USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 721 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 365 SER OG : rot 180:sc= 0 USER MOD Single : A 368 MET CE :methyl 169:sc= -0.494 (180deg=-1.09) USER MOD Single : A 369 ASN : amide:sc= -4.04! C(o=-4!,f=-9!) USER MOD Single : A 371 LYS NZ :NH3+ 171:sc= -0.125 (180deg=-0.231) USER MOD Single : A 373 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot 74:sc= -4.7! USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS :FLIP no HE2:sc= -4.65! C(o=-5.8!,f=-4.6!) USER MOD Single : A 387 TYR OH : rot 165:sc= -3.25! USER MOD Single : A 389 THR OG1 : rot 143:sc= -1.5! USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= -0.0737 (180deg=-0.0737) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 394 THR OG1 : rot -101:sc= -0.466 USER MOD Single : A 399 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 400 SER OG : rot 21:sc= 0.412 USER MOD Single : A 404 CYS SG : rot -83:sc= -6.51! USER MOD Single : A 410 THR OG1 : rot 180:sc= 0 USER MOD Single : A 414 THR OG1 : rot 12:sc= 0.882 USER MOD Single : A 419 ASN : amide:sc= 0.312 K(o=0.31,f=-7!) USER MOD Single : A 421 LYS NZ :NH3+ 156:sc= -1.48! (180deg=-2.07!) USER MOD Single : A 430 ASN : amide:sc= -0.0901 K(o=-0.09,f=-4.1!) USER MOD Single : A 435 LYS NZ :NH3+ -124:sc= 0.159 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl -116:sc= -0.507 (180deg=-4.87!) USER MOD Single : A 441 TYR OH : rot 130:sc= -1.72! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= 0 X(o=0,f=0.31) USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 453 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 364 -3.101 -13.796 7.379 1.00 0.00 N ATOM 2 CA GLY A 364 -3.302 -13.955 8.846 1.00 0.00 C ATOM 3 C GLY A 364 -4.489 -13.164 9.357 1.00 0.00 C ATOM 4 O GLY A 364 -4.453 -12.618 10.459 1.00 0.00 O ATOM 0 HA2 GLY A 364 -3.446 -15.010 9.078 1.00 0.00 H new ATOM 0 HA3 GLY A 364 -2.402 -13.633 9.370 1.00 0.00 H new ATOM 10 N SER A 365 -5.545 -13.100 8.553 1.00 0.00 N ATOM 11 CA SER A 365 -6.747 -12.368 8.930 1.00 0.00 C ATOM 12 C SER A 365 -6.459 -10.875 9.043 1.00 0.00 C ATOM 13 O SER A 365 -5.851 -10.421 10.012 1.00 0.00 O ATOM 14 CB SER A 365 -7.297 -12.894 10.256 1.00 0.00 C ATOM 15 OG SER A 365 -8.174 -13.988 10.046 1.00 0.00 O ATOM 0 H SER A 365 -5.592 -13.546 7.637 1.00 0.00 H new ATOM 0 HA SER A 365 -7.494 -12.520 8.151 1.00 0.00 H new ATOM 0 HB2 SER A 365 -6.472 -13.203 10.898 1.00 0.00 H new ATOM 0 HB3 SER A 365 -7.825 -12.095 10.777 1.00 0.00 H new ATOM 0 HG SER A 365 -8.511 -14.307 10.909 1.00 0.00 H new ATOM 21 N LEU A 366 -6.896 -10.120 8.044 1.00 0.00 N ATOM 22 CA LEU A 366 -6.686 -8.678 8.022 1.00 0.00 C ATOM 23 C LEU A 366 -7.951 -7.957 7.573 1.00 0.00 C ATOM 24 O LEU A 366 -9.024 -8.554 7.498 1.00 0.00 O ATOM 25 CB LEU A 366 -5.529 -8.334 7.083 1.00 0.00 C ATOM 26 CG LEU A 366 -5.169 -9.434 6.089 1.00 0.00 C ATOM 27 CD1 LEU A 366 -6.287 -9.624 5.076 1.00 0.00 C ATOM 28 CD2 LEU A 366 -3.863 -9.113 5.384 1.00 0.00 C ATOM 0 H LEU A 366 -7.400 -10.484 7.235 1.00 0.00 H new ATOM 0 HA LEU A 366 -6.440 -8.349 9.032 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -5.785 -7.431 6.529 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -4.649 -8.102 7.682 1.00 0.00 H new ATOM 0 HG LEU A 366 -5.041 -10.365 6.641 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -6.013 -10.412 4.375 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -7.204 -9.902 5.595 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -6.446 -8.693 4.531 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -3.624 -9.910 4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -3.962 -8.170 4.846 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -3.064 -9.028 6.120 1.00 0.00 H new ATOM 40 N ASP A 367 -7.813 -6.673 7.267 1.00 0.00 N ATOM 41 CA ASP A 367 -8.943 -5.872 6.815 1.00 0.00 C ATOM 42 C ASP A 367 -9.592 -6.510 5.592 1.00 0.00 C ATOM 43 O ASP A 367 -9.201 -7.596 5.167 1.00 0.00 O ATOM 44 CB ASP A 367 -8.489 -4.450 6.482 1.00 0.00 C ATOM 45 CG ASP A 367 -8.233 -3.615 7.722 1.00 0.00 C ATOM 46 OD1 ASP A 367 -7.862 -4.195 8.763 1.00 0.00 O ATOM 47 OD2 ASP A 367 -8.401 -2.379 7.649 1.00 0.00 O ATOM 0 H ASP A 367 -6.931 -6.165 7.324 1.00 0.00 H new ATOM 0 HA ASP A 367 -9.677 -5.828 7.620 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.579 -4.494 5.883 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.249 -3.963 5.871 1.00 0.00 H new ATOM 52 N MET A 368 -10.585 -5.831 5.028 1.00 0.00 N ATOM 53 CA MET A 368 -11.282 -6.339 3.854 1.00 0.00 C ATOM 54 C MET A 368 -10.895 -5.554 2.607 1.00 0.00 C ATOM 55 O MET A 368 -10.668 -6.131 1.544 1.00 0.00 O ATOM 56 CB MET A 368 -12.795 -6.275 4.066 1.00 0.00 C ATOM 57 CG MET A 368 -13.325 -7.380 4.967 1.00 0.00 C ATOM 58 SD MET A 368 -15.095 -7.240 5.271 1.00 0.00 S ATOM 59 CE MET A 368 -15.652 -6.573 3.706 1.00 0.00 C ATOM 0 H MET A 368 -10.924 -4.930 5.364 1.00 0.00 H new ATOM 0 HA MET A 368 -10.987 -7.378 3.709 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.053 -5.308 4.498 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.293 -6.335 3.098 1.00 0.00 H new ATOM 0 HG2 MET A 368 -13.114 -8.347 4.511 1.00 0.00 H new ATOM 0 HG3 MET A 368 -12.794 -7.354 5.918 1.00 0.00 H new ATOM 0 HE1 MET A 368 -16.740 -6.611 3.661 1.00 0.00 H new ATOM 0 HE2 MET A 368 -15.321 -5.539 3.613 1.00 0.00 H new ATOM 0 HE3 MET A 368 -15.234 -7.163 2.890 1.00 0.00 H new ATOM 69 N ASN A 369 -10.823 -4.234 2.742 1.00 0.00 N ATOM 70 