USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 677 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 404 LYS NZ :NH3+ -123:sc= 0.182 (180deg=0.0723) USER MOD Set 1.2: A 409 TYR OH : rot 110:sc= 0.189 USER MOD Single : A 379 SER OG : rot 14:sc= 0.416 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 389 LYS NZ :NH3+ -153:sc= -0.0684 (180deg=-0.452) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0.0297 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 415 MET CE :methyl 148:sc= -1.26 (180deg=-3.43!) USER MOD Single : A 417 THR OG1 : rot 180:sc= -0.0176 USER MOD Single : A 418 LYS NZ :NH3+ -121:sc= 0.105 (180deg=0) USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 428 THR OG1 : rot -170:sc= 0 USER MOD Single : A 431 GLN : amide:sc= -0.157 K(o=-0.16,f=-1) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.593 K(o=-0.59,f=-2.7!) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.403 X(o=-0.4,f=-0.4) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ -146:sc= -0.413 (180deg=-1.49!) USER MOD ----------------------------------------------------------------- ATOM 112 N SER A 379 3.659 24.634 -6.697 1.00 0.00 N ATOM 113 CA SER A 379 4.125 23.678 -5.696 1.00 0.00 C ATOM 114 C SER A 379 3.032 22.702 -5.296 1.00 0.00 C ATOM 115 O SER A 379 3.315 21.570 -4.903 1.00 0.00 O ATOM 116 CB SER A 379 4.667 24.405 -4.465 1.00 0.00 C ATOM 117 OG SER A 379 5.337 25.598 -4.830 1.00 0.00 O ATOM 0 HA SER A 379 4.933 23.102 -6.148 1.00 0.00 H new ATOM 0 HB2 SER A 379 3.847 24.638 -3.786 1.00 0.00 H new ATOM 0 HB3 SER A 379 5.351 23.751 -3.925 1.00 0.00 H new ATOM 0 HG SER A 379 5.121 25.823 -5.759 1.00 0.00 H new ATOM 123 N ILE A 380 1.787 23.124 -5.424 1.00 0.00 N ATOM 124 CA ILE A 380 0.669 22.260 -5.103 1.00 0.00 C ATOM 125 C ILE A 380 0.737 21.005 -5.967 1.00 0.00 C ATOM 126 O ILE A 380 0.299 19.928 -5.564 1.00 0.00 O ATOM 127 CB ILE A 380 -0.683 22.976 -5.310 1.00 0.00 C ATOM 128 CG1 ILE A 380 -0.832 24.107 -4.291 1.00 0.00 C ATOM 129 CG2 ILE A 380 -1.843 21.995 -5.190 1.00 0.00 C ATOM 130 CD1 ILE A 380 -0.926 23.622 -2.860 1.00 0.00 C ATOM 0 H ILE A 380 1.527 24.056 -5.747 1.00 0.00 H new ATOM 0 HA ILE A 380 0.737 21.989 -4.049 1.00 0.00 H new ATOM 0 HB ILE A 380 -0.703 23.397 -6.315 1.00 0.00 H new ATOM 0 HG12 ILE A 380 0.019 24.782 -4.382 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.725 24.685 -4.530 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -2.784 22.524 -5.340 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -1.740 21.216 -5.946 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.835 21.542 -4.199 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -1.030 24.477 -2.192 1.00 0.00 H new ATOM 0 HD12 ILE A 380 -1.793 22.970 -2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.023 23.069 -2.603 1.00 0.00 H new ATOM 142 N LYS A 381 1.299 21.158 -7.162 1.00 0.00 N ATOM 143 CA LYS A 381 1.434 20.044 -8.093 1.00 0.00 C ATOM 144 C LYS A 381 2.207 18.893 -7.455 1.00 0.00 C ATOM 145 O LYS A 381 1.952 17.725 -7.746 1.00 0.00 O ATOM 146 CB LYS A 381 2.140 20.500 -9.370 1.00 0.00 C ATOM 147 CG LYS A 381 1.314 21.457 -10.215 1.00 0.00 C ATOM 148 CD LYS A 381 1.520 21.208 -11.700 1.00 0.00 C ATOM 149 CE LYS A 381 2.681 22.023 -12.249 1.00 0.00 C ATOM 150 NZ LYS A 381 3.775 21.153 -12.765 1.00 0.00 N ATOM 0 H LYS A 381 1.668 22.043 -7.508 1.00 0.00 H new ATOM 0 HA LYS A 381 0.434 19.692 -8.346 1.00 0.00 H new ATOM 0 HB2 LYS A 381 3.080 20.983 -9.103 1.00 0.00 H new ATOM 0 HB3 LYS A 381 2.391 19.624 -9.969 1.00 0.00 H new ATOM 0 HG2 LYS A 381 0.258 21.343 -9.969 1.00 0.00 H new ATOM 0 HG3 LYS A 381 1.588 22.485 -9.976 1.00 0.00 H new ATOM 0 HD2 LYS A 381 1.707 20.148 -11.869 1.00 0.00 H new ATOM 0 HD3 LYS A 381 0.609 21.461 -12.242 1.00 0.00 H new ATOM 0 HE2 LYS A 381 2.324 22.670 -13.050 1.00 0.00 H new ATOM 0 HE3 LYS A 381 3.072 22.672 -11.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 4.547 21.746 -13.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 4.134 20.553 -11.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 3.409 20.552 -13.530 1.00 0.00 H new ATOM 164 N LYS A 382 3.159 19.232 -6.591 1.00 0.00 N ATOM 165 CA LYS A 382 3.971 18.223 -5.922 1.00 0.00 C ATOM 166 C LYS A 382 3.134 17.374 -4.985 1.00 0.00 C ATOM 167 O LYS A 382 3.294 16.155 -4.922 1.00 0.00 O ATOM 168 CB LYS A 382 5.125 18.878 -5.160 1.00 0.00 C ATOM 169 CG LYS A 382 6.451 18.830 -5.901 1.00 0.00 C ATOM 170 CD LYS A 382 7.566 19.474 -5.092 1.00 0.00 C ATOM 171 CE LYS A 382 8.454 18.430 -4.434 1.00 0.00 C ATOM 172 NZ LYS A 382 9.236 19.000 -3.302 1.00 0.00 N ATOM 0 H LYS A 382 3.386 20.194 -6.339 1.00 0.00 H new ATOM 0 HA LYS A 382 4.385 17.569 -6.689 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.870 19.918 -4.956 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.240 18.383 -4.196 1.00 0.00 H new ATOM 0 HG2 LYS A 382 6.710 17.794 -6.119 1.00 0.00 H new ATOM 0 HG3 LYS A 382 6.353 19.342 -6.858 1.00 0.00 H new ATOM 0 HD2 LYS A 382 8.169 20.108 -5.742 1.00 0.00 H new ATOM 0 HD3 LYS A 382 7.135 20.120 -4.327 1.00 0.00 H new ATOM 0 HE2 LYS A 382 7.839 17.606 -4.072 1.00 0.00 H new ATOM 0 HE3 LYS A 382 9.137 18.016 -5.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 9.829 18.257 -2.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 9.842 19.769 -3.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 8.584 19.373 -2.583 1.00 0.00 H new ATOM 186 N ILE A 383 2.232 18.019 -4.271 1.00 0.00 N ATOM 187 CA ILE A 383 1.357 17.305 -3.349 1.00 0.00 C ATOM 188 C ILE A 383 0.521 16.291 -4.125 1.00 0.00 C ATOM 189 O ILE A 383 0.215 15.207 -3.629 1.00 0.00 O ATOM 190 CB ILE A 383 0.448 18.266 -2.539 1.00 0.00 C ATOM 191 CG1 ILE A 383 0.040 17.615 -1.216 1.00 0.00 C ATOM 192 CG2 ILE A 383 -0.786 18.677 -3.332 1.00 0.00 C ATOM 193 CD1 ILE A 383 1.147 17.598 -0.184 1.00 0.00 C ATOM 0 H ILE A 383 2.083 19.027 -4.307 1.00 0.00 H new ATOM 0 HA ILE A 383 1.982 16.784 -2.624 1.00 0.00 H new ATOM 0 HB ILE A 383 1.020 19.170 -2.331 1.00 0.00 H new ATOM 0 HG12 ILE A 383 -0.818 18.148 -0.807 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.282 16.592 -1.408 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -1.397 19.350 -2.731 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -0.479 19.185 -4.246 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -1.366 17.790 -3.587 1.00 0.00 H new ATOM 0 HD11 ILE A 383 0.787 17.122 0.728 1.00 0.00 H new ATOM 0 HD12 ILE A 383 1.998 17.040 -0.573 1.00 0.00 H new ATOM 0 HD13 ILE A 383 1.454 18.620 0.037 1.00 0.00 H new ATOM 205 N ILE A 384 0.199 16.644 -5.369 1.00 0.00 N ATOM 206 CA ILE A 384 -0.557 15.751 -6.248 1.00 0.00 C ATOM 207 C ILE A 384 0.362 14.650 -6.735 1.00 0.00 C ATOM 208 O ILE A 384 0.005 13.471 -6.753 1.00 0.00 O ATOM 209 CB ILE A 384 -1.125 16.464 -7.501 1.00 0.00 C ATOM 210 CG1 ILE A 384 -1.179 17.978 -7.320 1.00 0.00 C ATOM 211 CG2 ILE A 384 -2.504 15.925 -7.837 1.00 0.00 C ATOM 212 CD1 ILE A 384 -2.125 18.420 -6.225 1.00 0.00 C ATOM 0 H ILE A 384 0.449 17.539 -5.790 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.394 15.371 -5.662 1.00 0.00 H new ATOM 0 HB ILE A 384 -0.448 16.256 -8.329 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -0.178 18.345 -7.095 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.483 18.438 -8.260 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -2.889 16.436 -8.719 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -2.438 14.856 -8.037 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -3.176 16.096 -6.996 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -2.114 19.507 -6.151 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -3.135 18.083 -6.459 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -1.809 17.989 -5.275 1.00 0.00 H new ATOM 224 N HIS A 385 1.558 15.064 -7.133 1.00 0.00 N ATOM 225 CA HIS A 385 2.569 14.138 -7.633 1.00 0.00 C ATOM 226 C HIS A 385 2.875 13.057 -6.600 1.00 0.00 C ATOM 227 O HIS A 385 2.881 11.867 -6.916 1.00 0.00 O ATOM 228 CB HIS A 385 3.849 14.894 -7.994 1.00 0.00 C ATOM 229 CG HIS A 385 4.475 14.432 -9.273 1.00 0.00 C ATOM 230 ND1 HIS A 385 5.307 13.340 -9.309 1.00 0.00 N ATOM 231 CD2 HIS A 385 4.361 14.945 -10.522 1.00 0.00 C ATOM 232 CE1 HIS A 385 5.678 13.211 -10.571 1.00 0.00 C ATOM 233 NE2 HIS A 385 5.131 14.160 -11.343 1.00 0.00 N ATOM 0 H HIS A 385 1.854 16.040 -7.119 1.00 0.00 H new ATOM 0 HA HIS A 385 2.175 13.657 -8.529 1.00 0.00 H new ATOM 0 HB2 HIS A 385 3.623 15.958 -8.073 1.00 0.00 H new ATOM 0 HB3 HIS A 385 4.570 14.780 -7.184 1.00 0.00 H new ATOM 0 HD2 HIS A 385 3.777 15.805 -10.815 1.00 0.00 H new ATOM 0 HE1 HIS A 385 6.339 12.438 -10.934 1.00 0.00 H new ATOM 0 HE2 HIS A 385 5.262 14.276 -12.348 1.00 0.00 H new ATOM 241 N VAL A 386 3.127 13.479 -5.366 1.00 0.00 N ATOM 242 CA VAL A 386 3.431 12.546 -4.289 1.00 0.00 C ATOM 243 C VAL A 386 2.239 11.637 -4.005 1.00 0.00 C ATOM 244 O VAL A 386 2.405 10.453 -3.712 1.00 0.00 O ATOM 245 CB VAL A 386 3.823 13.289 -2.995 1.00 0.00 C ATOM 246 CG1 VAL A 386 2.679 14.168 -2.513 1.00 0.00 C ATOM 247 CG2 VAL A 386 4.240 12.302 -1.915 1.00 0.00 C ATOM 0 H VAL A 386 3.127 14.460 -5.087 1.00 0.00 H new ATOM 0 HA VAL A 386 4.276 11.941 -4.617 1.00 0.00 H new ATOM 0 HB VAL A 386 4.675 13.932 -3.214 1.00 0.00 H new ATOM 0 HG11 VAL A 386 2.976 14.683 -1.599 1.00 0.00 H new ATOM 0 HG12 VAL A 386 2.436 14.902 -3.281 1.00 0.00 H new ATOM 0 HG13 VAL A 386 1.804 13.549 -2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.513 12.846 -1.011 1.00 0.00 H new ATOM 0 HG22 VAL A 386 3.411 11.629 -1.698 1.00 0.00 H new ATOM 0 HG23 VAL A 386 5.096 11.723 -2.262 1.00 0.00 H new ATOM 257 N LEU A 387 1.038 12.199 -4.095 1.00 0.00 N ATOM 258 CA LEU A 387 -0.178 11.439 -3.850 1.00 0.00 C ATOM 259 C LEU A 387 -0.385 10.392 -4.935 1.00 0.00 C ATOM 260 O LEU A 387 -0.819 9.274 -4.660 1.00 0.00 O ATOM 261 CB LEU A 387 -1.384 12.377 -3.784 1.00 0.00 C ATOM 262 CG LEU A 387 -2.667 11.734 -3.256 