USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=12 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 Single : A 379 SER OG : rot 36:sc= 0 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ 143:sc= 0.246 (180deg=-2.39) USER MOD Single : A 385 HIS : no HD1:sc= -0.201 X(o=-0.2,f=0.04) USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 TYR OH : rot 30:sc= -0.039 USER MOD Single : A 395 GLN : amide:sc= -0.228 K(o=-0.23,f=-2!) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0.0551 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 180:sc= -0.0371 USER MOD Single : A 415 MET CE :methyl 156:sc= -0.205 (180deg=-1.01) USER MOD Single : A 417 THR OG1 : rot 80:sc= 1.13 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= -0.832 USER MOD Single : A 431 GLN : amide:sc= -0.24 K(o=-0.24,f=-2.5!) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.176 K(o=-0.18,f=-1.3!) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ -128:sc= -1.74 (180deg=-4.59!) USER MOD Single : A 446 GLN : amide:sc= -0.109 K(o=-0.11,f=-1.5!) 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 0.248 17.174 1.828 1.00 0.00 N ATOM 44 CA SER A 379 -0.664 16.194 1.251 1.00 0.00 C ATOM 45 C SER A 379 -0.766 14.951 2.138 1.00 0.00 C ATOM 46 O SER A 379 -1.359 13.948 1.744 1.00 0.00 O ATOM 47 CB SER A 379 -0.203 15.797 -0.151 1.00 0.00 C ATOM 48 OG SER A 379 -0.853 16.576 -1.141 1.00 0.00 O ATOM 0 HA SER A 379 -1.651 16.652 1.184 1.00 0.00 H new ATOM 0 HB2 SER A 379 0.876 15.926 -0.233 1.00 0.00 H new ATOM 0 HB3 SER A 379 -0.411 14.741 -0.320 1.00 0.00 H new ATOM 0 HG SER A 379 -0.977 17.490 -0.809 1.00 0.00 H new ATOM 54 N ILE A 380 -0.167 15.024 3.331 1.00 0.00 N ATOM 55 CA ILE A 380 -0.169 13.908 4.278 1.00 0.00 C ATOM 56 C ILE A 380 -1.497 13.147 4.279 1.00 0.00 C ATOM 57 O ILE A 380 -1.526 11.939 4.495 1.00 0.00 O ATOM 58 CB ILE A 380 0.135 14.397 5.708 1.00 0.00 C ATOM 59 CG1 ILE A 380 0.328 13.206 6.650 1.00 0.00 C ATOM 60 CG2 ILE A 380 -0.979 15.304 6.213 1.00 0.00 C ATOM 61 CD1 ILE A 380 1.767 12.746 6.752 1.00 0.00 C ATOM 0 H ILE A 380 0.328 15.851 3.664 1.00 0.00 H new ATOM 0 HA ILE A 380 0.615 13.226 3.949 1.00 0.00 H new ATOM 0 HB ILE A 380 1.060 14.973 5.686 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -0.030 13.476 7.643 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -0.287 12.375 6.304 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -0.746 15.639 7.224 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -1.070 16.169 5.556 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.920 14.754 6.221 1.00 0.00 H new ATOM 0 HD11 ILE A 380 1.831 11.899 7.436 1.00 0.00 H new ATOM 0 HD12 ILE A 380 2.123 12.445 5.767 1.00 0.00 H new ATOM 0 HD13 ILE A 380 2.384 13.562 7.127 1.00 0.00 H new ATOM 73 N LYS A 381 -2.595 13.854 4.032 1.00 0.00 N ATOM 74 CA LYS A 381 -3.909 13.218 4.005 1.00 0.00 C ATOM 75 C LYS A 381 -3.904 12.012 3.067 1.00 0.00 C ATOM 76 O LYS A 381 -4.518 10.982 3.350 1.00 0.00 O ATOM 77 CB LYS A 381 -4.976 14.221 3.562 1.00 0.00 C ATOM 78 CG LYS A 381 -6.296 14.070 4.301 1.00 0.00 C ATOM 79 CD LYS A 381 -7.095 15.362 4.283 1.00 0.00 C ATOM 80 CE LYS A 381 -8.101 15.410 5.422 1.00 0.00 C ATOM 81 NZ LYS A 381 -8.620 16.787 5.648 1.00 0.00 N ATOM 0 H LYS A 381 -2.603 14.857 3.849 1.00 0.00 H new ATOM 0 HA LYS A 381 -4.143 12.874 5.013 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -4.598 15.232 3.713 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -5.152 14.103 2.493 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -6.881 13.273 3.843 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -6.105 13.773 5.332 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.417 16.212 4.359 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -7.617 15.455 3.331 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -8.932 14.741 5.200 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -7.632 15.044 6.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -9.303 16.776 6.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -7.830 17.421 5.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -9.090 17.127 4.785 1.00 0.00 H new ATOM 95 N LYS A 382 -3.200 12.154 1.947 1.00 0.00 N ATOM 96 CA LYS A 382 -3.104 11.088 0.960 1.00 0.00 C ATOM 97 C LYS A 382 -2.345 9.885 1.515 1.00 0.00 C ATOM 98 O LYS A 382 -2.872 8.773 1.549 1.00 0.00 O ATOM 99 CB LYS A 382 -2.415 11.600 -0.305 1.00 0.00 C ATOM 100 CG LYS A 382 -3.050 11.094 -1.591 1.00 0.00 C ATOM 101 CD LYS A 382 -3.197 12.207 -2.617 1.00 0.00 C ATOM 102 CE LYS A 382 -3.210 11.659 -4.035 1.00 0.00 C ATOM 103 NZ LYS A 382 -1.884 11.801 -4.696 1.00 0.00 N ATOM 0 H LYS A 382 -2.687 13.001 1.702 1.00 0.00 H new ATOM 0 HA LYS A 382 -4.116 10.767 0.714 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -2.435 12.690 -0.304 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -1.367 11.301 -0.285 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -2.441 10.292 -2.008 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -4.029 10.669 -1.371 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -4.120 12.757 -2.430 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.376 12.915 -2.507 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -3.495 10.607 -4.015 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -3.966 12.183 -4.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -1.703 10.969 -5.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -1.880 12.658 -5.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -1.141 11.875 -3.972 1.00 0.00 H new ATOM 117 N ILE A 383 -1.105 10.109 1.947 1.00 0.00 N ATOM 118 CA ILE A 383 -0.286 9.031 2.492 1.00 0.00 C ATOM 119 C ILE A 383 -0.995 8.338 3.654 1.00 0.00 C ATOM 120 O ILE A 383 -0.846 7.132 3.855 1.00 0.00 O ATOM 121 CB ILE A 383 1.106 9.532 2.952 1.00 0.00 C ATOM 122 CG1 ILE A 383 1.027 10.203 4.327 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.688 10.493 1.925 1.00 0.00 C ATOM 124 CD1 ILE A 383 1.356 9.269 5.473 1.00 0.00 C ATOM 0 H ILE A 383 -0.649 11.021 1.930 1.00 0.00 H new ATOM 0 HA ILE A 383 -0.136 8.314 1.685 1.00 0.00 H new ATOM 0 HB ILE A 383 1.764 8.667 3.038 1.00 0.00 H new ATOM 0 HG12 ILE A 383 1.713 11.049 4.350 1.00 0.00 H new ATOM 0 HG13 ILE A 383 0.023 10.603 4.471 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.666 10.837 2.262 1.00 0.00 H new ATOM 0 HG22 ILE A 383 1.793 9.983 0.967 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.023 11.349 1.809 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.281 9.810 6.416 1.00 0.00 H new ATOM 0 HD12 ILE A 383 0.654 8.435 5.476 1.00 0.00 H new ATOM 0 HD13 ILE A 383 2.371 8.889 5.353 1.00 0.00 H new ATOM 136 N ILE A 384 -1.777 9.106 4.408 1.00 0.00 N ATOM 137 CA ILE A 384 -2.517 8.561 5.538 1.00 0.00 C ATOM 138 C ILE A 384 -3.605 7.611 5.051 1.00 0.00 C ATOM 139 O ILE A 384 -3.713 6.480 5.526 1.00 0.00 O ATOM 140 CB ILE A 384 -3.152 9.677 6.396 1.00 0.00 C ATOM 141 CG1 ILE A 384 -2.063 10.583 6.974 1.00 0.00 C ATOM 142 CG2 ILE A 384 -3.997 9.083 7.514 1.00 0.00 C ATOM 143 CD1 ILE A 384 -2.540 11.990 7.266 1.00 0.00 C ATOM 0 H ILE A 384 -1.913 10.105 4.256 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.807 8.016 6.159 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.803 10.274 5.758 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -1.682 10.139 7.894 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.229 10.629 6.273 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -4.435 9.887 8.106 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -4.793 8.474 7.085 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -3.370 8.462 8.153 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -1.716 12.576 7.673 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -2.894 12.453 6.345 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -3.354 11.955 7.990 1.00 0.00 H new ATOM 155 N HIS A 385 -4.404 8.073 4.092 1.00 0.00 N ATOM 156 CA HIS A 385 -5.475 7.252 3.535 1.00 0.00 C ATOM 157 C HIS A 385 -4.914 5.939 2.994 1.00 0.00 C ATOM 158 O HIS A 385 -5.356 4.854 3.381 1.00 0.00 O ATOM 159 CB HIS A 385 -6.202 8.008 2.422 1.00 0.00 C ATOM 160 CG HIS A 385 -7.409 8.758 2.899 1.00 0.00 C ATOM 161 ND1 HIS A 385 -8.681 8.226 2.881 1.00 0.00 N ATOM 162 CD2 HIS A 385 -7.533 10.005 3.410 1.00 0.00 C ATOM 163 CE1 HIS A 385 -9.535 9.114 3.359 1.00 0.00 C ATOM 164 NE2 HIS A 385 -8.863 10.202 3.687 1.00 0.00 N ATOM 0 H HIS A 385 -4.331 9.006 3.687 1.00 0.00 H new ATOM 0 HA HIS A 385 -6.186 7.028 4.331 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -5.509 8.709 1.957 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -6.505 7.300 1.651 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -6.734 10.714 3.570 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -10.601 8.974 3.463 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -9.267 11.051 4.082 1.00 0.00 H new ATOM 173 N VAL A 386 -3.927 6.046 2.110 1.00 0.00 N ATOM 174 CA VAL A 386 -3.296 4.869 1.528 1.00 0.00 C ATOM 175 C VAL A 386 -2.676 4.003 2.618 1.00 0.00 C ATOM 176 O VAL A 386 -2.694 2.776 2.535 1.00 0.00 O ATOM 177 CB VAL A 386 -2.207 5.254 0.508 1.00 0.00 C ATOM 178 CG1 VAL A 386 -2.821 5.980 -0.679 1.00 0.00 C ATOM 179 CG2 VAL A 386 -1.134 6.106 1.168 1.00 0.00 C ATOM 0 H VAL A 386 -3.548 6.934 1.782 1.00 0.00 H new ATOM 0 HA VAL A 386 -4.074 4.309 1.010 1.00 0.00 H new ATOM 0 HB VAL A 386 -1.738 4.341 0.142 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -2.037 6.244 -1.389 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -3.548 5.330 -1.166 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -3.318 6.886 -0.334 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.374 6.368 0.432 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.585 7.016 1.564 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.674 5.545 1.982 1.00 0.00 H new ATOM 189 N LEU A 387 -2.141 4.654 3.648 1.00 