USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=15 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+ -126:sc= -1.64 (180deg=-5.24!) USER MOD Set 1.2: A 415 MET CE :methyl 175:sc= -4.47! (180deg=-4.49!) USER MOD Single : A 379 SER OG : rot -37:sc= -0.803 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= -0.13 X(o=-0.13,f=0) USER MOD Single : A 391 GLN : amide:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 403 LYS NZ :NH3+ -159:sc= -0.0256 (180deg=-0.182) USER MOD Single : A 404 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00648) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 35:sc= 0.221 USER MOD Single : A 417 THR OG1 : rot 64:sc= 1.15 USER MOD Single : A 418 LYS NZ :NH3+ -155:sc= -0.0781 (180deg=-0.389) USER MOD Single : A 425 SER OG : rot -72:sc= 1.23 USER MOD Single : A 428 THR OG1 : rot 180:sc= 0.921 USER MOD Single : A 431 GLN : amide:sc= -3.22 K(o=-3.2,f=-7.6!) USER MOD Single : A 433 SER OG : rot 180:sc= -0.407 USER MOD Single : A 436 GLN : amide:sc= -0.297 K(o=-0.3,f=-2.7!) USER MOD Single : A 439 LYS NZ :NH3+ 155:sc= -0.297 (180deg=-1.1) 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 X(o=0,f=0) 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+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 0.249 17.260 1.668 1.00 0.00 N ATOM 44 CA SER A 379 -0.635 16.303 1.014 1.00 0.00 C ATOM 45 C SER A 379 -0.654 14.974 1.770 1.00 0.00 C ATOM 46 O SER A 379 -1.229 13.992 1.299 1.00 0.00 O ATOM 47 CB SER A 379 -0.195 16.077 -0.432 1.00 0.00 C ATOM 48 OG SER A 379 -1.125 15.265 -1.128 1.00 0.00 O ATOM 0 HA SER A 379 -1.644 16.715 1.018 1.00 0.00 H new ATOM 0 HB2 SER A 379 -0.095 17.037 -0.939 1.00 0.00 H new ATOM 0 HB3 SER A 379 0.787 15.605 -0.447 1.00 0.00 H new ATOM 0 HG SER A 379 -1.474 14.576 -0.524 1.00 0.00 H new ATOM 54 N ILE A 380 -0.016 14.950 2.942 1.00 0.00 N ATOM 55 CA ILE A 380 0.050 13.745 3.764 1.00 0.00 C ATOM 56 C ILE A 380 -1.305 13.046 3.859 1.00 0.00 C ATOM 57 O ILE A 380 -1.371 11.831 4.042 1.00 0.00 O ATOM 58 CB ILE A 380 0.554 14.067 5.187 1.00 0.00 C ATOM 59 CG1 ILE A 380 0.747 12.779 5.991 1.00 0.00 C ATOM 60 CG2 ILE A 380 -0.415 15.003 5.896 1.00 0.00 C ATOM 61 CD1 ILE A 380 2.004 12.774 6.833 1.00 0.00 C ATOM 0 H ILE A 380 0.464 15.756 3.342 1.00 0.00 H new ATOM 0 HA ILE A 380 0.755 13.074 3.274 1.00 0.00 H new ATOM 0 HB ILE A 380 1.518 14.569 5.107 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -0.116 12.633 6.641 1.00 0.00 H new ATOM 0 HG13 ILE A 380 0.776 11.933 5.305 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -0.044 15.220 6.898 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.502 15.932 5.332 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.394 14.528 5.966 1.00 0.00 H new ATOM 0 HD11 ILE A 380 2.075 11.831 7.375 1.00 0.00 H new ATOM 0 HD12 ILE A 380 2.875 12.888 6.187 1.00 0.00 H new ATOM 0 HD13 ILE A 380 1.969 13.599 7.544 1.00 0.00 H new ATOM 73 N LYS A 381 -2.384 13.817 3.733 1.00 0.00 N ATOM 74 CA LYS A 381 -3.736 13.265 3.802 1.00 0.00 C ATOM 75 C LYS A 381 -3.847 11.988 2.973 1.00 0.00 C ATOM 76 O LYS A 381 -4.215 10.931 3.487 1.00 0.00 O ATOM 77 CB LYS A 381 -4.756 14.296 3.315 1.00 0.00 C ATOM 78 CG LYS A 381 -6.045 14.304 4.119 1.00 0.00 C ATOM 79 CD LYS A 381 -6.749 12.958 4.056 1.00 0.00 C ATOM 80 CE LYS A 381 -7.879 12.873 5.069 1.00 0.00 C ATOM 81 NZ LYS A 381 -7.396 12.413 6.400 1.00 0.00 N ATOM 0 H LYS A 381 -2.348 14.825 3.583 1.00 0.00 H new ATOM 0 HA LYS A 381 -3.948 13.019 4.842 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -4.306 15.288 3.357 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -4.991 14.096 2.270 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -5.826 14.553 5.157 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -6.708 15.081 3.738 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -7.145 12.800 3.053 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -6.030 12.161 4.244 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -8.350 13.851 5.171 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -8.644 12.188 4.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -8.196 12.368 7.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -6.970 11.469 6.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -6.684 13.080 6.761 1.00 0.00 H new ATOM 95 N LYS A 382 -3.514 12.093 1.690 1.00 0.00 N ATOM 96 CA LYS A 382 -3.566 10.945 0.795 1.00 0.00 C ATOM 97 C LYS A 382 -2.589 9.871 1.257 1.00 0.00 C ATOM 98 O LYS A 382 -2.857 8.675 1.132 1.00 0.00 O ATOM 99 CB LYS A 382 -3.236 11.371 -0.638 1.00 0.00 C ATOM 100 CG LYS A 382 -4.184 12.423 -1.192 1.00 0.00 C ATOM 101 CD LYS A 382 -3.527 13.234 -2.297 1.00 0.00 C ATOM 102 CE LYS A 382 -4.563 13.858 -3.219 1.00 0.00 C ATOM 103 NZ LYS A 382 -4.032 14.057 -4.596 1.00 0.00 N ATOM 0 H LYS A 382 -3.206 12.960 1.249 1.00 0.00 H new ATOM 0 HA LYS A 382 -4.576 10.536 0.816 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -2.218 11.759 -0.668 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -3.262 10.494 -1.284 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -5.081 11.939 -1.578 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -4.501 13.089 -0.389 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -2.910 14.018 -1.857 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.863 12.592 -2.875 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -5.445 13.219 -3.259 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -4.882 14.817 -2.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -4.768 14.484 -5.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -3.205 14.687 -4.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -3.751 13.139 -4.996 1.00 0.00 H new ATOM 117 N ILE A 383 -1.457 10.308 1.802 1.00 0.00 N ATOM 118 CA ILE A 383 -0.439 9.391 2.294 1.00 0.00 C ATOM 119 C ILE A 383 -0.962 8.601 3.489 1.00 0.00 C ATOM 120 O ILE A 383 -0.718 7.399 3.610 1.00 0.00 O ATOM 121 CB ILE A 383 0.845 10.139 2.702 1.00 0.00 C ATOM 122 CG1 ILE A 383 1.293 11.082 1.582 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.950 9.150 3.036 1.00 0.00 C ATOM 124 CD1 ILE A 383 1.684 10.365 0.309 1.00 0.00 C ATOM 0 H ILE A 383 -1.223 11.295 1.913 1.00 0.00 H new ATOM 0 HA ILE A 383 -0.200 8.707 1.480 1.00 0.00 H new ATOM 0 HB ILE A 383 0.632 10.734 3.590 1.00 0.00 H new ATOM 0 HG12 ILE A 383 0.486 11.781 1.362 1.00 0.00 H new ATOM 0 HG13 ILE A 383 2.140 11.672 1.932 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.850 9.693 3.322 1.00 0.00 H new ATOM 0 HG22 ILE A 383 1.632 8.514 3.862 1.00 0.00 H new ATOM 0 HG23 ILE A 383 2.161 8.532 2.163 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.990 11.095 -0.440 1.00 0.00 H new ATOM 0 HD12 ILE A 383 2.512 9.686 0.513 1.00 0.00 H new ATOM 0 HD13 ILE A 383 0.832 9.797 -0.065 1.00 0.00 H new ATOM 136 N ILE A 384 -1.694 9.282 4.364 1.00 0.00 N ATOM 137 CA ILE A 384 -2.267 8.643 5.539 1.00 0.00 C ATOM 138 C ILE A 384 -3.329 7.634 5.126 1.00 0.00 C ATOM 139 O ILE A 384 -3.377 6.517 5.643 1.00 0.00 O ATOM 140 CB ILE A 384 -2.891 9.675 6.499 1.00 0.00 C ATOM 141 CG1 ILE A 384 -1.883 10.776 6.828 1.00 0.00 C ATOM 142 CG2 ILE A 384 -3.375 8.996 7.771 1.00 0.00 C ATOM 143 CD1 ILE A 384 -2.511 12.143 6.991 1.00 0.00 C ATOM 0 H ILE A 384 -1.904 10.277 4.280 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.457 8.133 6.060 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.750 10.130 6.006 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -1.359 10.514 7.747 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.135 10.821 6.036 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -3.812 9.740 8.437 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -4.126 8.247 7.520 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -2.534 8.514 8.269 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -1.736 12.874 7.223 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -3.011 12.426 6.065 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -3.238 12.115 7.802 1.00 0.00 H new ATOM 155 N HIS A 385 -4.174 8.033 4.181 1.00 0.00 N ATOM 156 CA HIS A 385 -5.232 7.162 3.683 1.00 0.00 C ATOM 157 C HIS A 385 -4.639 5.872 3.127 1.00 0.00 C ATOM 158 O HIS A 385 -5.045 4.773 3.510 1.00 0.00 O ATOM 159 CB HIS A 385 -6.043 7.876 2.599 1.00 0.00 C ATOM 160 CG HIS A 385 -7.214 7.083 2.108 1.00 0.00 C ATOM 161 ND1 HIS A 385 -7.884 7.376 0.937 1.00 0.00 N ATOM 162 CD2 HIS A 385 -7.836 6.000 2.633 1.00 0.00 C ATOM 163 CE1 HIS A 385 -8.866 6.510 0.765 1.00 0.00 C ATOM 164 NE2 HIS A 385 -8.859 5.664 1.780 1.00 0.00 N ATOM 0 H HIS A 385 -4.146 8.955 3.745 1.00 0.00 H new ATOM 0 HA HIS A 385 -5.895 6.915 4.512 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -6.399 8.829 2.991 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.389 8.102 1.757 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -7.576 5.495 3.551 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -9.557 6.496 -0.064 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -9.508 4.888 1.909 1.00 0.00 H new ATOM 173 N VAL A 386 -3.667 6.013 2.231 1.00 0.00 N ATOM 174 CA VAL A 386 -3.012 4.857 1.634 1.00 0.00 C ATOM 175 C VAL A 386 -2.317 4.023 2.704 1.00 0.00 C ATOM 176 O VAL A 386 -2.320 2.793 2.645 1.00 0.00 O ATOM 177 CB VAL A 386 -1.982 5.273 0.566 1.00 0.00 C ATOM 178 CG1 VAL A 386 -2.671 5.972 -0.595 1.00 0.00 C ATOM 179 CG2 VAL A 386 -0.908 6.163 1.173 1.00 0.00 C ATOM 0 H VAL A 386 -3.317 6.914 1.904 1.00 0.00 H new ATOM 0 HA VAL A 386 -3.788 4.263 1.152 1.00 0.00 H new ATOM 0 HB VAL A 386 -1.499 4.373 0.185 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -1.928 6.259 -1.340 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -3.397 5.296 -1.048 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -3.183 6.863 -0.231 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.191 6.445 0.402 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.369 7.060 1.586 