CA ASN A 369 -10.465 -3.374 1.623 1.00 0.00 C ATOM 71 C ASN A 369 -9.291 -2.467 1.970 1.00 0.00 C ATOM 72 O ASN A 369 -9.470 -1.287 2.269 1.00 0.00 O ATOM 73 CB ASN A 369 -11.665 -2.525 1.219 1.00 0.00 C ATOM 74 CG ASN A 369 -12.360 -3.055 -0.019 1.00 0.00 C ATOM 75 OD1 ASN A 369 -11.801 -3.032 -1.116 1.00 0.00 O ATOM 76 ND2 ASN A 369 -13.585 -3.536 0.151 1.00 0.00 N ATOM 0 H ASN A 369 -11.008 -3.738 3.614 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.167 -4.012 0.792 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.376 -2.491 2.044 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.337 -1.501 1.038 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -14.103 -3.907 -0.646 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -14.009 -3.535 1.079 1.00 0.00 H new ATOM 83 N ALA A 370 -8.091 -3.022 1.907 1.00 0.00 N ATOM 84 CA ALA A 370 -6.882 -2.258 2.189 1.00 0.00 C ATOM 85 C ALA A 370 -6.458 -1.462 0.965 1.00 0.00 C ATOM 86 O ALA A 370 -6.370 -0.241 1.009 1.00 0.00 O ATOM 87 CB ALA A 370 -5.750 -3.157 2.646 1.00 0.00 C ATOM 0 H ALA A 370 -7.926 -3.999 1.663 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.110 -1.567 3.000 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -4.865 -2.554 2.847 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.046 -3.681 3.555 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.524 -3.883 1.865 1.00 0.00 H new ATOM 93 N LYS A 371 -6.211 -2.165 -0.135 1.00 0.00 N ATOM 94 CA LYS A 371 -5.816 -1.510 -1.379 1.00 0.00 C ATOM 95 C LYS A 371 -6.920 -0.563 -1.820 1.00 0.00 C ATOM 96 O LYS A 371 -6.693 0.379 -2.567 1.00 0.00 O ATOM 97 CB LYS A 371 -5.532 -2.536 -2.479 1.00 0.00 C ATOM 98 CG LYS A 371 -6.373 -3.796 -2.378 1.00 0.00 C ATOM 99 CD LYS A 371 -5.675 -4.861 -1.549 1.00 0.00 C ATOM 100 CE LYS A 371 -4.911 -5.839 -2.425 1.00 0.00 C ATOM 101 NZ LYS A 371 -3.683 -5.227 -3.005 1.00 0.00 N ATOM 0 H LYS A 371 -6.276 -3.181 -0.192 1.00 0.00 H new ATOM 0 HA LYS A 371 -4.898 -0.949 -1.202 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.707 -2.071 -3.449 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.478 -2.811 -2.442 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.337 -3.557 -1.929 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -6.573 -4.183 -3.377 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -4.988 -4.386 -0.849 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.412 -5.402 -0.955 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -4.637 -6.715 -1.837 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.558 -6.186 -3.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -3.113 -5.964 -3.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -3.952 -4.506 -3.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -3.125 -4.783 -2.248 1.00 0.00 H new ATOM 115 N ARG A 372 -8.116 -0.828 -1.316 1.00 0.00 N ATOM 116 CA ARG A 372 -9.269 0.000 -1.617 1.00 0.00 C ATOM 117 C ARG A 372 -9.285 1.200 -0.684 1.00 0.00 C ATOM 118 O ARG A 372 -9.253 2.347 -1.128 1.00 0.00 O ATOM 119 CB ARG A 372 -10.570 -0.793 -1.485 1.00 0.00 C ATOM 120 CG ARG A 372 -11.809 0.087 -1.377 1.00 0.00 C ATOM 121 CD ARG A 372 -12.637 0.042 -2.651 1.00 0.00 C ATOM 122 NE ARG A 372 -13.847 0.850 -2.540 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.981 0.402 -2.015 1.00 0.00 C ATOM 124 NH1 ARG A 372 -15.052 -0.837 -1.551 1.00 0.00 N ATOM 125 NH2 ARG A 372 -16.042 1.192 -1.949 1.00 0.00 N ATOM 0 H ARG A 372 -8.311 -1.613 -0.695 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.193 0.341 -2.650 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.675 -1.450 -2.348 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.509 -1.431 -0.604 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.418 -0.242 -0.535 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.510 1.115 -1.172 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -12.037 0.400 -3.487 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -12.908 -0.990 -2.872 1.00 0.00 H new ATOM 0 HE ARG A 372 -13.820 1.810 -2.884 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -14.235 -1.446 -1.597 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -15.923 -1.181 -1.148 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -15.989 2.147 -2.302 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.912 0.845 -1.545 1.00 0.00 H new ATOM 139 N GLN A 373 -9.325 0.927 0.614 1.00 0.00 N ATOM 140 CA GLN A 373 -9.336 1.985 1.612 1.00 0.00 C ATOM 141 C GLN A 373 -8.132 2.898 1.424 1.00 0.00 C ATOM 142 O GLN A 373 -8.229 4.118 1.546 1.00 0.00 O ATOM 143 CB GLN A 373 -9.331 1.372 3.012 1.00 0.00 C ATOM 144 CG GLN A 373 -9.444 2.397 4.121 1.00 0.00 C ATOM 145 CD GLN A 373 -10.583 2.102 5.079 1.00 0.00 C ATOM 146 OE1 GLN A 373 -10.372 1.562 6.165 1.00 0.00 O ATOM 147 NE2 GLN A 373 -11.800 2.456 4.679 1.00 0.00 N ATOM 0 H GLN A 373 -9.350 -0.017 0.998 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.240 2.582 1.492 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.158 0.667 3.094 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.412 0.802 3.147 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.507 2.429 4.677 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.590 3.385 3.684 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -11.929 2.901 3.770 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -12.605 2.282 5.281 1.00 0.00 H new ATOM 156 N LEU A 374 -7.003 2.280 1.115 1.00 0.00 N ATOM 157 CA LEU A 374 -5.760 2.989 0.886 1.00 