0.00 N ATOM 190 CA LEU A 387 -1.528 3.944 4.764 1.00 0.00 C ATOM 191 C LEU A 387 -2.542 3.002 5.405 1.00 0.00 C ATOM 192 O LEU A 387 -2.268 1.818 5.600 1.00 0.00 O ATOM 193 CB LEU A 387 -1.001 4.936 5.803 1.00 0.00 C ATOM 194 CG LEU A 387 0.484 5.280 5.673 1.00 0.00 C ATOM 195 CD1 LEU A 387 0.865 6.379 6.653 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.339 4.044 5.899 1.00 0.00 C ATOM 0 H LEU A 387 -2.120 5.670 3.732 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.690 3.358 4.386 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.580 5.857 5.730 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.178 4.526 6.797 1.00 0.00 H new ATOM 0 HG LEU A 387 0.666 5.644 4.662 1.00 0.00 H new ATOM 0 HD11 LEU A 387 1.925 6.610 6.546 1.00 0.00 H new ATOM 0 HD12 LEU A 387 0.276 7.272 6.445 1.00 0.00 H new ATOM 0 HD13 LEU A 387 0.668 6.043 7.671 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.392 4.308 5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.153 3.651 6.899 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.086 3.286 5.158 1.00 0.00 H new ATOM 208 N GLU A 388 -3.720 3.535 5.715 1.00 0.00 N ATOM 209 CA GLU A 388 -4.781 2.738 6.315 1.00 0.00 C ATOM 210 C GLU A 388 -5.169 1.600 5.379 1.00 0.00 C ATOM 211 O GLU A 388 -5.314 0.451 5.803 1.00 0.00 O ATOM 212 CB GLU A 388 -6.001 3.611 6.616 1.00 0.00 C ATOM 213 CG GLU A 388 -6.715 3.233 7.904 1.00 0.00 C ATOM 214 CD GLU A 388 -7.150 4.444 8.706 1.00 0.00 C ATOM 215 OE1 GLU A 388 -6.274 5.115 9.289 1.00 0.00 O ATOM 216 OE2 GLU A 388 -8.367 4.721 8.749 1.00 0.00 O ATOM 0 H GLU A 388 -3.962 4.514 5.560 1.00 0.00 H new ATOM 0 HA GLU A 388 -4.415 2.319 7.252 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.686 4.653 6.677 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.704 3.538 5.786 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -7.589 2.626 7.666 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.055 2.616 8.514 1.00 0.00 H new ATOM 223 N LYS A 389 -5.321 1.926 4.098 1.00 0.00 N ATOM 224 CA LYS A 389 -5.675 0.929 3.095 1.00 0.00 C ATOM 225 C LYS A 389 -4.644 -0.194 3.085 1.00 0.00 C ATOM 226 O LYS A 389 -4.993 -1.375 3.075 1.00 0.00 O ATOM 227 CB LYS A 389 -5.767 1.575 1.711 1.00 0.00 C ATOM 228 CG LYS A 389 -7.025 1.193 0.947 1.00 0.00 C ATOM 229 CD LYS A 389 -7.127 -0.312 0.759 1.00 0.00 C ATOM 230 CE LYS A 389 -8.555 -0.802 0.937 1.00 0.00 C ATOM 231 NZ LYS A 389 -8.605 -2.231 1.348 1.00 0.00 N ATOM 0 H LYS A 389 -5.205 2.871 3.732 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.649 0.510 3.348 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.733 2.659 1.821 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.894 1.287 1.125 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.902 1.554 1.484 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -7.024 1.683 -0.027 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -6.771 -0.580 -0.236 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -6.477 -0.814 1.476 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -9.057 -0.191 1.687 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -9.102 -0.674 0.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.596 -2.526 1.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -8.148 -2.818 0.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -8.106 -2.350 2.252 1.00 0.00 H new ATOM 245 N VAL A 390 -3.368 0.186 3.102 1.00 0.00 N ATOM 246 CA VAL A 390 -2.285 -0.786 3.111 1.00 0.00 C ATOM 247 C VAL A 390 -2.340 -1.627 4.381 1.00 0.00 C ATOM 248 O VAL A 390 -2.032 -2.818 4.363 1.00 0.00 O ATOM 249 CB VAL A 390 -0.906 -0.102 3.010 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.207 -1.139 2.976 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.845 0.793 1.782 1.00 0.00 C ATOM 0 H VAL A 390 -3.062 1.159 3.110 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.415 -1.427 2.239 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.764 0.519 3.895 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.171 -0.636 2.905 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.176 -1.736 3.887 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.072 -1.789 2.112 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.135 1.268 1.726 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -1.009 0.194 0.886 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.616 1.560 1.852 1.00 0.00 H new ATOM 261 N GLN A 391 -2.752 -0.999 5.480 1.00 0.00 N ATOM 262 CA GLN A 391 -2.865 -1.695 6.755 1.00 0.00 C ATOM 263 C GLN A 391 -3.863 -2.841 6.635 1.00 0.00 C ATOM 264 O GLN A 391 -3.541 -3.996 6.924 1.00 0.00 O ATOM 265 CB GLN A 391 -3.306 -0.727 7.855 1.00 0.00 C ATOM 266 CG GLN A 391 -2.701 -1.035 9.215 1.00 0.00 C ATOM 267 CD GLN A 391 -3.418 -0.327 10.347 1.00 0.00 C ATOM 268 OE1 GLN A 391 -4.328 -0.879 10.964 1.00 0.00 O ATOM 269 NE2 GLN A 391 -3.009 0.907 10.624 1.00 0.00 N ATOM 0 H GLN A 391 -3.012 -0.013 5.511 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.888 -2.100 7.020 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -3.032 0.288 7.566 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -4.393 -0.753 7.936 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -2.732 -2.111 9.387 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.651 -0.742 9.216 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -2.250 1.326 10.086 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -3.454 1.435 11.375 1.00 0.00 H new ATOM 278 N TYR A 392 -5.073 -2.514 6.185 1.00 0.00 N ATOM 279 CA TYR A 392 -6.112 -3.519 6.004 1.00 0.00 C ATOM 280 C TYR A 392 -5.611 -4.620 5.079 1.00 0.00 C ATOM 281 O TYR A 392 -5.771 -5.808 5.360 1.00 0.00 O ATOM 282 CB TYR A 392 -7.378 -2.884 5.425 1.00 0.00 C ATOM 283 CG TYR A 392 -7.941 -1.767 6.275 1.00 0.00 C ATOM 284 CD1 TYR A 392 -8.295 -1.987 7.600 1.00 0.00 C ATOM 285 CD2 TYR A 392 -8.115 -0.492 5.752 1.00 0.00 C ATOM 286 CE1 TYR A 392 -8.811 -0.969 8.379 1.00 0.00 C ATOM 287 CE2 TYR A 392 -8.628 0.532 6.526 1.00 0.00 C ATOM 288 CZ TYR A 392 -8.975 0.288 7.837 1.00 0.00 C ATOM 289 OH TYR A 392 -9.486 1.305 8.610 1.00 0.00 O ATOM 0 H TYR A 392 -5.355 -1.565 5.941 1.00 0.00 H new ATOM 0 HA TYR A 392 -6.354 -3.950 6.976 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -7.157 -2.496 4.431 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -8.138 -3.656 5.304 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -8.165 -2.970 8.028 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.845 -0.298 4.724 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -9.084 -1.157 9.407 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.756 1.518 6.105 1.00 0.00 H new ATOM 0 HH TYR A 392 -9.242 1.158 9.548 1.00 0.00 H new ATOM 299 N LEU A 393 -4.984 -4.211 3.980 1.00 0.00 N ATOM 300 CA LEU A 393 -4.437 -5.158 3.021 1.00 0.00 C ATOM 301 C LEU A 393 -3.340 -5.985 3.676 1.00 0.00 C ATOM 302 O LEU A 393 -3.203 -7.179 3.408 1.00 0.00 O ATOM 303 CB LEU A 393 -3.889 -4.422 1.796 1.00 0.00 C ATOM 304 CG LEU A 393 -4.862 -4.321 0.618 1.00 0.00 C ATOM 305 CD1 LEU A 393 -4.934 -2.891 0.102 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.455 -5.277 -0.495 1.00 0.00 C ATOM 0 H LEU A 393 -4.844 -3.231 3.734 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.234 -5.825 2.693 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.597 -3.415 2.095 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.985 -4.929 1.460 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.855 -4.606 0.967 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -5.631 -2.841 -0.735 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -5.278 -2.233 0.900 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -3.945 -2.574 -0.229 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -5.158 -5.191 -1.324 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.453 -5.026 -0.842 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.462 -6.299 -0.117 1.00 0.00 H new ATOM 318 N GLU A 394 -2.570 -5.345 4.554 1.00 0.00 N ATOM 319 CA GLU A 394 -1.497 -6.025 5.268 1.00 0.00 C ATOM 320 C GLU A 394 -2.062 -7.210 6.038 1.00 0.00 C ATOM 321 O GLU A 394 -1.561 -8.332 5.938 1.00 0.00 O ATOM 322 CB GLU A 394 -0.794 -5.062 6.225 1.00 0.00 C ATOM 323 CG GLU A 394 0.525 -5.593 6.763 1.00 0.00 C ATOM 324 CD GLU A 394 1.586 -4.516 6.876 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.220 -3.322 6.904 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.784 -4.865 6.935 1.00 0.00 O ATOM 0 H GLU A 394 -2.671 -4.357 4.786 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.766 -6.384 4.544 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -0.613 -4.119 5.710 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -1.458 -4.846 7.062 1.00 0.00 H new ATOM 0 HG2 GLU A 394 0.360 -6.039 7.744 1.00 0.00 H new ATOM 0 HG3 GLU A 394 0.887 -6.386 6.109 1.00 0.00 H new ATOM 333 N GLN A 395 -3.127 -6.958 6.790 1.00 0.00 N ATOM 334 CA GLN A 395 -3.779 -8.011 7.554 1.00 0.00 C ATOM 335 C GLN A 395 -4.345 -9.056 6.602 1.00 0.00 C ATOM 336 O GLN A 395 -4.296 -10.258 6.873 1.00 0.00 O ATOM 337 CB GLN A 395 -4.895 -7.431 8.424 1.00 0.00 C ATOM 338 CG GLN A 395 -5.102 -8.181 9.730 1.00 0.00 C ATOM 339 CD GLN A 395 -6.317 -9.088 9.696 1.00 0.00 C ATOM 340 OE1 GLN A 395 -7.269 -8.841 8.954 1.00 0.00 O ATOM 341 NE2 GLN A 395 -6.291 -10.144 10.500 1.00 0.00 N ATOM 0 H GLN A 395 -3.555 -6.037 6.886 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.044 -8.480 8.208 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -4.666 -6.389 8.646 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.827 -7.440 7.858 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -4.215 -8.776 9.947 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -5.212 -7.464 10.543 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -5.481 -10.310 11.098 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -7.081 -10.789 10.520 1.00 