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.393 5.622 1.967 1.00 0.00 H new ATOM 189 N LEU A 387 -1.731 4.700 3.689 1.00 0.00 N ATOM 190 CA LEU A 387 -1.041 4.020 4.779 1.00 0.00 C ATOM 191 C LEU A 387 -1.981 3.043 5.476 1.00 0.00 C ATOM 192 O LEU A 387 -1.692 1.849 5.575 1.00 0.00 O ATOM 193 CB LEU A 387 -0.501 5.037 5.786 1.00 0.00 C ATOM 194 CG LEU A 387 0.928 5.516 5.520 1.00 0.00 C ATOM 195 CD1 LEU A 387 1.233 6.764 6.335 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.926 4.413 5.835 1.00 0.00 C ATOM 0 H LEU A 387 -1.721 5.718 3.753 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.203 3.462 4.360 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.163 5.903 5.795 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -0.541 4.596 6.782 1.00 0.00 H new ATOM 0 HG LEU A 387 1.017 5.768 4.463 1.00 0.00 H new ATOM 0 HD11 LEU A 387 2.253 7.090 6.133 1.00 0.00 H new ATOM 0 HD12 LEU A 387 0.537 7.557 6.060 1.00 0.00 H new ATOM 0 HD13 LEU A 387 1.127 6.540 7.397 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.937 4.771 5.640 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.837 4.130 6.884 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.721 3.546 5.207 1.00 0.00 H new ATOM 208 N GLU A 388 -3.116 3.555 5.946 1.00 0.00 N ATOM 209 CA GLU A 388 -4.104 2.722 6.621 1.00 0.00 C ATOM 210 C GLU A 388 -4.573 1.609 5.693 1.00 0.00 C ATOM 211 O GLU A 388 -4.710 0.455 6.104 1.00 0.00 O ATOM 212 CB GLU A 388 -5.295 3.569 7.074 1.00 0.00 C ATOM 213 CG GLU A 388 -5.221 3.994 8.532 1.00 0.00 C ATOM 214 CD GLU A 388 -4.789 5.437 8.697 1.00 0.00 C ATOM 215 OE1 GLU A 388 -5.194 6.277 7.865 1.00 0.00 O ATOM 216 OE2 GLU A 388 -4.048 5.728 9.657 1.00 0.00 O ATOM 0 H GLU A 388 -3.372 4.539 5.872 1.00 0.00 H new ATOM 0 HA GLU A 388 -3.641 2.275 7.501 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.356 4.459 6.448 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.213 3.004 6.915 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.197 3.855 8.997 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -4.521 3.346 9.060 1.00 0.00 H new ATOM 223 N LYS A 389 -4.807 1.963 4.432 1.00 0.00 N ATOM 224 CA LYS A 389 -5.249 0.995 3.436 1.00 0.00 C ATOM 225 C LYS A 389 -4.234 -0.135 3.308 1.00 0.00 C ATOM 226 O LYS A 389 -4.599 -1.307 3.238 1.00 0.00 O ATOM 227 CB LYS A 389 -5.449 1.678 2.082 1.00 0.00 C ATOM 228 CG LYS A 389 -6.348 0.898 1.136 1.00 0.00 C ATOM 229 CD LYS A 389 -5.538 0.147 0.093 1.00 0.00 C ATOM 230 CE LYS A 389 -6.437 -0.655 -0.837 1.00 0.00 C ATOM 231 NZ LYS A 389 -7.311 0.224 -1.663 1.00 0.00 N ATOM 0 H LYS A 389 -4.698 2.913 4.077 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.201 0.576 3.761 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.876 2.668 2.243 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.477 1.823 1.610 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -6.953 0.193 1.706 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -7.037 1.582 0.640 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -4.948 0.854 -0.490 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -4.835 -0.523 0.589 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -5.822 -1.273 -1.491 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -7.056 -1.332 -0.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -8.304 -0.062 -1.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -7.197 1.212 -1.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -7.044 0.137 -2.664 1.00 0.00 H new ATOM 245 N VAL A 390 -2.954 0.231 3.288 1.00 0.00 N ATOM 246 CA VAL A 390 -1.885 -0.752 3.181 1.00 0.00 C ATOM 247 C VAL A 390 -1.867 -1.653 4.410 1.00 0.00 C ATOM 248 O VAL A 390 -1.663 -2.862 4.304 1.00 0.00 O ATOM 249 CB VAL A 390 -0.506 -0.076 3.027 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.588 -1.119 2.852 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.518 0.898 1.856 1.00 0.00 C ATOM 0 H VAL A 390 -2.635 1.198 3.344 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.081 -1.348 2.290 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.294 0.486 3.937 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.552 -0.621 2.745 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.611 -1.772 3.725 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.386 -1.713 1.960 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.462 1.366 1.762 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.753 0.360 0.938 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.272 1.666 2.029 1.00 0.00 H new ATOM 261 N GLN A 391 -2.094 -1.055 5.577 1.00 0.00 N ATOM 262 CA GLN A 391 -2.118 -1.806 6.826 1.00 0.00 C ATOM 263 C GLN A 391 -3.175 -2.902 6.765 1.00 0.00 C ATOM 264 O GLN A 391 -2.885 -4.076 7.005 1.00 0.00 O ATOM 265 CB GLN A 391 -2.399 -0.873 8.006 1.00 0.00 C ATOM 266 CG GLN A 391 -1.674 -1.270 9.282 1.00 0.00 C ATOM 267 CD GLN A 391 -2.095 -0.435 10.476 1.00 0.00 C ATOM 268 OE1 GLN A 391 -2.382 -0.966 11.548 1.00 0.00 O ATOM 269 NE2 GLN A 391 -2.131 0.880 10.294 1.00 0.00 N ATOM 0 H GLN A 391 -2.263 -0.055 5.682 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.141 -2.267 6.969 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.108 0.142 7.733 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.472 -0.856 8.198 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -1.867 -2.322 9.493 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -0.599 -1.167 9.132 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -1.884 1.276 9.387 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -2.405 1.494 11.061 1.00 0.00 H new ATOM 278 N TYR A 392 -4.402 -2.513 6.427 1.00 0.00 N ATOM 279 CA TYR A 392 -5.500 -3.467 6.318 1.00 0.00 C ATOM 280 C TYR A 392 -5.150 -4.559 5.314 1.00 0.00 C ATOM 281 O TYR A 392 -5.194 -5.750 5.633 1.00 0.00 O ATOM 282 CB TYR A 392 -6.785 -2.756 5.889 1.00 0.00 C ATOM 283 CG TYR A 392 -7.145 -1.574 6.760 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.189 -1.694 8.143 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.440 -0.339 6.198 1.00 0.00 C ATOM 286 CE1 TYR A 392 -7.518 -0.615 8.943 1.00 0.00 C ATOM 287 CE2 TYR A 392 -7.770 0.745 6.990 1.00 0.00 C ATOM 288 CZ TYR A 392 -7.808 0.601 8.361 1.00 0.00 C ATOM 289 OH TYR A 392 -8.135 1.678 9.154 1.00 0.00 O ATOM 0 H TYR A 392 -4.659 -1.547 6.225 1.00 0.00 H new ATOM 0 HA TYR A 392 -5.661 -3.922 7.295 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -6.676 -2.417 4.859 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -7.608 -3.471 5.904 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -6.963 -2.645 8.601 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.411 -0.223 5.125 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -7.548 -0.724 10.017 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -7.997 1.699 6.538 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.310 2.459 8.589 1.00 0.00 H new ATOM 299 N LEU A 393 -4.786 -4.145 4.103 1.00 0.00 N ATOM 300 CA LEU A 393 -4.410 -5.086 3.057 1.00 0.00 C ATOM 301 C LEU A 393 -3.273 -5.979 3.535 1.00 0.00 C ATOM 302 O LEU A 393 -3.259 -7.183 3.272 1.00 0.00 O ATOM 303 CB LEU A 393 -4.000 -4.338 1.786 1.00 0.00 C ATOM 304 CG LEU A 393 -4.895 -4.594 0.570 1.00 0.00 C ATOM 305 CD1 LEU A 393 -5.710 -3.354 0.232 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.062 -5.028 -0.628 1.00 0.00 C ATOM 0 H LEU A 393 -4.744 -3.165 3.824 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.273 -5.711 2.827 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.995 -3.269 1.997 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.978 -4.617 1.531 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.585 -5.400 0.819 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -6.339 -3.557 -0.635 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -6.338 -3.089 1.082 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -5.037 -2.527 0.006 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -4.717 -5.205 -1.481 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.346 -4.245 -0.876 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -3.526 -5.946 -0.385 1.00 0.00 H new ATOM 318 N GLU A 394 -2.327 -5.384 4.259 1.00 0.00 N ATOM 319 CA GLU A 394 -1.194 -6.128 4.794 1.00 0.00 C ATOM 320 C GLU A 394 -1.690 -7.286 5.652 1.00 0.00 C ATOM 321 O GLU A 394 -1.244 -8.423 5.500 1.00 0.00 O ATOM 322 CB GLU A 394 -0.293 -5.209 5.621 1.00 0.00 C ATOM 323 CG GLU A 394 0.846 -4.594 4.823 1.00 0.00 C ATOM 324 CD GLU A 394 1.742 -3.712 5.670 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.730 -3.868 6.909 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.456 -2.864 5.094 1.00 0.00 O ATOM 0 H GLU A 394 -2.325 -4.390 4.487 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.613 -6.525 3.962 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -0.898 -4.410 6.049 1.00 0.00 H new ATOM 0 HB3 GLU A 394 0.123 -5.776 6.454 1.00 0.00 H new ATOM 0 HG2 GLU A 394 1.443 -5.389 4.377 1.00 0.00 H new ATOM 0 HG3 GLU A 394 0.434 -4.006 4.003 1.00 0.00 H new ATOM 333 N GLN A 395 -2.638 -6.989 6.539 1.00 0.00 N ATOM 334 CA GLN A 395 -3.214 -8.008 7.403 1.00 0.00 C ATOM 335 C GLN A 395 -3.848 -9.105 6.555 1.00 0.00 C ATOM 336 O GLN A 395 -3.621 -10.296 6.785 1.00 0.00 O ATOM 337 CB GLN A 395 -4.262 -7.393 8.333 1.00 0.00 C ATOM 338 CG GLN A 395 -4.596 -8.264 9.533 1.00 0.00 C ATOM 339 CD GLN A 395 -4.034 -7.712 10.829 1.00 0.00 C ATOM 340 OE1 GLN A 395 -2.837 -7.822 11.098 1.00 0.00 O ATOM 341 NE2 GLN A 395 -4.899 -7.113 11.641 1.00 0.00 N ATOM 0 H GLN A 395 -3.020 -6.053 6.675 1.00 0.00 H new ATOM 0 HA GLN A 395 -2.421 -8.439 8.014 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -3.901 -6.427 8.685 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.174 -7.205 7.766 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -5.679 -8.356 9.621 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -4.203 -9.268 9.369 