1.00 0.00 C ATOM 263 CD1 LEU A 387 -2.855 12.050 -1.780 1.00 0.00 C ATOM 264 CD2 LEU A 387 -3.870 12.201 -4.063 1.00 0.00 C ATOM 0 H LEU A 387 0.883 13.178 -4.336 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.077 10.928 -2.893 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.132 13.226 -3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.576 12.771 -4.782 1.00 0.00 H new ATOM 0 HG LEU A 387 -2.580 10.653 -3.366 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -3.773 11.584 -1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -2.007 11.663 -1.214 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -2.919 13.130 -1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -4.774 11.733 -3.673 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -3.961 13.285 -3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -3.738 11.920 -5.108 1.00 0.00 H new ATOM 276 N GLU A 388 -0.051 10.757 -6.163 1.00 0.00 N ATOM 277 CA GLU A 388 -0.177 9.846 -7.290 1.00 0.00 C ATOM 278 C GLU A 388 0.737 8.644 -7.085 1.00 0.00 C ATOM 279 O GLU A 388 0.408 7.523 -7.473 1.00 0.00 O ATOM 280 CB GLU A 388 0.171 10.562 -8.599 1.00 0.00 C ATOM 281 CG GLU A 388 -0.998 10.665 -9.563 1.00 0.00 C ATOM 282 CD GLU A 388 -1.475 12.092 -9.755 1.00 0.00 C ATOM 283 OE1 GLU A 388 -2.244 12.581 -8.901 1.00 0.00 O ATOM 284 OE2 GLU A 388 -1.078 12.721 -10.758 1.00 0.00 O ATOM 0 H GLU A 388 0.310 11.680 -6.405 1.00 0.00 H new ATOM 0 HA GLU A 388 -1.209 9.502 -7.352 1.00 0.00 H new ATOM 0 HB2 GLU A 388 0.532 11.565 -8.370 1.00 0.00 H new ATOM 0 HB3 GLU A 388 0.989 10.032 -9.087 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -0.705 10.251 -10.528 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -1.824 10.057 -9.193 1.00 0.00 H new ATOM 291 N LYS A 389 1.890 8.893 -6.470 1.00 0.00 N ATOM 292 CA LYS A 389 2.861 7.837 -6.208 1.00 0.00 C ATOM 293 C LYS A 389 2.319 6.847 -5.183 1.00 0.00 C ATOM 294 O LYS A 389 2.428 5.633 -5.359 1.00 0.00 O ATOM 295 CB LYS A 389 4.179 8.437 -5.713 1.00 0.00 C ATOM 296 CG LYS A 389 5.411 7.783 -6.321 1.00 0.00 C ATOM 297 CD LYS A 389 6.440 7.428 -5.258 1.00 0.00 C ATOM 298 CE LYS A 389 7.579 8.435 -5.229 1.00 0.00 C ATOM 299 NZ LYS A 389 8.369 8.419 -6.492 1.00 0.00 N ATOM 0 H LYS A 389 2.174 9.817 -6.144 1.00 0.00 H new ATOM 0 HA LYS A 389 3.044 7.303 -7.141 1.00 0.00 H new ATOM 0 HB2 LYS A 389 4.193 9.502 -5.943 1.00 0.00 H new ATOM 0 HB3 LYS A 389 4.226 8.344 -4.628 1.00 0.00 H new ATOM 0 HG2 LYS A 389 5.117 6.882 -6.859 1.00 0.00 H new ATOM 0 HG3 LYS A 389 5.859 8.458 -7.051 1.00 0.00 H new ATOM 0 HD2 LYS A 389 5.958 7.393 -4.281 1.00 0.00 H new ATOM 0 HD3 LYS A 389 6.838 6.432 -5.453 1.00 0.00 H new ATOM 0 HE2 LYS A 389 7.176 9.434 -5.066 1.00 0.00 H new ATOM 0 HE3 LYS A 389 8.236 8.215 -4.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 9.341 8.733 -6.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 8.388 7.453 -6.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 7.930 9.059 -7.184 1.00 0.00 H new ATOM 313 N VAL A 390 1.722 7.372 -4.117 1.00 0.00 N ATOM 314 CA VAL A 390 1.151 6.530 -3.075 1.00 0.00 C ATOM 315 C VAL A 390 0.013 5.689 -3.637 1.00 0.00 C ATOM 316 O VAL A 390 -0.177 4.537 -3.251 1.00 0.00 O ATOM 317 CB VAL A 390 0.624 7.368 -1.893 1.00 0.00 C ATOM 318 CG1 VAL A 390 0.175 6.466 -0.754 1.00 0.00 C ATOM 319 CG2 VAL A 390 1.686 8.350 -1.418 1.00 0.00 C ATOM 0 H VAL A 390 1.622 8.374 -3.954 1.00 0.00 H new ATOM 0 HA VAL A 390 1.947 5.880 -2.712 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.240 7.939 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -0.193 7.077 0.070 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -0.621 5.809 -1.103 1.00 0.00 H new ATOM 0 HG13 VAL A 390 1.018 5.865 -0.412 1.00 0.00 H new ATOM 0 HG21 VAL A 390 1.296 8.932 -0.583 1.00 0.00 H new ATOM 0 HG22 VAL A 390 2.571 7.801 -1.095 1.00 0.00 H new ATOM 0 HG23 VAL A 390 1.953 9.020 -2.235 1.00 0.00 H new ATOM 329 N GLN A 391 -0.737 6.281 -4.561 1.00 0.00 N ATOM 330 CA GLN A 391 -1.857 5.600 -5.199 1.00 0.00 C ATOM 331 C GLN A 391 -1.379 4.339 -5.912 1.00 0.00 C ATOM 332 O GLN A 391 -2.031 3.295 -5.857 1.00 0.00 O ATOM 333 CB GLN A 391 -2.538 6.549 -6.188 1.00 0.00 C ATOM 334 CG GLN A 391 -3.661 5.914 -6.991 1.00 0.00 C ATOM 335 CD GLN A 391 -3.699 6.417 -8.412 1.00 0.00 C ATOM 336 OE1 GLN A 391 -3.286 5.728 -9.345 1.00 0.00 O ATOM 337 NE2 GLN A 391 -4.201 7.631 -8.581 1.00 0.00 N ATOM 0 H GLN A 391 -0.588 7.236 -4.886 1.00 0.00 H new ATOM 0 HA GLN A 391 -2.577 5.306 -4.435 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.937 7.402 -5.639 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -1.788 6.936 -6.878 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -3.536 4.831 -6.994 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -4.615 6.124 -6.507 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -4.531 8.163 -7.776 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -4.258 8.034 -9.516 1.00 0.00 H new ATOM 346 N TYR A 392 -0.232 4.442 -6.576 1.00 0.00 N ATOM 347 CA TYR A 392 0.339 3.309 -7.292 1.00 0.00 C ATOM 348 C TYR A 392 0.659 2.177 -6.322 1.00 0.00 C ATOM 349 O TYR A 392 0.388 1.008 -6.603 1.00 0.00 O ATOM 350 CB TYR A 392 1.606 3.735 -8.039 1.00 0.00 C ATOM 351 CG TYR A 392 1.710 3.157 -9.433 1.00 0.00 C ATOM 352 CD1 TYR A 392 0.639 3.227 -10.316 1.00 0.00 C ATOM 353 CD2 TYR A 392 2.879 2.545 -9.866 1.00 0.00 C ATOM 354 CE1 TYR A 392 0.730 2.702 -11.590 1.00 0.00 C ATOM 355 CE2 TYR A 392 2.977 2.017 -11.140 1.00 0.00 C ATOM 356 CZ TYR A 392 1.900 2.098 -11.998 1.00 0.00 C ATOM 357 OH TYR A 392 1.994 1.574 -13.266 1.00 0.00 O ATOM 0 H TYR A 392 0.319 5.298 -6.633 1.00 0.00 H new ATOM 0 HA TYR A 392 -0.393 2.954 -8.017 1.00 0.00 H new ATOM 0 HB2 TYR A 392 1.632 4.823 -8.103 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.478 3.429 -7.462 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -0.279 3.700 -10.001 1.00 0.00 H new ATOM 0 HD2 TYR A 392 3.725 2.481 -9.197 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -0.112 2.764 -12.264 1.00 0.00 H new ATOM 0 HE2 TYR A 392 3.893 1.543 -11.462 1.00 0.00 H new ATOM 0 HH TYR A 392 2.885 1.186 -13.394 1.00 0.00 H new ATOM 367 N LEU A 393 1.228 2.534 -5.176 1.00 0.00 N ATOM 368 CA LEU A 393 1.576 1.552 -4.156 1.00 0.00 C ATOM 369 C LEU A 393 0.337 0.780 -3.715 1.00 0.00 C ATOM 370 O LEU A 393 0.396 -0.425 -3.470 1.00 0.00 O ATOM 371 CB LEU A 393 2.227 2.242 -2.954 1.00 0.00 C ATOM 372 CG LEU A 393 3.685 1.851 -2.696 1.00 0.00 C ATOM 373 CD1 LEU A 393 4.577 3.084 -2.674 1.00 0.00 C ATOM 374 CD2 LEU A 393 3.809 1.080 -1.390 1.00 0.00 C ATOM 0 H LEU A 393 1.458 3.497 -4.930 1.00 0.00 H new ATOM 0 HA LEU A 393 2.290 0.848 -4.583 1.00 0.00 H new ATOM 0 HB2 LEU A 393 2.176 3.321 -3.102 1.00 0.00 H new ATOM 0 HB3 LEU A 393 1.642 2.015 -2.063 1.00 0.00 H new ATOM 0 HG LEU A 393 4.014 1.205 -3.510 1.00 0.00 H new ATOM 0 HD11 LEU A 393 5.608 2.784 -2.489 1.00 0.00 H new ATOM 0 HD12 LEU A 393 4.514 3.595 -3.635 1.00 0.00 H new ATOM 0 HD13 LEU A 393 4.248 3.757 -1.882 1.00 0.00 H new ATOM 0 HD21 LEU A 393 4.852 0.811 -1.224 1.00 0.00 H new ATOM 0 HD22 LEU A 393 3.459 1.702 -0.566 1.00 0.00 H new ATOM 0 HD23 LEU A 393 3.205 0.174 -1.443 1.00 0.00 H new ATOM 386 N GLU A 394 -0.787 1.486 -3.622 1.00 0.00 N ATOM 387 CA GLU A 394 -2.046 0.870 -3.221 1.00 0.00 C ATOM 388 C GLU A 394 -2.426 -0.247 -4.187 1.00 0.00 C ATOM 389 O GLU A 394 -2.865 -1.319 -3.771 1.00 0.00 O ATOM 390 CB GLU A 394 -3.157 1.923 -3.170 1.00 0.00 C ATOM 391 CG GLU A 394 -4.538 1.344 -2.899 1.00 0.00 C ATOM 392 CD GLU A 394 -5.415 2.275 -2.082 1.00 0.00 C ATOM 393 OE1 GLU A 394 -4.909 3.321 -1.625 1.00 0.00 O ATOM 394 OE2 GLU A 394 -6.609 1.955 -1.898 1.00 0.00 O ATOM 0 H GLU A 394 -0.850 2.485 -3.819 1.00 0.00 H new ATOM 0 HA GLU A 394 -1.920 0.441 -2.227 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -2.920 2.651 -2.394 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -3.178 2.462 -4.117 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -5.029 1.129 -3.848 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -4.433 0.396 -2.372 1.00 0.00 H new ATOM 401 N GLN A 395 -2.250 0.012 -5.478 1.00 0.00 N ATOM 402 CA GLN A 395 -2.570 -0.972 -6.506 1.00 0.00 C ATOM 403 C GLN A 395 -1.780 -2.259 -6.288 1.00 0.00 C ATOM 404 O GLN A 395 -2.309 -3.359 -6.443 1.00 0.00 O ATOM 405 CB GLN A 395 -2.274 -0.403 -7.896 1.00 0.00 C ATOM 406 CG GLN A 395 -3.389 -0.638 -8.900 1.00 0.00 C ATOM 407 CD GLN A 395 -3.587 0.536 -9.838 1.00 0.00 C ATOM 408 OE1 GLN A 395 -4.585 1.251 -9.756 1.00 0.00 O ATOM 409 NE2 GLN A 395 -2.631 0.742 -10.738 1.00 0.00 N ATOM 0 H GLN A 395 -1.888 0.895 -5.838 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.633 -1.204 -6.437 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -2.094 0.669 -7.810 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -1.355 -0.851 -8.275 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.165 -1.531 -9.484 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -4.319 -0.832 -8.366 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -1.820 0.124 -10.771 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -2.708 1.518 -11.396 1.00 0.00 H new ATOM 418 N GLU A 396 -0.509 -2.111 -5.926 1.00 0.00 N ATOM 419 CA GLU A 396 0.356 -3.262 -5.684 1.00 0.00 C ATOM 420 C GLU A 396 -0.067 -4.007 -4.422 1.00 0.00 C ATOM 421 O GLU A 396 -0.141 -5.236 -4.414 1.00 0.00 O ATOM 422 CB GLU A 396 1.814 -2.813 -5.562 1.00 0.00 C ATOM 423 CG GLU A 396 2.432 -2.386 -6.883 1.00 0.00 C ATOM 424 CD GLU A 396 2.803 -3.564 -7.762 1.00 0.00 C ATOM 425 OE1 GLU A 396 3.527 -4.459 -7.279 1.00 0.00 O ATOM 426 OE2 GLU A 396 2.369 -3.592 -8.932 1.00 0.00 O ATOM 0 H GLU A 396 -0.055 -1.207 -5.794 1.00 0.00 H new ATOM 0 HA GLU A 396 0.261 -3.941 -6.532 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.872 -1.983 -4.858 1.00 0.00 H new ATOM 0 HB3 GLU A 396 2.403 -3.629 -5.142 1.00 0.00 H new ATOM 0 HG2 GLU