0.00 H new ATOM 350 N GLU A 396 -4.869 -8.584 5.474 1.00 0.00 N ATOM 351 CA GLU A 396 -5.434 -9.467 4.464 1.00 0.00 C ATOM 352 C GLU A 396 -4.361 -10.398 3.912 1.00 0.00 C ATOM 353 O GLU A 396 -4.506 -11.619 3.953 1.00 0.00 O ATOM 354 CB GLU A 396 -6.054 -8.650 3.328 1.00 0.00 C ATOM 355 CG GLU A 396 -6.820 -9.494 2.322 1.00 0.00 C ATOM 356 CD GLU A 396 -8.321 -9.395 2.504 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.845 -8.261 2.515 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.974 -10.452 2.634 1.00 0.00 O ATOM 0 H GLU A 396 -4.913 -7.593 5.238 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.214 -10.068 4.930 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -6.727 -7.905 3.752 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.264 -8.107 2.808 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -6.558 -9.177 1.313 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.514 -10.536 2.419 1.00 0.00 H new ATOM 365 N VAL A 397 -3.276 -9.816 3.405 1.00 0.00 N ATOM 366 CA VAL A 397 -2.178 -10.607 2.858 1.00 0.00 C ATOM 367 C VAL A 397 -1.660 -11.590 3.899 1.00 0.00 C ATOM 368 O VAL A 397 -1.301 -12.722 3.576 1.00 0.00 O ATOM 369 CB VAL A 397 -1.015 -9.719 2.371 1.00 0.00 C ATOM 370 CG1 VAL A 397 -1.458 -8.854 1.202 1.00 0.00 C ATOM 371 CG2 VAL A 397 -0.481 -8.860 3.504 1.00 0.00 C ATOM 0 H VAL A 397 -3.135 -8.807 3.362 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.573 -11.152 2.001 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.208 -10.368 2.031 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -0.624 -8.234 0.872 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -1.784 -9.492 0.380 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -2.284 -8.215 1.515 1.00 0.00 H new ATOM 0 HG21 VAL A 397 0.339 -8.242 3.137 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.278 -8.219 3.881 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.120 -9.501 4.308 1.00 0.00 H new ATOM 381 N GLU A 398 -1.637 -11.155 5.156 1.00 0.00 N ATOM 382 CA GLU A 398 -1.180 -12.004 6.247 1.00 0.00 C ATOM 383 C GLU A 398 -2.102 -13.210 6.390 1.00 0.00 C ATOM 384 O GLU A 398 -1.647 -14.334 6.591 1.00 0.00 O ATOM 385 CB GLU A 398 -1.137 -11.218 7.558 1.00 0.00 C ATOM 386 CG GLU A 398 -0.463 -11.969 8.696 1.00 0.00 C ATOM 387 CD GLU A 398 0.942 -11.470 8.972 1.00 0.00 C ATOM 388 OE1 GLU A 398 1.805 -11.602 8.079 1.00 0.00 O ATOM 389 OE2 GLU A 398 1.178 -10.947 10.080 1.00 0.00 O ATOM 0 H GLU A 398 -1.929 -10.221 5.442 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.172 -12.351 6.019 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -0.610 -10.278 7.392 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -2.155 -10.965 7.854 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -1.064 -11.868 9.599 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -0.426 -13.031 8.454 1.00 0.00 H new ATOM 396 N GLU A 399 -3.403 -12.963 6.270 1.00 0.00 N ATOM 397 CA GLU A 399 -4.398 -14.024 6.374 1.00 0.00 C ATOM 398 C GLU A 399 -4.645 -14.679 5.013 1.00 0.00 C ATOM 399 O GLU A 399 -5.391 -15.653 4.914 1.00 0.00 O ATOM 400 CB GLU A 399 -5.710 -13.471 6.932 1.00 0.00 C ATOM 401 CG GLU A 399 -6.435 -14.438 7.852 1.00 0.00 C ATOM 402 CD GLU A 399 -7.899 -14.084 8.033 1.00 0.00 C ATOM 403 OE1 GLU A 399 -8.266 -12.920 7.769 1.00 0.00 O ATOM 404 OE2 GLU A 399 -8.678 -14.973 8.439 1.00 0.00 O ATOM 0 H GLU A 399 -3.793 -12.036 6.100 1.00 0.00 H new ATOM 0 HA GLU A 399 -4.012 -14.781 7.056 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -5.504 -12.550 7.477 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -6.367 -13.210 6.102 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -6.356 -15.447 7.447 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -5.944 -14.446 8.825 1.00 0.00 H new ATOM 411 N PHE A 400 -4.017 -14.135 3.967 1.00 0.00 N ATOM 412 CA PHE A 400 -4.164 -14.657 2.608 1.00 0.00 C ATOM 413 C PHE A 400 -4.157 -16.185 2.597 1.00 0.00 C ATOM 414 O PHE A 400 -3.251 -16.816 3.143 1.00 0.00 O ATOM 415 CB PHE A 400 -3.038 -14.118 1.718 1.00 0.00 C ATOM 416 CG PHE A 400 -3.087 -14.614 0.299 1.00 0.00 C ATOM 417 CD1 PHE A 400 -4.008 -14.099 -0.603 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.208 -15.594 -0.137 1.00 0.00 C ATOM 419 CE1 PHE A 400 -4.051 -14.553 -1.903 1.00 0.00 C ATOM 420 CE2 PHE A 400 -2.248 -16.051 -1.440 1.00 0.00 C ATOM 421 CZ PHE A 400 -3.172 -15.530 -2.322 1.00 0.00 C ATOM 0 H PHE A 400 -3.398 -13.327 4.038 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.125 -14.323 2.217 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.083 -13.029 1.713 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.079 -14.395 2.156 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -4.699 -13.334 -0.282 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.483 -16.005 0.550 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -4.773 -14.144 -2.594 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.558 -16.814 -1.767 1.00 0.00 H new ATOM 0 HZ PHE A 400 -3.207 -15.887 -3.341 1.00 0.00 H new ATOM 431 N VAL A 401 -5.178 -16.770 1.976 1.00 0.00 N ATOM 432 CA VAL A 401 -5.305 -18.224 1.891 1.00 0.00 C ATOM 433 C VAL A 401 -3.971 -18.883 1.543 1.00 0.00 C ATOM 434 O VAL A 401 -3.577 -19.874 2.157 1.00 0.00 O ATOM 435 CB VAL A 401 -6.359 -18.629 0.842 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.968 -18.115 -0.535 1.00 0.00 C ATOM 437 CG2 VAL A 401 -6.547 -20.140 0.822 1.00 0.00 C ATOM 0 H VAL A 401 -5.934 -16.257 1.522 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.624 -18.571 2.874 1.00 0.00 H new ATOM 0 HB VAL A 401 -7.310 -18.174 1.119 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.724 -18.411 -1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.894 -17.028 -0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -5.005 -18.537 -0.821 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -7.295 -20.404 0.075 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -5.601 -20.621 0.574 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.880 -20.478 1.803 1.00 0.00 H new ATOM 447 N GLY A 402 -3.283 -18.320 0.557 1.00 0.00 N ATOM 448 CA GLY A 402 -2.002 -18.860 0.145 1.00 0.00 C ATOM 449 C GLY A 402 -2.022 -19.389 -1.274 1.00 0.00 C ATOM 450 O GLY A 402 -1.233 -20.266 -1.627 1.00 0.00 O ATOM 0 H GLY A 402 -3.590 -17.499 0.035 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -1.241 -18.084 0.229 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.715 -19.663 0.824 1.00 0.00 H new ATOM 454 N LYS A 403 -2.925 -18.859 -2.092 1.00 0.00 N ATOM 455 CA LYS A 403 -3.038 -19.288 -3.480 1.00 0.00 C ATOM 456 C LYS A 403 -3.445 -18.128 -4.383 1.00 0.00 C ATOM 457 O LYS A 403 -4.466 -17.478 -4.157 1.00 0.00 O ATOM 458 CB LYS A 403 -4.048 -20.432 -3.602 1.00 0.00 C ATOM 459 CG LYS A 403 -3.438 -21.729 -4.107 1.00 0.00 C ATOM 460 CD LYS A 403 -2.781 -21.546 -5.466 1.00 0.00 C ATOM 461 CE LYS A 403 -1.478 -22.323 -5.564 1.00 0.00 C ATOM 462 NZ LYS A 403 -1.714 -23.781 -5.761 1.00 0.00 N ATOM 0 H LYS A 403 -3.588 -18.133 -1.818 1.00 0.00 H new ATOM 0 HA LYS A 403 -2.059 -19.643 -3.804 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -4.503 -20.609 -2.628 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -4.848 -20.129 -4.277 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -2.699 -22.088 -3.390 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -4.212 -22.493 -4.176 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -3.463 -21.878 -6.249 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -2.588 -20.487 -5.639 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -0.886 -21.936 -6.393 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -0.894 -22.169 -4.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -0.801 -24.275 -5.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -2.257 -24.156 -4.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -2.249 -23.930 -6.640 1.00 0.00 H new ATOM 476 N LYS A 404 -2.636 -17.874 -5.410 1.00 0.00 N ATOM 477 CA LYS A 404 -2.903 -16.791 -6.351 1.00 0.00 C ATOM 478 C LYS A 404 -4.227 -17.001 -7.088 1.00 0.00 C ATOM 479 O LYS A 404 -4.756 -16.073 -7.700 1.00 0.00 O ATOM 480 CB LYS A 404 -1.758 -16.680 -7.363 1.00 0.00 C ATOM 481 CG LYS A 404 -1.290 -15.253 -7.593 1.00 0.00 C ATOM 482 CD LYS A 404 -0.234 -15.183 -8.685 1.00 0.00 C ATOM 483 CE LYS A 404 -0.866 -15.112 -10.066 1.00 0.00 C ATOM 484 NZ LYS A 404 0.155 -14.939 -11.136 1.00 0.00 N ATOM 0 H LYS A 404 -1.789 -18.405 -5.611 1.00 0.00 H new ATOM 0 HA LYS A 404 -2.977 -15.865 -5.780 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -0.916 -17.279 -7.015 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -2.081 -17.106 -8.313 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -2.141 -14.630 -7.868 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -0.884 -14.848 -6.666 1.00 0.00 H new ATOM 0 HD2 LYS A 404 0.397 -14.309 -8.527 1.00 0.00 H new ATOM 0 HD3 LYS A 404 0.413 -16.058 -8.624 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -1.436 -16.023 -10.252 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.572 -14.282 -10.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -0.317 -14.895 -12.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 0.682 -14.057 -10.