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -5.882 -7.044 11.378 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -4.580 -6.722 12.527 1.00 0.00 H new ATOM 350 N GLU A 396 -4.625 -8.692 5.557 1.00 0.00 N ATOM 351 CA GLU A 396 -5.273 -9.638 4.657 1.00 0.00 C ATOM 352 C GLU A 396 -4.223 -10.493 3.962 1.00 0.00 C ATOM 353 O GLU A 396 -4.425 -11.686 3.738 1.00 0.00 O ATOM 354 CB GLU A 396 -6.120 -8.901 3.616 1.00 0.00 C ATOM 355 CG GLU A 396 -6.901 -7.729 4.183 1.00 0.00 C ATOM 356 CD GLU A 396 -8.230 -7.519 3.484 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.755 -8.493 2.904 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.746 -6.382 3.517 1.00 0.00 O ATOM 0 H GLU A 396 -4.820 -7.712 5.353 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.930 -10.280 5.244 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.469 -8.541 2.820 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -6.817 -9.606 3.163 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -7.076 -7.895 5.246 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.302 -6.822 4.096 1.00 0.00 H new ATOM 365 N VAL A 397 -3.091 -9.874 3.639 1.00 0.00 N ATOM 366 CA VAL A 397 -1.996 -10.576 2.986 1.00 0.00 C ATOM 367 C VAL A 397 -1.480 -11.695 3.883 1.00 0.00 C ATOM 368 O VAL A 397 -1.318 -12.833 3.443 1.00 0.00 O ATOM 369 CB VAL A 397 -0.833 -9.623 2.644 1.00 0.00 C ATOM 370 CG1 VAL A 397 0.295 -10.374 1.953 1.00 0.00 C ATOM 371 CG2 VAL A 397 -1.324 -8.469 1.782 1.00 0.00 C ATOM 0 H VAL A 397 -2.910 -8.887 3.820 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.384 -10.993 2.057 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.442 -9.211 3.575 1.00 0.00 H new ATOM 0 HG11 VAL A 397 1.104 -9.682 1.721 1.00 0.00 H new ATOM 0 HG12 VAL A 397 0.666 -11.159 2.612 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -0.076 -10.820 1.030 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -0.490 -7.807 1.551 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.745 -8.860 0.856 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -2.090 -7.912 2.322 1.00 0.00 H new ATOM 381 N GLU A 398 -1.236 -11.366 5.147 1.00 0.00 N ATOM 382 CA GLU A 398 -0.753 -12.347 6.109 1.00 0.00 C ATOM 383 C GLU A 398 -1.761 -13.480 6.257 1.00 0.00 C ATOM 384 O GLU A 398 -1.390 -14.644 6.406 1.00 0.00 O ATOM 385 CB GLU A 398 -0.503 -11.686 7.465 1.00 0.00 C ATOM 386 CG GLU A 398 0.388 -12.506 8.386 1.00 0.00 C ATOM 387 CD GLU A 398 -0.094 -12.497 9.823 1.00 0.00 C ATOM 388 OE1 GLU A 398 -1.323 -12.553 10.038 1.00 0.00 O ATOM 389 OE2 GLU A 398 0.757 -12.433 10.735 1.00 0.00 O ATOM 0 H GLU A 398 -1.365 -10.429 5.528 1.00 0.00 H new ATOM 0 HA GLU A 398 0.188 -12.758 5.742 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -0.046 -10.710 7.305 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -1.460 -11.513 7.958 1.00 0.00 H new ATOM 0 HG2 GLU A 398 0.428 -13.534 8.026 1.00 0.00 H new ATOM 0 HG3 GLU A 398 1.405 -12.115 8.345 1.00 0.00 H new ATOM 396 N GLU A 399 -3.044 -13.126 6.208 1.00 0.00 N ATOM 397 CA GLU A 399 -4.113 -14.110 6.328 1.00 0.00 C ATOM 398 C GLU A 399 -4.408 -14.773 4.982 1.00 0.00 C ATOM 399 O GLU A 399 -5.098 -15.791 4.922 1.00 0.00 O ATOM 400 CB GLU A 399 -5.383 -13.449 6.870 1.00 0.00 C ATOM 401 CG GLU A 399 -5.298 -13.089 8.345 1.00 0.00 C ATOM 402 CD GLU A 399 -6.491 -12.279 8.815 1.00 0.00 C ATOM 403 OE1 GLU A 399 -7.573 -12.871 9.006 1.00 0.00 O ATOM 404 OE2 GLU A 399 -6.342 -11.051 8.993 1.00 0.00 O ATOM 0 H GLU A 399 -3.366 -12.166 6.086 1.00 0.00 H new ATOM 0 HA GLU A 399 -3.782 -14.880 7.024 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -5.587 -12.546 6.295 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -6.227 -14.122 6.716 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -5.228 -14.003 8.935 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -4.384 -12.522 8.525 1.00 0.00 H new ATOM 411 N PHE A 400 -3.882 -14.189 3.903 1.00 0.00 N ATOM 412 CA PHE A 400 -4.089 -14.719 2.555 1.00 0.00 C ATOM 413 C PHE A 400 -3.908 -16.235 2.525 1.00 0.00 C ATOM 414 O PHE A 400 -2.916 -16.763 3.028 1.00 0.00 O ATOM 415 CB PHE A 400 -3.119 -14.052 1.573 1.00 0.00 C ATOM 416 CG PHE A 400 -3.228 -14.563 0.164 1.00 0.00 C ATOM 417 CD1 PHE A 400 -4.289 -14.189 -0.648 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.268 -15.420 -0.350 1.00 0.00 C ATOM 419 CE1 PHE A 400 -4.389 -14.660 -1.940 1.00 0.00 C ATOM 420 CE2 PHE A 400 -2.364 -15.894 -1.644 1.00 0.00 C ATOM 421 CZ PHE A 400 -3.426 -15.515 -2.440 1.00 0.00 C ATOM 0 H PHE A 400 -3.308 -13.347 3.938 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.113 -14.495 2.256 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.299 -12.977 1.574 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.099 -14.204 1.926 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -5.046 -13.521 -0.264 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.435 -15.721 0.268 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -5.220 -14.360 -2.561 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.608 -16.561 -2.033 1.00 0.00 H new ATOM 0 HZ PHE A 400 -3.504 -15.886 -3.451 1.00 0.00 H new ATOM 431 N VAL A 401 -4.878 -16.930 1.935 1.00 0.00 N ATOM 432 CA VAL A 401 -4.841 -18.387 1.838 1.00 0.00 C ATOM 433 C VAL A 401 -3.464 -18.881 1.394 1.00 0.00 C ATOM 434 O VAL A 401 -2.903 -19.800 1.989 1.00 0.00 O ATOM 435 CB VAL A 401 -5.914 -18.905 0.858 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.763 -18.240 -0.503 1.00 0.00 C ATOM 437 CG2 VAL A 401 -5.849 -20.421 0.733 1.00 0.00 C ATOM 0 H VAL A 401 -5.704 -16.504 1.515 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.049 -18.779 2.833 1.00 0.00 H new ATOM 0 HB VAL A 401 -6.894 -18.644 1.257 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.529 -18.619 -1.180 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.875 -17.161 -0.395 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.777 -18.463 -0.910 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -6.615 -20.762 0.037 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -4.866 -20.714 0.363 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.019 -20.874 1.710 1.00 0.00 H new ATOM 447 N GLY A 402 -2.926 -18.260 0.350 1.00 0.00 N ATOM 448 CA GLY A 402 -1.619 -18.646 -0.150 1.00 0.00 C ATOM 449 C GLY A 402 -1.657 -19.132 -1.587 1.00 0.00 C ATOM 450 O GLY A 402 -0.739 -19.816 -2.040 1.00 0.00 O ATOM 0 H GLY A 402 -3.371 -17.496 -0.159 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -0.942 -17.795 -0.077 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.211 -19.433 0.484 1.00 0.00 H new ATOM 454 N LYS A 403 -2.717 -18.780 -2.307 1.00 0.00 N ATOM 455 CA LYS A 403 -2.862 -19.186 -3.698 1.00 0.00 C ATOM 456 C LYS A 403 -3.618 -18.131 -4.498 1.00 0.00 C ATOM 457 O LYS A 403 -4.676 -17.661 -4.078 1.00 0.00 O ATOM 458 CB LYS A 403 -3.588 -20.530 -3.788 1.00 0.00 C ATOM 459 CG LYS A 403 -3.784 -21.023 -5.213 1.00 0.00 C ATOM 460 CD LYS A 403 -3.960 -22.533 -5.264 1.00 0.00 C ATOM 461 CE LYS A 403 -2.692 -23.226 -5.738 1.00 0.00 C ATOM 462 NZ LYS A 403 -2.418 -22.958 -7.176 1.00 0.00 N ATOM 0 H LYS A 403 -3.487 -18.215 -1.950 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.864 -19.292 -4.124 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -3.024 -21.276 -3.229 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -4.562 -20.440 -3.307 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -4.658 -20.539 -5.649 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -2.925 -20.736 -5.819 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -4.230 -22.903 -4.275 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -4.784 -22.782 -5.933 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -1.847 -22.887 -5.138 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -2.785 -24.301 -5.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -1.787 -23.694 -7.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -3.312 -22.964 -7.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -1.962 -22.028 -7.275 1.00 0.00 H new ATOM 476 N LYS A 404 -3.072 -17.762 -5.651 1.00 0.00 N ATOM 477 CA LYS A 404 -3.697 -16.761 -6.508 1.00 0.00 C ATOM 478 C LYS A 404 -4.910 -17.340 -7.230 1.00 0.00 C ATOM 479 O LYS A 404 -4.944 -17.404 -8.460 1.00 0.00 O ATOM 480 CB LYS A 404 -2.684 -16.229 -7.525 1.00 0.00 C ATOM 481 CG LYS A 404 -2.202 -17.282 -8.511 1.00 0.00 C ATOM 482 CD LYS A 404 -2.506 -16.887 -9.947 1.00 0.00 C ATOM 483 CE LYS A 404 -1.285 -16.293 -10.632 1.00 0.00 C ATOM 484 NZ LYS A 404 -0.862 -15.012 -10.003 1.00 0.00 N ATOM 0 H LYS A 404 -2.197 -18.141 -6.014 1.00 0.00 H new ATOM 0 HA LYS A 404 -4.035 -15.938 -5.878 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -3.135 -15.405 -8.078 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -1.825 -15.822 -6.991 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -1.128 -17.427 -8.393 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -2.679 -18.236 -8.287 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -2.846 -17.761 -10.502 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -3.321 -16.163 -9.962 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -0.462 -17.007 -10.590 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.507 -16.124 -11.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -0.048 -14.623 -10.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -1.649 -14.333 -10.