A 396 1.731 -1.745 -7.418 1.00 0.00 H new ATOM 0 HG3 GLU A 396 3.323 -1.789 -6.687 1.00 0.00 H new ATOM 433 N VAL A 397 -0.349 -3.259 -3.361 1.00 0.00 N ATOM 434 CA VAL A 397 -0.770 -3.858 -2.099 1.00 0.00 C ATOM 435 C VAL A 397 -2.060 -4.647 -2.286 1.00 0.00 C ATOM 436 O VAL A 397 -2.271 -5.674 -1.641 1.00 0.00 O ATOM 437 CB VAL A 397 -0.984 -2.792 -1.007 1.00 0.00 C ATOM 438 CG1 VAL A 397 -1.335 -3.448 0.320 1.00 0.00 C ATOM 439 CG2 VAL A 397 0.252 -1.916 -0.868 1.00 0.00 C ATOM 0 H VAL A 397 -0.294 -2.241 -3.349 1.00 0.00 H new ATOM 0 HA VAL A 397 0.028 -4.528 -1.779 1.00 0.00 H new ATOM 0 HB VAL A 397 -1.820 -2.158 -1.303 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -1.482 -2.679 1.078 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -2.251 -4.028 0.208 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -0.523 -4.108 0.626 1.00 0.00 H new ATOM 0 HG21 VAL A 397 0.083 -1.169 -0.093 1.00 0.00 H new ATOM 0 HG22 VAL A 397 1.107 -2.534 -0.596 1.00 0.00 H new ATOM 0 HG23 VAL A 397 0.452 -1.416 -1.816 1.00 0.00 H new ATOM 449 N GLU A 398 -2.914 -4.166 -3.185 1.00 0.00 N ATOM 450 CA GLU A 398 -4.178 -4.834 -3.471 1.00 0.00 C ATOM 451 C GLU A 398 -3.921 -6.271 -3.905 1.00 0.00 C ATOM 452 O GLU A 398 -4.689 -7.179 -3.589 1.00 0.00 O ATOM 453 CB GLU A 398 -4.944 -4.083 -4.563 1.00 0.00 C ATOM 454 CG GLU A 398 -6.439 -3.987 -4.301 1.00 0.00 C ATOM 455 CD GLU A 398 -7.222 -3.590 -5.537 1.00 0.00 C ATOM 456 OE1 GLU A 398 -7.266 -2.382 -5.850 1.00 0.00 O ATOM 457 OE2 GLU A 398 -7.791 -4.489 -6.193 1.00 0.00 O ATOM 0 H GLU A 398 -2.753 -3.317 -3.727 1.00 0.00 H new ATOM 0 HA GLU A 398 -4.783 -4.840 -2.564 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -4.535 -3.077 -4.656 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -4.782 -4.583 -5.518 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -6.803 -4.948 -3.938 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -6.620 -3.258 -3.511 1.00 0.00 H new ATOM 464 N GLU A 399 -2.816 -6.464 -4.616 1.00 0.00 N ATOM 465 CA GLU A 399 -2.425 -7.785 -5.084 1.00 0.00 C ATOM 466 C GLU A 399 -1.545 -8.462 -4.040 1.00 0.00 C ATOM 467 O GLU A 399 -1.946 -9.441 -3.413 1.00 0.00 O ATOM 468 CB GLU A 399 -1.668 -7.676 -6.410 1.00 0.00 C ATOM 469 CG GLU A 399 -1.927 -8.838 -7.354 1.00 0.00 C ATOM 470 CD GLU A 399 -1.199 -8.688 -8.675 1.00 0.00 C ATOM 471 OE1 GLU A 399 0.033 -8.487 -8.655 1.00 0.00 O ATOM 472 OE2 GLU A 399 -1.862 -8.773 -9.731 1.00 0.00 O ATOM 0 H GLU A 399 -2.173 -5.717 -4.881 1.00 0.00 H new ATOM 0 HA GLU A 399 -3.323 -8.383 -5.241 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -1.950 -6.747 -6.905 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -0.599 -7.616 -6.205 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -1.616 -9.767 -6.875 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -2.998 -8.918 -7.540 1.00 0.00 H new ATOM 479 N PHE A 400 -0.349 -7.908 -3.856 1.00 0.00 N ATOM 480 CA PHE A 400 0.618 -8.413 -2.883 1.00 0.00 C ATOM 481 C PHE A 400 0.726 -9.931 -2.892 1.00 0.00 C ATOM 482 O PHE A 400 -0.189 -10.638 -2.471 1.00 0.00 O ATOM 483 CB PHE A 400 0.260 -7.942 -1.476 1.00 0.00 C ATOM 484 CG PHE A 400 1.351 -8.178 -0.474 1.00 0.00 C ATOM 485 CD1 PHE A 400 2.674 -7.936 -0.805 1.00 0.00 C ATOM 486 CD2 PHE A 400 1.055 -8.638 0.798 1.00 0.00 C ATOM 487 CE1 PHE A 400 3.683 -8.148 0.114 1.00 0.00 C ATOM 488 CE2 PHE A 400 2.058 -8.853 1.723 1.00 0.00 C ATOM 489 CZ PHE A 400 3.375 -8.608 1.380 1.00 0.00 C ATOM 0 H PHE A 400 -0.022 -7.095 -4.378 1.00 0.00 H new ATOM 0 HA PHE A 400 1.587 -8.010 -3.177 1.00 0.00 H new ATOM 0 HB2 PHE A 400 0.028 -6.877 -1.505 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -0.643 -8.457 -1.147 1.00 0.00 H new ATOM 0 HD1 PHE A 400 2.920 -7.577 -1.794 1.00 0.00 H new ATOM 0 HD2 PHE A 400 0.028 -8.831 1.070 1.00 0.00 H new ATOM 0 HE1 PHE A 400 4.711 -7.955 -0.156 1.00 0.00 H new ATOM 0 HE2 PHE A 400 1.814 -9.212 2.712 1.00 0.00 H new ATOM 0 HZ PHE A 400 4.162 -8.776 2.101 1.00 0.00 H new ATOM 499 N VAL A 401 1.871 -10.424 -3.338 1.00 0.00 N ATOM 500 CA VAL A 401 2.119 -11.854 -3.364 1.00 0.00 C ATOM 501 C VAL A 401 2.882 -12.278 -2.113 1.00 0.00 C ATOM 502 O VAL A 401 3.563 -13.303 -2.108 1.00 0.00 O ATOM 503 CB VAL A 401 2.921 -12.267 -4.612 1.00 0.00 C ATOM 504 CG1 VAL A 401 2.048 -12.195 -5.856 1.00 0.00 C ATOM 505 CG2 VAL A 401 4.156 -11.392 -4.766 1.00 0.00 C ATOM 0 H VAL A 401 2.642 -9.854 -3.686 1.00 0.00 H new ATOM 0 HA VAL A 401 1.151 -12.354 -3.395 1.00 0.00 H new ATOM 0 HB VAL A 401 3.249 -13.299 -4.486 1.00 0.00 H new ATOM 0 HG11 VAL A 401 2.632 -12.490 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 401 1.198 -12.868 -5.743 1.00 0.00 H new ATOM 0 HG13 VAL A 401 1.688 -11.175 -5.989 1.00 0.00 H new ATOM 0 HG21 VAL A 401 4.711 -11.698 -5.653 1.00 0.00 H new ATOM 0 HG22 VAL A 401 3.853 -10.350 -4.869 1.00 0.00 H new ATOM 0 HG23 VAL A 401 4.790 -11.500 -3.886 1.00 0.00 H new ATOM 515 N GLY A 402 2.764 -11.478 -1.049 1.00 0.00 N ATOM 516 CA GLY A 402 3.450 -11.788 0.183 1.00 0.00 C ATOM 517 C GLY A 402 2.605 -12.614 1.126 1.00 0.00 C ATOM 518 O GLY A 402 1.530 -13.090 0.760 1.00 0.00 O ATOM 0 H GLY A 402 2.205 -10.625 -1.027 1.00 0.00 H new ATOM 0 HA2 GLY A 402 4.369 -12.328 -0.043 1.00 0.00 H new ATOM 0 HA3 GLY A 402 3.739 -10.860 0.677 1.00 0.00 H new ATOM 522 N LYS A 403 3.100 -12.786 2.340 1.00 0.00 N ATOM 523 CA LYS A 403 2.393 -13.569 3.355 1.00 0.00 C ATOM 524 C LYS A 403 2.369 -12.854 4.702 1.00 0.00 C ATOM 525 O LYS A 403 3.341 -12.210 5.087 1.00 0.00 O ATOM 526 CB LYS A 403 3.043 -14.945 3.508 1.00 0.00 C ATOM 527 CG LYS A 403 2.916 -15.817 2.269 1.00 0.00 C ATOM 528 CD LYS A 403 3.975 -15.475 1.233 1.00 0.00 C ATOM 529 CE LYS A 403 4.954 -16.621 1.034 1.00 0.00 C ATOM 530 NZ LYS A 403 5.831 -16.403 -0.150 1.00 0.00 N ATOM 0 H LYS A 403 3.989 -12.396 2.653 1.00 0.00 H new ATOM 0 HA LYS A 403 1.363 -13.689 3.020 1.00 0.00 H new ATOM 0 HB2 LYS A 403 4.099 -14.815 3.744 1.00 0.00 H new ATOM 0 HB3 LYS A 403 2.588 -15.461 4.354 1.00 0.00 H new ATOM 0 HG2 LYS A 403 3.007 -16.866 2.551 1.00 0.00 H new ATOM 0 HG3 LYS A 403 1.925 -15.689 1.833 1.00 0.00 H new ATOM 0 HD2 LYS A 403 3.494 -15.238 0.284 1.00 0.00 H new ATOM 0 HD3 LYS A 403 4.517 -14.583 1.547 1.00 0.00 H new ATOM 0 HE2 LYS A 403 5.570 -16.731 1.927 1.00 0.00 H new ATOM 0 HE3 LYS A 403 4.402 -17.553 0.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 6.484 -17.206 -0.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 5.245 -16.323 -1.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 6.377 -15.527 -0.021 1.00 0.00 H new ATOM 544 N LYS A 404 1.262 -12.994 5.426 1.00 0.00 N ATOM 545 CA LYS A 404 1.119 -12.375 6.741 1.00 0.00 C ATOM 546 C LYS A 404 2.262 -12.779 7.669 1.00 0.00 C ATOM 547 O LYS A 404 2.597 -12.054 8.606 1.00 0.00 O ATOM 548 CB LYS A 404 -0.221 -12.767 7.367 1.00 0.00 C ATOM 549 CG LYS A 404 -0.918 -11.619 8.080 1.00 0.00 C ATOM 550 CD LYS A 404 -1.217 -11.960 9.532 1.00 0.00 C ATOM 551 CE LYS A 404 -2.599 -11.480 9.944 1.00 0.00 C ATOM 552 NZ LYS A 404 -2.747 -10.007 9.783 1.00 0.00 N ATOM 0 H LYS A 404 0.449 -13.532 5.124 1.00 0.00 H new ATOM 0 HA LYS A 404 1.152 -11.294 6.608 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -0.878 -13.152 6.587 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -0.058 -13.579 8.076 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -0.291 -10.729 8.037 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -1.847 -11.380 7.563 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -1.148 -13.038 9.675 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -0.465 -11.504 10.176 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -3.354 -11.988 9.344 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -2.783 -11.752 10.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -3.016 -9.583 10.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -1.844 -9.600 9.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -3.485 -9.807 9.078 1.00 0.00 H new ATOM 566 N THR A 405 2.857 -13.938 7.406 1.00 0.00 N ATOM 567 CA THR A 405 3.961 -14.433 8.222 1.00 0.00 C ATOM 568 C THR A 405 5.309 -14.189 7.545 1.00 0.00 C ATOM 569 O THR A 405 6.355 -14.546 8.086 1.00 0.00 O ATOM 570 CB THR A 405 3.783 -15.927 8.502 1.00 0.00 C ATOM 571 OG1 THR A 405 3.097 -16.558 7.435 1.00 0.00 O ATOM 572 CG2 THR A 405 3.016 -16.212 9.774 1.00 0.00 C ATOM 0 H THR A 405 2.594 -14.552 6.635 1.00 0.00 H new ATOM 0 HA THR A 405 3.950 -13.884 9.164 1.00 0.00 H new ATOM 0 HB THR A 405 4.793 -16.322 8.612 1.00 0.00 H new ATOM 0 HG1 THR A 405 2.994 -17.513 7.631 1.00 0.00 H new ATOM 0 HG21 THR A 405 2.927 -17.290 9.911 1.00 0.00 H new ATOM 0 HG22 THR A 405 3.546 -15.781 10.623 1.00 0.00 H new ATOM 0 HG23 THR A 405 2.021 -15.771 9.706 1.00 0.00 H new ATOM 580 N ASP A 406 5.282 -13.579 6.363 1.00 0.00 N ATOM 581 CA ASP A 406 6.506 -13.292 5.627 1.00 0.00 C ATOM 582 C ASP A 406 7.023 -11.900 5.967 1.00 0.00 C ATOM 583 O ASP A 406 6.246 -10.997 6.276 1.00 0.00 O ATOM 584 CB ASP A 406 6.261 -13.404 4.121 1.00 0.00 C ATOM 585 CG ASP A 406 6.578 -14.787 3.585 1.00 0.00 C ATOM 586 OD1 ASP A 406 6.562 -15.750 4.379 1.00 0.00 O ATOM 587 OD2 ASP A 406 6.842 -14.906 2.369 1.00 0.00 O ATOM 0 H ASP A 406 4.427 -13.275 5.897 1.00 0.00 H new ATOM 0 HA ASP A 406 7.259 -14.025 5.918 1.00 0.00 H new ATOM 0 HB2 ASP A 406 5.220 -13.164 3.906 1.00 0.00 H new ATOM 0 HB3 ASP A 406 6.872 -12.667 3.600 1.00 0.00 H new ATOM 592 N LYS A 407 8.339 -11.731 5.911 1.00 0.00 N ATOM 593 CA LYS A 407 8.954 -10.446 6.216 1.00 0.00 C ATOM 594 C LYS A 407 8.470 -9.373 5.255 1.00 0.00 C ATOM 595 O LYS A 407 8.386 -8.197 5.610 1.00 0.00 O ATOM 596 CB LYS A 407 10.480 -10.553 6.161 1.00 0.00 C ATOM 597 CG LYS A 407 11.004 -11.118 4.851 1.00 0.00 C ATOM 598 CD LYS A 407 11.381 -10.010 3.879 1.00 0.00 C ATOM 599 CE LYS A 407 11.886 -10.571 2.558 1.00 0.00 C ATOM 600 NZ LYS A 407 13.259 -10.090 2.240 1.00 0.00 N ATOM 0 H LYS A 407 8.999 -12.466 5.658 1.00 0.00 H new ATOM 0 HA LYS A 407 8.659 -10.163 7.226 1.00 0.00 H new ATOM 0 HB2 LYS A 407 10.911 -9.564 6.319 1.00 0.00 H new ATOM 0 HB3 LYS A 407 10.821 -11.184 6.982 1.00 0.00 H new ATOM 0 HG2 LYS A 407 11.874 -11.745 5.046 1.00 0.00 H new ATOM 0 HG3 LYS A 407 10.245 -11.757 4.400 1.00 0.00 H new ATOM 0 HD2 LYS A 407 10.514 -9.374 3.697 1.00 0.00 H new ATOM 0 HD3 LYS A 407 12.150 -9.380 4.325 1.00 0.00 H new ATOM 0 HE2 LYS A 407 11.884 -11.660 2.601 1.00 0.00 H new ATOM 0 HE3 LYS A 407 11.205 -10.282 1.