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 0.814 -15.744 -11.121 1.00 0.00 H new ATOM 498 N THR A 405 -4.758 -18.220 -7.031 1.00 0.00 N ATOM 499 CA THR A 405 -6.015 -18.533 -7.699 1.00 0.00 C ATOM 500 C THR A 405 -7.198 -17.902 -6.969 1.00 0.00 C ATOM 501 O THR A 405 -8.263 -17.703 -7.553 1.00 0.00 O ATOM 502 CB THR A 405 -6.204 -20.049 -7.784 1.00 0.00 C ATOM 503 OG1 THR A 405 -5.762 -20.676 -6.595 1.00 0.00 O ATOM 504 CG2 THR A 405 -5.460 -20.679 -8.941 1.00 0.00 C ATOM 0 H THR A 405 -4.338 -19.003 -6.531 1.00 0.00 H new ATOM 0 HA THR A 405 -5.974 -18.118 -8.706 1.00 0.00 H new ATOM 0 HB THR A 405 -7.273 -20.200 -7.935 1.00 0.00 H new ATOM 0 HG1 THR A 405 -5.893 -21.645 -6.668 1.00 0.00 H new ATOM 0 HG21 THR A 405 -5.636 -21.755 -8.944 1.00 0.00 H new ATOM 0 HG22 THR A 405 -5.815 -20.250 -9.878 1.00 0.00 H new ATOM 0 HG23 THR A 405 -4.392 -20.486 -8.835 1.00 0.00 H new ATOM 512 N ASP A 406 -7.008 -17.587 -5.691 1.00 0.00 N ATOM 513 CA ASP A 406 -8.062 -16.977 -4.890 1.00 0.00 C ATOM 514 C ASP A 406 -8.275 -15.519 -5.289 1.00 0.00 C ATOM 515 O ASP A 406 -7.333 -14.828 -5.678 1.00 0.00 O ATOM 516 CB ASP A 406 -7.718 -17.066 -3.403 1.00 0.00 C ATOM 517 CG ASP A 406 -8.942 -16.954 -2.516 1.00 0.00 C ATOM 518 OD1 ASP A 406 -9.801 -16.092 -2.797 1.00 0.00 O ATOM 519 OD2 ASP A 406 -9.043 -17.729 -1.543 1.00 0.00 O ATOM 0 H ASP A 406 -6.134 -17.744 -5.189 1.00 0.00 H new ATOM 0 HA ASP A 406 -8.987 -17.524 -5.075 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -7.216 -18.013 -3.206 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -7.015 -16.273 -3.148 1.00 0.00 H new ATOM 524 N LYS A 407 -9.517 -15.059 -5.190 1.00 0.00 N ATOM 525 CA LYS A 407 -9.855 -13.684 -5.541 1.00 0.00 C ATOM 526 C LYS A 407 -9.127 -12.692 -4.637 1.00 0.00 C ATOM 527 O LYS A 407 -8.883 -11.547 -5.022 1.00 0.00 O ATOM 528 CB LYS A 407 -11.365 -13.466 -5.442 1.00 0.00 C ATOM 529 CG LYS A 407 -11.833 -12.159 -6.062 1.00 0.00 C ATOM 530 CD LYS A 407 -13.047 -11.602 -5.336 1.00 0.00 C ATOM 531 CE LYS A 407 -13.488 -10.271 -5.924 1.00 0.00 C ATOM 532 NZ LYS A 407 -14.600 -10.436 -6.902 1.00 0.00 N ATOM 0 H LYS A 407 -10.307 -15.618 -4.869 1.00 0.00 H new ATOM 0 HA LYS A 407 -9.535 -13.512 -6.569 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -11.876 -14.295 -5.932 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -11.659 -13.486 -4.392 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -11.023 -11.430 -6.032 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -12.078 -12.320 -7.112 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -13.868 -12.317 -5.396 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -12.813 -11.474 -4.279 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -13.807 -9.607 -5.120 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -12.641 -9.793 -6.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -14.871 -9.506 -7.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -14.288 -11.049 -7.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -15.418 -10.869 -6.428 1.00 0.00 H new ATOM 546 N ALA A 408 -8.783 -13.139 -3.431 1.00 0.00 N ATOM 547 CA ALA A 408 -8.085 -12.290 -2.472 1.00 0.00 C ATOM 548 C ALA A 408 -6.834 -11.672 -3.089 1.00 0.00 C ATOM 549 O ALA A 408 -6.632 -10.461 -3.023 1.00 0.00 O ATOM 550 CB ALA A 408 -7.721 -13.089 -1.230 1.00 0.00 C ATOM 0 H ALA A 408 -8.976 -14.083 -3.096 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.756 -11.479 -2.189 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -7.201 -12.444 -0.522 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.629 -13.477 -0.768 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -7.072 -13.920 -1.509 1.00 0.00 H new ATOM 556 N TYR A 409 -5.999 -12.512 -3.693 1.00 0.00 N ATOM 557 CA TYR A 409 -4.770 -12.039 -4.322 1.00 0.00 C ATOM 558 C TYR A 409 -5.079 -11.019 -5.410 1.00 0.00 C ATOM 559 O TYR A 409 -4.365 -10.028 -5.568 1.00 0.00 O ATOM 560 CB TYR A 409 -3.984 -13.212 -4.905 1.00 0.00 C ATOM 561 CG TYR A 409 -2.501 -12.943 -5.027 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.676 -12.982 -3.911 1.00 0.00 C ATOM 563 CD2 TYR A 409 -1.927 -12.648 -6.257 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.321 -12.736 -4.015 1.00 0.00 C ATOM 565 CE2 TYR A 409 -0.571 -12.402 -6.370 1.00 0.00 C ATOM 566 CZ TYR A 409 0.227 -12.446 -5.246 1.00 0.00 C ATOM 567 OH TYR A 409 1.577 -12.200 -5.355 1.00 0.00 O ATOM 0 H TYR A 409 -6.149 -13.519 -3.760 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.161 -11.554 -3.559 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.136 -14.089 -4.276 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.384 -13.453 -5.890 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.101 -13.209 -2.945 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -2.549 -12.610 -7.139 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.306 -12.771 -3.136 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.139 -12.177 -7.334 1.00 0.00 H new ATOM 0 HH TYR A 409 1.801 -12.013 -6.291 1.00 0.00 H new ATOM 577 N TRP A 410 -6.157 -11.259 -6.155 1.00 0.00 N ATOM 578 CA TRP A 410 -6.565 -10.349 -7.218 1.00 0.00 C ATOM 579 C TRP A 410 -6.807 -8.956 -6.652 1.00 0.00 C ATOM 580 O TRP A 410 -6.135 -7.994 -7.027 1.00 0.00 O ATOM 581 CB TRP A 410 -7.837 -10.852 -7.901 1.00 0.00 C ATOM 582 CG TRP A 410 -7.706 -12.224 -8.489 1.00 0.00 C ATOM 583 CD1 TRP A 410 -6.550 -12.903 -8.748 1.00 0.00 C ATOM 584 CD2 TRP A 410 -8.777 -13.082 -8.895 1.00 0.00 C ATOM 585 NE1 TRP A 410 -6.838 -14.132 -9.290 1.00 0.00 N ATOM 586 CE2 TRP A 410 -8.199 -14.265 -9.391 1.00 0.00 C ATOM 587 CE3 TRP A 410 -10.169 -12.963 -8.886 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -8.966 -15.322 -9.873 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -10.929 -14.013 -9.365 1.00 0.00 C ATOM 590 CH2 TRP A 410 -10.327 -15.179 -9.853 1.00 0.00 C ATOM 0 H TRP A 410 -6.760 -12.074 -6.041 1.00 0.00 H new ATOM 0 HA TRP A 410 -5.764 -10.305 -7.955 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -8.651 -10.854 -7.176 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.115 -10.154 -8.690 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -5.555 -12.529 -8.555 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -6.151 -14.832 -9.571 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -10.642 -12.067 -8.512 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -8.504 -16.223 -10.249 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.006 -13.933 -9.363 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -10.949 -15.982 -10.221 1.00 0.00 H new ATOM 601 N LEU A 411 -7.765 -8.862 -5.737 1.00 0.00 N ATOM 602 CA LEU A 411 -8.093 -7.594 -5.103 1.00 0.00 C ATOM 603 C LEU A 411 -6.910 -7.085 -4.287 1.00 0.00 C ATOM 604 O LEU A 411 -6.743 -5.880 -4.099 1.00 0.00 O ATOM 605 CB LEU A 411 -9.324 -7.748 -4.209 1.00 0.00 C ATOM 606 CG LEU A 411 -9.224 -8.848 -3.151 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.533 -8.327 -1.901 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.606 -9.387 -2.813 1.00 0.00 C ATOM 0 H LEU A 411 -8.328 -9.651 -5.418 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.317 -6.866 -5.883 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.510 -6.799 -3.707 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.189 -7.950 -4.840 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.626 -9.663 -3.557 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -8.472 -9.124 -1.160 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.528 -7.989 -2.155 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -9.103 -7.494 -1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.517 -10.169 -2.059 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.227 -8.579 -2.427 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -11.065 -9.800 -3.711 1.00 0.00 H new ATOM 620 N LEU A 412 -6.083 -8.013 -3.811 1.00 0.00 N ATOM 621 CA LEU A 412 -4.907 -7.662 -3.023 1.00 0.00 C ATOM 622 C LEU A 412 -3.983 -6.749 -3.823 1.00 0.00 C ATOM 623 O LEU A 412 -3.824 -5.569 -3.502 1.00 0.00 O ATOM 624 CB LEU A 412 -4.150 -8.928 -2.608 1.00 0.00 C ATOM 625 CG LEU A 412 -4.593 -9.557 -1.285 1.00 0.00 C ATOM 626 CD1 LEU A 412 -4.045 -10.971 -1.155 1.00 0.00 C ATOM 627 CD2 LEU A 412 -4.142 -8.699 -0.114 1.00 0.00 C ATOM 0 H LEU A 412 -6.207 -9.015 -3.958 1.00 0.00 H new ATOM 0 HA LEU A 412 -5.238 -7.134 -2.128 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.259 -9.671 -3.398 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -3.089 -8.690 -2.539 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.682 -9.610 -1.275 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -4.371 -11.402 -0.208 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -4.416 -11.582 -1.978 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.956 -10.943 -1.186 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -4.465 -9.159 0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -3.055 -8.616 -0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -4.582 -7.706 -0.200 1.00 0.00 H new ATOM 639 N GLU A 413 -3.377 -7.305 -4.868 1.00 0.00 N ATOM 640 CA GLU A 413 -2.468 -6.547 -5.719 1.00 0.00 C ATOM 641 C GLU A 413 -3.196 -5.391 -6.398 1.00 0.00 C ATOM 642 O GLU A 413 -2.643 -4.302 -6.552 1.00 0.00 O ATOM 643 CB GLU A 413 -1.842 -7.461 -6.774 1.00 0.00 C ATOM 644 CG GLU A 413 -0.545 -8.112 -6.322 1.00 0.00 C ATOM 645 CD GLU A 413 0.544 -8.032 -7.374 1.00 0.00 C ATOM 646 OE1 GLU A 413 0.620 -7.000 -8.074 1.00 0.00 O ATOM 647 OE2 GLU A 413 1.320 -9.002 -7.498 1.00 0.00 O ATOM 0 H GLU A 413 -3.500 -8.279 -5.145 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.678 -6.136 -5.090 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -2.557 -8.240 -7.038 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -1.653 -6.882 -7.678 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -0.199 -7.628 -5.408 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -0.733 -9.157 -6.078 1.00 0.00 H new ATOM 654 N GLU A 414 -4.440 -5.633 -6.800 1.00 0.00 N ATOM 655 CA GLU A 414 -5.244 -4.610 -7.463 1.00 0.00 C ATOM 656 C GLU A 414 -5.341 -3.357 -6.597 1.00 0.00 C ATOM 657 O GLU A 414 -4.907 -2.277 -6.997 1.00 0.00 O ATOM 658 CB GLU A 414 -6.644 -5.146 -7.764 1.00 0.00 C ATOM 659 CG GLU A 414 -6.748 -5.854 -9.106 1.00 0.00 C ATOM 660 CD GLU A 414 -8.105 -5.676 -9.753 1.00 0.00 C ATOM 661 OE1 GLU A 414 -8.781 -4.671 -9.452 1.00 0.00 O ATOM 662 OE2 GLU A 414 -8.495 -6.545 -10.564 1.00 0.00 O ATOM 0 H GLU A 414 -4.914 -6.528 -6.679 