USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 537 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 387 TYR OH : rot -63:sc= -4.15! USER MOD Set 1.2: A 404 CYS SG : rot 101:sc= 0.577 USER MOD Set 2.1: A 380 TYR OH : rot -140:sc= 0.707 USER MOD Set 2.2: A 444 GLN : amide:sc= -2.83! C(o=-2.1!,f=-1.9!) USER MOD Single : A 369 ASN : amide:sc= -0.737 K(o=-0.74,f=-1.5) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN :FLIP amide:sc= -4.73! C(o=-9.1!,f=-4.7!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -15:sc= 0.57 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -0.021 X(o=-0.021,f=-0.023) USER MOD Single : A 389 THR OG1 : rot 16:sc= 0.608 USER MOD Single : A 399 ASN : amide:sc= -0.801 K(o=-0.8,f=-2.3) USER MOD Single : A 400 SER OG : rot 69:sc= -2.18 USER MOD Single : A 410 THR OG1 : rot 34:sc= 0.0914 USER MOD Single : A 414 THR OG1 : rot 180:sc= -1.54 USER MOD Single : A 419 ASN : amide:sc= -6.94! C(o=-6.9!,f=-13!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -0.769 X(o=-0.77,f=-0.77) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl -167:sc= -0.604 (180deg=-0.86) USER MOD Single : A 441 TYR OH : rot 150:sc= 0 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.813 -1.920 9.011 1.00 0.00 N ATOM 103 CA ASN A 369 -2.656 -1.317 9.661 1.00 0.00 C ATOM 104 C ASN A 369 -1.683 -0.714 8.651 1.00 0.00 C ATOM 105 O ASN A 369 -1.380 0.478 8.707 1.00 0.00 O ATOM 106 CB ASN A 369 -1.937 -2.351 10.532 1.00 0.00 C ATOM 107 CG ASN A 369 -1.759 -3.684 9.830 1.00 0.00 C ATOM 108 OD1 ASN A 369 -0.714 -3.953 9.239 1.00 0.00 O ATOM 109 ND2 ASN A 369 -2.784 -4.526 9.893 1.00 0.00 N ATOM 0 HA ASN A 369 -3.022 -0.506 10.291 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -0.960 -1.962 10.819 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.502 -2.502 11.452 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -2.723 -5.438 9.440 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -3.632 -4.261 10.394 1.00 0.00 H new ATOM 116 N ALA A 370 -1.193 -1.539 7.738 1.00 0.00 N ATOM 117 CA ALA A 370 -0.248 -1.078 6.726 1.00 0.00 C ATOM 118 C ALA A 370 -0.869 -0.010 5.836 1.00 0.00 C ATOM 119 O ALA A 370 -0.207 0.958 5.460 1.00 0.00 O ATOM 120 CB ALA A 370 0.248 -2.249 5.889 1.00 0.00 C ATOM 0 H ALA A 370 -1.432 -2.529 7.675 1.00 0.00 H new ATOM 0 HA ALA A 370 0.603 -0.631 7.240 1.00 0.00 H new ATOM 0 HB1 ALA A 370 0.952 -1.888 5.139 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.745 -2.973 6.535 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.598 -2.726 5.393 1.00 0.00 H new ATOM 126 N LYS A 371 -2.141 -0.186 5.505 1.00 0.00 N ATOM 127 CA LYS A 371 -2.845 0.771 4.661 1.00 0.00 C ATOM 128 C LYS A 371 -3.165 2.039 5.442 1.00 0.00 C ATOM 129 O LYS A 371 -3.189 3.132 4.882 1.00 0.00 O ATOM 130 CB LYS A 371 -4.131 0.158 4.107 1.00 0.00 C ATOM 131 CG LYS A 371 -4.701 0.911 2.916 1.00 0.00 C ATOM 132 CD LYS A 371 -6.150 0.533 2.658 1.00 0.00 C ATOM 133 CE LYS A 371 -6.972 1.736 2.223 1.00 0.00 C ATOM 134 NZ LYS A 371 -8.312 1.759 2.872 1.00 0.00 N ATOM 0 H LYS A 371 -2.706 -0.980 5.807 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.194 1.029 3.826 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.935 -0.873 3.814 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.879 0.128 4.899 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.630 1.984 3.095 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.105 0.696 2.029 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.194 -0.237 1.888 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.582 0.104 3.562 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.434 2.651 2.469 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.094 1.720 1.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -8.840 2.595 2.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.836 0.898 2.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -8.197 1.801 3.905 1.00 0.00 H new ATOM 148 N ARG A 372 -3.396 1.887 6.742 1.00 0.00 N ATOM 149 CA ARG A 372 -3.697 3.028 7.596 1.00 0.00 C ATOM 150 C ARG A 372 -2.424 3.810 7.876 1.00 0.00 C ATOM 151 O ARG A 372 -2.434 5.038 7.953 1.00 0.00 O ATOM 152 CB ARG A 372 -4.332 2.566 8.908 1.00 0.00 C ATOM 153 CG ARG A 372 -5.848 2.457 8.846 1.00 0.00 C ATOM 154 CD ARG A 372 -6.474 2.563 10.229 1.00 0.00 C ATOM 155 NE ARG A 372 -7.095 1.309 10.647 1.00 0.00 N ATOM 156 CZ ARG A 372 -7.719 1.142 11.811 1.00 0.00 C ATOM 157 NH1 ARG A 372 -7.809 2.145 12.674 1.00 0.00 N ATOM 158 NH2 ARG A 372 -8.258 -0.032 12.111 1.00 0.00 N ATOM 0 H ARG A 372 -3.380 0.989 7.225 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.408 3.674 7.080 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -3.917 1.596 9.181 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -4.058 3.263 9.700 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -6.244 3.245 8.205 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -6.127 1.506 8.392 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -5.709 2.847 10.952 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -7.222 3.355 10.228 1.00 0.00 H new ATOM 0 HE ARG A 372 -7.048 0.514 10.009 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -7.399 3.051 12.448 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -8.288 2.010 13.564 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -8.194 -0.806 11.450 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -8.736 -0.161 13.003 1.00 0.00 H new ATOM 170 N GLN A 373 -1.323 3.081 8.010 1.00 0.00 N ATOM 171 CA GLN A 373 -0.026 3.688 8.263 1.00 0.00 C ATOM 172 C GLN A 373 0.395 4.535 7.068 1.00 0.00 C ATOM 173 O GLN A 373 0.820 5.681 7.223 1.00 0.00 O ATOM 174 CB GLN A 373 1.014 2.594 8.538 1.00 0.00 C ATOM 175 CG GLN A 373 2.439 3.110 8.647 1.00 0.00 C ATOM 176 CD GLN A 373 2.656 3.955 9.884 1.00 0.00 C ATOM 177 OE1 GLN A 373 2.070 5.144 9.892 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 3.342 3.545 10.820 1.00 0.00 N flip ATOM 0 H GLN A 373 -1.305 2.063 7.947 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.096 4.334 9.138 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.752 2.082 9.464 1.00 0.00 H new ATOM 0 HB3 GLN A 373 0.967 1.853 7.740 1.00 0.00 H new ATOM 0 HG2 GLN A 373 3.128 2.265 8.662 1.00 0.00 H new ATOM 0 HG3 GLN A 373 2.677 3.700 7.762 1.00 0.00 H new ATOM 0 HE21 GLN A 373 3.774 2.622 10.770 1.00 0.00 H new ATOM 0 HE22 GLN A 373 3.478 4.128 11.646 1.00 0.00 H new ATOM 187 N LEU A 374 0.260 3.968 5.876 1.00 0.00 N ATOM 188 CA LEU A 374 0.616 4.670 4.654 1.00 0.00 C ATOM 189 C LEU A 374 -0.301 5.867 4.433 1.00 0.00 C ATOM 190 O LEU A 374 0.158 6.970 4.141 1.00 0.00 O ATOM 191 CB LEU A 374 0.538 3.716 3.461 1.00 0.00 C ATOM 192 CG LEU A 374 1.307 4.160 2.215 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.748 4.506 2.567 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.261 3.075 1.148 1.00 0.00 C ATOM 0 H LEU A 374 -0.094 3.022 5.731 1.00 0.00 H new ATOM 0 HA LEU A 374 1.638 5.036 4.750 1.00 0.00 H new ATOM 0 HB2 LEU A 374 0.914 2.741 3.772 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.510 3.582 3.192 1.00 0.00 H new ATOM 0 HG LEU A 374 0.830 5.056 1.817 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.277 4.819 1.667 1.00 0.00 H new ATOM 0 HD12 LEU A 374 2.760 5.317 3.296 1.00 0.00 H new ATOM 0 HD13 LEU A 374 3.239 3.630 2.991 1.00 0.00 H new ATOM 0 HD21 LEU A 374 1.813 3.406 0.268 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.713 2.163 1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 374 0.225 2.878 0.874 1.00 0.00 H new ATOM 206 N TYR A 375 -1.599 5.643 4.581 1.00 0.00 N ATOM 207 CA TYR A 375 -2.584 6.704 4.402 1.00 0.00 C ATOM 208 C TYR A 375 -2.473 7.747 5.510 1.00 0.00 C ATOM 209 O TYR A 375 -2.825 8.911 5.318 1.00 0.00 O ATOM 210 CB TYR A 375 -3.998 6.118 4.381 1.00 0.00 C ATOM 211 CG TYR A 375 -4.897 6.719 3.324 1.00 0.00 C ATOM 212 CD1 TYR A 375 -4.969 8.094 3.141 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.679 5.907 2.510 1.00 0.00 C ATOM 214 CE1 TYR A 375 -5.792 8.644 2.176 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.504 6.450 1.543 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.557 7.817 1.381 