USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 677 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 404 LYS NZ :NH3+ 157:sc= 0.548 (180deg=0.45) USER MOD Set 1.2: A 409 TYR OH : rot 180:sc= 0.108 USER MOD Single : A 379 SER OG : rot 31:sc= 0.00384 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 389 LYS NZ :NH3+ -105:sc= 0.188 (180deg=0) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -0.32 X(o=-0.32,f=0) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 415 MET CE :methyl -122:sc= 0 (180deg=-0.0849) USER MOD Single : A 417 THR OG1 : rot 107:sc= 1.19 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 SER OG : rot -72:sc= 0.824 USER MOD Single : A 428 THR OG1 : rot -170:sc= -0.543 USER MOD Single : A 431 GLN : amide:sc= -0.983 K(o=-0.98,f=-2.3!) 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= -0.301 X(o=-0.3,f=-0.35) USER MOD Single : A 451 LYS NZ :NH3+ -129:sc= -0.224 (180deg=-1.41) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 112 N SER A 379 5.045 23.968 -4.653 1.00 0.00 N ATOM 113 CA SER A 379 4.965 22.881 -3.679 1.00 0.00 C ATOM 114 C SER A 379 3.767 21.975 -3.915 1.00 0.00 C ATOM 115 O SER A 379 3.758 20.827 -3.472 1.00 0.00 O ATOM 116 CB SER A 379 4.931 23.438 -2.255 1.00 0.00 C ATOM 117 OG SER A 379 6.167 24.043 -1.915 1.00 0.00 O ATOM 0 HA SER A 379 5.861 22.274 -3.809 1.00 0.00 H new ATOM 0 HB2 SER A 379 4.128 24.169 -2.166 1.00 0.00 H new ATOM 0 HB3 SER A 379 4.710 22.635 -1.552 1.00 0.00 H new ATOM 0 HG SER A 379 6.578 24.422 -2.720 1.00 0.00 H new ATOM 123 N ILE A 380 2.769 22.473 -4.625 1.00 0.00 N ATOM 124 CA ILE A 380 1.596 21.671 -4.922 1.00 0.00 C ATOM 125 C ILE A 380 2.007 20.415 -5.681 1.00 0.00 C ATOM 126 O ILE A 380 1.368 19.370 -5.569 1.00 0.00 O ATOM 127 CB ILE A 380 0.553 22.465 -5.734 1.00 0.00 C ATOM 128 CG1 ILE A 380 -0.004 23.605 -4.884 1.00 0.00 C ATOM 129 CG2 ILE A 380 -0.574 21.554 -6.207 1.00 0.00 C ATOM 130 CD1 ILE A 380 -0.774 23.132 -3.670 1.00 0.00 C ATOM 0 H ILE A 380 2.747 23.420 -5.003 1.00 0.00 H new ATOM 0 HA ILE A 380 1.133 21.390 -3.976 1.00 0.00 H new ATOM 0 HB ILE A 380 1.040 22.882 -6.615 1.00 0.00 H new ATOM 0 HG12 ILE A 380 0.820 24.240 -4.557 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -0.657 24.222 -5.501 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -1.298 22.136 -6.777 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.164 20.766 -6.838 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.068 21.107 -5.344 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -1.140 23.994 -3.113 1.00 0.00 H new ATOM 0 HD12 ILE A 380 -1.618 22.521 -3.990 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.119 22.539 -3.032 1.00 0.00 H new ATOM 142 N LYS A 381 3.086 20.530 -6.451 1.00 0.00 N ATOM 143 CA LYS A 381 3.593 19.406 -7.232 1.00 0.00 C ATOM 144 C LYS A 381 3.946 18.229 -6.326 1.00 0.00 C ATOM 145 O LYS A 381 3.803 17.071 -6.716 1.00 0.00 O ATOM 146 CB LYS A 381 4.820 19.830 -8.037 1.00 0.00 C ATOM 147 CG LYS A 381 4.535 20.928 -9.050 1.00 0.00 C ATOM 148 CD LYS A 381 4.627 20.410 -10.478 1.00 0.00 C ATOM 149 CE LYS A 381 3.950 21.354 -11.459 1.00 0.00 C ATOM 150 NZ LYS A 381 3.196 20.619 -12.512 1.00 0.00 N ATOM 0 H LYS A 381 3.626 21.390 -6.551 1.00 0.00 H new ATOM 0 HA LYS A 381 2.808 19.090 -7.919 1.00 0.00 H new ATOM 0 HB2 LYS A 381 5.594 20.173 -7.350 1.00 0.00 H new ATOM 0 HB3 LYS A 381 5.220 18.961 -8.559 1.00 0.00 H new ATOM 0 HG2 LYS A 381 3.540 21.337 -8.874 1.00 0.00 H new ATOM 0 HG3 LYS A 381 5.244 21.744 -8.912 1.00 0.00 H new ATOM 0 HD2 LYS A 381 5.674 20.286 -10.754 1.00 0.00 H new ATOM 0 HD3 LYS A 381 4.163 19.426 -10.540 1.00 0.00 H new ATOM 0 HE2 LYS A 381 3.269 22.012 -10.918 1.00 0.00 H new ATOM 0 HE3 LYS A 381 4.701 21.989 -11.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 2.750 21.300 -13.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 3.849 20.011 -13.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 2.461 20.032 -12.067 1.00 0.00 H new ATOM 164 N LYS A 382 4.409 18.533 -5.118 1.00 0.00 N ATOM 165 CA LYS A 382 4.782 17.493 -4.165 1.00 0.00 C ATOM 166 C LYS A 382 3.561 16.732 -3.691 1.00 0.00 C ATOM 167 O LYS A 382 3.597 15.514 -3.518 1.00 0.00 O ATOM 168 CB LYS A 382 5.534 18.093 -2.976 1.00 0.00 C ATOM 169 CG LYS A 382 6.985 18.428 -3.280 1.00 0.00 C ATOM 170 CD LYS A 382 7.621 19.230 -2.156 1.00 0.00 C ATOM 171 CE LYS A 382 8.487 18.354 -1.265 1.00 0.00 C ATOM 172 NZ LYS A 382 9.907 18.341 -1.711 1.00 0.00 N ATOM 0 H LYS A 382 4.535 19.486 -4.777 1.00 0.00 H new ATOM 0 HA LYS A 382 5.445 16.792 -4.673 1.00 0.00 H new ATOM 0 HB2 LYS A 382 5.021 18.998 -2.652 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.499 17.391 -2.143 1.00 0.00 H new ATOM 0 HG2 LYS A 382 7.547 17.507 -3.434 1.00 0.00 H new ATOM 0 HG3 LYS A 382 7.041 18.995 -4.209 1.00 0.00 H new ATOM 0 HD2 LYS A 382 8.227 20.032 -2.578 1.00 0.00 H new ATOM 0 HD3 LYS A 382 6.841 19.701 -1.557 1.00 0.00 H new ATOM 0 HE2 LYS A 382 8.432 18.715 -0.238 1.00 0.00 H new ATOM 0 HE3 LYS A 382 8.097 17.336 -1.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 10.464 17.733 -1.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 9.963 17.973 -2.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 10.288 19.308 -1.685 1.00 0.00 H new ATOM 186 N ILE A 383 2.477 17.456 -3.503 1.00 0.00 N ATOM 187 CA ILE A 383 1.224 16.852 -3.072 1.00 0.00 C ATOM 188 C ILE A 383 0.774 15.829 -4.105 1.00 0.00 C ATOM 189 O ILE A 383 0.213 14.786 -3.771 1.00 0.00 O ATOM 190 CB ILE A 383 0.115 17.906 -2.882 1.00 0.00 C ATOM 191 CG1 ILE A 383 0.607 19.042 -1.982 1.00 0.00 C ATOM 192 CG2 ILE A 383 -1.133 17.263 -2.298 1.00 0.00 C ATOM 193 CD1 ILE A 383 1.104 18.573 -0.632 1.00 0.00 C ATOM 0 H ILE A 383 2.434 18.466 -3.641 1.00 0.00 H new ATOM 0 HA ILE A 383 1.399 16.370 -2.110 1.00 0.00 H new ATOM 0 HB ILE A 383 -0.138 18.324 -3.856 1.00 0.00 H new ATOM 0 HG12 ILE A 383 1.410 19.575 -2.490 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.205 19.754 -1.834 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -1.907 18.020 -2.170 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -1.493 16.487 -2.974 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -0.895 16.820 -1.331 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.437 19.431 -0.048 1.00 0.00 H new ATOM 0 HD12 ILE A 383 0.297 18.066 -0.103 1.00 0.00 H new ATOM 0 HD13 ILE A 383 1.937 17.884 -0.770 1.00 0.00 H new ATOM 205 N ILE A 384 1.060 16.136 -5.365 1.00 0.00 N ATOM 206 CA ILE A 384 0.726 15.248 -6.475 1.00 0.00 C ATOM 207 C ILE A 384 1.690 14.078 -6.492 1.00 0.00 C ATOM 208 O ILE A 384 1.297 12.924 -6.661 1.00 0.00 O ATOM 209 CB ILE A 384 0.821 15.953 -7.849 1.00 0.00 C ATOM 210 CG1 ILE A 384 0.801 17.474 -7.704 1.00 0.00 C ATOM 211 CG2 ILE A 384 -0.304 15.496 -8.762 1.00 0.00 C ATOM 212 CD1 ILE A 384 -0.453 18.004 -7.042 1.00 0.00 C ATOM 0 H ILE A 384 1.526 16.999 -5.646 1.00 0.00 H new ATOM 0 HA ILE A 384 -0.303 14.923 -6.320 1.00 0.00 H new ATOM 0 HB ILE A 384 1.775 15.673 -8.296 1.00 0.00 H new ATOM 0 HG12 ILE A 384 1.668 17.786 -7.123 1.00 0.00 H new ATOM 0 HG13 ILE A 384 0.899 17.926 -8.691 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -0.221 16.002 -9.724 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -0.236 14.419 -8.912 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -1.264 15.739 -8.306 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.397 19.090 -6.973 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -1.324 17.723 -7.634 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -0.543 17.581 -6.041 1.00 0.00 H new ATOM 224 N HIS A 385 2.963 14.405 -6.318 1.00 0.00 N ATOM 225 CA HIS A 385 4.022 13.400 -6.312 1.00 0.00 C ATOM 226 C HIS A 385 3.759 12.334 -5.251 1.00 0.00 C ATOM 227 O HIS A 385 3.860 11.137 -5.523 1.00 0.00 O ATOM 228 CB HIS A 385 5.379 14.062 -6.066 1.00 0.00 C ATOM 229 CG HIS A 385 6.365 13.834 -7.170 1.00 0.00 C ATOM 230 ND1 HIS A 385 7.212 12.752 -7.162 1.00 0.00 N ATOM 231 CD2 HIS A 385 6.598 14.571 -8.284 1.00 0.00 C ATOM 232 CE1 HIS A 385 7.936 12.852 -8.262 1.00 0.00 C ATOM 233 NE2 HIS A 385 7.600 13.938 -8.974 1.00 0.00 N ATOM 0 H HIS A 385 3.290 15.361 -6.179 1.00 0.00 H new ATOM 0 HA HIS A 385 4.034 12.915 -7.288 1.00 0.00 H new ATOM 0 HB2 HIS A 385 5.233 15.134 -5.936 1.00 0.00 H new ATOM 0 HB3 HIS A 385 5.796 13.682 -5.133 1.00 0.00 H new ATOM 0 HD2 HIS A 385 6.092 15.481 -8.572 1.00 0.00 H new ATOM 0 HE1 HIS A 385 8.702 12.148 -8.552 1.00 0.00 H new ATOM 0 HE2 HIS A 385 8.011 14.236 -9.859 1.00 0.00 H new ATOM 241 N VAL A 386 3.420 12.775 -4.044 1.00 0.00 N ATOM 242 CA VAL A 386 3.145 11.856 -2.947 1.00 0.00 C ATOM 243 C VAL A 386 1.835 11.106 -3.173 1.00 0.00 C ATOM 244 O VAL A 386 1.751 9.900 -2.941 1.00 0.00 O ATOM 245 CB VAL A 386 3.078 12.594 -1.595 1.00 0.00 C ATOM 246 CG1 VAL A 386 2.865 11.610 -0.454 1.00 0.00 C ATOM 247 CG2 VAL A 386 4.340 13.414 -1.371 1.00 0.00 C ATOM 0 H VAL A 386 3.329 13.762 -3.802 1.00 0.00 H new ATOM 0 HA VAL A 386 3.968 11.142 -2.919 1.00 0.00 H new ATOM 0 HB VAL A 386 2.227 13.275 -1.618 1.00 0.00 H new ATOM 0 HG11 VAL A 386 2.821 12.152 0.491 1.00 0.00 H new ATOM 0 HG12 VAL A 386 1.930 11.072 -0.608 1.00 0.00 H new ATOM 0 HG13 VAL A 386 3.692 10.900 -0.427 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.275 13.928 -0.412 1.00 0.00 H new ATOM 0 HG22 VAL A 386 5.207 12.754 -1.371 1.00 0.00 H new ATOM 0 HG23 VAL A 386 4.443 14.148 -2.170 1.00 0.00 H new ATOM 257 N LEU A 387 0.812 11.826 -3.626 1.00 0.00 N ATOM 258 CA LEU A 387 -0.490 11.220 -3.880 1.00 0.00 C ATOM 259 C LEU A 387 -0.397 10.189 -4.995 1.00 0.00 C ATOM 260 O LEU A 387 -1.013 9.127 -4.925 1.00 0.00 O ATOM 261 CB LEU A 387 -1.524 12.291 -4.232 1.00 0.00 C ATOM 262 CG LEU A 387 -2.981 11.888 -3.995 1.00 0.00 C ATOM 263 CD1 LEU A 387 -3.804 13.090 -3.560 1.00 0.00 C ATOM 264 CD2 LEU A 387 -3.570 11.262 -5.250 1.00 0.00 C ATOM 0 H