1.00 0.00 H new ATOM 0 HA GLU A 414 -4.756 -4.348 -8.402 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -6.937 -5.837 -6.974 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.353 -4.319 -7.743 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -5.977 -5.472 -9.775 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -6.552 -6.917 -8.968 1.00 0.00 H new ATOM 669 N MET A 415 -5.910 -3.513 -5.405 1.00 0.00 N ATOM 670 CA MET A 415 -6.060 -2.397 -4.480 1.00 0.00 C ATOM 671 C MET A 415 -4.701 -1.799 -4.137 1.00 0.00 C ATOM 672 O MET A 415 -4.556 -0.581 -4.022 1.00 0.00 O ATOM 673 CB MET A 415 -6.767 -2.855 -3.203 1.00 0.00 C ATOM 674 CG MET A 415 -7.341 -1.713 -2.382 1.00 0.00 C ATOM 675 SD MET A 415 -8.785 -0.960 -3.154 1.00 0.00 S ATOM 676 CE MET A 415 -9.924 -2.342 -3.167 1.00 0.00 C ATOM 0 H MET A 415 -6.274 -4.401 -5.058 1.00 0.00 H new ATOM 0 HA MET A 415 -6.666 -1.631 -4.964 1.00 0.00 H new ATOM 0 HB2 MET A 415 -7.572 -3.540 -3.469 1.00 0.00 H new ATOM 0 HB3 MET A 415 -6.062 -3.415 -2.588 1.00 0.00 H new ATOM 0 HG2 MET A 415 -7.614 -2.083 -1.393 1.00 0.00 H new ATOM 0 HG3 MET A 415 -6.573 -0.953 -2.238 1.00 0.00 H new ATOM 0 HE1 MET A 415 -10.948 -1.969 -3.202 1.00 0.00 H new ATOM 0 HE2 MET A 415 -9.734 -2.962 -4.043 1.00 0.00 H new ATOM 0 HE3 MET A 415 -9.785 -2.937 -2.264 1.00 0.00 H new ATOM 686 N LEU A 416 -3.704 -2.666 -3.979 1.00 0.00 N ATOM 687 CA LEU A 416 -2.353 -2.226 -3.654 1.00 0.00 C ATOM 688 C LEU A 416 -1.779 -1.369 -4.778 1.00 0.00 C ATOM 689 O LEU A 416 -1.202 -0.309 -4.533 1.00 0.00 O ATOM 690 CB LEU A 416 -1.450 -3.439 -3.399 1.00 0.00 C ATOM 691 CG LEU A 416 -1.043 -3.667 -1.940 1.00 0.00 C ATOM 692 CD1 LEU A 416 -2.189 -3.334 -0.994 1.00 0.00 C ATOM 693 CD2 LEU A 416 -0.588 -5.103 -1.737 1.00 0.00 C ATOM 0 H LEU A 416 -3.808 -3.677 -4.071 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.397 -1.620 -2.749 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.962 -4.332 -3.758 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.545 -3.328 -3.997 1.00 0.00 H new ATOM 0 HG LEU A 416 -0.212 -3.000 -1.711 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -1.873 -3.505 0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -2.471 -2.288 -1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -3.045 -3.970 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.302 -5.250 -0.696 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -1.403 -5.782 -1.989 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.267 -5.308 -2.381 1.00 0.00 H new ATOM 705 N THR A 417 -1.942 -1.836 -6.013 1.00 0.00 N ATOM 706 CA THR A 417 -1.443 -1.111 -7.174 1.00 0.00 C ATOM 707 C THR A 417 -2.081 0.270 -7.264 1.00 0.00 C ATOM 708 O THR A 417 -1.390 1.278 -7.412 1.00 0.00 O ATOM 709 CB THR A 417 -1.723 -1.900 -8.454 1.00 0.00 C ATOM 710 OG1 THR A 417 -1.264 -3.234 -8.332 1.00 0.00 O ATOM 711 CG2 THR A 417 -1.072 -1.300 -9.681 1.00 0.00 C ATOM 0 H THR A 417 -2.415 -2.712 -6.234 1.00 0.00 H new ATOM 0 HA THR A 417 -0.366 -0.989 -7.061 1.00 0.00 H new ATOM 0 HB THR A 417 -2.805 -1.866 -8.583 1.00 0.00 H new ATOM 0 HG1 THR A 417 -1.917 -3.760 -7.825 1.00 0.00 H new ATOM 0 HG21 THR A 417 -1.310 -1.908 -10.554 1.00 0.00 H new ATOM 0 HG22 THR A 417 -1.445 -0.287 -9.832 1.00 0.00 H new ATOM 0 HG23 THR A 417 0.009 -1.272 -9.543 1.00 0.00 H new ATOM 719 N LYS A 418 -3.407 0.309 -7.173 1.00 0.00 N ATOM 720 CA LYS A 418 -4.140 1.570 -7.241 1.00 0.00 C ATOM 721 C LYS A 418 -3.690 2.516 -6.133 1.00 0.00 C ATOM 722 O LYS A 418 -3.463 3.703 -6.370 1.00 0.00 O ATOM 723 CB LYS A 418 -5.644 1.315 -7.132 1.00 0.00 C ATOM 724 CG LYS A 418 -6.495 2.483 -7.604 1.00 0.00 C ATOM 725 CD LYS A 418 -7.888 2.031 -8.011 1.00 0.00 C ATOM 726 CE LYS A 418 -8.944 3.040 -7.595 1.00 0.00 C ATOM 727 NZ LYS A 418 -9.132 4.102 -8.620 1.00 0.00 N ATOM 0 H LYS A 418 -3.995 -0.516 -7.052 1.00 0.00 H new ATOM 0 HA LYS A 418 -3.928 2.037 -8.203 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -5.898 0.431 -7.718 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -5.892 1.092 -6.094 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -6.570 3.224 -6.808 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -6.009 2.971 -8.449 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -7.924 1.889 -9.091 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -8.106 1.065 -7.555 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -9.891 2.526 -7.427 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -8.657 3.497 -6.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -9.861 4.770 -8.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -8.236 4.610 -8.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -9.431 3.669 -9.517 1.00 0.00 H new ATOM 741 N GLU A 419 -3.562 1.983 -4.923 1.00 0.00 N ATOM 742 CA GLU A 419 -3.137 2.778 -3.777 1.00 0.00 C ATOM 743 C GLU A 419 -1.765 3.398 -4.028 1.00 0.00 C ATOM 744 O GLU A 419 -1.541 4.573 -3.736 1.00 0.00 O ATOM 745 CB GLU A 419 -3.095 1.912 -2.516 1.00 0.00 C ATOM 746 CG GLU A 419 -3.612 2.619 -1.275 1.00 0.00 C ATOM 747 CD GLU A 419 -5.090 2.947 -1.363 1.00 0.00 C ATOM 748 OE1 GLU A 419 -5.844 2.135 -1.941 1.00 0.00 O ATOM 749 OE2 GLU A 419 -5.493 4.015 -0.857 1.00 0.00 O ATOM 0 H GLU A 419 -3.747 1.003 -4.710 1.00 0.00 H new ATOM 0 HA GLU A 419 -3.860 3.581 -3.633 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -3.686 1.012 -2.684 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -2.068 1.591 -2.340 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -3.435 1.990 -0.403 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -3.048 3.539 -1.124 1.00 0.00 H new ATOM 756 N LEU A 420 -0.853 2.601 -4.576 1.00 0.00 N ATOM 757 CA LEU A 420 0.494 3.070 -4.871 1.00 0.00 C ATOM 758 C LEU A 420 0.461 4.212 -5.881 1.00 0.00 C ATOM 759 O LEU A 420 1.059 5.266 -5.661 1.00 0.00 O ATOM 760 CB LEU A 420 1.350 1.922 -5.410 1.00 0.00 C ATOM 761 CG LEU A 420 2.841 2.016 -5.082 1.00 0.00 C ATOM 762 CD1 LEU A 420 3.599 0.857 -5.711 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.406 3.346 -5.557 1.00 0.00 C ATOM 0 H LEU A 420 -1.024 1.627 -4.824 1.00 0.00 H new ATOM 0 HA LEU A 420 0.935 3.439 -3.945 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.964 0.984 -5.011 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.234 1.880 -6.493 1.00 0.00 H new ATOM 0 HG LEU A 420 2.962 1.957 -4.000 1.00 0.00 H new ATOM 0 HD11 LEU A 420 4.658 0.940 -5.467 1.00 0.00 H new ATOM 0 HD12 LEU A 420 3.210 -0.085 -5.324 1.00 0.00 H new ATOM 0 HD13 LEU A 420 3.472 0.884 -6.793 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.468 3.397 -5.316 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.274 3.433 -6.635 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.882 4.162 -5.060 1.00 0.00 H new ATOM 775 N LEU A 421 -0.243 3.996 -6.987 1.00 0.00 N ATOM 776 CA LEU A 421 -0.354 5.009 -8.030 1.00 0.00 C ATOM 777 C LEU A 421 -1.022 6.271 -7.489 1.00 0.00 C ATOM 778 O LEU A 421 -0.726 7.381 -7.933 1.00 0.00 O ATOM 779 CB LEU A 421 -1.152 4.465 -9.216 1.00 0.00 C ATOM 780 CG LEU A 421 -0.319 3.742 -10.277 1.00 0.00 C ATOM 781 CD1 LEU A 421 -0.187 2.265 -9.936 1.00 0.00 C ATOM 782 CD2 LEU A 421 -0.941 3.921 -11.654 1.00 0.00 C ATOM 0 H LEU A 421 -0.745 3.130 -7.184 1.00 0.00 H new ATOM 0 HA LEU A 421 0.651 5.264 -8.365 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -1.910 3.778 -8.840 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -1.679 5.293 -9.691 1.00 0.00 H new ATOM 0 HG LEU A 421 0.679 4.180 -10.291 1.00 0.00 H new ATOM 0 HD11 LEU A 421 0.408 1.767 -10.701 1.00 0.00 H new ATOM 0 HD12 LEU A 421 0.303 2.157 -8.968 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -1.177 1.811 -9.894 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -0.336 3.401 -12.397 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -1.950 3.508 -11.654 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -0.983 4.982 -11.899 1.00 0.00 H new ATOM 794 N GLU A 422 -1.922 6.092 -6.528 1.00 0.00 N ATOM 795 CA GLU A 422 -2.631 7.215 -5.926 1.00 0.00 C ATOM 796 C GLU A 422 -1.681 8.084 -5.107 1.00 0.00 C ATOM 797 O GLU A 422 -1.482 9.260 -5.410 1.00 0.00 O ATOM 798 CB GLU A 422 -3.770 6.710 -5.039 1.00 0.00 C ATOM 799 CG GLU A 422 -5.000 7.605 -5.059 1.00 0.00 C ATOM 800 CD GLU A 422 -6.294 6.817 -5.091 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.297 5.660 -4.622 1.00 0.00 O ATOM 802 OE2 GLU A 422 -7.307 7.359 -5.584 1.00 0.00 O ATOM 0 H GLU A 422 -2.178 5.180 -6.149 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.047 7.822 -6.730 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -4.054 5.709 -5.362 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -3.410 6.624 -4.014 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.992 8.247 -4.178 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -4.955 8.258 -5.930 1.00 0.00 H new ATOM 809 N LEU A 423 -1.097 7.497 -4.067 1.00 0.00 N ATOM 810 CA LEU A 423 -0.169 8.218 -3.204 1.00 0.00 C ATOM 811 C LEU A 423 1.022 8.744 -4.000 1.00 0.00 C ATOM 812 O LEU A 423 1.610 9.769 -3.654 1.00 0.00 O ATOM 813 CB LEU A 423 0.319 7.312 -2.070 1.00 0.00 C ATOM 814 CG LEU A 423 1.259 6.183 -2.499 1.00 0.00 C ATOM 815 CD1 LEU A 423 2.709 6.636 -2.422 1.00 0.00 C ATOM 816 CD2 LEU A 423 1.038 4.949 -1.637 1.00 0.00 C ATOM 0 H LEU A 423 -1.250 6.524 -3.802 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.700 9.069 -2.776 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.830 7.927 -1.329 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -0.549 6.874 -1.577 1.00 0.00 H new ATOM 0 HG LEU A 423 1.035 5.924 -3.534 1.00 0.00 H new ATOM 0 HD11 LEU A 423 3.362 5.820 -2.731 1.00 0.00 H new ATOM 0 HD12 LEU A 423 2.859 7.490 -3.082 1.00 0.00 H new ATOM 0 HD13 LEU A 423 2.947 6.923 -1.398 1.00 0.00 H new ATOM 0 HD21 LEU A 423 1.715 4.156 -1.956 1.00 0.00 H new ATOM 0 HD22 LEU A 423 1.233 5.195 -0.593 1.00 0.00 H new ATOM 