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 13.567 -10.494 1.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 13.257 -9.052 2.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 13.914 -10.387 2.991 1.00 0.00 H new ATOM 614 N ALA A 408 8.148 -9.786 4.042 1.00 0.00 N ATOM 615 CA ALA A 408 7.666 -8.868 3.029 1.00 0.00 C ATOM 616 C ALA A 408 6.348 -8.229 3.450 1.00 0.00 C ATOM 617 O ALA A 408 6.030 -7.117 3.034 1.00 0.00 O ATOM 618 CB ALA A 408 7.506 -9.586 1.698 1.00 0.00 C ATOM 0 H ALA A 408 8.213 -10.757 3.735 1.00 0.00 H new ATOM 0 HA ALA A 408 8.404 -8.074 2.913 1.00 0.00 H new ATOM 0 HB1 ALA A 408 7.143 -8.884 0.947 1.00 0.00 H new ATOM 0 HB2 ALA A 408 8.469 -9.988 1.384 1.00 0.00 H new ATOM 0 HB3 ALA A 408 6.791 -10.401 1.808 1.00 0.00 H new ATOM 624 N TYR A 409 5.564 -8.950 4.251 1.00 0.00 N ATOM 625 CA TYR A 409 4.265 -8.446 4.685 1.00 0.00 C ATOM 626 C TYR A 409 4.385 -7.274 5.659 1.00 0.00 C ATOM 627 O TYR A 409 3.701 -6.266 5.480 1.00 0.00 O ATOM 628 CB TYR A 409 3.452 -9.584 5.308 1.00 0.00 C ATOM 629 CG TYR A 409 2.337 -9.131 6.223 1.00 0.00 C ATOM 630 CD1 TYR A 409 2.596 -8.776 7.540 1.00 0.00 C ATOM 631 CD2 TYR A 409 1.027 -9.064 5.768 1.00 0.00 C ATOM 632 CE1 TYR A 409 1.578 -8.366 8.379 1.00 0.00 C ATOM 633 CE2 TYR A 409 0.004 -8.656 6.599 1.00 0.00 C ATOM 634 CZ TYR A 409 0.283 -8.309 7.904 1.00 0.00 C ATOM 635 OH TYR A 409 -0.733 -7.900 8.737 1.00 0.00 O ATOM 0 H TYR A 409 5.803 -9.875 4.608 1.00 0.00 H new ATOM 0 HA TYR A 409 3.748 -8.066 3.804 1.00 0.00 H new ATOM 0 HB2 TYR A 409 3.025 -10.189 4.508 1.00 0.00 H new ATOM 0 HB3 TYR A 409 4.126 -10.230 5.870 1.00 0.00 H new ATOM 0 HD1 TYR A 409 3.608 -8.821 7.914 1.00 0.00 H new ATOM 0 HD2 TYR A 409 0.805 -9.336 4.747 1.00 0.00 H new ATOM 0 HE1 TYR A 409 1.794 -8.092 9.401 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -1.010 -8.609 6.229 1.00 0.00 H new ATOM 0 HH TYR A 409 -1.055 -7.019 8.453 1.00 0.00 H new ATOM 645 N TRP A 410 5.260 -7.362 6.664 1.00 0.00 N ATOM 646 CA TRP A 410 5.408 -6.230 7.570 1.00 0.00 C ATOM 647 C TRP A 410 6.145 -5.115 6.850 1.00 0.00 C ATOM 648 O TRP A 410 5.899 -3.935 7.088 1.00 0.00 O ATOM 649 CB TRP A 410 6.084 -6.577 8.906 1.00 0.00 C ATOM 650 CG TRP A 410 7.147 -7.625 8.870 1.00 0.00 C ATOM 651 CD1 TRP A 410 6.977 -8.962 9.067 1.00 0.00 C ATOM 652 CD2 TRP A 410 8.551 -7.416 8.688 1.00 0.00 C ATOM 653 NE1 TRP A 410 8.188 -9.601 9.015 1.00 0.00 N ATOM 654 CE2 TRP A 410 9.171 -8.674 8.774 1.00 0.00 C ATOM 655 CE3 TRP A 410 9.343 -6.288 8.452 1.00 0.00 C ATOM 656 CZ2 TRP A 410 10.547 -8.837 8.637 1.00 0.00 C ATOM 657 CZ3 TRP A 410 10.708 -6.450 8.315 1.00 0.00 C ATOM 658 CH2 TRP A 410 11.299 -7.717 8.406 1.00 0.00 C ATOM 0 H TRP A 410 5.851 -8.169 6.863 1.00 0.00 H new ATOM 0 HA TRP A 410 4.405 -5.904 7.846 1.00 0.00 H new ATOM 0 HB2 TRP A 410 6.520 -5.665 9.313 1.00 0.00 H new ATOM 0 HB3 TRP A 410 5.312 -6.900 9.604 1.00 0.00 H new ATOM 0 HD1 TRP A 410 6.027 -9.447 9.239 1.00 0.00 H new ATOM 0 HE1 TRP A 410 8.335 -10.603 9.136 1.00 0.00 H new ATOM 0 HE3 TRP A 410 8.896 -5.308 8.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 11.005 -9.812 8.710 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 11.330 -5.586 8.135 1.00 0.00 H new ATOM 0 HH2 TRP A 410 12.369 -7.812 8.292 1.00 0.00 H new ATOM 669 N LEU A 411 7.023 -5.515 5.932 1.00 0.00 N ATOM 670 CA LEU A 411 7.783 -4.585 5.122 1.00 0.00 C ATOM 671 C LEU A 411 6.851 -3.888 4.140 1.00 0.00 C ATOM 672 O LEU A 411 6.991 -2.693 3.883 1.00 0.00 O ATOM 673 CB LEU A 411 8.892 -5.326 4.369 1.00 0.00 C ATOM 674 CG LEU A 411 9.617 -4.502 3.305 1.00 0.00 C ATOM 675 CD1 LEU A 411 10.252 -3.267 3.927 1.00 0.00 C ATOM 676 CD2 LEU A 411 10.667 -5.346 2.601 1.00 0.00 C ATOM 0 H LEU A 411 7.222 -6.496 5.734 1.00 0.00 H new ATOM 0 HA LEU A 411 8.244 -3.838 5.768 1.00 0.00 H new ATOM 0 HB2 LEU A 411 9.625 -5.682 5.092 1.00 0.00 H new ATOM 0 HB3 LEU A 411 8.461 -6.206 3.893 1.00 0.00 H new ATOM 0 HG LEU A 411 8.886 -4.176 2.565 1.00 0.00 H new ATOM 0 HD11 LEU A 411 10.764 -2.693 3.155 1.00 0.00 H new ATOM 0 HD12 LEU A 411 9.478 -2.651 4.384 1.00 0.00 H new ATOM 0 HD13 LEU A 411 10.970 -3.571 4.688 1.00 0.00 H new ATOM 0 HD21 LEU A 411 11.173 -4.743 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 411 11.395 -5.702 3.329 1.00 0.00 H new ATOM 0 HD23 LEU A 411 10.187 -6.199 2.121 1.00 0.00 H new ATOM 688 N LEU A 412 5.884 -4.638 3.597 1.00 0.00 N ATOM 689 CA LEU A 412 4.933 -4.058 2.659 1.00 0.00 C ATOM 690 C LEU A 412 4.145 -2.958 3.356 1.00 0.00 C ATOM 691 O LEU A 412 4.019 -1.843 2.847 1.00 0.00 O ATOM 692 CB LEU A 412 3.974 -5.117 2.113 1.00 0.00 C ATOM 693 CG LEU A 412 3.191 -4.682 0.872 1.00 0.00 C ATOM 694 CD1 LEU A 412 4.055 -4.812 -0.374 1.00 0.00 C ATOM 695 CD2 LEU A 412 1.917 -5.498 0.727 1.00 0.00 C ATOM 0 H LEU A 412 5.746 -5.630 3.790 1.00 0.00 H new ATOM 0 HA LEU A 412 5.488 -3.643 1.818 1.00 0.00 H new ATOM 0 HB2 LEU A 412 4.543 -6.015 1.872 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.267 -5.388 2.897 1.00 0.00 H new ATOM 0 HG LEU A 412 2.913 -3.635 0.991 1.00 0.00 H new ATOM 0 HD11 LEU A 412 3.483 -4.499 -1.248 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.938 -4.180 -0.272 1.00 0.00 H new ATOM 0 HD13 LEU A 412 4.364 -5.850 -0.496 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.376 -5.173 -0.161 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.170 -6.554 0.631 1.00 0.00 H new ATOM 0 HD23 LEU A 412 1.290 -5.354 1.607 1.00 0.00 H new ATOM 707 N GLU A 413 3.658 -3.274 4.553 1.00 0.00 N ATOM 708 CA GLU A 413 2.924 -2.313 5.363 1.00 0.00 C ATOM 709 C GLU A 413 3.885 -1.249 5.876 1.00 0.00 C ATOM 710 O GLU A 413 3.521 -0.086 6.044 1.00 0.00 O ATOM 711 CB GLU A 413 2.235 -3.013 6.536 1.00 0.00 C ATOM 712 CG GLU A 413 0.874 -3.592 6.188 1.00 0.00 C ATOM 713 CD GLU A 413 0.135 -4.119 7.404 1.00 0.00 C ATOM 714 OE1 GLU A 413 0.628 -5.084 8.024 1.00 0.00 O ATOM 715 OE2 GLU A 413 -0.934 -3.566 7.736 1.00 0.00 O ATOM 0 H GLU A 413 3.761 -4.193 4.983 1.00 0.00 H new ATOM 0 HA GLU A 413 2.156 -1.843 4.749 1.00 0.00 H new ATOM 0 HB2 GLU A 413 2.879 -3.814 6.898 1.00 0.00 H new ATOM 0 HB3 GLU A 413 2.119 -2.302 7.354 1.00 0.00 H new ATOM 0 HG2 GLU A 413 0.270 -2.824 5.705 1.00 0.00 H new ATOM 0 HG3 GLU A 413 1.001 -4.399 5.466 1.00 0.00 H new ATOM 722 N GLU A 414 5.123 -1.674 6.119 1.00 0.00 N ATOM 723 CA GLU A 414 6.166 -0.788 6.609 1.00 0.00 C ATOM 724 C GLU A 414 6.476 0.292 5.577 1.00 0.00 C ATOM 725 O GLU A 414 6.764 1.436 5.925 1.00 0.00 O ATOM 726 CB GLU A 414 7.429 -1.595 6.928 1.00 0.00 C ATOM 727 CG GLU A 414 7.729 -1.691 8.416 1.00 0.00 C ATOM 728 CD GLU A 414 8.882 -2.629 8.719 1.00 0.00 C ATOM 729 OE1 GLU A 414 9.920 -2.536 8.031 1.00 0.00 O ATOM 730 OE2 GLU A 414 8.744 -3.457 9.645 1.00 0.00 O ATOM 0 H GLU A 414 5.426 -2.638 5.981 1.00 0.00 H new ATOM 0 HA GLU A 414 5.815 -0.303 7.520 1.00 0.00 H new ATOM 0 HB2 GLU A 414 7.320 -2.601 6.522 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.280 -1.138 6.423 1.00 0.00 H new ATOM 0 HG2 GLU A 414 7.962 -0.698 8.801 1.00 0.00 H new ATOM 0 HG3 GLU A 414 6.838 -2.035 8.941 1.00 0.00 H new ATOM 737 N MET A 415 6.408 -0.085 4.304 1.00 0.00 N ATOM 738 CA MET A 415 6.674 0.843 3.215 1.00 0.00 C ATOM 739 C MET A 415 5.563 1.885 3.112 1.00 0.00 C ATOM 740 O MET A 415 5.825 3.066 2.884 1.00 0.00 O ATOM 741 CB MET A 415 6.810 0.077 1.896 1.00 0.00 C ATOM 742 CG MET A 415 6.881 0.973 0.672 1.00 0.00 C ATOM 743 SD MET A 415 7.333 0.071 -0.823 1.00 0.00 S ATOM 744 CE MET A 415 6.190 -1.307 -0.745 1.00 0.00 C ATOM 0 H MET A 415 6.170 -1.030 4.003 1.00 0.00 H new ATOM 0 HA MET A 415 7.610 1.362 3.421 1.00 0.00 H new ATOM 0 HB2 MET A 415 7.708 -0.540 1.936 1.00 0.00 H new ATOM 0 HB3 MET A 415 5.962 -0.600 1.791 1.00 0.00 H new ATOM 0 HG2 MET A 415 5.915 1.455 0.523 1.00 0.00 H new ATOM 0 HG3 MET A 415 7.609 1.765 0.848 1.00 0.00 H new ATOM 0 HE1 MET A 415 5.922 -1.615 -1.756 1.00 0.00 H new ATOM 0 HE2 MET A 415 6.661 -2.141 -0.225 1.00 0.00 H new ATOM 0 HE3 MET A 415 5.291 -1.004 -0.207 1.00 0.00 H new ATOM 754 N LEU A 416 4.320 1.440 3.284 1.00 0.00 N ATOM 755 CA LEU A 416 3.172 2.336 3.212 1.00 0.00 C ATOM 756 C LEU A 416 3.267 3.420 4.277 1.00 0.00 C ATOM 757 O LEU A 416 3.045 4.599 4.001 1.00 0.00 O ATOM 758 CB LEU A 416 1.871 1.552 3.391 1.00 0.00 C ATOM 759 CG LEU A 416 1.322 0.911 2.116 1.00 0.00 C ATOM 760 CD1 LEU A 416 1.748 -0.546 2.034 1.00 0.00 C ATOM 761 CD2 LEU A 416 -0.194 1.032 2.068 1.00 0.00 C ATOM 0 H LEU A 416 4.084 0.466 3.474 1.00 0.00 H new ATOM 0 HA LEU A 416 3.173 2.807 2.229 1.00 0.00 H new ATOM 0 HB2 LEU A 416 2.035 0.769 4.132 1.00 0.00 H new ATOM 0 HB3 LEU A 416 1.114 2.222 3.798 1.00 0.00 H new ATOM 0 HG LEU A 416 1.733 1.439 1.256 1.00 0.00 H new ATOM 0 HD11 LEU A 416 1.350 -0.991 1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 416 2.836 -0.607 2.023 1.00 0.00 H new ATOM 0 HD13 LEU A 416 1.363 -1.087 2.899 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.567 0.570 1.154 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.627 0.528 2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -0.476 2.085 2.084 1.00 0.00 H new ATOM 773 N THR A 417 3.599 3.012 5.495 1.00 0.00 N ATOM 774 CA THR A 417 3.724 3.948 6.605 1.00 0.00 C ATOM 775 C THR A 417 4.838 4.954 6.337 1.00 0.00 C ATOM 776 O THR A 417 4.749 6.114 6.738 1.00 0.00 O ATOM 777 CB THR A 417 4.001 3.196 7.908 