USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 667 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 389 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.0619) USER MOD Set 1.2: A 415 MET CE :methyl -116:sc= -0.0324 (180deg=-0.659) USER MOD Single : A 379 SER OG : rot 35:sc= -0.729 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=-0.0079) USER MOD Single : A 391 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 392 TYR OH : rot -179:sc= -0.898 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot -27:sc= 0.694 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 180:sc= 0 USER MOD Single : A 417 THR OG1 : rot -86:sc= 0.813 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 428 THR OG1 : rot 180:sc= 0 USER MOD Single : A 431 GLN : amide:sc= -0.129 K(o=-0.13,f=-0.76) 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+ 176:sc= 0 (180deg=-0.0146) 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= -0.149 X(o=-0.15,f=-0.025) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ 170:sc= 0.486 (180deg=0.459) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 0.462 17.150 2.065 1.00 0.00 N ATOM 44 CA SER A 379 -0.481 16.228 1.442 1.00 0.00 C ATOM 45 C SER A 379 -0.563 14.917 2.226 1.00 0.00 C ATOM 46 O SER A 379 -1.191 13.957 1.775 1.00 0.00 O ATOM 47 CB SER A 379 -0.073 15.946 -0.005 1.00 0.00 C ATOM 48 OG SER A 379 -0.616 16.916 -0.886 1.00 0.00 O ATOM 0 HA SER A 379 -1.465 16.697 1.449 1.00 0.00 H new ATOM 0 HB2 SER A 379 1.014 15.944 -0.086 1.00 0.00 H new ATOM 0 HB3 SER A 379 -0.416 14.953 -0.296 1.00 0.00 H new ATOM 0 HG SER A 379 -0.634 17.789 -0.441 1.00 0.00 H new ATOM 54 N ILE A 380 0.086 14.882 3.391 1.00 0.00 N ATOM 55 CA ILE A 380 0.105 13.693 4.243 1.00 0.00 C ATOM 56 C ILE A 380 -1.237 12.959 4.243 1.00 0.00 C ATOM 57 O ILE A 380 -1.281 11.735 4.341 1.00 0.00 O ATOM 58 CB ILE A 380 0.481 14.055 5.695 1.00 0.00 C ATOM 59 CG1 ILE A 380 0.663 12.787 6.533 1.00 0.00 C ATOM 60 CG2 ILE A 380 -0.576 14.959 6.311 1.00 0.00 C ATOM 61 CD1 ILE A 380 2.113 12.406 6.746 1.00 0.00 C ATOM 0 H ILE A 380 0.610 15.672 3.768 1.00 0.00 H new ATOM 0 HA ILE A 380 0.861 13.029 3.824 1.00 0.00 H new ATOM 0 HB ILE A 380 1.427 14.596 5.682 1.00 0.00 H new ATOM 0 HG12 ILE A 380 0.187 12.931 7.503 1.00 0.00 H new ATOM 0 HG13 ILE A 380 0.147 11.961 6.044 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -0.294 15.204 7.335 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.655 15.876 5.727 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.538 14.446 6.313 1.00 0.00 H new ATOM 0 HD11 ILE A 380 2.166 11.499 7.348 1.00 0.00 H new ATOM 0 HD12 ILE A 380 2.588 12.230 5.781 1.00 0.00 H new ATOM 0 HD13 ILE A 380 2.630 13.215 7.263 1.00 0.00 H new ATOM 73 N LYS A 381 -2.328 13.709 4.128 1.00 0.00 N ATOM 74 CA LYS A 381 -3.663 13.111 4.113 1.00 0.00 C ATOM 75 C LYS A 381 -3.709 11.912 3.167 1.00 0.00 C ATOM 76 O LYS A 381 -4.371 10.909 3.444 1.00 0.00 O ATOM 77 CB LYS A 381 -4.705 14.148 3.689 1.00 0.00 C ATOM 78 CG LYS A 381 -6.092 13.881 4.251 1.00 0.00 C ATOM 79 CD LYS A 381 -7.149 14.713 3.541 1.00 0.00 C ATOM 80 CE LYS A 381 -8.509 14.568 4.204 1.00 0.00 C ATOM 81 NZ LYS A 381 -8.606 15.377 5.453 1.00 0.00 N ATOM 0 H LYS A 381 -2.317 14.725 4.044 1.00 0.00 H new ATOM 0 HA LYS A 381 -3.892 12.767 5.122 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -4.375 15.135 4.012 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -4.761 14.171 2.601 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -6.330 12.822 4.148 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -6.104 14.108 5.317 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.851 15.762 3.544 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -7.217 14.404 2.498 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -9.288 14.880 3.508 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -8.690 13.518 4.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -9.548 15.252 5.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -7.879 15.063 6.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -8.458 16.382 5.228 1.00 0.00 H new ATOM 95 N LYS A 382 -2.993 12.024 2.053 1.00 0.00 N ATOM 96 CA LYS A 382 -2.940 10.955 1.064 1.00 0.00 C ATOM 97 C LYS A 382 -2.207 9.736 1.614 1.00 0.00 C ATOM 98 O LYS A 382 -2.737 8.624 1.598 1.00 0.00 O ATOM 99 CB LYS A 382 -2.254 11.444 -0.212 1.00 0.00 C ATOM 100 CG LYS A 382 -3.200 12.127 -1.187 1.00 0.00 C ATOM 101 CD LYS A 382 -3.113 13.641 -1.083 1.00 0.00 C ATOM 102 CE LYS A 382 -4.433 14.302 -1.446 1.00 0.00 C ATOM 103 NZ LYS A 382 -5.197 14.717 -0.237 1.00 0.00 N ATOM 0 H LYS A 382 -2.440 12.847 1.813 1.00 0.00 H new ATOM 0 HA LYS A 382 -3.964 10.664 0.829 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -1.458 12.139 0.056 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -1.783 10.596 -0.709 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -2.961 11.817 -2.204 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -4.223 11.806 -0.988 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -2.832 13.921 -0.068 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.328 14.007 -1.744 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -4.242 15.174 -2.072 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -5.035 13.611 -2.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -6.090 15.163 -0.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -5.401 13.882 0.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -4.634 15.396 0.314 1.00 0.00 H new ATOM 117 N ILE A 383 -0.985 9.947 2.099 1.00 0.00 N ATOM 118 CA ILE A 383 -0.189 8.854 2.648 1.00 0.00 C ATOM 119 C ILE A 383 -0.916 8.179 3.809 1.00 0.00 C ATOM 120 O ILE A 383 -0.756 6.981 4.041 1.00 0.00 O ATOM 121 CB ILE A 383 1.212 9.330 3.106 1.00 0.00 C ATOM 122 CG1 ILE A 383 1.149 10.028 4.468 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.821 10.258 2.062 1.00 0.00 C ATOM 124 CD1 ILE A 383 1.719 9.197 5.598 1.00 0.00 C ATOM 0 H ILE A 383 -0.528 10.859 2.123 1.00 0.00 H new ATOM 0 HA ILE A 383 -0.051 8.129 1.846 1.00 0.00 H new ATOM 0 HB ILE A 383 1.846 8.450 3.212 1.00 0.00 H new ATOM 0 HG12 ILE A 383 1.693 10.971 4.410 1.00 0.00 H new ATOM 0 HG13 ILE A 383 0.111 10.273 4.695 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.806 10.585 2.396 1.00 0.00 H new ATOM 0 HG22 ILE A 383 1.917 9.727 1.115 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.176 11.127 1.927 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.642 9.752 6.533 1.00 0.00 H new ATOM 0 HD12 ILE A 383 1.160 8.265 5.682 1.00 0.00 H new ATOM 0 HD13 ILE A 383 2.766 8.974 5.393 1.00 0.00 H new ATOM 136 N ILE A 384 -1.728 8.952 4.526 1.00 0.00 N ATOM 137 CA ILE A 384 -2.490 8.423 5.650 1.00 0.00 C ATOM 138 C ILE A 384 -3.588 7.491 5.153 1.00 0.00 C ATOM 139 O ILE A 384 -3.685 6.342 5.587 1.00 0.00 O ATOM 140 CB ILE A 384 -3.119 9.553 6.490 1.00 0.00 C ATOM 141 CG1 ILE A 384 -2.037 10.513 6.987 1.00 0.00 C ATOM 142 CG2 ILE A 384 -3.898 8.977 7.664 1.00 0.00 C ATOM 143 CD1 ILE A 384 -2.550 11.907 7.273 1.00 0.00 C ATOM 0 H ILE A 384 -1.874 9.946 4.348 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.797 7.869 6.283 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.812 10.108 5.857 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -1.590 10.106 7.894 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.245 10.572 6.241 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -4.334 9.790 8.245 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -4.692 8.330 7.291 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -3.226 8.398 8.298 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -1.728 12.533 7.621 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -2.970 12.334 6.362 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -3.321 11.860 8.042 1.00 0.00 H new ATOM 155 N HIS A 385 -4.407 7.988 4.228 1.00 0.00 N ATOM 156 CA HIS A 385 -5.489 7.191 3.663 1.00 0.00 C ATOM 157 C HIS A 385 -4.949 5.872 3.122 1.00 0.00 C ATOM 158 O HIS A 385 -5.433 4.794 3.475 1.00 0.00 O ATOM 159 CB HIS A 385 -6.196 7.964 2.548 1.00 0.00 C ATOM 160 CG HIS A 385 -7.642 7.607 2.394 1.00 0.00 C ATOM 161 ND1 HIS A 385 -8.137 6.927 1.301 1.00 0.00 N ATOM 162 CD2 HIS A 385 -8.702 7.839 3.205 1.00 0.00 C ATOM 163 CE1 HIS A 385 -9.440 6.757 1.445 1.00 0.00 C ATOM 164 NE2 HIS A 385 -9.807 7.301 2.591 1.00 0.00 N ATOM 0 H HIS A 385 -4.341 8.936 3.856 1.00 0.00 H new ATOM 0 HA HIS A 385 -6.209 6.979 4.453 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -6.114 9.032 2.749 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.682 7.777 1.605 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -8.682 8.351 4.156 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -10.093 6.258 0.745 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -10.757 7.319 2.961 1.00 0.00 H new ATOM 173 N VAL A 386 -3.928 5.963 2.274 1.00 0.00 N ATOM 174 CA VAL A 386 -3.312 4.777 1.699 1.00 0.00 C ATOM 175 C VAL A 386 -2.716 3.904 2.795 1.00 0.00 C ATOM 176 O VAL A 386 -2.780 2.677 2.728 1.00 0.00 O ATOM 177 CB VAL A 386 -2.212 5.139 0.682 1.00 0.00 C ATOM 178 CG1 VAL A 386 -2.800 5.918 -0.485 1.00 0.00 C ATOM 179 CG2 VAL A 386 -1.100 5.932 1.353 1.00 0.00 C ATOM 0 H VAL A 386 -3.513 6.844 1.972 1.00 0.00 H new ATOM 0 HA VAL A 386 -4.096 4.229 1.176 1.00 0.00 H new ATOM 0 HB VAL A 386 -1.784 4.214 0.295 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -2.009 6.165 -1.193 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -3.556 5.311 -0.983 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -3.257 6.836 -0.116 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.334 6.178 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.510 6.852 1.771 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.659 5.336 2.152 1.00 0.00 H new ATOM 189 N LEU A 387 -2.144 4.545 3.815 1.00 0.00 N ATOM 190 CA LEU A 387 -1.549 3.821 4.933 