0.00 C ATOM 158 C LEU A 374 -5.873 3.847 -0.370 1.00 0.00 C ATOM 159 O LEU A 374 -5.783 5.072 -0.301 1.00 0.00 O ATOM 160 CB LEU A 374 -4.609 1.984 0.763 1.00 0.00 C ATOM 161 CG LEU A 374 -3.211 2.589 0.858 1.00 0.00 C ATOM 162 CD1 LEU A 374 -2.709 3.000 -0.513 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.219 3.775 1.810 1.00 0.00 C ATOM 0 H LEU A 374 -6.926 1.268 1.016 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.555 3.648 1.730 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.717 1.233 1.545 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.700 1.465 -0.191 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.530 1.834 1.251 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -1.711 3.429 -0.422 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -2.670 2.126 -1.163 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.384 3.741 -0.941 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.217 4.200 1.871 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.912 4.532 1.443 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.534 3.445 2.800 1.00 0.00 H new ATOM 175 N TYR A 375 -6.090 3.203 -1.514 1.00 0.00 N ATOM 176 CA TYR A 375 -6.234 3.939 -2.769 1.00 0.00 C ATOM 177 C TYR A 375 -7.145 5.126 -2.540 1.00 0.00 C ATOM 178 O TYR A 375 -6.962 6.204 -3.102 1.00 0.00 O ATOM 179 CB TYR A 375 -6.806 3.054 -3.871 1.00 0.00 C ATOM 180 CG TYR A 375 -6.351 3.444 -5.260 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.062 3.915 -5.484 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.210 3.344 -6.347 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.644 4.274 -6.750 1.00 0.00 C ATOM 184 CE2 TYR A 375 -6.798 3.701 -7.617 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.515 4.164 -7.813 1.00 0.00 C ATOM 186 OH TYR A 375 -5.101 4.521 -9.076 1.00 0.00 O ATOM 0 H TYR A 375 -6.169 2.190 -1.600 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.248 4.275 -3.091 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.518 2.020 -3.681 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.894 3.095 -3.830 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.376 4.001 -4.654 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.216 2.981 -6.197 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -3.640 4.639 -6.907 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.478 3.618 -8.452 1.00 0.00 H new ATOM 0 HH TYR A 375 -5.834 4.383 -9.712 1.00 0.00 H new ATOM 196 N SER A 376 -8.111 4.922 -1.667 1.00 0.00 N ATOM 197 CA SER A 376 -9.033 5.978 -1.309 1.00 0.00 C ATOM 198 C SER A 376 -8.280 7.009 -0.482 1.00 0.00 C ATOM 199 O SER A 376 -8.334 8.210 -0.747 1.00 0.00 O ATOM 200 CB SER A 376 -10.213 5.415 -0.511 1.00 0.00 C ATOM 201 OG SER A 376 -10.782 6.410 0.322 1.00 0.00 O ATOM 0 H SER A 376 -8.277 4.034 -1.193 1.00 0.00 H new ATOM 0 HA SER A 376 -9.433 6.441 -2.211 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.970 5.032 -1.195 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.878 4.574 0.097 1.00 0.00 H new ATOM 0 HG SER A 376 -11.534 6.028 0.821 1.00 0.00 H new ATOM 207 N LEU A 377 -7.581 6.510 0.531 1.00 0.00 N ATOM 208 CA LEU A 377 -6.806 7.347 1.432 1.00 0.00 C ATOM 209 C LEU A 377 -5.569 7.926 0.745 1.00 0.00 C ATOM 210 O LEU A 377 -5.475 9.137 0.543 1.00 0.00 O ATOM 211 CB LEU A 377 -6.387 6.517 2.647 1.00 0.00 C ATOM 212 CG LEU A 377 -7.414 6.462 3.779 1.00 0.00 C ATOM 213 CD1 LEU A 377 -7.638 5.025 4.216 1.00 0.00 C ATOM 214 CD2 LEU A 377 -6.964 7.314 4.957 1.00 0.00 C ATOM 0 H LEU A 377 -7.537 5.514 0.749 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.429 8.185 1.744 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.177 5.499 2.318 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.456 6.923 3.041 1.00 0.00 H new ATOM 0 HG LEU A 377 -8.357 6.865 3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -8.371 5.000 5.022 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -8.006 4.441 3.372 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -6.697 4.601 4.568 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.709 7.260 5.751 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -6.009 6.944 5.330 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -6.851 8.349 4.635 1.00 0.00 H new ATOM 226 N ILE A 378 -4.606 7.066 0.420 1.00 0.00 N ATOM 227 CA ILE A 378 -3.352 7.492 -0.203 1.00 0.00 C ATOM 228 C ILE A 378 -3.290 7.124 -1.692 1.00 0.00 C ATOM 229 O ILE A 378 -2.216 6.975 -2.266 1.00 0.00 O ATOM 230 CB ILE A 378 -2.175 6.806 0.532 1.00 0.00 C ATOM 231 CG1 ILE A 378 -2.070 7.313 1.967 1.00 0.00 C ATOM 232 CG2 ILE A 378 -0.859 7.000 -0.194 1.00 0.00 C ATOM 233 CD1 ILE A 378 -1.043 6.570 2.795 1.00 0.00 C ATOM 0 H ILE A 378 -4.671 6.061 0.579 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.290 8.577 -0.126 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.384 5.736 0.548 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -1.816 8.373 1.952 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -3.045 7.226 2.447 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.062 6.502 0.358 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -0.929 6.573 -1.195 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -0.638 8.065 -0.268 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -1.021 6.982 3.804 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.308 5.514 2.840 1.00 0.00 H new ATOM 0 HD13 ILE A 378 -0.060 6.678 2.338 1.00 0.00 H new ATOM 245 N GLY A 379 -4.425 6.992 -2.342 1.00 0.00 N ATOM 246 CA GLY A 379 -4.376 6.650 -3.747 1.00 0.00 C ATOM 247 C GLY A 379 -4.531 7.850 -4.661 1.00 0.00 C ATOM 248 O GLY A 379 -5.648 8.283 -4.952 1.00 0.00 O ATOM 0 H GLY A 379 -5.356 7.110 -1.943 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -3.427 6.159 -3.962 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -5.165 5.930 -3.967 1.00 0.00 H new ATOM 252 N TYR A 380 -3.401 8.380 -5.119 1.00 0.00 N ATOM 253 CA TYR A 380 -3.395 9.531 -6.012 1.00 0.00 C ATOM 254 C TYR A 380 -2.571 9.237 -7.262 1.00 0.00 C ATOM 255 O TYR A 380 -1.553 8.547 -7.197 1.00 0.00 O ATOM 256 CB TYR A 380 -2.827 10.754 -5.296 1.00 0.00 C ATOM 257 CG TYR A 380 -3.325 10.910 -3.877 1.00 0.00 C ATOM 258 CD1 TYR A 380 -4.627 11.319 -3.617 1.00 0.00 C ATOM 259 CD2 TYR A 380 -2.492 10.646 -2.798 1.00 0.00 C ATOM 260 CE1 TYR A 380 -5.085 11.461 -2.320 1.00 0.00 C ATOM 261 CE2 TYR A 380 -2.942 10.785 -1.499 1.00 0.00 C ATOM 262 CZ TYR A 380 -4.238 11.193 -1.266 1.00 0.00 C ATOM 263 OH TYR A 380 -4.688 11.333 0.026 1.00 0.00 O ATOM 0 H TYR A 380 -2.473 8.027 -4.884 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.423 9.737 -6.309 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -1.739 10.686 -5.285 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -3.084 11.649 -5.863 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.292 11.529 -4.441 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -1.476 10.327 -2.977 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -6.100 11.780 -2.134 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -2.282 10.575 -0.670 1.00 0.00 H new ATOM 0 HH TYR A 380 -5.287 10.589 0.246 1.00 0.00 H new ATOM 273 N ALA A 381 -3.013 9.765 -8.398 1.00 0.00 N ATOM 274 CA ALA A 381 -2.312 9.557 -9.659 1.00 0.00 C ATOM 275 C ALA A 381 -0.932 10.203 -9.629 1.00 0.00 C ATOM 276 O ALA A 381 -0.050 9.844 -10.410 1.00 0.00 O ATOM 277 CB ALA A 381 -3.123 10.097 -10.825 1.00 0.00 C ATOM 0 H ALA A 381 -3.853 10.340 -8.471 1.00 0.00 H new ATOM 0 HA ALA A 381 -2.185 8.483 -9.796 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -2.579 9.930 -11.755 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -4.083 9.583 -10.869 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -3.289 11.166 -10.689 1.00 0.00 H new ATOM 283 N SER A 382 -0.748 11.155 -8.720 1.00 0.00 N ATOM 284 CA SER A 382 0.528 11.849 -8.587 1.00 0.00 C ATOM 285 C SER A 382 1.438 11.134 -7.593 1.00 0.00 C ATOM 286 O SER A 382 2.599 11.507 -7.423 1.00 0.00 O ATOM 287 CB SER A 382 0.306 13.296 -8.142 1.00 0.00 C ATOM 288 OG SER A 382 0.292 14.176 -9.252 1.00 0.00 O ATOM 0 H SER A 382 -1.466 11.464 -8.065 1.00 0.00 H new ATOM 0 HA SER A 382 1.013 11.848 -9.563 1.00 0.00 H new ATOM 0 HB2 SER A 382 -0.638 13.373 -7.602 1.00 0.00 H new ATOM 0 HB3 SER A 382 1.094 13.592 -7.450 1.00 0.00 H new ATOM 0 HG SER A 382 0.147 15.094 -8.940 1.00 0.00 H new ATOM 294 N LEU A 383 0.905 10.109 -6.933 1.00 0.00 N ATOM 295 CA LEU A 383 1.676 9.353 -5.952 1.00 0.00 C ATOM 296 C LEU A 383 1.952 7.930 -6.446 1.00 0.00 C ATOM 297 O LEU A 383 2.790 7.223 -5.888 1.00 0.00 O ATOM 298 CB LEU A 383 0.922 9.319 -4.617 1.00 0.00 C ATOM 299 CG LEU A 383 0.904 7.964 -3.910 1.00 0.00 C ATOM 300 CD1 LEU A 383 0.562 8.123 -2.439 1.00 0.00 C ATOM 301 CD2 LEU A 383 -0.080 7.028 -4.592 1.00 0.00 C ATOM 0 H LEU A 383 -0.054 9.784 -7.059 1.00 0.00 H new ATOM 0 HA LEU A 383 2.636 9.848 -5.810 1.00 0.00 H new ATOM 0 HB2 LEU A 383 1.369 10.054 -3.947 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -0.107 9.632 -4.792 1.00 0.00 H new ATOM 0 HG LEU A 383 1.901 7.529 -3.976 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.556 7.144 -1.959 1.00 0.00 H new ATOM 0 HD12 LEU A 383 1.307 8.758 -1.959 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -0.422 8.581 -2.342 1.00 0.00 H new ATOM 0 HD21 LEU A 383 -0.083 6.066 -4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -1.079 7.462 -4.556 1.00 0.00 H new ATOM 0 HD23 LEU A 383 0.216 6.884 -5.631 1.00 0.00 H new ATOM 313 N ARG A 384 1.245 7.526 -7.494 1.00 0.00 N ATOM 314 CA ARG A 384 1.405 6.195 -8.078 1.00 0.00 C ATOM 315 C ARG A 384 1.823 5.155 -7.038 1.00 0.00 C ATOM 316 O ARG A 384 3.004 4.831 -6.914 1.00 0.00 O ATOM 317 CB ARG A 384 2.441 6.234 -9.203 1.00 0.00 C ATOM 318 CG ARG A 384 1.984 5.541 -10.477 1.00 0.00 C ATOM 319 CD ARG A 384 2.289 4.051 -10.442 1.00 0.00 C ATOM 320 NE ARG A 384 2.937 3.595 -11.670 1.00 0.00 N ATOM 321 CZ ARG A 384 4.246 3.681 -11.888 1.00 0.00 C ATOM 322 NH1 ARG A 384 5.041 4.201 -10.964 1.00 0.00 N ATOM 323 NH2 ARG A 384 4.760 3.246 -13.030 1.00 0.00 N ATOM 0 H ARG A 384 0.548 8.105 -7.962 1.00 0.00 H new ATOM 0 HA ARG A 384 0.434 5.900 -8.475 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.679 7.273 -9.430 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.361 5.765 -8.854 1.00 0.00 H new ATOM 0 HG2 ARG A 384 0.913 5.691 -10.610 1.00 0.00 H new ATOM 0 HG3 ARG A 384 2.478 5.994 -11.336 1.00 0.00 H new ATOM 0 HD2 ARG A 384 2.933 3.833 -9.590 1.00 0.00 H new ATOM 0 HD3 ARG A 384 1.363 3.495 -10.293 1.00 0.00 H new ATOM 0 HE ARG A 384 2.353 3.188 -12.400 1.00 0.00 H new ATOM 0 HH11 ARG A 384 4.649 4.536 -10.084 1.00 0.00 H new ATOM 0 HH12 ARG A 384 6.045 4.266 -11.133 1.00 0.00 H new ATOM 0 HH21 ARG A 384 4.151 2.845 -13.743 1.00 0.00 H new ATOM 0 HH22 ARG A 384 5.764 3.313 -13.195 1.00 0.00 H new ATOM 337 N LEU A 385 0.848 4.614 -6.313 1.00 0.00 N ATOM 338 CA LEU A 385 1.117 3.590 -5.312 1.00 0.00 C ATOM 339 C