1.00 0.00 C ATOM 778 OG1 THR A 417 3.388 1.919 7.890 1.00 0.00 O ATOM 779 CG2 THR A 417 3.505 3.927 9.137 1.00 0.00 C ATOM 0 H THR A 417 3.787 2.040 5.739 1.00 0.00 H new ATOM 0 HA THR A 417 2.782 4.488 6.703 1.00 0.00 H new ATOM 0 HB THR A 417 5.086 3.112 7.968 1.00 0.00 H new ATOM 0 HG1 THR A 417 3.578 1.453 8.731 1.00 0.00 H new ATOM 0 HG21 THR A 417 3.733 3.340 10.026 1.00 0.00 H new ATOM 0 HG22 THR A 417 3.997 4.897 9.207 1.00 0.00 H new ATOM 0 HG23 THR A 417 2.427 4.071 9.064 1.00 0.00 H new ATOM 787 N LYS A 418 5.884 4.505 5.647 1.00 0.00 N ATOM 788 CA LYS A 418 7.008 5.374 5.316 1.00 0.00 C ATOM 789 C LYS A 418 6.534 6.561 4.487 1.00 0.00 C ATOM 790 O LYS A 418 6.874 7.708 4.773 1.00 0.00 O ATOM 791 CB LYS A 418 8.080 4.595 4.553 1.00 0.00 C ATOM 792 CG LYS A 418 9.439 5.279 4.546 1.00 0.00 C ATOM 793 CD LYS A 418 9.995 5.406 3.136 1.00 0.00 C ATOM 794 CE LYS A 418 9.484 6.661 2.448 1.00 0.00 C ATOM 795 NZ LYS A 418 10.124 6.865 1.119 1.00 0.00 N ATOM 0 H LYS A 418 5.976 3.547 5.308 1.00 0.00 H new ATOM 0 HA LYS A 418 7.441 5.745 6.245 1.00 0.00 H new ATOM 0 HB2 LYS A 418 8.183 3.605 4.997 1.00 0.00 H new ATOM 0 HB3 LYS A 418 7.750 4.451 3.524 1.00 0.00 H new ATOM 0 HG2 LYS A 418 9.351 6.269 4.993 1.00 0.00 H new ATOM 0 HG3 LYS A 418 10.136 4.711 5.163 1.00 0.00 H new ATOM 0 HD2 LYS A 418 11.084 5.428 3.174 1.00 0.00 H new ATOM 0 HD3 LYS A 418 9.714 4.529 2.552 1.00 0.00 H new ATOM 0 HE2 LYS A 418 8.403 6.593 2.324 1.00 0.00 H new ATOM 0 HE3 LYS A 418 9.678 7.527 3.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 10.614 7.782 1.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 10.810 6.103 0.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 9.395 6.852 0.377 1.00 0.00 H new ATOM 809 N GLU A 419 5.730 6.276 3.466 1.00 0.00 N ATOM 810 CA GLU A 419 5.191 7.323 2.607 1.00 0.00 C ATOM 811 C GLU A 419 4.174 8.145 3.384 1.00 0.00 C ATOM 812 O GLU A 419 4.099 9.366 3.244 1.00 0.00 O ATOM 813 CB GLU A 419 4.534 6.723 1.358 1.00 0.00 C ATOM 814 CG GLU A 419 5.207 5.457 0.852 1.00 0.00 C ATOM 815 CD GLU A 419 6.712 5.600 0.732 1.00 0.00 C ATOM 816 OE1 GLU A 419 7.175 6.690 0.332 1.00 0.00 O ATOM 817 OE2 GLU A 419 7.428 4.624 1.039 1.00 0.00 O ATOM 0 H GLU A 419 5.439 5.331 3.215 1.00 0.00 H new ATOM 0 HA GLU A 419 6.011 7.965 2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 419 3.490 6.503 1.580 1.00 0.00 H new ATOM 0 HB3 GLU A 419 4.541 7.468 0.563 1.00 0.00 H new ATOM 0 HG2 GLU A 419 4.978 4.634 1.528 1.00 0.00 H new ATOM 0 HG3 GLU A 419 4.793 5.195 -0.121 1.00 0.00 H new ATOM 824 N LEU A 420 3.400 7.457 4.217 1.00 0.00 N ATOM 825 CA LEU A 420 2.390 8.104 5.042 1.00 0.00 C ATOM 826 C LEU A 420 3.044 9.102 5.991 1.00 0.00 C ATOM 827 O LEU A 420 2.519 10.190 6.228 1.00 0.00 O ATOM 828 CB LEU A 420 1.612 7.052 5.837 1.00 0.00 C ATOM 829 CG LEU A 420 0.714 7.600 6.949 1.00 0.00 C ATOM 830 CD1 LEU A 420 -0.460 8.359 6.356 1.00 0.00 C ATOM 831 CD2 LEU A 420 0.225 6.471 7.843 1.00 0.00 C ATOM 0 H LEU A 420 3.455 6.446 4.338 1.00 0.00 H new ATOM 0 HA LEU A 420 1.698 8.641 4.394 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.995 6.480 5.144 1.00 0.00 H new ATOM 0 HB3 LEU A 420 2.324 6.355 6.279 1.00 0.00 H new ATOM 0 HG LEU A 420 1.298 8.290 7.557 1.00 0.00 H new ATOM 0 HD11 LEU A 420 -1.089 8.742 7.160 1.00 0.00 H new ATOM 0 HD12 LEU A 420 -0.090 9.191 5.757 1.00 0.00 H new ATOM 0 HD13 LEU A 420 -1.045 7.689 5.725 1.00 0.00 H new ATOM 0 HD21 LEU A 420 -0.412 6.878 8.628 1.00 0.00 H new ATOM 0 HD22 LEU A 420 -0.344 5.756 7.248 1.00 0.00 H new ATOM 0 HD23 LEU A 420 1.080 5.968 8.294 1.00 0.00 H new ATOM 843 N LEU A 421 4.197 8.718 6.527 1.00 0.00 N ATOM 844 CA LEU A 421 4.936 9.568 7.449 1.00 0.00 C ATOM 845 C LEU A 421 5.534 10.767 6.719 1.00 0.00 C ATOM 846 O LEU A 421 5.669 11.850 7.288 1.00 0.00 O ATOM 847 CB LEU A 421 6.040 8.762 8.138 1.00 0.00 C ATOM 848 CG LEU A 421 5.968 8.744 9.666 1.00 0.00 C ATOM 849 CD1 LEU A 421 4.645 8.155 10.131 1.00 0.00 C ATOM 850 CD2 LEU A 421 7.137 7.959 10.244 1.00 0.00 C ATOM 0 H LEU A 421 4.641 7.819 6.337 1.00 0.00 H new ATOM 0 HA LEU A 421 4.244 9.939 8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 421 6.000 7.735 7.775 1.00 0.00 H new ATOM 0 HB3 LEU A 421 7.006 9.168 7.839 1.00 0.00 H new ATOM 0 HG LEU A 421 6.031 9.771 10.027 1.00 0.00 H new ATOM 0 HD11 LEU A 421 4.612 8.150 11.220 1.00 0.00 H new ATOM 0 HD12 LEU A 421 3.823 8.758 9.745 1.00 0.00 H new ATOM 0 HD13 LEU A 421 4.551 7.134 9.761 1.00 0.00 H new ATOM 0 HD21 LEU A 421 7.071 7.956 11.332 1.00 0.00 H new ATOM 0 HD22 LEU A 421 7.104 6.934 9.876 1.00 0.00 H new ATOM 0 HD23 LEU A 421 8.074 8.424 9.939 1.00 0.00 H new ATOM 862 N GLU A 422 5.887 10.565 5.453 1.00 0.00 N ATOM 863 CA GLU A 422 6.468 11.629 4.644 1.00 0.00 C ATOM 864 C GLU A 422 5.500 12.802 4.516 1.00 0.00 C ATOM 865 O GLU A 422 5.886 13.960 4.680 1.00 0.00 O ATOM 866 CB GLU A 422 6.837 11.100 3.256 1.00 0.00 C ATOM 867 CG GLU A 422 8.249 11.459 2.823 1.00 0.00 C ATOM 868 CD GLU A 422 8.333 12.835 2.192 1.00 0.00 C ATOM 869 OE1 GLU A 422 7.793 13.794 2.784 1.00 0.00 O ATOM 870 OE2 GLU A 422 8.939 12.955 1.108 1.00 0.00 O ATOM 0 H GLU A 422 5.781 9.675 4.966 1.00 0.00 H new ATOM 0 HA GLU A 422 7.372 11.980 5.142 1.00 0.00 H new ATOM 0 HB2 GLU A 422 6.729 10.015 3.249 1.00 0.00 H new ATOM 0 HB3 GLU A 422 6.131 11.495 2.526 1.00 0.00 H new ATOM 0 HG2 GLU A 422 8.912 11.419 3.688 1.00 0.00 H new ATOM 0 HG3 GLU A 422 8.607 10.715 2.112 1.00 0.00 H new ATOM 877 N LEU A 423 4.241 12.493 4.222 1.00 0.00 N ATOM 878 CA LEU A 423 3.217 13.521 4.073 1.00 0.00 C ATOM 879 C LEU A 423 3.022 14.285 5.378 1.00 0.00 C ATOM 880 O LEU A 423 2.760 15.488 5.372 1.00 0.00 O ATOM 881 CB LEU A 423 1.893 12.893 3.634 1.00 0.00 C ATOM 882 CG LEU A 423 1.749 12.676 2.124 1.00 0.00 C ATOM 883 CD1 LEU A 423 1.828 11.196 1.784 1.00 0.00 C ATOM 884 CD2 LEU A 423 0.441 13.270 1.622 1.00 0.00 C ATOM 0 H LEU A 423 3.906 11.540 4.082 1.00 0.00 H new ATOM 0 HA LEU A 423 3.549 14.222 3.307 1.00 0.00 H new ATOM 0 HB2 LEU A 423 1.779 11.932 4.136 1.00 0.00 H new ATOM 0 HB3 LEU A 423 1.076 13.529 3.974 1.00 0.00 H new ATOM 0 HG LEU A 423 2.573 13.186 1.625 1.00 0.00 H new ATOM 0 HD11 LEU A 423 1.724 11.064 0.707 1.00 0.00 H new ATOM 0 HD12 LEU A 423 2.791 10.799 2.106 1.00 0.00 H new ATOM 0 HD13 LEU A 423 1.026 10.662 2.294 1.00 0.00 H new ATOM 0 HD21 LEU A 423 0.356 13.107 0.548 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -0.395 12.789 2.130 1.00 0.00 H new ATOM 0 HD23 LEU A 423 0.424 14.340 1.829 1.00 0.00 H new ATOM 896 N ASP A 424 3.153 13.578 6.495 1.00 0.00 N ATOM 897 CA ASP A 424 2.992 14.189 7.810 1.00 0.00 C ATOM 898 C ASP A 424 4.153 15.130 8.116 1.00 0.00 C ATOM 899 O ASP A 424 3.986 16.129 8.817 1.00 0.00 O ATOM 900 CB ASP A 424 2.897 13.109 8.888 1.00 0.00 C ATOM 901 CG ASP A 424 1.465 12.698 9.170 1.00 0.00 C ATOM 902 OD1 ASP A 424 0.683 13.553 9.636 1.00 0.00 O ATOM 903 OD2 ASP A 424 1.126 11.521 8.925 1.00 0.00 O ATOM 0 H ASP A 424 3.370 12.582 6.517 1.00 0.00 H new ATOM 0 HA ASP A 424 2.069 14.769 7.805 1.00 0.00 H new ATOM 0 HB2 ASP A 424 3.468 12.235 8.574 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.355 13.475 9.807 1.00 0.00 H new ATOM 908 N SER A 425 5.327 14.806 7.585 1.00 0.00 N ATOM 909 CA SER A 425 6.516 15.624 7.800 1.00 0.00 C ATOM 910 C SER A 425 6.312 17.041 7.267 1.00 0.00 C ATOM 911 O SER A 425 7.011 17.970 7.670 1.00 0.00 O ATOM 912 CB SER A 425 7.730 14.983 7.125 1.00 0.00 C ATOM 913 OG SER A 425 8.931 15.622 7.524 1.00 0.00 O ATOM 0 H SER A 425 5.481 13.983 7.003 1.00 0.00 H new ATOM 0 HA SER A 425 6.693 15.684 8.874 1.00 0.00 H new ATOM 0 HB2 SER A 425 7.775 13.924 7.380 1.00 0.00 H new ATOM 0 HB3 SER A 425 7.623 15.046 6.042 1.00 0.00 H new ATOM 0 HG SER A 425 9.693 15.193 7.080 1.00 0.00 H new ATOM 919 N VAL A 426 5.353 17.199 6.358 1.00 0.00 N ATOM 920 CA VAL A 426 5.063 18.503 5.774 1.00 0.00 C ATOM 921 C VAL A 426 4.502 19.460 6.820 1.00 0.00 C ATOM 922 O VAL A 426 3.429 19.228 7.377 1.00 0.00 O ATOM 923 CB VAL A 426 4.061 18.386 4.610 1.00 0.00 C ATOM 924 CG1 VAL A 426 3.908 19.721 3.898 1.00 0.00 C ATOM 925 CG2 VAL A 426 4.497 17.301 3.637 1.00 0.00 C ATOM 0 H VAL A 426 4.765 16.441 6.011 1.00 0.00 H new ATOM 0 HA VAL A 426 6.005 18.897 5.393 1.00 0.00 H new ATOM 0 HB VAL A 426 3.090 18.107 5.019 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.196 19.617 3.079 1.00 0.00 H new ATOM 0 HG12 VAL A 426 3.544 20.469 4.602 1.00 0.00 H new ATOM 0 HG13 VAL A 426 4.874 20.035 3.502 1.00 0.00 H new ATOM 0 HG21 VAL A 426 3.777 17.233 2.821 1.00 0.00 H new ATOM 0 HG22 VAL A 426 5.479 17.547 3.234 1.00 0.00 H new ATOM 0 HG23 VAL A 426 4.547 16.345 4.157 1.00 0.00 H new ATOM 935 N GLU A 427 5.236 20.537 7.082 1.00 0.00 N ATOM 936 CA GLU A 427 4.812 21.531 8.061 1.00 0.00 C ATOM 937 C GLU A 427 3.980 22.625 7.402 1.00 0.00 C ATOM 938 O GLU A 427 4.483 23.394 6.583 1.00 0.00 O ATOM 939 CB GLU A 427 6.031 22.148 8.751 1.00 0.00 C ATOM 940 CG GLU A 427 7.106 22.614 7.784 1.00 0.00 C ATOM 941 CD GLU A 427 8.282 21.660 7.713 1.00 0.00 C ATOM 942 OE1 GLU A 427 8.768 21.237 8.784 1.00 0.00 O ATOM 943 OE2 GLU A 427 8.716 21.334 6.589 1.00 0.00 O ATOM 0 H GLU A 427 6.127 20.743 6.630 1.00 0.00 H new ATOM 0 HA GLU A 427 4.194 21.030 8.806 1.00 0.00 H new ATOM 0 HB2 GLU A 427 5.706 22.995 9.355 1.00 0.00 H new ATOM 0 HB3 GLU A 427 6.461 21.415 9.434 1.00 0.00 H new ATOM 0 HG2 GLU A 427 6.672 22.724 6.790 1.00 0.00 H new ATOM 0 HG3 GLU A 427 7.460 23.599 8.088 1.00 0.00 H new ATOM 950 N THR A 428 2.702 22.689 7.764 1.00 0.00 N ATOM 951 CA THR A 428 1.798 23.689 7.207 1.00 0.00 C ATOM 952 C THR A 428 1.462 24.754 8.245 1.00 0.00 C ATOM 953 O THR A 428 1.136 24.440 9.390 1.00 0.00 O ATOM 954 CB THR A 428 0.515 23.024 6.708 1.00 0.00 C ATOM 955 OG1 THR A 428 -0.382 23.990 6.190 1.00 0.00 O ATOM 956 CG2 THR A 428 -0.215 22.248 7.782 1.00 0.00 C ATOM 0 H THR A 428 2.269 22.060 8.441 1.00 0.00 