1.00 0.00 C ATOM 191 C LEU A 387 -2.562 2.856 5.537 1.00 0.00 C ATOM 192 O LEU A 387 -2.284 1.667 5.697 1.00 0.00 O ATOM 193 CB LEU A 387 -1.054 4.801 6.001 1.00 0.00 C ATOM 194 CG LEU A 387 0.469 4.891 6.144 1.00 0.00 C ATOM 195 CD1 LEU A 387 1.016 3.633 6.804 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.124 5.115 4.787 1.00 0.00 C ATOM 0 H LEU A 387 -2.081 5.560 3.888 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.698 3.250 4.561 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.441 5.793 5.769 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.477 4.511 6.963 1.00 0.00 H new ATOM 0 HG LEU A 387 0.705 5.744 6.780 1.00 0.00 H new ATOM 0 HD11 LEU A 387 2.099 3.713 6.898 1.00 0.00 H new ATOM 0 HD12 LEU A 387 0.573 3.519 7.793 1.00 0.00 H new ATOM 0 HD13 LEU A 387 0.768 2.765 6.194 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.205 5.176 4.911 1.00 0.00 H new ATOM 0 HD22 LEU A 387 0.881 4.285 4.124 1.00 0.00 H new ATOM 0 HD23 LEU A 387 0.755 6.045 4.354 1.00 0.00 H new ATOM 208 N GLU A 388 -3.745 3.372 5.854 1.00 0.00 N ATOM 209 CA GLU A 388 -4.805 2.550 6.422 1.00 0.00 C ATOM 210 C GLU A 388 -5.203 1.459 5.436 1.00 0.00 C ATOM 211 O GLU A 388 -5.317 0.286 5.799 1.00 0.00 O ATOM 212 CB GLU A 388 -6.020 3.413 6.771 1.00 0.00 C ATOM 213 CG GLU A 388 -5.686 4.604 7.655 1.00 0.00 C ATOM 214 CD GLU A 388 -5.809 4.287 9.132 1.00 0.00 C ATOM 215 OE1 GLU A 388 -5.415 3.172 9.534 1.00 0.00 O ATOM 216 OE2 GLU A 388 -6.299 5.154 9.886 1.00 0.00 O ATOM 0 H GLU A 388 -3.993 4.353 5.727 1.00 0.00 H new ATOM 0 HA GLU A 388 -4.435 2.085 7.336 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -6.477 3.772 5.849 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.762 2.794 7.275 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -4.670 4.936 7.442 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.350 5.432 7.408 1.00 0.00 H new ATOM 223 N LYS A 389 -5.400 1.854 4.180 1.00 0.00 N ATOM 224 CA LYS A 389 -5.772 0.909 3.132 1.00 0.00 C ATOM 225 C LYS A 389 -4.732 -0.203 3.025 1.00 0.00 C ATOM 226 O LYS A 389 -5.072 -1.386 2.997 1.00 0.00 O ATOM 227 CB LYS A 389 -5.912 1.632 1.790 1.00 0.00 C ATOM 228 CG LYS A 389 -7.200 1.300 1.054 1.00 0.00 C ATOM 229 CD LYS A 389 -7.155 -0.096 0.453 1.00 0.00 C ATOM 230 CE LYS A 389 -7.904 -1.098 1.318 1.00 0.00 C ATOM 231 NZ LYS A 389 -9.379 -0.898 1.252 1.00 0.00 N ATOM 0 H LYS A 389 -5.308 2.820 3.865 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.733 0.464 3.392 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.867 2.708 1.959 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -5.064 1.373 1.156 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -8.043 1.374 1.742 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -7.368 2.032 0.264 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -7.591 -0.078 -0.546 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -6.118 -0.413 0.342 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -7.660 -2.110 0.995 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -7.571 -1.005 2.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.861 -1.749 1.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -9.645 -0.080 1.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -9.662 -0.725 0.266 1.00 0.00 H new ATOM 245 N VAL A 390 -3.460 0.187 2.980 1.00 0.00 N ATOM 246 CA VAL A 390 -2.370 -0.775 2.892 1.00 0.00 C ATOM 247 C VAL A 390 -2.377 -1.696 4.106 1.00 0.00 C ATOM 248 O VAL A 390 -2.182 -2.905 3.982 1.00 0.00 O ATOM 249 CB VAL A 390 -1.000 -0.075 2.791 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.116 -1.096 2.615 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.996 0.931 1.648 1.00 0.00 C ATOM 0 H VAL A 390 -3.161 1.162 3.003 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.525 -1.359 1.985 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.822 0.464 3.722 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.074 -0.580 2.546 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.129 -1.772 3.470 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -0.055 -1.668 1.703 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -0.021 1.415 1.593 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -1.199 0.416 0.709 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.765 1.683 1.823 1.00 0.00 H new ATOM 261 N GLN A 391 -2.618 -1.116 5.279 1.00 0.00 N ATOM 262 CA GLN A 391 -2.667 -1.887 6.516 1.00 0.00 C ATOM 263 C GLN A 391 -3.664 -3.032 6.380 1.00 0.00 C ATOM 264 O GLN A 391 -3.325 -4.198 6.600 1.00 0.00 O ATOM 265 CB GLN A 391 -3.057 -0.990 7.692 1.00 0.00 C ATOM 266 CG GLN A 391 -2.347 -1.340 8.989 1.00 0.00 C ATOM 267 CD GLN A 391 -2.707 -0.402 10.124 1.00 0.00 C ATOM 268 OE1 GLN A 391 -3.496 0.527 9.950 1.00 0.00 O ATOM 269 NE2 GLN A 391 -2.130 -0.642 11.296 1.00 0.00 N ATOM 0 H GLN A 391 -2.782 -0.116 5.398 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.676 -2.299 6.707 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.837 0.046 7.436 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -4.134 -1.058 7.848 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -2.600 -2.361 9.273 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.269 -1.312 8.828 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -1.482 -1.423 11.395 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -2.335 -0.045 12.097 1.00 0.00 H new ATOM 278 N TYR A 392 -4.892 -2.695 5.993 1.00 0.00 N ATOM 279 CA TYR A 392 -5.931 -3.699 5.802 1.00 0.00 C ATOM 280 C TYR A 392 -5.466 -4.736 4.786 1.00 0.00 C ATOM 281 O TYR A 392 -5.623 -5.941 4.991 1.00 0.00 O ATOM 282 CB TYR A 392 -7.230 -3.046 5.328 1.00 0.00 C ATOM 283 CG TYR A 392 -7.578 -1.775 6.069 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.486 -1.706 7.453 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.998 -0.643 5.382 1.00 0.00 C ATOM 286 CE1 TYR A 392 -7.803 -0.544 8.132 1.00 0.00 C ATOM 287 CE2 TYR A 392 -8.317 0.522 6.054 1.00 0.00 C ATOM 288 CZ TYR A 392 -8.217 0.565 7.430 1.00 0.00 C ATOM 289 OH TYR A 392 -8.534 1.723 8.103 1.00 0.00 O ATOM 0 H TYR A 392 -5.190 -1.737 5.807 1.00 0.00 H new ATOM 0 HA TYR A 392 -6.121 -4.191 6.756 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -7.147 -2.825 4.264 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -8.047 -3.758 5.443 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.162 -2.574 8.008 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -8.077 -0.674 4.305 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -7.726 -0.507 9.209 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.643 1.394 5.506 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.822 2.406 7.462 1.00 0.00 H new ATOM 299 N LEU A 393 -4.874 -4.253 3.696 1.00 0.00 N ATOM 300 CA LEU A 393 -4.364 -5.131 2.652 1.00 0.00 C ATOM 301 C LEU A 393 -3.318 -6.078 3.228 1.00 0.00 C ATOM 302 O LEU A 393 -3.318 -7.273 2.934 1.00 0.00 O ATOM 303 CB LEU A 393 -3.757 -4.306 1.513 1.00 0.00 C ATOM 304 CG LEU A 393 -4.632 -4.178 0.267 1.00 0.00 C ATOM 305 CD1 LEU A 393 -4.470 -2.802 -0.359 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.287 -5.268 -0.738 1.00 0.00 C ATOM 0 H LEU A 393 -4.737 -3.259 3.515 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.192 -5.719 2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.536 -3.306 1.887 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.807 -4.756 1.226 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.674 -4.299 0.562 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -5.100 -2.729 -1.245 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -4.765 -2.038 0.360 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -3.428 -2.651 -0.642 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -4.919 -5.163 -1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.240 -5.177 -1.029 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.454 -6.246 -0.286 1.00 0.00 H new ATOM 318 N GLU A 394 -2.436 -5.534 4.062 1.00 0.00 N ATOM 319 CA GLU A 394 -1.391 -6.331 4.693 1.00 0.00 C ATOM 320 C GLU A 394 -2.012 -7.484 5.469 1.00 0.00 C ATOM 321 O GLU A 394 -1.598 -8.636 5.331 1.00 0.00 O ATOM 322 CB GLU A 394 -0.549 -5.462 5.631 1.00 0.00 C ATOM 323 CG GLU A 394 0.493 -4.623 4.909 1.00 0.00 C ATOM 324 CD GLU A 394 1.583 -4.124 5.837 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.247 -3.527 6.881 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.774 -4.329 5.518 1.00 0.00 O ATOM 0 H GLU A 394 -2.425 -4.546 4.316 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.742 -6.734 3.915 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -1.210 -4.802 6.193 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.048 -6.104 6.356 1.00 0.00 H new ATOM 0 HG2 GLU A 394 0.942 -5.215 4.112 1.00 0.00 H new ATOM 0 HG3 GLU A 394 0.005 -3.771 4.437 1.00 0.00 H new ATOM 333 N GLN A 395 -3.023 -7.168 6.275 1.00 0.00 N ATOM 334 CA GLN A 395 -3.716 -8.183 7.059 1.00 0.00 C ATOM 335 C GLN A 395 -4.276 -9.262 6.139 1.00 0.00 C ATOM 336 O GLN A 395 -4.129 -10.458 6.402 1.00 0.00 O ATOM 337 CB GLN A 395 -4.846 -7.549 7.873 1.00 0.00 C ATOM 338 CG GLN A 395 -4.405 -7.047 9.237 1.00 0.00 C ATOM 339 CD GLN A 395 -5.576 -6.757 10.156 1.00 0.00 C ATOM 340 OE1 GLN A 395 -6.703 -6.561 9.703 1.00 0.00 O ATOM 341 NE2 GLN A 395 -5.312 -6.726 11.459 1.00 0.00 N ATOM 0 H GLN A 395 -3.378 -6.220 6.401 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.004 -8.638 7.747 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -5.267 -6.718 7.308 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.643 -8.281 8.005 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.758 -7.790 9.702 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -3.812 -6.141 9.113 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -4.362 -6.894 11.791 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -6.059 -6.534 12.126 1.00 0.00 H new ATOM 350 N GLU A 396 -4.905 -8.830 5.050 1.00 0.00 N ATOM 351 CA GLU A 396 -5.475 -9.759 4.080 1.00 0.00 C ATOM 352 C GLU A 396 -4.379 -10.636 3.488 1.00 0.00 C ATOM 353 O GLU A 396 -4.532 -11.852 3.384 1.00 0.00 O ATOM 354 CB GLU A 396 -6.193 -8.998 2.964 1.00 0.00 C ATOM 355 CG GLU A 396 -7.005 -7.811 3.456 1.00 0.00 C ATOM 356 CD GLU A 396 -8.402 -7.774 2.870 1.00 0.00 C ATOM 357 OE1 GLU A 396 -9.084 -8.821 2.895 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.816 -6.700 2.386 1.00 0.00 O ATOM 0 H GLU A 396 -5.033 -7.845 4.818 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.200 -10.391 4.593 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.455 -8.648 2.243 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -6.854 -9.685 2.436 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -7.073 -7.848 4.543 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.484 -6.889 3.200 1.00 0.00 H new ATOM 365 N VAL A 397 -3.269 -10.009 3.109 1.00 0.00 N ATOM 366 CA VAL A 397 -2.140 -10.734 2.537 1.00 0.00 C ATOM 367 C VAL A 397 -1.699 -11.862 3.463 1.00 0.00 C ATOM 368 O VAL A 397 -1.481 -12.992 3.024 1.00 0.00 O ATOM 369 CB VAL A 397 -0.942 -9.803 2.273 1.00 0.00 C ATOM 370 CG1 VAL A 397 0.162 -10.545 1.536 1.00 0.00 C ATOM 371 CG2 VAL A 397 -1.380 -8.569 1.495 1.00 0.00 C ATOM 0 H VAL A 397 -3.128 -9.002 3.188 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.476 -11.149 1.587 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.546 -9.474 3.234 1.00 0.00 H new ATOM 0 HG11 VAL A 397 0.999 -9.870 1.359 1.00 0.00 H new ATOM 0 HG12 VAL A 397 0.498 -11.389 2.138 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -0.218 -10.909 0.582 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -0.518 -7.925 1.319 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.806 -8.874 0.539 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -2.129 -8.024 2.069 1.00 0.00 H new ATOM 381 N GLU A 398 -1.580 -11.547 4.748 1.00 0.00 N ATOM 382 CA GLU A 398 -1.177 -12.534 5.741 1.00 0.00 C ATOM 383 C GLU A 398 -2.215 -13.648 5.834 1.00 0.00 C ATOM 384 O GLU A 398 -1.870 -14.824 5.942 1.00 0.00 O ATOM 385 CB GLU A 398 -0.994 -11.872 7.108 1.00 0.00 C ATOM 386 CG GLU A 398 0.154 -12.453 7.916 1.00 0.00 C ATOM 387 CD GLU A 398 -0.118 -12.442 9.407 1.00 0.00 C ATOM 388 OE1 GLU A 398 -0.848 -11.540 9.872 1.00 0.00 O ATOM 389 OE2 GLU A 398 0.396 -13.336 10.112 1.00 0.00 O ATOM 0 H GLU A 398 -1.757 -10.616 5.126 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.225 -12.966 5.431 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -0.824 -10.805 6.966 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -1.917 -11.974 7.678 1.00 0.00 H new ATOM 0 HG2 GLU A 398 0.340 -13.477 7.592 1.00 0.00 H new ATOM 0 HG3 GLU A 398 1.061 -11.885 7.712 1.00 0.00 H new ATOM 396 N GLU A 399 -3.488 -13.265 5.786 1.00 0.00 N ATOM 397 CA GLU A 399 -4.580 -14.230 5.859 1.00 0.00 C ATOM 398 C GLU A 399 -4.820 -14.899 4.505 1.00 0.00 C ATOM 399 O GLU A 399 -5.592 -15.854 4.406 1.00 0.00 O ATOM 400 CB GLU A 399 -5.861 -13.543 6.335 1.00 0.00 C ATOM 401 CG GLU A 399 -5.839 -13.167 7.807 1.00 0.00 C ATOM 402 CD GLU A 399 -7.207 -12.775 8.329 1.00 0.00 C ATOM 403 OE1 GLU A 399 -7.734 -11.731 7.890 1.00 0.00 O ATOM 404 OE2 GLU A 399 -7.752 -13.512 9.179 1.00 0.00 O ATOM 0 H GLU A 399 -3.788 -12.294 5.697 1.00 0.00 H new ATOM 0 HA GLU A 399 -4.298 -15.002 6.575 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -6.023 -12.643 5.741 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -6.708 -14.204 6.150 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -5.460 -14.008 8.387 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -5.146 -12.339 7.956 1.00 0.00 H new ATOM 411 N PHE A 400 -4.159 -14.393 3.462 1.00 0.00 N ATOM 412 CA PHE A 400 -4.300 -14.937 2.112 1.00 0.00 C ATOM 413 C PHE A 400 -4.282 -16.465 2.125 1.00 0.00 C ATOM 414 O PHE A 400 -3.501 -17.082 2.850 1.00 0.00 O ATOM 415 CB PHE A 400 -3.179 -14.402 1.213 1.00 0.00 C ATOM 416 CG PHE A 400 -3.205 -14.953 -0.184 1.00 0.00 C ATOM 417 CD1 PHE A 400 -4.266 -14.685 -1.033 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.161 -15.738 -0.649 1.00 0.00 C ATOM 419 CE1 PHE A 400 -4.288 -15.192 -2.318 1.00 0.00 C ATOM 420 CE2 PHE A 400 -2.177 -16.247 -1.934 1.00 0.00 C ATOM 421 CZ PHE A 400 -3.243 -15.973 -2.770 1.00 0.00 C ATOM 0 H PHE A 400 -3.517 -13.603 3.529 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.263 -14.617 1.715 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.251 -13.315 1.166 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.217 -14.638 1.668 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -5.085 -14.073 -0.687 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.326 -15.954 0.000 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -5.123 -14.977 -2.969 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.358 -16.858 -2.284 1.00 0.00 H new ATOM 0 HZ PHE A 400 -3.259 -16.369 -3.775 1.00 0.00 H new ATOM 431 N VAL A 401 -5.155 -17.066 1.320 1.00 0.00 N ATOM 432 CA VAL A 401 -5.253 -18.520 1.237 1.00 0.00 C ATOM 433 C VAL A 401 -3.883 -19.164 1.015 1.00 0.00 C ATOM 434 O VAL A 401 -3.526 -20.129 1.692 1.00 0.00 O ATOM 435 CB VAL A 401 -6.207 -18.951 0.105 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.753 -18.378 -1.227 1.00 0.00 C ATOM 437 CG2 VAL A 401 -6.315 -20.468 0.034 1.00 0.00 C ATOM 0 H VAL A 401 -5.806 -16.566 0.714 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.652 -18.863 2.192 1.00 0.00 H new ATOM 0 HB VAL A 401 -7.198 -18.553 0.326 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.440 -18.694 -2.012 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.743 -17.290 -1.170 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.750 -18.739 -1.455 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -6.993 -20.747 -0.772 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -5.330 -20.894 -0.157 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.699 -20.850 0.980 1.00 0.00 H new ATOM 447 N GLY A 402 -3.122 -18.626 0.069 1.00 0.00 N ATOM 448 CA GLY A 402 -1.805 -19.164 -0.215 1.00 0.00 C ATOM 449 C GLY A 402 -1.520 -19.258 -1.701 1.00 0.00 C ATOM 450 O GLY A 402 -0.429 -18.912 -2.154 1.00 0.00 O ATOM 0 H GLY A 402 -3.393 -17.828 -0.506 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -1.050 -18.534 0.257 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.718 -20.155 0.231 1.00 0.00 H new ATOM 454 N LYS A 403 -2.504 -19.727 -2.462 1.00 0.00 N ATOM 455 CA LYS A 403 -2.352 -19.864 -3.906 1.00 0.00 C ATOM 456 C LYS A 403 -3.101 -18.754 -4.636 1.00 0.00 C ATOM 457 O LYS A 403 -4.180 -18.337 -4.213 1.00 0.00 O ATOM 458 CB LYS A 403 -2.864 -21.229 -4.368 1.00 0.00 C ATOM 459 CG LYS A 403 -2.063 -21.823 -5.515 1.00 0.00 C ATOM 460 CD LYS A 403 -0.657 -22.201 -5.076 1.00 0.00 C ATOM 461 CE LYS A 403 -0.209 -23.509 -5.708 1.00 0.00 C ATOM 462 NZ LYS A 403 -0.619 -24.688 -4.896 1.00 0.00 N ATOM 0 H LYS A 403 -3.413 -20.018 -2.103 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.292 -19.783 -4.145 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -2.843 -21.920 -3.525 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -3.905 -21.132 -4.675 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -2.575 -22.705 -5.899 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -2.009 -21.105 -6.333 1.00 0.00 H new ATOM 0 HD2 LYS A 403 0.037 -21.407 -5.351 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -0.625 -22.291 -3.990 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -0.633 -23.592 -6.709 1.00 0.00 H new ATOM 0 HE3 LYS A 403 0.875 -23.505 -5.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -0.295 -25.560 -5.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -0.194 -24.622 -3.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -1.655 -24.707 -4.810 1.00 0.00 H new ATOM 476 N LYS A 404 -2.522 -18.276 -5.732 1.00 0.00 N ATOM 477 CA LYS A 404 -3.134 -17.211 -6.519 1.00 0.00 C ATOM 478 C LYS A 404 -4.321 -17.732 -7.325 1.00 0.00 C ATOM 479 O LYS A 404 -4.332 -17.656 -8.554 1.00 0.00 O ATOM 480 CB LYS A 404 -2.100 -16.582 -7.456 1.00 0.00 C ATOM 481 CG LYS A 404 -1.537 -17.555 -8.481 1.00 0.00 C ATOM 482 CD LYS A 404 -1.969 -17.193 -9.892 1.00 0.00 C ATOM 483 CE LYS A 404 -2.291 -18.433 -10.712 1.00 0.00 C ATOM 484 NZ LYS A 404 -2.950 -18.089 -12.004 1.00 0.00 N ATOM 0 H LYS A 404 -1.629 -18.609 -6.096 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.499 -16.451 -5.828 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -2.558 -15.742 -7.978 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -1.280 -16.179 -6.861 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -0.449 -17.557 -8.422 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -1.871 -18.566 -8.246 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -2.845 -16.545 -9.851 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -1.177 -16.627 -10.382 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -1.373 -18.987 -10.909 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -2.942 -19.090 -10.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -3.153 -18.961 -12.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -3.839 -17.583 -11.