LEU A 387 0.860 12.826 -3.824 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.811 10.714 -2.969 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.311 13.186 -3.647 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.403 12.560 -5.281 1.00 0.00 H new ATOM 0 HG LEU A 387 -3.008 11.148 -3.195 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -4.837 12.784 -3.396 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -3.395 13.495 -2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -3.771 13.854 -4.337 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -4.607 10.981 -5.064 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -3.530 11.981 -6.068 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -2.996 10.375 -5.518 1.00 0.00 H new ATOM 276 N GLU A 388 0.396 10.499 -6.011 1.00 0.00 N ATOM 277 CA GLU A 388 0.590 9.588 -7.127 1.00 0.00 C ATOM 278 C GLU A 388 1.238 8.302 -6.630 1.00 0.00 C ATOM 279 O GLU A 388 0.952 7.213 -7.126 1.00 0.00 O ATOM 280 CB GLU A 388 1.463 10.236 -8.204 1.00 0.00 C ATOM 281 CG GLU A 388 1.229 9.673 -9.597 1.00 0.00 C ATOM 282 CD GLU A 388 2.226 10.196 -10.612 1.00 0.00 C ATOM 283 OE1 GLU A 388 3.414 10.343 -10.254 1.00 0.00 O ATOM 284 OE2 GLU A 388 1.820 10.460 -11.763 1.00 0.00 O ATOM 0 H GLU A 388 0.915 11.374 -6.084 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.380 9.356 -7.566 1.00 0.00 H new ATOM 0 HB2 GLU A 388 1.272 11.309 -8.218 1.00 0.00 H new ATOM 0 HB3 GLU A 388 2.512 10.103 -7.939 1.00 0.00 H new ATOM 0 HG2 GLU A 388 1.290 8.585 -9.560 1.00 0.00 H new ATOM 0 HG3 GLU A 388 0.219 9.925 -9.922 1.00 0.00 H new ATOM 291 N LYS A 389 2.110 8.446 -5.636 1.00 0.00 N ATOM 292 CA LYS A 389 2.800 7.304 -5.054 1.00 0.00 C ATOM 293 C LYS A 389 1.804 6.371 -4.376 1.00 0.00 C ATOM 294 O LYS A 389 1.906 5.150 -4.484 1.00 0.00 O ATOM 295 CB LYS A 389 3.853 7.778 -4.048 1.00 0.00 C ATOM 296 CG LYS A 389 5.210 7.117 -4.232 1.00 0.00 C ATOM 297 CD LYS A 389 6.120 7.375 -3.042 1.00 0.00 C ATOM 298 CE LYS A 389 6.380 8.861 -2.846 1.00 0.00 C ATOM 299 NZ LYS A 389 6.031 9.308 -1.469 1.00 0.00 N ATOM 0 H LYS A 389 2.354 9.344 -5.218 1.00 0.00 H new ATOM 0 HA LYS A 389 3.300 6.756 -5.852 1.00 0.00 H new ATOM 0 HB2 LYS A 389 3.969 8.858 -4.138 1.00 0.00 H new ATOM 0 HB3 LYS A 389 3.495 7.578 -3.038 1.00 0.00 H new ATOM 0 HG2 LYS A 389 5.078 6.043 -4.365 1.00 0.00 H new ATOM 0 HG3 LYS A 389 5.680 7.495 -5.140 1.00 0.00 H new ATOM 0 HD2 LYS A 389 5.667 6.963 -2.141 1.00 0.00 H new ATOM 0 HD3 LYS A 389 7.067 6.856 -3.188 1.00 0.00 H new ATOM 0 HE2 LYS A 389 7.431 9.075 -3.042 1.00 0.00 H new ATOM 0 HE3 LYS A 389 5.798 9.430 -3.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 5.138 9.841 -1.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 5.923 8.478 -0.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 6.788 9.918 -1.100 1.00 0.00 H new ATOM 313 N VAL A 390 0.835 6.961 -3.683 1.00 0.00 N ATOM 314 CA VAL A 390 -0.190 6.188 -2.995 1.00 0.00 C ATOM 315 C VAL A 390 -0.994 5.358 -3.990 1.00 0.00 C ATOM 316 O VAL A 390 -1.366 4.219 -3.709 1.00 0.00 O ATOM 317 CB VAL A 390 -1.149 7.104 -2.209 1.00 0.00 C ATOM 318 CG1 VAL A 390 -2.186 6.282 -1.456 1.00 0.00 C ATOM 319 CG2 VAL A 390 -0.370 7.995 -1.253 1.00 0.00 C ATOM 0 H VAL A 390 0.739 7.972 -3.584 1.00 0.00 H new ATOM 0 HA VAL A 390 0.318 5.526 -2.294 1.00 0.00 H new ATOM 0 HB VAL A 390 -1.675 7.741 -2.921 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -2.852 6.949 -0.909 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -2.767 5.691 -2.165 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -1.683 5.616 -0.755 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -1.062 8.635 -0.706 1.00 0.00 H new ATOM 0 HG22 VAL A 390 0.185 7.375 -0.548 1.00 0.00 H new ATOM 0 HG23 VAL A 390 0.327 8.614 -1.818 1.00 0.00 H new ATOM 329 N GLN A 391 -1.252 5.940 -5.157 1.00 0.00 N ATOM 330 CA GLN A 391 -2.005 5.260 -6.200 1.00 0.00 C ATOM 331 C GLN A 391 -1.292 3.983 -6.635 1.00 0.00 C ATOM 332 O GLN A 391 -1.923 2.947 -6.848 1.00 0.00 O ATOM 333 CB GLN A 391 -2.194 6.194 -7.396 1.00 0.00 C ATOM 334 CG GLN A 391 -3.649 6.478 -7.725 1.00 0.00 C ATOM 335 CD GLN A 391 -3.809 7.595 -8.731 1.00 0.00 C ATOM 336 OE1 GLN A 391 -3.718 7.380 -9.940 1.00 0.00 O ATOM 337 NE2 GLN A 391 -4.049 8.800 -8.233 1.00 0.00 N ATOM 0 H GLN A 391 -0.949 6.883 -5.402 1.00 0.00 H new ATOM 0 HA GLN A 391 -2.982 4.986 -5.802 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -1.686 7.137 -7.193 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -1.713 5.754 -8.269 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -4.113 5.572 -8.116 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -4.181 6.739 -6.810 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -4.116 8.931 -7.224 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -4.167 9.596 -8.859 1.00 0.00 H new ATOM 346 N TYR A 392 0.029 4.065 -6.756 1.00 0.00 N ATOM 347 CA TYR A 392 0.832 2.916 -7.156 1.00 0.00 C ATOM 348 C TYR A 392 0.915 1.898 -6.024 1.00 0.00 C ATOM 349 O TYR A 392 0.768 0.696 -6.242 1.00 0.00 O ATOM 350 CB TYR A 392 2.238 3.366 -7.562 1.00 0.00 C ATOM 351 CG TYR A 392 2.453 3.402 -9.058 1.00 0.00 C ATOM 352 CD1 TYR A 392 1.544 4.038 -9.894 1.00 0.00 C ATOM 353 CD2 TYR A 392 3.565 2.800 -9.634 1.00 0.00 C ATOM 354 CE1 TYR A 392 1.737 4.073 -11.262 1.00 0.00 C ATOM 355 CE2 TYR A 392 3.765 2.832 -11.001 1.00 0.00 C ATOM 356 CZ TYR A 392 2.849 3.468 -11.811 1.00 0.00 C ATOM 357 OH TYR A 392 3.045 3.502 -13.172 1.00 0.00 O ATOM 0 H TYR A 392 0.566 4.915 -6.583 1.00 0.00 H new ATOM 0 HA TYR A 392 0.351 2.444 -8.013 1.00 0.00 H new ATOM 0 HB2 TYR A 392 2.425 4.359 -7.152 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.969 2.693 -7.114 1.00 0.00 H new ATOM 0 HD1 TYR A 392 0.672 4.513 -9.468 1.00 0.00 H new ATOM 0 HD2 TYR A 392 4.284 2.299 -9.003 1.00 0.00 H new ATOM 0 HE1 TYR A 392 1.021 4.572 -11.898 1.00 0.00 H new ATOM 0 HE2 TYR A 392 4.635 2.361 -11.433 1.00 0.00 H new ATOM 0 HH TYR A 392 3.875 3.031 -13.395 1.00 0.00 H new ATOM 367 N LEU A 393 1.151 2.391 -4.812 1.00 0.00 N ATOM 368 CA LEU A 393 1.253 1.529 -3.641 1.00 0.00 C ATOM 369 C LEU A 393 -0.034 0.734 -3.441 1.00 0.00 C ATOM 370 O LEU A 393 0.003 -0.459 -3.138 1.00 0.00 O ATOM 371 CB LEU A 393 1.553 2.364 -2.393 1.00 0.00 C ATOM 372 CG LEU A 393 3.029 2.424 -1.996 1.00 0.00 C ATOM 373 CD1 LEU A 393 3.515 1.057 -1.541 1.00 0.00 C ATOM 374 CD2 LEU A 393 3.873 2.933 -3.155 1.00 0.00 C ATOM 0 H LEU A 393 1.275 3.384 -4.616 1.00 0.00 H new ATOM 0 HA LEU A 393 2.071 0.827 -3.804 1.00 0.00 H new ATOM 0 HB2 LEU A 393 1.195 3.380 -2.559 1.00 0.00 H new ATOM 0 HB3 LEU A 393 0.983 1.958 -1.557 1.00 0.00 H new ATOM 0 HG LEU A 393 3.133 3.120 -1.164 1.00 0.00 H new ATOM 0 HD11 LEU A 393 4.567 1.119 -1.263 1.00 0.00 H new ATOM 0 HD12 LEU A 393 2.931 0.731 -0.681 1.00 0.00 H new ATOM 0 HD13 LEU A 393 3.396 0.340 -2.353 1.00 0.00 H new ATOM 0 HD21 LEU A 393 4.920 2.969 -2.854 1.00 0.00 H new ATOM 0 HD22 LEU A 393 3.763 2.262 -4.007 1.00 0.00 H new ATOM 0 HD23 LEU A 393 3.541 3.933 -3.435 1.00 0.00 H new ATOM 386 N GLU A 394 -1.168 1.402 -3.615 1.00 0.00 N ATOM 387 CA GLU A 394 -2.467 0.759 -3.454 1.00 0.00 C ATOM 388 C GLU A 394 -2.624 -0.397 -4.438 1.00 0.00 C ATOM 389 O GLU A 394 -3.088 -1.476 -4.072 1.00 0.00 O ATOM 390 CB GLU A 394 -3.592 1.775 -3.661 1.00 0.00 C ATOM 391 CG GLU A 394 -4.971 1.232 -3.322 1.00 0.00 C ATOM 392 CD GLU A 394 -5.969 2.331 -3.011 1.00 0.00 C ATOM 393 OE1 GLU A 394 -6.262 3.139 -3.917 1.00 0.00 O ATOM 394 OE2 GLU A 394 -6.456 2.384 -1.863 1.00 0.00 O ATOM 0 H GLU A 394 -1.215 2.389 -3.868 1.00 0.00 H new ATOM 0 HA GLU A 394 -2.527 0.363 -2.440 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -3.395 2.653 -3.046 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -3.586 2.105 -4.700 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -5.339 0.638 -4.158 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -4.894 0.563 -2.465 1.00 0.00 H new ATOM 401 N GLN A 395 -2.233 -0.162 -5.686 1.00 0.00 N ATOM 402 CA GLN A 395 -2.330 -1.184 -6.721 1.00 0.00 C ATOM 403 C GLN A 395 -1.493 -2.407 -6.362 1.00 0.00 C ATOM 404 O GLN A 395 -1.872 -3.540 -6.656 1.00 0.00 O ATOM 405 CB GLN A 395 -1.877 -0.618 -8.068 1.00 0.00 C ATOM 406 CG GLN A 395 -2.398 -1.400 -9.264 1.00 0.00 C ATOM 407 CD GLN A 395 -1.285 -1.898 -10.166 1.00 0.00 C ATOM 408 OE1 GLN A 395 -1.260 -1.601 -11.361 1.00 0.00 O ATOM 409 NE2 GLN A 395 -0.358 -2.659 -9.597 1.00 0.00 N ATOM 0 H GLN A 395 -1.846 0.726 -6.005 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.373 -1.492 -6.795 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -2.210 0.417 -8.148 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -0.788 -0.606 -8.099 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -2.982 -2.250 -8.911 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -3.072 -0.767 -9.841 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -0.419 -2.880 -8.603 1.00 0.00 H new ATOM 0 HE22 GLN A 395 0.415 -3.023 -10.154 1.00 0.00 H new ATOM 418 N GLU A 396 -0.348 -2.170 -5.729 1.00 0.00 N ATOM 419 CA GLU A 396 0.547 -3.252 -5.333 1.00 0.00 C ATOM 420 C GLU A 396 -0.062 -4.091 -4.213 1.00 0.00 C ATOM 421 O GLU A 396 -0.017 -5.319 -4.254 1.00 0.00 O ATOM 422 CB GLU A 396 1.897 -2.687 -4.889 1.00 0.00 C ATOM 423 CG GLU A 396 3.089 -3.461 -5.430 1.00 0.00 C ATOM 424 CD GLU A 396 4.095 -3.813 -4.351 1.00 0.00 C ATOM 425 OE1 GLU A 396 4.471 -2.912 -3.573 1.00 0.00 O ATOM 426 OE2 GLU A 396 4.507 -4.990 -4.285 1.00 0.00 O ATOM 0 H GLU A 396 -0.018 -1.238 -5.479 1.00 0.00 H new ATOM 0 HA GLU A 396 0.696 -3.897 -6.199 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.971 -1.649 -5.213 1.00 0.00 H new ATOM 0 HB3 GLU A 396 1.940 -2.685 -3.800 1.00 0.00 H new ATOM 0 HG2 GLU A 396 2.737 -4.376 -5.906 1.00 0.00 H new ATOM 0 HG3 GLU A 396 3.582 -2.869 -6.202 1.00 0.00 H new ATOM 433 N VAL A 397 -0.626 -3.422 -3.211 1.00 0.00 N ATOM 434 CA VAL A 397 -1.238 -4.115 -2.084 1.00 0.00 C ATOM 435 C VAL A 397 -2.385 -5.007 -2.549 1.00 0.00 C ATOM 436 O VAL A 397 -2.553 -6.123 -2.058 1.00 0.00 O ATOM 437 CB VAL A 397 -1.767 -3.122 -1.030 1.00 0.00 C ATOM 438 CG1 VAL A 397 -2.183 -3.857 0.240 1.00 0.00 C ATOM 439 CG2 VAL A 397 -0.720 -2.059 -0.726 1.00 0.00 C ATOM 0 H VAL A 397 -0.671 -2.404 -3.157 1.00 0.00 H new ATOM 0 HA VAL A 397 -0.461 -4.730 -1.630 1.00 0.00 H new ATOM 0 HB VAL A 397 -2.648 -2.625 -1.435 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -2.553 -3.139 0.971 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -2.970 -4.574 0.004 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.323 -4.385 0.653 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -1.110 -1.367 0.020 1.00 0.00 H new ATOM 0 HG22 VAL A 397 0.182 -2.536 -0.342 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.481 -1.513 -1.638 1.00 0.00 H new ATOM 449 N GLU A 398 -3.166 -4.512 -3.506 1.00 0.00 N ATOM 450 CA GLU A 398 -4.289 -5.274 -4.044 1.00 0.00 C ATOM 451 C GLU A 398 -3.802 -6.596 -4.625 1.00 0.00 C ATOM 452 O GLU A 398 -4.451 -7.632 -4.476 1.00 0.00 O ATOM 453 CB GLU A 398 -5.016 -4.464 -5.119 1.00 0.00 C ATOM 454 CG GLU A 398 -6.466 -4.874 -5.315 1.00 0.00 C ATOM 455 CD GLU A 398 -6.644 -5.866 -6.448 1.00 0.00 C ATOM 456 OE1 GLU A 398 -5.789 -5.886 -7.358 1.00 0.00 O ATOM 457 OE2 GLU A 398 -7.637 -6.622 -6.425 1.00 0.00 O ATOM 0 H GLU A 398 -3.042 -3.590 -3.924 1.00 0.00 H new ATOM 0 HA GLU A 398 -4.985 -5.483 -3.232 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -4.979 -3.408 -4.853 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -4.485 -4.573 -6.065 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -6.844 -5.312 -4.391 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -7.066 -3.987 -5.516 1.00 0.00 H new ATOM 464 N GLU A 399 -2.647 -6.548 -5.279 1.00 0.00 N ATOM 465 CA GLU A 399 -2.051 -7.735 -5.878 1.00 0.00 C ATOM 466 C GLU A 399 -1.322 -8.553 -4.820 1.00 0.00 C ATOM 467 O GLU A 399 -1.578 -9.744 -4.652 1.00 0.00 O ATOM 468 CB GLU A 399 -1.069 -7.331 -6.978 1.00 0.00 C ATOM 469 CG GLU A 399 -0.805 -8.430 -7.992 1.00 0.00 C ATOM 470 CD GLU A 399 0.117 -7.984 -9.109 1.00 0.00 C ATOM 471 OE1 GLU A 399 -0.378 -7.364 -10.075 1.00 0.00 O ATOM 472 OE2 GLU A 399 1.333 -8.253 -9.020 1.00 0.00 O ATOM 0 H GLU A 399 -2.103 -5.695 -5.408 1.00 0.00 H new ATOM 0 HA GLU A 399 -2.847 -8.341 -6.310 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -1.458 -6.455 -7.497 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -0.125 -7.036 -6.520 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -0.366 -9.289 -7.485 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -1.752 -8.761 -8.418 1.00 0.00 H new ATOM 479 N PHE A 400 -0.411 -7.881 -4.120 1.00 0.00 N ATOM 480 CA PHE A 400 0.399 -8.481 -3.060 1.00 0.00 C ATOM 481 C PHE A 400 -0.212 -9.745 -2.475 1.00 0.00 C ATOM 482 O PHE A 400 -1.275 -9.712 -1.856 1.00 0.00 O ATOM 483 CB PHE A 400 0.603 -7.468 -1.939 1.00 0.00 C ATOM 484 CG PHE A 400 1.606 -7.891 -0.915 1.00 0.00 C ATOM 485 CD1 PHE A 400 2.932 -8.051 -1.266 1.00 0.00 C ATOM 486 CD2 PHE A 400 1.228 -8.114 0.396 1.00 0.00 C ATOM 487 CE1 PHE A 400 3.870 -8.429 -0.325 1.00 0.00 C ATOM 488 CE2 PHE A 400 2.158 -8.491 1.344 1.00 0.00 C ATOM 489 CZ PHE A 400 3.483 -8.649 0.984 1.00 0.00 C ATOM 0 H PHE A 400 -0.211 -6.893 -4.274 1.00 0.00 H new ATOM 0 HA PHE A 400 1.348 -8.762 -3.517 1.00 0.00 H new ATOM 0 HB2 PHE A 400 0.919 -6.520 -2.373 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -0.352 -7.290 -1.445 1.00 0.00 H new ATOM 0 HD1 PHE A 400 3.239 -7.879 -2.287 1.00 0.00 H new ATOM 0 HD2 PHE A 400 0.194 -7.992 0.682 1.00 0.00 H new ATOM 0 HE1 PHE A 400 4.904 -8.552 -0.611 1.00 0.00 H new ATOM 0 HE2 PHE A 400 1.851 -8.662 2.365 1.00 0.00 H new ATOM 0 HZ PHE A 400 4.214 -8.943 1.723 1.00 0.00 H new ATOM 499 N VAL A 401 0.496 -10.846 -2.647 1.00 0.00 N ATOM 500 CA VAL A 401 0.068 -12.122 -2.109 1.00 0.00 C ATOM 501 C VAL A 401 1.012 -12.535 -0.991 1.00 0.00 C ATOM 502 O VAL A 401 1.199 -13.721 -0.723 1.00 0.00 O ATOM 503 CB VAL A 401 0.045 -13.219 -3.190 1.00 0.00 C ATOM 504 CG1 VAL A 401 -1.024 -12.922 -4.230 1.00 0.00 C ATOM 505 CG2 VAL A 401 1.412 -13.353 -3.842 1.00 0.00 C ATOM 0 H VAL A 401 1.377 -10.881 -3.160 1.00 0.00 H new ATOM 0 HA VAL A 401 -0.947 -12.005 -1.729 1.00 0.00 H new ATOM 0 HB VAL A 401 -0.200 -14.169 -2.714 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -1.025 -13.708 -4.985 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -2.000 -12.882 -3.747 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -0.814 -11.963 -4.704 1.00 0.00 H new ATOM 0 HG21 VAL A 401 1.377 -14.132 -4.603 1.00 0.00 H new ATOM 0 HG22 VAL A 401 1.689 -12.406 -4.305 1.00 0.00 H new ATOM 0 HG23 VAL A 401 2.151 -13.617 -3.086 1.00 0.00 H new ATOM 515 N GLY A 402 1.623 -11.535 -0.348 1.00 0.00 N ATOM 516 CA GLY A 402 2.556 -11.802 0.718 1.00 0.00 C ATOM 517 C GLY A 402 1.980 -12.663 1.814 1.00 0.00 C ATOM 518 O GLY A 402 0.871 -13.186 1.704 1.00 0.00 O ATOM 0 H GLY A 402 1.481 -10.546 -0.554 1.00 0.00 H new ATOM 0 HA2 GLY A 402 3.437 -12.293 0.305 1.00 0.00 H new ATOM 0 HA3 GLY A 402 2.889 -10.856 1.146 1.00 0.00 H new ATOM 522 N LYS A 403 2.755 -12.803 2.872 1.00 0.00 N ATOM 523 CA LYS A 403 2.352 -13.607 4.027 1.00 0.00 C ATOM 524 C LYS A 403 2.621 -12.869 5.335 1.00 0.00 C ATOM 525 O LYS A 403 3.618 -12.166 5.465 1.00 0.00 O ATOM 526 CB LYS A 403 3.084 -14.950 4.026 1.00 0.00 C ATOM 527 CG LYS A 403 2.486 -15.968 3.068 1.00 0.00 C ATOM 528 CD LYS A 403 2.911 -15.700 1.632 1.00 0.00 C ATOM 529 CE LYS A 403 3.913 -16.735 1.142 1.00 0.00 C ATOM 530 NZ LYS A 403 4.545 -16.331 -0.144 1.00 0.00 N ATOM 0 H LYS A 403 3.674 -12.370 2.963 1.00 0.00 H new ATOM 0 HA LYS A 403 1.280 -13.786 3.949 1.00 0.00 H new ATOM 0 HB2 LYS A 403 4.129 -14.785 3.762 1.00 0.00 H new ATOM 0 HB3 LYS A 403 3.072 -15.362 5.035 1.00 0.00 H new ATOM 0 HG2 LYS A 403 2.798 -16.971 3.360 1.00 0.00 H new ATOM 0 HG3 LYS A 403 1.399 -15.940 3.138 1.00 0.00 H new ATOM 0 HD2 LYS A 403 2.034 -15.707 0.985 1.00 0.00 H new ATOM 0 HD3 LYS A 403 3.351 -14.705 1.562 1.00 0.00 H new ATOM 0 HE2 LYS A 403 4.686 -16.878 1.897 1.00 0.00 H new ATOM 0 HE3 LYS A 403 3.411 -17.694 1.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 5.221 -17.063 -0.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 3.811 -16.219 -0.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 5.046 -15.429 -0.016 1.00 0.00 H new ATOM 544 N LYS A 404 1.733 -13.047 6.310 1.00 0.00 N ATOM 545 CA LYS A 404 1.883 -12.400 7.612 1.00 0.00 C ATOM 546 C LYS A 404 3.265 -12.662 8.213 1.00 0.00 C ATOM 547 O LYS A 404 3.768 -11.860 9.001 1.00 0.00 O ATOM 548 CB LYS A 404 0.799 -12.893 8.575 1.00 0.00 C ATOM 549 CG LYS A 404 0.080 -11.772 9.308 1.00 0.00 C ATOM 550 CD LYS A 404 -0.244 -12.164 10.742 1.00 0.00 C ATOM 551 CE LYS A 404 0.028 -11.022 11.708 1.00 0.00 C ATOM 552 NZ LYS A 404 -0.836 -9.842 11.433 1.00 0.00 N ATOM 0 H LYS A 404 0.903 -13.633 6.224 1.00 0.00 H new ATOM 0 HA LYS A 404 1.776 -11.326 7.462 1.00 0.00 H new ATOM 0 HB2 LYS A 404 0.068 -13.478 8.017 1.00 0.00 H new ATOM 0 HB3 LYS A 404 1.252 -13.562 9.307 1.00 0.00 H new ATOM 0 HG2 LYS A 404 0.701 -10.877 9.306 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -0.841 -11.522 8.781 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -1.291 -12.459 10.812 1.00 0.00 H new ATOM 0 HD3 LYS A 404 0.351 -13.032 11.026 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -0.139 -11.364 12.730 1.00 0.00 H new ATOM 0 HE3 LYS A 404 1.075 -10.729 11.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -0.917 -9.263 12.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -0.414 -9.273 10.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -1.781 -10.164 11.142 1.00 0.00 H new ATOM 566 N THR A 405 3.869 -13.787 7.844 1.00 0.00 N ATOM 567 CA THR A 405 5.189 -14.147 8.358 1.00 0.00 C ATOM 568 C THR A 405 6.270 -13.989 7.291 1.00 0.00 C ATOM 569 O THR A 405 7.404 -14.427 7.479 1.00 0.00 O ATOM 570 CB THR A 405 5.178 -15.585 8.882 1.00 0.00 C ATOM 571 OG1 THR A 405 4.140 -16.332 8.274 1.00 0.00 O ATOM 572 CG2 THR A 405 4.986 -15.674 10.382 1.00 0.00 C ATOM 0 H THR A 405 3.469 -14.464 7.194 1.00 0.00 H new ATOM 0 HA THR A 405 5.423 -13.466 9.176 1.00 0.00 H new ATOM 0 HB THR A 405 6.158 -15.991 8.631 1.00 0.00 H new ATOM 0 HG1 THR A 405 4.150 -17.249 8.621 1.00 0.00 H new ATOM 0 HG21 THR A 405 4.988 -16.720 10.688 1.00 0.00 H new ATOM 0 HG22 THR A 405 5.798 -15.148 10.885 1.00 0.00 H new ATOM 0 HG23 THR A 405 4.034 -15.218 10.655 1.00 0.00 H new ATOM 580 N ASP A 406 5.921 -13.350 6.178 1.00 0.00 N ATOM 581 CA ASP A 406 6.875 -13.129 5.101 1.00 0.00 C ATOM 582 C ASP A 406 7.545 -11.772 5.263 1.00 0.00 C ATOM 583 O ASP A 406 6.908 -10.801 5.672 1.00 0.00 O ATOM 584 CB ASP A 406 6.178 -13.211 3.741 1.00 0.00 C ATOM 585 CG ASP A 406 6.464 -14.514 3.022 1.00 0.00 C ATOM 586 OD1 ASP A 406 6.503 -15.568 3.692 1.00 0.00 O ATOM 587 OD2 ASP A 406 6.649 -14.482 1.787 1.00 0.00 O ATOM 0 H ASP A 406 4.988 -12.978 6.001 1.00 0.00 H new ATOM 0 HA ASP A 406 7.636 -13.908 5.149 1.00 0.00 H new ATOM 0 HB2 ASP A 406 5.102 -13.105 3.880 1.00 0.00 H new ATOM 0 HB3 ASP A 406 6.503 -12.377 3.119 1.00 0.00 H new ATOM 592 N LYS A 407 8.830 -11.704 4.942 1.00 0.00 N ATOM 593 CA LYS A 407 9.571 -10.456 5.060 1.00 0.00 C ATOM 594 C LYS A 407 8.971 -9.389 4.160 1.00 0.00 C ATOM 595 O LYS A 407 9.022 -8.198 4.468 1.00 0.00 O ATOM 596 CB LYS A 407 11.046 -10.673 4.715 1.00 0.00 C ATOM 597 CG LYS A 407 11.264 -11.324 3.360 1.00 0.00 C ATOM 598 CD LYS A 407 11.460 -10.285 2.270 1.00 0.00 C ATOM 599 CE LYS A 407 12.032 -10.904 1.006 1.00 0.00 C ATOM 600 NZ LYS A 407 13.503 -10.694 0.900 1.00 0.00 N ATOM 0 H LYS A 407 9.378 -12.493 4.600 1.00 0.00 H new ATOM 0 HA LYS A 407 9.502 -10.115 6.093 1.00 0.00 H new ATOM 0 HB2 LYS A 407 11.560 -9.712 4.734 1.00 0.00 H new ATOM 0 HB3 LYS A 407 11.503 -11.294 5.485 1.00 0.00 H new ATOM 0 HG2 LYS A 407 12.136 -11.976 3.404 1.00 0.00 H new ATOM 0 HG3 LYS A 407 10.408 -11.953 3.115 1.00 0.00 H new ATOM 0 HD2 LYS A 407 10.506 -9.809 2.044 1.00 0.00 H new ATOM 0 HD3 LYS A 407 12.129 -9.503 2.628 1.00 0.00 H new ATOM 0 HE2 LYS A 407 11.816 -11.972 0.996 1.00 0.00 H new ATOM 0 HE3 LYS A 407 11.540 -10.471 0.