LEU A 385 0.956 2.210 -5.944 1.00 0.00 C ATOM 340 O LEU A 385 0.180 2.048 -6.884 1.00 0.00 O ATOM 341 CB LEU A 385 0.171 3.749 -4.120 1.00 0.00 C ATOM 342 CG LEU A 385 -1.275 4.079 -4.478 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.784 3.152 -5.570 1.00 0.00 C ATOM 344 CD2 LEU A 385 -2.144 3.984 -3.238 1.00 0.00 C ATOM 0 H LEU A 385 -0.136 4.869 -6.401 1.00 0.00 H new ATOM 0 HA LEU A 385 2.139 3.700 -4.950 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.183 2.826 -3.541 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.557 4.536 -3.473 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.321 5.099 -4.861 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.817 3.405 -5.810 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.166 3.266 -6.461 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.734 2.120 -5.223 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.176 4.220 -3.498 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.094 2.972 -2.835 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -1.787 4.691 -2.489 1.00 0.00 H new ATOM 356 N HIS A 386 1.677 1.211 -5.437 1.00 0.00 N ATOM 357 CA HIS A 386 1.574 -0.139 -5.983 1.00 0.00 C ATOM 358 C HIS A 386 1.950 -1.186 -4.939 1.00 0.00 C ATOM 359 O HIS A 386 2.388 -0.854 -3.835 1.00 0.00 O ATOM 360 CB HIS A 386 2.461 -0.299 -7.220 1.00 0.00 C ATOM 361 CG HIS A 386 3.878 0.130 -7.006 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.466 1.340 -7.157 1.00 0.00 N flip ATOM 363 CD2 HIS A 386 4.876 -0.731 -6.595 1.00 0.00 C flip ATOM 364 CE1 HIS A 386 5.791 1.191 -6.837 1.00 0.00 C flip ATOM 365 NE2 HIS A 386 6.014 -0.066 -6.502 1.00 0.00 N flip ATOM 0 H HIS A 386 2.330 1.309 -4.660 1.00 0.00 H new ATOM 0 HA HIS A 386 0.535 -0.294 -6.273 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.450 -1.344 -7.531 1.00 0.00 H new ATOM 0 HB3 HIS A 386 2.035 0.281 -8.039 1.00 0.00 H new ATOM 0 HD1 HIS A 386 4.009 2.202 -7.454 1.00 0.00 H new ATOM 0 HD2 HIS A 386 4.747 -1.782 -6.383 1.00 0.00 H new ATOM 0 HE1 HIS A 386 6.533 1.976 -6.856 1.00 0.00 H new ATOM 374 N TYR A 387 1.782 -2.451 -5.304 1.00 0.00 N ATOM 375 CA TYR A 387 2.100 -3.556 -4.409 1.00 0.00 C ATOM 376 C TYR A 387 3.178 -4.454 -5.006 1.00 0.00 C ATOM 377 O TYR A 387 2.982 -5.084 -6.045 1.00 0.00 O ATOM 378 CB TYR A 387 0.835 -4.356 -4.098 1.00 0.00 C ATOM 379 CG TYR A 387 -0.382 -3.477 -3.919 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.623 -2.828 -2.714 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.280 -3.278 -4.961 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.721 -2.010 -2.550 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.385 -2.461 -4.803 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.601 -1.829 -3.598 1.00 0.00 C ATOM 385 OH TYR A 387 -3.697 -1.012 -3.439 1.00 0.00 O ATOM 0 H TYR A 387 1.426 -2.737 -6.216 1.00 0.00 H new ATOM 0 HA TYR A 387 2.493 -3.146 -3.479 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.651 -5.065 -4.905 1.00 0.00 H new ATOM 0 HB3 TYR A 387 0.993 -4.940 -3.191 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.062 -2.967 -1.891 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.113 -3.769 -5.908 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.892 -1.513 -1.606 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -3.076 -2.319 -5.621 1.00 0.00 H new ATOM 0 HH TYR A 387 -4.076 -0.799 -4.317 1.00 0.00 H new ATOM 395 N VAL A 388 4.318 -4.499 -4.328 1.00 0.00 N ATOM 396 CA VAL A 388 5.449 -5.307 -4.762 1.00 0.00 C ATOM 397 C VAL A 388 5.558 -6.574 -3.925 1.00 0.00 C ATOM 398 O VAL A 388 5.657 -6.505 -2.703 1.00 0.00 O ATOM 399 CB VAL A 388 6.763 -4.516 -4.644 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.861 -3.855 -3.278 1.00 0.00 C ATOM 401 CG2 VAL A 388 7.958 -5.421 -4.896 1.00 0.00 C ATOM 0 H VAL A 388 4.484 -3.979 -3.466 1.00 0.00 H new ATOM 0 HA VAL A 388 5.281 -5.574 -5.805 1.00 0.00 H new ATOM 0 HB VAL A 388 6.767 -3.734 -5.404 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.796 -3.299 -3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 388 6.022 -3.172 -3.143 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.835 -4.619 -2.501 1.00 0.00 H new ATOM 0 HG21 VAL A 388 8.878 -4.842 -4.808 1.00 0.00 H new ATOM 0 HG22 VAL A 388 7.965 -6.227 -4.163 1.00 0.00 H new ATOM 0 HG23 VAL A 388 7.890 -5.843 -5.899 1.00 0.00 H new ATOM 411 N THR A 389 5.532 -7.728 -4.578 1.00 0.00 N ATOM 412 CA THR A 389 5.620 -8.998 -3.867 1.00 0.00 C ATOM 413 C THR A 389 7.063 -9.446 -3.681 1.00 0.00 C ATOM 414 O THR A 389 7.799 -9.639 -4.649 1.00 0.00 O ATOM 415 CB THR A 389 4.845 -10.113 -4.592 1.00 0.00 C ATOM 416 OG1 THR A 389 3.518 -9.694 -4.933 1.00 0.00 O ATOM 417 CG2 THR A 389 4.750 -11.356 -3.719 1.00 0.00 C ATOM 0 H THR A 389 5.451 -7.812 -5.591 1.00 0.00 H new ATOM 0 HA THR A 389 5.171 -8.825 -2.889 1.00 0.00 H new ATOM 0 HB THR A 389 5.395 -10.340 -5.506 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.271 -10.067 -5.805 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.199 -12.132 -4.250 1.00 0.00 H new ATOM 0 HG22 THR A 389 5.753 -11.716 -3.489 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.231 -11.111 -2.793 1.00 0.00 H new ATOM 425 N VAL A 390 7.454 -9.630 -2.424 1.00 0.00 N ATOM 426 CA VAL A 390 8.800 -10.079 -2.095 1.00 0.00 C ATOM 427 C VAL A 390 8.837 -11.597 -2.015 1.00 0.00 C ATOM 428 O VAL A 390 9.699 -12.243 -2.609 1.00 0.00 O ATOM 429 CB VAL A 390 9.300 -9.499 -0.754 