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -2.318 -17.483 -12.565 1.00 0.00 H new ATOM 498 N THR A 405 -5.320 -18.259 -6.626 1.00 0.00 N ATOM 499 CA THR A 405 -6.514 -18.789 -7.278 1.00 0.00 C ATOM 500 C THR A 405 -7.791 -18.321 -6.576 1.00 0.00 C ATOM 501 O THR A 405 -8.896 -18.669 -6.992 1.00 0.00 O ATOM 502 CB THR A 405 -6.466 -20.318 -7.300 1.00 0.00 C ATOM 503 OG1 THR A 405 -7.569 -20.843 -8.021 1.00 0.00 O ATOM 504 CG2 THR A 405 -6.484 -20.938 -5.920 1.00 0.00 C ATOM 0 H THR A 405 -5.328 -18.331 -5.609 1.00 0.00 H new ATOM 0 HA THR A 405 -6.531 -18.410 -8.300 1.00 0.00 H new ATOM 0 HB THR A 405 -5.521 -20.571 -7.781 1.00 0.00 H new ATOM 0 HG1 THR A 405 -8.317 -20.211 -7.981 1.00 0.00 H new ATOM 0 HG21 THR A 405 -6.448 -22.024 -6.008 1.00 0.00 H new ATOM 0 HG22 THR A 405 -5.619 -20.591 -5.354 1.00 0.00 H new ATOM 0 HG23 THR A 405 -7.398 -20.646 -5.402 1.00 0.00 H new ATOM 512 N ASP A 406 -7.638 -17.532 -5.515 1.00 0.00 N ATOM 513 CA ASP A 406 -8.782 -17.026 -4.767 1.00 0.00 C ATOM 514 C ASP A 406 -9.036 -15.555 -5.093 1.00 0.00 C ATOM 515 O ASP A 406 -8.156 -14.862 -5.603 1.00 0.00 O ATOM 516 CB ASP A 406 -8.550 -17.201 -3.264 1.00 0.00 C ATOM 517 CG ASP A 406 -9.708 -16.682 -2.432 1.00 0.00 C ATOM 518 OD1 ASP A 406 -10.663 -17.453 -2.200 1.00 0.00 O ATOM 519 OD2 ASP A 406 -9.659 -15.507 -2.012 1.00 0.00 O ATOM 0 H ASP A 406 -6.732 -17.230 -5.155 1.00 0.00 H new ATOM 0 HA ASP A 406 -9.662 -17.599 -5.059 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -8.394 -18.257 -3.044 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -7.638 -16.678 -2.977 1.00 0.00 H new ATOM 524 N LYS A 407 -10.244 -15.087 -4.794 1.00 0.00 N ATOM 525 CA LYS A 407 -10.611 -13.700 -5.054 1.00 0.00 C ATOM 526 C LYS A 407 -9.687 -12.739 -4.311 1.00 0.00 C ATOM 527 O LYS A 407 -9.485 -11.599 -4.738 1.00 0.00 O ATOM 528 CB LYS A 407 -12.063 -13.450 -4.642 1.00 0.00 C ATOM 529 CG LYS A 407 -12.403 -13.985 -3.260 1.00 0.00 C ATOM 530 CD LYS A 407 -13.218 -15.267 -3.342 1.00 0.00 C ATOM 531 CE LYS A 407 -13.052 -16.112 -2.090 1.00 0.00 C ATOM 532 NZ LYS A 407 -14.168 -15.904 -1.126 1.00 0.00 N ATOM 0 H LYS A 407 -10.984 -15.648 -4.372 1.00 0.00 H new ATOM 0 HA LYS A 407 -10.506 -13.519 -6.124 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -12.260 -12.378 -4.666 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -12.725 -13.912 -5.375 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -11.484 -14.172 -2.705 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -12.963 -13.232 -2.705 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -14.271 -15.022 -3.480 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -12.907 -15.842 -4.214 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -13.003 -17.165 -2.367 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -12.106 -15.865 -1.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -14.017 -16.498 -0.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -14.199 -14.904 -0.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -15.069 -16.164 -1.576 1.00 0.00 H new ATOM 546 N ALA A 408 -9.128 -13.206 -3.199 1.00 0.00 N ATOM 547 CA ALA A 408 -8.225 -12.390 -2.395 1.00 0.00 C ATOM 548 C ALA A 408 -7.094 -11.816 -3.243 1.00 0.00 C ATOM 549 O ALA A 408 -6.988 -10.604 -3.411 1.00 0.00 O ATOM 550 CB ALA A 408 -7.660 -13.209 -1.245 1.00 0.00 C ATOM 0 H ALA A 408 -9.285 -14.146 -2.834 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.796 -11.555 -1.989 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -6.988 -12.589 -0.652 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.476 -13.563 -0.615 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -7.111 -14.063 -1.642 1.00 0.00 H new ATOM 556 N TYR A 409 -6.253 -12.697 -3.776 1.00 0.00 N ATOM 557 CA TYR A 409 -5.125 -12.277 -4.607 1.00 0.00 C ATOM 558 C TYR A 409 -5.555 -11.232 -5.634 1.00 0.00 C ATOM 559 O TYR A 409 -4.826 -10.276 -5.900 1.00 0.00 O ATOM 560 CB TYR A 409 -4.513 -13.484 -5.315 1.00 0.00 C ATOM 561 CG TYR A 409 -3.081 -13.271 -5.747 1.00 0.00 C ATOM 562 CD1 TYR A 409 -2.025 -13.582 -4.899 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.784 -12.759 -7.004 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.714 -13.389 -5.292 1.00 0.00 C ATOM 565 CE2 TYR A 409 -1.475 -12.563 -7.404 1.00 0.00 C ATOM 566 CZ TYR A 409 -0.444 -12.879 -6.544 1.00 0.00 C ATOM 567 OH TYR A 409 0.860 -12.684 -6.938 1.00 0.00 O ATOM 0 H TYR A 409 -6.329 -13.706 -3.649 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.377 -11.826 -3.955 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.558 -14.346 -4.650 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -5.116 -13.725 -6.191 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.232 -13.981 -3.917 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -3.589 -12.510 -7.680 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.095 -13.637 -4.621 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -1.261 -12.165 -8.385 1.00 0.00 H new ATOM 0 HH TYR A 409 0.876 -12.320 -7.848 1.00 0.00 H new ATOM 577 N TRP A 410 -6.745 -11.410 -6.200 1.00 0.00 N ATOM 578 CA TRP A 410 -7.265 -10.468 -7.184 1.00 0.00 C ATOM 579 C TRP A 410 -7.398 -9.084 -6.563 1.00 0.00 C ATOM 580 O TRP A 410 -6.717 -8.138 -6.965 1.00 0.00 O ATOM 581 CB TRP A 410 -8.627 -10.927 -7.708 1.00 0.00 C ATOM 582 CG TRP A 410 -8.641 -12.343 -8.194 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.562 -13.135 -8.462 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.801 -13.136 -8.474 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.980 -14.374 -8.891 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.351 -14.398 -8.906 1.00 0.00 C ATOM 587 CE3 TRP A 410 -11.176 -12.899 -8.398 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -10.229 -15.418 -9.260 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -12.046 -13.913 -8.749 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.570 -15.159 -9.176 1.00 0.00 C ATOM 0 H TRP A 410 -7.364 -12.194 -5.995 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.565 -10.426 -8.018 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -9.367 -10.817 -6.915 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.933 -10.270 -8.522 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.531 -12.833 -8.353 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.370 -15.148 -9.155 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.552 -11.941 -8.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.865 -16.380 -9.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -13.111 -13.742 -8.693 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -12.276 -15.931 -9.444 1.00 0.00 H new ATOM 601 N LEU A 411 -8.277 -8.978 -5.571 1.00 0.00 N ATOM 602 CA LEU A 411 -8.495 -7.714 -4.881 1.00 0.00 C ATOM 603 C LEU A 411 -7.202 -7.229 -4.230 1.00 0.00 C ATOM 604 O LEU A 411 -7.013 -6.031 -4.017 1.00 0.00 O ATOM 605 CB LEU A 411 -9.601 -7.855 -3.832 1.00 0.00 C ATOM 606 CG LEU A 411 -9.430 -9.016 -2.851 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.464 -8.638 -1.738 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.775 -9.427 -2.275 1.00 0.00 C ATOM 0 H LEU A 411 -8.848 -9.751 -5.229 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.811 -6.974 -5.616 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.660 -6.927 -3.264 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.554 -7.974 -4.347 1.00 0.00 H new ATOM 0 HG LEU A 411 -9.013 -9.866 -3.392 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -8.355 -9.477 -1.050 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.493 -8.392 -2.167 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -8.851 -7.774 -1.198 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.635 -10.254 -1.579 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.219 -8.582 -1.750 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -11.436 -9.740 -3.083 1.00 0.00 H new ATOM 620 N LEU A 412 -6.309 -8.169 -3.925 1.00 0.00 N ATOM 621 CA LEU A 412 -5.029 -7.839 -3.309 1.00 0.00 C ATOM 622 C LEU A 412 -4.196 -6.965 -4.243 1.00 0.00 C ATOM 623 O LEU A 412 -3.755 -5.880 -3.869 1.00 0.00 O ATOM 624 CB LEU A 412 -4.248 -9.118 -2.976 1.00 0.00 C ATOM 625 CG LEU A 412 -4.652 -9.835 -1.682 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.630 -10.902 -1.323 1.00 0.00 C ATOM 627 CD2 LEU A 412 -4.805 -8.843 -0.541 1.00 0.00 C ATOM 0 H LEU A 412 -6.450 -9.165 -4.095 1.00 0.00 H new ATOM 0 HA LEU A 412 -5.228 -7.291 -2.388 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.362 -9.816 -3.805 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -3.189 -8.867 -2.914 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.615 -10.318 -1.847 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -3.933 -11.401 -0.402 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -3.569 -11.634 -2.129 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.654 -10.438 -1.180 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -5.092 -9.374 0.367 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -3.858 -8.329 -0.377 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -5.575 -8.114 -0.794 1.00 0.00 H new ATOM 639 N GLU A 413 -3.983 -7.458 -5.459 1.00 0.00 N ATOM 640 CA GLU A 413 -3.197 -6.738 -6.455 1.00 0.00 C ATOM 641 C GLU A 413 -3.895 -5.456 -6.900 1.00 0.00 C ATOM 642 O GLU A 413 -3.287 -4.385 -6.918 1.00 0.00 O ATOM 643 CB GLU A 413 -2.934 -7.632 -7.667 1.00 0.00 C ATOM 644 CG GLU A 413 -1.672 -8.472 -7.540 1.00 0.00 C ATOM 645 CD GLU A 413 -0.518 -7.913 -8.348 1.00 0.00 C ATOM 646 OE1 GLU A 413 -0.417 -8.246 -9.549 1.00 0.00 O ATOM 647 OE2 GLU A 413 0.285 -7.143 -7.782 1.00 0.00 O ATOM 0 H GLU A 413 -4.345 -8.356 -5.779 1.00 0.00 H new ATOM 0 HA GLU A 413 -2.249 -6.464 -5.993 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -3.788 -8.294 -7.812 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -2.858 -7.009 -8.558 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -1.382 -8.530 -6.491 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -1.882 -9.490 -7.869 1.00 0.00 H new ATOM 654 N GLU A 414 -5.169 -5.566 -7.268 1.00 0.00 N ATOM 655 CA GLU A 414 -5.931 -4.403 -7.721 1.00 0.00 C ATOM 656 C GLU A 414 -5.894 -3.283 -6.684 1.00 0.00 C ATOM 657 O GLU A 414 -5.637 -2.124 -7.016 1.00 0.00 O ATOM 658 CB GLU A 414 -7.380 -4.801 -8.039 1.00 0.00 C ATOM 659 CG GLU A 414 -8.316 -4.770 -6.840 1.00 0.00 C ATOM 660 CD GLU A 414 -9.705 -5.280 -7.173 1.00 0.00 C ATOM 661 OE1 GLU A 414 -9.838 -6.045 -8.151 1.00 0.00 O ATOM 662 OE2 GLU A 414 -10.658 -4.913 -6.454 1.00 0.00 O ATOM 