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 379 SER OG : rot 180:sc= -0.687 USER MOD Set 1.2: A 382 LYS NZ :NH3+ -114:sc=-0.00404 (180deg=0) USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS :FLIP no HD1:sc= -0.494 F(o=-2.2,f=-0.49) USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 391 GLN : amide:sc= -1.4 K(o=-1.4,f=-3.6!) 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 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0.00632 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 104:sc= 0.259 USER MOD Single : A 415 MET CE :methyl -131:sc= -3.47! (180deg=-13.2!) USER MOD Single : A 417 THR OG1 : rot 75:sc= 0.647 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 428 THR OG1 : rot 50:sc= 0 USER MOD Single : A 431 GLN : amide:sc= -3.31! C(o=-3.3!,f=-6.3!) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= 0 X(o=0,f=0) 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= -0.0681 X(o=-0.068,f=0) USER MOD Single : A 451 LYS NZ :NH3+ 152:sc= -1.22! (180deg=-1.63!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ -159:sc= -0.777 (180deg=-1.78!) USER MOD ----------------------------------------------------------------- ATOM 112 N SER A 379 4.185 23.892 -3.742 1.00 0.00 N ATOM 113 CA SER A 379 4.157 22.753 -2.827 1.00 0.00 C ATOM 114 C SER A 379 3.027 21.786 -3.141 1.00 0.00 C ATOM 115 O SER A 379 3.097 20.609 -2.790 1.00 0.00 O ATOM 116 CB SER A 379 4.056 23.231 -1.378 1.00 0.00 C ATOM 117 OG SER A 379 4.904 22.474 -0.531 1.00 0.00 O ATOM 0 HA SER A 379 5.094 22.213 -2.963 1.00 0.00 H new ATOM 0 HB2 SER A 379 4.326 24.285 -1.320 1.00 0.00 H new ATOM 0 HB3 SER A 379 3.025 23.147 -1.035 1.00 0.00 H new ATOM 0 HG SER A 379 4.823 22.800 0.390 1.00 0.00 H new ATOM 123 N ILE A 380 2.001 22.267 -3.820 1.00 0.00 N ATOM 124 CA ILE A 380 0.887 21.415 -4.190 1.00 0.00 C ATOM 125 C ILE A 380 1.389 20.253 -5.042 1.00 0.00 C ATOM 126 O ILE A 380 0.822 19.162 -5.021 1.00 0.00 O ATOM 127 CB ILE A 380 -0.208 22.200 -4.939 1.00 0.00 C ATOM 128 CG1 ILE A 380 -0.847 23.219 -3.993 1.00 0.00 C ATOM 129 CG2 ILE A 380 -1.264 21.258 -5.503 1.00 0.00 C ATOM 130 CD1 ILE A 380 -1.606 22.585 -2.848 1.00 0.00 C ATOM 0 H ILE A 380 1.917 23.237 -4.124 1.00 0.00 H new ATOM 0 HA ILE A 380 0.439 21.027 -3.275 1.00 0.00 H new ATOM 0 HB ILE A 380 0.249 22.727 -5.777 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -0.068 23.866 -3.589 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.526 23.855 -4.561 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -2.025 21.836 -6.027 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.796 20.561 -6.198 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.728 20.702 -4.688 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -2.032 23.365 -2.218 1.00 0.00 H new ATOM 0 HD12 ILE A 380 -2.407 21.960 -3.244 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.926 21.972 -2.256 1.00 0.00 H new ATOM 142 N LYS A 381 2.465 20.501 -5.787 1.00 0.00 N ATOM 143 CA LYS A 381 3.054 19.476 -6.644 1.00 0.00 C ATOM 144 C LYS A 381 3.429 18.245 -5.827 1.00 0.00 C ATOM 145 O LYS A 381 3.347 17.116 -6.312 1.00 0.00 O ATOM 146 CB LYS A 381 4.290 20.025 -7.359 1.00 0.00 C ATOM 147 CG LYS A 381 3.961 20.966 -8.506 1.00 0.00 C ATOM 148 CD LYS A 381 4.451 20.422 -9.839 1.00 0.00 C ATOM 149 CE LYS A 381 4.586 21.527 -10.874 1.00 0.00 C ATOM 150 NZ LYS A 381 4.358 21.024 -12.257 1.00 0.00 N ATOM 0 H LYS A 381 2.945 21.401 -5.814 1.00 0.00 H new ATOM 0 HA LYS A 381 2.314 19.188 -7.390 1.00 0.00 H new ATOM 0 HB2 LYS A 381 4.914 20.551 -6.636 1.00 0.00 H new ATOM 0 HB3 LYS A 381 4.879 19.191 -7.741 1.00 0.00 H new ATOM 0 HG2 LYS A 381 2.883 21.122 -8.551 1.00 0.00 H new ATOM 0 HG3 LYS A 381 4.416 21.939 -8.321 1.00 0.00 H new ATOM 0 HD2 LYS A 381 5.414 19.931 -9.701 1.00 0.00 H new ATOM 0 HD3 LYS A 381 3.756 19.665 -10.202 1.00 0.00 H new ATOM 0 HE2 LYS A 381 3.871 22.320 -10.654 1.00 0.00 H new ATOM 0 HE3 LYS A 381 5.581 21.967 -10.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 4.459 21.808 -12.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 5.056 20.285 -12.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 3.399 20.627 -12.328 1.00 0.00 H new ATOM 164 N LYS A 382 3.830 18.468 -4.580 1.00 0.00 N ATOM 165 CA LYS A 382 4.205 17.373 -3.694 1.00 0.00 C ATOM 166 C LYS A 382 2.990 16.541 -3.336 1.00 0.00 C ATOM 167 O LYS A 382 3.059 15.315 -3.253 1.00 0.00 O ATOM 168 CB LYS A 382 4.880 17.905 -2.429 1.00 0.00 C ATOM 169 CG LYS A 382 6.086 18.786 -2.709 1.00 0.00 C ATOM 170 CD LYS A 382 6.968 18.931 -1.479 1.00 0.00 C ATOM 171 CE LYS A 382 6.253 19.680 -0.367 1.00 0.00 C ATOM 172 NZ LYS A 382 7.177 20.576 0.382 1.00 0.00 N ATOM 0 H LYS A 382 3.903 19.395 -4.161 1.00 0.00 H new ATOM 0 HA LYS A 382 4.918 16.738 -4.220 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.152 18.473 -1.850 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.191 17.063 -1.811 1.00 0.00 H new ATOM 0 HG2 LYS A 382 6.667 18.360 -3.527 1.00 0.00 H new ATOM 0 HG3 LYS A 382 5.751 19.770 -3.036 1.00 0.00 H new ATOM 0 HD2 LYS A 382 7.263 17.944 -1.123 1.00 0.00 H new ATOM 0 HD3 LYS A 382 7.883 19.460 -1.746 1.00 0.00 H new ATOM 0 HE2 LYS A 382 5.440 20.269 -0.791 1.00 0.00 H new ATOM 0 HE3 LYS A 382 5.803 18.965 0.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 7.277 20.234 1.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 8.109 20.579 -0.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 6.792 21.542 0.391 1.00 0.00 H new ATOM 186 N ILE A 383 1.876 17.218 -3.148 1.00 0.00 N ATOM 187 CA ILE A 383 0.624 16.551 -2.820 1.00 0.00 C ATOM 188 C ILE A 383 0.253 15.590 -3.941 1.00 0.00 C ATOM 189 O ILE A 383 -0.302 14.518 -3.706 1.00 0.00 O ATOM 190 CB ILE A 383 -0.527 17.558 -2.619 1.00 0.00 C ATOM 191 CG1 ILE A 383 -0.078 18.722 -1.730 1.00 0.00 C ATOM 192 CG2 ILE A 383 -1.739 16.864 -2.018 1.00 0.00 C ATOM 193 CD1 ILE A 383 0.516 18.285 -0.408 1.00 0.00 C ATOM 0 H ILE A 383 1.808 18.233 -3.216 1.00 0.00 H new ATOM 0 HA ILE A 383 0.770 16.011 -1.884 1.00 0.00 H new ATOM 0 HB ILE A 383 -0.806 17.961 -3.593 1.00 0.00 H new ATOM 0 HG12 ILE A 383 0.659 19.317 -2.270 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.932 19.371 -1.537 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -2.543 17.588 -1.882 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -2.074 16.072 -2.687 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -1.471 16.434 -1.053 1.00 0.00 H new ATOM 0 HD11 ILE A 383 0.811 19.163 0.167 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -0.225 17.716 0.153 1.00 0.00 H new ATOM 0 HD13 ILE A 383 1.391 17.661 -0.591 1.00 0.00 H new ATOM 205 N ILE A 384 0.599 15.985 -5.161 1.00 0.00 N ATOM 206 CA ILE A 384 0.346 15.167 -6.341 1.00 0.00 C ATOM 207 C ILE A 384 1.334 14.019 -6.381 1.00 0.00 C ATOM 208 O ILE A 384 0.978 12.870 -6.641 1.00 0.00 O ATOM 209 CB ILE A 384 0.499 15.965 -7.658 1.00 0.00 C ATOM 210 CG1 ILE A 384 0.422 17.470 -7.412 1.00 0.00 C ATOM 211 CG2 ILE A 384 -0.555 15.539 -8.668 1.00 0.00 C ATOM 212 CD1 ILE A 384 -0.876 17.917 -6.773 1.00 0.00 C ATOM 0 H ILE A 384 1.059 16.874 -5.359 1.00 0.00 H new ATOM 0 HA ILE A 384 -0.682 14.812 -6.265 1.00 0.00 H new ATOM 0 HB ILE A 384 1.485 15.743 -8.065 1.00 0.00 H new ATOM 0 HG12 ILE A 384 1.253 17.768 -6.772 1.00 0.00 H new ATOM 0 HG13 ILE A 384 0.548 17.991 -8.361 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -0.431 16.112 -9.587 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -0.443 14.477 -8.884 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -1.548 15.723 -8.257 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.858 18.997 -6.629 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -1.711 17.651 -7.421 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -0.995 17.424 -5.808 1.00 0.00 H new ATOM 224 N HIS A 385 2.589 14.358 -6.115 1.00 0.00 N ATOM 225 CA HIS A 385 3.665 13.376 -6.109 1.00 0.00 C ATOM 226 C HIS A 385 3.378 12.266 -5.096 1.00 0.00 C ATOM 227 O HIS A 385 3.466 11.080 -5.418 1.00 0.00 O ATOM 228 CB HIS A 385 5.002 14.068 -5.803 1.00 0.00 C ATOM 229 CG HIS A 385 6.001 13.202 -5.099 1.00 0.00 C ATOM 230 ND1 HIS A 385 6.026 12.803 -3.806 1.00 0.00 N flip ATOM 231 CD2 HIS A 385 7.090 12.680 -5.753 1.00 0.00 C flip ATOM 232 CE1 HIS A 385 7.145 12.024 -3.654 1.00 0.00 C flip ATOM 233 NE2 HIS A 385 7.752 11.979 -4.850 1.00 0.00 N flip ATOM 0 H HIS A 385 2.887 15.309 -5.900 1.00 0.00 H new ATOM 0 HA HIS A 385 3.729 12.917 -7.095 1.00 0.00 H new ATOM 0 HB2 HIS A 385 5.438 14.418 -6.739 1.00 0.00 H new ATOM 0 HB3 HIS A 385 4.809 14.950 -5.192 1.00 0.00 H new ATOM 0 HD2 HIS A 385 7.351 12.815 -6.792 1.00 0.00 H new ATOM 0 HE1 HIS A 385 7.474 11.540 -2.746 1.00 0.00 H new ATOM 0 HE2 HIS A 385 8.615 11.468 -5.038 1.00 0.00 H new ATOM 241 N VAL A 386 3.028 12.658 -3.874 1.00 0.00 N ATOM 242 CA VAL A 386 2.723 11.691 -2.825 1.00 0.00 C ATOM 243 C VAL A 386 1.464 10.902 -3.167 1.00 0.00 C ATOM 244 O VAL A 386 1.423 9.682 -3.005 1.00 0.00 O ATOM 245 CB VAL A 386 2.539 12.377 -1.454 1.00 0.00 C ATOM 246 CG1 VAL A 386 2.202 11.354 -0.376 1.00 0.00 C ATOM 247 CG2 VAL A 386 3.788 13.161 -1.080 1.00 0.00 C ATOM 0 H VAL A 386 2.949 13.634 -3.587 1.00 0.00 H new ATOM 0 HA VAL A 386 3.572 11.011 -2.761 1.00 0.00 H new ATOM 0 HB VAL A 386 1.704 13.074 -1.530 1.00 0.00 H new ATOM 0 HG11 VAL A 386 2.077 11.861 0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 386 1.277 10.841 -0.638 1.00 0.00 H new ATOM 0 HG13 VAL A 386 3.011 10.627 -0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 386 3.641 13.638 -0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.640 12.484 -1.026 1.00 0.00 H new ATOM 0 HG23 VAL A 386 3.978 13.924 -1.835 1.00 0.00 H new ATOM 257 N LEU A 387 0.438 11.602 -3.644 1.00 0.00 N ATOM 258 CA LEU A 387 -0.816 10.955 -4.009 1.00 0.00 C ATOM 259 C LEU A 387 -0.590 9.946 -5.125 1.00 0.00 C ATOM 260 O LEU A 387 -1.211 8.884 -5.152 1.00 0.00 O ATOM 261 CB LEU A 387 -1.856 11.995 -4.433 1.00 0.00 C ATOM 262 CG LEU A 387 -3.310 11.518 -4.370 1.00 0.00 C ATOM 263 CD1 LEU A 387 -4.204 12.598 -3.777 1.00 0.00 C ATOM 264 CD2 LEU A 387 -3.801 11.116 -5.754 1.00 0.00 C ATOM 0 H LEU A 387 0.451 12.612 -3.786 1.00 0.00 H new ATOM 0 HA LEU A 387 -1.195 10.426 -3.135 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.750 12.874 -3.797 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.637 12.311 -5.453 1.00 0.00 H new ATOM 0 HG LEU A 387 -3.356 10.643 -3.722 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -5.233 12.239 -3.741 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -3.867 12.836 -2.768 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -4.153 13.493 -4.397 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -4.836 10.780 -5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -3.739 11.973 -6.425 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -3.180 10.307 -6.140 1.00 0.00 H new ATOM 276 N GLU A 388 0.320 10.276 -6.033 1.00 0.00 N ATOM 277 CA GLU A 388 0.648 9.388 -7.137 1.00 0.00 C ATOM 278 C GLU A 388 1.234 8.091 -6.594 1.00 0.00 C ATOM 279 O GLU A 388 1.012 7.012 -7.142 1.00 0.00 O ATOM 280 CB GLU A 388 1.640 10.058 -8.090 1.00 0.00 C ATOM 281 CG GLU A 388 0.977 10.752 -9.269 1.00 0.00 C ATOM 282 CD GLU A 388 1.758 11.959 -9.751 1.00 0.00 C ATOM 283 OE1 GLU A 388 2.555 12.505 -8.958 1.00 0.00 O ATOM 284 OE2 GLU A 388 1.572 12.359 -10.919 1.00 0.00 O ATOM 0 H GLU A 388 0.843 11.152 -6.025 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.263 9.166 -7.693 1.00 0.00 H new ATOM 0 HB2 GLU A 388 2.229 10.787 -7.534 1.00 0.00 H new ATOM 0 HB3 GLU A 388 2.335 9.307 -8.465 1.00 0.00 H new ATOM 0 HG2 GLU A 388 0.869 10.043 -10.089 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -0.028 11.064 -8.984 1.00 0.00 H new ATOM 291 N LYS A 389 1.983 8.214 -5.504 1.00 0.00 N ATOM 292 CA LYS A 389 2.604 7.060 -4.867 1.00 0.00 C ATOM 293 C LYS A 389 1.549 6.184 -4.200 1.00 0.00 C ATOM 294 O LYS A 389 1.675 4.960 -4.162 1.00 0.00 O ATOM 295 CB LYS A 389 3.638 7.518 -3.834 1.00 0.00 C ATOM 296 CG LYS A 389 4.933 6.723 -3.876 1.00 0.00 C ATOM 297 CD LYS A 389 6.018 7.464 -4.641 1.00 0.00 C ATOM 298 CE LYS A 389 6.952 8.214 -3.704 1.00 0.00 C ATOM 299 NZ LYS A 389 8.382 7.993 -4.053 1.00 0.00 N ATOM 0 H LYS A 389 2.175 9.103 -5.043 1.00 0.00 H new ATOM 0 HA LYS A 389 3.108 6.472 -5.634 1.00 0.00 H new ATOM 0 HB2 LYS A 389 3.863 8.572 -4.000 1.00 0.00 H new ATOM 0 HB3 LYS A 389 3.204 7.437 -2.837 1.00 0.00 H new ATOM 0 HG2 LYS A 389 5.273 6.526 -2.859 1.00 0.00 H new ATOM 0 HG3 LYS A 389 4.752 5.756 -4.345 1.00 0.00 H new ATOM 0 HD2 LYS A 389 6.592 6.755 -5.237 1.00 0.00 H new ATOM 0 HD3 LYS A 389 5.558 8.166 -5.336 1.00 0.00 H new ATOM 0 HE2 LYS A 389 6.729 9.280 -3.745 1.00 0.00 H new ATOM 0 HE3 LYS A 389 6.774 7.891 -2.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 8.986 8.521 -3.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 8.602 6.979 -3.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 8.558 8.325 -5.023 1.00 0.00 H new ATOM 313 N VAL A 390 0.511 6.824 -3.670 1.00 0.00 N ATOM 314 CA VAL A 390 -0.568 6.110 -2.996 1.00 0.00 C ATOM 315 C VAL A 390 -1.296 5.168 -3.951 1.00 0.00 C ATOM 316 O VAL A 390 -1.544 4.009 -3.621 1.00 0.00 O ATOM 317 CB VAL A 390 -1.587 7.087 -2.378 1.00 0.00 C ATOM 318 CG1 VAL A 390 -2.627 6.334 -1.564 1.00 0.00 C ATOM 319 CG2 VAL A 390 -0.879 8.125 -1.520 1.00 0.00 C ATOM 0 H VAL A 390 0.394 7.837 -3.694 1.00 0.00 H new ATOM 0 HA VAL A 390 -0.107 5.524 -2.201 1.00 0.00 H new ATOM 0 HB VAL A 390 -2.100 7.605 -3.188 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.337 7.042 -1.136 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -3.157 5.634 -2.210 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -2.134 5.785 -0.762 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -1.614 8.806 -1.092 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.337 7.625 -0.717 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -0.178 8.688 -2.135 1.00 0.00 H new ATOM 329 N GLN A 391 -1.639 5.668 -5.136 1.00 0.00 N ATOM 330 CA GLN A 391 -2.340 4.856 -6.123 1.00 0.00 C ATOM 331 C GLN A 391 -1.464 3.694 -6.585 1.00 0.00 C ATOM 332 O GLN A 391 -1.954 2.590 -6.825 1.00 0.00 O ATOM 333 CB GLN A 391 -2.780 5.712 -7.319 1.00 0.00 C ATOM 334 CG GLN A 391 -1.671 6.007 -8.316 1.00 0.00 C ATOM 335 CD GLN A 391 -1.783 7.390 -8.919 1.00 0.00 C ATOM 336 OE1 GLN A 391 -2.244 8.330 -8.272 1.00 0.00 O ATOM 337 NE2 GLN A 391 -1.360 7.517 -10.169 1.00 0.00 N ATOM 0 H GLN A 391 -1.444 6.624 -5.433 1.00 0.00 H new ATOM 0 HA GLN A 391 -3.233 4.445 -5.653 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -3.593 5.202 -7.837 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.180 6.656 -6.948 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -0.706 5.908 -7.820 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.697 5.264 -9.113 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.985 6.708 -10.665 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -1.409 8.423 -10.634 1.00 0.00 H new ATOM 346 N TYR A 392 -0.162 3.947 -6.695 1.00 0.00 N ATOM 347 CA TYR A 392 0.777 2.915 -7.113 1.00 0.00 C ATOM 348 C TYR A 392 0.808 1.787 -6.090 1.00 0.00 C ATOM 349 O TYR A 392 0.954 0.617 -6.441 1.00 0.00 O ATOM 350 CB TYR A 392 2.179 3.508 -7.288 1.00 0.00 C ATOM 351 CG TYR A 392 2.589 3.679 -8.733 1.00 0.00 C ATOM 352 CD1 TYR A 392 2.829 2.576 -9.542 1.00 0.00 C ATOM 353 CD2 TYR A 392 2.738 4.945 -9.288 1.00 0.00 C ATOM 354 CE1 TYR A 392 3.207 2.728 -10.863 1.00 0.00 C ATOM 355 CE2 TYR A 392 3.114 5.104 -10.607 1.00 0.00 C ATOM 356 CZ TYR A 392 3.347 3.994 -11.390 1.00 0.00 C ATOM 357 OH TYR A 392 3.723 4.150 -12.705 1.00 0.00 O ATOM 0 H TYR A 392 0.263 4.854 -6.501 1.00 0.00 H new ATOM 0 HA TYR A 392 0.447 2.512 -8.071 1.00 0.00 H new ATOM 0 HB2 TYR A 392 2.219 4.477 -6.791 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.902 2.863 -6.788 1.00 0.00 H new ATOM 0 HD1 TYR A 392 2.718 1.583 -9.132 1.00 0.00 H new ATOM 0 HD2 TYR A 392 2.557 5.818 -8.678 1.00 0.00 H new ATOM 0 HE1 TYR A 392 3.392 1.860 -11.479 1.00 0.00 H new ATOM 0 HE2 TYR A 392 3.225 6.094 -11.023 1.00 0.00 H new ATOM 0 HH TYR A 392 3.775 5.105 -12.919 1.00 0.00 H new ATOM 367 N LEU A 393 0.657 2.152 -4.821 1.00 0.00 N ATOM 368 CA LEU A 393 0.654 1.176 -3.739 1.00 0.00 C ATOM 369 C LEU A 393 -0.590 0.300 -3.822 1.00 0.00 C ATOM 370 O LEU A 393 -0.535 -0.902 -3.560 1.00 0.00 O ATOM 371 CB LEU A 393 0.711 1.886 -2.383 1.00 0.00 C ATOM 372 CG LEU A 393 2.078 1.858 -1.699 1.00 0.00 C ATOM 373 CD1 LEU A 393 2.314 3.144 -0.923 1.00 0.00 C ATOM 374 CD2 LEU A 393 2.185 0.652 -0.778 1.00 0.00 C ATOM 0 H LEU A 393 0.535 3.118 -4.517 1.00 0.00 H new ATOM 0 HA LEU A 393 1.535 0.543 -3.839 1.00 0.00 H new ATOM 0 HB2 LEU A 393 0.411 2.925 -2.520 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -0.021 1.428 -1.718 1.00 0.00 H new ATOM 0 HG LEU A 393 2.847 1.776 -2.467 1.00 0.00 H new ATOM 0 HD11 LEU A 393 3.292 3.105 -0.443 1.00 0.00 H new ATOM 0 HD12 LEU A 393 2.278 3.993 -1.606 1.00 0.00 H new ATOM 0 HD13 LEU A 393 1.541 3.257 -0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 393 3.164 0.646 -0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 393 1.408 0.706 -0.016 1.00 0.00 H new ATOM 0 HD23 LEU A 393 2.060 -0.262 -1.359 1.00 0.00 H new ATOM 386 N GLU A 394 -1.711 0.913 -4.192 1.00 0.00 N ATOM 387 CA GLU A 394 -2.971 0.191 -4.317 1.00 0.00 C ATOM 388 C GLU A 394 -2.842 -0.942 -5.327 1.00 0.00 C ATOM 389 O GLU A 394 -3.377 -2.033 -5.126 1.00 0.00 O ATOM 390 CB GLU A 394 -4.091 1.147 -4.737 1.00 0.00 C ATOM 391 CG GLU A 394 -5.220 1.245 -3.725 1.00 0.00 C ATOM 392 CD GLU A 394 -5.929 -0.078 -3.511 1.00 0.00 C ATOM 393 OE1 GLU A 394 -5.253 -1.128 -3.561 1.00 0.00 O ATOM 394 OE2 GLU A 394 -7.158 -0.064 -3.294 1.00 0.00 O ATOM 0 H GLU A 394 -1.771 1.908 -4.410 1.00 0.00 H new ATOM 0 HA GLU A 394 -3.219 -0.238 -3.346 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -3.669 2.140 -4.895 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -4.499 0.818 -5.693 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -4.821 1.597 -2.774 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -5.942 1.989 -4.062 1.00 0.00 H new ATOM 401 N GLN A 395 -2.120 -0.680 -6.413 1.00 0.00 N ATOM 402 CA GLN A 395 -1.915 -1.682 -7.450 1.00 0.00 C ATOM 403 C GLN A 395 -1.027 -2.811 -6.933 1.00 0.00 C ATOM 404 O GLN A 395 -1.254 -3.983 -7.234 1.00 0.00 O ATOM 405 CB GLN A 395 -1.285 -1.042 -8.690 1.00 0.00 C ATOM 406 CG GLN A 395 -2.196 -1.048 -9.907 1.00 0.00 C ATOM 407 CD GLN A 395 -1.523 -1.623 -11.138 1.00 0.00 C ATOM 408 OE1 GLN A 395 -1.865 -2.713 -11.595 1.00 0.00 O ATOM 409 NE2 GLN A 395 -0.560 -0.888 -11.682 1.00 0.00 N ATOM 0 H GLN A 395 -1.669 0.216 -6.596 1.00 0.00 H new ATOM 0 HA GLN A 395 -2.884 -2.099 -7.724 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -1.010 -0.013 -8.458 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -0.364 -1.571 -8.933 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.091 -1.628 -9.683 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -2.521 -0.029 -10.118 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -0.309 0.010 -11.269 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -0.071 -1.222 -12.513 1.00 0.00 H new ATOM 418 N GLU A 396 -0.016 -2.445 -6.155 1.00 0.00 N ATOM 419 CA GLU A 396 0.911 -3.420 -5.592 1.00 0.00 C ATOM 420 C GLU A 396 0.230 -4.282 -4.532 1.00 0.00 C ATOM 421 O GLU A 396 0.403 -5.499 -4.505 1.00 0.00 O ATOM 422 CB GLU A 396 2.124 -2.710 -4.987 1.00 0.00 C ATOM 423 CG GLU A 396 3.311 -2.625 -5.932 1.00 0.00 C ATOM 424 CD GLU A 396 4.316 -3.738 -5.707 1.00 0.00 C ATOM 425 OE1 GLU A 396 3.920 -4.919 -5.785 1.00 0.00 O ATOM 426 OE2 GLU A 396 5.498 -3.427 -5.451 1.00 0.00 O ATOM 0 H GLU A 396 0.184 -1.478 -5.899 1.00 0.00 H new ATOM 0 HA GLU A 396 1.243 -4.072 -6.400 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.834 -1.702 -4.689 1.00 0.00 H new ATOM 0 HB3 GLU A 396 2.428 -3.235 -4.081 1.00 0.00 H new ATOM 0 HG2 GLU A 396 2.955 -2.665 -6.961 1.00 0.00 H new ATOM 0 HG3 GLU A 396 3.805 -1.662 -5.803 1.00 0.00 H new ATOM 433 N VAL A 397 -0.539 -3.642 -3.654 1.00 0.00 N ATOM 434 CA VAL A 397 -1.236 -4.353 -2.588 1.00 0.00 C ATOM 435 C VAL A 397 -2.215 -5.378 -3.150 1.00 0.00 C ATOM 436 O VAL A 397 -2.244 -6.527 -2.710 1.00 0.00 O ATOM 437 CB VAL A 397 -2.001 -3.383 -1.668 1.00 0.00 C ATOM 438 CG1 VAL A 397 -2.560 -4.120 -0.459 1.00 0.00 C ATOM 439 CG2 VAL A 397 -1.104 -2.230 -1.237 1.00 0.00 C ATOM 0 H VAL A 397 -0.694 -2.634 -3.661 1.00 0.00 H new ATOM 0 HA VAL A 397 -0.471 -4.868 -2.007 1.00 0.00 H new ATOM 0 HB VAL A 397 -2.839 -2.967 -2.228 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -3.097 -3.418 0.179 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -3.242 -4.902 -0.793 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.742 -4.569 0.104 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -1.664 -1.557 -0.588 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -0.242 -2.622 -0.697 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.763 -1.685 -2.118 1.00 0.00 H new ATOM 449 N GLU A 398 -3.016 -4.957 -4.123 1.00 0.00 N ATOM 450 CA GLU A 398 -3.995 -5.846 -4.741 1.00 0.00 C ATOM 451 C GLU A 398 -3.310 -7.076 -5.331 1.00 0.00 C ATOM 452 O GLU A 398 -3.898 -8.156 -5.397 1.00 0.00 O ATOM 453 CB GLU A 398 -4.770 -5.107 -5.834 1.00 0.00 C ATOM 454 CG GLU A 398 -3.898 -4.636 -6.986 1.00 0.00 C ATOM 455 CD GLU A 398 -4.695 -4.360 -8.246 1.00 0.00 C ATOM 456 OE1 GLU A 398 -5.319 -3.281 -8.329 1.00 0.00 O ATOM 457 OE2 GLU A 398 -4.693 -5.221 -9.150 1.00 0.00 O ATOM 0 H GLU A 398 -3.007 -4.009 -4.500 1.00 0.00 H new ATOM 0 HA GLU A 398 -4.693 -6.172 -3.970 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -5.548 -5.764 -6.223 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -5.271 -4.245 -5.393 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -3.369 -3.730 -6.690 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -3.142 -5.392 -7.197 1.00 0.00 H new ATOM 464 N GLU A 399 -2.065 -6.900 -5.756 1.00 0.00 N ATOM 465 CA GLU A 399 -1.292 -7.990 -6.340 1.00 0.00 C ATOM 466 C GLU A 399 -0.560 -8.780 -5.260 1.00 0.00 C ATOM 467 O GLU A 399 -0.740 -9.991 -5.130 1.00 0.00 O ATOM 468 CB GLU A 399 -0.282 -7.436 -7.346 1.00 0.00 C ATOM 469 CG GLU A 399 0.132 -8.440 -8.407 1.00 0.00 C ATOM 470 CD GLU A 399 0.729 -7.777 -9.633 1.00 0.00 C ATOM 471 OE1 GLU A 399 -0.046 -7.367 -10.523 1.00 0.00 O ATOM 472 OE2 GLU A 399 1.971 -7.668 -9.703 1.00 0.00 O ATOM 0 H GLU A 399 -1.568 -6.011 -5.707 1.00 0.00 H new ATOM 0 HA GLU A 399 -1.983 -8.660 -6.851 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -0.710 -6.560 -7.834 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.605 -7.100 -6.810 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.858 -9.133 -7.983 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.736 -9.029 -8.703 1.00 0.00 H new ATOM 479 N PHE A 400 0.270 -8.083 -4.491 1.00 0.00 N ATOM 480 CA PHE A 400 1.038 -8.705 -3.422 1.00 0.00 C ATOM 481 C PHE A 400 0.124 -9.432 -2.450 1.00 0.00 C ATOM 482 O PHE A 400 -0.851 -8.872 -1.950 1.00 0.00 O ATOM 483 CB PHE A 400 1.876 -7.640 -2.706 1.00 0.00 C ATOM 484 CG PHE A 400 2.229 -7.934 -1.275 1.00 0.00 C ATOM 485 CD1 PHE A 400 1.279 -7.833 -0.274 1.00 0.00 C ATOM 486 CD2 PHE A 400 3.524 -8.282 -0.936 1.00 0.00 C ATOM 487 CE1 PHE A 400 1.615 -8.080 1.044 1.00 0.00 C ATOM 488 CE2 PHE A 400 3.870 -8.523 0.379 1.00 0.00 C ATOM 489 CZ PHE A 400 2.915 -8.423 1.370 1.00 0.00 C ATOM 0 H PHE A 400 0.428 -7.080 -4.591 1.00 0.00 H new ATOM 0 HA PHE A 400 1.710 -9.448 -3.852 1.00 0.00 H new ATOM 0 HB2 PHE A 400 2.800 -7.496 -3.266 1.00 0.00 H new ATOM 0 HB3 PHE A 400 1.333 -6.695 -2.739 1.00 0.00 H new ATOM 0 HD1 PHE A 400 0.265 -7.558 -0.525 1.00 0.00 H new ATOM 0 HD2 PHE A 400 4.274 -8.366 -1.709 1.00 0.00 H new ATOM 0 HE1 PHE A 400 0.865 -8.005 1.817 1.00 0.00 H new ATOM 0 HE2 PHE A 400 4.886 -8.789 0.631 1.00 0.00 H new ATOM 0 HZ PHE A 400 3.182 -8.612 2.399 1.00 0.00 H new ATOM 499 N VAL A 401 0.455 -10.684 -2.191 1.00 0.00 N ATOM 500 CA VAL A 401 -0.318 -11.508 -1.281 1.00 0.00 C ATOM 501 C VAL A 401 0.573 -12.061 -0.179 1.00 0.00 C ATOM 502 O VAL A 401 0.450 -13.224 0.206 1.00 0.00 O ATOM 503 CB VAL A 401 -0.999 -12.677 -2.016 1.00 0.00 C ATOM 504 CG1 VAL A 401 -2.047 -12.159 -2.989 1.00 0.00 C ATOM 505 CG2 VAL A 401 0.035 -13.529 -2.738 1.00 0.00 C ATOM 0 H VAL A 401 1.261 -11.155 -2.602 1.00 0.00 H new ATOM 0 HA VAL A 401 -1.091 -10.874 -0.846 1.00 0.00 H new ATOM 0 HB VAL A 401 -1.501 -13.303 -1.278 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -2.517 -13.000 -3.499 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -2.804 -11.596 -2.443 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -1.572 -11.509 -3.724 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -0.465 -14.350 -3.252 1.00 0.00 H new ATOM 0 HG22 VAL A 401 0.567 -12.916 -3.466 1.00 0.00 H new ATOM 0 HG23 VAL A 401 0.744 -13.932 -2.015 1.00 0.00 H new ATOM 515 N GLY A 402 1.480 -11.221 0.320 1.00 0.00 N ATOM 516 CA GLY A 402 2.382 -11.645 1.366 1.00 0.00 C ATOM 517 C GLY A 402 1.665 -12.246 2.559 1.00 0.00 C ATOM 518 O GLY A 402 0.498 -12.627 2.477 1.00 0.00 O ATOM 0 H GLY A 402 1.601 -10.255 0.014 1.00 0.00 H new ATOM 0 HA2 GLY A 402 3.080 -12.378 0.961 1.00 0.00 H new ATOM 0 HA3 GLY A 402 2.973 -10.791 1.697 1.00 0.00 H new ATOM 522 N LYS A 403 2.379 -12.336 3.666 1.00 0.00 N ATOM 523 CA LYS A 403 1.820 -12.910 4.896 1.00 0.00 C ATOM 524 C LYS A 403 2.124 -12.034 6.109 1.00 0.00 C ATOM 525 O LYS A 403 3.195 -11.446 6.211 1.00 0.00 O ATOM 526 CB LYS A 403 2.355 -14.331 5.137 1.00 0.00 C ATOM 527 CG LYS A 403 3.164 -14.906 3.982 1.00 0.00 C ATOM 528 CD LYS A 403 2.311 -15.105 2.742 1.00 0.00 C ATOM 529 CE LYS A 403 2.492 -16.495 2.153 1.00 0.00 C ATOM 530 NZ LYS A 403 1.326 -16.902 1.320 1.00 0.00 N ATOM 0 H LYS A 403 3.346 -12.022 3.748 1.00 0.00 H new ATOM 0 HA LYS A 403 0.739 -12.957 4.764 1.00 0.00 H new ATOM 0 HB2 LYS A 403 2.977 -14.324 6.032 1.00 0.00 H new ATOM 0 HB3 LYS A 403 1.513 -14.993 5.339 1.00 0.00 H new ATOM 0 HG2 LYS A 403 3.993 -14.237 3.750 1.00 0.00 H new ATOM 0 HG3 LYS A 403 3.598 -15.860 4.282 1.00 0.00 H new ATOM 0 HD2 LYS A 403 1.262 -14.950 2.993 1.00 0.00 H new ATOM 0 HD3 LYS A 403 2.574 -14.356 1.995 1.00 0.00 H new ATOM 0 HE2 LYS A 403 3.397 -16.517 1.546 1.00 0.00 H new ATOM 0 HE3 LYS A 403 2.631 -17.215 2.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 1.489 -17.855 0.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 0.466 -16.906 1.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 1.208 -16.229 0.536 1.00 0.00 H new ATOM 544 N LYS A 404 1.172 -11.962 7.032 1.00 0.00 N ATOM 545 CA LYS A 404 1.325 -11.160 8.243 1.00 0.00 C ATOM 546 C LYS A 404 2.584 -11.538 9.020 1.00 0.00 C ATOM 547 O LYS A 404 3.118 -10.729 9.779 1.00 0.00 O ATOM 548 CB LYS A 404 0.095 -11.315 9.140 1.00 0.00 C ATOM 549 CG LYS A 404 -0.400 -10.001 9.723 1.00 0.00 C ATOM 550 CD LYS A 404 -0.051 -9.877 11.199 1.00 0.00 C ATOM 551 CE LYS A 404 0.556 -8.518 11.517 1.00 0.00 C ATOM 552 NZ LYS A 404 1.274 -8.521 12.822 1.00 0.00 N ATOM 0 H LYS A 404 0.280 -12.452 6.965 1.00 0.00 H new ATOM 0 HA LYS A 404 1.422 -10.119 7.935 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -0.709 -11.774 8.565 1.00 0.00 H new ATOM 0 HB3 LYS A 404 0.333 -11.998 9.955 1.00 0.00 H new ATOM 0 HG2 LYS A 404 0.041 -9.169 9.173 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -1.480 -9.930 9.597 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -0.948 -10.025 11.800 1.00 0.00 H new ATOM 0 HD3 LYS A 404 0.651 -10.664 11.475 1.00 0.00 H new ATOM 0 HE2 LYS A 404 1.247 -8.235 10.723 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -0.232 -7.765 11.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 1.673 -7.577 13.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 0.609 -8.766 13.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 2.042 -9.222 12.794 1.00 0.00 H new ATOM 566 N THR A 405 3.054 -12.765 8.833 1.00 0.00 N ATOM 567 CA THR A 405 4.250 -13.231 9.530 1.00 0.00 C ATOM 568 C THR A 405 5.433 -13.365 8.575 1.00 0.00 C ATOM 569 O THR A 405 6.444 -13.981 8.914 1.00 0.00 O ATOM 570 CB THR A 405 3.975 -14.573 10.214 1.00 0.00 C ATOM 571 OG1 THR A 405 2.926 -15.265 9.561 1.00 0.00 O ATOM 572 CG2 THR A 405 3.594 -14.433 11.673 1.00 0.00 C ATOM 0 H THR A 405 2.630 -13.452 8.210 1.00 0.00 H new ATOM 0 HA THR A 405 4.507 -12.488 10.285 1.00 0.00 H new ATOM 0 HB THR A 405 4.912 -15.127 10.150 1.00 0.00 H new ATOM 0 HG1 THR A 405 2.767 -16.120 10.013 1.00 0.00 H new ATOM 0 HG21 THR A 405 3.413 -15.420 12.098 1.00 0.00 H new ATOM 0 HG22 THR A 405 4.405 -13.948 12.216 1.00 0.00 H new ATOM 0 HG23 THR A 405 2.690 -13.830 11.757 1.00 0.00 H new ATOM 580 N ASP A 406 5.307 -12.790 7.384 1.00 0.00 N ATOM 581 CA ASP A 406 6.375 -12.855 6.391 1.00 0.00 C ATOM 582 C ASP A 406 7.255 -11.610 6.446 1.00 0.00 C ATOM 583 O ASP A 406 6.811 -10.540 6.865 1.00 0.00 O ATOM 584 CB ASP A 406 5.786 -13.013 4.990 1.00 0.00 C ATOM 585 CG ASP A 406 6.562 -14.007 4.145 1.00 0.00 C ATOM 586 OD1 ASP A 406 7.666 -14.411 4.567 1.00 0.00 O ATOM 587 OD2 ASP A 406 6.065 -14.379 3.061 1.00 0.00 O ATOM 0 H ASP A 406 4.480 -12.275 7.083 1.00 0.00 H new ATOM 0 HA ASP A 406 6.994 -13.722 6.621 1.00 0.00 H new ATOM 0 HB2 ASP A 406 4.749 -13.339 5.069 1.00 0.00 H new ATOM 0 HB3 ASP A 406 5.778 -12.044 4.491 1.00 0.00 H new ATOM 592 N LYS A 407 8.504 -11.757 6.018 1.00 0.00 N ATOM 593 CA LYS A 407 9.448 -10.645 6.014 1.00 0.00 C ATOM 594 C LYS A 407 9.085 -9.634 4.933 1.00 0.00 C ATOM 595 O LYS A 407 9.110 -8.426 5.165 1.00 0.00 O ATOM 596 CB LYS A 407 10.873 -11.156 5.795 1.00 0.00 C ATOM 597 CG LYS A 407 11.589 -11.526 7.084 1.00 0.00 C ATOM 598 CD LYS A 407 12.989 -10.936 7.137 1.00 0.00 C ATOM 599 CE LYS A 407 13.889 -11.724 8.073 1.00 0.00 C ATOM 600 NZ LYS A 407 15.284 -11.812 7.560 1.00 0.00 N ATOM 0 H LYS A 407 8.887 -12.636 5.669 1.00 0.00 H new ATOM 0 HA LYS A 407 9.395 -10.151 6.984 1.00 0.00 H new ATOM 0 HB2 LYS A 407 10.841 -12.029 5.143 1.00 0.00 H new ATOM 0 HB3 LYS A 407 11.449 -10.390 5.275 1.00 0.00 H new ATOM 0 HG2 LYS A 407 11.011 -11.170 7.937 1.00 0.00 H new ATOM 0 HG3 LYS A 407 11.648 -12.611 7.170 1.00 0.00 H new ATOM 0 HD2 LYS A 407 13.420 -10.929 6.136 1.00 0.00 H new ATOM 0 HD3 LYS A 407 12.936 -9.899 7.469 1.00 0.00 H new ATOM 0 HE2 LYS A 407 13.893 -11.252 9.056 1.00 0.00 H new ATOM 0 HE3 LYS A 407 13.486 -12.728 8.