOM 1980 CB GLU A 488 13.306 -4.497 -1.264 1.00 0.00 C ATOM 1981 CG GLU A 488 13.403 -5.742 -2.148 1.00 0.00 C ATOM 1982 CD GLU A 488 12.002 -6.301 -2.402 1.00 0.00 C ATOM 1983 OE1 GLU A 488 11.049 -5.665 -1.984 1.00 0.00 O ATOM 1984 OE2 GLU A 488 11.907 -7.354 -3.011 1.00 0.00 O ATOM 0 H GLU A 488 15.370 -5.460 -0.180 1.00 0.00 H new ATOM 0 HA GLU A 488 14.899 -3.470 -2.287 1.00 0.00 H new ATOM 0 HB2 GLU A 488 13.036 -4.779 -0.246 1.00 0.00 H new ATOM 0 HB3 GLU A 488 12.520 -3.837 -1.631 1.00 0.00 H new ATOM 0 HG2 GLU A 488 13.883 -5.492 -3.094 1.00 0.00 H new ATOM 0 HG3 GLU A 488 14.024 -6.496 -1.665 1.00 0.00 H new ATOM 1991 N VAL A 489 14.542 -2.687 0.904 1.00 0.00 N ATOM 1992 CA VAL A 489 14.460 -1.504 1.808 1.00 0.00 C ATOM 1993 C VAL A 489 15.801 -0.777 1.787 1.00 0.00 C ATOM 1994 O VAL A 489 15.872 0.436 1.765 1.00 0.00 O ATOM 1995 CB VAL A 489 14.136 -1.971 3.237 1.00 0.00 C ATOM 1996 CG1 VAL A 489 13.052 -3.042 3.177 1.00 0.00 C ATOM 1997 CG2 VAL A 489 15.386 -2.565 3.904 1.00 0.00 C ATOM 0 H VAL A 489 14.578 -3.592 1.374 1.00 0.00 H new ATOM 0 HA VAL A 489 13.673 -0.829 1.472 1.00 0.00 H new ATOM 0 HB VAL A 489 13.794 -1.115 3.819 1.00 0.00 H new ATOM 0 HG11 VAL A 489 12.817 -3.378 4.187 1.00 0.00 H new ATOM 0 HG12 VAL A 489 12.156 -2.628 2.715 1.00 0.00 H new ATOM 0 HG13 VAL A 489 13.407 -3.887 2.587 1.00 0.00 H new ATOM 0 HG21 VAL A 489 15.139 -2.891 4.915 1.00 0.00 H new ATOM 0 HG22 VAL A 489 15.737 -3.418 3.324 1.00 0.00 H new ATOM 0 HG23 VAL A 489 16.169 -1.808 3.948 1.00 0.00 H new ATOM 2007 N GLN A 490 16.862 -1.527 1.791 1.00 0.00 N ATOM 2008 CA GLN A 490 18.217 -0.912 1.769 1.00 0.00 C ATOM 2009 C GLN A 490 18.379 -0.107 0.483 1.00 0.00 C ATOM 2010 O GLN A 490 19.254 0.728 0.365 1.00 0.00 O ATOM 2011 CB GLN A 490 19.279 -2.015 1.807 1.00 0.00 C ATOM 2012 CG GLN A 490 19.294 -2.684 3.189 1.00 0.00 C ATOM 2013 CD GLN A 490 20.072 -1.823 4.179 1.00 0.00 C ATOM 2014 OE1 GLN A 490 20.482 -0.644 3.814 1.00 0.00 O flip ATOM 2015 NE2 GLN A 490 20.310 -2.229 5.300 1.00 0.00 N flip ATOM 0 H GLN A 490 16.851 -2.547 1.809 1.00 0.00 H new ATOM 0 HA GLN A 490 18.336 -0.260 2.634 1.00 0.00 H new ATOM 0 HB2 GLN A 490 19.071 -2.758 1.037 1.00 0.00 H new ATOM 0 HB3 GLN A 490 20.260 -1.594 1.587 1.00 0.00 H new ATOM 0 HG2 GLN A 490 18.273 -2.827 3.543 1.00 0.00 H new ATOM 0 HG3 GLN A 490 19.749 -3.672 3.119 1.00 0.00 H new ATOM 0 HE21 GLN A 490 19.989 -3.154 5.586 1.00 0.00 H new ATOM 0 HE22 GLN A 490 20.831 -1.645 5.954 1.00 0.00 H new ATOM 2024 N ASN A 491 17.550 -0.365 -0.492 1.00 0.00 N ATOM 2025 CA ASN A 491 17.667 0.372 -1.784 1.00 0.00 C ATOM 2026 C ASN A 491 16.950 1.726 -1.693 1.00 0.00 C ATOM 2027 O ASN A 491 17.230 2.628 -2.453 1.00 0.00 O ATOM 2028 CB ASN A 491 17.036 -0.467 -2.904 1.00 0.00 C ATOM 2029 CG ASN A 491 18.000 -1.579 -3.329 1.00 0.00 C ATOM 2030 OD1 ASN A 491 19.167 -1.551 -2.994 1.00 0.00 O ATOM 2031 ND2 ASN A 491 17.553 -2.564 -4.060 1.00 0.00 N ATOM 0 H ASN A 491 16.798 -1.053 -0.451 1.00 0.00 H new ATOM 0 HA ASN A 491 