0 HD23 LEU A 423 0.007 4.611 -1.743 1.00 0.00 H new ATOM 828 N ASP A 424 1.374 8.034 -5.068 1.00 0.00 N ATOM 829 CA ASP A 424 2.495 8.429 -5.915 1.00 0.00 C ATOM 830 C ASP A 424 2.317 9.849 -6.446 1.00 0.00 C ATOM 831 O ASP A 424 3.288 10.509 -6.812 1.00 0.00 O ATOM 832 CB ASP A 424 2.644 7.452 -7.083 1.00 0.00 C ATOM 833 CG ASP A 424 3.862 7.753 -7.935 1.00 0.00 C ATOM 834 OD1 ASP A 424 4.966 7.291 -7.576 1.00 0.00 O ATOM 835 OD2 ASP A 424 3.712 8.449 -8.961 1.00 0.00 O ATOM 0 H ASP A 424 0.899 7.182 -5.367 1.00 0.00 H new ATOM 0 HA ASP A 424 3.399 8.405 -5.306 1.00 0.00 H new ATOM 0 HB2 ASP A 424 2.716 6.436 -6.696 1.00 0.00 H new ATOM 0 HB3 ASP A 424 1.750 7.494 -7.705 1.00 0.00 H new ATOM 840 N SER A 425 1.070 10.314 -6.487 1.00 0.00 N ATOM 841 CA SER A 425 0.772 11.655 -6.978 1.00 0.00 C ATOM 842 C SER A 425 0.662 12.650 -5.826 1.00 0.00 C ATOM 843 O SER A 425 -0.181 13.548 -5.849 1.00 0.00 O ATOM 844 CB SER A 425 -0.526 11.646 -7.787 1.00 0.00 C ATOM 845 OG SER A 425 -0.301 11.183 -9.108 1.00 0.00 O ATOM 0 H SER A 425 0.253 9.783 -6.187 1.00 0.00 H new ATOM 0 HA SER A 425 1.593 11.968 -7.623 1.00 0.00 H new ATOM 0 HB2 SER A 425 -1.260 11.008 -7.295 1.00 0.00 H new ATOM 0 HB3 SER A 425 -0.946 12.651 -7.817 1.00 0.00 H new ATOM 0 HG SER A 425 -1.146 11.185 -9.604 1.00 0.00 H new ATOM 851 N VAL A 426 1.516 12.486 -4.821 1.00 0.00 N ATOM 852 CA VAL A 426 1.513 13.374 -3.664 1.00 0.00 C ATOM 853 C VAL A 426 2.390 14.598 -3.913 1.00 0.00 C ATOM 854 O VAL A 426 3.455 14.496 -4.521 1.00 0.00 O ATOM 855 CB VAL A 426 2.000 12.647 -2.394 1.00 0.00 C ATOM 856 CG1 VAL A 426 3.413 12.121 -2.588 1.00 0.00 C ATOM 857 CG2 VAL A 426 1.926 13.571 -1.184 1.00 0.00 C ATOM 0 H VAL A 426 2.218 11.747 -4.784 1.00 0.00 H new ATOM 0 HA VAL A 426 0.483 13.695 -3.510 1.00 0.00 H new ATOM 0 HB VAL A 426 1.343 11.797 -2.211 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.739 11.611 -1.681 1.00 0.00 H new ATOM 0 HG12 VAL A 426 3.429 11.421 -3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 426 4.085 12.953 -2.798 1.00 0.00 H new ATOM 0 HG21 VAL A 426 2.274 13.039 -0.298 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.556 14.444 -1.354 1.00 0.00 H new ATOM 0 HG23 VAL A 426 0.895 13.891 -1.033 1.00 0.00 H new ATOM 867 N GLU A 427 1.935 15.752 -3.439 1.00 0.00 N ATOM 868 CA GLU A 427 2.679 16.995 -3.611 1.00 0.00 C ATOM 869 C GLU A 427 3.282 17.456 -2.288 1.00 0.00 C ATOM 870 O GLU A 427 2.576 17.951 -1.411 1.00 0.00 O ATOM 871 CB GLU A 427 1.768 18.086 -4.176 1.00 0.00 C ATOM 872 CG GLU A 427 1.506 17.947 -5.667 1.00 0.00 C ATOM 873 CD GLU A 427 0.367 16.994 -5.973 1.00 0.00 C ATOM 874 OE1 GLU A 427 -0.577 16.917 -5.158 1.00 0.00 O ATOM 875 OE2 GLU A 427 0.419 16.325 -7.026 1.00 0.00 O ATOM 0 H GLU A 427 1.055 15.853 -2.933 1.00 0.00 H new ATOM 0 HA GLU A 427 3.490 16.808 -4.315 1.00 0.00 H new ATOM 0 HB2 GLU A 427 0.817 18.065 -3.645 1.00 0.00 H new ATOM 0 HB3 GLU A 427 2.219 19.060 -3.984 1.00 0.00 H new ATOM 0 HG2 GLU A 427 1.277 18.927 -6.085 1.00 0.00 H new ATOM 0 HG3 GLU A 427 2.412 17.595 -6.160 1.00 0.00 H new ATOM 882 N THR A 428 4.593 17.288 -2.154 1.00 0.00 N ATOM 883 CA THR A 428 5.292 17.685 -0.937 1.00 0.00 C ATOM 884 C THR A 428 5.952 19.051 -1.110 1.00 0.00 C ATOM 885 O THR A 428 5.828 19.925 -0.253 1.00 0.00 O ATOM 886 CB THR A 428 6.345 16.639 -0.562 1.00 0.00 C ATOM 887 OG1 THR A 428 7.027 17.015 0.621 1.00 0.00 O ATOM 888 CG2 THR A 428 7.383 16.416 -1.640 1.00 0.00 C ATOM 0 H THR A 428 5.192 16.880 -2.872 1.00 0.00 H new ATOM 0 HA THR A 428 4.559 17.755 -0.133 1.00 0.00 H new ATOM 0 HB THR A 428 5.790 15.712 -0.421 1.00 0.00 H new ATOM 0 HG1 THR A 428 7.694 16.333 0.845 1.00 0.00 H new ATOM 0 HG21 THR A 428 8.097 15.663 -1.307 1.00 0.00 H new ATOM 0 HG22 THR A 428 6.893 16.074 -2.552 1.00 0.00 H new ATOM 0 HG23 THR A 428 7.908 17.351 -1.839 1.00 0.00 H new ATOM 896 N GLY A 429 6.653 19.226 -2.225 1.00 0.00 N ATOM 897 CA GLY A 429 7.323 20.487 -2.493 1.00 0.00 C ATOM 898 C GLY A 429 8.261 20.898 -1.375 1.00 0.00 C ATOM 899 O GLY A 429 8.518 22.086 -1.176 1.00 0.00 O ATOM 0 H GLY A 429 6.770 18.517 -2.949 1.00 0.00 H new ATOM 0 HA2 GLY A 429 7.886 20.405 -3.423 1.00 0.00 H new ATOM 0 HA3 GLY A 429 6.576 21.267 -2.641 1.00 0.00 H new ATOM 903 N GLY A 430 8.773 19.915 -0.642 1.00 0.00 N ATOM 904 CA GLY A 430 9.681 20.201 0.451 1.00 0.00 C ATOM 905 C GLY A 430 9.007 20.113 1.806 1.00 0.00 C ATOM 906 O GLY A 430 8.990 21.084 2.563 1.00 0.00 O ATOM 0 H GLY A 430 8.575 18.925 -0.786 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.516 19.501 0.418 1.00 0.00 H new ATOM 0 HA3 GLY A 430 10.098 21.200 0.321 1.00 0.00 H new ATOM 910 N GLN A 431 8.448 18.947 2.113 1.00 0.00 N ATOM 911 CA GLN A 431 7.771 18.734 3.386 1.00 0.00 C ATOM 912 C GLN A 431 8.354 17.531 4.119 1.00 0.00 C ATOM 913 O GLN A 431 8.348 16.414 3.601 1.00 0.00 O ATOM 914 CB GLN A 431 6.270 18.534 3.164 1.00 0.00 C ATOM 915 CG GLN A 431 5.595 19.705 2.473 1.00 0.00 C ATOM 916 CD GLN A 431 4.813 20.578 3.437 1.00 0.00 C ATOM 917 OE1 GLN A 431 4.777 20.317 4.639 1.00 0.00 O ATOM 918 NE2 GLN A 431 4.179 21.621 2.911 1.00 0.00 N ATOM 0 H GLN A 431 8.451 18.134 1.496 1.00 0.00 H new ATOM 0 HA GLN A 431 7.924 19.620 4.002 1.00 0.00 H new ATOM 0 HB2 GLN A 431 6.116 17.634 2.568 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.788 18.365 4.127 1.00 0.00 H new ATOM 0 HG2 GLN A 431 6.350 20.310 1.971 1.00 0.00 H new ATOM 0 HG3 GLN A 431 4.923 19.329 1.702 1.00 0.00 H new ATOM 0 HE21 GLN A 431 4.236 21.800 1.908 1.00 0.00 H new ATOM 0 HE22 GLN A 431 3.635 22.242 3.510 1.00 0.00 H new ATOM 927 N ASP A 432 8.858 17.765 5.326 1.00 0.00 N ATOM 928 CA ASP A 432 9.446 16.700 6.130 1.00 0.00 C ATOM 929 C ASP A 432 8.423 15.602 6.409 1.00 0.00 C ATOM 930 O ASP A 432 8.728 14.413 6.302 1.00 0.00 O ATOM 931 CB ASP A 432 9.980 17.263 7.447 1.00 0.00 C ATOM 932 CG ASP A 432 10.680 16.211 8.286 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.620 15.571 7.771 1.00 0.00 O ATOM 934 OD2 ASP A 432 10.286 16.028 9.458 1.00 0.00 O ATOM 0 H ASP A 432 8.871 18.684 5.769 1.00 0.00 H new ATOM 0 HA ASP A 432 10.273 16.267 5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 432 10.674 18.076 7.236 1.00 0.00 H new ATOM 0 HB3 ASP A 432 9.155 17.689 8.018 1.00 0.00 H new ATOM 939 N SER A 433 7.208 16.008 6.766 1.00 0.00 N ATOM 940 CA SER A 433 6.141 15.059 7.061 1.00 0.00 C ATOM 941 C SER A 433 5.869 14.157 5.862 1.00 0.00 C ATOM 942 O SER A 433 5.937 12.931 5.965 1.00 0.00 O ATOM 943 CB SER A 433 4.863 15.802 7.455 1.00 0.00 C ATOM 944 OG SER A 433 4.090 15.040 8.366 1.00 0.00 O ATOM 0 H SER A 433 6.939 16.987 6.858 1.00 0.00 H new ATOM 0 HA SER A 433 6.463 14.437 7.896 1.00 0.00 H new ATOM 0 HB2 SER A 433 5.120 16.761 7.905 1.00 0.00 H new ATOM 0 HB3 SER A 433 4.274 16.016 6.563 1.00 0.00 H new ATOM 0 HG SER A 433 3.280 15.537 8.603 1.00 0.00 H new ATOM 950 N VAL A 434 5.563 14.772 4.723 1.00 0.00 N ATOM 951 CA VAL A 434 5.283 14.024 3.504 1.00 0.00 C ATOM 952 C VAL A 434 6.477 13.166 3.100 1.00 0.00 C ATOM 953 O VAL A 434 6.313 12.063 2.581 1.00 0.00 O ATOM 954 CB VAL A 434 4.921 14.963 2.337 1.00 0.00 C ATOM 955 CG1 VAL A 434 4.375 14.165 1.163 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.921 16.016 2.787 1.00 0.00 C ATOM 0 H VAL A 434 5.503 15.785 4.620 1.00 0.00 H new ATOM 0 HA VAL A 434 4.431 13.379 3.718 1.00 0.00 H new ATOM 0 HB VAL A 434 5.827 15.474 2.011 1.00 0.00 H new ATOM 0 HG11 VAL A 434 4.124 14.843 0.347 1.00 0.00 H new ATOM 0 HG12 VAL A 434 5.128 13.454 0.825 1.00 0.00 H new ATOM 0 HG13 VAL A 434 3.480 13.626 1.474 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.678 16.669 1.949 1.00 0.00 H new ATOM 0 HG22 VAL A 434 3.013 15.528 3.141 1.00 0.00 H new ATOM 0 HG23 VAL A 434 4.354 16.607 3.594 1.00 0.00 H new ATOM 966 N ARG A 435 7.678 13.680 3.345 1.00 0.00 N ATOM 967 CA ARG A 435 8.899 12.958 3.010 1.00 0.00 C ATOM 968 C ARG A 435 8.958 11.625 3.749 1.00 0.00 C ATOM 969 O ARG A 435 9.037 10.563 3.130 1.00 0.00 O ATOM 970 CB ARG A 435 10.128 13.803 3.356 1.00 0.00 C ATOM 971 CG ARG A 435 10.558 14.738 2.238 1.00 0.00 C ATOM 972 CD ARG A 435 12.073 14.823 2.132 1.00 0.00 C ATOM 973 NE ARG A 435 12.502 15.402 0.862 1.00 0.00 N ATOM 974 CZ ARG A 435 12.363 14.796 -0.314 1.00 0.00 C ATOM 975 NH1 ARG A 435 11.805 13.594 -0.388 1.00 0.00 N ATOM 976 NH2 ARG A 435 12.783 15.393 -1.421 1.00 0.00 N ATOM 0 H ARG A 435 7.831 14.593 3.774 1.00 0.00 H new ATOM 0 HA ARG A 435 8.895 12.760 1.938 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.914 14.391 4.248 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.957 13.140 3.602 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.145 14.389 1.292 1.00 0.00 H new ATOM 0 HG3 ARG A 435 10.149 15.732 2.417 1.00 0.00 H new ATOM 0 HD2 ARG A 435 12.460 15.425 2.954 1.00 0.00 H new ATOM 0 HD3 ARG A 435 12.500 13.826 2.238 1.00 0.00 H new ATOM 0 HE ARG A 435 12.934 16.326 0.878 1.00 0.00 H new ATOM 0 HH11 ARG A 435 11.480 13.130 0.460 1.00 0.00 H new ATOM 0 HH12 ARG A 435 11.701 13.135 -1.293 1.00 0.00 H new ATOM 0 HH21 ARG A 435 13.213 16.317 -1.371 1.00 0.00 H new ATOM 0 HH22 ARG A 435 12.677 14.928 -2.323 1.00 0.00 H new ATOM 990 N GLN A 436 8.913 11.690 5.076 1.00 0.00 N ATOM 991 CA GLN A 436 8.953 10.488 5.902 1.00 0.00 C ATOM 992 C GLN A 436 7.823 9.537 5.525 1.00 0.00 C ATOM 993 O GLN A 436 8.041 8.340 5.336 1.00 0.00 O ATOM 994 CB GLN A 436 8.853 10.857 7.382 1.00 0.00 C ATOM 995 CG GLN A 436 9.681 9.961 8.292 1.00 0.00 C ATOM 996 CD GLN A 436 9.060 9.791 9.664 1.00 0.00 C ATOM 997 OE1 GLN A 436 7.838 9.772 9.808 1.00 0.00 O ATOM 998 NE2 GLN A 436 9.903 9.664 10.682 1.00 0.00 N ATOM 0 H GLN A 436 8.849 12.561 5.602 1.00 0.00 H new ATOM 0 HA GLN A 436 9.904 9.985 5.726 1.00 0.00 H new ATOM 0 HB2 GLN A 436 9.175 11.890 7.513 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.809 10.808 7.690 1.00 0.00 H new ATOM 0 HG2 