0 H GLU A 414 -5.693 -6.441 -7.262 1.00 0.00 H new ATOM 0 HA GLU A 414 -5.467 -4.029 -8.633 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -7.769 -4.131 -8.806 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.384 -5.806 -8.462 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -7.893 -5.375 -6.038 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -8.388 -3.749 -6.466 1.00 0.00 H new ATOM 669 N MET A 415 -6.149 -3.633 -5.428 1.00 0.00 N ATOM 670 CA MET A 415 -6.142 -2.654 -4.347 1.00 0.00 C ATOM 671 C MET A 415 -4.741 -2.086 -4.146 1.00 0.00 C ATOM 672 O MET A 415 -4.566 -0.877 -3.992 1.00 0.00 O ATOM 673 CB MET A 415 -6.646 -3.288 -3.049 1.00 0.00 C ATOM 674 CG MET A 415 -7.173 -2.279 -2.043 1.00 0.00 C ATOM 675 SD MET A 415 -8.972 -2.149 -2.065 1.00 0.00 S ATOM 676 CE MET A 415 -9.422 -3.499 -0.977 1.00 0.00 C ATOM 0 H MET A 415 -6.363 -4.586 -5.134 1.00 0.00 H new ATOM 0 HA MET A 415 -6.811 -1.838 -4.620 1.00 0.00 H new ATOM 0 HB2 MET A 415 -7.437 -4.000 -3.285 1.00 0.00 H new ATOM 0 HB3 MET A 415 -5.834 -3.854 -2.592 1.00 0.00 H new ATOM 0 HG2 MET A 415 -6.846 -2.564 -1.043 1.00 0.00 H new ATOM 0 HG3 MET A 415 -6.740 -1.301 -2.254 1.00 0.00 H new ATOM 0 HE1 MET A 415 -9.982 -4.247 -1.538 1.00 0.00 H new ATOM 0 HE2 MET A 415 -8.519 -3.952 -0.567 1.00 0.00 H new ATOM 0 HE3 MET A 415 -10.039 -3.120 -0.163 1.00 0.00 H new ATOM 686 N LEU A 416 -3.744 -2.967 -4.154 1.00 0.00 N ATOM 687 CA LEU A 416 -2.358 -2.548 -3.980 1.00 0.00 C ATOM 688 C LEU A 416 -1.947 -1.579 -5.083 1.00 0.00 C ATOM 689 O LEU A 416 -1.394 -0.511 -4.812 1.00 0.00 O ATOM 690 CB LEU A 416 -1.430 -3.765 -3.985 1.00 0.00 C ATOM 691 CG LEU A 416 -1.483 -4.626 -2.721 1.00 0.00 C ATOM 692 CD1 LEU A 416 -0.937 -6.017 -3.000 1.00 0.00 C ATOM 693 CD2 LEU A 416 -0.706 -3.963 -1.594 1.00 0.00 C ATOM 0 H LEU A 416 -3.870 -3.971 -4.279 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.273 -2.040 -3.019 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.680 -4.390 -4.842 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.406 -3.421 -4.129 1.00 0.00 H new ATOM 0 HG LEU A 416 -2.524 -4.722 -2.412 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -0.983 -6.615 -2.090 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -1.534 -6.493 -3.777 1.00 0.00 H new ATOM 0 HD13 LEU A 416 0.098 -5.942 -3.333 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.754 -4.588 -0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 416 0.334 -3.838 -1.894 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -1.141 -2.987 -1.377 1.00 0.00 H new ATOM 705 N THR A 417 -2.228 -1.955 -6.327 1.00 0.00 N ATOM 706 CA THR A 417 -1.894 -1.117 -7.473 1.00 0.00 C ATOM 707 C THR A 417 -2.576 0.242 -7.361 1.00 0.00 C ATOM 708 O THR A 417 -1.958 1.279 -7.605 1.00 0.00 O ATOM 709 CB THR A 417 -2.311 -1.805 -8.773 1.00 0.00 C ATOM 710 OG1 THR A 417 -3.534 -2.498 -8.606 1.00 0.00 O ATOM 711 CG2 THR A 417 -1.286 -2.797 -9.279 1.00 0.00 C ATOM 0 H THR A 417 -2.686 -2.834 -6.567 1.00 0.00 H new ATOM 0 HA THR A 417 -0.815 -0.965 -7.483 1.00 0.00 H new ATOM 0 HB THR A 417 -2.410 -1.003 -9.505 1.00 0.00 H new ATOM 0 HG1 THR A 417 -3.356 -3.395 -8.254 1.00 0.00 H new ATOM 0 HG21 THR A 417 -1.643 -3.250 -10.204 1.00 0.00 H new ATOM 0 HG22 THR A 417 -0.344 -2.282 -9.467 1.00 0.00 H new ATOM 0 HG23 THR A 417 -1.132 -3.574 -8.531 1.00 0.00 H new ATOM 719 N LYS A 418 -3.851 0.230 -6.986 1.00 0.00 N ATOM 720 CA LYS A 418 -4.614 1.464 -6.837 1.00 0.00 C ATOM 721 C LYS A 418 -3.955 2.386 -5.815 1.00 0.00 C ATOM 722 O LYS A 418 -3.793 3.583 -6.056 1.00 0.00 O ATOM 723 CB LYS A 418 -6.050 1.152 -6.411 1.00 0.00 C ATOM 724 CG LYS A 418 -7.094 2.011 -7.106 1.00 0.00 C ATOM 725 CD LYS A 418 -8.499 1.488 -6.863 1.00 0.00 C ATOM 726 CE LYS A 418 -8.670 0.078 -7.404 1.00 0.00 C ATOM 727 NZ LYS A 418 -10.101 -0.337 -7.432 1.00 0.00 N ATOM 0 H LYS A 418 -4.377 -0.619 -6.780 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.633 1.972 -7.801 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -6.261 0.102 -6.616 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -6.138 1.290 -5.333 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -7.020 3.037 -6.746 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -6.893 2.033 -8.177 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -8.712 1.497 -5.794 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -9.222 2.151 -7.338 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -8.256 0.023 -8.411 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -8.102 -0.619 -6.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -10.175 -1.304 -7.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -10.489 -0.309 -6.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -10.639 0.312 -8.041 1.00 0.00 H new ATOM 741 N GLU A 419 -3.573 1.817 -4.675 1.00 0.00 N ATOM 742 CA GLU A 419 -2.928 2.585 -3.616 1.00 0.00 C ATOM 743 C GLU A 419 -1.640 3.227 -4.123 1.00 0.00 C ATOM 744 O GLU A 419 -1.425 4.427 -3.953 1.00 0.00 O ATOM 745 CB GLU A 419 -2.625 1.685 -2.417 1.00 0.00 C ATOM 746 CG GLU A 419 -3.713 1.703 -1.354 1.00 0.00 C ATOM 747 CD GLU A 419 -4.078 0.313 -0.872 1.00 0.00 C ATOM 748 OE1 GLU A 419 -4.851 -0.374 -1.570 1.00 0.00 O ATOM 749 OE2 GLU A 419 -3.591 -0.087 0.207 1.00 0.00 O ATOM 0 H GLU A 419 -3.699 0.828 -4.462 1.00 0.00 H new ATOM 0 HA GLU A 419 -3.611 3.375 -3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -2.487 0.662 -2.767 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -1.683 1.998 -1.967 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -3.378 2.301 -0.507 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -4.602 2.189 -1.757 1.00 0.00 H new ATOM 756 N LEU A 420 -0.788 2.419 -4.747 1.00 0.00 N ATOM 757 CA LEU A 420 0.478 2.912 -5.281 1.00 0.00 C ATOM 758 C LEU A 420 0.240 4.022 -6.300 1.00 0.00 C ATOM 759 O LEU A 420 0.920 5.049 -6.283 1.00 0.00 O ATOM 760 CB LEU A 420 1.261 1.767 -5.929 1.00 0.00 C ATOM 761 CG LEU A 420 2.780 1.850 -5.766 1.00 0.00 C ATOM 762 CD1 LEU A 420 3.394 0.459 -5.786 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.384 2.718 -6.858 1.00 0.00 C ATOM 0 H LEU A 420 -0.950 1.423 -4.895 1.00 0.00 H new ATOM 0 HA LEU A 420 1.061 3.320 -4.455 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.916 0.824 -5.504 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.025 1.742 -6.993 1.00 0.00 H new ATOM 0 HG LEU A 420 3.001 2.308 -4.802 1.00 0.00 H new ATOM 0 HD11 LEU A 420 4.475 0.537 -5.669 1.00 0.00 H new ATOM 0 HD12 LEU A 420 2.982 -0.132 -4.968 1.00 0.00 H new ATOM 0 HD13 LEU A 420 3.166 -0.026 -6.735 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.465 2.767 -6.728 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.155 2.288 -7.833 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.966 3.723 -6.797 1.00 0.00 H new ATOM 775 N LEU A 421 -0.732 3.810 -7.181 1.00 0.00 N ATOM 776 CA LEU A 421 -1.064 4.793 -8.207 1.00 0.00 C ATOM 777 C LEU A 421 -1.435 6.130 -7.576 1.00 0.00 C ATOM 778 O LEU A 421 -0.959 7.184 -8.004 1.00 0.00 O ATOM 779 CB LEU A 421 -2.218 4.285 -9.075 1.00 0.00 C ATOM 780 CG LEU A 421 -2.136 4.673 -10.552 1.00 0.00 C ATOM 781 CD1 LEU A 421 -1.348 3.632 -11.333 1.00 0.00 C ATOM 782 CD2 LEU A 421 -3.530 4.837 -11.138 1.00 0.00 C ATOM 0 H LEU A 421 -1.304 2.966 -7.205 1.00 0.00 H new ATOM 0 HA LEU A 421 -0.185 4.940 -8.835 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -2.256 3.198 -9.002 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -3.154 4.665 -8.667 1.00 0.00 H new ATOM 0 HG LEU A 421 -1.616 5.628 -10.629 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -1.300 3.924 -12.382 1.00 0.00 H new ATOM 0 HD12 LEU A 421 -0.338 3.562 -10.929 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -1.841 2.664 -11.248 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -3.452 5.113 -12.190 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -4.075 3.897 -11.049 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -4.063 5.618 -10.596 1.00 0.00 H new ATOM 794 N GLU A 422 -2.286 6.081 -6.555 1.00 0.00 N ATOM 795 CA GLU A 422 -2.718 7.291 -5.865 1.00 0.00 C ATOM 796 C GLU A 422 -1.621 7.812 -4.940 1.00 0.00 C ATOM 797 O GLU A 422 -1.528 9.013 -4.686 1.00 0.00 O ATOM 798 CB GLU A 422 -3.989 7.015 -5.060 1.00 0.00 C ATOM 799 CG GLU A 422 -5.220 6.793 -5.924 1.00 0.00 C ATOM 800 CD GLU A 422 -6.062 8.045 -6.070 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.918 8.291 -5.193 1.00 0.00 O ATOM 802 OE2 GLU A 422 -5.867 8.781 -7.060 1.00 0.00 O ATOM 0 H GLU A 422 -2.689 5.219 -6.188 1.00 0.00 H new ATOM 0 HA GLU A 422 -2.927 8.053 -6.616 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -3.830 6.136 -4.436 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.173 7.854 -4.388 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.910 6.451 -6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.827 6.000 -5.488 1.00 0.00 H new ATOM 809 N LEU A 423 -0.792 6.900 -4.441 1.00 0.00 N ATOM 810 CA LEU A 423 0.300 7.268 -3.545 1.00 0.00 C ATOM 811 C LEU A 423 1.331 8.130 -4.266 1.00 0.00 C ATOM 812 O LEU A 423 1.863 9.083 -3.698 1.00 0.00 O ATOM 813 CB LEU A 423 0.971 6.011 -2.985 1.00 0.00 C ATOM 814 CG LEU A 423 2.180 6.269 -2.084 1.00 0.00 C ATOM 815 CD1 LEU A 423 1.735 6.527 -0.654 1.00 0.00 C ATOM 816 CD2 LEU A 423 3.144 5.093 -2.140 1.00 0.00 C ATOM 0 H LEU A 423 -0.855 5.902 -4.641 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.118 7.848 -2.722 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.231 5.443 -2.421 1.00 0.00 H new ATOM 0 HB3 LEU A 423 1.286 5.384 -3.819 1.00 0.00 H new ATOM 0 HG LEU A 423 2.697 7.157 -2.447 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.609 6.708 -0.028 1.00 0.00 H new ATOM 0 HD12 LEU A 423 1.082 7.400 -0.628 1.00 0.00 H new ATOM 0 HD13 LEU A 423 1.194 5.658 -0.279 1.00 0.00 H new ATOM 0 HD21 LEU A 423 3.999 5.292 -1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 