H new ATOM 0 HA THR A 428 2.300 24.170 6.367 1.00 0.00 H new ATOM 0 HB THR A 428 0.834 22.327 5.934 1.00 0.00 H new ATOM 0 HG1 THR A 428 -1.252 23.572 6.023 1.00 0.00 H new ATOM 0 HG21 THR A 428 -1.116 21.802 7.360 1.00 0.00 H new ATOM 0 HG22 THR A 428 0.434 21.461 8.167 1.00 0.00 H new ATOM 0 HG23 THR A 428 -0.490 22.921 8.594 1.00 0.00 H new ATOM 964 N GLY A 429 1.542 26.017 7.837 1.00 0.00 N ATOM 965 CA GLY A 429 1.243 27.110 8.744 1.00 0.00 C ATOM 966 C GLY A 429 -0.183 27.605 8.605 1.00 0.00 C ATOM 967 O GLY A 429 -0.450 28.797 8.753 1.00 0.00 O ATOM 0 H GLY A 429 1.808 26.303 6.895 1.00 0.00 H new ATOM 0 HA2 GLY A 429 1.413 26.783 9.770 1.00 0.00 H new ATOM 0 HA3 GLY A 429 1.931 27.934 8.554 1.00 0.00 H new ATOM 971 N GLY A 430 -1.101 26.688 8.321 1.00 0.00 N ATOM 972 CA GLY A 430 -2.497 27.056 8.168 1.00 0.00 C ATOM 973 C GLY A 430 -2.961 26.979 6.726 1.00 0.00 C ATOM 974 O GLY A 430 -3.221 28.004 6.096 1.00 0.00 O ATOM 0 H GLY A 430 -0.904 25.695 8.194 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -3.113 26.397 8.781 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -2.646 28.069 8.541 1.00 0.00 H new ATOM 978 N GLN A 431 -3.066 25.761 6.205 1.00 0.00 N ATOM 979 CA GLN A 431 -3.502 25.554 4.830 1.00 0.00 C ATOM 980 C GLN A 431 -4.372 24.306 4.716 1.00 0.00 C ATOM 981 O GLN A 431 -3.903 23.188 4.933 1.00 0.00 O ATOM 982 CB GLN A 431 -2.292 25.431 3.902 1.00 0.00 C ATOM 983 CG GLN A 431 -2.634 25.602 2.430 1.00 0.00 C ATOM 984 CD GLN A 431 -1.667 26.520 1.709 1.00 0.00 C ATOM 985 OE1 GLN A 431 -0.525 26.695 2.135 1.00 0.00 O ATOM 986 NE2 GLN A 431 -2.119 27.111 0.609 1.00 0.00 N ATOM 0 H GLN A 431 -2.855 24.903 6.715 1.00 0.00 H new ATOM 0 HA GLN A 431 -4.096 26.418 4.531 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -1.551 26.179 4.184 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -1.830 24.454 4.048 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -2.633 24.626 1.945 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -3.644 26.001 2.340 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -3.073 26.937 0.292 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -1.512 27.739 0.081 1.00 0.00 H new ATOM 995 N ASP A 432 -5.641 24.505 4.377 1.00 0.00 N ATOM 996 CA ASP A 432 -6.577 23.396 4.236 1.00 0.00 C ATOM 997 C ASP A 432 -6.184 22.497 3.068 1.00 0.00 C ATOM 998 O ASP A 432 -6.355 21.279 3.124 1.00 0.00 O ATOM 999 CB ASP A 432 -7.999 23.923 4.031 1.00 0.00 C ATOM 1000 CG ASP A 432 -8.086 24.927 2.899 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -7.869 26.131 3.154 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -8.371 24.510 1.755 1.00 0.00 O ATOM 0 H ASP A 432 -6.045 25.424 4.195 1.00 0.00 H new ATOM 0 HA ASP A 432 -6.543 22.807 5.153 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -8.667 23.087 3.824 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -8.348 24.388 4.953 1.00 0.00 H new ATOM 1007 N SER A 433 -5.655 23.106 2.011 1.00 0.00 N ATOM 1008 CA SER A 433 -5.237 22.361 0.830 1.00 0.00 C ATOM 1009 C SER A 433 -4.159 21.341 1.183 1.00 0.00 C ATOM 1010 O SER A 433 -4.211 20.190 0.747 1.00 0.00 O ATOM 1011 CB SER A 433 -4.715 23.317 -0.245 1.00 0.00 C ATOM 1012 OG SER A 433 -4.255 22.606 -1.380 1.00 0.00 O ATOM 0 H SER A 433 -5.506 24.113 1.949 1.00 0.00 H new ATOM 0 HA SER A 433 -6.105 21.828 0.443 1.00 0.00 H new ATOM 0 HB2 SER A 433 -5.507 24.005 -0.540 1.00 0.00 H new ATOM 0 HB3 SER A 433 -3.904 23.920 0.163 1.00 0.00 H new ATOM 0 HG SER A 433 -3.928 23.239 -2.053 1.00 0.00 H new ATOM 1018 N VAL A 434 -3.184 21.769 1.977 1.00 0.00 N ATOM 1019 CA VAL A 434 -2.094 20.892 2.391 1.00 0.00 C ATOM 1020 C VAL A 434 -2.584 19.842 3.382 1.00 0.00 C ATOM 1021 O VAL A 434 -2.221 18.670 3.290 1.00 0.00 O ATOM 1022 CB VAL A 434 -0.942 21.690 3.031 1.00 0.00 C ATOM 1023 CG1 VAL A 434 0.246 20.783 3.312 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -0.534 22.852 2.136 1.00 0.00 C ATOM 0 H VAL A 434 -3.126 22.718 2.347 1.00 0.00 H new ATOM 0 HA VAL A 434 -1.725 20.397 1.492 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.291 22.097 3.980 1.00 0.00 H new ATOM 0 HG11 VAL A 434 1.049 21.365 3.764 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.056 19.989 3.995 1.00 0.00 H new ATOM 0 HG13 VAL A 434 0.597 20.344 2.378 1.00 0.00 H new ATOM 0 HG21 VAL A 434 0.281 23.404 2.605 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -0.204 22.469 1.170 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -1.386 23.516 1.991 1.00 0.00 H new ATOM 1034 N ARG A 435 -3.410 20.272 4.331 1.00 0.00 N ATOM 1035 CA ARG A 435 -3.950 19.367 5.341 1.00 0.00 C ATOM 1036 C ARG A 435 -4.912 18.364 4.712 1.00 0.00 C ATOM 1037 O ARG A 435 -4.978 17.207 5.128 1.00 0.00 O ATOM 1038 CB ARG A 435 -4.661 20.163 6.438 1.00 0.00 C ATOM 1039 CG ARG A 435 -4.035 19.990 7.813 1.00 0.00 C ATOM 1040 CD ARG A 435 -4.427 21.121 8.752 1.00 0.00 C ATOM 1041 NE ARG A 435 -5.404 20.691 9.750 1.00 0.00 N ATOM 1042 CZ ARG A 435 -6.161 21.527 10.456 1.00 0.00 C ATOM 1043 NH1 ARG A 435 -6.059 22.839 10.276 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -7.024 21.051 11.343 1.00 0.00 N ATOM 0 H ARG A 435 -3.720 21.240 4.422 1.00 0.00 H new ATOM 0 HA ARG A 435 -3.121 18.815 5.784 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -4.652 21.220 6.173 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -5.706 19.855 6.481 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -4.349 19.037 8.239 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -2.950 19.955 7.718 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -3.537 21.499 9.255 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -4.840 21.946 8.172 1.00 0.00 H new ATOM 0 HE ARG A 435 -5.512 19.690 9.915 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -5.398 23.210 9.594 1.00 0.00 H new ATOM 0 HH12 ARG A 435 -6.642 23.475 10.820 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -7.107 20.044 11.484 1.00 0.00 H new ATOM 0 HH22 ARG A 435 -7.604 21.692 11.884 1.00 0.00 H new ATOM 1058 N GLN A 436 -5.658 18.815 3.708 1.00 0.00 N ATOM 1059 CA GLN A 436 -6.616 17.957 3.021 1.00 0.00 C ATOM 1060 C GLN A 436 -5.898 16.887 2.203 1.00 0.00 C ATOM 1061 O GLN A 436 -6.374 15.758 2.087 1.00 0.00 O ATOM 1062 CB GLN A 436 -7.520 18.791 2.112 1.00 0.00 C ATOM 1063 CG GLN A 436 -8.638 17.990 1.464 1.00 0.00 C ATOM 1064 CD GLN A 436 -8.390 17.729 -0.009 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -8.482 16.594 -0.474 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -8.074 18.783 -0.751 1.00 0.00 N ATOM 0 H GLN A 436 -5.617 19.770 3.352 1.00 0.00 H new ATOM 0 HA GLN A 436 -7.229 17.462 3.774 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -7.956 19.603 2.694 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -6.913 19.249 1.331 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -8.747 17.039 1.984 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -9.579 18.527 1.581 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -8.009 19.707 -0.323 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -7.896 18.669 -1.749 1.00 0.00 H new ATOM 1075 N ALA A 437 -4.752 17.253 1.638 1.00 0.00 N ATOM 1076 CA ALA A 437 -3.969 16.326 0.831 1.00 0.00 C ATOM 1077 C ALA A 437 -3.390 15.204 1.688 1.00 0.00 C ATOM 1078 O ALA A 437 -3.445 14.033 1.313 1.00 0.00 O ATOM 1079 CB ALA A 437 -2.855 17.068 0.107 1.00 0.00 C ATOM 0 H ALA A 437 -4.346 18.185 1.724 1.00 0.00 H new ATOM 0 HA ALA A 437 -4.633 15.877 0.092 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -2.278 16.363 -0.492 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -3.287 17.828 -0.543 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -2.201 17.544 0.837 1.00 0.00 H new ATOM 1085 N ARG A 438 -2.836 15.571 2.839 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.248 14.594 3.748 1.00 0.00 C ATOM 1087 C ARG A 438 -3.325 13.708 4.367 1.00 0.00 C ATOM 1088 O ARG A 438 -3.164 12.491 4.457 1.00 0.00 O ATOM 1089 CB ARG A 438 -1.456 15.301 4.849 1.00 0.00 C ATOM 1090 CG ARG A 438 -2.287 16.275 5.668 1.00 0.00 C ATOM 1091 CD ARG A 438 -1.433 17.034 6.670 1.00 0.00 C ATOM 1092 NE ARG A 438 -1.979 16.960 8.023 1.00 0.00 N ATOM 1093 CZ ARG A 438 -1.859 15.896 8.814 1.00 0.00 C ATOM 1094 NH1 ARG A 438 -1.212 14.817 8.392 1.00 0.00 N ATOM 1095 NH2 ARG A 438 -2.388 15.912 10.030 1.00 0.00 N ATOM 0 H ARG A 438 -2.782 16.536 3.164 1.00 0.00 H new ATOM 0 HA ARG A 438 -1.571 13.962 3.173 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -1.028 14.552 5.515 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -0.622 15.839 4.397 1.00 0.00 H new ATOM 0 HG2 ARG A 438 -2.782 16.982 5.002 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -3.071 15.731 6.195 1.00 0.00 H new ATOM 0 HD2 ARG A 438 -0.421 16.628 6.665 1.00 0.00 H new ATOM 0 HD3 ARG A 438 -1.359 18.078 6.366 1.00 0.00 H new ATOM 0 HE ARG A 438 -2.482 17.771 8.383 1.00 0.00 H new ATOM 0 HH11 ARG A 438 -0.804 14.800 7.457 1.00 0.00 H new ATOM 0 HH12 ARG A 438 -1.123 14.005 9.002 1.00 0.00 H new ATOM 0 HH21 ARG A 438 -2.886 16.739 10.359 1.00 0.00 H new ATOM 0 HH22 ARG A 438 -2.297 15.097 10.637 1.00 0.00 H new ATOM 1109 N LYS A 439 -4.422 14.327 4.790 1.00 0.00 N ATOM 1110 CA LYS A 439 -5.526 13.592 5.399 1.00 0.00 C ATOM 1111 C LYS A 439 -6.074 12.543 4.436 1.00 0.00 C ATOM 1112 O LYS A 439 -6.318 11.400 4.822 1.00 0.00 O ATOM 1113 CB LYS A 439 -6.640 14.555 5.818 1.00 0.00 C ATOM 1114 CG LYS A 439 -6.768 14.717 7.324 1.00 0.00 C ATOM 1115 CD LYS A 439 -7.570 15.955 7.685 1.00 0.00 C ATOM 1116 CE LYS A 439 -7.545 16.217 9.183 1.00 0.00 C ATOM 1117 NZ LYS A 439 -8.431 17.352 9.562 1.00 0.00 N ATOM 0 H LYS A 439 -4.571 15.334 4.723 1.00 0.00 H new ATOM 0 HA LYS A 439 -5.148 13.083 6.285 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -6.453 15.531 5.370 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -7.588 14.197 5.417 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -7.249 13.835 7.746 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -5.775 14.783 7.770 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -7.166 16.819 7.157 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -8.601 15.832 7.353 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -7.859 15.318 9.714 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -6.524 16.433 9.