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -0.593 -15.183 -9.013 1.00 0.00 H new ATOM 498 N THR A 405 -5.907 -17.762 -6.458 1.00 0.00 N ATOM 499 CA THR A 405 -7.124 -18.336 -7.023 1.00 0.00 C ATOM 500 C THR A 405 -8.367 -17.634 -6.485 1.00 0.00 C ATOM 501 O THR A 405 -9.380 -17.532 -7.176 1.00 0.00 O ATOM 502 CB THR A 405 -7.195 -19.832 -6.713 1.00 0.00 C ATOM 503 OG1 THR A 405 -8.325 -20.419 -7.333 1.00 0.00 O ATOM 504 CG2 THR A 405 -7.275 -20.133 -5.233 1.00 0.00 C ATOM 0 H THR A 405 -5.896 -17.717 -5.439 1.00 0.00 H new ATOM 0 HA THR A 405 -7.093 -18.193 -8.103 1.00 0.00 H new ATOM 0 HB THR A 405 -6.268 -20.252 -7.103 1.00 0.00 H new ATOM 0 HG1 THR A 405 -8.352 -21.376 -7.124 1.00 0.00 H new ATOM 0 HG21 THR A 405 -7.323 -21.212 -5.083 1.00 0.00 H new ATOM 0 HG22 THR A 405 -6.392 -19.736 -4.733 1.00 0.00 H new ATOM 0 HG23 THR A 405 -8.168 -19.669 -4.815 1.00 0.00 H new ATOM 512 N ASP A 406 -8.287 -17.153 -5.247 1.00 0.00 N ATOM 513 CA ASP A 406 -9.408 -16.462 -4.620 1.00 0.00 C ATOM 514 C ASP A 406 -9.410 -14.982 -4.988 1.00 0.00 C ATOM 515 O ASP A 406 -8.396 -14.439 -5.427 1.00 0.00 O ATOM 516 CB ASP A 406 -9.346 -16.624 -3.101 1.00 0.00 C ATOM 517 CG ASP A 406 -10.534 -15.994 -2.403 1.00 0.00 C ATOM 518 OD1 ASP A 406 -11.645 -16.558 -2.493 1.00 0.00 O ATOM 519 OD2 ASP A 406 -10.356 -14.935 -1.764 1.00 0.00 O ATOM 0 H ASP A 406 -7.457 -17.230 -4.659 1.00 0.00 H new ATOM 0 HA ASP A 406 -10.331 -16.909 -4.988 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -9.303 -17.685 -2.853 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -8.427 -16.172 -2.728 1.00 0.00 H new ATOM 524 N LYS A 407 -10.555 -14.334 -4.806 1.00 0.00 N ATOM 525 CA LYS A 407 -10.692 -12.916 -5.119 1.00 0.00 C ATOM 526 C LYS A 407 -9.738 -12.071 -4.277 1.00 0.00 C ATOM 527 O LYS A 407 -9.421 -10.938 -4.635 1.00 0.00 O ATOM 528 CB LYS A 407 -12.134 -12.458 -4.889 1.00 0.00 C ATOM 529 CG LYS A 407 -13.149 -13.188 -5.752 1.00 0.00 C ATOM 530 CD LYS A 407 -13.918 -14.229 -4.955 1.00 0.00 C ATOM 531 CE LYS A 407 -15.171 -14.677 -5.687 1.00 0.00 C ATOM 532 NZ LYS A 407 -14.849 -15.475 -6.902 1.00 0.00 N ATOM 0 H LYS A 407 -11.403 -14.769 -4.443 1.00 0.00 H new ATOM 0 HA LYS A 407 -10.435 -12.779 -6.169 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -12.390 -12.604 -3.840 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -12.203 -11.388 -5.088 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -13.847 -12.469 -6.180 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -12.638 -13.671 -6.585 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -13.278 -15.091 -4.767 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -14.191 -13.817 -3.984 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -15.790 -15.272 -5.016 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -15.757 -13.803 -5.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -15.731 -15.762 -7.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -14.279 -14.899 -7.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -14.312 -16.322 -6.628 1.00 0.00 H new ATOM 546 N ALA A 408 -9.285 -12.630 -3.158 1.00 0.00 N ATOM 547 CA ALA A 408 -8.369 -11.925 -2.266 1.00 0.00 C ATOM 548 C ALA A 408 -7.166 -11.371 -3.025 1.00 0.00 C ATOM 549 O ALA A 408 -6.999 -10.158 -3.140 1.00 0.00 O ATOM 550 CB ALA A 408 -7.909 -12.849 -1.149 1.00 0.00 C ATOM 0 H ALA A 408 -9.537 -13.568 -2.848 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.906 -11.081 -1.833 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -7.226 -12.312 -0.490 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.773 -13.187 -0.578 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -7.397 -13.711 -1.577 1.00 0.00 H new ATOM 556 N TYR A 409 -6.331 -12.267 -3.542 1.00 0.00 N ATOM 557 CA TYR A 409 -5.142 -11.866 -4.287 1.00 0.00 C ATOM 558 C TYR A 409 -5.487 -10.842 -5.367 1.00 0.00 C ATOM 559 O TYR A 409 -4.752 -9.876 -5.577 1.00 0.00 O ATOM 560 CB TYR A 409 -4.471 -13.085 -4.917 1.00 0.00 C ATOM 561 CG TYR A 409 -2.988 -12.909 -5.145 1.00 0.00 C ATOM 562 CD1 TYR A 409 -2.119 -12.730 -4.075 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.455 -12.921 -6.428 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.761 -12.567 -4.278 1.00 0.00 C ATOM 565 CE2 TYR A 409 -1.098 -12.761 -6.638 1.00 0.00 C ATOM 566 CZ TYR A 409 -0.257 -12.584 -5.559 1.00 0.00 C ATOM 567 OH TYR A 409 1.095 -12.422 -5.765 1.00 0.00 O ATOM 0 H TYR A 409 -6.456 -13.276 -3.459 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.449 -11.402 -3.585 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.631 -13.950 -4.274 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.953 -13.303 -5.870 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.511 -12.718 -3.069 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -3.111 -13.058 -7.275 1.00 0.00 H new ATOM 0 HE1 TYR A 409 -0.099 -12.427 -3.436 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.699 -12.775 -7.641 1.00 0.00 H new ATOM 0 HH TYR A 409 1.590 -12.845 -5.033 1.00 0.00 H new ATOM 577 N TRP A 410 -6.614 -11.056 -6.043 1.00 0.00 N ATOM 578 CA TRP A 410 -7.055 -10.143 -7.092 1.00 0.00 C ATOM 579 C TRP A 410 -7.120 -8.717 -6.562 1.00 0.00 C ATOM 580 O TRP A 410 -6.365 -7.848 -6.994 1.00 0.00 O ATOM 581 CB TRP A 410 -8.432 -10.550 -7.619 1.00 0.00 C ATOM 582 CG TRP A 410 -8.490 -11.946 -8.161 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.439 -12.781 -8.409 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.672 -12.665 -8.524 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.898 -13.977 -8.905 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.267 -13.931 -8.985 1.00 0.00 C ATOM 587 CE3 TRP A 410 -11.035 -12.359 -8.502 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -10.177 -14.891 -9.421 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.938 -13.312 -8.936 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.505 -14.565 -9.388 1.00 0.00 C ATOM 0 H TRP A 410 -7.235 -11.850 -5.883 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.333 -10.193 -7.907 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -9.161 -10.453 -6.814 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.729 -9.854 -8.403 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.400 -12.537 -8.240 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.315 -14.771 -9.171 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.377 -11.396 -8.153 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.846 -15.857 -9.772 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.994 -13.087 -8.926 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -12.235 -15.289 -9.718 1.00 0.00 H new ATOM 601 N LEU A 411 -8.025 -8.491 -5.615 1.00 0.00 N ATOM 602 CA LEU A 411 -8.185 -7.174 -5.016 1.00 0.00 C ATOM 603 C LEU A 411 -6.916 -6.768 -4.278 1.00 0.00 C ATOM 604 O LEU A 411 -6.581 -5.587 -4.200 1.00 0.00 O ATOM 605 CB LEU A 411 -9.379 -7.160 -4.061 1.00 0.00 C ATOM 606 CG LEU A 411 -9.373 -8.252 -2.990 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.542 -7.822 -1.791 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.796 -8.581 -2.564 1.00 0.00 C ATOM 0 H LEU A 411 -8.657 -9.202 -5.248 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.370 -6.455 -5.814 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.416 -6.189 -3.566 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.293 -7.254 -4.647 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.921 -9.149 -3.413 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -8.550 -8.612 -1.040 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.516 -7.633 -2.108 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -8.963 -6.912 -1.364 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.777 -9.360 -1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.270 -7.687 -2.158 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -11.362 -8.932 -3.427 1.00 0.00 H new ATOM 620 N LEU A 412 -6.205 -7.759 -3.744 1.00 0.00 N ATOM 621 CA LEU A 412 -4.964 -7.506 -3.020 1.00 0.00 C ATOM 622 C LEU A 412 -4.024 -6.642 -3.857 1.00 0.00 C ATOM 623 O LEU A 412 -3.814 -5.464 -3.562 1.00 0.00 O ATOM 624 CB LEU A 412 -4.274 -8.828 -2.666 1.00 0.00 C ATOM 625 CG LEU A 412 -4.709 -9.472 -1.344 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.857 -10.695 -1.041 1.00 0.00 C ATOM 627 CD2 LEU A 412 -4.619 -8.466 -0.209 1.00 0.00 C ATOM 0 H LEU A 412 -6.468 -8.743 -3.800 1.00 0.00 H new ATOM 0 HA LEU A 412 -5.207 -6.975 -2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.456 -9.539 -3.472 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -3.198 -8.657 -2.629 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.747 -9.791 -1.441 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -4.180 -11.139 -0.099 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -3.969 -11.424 -1.843 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.811 -10.399 -0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -4.931 -8.939 0.722 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -3.591 -8.118 -0.112 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -5.271 -7.618 -0.422 1.00 0.00 H new ATOM 639 N GLU A 413 -3.465 -7.238 -4.906 1.00 0.00 N ATOM 640 CA GLU A 413 -2.547 -6.528 -5.789 1.00 0.00 C ATOM 641 C GLU A 413 -3.264 -5.416 -6.553 1.00 0.00 C ATOM 642 O GLU A 413 -2.692 -4.355 -6.798 1.00 0.00 O ATOM 643 CB GLU A 413 -1.897 -7.501 -6.774 1.00 0.00 C ATOM 644 CG GLU A 413 -2.889 -8.193 -7.695 1.00 0.00 C ATOM 645 CD GLU A 413 -2.212 -8.901 -8.853 1.00 0.00 C ATOM 646 OE1 GLU A 413 -1.539 -8.220 -9.654 1.00 0.00 O ATOM 647 OE2 GLU A 413 -2.357 -10.137 -8.958 1.00 0.00 O ATOM 0 H GLU A 413 -3.632 -8.210 -5.165 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.773 -6.074 -5.170 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -1.170 -6.960 -7.379 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -1.346 -8.257 -6.214 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -3.469 -8.916 -7.121 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -3.592 -7.457 -8.085 1.00 0.00 H new ATOM 654 N GLU A 414 -4.514 -5.667 -6.929 1.00 0.00 N ATOM 655 CA GLU A 414 -5.298 -4.682 -7.667 1.00 0.00 C ATOM 656 C GLU A 414 -5.436 -3.384 -6.879 1.00 0.00 C ATOM 657 O GLU A 414 -4.921 -2.343 -7.285 1.00 0.00 O ATOM 658 CB GLU A 414 -6.684 -5.241 -7.995 1.00 0.00 C ATOM 659 CG GLU A 414 -6.688 -6.215 -9.161 1.00 0.00 C ATOM 660 CD GLU A 414 -7.989 -6.983 -9.275 1.00 0.00 C ATOM 661 OE1 GLU A 414 -9.026 -6.470 -8.805 1.00 0.00 O ATOM 662 OE2 GLU A 414 -7.973 -8.101 -9.835 1.00 0.00 O ATOM 0 H GLU A 414 -5.005 -6.540 -6.736 1.00 0.00 H new ATOM 0 HA GLU A 414 -4.770 -4.465 -8.596 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -7.082 -5.742 -7.113 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.356 -4.413 -8.222 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -6.511 -5.668 -10.087 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -5.864 -6.919 -9.044 1.00 0.00 H new ATOM 669 N MET A 415 -6.136 -3.452 -5.751 1.00 0.00 N ATOM 670 CA MET A 415 -6.343 -2.279 -4.910 1.00 0.00 C ATOM 671 C MET A 415 -5.010 -1.689 -4.457 1.00 0.00 C ATOM 672 O MET A 415 -4.828 -0.470 -4.458 1.00 0.00 O ATOM 673 CB MET A 415 -7.200 -2.638 -3.693 1.00 0.00 C ATOM 674 CG MET A 415 -8.689 -2.687 -3.995 1.00 0.00 C ATOM 675 SD MET A 415 -9.613 -3.655 -2.786 1.00 0.00 S ATOM 676 CE MET A 415 -8.876 -3.084 -1.256 1.00 0.00 C ATOM 0 H MET A 415 -6.569 -4.306 -5.399 1.00 0.00 H new ATOM 0 HA MET A 415 -6.867 -1.529 -5.502 1.00 0.00 H new ATOM 0 HB2 MET A 415 -6.883 -3.607 -3.308 1.00 0.00 H new ATOM 0 HB3 MET A 415 -7.021 -1.908 -2.904 1.00 0.00 H new ATOM 0 HG2 MET A 415 -9.084 -1.671 -4.020 1.00 0.00 H new ATOM 0 HG3 MET A 415 -8.841 -3.112 -4.987 1.00 0.00 H new ATOM 0 HE1 MET A 415 -9.404 -3.526 -0.411 1.00 0.00 H new ATOM 0 HE2 MET A 415 -7.828 -3.380 -1.224 1.00 0.00 H new ATOM 0 HE3 MET A 415 -8.948 -1.998 -1.201 1.00 0.00 H new ATOM 686 N LEU A 416 -4.078 -2.557 -4.073 1.00 0.00 N ATOM 687 CA LEU A 416 -2.765 -2.112 -3.622 1.00 0.00 C ATOM 688 C LEU A 416 -2.050 -1.321 -4.715 1.00 0.00 C ATOM 689 O LEU A 416 -1.583 -0.205 -4.485 1.00 0.00 O ATOM 690 CB LEU A 416 -1.912 -3.308 -3.203 1.00 0.00 C ATOM 691 CG LEU A 416 -0.653 -2.960 -2.409 1.00 0.00 C ATOM 692 CD1 LEU A 416 -1.006 -2.133 -1.181 1.00 0.00 C ATOM 693 CD2 LEU A 416 0.091 -4.227 -2.009 1.00 0.00 C ATOM 0 H LEU A 416 -4.208 -3.569 -4.065 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.909 -1.459 -2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -2.526 -3.981 -2.604 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -1.618 -3.856 -4.098 1.00 0.00 H new ATOM 0 HG LEU A 416 0.002 -2.364 -3.044 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -0.097 -1.895 -0.629 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -1.494 -1.209 -1.492 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -1.681 -2.702 -0.541 1.00 0.00 H new ATOM 0 HD21 LEU A 416 0.985 -3.961 -1.444 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.556 -4.850 -1.391 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.378 -4.778 -2.904 1.00 0.00 H new ATOM 705 N THR A 417 -1.966 -1.910 -5.904 1.00 0.00 N ATOM 706 CA THR A 417 -1.306 -1.262 -7.034 1.00 0.00 C ATOM 707 C THR A 417 -1.945 0.088 -7.344 1.00 0.00 C ATOM 708 O THR A 417 -1.249 1.081 -7.558 1.00 0.00 O ATOM 709 CB THR A 417 -1.365 -2.163 -8.269 1.00 0.00 C ATOM 710 OG1 THR A 417 -0.748 -3.412 -8.010 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.689 -1.562 -9.484 1.00 0.00 C ATOM 0 H THR A 417 -2.346 -2.834 -6.111 1.00 0.00 H new ATOM 0 HA THR A 417 -0.264 -1.093 -6.763 1.00 0.00 H new ATOM 0 HB THR A 417 -2.426 -2.283 -8.486 1.00 0.00 H new ATOM 0 HG1 THR A 417 -1.253 -3.889 -7.319 1.00 0.00 H new ATOM 0 HG21 THR A 417 -0.768 -2.253 -10.323 1.00 0.00 H new ATOM 0 HG22 THR A 417 -1.174 -0.621 -9.742 1.00 0.00 H new ATOM 0 HG23 THR A 417 0.362 -1.379 -9.262 1.00 0.00 H new ATOM 719 N LYS A 418 -3.274 0.119 -7.370 1.00 0.00 N ATOM 720 CA LYS A 418 -4.005 1.350 -7.658 1.00 0.00 C ATOM 721 C LYS A 418 -3.623 2.456 -6.679 1.00 0.00 C ATOM 722 O LYS A 418 -3.177 3.530 -7.084 1.00 0.00 O ATOM 723 CB LYS A 418 -5.514 1.098 -7.595 1.00 0.00 C ATOM 724 CG LYS A 418 -6.337 2.179 -8.276 1.00 0.00 C ATOM 725 CD LYS A 418 -6.222 2.099 -9.790 1.00 0.00 C ATOM 726 CE LYS A 418 -7.531 2.465 -10.469 1.00 0.00 C ATOM 727 NZ LYS A 418 -8.606 1.478 -10.177 1.00 0.00 N ATOM 0 H LYS A 418 -3.867 -0.693 -7.195 1.00 0.00 H new ATOM 0 HA LYS A 418 -3.737 1.673 -8.664 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -5.734 0.137 -8.061 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -5.819 1.023 -6.551 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -7.382 2.079 -7.984 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -6.003 3.159 -7.936 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -5.434 2.770 -10.132 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -5.930 1.090 -10.081 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -7.847 3.454 -10.137 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -7.376 2.524 -11.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -9.312 1.497 -10.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -8.194 0.525 -10.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -9.065 1.721 -9.276 1.00 0.00 H new ATOM 741 N GLU A 419 -3.799 2.185 -5.388 1.00 0.00 N ATOM 742 CA GLU A 419 -3.470 3.158 -4.352 1.00 0.00 C ATOM 743 C GLU A 419 -2.013 3.594 -4.460 1.00 0.00 C ATOM 744 O GLU A 419 -1.685 4.760 -4.242 1.00 0.00 O ATOM 745 CB GLU A 419 -3.741 2.571 -2.967 1.00 0.00 C ATOM 746 CG GLU A 419 -5.219 2.476 -2.627 1.00 0.00 C ATOM 747 CD GLU A 419 -5.626 3.421 -1.512 1.00 0.00 C ATOM 748 OE1 GLU A 419 -4.882 4.390 -1.253 1.00 0.00 O ATOM 749 OE2 GLU A 419 -6.689 3.191 -0.897 1.00 0.00 O ATOM 0 H GLU A 419 -4.167 1.301 -5.036 1.00 0.00 H new ATOM 0 HA GLU A 419 -4.103 4.034 -4.495 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -3.299 1.576 -2.910 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -3.243 3.185 -2.217 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -5.807 2.697 -3.518 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -5.455 1.453 -2.335 1.00 0.00 H new ATOM 756 N LEU A 420 -1.140 2.650 -4.802 1.00 0.00 N ATOM 757 CA LEU A 420 0.281 2.939 -4.946 1.00 0.00 C ATOM 758 C LEU A 420 0.512 3.965 -6.049 1.00 0.00 C ATOM 759 O LEU A 420 1.220 4.954 -5.855 1.00 0.00 O ATOM 760 CB LEU A 420 1.056 1.655 -5.252 1.00 0.00 C ATOM 761 CG LEU A 420 2.377 1.500 -4.496 1.00 0.00 C ATOM 762 CD1 LEU A 420 3.004 0.148 -4.793 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.333 2.625 -4.858 1.00 0.00 C ATOM 0 H LEU A 420 -1.393 1.679 -4.984 1.00 0.00 H new ATOM 0 HA LEU A 420 0.643 3.354 -4.005 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.420 0.801 -5.020 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.261 1.619 -6.322 1.00 0.00 H new ATOM 0 HG LEU A 420 2.172 1.556 -3.427 1.00 0.00 H new ATOM 0 HD11 LEU A 420 3.943 0.055 -4.247 1.00 0.00 H new ATOM 0 HD12 LEU A 420 2.323 -0.645 -4.483 1.00 0.00 H new ATOM 0 HD13 LEU A 420 3.196 0.063 -5.863 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.267 2.499 -4.311 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.534 2.602 -5.929 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.885 3.583 -4.594 1.00 0.00 H new ATOM 775 N LEU A 421 -0.095 3.726 -7.208 1.00 0.00 N ATOM 776 CA LEU A 421 0.041 4.629 -8.344 1.00 0.00 C ATOM 777 C LEU A 421 -0.449 6.027 -7.981 1.00 0.00 C ATOM 778 O LEU A 421 0.251 7.016 -8.199 1.00 0.00 O ATOM 779 CB LEU A 421 -0.744 4.095 -9.545 1.00 0.00 C ATOM 780 CG LEU A 421 -0.060 4.283 -10.900 1.00 0.00 C ATOM 781 CD1 LEU A 421 0.958 3.181 -11.141 1.00 0.00 C ATOM 782 CD2 LEU A 421 -1.092 4.311 -12.017 1.00 0.00 C ATOM 0 H LEU A 421 -0.686 2.914 -7.384 1.00 0.00 H new ATOM 0 HA LEU A 421 1.097 4.688 -8.609 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -0.931 3.032 -9.394 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -1.715 4.589 -9.574 1.00 0.00 H new ATOM 0 HG LEU A 421 0.465 5.238 -10.892 1.00 0.00 H new ATOM 0 HD11 LEU A 421 1.434 3.331 -12.110 1.00 0.00 H new ATOM 0 HD12 LEU A 421 1.714 3.207 -10.357 1.00 0.00 H new ATOM 0 HD13 LEU A 421 0.456 2.213 -11.130 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -0.588 4.445 -12.974 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -1.644 3.371 -12.026 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -1.784 5.137 -11.852 1.00 0.00 H new ATOM 794 N GLU A 422 -1.653 6.101 -7.424 1.00 0.00 N ATOM 795 CA GLU A 422 -2.233 7.379 -7.026 1.00 0.00 C ATOM 796 C GLU A 422 -1.439 7.998 -5.879 1.00 0.00 C ATOM 797 O GLU A 422 -1.369 9.220 -5.748 1.00 0.00 O ATOM 798 CB GLU A 422 -3.694 7.194 -6.611 1.00 0.00 C ATOM 799 CG GLU A 422 -4.675 7.326 -7.763 1.00 0.00 C ATOM 800 CD GLU A 422 -5.075 8.765 -8.025 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.039 9.240 -7.388 1.00 0.00 O ATOM 802 OE2 GLU A 422 -4.425 9.418 -8.869 1.00 0.00 O ATOM 0 H GLU A 422 -2.246 5.292 -7.238 1.00 0.00 H new ATOM 0 HA GLU A 422 -2.191 8.053 -7.881 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -3.812 6.211 -6.155 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -3.942 7.931 -5.847 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.229 6.906 -8.665 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.567 6.739 -7.545 1.00 0.00 H new ATOM 809 N LEU A 423 -0.842 7.144 -5.054 1.00 0.00 N ATOM 810 CA LEU A 423 -0.051 7.602 -3.918 1.00 0.00 C ATOM 811 C LEU A 423 1.173 8.385 -4.390 1.00 0.00 C ATOM 812 O LEU A 423 1.430 9.495 -3.926 1.00 0.00 O ATOM 813 CB LEU A 423 0.385 6.404 -3.064 1.00 0.00 C ATOM 814 CG LEU A 423 1.560 6.663 -2.120 1.00 0.00 C ATOM 815 CD1 LEU A 423 1.216 7.764 -1.129 1.00 0.00 C ATOM 816 CD2 LEU A 423 1.947 5.385 -1.392 1.00 0.00 C ATOM 0 H LEU A 423 -0.891 6.130 -5.151 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.669 8.265 -3.313 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -0.468 6.072 -2.472 1.00 0.00 H new ATOM 0 HB3 LEU A 423 0.650 5.583 -3.730 1.00 0.00 H new ATOM 0 HG LEU A 423 2.414 6.993 -2.712 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.064 7.934 -0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.988 8.682 -1.670 1.00 0.00 H new ATOM 0 HD13 LEU A 423 