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 15.866 -12.357 8.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 15.284 -12.285 6.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 15.678 -10.855 7.460 1.00 0.00 H new ATOM 614 N ALA A 408 8.741 -10.136 3.750 1.00 0.00 N ATOM 615 CA ALA A 408 8.366 -9.275 2.637 1.00 0.00 C ATOM 616 C ALA A 408 7.109 -8.483 2.974 1.00 0.00 C ATOM 617 O ALA A 408 6.947 -7.342 2.542 1.00 0.00 O ATOM 618 CB ALA A 408 8.156 -10.098 1.376 1.00 0.00 C ATOM 0 H ALA A 408 8.715 -11.134 3.540 1.00 0.00 H new ATOM 0 HA ALA A 408 9.178 -8.570 2.457 1.00 0.00 H new ATOM 0 HB1 ALA A 408 7.876 -9.439 0.554 1.00 0.00 H new ATOM 0 HB2 ALA A 408 9.079 -10.620 1.124 1.00 0.00 H new ATOM 0 HB3 ALA A 408 7.362 -10.825 1.544 1.00 0.00 H new ATOM 624 N TYR A 409 6.227 -9.097 3.756 1.00 0.00 N ATOM 625 CA TYR A 409 4.986 -8.449 4.161 1.00 0.00 C ATOM 626 C TYR A 409 5.279 -7.284 5.088 1.00 0.00 C ATOM 627 O TYR A 409 4.712 -6.201 4.941 1.00 0.00 O ATOM 628 CB TYR A 409 4.064 -9.448 4.857 1.00 0.00 C ATOM 629 CG TYR A 409 2.994 -8.806 5.719 1.00 0.00 C ATOM 630 CD1 TYR A 409 3.267 -8.408 7.026 1.00 0.00 C ATOM 631 CD2 TYR A 409 1.712 -8.598 5.225 1.00 0.00 C ATOM 632 CE1 TYR A 409 2.290 -7.823 7.810 1.00 0.00 C ATOM 633 CE2 TYR A 409 0.733 -8.013 6.004 1.00 0.00 C ATOM 634 CZ TYR A 409 1.026 -7.627 7.294 1.00 0.00 C ATOM 635 OH TYR A 409 0.053 -7.046 8.073 1.00 0.00 O ATOM 0 H TYR A 409 6.349 -10.042 4.121 1.00 0.00 H new ATOM 0 HA TYR A 409 4.487 -8.074 3.268 1.00 0.00 H new ATOM 0 HB2 TYR A 409 3.583 -10.069 4.102 1.00 0.00 H new ATOM 0 HB3 TYR A 409 4.667 -10.111 5.478 1.00 0.00 H new ATOM 0 HD1 TYR A 409 4.256 -8.559 7.433 1.00 0.00 H new ATOM 0 HD2 TYR A 409 1.477 -8.899 4.215 1.00 0.00 H new ATOM 0 HE1 TYR A 409 2.516 -7.521 8.822 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.258 -7.859 5.604 1.00 0.00 H new ATOM 0 HH TYR A 409 -0.073 -6.114 7.798 1.00 0.00 H new ATOM 645 N TRP A 410 6.176 -7.507 6.040 1.00 0.00 N ATOM 646 CA TRP A 410 6.544 -6.462 6.976 1.00 0.00 C ATOM 647 C TRP A 410 7.025 -5.254 6.195 1.00 0.00 C ATOM 648 O TRP A 410 6.564 -4.135 6.404 1.00 0.00 O ATOM 649 CB TRP A 410 7.627 -6.966 7.924 1.00 0.00 C ATOM 650 CG TRP A 410 7.263 -6.770 9.352 1.00 0.00 C ATOM 651 CD1 TRP A 410 6.672 -7.676 10.183 1.00 0.00 C ATOM 652 CD2 TRP A 410 7.449 -5.582 10.112 1.00 0.00 C ATOM 653 NE1 TRP A 410 6.478 -7.118 11.420 1.00 0.00 N ATOM 654 CE2 TRP A 410 6.953 -5.829 11.404 1.00 0.00 C ATOM 655 CE3 TRP A 410 7.993 -4.332 9.818 1.00 0.00 C ATOM 656 CZ2 TRP A 410 6.984 -4.864 12.406 1.00 0.00 C ATOM 657 CZ3 TRP A 410 8.025 -3.372 10.812 1.00 0.00 C ATOM 658 CH2 TRP A 410 7.524 -3.644 12.095 1.00 0.00 C ATOM 0 H TRP A 410 6.657 -8.396 6.181 1.00 0.00 H new ATOM 0 HA TRP A 410 5.680 -6.178 7.577 1.00 0.00 H new ATOM 0 HB2 TRP A 410 7.805 -8.025 7.739 1.00 0.00 H new ATOM 0 HB3 TRP A 410 8.561 -6.445 7.715 1.00 0.00 H new ATOM 0 HD1 TRP A 410 6.398 -8.684 9.907 1.00 0.00 H new ATOM 0 HE1 TRP A 410 6.051 -7.583 12.221 1.00 0.00 H new ATOM 0 HE3 TRP A 410 8.382 -4.118 8.833 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 6.596 -5.069 13.393 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 8.441 -2.399 10.599 1.00 0.00 H new ATOM 0 HH2 TRP A 410 7.565 -2.875 12.853 1.00 0.00 H new ATOM 669 N LEU A 411 7.914 -5.520 5.251 1.00 0.00 N ATOM 670 CA LEU A 411 8.435 -4.501 4.365 1.00 0.00 C ATOM 671 C LEU A 411 7.283 -3.886 3.580 1.00 0.00 C ATOM 672 O LEU A 411 7.257 -2.680 3.338 1.00 0.00 O ATOM 673 CB LEU A 411 9.464 -5.103 3.407 1.00 0.00 C ATOM 674 CG LEU A 411 10.916 -5.025 3.882 1.00 0.00 C ATOM 675 CD1 LEU A 411 11.373 -3.577 3.963 1.00 0.00 C ATOM 676 CD2 LEU A 411 11.072 -5.713 5.230 1.00 0.00 C ATOM 0 H LEU A 411 8.293 -6.452 5.080 1.00 0.00 H new ATOM 0 HA LEU A 411 8.928 -3.728 4.954 1.00 0.00 H new ATOM 0 HB2 LEU A 411 9.210 -6.149 3.236 1.00 0.00 H new ATOM 0 HB3 LEU A 411 9.384 -4.594 2.446 1.00 0.00 H new ATOM 0 HG LEU A 411 11.545 -5.542 3.158 1.00 0.00 H new ATOM 0 HD11 LEU A 411 12.408 -3.541 4.303 1.00 0.00 H new ATOM 0 HD12 LEU A 411 11.298 -3.116 2.978 1.00 0.00 H new ATOM 0 HD13 LEU A 411 10.741 -3.035 4.666 1.00 0.00 H new ATOM 0 HD21 LEU A 411 12.111 -5.648 5.553 1.00 0.00 H new ATOM 0 HD22 LEU A 411 10.432 -5.224 5.964 1.00 0.00 H new ATOM 0 HD23 LEU A 411 10.785 -6.761 5.139 1.00 0.00 H new ATOM 688 N LEU A 412 6.318 -4.731 3.191 1.00 0.00 N ATOM 689 CA LEU A 412 5.159 -4.257 2.443 1.00 0.00 C ATOM 690 C LEU A 412 4.416 -3.211 3.263 1.00 0.00 C ATOM 691 O LEU A 412 4.108 -2.121 2.778 1.00 0.00 O ATOM 692 CB LEU A 412 4.221 -5.415 2.107 1.00 0.00 C ATOM 693 CG LEU A 412 3.483 -5.269 0.774 1.00 0.00 C ATOM 694 CD1 LEU A 412 2.794 -3.916 0.688 1.00 0.00 C ATOM 695 CD2 LEU A 412 4.446 -5.453 -0.389 1.00 0.00 C ATOM 0 H LEU A 412 6.321 -5.733 3.382 1.00 0.00 H new ATOM 0 HA LEU A 412 5.504 -3.812 1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 412 4.798 -6.340 2.089 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.486 -5.514 2.906 1.00 0.00 H new ATOM 0 HG LEU A 412 2.720 -6.045 0.717 1.00 0.00 H new ATOM 0 HD11 LEU A 412 2.275 -3.832 -0.267 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.075 -3.822 1.501 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.538 -3.123 0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 412 3.905 -5.346 -1.329 1.00 0.00 H new ATOM 0 HD22 LEU A 412 5.231 -4.699 -0.334 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.893 -6.446 -0.338 1.00 0.00 H new ATOM 707 N GLU A 413 4.180 -3.536 4.528 1.00 0.00 N ATOM 708 CA GLU A 413 3.529 -2.614 5.445 1.00 0.00 C ATOM 709 C GLU A 413 4.481 -1.471 5.780 1.00 0.00 C ATOM 710 O GLU A 413 4.065 -0.338 6.017 1.00 0.00 O ATOM 711 CB GLU A 413 3.102 -3.338 6.723 1.00 0.00 C ATOM 712 CG GLU A 413 1.791 -2.830 7.298 1.00 0.00 C ATOM 713 CD GLU A 413 0.585 -3.317 6.519 1.00 0.00 C ATOM 714 OE1 GLU A 413 0.311 -2.756 5.438 1.00 0.00 O ATOM 715 OE2 GLU A 413 -0.085 -4.260 6.990 1.00 0.00 O ATOM 0 H GLU A 413 4.431 -4.434 4.941 1.00 0.00 H new ATOM 0 HA GLU A 413 2.636 -2.211 4.967 1.00 0.00 H new ATOM 0 HB2 GLU A 413 3.009 -4.404 6.514 1.00 0.00 H new ATOM 0 HB3 GLU A 413 3.885 -3.228 7.473 1.00 0.00 H new ATOM 0 HG2 GLU A 413 1.704 -3.154 8.335 1.00 0.00 H new ATOM 0 HG3 GLU A 413 1.799 -1.740 7.304 1.00 0.00 H new ATOM 722 N GLU A 414 5.772 -1.803 5.808 1.00 0.00 N ATOM 723 CA GLU A 414 6.821 -0.845 6.124 1.00 0.00 C ATOM 724 C GLU A 414 6.904 0.265 5.078 1.00 0.00 C ATOM 725 O GLU A 414 6.988 1.444 5.421 1.00 0.00 O ATOM 726 CB GLU A 414 8.167 -1.573 6.228 1.00 0.00 C ATOM 727 CG GLU A 414 8.828 -1.437 7.590 1.00 0.00 C ATOM 728 CD GLU A 414 10.030 -0.514 7.567 1.00 0.00 C ATOM 729 OE1 GLU A 414 10.098 0.351 6.668 1.00 0.00 O ATOM 730 OE2 GLU A 414 10.903 -0.655 8.449 1.00 0.00 O ATOM 0 H GLU A 414 6.115 -2.743 5.612 1.00 0.00 H new ATOM 0 HA GLU A 414 6.579 -0.380 7.080 1.00 0.00 H new ATOM 0 HB2 GLU A 414 8.017 -2.630 6.010 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.841 -1.183 5.465 1.00 0.00 H new ATOM 0 HG2 GLU A 414 8.099 -1.060 8.307 1.00 0.00 H new ATOM 0 HG3 GLU A 414 9.138 -2.422 7.939 1.00 0.00 H new ATOM 737 N MET A 415 6.884 -0.116 3.804 1.00 0.00 N ATOM 738 CA MET A 415 6.962 0.861 2.723 1.00 0.00 C ATOM 739 C MET A 415 5.739 1.770 2.724 1.00 0.00 C ATOM 740 O MET A 415 5.850 2.975 2.495 1.00 0.00 O ATOM 741 CB MET A 415 7.094 0.157 1.369 1.00 0.00 C ATOM 742 CG MET A 415 5.989 -0.847 1.090 1.00 0.00 C ATOM 743 SD MET A 415 6.147 -1.617 -0.533 1.00 0.00 S ATOM 744 CE MET A 415 4.426 -1.802 -0.992 1.00 0.00 C ATOM 0 H MET A 415 6.815 -1.086 3.497 1.00 0.00 H new ATOM 0 HA MET A 415 7.848 1.474 2.887 1.00 0.00 H new ATOM 0 HB2 MET A 415 7.098 0.908 0.579 1.00 0.00 H new ATOM 0 HB3 MET A 415 8.056 -0.354 1.328 1.00 0.00 H new ATOM 0 HG2 MET A 415 6.003 -1.620 1.858 1.00 0.00 H new ATOM 0 HG3 MET A 415 5.023 -0.347 1.159 1.00 0.00 H new ATOM 0 HE1 MET A 415 4.249 -2.820 -1.338 1.00 0.00 H new ATOM 0 HE2 MET A 415 3.795 -1.598 -0.127 1.00 0.00 H new ATOM 0 HE3 MET A 415 4.185 -1.100 -1.790 1.00 0.00 H new ATOM 754 N LEU A 416 4.573 1.190 2.988 1.00 0.00 N ATOM 755 CA LEU A 416 3.332 1.955 3.023 1.00 0.00 C ATOM 756 C LEU A 416 3.395 3.037 4.098 1.00 0.00 C ATOM 757 O LEU A 416 2.902 4.150 3.906 1.00 0.00 O ATOM 758 CB LEU A 416 2.144 1.025 3.283 1.00 0.00 C ATOM 759 CG LEU A 416 0.762 1.673 3.151 1.00 0.00 C ATOM 760 CD1 LEU A 416 0.468 2.555 4.355 1.00 0.00 C ATOM 761 CD2 LEU A 416 0.668 2.477 1.862 1.00 0.00 C ATOM 0 H LEU A 416 4.461 0.195 3.181 1.00 0.00 H new ATOM 0 HA LEU A 416 3.199 2.437 2.055 1.00 0.00 H new ATOM 0 HB2 LEU A 416 2.202 0.187 2.589 1.00 0.00 H new ATOM 0 HB3 LEU A 416 2.239 0.614 4.288 1.00 0.00 H new ATOM 0 HG LEU A 416 0.014 0.881 3.115 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -0.518 3.007 4.243 1.00 0.00 H new ATOM 0 HD12 LEU A 416 0.490 1.951 5.262 1.00 0.00 H new ATOM 0 HD13 LEU A 416 1.221 3.340 4.423 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.321 2.929 1.787 1.00 0.00 H new ATOM 0 HD22 LEU A 416 1.426 3.260 1.866 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.831 1.818 1.009 1.00 0.00 H new ATOM 773 N THR A 417 4.005 2.701 5.229 1.00 0.00 N ATOM 774 CA THR A 417 4.135 3.640 6.338 1.00 0.00 C ATOM 775 C THR A 417 5.065 