1.00 0.00 C ATOM 217 OH TYR A 375 -7.378 8.361 0.420 1.00 0.00 O ATOM 0 H TYR A 375 -1.996 4.736 4.825 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.383 7.191 3.448 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -3.932 5.042 4.218 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.456 6.265 5.359 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.372 8.744 3.763 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.641 4.835 2.635 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -5.836 9.715 2.046 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.104 5.806 0.918 1.00 0.00 H new ATOM 0 HH TYR A 375 -7.847 7.643 -0.054 1.00 0.00 H new ATOM 227 N SER A 376 -1.986 7.326 6.672 1.00 0.00 N ATOM 228 CA SER A 376 -1.840 8.228 7.806 1.00 0.00 C ATOM 229 C SER A 376 -0.485 8.934 7.798 1.00 0.00 C ATOM 230 O SER A 376 -0.260 9.858 8.579 1.00 0.00 O ATOM 231 CB SER A 376 -2.015 7.463 9.119 1.00 0.00 C ATOM 232 OG SER A 376 -1.732 8.291 10.234 1.00 0.00 O ATOM 0 H SER A 376 -1.687 6.368 6.852 1.00 0.00 H new ATOM 0 HA SER A 376 -2.617 8.988 7.720 1.00 0.00 H new ATOM 0 HB2 SER A 376 -3.036 7.087 9.191 1.00 0.00 H new ATOM 0 HB3 SER A 376 -1.354 6.596 9.129 1.00 0.00 H new ATOM 0 HG SER A 376 -1.253 9.091 9.934 1.00 0.00 H new ATOM 238 N LEU A 377 0.423 8.496 6.926 1.00 0.00 N ATOM 239 CA LEU A 377 1.748 9.101 6.858 1.00 0.00 C ATOM 240 C LEU A 377 2.013 9.785 5.517 1.00 0.00 C ATOM 241 O LEU A 377 2.978 10.541 5.393 1.00 0.00 O ATOM 242 CB LEU A 377 2.827 8.052 7.131 1.00 0.00 C ATOM 243 CG LEU A 377 3.297 7.973 8.586 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.109 7.964 9.537 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.161 6.739 8.796 1.00 0.00 C ATOM 0 H LEU A 377 0.266 7.734 6.266 1.00 0.00 H new ATOM 0 HA LEU A 377 1.783 9.872 7.628 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.446 7.075 6.834 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.688 8.265 6.497 1.00 0.00 H new ATOM 0 HG LEU A 377 3.897 8.857 8.802 1.00 0.00 H new ATOM 0 HD11 LEU A 377 2.466 7.907 10.565 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.530 8.878 9.404 1.00 0.00 H new ATOM 0 HD13 LEU A 377 1.479 7.100 9.324 1.00 0.00 H new ATOM 0 HD21 LEU A 377 4.488 6.696 9.835 1.00 0.00 H new ATOM 0 HD22 LEU A 377 3.583 5.846 8.560 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.033 6.790 8.143 1.00 0.00 H new ATOM 257 N ILE A 378 1.176 9.533 4.512 1.00 0.00 N ATOM 258 CA ILE A 378 1.379 10.157 3.207 1.00 0.00 C ATOM 259 C ILE A 378 0.068 10.570 2.540 1.00 0.00 C ATOM 260 O ILE A 378 0.021 11.570 1.823 1.00 0.00 O ATOM 261 CB ILE A 378 2.170 9.243 2.249 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.404 7.955 1.955 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.538 8.924 2.828 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.607 7.463 0.543 1.00 0.00 C ATOM 0 H ILE A 378 0.367 8.914 4.573 1.00 0.00 H new ATOM 0 HA ILE A 378 1.961 11.057 3.404 1.00 0.00 H new ATOM 0 HB ILE A 378 2.302 9.778 1.309 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.722 7.181 2.654 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.341 8.123 2.127 1.00 0.00 H new ATOM 0 HG21 ILE A 378 4.083 8.278 2.139 1.00 0.00 H new ATOM 0 HG22 ILE A 378 4.095 9.849 2.976 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.419 8.416 3.785 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.039 6.545 0.392 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.263 8.222 -0.160 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.666 7.266 0.375 1.00 0.00 H new ATOM 276 N GLY A 379 -0.992 9.803 2.767 1.00 0.00 N ATOM 277 CA GLY A 379 -2.273 10.125 2.165 1.00 0.00 C ATOM 278 C GLY A 379 -2.874 11.401 2.719 1.00 0.00 C ATOM 279 O GLY A 379 -3.448 11.399 3.808 1.00 0.00 O ATOM 0 H GLY A 379 -0.988 8.969 3.354 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.148 10.225 1.087 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -2.966 9.300 2.331 1.00 0.00 H new ATOM 283 N TYR A 380 -2.753 12.494 1.970 1.00 0.00 N ATOM 284 CA TYR A 380 -3.305 13.776 2.411 1.00 0.00 C ATOM 285 C TYR A 380 -4.789 13.871 2.062 1.00 0.00 C ATOM 286 O TYR A 380 -5.652 13.613 2.901 1.00 0.00 O ATOM 287 CB TYR A 380 -2.544 14.973 1.809 1.00 0.00 C ATOM 288 CG TYR A 380 -1.495 14.621 0.770 1.00 0.00 C ATOM 289 CD1 TYR A 380 -1.843 14.419 -0.560 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.156 14.506 1.121 1.00 0.00 C ATOM 291 CE1 TYR A 380 -0.885 14.113 -1.509 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.805 14.198 0.179 1.00 0.00 C ATOM 293 CZ TYR A 380 0.435 14.003 -1.134 1.00 0.00 C ATOM 294 OH TYR A 380 1.390 13.706 -2.077 1.00 0.00 O ATOM 0 H TYR A 380 -2.284 12.521 1.065 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.187 13.819 3.494 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.267 15.651 1.355 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.060 15.519 2.619 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -2.878 14.502 -0.857 1.00 0.00 H new ATOM 0 HD2 TYR A 380 0.138 14.660 2.149 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.171 13.961 -2.539 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.841 14.110 0.470 1.00 0.00 H new ATOM 0 HH TYR A 380 2.036 13.072 -1.700 1.00 0.00 H new ATOM 304 N ALA A 381 -5.077 14.240 0.819 1.00 0.00 N ATOM 305 CA ALA A 381 -6.453 14.367 0.353 1.00 0.00 C ATOM 306 C ALA A 381 -6.593 13.818 -1.062 1.00 0.00 C ATOM 307 O ALA A 381 -7.418 12.941 -1.321 1.00 0.00 O ATOM 308 CB ALA A 381 -6.899 15.820 0.406 1.00 0.00 C ATOM 0 H ALA A 381 -4.373 14.457 0.114 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.095 13.783 1.013 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.928 15.898 0.055 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -6.837 16.182 1.432 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.252 16.423 -0.231 1.00 0.00 H new ATOM 314 N SER A 382 -5.773 14.333 -1.972 1.00 0.00 N ATOM 315 CA SER A 382 -5.795 13.890 -3.361 1.00 0.00 C ATOM 316 C SER A 382 -5.131 12.522 -3.498 1.00 0.00 C ATOM 317 O SER A 382 -5.436 11.761 -4.416 1.00 0.00 O ATOM 318 CB SER A 382 -5.083 14.906 -4.255 1.00 0.00 C ATOM 319 OG SER A 382 -5.937 15.991 -4.577 1.00 0.00 O ATOM 0 H SER A 382 -5.084 15.058 -1.772 1.00 0.00 H new ATOM 0 HA SER A 382 -6.835 13.808 -3.677 1.00 0.00 H new ATOM 0 HB2 SER A 382 -4.192 15.278 -3.749 1.00 0.00 H new ATOM 0 HB3 SER A 382 -4.749 14.418 -5.171 1.00 0.00 H new ATOM 0 HG SER A 382 -5.457 16.627 -5.148 1.00 0.00 H new ATOM 325 N LEU A 383 -4.222 12.220 -2.575 1.00 0.00 N ATOM 326 CA LEU A 383 -3.512 10.946 -2.582 1.00 0.00 C ATOM 327 C LEU A 383 -4.486 9.790 -2.379 1.00 0.00 C ATOM 328 O LEU A 383 -4.638 9.275 -1.270 1.00 0.00 O ATOM 329 CB LEU A 383 -2.440 10.939 -1.480 1.00 0.00 C ATOM 330 CG LEU A 383 -0.997 10.635 -1.922 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.631 9.193 -1.604 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.788 10.927 -3.404 1.00 0.00 C ATOM 0 H LEU A 383 -3.960 12.843 -1.811 1.00 0.00 H new ATOM 0 HA LEU A 383 -3.027 10.820 -3.550 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -2.448 11.913 -0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.728 10.203 -0.729 1.00 0.00 H new ATOM 0 HG LEU A 383 -0.336 11.295 -1.360 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.393 8.998 -1.924 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.714 9.025 -0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -1.310 8.521 -2.130 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.242 10.700 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -1.465 10.310 -3.995 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.992 11.980 -3.600 1.00 0.00 H new ATOM 344 N ARG A 384 -5.148 9.389 -3.458 1.00 0.00 N ATOM 345 CA ARG A 384 -6.111 8.299 -3.404 1.00 0.00 C ATOM 346 C ARG A 384 -5.409 6.956 -3.225 1.00 0.00 C ATOM 347 O ARG A 384 -5.364 6.141 -4.147 1.00 0.00 O ATOM 348 CB ARG A 384 -6.960 8.280 -4.678 1.00 0.00 C ATOM 349 CG ARG A 384 -8.255 9.066 -4.558 1.00 0.00 C ATOM 350 CD ARG A 384 -8.908 9.270 -5.916 1.00 0.00 C ATOM 351 NE ARG A 384 -8.418 10.471 -6.586 1.00 0.00 N ATOM 352 CZ ARG A 384 -8.722 10.799 -7.840 1.00 0.00 C ATOM 353 NH1 ARG A 384 -9.515 10.018 -8.563 1.00 0.00 N ATOM 354 NH2 ARG A 384 -8.233 11.910 -8.373 1.00 0.00 N ATOM 0 H ARG A 384 -5.034 9.805 -4.383 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.760 8.463 -2.544 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.373 8.686 -5.502 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.194 7.246 -4.933 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.943 8.538 -3.897 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.054 10.035 -4.100 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -8.715 8.401 -6.545 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.989 9.340 -5.791 1.00 0.00 H new ATOM 0 HE ARG A 384 -7.806 11.096 -6.062 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -9.895 9.162 -8.158 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -9.745 10.274 -9.523 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -7.623 12.514 -7.822 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -8.466 12.160 -9.334 1.00 0.00 H new ATOM 366 N LEU A 385 -4.865 6.728 -2.033 1.00 0.00 N ATOM 367 CA LEU A 385 -4.171 5.478 -1.742 1.00 0.00 C ATOM 368 C LEU A 385 -5.107 4.289 -1.940 1.00 0.00 C ATOM 369 O LEU A 385 -5.936 3.988 -1.081 1.00 0.00 O ATOM 370 CB LEU A 385 -3.623 5.484 -0.311 1.00 0.00 C ATOM 371 CG LEU A 385 -2.989 4.169 0.145 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.878 4.432 1.149 1.00 0.00 C ATOM 373 CD2 LEU A 385 -4.041 3.248 0.742 1.00 0.00 C ATOM 0 H LEU A 385 -4.891 7.389 -1.257 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.334 5.385 -2.434 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.880 6.277 -0.226 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.435 5.734 0.372 1.00 0.00 H new ATOM 0 HG LEU A 385 -2.556 3.677 -0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.439 3.485 1.462 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.110 5.053 0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -2.287 4.947 2.018 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.571 2.317 1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -4.504 3.733 1.601 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -4.803 3.032 -0.007 1.00 0.00 H new ATOM 385 N HIS A 386 -4.970 3.620 -3.080 1.00 0.00 N ATOM 386 CA HIS A 386 -5.802 2.468 -3.396 1.00 0.00 C ATOM 387 C HIS A 386 -4.940 1.264 -3.749 1.00 0.00 C ATOM 388 O HIS A 386 -3.833 1.411 -4.265 1.00 0.00 O ATOM 389 CB HIS A 386 -6.746 2.795 -4.555 1.00 0.00 C ATOM 390 CG HIS A 386 -7.829 1.779 -4.751 1.00 0.00 C ATOM 391 ND1 HIS A 386 -8.837 1.567 -3.834 1.00 0.00 N ATOM 392 CD2 HIS A 386 -8.060 0.916 -5.769 1.00 0.00 C ATOM 393 CE1 HIS A 386 -9.640 0.617 -4.279 1.00 0.00 C ATOM 394 NE2 HIS A 386 -9.192 0.206 -5.450 1.00 0.00 N ATOM 0 H HIS A 386 -4.289 3.858 -3.801 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.396 2.224 -2.515 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.201 3.769 -4.378 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.165 2.877 -5.474 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -7.466 0.807 -6.664 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -10.515 0.240 -3.770 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -9.617 -0.521 -6.025 1.00 0.00 H new ATOM 403 N TYR A 387 -5.450 0.071 -3.463 1.00 0.00 N ATOM 404 CA TYR A 387 -4.717 -1.154 -3.747 1.00 0.00 C ATOM 405 C TYR A 387 -5.414 -1.985 -4.816 1.00 0.00 C ATOM 406 O TYR A 387 -6.578 -2.359 -4.671 1.00 0.00 O ATOM 407 CB TYR A 387 -4.550 -1.976 -2.470 1.00 0.00 C ATOM 408 CG TYR A 387 -3.435 -1.471 -1.589 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.498 -0.206 -1.020 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.317 -2.253 -1.333 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.478 0.268 -0.222 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.292 -1.788 -0.535 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.375 -0.526 0.019 1.00 0.00 C ATOM 414 OH TYR A 387 -0.356 -0.057 0.813 1.00 0.00 O ATOM 0 H TYR A 387 -6.365 -0.072 -3.036 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.734 -0.875 -4.127 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.485 -1.961 -1.909 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.354 -3.015 -2.736 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.360 0.417 -1.205 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.248 -3.240 -1.765 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.542 1.255 0.212 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.429 -2.408 -0.345 1.00 0.00 H new ATOM 0 HH TYR A 387 0.047 0.733 0.396 1.00 0.00 H new ATOM 424 N VAL A 388 -4.686 -2.272 -5.889 1.00 0.00 N ATOM 425 CA VAL A 388 -5.218 -3.062 -6.986 1.00 0.00 C ATOM 426 C VAL A 388 -4.662 -4.480 -6.950 1.00 0.00 C ATOM 427 O VAL A 388 -3.549 -4.735 -7.414 1.00 0.00 O ATOM 428 CB VAL A 388 -4.887 -2.423 -8.349 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.557 -3.190 -9.479 1.00 0.00 C ATOM 430 CG2 VAL A 388 -5.305 -0.961 -8.366 1.00 0.00 C ATOM 0 H VAL A 388 -3.722 -1.966 -6.020 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.301 -3.094 -6.865 1.00 0.00 H new ATOM 0 HB VAL A 388 -3.809 -2.472 -8.500 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.311 -2.722 -10.432 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.204 -4.221 -9.478 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.638 -3.177 -9.337 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -5.064 -0.525 -9.336 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -6.378 -0.887 -8.192 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -4.772 -0.421 -7.583 1.00 0.00 H new ATOM 440 N THR A 389 -5.440 -5.400 -6.389 1.00 0.00 N ATOM 441 CA THR A 389 -5.024 -6.793 -6.287 1.00 0.00 C ATOM 442 C THR A 389 -5.294 -7.538 -7.590 1.00 0.00 C ATOM 443 O THR A 389 -6.420 -7.554 -8.087 1.00 0.00 O ATOM 444 CB THR A 389 -5.750 -7.481 -5.131 1.00 0.00 C ATOM 445 OG1 THR A 389 -7.110 -7.707 -5.455 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.710 -6.688 -3.843 1.00 0.00 C ATOM 0 H THR A 389 -6.362 -5.205 -5.998 1.00 0.00 H new ATOM 0 HA THR A 389 -3.951 -6.813 -6.095 1.00 0.00 H new ATOM 0 HB THR A 389 -5.220 -8.421 -4.977 1.00 0.00 H new ATOM 0 HG1 THR A 389 -7.235 -7.615 -6.423 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.243 -7.232 -3.064 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.674 -6.541 -3.538 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.184 -5.719 -3.998 1.00 0.00 H new ATOM 594 N ASN A 399 0.657 -16.270 -7.328 1.00 0.00 N ATOM 595 CA ASN A 399 0.555 -15.682 -5.999 1.00 0.00 C ATOM 596 C ASN A 399 -0.390 -14.486 -6.006 1.00 0.00 C ATOM 597 O ASN A 399 -0.873 -14.073 -7.060 1.00 0.00 O ATOM 598 CB ASN A 399 1.936 -15.254 -5.500 1.00 0.00 C ATOM 599 CG ASN A 399 2.184 -15.673 -4.065 1.00 0.00 C ATOM 600 OD1 ASN A 399 2.723 -14.910 -3.266 1.00 0.00 O ATOM 601 ND2 ASN A 399 1.793 -16.896 -3.735 1.00 0.00 N ATOM 0 HA ASN A 399 0.152 -16.437 -5.324 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.703 -15.689 -6.141 1.00 0.00 H new ATOM 0 HB3 ASN A 399 2.030 -14.171 -5.581 1.00 0.00 H new ATOM 0 HD21 ASN A 399 1.936 -17.238 -2.785 1.00 0.00 H new ATOM 0 HD22 ASN A 399 1.350 -17.495 -4.431 1.00 0.00 H new ATOM 608 N SER A 400 -0.645 -13.929 -4.827 1.00 0.00 N ATOM 609 CA SER A 400 -1.523 -12.777 -4.706 1.00 0.00 C ATOM 610 C SER A 400 -0.709 -11.494 -4.763 1.00 0.00 C ATOM 611 O SER A 400 -0.208 -11.016 -3.745 1.00 0.00 O ATOM 612 CB SER A 400 -2.323 -12.845 -3.404 1.00 0.00 C ATOM 613 OG SER A 400 -2.441 -14.182 -2.952 1.00 0.00 O ATOM 0 H SER A 400 -0.255 -14.258 -3.944 1.00 0.00 H new ATOM 0 HA SER A 400 -2.226 -12.785 -5.539 1.00 0.00 H new ATOM 0 HB2 SER A 400 -1.834 -12.241 -2.640 1.00 0.00 H new ATOM 0 HB3 SER A 400 -3.315 -12.421 -3.559 1.00 0.00 H new ATOM 0 HG SER A 400 -1.565 -14.506 -2.657 1.00 0.00 H new ATOM 619 N ILE A 401 -0.562 -10.953 -5.965 1.00 0.00 N ATOM 620 CA ILE A 401 0.210 -9.740 -6.167 1.00 0.00 C ATOM 621 C ILE A 401 -0.676 -8.498 -6.088 1.00 0.00 C ATOM 622 O ILE A 401 -1.690 -8.399 -6.780 1.00 0.00 O ATOM 623 CB ILE A 401 0.957 -9.791 -7.525 