0.349 7.465 -0.540 1.00 0.00 H new ATOM 0 HD21 LEU A 423 2.785 5.586 -0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 423 1.098 5.026 -0.811 1.00 0.00 H new ATOM 0 HD23 LEU A 423 2.236 4.626 -2.119 1.00 0.00 H new ATOM 828 N ASP A 424 1.924 7.793 -5.314 1.00 0.00 N ATOM 829 CA ASP A 424 3.124 8.428 -5.853 1.00 0.00 C ATOM 830 C ASP A 424 2.836 9.844 -6.355 1.00 0.00 C ATOM 831 O ASP A 424 3.745 10.666 -6.466 1.00 0.00 O ATOM 832 CB ASP A 424 3.704 7.584 -6.989 1.00 0.00 C ATOM 833 CG ASP A 424 4.682 6.538 -6.488 1.00 0.00 C ATOM 834 OD1 ASP A 424 5.878 6.865 -6.342 1.00 0.00 O ATOM 835 OD2 ASP A 424 4.250 5.391 -6.245 1.00 0.00 O ATOM 0 H ASP A 424 1.723 6.873 -5.706 1.00 0.00 H new ATOM 0 HA ASP A 424 3.851 8.498 -5.044 1.00 0.00 H new ATOM 0 HB2 ASP A 424 2.892 7.092 -7.524 1.00 0.00 H new ATOM 0 HB3 ASP A 424 4.207 8.236 -7.703 1.00 0.00 H new ATOM 840 N SER A 425 1.570 10.122 -6.661 1.00 0.00 N ATOM 841 CA SER A 425 1.175 11.437 -7.153 1.00 0.00 C ATOM 842 C SER A 425 0.797 12.375 -6.005 1.00 0.00 C ATOM 843 O SER A 425 -0.139 13.166 -6.123 1.00 0.00 O ATOM 844 CB SER A 425 0.000 11.306 -8.124 1.00 0.00 C ATOM 845 OG SER A 425 -1.223 11.143 -7.426 1.00 0.00 O ATOM 0 H SER A 425 0.803 9.455 -6.577 1.00 0.00 H new ATOM 0 HA SER A 425 2.031 11.867 -7.674 1.00 0.00 H new ATOM 0 HB2 SER A 425 -0.054 12.192 -8.756 1.00 0.00 H new ATOM 0 HB3 SER A 425 0.162 10.453 -8.783 1.00 0.00 H new ATOM 0 HG SER A 425 -1.258 10.246 -7.033 1.00 0.00 H new ATOM 851 N VAL A 426 1.530 12.284 -4.899 1.00 0.00 N ATOM 852 CA VAL A 426 1.270 13.129 -3.738 1.00 0.00 C ATOM 853 C VAL A 426 2.007 14.460 -3.855 1.00 0.00 C ATOM 854 O VAL A 426 3.022 14.559 -4.544 1.00 0.00 O ATOM 855 CB VAL A 426 1.689 12.429 -2.429 1.00 0.00 C ATOM 856 CG1 VAL A 426 3.171 12.090 -2.450 1.00 0.00 C ATOM 857 CG2 VAL A 426 1.349 13.296 -1.225 1.00 0.00 C ATOM 0 H VAL A 426 2.308 11.634 -4.782 1.00 0.00 H new ATOM 0 HA VAL A 426 0.196 13.314 -3.711 1.00 0.00 H new ATOM 0 HB VAL A 426 1.130 11.497 -2.346 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.445 11.597 -1.517 1.00 0.00 H new ATOM 0 HG12 VAL A 426 3.380 11.424 -3.287 1.00 0.00 H new ATOM 0 HG13 VAL A 426 3.752 13.006 -2.561 1.00 0.00 H new ATOM 0 HG21 VAL A 426 1.652 12.785 -0.311 1.00 0.00 H new ATOM 0 HG22 VAL A 426 1.876 14.247 -1.301 1.00 0.00 H new ATOM 0 HG23 VAL A 426 0.275 13.478 -1.199 1.00 0.00 H new ATOM 867 N GLU A 427 1.488 15.482 -3.181 1.00 0.00 N ATOM 868 CA GLU A 427 2.099 16.806 -3.212 1.00 0.00 C ATOM 869 C GLU A 427 2.874 17.080 -1.926 1.00 0.00 C ATOM 870 O GLU A 427 2.290 17.183 -0.847 1.00 0.00 O ATOM 871 CB GLU A 427 1.029 17.879 -3.415 1.00 0.00 C ATOM 872 CG GLU A 427 1.491 19.042 -4.279 1.00 0.00 C ATOM 873 CD GLU A 427 0.881 20.363 -3.852 1.00 0.00 C ATOM 874 OE1 GLU A 427 -0.314 20.586 -4.136 1.00 0.00 O ATOM 875 OE2 GLU A 427 1.601 21.175 -3.233 1.00 0.00 O ATOM 0 H GLU A 427 0.647 15.419 -2.608 1.00 0.00 H new ATOM 0 HA GLU A 427 2.798 16.836 -4.048 1.00 0.00 H new ATOM 0 HB2 GLU A 427 0.151 17.423 -3.873 1.00 0.00 H new ATOM 0 HB3 GLU A 427 0.719 18.260 -2.442 1.00 0.00 H new ATOM 0 HG2 GLU A 427 2.578 19.116 -4.232 1.00 0.00 H new ATOM 0 HG3 GLU A 427 1.229 18.844 -5.318 1.00 0.00 H new ATOM 882 N THR A 428 4.193 17.194 -2.049 1.00 0.00 N ATOM 883 CA THR A 428 5.047 17.455 -0.897 1.00 0.00 C ATOM 884 C THR A 428 5.938 18.669 -1.143 1.00 0.00 C ATOM 885 O THR A 428 6.018 19.572 -0.310 1.00 0.00 O ATOM 886 CB THR A 428 5.911 16.232 -0.586 1.00 0.00 C ATOM 887 OG1 THR A 428 6.853 16.526 0.430 1.00 0.00 O ATOM 888 CG2 THR A 428 6.677 15.718 -1.787 1.00 0.00 C ATOM 0 H THR A 428 4.693 17.110 -2.934 1.00 0.00 H new ATOM 0 HA THR A 428 4.404 17.664 -0.042 1.00 0.00 H new ATOM 0 HB THR A 428 5.211 15.461 -0.264 1.00 0.00 H new ATOM 0 HG1 THR A 428 7.394 15.730 0.615 1.00 0.00 H new ATOM 0 HG21 THR A 428 7.269 14.850 -1.497 1.00 0.00 H new ATOM 0 HG22 THR A 428 5.976 15.433 -2.571 1.00 0.00 H new ATOM 0 HG23 THR A 428 7.338 16.501 -2.159 1.00 0.00 H new ATOM 896 N GLY A 429 6.604 18.686 -2.293 1.00 0.00 N ATOM 897 CA GLY A 429 7.480 19.793 -2.628 1.00 0.00 C ATOM 898 C GLY A 429 8.548 20.026 -1.578 1.00 0.00 C ATOM 899 O GLY A 429 9.022 21.149 -1.404 1.00 0.00 O ATOM 0 H GLY A 429 6.552 17.952 -2.999 1.00 0.00 H new ATOM 0 HA2 GLY A 429 7.956 19.597 -3.589 1.00 0.00 H new ATOM 0 HA3 GLY A 429 6.886 20.700 -2.745 1.00 0.00 H new ATOM 903 N GLY A 430 8.927 18.964 -0.874 1.00 0.00 N ATOM 904 CA GLY A 430 9.940 19.078 0.156 1.00 0.00 C ATOM 905 C GLY A 430 9.345 19.158 1.548 1.00 0.00 C ATOM 906 O GLY A 430 9.934 19.753 2.451 1.00 0.00 O ATOM 0 H GLY A 430 8.549 18.025 -1.000 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.610 18.220 0.099 1.00 0.00 H new ATOM 0 HA3 GLY A 430 10.544 19.966 -0.029 1.00 0.00 H new ATOM 910 N GLN A 431 8.171 18.558 1.722 1.00 0.00 N ATOM 911 CA GLN A 431 7.492 18.564 3.013 1.00 0.00 C ATOM 912 C GLN A 431 7.918 17.368 3.858 1.00 0.00 C ATOM 913 O GLN A 431 7.839 16.222 3.416 1.00 0.00 O ATOM 914 CB GLN A 431 5.975 18.554 2.815 1.00 0.00 C ATOM 915 CG GLN A 431 5.242 19.556 3.692 1.00 0.00 C ATOM 916 CD GLN A 431 4.425 18.892 4.782 1.00 0.00 C ATOM 917 OE1 GLN A 431 3.778 17.870 4.552 1.00 0.00 O ATOM 918 NE2 GLN A 431 4.450 19.471 5.976 1.00 0.00 N ATOM 0 H GLN A 431 7.670 18.062 0.985 1.00 0.00 H new ATOM 0 HA GLN A 431 7.775 19.475 3.541 1.00 0.00 H new ATOM 0 HB2 GLN A 431 5.752 18.767 1.770 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.596 17.554 3.025 1.00 0.00 H new ATOM 0 HG2 GLN A 431 5.966 20.232 4.147 1.00 0.00 H new ATOM 0 HG3 GLN A 431 4.585 20.164 3.070 1.00 0.00 H new ATOM 0 HE21 GLN A 431 5.000 20.317 6.121 1.00 0.00 H new ATOM 0 HE22 GLN A 431 3.919 19.070 6.749 1.00 0.00 H new ATOM 927 N ASP A 432 8.373 17.643 5.076 1.00 0.00 N ATOM 928 CA ASP A 432 8.814 16.591 5.986 1.00 0.00 C ATOM 929 C ASP A 432 7.697 15.585 6.244 1.00 0.00 C ATOM 930 O ASP A 432 7.945 14.382 6.354 1.00 0.00 O ATOM 931 CB ASP A 432 9.285 17.198 7.309 1.00 0.00 C ATOM 932 CG ASP A 432 10.480 16.467 7.887 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.413 16.152 7.118 1.00 0.00 O ATOM 934 OD2 ASP A 432 10.485 16.211 9.109 1.00 0.00 O ATOM 0 H ASP A 432 8.446 18.587 5.456 1.00 0.00 H new ATOM 0 HA ASP A 432 9.646 16.066 5.516 1.00 0.00 H new ATOM 0 HB2 ASP A 432 9.544 18.245 7.153 1.00 0.00 H new ATOM 0 HB3 ASP A 432 8.466 17.175 8.028 1.00 0.00 H new ATOM 939 N SER A 433 6.466 16.082 6.340 1.00 0.00 N ATOM 940 CA SER A 433 5.312 15.223 6.588 1.00 0.00 C ATOM 941 C SER A 433 5.215 14.122 5.537 1.00 0.00 C ATOM 942 O SER A 433 5.425 12.944 5.835 1.00 0.00 O ATOM 943 CB SER A 433 4.026 16.053 6.596 1.00 0.00 C ATOM 944 OG SER A 433 3.158 15.638 7.635 1.00 0.00 O ATOM 0 H SER A 433 6.243 17.073 6.250 1.00 0.00 H new ATOM 0 HA SER A 433 5.442 14.756 7.564 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.271 17.108 6.722 1.00 0.00 H new ATOM 0 HB3 SER A 433 3.521 15.956 5.635 1.00 0.00 H new ATOM 0 HG SER A 433 2.345 16.185 7.620 1.00 0.00 H new ATOM 950 N VAL A 434 4.898 14.509 4.306 1.00 0.00 N ATOM 951 CA VAL A 434 4.777 13.552 3.214 1.00 0.00 C ATOM 952 C VAL A 434 6.101 12.836 2.968 1.00 0.00 C ATOM 953 O VAL A 434 6.123 11.716 2.463 1.00 0.00 O ATOM 954 CB VAL A 434 4.309 14.238 1.913 1.00 0.00 C ATOM 955 CG1 VAL A 434 4.350 13.269 0.739 1.00 0.00 C ATOM 956 CG2 VAL A 434 2.907 14.802 2.090 1.00 0.00 C ATOM 0 H VAL A 434 4.721 15.478 4.040 1.00 0.00 H new ATOM 0 HA VAL A 434 4.026 12.819 3.509 1.00 0.00 H new ATOM 0 HB VAL A 434 4.992 15.059 1.695 1.00 0.00 H new ATOM 0 HG11 VAL A 434 4.015 13.778 -0.165 1.00 0.00 H new ATOM 0 HG12 VAL A 434 5.370 12.912 0.598 1.00 0.00 H new ATOM 0 HG13 VAL A 434 3.694 12.423 0.943 1.00 0.00 H new ATOM 0 HG21 VAL A 434 2.589 15.283 1.165 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.218 13.994 2.334 1.00 0.00 H new ATOM 0 HG23 VAL A 434 2.909 15.534 2.898 1.00 0.00 H new ATOM 966 N ARG A 435 7.205 13.483 3.332 1.00 0.00 N ATOM 967 CA ARG A 435 8.525 12.892 3.151 1.00 0.00 C ATOM 968 C ARG A 435 8.629 11.574 3.915 1.00 0.00 C ATOM 969 O ARG A 435 8.809 10.510 3.321 1.00 0.00 O ATOM 970 CB ARG A 435 9.612 13.860 3.622 1.00 0.00 C ATOM 971 CG ARG A 435 10.249 14.655 2.494 1.00 0.00 C ATOM 972 CD ARG A 435 11.711 14.960 2.782 1.00 0.00 C ATOM 973 NE ARG A 435 12.611 14.104 2.010 1.00 0.00 N ATOM 974 CZ ARG A 435 13.894 14.384 1.792 1.00 0.00 C ATOM 975 NH1 ARG A 435 14.432 15.491 2.284 1.00 0.00 N ATOM 976 NH2 ARG A 435 14.641 13.552 1.080 1.00 0.00 N ATOM 0 H ARG A 435 7.211 14.412 3.752 1.00 0.00 H new ATOM 0 HA ARG A 435 8.670 12.693 2.089 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.182 14.553 4.345 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.387 13.297 4.142 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.170 14.094 1.563 1.00 0.00 H new ATOM 0 HG3 ARG A 435 9.703 15.588 2.352 1.00 0.00 H new ATOM 0 HD2 ARG A 435 11.916 16.005 2.549 1.00 0.00 H new ATOM 0 HD3 ARG A 435 11.907 14.826 3.846 1.00 0.00 H new ATOM 0 HE ARG A 435 12.234 13.242 1.616 1.00 0.00 H new ATOM 0 HH11 ARG A 435 13.862 16.134 2.833 1.00 0.00 H new ATOM 0 HH12 ARG A 435 15.416 15.699 2.113 1.00 0.00 H new ATOM 0 HH21 ARG A 435 14.233 12.698 0.700 1.00 0.00 H new ATOM 0 HH22 ARG A 435 15.624 13.766 0.912 1.00 0.00 H new ATOM 990 N GLN A 436 8.503 11.655 5.237 1.00 0.00 N ATOM 991 CA GLN A 436 8.573 10.470 6.082 1.00 0.00 C ATOM 992 C GLN A 436 7.417 9.525 5.775 1.00 0.00 C ATOM 993 O GLN A 436 7.601 8.311 5.682 1.00 0.00 O ATOM 994 CB GLN A 436 8.546 10.867 7.559 1.00 0.00 C ATOM 995 CG GLN A 436 9.442 10.008 8.437 1.00 0.00 C ATOM 996 CD GLN A 436 10.149 10.813 9.511 1.00 0.00 C ATOM 997 OE1 GLN A 436 9.990 12.031 9.598 1.00 0.00 O ATOM 998 NE2 GLN A 436 10.938 10.133 10.336 1.00 0.00 N ATOM 0 H GLN A 436 8.352 12.527 5.744 1.00 0.00 H new ATOM 0 HA GLN A 436 9.510 9.955 5.872 1.00 0.00 H new ATOM 0 HB2 GLN A 436 8.852 11.909 7.652 