GLN A 436 9.796 8.983 7.826 1.00 0.00 H new ATOM 0 HG3 GLN A 436 10.680 10.383 8.399 1.00 0.00 H new ATOM 0 HE21 GLN A 436 10.909 9.685 10.517 1.00 0.00 H new ATOM 0 HE22 GLN A 436 9.544 9.545 11.629 1.00 0.00 H new ATOM 1007 N ALA A 437 6.616 10.081 5.409 1.00 0.00 N ATOM 1008 CA ALA A 437 5.451 9.285 5.048 1.00 0.00 C ATOM 1009 C ALA A 437 5.609 8.693 3.652 1.00 0.00 C ATOM 1010 O ALA A 437 5.219 7.553 3.402 1.00 0.00 O ATOM 1011 CB ALA A 437 4.191 10.133 5.125 1.00 0.00 C ATOM 0 H ALA A 437 6.420 11.071 5.560 1.00 0.00 H new ATOM 0 HA ALA A 437 5.365 8.462 5.758 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.327 9.527 4.853 1.00 0.00 H new ATOM 0 HB2 ALA A 437 4.066 10.507 6.141 1.00 0.00 H new ATOM 0 HB3 ALA A 437 4.276 10.974 4.436 1.00 0.00 H new ATOM 1017 N ARG A 438 6.189 9.475 2.747 1.00 0.00 N ATOM 1018 CA ARG A 438 6.403 9.029 1.375 1.00 0.00 C ATOM 1019 C ARG A 438 7.273 7.777 1.345 1.00 0.00 C ATOM 1020 O ARG A 438 6.867 6.739 0.823 1.00 0.00 O ATOM 1021 CB ARG A 438 7.058 10.140 0.551 1.00 0.00 C ATOM 1022 CG ARG A 438 7.295 9.759 -0.902 1.00 0.00 C ATOM 1023 CD ARG A 438 6.539 10.676 -1.852 1.00 0.00 C ATOM 1024 NE ARG A 438 7.294 11.887 -2.160 1.00 0.00 N ATOM 1025 CZ ARG A 438 8.401 11.905 -2.899 1.00 0.00 C ATOM 1026 NH1 ARG A 438 8.884 10.778 -3.408 1.00 0.00 N ATOM 1027 NH2 ARG A 438 9.025 13.052 -3.129 1.00 0.00 N ATOM 0 H ARG A 438 6.519 10.421 2.939 1.00 0.00 H new ATOM 0 HA ARG A 438 5.433 8.789 0.939 1.00 0.00 H new ATOM 0 HB2 ARG A 438 6.427 11.028 0.587 1.00 0.00 H new ATOM 0 HB3 ARG A 438 8.011 10.407 1.008 1.00 0.00 H new ATOM 0 HG2 ARG A 438 8.362 9.806 -1.122 1.00 0.00 H new ATOM 0 HG3 ARG A 438 6.981 8.728 -1.064 1.00 0.00 H new ATOM 0 HD2 ARG A 438 6.320 10.140 -2.776 1.00 0.00 H new ATOM 0 HD3 ARG A 438 5.582 10.949 -1.408 1.00 0.00 H new ATOM 0 HE ARG A 438 6.953 12.773 -1.786 1.00 0.00 H new ATOM 0 HH11 ARG A 438 8.407 9.894 -3.233 1.00 0.00 H new ATOM 0 HH12 ARG A 438 9.733 10.796 -3.974 1.00 0.00 H new ATOM 0 HH21 ARG A 438 8.657 13.920 -2.740 1.00 0.00 H new ATOM 0 HH22 ARG A 438 9.873 13.066 -3.695 1.00 0.00 H new ATOM 1041 N LYS A 439 8.471 7.881 1.914 1.00 0.00 N ATOM 1042 CA LYS A 439 9.395 6.752 1.956 1.00 0.00 C ATOM 1043 C LYS A 439 8.752 5.557 2.651 1.00 0.00 C ATOM 1044 O LYS A 439 8.801 4.431 2.150 1.00 0.00 O ATOM 1045 CB LYS A 439 10.684 7.148 2.681 1.00 0.00 C ATOM 1046 CG LYS A 439 11.756 7.702 1.756 1.00 0.00 C ATOM 1047 CD LYS A 439 13.153 7.390 2.272 1.00 0.00 C ATOM 1048 CE LYS A 439 14.100 7.040 1.137 1.00 0.00 C ATOM 1049 NZ LYS A 439 14.262 5.566 0.981 1.00 0.00 N ATOM 0 H LYS A 439 8.824 8.733 2.351 1.00 0.00 H new ATOM 0 HA LYS A 439 9.637 6.469 0.931 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.450 7.894 3.440 1.00 0.00 H new ATOM 0 HB3 LYS A 439 11.080 6.277 3.202 1.00 0.00 H new ATOM 0 HG2 LYS A 439 11.632 7.279 0.759 1.00 0.00 H new ATOM 0 HG3 LYS A 439 11.634 8.781 1.661 1.00 0.00 H new ATOM 0 HD2 LYS A 439 13.541 8.250 2.819 1.00 0.00 H new ATOM 0 HD3 LYS A 439 13.105 6.560 2.976 1.00 0.00 H new ATOM 0 HE2 LYS A 439 13.723 7.464 0.206 1.00 0.00 H new ATOM 0 HE3 LYS A 439 15.073 7.494 1.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 14.916 5.370 0.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 14.646 5.164 1.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 13.338 5.135 0.778 1.00 0.00 H new ATOM 1063 N GLU A 440 8.144 5.811 3.805 1.00 0.00 N ATOM 1064 CA GLU A 440 7.483 4.760 4.570 1.00 0.00 C ATOM 1065 C GLU A 440 6.387 4.099 3.742 1.00 0.00 C ATOM 1066 O GLU A 440 6.238 2.878 3.750 1.00 0.00 O ATOM 1067 CB GLU A 440 6.892 5.338 5.858 1.00 0.00 C ATOM 1068 CG GLU A 440 6.136 4.318 6.695 1.00 0.00 C ATOM 1069 CD GLU A 440 7.060 3.371 7.436 1.00 0.00 C ATOM 1070 OE1 GLU A 440 8.146 3.063 6.902 1.00 0.00 O ATOM 1071 OE2 GLU A 440 6.696 2.936 8.550 1.00 0.00 O ATOM 0 H GLU A 440 8.095 6.736 4.231 1.00 0.00 H new ATOM 0 HA GLU A 440 8.225 4.004 4.827 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.697 5.762 6.458 1.00 0.00 H new ATOM 0 HB3 GLU A 440 6.219 6.156 5.603 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.504 4.840 7.414 1.00 0.00 H new ATOM 0 HG3 GLU A 440 5.474 3.742 6.048 1.00 0.00 H new ATOM 1078 N ALA A 441 5.622 4.916 3.023 1.00 0.00 N ATOM 1079 CA ALA A 441 4.541 4.412 2.186 1.00 0.00 C ATOM 1080 C ALA A 441 5.074 3.461 1.122 1.00 0.00 C ATOM 1081 O ALA A 441 4.557 2.357 0.946 1.00 0.00 O ATOM 1082 CB ALA A 441 3.793 5.567 1.538 1.00 0.00 C ATOM 0 H ALA A 441 5.732 5.930 3.004 1.00 0.00 H new ATOM 0 HA ALA A 441 3.849 3.857 2.820 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.988 5.176 0.916 1.00 0.00 H new ATOM 0 HB2 ALA A 441 3.373 6.209 2.313 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.481 6.145 0.921 1.00 0.00 H new ATOM 1088 N VAL A 442 6.114 3.893 0.415 1.00 0.00 N ATOM 1089 CA VAL A 442 6.718 3.077 -0.630 1.00 0.00 C ATOM 1090 C VAL A 442 7.245 1.765 -0.061 1.00 0.00 C ATOM 1091 O VAL A 442 7.113 0.709 -0.681 1.00 0.00 O ATOM 1092 CB VAL A 442 7.873 3.820 -1.330 1.00 0.00 C ATOM 1093 CG1 VAL A 442 8.319 3.064 -2.572 1.00 0.00 C ATOM 1094 CG2 VAL A 442 7.461 5.242 -1.681 1.00 0.00 C ATOM 0 H VAL A 442 6.555 4.803 0.548 1.00 0.00 H new ATOM 0 HA VAL A 442 5.937 2.869 -1.361 1.00 0.00 H new ATOM 0 HB VAL A 442 8.716 3.872 -0.642 1.00 0.00 H new ATOM 0 HG11 VAL A 442 9.135 3.604 -3.053 1.00 0.00 H new ATOM 0 HG12 VAL A 442 8.660 2.068 -2.289 1.00 0.00 H new ATOM 0 HG13 VAL A 442 7.483 2.978 -3.266 1.00 0.00 H new ATOM 0 HG21 VAL A 442 8.290 5.750 -2.174 1.00 0.00 H new ATOM 0 HG22 VAL A 442 6.601 5.217 -2.350 1.00 0.00 H new ATOM 0 HG23 VAL A 442 7.197 5.779 -0.770 1.00 0.00 H new ATOM 1104 N CYS A 443 7.841 1.837 1.124 1.00 0.00 N ATOM 1105 CA CYS A 443 8.384 0.652 1.778 1.00 0.00 C ATOM 1106 C CYS A 443 7.277 -0.354 2.077 1.00 0.00 C ATOM 1107 O CYS A 443 7.413 -1.545 1.796 1.00 0.00 O ATOM 1108 CB CYS A 443 9.100 1.039 3.073 1.00 0.00 C ATOM 1109 SG CYS A 443 10.575 0.056 3.421 1.00 0.00 S ATOM 0 H CYS A 443 7.960 2.702 1.651 1.00 0.00 H new ATOM 0 HA CYS A 443 9.102 0.189 1.101 1.00 0.00 H new ATOM 0 HB2 CYS A 443 9.381 2.091 3.020 1.00 0.00 H new ATOM 0 HB3 CYS A 443 8.404 0.937 3.905 1.00 0.00 H new ATOM 0 HG CYS A 443 11.112 0.459 4.534 1.00 0.00 H new ATOM 1115 N LYS A 444 6.181 0.135 2.648 1.00 0.00 N ATOM 1116 CA LYS A 444 5.044 -0.715 2.989 1.00 0.00 C ATOM 1117 C LYS A 444 4.446 -1.355 1.742 1.00 0.00 C ATOM 1118 O LYS A 444 4.439 -2.578 1.607 1.00 0.00 O ATOM 1119 CB LYS A 444 3.976 0.097 3.724 1.00 0.00 C ATOM 1120 CG LYS A 444 4.156 0.116 5.233 1.00 0.00 C ATOM 1121 CD LYS A 444 3.501 1.337 5.857 1.00 0.00 C ATOM 1122 CE LYS A 444 2.142 1.000 6.449 1.00 0.00 C ATOM 1123 NZ LYS A 444 1.090 0.890 5.400 1.00 0.00 N ATOM 0 H LYS A 444 6.055 1.119 2.885 1.00 0.00 H new ATOM 0 HA LYS A 444 5.401 -1.509 3.644 1.00 0.00 H new ATOM 0 HB2 LYS A 444 3.991 1.121 3.352 1.00 0.00 H new ATOM 0 HB3 LYS A 444 2.994 -0.313 3.489 1.00 0.00 H new ATOM 0 HG2 LYS A 444 3.726 -0.789 5.663 1.00 0.00 H new ATOM 0 HG3 LYS A 444 5.219 0.109 5.474 1.00 0.00 H new ATOM 0 HD2 LYS A 444 4.148 1.740 6.636 1.00 0.00 H new ATOM 0 HD3 LYS A 444 3.387 2.115 5.103 1.00 0.00 H new ATOM 0 HE2 LYS A 444 2.208 0.060 6.997 1.00 0.00 H new ATOM 0 HE3 LYS A 444 1.859 1.769 7.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 0.281 1.491 5.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 1.477 1.200 4.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 0.776 -0.099 5.325 1.00 0.00 H new ATOM 1137 N ILE A 445 3.944 -0.525 0.829 1.00 0.00 N ATOM 1138 CA ILE A 445 3.345 -1.025 -0.407 1.00 0.00 C ATOM 1139 C ILE A 445 4.256 -2.050 -1.075 1.00 0.00 C ATOM 1140 O ILE A 445 3.813 -3.137 -1.449 1.00 0.00 O ATOM 1141 CB ILE A 445 3.047 0.116 -1.402 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.266 1.028 -1.560 1.00 0.00 C ATOM 1143 CG2 ILE A 445 1.837 0.915 -0.942 1.00 0.00 C ATOM 1144 CD1 ILE A 445 5.070 0.748 -2.811 1.00 0.00 C ATOM 0 H ILE A 445 3.940 0.491 0.921 1.00 0.00 H new ATOM 0 HA ILE A 445 2.403 -1.499 -0.132 1.00 0.00 H new ATOM 0 HB ILE A 445 2.823 -0.323 -2.374 1.00 0.00 H new ATOM 0 HG12 ILE A 445 3.934 2.066 -1.576 1.00 0.00 H new ATOM 0 HG13 ILE A 445 4.911 0.913 -0.689 1.00 0.00 H new ATOM 0 HG21 ILE A 445 1.638 1.717 -1.653 1.00 0.00 H new ATOM 0 HG22 ILE A 445 0.969 0.259 -0.883 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.036 1.343 0.041 1.00 0.00 H new ATOM 0 HD11 ILE A 445 5.918 1.431 -2.859 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.432 -0.280 -2.788 1.00 0.00 H new ATOM 0 HD13 ILE A 445 4.439 0.891 -3.688 1.00 0.00 H new ATOM 1156 N GLN A 446 5.534 -1.707 -1.200 1.00 0.00 N ATOM 1157 CA GLN A 446 6.506 -2.610 -1.800 1.00 0.00 C ATOM 1158 C GLN A 446 6.734 -3.809 -0.887 1.00 0.00 C ATOM 1159 O GLN A 446 7.025 -4.912 -1.349 1.00 0.00 O ATOM 1160 CB GLN A 446 7.828 -1.883 -2.052 1.00 0.00 C ATOM 1161 CG GLN A 446 8.599 -2.421 -3.248 1.00 0.00 C ATOM 1162 CD GLN A 446 10.088 -2.521 -2.983 1.00 0.00 C ATOM 1163 OE1 GLN A 446 10.606 -1.919 -2.043 1.00 0.00 O ATOM 1164 NE2 GLN A 446 10.786 -3.289 -3.812 1.00 0.00 N ATOM 0 H GLN A 446 5.918 -0.813 -0.895 1.00 0.00 H new ATOM 0 HA GLN A 446 6.115 -2.959 -2.756 1.00 0.00 H new ATOM 0 HB2 GLN A 446 7.627 -0.823 -2.207 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.452 -1.962 -1.162 1.00 0.00 H new ATOM 0 HG2 GLN A 446 8.213 -3.406 -3.511 1.00 0.00 H new ATOM 0 HG3 GLN A 446 8.429 -1.772 -4.107 1.00 0.00 H new ATOM 0 HE21 GLN A 446 10.316 -3.770 -4.579 1.00 0.00 H new ATOM 0 HE22 GLN A 446 11.792 -3.397 -3.682 1.00 0.00 H new ATOM 1173 N ALA A 447 6.588 -3.580 0.416 1.00 0.00 N ATOM 1174 CA ALA A 447 6.764 -4.633 1.407 1.00 0.00 C ATOM 1175 C ALA A 447 5.643 -5.661 1.303 1.00 0.00 C ATOM 1176 O ALA A 447 5.892 -6.865 1.243 1.00 0.00 O ATOM 1177 CB ALA A 447 6.809 -4.032 2.805 1.00 0.00 C ATOM 0 H ALA A 447 6.347 -2.670 