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 13.854 -11.131 0.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 13.708 -9.675 0.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 13.976 -11.129 1.718 1.00 0.00 H new ATOM 614 N ALA A 408 8.393 -9.824 3.053 1.00 0.00 N ATOM 615 CA ALA A 408 7.769 -8.912 2.113 1.00 0.00 C ATOM 616 C ALA A 408 6.522 -8.278 2.719 1.00 0.00 C ATOM 617 O ALA A 408 6.143 -7.167 2.356 1.00 0.00 O ATOM 618 CB ALA A 408 7.427 -9.638 0.819 1.00 0.00 C ATOM 0 H ALA A 408 8.344 -10.807 2.784 1.00 0.00 H new ATOM 0 HA ALA A 408 8.477 -8.115 1.887 1.00 0.00 H new ATOM 0 HB1 ALA A 408 6.959 -8.941 0.123 1.00 0.00 H new ATOM 0 HB2 ALA A 408 8.338 -10.038 0.374 1.00 0.00 H new ATOM 0 HB3 ALA A 408 6.738 -10.455 1.032 1.00 0.00 H new ATOM 624 N TYR A 409 5.869 -9.005 3.627 1.00 0.00 N ATOM 625 CA TYR A 409 4.645 -8.516 4.254 1.00 0.00 C ATOM 626 C TYR A 409 4.893 -7.300 5.145 1.00 0.00 C ATOM 627 O TYR A 409 4.153 -6.320 5.057 1.00 0.00 O ATOM 628 CB TYR A 409 3.989 -9.642 5.057 1.00 0.00 C ATOM 629 CG TYR A 409 3.123 -9.175 6.207 1.00 0.00 C ATOM 630 CD1 TYR A 409 3.682 -8.872 7.442 1.00 0.00 C ATOM 631 CD2 TYR A 409 1.749 -9.040 6.058 1.00 0.00 C ATOM 632 CE1 TYR A 409 2.896 -8.449 8.497 1.00 0.00 C ATOM 633 CE2 TYR A 409 0.955 -8.616 7.107 1.00 0.00 C ATOM 634 CZ TYR A 409 1.533 -8.322 8.324 1.00 0.00 C ATOM 635 OH TYR A 409 0.746 -7.901 9.372 1.00 0.00 O ATOM 0 H TYR A 409 6.167 -9.928 3.942 1.00 0.00 H new ATOM 0 HA TYR A 409 3.973 -8.194 3.458 1.00 0.00 H new ATOM 0 HB2 TYR A 409 3.380 -10.244 4.383 1.00 0.00 H new ATOM 0 HB3 TYR A 409 4.770 -10.293 5.449 1.00 0.00 H new ATOM 0 HD1 TYR A 409 4.749 -8.969 7.580 1.00 0.00 H new ATOM 0 HD2 TYR A 409 1.293 -9.270 5.106 1.00 0.00 H new ATOM 0 HE1 TYR A 409 3.346 -8.219 9.451 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.112 -8.516 6.974 1.00 0.00 H new ATOM 0 HH TYR A 409 -0.190 -7.864 9.084 1.00 0.00 H new ATOM 645 N TRP A 410 5.932 -7.327 5.981 1.00 0.00 N ATOM 646 CA TRP A 410 6.199 -6.164 6.814 1.00 0.00 C ATOM 647 C TRP A 410 6.756 -5.048 5.947 1.00 0.00 C ATOM 648 O TRP A 410 6.514 -3.871 6.201 1.00 0.00 O ATOM 649 CB TRP A 410 7.109 -6.459 8.018 1.00 0.00 C ATOM 650 CG TRP A 410 8.233 -7.415 7.793 1.00 0.00 C ATOM 651 CD1 TRP A 410 8.260 -8.730 8.150 1.00 0.00 C ATOM 652 CD2 TRP A 410 9.512 -7.121 7.223 1.00 0.00 C ATOM 653 NE1 TRP A 410 9.474 -9.278 7.835 1.00 0.00 N ATOM 654 CE2 TRP A 410 10.261 -8.312 7.255 1.00 0.00 C ATOM 655 CE3 TRP A 410 10.092 -5.972 6.680 1.00 0.00 C ATOM 656 CZ2 TRP A 410 11.563 -8.384 6.769 1.00 0.00 C ATOM 657 CZ3 TRP A 410 11.386 -6.046 6.197 1.00 0.00 C ATOM 658 CH2 TRP A 410 12.108 -7.245 6.243 1.00 0.00 C ATOM 0 H TRP A 410 6.577 -8.109 6.095 1.00 0.00 H new ATOM 0 HA TRP A 410 5.252 -5.851 7.254 1.00 0.00 H new ATOM 0 HB2 TRP A 410 7.530 -5.515 8.365 1.00 0.00 H new ATOM 0 HB3 TRP A 410 6.489 -6.848 8.826 1.00 0.00 H new ATOM 0 HD1 TRP A 410 7.443 -9.262 8.614 1.00 0.00 H new ATOM 0 HE1 TRP A 410 9.750 -10.246 8.003 1.00 0.00 H new ATOM 0 HE3 TRP A 410 9.541 -5.044 6.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 12.123 -9.307 6.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 11.847 -5.164 5.777 1.00 0.00 H new ATOM 0 HH2 TRP A 410 13.116 -7.271 5.855 1.00 0.00 H new ATOM 669 N LEU A 411 7.464 -5.444 4.891 1.00 0.00 N ATOM 670 CA LEU A 411 8.022 -4.511 3.933 1.00 0.00 C ATOM 671 C LEU A 411 6.892 -3.881 3.126 1.00 0.00 C ATOM 672 O LEU A 411 6.924 -2.687 2.824 1.00 0.00 O ATOM 673 CB LEU A 411 9.000 -5.233 3.002 1.00 0.00 C ATOM 674 CG LEU A 411 9.489 -4.410 1.810 1.00 0.00 C ATOM 675 CD1 LEU A 411 10.463 -3.334 2.265 1.00 0.00 C ATOM 676 CD2 LEU A 411 10.136 -5.312 0.769 1.00 0.00 C ATOM 0 H LEU A 411 7.663 -6.422 4.682 1.00 0.00 H new ATOM 0 HA LEU A 411 8.565 -3.729 4.463 1.00 0.00 H new ATOM 0 HB2 LEU A 411 9.865 -5.550 3.584 1.00 0.00 H new ATOM 0 HB3 LEU A 411 8.520 -6.137 2.627 1.00 0.00 H new ATOM 0 HG LEU A 411 8.628 -3.921 1.354 1.00 0.00 H new ATOM 0 HD11 LEU A 411 10.799 -2.759 1.402 1.00 0.00 H new ATOM 0 HD12 LEU A 411 9.967 -2.670 2.972 1.00 0.00 H new ATOM 0 HD13 LEU A 411 11.322 -3.801 2.747 1.00 0.00 H new ATOM 0 HD21 LEU A 411 10.478 -4.709 -0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 411 10.986 -5.830 1.214 1.00 0.00 H new ATOM 0 HD23 LEU A 411 9.408 -6.044 0.419 1.00 0.00 H new ATOM 688 N LEU A 412 5.878 -4.690 2.792 1.00 0.00 N ATOM 689 CA LEU A 412 4.734 -4.192 2.038 1.00 0.00 C ATOM 690 C LEU A 412 4.014 -3.134 2.861 1.00 0.00 C ATOM 691 O LEU A 412 3.710 -2.044 2.377 1.00 0.00 O ATOM 692 CB LEU A 412 3.769 -5.327 1.691 1.00 0.00 C ATOM 693 CG LEU A 412 2.946 -5.101 0.421 1.00 0.00 C ATOM 694 CD1 LEU A 412 2.254 -3.747 0.463 1.00 0.00 C ATOM 695 CD2 LEU A 412 3.830 -5.211 -0.812 1.00 0.00 C ATOM 0 H LEU A 412 5.831 -5.680 3.032 1.00 0.00 H new ATOM 0 HA LEU A 412 5.092 -3.756 1.105 1.00 0.00 H new ATOM 0 HB2 LEU A 412 4.339 -6.249 1.579 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.087 -5.474 2.528 1.00 0.00 H new ATOM 0 HG LEU A 412 2.180 -5.874 0.367 1.00 0.00 H new ATOM 0 HD11 LEU A 412 1.674 -3.606 -0.449 1.00 0.00 H new ATOM 0 HD12 LEU A 412 1.589 -3.705 1.326 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.002 -2.958 0.543 1.00 0.00 H new ATOM 0 HD21 LEU A 412 3.229 -5.048 -1.706 1.00 0.00 H new ATOM 0 HD22 LEU A 412 4.618 -4.460 -0.763 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.277 -6.204 -0.852 1.00 0.00 H new ATOM 707 N GLU A 413 3.784 -3.461 4.127 1.00 0.00 N ATOM 708 CA GLU A 413 3.147 -2.543 5.058 1.00 0.00 C ATOM 709 C GLU A 413 4.105 -1.402 5.378 1.00 0.00 C ATOM 710 O GLU A 413 3.693 -0.272 5.636 1.00 0.00 O ATOM 711 CB GLU A 413 2.741 -3.271 6.341 1.00 0.00 C ATOM 712 CG GLU A 413 1.397 -2.826 6.893 1.00 0.00 C ATOM 713 CD GLU A 413 1.459 -2.465 8.365 1.00 0.00 C ATOM 714 OE1 GLU A 413 1.965 -1.369 8.686 1.00 0.00 O ATOM 715 OE2 GLU A 413 1.002 -3.278 9.196 1.00 0.00 O ATOM 0 H GLU A 413 4.032 -4.363 4.533 1.00 0.00 H new ATOM 0 HA GLU A 413 2.245 -2.140 4.598 1.00 0.00 H new ATOM 0 HB2 GLU A 413 2.707 -4.343 6.146 1.00 0.00 H new ATOM 0 HB3 GLU A 413 3.507 -3.109 7.099 1.00 0.00 H new ATOM 0 HG2 GLU A 413 1.043 -1.965 6.326 1.00 0.00 H new ATOM 0 HG3 GLU A 413 0.668 -3.623 6.749 1.00 0.00 H new ATOM 722 N GLU A 414 5.392 -1.728 5.370 1.00 0.00 N ATOM 723 CA GLU A 414 6.441 -0.767 5.668 1.00 0.00 C ATOM 724 C GLU A 414 6.483 0.356 4.631 1.00 0.00 C ATOM 725 O GLU A 414 6.661 1.523 4.981 1.00 0.00 O ATOM 726 CB GLU A 414 7.797 -1.483 5.721 1.00 0.00 C ATOM 727 CG GLU A 414 8.385 -1.564 7.120 1.00 0.00 C ATOM 728 CD GLU A 414 9.524 -0.586 7.331 1.00 0.00 C ATOM 729 OE1 GLU A 414 10.421 -0.521 6.464 1.00 0.00 O ATOM 730 OE2 GLU A 414 9.521 0.116 8.365 1.00 0.00 O ATOM 0 H GLU A 414 5.735 -2.665 5.157 1.00 0.00 H new ATOM 0 HA GLU A 414 6.225 -0.318 6.637 1.00 0.00 H new ATOM 0 HB2 GLU A 414 7.682 -2.492 5.325 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.499 -0.963 5.070 1.00 0.00 H new ATOM 0 HG2 GLU A 414 7.601 -1.367 7.851 1.00 0.00 H new ATOM 0 HG3 GLU A 414 8.743 -2.577 7.302 1.00 0.00 H new ATOM 737 N MET A 415 6.325 0.003 3.358 1.00 0.00 N ATOM 738 CA MET A 415 6.356 0.998 2.290 1.00 0.00 C ATOM 739 C MET A 415 5.125 1.904 2.334 1.00 0.00 C ATOM 740 O MET A 415 5.239 3.125 2.210 1.00 0.00 O ATOM 741 CB MET A 415 6.463 0.318 0.921 1.00 0.00 C ATOM 742 CG MET A 415 5.434 -0.777 0.693 1.00 0.00 C ATOM 743 SD MET A 415 5.477 -1.429 -0.988 1.00 0.00 S ATOM 744 CE MET A 415 6.970 -2.417 -0.931 1.00 0.00 C ATOM 0 H MET A 415 6.176 -0.955 3.043 1.00 0.00 H new ATOM 0 HA MET A 415 7.238 1.619 2.445 1.00 0.00 H new ATOM 0 HB2 MET A 415 6.354 1.073 0.142 1.00 0.00 H new ATOM 0 HB3 MET A 415 7.461 -0.107 0.815 1.00 0.00 H new ATOM 0 HG2 MET A 415 5.610 -1.589 1.398 1.00 0.00 H new ATOM 0 HG3 MET A 415 4.439 -0.384 0.901 1.00 0.00 H new ATOM 0 HE1 MET A 415 7.665 -2.070 -1.695 1.00 0.00 H new ATOM 0 HE2 MET A 415 7.433 -2.321 0.051 1.00 0.00 H new ATOM 0 HE3 MET A 415 6.722 -3.462 -1.114 1.00 0.00 H new ATOM 754 N LEU A 416 3.948 1.311 2.524 1.00 0.00 N ATOM 755 CA LEU A 416 2.718 2.092 2.590 1.00 0.00 C ATOM 756 C LEU A 416 2.721 2.975 3.830 1.00 0.00 C ATOM 757 O LEU A 416 2.258 4.115 3.795 1.00 0.00 O ATOM 758 CB LEU A 416 1.484 1.184 2.580 1.00 0.00 C ATOM 759 CG LEU A 416 1.445 0.110 3.665 1.00 0.00 C ATOM 760 CD1 LEU A 416 0.919 0.686 4.973 1.00 0.00 C ATOM 761 CD2 LEU A 416 0.586 -1.063 3.213 1.00 0.00 C ATOM 0 H LEU A 416 3.822 0.305 2.634 1.00 0.00 H new ATOM 0 HA LEU A 416 2.672 2.727 1.706 1.00 0.00 H new ATOM 0 HB2 LEU A 416 0.596 1.808 2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 416 1.423 0.695 1.608 1.00 0.00 H new ATOM 0 HG LEU A 416 2.461 -0.247 3.836 1.00 0.00 H new ATOM 0 HD11 LEU A 416 0.899 -0.095 5.733 1.00 0.00 H new ATOM 0 HD12 LEU A 416 1.570 1.496 5.302 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -0.090 1.071 4.822 1.00 0.00 H new ATOM 0 HD21 LEU A 416 0.566 -1.822 3.995 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.429 -0.717 3.017 1.00 0.00 H new ATOM 0 HD23 LEU A 416 1.005 -1.491 2.302 1.00 0.00 H new ATOM 773 N THR A 417 3.264 2.447 4.922 1.00 0.00 N ATOM 774 CA THR A 417 3.346 3.195 6.168 1.00 0.00 C ATOM 775 C THR A 417 4.224 4.429 5.985 1.00 0.00 C ATOM 776 O THR A 417 4.021 5.452 6.637 1.00 0.00 O ATOM 777 CB THR A 417 3.905 2.311 7.288 1.00 0.00 C ATOM 778 OG1 THR A 417 3.057 1.200 7.517 1.00 0.00 O ATOM 779 CG2 THR A 417 4.069 3.040 8.604 1.00 0.00 C ATOM 0 H THR A 417 3.653 1.505 4.968 1.00 0.00 H new ATOM 0 HA THR A 417 2.342 3.515 6.446 1.00 0.00 H new ATOM 0 HB THR A 417 4.889 1.995 6.942 1.00 0.00 H new ATOM 0 HG1 THR A 417 3.482 0.387 7.171 1.00 0.00 H new ATOM 0 HG21 THR A 417 4.469 2.355 9.352 1.00 0.00 H new ATOM 0 HG22 THR A 417 4.756 3.876 8.474 1.00 0.00 H new ATOM 0 HG23 THR A 417 3.101 3.415 8.936 1.00 0.00 H new ATOM 787 N LYS A 418 5.202 4.323 5.091 1.00 0.00 N ATOM 788 CA LYS A 418 6.109 5.429 4.816 1.00 0.00 C ATOM 789 C LYS A 418 5.401 6.533 4.036 1.00 0.00 C ATOM 790 O LYS A 418 5.707 7.712 4.193 1.00 0.00 O ATOM 791 CB LYS A 418 7.327 4.937 4.033 1.00 0.00 C ATOM 792 CG LYS A 418 8.621 5.635 4.418 1.00 0.00 C ATOM 793 CD LYS A 418 9.495 4.749 5.292 1.00 0.00 C ATOM 794 CE LYS A 418 8.849 4.492 6.644 1.00 0.00 C ATOM 795 NZ LYS A 418 9.850 4.092 7.669 1.00 0.00 N ATOM 0 H LYS A 418 5.386 3.481 4.545 1.00 0.00 H new ATOM 0 HA LYS A 418 6.441 5.838 5.770 1.00 0.00 H new ATOM 0 HB2 LYS A 418 7.441 3.865 4.192 1.00 0.00 H new ATOM 0 HB3 LYS A 418 7.148 5.084 2.968 1.00 0.00 H new ATOM 0 HG2 LYS A 418 9.168 5.912 3.517 1.00 0.00 H new ATOM 0 HG3 LYS A 418 8.393 6.559 4.949 1.00 0.00 H new ATOM 0 HD2 LYS A 418 9.674 3.800 4.786 1.00 0.00 H new ATOM 0 HD3 LYS A 418 10.467 5.222 5.435 1.00 0.00 H new ATOM 0 HE2 LYS A 418 8.330 5.391 6.975 1.00 0.00 H new ATOM 0 HE3 LYS A 418 8.098 3.708 6.