423 2.636 4.190 -1.802 1.00 0.00 H new ATOM 0 HD23 LEU A 423 3.489 4.954 -3.165 1.00 0.00 H new ATOM 828 N ASP A 424 1.608 7.788 -5.522 1.00 0.00 N ATOM 829 CA ASP A 424 2.579 8.532 -6.319 1.00 0.00 C ATOM 830 C ASP A 424 2.037 9.902 -6.727 1.00 0.00 C ATOM 831 O ASP A 424 2.767 10.725 -7.278 1.00 0.00 O ATOM 832 CB ASP A 424 2.963 7.733 -7.566 1.00 0.00 C ATOM 833 CG ASP A 424 1.777 7.462 -8.471 1.00 0.00 C ATOM 834 OD1 ASP A 424 1.047 8.421 -8.798 1.00 0.00 O ATOM 835 OD2 ASP A 424 1.579 6.289 -8.851 1.00 0.00 O ATOM 0 H ASP A 424 1.175 7.003 -6.008 1.00 0.00 H new ATOM 0 HA ASP A 424 3.464 8.688 -5.702 1.00 0.00 H new ATOM 0 HB2 ASP A 424 3.724 8.279 -8.123 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.409 6.785 -7.263 1.00 0.00 H new ATOM 840 N SER A 425 0.755 10.145 -6.458 1.00 0.00 N ATOM 841 CA SER A 425 0.130 11.417 -6.804 1.00 0.00 C ATOM 842 C SER A 425 0.171 12.389 -5.627 1.00 0.00 C ATOM 843 O SER A 425 -0.780 13.138 -5.397 1.00 0.00 O ATOM 844 CB SER A 425 -1.317 11.193 -7.245 1.00 0.00 C ATOM 845 OG SER A 425 -1.702 12.134 -8.232 1.00 0.00 O ATOM 0 H SER A 425 0.132 9.478 -6.003 1.00 0.00 H new ATOM 0 HA SER A 425 0.693 11.855 -7.629 1.00 0.00 H new ATOM 0 HB2 SER A 425 -1.428 10.183 -7.639 1.00 0.00 H new ATOM 0 HB3 SER A 425 -1.980 11.274 -6.383 1.00 0.00 H new ATOM 0 HG SER A 425 -2.631 11.968 -8.498 1.00 0.00 H new ATOM 851 N VAL A 426 1.275 12.375 -4.887 1.00 0.00 N ATOM 852 CA VAL A 426 1.436 13.258 -3.737 1.00 0.00 C ATOM 853 C VAL A 426 2.535 14.287 -3.988 1.00 0.00 C ATOM 854 O VAL A 426 3.441 14.060 -4.788 1.00 0.00 O ATOM 855 CB VAL A 426 1.768 12.463 -2.458 1.00 0.00 C ATOM 856 CG1 VAL A 426 3.084 11.715 -2.614 1.00 0.00 C ATOM 857 CG2 VAL A 426 1.808 13.386 -1.249 1.00 0.00 C ATOM 0 H VAL A 426 2.071 11.762 -5.063 1.00 0.00 H new ATOM 0 HA VAL A 426 0.486 13.773 -3.595 1.00 0.00 H new ATOM 0 HB VAL A 426 0.980 11.727 -2.298 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.298 11.161 -1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 426 3.011 11.020 -3.451 1.00 0.00 H new ATOM 0 HG13 VAL A 426 3.887 12.427 -2.803 1.00 0.00 H new ATOM 0 HG21 VAL A 426 2.044 12.806 -0.356 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.572 14.149 -1.399 1.00 0.00 H new ATOM 0 HG23 VAL A 426 0.837 13.865 -1.125 1.00 0.00 H new ATOM 867 N GLU A 427 2.448 15.420 -3.297 1.00 0.00 N ATOM 868 CA GLU A 427 3.435 16.484 -3.447 1.00 0.00 C ATOM 869 C GLU A 427 4.378 16.526 -2.249 1.00 0.00 C ATOM 870 O GLU A 427 3.936 16.567 -1.100 1.00 0.00 O ATOM 871 CB GLU A 427 2.737 17.835 -3.610 1.00 0.00 C ATOM 872 CG GLU A 427 1.905 18.239 -2.405 1.00 0.00 C ATOM 873 CD GLU A 427 1.212 19.576 -2.597 1.00 0.00 C ATOM 874 OE1 GLU A 427 1.904 20.614 -2.547 1.00 0.00 O ATOM 875 OE2 GLU A 427 -0.020 19.581 -2.795 1.00 0.00 O ATOM 0 H GLU A 427 1.705 15.625 -2.629 1.00 0.00 H new ATOM 0 HA GLU A 427 4.023 16.276 -4.341 1.00 0.00 H new ATOM 0 HB2 GLU A 427 3.488 18.603 -3.796 1.00 0.00 H new ATOM 0 HB3 GLU A 427 2.094 17.799 -4.489 1.00 0.00 H new ATOM 0 HG2 GLU A 427 1.157 17.471 -2.210 1.00 0.00 H new ATOM 0 HG3 GLU A 427 2.547 18.289 -1.525 1.00 0.00 H new ATOM 882 N THR A 428 5.677 16.518 -2.524 1.00 0.00 N ATOM 883 CA THR A 428 6.684 16.558 -1.470 1.00 0.00 C ATOM 884 C THR A 428 7.908 17.351 -1.915 1.00 0.00 C ATOM 885 O THR A 428 8.854 16.793 -2.471 1.00 0.00 O ATOM 886 CB THR A 428 7.099 15.138 -1.077 1.00 0.00 C ATOM 887 OG1 THR A 428 8.109 15.168 -0.085 1.00 0.00 O ATOM 888 CG2 THR A 428 7.622 14.325 -2.241 1.00 0.00 C ATOM 0 H THR A 428 6.058 16.484 -3.469 1.00 0.00 H new ATOM 0 HA THR A 428 6.246 17.055 -0.604 1.00 0.00 H new ATOM 0 HB THR A 428 6.192 14.664 -0.702 1.00 0.00 H new ATOM 0 HG1 THR A 428 8.360 14.251 0.154 1.00 0.00 H new ATOM 0 HG21 THR A 428 7.898 13.329 -1.894 1.00 0.00 H new ATOM 0 HG22 THR A 428 6.848 14.242 -3.004 1.00 0.00 H new ATOM 0 HG23 THR A 428 8.497 14.818 -2.665 1.00 0.00 H new ATOM 896 N GLY A 429 7.882 18.658 -1.668 1.00 0.00 N ATOM 897 CA GLY A 429 8.995 19.506 -2.050 1.00 0.00 C ATOM 898 C GLY A 429 9.643 20.182 -0.857 1.00 0.00 C ATOM 899 O GLY A 429 9.596 21.406 -0.726 1.00 0.00 O ATOM 0 H GLY A 429 7.110 19.143 -1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 429 9.740 18.908 -2.575 1.00 0.00 H new ATOM 0 HA3 GLY A 429 8.646 20.266 -2.749 1.00 0.00 H new ATOM 903 N GLY A 430 10.251 19.383 0.014 1.00 0.00 N ATOM 904 CA GLY A 430 10.903 19.929 1.189 1.00 0.00 C ATOM 905 C GLY A 430 10.145 19.626 2.468 1.00 0.00 C ATOM 906 O GLY A 430 10.733 19.567 3.547 1.00 0.00 O ATOM 0 H GLY A 430 10.304 18.368 -0.073 1.00 0.00 H new ATOM 0 HA2 GLY A 430 11.911 19.522 1.263 1.00 0.00 H new ATOM 0 HA3 GLY A 430 11.003 21.009 1.077 1.00 0.00 H new ATOM 910 N GLN A 431 8.835 19.435 2.347 1.00 0.00 N ATOM 911 CA GLN A 431 7.995 19.138 3.500 1.00 0.00 C ATOM 912 C GLN A 431 8.458 17.861 4.197 1.00 0.00 C ATOM 913 O GLN A 431 8.285 16.760 3.676 1.00 0.00 O ATOM 914 CB GLN A 431 6.534 18.996 3.072 1.00 0.00 C ATOM 915 CG GLN A 431 5.790 20.319 3.000 1.00 0.00 C ATOM 916 CD GLN A 431 4.699 20.319 1.949 1.00 0.00 C ATOM 917 OE1 GLN A 431 4.880 19.796 0.849 1.00 0.00 O ATOM 918 NE2 GLN A 431 3.556 20.906 2.282 1.00 0.00 N ATOM 0 H GLN A 431 8.333 19.481 1.461 1.00 0.00 H new ATOM 0 HA GLN A 431 8.082 19.967 4.202 1.00 0.00 H new ATOM 0 HB2 GLN A 431 6.495 18.513 2.095 1.00 0.00 H new ATOM 0 HB3 GLN A 431 6.021 18.338 3.773 1.00 0.00 H new ATOM 0 HG2 GLN A 431 5.351 20.538 3.973 1.00 0.00 H new ATOM 0 HG3 GLN A 431 6.498 21.118 2.783 1.00 0.00 H new ATOM 0 HE21 GLN A 431 3.449 21.327 3.205 1.00 0.00 H new ATOM 0 HE22 GLN A 431 2.785 20.936 1.615 1.00 0.00 H new ATOM 927 N ASP A 432 9.049 18.019 5.377 1.00 0.00 N ATOM 928 CA ASP A 432 9.540 16.879 6.148 1.00 0.00 C ATOM 929 C ASP A 432 8.422 15.873 6.404 1.00 0.00 C ATOM 930 O ASP A 432 8.665 14.670 6.489 1.00 0.00 O ATOM 931 CB ASP A 432 10.130 17.354 7.477 1.00 0.00 C ATOM 932 CG ASP A 432 11.373 18.201 7.288 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.245 19.336 6.782 1.00 0.00 O ATOM 934 OD2 ASP A 432 12.473 17.730 7.648 1.00 0.00 O ATOM 0 H ASP A 432 9.200 18.925 5.821 1.00 0.00 H new ATOM 0 HA ASP A 432 10.320 16.387 5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 432 9.380 17.930 8.019 1.00 0.00 H new ATOM 0 HB3 ASP A 432 10.374 16.489 8.093 1.00 0.00 H new ATOM 939 N SER A 433 7.197 16.374 6.525 1.00 0.00 N ATOM 940 CA SER A 433 6.043 15.517 6.770 1.00 0.00 C ATOM 941 C SER A 433 5.858 14.520 5.631 1.00 0.00 C ATOM 942 O SER A 433 6.046 13.315 5.810 1.00 0.00 O ATOM 943 CB SER A 433 4.778 16.362 6.934 1.00 0.00 C ATOM 944 OG SER A 433 4.612 16.775 8.280 1.00 0.00 O ATOM 0 H SER A 433 6.978 17.368 6.457 1.00 0.00 H new ATOM 0 HA SER A 433 6.222 14.962 7.691 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.835 17.237 6.286 1.00 0.00 H new ATOM 0 HB3 SER A 433 3.908 15.786 6.617 1.00 0.00 H new ATOM 0 HG SER A 433 3.798 17.315 8.359 1.00 0.00 H new ATOM 950 N VAL A 434 5.490 15.031 4.460 1.00 0.00 N ATOM 951 CA VAL A 434 5.281 14.184 3.292 1.00 0.00 C ATOM 952 C VAL A 434 6.543 13.398 2.952 1.00 0.00 C ATOM 953 O VAL A 434 6.470 12.301 2.400 1.00 0.00 O ATOM 954 CB VAL A 434 4.856 15.009 2.063 1.00 0.00 C ATOM 955 CG1 VAL A 434 4.390 14.091 0.943 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.763 16.000 2.436 1.00 0.00 C ATOM 0 H VAL A 434 5.331 16.025 4.295 1.00 0.00 H new ATOM 0 HA VAL A 434 4.479 13.490 3.546 1.00 0.00 H new ATOM 0 HB VAL A 434 5.720 15.572 1.709 1.00 0.00 H new ATOM 0 HG11 VAL A 434 4.093 14.690 0.082 1.00 0.00 H new ATOM 0 HG12 VAL A 434 5.203 13.423 0.658 1.00 0.00 H new ATOM 0 HG13 VAL A 434 3.540 13.502 1.286 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.476 16.574 1.555 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.896 15.459 2.816 1.00 0.00 H new ATOM 0 HG23 VAL A 434 4.133 16.678 3.205 1.00 0.00 H new ATOM 966 N ARG A 435 7.699 13.961 3.289 1.00 0.00 N ATOM 967 CA ARG A 435 8.972 13.304 3.021 1.00 0.00 C ATOM 968 C ARG A 435 9.052 11.976 3.769 1.00 0.00 C ATOM 969 O ARG A 435 9.172 10.912 3.160 1.00 0.00 O ATOM 970 CB ARG A 435 10.136 14.210 3.427 1.00 0.00 C ATOM 971 CG ARG A 435 10.979 14.678 2.251 1.00 0.00 C ATOM 972 CD ARG A 435 11.515 13.504 1.447 1.00 0.00 C ATOM 973 NE ARG A 435 12.657 13.882 0.620 1.00 0.00 N ATOM 974 CZ ARG A 435 13.119 13.144 -0.386 1.00 0.00 C ATOM 975 NH1 ARG A 435 12.541 11.989 -0.691 1.00 0.00 N ATOM 976 NH2 ARG A 435 14.163 13.562 -1.090 1.00 0.00 N ATOM 0 H ARG A 435 7.780 14.869 3.747 1.00 0.00 H new ATOM 0 HA ARG A 435 9.041 13.107 1.951 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.742 15.081 3.951 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.774 13.675 4.131 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.380 15.319 1.605 1.00 0.00 H new ATOM 0 HG3 ARG A 435 11.811 15.281 2.615 1.00 0.00 H new ATOM 0 HD2 ARG A 435 11.809 12.704 2.126 1.00 0.00 H new ATOM 0 HD3 ARG A 435 10.723 13.108 0.812 1.00 0.00 H new ATOM 0 HE ARG A 435 13.128 14.763 0.825 1.00 0.00 H new ATOM 0 HH11 ARG A 435 11.738 11.663 -0.153 1.00 0.00 H new ATOM 0 HH12 ARG A 435 12.900 11.428 -1.463 1.00 0.00 H new ATOM 0 HH21 ARG A 435 14.611 14.449 -0.860 1.00 0.00 H new ATOM 0 HH22 ARG A 435 14.517 12.996 -1.861 1.00 0.00 H new ATOM 990 N GLN A 436 8.972 12.049 5.096 1.00 0.00 N ATOM 991 CA GLN A 436 9.023 10.853 5.927 1.00 0.00 C ATOM 992 C GLN A 436 7.904 9.892 5.544 1.00 0.00 C ATOM 993 O GLN A 436 8.112 8.682 5.454 1.00 0.00 O ATOM 994 CB GLN A 436 8.909 11.228 7.407 1.00 0.00 C ATOM 995 CG GLN A 436 8.965 10.032 8.343 1.00 0.00 C ATOM 996 CD GLN A 436 9.562 10.378 9.694 1.00 0.00 C ATOM 997 OE1 GLN A 436 9.073 11.265 10.392 1.00 0.00 O ATOM 998 NE2 GLN A 436 10.624 9.675 10.068 1.00 0.00 N ATOM 0 H GLN A 436 8.872 12.921 5.615 1.00 0.00 H new ATOM 0 HA GLN A 436 9.981 10.359 5.762 1.00 0.00 H new ATOM 0 HB2 GLN A 436 9.715 11.917 