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.430 -9.432 -7.334 1.00 0.00 C ATOM 625 CG2 ILE A 401 0.314 -8.876 -8.561 1.00 0.00 C ATOM 626 CD1 ILE A 401 2.652 -8.004 -6.882 1.00 0.00 C ATOM 0 H ILE A 401 -0.970 -11.339 -6.816 1.00 0.00 H new ATOM 0 HA ILE A 401 0.947 -9.675 -5.366 1.00 0.00 H new ATOM 0 HB ILE A 401 0.886 -10.811 -7.902 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.868 -10.109 -6.600 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.959 -9.594 -8.273 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.868 -8.941 -9.498 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.718 -9.184 -8.727 1.00 0.00 H new ATOM 0 HG23 ILE A 401 0.332 -7.848 -8.200 1.00 0.00 H new ATOM 0 HD11 ILE A 401 3.720 -7.821 -6.767 1.00 0.00 H new ATOM 0 HD12 ILE A 401 2.244 -7.319 -7.626 1.00 0.00 H new ATOM 0 HD13 ILE A 401 2.152 -7.843 -5.927 1.00 0.00 H new ATOM 638 N VAL A 402 -0.281 -7.552 -5.243 1.00 0.00 N ATOM 639 CA VAL A 402 -1.030 -6.316 -5.074 1.00 0.00 C ATOM 640 C VAL A 402 -0.152 -5.107 -5.373 1.00 0.00 C ATOM 641 O VAL A 402 1.046 -5.114 -5.091 1.00 0.00 O ATOM 642 CB VAL A 402 -1.600 -6.189 -3.650 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.511 -4.976 -3.545 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.340 -7.457 -3.256 1.00 0.00 C ATOM 0 H VAL A 402 0.556 -7.620 -4.664 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.860 -6.347 -5.780 1.00 0.00 H new ATOM 0 HB VAL A 402 -0.770 -6.051 -2.957 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -2.904 -4.903 -2.531 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.945 -4.075 -3.781 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.337 -5.080 -4.248 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -2.736 -7.348 -2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.162 -7.630 -3.951 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.654 -8.303 -3.288 1.00 0.00 H new ATOM 654 N GLU A 403 -0.753 -4.072 -5.950 1.00 0.00 N ATOM 655 CA GLU A 403 -0.019 -2.861 -6.291 1.00 0.00 C ATOM 656 C GLU A 403 -0.713 -1.619 -5.738 1.00 0.00 C ATOM 657 O GLU A 403 -1.770 -1.217 -6.224 1.00 0.00 O ATOM 658 CB GLU A 403 0.133 -2.742 -7.809 1.00 0.00 C ATOM 659 CG GLU A 403 0.622 -4.020 -8.472 1.00 0.00 C ATOM 660 CD GLU A 403 -0.492 -4.777 -9.169 1.00 0.00 C ATOM 661 OE1 GLU A 403 -1.001 -4.274 -10.192 1.00 0.00 O ATOM 662 OE2 GLU A 403 -0.853 -5.874 -8.692 1.00 0.00 O ATOM 0 H GLU A 403 -1.744 -4.048 -6.190 1.00 0.00 H new ATOM 0 HA GLU A 403 0.969 -2.930 -5.836 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.828 -2.462 -8.241 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.831 -1.935 -8.034 1.00 0.00 H new ATOM 0 HG2 GLU A 403 1.399 -3.775 -9.196 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.079 -4.663 -7.720 1.00 0.00 H new ATOM 669 N CYS A 404 -0.104 -1.012 -4.724 1.00 0.00 N ATOM 670 CA CYS A 404 -0.655 0.189 -4.108 1.00 0.00 C ATOM 671 C CYS A 404 -0.533 1.379 -5.052 1.00 0.00 C ATOM 672 O CYS A 404 0.565 1.886 -5.282 1.00 0.00 O ATOM 673 CB CYS A 404 0.070 0.491 -2.794 1.00 0.00 C ATOM 674 SG CYS A 404 -0.490 1.999 -1.965 1.00 0.00 S ATOM 0 H CYS A 404 0.772 -1.333 -4.312 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.711 0.014 -3.900 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.063 -0.353 -2.117 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.138 0.575 -2.993 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.304 1.687 -1.001 1.00 0.00 H new ATOM 680 N ARG A 405 -1.662 1.822 -5.594 1.00 0.00 N ATOM 681 CA ARG A 405 -1.675 2.952 -6.509 1.00 0.00 C ATOM 682 C ARG A 405 -2.272 4.180 -5.840 1.00 0.00 C ATOM 683 O ARG A 405 -3.237 4.081 -5.082 1.00 0.00 O ATOM 684 CB ARG A 405 -2.470 2.610 -7.770 1.00 0.00 C ATOM 685 CG ARG A 405 -1.745 1.658 -8.707 1.00 0.00 C ATOM 686 CD ARG A 405 -2.643 1.210 -9.851 1.00 0.00 C ATOM 687 NE ARG A 405 -1.951 0.306 -10.767 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.415 -0.027 -11.969 1.00 0.00 C ATOM 689 NH1 ARG A 405 -3.567 0.467 -12.405 1.00 0.00 N ATOM 690 NH2 ARG A 405 -1.723 -0.855 -12.740 1.00 0.00 N ATOM 0 H ARG A 405 -2.579 1.414 -5.414 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.645 3.172 -6.788 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.422 2.166 -7.480 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.698 3.531 -8.306 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -0.858 2.147 -9.109 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -1.403 0.787 -8.149 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -3.524 0.712 -9.447 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -2.994 2.084 -10.400 1.00 0.00 H new ATOM 0 HE ARG A 405 -1.061 -0.093 -10.468 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -4.103 1.106 -11.818 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -3.917 0.208 -13.327 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -0.836 -1.236 -12.412 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -2.078 -1.111 -13.661 1.00 0.00 H new ATOM 702 N VAL A 406 -1.694 5.339 -6.126 1.00 0.00 N ATOM 703 CA VAL A 406 -2.172 6.586 -5.551 1.00 0.00 C ATOM 704 C VAL A 406 -2.421 7.631 -6.631 1.00 0.00 C ATOM 705 O VAL A 406 -1.872 7.548 -7.730 1.00 0.00 O ATOM 706 CB VAL A 406 -1.175 7.154 -4.525 1.00 0.00 C ATOM 707 CG1 VAL A 406 -1.063 6.232 -3.319 1.00 0.00 C ATOM 708 CG2 VAL A 406 0.187 7.373 -5.167 1.00 0.00 C ATOM 0 H VAL A 406 -0.895 5.440 -6.752 1.00 0.00 H new ATOM 0 HA VAL A 406 -3.110 6.358 -5.046 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.548 8.119 -4.181 1.00 0.00 H new ATOM 0 HG11 VAL A 406 -0.354 6.651 -2.605 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -2.039 6.133 -2.845 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -0.716 5.251 -3.642 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.878 7.775 -4.426 1.00 0.00 H new ATOM 0 HG22 VAL A 406 0.569 6.424 -5.542 1.00 0.00 H new ATOM 0 HG23 VAL A 406 0.091 8.078 -5.993 1.00 0.00 H new ATOM 744 N THR A 410 -0.392 5.904 -10.062 1.00 0.00 N ATOM 745 CA THR A 410 1.021 5.725 -9.759 1.00 0.00 C ATOM 746 C THR A 410 1.208 4.766 -8.589 1.00 0.00 C ATOM 747 O THR A 410 0.801 5.058 -7.465 1.00 0.00 O ATOM 748 CB THR A 410 1.670 7.072 -9.437 1.00 0.00 C ATOM 749 OG1 THR A 410 1.499 7.981 -10.511 1.00 0.00 O ATOM 750 CG2 THR A 410 3.154 6.971 -9.155 1.00 0.00 C ATOM 0 HA THR A 410 1.504 5.298 -10.638 1.00 0.00 H new ATOM 0 HB THR A 410 1.168 7.425 -8.536 1.00 0.00 H new ATOM 0 HG1 THR A 410 0.635 7.817 -10.944 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.551 7.962 -8.934 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.318 6.316 -8.300 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.663 6.563 -10.028 1.00 0.00 H new ATOM 758 N VAL A 411 1.823 3.620 -8.860 1.00 0.00 N ATOM 759 CA VAL A 411 2.059 2.621 -7.826 1.00 0.00 C ATOM 760 C VAL A 411 3.247 3.006 -6.951 1.00 0.00 C ATOM 761 O VAL A 411 4.382 3.071 -7.422 1.00 0.00 O ATOM 762 CB VAL A 411 2.309 1.225 -8.429 1.00 0.00 C ATOM 763 CG1 VAL A 411 2.368 0.172 -7.333 1.00 0.00 C ATOM 764 CG2 VAL A 411 1.234 0.880 -9.449 1.00 0.00 C ATOM 0 H VAL A 411 2.166 3.361 -9.785 1.00 0.00 H new ATOM 0 HA VAL A 411 1.157 2.584 -7.216 1.00 0.00 H new ATOM 0 HB VAL A 411 3.271 1.240 -8.941 1.00 0.00 H new ATOM 0 HG11 VAL A 411 2.545 -0.807 -7.778 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.178 0.409 -6.644 1.00 0.00 H new ATOM 0 HG13 VAL A 411 1.423 0.158 -6.790 1.00 0.00 H new ATOM 0 HG21 VAL A 411 1.429 -0.109 -9.863 1.00 0.00 H new ATOM 0 HG22 VAL A 411 0.258 0.885 -8.964 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.244 1.617 -10.252 1.00 0.00 H new ATOM 774 N LEU A 412 2.975 3.263 -5.676 1.00 0.00 N ATOM 775 CA LEU A 412 4.018 3.645 -4.734 1.00 0.00 C ATOM 776 C LEU A 412 4.505 2.442 -3.930 1.00 0.00 C ATOM 777 O LEU A 412 5.609 2.458 -3.384 1.00 0.00 O ATOM 778 CB LEU A 412 3.503 4.730 -3.786 1.00 0.00 C ATOM 779 CG LEU A 412 4.562 5.720 -3.299 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.613 6.938 -4.210 1.00 0.00 C ATOM 781 CD2 LEU A 412 4.280 6.139 -1.863 1.00 0.00 C ATOM 0 H LEU A 412 2.040 3.213 -5.272 1.00 0.00 H new ATOM 0 HA LEU A 412 