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.522 10.801 7.926 1.00 0.00 H new ATOM 0 HG2 GLN A 436 8.844 9.228 8.907 1.00 0.00 H new ATOM 0 HG3 GLN A 436 10.184 9.509 7.814 1.00 0.00 H new ATOM 0 HE21 GLN A 436 11.041 9.124 10.228 1.00 0.00 H new ATOM 0 HE22 GLN A 436 11.441 10.620 11.078 1.00 0.00 H new ATOM 1007 N ALA A 437 6.225 10.091 5.614 1.00 0.00 N ATOM 1008 CA ALA A 437 5.037 9.304 5.312 1.00 0.00 C ATOM 1009 C ALA A 437 5.193 8.574 3.982 1.00 0.00 C ATOM 1010 O ALA A 437 4.703 7.457 3.816 1.00 0.00 O ATOM 1011 CB ALA A 437 3.806 10.199 5.289 1.00 0.00 C ATOM 0 H ALA A 437 6.057 11.094 5.688 1.00 0.00 H new ATOM 0 HA ALA A 437 4.911 8.556 6.095 1.00 0.00 H new ATOM 0 HB1 ALA A 437 2.924 9.599 5.062 1.00 0.00 H new ATOM 0 HB2 ALA A 437 3.682 10.672 6.263 1.00 0.00 H new ATOM 0 HB3 ALA A 437 3.929 10.967 4.525 1.00 0.00 H new ATOM 1017 N ARG A 438 5.882 9.212 3.039 1.00 0.00 N ATOM 1018 CA ARG A 438 6.107 8.619 1.726 1.00 0.00 C ATOM 1019 C ARG A 438 7.069 7.443 1.828 1.00 0.00 C ATOM 1020 O ARG A 438 6.740 6.324 1.436 1.00 0.00 O ATOM 1021 CB ARG A 438 6.657 9.664 0.752 1.00 0.00 C ATOM 1022 CG ARG A 438 6.956 9.111 -0.632 1.00 0.00 C ATOM 1023 CD ARG A 438 7.353 10.213 -1.600 1.00 0.00 C ATOM 1024 NE ARG A 438 8.207 9.715 -2.678 1.00 0.00 N ATOM 1025 CZ ARG A 438 9.434 9.235 -2.489 1.00 0.00 C ATOM 1026 NH1 ARG A 438 9.955 9.184 -1.269 1.00 0.00 N ATOM 1027 NH2 ARG A 438 10.142 8.803 -3.523 1.00 0.00 N ATOM 0 H ARG A 438 6.293 10.138 3.160 1.00 0.00 H new ATOM 0 HA ARG A 438 5.151 8.257 1.348 1.00 0.00 H new ATOM 0 HB2 ARG A 438 5.937 10.477 0.661 1.00 0.00 H new ATOM 0 HB3 ARG A 438 7.570 10.091 1.168 1.00 0.00 H new ATOM 0 HG2 ARG A 438 7.759 8.377 -0.566 1.00 0.00 H new ATOM 0 HG3 ARG A 438 6.078 8.589 -1.014 1.00 0.00 H new ATOM 0 HD2 ARG A 438 6.456 10.661 -2.026 1.00 0.00 H new ATOM 0 HD3 ARG A 438 7.876 11.001 -1.058 1.00 0.00 H new ATOM 0 HE ARG A 438 7.841 9.737 -3.630 1.00 0.00 H new ATOM 0 HH11 ARG A 438 9.414 9.514 -0.469 1.00 0.00 H new ATOM 0 HH12 ARG A 438 10.896 8.815 -1.131 1.00 0.00 H new ATOM 0 HH21 ARG A 438 9.746 8.839 -4.463 1.00 0.00 H new ATOM 0 HH22 ARG A 438 11.082 8.435 -3.379 1.00 0.00 H new ATOM 1041 N LYS A 439 8.258 7.699 2.368 1.00 0.00 N ATOM 1042 CA LYS A 439 9.263 6.651 2.529 1.00 0.00 C ATOM 1043 C LYS A 439 8.671 5.457 3.270 1.00 0.00 C ATOM 1044 O LYS A 439 8.805 4.311 2.837 1.00 0.00 O ATOM 1045 CB LYS A 439 10.478 7.189 3.287 1.00 0.00 C ATOM 1046 CG LYS A 439 11.358 8.106 2.452 1.00 0.00 C ATOM 1047 CD LYS A 439 12.573 8.578 3.234 1.00 0.00 C ATOM 1048 CE LYS A 439 13.701 7.562 3.178 1.00 0.00 C ATOM 1049 NZ LYS A 439 14.061 7.208 1.777 1.00 0.00 N ATOM 0 H LYS A 439 8.549 8.619 2.700 1.00 0.00 H new ATOM 0 HA LYS A 439 9.583 6.326 1.539 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.135 7.731 4.168 1.00 0.00 H new ATOM 0 HB3 LYS A 439 11.076 6.349 3.642 1.00 0.00 H new ATOM 0 HG2 LYS A 439 11.684 7.581 1.554 1.00 0.00 H new ATOM 0 HG3 LYS A 439 10.778 8.969 2.124 1.00 0.00 H new ATOM 0 HD2 LYS A 439 12.919 9.530 2.831 1.00 0.00 H new ATOM 0 HD3 LYS A 439 12.292 8.755 4.272 1.00 0.00 H new ATOM 0 HE2 LYS A 439 14.577 7.964 3.687 1.00 0.00 H new ATOM 0 HE3 LYS A 439 13.405 6.661 3.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 15.047 6.878 1.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 13.432 6.453 1.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 13.956 8.046 1.169 1.00 0.00 H new ATOM 1063 N GLU A 440 7.998 5.739 4.381 1.00 0.00 N ATOM 1064 CA GLU A 440 7.366 4.695 5.179 1.00 0.00 C ATOM 1065 C GLU A 440 6.331 3.950 4.344 1.00 0.00 C ATOM 1066 O GLU A 440 6.293 2.717 4.331 1.00 0.00 O ATOM 1067 CB GLU A 440 6.711 5.310 6.421 1.00 0.00 C ATOM 1068 CG GLU A 440 5.837 4.339 7.202 1.00 0.00 C ATOM 1069 CD GLU A 440 6.636 3.224 7.846 1.00 0.00 C ATOM 1070 OE1 GLU A 440 7.341 2.498 7.113 1.00 0.00 O ATOM 1071 OE2 GLU A 440 6.558 3.075 9.084 1.00 0.00 O ATOM 0 H GLU A 440 7.876 6.682 4.749 1.00 0.00 H new ATOM 0 HA GLU A 440 8.127 3.984 5.501 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.491 5.692 7.080 1.00 0.00 H new ATOM 0 HB3 GLU A 440 6.106 6.163 6.116 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.294 4.885 7.974 1.00 0.00 H new ATOM 0 HG3 GLU A 440 5.092 3.908 6.533 1.00 0.00 H new ATOM 1078 N ALA A 441 5.496 4.708 3.639 1.00 0.00 N ATOM 1079 CA ALA A 441 4.465 4.126 2.792 1.00 0.00 C ATOM 1080 C ALA A 441 5.087 3.258 1.706 1.00 0.00 C ATOM 1081 O ALA A 441 4.629 2.145 1.449 1.00 0.00 O ATOM 1082 CB ALA A 441 3.608 5.220 2.174 1.00 0.00 C ATOM 0 H ALA A 441 5.515 5.728 3.639 1.00 0.00 H new ATOM 0 HA ALA A 441 3.828 3.494 3.411 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.842 4.769 1.543 1.00 0.00 H new ATOM 0 HB2 ALA A 441 3.132 5.800 2.965 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.235 5.876 1.570 1.00 0.00 H new ATOM 1088 N VAL A 442 6.138 3.774 1.074 1.00 0.00 N ATOM 1089 CA VAL A 442 6.830 3.043 0.018 1.00 0.00 C ATOM 1090 C VAL A 442 7.356 1.711 0.538 1.00 0.00 C ATOM 1091 O VAL A 442 7.266 0.688 -0.140 1.00 0.00 O ATOM 1092 CB VAL A 442 8.005 3.859 -0.557 1.00 0.00 C ATOM 1093 CG1 VAL A 442 8.629 3.137 -1.743 1.00 0.00 C ATOM 1094 CG2 VAL A 442 7.544 5.255 -0.955 1.00 0.00 C ATOM 0 H VAL A 442 6.528 4.695 1.275 1.00 0.00 H new ATOM 0 HA VAL A 442 6.104 2.864 -0.775 1.00 0.00 H new ATOM 0 HB VAL A 442 8.765 3.960 0.218 1.00 0.00 H new ATOM 0 HG11 VAL A 442 9.456 3.729 -2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 442 8.999 2.163 -1.422 1.00 0.00 H new ATOM 0 HG13 VAL A 442 7.879 3.001 -2.522 1.00 0.00 H new ATOM 0 HG21 VAL A 442 8.387 5.815 -1.358 1.00 0.00 H new ATOM 0 HG22 VAL A 442 6.764 5.178 -1.712 1.00 0.00 H new ATOM 0 HG23 VAL A 442 7.151 5.772 -0.080 1.00 0.00 H new ATOM 1104 N CYS A 443 7.900 1.729 1.750 1.00 0.00 N ATOM 1105 CA CYS A 443 8.430 0.518 2.362 1.00 0.00 C ATOM 1106 C CYS A 443 7.316 -0.502 2.569 1.00 0.00 C ATOM 1107 O CYS A 443 7.446 -1.664 2.186 1.00 0.00 O ATOM 1108 CB CYS A 443 9.098 0.845 3.700 1.00 0.00 C ATOM 1109 SG CYS A 443 10.824 1.363 3.555 1.00 0.00 S ATOM 0 H CYS A 443 7.985 2.567 2.326 1.00 0.00 H new ATOM 0 HA CYS A 443 9.177 0.091 1.693 1.00 0.00 H new ATOM 0 HB2 CYS A 443 8.532 1.636 4.193 1.00 0.00 H new ATOM 0 HB3 CYS A 443 9.046 -0.033 4.344 1.00 0.00 H new ATOM 0 HG CYS A 443 11.301 1.619 4.737 1.00 0.00 H new ATOM 1115 N LYS A 444 6.221 -0.053 3.175 1.00 0.00 N ATOM 1116 CA LYS A 444 5.076 -0.916 3.435 1.00 0.00 C ATOM 1117 C LYS A 444 4.504 -1.474 2.135 1.00 0.00 C ATOM 1118 O LYS A 444 4.495 -2.686 1.925 1.00 0.00 O ATOM 1119 CB LYS A 444 3.994 -0.147 4.194 1.00 0.00 C ATOM 1120 CG LYS A 444 4.422 0.292 5.585 1.00 0.00 C ATOM 1121 CD LYS A 444 3.345 0.004 6.620 1.00 0.00 C ATOM 1122 CE LYS A 444 2.118 0.874 6.402 1.00 0.00 C ATOM 1123 NZ LYS A 444 1.073 0.629 7.434 1.00 0.00 N ATOM 0 H LYS A 444 6.103 0.908 3.496 1.00 0.00 H new ATOM 0 HA LYS A 444 5.416 -1.752 4.047 1.00 0.00 H new ATOM 0 HB2 LYS A 444 3.711 0.732 3.615 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.106 -0.773 4.277 1.00 0.00 H new ATOM 0 HG2 LYS A 444 5.341 -0.223 5.863 1.00 0.00 H new ATOM 0 HG3 LYS A 444 4.644 1.359 5.578 1.00 0.00 H new ATOM 0 HD2 LYS A 444 3.061 -1.047 6.569 1.00 0.00 H new ATOM 0 HD3 LYS A 444 3.743 0.178 7.620 1.00 0.00 H new ATOM 0 HE2 LYS A 444 2.409 1.924 6.423 1.00 0.00 H new ATOM 0 HE3 LYS A 444 1.705 0.677 5.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 0.253 1.242 7.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 0.776 -0.367 7.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 1.459 0.841 8.376 1.00 0.00 H new ATOM 1137 N ILE A 445 4.027 -0.585 1.263 1.00 0.00 N ATOM 1138 CA ILE A 445 3.455 -1.003 -0.016 1.00 0.00 C ATOM 1139 C ILE A 445 4.374 -1.994 -0.721 1.00 0.00 C ATOM 1140 O ILE A 445 3.930 -3.043 -1.189 1.00 0.00 O ATOM 1141 CB ILE A 445 3.190 0.198 -0.947 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.461 1.027 -1.133 1.00 0.00 C ATOM 1143 CG2 ILE A 445 2.067 1.061 -0.389 1.00 0.00 C ATOM 1144 CD1 ILE A 445 5.253 0.649 -2.366 1.00 0.00 C ATOM 0 H ILE A 445 4.025 0.423 1.418 1.00 0.00 H new ATOM 0 HA ILE A 445 2.502 -1.483 0.206 1.00 0.00 H new ATOM 0 HB ILE A 445 2.885 -0.182 -1.922 1.00 0.00 H new ATOM 0 HG12 ILE A 445 4.192 2.082 -1.193 1.00 0.00 H new ATOM 0 HG13 ILE A 445 5.094 0.909 -0.254 1.00 0.00 H new ATOM 0 HG21 ILE A 445 1.891 1.905 -1.056 1.00 0.00 H new ATOM 0 HG22 ILE A 445 1.157 0.466 -0.308 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.348 1.431 0.597 1.00 0.00 H new ATOM 0 HD11 ILE A 445 6.141 1.277 -2.435 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.553 -0.397 -2.299 1.00 0.00 H new ATOM 0 HD13 ILE A 445 4.636 0.794 -3.253 1.00 0.00 H new ATOM 1156 N GLN A 446 5.662 -1.667 -0.775 1.00 0.00 N ATOM 1157 CA GLN A 446 6.642 -2.543 -1.401 1.00 0.00 C ATOM 1158 C GLN A 446 6.809 -3.808 -0.570 1.00 0.00 C ATOM 1159 O GLN A 446 7.088 -4.885 -1.099 1.00 0.00 O ATOM 1160 CB GLN A 446 7.987 -1.826 -1.547 1.00 0.00 C ATOM 1161 CG GLN A 446 9.057 -2.672 -2.216 1.00 0.00 C ATOM 1162 CD GLN A 446 10.413 -2.526 -1.555 1.00 0.00 C ATOM 1163 OE1 GLN A 446 10.963 -3.490 -1.021 1.00 0.00 O ATOM 1164 NE2 GLN A 446 10.959 -1.317 -1.585 1.00 0.00 N ATOM 0 H GLN A 446 6.049 -0.804 -0.393 1.00 0.00 H new ATOM 0 HA GLN A 446 6.286 -2.813 -2.395 1.00 0.00 H new ATOM 0 HB2 GLN A 446 7.842 -0.914 -2.126 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.338 -1.525 -0.560 1.00 0.00 H new ATOM 0 HG2 GLN A 446 8.755 -3.719 -2.191 1.00 0.00 H new ATOM 0 HG3 GLN A 446 9.136 -2.388 -3.265 1.00 0.00 H new ATOM 0 HE21 GLN A 446 10.468 -0.547 -2.039 1.00 0.00 H new ATOM 0 HE22 GLN A 446 11.870 -1.158 -1.155 1.00 0.00 H new ATOM 1173 N ALA A 447 6.623 -3.665 0.740 1.00 0.00 N ATOM 1174 CA ALA A 447 6.737 -4.787 1.660 1.00 0.00 C ATOM 1175 C ALA A 447 5.598 -5.778 1.438 1.00 0.00 C ATOM 1176 O ALA A 447 5.826 -6.976 1.269 1.00 0.00 O ATOM 