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 9.370 3.926 8.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 10.328 3.220 7.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 10.553 4.850 7.783 1.00 0.00 H new ATOM 809 N GLU A 419 4.455 6.143 3.190 1.00 0.00 N ATOM 810 CA GLU A 419 3.708 7.111 2.391 1.00 0.00 C ATOM 811 C GLU A 419 2.718 7.896 3.252 1.00 0.00 C ATOM 812 O GLU A 419 2.619 9.118 3.144 1.00 0.00 O ATOM 813 CB GLU A 419 2.957 6.414 1.252 1.00 0.00 C ATOM 814 CG GLU A 419 3.688 5.211 0.674 1.00 0.00 C ATOM 815 CD GLU A 419 5.140 5.508 0.351 1.00 0.00 C ATOM 816 OE1 GLU A 419 5.473 6.695 0.149 1.00 0.00 O ATOM 817 OE2 GLU A 419 5.945 4.554 0.300 1.00 0.00 O ATOM 0 H GLU A 419 4.187 5.170 3.039 1.00 0.00 H new ATOM 0 HA GLU A 419 4.431 7.808 1.968 1.00 0.00 H new ATOM 0 HB2 GLU A 419 1.981 6.093 1.617 1.00 0.00 H new ATOM 0 HB3 GLU A 419 2.777 7.135 0.454 1.00 0.00 H new ATOM 0 HG2 GLU A 419 3.640 4.386 1.384 1.00 0.00 H new ATOM 0 HG3 GLU A 419 3.178 4.882 -0.232 1.00 0.00 H new ATOM 824 N LEU A 420 1.975 7.180 4.093 1.00 0.00 N ATOM 825 CA LEU A 420 0.973 7.805 4.957 1.00 0.00 C ATOM 826 C LEU A 420 1.597 8.780 5.953 1.00 0.00 C ATOM 827 O LEU A 420 1.100 9.893 6.132 1.00 0.00 O ATOM 828 CB LEU A 420 0.162 6.734 5.700 1.00 0.00 C ATOM 829 CG LEU A 420 0.868 6.071 6.887 1.00 0.00 C ATOM 830 CD1 LEU A 420 0.749 6.935 8.135 1.00 0.00 C ATOM 831 CD2 LEU A 420 0.289 4.686 7.136 1.00 0.00 C ATOM 0 H LEU A 420 2.047 6.168 4.195 1.00 0.00 H new ATOM 0 HA LEU A 420 0.306 8.379 4.313 1.00 0.00 H new ATOM 0 HB2 LEU A 420 -0.762 7.188 6.058 1.00 0.00 H new ATOM 0 HB3 LEU A 420 -0.119 5.958 4.988 1.00 0.00 H new ATOM 0 HG LEU A 420 1.926 5.967 6.647 1.00 0.00 H new ATOM 0 HD11 LEU A 420 1.257 6.446 8.966 1.00 0.00 H new ATOM 0 HD12 LEU A 420 1.208 7.906 7.950 1.00 0.00 H new ATOM 0 HD13 LEU A 420 -0.303 7.072 8.383 1.00 0.00 H new ATOM 0 HD21 LEU A 420 0.799 4.225 7.982 1.00 0.00 H new ATOM 0 HD22 LEU A 420 -0.775 4.771 7.356 1.00 0.00 H new ATOM 0 HD23 LEU A 420 0.428 4.069 6.248 1.00 0.00 H new ATOM 843 N LEU A 421 2.677 8.366 6.607 1.00 0.00 N ATOM 844 CA LEU A 421 3.340 9.220 7.584 1.00 0.00 C ATOM 845 C LEU A 421 4.000 10.417 6.900 1.00 0.00 C ATOM 846 O LEU A 421 4.094 11.499 7.481 1.00 0.00 O ATOM 847 CB LEU A 421 4.336 8.405 8.439 1.00 0.00 C ATOM 848 CG LEU A 421 5.834 8.645 8.199 1.00 0.00 C ATOM 849 CD1 LEU A 421 6.194 8.388 6.747 1.00 0.00 C ATOM 850 CD2 LEU A 421 6.234 10.054 8.619 1.00 0.00 C ATOM 0 H LEU A 421 3.109 7.451 6.479 1.00 0.00 H new ATOM 0 HA LEU A 421 2.589 9.619 8.266 1.00 0.00 H new ATOM 0 HB2 LEU A 421 4.126 8.610 9.489 1.00 0.00 H new ATOM 0 HB3 LEU A 421 4.134 7.347 8.275 1.00 0.00 H new ATOM 0 HG LEU A 421 6.393 7.941 8.816 1.00 0.00 H new ATOM 0 HD11 LEU A 421 7.260 8.564 6.600 1.00 0.00 H new ATOM 0 HD12 LEU A 421 5.958 7.355 6.491 1.00 0.00 H new ATOM 0 HD13 LEU A 421 5.623 9.060 6.106 1.00 0.00 H new ATOM 0 HD21 LEU A 421 7.299 10.199 8.439 1.00 0.00 H new ATOM 0 HD22 LEU A 421 5.666 10.782 8.039 1.00 0.00 H new ATOM 0 HD23 LEU A 421 6.023 10.191 9.680 1.00 0.00 H new ATOM 862 N GLU A 422 4.453 10.222 5.663 1.00 0.00 N ATOM 863 CA GLU A 422 5.095 11.293 4.910 1.00 0.00 C ATOM 864 C GLU A 422 4.156 12.485 4.764 1.00 0.00 C ATOM 865 O GLU A 422 4.551 13.630 4.983 1.00 0.00 O ATOM 866 CB GLU A 422 5.516 10.793 3.525 1.00 0.00 C ATOM 867 CG GLU A 422 6.992 10.995 3.226 1.00 0.00 C ATOM 868 CD GLU A 422 7.326 12.434 2.886 1.00 0.00 C ATOM 869 OE1 GLU A 422 6.425 13.156 2.411 1.00 0.00 O ATOM 870 OE2 GLU A 422 8.490 12.838 3.095 1.00 0.00 O ATOM 0 H GLU A 422 4.387 9.335 5.164 1.00 0.00 H new ATOM 0 HA GLU A 422 5.982 11.610 5.459 1.00 0.00 H new ATOM 0 HB2 GLU A 422 5.280 9.732 3.444 1.00 0.00 H new ATOM 0 HB3 GLU A 422 4.927 11.309 2.767 1.00 0.00 H new ATOM 0 HG2 GLU A 422 7.580 10.684 4.090 1.00 0.00 H new ATOM 0 HG3 GLU A 422 7.282 10.352 2.395 1.00 0.00 H new ATOM 877 N LEU A 423 2.911 12.205 4.396 1.00 0.00 N ATOM 878 CA LEU A 423 1.911 13.252 4.225 1.00 0.00 C ATOM 879 C LEU A 423 1.536 13.866 5.570 1.00 0.00 C ATOM 880 O LEU A 423 1.244 15.059 5.660 1.00 0.00 O ATOM 881 CB LEU A 423 0.662 12.690 3.543 1.00 0.00 C ATOM 882 CG LEU A 423 0.927 11.871 2.275 1.00 0.00 C ATOM 883 CD1 LEU A 423 0.363 10.464 2.417 1.00 0.00 C ATOM 884 CD2 LEU A 423 0.333 12.562 1.055 1.00 0.00 C ATOM 0 H LEU A 423 2.570 11.262 4.210 1.00 0.00 H new ATOM 0 HA LEU A 423 2.340 14.031 3.594 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.128 12.063 4.257 1.00 0.00 H new ATOM 0 HB3 LEU A 423 0.001 13.519 3.290 1.00 0.00 H new ATOM 0 HG LEU A 423 2.006 11.797 2.137 1.00 0.00 H new ATOM 0 HD11 LEU A 423 0.561 9.899 1.506 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.836 9.966 3.263 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -0.713 10.518 2.583 1.00 0.00 H new ATOM 0 HD21 LEU A 423 0.532 11.964 0.165 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -0.744 12.670 1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 423 0.785 13.547 0.939 1.00 0.00 H new ATOM 896 N ASP A 424 1.549 13.042 6.613 1.00 0.00 N ATOM 897 CA ASP A 424 1.211 13.503 7.956 1.00 0.00 C ATOM 898 C ASP A 424 2.272 14.462 8.487 1.00 0.00 C ATOM 899 O ASP A 424 1.979 15.336 9.302 1.00 0.00 O ATOM 900 CB ASP A 424 1.064 12.311 8.904 1.00 0.00 C ATOM 901 CG ASP A 424 0.057 12.571 10.007 1.00 0.00 C ATOM 902 OD1 ASP A 424 -1.018 13.131 9.709 1.00 0.00 O ATOM 903 OD2 ASP A 424 0.343 12.213 11.169 1.00 0.00 O ATOM 0 H ASP A 424 1.790 12.053 6.555 1.00 0.00 H new ATOM 0 HA ASP A 424 0.262 14.036 7.902 1.00 0.00 H new ATOM 0 HB2 ASP A 424 0.757 11.433 8.335 1.00 0.00 H new ATOM 0 HB3 ASP A 424 2.033 12.081 9.347 1.00 0.00 H new ATOM 908 N SER A 425 3.505 14.293 8.018 1.00 0.00 N ATOM 909 CA SER A 425 4.609 15.146 8.446 1.00 0.00 C ATOM 910 C SER A 425 4.841 16.276 7.448 1.00 0.00 C ATOM 911 O SER A 425 5.981 16.648 7.170 1.00 0.00 O ATOM 912 CB SER A 425 5.886 14.320 8.607 1.00 0.00 C ATOM 913 OG SER A 425 6.099 13.484 7.483 1.00 0.00 O ATOM 0 H SER A 425 3.764 13.574 7.342 1.00 0.00 H new ATOM 0 HA SER A 425 4.346 15.585 9.408 1.00 0.00 H new ATOM 0 HB2 SER A 425 6.739 14.986 8.736 1.00 0.00 H new ATOM 0 HB3 SER A 425 5.818 13.711 9.509 1.00 0.00 H new ATOM 0 HG SER A 425 5.443 12.756 7.488 1.00 0.00 H new ATOM 919 N VAL A 426 3.753 16.819 6.914 1.00 0.00 N ATOM 920 CA VAL A 426 3.837 17.907 5.949 1.00 0.00 C ATOM 921 C VAL A 426 3.915 19.258 6.654 1.00 0.00 C ATOM 922 O VAL A 426 3.205 19.501 7.630 1.00 0.00 O ATOM 923 CB VAL A 426 2.626 17.901 4.994 1.00 0.00 C ATOM 924 CG1 VAL A 426 1.329 18.086 5.769 1.00 0.00 C ATOM 925 CG2 VAL A 426 2.777 18.975 3.926 1.00 0.00 C ATOM 0 H VAL A 426 2.802 16.523 7.134 1.00 0.00 H new ATOM 0 HA VAL A 426 4.747 17.752 5.369 1.00 0.00 H new ATOM 0 HB VAL A 426 2.588 16.932 4.496 1.00 0.00 H new ATOM 0 HG11 VAL A 426 0.487 18.079 5.077 1.00 0.00 H new ATOM 0 HG12 VAL A 426 1.215 17.274 6.487 1.00 0.00 H new ATOM 0 HG13 VAL A 426 1.355 19.038 6.299 1.00 0.00 H new ATOM 0 HG21 VAL A 426 1.912 18.953 3.263 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.845 19.954 4.401 1.00 0.00 H new ATOM 0 HG23 VAL A 426 3.682 18.788 3.348 1.00 0.00 H new ATOM 935 N GLU A 427 4.781 20.132 6.154 1.00 0.00 N ATOM 936 CA GLU A 427 4.952 21.456 6.737 1.00 0.00 C ATOM 937 C GLU A 427 3.874 22.416 6.242 1.00 0.00 C ATOM 938 O GLU A 427 3.867 22.808 5.075 1.00 0.00 O ATOM 939 CB GLU A 427 6.339 22.009 6.402 1.00 0.00 C ATOM 940 CG GLU A 427 6.985 22.772 7.547 1.00 0.00 C ATOM 941 CD GLU A 427 8.406 22.322 7.822 1.00 0.00 C ATOM 942 OE1 GLU A 427 9.334 22.858 7.180 1.00 0.00 O ATOM 943 OE2 GLU A 427 8.592 21.432 8.681 1.00 0.00 O ATOM 0 H GLU A 427 5.375 19.947 5.346 1.00 0.00 H new ATOM 0 HA GLU A 427 4.857 21.362 7.819 1.00 0.00 H new ATOM 0 HB2 GLU A 427 6.990 21.183 6.114 1.00 0.00 H new ATOM 0 HB3 GLU A 427 6.259 22.668 5.537 1.00 0.00 H new ATOM 0 HG2 GLU A 427 6.984 23.837 7.315 1.00 0.00 H new ATOM 0 HG3 GLU A 427 6.386 22.642 8.448 1.00 0.00 H new ATOM 950 N THR A 428 2.966 22.790 7.138 1.00 0.00 N ATOM 951 CA THR A 428 1.883 23.704 6.793 1.00 0.00 C ATOM 952 C THR A 428 1.361 24.424 8.032 1.00 0.00 C ATOM 953 O THR A 428 0.917 23.789 8.989 1.00 0.00 O ATOM 954 CB THR A 428 0.741 22.947 6.112 1.00 0.00 C ATOM 955 OG1 THR A 428 -0.426 23.749 6.051 1.00 0.00 O ATOM 956 CG2 THR A 428 0.374 21.658 6.814 1.00 0.00 C ATOM 0 H THR A 428 2.959 22.474 8.108 1.00 0.00 H new ATOM 0 HA THR A 428 2.279 24.448 6.102 