4.794 5.975 1.00 0.00 C ATOM 776 O THR A 417 4.820 5.942 6.348 1.00 0.00 O ATOM 777 CB THR A 417 4.659 2.918 7.581 1.00 0.00 C ATOM 778 OG1 THR A 417 4.169 1.591 7.635 1.00 0.00 O ATOM 779 CG2 THR A 417 4.277 3.602 8.876 1.00 0.00 C ATOM 0 H THR A 417 4.418 1.785 5.403 1.00 0.00 H new ATOM 0 HA THR A 417 3.148 4.051 6.550 1.00 0.00 H new ATOM 0 HB THR A 417 5.745 2.934 7.487 1.00 0.00 H new ATOM 0 HG1 THR A 417 4.644 1.040 6.979 1.00 0.00 H new ATOM 0 HG21 THR A 417 4.680 3.039 9.718 1.00 0.00 H new ATOM 0 HG22 THR A 417 4.685 4.613 8.888 1.00 0.00 H new ATOM 0 HG23 THR A 417 3.191 3.648 8.957 1.00 0.00 H new ATOM 787 N LYS A 418 6.134 4.483 5.248 1.00 0.00 N ATOM 788 CA LYS A 418 7.101 5.496 4.839 1.00 0.00 C ATOM 789 C LYS A 418 6.428 6.598 4.027 1.00 0.00 C ATOM 790 O LYS A 418 6.726 7.780 4.202 1.00 0.00 O ATOM 791 CB LYS A 418 8.228 4.858 4.025 1.00 0.00 C ATOM 792 CG LYS A 418 9.602 5.426 4.340 1.00 0.00 C ATOM 793 CD LYS A 418 10.577 5.195 3.196 1.00 0.00 C ATOM 794 CE LYS A 418 11.497 4.017 3.473 1.00 0.00 C ATOM 795 NZ LYS A 418 12.893 4.455 3.754 1.00 0.00 N ATOM 0 H LYS A 418 6.352 3.539 4.930 1.00 0.00 H new ATOM 0 HA LYS A 418 7.523 5.943 5.739 1.00 0.00 H new ATOM 0 HB2 LYS A 418 8.236 3.784 4.211 1.00 0.00 H new ATOM 0 HB3 LYS A 418 8.021 4.996 2.964 1.00 0.00 H new ATOM 0 HG2 LYS A 418 9.518 6.495 4.538 1.00 0.00 H new ATOM 0 HG3 LYS A 418 9.989 4.963 5.248 1.00 0.00 H new ATOM 0 HD2 LYS A 418 10.022 5.015 2.275 1.00 0.00 H new ATOM 0 HD3 LYS A 418 11.173 6.094 3.038 1.00 0.00 H new ATOM 0 HE2 LYS A 418 11.116 3.451 4.323 1.00 0.00 H new ATOM 0 HE3 LYS A 418 11.493 3.344 2.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 13.488 3.622 3.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 13.266 4.973 2.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 12.901 5.076 4.588 1.00 0.00 H new ATOM 809 N GLU A 419 5.516 6.207 3.143 1.00 0.00 N ATOM 810 CA GLU A 419 4.801 7.175 2.315 1.00 0.00 C ATOM 811 C GLU A 419 3.959 8.092 3.190 1.00 0.00 C ATOM 812 O GLU A 419 3.971 9.312 3.026 1.00 0.00 O ATOM 813 CB GLU A 419 3.903 6.467 1.293 1.00 0.00 C ATOM 814 CG GLU A 419 4.498 5.186 0.731 1.00 0.00 C ATOM 815 CD GLU A 419 5.928 5.362 0.257 1.00 0.00 C ATOM 816 OE1 GLU A 419 6.845 5.302 1.102 1.00 0.00 O ATOM 817 OE2 GLU A 419 6.129 5.560 -0.960 1.00 0.00 O ATOM 0 H GLU A 419 5.255 5.234 2.981 1.00 0.00 H new ATOM 0 HA GLU A 419 5.539 7.768 1.775 1.00 0.00 H new ATOM 0 HB2 GLU A 419 2.947 6.236 1.763 1.00 0.00 H new ATOM 0 HB3 GLU A 419 3.697 7.151 0.470 1.00 0.00 H new ATOM 0 HG2 GLU A 419 4.466 4.410 1.496 1.00 0.00 H new ATOM 0 HG3 GLU A 419 3.884 4.840 -0.101 1.00 0.00 H new ATOM 824 N LEU A 420 3.236 7.492 4.129 1.00 0.00 N ATOM 825 CA LEU A 420 2.394 8.250 5.045 1.00 0.00 C ATOM 826 C LEU A 420 3.242 9.193 5.891 1.00 0.00 C ATOM 827 O LEU A 420 2.837 10.315 6.191 1.00 0.00 O ATOM 828 CB LEU A 420 1.607 7.300 5.951 1.00 0.00 C ATOM 829 CG LEU A 420 0.676 7.972 6.969 1.00 0.00 C ATOM 830 CD1 LEU A 420 1.452 8.384 8.211 1.00 0.00 C ATOM 831 CD2 LEU A 420 -0.027 9.175 6.356 1.00 0.00 C ATOM 0 H LEU A 420 3.217 6.483 4.275 1.00 0.00 H new ATOM 0 HA LEU A 420 1.692 8.842 4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 420 1.011 6.638 5.323 1.00 0.00 H new ATOM 0 HB3 LEU A 420 2.316 6.673 6.492 1.00 0.00 H new ATOM 0 HG LEU A 420 -0.085 7.248 7.259 1.00 0.00 H new ATOM 0 HD11 LEU A 420 0.776 8.859 8.922 1.00 0.00 H new ATOM 0 HD12 LEU A 420 1.900 7.502 8.670 1.00 0.00 H new ATOM 0 HD13 LEU A 420 2.238 9.087 7.933 1.00 0.00 H new ATOM 0 HD21 LEU A 420 -0.680 9.632 7.099 1.00 0.00 H new ATOM 0 HD22 LEU A 420 0.716 9.903 6.029 1.00 0.00 H new ATOM 0 HD23 LEU A 420 -0.620 8.853 5.500 1.00 0.00 H new ATOM 843 N LEU A 421 4.423 8.724 6.271 1.00 0.00 N ATOM 844 CA LEU A 421 5.337 9.515 7.082 1.00 0.00 C ATOM 845 C LEU A 421 5.923 10.669 6.273 1.00 0.00 C ATOM 846 O LEU A 421 6.216 11.734 6.814 1.00 0.00 O ATOM 847 CB LEU A 421 6.454 8.624 7.630 1.00 0.00 C ATOM 848 CG LEU A 421 6.178 8.026 9.011 1.00 0.00 C ATOM 849 CD1 LEU A 421 4.816 7.346 9.039 1.00 0.00 C ATOM 850 CD2 LEU A 421 7.274 7.042 9.392 1.00 0.00 C ATOM 0 H LEU A 421 4.771 7.796 6.029 1.00 0.00 H new ATOM 0 HA LEU A 421 4.780 9.939 7.918 1.00 0.00 H new ATOM 0 HB2 LEU A 421 6.629 7.811 6.926 1.00 0.00 H new ATOM 0 HB3 LEU A 421 7.374 9.207 7.679 1.00 0.00 H new ATOM 0 HG LEU A 421 6.171 8.835 9.741 1.00 0.00 H new ATOM 0 HD11 LEU A 421 4.639 6.927 10.030 1.00 0.00 H new ATOM 0 HD12 LEU A 421 4.040 8.076 8.810 1.00 0.00 H new ATOM 0 HD13 LEU A 421 4.793 6.547 8.298 1.00 0.00 H new ATOM 0 HD21 LEU A 421 7.063 6.626 10.377 1.00 0.00 H new ATOM 0 HD22 LEU A 421 7.311 6.237 8.658 1.00 0.00 H new ATOM 0 HD23 LEU A 421 8.234 7.558 9.414 1.00 0.00 H new ATOM 862 N GLU A 422 6.092 10.446 4.974 1.00 0.00 N ATOM 863 CA GLU A 422 6.645 11.465 4.087 1.00 0.00 C ATOM 864 C GLU A 422 5.668 12.624 3.903 1.00 0.00 C ATOM 865 O GLU A 422 6.053 13.790 3.986 1.00 0.00 O ATOM 866 CB GLU A 422 6.986 10.854 2.728 1.00 0.00 C ATOM 867 CG GLU A 422 8.205 11.479 2.068 1.00 0.00 C ATOM 868 CD GLU A 422 7.836 12.565 1.076 1.00 0.00 C ATOM 869 OE1 GLU A 422 6.999 13.425 1.421 1.00 0.00 O ATOM 870 OE2 GLU A 422 8.387 12.555 -0.045 1.00 0.00 O ATOM 0 H GLU A 422 5.854 9.569 4.511 1.00 0.00 H new ATOM 0 HA GLU A 422 7.554 11.852 4.546 1.00 0.00 H new ATOM 0 HB2 GLU A 422 7.159 9.785 2.853 1.00 0.00 H new ATOM 0 HB3 GLU A 422 6.128 10.963 2.064 1.00 0.00 H new ATOM 0 HG2 GLU A 422 8.855 11.899 2.836 1.00 0.00 H new ATOM 0 HG3 GLU A 422 8.775 10.703 1.557 1.00 0.00 H new ATOM 877 N LEU A 423 4.405 12.295 3.650 1.00 0.00 N ATOM 878 CA LEU A 423 3.376 13.310 3.451 1.00 0.00 C ATOM 879 C LEU A 423 3.096 14.069 4.743 1.00 0.00 C ATOM 880 O LEU A 423 2.737 15.247 4.717 1.00 0.00 O ATOM 881 CB LEU A 423 2.087 12.672 2.924 1.00 0.00 C ATOM 882 CG LEU A 423 1.500 11.569 3.805 1.00 0.00 C ATOM 883 CD1 LEU A 423 0.795 12.166 5.014 1.00 0.00 C ATOM 884 CD2 LEU A 423 0.542 10.702 3.000 1.00 0.00 C ATOM 0 H LEU A 423 4.070 11.334 3.578 1.00 0.00 H new ATOM 0 HA LEU A 423 3.746 14.020 2.711 1.00 0.00 H new ATOM 0 HB2 LEU A 423 1.338 13.454 2.800 1.00 0.00 H new ATOM 0 HB3 LEU A 423 2.283 12.259 1.934 1.00 0.00 H new ATOM 0 HG LEU A 423 2.317 10.942 4.163 1.00 0.00 H new ATOM 0 HD11 LEU A 423 0.384 11.365 5.628 1.00 0.00 H new ATOM 0 HD12 LEU A 423 1.508 12.745 5.602 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -0.013 12.817 4.679 1.00 0.00 H new ATOM 0 HD21 LEU A 423 0.132 9.921 3.641 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -0.270 11.318 2.614 1.00 0.00 H new ATOM 0 HD23 LEU A 423 1.077 10.245 2.168 1.00 0.00 H new ATOM 896 N ASP A 424 3.259 13.391 5.875 1.00 0.00 N ATOM 897 CA ASP A 424 3.020 14.007 7.177 1.00 0.00 C ATOM 898 C ASP A 424 4.243 14.787 7.664 1.00 0.00 C ATOM 899 O ASP A 424 4.304 15.196 8.823 1.00 0.00 O ATOM 900 CB ASP A 424 2.648 12.938 8.208 1.00 0.00 C ATOM 901 CG ASP A 424 1.776 13.488 9.321 1.00 0.00 C ATOM 902 OD1 ASP A 424 2.269 14.330 10.099 1.00 0.00 O ATOM 903 OD2 ASP A 424 0.600 13.075 9.412 1.00 0.00 O ATOM 0 H ASP A 424 3.555 12.416 5.918 1.00 0.00 H new ATOM 0 HA ASP A 424 2.193 14.708 7.062 1.00 0.00 H new ATOM 0 HB2 ASP A 424 2.125 12.122 7.709 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.558 12.518 8.637 1.00 0.00 H new ATOM 908 N SER A 425 5.217 14.992 6.779 1.00 0.00 N ATOM 909 CA SER A 425 6.429 15.723 7.132 1.00 0.00 C ATOM 910 C SER A 425 6.371 17.167 6.639 1.00 0.00 C ATOM 911 O SER A 425 7.112 18.024 7.118 1.00 0.00 O ATOM 912 CB SER A 425 7.657 15.023 6.546 1.00 0.00 C ATOM 913 OG SER A 425 8.819 15.819 6.699 1.00 0.00 O ATOM 0 H SER A 425 5.189 14.662 5.814 1.00 0.00 H new ATOM 0 HA SER A 425 6.505 15.738 8.219 1.00 0.00 H new ATOM 0 HB2 SER A 425 7.803 14.063 7.041 1.00 0.00 H new ATOM 0 HB3 SER A 425 7.491 14.815 5.489 1.00 0.00 H new ATOM 0 HG SER A 425 9.590 15.349 6.318 1.00 0.00 H new ATOM 919 N VAL A 426 5.491 17.432 5.678 1.00 0.00 N ATOM 920 CA VAL A 426 5.348 18.774 5.124 1.00 0.00 C ATOM 921 C VAL A 426 4.796 19.744 6.165 1.00 0.00 C ATOM 922 O VAL A 426 3.881 19.411 6.916 1.00 0.00 O ATOM 923 CB VAL A 426 4.422 18.779 3.892 1.00 0.00 C ATOM 924 CG1 VAL A 426 5.042 17.979 2.757 1.00 0.00 C ATOM 925 CG2 VAL A 426 3.047 18.232 4.250 1.00 0.00 C ATOM 0 H VAL A 426 4.868 16.737 5.268 1.00 0.00 H new ATOM 0 HA VAL A 426 6.344 19.098 4.822 1.00 0.00 H new ATOM 0 HB VAL A 426 4.300 19.809 3.558 1.00 0.00 H new ATOM 0 HG11 VAL A 426 4.375 17.993 1.895 1.00 0.00 H new ATOM 0 HG12 VAL A 426 6.000 18.420 2.482 1.00 0.00 H new ATOM 0 HG13 VAL A 426 5.196 16.949 3.080 1.00 0.00 H new ATOM 0 HG21 VAL A 426 2.409 18.244 3.366 1.00 0.00 H new ATOM 0 HG22 VAL A 426 3.146 17.209 4.612 1.00 0.00 H new ATOM 0 HG23 VAL A 426 2.601 18.851 5.028 1.00 0.00 H new ATOM 935 N GLU A 427 5.362 20.946 6.202 1.00 0.00 N ATOM 936 CA GLU A 427 4.929 21.966 7.150 1.00 0.00 C ATOM 937 C GLU A 427 3.674 22.675 6.652 1.00 0.00 C ATOM 938 O GLU A 427 3.466 22.817 5.447 1.00 0.00 O ATOM 939 CB GLU A 427 6.047 22.984 7.380 1.00 0.00 C ATOM 940 CG GLU A 427 5.865 23.811 8.643 1.00 0.00 C ATOM 941 CD GLU A 427 7.182 24.147 9.315 1.00 0.00 C ATOM 942 OE1 GLU A 427 7.786 23.240 9.926 1.00 0.00 O ATOM 943 OE2 GLU A 427 7.612 25.317 9.230 1.00 0.00 O ATOM 0 H GLU A 427 6.121 21.237 5.587 1.00 0.00 H new ATOM 0 HA GLU A 427 4.695 21.474 8.094 1.00 0.00 H new ATOM 0 HB2 GLU A 427 7.000 22.458 7.434 1.00 0.00 H new ATOM 0 HB3 GLU A 427 6.100 23.654 6.521 1.00 0.00 H new ATOM 0 HG2 GLU A 427 5.342 24.735 8.396 1.00 0.00 H new ATOM 0 HG3 GLU A 427 5.233 23.264 9.343 1.00 0.00 H new ATOM 950 N THR A 428 2.839 23.117 7.586 1.00 0.00 N ATOM 951 CA THR A 428 1.603 23.809 7.241 1.00 0.00 C ATOM 952 C THR A 428 1.245 24.846 8.301 1.00 0.00 C ATOM 953 O THR A 428 1.014 24.509 9.462 1.00 0.00 O ATOM 954 CB THR A 428 0.460 22.804 7.086 1.00 0.00 C ATOM 955 OG1 THR A 428 0.687 21.660 7.890 1.00 0.00 O ATOM 956 CG2 THR A 428 0.267 22.334 