1177 CB ALA A 447 6.738 -4.283 3.098 1.00 0.00 C ATOM 0 H ALA A 447 6.392 -2.778 1.187 1.00 0.00 H new ATOM 0 HA ALA A 447 7.678 -5.303 1.470 1.00 0.00 H new ATOM 0 HB1 ALA A 447 6.824 -5.129 3.780 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.582 -3.610 3.247 1.00 0.00 H new ATOM 0 HB3 ALA A 447 5.809 -3.749 3.297 1.00 0.00 H new ATOM 1183 N ILE A 448 4.374 -5.262 1.433 1.00 0.00 N ATOM 1184 CA ILE A 448 3.195 -6.091 1.223 1.00 0.00 C ATOM 1185 C ILE A 448 3.223 -6.732 -0.162 1.00 0.00 C ATOM 1186 O ILE A 448 2.861 -7.898 -0.326 1.00 0.00 O ATOM 1187 CB ILE A 448 1.896 -5.271 1.386 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.666 -6.134 1.090 1.00 0.00 C ATOM 1189 CG2 ILE A 448 1.921 -4.048 0.483 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.644 -5.398 1.267 1.00 0.00 C ATOM 0 H ILE A 448 4.173 -4.272 1.572 1.00 0.00 H new ATOM 0 HA ILE A 448 3.210 -6.874 1.981 1.00 0.00 H new ATOM 0 HB ILE A 448 1.833 -4.935 2.421 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.730 -6.505 0.067 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.676 -7.004 1.746 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.998 -3.482 0.611 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.772 -3.419 0.746 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.011 -4.365 -0.556 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.472 -6.070 1.041 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.730 -5.050 2.296 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.675 -4.543 0.591 1.00 0.00 H new ATOM 1202 N LEU A 449 3.662 -5.962 -1.155 1.00 0.00 N ATOM 1203 CA LEU A 449 3.744 -6.459 -2.522 1.00 0.00 C ATOM 1204 C LEU A 449 4.743 -7.606 -2.617 1.00 0.00 C ATOM 1205 O LEU A 449 4.450 -8.651 -3.198 1.00 0.00 O ATOM 1206 CB LEU A 449 4.146 -5.332 -3.476 1.00 0.00 C ATOM 1207 CG LEU A 449 3.398 -5.316 -4.810 1.00 0.00 C ATOM 1208 CD1 LEU A 449 1.923 -5.015 -4.591 1.00 0.00 C ATOM 1209 CD2 LEU A 449 4.017 -4.300 -5.757 1.00 0.00 C ATOM 0 H LEU A 449 3.965 -4.995 -1.037 1.00 0.00 H new ATOM 0 HA LEU A 449 2.760 -6.830 -2.810 1.00 0.00 H new ATOM 0 HB2 LEU A 449 3.985 -4.378 -2.975 1.00 0.00 H new ATOM 0 HB3 LEU A 449 5.214 -5.410 -3.677 1.00 0.00 H new ATOM 0 HG LEU A 449 3.483 -6.303 -5.264 1.00 0.00 H new ATOM 0 HD11 LEU A 449 1.407 -5.008 -5.551 1.00 0.00 H new ATOM 0 HD12 LEU A 449 1.487 -5.781 -3.950 1.00 0.00 H new ATOM 0 HD13 LEU A 449 1.817 -4.040 -4.115 1.00 0.00 H new ATOM 0 HD21 LEU A 449 3.472 -4.303 -6.701 1.00 0.00 H new ATOM 0 HD22 LEU A 449 3.964 -3.307 -5.310 1.00 0.00 H new ATOM 0 HD23 LEU A 449 5.059 -4.561 -5.940 1.00 0.00 H new ATOM 1221 N GLU A 450 5.920 -7.407 -2.034 1.00 0.00 N ATOM 1222 CA GLU A 450 6.959 -8.428 -2.045 1.00 0.00 C ATOM 1223 C GLU A 450 6.477 -9.689 -1.335 1.00 0.00 C ATOM 1224 O GLU A 450 6.741 -10.805 -1.783 1.00 0.00 O ATOM 1225 CB GLU A 450 8.230 -7.903 -1.375 1.00 0.00 C ATOM 1226 CG GLU A 450 9.505 -8.537 -1.909 1.00 0.00 C ATOM 1227 CD GLU A 450 10.490 -8.881 -0.809 1.00 0.00 C ATOM 1228 OE1 GLU A 450 10.558 -8.126 0.183 1.00 0.00 O ATOM 1229 OE2 GLU A 450 11.193 -9.905 -0.940 1.00 0.00 O ATOM 0 H GLU A 450 6.178 -6.548 -1.548 1.00 0.00 H new ATOM 0 HA GLU A 450 7.185 -8.675 -3.082 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.285 -6.823 -1.514 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.166 -8.083 -0.302 1.00 0.00 H new ATOM 0 HG2 GLU A 450 9.253 -9.442 -2.462 1.00 0.00 H new ATOM 0 HG3 GLU A 450 9.978 -7.854 -2.615 1.00 0.00 H new ATOM 1236 N LYS A 451 5.766 -9.501 -0.229 1.00 0.00 N ATOM 1237 CA LYS A 451 5.240 -10.622 0.541 1.00 0.00 C ATOM 1238 C LYS A 451 4.270 -11.447 -0.299 1.00 0.00 C ATOM 1239 O LYS A 451 4.367 -12.672 -0.353 1.00 0.00 O ATOM 1240 CB LYS A 451 4.540 -10.119 1.805 1.00 0.00 C ATOM 1241 CG LYS A 451 4.352 -11.195 2.864 1.00 0.00 C ATOM 1242 CD LYS A 451 5.533 -11.250 3.818 1.00 0.00 C ATOM 1243 CE LYS A 451 5.230 -12.119 5.030 1.00 0.00 C ATOM 1244 NZ LYS A 451 6.442 -12.833 5.517 1.00 0.00 N ATOM 0 H LYS A 451 5.541 -8.583 0.154 1.00 0.00 H new ATOM 0 HA LYS A 451 6.077 -11.258 0.829 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.120 -9.300 2.230 1.00 0.00 H new ATOM 0 HB3 LYS A 451 3.565 -9.713 1.534 1.00 0.00 H new ATOM 0 HG2 LYS A 451 3.438 -10.999 3.425 1.00 0.00 H new ATOM 0 HG3 LYS A 451 4.228 -12.164 2.381 1.00 0.00 H new ATOM 0 HD2 LYS A 451 6.406 -11.643 3.296 1.00 0.00 H new ATOM 0 HD3 LYS A 451 5.785 -10.241 4.146 1.00 0.00 H new ATOM 0 HE2 LYS A 451 4.828 -11.498 5.831 1.00 0.00 H new ATOM 0 HE3 LYS A 451 4.459 -12.846 4.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 6.194 -13.414 6.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 6.811 -13.445 4.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 7.168 -12.139 5.787 1.00 0.00 H new ATOM 1258 N LEU A 452 3.336 -10.763 -0.955 1.00 0.00 N ATOM 1259 CA LEU A 452 2.351 -11.434 -1.796 1.00 0.00 C ATOM 1260 C LEU A 452 3.030 -12.185 -2.937 1.00 0.00 C ATOM 1261 O LEU A 452 2.664 -13.317 -3.251 1.00 0.00 O ATOM 1262 CB LEU A 452 1.354 -10.418 -2.360 1.00 0.00 C ATOM 1263 CG LEU A 452 0.157 -10.116 -1.457 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.617 -8.916 -1.978 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.750 -11.332 -1.348 1.00 0.00 C ATOM 0 H LEU A 452 3.241 -9.748 -0.920 1.00 0.00 H new ATOM 0 HA LEU A 452 1.815 -12.155 -1.179 1.00 0.00 H new ATOM 0 HB2 LEU A 452 1.883 -9.486 -2.561 1.00 0.00 H new ATOM 0 HB3 LEU A 452 0.984 -10.787 -3.317 1.00 0.00 H new ATOM 0 HG LEU A 452 0.530 -9.876 -0.461 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.465 -8.717 -1.322 1.00 0.00 H new ATOM 0 HD12 LEU A 452 0.036 -8.044 -2.001 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.979 -9.125 -2.985 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.596 -11.098 -0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -1.114 -11.604 -2.339 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -0.190 -12.167 -0.926 1.00 0.00 H new ATOM 1277 N GLU A 453 4.018 -11.544 -3.552 1.00 0.00 N ATOM 1278 CA GLU A 453 4.750 -12.152 -4.658 1.00 0.00 C ATOM 1279 C GLU A 453 5.499 -13.398 -4.196 1.00 0.00 C ATOM 1280 O GLU A 453 5.578 -14.391 -4.918 1.00 0.00 O ATOM 1281 CB GLU A 453 5.732 -11.146 -5.262 1.00 0.00 C ATOM 1282 CG GLU A 453 5.068 -10.103 -6.147 1.00 0.00 C ATOM 1283 CD GLU A 453 5.791 -9.913 -7.467 1.00 0.00 C ATOM 1284 OE1 GLU A 453 7.037 -9.985 -7.477 1.00 0.00 O ATOM 1285 OE2 GLU A 453 5.109 -9.692 -8.489 1.00 0.00 O ATOM 0 H GLU A 453 4.330 -10.605 -3.304 1.00 0.00 H new ATOM 0 HA GLU A 453 4.028 -12.446 -5.420 1.00 0.00 H new ATOM 0 HB2 GLU A 453 6.264 -10.641 -4.456 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.478 -11.685 -5.847 1.00 0.00 H new ATOM 0 HG2 GLU A 453 4.037 -10.399 -6.341 1.00 0.00 H new ATOM 0 HG3 GLU A 453 5.032 -9.152 -5.616 1.00 0.00 H new ATOM 1292 N LYS A 454 6.049 -13.335 -2.988 1.00 0.00 N ATOM 1293 CA LYS A 454 6.794 -14.457 -2.429 1.00 0.00 C ATOM 1294 C LYS A 454 5.855 -15.596 -2.045 1.00 0.00 C ATOM 1295 O LYS A 454 6.131 -16.763 -2.324 1.00 0.00 O ATOM 1296 CB LYS A 454 7.594 -14.006 -1.205 1.00 0.00 C ATOM 1297 CG LYS A 454 8.468 -15.099 -0.613 1.00 0.00 C ATOM 1298 CD LYS A 454 9.121 -14.649 0.684 1.00 0.00 C ATOM 1299 CE LYS A 454 10.188 -13.595 0.434 1.00 0.00 C ATOM 1300 NZ LYS A 454 11.342 -13.741 1.364 1.00 0.00 N ATOM 0 H LYS A 454 5.993 -12.520 -2.378 1.00 0.00 H new ATOM 0 HA LYS A 454 7.483 -14.819 -3.192 1.00 0.00 H new ATOM 0 HB2 LYS A 454 8.223 -13.161 -1.484 1.00 0.00 H new ATOM 0 HB3 LYS A 454 6.903 -13.651 -0.440 1.00 0.00 H new ATOM 0 HG2 LYS A 454 7.865 -15.988 -0.429 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.238 -15.379 -1.331 1.00 0.00 H new ATOM 0 HD2 LYS A 454 8.361 -14.247 1.355 1.00 0.00 H new ATOM 0 HD3 LYS A 454 9.567 -15.508 1.185 1.00 0.00 H new ATOM 0 HE2 LYS A 454 10.539 -13.671 -0.595 1.00 0.00 H new ATOM 0 HE3 LYS A 454 9.752 -12.603 0.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 12.047 -13.004 1.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 11.012 -13.643 2.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 11.774 -14.678 1.236 1.00 0.00 H new ATOM 1314 N LYS A 455 4.745 -15.251 -1.402 1.00 0.00 N ATOM 1315 CA LYS A 455 3.765 -16.244 -0.979 1.00 0.00 C ATOM 1316 C LYS A 455 2.979 -16.776 -2.172 1.00 0.00 C ATOM 1317 O LYS A 455 2.606 -17.949 -2.210 1.00 0.00 O ATOM 1318 CB LYS A 455 2.807 -15.641 0.050 1.00 0.00 C ATOM 1319 CG LYS A 455 3.323 -15.712 1.478 1.00 0.00 C ATOM 1320 CD LYS A 455 2.185 -15.695 2.484 1.00 0.00 C ATOM 1321 CE LYS A 455 2.648 -16.150 3.857 1.00 0.00 C ATOM 1322 NZ LYS A 455 1.592 -16.914 4.577 1.00 0.00 N ATOM 0 H LYS A 455 4.501 -14.290 -1.162 1.00 0.00 H new ATOM 0 HA LYS A 455 4.302 -17.075 -0.521 1.00 0.00 H new ATOM 0 HB2 LYS A 455 2.619 -14.599 -0.208 1.00 0.00 H new ATOM 0 HB3 LYS A 455 1.851 -16.161 -0.008 1.00 0.00 H new ATOM 0 HG2 LYS A 455 3.911 -16.620 1.608 1.00 0.00 H new ATOM 0 HG3 LYS A 455 3.990 -14.871 1.667 1.00 0.00 H new ATOM 0 HD2 LYS A 455 1.774 -14.688 2.553 1.00 0.00 H new ATOM 0 HD3 LYS A 455 1.381 -16.344 2.136 1.00 0.00 H new ATOM 0 HE2 LYS A 455 3.537 -16.771 3.752 1.00 0.00 H new ATOM 0 HE3 LYS A 455 2.934 -15.281 4.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 1.949 -17.206 5.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 0.752 -16.313 4.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 1.336 -17.757 4.025 1.00 0.00 H new ATOM 1336 N GLY A 456 2.730 -15.906 -3.145 1.00 0.00 N ATOM 1337 CA GLY A 456 1.989 -16.307 -4.327 1.00 0.00 C ATOM 1338 C GLY A 456 2.774 -16.086 -5.606 1.00 0.00 C ATOM 1339 O GLY A 456 4.012 -16.241 -5.577 1.00 0.00 O ATOM 1340 OXT GLY A 456 2.148 -15.758 -6.637 1.00 0.00 O ATOM 0 H GLY A 456 3.028 -14.931 -3.136 1.00 0.00 H new ATOM 0 HA2 GLY A 456 1.723 -17.361 -4.245 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.056 -15.745 -4.375 1.00 0.00 H new