1.00 0.00 H new ATOM 0 HB THR A 428 1.109 22.707 5.115 1.00 0.00 H new ATOM 0 HG1 THR A 428 -1.185 23.201 5.760 1.00 0.00 H new ATOM 0 HG21 THR A 428 -0.442 21.172 6.279 1.00 0.00 H new ATOM 0 HG22 THR A 428 1.240 20.996 6.835 1.00 0.00 H new ATOM 0 HG23 THR A 428 0.060 21.876 7.835 1.00 0.00 H new ATOM 964 N GLY A 429 1.418 25.750 8.008 1.00 0.00 N ATOM 965 CA GLY A 429 0.948 26.534 9.135 1.00 0.00 C ATOM 966 C GLY A 429 -0.486 26.998 8.961 1.00 0.00 C ATOM 967 O GLY A 429 -1.310 26.836 9.861 1.00 0.00 O ATOM 0 H GLY A 429 1.782 26.297 7.228 1.00 0.00 H new ATOM 0 HA2 GLY A 429 1.026 25.939 10.045 1.00 0.00 H new ATOM 0 HA3 GLY A 429 1.594 27.402 9.265 1.00 0.00 H new ATOM 971 N GLY A 430 -0.783 27.575 7.802 1.00 0.00 N ATOM 972 CA GLY A 430 -2.127 28.054 7.534 1.00 0.00 C ATOM 973 C GLY A 430 -2.603 27.696 6.141 1.00 0.00 C ATOM 974 O GLY A 430 -2.863 28.577 5.321 1.00 0.00 O ATOM 0 H GLY A 430 -0.117 27.720 7.043 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -2.813 27.632 8.269 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -2.155 29.137 7.657 1.00 0.00 H new ATOM 978 N GLN A 431 -2.715 26.400 5.870 1.00 0.00 N ATOM 979 CA GLN A 431 -3.161 25.927 4.564 1.00 0.00 C ATOM 980 C GLN A 431 -4.112 24.744 4.709 1.00 0.00 C ATOM 981 O GLN A 431 -3.696 23.588 4.637 1.00 0.00 O ATOM 982 CB GLN A 431 -1.959 25.528 3.706 1.00 0.00 C ATOM 983 CG GLN A 431 -0.981 26.666 3.464 1.00 0.00 C ATOM 984 CD GLN A 431 0.403 26.176 3.088 1.00 0.00 C ATOM 985 OE1 GLN A 431 0.587 25.529 2.057 1.00 0.00 O ATOM 986 NE2 GLN A 431 1.387 26.481 3.927 1.00 0.00 N ATOM 0 H GLN A 431 -2.503 25.658 6.537 1.00 0.00 H new ATOM 0 HA GLN A 431 -3.695 26.741 4.074 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -1.434 24.705 4.191 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -2.316 25.156 2.746 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -1.364 27.306 2.669 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -0.913 27.279 4.363 1.00 0.00 H new ATOM 0 HE21 GLN A 431 1.190 27.020 4.770 1.00 0.00 H new ATOM 0 HE22 GLN A 431 2.340 26.177 3.728 1.00 0.00 H new ATOM 995 N ASP A 432 -5.392 25.040 4.914 1.00 0.00 N ATOM 996 CA ASP A 432 -6.402 23.999 5.068 1.00 0.00 C ATOM 997 C ASP A 432 -6.463 23.113 3.829 1.00 0.00 C ATOM 998 O ASP A 432 -6.756 21.920 3.919 1.00 0.00 O ATOM 999 CB ASP A 432 -7.774 24.624 5.331 1.00 0.00 C ATOM 1000 CG ASP A 432 -7.794 25.464 6.592 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -6.845 26.250 6.798 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -8.760 25.338 7.374 1.00 0.00 O ATOM 0 H ASP A 432 -5.754 25.992 4.977 1.00 0.00 H new ATOM 0 HA ASP A 432 -6.123 23.381 5.921 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -8.057 25.244 4.480 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -8.521 23.834 5.412 1.00 0.00 H new ATOM 1007 N SER A 433 -6.184 23.703 2.671 1.00 0.00 N ATOM 1008 CA SER A 433 -6.207 22.969 1.412 1.00 0.00 C ATOM 1009 C SER A 433 -5.170 21.850 1.416 1.00 0.00 C ATOM 1010 O SER A 433 -5.442 20.737 0.963 1.00 0.00 O ATOM 1011 CB SER A 433 -5.946 23.916 0.239 1.00 0.00 C ATOM 1012 OG SER A 433 -6.743 23.574 -0.881 1.00 0.00 O ATOM 0 H SER A 433 -5.939 24.689 2.579 1.00 0.00 H new ATOM 0 HA SER A 433 -7.196 22.525 1.298 1.00 0.00 H new ATOM 0 HB2 SER A 433 -6.159 24.941 0.541 1.00 0.00 H new ATOM 0 HB3 SER A 433 -4.892 23.877 -0.036 1.00 0.00 H new ATOM 0 HG SER A 433 -6.558 24.195 -1.616 1.00 0.00 H new ATOM 1018 N VAL A 434 -3.983 22.152 1.929 1.00 0.00 N ATOM 1019 CA VAL A 434 -2.906 21.172 1.991 1.00 0.00 C ATOM 1020 C VAL A 434 -3.253 20.036 2.947 1.00 0.00 C ATOM 1021 O VAL A 434 -3.063 18.862 2.628 1.00 0.00 O ATOM 1022 CB VAL A 434 -1.581 21.819 2.441 1.00 0.00 C ATOM 1023 CG1 VAL A 434 -0.439 20.817 2.355 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -1.280 23.054 1.604 1.00 0.00 C ATOM 0 H VAL A 434 -3.742 23.068 2.308 1.00 0.00 H new ATOM 0 HA VAL A 434 -2.783 20.773 0.984 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.684 22.128 3.481 1.00 0.00 H new ATOM 0 HG11 VAL A 434 0.487 21.293 2.677 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.653 19.965 3.001 1.00 0.00 H new ATOM 0 HG13 VAL A 434 -0.332 20.474 1.326 1.00 0.00 H new ATOM 0 HG21 VAL A 434 -0.341 23.498 1.935 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -1.197 22.771 0.555 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -2.086 23.779 1.722 1.00 0.00 H new ATOM 1034 N ARG A 435 -3.764 20.392 4.120 1.00 0.00 N ATOM 1035 CA ARG A 435 -4.139 19.402 5.124 1.00 0.00 C ATOM 1036 C ARG A 435 -5.188 18.442 4.572 1.00 0.00 C ATOM 1037 O ARG A 435 -5.207 17.260 4.921 1.00 0.00 O ATOM 1038 CB ARG A 435 -4.669 20.096 6.381 1.00 0.00 C ATOM 1039 CG ARG A 435 -3.921 19.714 7.648 1.00 0.00 C ATOM 1040 CD ARG A 435 -2.627 20.499 7.788 1.00 0.00 C ATOM 1041 NE ARG A 435 -2.318 20.800 9.185 1.00 0.00 N ATOM 1042 CZ ARG A 435 -1.776 19.927 10.030 1.00 0.00 C ATOM 1043 NH1 ARG A 435 -1.481 18.697 9.625 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -1.527 20.283 11.282 1.00 0.00 N ATOM 0 H ARG A 435 -3.928 21.359 4.400 1.00 0.00 H new ATOM 0 HA ARG A 435 -3.251 18.827 5.386 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -4.607 21.176 6.244 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -5.724 19.851 6.504 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -4.555 19.897 8.516 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -3.701 18.647 7.634 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -1.808 19.929 7.350 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -2.704 21.429 7.225 1.00 0.00 H new ATOM 0 HE ARG A 435 -2.531 21.735 9.532 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -1.670 18.418 8.662 1.00 0.00 H new ATOM 0 HH12 ARG A 435 -1.066 18.031 10.277 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -1.751 21.227 11.598 1.00 0.00 H new ATOM 0 HH22 ARG A 435 -1.111 19.613 11.930 1.00 0.00 H new ATOM 1058 N GLN A 436 -6.058 18.955 3.708 1.00 0.00 N ATOM 1059 CA GLN A 436 -7.109 18.142 3.108 1.00 0.00 C ATOM 1060 C GLN A 436 -6.519 17.107 2.156 1.00 0.00 C ATOM 1061 O GLN A 436 -6.879 15.931 2.203 1.00 0.00 O ATOM 1062 CB GLN A 436 -8.108 19.030 2.363 1.00 0.00 C ATOM 1063 CG GLN A 436 -9.439 18.350 2.086 1.00 0.00 C ATOM 1064 CD GLN A 436 -10.129 18.896 0.852 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -10.104 18.278 -0.212 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -10.749 20.063 0.989 1.00 0.00 N ATOM 0 H GLN A 436 -6.056 19.930 3.408 1.00 0.00 H new ATOM 0 HA GLN A 436 -7.630 17.616 3.909 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -8.286 19.932 2.948 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -7.667 19.345 1.417 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -9.277 17.279 1.963 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -10.093 18.476 2.949 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -10.744 20.540 1.890 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -11.230 20.482 0.193 1.00 0.00 H new ATOM 1075 N ALA A 437 -5.611 17.552 1.292 1.00 0.00 N ATOM 1076 CA ALA A 437 -4.973 16.661 0.330 1.00 0.00 C ATOM 1077 C ALA A 437 -4.105 15.626 1.036 1.00 0.00 C ATOM 1078 O ALA A 437 -4.146 14.439 0.710 1.00 0.00 O ATOM 1079 CB ALA A 437 -4.142 17.463 -0.661 1.00 0.00 C ATOM 0 H ALA A 437 -5.301 18.522 1.239 1.00 0.00 H new ATOM 0 HA ALA A 437 -5.755 16.132 -0.214 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -3.671 16.785 -1.373 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -4.787 18.161 -1.195 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -3.372 18.018 -0.125 1.00 0.00 H new ATOM 1085 N ARG A 438 -3.320 16.082 2.006 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.443 15.196 2.761 1.00 0.00 C ATOM 1087 C ARG A 438 -3.255 14.237 3.626 1.00 0.00 C ATOM 1088 O ARG A 438 -2.887 13.074 3.793 1.00 0.00 O ATOM 1089 CB ARG A 438 -1.492 16.014 3.638 1.00 0.00 C ATOM 1090 CG ARG A 438 -0.625 16.983 2.851 1.00 0.00 C ATOM 1091 CD ARG A 438 0.354 16.246 1.952 1.00 0.00 C ATOM 1092 NE ARG A 438 1.568 17.023 1.711 1.00 0.00 N ATOM 1093 CZ ARG A 438 2.739 16.487 1.370 1.00 0.00 C ATOM 1094 NH1 ARG A 438 2.863 15.172 1.232 1.00 0.00 N ATOM 1095 NH2 ARG A 438 3.789 17.269 1.165 1.00 0.00 N ATOM 0 H ARG A 438 -3.273 17.061 2.288 1.00 0.00 H new ATOM 0 HA ARG A 438 -1.858 14.610 2.052 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -2.075 16.573 4.370 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -0.849 15.333 4.196 1.00 0.00 H new ATOM 0 HG2 ARG A 438 -1.259 17.632 2.247 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -0.076 17.625 3.540 1.00 0.00 H new ATOM 0 HD2 ARG A 438 0.619 15.293 2.409 1.00 0.00 H new ATOM 0 HD3 ARG A 438 -0.127 16.021 1.000 1.00 0.00 H new ATOM 0 HE ARG A 438 1.516 18.037 1.810 1.00 0.00 H new ATOM 0 HH11 ARG A 438 2.058 14.565 1.387 1.00 0.00 H new ATOM 0 HH12 ARG A 438 3.763 14.769 0.971 1.00 0.00 H new ATOM 0 HH21 ARG A 438 3.700 18.280 1.268 1.00 0.00 H new ATOM 0 HH22 ARG A 438 4.686 16.860 0.904 1.00 0.00 H new ATOM 1109 N LYS A 439 -4.362 14.731 4.169 1.00 0.00 N ATOM 1110 CA LYS A 439 -5.228 13.917 5.014 1.00 0.00 C ATOM 1111 C LYS A 439 -5.890 12.809 4.200 1.00 0.00 C ATOM 1112 O LYS A 439 -5.944 11.657 4.630 1.00 0.00 O ATOM 1113 CB LYS A 439 -6.298 14.787 5.675 1.00 0.00 C ATOM 1114 CG LYS A 439 -7.228 14.015 6.597 1.00 0.00 C ATOM 1115 CD LYS A 439 -6.478 13.435 7.787 1.00 0.00 C ATOM 1116 CE LYS A 439 -6.025 14.524 8.747 1.00 0.00 C ATOM 1117 NZ LYS A 439 -4.575 14.413 9.067 1.00 0.00 N ATOM 0 H LYS A 439 -4.681 15.691 4.039 1.00 0.00 H new ATOM 0 HA LYS A 439 -4.613 13.460 5.789 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -5.810 15.578 6.245 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -6.890 15.272 4.899 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -8.021 14.674 6.951 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -7.708 13.210 6.041 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -7.120 12.729 8.314 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -5.611 12.876 7.434 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -6.226 15.501 8.309 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -6.606 14.462 9.