18.721 0.546 -2.000 1.00 0.00 H new ATOM 0 HB2 ASN A 491 16.096 -0.900 -2.561 1.00 0.00 H new ATOM 0 HB3 ASN A 491 16.801 0.168 -3.758 1.00 0.00 H new ATOM 0 HD21 ASN A 491 18.184 -3.311 -4.350 1.00 0.00 H new ATOM 0 HD22 ASN A 491 16.573 -2.587 -4.341 1.00 0.00 H new ATOM 2038 N ILE A 492 16.020 1.878 -0.785 1.00 0.00 N ATOM 2039 CA ILE A 492 15.291 3.181 -0.678 1.00 0.00 C ATOM 2040 C ILE A 492 16.093 4.164 0.185 1.00 0.00 C ATOM 2041 O ILE A 492 16.545 5.192 -0.281 1.00 0.00 O ATOM 2042 CB ILE A 492 13.913 2.940 -0.040 1.00 0.00 C ATOM 2043 CG1 ILE A 492 13.338 1.608 -0.540 1.00 0.00 C ATOM 2044 CG2 ILE A 492 12.958 4.080 -0.412 1.00 0.00 C ATOM 2045 CD1 ILE A 492 13.314 1.577 -2.072 1.00 0.00 C ATOM 0 H ILE A 492 15.734 1.162 -0.117 1.00 0.00 H new ATOM 0 HA ILE A 492 15.166 3.606 -1.674 1.00 0.00 H new ATOM 0 HB ILE A 492 14.025 2.904 1.044 1.00 0.00 H new ATOM 0 HG12 ILE A 492 13.939 0.781 -0.163 1.00 0.00 H new ATOM 0 HG13 ILE A 492 12.329 1.472 -0.151 1.00 0.00 H new ATOM 0 HG21 ILE A 492 11.984 3.902 0.044 1.00 0.00 H new ATOM 0 HG22 ILE A 492 13.361 5.025 -0.049 1.00 0.00 H new ATOM 0 HG23 ILE A 492 12.849 4.124 -1.496 1.00 0.00 H new ATOM 0 HD11 ILE A 492 12.903 0.626 -2.410 1.00 0.00 H new ATOM 0 HD12 ILE A 492 12.693 2.393 -2.443 1.00 0.00 H new ATOM 0 HD13 ILE A 492 14.328 1.691 -2.454 1.00 0.00 H new ATOM 2057 N LEU A 493 16.260 3.856 1.442 1.00 0.00 N ATOM 2058 CA LEU A 493 17.017 4.764 2.355 1.00 0.00 C ATOM 2059 C LEU A 493 18.304 5.247 1.665 1.00 0.00 C ATOM 2060 O LEU A 493 18.793 6.328 1.930 1.00 0.00 O ATOM 2061 CB LEU A 493 17.358 3.981 3.653 1.00 0.00 C ATOM 2062 CG LEU A 493 16.588 4.549 4.857 1.00 0.00 C ATOM 2063 CD1 LEU A 493 16.597 3.529 5.999 1.00 0.00 C ATOM 2064 CD2 LEU A 493 17.262 5.841 5.328 1.00 0.00 C ATOM 0 H LEU A 493 15.902 3.008 1.881 1.00 0.00 H new ATOM 0 HA LEU A 493 16.415 5.639 2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 493 17.110 2.928 3.522 1.00 0.00 H new ATOM 0 HB3 LEU A 493 18.430 4.035 3.844 1.00 0.00 H new ATOM 0 HG LEU A 493 15.559 4.757 4.563 1.00 0.00 H new ATOM 0 HD11 LEU A 493 16.051 3.933 6.852 1.00 0.00 H new ATOM 0 HD12 LEU A 493 16.121 2.607 5.667 1.00 0.00 H new ATOM 0 HD13 LEU A 493 17.626 3.321 6.293 1.00 0.00 H new ATOM 0 HD21 LEU A 493 16.718 6.245 6.181 1.00 0.00 H new ATOM 0 HD22 LEU A 493 18.290 5.629 5.621 1.00 0.00 H new ATOM 0 HD23 LEU A 493 17.258 6.570 4.517 1.00 0.00 H new ATOM 2076 N SER A 494 18.858 4.449 0.798 1.00 0.00 N ATOM 2077 CA SER A 494 20.120 4.846 0.105 1.00 0.00 C ATOM 2078 C SER A 494 19.809 5.704 -1.128 1.00 0.00 C ATOM 2079 O SER A 494 20.672 6.369 -1.660 1.00 0.00 O ATOM 2080 CB SER A 494 20.871 3.588 -0.325 1.00 0.00 C ATOM 2081 OG SER A 494 21.009 2.721 0.795 1.00 0.00 O ATOM 0 H SER A 494 18.492 3.534 0.536 1.00 0.00 H new ATOM 0 HA SER A 494 20.733 5.431 0.790 1.00 0.00 H new ATOM 0 HB2 SER A 494 20.331 3.084 -1.126 1.00 0.00 H new ATOM 0 HB3 SER A 494 21.852 3.852 -0.719 1.00 0.00 H new ATOM 0 HG SER A 494 20.595 1.856 0.592 1.00 0.00 H new