5.661 1.00 0.00 C ATOM 0 H THR A 428 2.996 23.008 8.588 1.00 0.00 H new ATOM 0 HA THR A 428 1.756 24.325 6.293 1.00 0.00 H new ATOM 0 HB THR A 428 -0.438 23.335 7.401 1.00 0.00 H new ATOM 0 HG1 THR A 428 0.910 21.940 8.802 1.00 0.00 H new ATOM 0 HG21 THR A 428 -0.559 21.623 5.621 1.00 0.00 H new ATOM 0 HG22 THR A 428 0.041 23.189 5.023 1.00 0.00 H new ATOM 0 HG23 THR A 428 1.179 21.851 5.311 1.00 0.00 H new ATOM 964 N GLY A 429 1.201 26.111 7.893 1.00 0.00 N ATOM 965 CA GLY A 429 0.871 27.178 8.819 1.00 0.00 C ATOM 966 C GLY A 429 -0.618 27.273 9.088 1.00 0.00 C ATOM 967 O GLY A 429 -1.047 27.307 10.242 1.00 0.00 O ATOM 0 H GLY A 429 1.388 26.415 6.938 1.00 0.00 H new ATOM 0 HA2 GLY A 429 1.397 27.014 9.759 1.00 0.00 H new ATOM 0 HA3 GLY A 429 1.226 28.127 8.416 1.00 0.00 H new ATOM 971 N GLY A 430 -1.409 27.318 8.021 1.00 0.00 N ATOM 972 CA GLY A 430 -2.850 27.408 8.168 1.00 0.00 C ATOM 973 C GLY A 430 -3.576 27.258 6.847 1.00 0.00 C ATOM 974 O GLY A 430 -4.599 27.904 6.616 1.00 0.00 O ATOM 0 H GLY A 430 -1.078 27.294 7.057 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -3.191 26.635 8.857 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -3.108 28.369 8.614 1.00 0.00 H new ATOM 978 N GLN A 431 -3.048 26.404 5.977 1.00 0.00 N ATOM 979 CA GLN A 431 -3.653 26.172 4.671 1.00 0.00 C ATOM 980 C GLN A 431 -4.531 24.925 4.692 1.00 0.00 C ATOM 981 O GLN A 431 -4.032 23.800 4.649 1.00 0.00 O ATOM 982 CB GLN A 431 -2.568 26.031 3.601 1.00 0.00 C ATOM 983 CG GLN A 431 -2.879 26.785 2.317 1.00 0.00 C ATOM 984 CD GLN A 431 -2.220 26.164 1.102 1.00 0.00 C ATOM 985 OE1 GLN A 431 -2.884 25.549 0.268 1.00 0.00 O ATOM 986 NE2 GLN A 431 -0.906 26.323 0.995 1.00 0.00 N ATOM 0 H GLN A 431 -2.203 25.861 6.153 1.00 0.00 H new ATOM 0 HA GLN A 431 -4.280 27.030 4.430 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -1.622 26.392 4.005 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -2.433 24.975 3.369 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -3.958 26.810 2.167 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -2.547 27.818 2.417 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -0.395 26.840 1.710 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -0.408 25.928 0.198 1.00 0.00 H new ATOM 995 N ASP A 432 -5.842 25.132 4.758 1.00 0.00 N ATOM 996 CA ASP A 432 -6.792 24.024 4.784 1.00 0.00 C ATOM 997 C ASP A 432 -6.667 23.171 3.526 1.00 0.00 C ATOM 998 O ASP A 432 -6.913 21.965 3.557 1.00 0.00 O ATOM 999 CB ASP A 432 -8.221 24.554 4.918 1.00 0.00 C ATOM 1000 CG ASP A 432 -8.666 24.662 6.363 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -8.095 23.948 7.215 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -9.583 25.462 6.644 1.00 0.00 O ATOM 0 H ASP A 432 -6.272 26.056 4.794 1.00 0.00 H new ATOM 0 HA ASP A 432 -6.562 23.400 5.647 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -8.287 25.534 4.446 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -8.902 23.895 4.380 1.00 0.00 H new ATOM 1007 N SER A 433 -6.284 23.804 2.423 1.00 0.00 N ATOM 1008 CA SER A 433 -6.127 23.101 1.154 1.00 0.00 C ATOM 1009 C SER A 433 -5.094 21.987 1.275 1.00 0.00 C ATOM 1010 O SER A 433 -5.311 20.871 0.804 1.00 0.00 O ATOM 1011 CB SER A 433 -5.714 24.079 0.052 1.00 0.00 C ATOM 1012 OG SER A 433 -6.343 23.758 -1.176 1.00 0.00 O ATOM 0 H SER A 433 -6.077 24.802 2.381 1.00 0.00 H new ATOM 0 HA SER A 433 -7.087 22.655 0.893 1.00 0.00 H new ATOM 0 HB2 SER A 433 -5.979 25.095 0.345 1.00 0.00 H new ATOM 0 HB3 SER A 433 -4.631 24.055 -0.073 1.00 0.00 H new ATOM 0 HG SER A 433 -6.064 24.398 -1.864 1.00 0.00 H new ATOM 1018 N VAL A 434 -3.969 22.298 1.911 1.00 0.00 N ATOM 1019 CA VAL A 434 -2.901 21.322 2.096 1.00 0.00 C ATOM 1020 C VAL A 434 -3.265 20.313 3.180 1.00 0.00 C ATOM 1021 O VAL A 434 -3.033 19.113 3.028 1.00 0.00 O ATOM 1022 CB VAL A 434 -1.573 22.006 2.471 1.00 0.00 C ATOM 1023 CG1 VAL A 434 -0.437 20.995 2.486 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -1.271 23.146 1.510 1.00 0.00 C ATOM 0 H VAL A 434 -3.773 23.218 2.307 1.00 0.00 H new ATOM 0 HA VAL A 434 -2.776 20.803 1.146 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.669 22.423 3.474 1.00 0.00 H new ATOM 0 HG11 VAL A 434 0.493 21.497 2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.652 20.217 3.218 1.00 0.00 H new ATOM 0 HG13 VAL A 434 -0.336 20.546 1.498 1.00 0.00 H new ATOM 0 HG21 VAL A 434 -0.329 23.618 1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -1.194 22.756 0.495 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -2.073 23.882 1.555 1.00 0.00 H new ATOM 1034 N ARG A 435 -3.837 20.807 4.272 1.00 0.00 N ATOM 1035 CA ARG A 435 -4.235 19.948 5.381 1.00 0.00 C ATOM 1036 C ARG A 435 -5.310 18.959 4.942 1.00 0.00 C ATOM 1037 O ARG A 435 -5.294 17.794 5.338 1.00 0.00 O ATOM 1038 CB ARG A 435 -4.751 20.792 6.549 1.00 0.00 C ATOM 1039 CG ARG A 435 -3.725 21.776 7.087 1.00 0.00 C ATOM 1040 CD ARG A 435 -2.737 21.096 8.020 1.00 0.00 C ATOM 1041 NE ARG A 435 -2.346 21.962 9.130 1.00 0.00 N ATOM 1042 CZ ARG A 435 -3.093 22.164 10.212 1.00 0.00 C ATOM 1043 NH1 ARG A 435 -4.272 21.566 10.334 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -2.662 22.967 11.175 1.00 0.00 N ATOM 0 H ARG A 435 -4.036 21.797 4.413 1.00 0.00 H new ATOM 0 HA ARG A 435 -3.359 19.387 5.706 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -5.635 21.342 6.227 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -5.064 20.129 7.355 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -3.187 22.233 6.256 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -4.234 22.580 7.618 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -3.180 20.181 8.413 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -1.850 20.804 7.458 1.00 0.00 H new ATOM 0 HE ARG A 435 -1.447 22.440 9.072 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -4.609 20.948 9.596 1.00 0.00 H new ATOM 0 HH12 ARG A 435 -4.841 21.725 11.166 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -1.757 23.430 11.086 1.00 0.00 H new ATOM 0 HH22 ARG A 435 -3.235 23.122 12.005 1.00 0.00 H new ATOM 1058 N GLN A 436 -6.241 19.432 4.120 1.00 0.00 N ATOM 1059 CA GLN A 436 -7.324 18.590 3.625 1.00 0.00 C ATOM 1060 C GLN A 436 -6.793 17.520 2.677 1.00 0.00 C ATOM 1061 O GLN A 436 -7.269 16.384 2.676 1.00 0.00 O ATOM 1062 CB GLN A 436 -8.376 19.443 2.913 1.00 0.00 C ATOM 1063 CG GLN A 436 -9.659 18.691 2.602 1.00 0.00 C ATOM 1064 CD GLN A 436 -10.221 19.035 1.236 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -9.944 18.354 0.249 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -11.013 20.099 1.173 1.00 0.00 N ATOM 0 H GLN A 436 -6.267 20.394 3.783 1.00 0.00 H new ATOM 0 HA GLN A 436 -7.785 18.095 4.480 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -8.612 20.307 3.534 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -7.954 19.825 1.983 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -9.469 17.619 2.653 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -10.403 18.919 3.365 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -11.216 20.635 2.017 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -11.419 20.381 0.281 1.00 0.00 H new ATOM 1075 N ALA A 437 -5.805 17.890 1.868 1.00 0.00 N ATOM 1076 CA ALA A 437 -5.209 16.964 0.911 1.00 0.00 C ATOM 1077 C ALA A 437 -4.331 15.934 1.613 1.00 0.00 C ATOM 1078 O ALA A 437 -4.251 14.781 1.189 1.00 0.00 O ATOM 1079 CB ALA A 437 -4.402 17.729 -0.125 1.00 0.00 C ATOM 0 H ALA A 437 -5.400 18.826 1.856 1.00 0.00 H new ATOM 0 HA ALA A 437 -6.016 16.430 0.409 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -3.962 17.028 -0.834 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -5.055 18.421 -0.657 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -3.609 18.288 0.372 1.00 0.00 H new ATOM 1085 N ARG A 438 -3.669 16.356 2.686 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.794 15.466 3.440 1.00 0.00 C ATOM 1087 C ARG A 438 -3.602 14.411 4.188 1.00 0.00 C ATOM 1088 O ARG A 438 -3.255 13.230 4.180 1.00 0.00 O ATOM 1089 CB ARG A 438 -1.933 16.270 4.418 1.00 0.00 C ATOM 1090 CG ARG A 438 -0.465 16.320 4.031 1.00 0.00 C ATOM 1091 CD ARG A 438 -0.251 17.109 2.748 1.00 0.00 C ATOM 1092 NE ARG A 438 0.910 16.631 1.998 1.00 0.00 N ATOM 1093 CZ ARG A 438 0.855 15.703 1.043 1.00 0.00 C ATOM 1094 NH1 ARG A 438 -0.303 15.151 0.704 1.00 0.00 N ATOM 1095 NH2 ARG A 438 1.965 15.331 0.419 1.00 0.00 N ATOM 0 H ARG A 438 -3.722 17.307 3.052 1.00 0.00 H new ATOM 0 HA ARG A 438 -2.140 14.954 2.734 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -2.320 17.287 4.479 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -2.024 15.834 5.413 1.00 0.00 H new ATOM 0 HG2 ARG A 438 0.109 16.774 4.838 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -0.087 15.306 3.902 1.00 0.00 H new ATOM 0 HD2 ARG A 438 -1.142 17.035 2.124 1.00 0.00 H new ATOM 0 HD3 ARG A 438 -0.118 18.164 2.989 1.00 0.00 H new ATOM 0 HE ARG A 438 1.820 17.034 2.220 1.00 0.00 H new ATOM 0 HH11 ARG A 438 -1.161 15.436 1.176 1.00 0.00 H new ATOM 0 HH12 ARG A 438 -0.335 14.442 -0.028 1.00 0.00 H new ATOM 0 HH21 ARG A 438 2.858 15.755 0.670 1.00 0.00 H new ATOM 0 HH22 ARG A 438 1.925 14.621 -0.312 1.00 0.00 H new ATOM 1109 N LYS A 439 -4.685 14.839 4.828 1.00 0.00 N ATOM 1110 CA LYS A 439 -5.539 13.920 5.571 1.00 0.00 C ATOM 1111 C LYS A 439 -6.193 12.917 4.627 1.00 0.00 C ATOM 1112 O LYS A 439 -6.448 11.772 4.999 1.00 0.00 O ATOM 1113 CB LYS A 439 -6.611 14.688 6.348 1.00 0.00 C ATOM 1114 CG LYS A 439 -7.529 15.517 5.465 1.00 0.00 C ATOM 1115 CD LYS A 439 -8.928 15.614 6.053 1.00 0.00 C ATOM 1116 CE LYS A 439 -9.888 14.653 5.369 1.00 0.00 C ATOM 1117 NZ LYS A 439 -10.759 15.346 4.380 1.00 0.00 N ATOM 0 H LYS A 439 -4.991 15.812 4.847 1.00 0.00 H new ATOM 0 HA LYS A 439 -4.917 13.377 6.282 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -7.212 13.979 6.918 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -6.124 15.345 7.069 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -7.114 16.517 5.344 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -7.581 15.071 4.472 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -8.891 15.395 7.120 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -9.297 16.634 5.949 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -9.321 13.870 4.866 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -10.509 14.165 6.