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -8.386 17.499 10.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -8.117 18.215 9.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -9.410 17.136 9.286 1.00 0.00 H new ATOM 1131 N GLU A 440 -6.259 12.940 3.181 1.00 0.00 N ATOM 1132 CA GLU A 440 -6.771 12.031 2.162 1.00 0.00 C ATOM 1133 C GLU A 440 -5.812 10.867 1.950 1.00 0.00 C ATOM 1134 O GLU A 440 -6.234 9.735 1.712 1.00 0.00 O ATOM 1135 CB GLU A 440 -6.988 12.778 0.844 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.305 13.533 0.782 1.00 0.00 C ATOM 1137 CD GLU A 440 -9.489 12.621 0.527 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -9.451 11.459 0.984 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -10.453 13.068 -0.128 1.00 0.00 O ATOM 0 H GLU A 440 -6.062 13.883 2.846 1.00 0.00 H new ATOM 0 HA GLU A 440 -7.727 11.636 2.506 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -6.168 13.481 0.695 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -6.949 12.064 0.021 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.458 14.067 1.720 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -8.253 14.283 -0.007 1.00 0.00 H new ATOM 1146 N ALA A 441 -4.518 11.154 2.038 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.495 10.134 1.858 1.00 0.00 C ATOM 1148 C ALA A 441 -3.489 9.154 3.026 1.00 0.00 C ATOM 1149 O ALA A 441 -3.319 7.950 2.837 1.00 0.00 O ATOM 1150 CB ALA A 441 -2.126 10.781 1.703 1.00 0.00 C ATOM 0 H ALA A 441 -4.154 12.086 2.233 1.00 0.00 H new ATOM 0 HA ALA A 441 -3.726 9.577 0.950 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.371 10.007 1.569 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -2.130 11.438 0.833 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -1.895 11.363 2.596 1.00 0.00 H new ATOM 1156 N VAL A 442 -3.679 9.679 4.233 1.00 0.00 N ATOM 1157 CA VAL A 442 -3.695 8.850 5.433 1.00 0.00 C ATOM 1158 C VAL A 442 -4.850 7.855 5.396 1.00 0.00 C ATOM 1159 O VAL A 442 -4.672 6.671 5.685 1.00 0.00 O ATOM 1160 CB VAL A 442 -3.812 9.710 6.706 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -3.683 8.845 7.951 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -2.765 10.816 6.702 1.00 0.00 C ATOM 0 H VAL A 442 -3.824 10.674 4.405 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.751 8.306 5.457 1.00 0.00 H new ATOM 0 HB VAL A 442 -4.798 10.175 6.718 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -3.768 9.471 8.839 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -4.475 8.096 7.957 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -2.713 8.347 7.949 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.863 11.413 7.609 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.769 10.374 6.664 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.912 11.453 5.830 1.00 0.00 H new ATOM 1172 N CYS A 443 -6.033 8.339 5.031 1.00 0.00 N ATOM 1173 CA CYS A 443 -7.212 7.485 4.951 1.00 0.00 C ATOM 1174 C CYS A 443 -6.994 6.376 3.928 1.00 0.00 C ATOM 1175 O CYS A 443 -7.465 5.250 4.100 1.00 0.00 O ATOM 1176 CB CYS A 443 -8.445 8.309 4.577 1.00 0.00 C ATOM 1177 SG CYS A 443 -9.357 8.956 5.998 1.00 0.00 S ATOM 0 H CYS A 443 -6.200 9.315 4.787 1.00 0.00 H new ATOM 0 HA CYS A 443 -7.377 7.034 5.929 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -8.135 9.143 3.947 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -9.115 7.691 3.979 1.00 0.00 H new ATOM 0 HG CYS A 443 -10.381 9.641 5.582 1.00 0.00 H new ATOM 1183 N LYS A 444 -6.265 6.703 2.866 1.00 0.00 N ATOM 1184 CA LYS A 444 -5.974 5.736 1.819 1.00 0.00 C ATOM 1185 C LYS A 444 -5.146 4.586 2.376 1.00 0.00 C ATOM 1186 O LYS A 444 -5.317 3.435 1.980 1.00 0.00 O ATOM 1187 CB LYS A 444 -5.229 6.409 0.663 1.00 0.00 C ATOM 1188 CG LYS A 444 -5.920 6.249 -0.682 1.00 0.00 C ATOM 1189 CD LYS A 444 -6.486 7.569 -1.180 1.00 0.00 C ATOM 1190 CE LYS A 444 -7.247 7.393 -2.483 1.00 0.00 C ATOM 1191 NZ LYS A 444 -7.948 8.642 -2.889 1.00 0.00 N ATOM 0 H LYS A 444 -5.867 7.629 2.710 1.00 0.00 H new ATOM 0 HA LYS A 444 -6.917 5.339 1.443 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -5.120 7.471 0.882 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -4.224 5.992 0.598 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -5.211 5.858 -1.412 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -6.723 5.518 -0.594 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -7.149 7.990 -0.424 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -5.675 8.282 -1.325 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -6.555 7.093 -3.270 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -7.974 6.588 -2.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -8.455 8.481 -3.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -8.627 8.915 -2.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -7.252 9.404 -3.019 1.00 0.00 H new ATOM 1205 N ILE A 445 -4.254 4.906 3.309 1.00 0.00 N ATOM 1206 CA ILE A 445 -3.408 3.892 3.928 1.00 0.00 C ATOM 1207 C ILE A 445 -4.247 2.931 4.752 1.00 0.00 C ATOM 1208 O ILE A 445 -3.965 1.735 4.818 1.00 0.00 O ATOM 1209 CB ILE A 445 -2.322 4.515 4.834 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -1.802 5.833 4.249 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -1.177 3.533 5.031 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -1.502 5.769 2.765 1.00 0.00 C ATOM 0 H ILE A 445 -4.099 5.854 3.651 1.00 0.00 H new ATOM 0 HA ILE A 445 -2.914 3.356 3.118 1.00 0.00 H new ATOM 0 HB ILE A 445 -2.772 4.733 5.803 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -2.540 6.615 4.427 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -0.896 6.123 4.781 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -0.418 3.983 5.671 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -1.554 2.624 5.499 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -0.738 3.288 4.064 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -1.139 6.739 2.425 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -0.741 5.011 2.580 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -2.411 5.511 2.221 1.00 0.00 H new ATOM 1224 N GLN A 446 -5.284 3.469 5.374 1.00 0.00 N ATOM 1225 CA GLN A 446 -6.185 2.685 6.194 1.00 0.00 C ATOM 1226 C GLN A 446 -6.819 1.557 5.388 1.00 0.00 C ATOM 1227 O GLN A 446 -6.848 0.406 5.823 1.00 0.00 O ATOM 1228 CB GLN A 446 -7.265 3.604 6.747 1.00 0.00 C ATOM 1229 CG GLN A 446 -8.045 3.021 7.902 1.00 0.00 C ATOM 1230 CD GLN A 446 -7.161 2.361 8.943 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -7.300 1.171 9.229 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -6.245 3.132 9.519 1.00 0.00 N ATOM 0 H GLN A 446 -5.522 4.460 5.323 1.00 0.00 H new ATOM 0 HA GLN A 446 -5.623 2.233 7.011 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -6.802 4.536 7.070 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -7.959 3.854 5.944 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -8.626 3.812 8.376 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -8.756 2.288 7.520 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -6.164 4.113 9.253 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -5.623 2.743 10.228 1.00 0.00 H new ATOM 1241 N ALA A 447 -7.323 1.898 4.207 1.00 0.00 N ATOM 1242 CA ALA A 447 -7.955 0.916 3.333 1.00 0.00 C ATOM 1243 C ALA A 447 -6.940 -0.113 2.844 1.00 0.00 C ATOM 1244 O ALA A 447 -7.254 -1.296 2.710 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.615 1.612 2.151 1.00 0.00 C ATOM 0 H ALA A 447 -7.306 2.847 3.833 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.720 0.391 3.906 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.083 0.868 1.506 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.373 2.306 2.514 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -7.862 2.161 1.585 1.00 0.00 H new ATOM 1251 N ILE A 448 -5.722 0.348 2.581 1.00 0.00 N ATOM 1252 CA ILE A 448 -4.652 -0.524 2.108 1.00 0.00 C ATOM 1253 C ILE A 448 -4.109 -1.389 3.237 1.00 0.00 C ATOM 1254 O ILE A 448 -3.746 -2.546 3.031 1.00 0.00 O ATOM 1255 CB ILE A 448 -3.492 0.286 1.500 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -4.028 1.322 0.515 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -2.498 -0.641 0.817 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -3.172 2.566 0.421 1.00 0.00 C ATOM 0 H ILE A 448 -5.450 1.325 2.688 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.085 -1.162 1.337 1.00 0.00 H new ATOM 0 HB ILE A 448 -2.974 0.811 2.303 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -4.104 0.867 -0.473 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -5.037 1.607 0.813 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -1.684 -0.053 0.393 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -2.096 -1.344 1.546 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -3.001 -1.191 0.022 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -3.613 3.258 -0.297 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -3.117 3.044 1.399 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -2.169 2.293 0.093 1.00 0.00 H new ATOM 1270 N LEU A 449 -4.047 -0.811 4.431 1.00 0.00 N ATOM 1271 CA LEU A 449 -3.536 -1.522 5.599 1.00 0.00 C ATOM 1272 C LEU A 449 -4.330 -2.801 5.849 1.00 0.00 C ATOM 1273 O LEU A 449 -3.757 -3.888 5.936 1.00 0.00 O ATOM 1274 CB LEU A 449 -3.588 -0.622 6.838 1.00 0.00 C ATOM 1275 CG LEU A 449 -2.241 -0.400 7.531 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -1.605 0.898 7.059 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -2.414 -0.393 9.042 1.00 0.00 C ATOM 0 H LEU A 449 -4.344 0.147 