4.859 4.036 -5.306 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.712 5.286 -4.290 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.051 4.249 -2.919 1.00 0.00 H new ATOM 0 HG LEU A 412 5.534 5.227 -3.329 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.372 7.632 -3.848 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.862 6.624 -5.224 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.641 7.432 -4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 412 5.043 6.843 -1.533 1.00 0.00 H new ATOM 0 HD22 LEU A 412 3.300 6.614 -1.808 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.294 5.260 -1.218 1.00 0.00 H new ATOM 793 N GLY A 413 3.679 1.404 -3.853 1.00 0.00 N ATOM 794 CA GLY A 413 4.054 0.217 -3.105 1.00 0.00 C ATOM 795 C GLY A 413 3.507 -1.061 -3.713 1.00 0.00 C ATOM 796 O GLY A 413 2.294 -1.258 -3.773 1.00 0.00 O ATOM 0 H GLY A 413 2.760 1.363 -4.293 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.141 0.153 -3.055 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.693 0.310 -2.081 1.00 0.00 H new ATOM 800 N THR A 414 4.408 -1.930 -4.161 1.00 0.00 N ATOM 801 CA THR A 414 4.018 -3.196 -4.763 1.00 0.00 C ATOM 802 C THR A 414 4.556 -4.371 -3.948 1.00 0.00 C ATOM 803 O THR A 414 5.746 -4.424 -3.632 1.00 0.00 O ATOM 804 CB THR A 414 4.536 -3.269 -6.200 1.00 0.00 C ATOM 805 OG1 THR A 414 3.925 -2.276 -7.003 1.00 0.00 O ATOM 806 CG2 THR A 414 4.293 -4.609 -6.864 1.00 0.00 C ATOM 0 H THR A 414 5.416 -1.778 -4.117 1.00 0.00 H new ATOM 0 HA THR A 414 2.930 -3.256 -4.771 1.00 0.00 H new ATOM 0 HB THR A 414 5.612 -3.113 -6.124 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.270 -2.337 -7.918 1.00 0.00 H new ATOM 0 HG21 THR A 414 4.686 -4.588 -7.880 1.00 0.00 H new ATOM 0 HG22 THR A 414 4.795 -5.393 -6.297 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.222 -4.812 -6.893 1.00 0.00 H new ATOM 814 N GLY A 415 3.677 -5.309 -3.611 1.00 0.00 N ATOM 815 CA GLY A 415 4.091 -6.465 -2.837 1.00 0.00 C ATOM 816 C GLY A 415 3.156 -7.647 -3.011 1.00 0.00 C ATOM 817 O GLY A 415 1.940 -7.479 -3.086 1.00 0.00 O ATOM 0 H GLY A 415 2.688 -5.290 -3.859 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.098 -6.756 -3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.137 -6.194 -1.782 1.00 0.00 H new ATOM 821 N VAL A 416 3.727 -8.846 -3.075 1.00 0.00 N ATOM 822 CA VAL A 416 2.937 -10.059 -3.243 1.00 0.00 C ATOM 823 C VAL A 416 2.523 -10.640 -1.901 1.00 0.00 C ATOM 824 O VAL A 416 2.872 -10.117 -0.842 1.00 0.00 O ATOM 825 CB VAL A 416 3.702 -11.131 -4.050 1.00 0.00 C ATOM 826 CG1 VAL A 416 4.647 -11.933 -3.165 1.00 0.00 C ATOM 827 CG2 VAL A 416 2.734 -12.049 -4.778 1.00 0.00 C ATOM 0 H VAL A 416 4.733 -9.003 -3.013 1.00 0.00 H new ATOM 0 HA VAL A 416 2.044 -9.774 -3.799 1.00 0.00 H new ATOM 0 HB VAL A 416 4.310 -10.613 -4.792 1.00 0.00 H new ATOM 0 HG11 VAL A 416 5.167 -12.677 -3.768 1.00 0.00 H new ATOM 0 HG12 VAL A 416 5.375 -11.262 -2.709 1.00 0.00 H new ATOM 0 HG13 VAL A 416 4.076 -12.434 -2.384 1.00 0.00 H new ATOM 0 HG21 VAL A 416 3.294 -12.796 -5.340 1.00 0.00 H new ATOM 0 HG22 VAL A 416 2.090 -12.547 -4.053 1.00 0.00 H new ATOM 0 HG23 VAL A 416 2.122 -11.463 -5.464 1.00 0.00 H new ATOM 837 N GLY A 417 1.781 -11.727 -1.969 1.00 0.00 N ATOM 838 CA GLY A 417 1.315 -12.392 -0.767 1.00 0.00 C ATOM 839 C GLY A 417 0.461 -13.606 -1.071 1.00 0.00 C ATOM 840 O GLY A 417 -0.049 -13.752 -2.182 1.00 0.00 O ATOM 0 H GLY A 417 1.488 -12.168 -2.841 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.173 -12.696 -0.168 1.00 0.00 H new ATOM 0 HA3 GLY A 417 0.740 -11.688 -0.166 1.00 0.00 H new ATOM 844 N ARG A 418 0.302 -14.478 -0.082 1.00 0.00 N ATOM 845 CA ARG A 418 -0.499 -15.684 -0.252 1.00 0.00 C ATOM 846 C ARG A 418 -1.952 -15.330 -0.550 1.00 0.00 C ATOM 847 O ARG A 418 -2.665 -16.091 -1.204 1.00 0.00 O ATOM 848 CB ARG A 418 -0.421 -16.559 1.001 1.00 0.00 C ATOM 849 CG ARG A 418 1.000 -16.842 1.459 1.00 0.00 C ATOM 850 CD ARG A 418 1.088 -16.938 2.973 1.00 0.00 C ATOM 851 NE ARG A 418 2.361 -17.506 3.414 1.00 0.00 N ATOM 852 CZ ARG A 418 3.496 -16.815 3.487 1.00 0.00 C ATOM 853 NH1 ARG A 418 3.523 -15.532 3.147 1.00 0.00 N ATOM 854 NH2 ARG A 418 4.608 -17.408 3.899 1.00 0.00 N ATOM 0 H ARG A 418 0.716 -14.373 0.844 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.096 -16.241 -1.098 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.964 -16.070 1.810 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -0.926 -17.505 0.805 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.348 -17.774 1.013 1.00 0.00 H new ATOM 0 HG3 ARG A 418 1.662 -16.052 1.104 1.00 0.00 H new ATOM 0 HD2 ARG A 418 0.964 -15.946 3.407 1.00 0.00 H new ATOM 0 HD3 ARG A 418 0.269 -17.553 3.345 1.00 0.00 H new ATOM 0 HE ARG A 418 2.380 -18.490 3.682 1.00 0.00 H new ATOM 0 HH11 ARG A 418 2.671 -15.071 2.828 1.00 0.00 H new ATOM 0 HH12 ARG A 418 4.396 -15.007 3.205 1.00 0.00 H new ATOM 0 HH21 ARG A 418 4.594 -18.394 4.160 1.00 0.00 H new ATOM 0 HH22 ARG A 418 5.478 -16.878 3.955 1.00 0.00 H new ATOM 866 N ASN A 419 -2.384 -14.167 -0.071 1.00 0.00 N ATOM 867 CA ASN A 419 -3.752 -13.710 -0.293 1.00 0.00 C ATOM 868 C ASN A 419 -3.828 -12.188 -0.245 1.00 0.00 C ATOM 869 O ASN A 419 -2.812 -11.510 -0.092 1.00 0.00 O ATOM 870 CB ASN A 419 -4.704 -14.318 0.744 1.00 0.00 C ATOM 871 CG ASN A 419 -4.055 -14.512 2.101 1.00 0.00 C ATOM 872 OD1 ASN A 419 -3.026 -15.178 2.221 1.00 0.00 O ATOM 873 ND2 ASN A 419 -4.655 -13.929 3.132 1.00 0.00 N ATOM 0 H ASN A 419 -1.807 -13.525 0.473 1.00 0.00 H new ATOM 0 HA ASN A 419 -4.060 -14.043 -1.284 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -5.575 -13.672 0.853 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -5.064 -15.280 0.379 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -4.265 -14.024 4.070 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -5.506 -13.386 2.986 1.00 0.00 H new ATOM 880 N ILE A 420 -5.037 -11.656 -0.384 1.00 0.00 N ATOM 881 CA ILE A 420 -5.247 -10.212 -0.364 1.00 0.00 C ATOM 882 C ILE A 420 -4.726 -9.592 0.929 1.00 0.00 C ATOM 883 O ILE A 420 -4.210 -8.474 0.929 1.00 0.00 O ATOM 884 CB ILE A 420 -6.739 -9.859 -0.533 1.00 0.00 C ATOM 885 CG1 ILE A 420 -6.924 -8.341 -0.634 1.00 0.00 C ATOM 886 CG2 ILE A 420 -7.553 -10.425 0.623 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.652 -7.906 -1.887 1.00 0.00 C ATOM 0 H ILE A 420 -5.888 -12.203 -0.512 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.688 -9.801 -1.204 1.00 0.00 H new ATOM 0 HB ILE A 420 -7.099 -10.309 -1.458 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.476 -7.991 0.238 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -5.946 -7.861 -0.606 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.604 -10.167 0.489 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -7.446 -11.509 0.647 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -7.193 -10.004 1.562 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -7.748 -6.820 -1.894 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -7.090 -8.226 -2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.644 -8.358 -1.907 1.00 0.00 H new ATOM 899 N LYS A 421 -4.869 -10.322 2.030 1.00 0.00 N ATOM 900 CA LYS A 421 -4.417 -9.840 3.330 1.00 0.00 C ATOM 901 C LYS A 421 -2.903 -9.672 3.357 1.00 0.00 C ATOM 902 O LYS A 421 -2.391 -8.568 3.545 1.00 0.00 O ATOM 903 CB LYS A 421 -4.855 -10.802 4.435 1.00 0.00 C ATOM 904 CG LYS A 421 -6.326 -10.686 4.795 1.00 0.00 C ATOM 905 CD LYS A 421 -7.146 -11.796 4.157 1.00 0.00 C ATOM 906 CE LYS A 421 -8.581 -11.787 4.656 1.00 0.00 C ATOM 907 NZ LYS A 421 -9.112 -13.165 4.846 1.00 0.00 N ATOM 0 H LYS A 421 -5.294 -11.249 2.048 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.873 -8.865 3.503 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.647 -11.824 4.119 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.256 -10.615 5.326 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.440 -10.725 5.878 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -6.706 -9.718 4.469 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -7.136 -11.680 3.073 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -6.689 -12.760 4.378 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -8.634 -11.244 5.600 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -9.209 -11.251 3.