7.662 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.972 11.761 7.567 1.00 0.00 H new ATOM 0 HG2 GLN A 436 7.959 9.638 8.484 1.00 0.00 H new ATOM 0 HG3 GLN A 436 9.555 9.241 7.881 1.00 0.00 H new ATOM 0 HE21 GLN A 436 10.996 8.948 9.456 1.00 0.00 H new ATOM 0 HE22 GLN A 436 11.068 9.862 10.967 1.00 0.00 H new ATOM 1007 N ALA A 437 6.718 10.444 5.310 1.00 0.00 N ATOM 1008 CA ALA A 437 5.566 9.641 4.924 1.00 0.00 C ATOM 1009 C ALA A 437 5.796 8.988 3.566 1.00 0.00 C ATOM 1010 O ALA A 437 5.410 7.842 3.341 1.00 0.00 O ATOM 1011 CB ALA A 437 4.311 10.500 4.894 1.00 0.00 C ATOM 0 H ALA A 437 6.531 11.444 5.381 1.00 0.00 H new ATOM 0 HA ALA A 437 5.432 8.852 5.664 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.458 9.887 4.604 1.00 0.00 H new ATOM 0 HB2 ALA A 437 4.135 10.922 5.883 1.00 0.00 H new ATOM 0 HB3 ALA A 437 4.440 11.307 4.173 1.00 0.00 H new ATOM 1017 N ARG A 438 6.437 9.728 2.666 1.00 0.00 N ATOM 1018 CA ARG A 438 6.731 9.223 1.330 1.00 0.00 C ATOM 1019 C ARG A 438 7.621 7.989 1.410 1.00 0.00 C ATOM 1020 O ARG A 438 7.296 6.938 0.861 1.00 0.00 O ATOM 1021 CB ARG A 438 7.409 10.306 0.487 1.00 0.00 C ATOM 1022 CG ARG A 438 7.745 9.859 -0.925 1.00 0.00 C ATOM 1023 CD ARG A 438 6.629 10.199 -1.900 1.00 0.00 C ATOM 1024 NE ARG A 438 6.548 9.237 -2.997 1.00 0.00 N ATOM 1025 CZ ARG A 438 5.931 9.480 -4.152 1.00 0.00 C ATOM 1026 NH1 ARG A 438 5.344 10.650 -4.366 1.00 0.00 N ATOM 1027 NH2 ARG A 438 5.905 8.550 -5.096 1.00 0.00 N ATOM 0 H ARG A 438 6.762 10.679 2.838 1.00 0.00 H new ATOM 0 HA ARG A 438 5.791 8.945 0.854 1.00 0.00 H new ATOM 0 HB2 ARG A 438 6.756 11.177 0.437 1.00 0.00 H new ATOM 0 HB3 ARG A 438 8.325 10.622 0.986 1.00 0.00 H new ATOM 0 HG2 ARG A 438 8.670 10.337 -1.248 1.00 0.00 H new ATOM 0 HG3 ARG A 438 7.922 8.784 -0.934 1.00 0.00 H new ATOM 0 HD2 ARG A 438 5.678 10.223 -1.368 1.00 0.00 H new ATOM 0 HD3 ARG A 438 6.793 11.198 -2.305 1.00 0.00 H new ATOM 0 HE ARG A 438 6.990 8.326 -2.871 1.00 0.00 H new ATOM 0 HH11 ARG A 438 5.363 11.370 -3.644 1.00 0.00 H new ATOM 0 HH12 ARG A 438 4.873 10.830 -5.253 1.00 0.00 H new ATOM 0 HH21 ARG A 438 6.357 7.650 -4.937 1.00 0.00 H new ATOM 0 HH22 ARG A 438 5.433 8.735 -5.981 1.00 0.00 H new ATOM 1041 N LYS A 439 8.746 8.123 2.108 1.00 0.00 N ATOM 1042 CA LYS A 439 9.678 7.013 2.267 1.00 0.00 C ATOM 1043 C LYS A 439 8.992 5.837 2.954 1.00 0.00 C ATOM 1044 O LYS A 439 9.095 4.694 2.506 1.00 0.00 O ATOM 1045 CB LYS A 439 10.899 7.454 3.078 1.00 0.00 C ATOM 1046 CG LYS A 439 11.959 6.373 3.215 1.00 0.00 C ATOM 1047 CD LYS A 439 13.344 6.973 3.407 1.00 0.00 C ATOM 1048 CE LYS A 439 14.192 6.126 4.340 1.00 0.00 C ATOM 1049 NZ LYS A 439 14.438 4.765 3.786 1.00 0.00 N ATOM 0 H LYS A 439 9.032 8.986 2.570 1.00 0.00 H new ATOM 0 HA LYS A 439 10.009 6.697 1.278 1.00 0.00 H new ATOM 0 HB2 LYS A 439 11.343 8.329 2.604 1.00 0.00 H new ATOM 0 HB3 LYS A 439 10.574 7.761 4.072 1.00 0.00 H new ATOM 0 HG2 LYS A 439 11.718 5.731 4.062 1.00 0.00 H new ATOM 0 HG3 LYS A 439 11.954 5.742 2.326 1.00 0.00 H new ATOM 0 HD2 LYS A 439 13.841 7.061 2.441 1.00 0.00 H new ATOM 0 HD3 LYS A 439 13.252 7.981 3.811 1.00 0.00 H new ATOM 0 HE2 LYS A 439 15.145 6.624 4.516 1.00 0.00 H new ATOM 0 HE3 LYS A 439 13.694 6.040 5.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 15.076 4.242 4.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 13.535 4.255 3.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 14.875 4.847 2.846 1.00 0.00 H new ATOM 1063 N GLU A 440 8.282 6.131 4.039 1.00 0.00 N ATOM 1064 CA GLU A 440 7.565 5.106 4.785 1.00 0.00 C ATOM 1065 C GLU A 440 6.542 4.413 3.893 1.00 0.00 C ATOM 1066 O GLU A 440 6.381 3.193 3.943 1.00 0.00 O ATOM 1067 CB GLU A 440 6.873 5.723 6.003 1.00 0.00 C ATOM 1068 CG GLU A 440 6.035 4.734 6.799 1.00 0.00 C ATOM 1069 CD GLU A 440 6.883 3.747 7.579 1.00 0.00 C ATOM 1070 OE1 GLU A 440 7.238 4.056 8.736 1.00 0.00 O ATOM 1071 OE2 GLU A 440 7.189 2.668 7.032 1.00 0.00 O ATOM 0 H GLU A 440 8.189 7.072 4.420 1.00 0.00 H new ATOM 0 HA GLU A 440 8.284 4.363 5.129 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.629 6.155 6.659 1.00 0.00 H new ATOM 0 HB3 GLU A 440 6.234 6.541 5.671 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.393 5.281 7.489 1.00 0.00 H new ATOM 0 HG3 GLU A 440 5.381 4.188 6.119 1.00 0.00 H new ATOM 1078 N ALA A 441 5.857 5.202 3.070 1.00 0.00 N ATOM 1079 CA ALA A 441 4.853 4.668 2.161 1.00 0.00 C ATOM 1080 C ALA A 441 5.484 3.702 1.166 1.00 0.00 C ATOM 1081 O ALA A 441 4.959 2.618 0.917 1.00 0.00 O ATOM 1082 CB ALA A 441 4.147 5.797 1.427 1.00 0.00 C ATOM 0 H ALA A 441 5.980 6.213 3.015 1.00 0.00 H new ATOM 0 HA ALA A 441 4.117 4.121 2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 441 3.400 5.381 0.752 1.00 0.00 H new ATOM 0 HB2 ALA A 441 3.659 6.451 2.149 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.876 6.370 0.853 1.00 0.00 H new ATOM 1088 N VAL A 442 6.623 4.103 0.604 1.00 0.00 N ATOM 1089 CA VAL A 442 7.332 3.270 -0.359 1.00 0.00 C ATOM 1090 C VAL A 442 7.762 1.954 0.279 1.00 0.00 C ATOM 1091 O VAL A 442 7.651 0.890 -0.329 1.00 0.00 O ATOM 1092 CB VAL A 442 8.575 3.988 -0.920 1.00 0.00 C ATOM 1093 CG1 VAL A 442 9.217 3.164 -2.026 1.00 0.00 C ATOM 1094 CG2 VAL A 442 8.208 5.376 -1.425 1.00 0.00 C ATOM 0 H VAL A 442 7.072 4.998 0.800 1.00 0.00 H new ATOM 0 HA VAL A 442 6.642 3.070 -1.179 1.00 0.00 H new ATOM 0 HB VAL A 442 9.301 4.099 -0.114 1.00 0.00 H new ATOM 0 HG11 VAL A 442 10.093 3.688 -2.409 1.00 0.00 H new ATOM 0 HG12 VAL A 442 9.519 2.195 -1.629 1.00 0.00 H new ATOM 0 HG13 VAL A 442 8.500 3.018 -2.834 1.00 0.00 H new ATOM 0 HG21 VAL A 442 9.098 5.868 -1.817 1.00 0.00 H new ATOM 0 HG22 VAL A 442 7.463 5.290 -2.216 1.00 0.00 H new ATOM 0 HG23 VAL A 442 7.800 5.966 -0.604 1.00 0.00 H new ATOM 1104 N CYS A 443 8.247 2.035 1.513 1.00 0.00 N ATOM 1105 CA CYS A 443 8.684 0.848 2.237 1.00 0.00 C ATOM 1106 C CYS A 443 7.516 -0.108 2.450 1.00 0.00 C ATOM 1107 O CYS A 443 7.639 -1.312 2.234 1.00 0.00 O ATOM 1108 CB CYS A 443 9.292 1.241 3.584 1.00 0.00 C ATOM 1109 SG CYS A 443 10.394 -0.009 4.289 1.00 0.00 S ATOM 0 H CYS A 443 8.347 2.908 2.031 1.00 0.00 H new ATOM 0 HA CYS A 443 9.444 0.343 1.641 1.00 0.00 H new ATOM 0 HB2 CYS A 443 9.846 2.172 3.463 1.00 0.00 H new ATOM 0 HB3 CYS A 443 8.486 1.440 4.290 1.00 0.00 H new ATOM 0 HG CYS A 443 10.860 0.415 5.426 1.00 0.00 H new ATOM 1115 N LYS A 444 6.383 0.443 2.874 1.00 0.00 N ATOM 1116 CA LYS A 444 5.183 -0.349 3.118 1.00 0.00 C ATOM 1117 C LYS A 444 4.689 -1.007 1.834 1.00 0.00 C ATOM 1118 O LYS A 444 4.646 -2.231 1.732 1.00 0.00 O ATOM 1119 CB LYS A 444 4.081 0.528 3.713 1.00 0.00 C ATOM 1120 CG LYS A 444 3.272 -0.163 4.799 1.00 0.00 C ATOM 1121 CD LYS A 444 3.860 0.090 6.178 1.00 0.00 C ATOM 1122 CE LYS A 444 2.805 -0.035 7.264 1.00 0.00 C ATOM 1123 NZ LYS A 444 3.114 0.824 8.442 1.00 0.00 N ATOM 0 H LYS A 444 6.271 1.440 3.056 1.00 0.00 H new ATOM 0 HA LYS A 444 5.437 -1.135 3.829 1.00 0.00 H new ATOM 0 HB2 LYS A 444 4.530 1.431 4.126 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.408 0.843 2.915 1.00 0.00 H new ATOM 0 HG2 LYS A 444 2.243 0.194 4.770 1.00 0.00 H new ATOM 0 HG3 LYS A 444 3.243 -1.235 4.606 1.00 0.00 H new ATOM 0 HD2 LYS A 444 4.665 -0.620 6.368 1.00 0.00 H new ATOM 0 HD3 LYS A 444 4.300 1.087 6.210 1.00 0.00 H new ATOM 0 HE2 LYS A 444 1.832 0.242 6.858 1.00 0.00 H new ATOM 0 HE3 LYS A 444 2.733 -1.075 7.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 2.370 0.710 9.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 4.031 0.543 8.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 3.157 1.819 8.144 1.00 0.00 H new ATOM 1137 N ILE A 445 4.316 -0.188 0.850 1.00 0.00 N ATOM 1138 CA ILE A 445 3.826 -0.702 -0.426 1.00 0.00 C ATOM 1139 C ILE A 445 4.755 -1.783 -0.968 1.00 0.00 C ATOM 1140 O ILE A 445 4.305 -2.855 -1.376 1.00 0.00 O ATOM 1141 CB ILE A 445 3.679 0.417 -1.476 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.963 1.244 -1.564 1.00 0.00 C ATOM 1143 CG2 ILE A 445 2.491 1.305 -1.139 1.00 0.00 C ATOM 1144 CD1 ILE A 445 5.872 0.829 -2.700 1.00 0.00 C ATOM 0 H ILE A 445 4.344 0.830 0.913 1.00 0.00 H new ATOM 0 HA ILE A 445 2.841 -1.130 -0.237 1.00 0.00 H new ATOM 0 HB ILE A 445 3.502 -0.042 -2.449 1.00 0.00 H new ATOM 0 HG12 ILE A 445 4.701 2.295 -1.684 1.00 0.00 H new ATOM 0 HG13 ILE A 445 5.507 1.157 -0.624 1.00 0.00 H new ATOM 0 HG21 ILE A 445 2.400 2.091 -1.889 1.00 0.00 H new ATOM 0 HG22 ILE A 445 1.580 0.706 -1.128 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.640 1.756 -0.158 1.00 0.00 H new ATOM 0 HD11 ILE A 445 6.762 1.458 -2.702 1.00 0.00 H new ATOM 0 HD12 ILE A 445 6.164 -0.213 -2.570 1.00 0.00 H new ATOM 0 HD13 ILE A 445 5.345 0.943 -3.648 1.00 0.00 H new ATOM 1156 N GLN A 446 6.055 -1.504 -0.952 1.00 0.00 N ATOM 1157 CA GLN A 446 7.042 -2.464 -1.424 1.00 0.00 C ATOM 1158 C GLN A 446 7.123 -3.641 -0.460 1.00 0.00 C ATOM 1159 O GLN A 446 7.376 -4.776 -0.863 1.00 0.00 O ATOM 1160 CB GLN A 446 8.413 -1.799 -1.560 1.00 0.00 C ATOM 1161 CG GLN A 446 8.582 -1.013 -2.851 1.00 0.00 C ATOM 1162 CD GLN A 446 9.673 -1.579 -3.740 1.00 0.00 C ATOM 1163 OE1 GLN A 446 9.454 -1.838 -4.923 1.00 0.00 O ATOM 1164 NE2 GLN A 446 10.858 -1.772 -3.171 1.00 0.00 N ATOM 0 H GLN A 446 6.447 -0.623 -0.618 1.00 0.00 H new ATOM 0 HA GLN A 446 6.736 -2.827 -2.405 1.00 0.00 H new ATOM 0 HB2 GLN A 446 8.569 -1.130 -0.714 1.00 0.00 H new ATOM 0 HB3 GLN A 446 9.186 -2.565 -1.507 1.00 0.00 H new ATOM 0 HG2 GLN A 446 7.638 -1.011 -3.397 1.00 0.00 H new ATOM 0 HG3 GLN A 446 8.815 0.025 -2.612 1.00 0.00 H new ATOM 0 HE21 GLN A 446 10.994 -1.543 -2.186 1.00 0.00 H new ATOM 0 HE22 GLN A 446 11.631 -2.149 -3.719 1.00 0.00 H new ATOM 1173 N ALA A 447 6.894 -3.356 0.819 1.00 0.00 N ATOM 1174 CA ALA A 447 6.926 -4.379 1.853 1.00 0.00 C ATOM 1175 C ALA A 447 5.773 -5.361 1.674 1.00 0.00 C ATOM 1176 O ALA A 447 5.975 -6.576 1.646 1.00 0.00 O ATOM 1177 CB ALA A 447 