4.617 1.00 0.00 H new ATOM 0 HA LEU A 449 -2.499 -1.793 5.401 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -3.995 0.347 6.548 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -4.282 -1.058 7.557 1.00 0.00 H new ATOM 0 HG LEU A 449 -1.577 -1.223 7.265 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -0.649 1.039 7.562 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -1.445 0.854 5.982 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -2.265 1.733 7.294 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -1.447 -0.234 9.518 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -3.095 0.409 9.327 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -2.825 -1.349 9.366 1.00 0.00 H new ATOM 1289 N GLU A 450 -5.647 -2.672 5.957 1.00 0.00 N ATOM 1290 CA GLU A 450 -6.504 -3.828 6.189 1.00 0.00 C ATOM 1291 C GLU A 450 -6.444 -4.778 5.002 1.00 0.00 C ATOM 1292 O GLU A 450 -6.425 -5.997 5.174 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.947 -3.390 6.445 1.00 0.00 C ATOM 1294 CG GLU A 450 -8.504 -2.473 5.367 1.00 0.00 C ATOM 1295 CD GLU A 450 -9.479 -3.180 4.446 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -10.302 -3.974 4.949 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -9.420 -2.941 3.222 1.00 0.00 O ATOM 0 H GLU A 450 -6.143 -1.783 5.888 1.00 0.00 H new ATOM 0 HA GLU A 450 -6.141 -4.350 7.075 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -8.579 -4.275 6.520 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -7.998 -2.880 7.407 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -9.004 -1.626 5.838 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -7.681 -2.069 4.778 1.00 0.00 H new ATOM 1304 N LYS A 451 -6.393 -4.218 3.799 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.310 -5.031 2.595 1.00 0.00 C ATOM 1306 C LYS A 451 -5.074 -5.918 2.670 1.00 0.00 C ATOM 1307 O LYS A 451 -5.084 -7.063 2.220 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.249 -4.143 1.350 1.00 0.00 C ATOM 1309 CG LYS A 451 -7.563 -4.070 0.589 1.00 0.00 C ATOM 1310 CD LYS A 451 -7.538 -2.975 -0.465 1.00 0.00 C ATOM 1311 CE LYS A 451 -8.865 -2.239 -0.535 1.00 0.00 C ATOM 1312 NZ LYS A 451 -9.858 -2.960 -1.377 1.00 0.00 N ATOM 0 H LYS A 451 -6.408 -3.212 3.633 1.00 0.00 H new ATOM 0 HA LYS A 451 -7.201 -5.655 2.524 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -5.954 -3.136 1.646 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -5.473 -4.519 0.683 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -7.762 -5.030 0.113 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.379 -3.885 1.288 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -6.740 -2.268 -0.238 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -7.310 -3.410 -1.438 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -9.265 -2.115 0.472 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -8.704 -1.240 -0.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -10.749 -2.424 -1.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -9.488 -3.056 -2.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -10.031 -3.904 -0.978 1.00 0.00 H new ATOM 1326 N LEU A 452 -4.017 -5.379 3.266 1.00 0.00 N ATOM 1327 CA LEU A 452 -2.770 -6.109 3.432 1.00 0.00 C ATOM 1328 C LEU A 452 -2.964 -7.282 4.386 1.00 0.00 C ATOM 1329 O LEU A 452 -2.387 -8.352 4.196 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.680 -5.172 3.962 1.00 0.00 C ATOM 1331 CG LEU A 452 -0.362 -5.203 3.186 1.00 0.00 C ATOM 1332 CD1 LEU A 452 0.292 -3.828 3.190 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.575 -6.250 3.775 1.00 0.00 C ATOM 0 H LEU A 452 -4.001 -4.432 3.644 1.00 0.00 H new ATOM 0 HA LEU A 452 -2.461 -6.498 2.462 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -2.064 -4.152 3.954 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -1.477 -5.428 5.002 1.00 0.00 H new ATOM 0 HG LEU A 452 -0.573 -5.475 2.152 1.00 0.00 H new ATOM 0 HD11 LEU A 452 1.228 -3.869 2.633 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.377 -3.106 2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 452 0.493 -3.524 4.217 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.509 -6.260 3.212 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.782 -6.008 4.817 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.106 -7.232 3.717 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.787 -7.075 5.412 1.00 0.00 N ATOM 1346 CA GLU A 453 -4.059 -8.119 6.390 1.00 0.00 C ATOM 1347 C GLU A 453 -4.715 -9.327 5.725 1.00 0.00 C ATOM 1348 O GLU A 453 -4.552 -10.461 6.177 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.959 -7.583 7.505 1.00 0.00 C ATOM 1350 CG GLU A 453 -4.193 -6.919 8.637 1.00 0.00 C ATOM 1351 CD GLU A 453 -4.955 -6.941 9.948 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -5.777 -6.028 10.172 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -4.730 -7.870 10.751 1.00 0.00 O ATOM 0 H GLU A 453 -4.274 -6.196 5.585 1.00 0.00 H new ATOM 0 HA GLU A 453 -3.109 -8.435 6.822 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -5.660 -6.864 7.081 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.550 -8.404 7.910 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -3.236 -7.424 8.769 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -3.974 -5.886 8.366 1.00 0.00 H new ATOM 1360 N LYS A 454 -5.467 -9.074 4.656 1.00 0.00 N ATOM 1361 CA LYS A 454 -6.157 -10.142 3.939 1.00 0.00 C ATOM 1362 C LYS A 454 -5.319 -10.683 2.780 1.00 0.00 C ATOM 1363 O LYS A 454 -5.596 -11.765 2.263 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.506 -9.642 3.418 1.00 0.00 C ATOM 1365 CG LYS A 454 -8.682 -10.050 4.290 1.00 0.00 C ATOM 1366 CD LYS A 454 -8.803 -9.159 5.517 1.00 0.00 C ATOM 1367 CE LYS A 454 -8.051 -9.739 6.703 1.00 0.00 C ATOM 1368 NZ LYS A 454 -8.845 -10.784 7.408 1.00 0.00 N ATOM 0 H LYS A 454 -5.613 -8.142 4.269 1.00 0.00 H new ATOM 0 HA LYS A 454 -6.318 -10.959 4.643 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -7.478 -8.555 3.345 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -7.662 -10.025 2.409 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.603 -9.997 3.709 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.562 -11.087 4.603 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -8.413 -8.167 5.288 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -9.855 -9.036 5.776 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -7.109 -10.168 6.361 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -7.802 -8.940 7.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -8.297 -11.154 8.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -9.732 -10.369 7.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -9.061 -11.559 6.749 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.294 -9.937 2.375 1.00 0.00 N ATOM 1383 CA LYS A 455 -3.432 -10.370 1.279 1.00 0.00 C ATOM 1384 C LYS A 455 -2.371 -11.344 1.778 1.00 0.00 C ATOM 1385 O LYS A 455 -1.825 -12.132 1.005 1.00 0.00 O ATOM 1386 CB LYS A 455 -2.759 -9.168 0.610 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.324 -8.842 -0.764 1.00 0.00 C ATOM 1388 CD LYS A 455 -4.763 -8.358 -0.681 1.00 0.00 C ATOM 1389 CE LYS A 455 -5.749 -9.473 -0.992 1.00 0.00 C ATOM 1390 NZ LYS A 455 -5.396 -10.198 -2.245 1.00 0.00 N ATOM 0 H LYS A 455 -4.042 -9.038 2.785 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.057 -10.877 0.544 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -2.867 -8.296 1.255 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -1.691 -9.365 0.517 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -2.710 -8.076 -1.238 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -3.274 -9.728 -1.397 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -4.959 -7.967 0.317 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -4.911 -7.535 -1.380 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -5.774 -10.177 -0.160 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -6.751 -9.055 -1.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -6.266 -10.499 -2.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -4.852 -9.568 -2.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -4.823 -11.034 -2.013 1.00 0.00 H new ATOM 1404 N GLY A 456 -2.082 -11.288 3.075 1.00 0.00 N ATOM 1405 CA GLY A 456 -1.087 -12.174 3.649 1.00 0.00 C ATOM 1406 C GLY A 456 -1.615 -13.580 3.852 1.00 0.00 C ATOM 1407 O GLY A 456 -1.345 -14.474 3.051 1.00 0.00 O ATOM 0 H GLY A 456 -2.518 -10.646 3.737 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.214 -12.207 2.997 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.755 -11.772 4.606 1.00 0.00 H new ATOM 1411 N LEU A 457 -2.369 -13.775 4.929 1.00 0.00 N ATOM 1412 CA LEU A 457 -2.938 -15.081 5.240 1.00 0.00 C ATOM 1413 C LEU A 457 -1.838 -16.094 5.543 1.00 0.00 C ATOM 1414 O LEU A 457 -2.164 -17.184 6.059 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.806 -15.577 4.079 1.00 0.00 C ATOM 1416 CG LEU A 457 -5.307 -15.635 4.372 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -6.005 -14.398 3.831 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -5.918 -16.896 3.779 1.00 0.00 C ATOM 1419 OXT LEU A 457 -0.660 -15.789 5.262 1.00 0.00 O ATOM 0 H LEU A 457 -2.600 -13.044 5.602 1.00 0.00 H new ATOM 0 HA LEU A 457 -3.563 -14.975 6.127 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -3.644 -14.926 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -3.468 -16.573 3.792 1.00 0.00 H new ATOM 0 HG LEU A 457 -5.445 -15.662 5.453 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -7.071 -14.457 4.049 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -5.587 -13.509 4.303 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -5.858 -14.340 2.753 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -6.986 -16.920 3.997 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -5.768 -16.900 2.699 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -5.439 -17.772 4.215 1.00 0.00 H new