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -10.093 -13.115 5.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -9.086 -13.675 3.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -8.528 -13.669 5.544 1.00 0.00 H new ATOM 921 N ILE A 422 -2.195 -10.776 3.169 1.00 0.00 N ATOM 922 CA ILE A 422 -0.737 -10.762 3.171 1.00 0.00 C ATOM 923 C ILE A 422 -0.196 -9.839 2.083 1.00 0.00 C ATOM 924 O ILE A 422 0.624 -8.961 2.350 1.00 0.00 O ATOM 925 CB ILE A 422 -0.161 -12.185 2.977 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.364 -13.014 4.247 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.316 -12.128 2.613 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.799 -13.436 4.473 1.00 0.00 C ATOM 0 H ILE A 422 -2.607 -11.696 3.013 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.421 -10.386 4.144 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.695 -12.662 2.155 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.263 -13.904 4.194 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -0.025 -12.436 5.106 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.698 -13.141 2.482 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.441 -11.570 1.685 1.00 0.00 H new ATOM 0 HG23 ILE A 422 1.869 -11.632 3.411 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.866 -14.020 5.391 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -2.429 -12.551 4.559 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -2.137 -14.042 3.632 1.00 0.00 H new ATOM 940 N ALA A 423 -0.660 -10.045 0.859 1.00 0.00 N ATOM 941 CA ALA A 423 -0.223 -9.235 -0.271 1.00 0.00 C ATOM 942 C ALA A 423 -0.418 -7.751 0.008 1.00 0.00 C ATOM 943 O ALA A 423 0.466 -6.936 -0.256 1.00 0.00 O ATOM 944 CB ALA A 423 -0.970 -9.639 -1.533 1.00 0.00 C ATOM 0 H ALA A 423 -1.340 -10.767 0.622 1.00 0.00 H new ATOM 0 HA ALA A 423 0.842 -9.413 -0.420 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.632 -9.025 -2.368 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.774 -10.689 -1.752 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -2.040 -9.493 -1.385 1.00 0.00 H new ATOM 950 N GLY A 424 -1.579 -7.412 0.549 1.00 0.00 N ATOM 951 CA GLY A 424 -1.874 -6.029 0.865 1.00 0.00 C ATOM 952 C GLY A 424 -0.879 -5.443 1.847 1.00 0.00 C ATOM 953 O GLY A 424 -0.505 -4.275 1.741 1.00 0.00 O ATOM 0 H GLY A 424 -2.324 -8.071 0.775 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.868 -5.439 -0.052 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.878 -5.959 1.283 1.00 0.00 H new ATOM 957 N ILE A 425 -0.448 -6.259 2.802 1.00 0.00 N ATOM 958 CA ILE A 425 0.515 -5.822 3.803 1.00 0.00 C ATOM 959 C ILE A 425 1.905 -5.697 3.193 1.00 0.00 C ATOM 960 O ILE A 425 2.674 -4.803 3.548 1.00 0.00 O ATOM 961 CB ILE A 425 0.567 -6.800 4.995 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.816 -6.930 5.636 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.592 -6.338 6.023 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.979 -8.179 6.473 1.00 0.00 C ATOM 0 H ILE A 425 -0.751 -7.228 2.903 1.00 0.00 H new ATOM 0 HA ILE A 425 0.189 -4.847 4.164 1.00 0.00 H new ATOM 0 HB ILE A 425 0.871 -7.779 4.626 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -1.001 -6.057 6.261 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.573 -6.927 4.852 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.614 -7.041 6.856 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.578 -6.294 5.560 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.319 -5.349 6.390 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.983 -8.205 6.896 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.826 -9.059 5.848 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.246 -8.175 7.279 1.00 0.00 H new ATOM 976 N ARG A 426 2.218 -6.596 2.267 1.00 0.00 N ATOM 977 CA ARG A 426 3.514 -6.584 1.600 1.00 0.00 C ATOM 978 C ARG A 426 3.633 -5.372 0.686 1.00 0.00 C ATOM 979 O ARG A 426 4.678 -4.725 0.628 1.00 0.00 O ATOM 980 CB ARG A 426 3.714 -7.873 0.797 1.00 0.00 C ATOM 981 CG ARG A 426 4.598 -8.893 1.496 1.00 0.00 C ATOM 982 CD ARG A 426 5.351 -9.759 0.497 1.00 0.00 C ATOM 983 NE ARG A 426 6.756 -9.922 0.864 1.00 0.00 N ATOM 984 CZ ARG A 426 7.538 -10.894 0.397 1.00 0.00 C ATOM 985 NH1 ARG A 426 7.056 -11.791 -0.454 1.00 0.00 N ATOM 986 NH2 ARG A 426 8.804 -10.968 0.783 1.00 0.00 N ATOM 0 H ARG A 426 1.593 -7.342 1.961 1.00 0.00 H new ATOM 0 HA ARG A 426 4.291 -6.523 2.362 1.00 0.00 H new ATOM 0 HB2 ARG A 426 2.741 -8.323 0.599 1.00 0.00 H new ATOM 0 HB3 ARG A 426 4.153 -7.625 -0.169 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.310 -8.377 2.141 1.00 0.00 H new ATOM 0 HG3 ARG A 426 3.986 -9.526 2.139 1.00 0.00 H new ATOM 0 HD2 ARG A 426 4.876 -10.738 0.436 1.00 0.00 H new ATOM 0 HD3 ARG A 426 5.285 -9.310 -0.494 1.00 0.00 H new ATOM 0 HE ARG A 426 7.162 -9.252 1.517 1.00 0.00 H new ATOM 0 HH11 ARG A 426 6.082 -11.738 -0.754 1.00 0.00 H new ATOM 0 HH12 ARG A 426 7.659 -12.533 -0.809 1.00 0.00 H new ATOM 0 HH21 ARG A 426 9.179 -10.281 1.437 1.00 0.00 H new ATOM 0 HH22 ARG A 426 9.403 -11.712 0.426 1.00 0.00 H new ATOM 998 N ALA A 427 2.552 -5.066 -0.020 1.00 0.00 N ATOM 999 CA ALA A 427 2.532 -3.924 -0.927 1.00 0.00 C ATOM 1000 C ALA A 427 2.714 -2.626 -0.154 1.00 0.00 C ATOM 1001 O ALA A 427 3.545 -1.790 -0.508 1.00 0.00 O ATOM 1002 CB ALA A 427 1.234 -3.897 -1.720 1.00 0.00 C ATOM 0 H ALA A 427 1.678 -5.591 0.017 1.00 0.00 H new ATOM 0 HA ALA A 427 3.361 -4.025 -1.628 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.236 -3.039 -2.392 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.145 -4.814 -2.303 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.390 -3.819 -1.034 1.00 0.00 H new ATOM 1008 N ALA A 428 1.939 -2.471 0.911 1.00 0.00 N ATOM 1009 CA ALA A 428 2.020 -1.282 1.748 1.00 0.00 C ATOM 1010 C ALA A 428 3.399 -1.175 2.378 1.00 0.00 C ATOM 1011 O ALA A 428 3.982 -0.094 2.449 1.00 0.00 O ATOM 1012 CB ALA A 428 0.947 -1.316 2.826 1.00 0.00 C ATOM 0 H ALA A 428 1.246 -3.155 1.216 1.00 0.00 H new ATOM 0 HA ALA A 428 1.853 -0.405 1.122 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.022 -0.420 3.442 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -0.037 -1.354 2.359 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.086 -2.199 3.450 1.00 0.00 H new ATOM 1018 N GLU A 429 3.921 -2.313 2.822 1.00 0.00 N ATOM 1019 CA GLU A 429 5.241 -2.355 3.434 1.00 0.00 C ATOM 1020 C GLU A 429 6.295 -1.903 2.432 1.00 0.00 C ATOM 1021 O GLU A 429 7.260 -1.228 2.788 1.00 0.00 O ATOM 1022 CB GLU A 429 5.555 -3.767 3.932 1.00 0.00 C ATOM 1023 CG GLU A 429 5.021 -4.050 5.326 1.00 0.00 C ATOM 1024 CD GLU A 429 5.507 -5.374 5.880 1.00 0.00 C ATOM 1025 OE1 GLU A 429 5.905 -6.244 5.075 1.00 0.00 O ATOM 1026 OE2 GLU A 429 5.490 -5.544 7.117 1.00 0.00 O ATOM 0 H GLU A 429 3.450 -3.216 2.769 1.00 0.00 H new ATOM 0 HA GLU A 429 5.252 -1.678 4.288 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.133 -4.492 3.236 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.635 -3.913 3.929 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.325 -3.246 5.997 1.00 0.00 H new ATOM 0 HG3 GLU A 429 3.931 -4.049 5.300 1.00 0.00 H new ATOM 1033 N ASN A 430 6.086 -2.266 1.171 1.00 0.00 N ATOM 1034 CA ASN A 430 7.002 -1.885 0.104 1.00 0.00 C ATOM 1035 C ASN A 430 6.999 -0.372 -0.064 1.00 0.00 C ATOM 1036 O ASN A 430 8.025 0.237 -0.366 1.00 0.00 O ATOM 1037 CB ASN A 430 6.604 -2.566 -1.209 1.00 0.00 C ATOM 1038 CG ASN A 430 7.585 -3.647 -1.619 1.00 0.00 C ATOM 1039 OD1 ASN A 430 7.570 -4.753 -1.079 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.445 -3.331 -2.581 1.00 0.00 N ATOM 0 H ASN A 430 5.289 -2.824 0.863 1.00 0.00 H new ATOM 0 HA ASN A 430 8.008 -2.210 0.370 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.611 -3.002 -1.103 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.541 -1.818 -1.999 1.00 0.00 H new ATOM 0 HD21 ASN A 430 9.129 -4.018 -2.900 1.00 0.00 H new ATOM 0 HD22 ASN A 430 8.422 -2.402 -3.001 1.00 0.00 H new ATOM 1047 N ALA A 431 5.832 0.229 0.149 1.00 0.00 N ATOM 1048 CA ALA