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -11.398 14.656 3.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -11.320 16.077 4.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -10.168 15.790 3.649 1.00 0.00 H new ATOM 1131 N GLU A 440 -6.454 13.354 3.398 1.00 0.00 N ATOM 1132 CA GLU A 440 -7.071 12.495 2.396 1.00 0.00 C ATOM 1133 C GLU A 440 -6.135 11.350 2.024 1.00 0.00 C ATOM 1134 O GLU A 440 -6.569 10.212 1.849 1.00 0.00 O ATOM 1135 CB GLU A 440 -7.429 13.305 1.149 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.284 12.540 0.152 1.00 0.00 C ATOM 1137 CD GLU A 440 -9.623 12.125 0.731 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -9.689 11.047 1.359 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -10.605 12.877 0.554 1.00 0.00 O ATOM 0 H GLU A 440 -6.247 14.299 3.074 1.00 0.00 H new ATOM 0 HA GLU A 440 -7.984 12.076 2.818 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -7.959 14.208 1.452 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -6.510 13.625 0.657 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.450 13.159 -0.730 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -7.744 11.653 -0.179 1.00 0.00 H new ATOM 1146 N ALA A 441 -4.847 11.660 1.911 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.848 10.657 1.567 1.00 0.00 C ATOM 1148 C ALA A 441 -3.784 9.575 2.636 1.00 0.00 C ATOM 1149 O ALA A 441 -3.758 8.383 2.327 1.00 0.00 O ATOM 1150 CB ALA A 441 -2.486 11.309 1.386 1.00 0.00 C ATOM 0 H ALA A 441 -4.472 12.598 2.053 1.00 0.00 H new ATOM 0 HA ALA A 441 -4.137 10.190 0.626 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.749 10.548 1.129 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -2.539 12.047 0.586 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -2.192 11.800 2.313 1.00 0.00 H new ATOM 1156 N VAL A 442 -3.765 9.999 3.896 1.00 0.00 N ATOM 1157 CA VAL A 442 -3.712 9.070 5.019 1.00 0.00 C ATOM 1158 C VAL A 442 -4.959 8.190 5.053 1.00 0.00 C ATOM 1159 O VAL A 442 -4.912 7.043 5.492 1.00 0.00 O ATOM 1160 CB VAL A 442 -3.589 9.813 6.363 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -3.253 8.841 7.486 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -2.545 10.917 6.270 1.00 0.00 C ATOM 0 H VAL A 442 -3.786 10.983 4.165 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.828 8.449 4.876 1.00 0.00 H new ATOM 0 HB VAL A 442 -4.551 10.273 6.591 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -3.171 9.386 8.426 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -4.042 8.093 7.568 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -2.306 8.347 7.269 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.472 11.431 7.229 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.578 10.483 6.017 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.836 11.629 5.498 1.00 0.00 H new ATOM 1172 N CYS A 443 -6.076 8.741 4.585 1.00 0.00 N ATOM 1173 CA CYS A 443 -7.338 8.010 4.560 1.00 0.00 C ATOM 1174 C CYS A 443 -7.303 6.897 3.517 1.00 0.00 C ATOM 1175 O CYS A 443 -7.709 5.767 3.787 1.00 0.00 O ATOM 1176 CB CYS A 443 -8.497 8.964 4.267 1.00 0.00 C ATOM 1177 SG CYS A 443 -10.022 8.567 5.155 1.00 0.00 S ATOM 0 H CYS A 443 -6.132 9.691 4.218 1.00 0.00 H new ATOM 0 HA CYS A 443 -7.487 7.558 5.541 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -8.193 9.978 4.525 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -8.700 8.954 3.196 1.00 0.00 H new ATOM 0 HG CYS A 443 -10.943 9.430 4.844 1.00 0.00 H new ATOM 1183 N LYS A 444 -6.812 7.222 2.325 1.00 0.00 N ATOM 1184 CA LYS A 444 -6.721 6.247 1.246 1.00 0.00 C ATOM 1185 C LYS A 444 -5.776 5.113 1.627 1.00 0.00 C ATOM 1186 O LYS A 444 -6.075 3.939 1.408 1.00 0.00 O ATOM 1187 CB LYS A 444 -6.238 6.925 -0.041 1.00 0.00 C ATOM 1188 CG LYS A 444 -7.245 6.861 -1.178 1.00 0.00 C ATOM 1189 CD LYS A 444 -7.408 8.212 -1.859 1.00 0.00 C ATOM 1190 CE LYS A 444 -7.354 8.090 -3.375 1.00 0.00 C ATOM 1191 NZ LYS A 444 -6.266 8.919 -3.961 1.00 0.00 N ATOM 0 H LYS A 444 -6.472 8.153 2.083 1.00 0.00 H new ATOM 0 HA LYS A 444 -7.713 5.829 1.075 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -6.009 7.969 0.172 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -5.309 6.455 -0.363 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -6.922 6.121 -1.910 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -8.209 6.528 -0.793 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -8.359 8.656 -1.564 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -6.622 8.887 -1.520 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -7.203 7.046 -3.650 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -8.311 8.396 -3.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -6.263 8.808 -4.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -6.423 9.919 -3.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -5.350 8.611 -3.577 1.00 0.00 H new ATOM 1205 N ILE A 445 -4.636 5.475 2.203 1.00 0.00 N ATOM 1206 CA ILE A 445 -3.642 4.496 2.622 1.00 0.00 C ATOM 1207 C ILE A 445 -4.184 3.608 3.733 1.00 0.00 C ATOM 1208 O ILE A 445 -3.818 2.437 3.847 1.00 0.00 O ATOM 1209 CB ILE A 445 -2.352 5.184 3.106 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -2.655 6.098 4.283 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -1.710 5.967 1.972 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -1.419 6.528 5.040 1.00 0.00 C ATOM 0 H ILE A 445 -4.377 6.443 2.391 1.00 0.00 H new ATOM 0 HA ILE A 445 -3.411 3.881 1.752 1.00 0.00 H new ATOM 0 HB ILE A 445 -1.649 4.418 3.433 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -3.177 6.984 3.921 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -3.332 5.586 4.967 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -0.800 6.447 2.331 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -1.465 5.289 1.155 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -2.405 6.728 1.616 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -1.706 7.178 5.866 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -0.907 5.648 5.431 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -0.751 7.068 4.369 1.00 0.00 H new ATOM 1224 N GLN A 446 -5.061 4.175 4.548 1.00 0.00 N ATOM 1225 CA GLN A 446 -5.668 3.451 5.650 1.00 0.00 C ATOM 1226 C GLN A 446 -6.497 2.286 5.122 1.00 0.00 C ATOM 1227 O GLN A 446 -6.473 1.189 5.680 1.00 0.00 O ATOM 1228 CB GLN A 446 -6.530 4.412 6.467 1.00 0.00 C ATOM 1229 CG GLN A 446 -7.431 3.734 7.481 1.00 0.00 C ATOM 1230 CD GLN A 446 -6.973 3.962 8.908 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -7.763 4.332 9.776 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -5.687 3.739 9.156 1.00 0.00 N ATOM 0 H GLN A 446 -5.369 5.144 4.464 1.00 0.00 H new ATOM 0 HA GLN A 446 -4.890 3.041 6.294 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -5.878 5.112 6.989 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -7.146 4.998 5.785 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -8.448 4.107 7.365 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -7.459 2.663 7.279 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -5.068 3.433 8.405 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -5.318 3.874 10.097 1.00 0.00 H new ATOM 1241 N ALA A 447 -7.221 2.531 4.035 1.00 0.00 N ATOM 1242 CA ALA A 447 -8.046 1.500 3.423 1.00 0.00 C ATOM 1243 C ALA A 447 -7.171 0.394 2.846 1.00 0.00 C ATOM 1244 O ALA A 447 -7.529 -0.783 2.886 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.929 2.102 2.341 1.00 0.00 C ATOM 0 H ALA A 447 -7.252 3.434 3.561 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.688 1.067 4.190 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.540 1.319 1.893 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.577 2.861 2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -8.304 2.559 1.574 1.00 0.00 H new ATOM 1251 N ILE A 448 -6.016 0.786 2.318 1.00 0.00 N ATOM 1252 CA ILE A 448 -5.075 -0.165 1.740 1.00 0.00 C ATOM 1253 C ILE A 448 -4.352 -0.939 2.835 1.00 0.00 C ATOM 1254 O ILE A 448 -4.072 -2.129 2.689 1.00 0.00 O ATOM 1255 CB ILE A 448 -4.032 0.539 0.852 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -4.719 1.497 -0.121 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -3.200 -0.486 0.095 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -3.783 2.525 -0.718 1.00 0.00 C ATOM 0 H ILE A 448 -5.709 1.758 2.279 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.654 -0.853 1.124 1.00 0.00 H new ATOM 0 HB ILE A 448 -3.366 1.118 1.492 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -5.174 0.920 -0.926 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -5.528 2.012 0.398 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -2.468 0.028 -0.528 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -2.683 -1.131 0.805 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -3.852 -1.090 -0.536 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -4.338 3.171 -1.398 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -3.348 3.127 0.079 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -2.988 2.019 -1.266 1.00 0.00 H new ATOM 1270 N LEU A 449 -4.054 -0.252 3.934 1.00 0.00 N ATOM 1271 CA LEU A 449 -3.365 -0.870 5.060 1.00 0.00 C ATOM 1272 C LEU A 449 -4.150 -2.069 5.577 1.00 0.00 C ATOM 1273 O LEU A 449 -3.591 -3.146 5.788 1.00 0.00 O ATOM 1274 CB LEU A 449 -3.164 0.148 6.185 1.00 0.00 C ATOM 1275 CG LEU A 449 -2.206 -0.293 7.293 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -1.442 0.900 7.845 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -2.969 -1.001 8.404 1.00 0.00 C