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -4.305 15.173 9.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -4.387 13.490 9.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -4.019 14.498 8.192 1.00 0.00 H new ATOM 1131 N GLU A 440 -6.390 13.168 3.023 1.00 0.00 N ATOM 1132 CA GLU A 440 -7.047 12.205 2.147 1.00 0.00 C ATOM 1133 C GLU A 440 -6.076 11.107 1.726 1.00 0.00 C ATOM 1134 O GLU A 440 -6.462 9.950 1.566 1.00 0.00 O ATOM 1135 CB GLU A 440 -7.608 12.908 0.911 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.894 13.674 1.177 1.00 0.00 C ATOM 1137 CD GLU A 440 -10.077 12.759 1.426 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -10.149 12.165 2.522 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -10.932 12.637 0.524 1.00 0.00 O ATOM 0 H GLU A 440 -6.353 14.118 2.654 1.00 0.00 H new ATOM 0 HA GLU A 440 -7.869 11.748 2.699 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -6.858 13.598 0.524 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -7.791 12.166 0.133 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.754 14.323 2.041 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -9.111 14.319 0.325 1.00 0.00 H new ATOM 1146 N ALA A 441 -4.812 11.479 1.551 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.784 10.526 1.151 1.00 0.00 C ATOM 1148 C ALA A 441 -3.469 9.554 2.282 1.00 0.00 C ATOM 1149 O ALA A 441 -3.365 8.347 2.066 1.00 0.00 O ATOM 1150 CB ALA A 441 -2.526 11.261 0.716 1.00 0.00 C ATOM 0 H ALA A 441 -4.476 12.433 1.680 1.00 0.00 H new ATOM 0 HA ALA A 441 -4.164 9.949 0.308 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.766 10.538 0.420 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -2.758 11.910 -0.128 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -2.151 11.862 1.544 1.00 0.00 H new ATOM 1156 N VAL A 442 -3.321 10.088 3.491 1.00 0.00 N ATOM 1157 CA VAL A 442 -3.020 9.267 4.657 1.00 0.00 C ATOM 1158 C VAL A 442 -4.151 8.283 4.936 1.00 0.00 C ATOM 1159 O VAL A 442 -3.913 7.099 5.177 1.00 0.00 O ATOM 1160 CB VAL A 442 -2.790 10.133 5.910 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -2.314 9.277 7.073 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -1.796 11.248 5.616 1.00 0.00 C ATOM 0 H VAL A 442 -3.405 11.085 3.688 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.106 8.718 4.432 1.00 0.00 H new ATOM 0 HB VAL A 442 -3.739 10.589 6.191 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -2.157 9.907 7.948 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -3.066 8.521 7.300 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.377 8.788 6.805 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -1.647 11.849 6.513 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -0.845 10.815 5.307 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.184 11.880 4.817 1.00 0.00 H new ATOM 1172 N CYS A 443 -5.385 8.779 4.896 1.00 0.00 N ATOM 1173 CA CYS A 443 -6.553 7.942 5.140 1.00 0.00 C ATOM 1174 C CYS A 443 -6.635 6.825 4.107 1.00 0.00 C ATOM 1175 O CYS A 443 -7.065 5.709 4.411 1.00 0.00 O ATOM 1176 CB CYS A 443 -7.829 8.785 5.102 1.00 0.00 C ATOM 1177 SG CYS A 443 -9.100 8.252 6.273 1.00 0.00 S ATOM 0 H CYS A 443 -5.600 9.756 4.697 1.00 0.00 H new ATOM 0 HA CYS A 443 -6.455 7.496 6.130 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -7.572 9.824 5.309 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -8.243 8.754 4.094 1.00 0.00 H new ATOM 0 HG CYS A 443 -10.139 9.026 6.168 1.00 0.00 H new ATOM 1183 N LYS A 444 -6.206 7.129 2.886 1.00 0.00 N ATOM 1184 CA LYS A 444 -6.222 6.148 1.811 1.00 0.00 C ATOM 1185 C LYS A 444 -5.300 4.987 2.154 1.00 0.00 C ATOM 1186 O LYS A 444 -5.598 3.832 1.852 1.00 0.00 O ATOM 1187 CB LYS A 444 -5.790 6.789 0.491 1.00 0.00 C ATOM 1188 CG LYS A 444 -6.428 6.151 -0.733 1.00 0.00 C ATOM 1189 CD LYS A 444 -7.844 6.659 -0.952 1.00 0.00 C ATOM 1190 CE LYS A 444 -8.209 6.673 -2.427 1.00 0.00 C ATOM 1191 NZ LYS A 444 -8.935 5.437 -2.832 1.00 0.00 N ATOM 0 H LYS A 444 -5.844 8.045 2.619 1.00 0.00 H new ATOM 0 HA LYS A 444 -7.240 5.774 1.697 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -6.043 7.849 0.511 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -4.706 6.722 0.402 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -5.823 6.366 -1.614 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -6.443 5.068 -0.614 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -8.546 6.027 -0.408 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -7.938 7.665 -0.543 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -8.829 7.544 -2.639 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -7.303 6.774 -3.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -9.166 5.486 -3.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -8.334 4.607 -2.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -9.813 5.354 -2.281 1.00 0.00 H new ATOM 1205 N ILE A 445 -4.185 5.301 2.805 1.00 0.00 N ATOM 1206 CA ILE A 445 -3.229 4.280 3.207 1.00 0.00 C ATOM 1207 C ILE A 445 -3.823 3.401 4.295 1.00 0.00 C ATOM 1208 O ILE A 445 -3.517 2.214 4.392 1.00 0.00 O ATOM 1209 CB ILE A 445 -1.903 4.885 3.718 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -1.563 6.185 2.981 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -0.773 3.877 3.566 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -1.759 6.110 1.481 1.00 0.00 C ATOM 0 H ILE A 445 -3.923 6.252 3.064 1.00 0.00 H new ATOM 0 HA ILE A 445 -3.011 3.687 2.319 1.00 0.00 H new ATOM 0 HB ILE A 445 -2.026 5.124 4.774 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -2.182 6.989 3.379 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -0.526 6.449 3.189 1.00 0.00 H new ATOM 0 HG21 ILE A 445 0.157 4.315 3.930 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -1.003 2.982 4.145 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -0.662 3.611 2.515 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -1.498 7.068 1.032 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -1.119 5.329 1.069 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -2.801 5.878 1.261 1.00 0.00 H new ATOM 1224 N GLN A 446 -4.684 3.999 5.109 1.00 0.00 N ATOM 1225 CA GLN A 446 -5.341 3.294 6.190 1.00 0.00 C ATOM 1226 C GLN A 446 -6.141 2.114 5.657 1.00 0.00 C ATOM 1227 O GLN A 446 -6.042 0.998 6.169 1.00 0.00 O ATOM 1228 CB GLN A 446 -6.261 4.266 6.919 1.00 0.00 C ATOM 1229 CG GLN A 446 -6.719 3.785 8.275 1.00 0.00 C ATOM 1230 CD GLN A 446 -5.596 3.198 9.111 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -5.385 1.985 9.121 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -4.871 4.058 9.816 1.00 0.00 N ATOM 0 H GLN A 446 -4.942 4.983 5.035 1.00 0.00 H new ATOM 0 HA GLN A 446 -4.590 2.906 6.878 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -5.744 5.218 7.039 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -7.137 4.455 6.298 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -7.169 4.617 8.816 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -7.497 3.033 8.143 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -5.082 5.055 9.777 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -4.103 3.722 10.397 1.00 0.00 H new ATOM 1241 N ALA A 447 -6.924 2.366 4.615 1.00 0.00 N ATOM 1242 CA ALA A 447 -7.734 1.322 3.999 1.00 0.00 C ATOM 1243 C ALA A 447 -6.841 0.252 3.378 1.00 0.00 C ATOM 1244 O ALA A 447 -7.167 -0.935 3.395 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.659 1.917 2.949 1.00 0.00 C ATOM 0 H ALA A 447 -7.015 3.284 4.179 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.344 0.856 4.773 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.256 1.124 2.499 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.319 2.647 3.417 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -8.066 2.407 2.177 1.00 0.00 H new ATOM 1251 N ILE A 448 -5.708 0.686 2.837 1.00 0.00 N ATOM 1252 CA ILE A 448 -4.754 -0.224 2.216 1.00 0.00 C ATOM 1253 C ILE A 448 -3.991 -1.010 3.273 1.00 0.00 C ATOM 1254 O ILE A 448 -3.676 -2.185 3.086 1.00 0.00 O ATOM 1255 CB ILE A 448 -3.745 0.532 1.330 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -4.477 1.498 0.399 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -2.903 -0.450 0.529 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -3.638 2.687 -0.017 1.00 0.00 C ATOM 0 H ILE A 448 -5.428 1.666 2.816 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.328 -0.909 1.592 1.00 0.00 H new ATOM 0 HB ILE A 448 -3.080 1.109 1.972 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -4.797 0.959 -0.493 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -5.379 1.856 0.896 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -2.195 0.099 -0.092 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -2.357 -1.102 1.211 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -3.552 -1.052 -0.107 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -4.220 3.330 -0.677 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -3.340 3.249 0.868 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -2.749 2.339 -0.542 1.00 0.00 H new ATOM 1270 N LEU A 449 -3.695 -0.347 4.386 1.00 0.00 N ATOM 1271 CA LEU A 449 -2.964 -0.975 5.481 1.00 0.00 C ATOM 1272 C LEU A 449 -3.696 -2.219 5.974 1.00 0.00 C ATOM 1273 O LEU A 449 -3.128 -3.312 6.004 1.00 0.00 O ATOM 1274 CB LEU A 449 -2.780 0.012 6.635 1.00 0.00 C ATOM 1275 CG LEU A 449 -1.588 -0.275 7.550 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -1.100 1.006 8.207 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -1.961 -1.309 8.602 1.00 0.00 C ATOM 0 H LEU A 449 -3.950 0.626 4.554 1.00 0.00 H