A 431 5.679 1.672 0.040 1.00 0.00 C ATOM 1049 C ALA A 431 6.219 2.361 1.288 1.00 0.00 C ATOM 1050 O ALA A 431 6.704 3.490 1.228 1.00 0.00 O ATOM 1051 CB ALA A 431 4.217 2.033 -0.177 1.00 0.00 C ATOM 0 H ALA A 431 4.976 -0.266 0.399 1.00 0.00 H new ATOM 0 HA ALA A 431 6.253 2.018 -0.820 1.00 0.00 H new ATOM 0 HB1 ALA A 431 4.117 3.116 -0.257 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.860 1.567 -1.095 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.625 1.675 0.665 1.00 0.00 H new ATOM 1057 N LEU A 432 6.133 1.665 2.419 1.00 0.00 N ATOM 1058 CA LEU A 432 6.615 2.199 3.686 1.00 0.00 C ATOM 1059 C LEU A 432 8.137 2.101 3.772 1.00 0.00 C ATOM 1060 O LEU A 432 8.779 2.870 4.487 1.00 0.00 O ATOM 1061 CB LEU A 432 5.977 1.444 4.856 1.00 0.00 C ATOM 1062 CG LEU A 432 4.671 2.041 5.380 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.562 1.888 4.352 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.274 1.382 6.692 1.00 0.00 C ATOM 0 H LEU A 432 5.733 0.729 2.482 1.00 0.00 H new ATOM 0 HA LEU A 432 6.332 3.250 3.742 1.00 0.00 H new ATOM 0 HB2 LEU A 432 5.789 0.416 4.545 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.694 1.403 5.676 1.00 0.00 H new ATOM 0 HG LEU A 432 4.828 3.105 5.560 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.641 2.319 4.744 1.00 0.00 H new ATOM 0 HD12 LEU A 432 3.843 2.405 3.434 1.00 0.00 H new ATOM 0 HD13 LEU A 432 3.406 0.830 4.140 1.00 0.00 H new ATOM 0 HD21 LEU A 432 3.342 1.819 7.051 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.136 0.312 6.535 1.00 0.00 H new ATOM 0 HD23 LEU A 432 5.058 1.542 7.432 1.00 0.00 H new ATOM 1076 N ARG A 433 8.707 1.146 3.040 1.00 0.00 N ATOM 1077 CA ARG A 433 10.153 0.942 3.032 1.00 0.00 C ATOM 1078 C ARG A 433 10.888 2.228 2.673 1.00 0.00 C ATOM 1079 O ARG A 433 11.790 2.661 3.390 1.00 0.00 O ATOM 1080 CB ARG A 433 10.526 -0.167 2.046 1.00 0.00 C ATOM 1081 CG ARG A 433 10.833 -1.498 2.714 1.00 0.00 C ATOM 1082 CD ARG A 433 11.326 -2.525 1.708 1.00 0.00 C ATOM 1083 NE ARG A 433 11.227 -3.888 2.224 1.00 0.00 N ATOM 1084 CZ ARG A 433 12.108 -4.432 3.062 1.00 0.00 C ATOM 1085 NH1 ARG A 433 13.155 -3.732 3.480 1.00 0.00 N ATOM 1086 NH2 ARG A 433 11.941 -5.679 3.482 1.00 0.00 N ATOM 0 H ARG A 433 8.188 0.501 2.444 1.00 0.00 H new ATOM 0 HA ARG A 433 10.456 0.645 4.036 1.00 0.00 H new ATOM 0 HB2 ARG A 433 9.707 -0.305 1.340 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.395 0.149 1.468 1.00 0.00 H new ATOM 0 HG2 ARG A 433 11.588 -1.353 3.487 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.937 -1.873 3.209 1.00 0.00 H new ATOM 0 HD2 ARG A 433 10.744 -2.442 0.790 1.00 0.00 H new ATOM 0 HD3 ARG A 433 12.363 -2.310 1.449 1.00 0.00 H new ATOM 0 HE ARG A 433 10.436 -4.458 1.925 1.00 0.00 H new ATOM 0 HH11 ARG A 433 13.288 -2.773 3.160 1.00 0.00 H new ATOM 0 HH12 ARG A 433 13.827 -4.153 4.122 1.00 0.00 H new ATOM 0 HH21 ARG A 433 11.138 -6.221 3.163 1.00 0.00 H new ATOM 0 HH22 ARG A 433 12.616 -6.096 4.124 1.00 0.00 H new ATOM 1098 N ASP A 434 10.495 2.830 1.560 1.00 0.00 N ATOM 1099 CA ASP A 434 11.114 4.069 1.098 1.00 0.00 C ATOM 1100 C ASP A 434 10.931 5.180 2.125 1.00 0.00 C ATOM 1101 O ASP A 434 10.015 5.996 2.018 1.00 0.00 O ATOM 1102 CB ASP A 434 10.514 4.495 -0.243 1.00 0.00 C ATOM 1103 CG ASP A 434 11.051 3.677 -1.402 1.00 0.00 C ATOM 1104 OD1 ASP A 434 10.712 2.480 -1.492 1.00 0.00 O ATOM 1105 OD2 ASP A 434 11.812 4.236 -2.221 1.00 0.00 O ATOM 0 H ASP A 434 9.749 2.482 0.958 1.00 0.00 H new ATOM 0 HA ASP A 434 12.181 3.888 0.968 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.430 4.393 -0.202 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.729 5.550 -0.416 1.00 0.00 H new ATOM 1110 N LYS A 435 11.810 5.207 3.122 1.00 0.00 N ATOM 1111 CA LYS A 435 11.748 6.216 4.173 1.00 0.00 C ATOM 1112 C LYS A 435 11.816 7.619 3.585 1.00 0.00 C ATOM 1113 O LYS A 435 11.136 8.532 4.053 1.00 0.00 O ATOM 1114 CB LYS A 435 12.889 6.014 5.171 1.00 0.00 C ATOM 1115 CG LYS A 435 14.269 6.094 4.540 1.00 0.00 C ATOM 1116 CD LYS A 435 15.368 5.938 5.578 1.00 0.00 C ATOM 1117 CE LYS A 435 15.536 7.199 6.411 1.00 0.00 C ATOM 1118 NZ LYS A 435 16.948 7.674 6.420 1.00 0.00 N ATOM 0 H LYS A 435 12.575 4.540 3.224 1.00 0.00 H new ATOM 0 HA LYS A 435 10.796 6.105 4.692 1.00 0.00 H new ATOM 0 HB2 LYS A 435 12.813 6.767 5.955 1.00 0.00 H new ATOM 0 HB3 LYS A 435 12.774 5.042 5.651 1.00 0.00 H new ATOM 0 HG2 LYS A 435 14.369 5.316 3.783 1.00 0.00 H new ATOM 0 HG3 LYS A 435 14.382 7.051 4.030 1.00 0.00 H new ATOM 0 HD2 LYS A 435 15.135 5.098 6.232 1.00 0.00 H new ATOM 0 HD3 LYS A 435 16.309 5.702 5.080 1.00 0.00 H new ATOM 0 HE2 LYS A 435 14.891 7.984 6.016 1.00 0.00 H new ATOM 0 HE3 LYS A 435 15.212 7.005 7.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 17.021 8.535 6.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 17.560 6.935 6.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 17.250 7.884 5.447 1.00 0.00 H new ATOM 1132 N LYS A 436 12.636 7.784 2.555 1.00 0.00 N ATOM 1133 CA LYS A 436 12.785 9.077 1.903 1.00 0.00 C ATOM 1134 C LYS A 436 11.471 9.512 1.275 1.00 0.00 C ATOM 1135 O LYS A 436 10.923 10.563 1.610 1.00 0.00 O ATOM 1136 CB LYS A 436 13.880 9.017 0.837 1.00 0.00 C ATOM 1137 CG LYS A 436 14.965 10.063 1.027 1.00 0.00 C ATOM 1138 CD LYS A 436 14.384 11.468 1.048 1.00 0.00 C ATOM 1139 CE LYS A 436 15.165 12.379 1.981 1.00 0.00 C ATOM 1140 NZ LYS A 436 16.406 12.896 1.342 1.00 0.00 N ATOM 0 H LYS A 436 13.207 7.040 2.154 1.00 0.00 H new ATOM 0 HA LYS A 436 13.071 9.809 2.659 1.00 0.00 H new ATOM 0 HB2 LYS A 436 14.335 8.026 0.849 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.427 9.148 -0.146 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.496 9.873 1.960 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.696 9.982 0.222 1.00 0.00 H new ATOM 0 HD2 LYS A 436 14.394 11.882 0.040 1.00 0.00 H new ATOM 0 HD3 LYS A 436 13.342 11.427 1.365 1.00 0.00 H new ATOM 0 HE2 LYS A 436 14.535 13.217 2.282 1.00 0.00 H new ATOM 0 HE3 LYS A 436 15.424 11.833 2.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 16.910 13.513 2.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 17.019 12.098 1.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 16.158 13.439 0.490 1.00 0.00 H new ATOM 1154 N MET A 437 10.968 8.690 0.364 1.00 0.00 N ATOM 1155 CA MET A 437 9.712 8.977 -0.315 1.00 0.00 C ATOM 1156 C MET A 437 8.587 9.159 0.696 1.00 0.00 C ATOM 1157 O MET A 437 7.623 9.883 0.443 1.00 0.00 O ATOM 1158 CB MET A 437 9.367 7.851 -1.292 1.00 0.00 C ATOM 1159 CG MET A 437 8.058 8.067 -2.035 1.00 0.00 C ATOM 1160 SD MET A 437 8.304 8.525 -3.762 1.00 0.00 S ATOM 1161 CE MET A 437 9.479 9.864 -3.593 1.00 0.00 C ATOM 0 H MET A 437 11.412 7.817 0.078 1.00 0.00 H new ATOM 0 HA MET A 437 9.828 9.905 -0.875 1.00 0.00 H new ATOM 0 HB2 MET A 437 10.174 7.751 -2.018 1.00 0.00 H new ATOM 0 HB3 MET A 437 9.313 6.910 -0.744 1.00 0.00 H new ATOM 0 HG2 MET A 437 7.463 7.155 -1.987 1.00 0.00 H new ATOM 0 HG3 MET A 437 7.486 8.848 -1.534 1.00 0.00 H new ATOM 0 HE1 MET A 437 9.556 10.402 -4.538 1.00 0.00 H new ATOM 0 HE2 MET A 437 9.143 10.547 -2.813 1.00 0.00 H new ATOM 0 HE3 MET A 437 10.455 9.460 -3.325 1.00 0.00 H new ATOM 1171 N LEU A 438 8.721 8.510 1.848 1.00 0.00 N ATOM 1172 CA LEU A 438 7.717 8.618 2.898 1.00 0.00 C ATOM 1173 C LEU A 438 7.862 9.949 3.623 1.00 0.00 C ATOM 1174 O LEU A 438 6.873 10.577 4.000 1.00 0.00 O ATOM 1175 CB LEU A 438 7.846 7.461 3.890 1.00 0.00 C ATOM 1176 CG LEU A 438 6.521 6.819 4.303 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.641 7.827 5.026 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.801 6.259 3.085 1.00 0.00 C ATOM 0 H LEU A 438 9.511 7.907 2.077 1.00 0.00 H new ATOM 0 HA LEU A 438 6.730 8.568 2.439 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.484 6.694 3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.353 7.823 4.785 1.00 0.00 H new ATOM 0 HG LEU A 438 6.734 5.998 4.987 1.00 0.00 H new ATOM 0 HD11 LEU A 438 4.703 7.352 5.312 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.154 8.183 5.919 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.435 8.669 4.366 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.860 