ATOM 0 H LEU A 449 -4.280 0.734 4.068 1.00 0.00 H new ATOM 0 HA LEU A 449 -2.390 -1.214 4.716 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -2.792 1.077 5.752 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -4.133 0.370 6.631 1.00 0.00 H new ATOM 0 HG LEU A 449 -1.486 -0.993 6.869 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -0.766 0.566 8.632 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.866 1.365 7.045 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -2.146 1.625 8.254 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -2.273 -1.308 9.185 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -3.711 -0.323 8.826 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -3.470 -1.880 7.998 1.00 0.00 H new ATOM 1289 N GLU A 450 -5.452 -1.881 5.770 1.00 0.00 N ATOM 1290 CA GLU A 450 -6.311 -2.955 6.251 1.00 0.00 C ATOM 1291 C GLU A 450 -6.404 -4.063 5.211 1.00 0.00 C ATOM 1292 O GLU A 450 -6.360 -5.247 5.546 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.705 -2.419 6.580 1.00 0.00 C ATOM 1294 CG GLU A 450 -8.353 -1.659 5.434 1.00 0.00 C ATOM 1295 CD GLU A 450 -9.799 -1.302 5.716 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -10.637 -2.226 5.783 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -10.094 -0.098 5.870 1.00 0.00 O ATOM 0 H GLU A 450 -5.933 -0.998 5.601 1.00 0.00 H new ATOM 0 HA GLU A 450 -5.874 -3.365 7.161 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -8.348 -3.253 6.861 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -7.637 -1.762 7.447 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -7.788 -0.747 5.242 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -8.302 -2.262 4.528 1.00 0.00 H new ATOM 1304 N LYS A 451 -6.514 -3.673 3.944 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.588 -4.640 2.858 1.00 0.00 C ATOM 1306 C LYS A 451 -5.355 -5.537 2.877 1.00 0.00 C ATOM 1307 O LYS A 451 -5.411 -6.702 2.486 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.700 -3.923 1.509 1.00 0.00 C ATOM 1309 CG LYS A 451 -8.087 -4.004 0.892 1.00 0.00 C ATOM 1310 CD LYS A 451 -9.117 -3.266 1.733 1.00 0.00 C ATOM 1311 CE LYS A 451 -9.794 -2.157 0.944 1.00 0.00 C ATOM 1312 NZ LYS A 451 -9.999 -0.934 1.768 1.00 0.00 N ATOM 0 H LYS A 451 -6.554 -2.698 3.647 1.00 0.00 H new ATOM 0 HA LYS A 451 -7.477 -5.255 2.996 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.430 -2.875 1.640 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -5.977 -4.354 0.816 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -8.065 -3.580 -0.112 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.380 -5.049 0.790 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -9.869 -3.970 2.089 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.633 -2.843 2.614 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -9.188 -1.910 0.072 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -10.756 -2.511 0.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -10.003 -0.097 1.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -10.909 -1.000 2.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -9.229 -0.850 2.462 1.00 0.00 H new ATOM 1326 N LEU A 452 -4.244 -4.978 3.349 1.00 0.00 N ATOM 1327 CA LEU A 452 -2.992 -5.713 3.441 1.00 0.00 C ATOM 1328 C LEU A 452 -3.023 -6.671 4.629 1.00 0.00 C ATOM 1329 O LEU A 452 -2.492 -7.780 4.560 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.818 -4.738 3.581 1.00 0.00 C ATOM 1331 CG LEU A 452 -0.885 -4.667 2.369 1.00 0.00 C ATOM 1332 CD1 LEU A 452 -0.518 -3.222 2.061 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.368 -5.495 2.612 1.00 0.00 C ATOM 0 H LEU A 452 -4.189 -4.013 3.675 1.00 0.00 H new ATOM 0 HA LEU A 452 -2.862 -6.295 2.528 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -2.215 -3.741 3.774 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -1.232 -5.022 4.455 1.00 0.00 H new ATOM 0 HG LEU A 452 -1.409 -5.080 1.507 1.00 0.00 H new ATOM 0 HD11 LEU A 452 0.146 -3.191 1.197 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -1.423 -2.655 1.844 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.013 -2.783 2.922 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.020 -5.433 1.740 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.894 -5.111 3.486 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.089 -6.535 2.784 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.652 -6.235 5.718 1.00 0.00 N ATOM 1346 CA GLU A 453 -3.754 -7.055 6.920 1.00 0.00 C ATOM 1347 C GLU A 453 -4.489 -8.358 6.626 1.00 0.00 C ATOM 1348 O GLU A 453 -4.100 -9.425 7.102 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.474 -6.283 8.029 1.00 0.00 C ATOM 1350 CG GLU A 453 -3.569 -5.900 9.190 1.00 0.00 C ATOM 1351 CD GLU A 453 -4.048 -6.461 10.515 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -5.112 -6.017 10.997 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -3.361 -7.344 11.069 1.00 0.00 O ATOM 0 H GLU A 453 -4.097 -5.320 5.792 1.00 0.00 H new ATOM 0 HA GLU A 453 -2.745 -7.297 7.254 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -4.911 -5.378 7.606 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.298 -6.889 8.406 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -2.559 -6.259 8.992 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -3.513 -4.814 9.259 1.00 0.00 H new ATOM 1360 N LYS A 454 -5.556 -8.264 5.839 1.00 0.00 N ATOM 1361 CA LYS A 454 -6.348 -9.435 5.481 1.00 0.00 C ATOM 1362 C LYS A 454 -5.673 -10.240 4.373 1.00 0.00 C ATOM 1363 O LYS A 454 -5.955 -11.426 4.197 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.751 -9.014 5.040 1.00 0.00 C ATOM 1365 CG LYS A 454 -7.762 -8.130 3.804 1.00 0.00 C ATOM 1366 CD LYS A 454 -9.106 -7.445 3.621 1.00 0.00 C ATOM 1367 CE LYS A 454 -9.320 -7.013 2.179 1.00 0.00 C ATOM 1368 NZ LYS A 454 -10.253 -7.923 1.459 1.00 0.00 N ATOM 0 H LYS A 454 -5.892 -7.389 5.437 1.00 0.00 H new ATOM 0 HA LYS A 454 -6.426 -10.068 6.365 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -8.344 -9.907 4.843 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -8.236 -8.484 5.860 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -6.977 -7.378 3.886 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -7.536 -8.731 2.923 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -9.905 -8.123 3.921 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -9.164 -6.575 4.275 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -9.716 -5.998 2.159 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.361 -6.992 1.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -10.372 -7.594 0.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -9.864 -8.887 1.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.176 -7.924 1.938 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.780 -9.593 3.629 1.00 0.00 N ATOM 1383 CA LYS A 455 -4.068 -10.258 2.543 1.00 0.00 C ATOM 1384 C LYS A 455 -2.871 -11.042 3.076 1.00 0.00 C ATOM 1385 O LYS A 455 -2.365 -11.945 2.409 1.00 0.00 O ATOM 1386 CB LYS A 455 -3.602 -9.234 1.506 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.972 -9.605 0.079 1.00 0.00 C ATOM 1388 CD LYS A 455 -3.602 -8.500 -0.897 1.00 0.00 C ATOM 1389 CE LYS A 455 -4.723 -7.481 -1.037 1.00 0.00 C ATOM 1390 NZ LYS A 455 -5.523 -7.701 -2.272 1.00 0.00 N ATOM 0 H LYS A 455 -4.533 -8.612 3.758 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.755 -10.958 2.067 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -4.036 -8.263 1.745 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -2.520 -9.125 1.576 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -3.462 -10.526 -0.202 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -5.042 -9.802 0.019 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -2.695 -8.000 -0.556 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -3.379 -8.934 -1.872 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -5.376 -7.538 -0.166 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -4.300 -6.476 -1.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -6.023 -6.824 -2.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -4.891 -7.974 -3.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -6.216 -8.459 -2.107 1.00 0.00 H new ATOM 1404 N GLY A 456 -2.421 -10.691 4.277 1.00 0.00 N ATOM 1405 CA GLY A 456 -1.288 -11.375 4.871 1.00 0.00 C ATOM 1406 C GLY A 456 -1.662 -12.728 5.441 1.00 0.00 C ATOM 1407 O GLY A 456 -1.572 -13.745 4.753 1.00 0.00 O ATOM 0 H GLY A 456 -2.820 -9.946 4.848 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.510 -11.504 4.119 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.867 -10.755 5.662 1.00 0.00 H new ATOM 1411 N LEU A 457 -2.081 -12.742 6.702 1.00 0.00 N ATOM 1412 CA LEU A 457 -2.470 -13.982 7.367 1.00 0.00 C ATOM 1413 C LEU A 457 -1.323 -14.988 7.355 1.00 0.00 C ATOM 1414 O LEU A 457 -1.591 -16.192 7.549 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.704 -14.583 6.687 1.00 0.00 C ATOM 1416 CG LEU A 457 -5.022 -14.369 7.435 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -6.172 -14.211 6.453 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -5.286 -15.527 8.386 1.00 0.00 C ATOM 1419 OXT LEU A 457 -0.166 -14.563 7.150 1.00 0.00 O ATOM 0 H LEU A 457 -2.160 -11.909 7.285 1.00 0.00 H new ATOM 0 HA LEU A 457 -2.713 -13.751 8.404 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -3.796 -14.154 5.689 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -3.545 -15.654 6.560 1.00 0.00 H new ATOM 0 HG LEU A 457 -4.943 -13.453 8.021 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -7.101 -14.060 7.002 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -5.986 -13.350 5.810 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -6.254 -15.109 5.841 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -6.227 -15.360 8.910 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -5.346 -16.456 7.820 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -4.474 -15.595 9.110 1.00 0.00 H new