6.864 -3.734 3.230 1.00 0.00 C ATOM 0 H ALA A 447 6.683 -2.419 1.163 1.00 0.00 H new ATOM 0 HA ALA A 447 7.862 -4.931 1.765 1.00 0.00 H new ATOM 0 HB1 ALA A 447 6.889 -4.509 3.996 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.718 -3.069 3.359 1.00 0.00 H new ATOM 0 HB3 ALA A 447 5.941 -3.162 3.322 1.00 0.00 H new ATOM 1183 N ILE A 448 4.565 -4.822 1.543 1.00 0.00 N ATOM 1184 CA ILE A 448 3.377 -5.643 1.356 1.00 0.00 C ATOM 1185 C ILE A 448 3.445 -6.400 0.033 1.00 0.00 C ATOM 1186 O ILE A 448 3.060 -7.566 -0.047 1.00 0.00 O ATOM 1187 CB ILE A 448 2.095 -4.787 1.391 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.852 -5.673 1.287 1.00 0.00 C ATOM 1189 CG2 ILE A 448 2.111 -3.755 0.274 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.414 -4.992 1.756 1.00 0.00 C ATOM 0 H ILE A 448 4.384 -3.818 1.563 1.00 0.00 H new ATOM 0 HA ILE A 448 3.344 -6.358 2.178 1.00 0.00 H new ATOM 0 HB ILE A 448 2.061 -4.260 2.345 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.724 -5.986 0.251 1.00 0.00 H new ATOM 0 HG13 ILE A 448 1.009 -6.577 1.876 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.198 -3.160 0.315 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.975 -3.102 0.394 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.171 -4.262 -0.689 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.255 -5.678 1.654 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.306 -4.703 2.801 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.595 -4.104 1.151 1.00 0.00 H new ATOM 1202 N LEU A 449 3.948 -5.729 -0.999 1.00 0.00 N ATOM 1203 CA LEU A 449 4.073 -6.341 -2.317 1.00 0.00 C ATOM 1204 C LEU A 449 5.001 -7.549 -2.257 1.00 0.00 C ATOM 1205 O LEU A 449 4.660 -8.632 -2.733 1.00 0.00 O ATOM 1206 CB LEU A 449 4.603 -5.320 -3.329 1.00 0.00 C ATOM 1207 CG LEU A 449 3.553 -4.755 -4.288 1.00 0.00 C ATOM 1208 CD1 LEU A 449 2.711 -3.697 -3.593 1.00 0.00 C ATOM 1209 CD2 LEU A 449 4.222 -4.180 -5.527 1.00 0.00 C ATOM 0 H LEU A 449 4.275 -4.764 -0.948 1.00 0.00 H new ATOM 0 HA LEU A 449 3.086 -6.674 -2.638 1.00 0.00 H new ATOM 0 HB2 LEU A 449 5.058 -4.493 -2.784 1.00 0.00 H new ATOM 0 HB3 LEU A 449 5.394 -5.789 -3.915 1.00 0.00 H new ATOM 0 HG LEU A 449 2.894 -5.566 -4.598 1.00 0.00 H new ATOM 0 HD11 LEU A 449 1.970 -3.306 -4.290 1.00 0.00 H new ATOM 0 HD12 LEU A 449 2.205 -4.140 -2.736 1.00 0.00 H new ATOM 0 HD13 LEU A 449 3.354 -2.885 -3.254 1.00 0.00 H new ATOM 0 HD21 LEU A 449 3.462 -3.782 -6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 449 4.903 -3.380 -5.235 1.00 0.00 H new ATOM 0 HD23 LEU A 449 4.781 -4.965 -6.036 1.00 0.00 H new ATOM 1221 N GLU A 450 6.176 -7.357 -1.663 1.00 0.00 N ATOM 1222 CA GLU A 450 7.151 -8.433 -1.535 1.00 0.00 C ATOM 1223 C GLU A 450 6.589 -9.569 -0.688 1.00 0.00 C ATOM 1224 O GLU A 450 6.793 -10.744 -0.993 1.00 0.00 O ATOM 1225 CB GLU A 450 8.445 -7.907 -0.913 1.00 0.00 C ATOM 1226 CG GLU A 450 9.526 -8.966 -0.771 1.00 0.00 C ATOM 1227 CD GLU A 450 10.268 -8.869 0.548 1.00 0.00 C ATOM 1228 OE1 GLU A 450 11.044 -7.905 0.722 1.00 0.00 O ATOM 1229 OE2 GLU A 450 10.074 -9.755 1.406 1.00 0.00 O ATOM 0 H GLU A 450 6.474 -6.467 -1.264 1.00 0.00 H new ATOM 0 HA GLU A 450 7.369 -8.817 -2.532 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.827 -7.090 -1.525 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.223 -7.492 0.070 1.00 0.00 H new ATOM 0 HG2 GLU A 450 9.075 -9.954 -0.858 1.00 0.00 H new ATOM 0 HG3 GLU A 450 10.237 -8.867 -1.592 1.00 0.00 H new ATOM 1236 N LYS A 451 5.879 -9.211 0.377 1.00 0.00 N ATOM 1237 CA LYS A 451 5.283 -10.200 1.267 1.00 0.00 C ATOM 1238 C LYS A 451 4.318 -11.103 0.506 1.00 0.00 C ATOM 1239 O LYS A 451 4.371 -12.328 0.628 1.00 0.00 O ATOM 1240 CB LYS A 451 4.549 -9.505 2.418 1.00 0.00 C ATOM 1241 CG LYS A 451 4.568 -10.296 3.716 1.00 0.00 C ATOM 1242 CD LYS A 451 5.819 -10.002 4.528 1.00 0.00 C ATOM 1243 CE LYS A 451 5.659 -8.742 5.363 1.00 0.00 C ATOM 1244 NZ LYS A 451 6.850 -8.488 6.220 1.00 0.00 N ATOM 0 H LYS A 451 5.702 -8.243 0.645 1.00 0.00 H new ATOM 0 HA LYS A 451 6.085 -10.816 1.675 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.002 -8.529 2.590 1.00 0.00 H new ATOM 0 HB3 LYS A 451 3.514 -9.329 2.124 1.00 0.00 H new ATOM 0 HG2 LYS A 451 3.684 -10.052 4.305 1.00 0.00 H new ATOM 0 HG3 LYS A 451 4.519 -11.362 3.495 1.00 0.00 H new ATOM 0 HD2 LYS A 451 6.037 -10.847 5.181 1.00 0.00 H new ATOM 0 HD3 LYS A 451 6.671 -9.889 3.857 1.00 0.00 H new ATOM 0 HE2 LYS A 451 5.497 -7.889 4.705 1.00 0.00 H new ATOM 0 HE3 LYS A 451 4.773 -8.833 5.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 6.701 -7.620 6.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 6.990 -9.291 6.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 7.692 -8.376 5.620 1.00 0.00 H new ATOM 1258 N LEU A 452 3.439 -10.490 -0.280 1.00 0.00 N ATOM 1259 CA LEU A 452 2.464 -11.238 -1.064 1.00 0.00 C ATOM 1260 C LEU A 452 3.157 -12.094 -2.120 1.00 0.00 C ATOM 1261 O LEU A 452 2.771 -13.238 -2.358 1.00 0.00 O ATOM 1262 CB LEU A 452 1.473 -10.279 -1.732 1.00 0.00 C ATOM 1263 CG LEU A 452 0.426 -10.936 -2.640 1.00 0.00 C ATOM 1264 CD1 LEU A 452 1.025 -11.254 -4.002 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.134 -12.196 -1.995 1.00 0.00 C ATOM 0 H LEU A 452 3.382 -9.478 -0.391 1.00 0.00 H new ATOM 0 HA LEU A 452 1.920 -11.899 -0.389 1.00 0.00 H new ATOM 0 HB2 LEU A 452 0.954 -9.721 -0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 452 2.036 -9.555 -2.321 1.00 0.00 H new ATOM 0 HG LEU A 452 -0.394 -10.232 -2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 452 0.268 -11.720 -4.633 1.00 0.00 H new ATOM 0 HD12 LEU A 452 1.372 -10.333 -4.471 1.00 0.00 H new ATOM 0 HD13 LEU A 452 1.865 -11.937 -3.879 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -0.875 -12.645 -2.657 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.675 -12.906 -1.821 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -0.604 -11.941 -1.045 1.00 0.00 H new ATOM 1277 N GLU A 453 4.183 -11.530 -2.748 1.00 0.00 N ATOM 1278 CA GLU A 453 4.932 -12.240 -3.779 1.00 0.00 C ATOM 1279 C GLU A 453 5.569 -13.506 -3.213 1.00 0.00 C ATOM 1280 O GLU A 453 5.559 -14.557 -3.855 1.00 0.00 O ATOM 1281 CB GLU A 453 6.011 -11.334 -4.371 1.00 0.00 C ATOM 1282 CG GLU A 453 5.511 -10.451 -5.503 1.00 0.00 C ATOM 1283 CD GLU A 453 6.641 -9.821 -6.294 1.00 0.00 C ATOM 1284 OE1 GLU A 453 7.100 -10.449 -7.271 1.00 0.00 O ATOM 1285 OE2 GLU A 453 7.064 -8.702 -5.936 1.00 0.00 O ATOM 0 H GLU A 453 4.515 -10.584 -2.561 1.00 0.00 H new ATOM 0 HA GLU A 453 4.235 -12.525 -4.567 1.00 0.00 H new ATOM 0 HB2 GLU A 453 6.417 -10.702 -3.581 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.831 -11.951 -4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 453 4.889 -11.044 -6.174 1.00 0.00 H new ATOM 0 HG3 GLU A 453 4.877 -9.665 -5.093 1.00 0.00 H new ATOM 1292 N LYS A 454 6.119 -13.399 -2.009 1.00 0.00 N ATOM 1293 CA LYS A 454 6.760 -14.536 -1.357 1.00 0.00 C ATOM 1294 C LYS A 454 5.719 -15.522 -0.836 1.00 0.00 C ATOM 1295 O LYS A 454 5.945 -16.732 -0.831 1.00 0.00 O ATOM 1296 CB LYS A 454 7.646 -14.057 -0.206 1.00 0.00 C ATOM 1297 CG LYS A 454 8.631 -15.107 0.280 1.00 0.00 C ATOM 1298 CD LYS A 454 8.023 -15.982 1.365 1.00 0.00 C ATOM 1299 CE LYS A 454 8.466 -15.539 2.750 1.00 0.00 C ATOM 1300 NZ LYS A 454 8.616 -16.693 3.680 1.00 0.00 N ATOM 0 H LYS A 454 6.134 -12.537 -1.464 1.00 0.00 H new ATOM 0 HA LYS A 454 7.379 -15.045 -2.096 1.00 0.00 H new ATOM 0 HB2 LYS A 454 8.198 -13.174 -0.527 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.012 -13.752 0.627 1.00 0.00 H new ATOM 0 HG2 LYS A 454 8.944 -15.730 -0.558 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.526 -14.618 0.665 1.00 0.00 H new ATOM 0 HD2 LYS A 454 6.936 -15.942 1.299 1.00 0.00 H new ATOM 0 HD3 LYS A 454 8.314 -17.020 1.203 1.00 0.00 H new ATOM 0 HE2 LYS A 454 9.415 -15.007 2.675 1.00 0.00 H new ATOM 0 HE3 LYS A 454 7.738 -14.837 3.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 8.919 -16.349 4.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 7.705 -17.186 3.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 9.329 -17.351 3.305 1.00 0.00 H new ATOM 1314 N LYS A 455 4.581 -14.997 -0.399 1.00 0.00 N ATOM 1315 CA LYS A 455 3.505 -15.832 0.124 1.00 0.00 C ATOM 1316 C LYS A 455 2.451 -16.101 -0.946 1.00 0.00 C ATOM 1317 O LYS A 455 1.290 -16.368 -0.634 1.00 0.00 O ATOM 1318 CB LYS A 455 2.857 -15.161 1.338 1.00 0.00 C ATOM 1319 CG LYS A 455 2.462 -16.139 2.433 1.00 0.00 C ATOM 1320 CD LYS A 455 0.995 -16.524 2.335 1.00 0.00 C ATOM 1321 CE LYS A 455 0.551 -17.339 3.538 1.00 0.00 C ATOM 1322 NZ LYS A 455 -0.849 -17.023 3.939 1.00 0.00 N ATOM 0 H LYS A 455 4.379 -13.997 -0.396 1.00 0.00 H new ATOM 0 HA LYS A 455 3.935 -16.786 0.429 1.00 0.00 H new ATOM 0 HB2 LYS A 455 3.549 -14.427 1.750 1.00 0.00 H new ATOM 0 HB3 LYS A 455 1.971 -14.616 1.012 1.00 0.00 H new ATOM 0 HG2 LYS A 455 3.079 -17.034 2.362 1.00 0.00 H new ATOM 0 HG3 LYS A 455 2.658 -15.693 3.408 1.00 0.00 H new ATOM 0 HD2 LYS A 455 0.386 -15.623 2.260 1.00 0.00 H new ATOM 0 HD3 LYS A 455 0.829 -17.098 1.424 1.00 0.00 H new ATOM 0 HE2 LYS A 455 0.631 -18.401 3.306 1.00 0.00 H new ATOM 0 HE3 LYS A 455 1.221 -17.144 4.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -1.171 -17.712 4.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -0.886 -16.066 4.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -1.468 -17.070 3.105 1.00 0.00 H new ATOM 1336 N GLY A 456 2.860 -16.031 -2.209 1.00 0.00 N ATOM 1337 CA GLY A 456 1.936 -16.270 -3.302 1.00 0.00 C ATOM 1338 C GLY A 456 2.483 -17.251 -4.319 1.00 0.00 C ATOM 1339 O GLY A 456 1.882 -17.377 -5.407 1.00 0.00 O ATOM 1340 OXT GLY A 456 3.513 -17.895 -4.029 1.00 0.00 O ATOM 0 H GLY A 456 3.815 -15.813 -2.495 1.00 0.00 H new ATOM 0 HA2 GLY A 456 0.996 -16.652 -2.903 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.712 -15.325 -3.797 1.00 0.00 H new