5.805 3.395 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.600 7.065 2.379 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.427 5.505 2.607 1.00 0.00 H new ATOM 1190 N ASP A 439 9.105 10.378 3.801 1.00 0.00 N ATOM 1191 CA ASP A 439 9.386 11.640 4.466 1.00 0.00 C ATOM 1192 C ASP A 439 8.822 12.799 3.658 1.00 0.00 C ATOM 1193 O ASP A 439 8.222 13.719 4.210 1.00 0.00 O ATOM 1194 CB ASP A 439 10.893 11.819 4.662 1.00 0.00 C ATOM 1195 CG ASP A 439 11.393 11.166 5.935 1.00 0.00 C ATOM 1196 OD1 ASP A 439 10.757 11.364 6.992 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.419 10.457 5.876 1.00 0.00 O ATOM 0 H ASP A 439 9.934 9.869 3.493 1.00 0.00 H new ATOM 0 HA ASP A 439 8.907 11.628 5.445 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.420 11.394 3.808 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.129 12.883 4.686 1.00 0.00 H new ATOM 1202 N PHE A 440 9.014 12.742 2.345 1.00 0.00 N ATOM 1203 CA PHE A 440 8.521 13.786 1.453 1.00 0.00 C ATOM 1204 C PHE A 440 7.012 13.963 1.600 1.00 0.00 C ATOM 1205 O PHE A 440 6.501 15.083 1.554 1.00 0.00 O ATOM 1206 CB PHE A 440 8.860 13.447 0.003 1.00 0.00 C ATOM 1207 CG PHE A 440 9.051 14.656 -0.868 1.00 0.00 C ATOM 1208 CD1 PHE A 440 9.839 15.713 -0.445 1.00 0.00 C ATOM 1209 CD2 PHE A 440 8.441 14.734 -2.110 1.00 0.00 C ATOM 1210 CE1 PHE A 440 10.016 16.828 -1.243 1.00 0.00 C ATOM 1211 CE2 PHE A 440 8.613 15.846 -2.913 1.00 0.00 C ATOM 1212 CZ PHE A 440 9.402 16.894 -2.480 1.00 0.00 C ATOM 0 H PHE A 440 9.508 11.984 1.874 1.00 0.00 H new ATOM 0 HA PHE A 440 9.009 14.721 1.728 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.770 12.847 -0.018 1.00 0.00 H new ATOM 0 HB3 PHE A 440 8.063 12.832 -0.414 1.00 0.00 H new ATOM 0 HD1 PHE A 440 10.321 15.666 0.520 1.00 0.00 H new ATOM 0 HD2 PHE A 440 7.824 13.917 -2.454 1.00 0.00 H new ATOM 0 HE1 PHE A 440 10.633 17.646 -0.901 1.00 0.00 H new ATOM 0 HE2 PHE A 440 8.131 15.895 -3.878 1.00 0.00 H new ATOM 0 HZ PHE A 440 9.539 17.763 -3.106 1.00 0.00 H new ATOM 1222 N TYR A 441 6.308 12.852 1.784 1.00 0.00 N ATOM 1223 CA TYR A 441 4.864 12.881 1.946 1.00 0.00 C ATOM 1224 C TYR A 441 4.505 13.220 3.380 1.00 0.00 C ATOM 1225 O TYR A 441 3.646 14.060 3.636 1.00 0.00 O ATOM 1226 CB TYR A 441 4.259 11.534 1.563 1.00 0.00 C ATOM 1227 CG TYR A 441 3.996 11.388 0.083 1.00 0.00 C ATOM 1228 CD1 TYR A 441 5.041 11.201 -0.811 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.704 11.428 -0.415 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.802 11.059 -2.166 1.00 0.00 C ATOM 1231 CE2 TYR A 441 2.455 11.288 -1.766 1.00 0.00 C ATOM 1232 CZ TYR A 441 3.507 11.103 -2.638 1.00 0.00 C ATOM 1233 OH TYR A 441 3.264 10.961 -3.985 1.00 0.00 O ATOM 0 H TYR A 441 6.718 11.919 1.824 1.00 0.00 H new ATOM 0 HA TYR A 441 4.457 13.648 1.288 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.932 10.739 1.884 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.323 11.398 2.105 1.00 0.00 H new ATOM 0 HD1 TYR A 441 6.056 11.166 -0.443 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.877 11.571 0.265 1.00 0.00 H new ATOM 0 HE1 TYR A 441 5.625 10.914 -2.850 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.442 11.323 -2.138 1.00 0.00 H new ATOM 0 HH TYR A 441 2.386 10.546 -4.117 1.00 0.00 H new ATOM 1243 N ALA A 442 5.176 12.562 4.314 1.00 0.00 N ATOM 1244 CA ALA A 442 4.930 12.800 5.727 1.00 0.00 C ATOM 1245 C ALA A 442 5.187 14.261 6.080 1.00 0.00 C ATOM 1246 O ALA A 442 4.538 14.817 6.965 1.00 0.00 O ATOM 1247 CB ALA A 442 5.788 11.878 6.583 1.00 0.00 C ATOM 0 H ALA A 442 5.892 11.862 4.119 1.00 0.00 H new ATOM 0 HA ALA A 442 3.883 12.580 5.934 1.00 0.00 H new ATOM 0 HB1 ALA A 442 5.590 12.071 7.637 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.548 10.840 6.353 1.00 0.00 H new ATOM 0 HB3 ALA A 442 6.842 12.062 6.372 1.00 0.00 H new ATOM 1253 N LYS A 443 6.124 14.887 5.371 1.00 0.00 N ATOM 1254 CA LYS A 443 6.440 16.293 5.606 1.00 0.00 C ATOM 1255 C LYS A 443 5.438 17.193 4.887 1.00 0.00 C ATOM 1256 O LYS A 443 5.491 18.416 5.009 1.00 0.00 O ATOM 1257 CB LYS A 443 7.862 16.617 5.143 1.00 0.00 C ATOM 1258 CG LYS A 443 8.836 16.862 6.287 1.00 0.00 C ATOM 1259 CD LYS A 443 8.809 15.728 7.300 1.00 0.00 C ATOM 1260 CE LYS A 443 8.153 16.160 8.602 1.00 0.00 C ATOM 1261 NZ LYS A 443 7.608 15.000 9.361 1.00 0.00 N ATOM 0 H LYS A 443 6.674 14.446 4.634 1.00 0.00 H new ATOM 0 HA LYS A 443 6.375 16.479 6.678 1.00 0.00 H new ATOM 0 HB2 LYS A 443 8.232 15.794 4.532 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.835 17.500 4.505 1.00 0.00 H new ATOM 0 HG2 LYS A 443 9.845 16.971 5.889 1.00 0.00 H new ATOM 0 HG3 LYS A 443 8.586 17.800 6.783 1.00 0.00 H new ATOM 0 HD2 LYS A 443 8.268 14.879 6.883 1.00 0.00 H new ATOM 0 HD3 LYS A 443 9.827 15.391 7.498 1.00 0.00 H new ATOM 0 HE2 LYS A 443 8.882 16.687 9.218 1.00 0.00 H new ATOM 0 HE3 LYS A 443 7.349 16.864 8.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 7.169 15.337 10.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 6.894 14.512 8.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 8.379 14.341 9.588 1.00 0.00 H new ATOM 1275 N GLN A 444 4.523 16.579 4.142 1.00 0.00 N ATOM 1276 CA GLN A 444 3.510 17.317 3.413 1.00 0.00 C ATOM 1277 C GLN A 444 2.129 17.025 3.994 1.00 0.00 C ATOM 1278 O GLN A 444 1.381 17.941 4.330 1.00 0.00 O ATOM 1279 CB GLN A 444 3.575 16.963 1.921 1.00 0.00 C ATOM 1280 CG GLN A 444 2.219 16.835 1.250 1.00 0.00 C ATOM 1281 CD GLN A 444 2.321 16.731 -0.259 1.00 0.00 C ATOM 1282 OE1 GLN A 444 1.550 17.353 -0.989 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.277 15.940 -0.733 1.00 0.00 N ATOM 0 H GLN A 444 4.467 15.567 4.031 1.00 0.00 H new ATOM 0 HA GLN A 444 3.698 18.386 3.515 1.00 0.00 H new ATOM 0 HB2 GLN A 444 4.153 17.728 1.403 1.00 0.00 H new ATOM 0 HB3 GLN A 444 4.115 16.023 1.806 1.00 0.00 H new ATOM 0 HG2 GLN A 444 1.708 15.953 1.637 1.00 0.00 H new ATOM 0 HG3 GLN A 444 1.606 17.698 1.510 1.00 0.00 H new ATOM 0 HE21 GLN A 444 3.894 15.443 -0.090 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.395 15.829 -1.740 1.00 0.00 H new ATOM 1292 N ARG A 445 1.801 15.742 4.117 1.00 0.00 N ATOM 1293 CA ARG A 445 0.511 15.342 4.670 1.00 0.00 C ATOM 1294 C ARG A 445 0.407 15.738 6.140 1.00 0.00 C ATOM 1295 O ARG A 445 -0.651 16.162 6.606 1.00 0.00 O ATOM 1296 CB ARG A 445 0.302 13.831 4.521 1.00 0.00 C ATOM 1297 CG ARG A 445 1.201 12.993 5.416 1.00 0.00 C ATOM 1298 CD ARG A 445 0.509 12.625 6.720 1.00 0.00 C ATOM 1299 NE ARG A 445 -0.705 11.844 6.494 1.00 0.00 N ATOM 1300 CZ ARG A 445 -1.940 12.342 6.554 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -2.140 13.627 6.821 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -2.982 11.549 6.343 1.00 0.00 N ATOM 0 H ARG A 445 2.405 14.967 3.844 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.268 15.861 4.111 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -0.738 13.594 4.744 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.477 13.551 3.482 1.00 0.00 H new ATOM 0 HG2 ARG A 445 1.494 12.084 4.890 1.00 0.00 H new ATOM 0 HG3 ARG A 445 2.116 13.545 5.632 1.00 0.00 H new ATOM 0 HD2 ARG A 445 1.195 12.055 7.346 1.00 0.00 H new ATOM 0 HD3 ARG A 445 0.259 13.534 7.267 1.00 0.00 H new ATOM 0 HE ARG A 445 -0.601 10.853 6.276 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -1.344 14.244 6.983 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -3.089 13.997 6.864 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -2.837 10.561 6.135 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -3.928 11.927 6.388 1.00 0.00 H new ATOM 1314 N ALA A 446 1.513 15.598 6.862 1.00 0.00 N ATOM 1315 CA ALA A 446 1.551 15.942 8.278 1.00 0.00 C ATOM 1316 C ALA A 446 1.820 17.431 8.474 1.00 0.00 C ATOM 1317 O ALA A 446 1.603 17.972 9.558 1.00 0.00 O ATOM 1318 CB ALA A 446 2.610 15.114 8.992 1.00 0.00 C ATOM 0 H ALA A 446 2.396 15.248 6.489 1.00 0.00 H new ATOM 0 HA ALA A 446 0.576 15.716 8.709 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.629 15.380 10.049 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.374 14.055 8.889 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.586 15.313 8.550 1.00 0.00 H new