new ATOM 0 HA LEU A 449 -1.983 -1.271 5.109 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -2.668 1.014 6.221 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -3.688 0.016 7.238 1.00 0.00 H new ATOM 0 HG LEU A 449 -0.777 -0.679 6.944 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -0.252 0.783 8.854 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -0.793 1.715 7.438 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.905 1.440 8.800 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -1.101 -1.501 9.244 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -2.787 -0.933 9.205 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -2.262 -2.235 8.112 1.00 0.00 H new ATOM 1289 N GLU A 450 -4.960 -2.053 6.350 1.00 0.00 N ATOM 1290 CA GLU A 450 -5.759 -3.175 6.827 1.00 0.00 C ATOM 1291 C GLU A 450 -5.866 -4.242 5.747 1.00 0.00 C ATOM 1292 O GLU A 450 -5.815 -5.437 6.036 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.152 -2.707 7.251 1.00 0.00 C ATOM 1294 CG GLU A 450 -7.893 -1.935 6.172 1.00 0.00 C ATOM 1295 CD GLU A 450 -8.852 -0.909 6.744 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -8.517 -0.297 7.780 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -9.937 -0.717 6.157 1.00 0.00 O ATOM 0 H GLU A 450 -5.450 -1.159 6.334 1.00 0.00 H new ATOM 0 HA GLU A 450 -5.263 -3.604 7.697 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -7.746 -3.575 7.537 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -7.060 -2.078 8.137 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -7.171 -1.433 5.529 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -8.446 -2.634 5.545 1.00 0.00 H new ATOM 1304 N LYS A 451 -5.988 -3.804 4.497 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.070 -4.735 3.379 1.00 0.00 C ATOM 1306 C LYS A 451 -4.831 -5.622 3.366 1.00 0.00 C ATOM 1307 O LYS A 451 -4.886 -6.788 2.973 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.195 -3.976 2.054 1.00 0.00 C ATOM 1309 CG LYS A 451 -7.603 -3.978 1.485 1.00 0.00 C ATOM 1310 CD LYS A 451 -7.697 -3.124 0.230 1.00 0.00 C ATOM 1311 CE LYS A 451 -8.027 -1.678 0.565 1.00 0.00 C ATOM 1312 NZ LYS A 451 -9.305 -1.557 1.322 1.00 0.00 N ATOM 0 H LYS A 451 -6.032 -2.819 4.235 1.00 0.00 H new ATOM 0 HA LYS A 451 -6.957 -5.357 3.499 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -5.873 -2.945 2.203 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -5.516 -4.419 1.325 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -7.902 -5.000 1.254 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.300 -3.604 2.235 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -6.752 -3.167 -0.312 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.463 -3.530 -0.431 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -7.216 -1.248 1.152 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -8.095 -1.099 -0.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -9.915 -0.852 0.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -9.789 -2.477 1.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -9.104 -1.258 2.297 1.00 0.00 H new ATOM 1326 N LEU A 452 -3.715 -5.056 3.822 1.00 0.00 N ATOM 1327 CA LEU A 452 -2.458 -5.774 3.893 1.00 0.00 C ATOM 1328 C LEU A 452 -2.530 -6.867 4.952 1.00 0.00 C ATOM 1329 O LEU A 452 -2.008 -7.965 4.763 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.340 -4.792 4.226 1.00 0.00 C ATOM 1331 CG LEU A 452 0.066 -5.249 3.854 1.00 0.00 C ATOM 1332 CD1 LEU A 452 0.511 -6.394 4.750 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.130 -5.654 2.390 1.00 0.00 C ATOM 0 H LEU A 452 -3.663 -4.091 4.149 1.00 0.00 H new ATOM 0 HA LEU A 452 -2.256 -6.244 2.930 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -1.544 -3.850 3.717 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -1.366 -4.588 5.296 1.00 0.00 H new ATOM 0 HG LEU A 452 0.749 -4.413 4.005 1.00 0.00 H new ATOM 0 HD11 LEU A 452 1.517 -6.706 4.469 1.00 0.00 H new ATOM 0 HD12 LEU A 452 0.510 -6.064 5.789 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.175 -7.233 4.635 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.142 -5.977 2.146 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -0.566 -6.473 2.208 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -0.140 -4.803 1.765 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.187 -6.559 6.070 1.00 0.00 N ATOM 1346 CA GLU A 453 -3.332 -7.519 7.157 1.00 0.00 C ATOM 1347 C GLU A 453 -4.085 -8.758 6.682 1.00 0.00 C ATOM 1348 O GLU A 453 -3.866 -9.861 7.183 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.066 -6.880 8.338 1.00 0.00 C ATOM 1350 CG GLU A 453 -3.502 -7.282 9.691 1.00 0.00 C ATOM 1351 CD GLU A 453 -4.231 -8.465 10.299 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -5.443 -8.614 10.034 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -3.591 -9.241 11.038 1.00 0.00 O ATOM 0 H GLU A 453 -3.625 -5.654 6.244 1.00 0.00 H new ATOM 0 HA GLU A 453 -2.336 -7.820 7.482 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -4.019 -5.795 8.241 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.119 -7.158 8.295 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -2.446 -7.528 9.582 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -3.563 -6.433 10.372 1.00 0.00 H new ATOM 1360 N LYS A 454 -4.973 -8.568 5.711 1.00 0.00 N ATOM 1361 CA LYS A 454 -5.759 -9.667 5.166 1.00 0.00 C ATOM 1362 C LYS A 454 -5.069 -10.289 3.952 1.00 0.00 C ATOM 1363 O LYS A 454 -5.414 -11.393 3.532 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.159 -9.179 4.780 1.00 0.00 C ATOM 1365 CG LYS A 454 -8.268 -9.793 5.617 1.00 0.00 C ATOM 1366 CD LYS A 454 -8.356 -11.296 5.408 1.00 0.00 C ATOM 1367 CE LYS A 454 -8.721 -11.639 3.973 1.00 0.00 C ATOM 1368 NZ LYS A 454 -8.888 -13.106 3.777 1.00 0.00 N ATOM 0 H LYS A 454 -5.166 -7.661 5.286 1.00 0.00 H new ATOM 0 HA LYS A 454 -5.847 -10.432 5.938 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -7.197 -8.094 4.880 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -7.338 -9.408 3.730 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -8.090 -9.581 6.671 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -9.220 -9.332 5.356 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -7.401 -11.756 5.661 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -9.101 -11.715 6.084 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -9.645 -11.129 3.702 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -7.945 -11.269 3.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.136 -13.298 2.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -7.998 -13.591 4.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -9.646 -13.455 4.398 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.093 -9.578 3.394 1.00 0.00 N ATOM 1383 CA LYS A 455 -3.361 -10.070 2.233 1.00 0.00 C ATOM 1384 C LYS A 455 -2.250 -11.026 2.657 1.00 0.00 C ATOM 1385 O LYS A 455 -1.795 -11.855 1.867 1.00 0.00 O ATOM 1386 CB LYS A 455 -2.773 -8.900 1.439 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.282 -8.823 0.008 1.00 0.00 C ATOM 1388 CD LYS A 455 -4.665 -8.194 -0.060 1.00 0.00 C ATOM 1389 CE LYS A 455 -5.759 -9.250 -0.100 1.00 0.00 C ATOM 1390 NZ LYS A 455 -6.695 -9.038 -1.239 1.00 0.00 N ATOM 0 H LYS A 455 -3.792 -8.662 3.727 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.059 -10.614 1.597 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -3.010 -7.968 1.951 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -1.687 -8.989 1.426 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -2.586 -8.240 -0.596 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -3.315 -9.824 -0.422 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -4.814 -7.547 0.805 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -4.735 -7.563 -0.946 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -5.307 -10.238 -0.181 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -6.317 -9.231 0.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -7.425 -9.778 -1.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -7.146 -8.105 -1.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -6.168 -9.082 -2.134 1.00 0.00 H new ATOM 1404 N GLY A 456 -1.815 -10.908 3.908 1.00 0.00 N ATOM 1405 CA GLY A 456 -0.762 -11.769 4.411 1.00 0.00 C ATOM 1406 C GLY A 456 -1.295 -13.086 4.938 1.00 0.00 C ATOM 1407 O GLY A 456 -1.590 -13.998 4.166 1.00 0.00 O ATOM 0 H GLY A 456 -2.174 -10.231 4.582 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.044 -11.963 3.614 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.224 -11.254 5.206 1.00 0.00 H new ATOM 1411 N LEU A 457 -1.418 -13.185 6.258 1.00 0.00 N ATOM 1412 CA LEU A 457 -1.920 -14.400 6.892 1.00 0.00 C ATOM 1413 C LEU A 457 -1.084 -15.612 6.490 1.00 0.00 C ATOM 1414 O LEU A 457 -0.104 -15.430 5.737 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.387 -14.625 6.518 1.00 0.00 C ATOM 1416 CG LEU A 457 -4.361 -14.624 7.698 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -5.661 -13.932 7.319 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -4.631 -16.047 8.166 1.00 0.00 C ATOM 1419 OXT LEU A 457 -1.415 -16.731 6.932 1.00 0.00 O ATOM 0 H LEU A 457 -1.177 -12.438 6.910 1.00 0.00 H new ATOM 0 HA LEU A 457 -1.843 -14.275 7.972 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -3.690 -13.849 5.815 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -3.472 -15.579 5.997 1.00 0.00 H new ATOM 0 HG LEU A 457 -3.905 -14.071 8.519 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -6.340 -13.942 8.171 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -5.454 -12.901 7.032 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -6.122 -14.456 6.482 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -5.326 -16.028 9.006 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -5.065 -16.623 7.349 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -3.696 -16.511 8.479 1.00 0.00 H new