0.809 1.00 0.00 H new ATOM 0 HA ALA A 447 7.709 -5.140 1.213 1.00 0.00 H new ATOM 0 HB1 ALA A 447 6.941 -4.827 3.539 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.642 -3.333 2.874 1.00 0.00 H new ATOM 0 HB3 ALA A 447 5.876 -3.505 3.005 1.00 0.00 H new ATOM 1183 N ILE A 448 4.406 -5.173 1.275 1.00 0.00 N ATOM 1184 CA ILE A 448 3.242 -6.042 1.170 1.00 0.00 C ATOM 1185 C ILE A 448 3.233 -6.778 -0.166 1.00 0.00 C ATOM 1186 O ILE A 448 2.908 -7.964 -0.232 1.00 0.00 O ATOM 1187 CB ILE A 448 1.931 -5.241 1.327 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.714 -6.165 1.212 1.00 0.00 C ATOM 1189 CG2 ILE A 448 1.858 -4.130 0.289 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.562 -5.548 1.739 1.00 0.00 C ATOM 0 H ILE A 448 4.186 -4.178 1.324 1.00 0.00 H new ATOM 0 HA ILE A 448 3.306 -6.771 1.978 1.00 0.00 H new ATOM 0 HB ILE A 448 1.923 -4.789 2.319 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.572 -6.437 0.166 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.915 -7.087 1.757 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.928 -3.576 0.414 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.703 -3.454 0.419 1.00 0.00 H new ATOM 0 HG23 ILE A 448 1.890 -4.563 -0.711 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.382 -6.257 1.626 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.438 -5.301 2.793 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.786 -4.641 1.178 1.00 0.00 H new ATOM 1202 N LEU A 449 3.601 -6.068 -1.229 1.00 0.00 N ATOM 1203 CA LEU A 449 3.641 -6.658 -2.562 1.00 0.00 C ATOM 1204 C LEU A 449 4.669 -7.782 -2.620 1.00 0.00 C ATOM 1205 O LEU A 449 4.376 -8.884 -3.088 1.00 0.00 O ATOM 1206 CB LEU A 449 3.969 -5.587 -3.607 1.00 0.00 C ATOM 1207 CG LEU A 449 2.935 -5.432 -4.722 1.00 0.00 C ATOM 1208 CD1 LEU A 449 1.565 -5.113 -4.140 1.00 0.00 C ATOM 1209 CD2 LEU A 449 3.365 -4.348 -5.700 1.00 0.00 C ATOM 0 H LEU A 449 3.875 -5.086 -1.193 1.00 0.00 H new ATOM 0 HA LEU A 449 2.659 -7.076 -2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 449 4.080 -4.629 -3.100 1.00 0.00 H new ATOM 0 HB3 LEU A 449 4.933 -5.823 -4.057 1.00 0.00 H new ATOM 0 HG LEU A 449 2.867 -6.376 -5.262 1.00 0.00 H new ATOM 0 HD11 LEU A 449 0.842 -5.006 -4.949 1.00 0.00 H new ATOM 0 HD12 LEU A 449 1.253 -5.922 -3.479 1.00 0.00 H new ATOM 0 HD13 LEU A 449 1.617 -4.182 -3.575 1.00 0.00 H new ATOM 0 HD21 LEU A 449 2.617 -4.251 -6.487 1.00 0.00 H new ATOM 0 HD22 LEU A 449 3.461 -3.399 -5.172 1.00 0.00 H new ATOM 0 HD23 LEU A 449 4.325 -4.616 -6.142 1.00 0.00 H new ATOM 1221 N GLU A 450 5.875 -7.500 -2.133 1.00 0.00 N ATOM 1222 CA GLU A 450 6.945 -8.490 -2.123 1.00 0.00 C ATOM 1223 C GLU A 450 6.542 -9.707 -1.297 1.00 0.00 C ATOM 1224 O GLU A 450 6.774 -10.847 -1.701 1.00 0.00 O ATOM 1225 CB GLU A 450 8.229 -7.880 -1.559 1.00 0.00 C ATOM 1226 CG GLU A 450 9.495 -8.566 -2.049 1.00 0.00 C ATOM 1227 CD GLU A 450 10.218 -7.765 -3.113 1.00 0.00 C ATOM 1228 OE1 GLU A 450 9.644 -7.573 -4.206 1.00 0.00 O ATOM 1229 OE2 GLU A 450 11.359 -7.326 -2.854 1.00 0.00 O ATOM 0 H GLU A 450 6.134 -6.595 -1.741 1.00 0.00 H new ATOM 0 HA GLU A 450 7.125 -8.808 -3.150 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.269 -6.825 -1.830 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.197 -7.929 -0.471 1.00 0.00 H new ATOM 0 HG2 GLU A 450 10.165 -8.730 -1.205 1.00 0.00 H new ATOM 0 HG3 GLU A 450 9.240 -9.548 -2.449 1.00 0.00 H new ATOM 1236 N LYS A 451 5.933 -9.458 -0.143 1.00 0.00 N ATOM 1237 CA LYS A 451 5.491 -10.534 0.735 1.00 0.00 C ATOM 1238 C LYS A 451 4.478 -11.427 0.025 1.00 0.00 C ATOM 1239 O LYS A 451 4.552 -12.653 0.104 1.00 0.00 O ATOM 1240 CB LYS A 451 4.878 -9.961 2.014 1.00 0.00 C ATOM 1241 CG LYS A 451 5.881 -9.783 3.143 1.00 0.00 C ATOM 1242 CD LYS A 451 5.385 -8.786 4.177 1.00 0.00 C ATOM 1243 CE LYS A 451 4.767 -9.487 5.377 1.00 0.00 C ATOM 1244 NZ LYS A 451 5.771 -9.749 6.445 1.00 0.00 N ATOM 0 H LYS A 451 5.734 -8.520 0.206 1.00 0.00 H new ATOM 0 HA LYS A 451 6.360 -11.136 0.999 1.00 0.00 H new ATOM 0 HB2 LYS A 451 4.423 -8.997 1.788 1.00 0.00 H new ATOM 0 HB3 LYS A 451 4.078 -10.620 2.351 1.00 0.00 H new ATOM 0 HG2 LYS A 451 6.065 -10.744 3.622 1.00 0.00 H new ATOM 0 HG3 LYS A 451 6.833 -9.443 2.735 1.00 0.00 H new ATOM 0 HD2 LYS A 451 6.214 -8.160 4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 451 4.648 -8.124 3.722 1.00 0.00 H new ATOM 0 HE2 LYS A 451 3.960 -8.874 5.780 1.00 0.00 H new ATOM 0 HE3 LYS A 451 4.322 -10.430 5.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 5.310 -10.228 7.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 6.528 -10.355 6.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 6.177 -8.848 6.768 1.00 0.00 H new ATOM 1258 N LEU A 452 3.534 -10.801 -0.671 1.00 0.00 N ATOM 1259 CA LEU A 452 2.508 -11.538 -1.401 1.00 0.00 C ATOM 1260 C LEU A 452 3.138 -12.427 -2.468 1.00 0.00 C ATOM 1261 O LEU A 452 2.824 -13.613 -2.568 1.00 0.00 O ATOM 1262 CB LEU A 452 1.515 -10.570 -2.047 1.00 0.00 C ATOM 1263 CG LEU A 452 0.292 -10.233 -1.192 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.254 -8.862 -1.563 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.782 -11.298 -1.354 1.00 0.00 C ATOM 0 H LEU A 452 3.458 -9.787 -0.745 1.00 0.00 H new ATOM 0 HA LEU A 452 1.975 -12.171 -0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 452 2.037 -9.644 -2.288 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.174 -10.998 -2.990 1.00 0.00 H new ATOM 0 HG LEU A 452 0.597 -10.211 -0.146 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.124 -8.638 -0.946 1.00 0.00 H new ATOM 0 HD12 LEU A 452 0.514 -8.107 -1.396 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.544 -8.858 -2.614 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.644 -11.042 -0.739 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -1.086 -11.352 -2.399 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -0.387 -12.264 -1.040 1.00 0.00 H new ATOM 1277 N GLU A 453 4.030 -11.844 -3.265 1.00 0.00 N ATOM 1278 CA GLU A 453 4.706 -12.583 -4.324 1.00 0.00 C ATOM 1279 C GLU A 453 5.465 -13.777 -3.755 1.00 0.00 C ATOM 1280 O GLU A 453 5.434 -14.872 -4.319 1.00 0.00 O ATOM 1281 CB GLU A 453 5.668 -11.667 -5.080 1.00 0.00 C ATOM 1282 CG GLU A 453 6.017 -12.167 -6.473 1.00 0.00 C ATOM 1283 CD GLU A 453 6.063 -11.052 -7.499 1.00 0.00 C ATOM 1284 OE1 GLU A 453 5.220 -10.135 -7.417 1.00 0.00 O ATOM 1285 OE2 GLU A 453 6.942 -11.097 -8.385 1.00 0.00 O ATOM 0 H GLU A 453 4.300 -10.863 -3.196 1.00 0.00 H new ATOM 0 HA GLU A 453 3.948 -12.952 -5.015 1.00 0.00 H new ATOM 0 HB2 GLU A 453 5.224 -10.675 -5.160 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.585 -11.560 -4.501 1.00 0.00 H new ATOM 0 HG2 GLU A 453 6.985 -12.668 -6.443 1.00 0.00 H new ATOM 0 HG3 GLU A 453 5.282 -12.910 -6.783 1.00 0.00 H new ATOM 1292 N LYS A 454 6.145 -13.559 -2.634 1.00 0.00 N ATOM 1293 CA LYS A 454 6.911 -14.616 -1.986 1.00 0.00 C ATOM 1294 C LYS A 454 5.988 -15.708 -1.455 1.00 0.00 C ATOM 1295 O LYS A 454 6.325 -16.892 -1.487 1.00 0.00 O ATOM 1296 CB LYS A 454 7.752 -14.042 -0.845 1.00 0.00 C ATOM 1297 CG LYS A 454 9.084 -14.750 -0.654 1.00 0.00 C ATOM 1298 CD LYS A 454 9.898 -14.111 0.459 1.00 0.00 C ATOM 1299 CE LYS A 454 11.380 -14.084 0.120 1.00 0.00 C ATOM 1300 NZ LYS A 454 12.086 -12.966 0.803 1.00 0.00 N ATOM 0 H LYS A 454 6.181 -12.659 -2.156 1.00 0.00 H new ATOM 0 HA LYS A 454 7.576 -15.056 -2.729 1.00 0.00 H new ATOM 0 HB2 LYS A 454 7.936 -12.985 -1.037 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.182 -14.103 0.082 1.00 0.00 H new ATOM 0 HG2 LYS A 454 8.909 -15.801 -0.422 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.651 -14.719 -1.585 1.00 0.00 H new ATOM 0 HD2 LYS A 454 9.545 -13.095 0.632 1.00 0.00 H new ATOM 0 HD3 LYS A 454 9.746 -14.664 1.386 1.00 0.00 H new ATOM 0 HE2 LYS A 454 11.836 -15.031 0.409 1.00 0.00 H new ATOM 0 HE3 LYS A 454 11.504 -13.986 -0.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 13.094 -12.983 0.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 11.668 -12.060 0.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 11.990 -13.073 1.833 1.00 0.00 H new ATOM 1314 N LYS A 455 4.820 -15.301 -0.966 1.00 0.00 N ATOM 1315 CA LYS A 455 3.846 -16.245 -0.427 1.00 0.00 C ATOM 1316 C LYS A 455 2.786 -16.594 -1.470 1.00 0.00 C ATOM 1317 O LYS A 455 1.668 -16.975 -1.127 1.00 0.00 O ATOM 1318 CB LYS A 455 3.178 -15.662 0.819 1.00 0.00 C ATOM 1319 CG LYS A 455 3.847 -16.078 2.119 1.00 0.00 C ATOM 1320 CD LYS A 455 2.842 -16.185 3.253 1.00 0.00 C ATOM 1321 CE LYS A 455 3.524 -16.506 4.575 1.00 0.00 C ATOM 1322 NZ LYS A 455 3.434 -17.955 4.909 1.00 0.00 N ATOM 0 H LYS A 455 4.525 -14.325 -0.932 1.00 0.00 H new ATOM 0 HA LYS A 455 4.375 -17.158 -0.156 1.00 0.00 H new ATOM 0 HB2 LYS A 455 3.184 -14.574 0.749 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.134 -15.974 0.841 1.00 0.00 H new ATOM 0 HG2 LYS A 455 4.346 -17.037 1.982 1.00 0.00 H new ATOM 0 HG3 LYS A 455 4.617 -15.353 2.381 1.00 0.00 H new ATOM 0 HD2 LYS A 455 2.293 -15.248 3.344 1.00 0.00 H new ATOM 0 HD3 LYS A 455 2.112 -16.961 3.021 1.00 0.00 H new ATOM 0 HE2 LYS A 455 4.572 -16.210 4.524 1.00 0.00 H new ATOM 0 HE3 LYS A 455 3.065 -15.921 5.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 3.910 -18.132 5.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 2.435 -18.233 4.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 3.894 -18.513 4.162 1.00 0.00 H new ATOM 1336 N GLY A 456 3.146 -16.460 -2.744 1.00 0.00 N ATOM 1337 CA GLY A 456 2.212 -16.767 -3.812 1.00 0.00 C ATOM 1338 C GLY A 456 2.821 -16.576 -5.187 1.00 0.00 C ATOM 1339 O GLY A 456 2.699 -15.463 -5.740 1.00 0.00 O ATOM 1340 OXT GLY A 456 3.419 -17.540 -5.709 1.00 0.00 O ATOM 0 H GLY A 456 4.065 -16.145 -3.054 1.00 0.00 H new ATOM 0 HA2 GLY A 456 1.872 -17.797 -3.708 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.333 -16.130 -3.716 1.00 0.00 H new