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.561 -8.681 -0.967 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.225 -8.661 -0.077 1.00 0.00 C ATOM 0 H VAL A 390 6.854 -9.474 -1.614 1.00 0.00 H new ATOM 0 HA VAL A 390 9.457 -9.720 -2.888 1.00 0.00 H new ATOM 0 HB VAL A 390 9.533 -10.335 -0.094 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.900 -8.280 -0.012 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.339 -9.316 -1.391 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.350 -7.859 -1.652 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.609 -8.268 0.864 1.00 0.00 H new ATOM 0 HG22 VAL A 390 7.945 -7.833 -0.729 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.350 -9.281 0.119 1.00 0.00 H new ATOM 441 N LYS A 391 7.884 -12.158 -1.282 1.00 0.00 N ATOM 442 CA LYS A 391 7.788 -13.602 -1.124 1.00 0.00 C ATOM 443 C LYS A 391 6.357 -14.074 -1.378 1.00 0.00 C ATOM 444 O LYS A 391 5.400 -13.318 -1.207 1.00 0.00 O ATOM 445 CB LYS A 391 8.289 -14.023 0.271 1.00 0.00 C ATOM 446 CG LYS A 391 7.231 -14.609 1.199 1.00 0.00 C ATOM 447 CD LYS A 391 7.849 -15.562 2.211 1.00 0.00 C ATOM 448 CE LYS A 391 8.123 -16.926 1.599 1.00 0.00 C ATOM 449 NZ LYS A 391 9.118 -17.701 2.390 1.00 0.00 N ATOM 0 H LYS A 391 7.164 -11.632 -0.786 1.00 0.00 H new ATOM 0 HA LYS A 391 8.428 -14.083 -1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.084 -14.758 0.146 1.00 0.00 H new ATOM 0 HB3 LYS A 391 8.732 -13.153 0.757 1.00 0.00 H new ATOM 0 HG2 LYS A 391 6.717 -13.803 1.722 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.480 -15.137 0.611 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.779 -15.139 2.589 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.179 -15.673 3.064 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.192 -17.489 1.536 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.489 -16.800 0.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.277 -18.625 1.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 10.015 -17.176 2.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 8.758 -17.844 3.355 1.00 0.00 H new ATOM 463 N LYS A 392 6.228 -15.327 -1.795 1.00 0.00 N ATOM 464 CA LYS A 392 4.926 -15.915 -2.088 1.00 0.00 C ATOM 465 C LYS A 392 4.856 -17.348 -1.575 1.00 0.00 C ATOM 466 O LYS A 392 5.859 -17.910 -1.136 1.00 0.00 O ATOM 467 CB LYS A 392 4.656 -15.893 -3.595 1.00 0.00 C ATOM 468 CG LYS A 392 5.733 -15.181 -4.399 1.00 0.00 C ATOM 469 CD LYS A 392 6.941 -16.077 -4.624 1.00 0.00 C ATOM 470 CE LYS A 392 7.816 -15.559 -5.754 1.00 0.00 C ATOM 471 NZ LYS A 392 8.263 -16.655 -6.657 1.00 0.00 N ATOM 0 H LYS A 392 7.015 -15.960 -1.939 1.00 0.00 H new ATOM 0 HA LYS A 392 4.165 -15.322 -1.581 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.565 -16.918 -3.954 1.00 0.00 H new ATOM 0 HB3 LYS A 392 3.698 -15.406 -3.776 1.00 0.00 H new ATOM 0 HG2 LYS A 392 5.325 -14.869 -5.361 1.00 0.00 H new ATOM 0 HG3 LYS A 392 6.042 -14.276 -3.875 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.527 -16.137 -3.707 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.607 -17.088 -4.855 1.00 0.00 H new ATOM 0 HE2 LYS A 392 7.263 -14.817 -6.330 1.00 0.00 H new ATOM 0 HE3 LYS A 392 8.687 -15.054 -5.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 8.857 -16.261 -7.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 8.812 -17.351 -6.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 7.432 -17.120 -7.076 1.00 0.00 H new ATOM 485 N PRO A 393 3.665 -17.960 -1.627 1.00 0.00 N ATOM 486 CA PRO A 393 3.472 -19.336 -1.167 1.00 0.00 C ATOM 487 C PRO A 393 4.316 -20.322 -1.964 1.00 0.00 C ATOM 488 O PRO A 393 4.321 -20.299 -3.195 1.00 0.00 O ATOM 489 CB PRO A 393 1.979 -19.600 -1.406 1.00 0.00 C ATOM 490 CG PRO A 393 1.357 -18.254 -1.574 1.00 0.00 C ATOM 491 CD PRO A 393 2.425 -17.364 -2.141 1.00 0.00 C ATOM 0 HA PRO A 393 3.772 -19.462 -0.127 1.00 0.00 H new ATOM 0 HB2 PRO A 393 1.827 -20.216 -2.292 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.536 -20.135 -0.566 1.00 0.00 H new ATOM 0 HG2 PRO A 393 0.497 -18.304 -2.242 1.00 0.00 H new ATOM 0 HG3 PRO A 393 0.997 -17.870 -0.619 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.404 -17.354 -3.231 1.00 0.00 H new ATOM 0 HD3 PRO A 393 2.307 -16.332 -1.810 1.00 0.00 H new ATOM 499 N THR A 394 5.025 -21.191 -1.255 1.00 0.00 N ATOM 500 CA THR A 394 5.871 -22.189 -1.893 1.00 0.00 C ATOM 501 C THR A 394 5.894 -23.479 -1.081 1.00 0.00 C ATOM 502 O THR A 394 5.299 -23.555 -0.006 1.00 0.00 O ATOM 503 CB THR A 394 7.312 -21.676 -2.075 1.00 0.00 C ATOM 504 OG1 THR A 394 8.137 -22.017 -0.954 1.00 0.00 O ATOM 505 CG2 THR A 394 7.331 -20.163 -2.244 1.00 0.00 C ATOM 0 H THR A 394 5.030 -21.224 -0.236 1.00 0.00 H new ATOM 0 HA THR A 394 5.445 -22.388 -2.876 1.00 0.00 H new ATOM 0 HB THR A 394 7.706 -22.156 -2.971 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.237 -21.235 -0.372 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.359 -19.824 -2.371 1.00 0.00 H new ATOM 0 HG22 THR A 394 6.747 -19.888 -3.122 1.00 0.00 H new ATOM 0 HG23 THR A 394 6.900 -19.693 -1.360 1.00 0.00 H new ATOM 513 N ALA A 395 6.581 -24.491 -1.598 1.00 0.00 N ATOM 514 CA ALA A 395 6.675 -25.772 -0.913 1.00 0.00 C ATOM 515 C ALA A 395 7.465 -25.644 0.382 1.00 0.00 C ATOM 516 O ALA A 395 7.089 -26.209 1.410 1.00 0.00 O ATOM 517 CB ALA A 395 7.304 -26.826 -1.813 1.00 0.00 C ATOM 0 H ALA A 395 7.079 -24.449 -2.487 1.00 0.00 H new ATOM 0 HA ALA A 395 5.662 -26.089 -0.666 1.00 0.00 H new ATOM 0 HB1 ALA A 395 7.363 -27.774 -1.278 1.00 0.00 H new ATOM 0 HB2 ALA A 395 6.694 -26.952 -2.707 1.00 0.00 H new ATOM 0 HB3 ALA A 395 8.307 -26.508 -2.100 1.00 0.00 H new ATOM 523 N VAL A 396 8.561 -24.898 0.327 1.00 0.00 N ATOM 524 CA VAL A 396 9.405 -24.695 1.493 1.00 0.00 C ATOM 525 C VAL A 396 8.713 -23.810 2.524 1.00 0.00 C ATOM 526 O VAL A 396 8.792 -24.058 3.727 1.00 0.00 O ATOM 527 CB VAL A 396 10.760 -24.068 1.095 1.00 0.00 C ATOM 528 CG1 VAL A 396 11.192 -24.560 -0.277 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.694 -22.544 1.121 1.00 0.00 C ATOM 0 H VAL A 396 8.885 -24.423 -0.516 1.00 0.00 H new ATOM 0 HA VAL A 396 9.587 -25.674 1.937 1.00 0.00 H new ATOM 0 HB VAL A 396 11.503 -24.383 1.828 1.00 0.00 H new ATOM 0 HG11 VAL A 396 12.148 -24.108 -0.541 1.00 0.00 H new ATOM 0 HG12 VAL A 396 11.296 -25.645 -0.258 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.442 -24.280 -1.017 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.663 -22.133 0.836 1.00 0.00 H new ATOM 0 HG22 VAL A 396 9.934 -22.201 0.419 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.438 -22.208 2.126 1.00 0.00 H new ATOM 539 N ASP A 397 8.041 -22.771 2.040 1.00 0.00 N ATOM 540 CA ASP A 397 7.341 -21.839 2.916 1.00 0.00 C ATOM 541 C ASP A 397 6.112 -21.254 2.226 1.00 0.00 C ATOM 542 O ASP A 397 6.231 -20.475 1.280 1.00 0.00 O ATOM 543 CB ASP A 397 8.280 -20.711 3.346 1.00 0.00 C ATOM 544 CG ASP A 397 8.817 -20.908 4.749 1.00 0.00 C ATOM 545 OD1 ASP A 397 8.019 -21.245 5.649 1.00 0.00 O ATOM 546 OD2 ASP A 397 10.036 -20.724 4.950 1.00 0.00 O ATOM 0 H ASP A 397 7.966 -22.553 1.046 1.00 0.00 H new ATOM 0 HA ASP A 397 7.011 -22.389 3.797 1.00 0.00 H new ATOM 0 HB2 ASP A 397 9.114 -20.650 2.646 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.749 -19.760 3.293 1.00 0.00 H new ATOM 551 N PRO A 398 4.912 -21.623 2.696 1.00 0.00 N ATOM 552 CA PRO A 398 3.654 -21.135 2.129 1.00 0.00 C ATOM 553 C PRO A 398 3.296 -19.740 2.629 1.00 0.00 C ATOM 554 O PRO A 398 2.154 -19.481 3.010 1.00 0.00 O ATOM 555 CB PRO A 398 2.638 -22.157 2.630 1.00 0.00 C ATOM 556 CG PRO A 398 3.187 -22.624 3.935 1.00 0.00 C ATOM 557 CD PRO A 398 4.689 -22.549 3.822 1.00 0.00 C ATOM 0 HA PRO A 398 3.697 -21.043 1.044 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.652 -21.709 2.752 1.00 0.00 H new ATOM 0 HB3 PRO A 398 2.528 -22.983 1.928 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.828 -21.999 4.752 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.865 -23.643 4.148 1.00 0.00 H new ATOM 0 HD2 PRO A 398 5.141 -22.177 4.741 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.125 -23.529 3.626 1.00 0.00 H new ATOM 565 N ASN A 399 4.278 -18.844 2.631 1.00 0.00 N ATOM 566 CA ASN A 399 4.061 -17.477 3.090 1.00 0.00 C ATOM 567 C ASN A 399 4.357 -16.471 1.982 1.00 0.00 C ATOM 568 O ASN A 399 5.134 -16.747 1.070 1.00 0.00 O ATOM 569 CB ASN A 399 4.936 -17.183 4.309 1.00 0.00 C ATOM 570 CG ASN A 399 5.067 -18.381 5.229 1.00 0.00 C ATOM 571 OD1 ASN A 399 6.171 -18.860 5.490 1.00 0.00 O ATOM 572 ND2 ASN A 399 3.937 -18.872 5.726 1.00 0.00 N ATOM 0 H ASN A 399 5.230 -19.040 2.321 1.00 0.00 H new ATOM 0 HA ASN A 399 3.012 -17.379 3.370 1.00 0.00 H new ATOM 0 HB2 ASN A 399 5.927 -16.874 3.976 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.512 -16.347 4.864 1.00 0.00 H new ATOM 0 HD21 ASN A 399 3.962 -19.678 6.351 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.044 -18.443 5.483 1.00 0.00 H new ATOM 579 N SER A 400 3.733 -15.300 2.074 1.00 0.00 N ATOM 580 CA SER A 400 3.930 -14.249 1.084 1.00 0.00 C ATOM 581 C SER A 400 4.247 -12.919 1.761 1.00 0.00 C ATOM 582 O SER A 400 3.891 -12.696 2.918 1.00 0.00 O ATOM 583 CB SER A 400 2.683 -14.101 0.210 1.00 0.00 C ATOM 584 OG SER A 400 2.952 -13.309 -0.936 1.00 0.00 O ATOM 0 H SER A 400 3.087 -15.056 2.825 1.00 0.00 H new ATOM 0 HA SER A 400 4.775 -14.530 0.456 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.333 -15.086 -0.099 1.00 0.00 H new ATOM 0 HB3 SER A 400 1.881 -13.645 0.790 1.00 0.00 H new ATOM 0 HG SER A 400 3.916 -13.302 -1.110 1.00 0.00 H new ATOM 590 N ILE A 401 4.904 -12.038 1.021 1.00 0.00 N ATOM 591 CA ILE A 401 5.265 -10.717 1.523 1.00 0.00 C ATOM 592 C ILE A 401 5.114 -9.689 0.415 1.00 0.00 C ATOM 593 O ILE A 401 5.464 -9.965 -0.730 1.00 0.00 O ATOM 594 CB ILE A 401 6.723 -10.675 2.027 1.00 0.00 C ATOM 595 CG1 ILE A 401 6.950 -11.720 3.118 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.065 -9.286 2.542 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.327 -12.347 3.075 1.00 0.00 C ATOM 0 H ILE A 401 5.201 -12.215 0.061 1.00 0.00 H new ATOM 0 HA ILE A 401 4.599 -10.492 2.356 1.00 0.00 H new ATOM 0 HB ILE A 401 7.381 -10.908 1.190 1.00 0.00 H new ATOM 0 HG12 ILE A 401 6.801 -11.255 4.092 1.00 0.00 H new ATOM 0 HG13 ILE A 401 6.199 -12.504 3.021 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.097 -9.272 2.894 1.00 0.00 H new ATOM 0 HG22 ILE A 401 6.946 -8.560 1.737 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.398 -9.028 3.364 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.419 -13.079 3.877 1.00 0.00 H new ATOM 0 HD12 ILE A 401 8.472 -12.841 2.114 1.00 0.00 H new ATOM 0 HD13 ILE A 401 9.084 -11.573 3.202 1.00 0.00 H new ATOM 609 N VAL A 402 4.607 -8.503 0.736 1.00 0.00 N ATOM 610 CA VAL A 402 4.444 -7.461 -0.265 1.00 0.00 C ATOM 611 C VAL A 402 4.711 -6.094 0.352 1.00 0.00 C ATOM 612 O VAL A 402 4.520 -5.893 1.551 1.00 0.00 O ATOM 613 CB VAL A 402 3.031 -7.476 -0.882 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.788 -6.210 -1.689 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.836 -8.710 -1.751 1.00 0.00 C ATOM 0 H VAL A 402 4.305 -8.243 1.675 1.00 0.00 H new ATOM 0 HA VAL A 402 5.165 -7.657 -1.059 1.00 0.00 H new ATOM 0 HB VAL A 402 2.304 -7.512 -0.071 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.786 -6.238 -2.117 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.880 -5.340 -1.038 1.00 0.00 H new ATOM 0 HG13 VAL A 402 3.523 -6.143 -2.491 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.832 -8.701 -2.176 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.571 -8.708 -2.556 1.00 0.00 H new ATOM 0 HG23 VAL A 402 2.964 -9.606 -1.144 1.00 0.00 H new ATOM 625 N GLU A 403 5.162 -5.163 -0.474 1.00 0.00 N ATOM 626 CA GLU A 403 5.470 -3.815 -0.018 1.00 0.00 C ATOM 627 C GLU A 403 4.716 -2.781 -0.842 1.00 0.00 C ATOM 628 O GLU A 403 4.905 -2.690 -2.054 1.00 0.00 O ATOM 629 CB GLU A 403 6.976 -3.550 -0.116 1.00 0.00 C ATOM 630 CG GLU A 403 7.833 -4.804 -0.024 1.00 0.00 C ATOM 631 CD GLU A 403 9.108 -4.698 -0.838 1.00 0.00 C ATOM 632 OE1 GLU A 403 9.926 -3.801 -0.547 1.00 0.00 O ATOM 633 OE2 GLU A 403 9.288 -5.515 -1.767 1.00 0.00 O ATOM 0 H GLU A 403 5.324 -5.317 -1.469 1.00 0.00 H new ATOM 0 HA GLU A 403 5.157 -3.732 1.023 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.185 -3.048 -1.061 1.00 0.00 H new ATOM 0 HB3 GLU A 403 7.266 -2.865 0.680 1.00 0.00 H new ATOM 0 HG2 GLU A 403 8.087 -4.991 1.019 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.255 -5.661 -0.370 1.00 0.00 H new ATOM 640 N CYS A 404 3.867 -1.997 -0.186 1.00 0.00 N ATOM 641 CA CYS A 404 3.107 -0.976 -0.885 1.00 0.00 C ATOM 642 C CYS A 404 3.977 0.244 -1.147 1.00 0.00 C ATOM 643 O CYS A 404 4.130 1.101 -0.276 1.00 0.00 O ATOM 644 CB CYS A 404 1.909 -0.556 -0.038 1.00 0.00 C ATOM 645 SG CYS A 404 0.710 -1.874 0.263 1.00 0.00 S ATOM 0 H CYS A 404 3.691 -2.050 0.817 1.00 0.00 H new ATOM 0 HA CYS A 404 2.766 -1.387 -1.835 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.270 -0.184 0.921 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.403 0.273 -0.532 1.00 0.00 H new ATOM 0 HG CYS A 404 -0.101 -1.962 -0.749 1.00 0.00 H new ATOM 651 N ARG A 405 4.556 0.323 -2.339 1.00 0.00 N ATOM 652 CA ARG A 405 5.417 1.448 -2.680 1.00 0.00 C ATOM 653 C ARG A 405 4.619 2.552 -3.355 1.00 0.00 C ATOM 654 O ARG A 405 3.395 2.471 -3.457 1.00 0.00 O ATOM 655 CB ARG A 405 6.562 0.993 -3.585 1.00 0.00 C ATOM 656 CG ARG A 405 6.832 -0.502 -3.520 1.00 0.00 C ATOM 657 CD ARG A 405 8.323 -0.801 -3.537 1.00 0.00 C ATOM 658 NE ARG A 405 8.686 -1.709 -4.623 1.00 0.00 N ATOM 659 CZ ARG A 405 9.734 -2.526 -4.582 1.00 0.00 C ATOM 660 NH1 ARG A 405 10.516 -2.557 -3.511 1.00 0.00 N ATOM 661 NH2 ARG A 405 10.001 -3.315 -5.614 1.00 0.00 N ATOM 0 H ARG A 405 4.447 -0.371 -3.079 1.00 0.00 H new ATOM 0 HA ARG A 405 5.839 1.844 -1.756 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.332 1.268 -4.614 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.469 1.530 -3.307 1.00 0.00 H new ATOM 0 HG2 ARG A 405 6.388 -0.914 -2.614 1.00 0.00 H new ATOM 0 HG3 ARG A 405 6.351 -0.997 -4.364 1.00 0.00 H new ATOM 0 HD2 ARG A 405 8.879 0.131 -3.642 1.00 0.00 H new ATOM 0 HD3 ARG A 405 8.616 -1.241 -2.583 1.00 0.00 H new ATOM 0 HE ARG A 405 8.102 -1.716 -5.460 1.00 0.00 H new ATOM 0 HH11 ARG A 405 10.314 -1.952 -2.715 1.00 0.00 H new ATOM 0 HH12 ARG A 405 11.319 -3.185 -3.484 1.00 0.00 H new ATOM 0 HH21 ARG A 405 9.402 -3.295 -6.440 1.00 0.00 H new ATOM 0 HH22 ARG A 405 10.805 -3.942 -5.582 1.00 0.00 H new ATOM 675 N VAL A 406 5.314 3.591 -3.803 1.00 0.00 N ATOM 676 CA VAL A 406 4.652 4.710 -4.454 1.00 0.00 C ATOM 677 C VAL A 406 5.578 5.428 -5.430 1.00 0.00 C ATOM 678 O VAL A 406 6.800 5.291 -5.364 1.00 0.00 O ATOM 679 CB VAL A 406 4.114 5.712 -3.416 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.626 5.494 -3.203 1.00 0.00 C ATOM 681 CG2 VAL A 406 4.863 5.576 -2.097 1.00 0.00 C ATOM 0 H VAL A 406 6.327 3.680 -3.727 1.00 0.00 H new ATOM 0 HA VAL A 406 3.816 4.297 -5.019 1.00 0.00 H new ATOM 0 HB VAL A 406 4.272 6.721 -3.796 1.00 0.00 H new ATOM 0 HG11 VAL A 406 2.255 6.208 -2.467 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.099 5.638 -4.146 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.455 4.480 -2.843 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.467 6.293 -1.378 1.00 0.00 H new ATOM 0 HG22 VAL A 406 4.736 4.565 -1.709 1.00 0.00 H new ATOM 0 HG23 VAL A 406 5.923 5.772 -2.259 1.00 0.00 H new ATOM 691 N GLY A 407 4.978 6.184 -6.347 1.00 0.00 N ATOM 692 CA GLY A 407 5.742 6.909 -7.346 1.00 0.00 C ATOM 693 C GLY A 407 7.003 7.549 -6.794 1.00 0.00 C ATOM 694 O GLY A 407 7.975 7.744 -7.525 1.00 0.00 O ATOM 0 H GLY A 407 3.968 6.307 -6.415 1.00 0.00 H new ATOM 0 HA2 GLY A 407 6.013 6.226 -8.151 1.00 0.00 H new ATOM 0 HA3 GLY A 407 5.112 7.684 -7.783 1.00 0.00 H new ATOM 698 N ASP A 408 6.990 7.884 -5.510 1.00 0.00 N ATOM 699 CA ASP A 408 8.145 8.513 -4.877 1.00 0.00 C ATOM 700 C ASP A 408 9.257 7.499 -4.618 1.00 0.00 C ATOM 701 O ASP A 408 10.304 7.840 -4.065 1.00 0.00 O ATOM 702 CB ASP A 408 7.729 9.187 -3.569 1.00 0.00 C ATOM 703 CG ASP A 408 7.686 10.697 -3.689 1.00 0.00 C ATOM 704 OD1 ASP A 408 8.761 11.330 -3.628 1.00 0.00 O ATOM 705 OD2 ASP A 408 6.576 11.248 -3.846 1.00 0.00 O ATOM 0 H ASP A 408 6.196 7.732 -4.888 1.00 0.00 H new ATOM 0 HA ASP A 408 8.532 9.269 -5.560 1.00 0.00 H new ATOM 0 HB2 ASP A 408 6.747 8.820 -3.270 1.00 0.00 H new ATOM 0 HB3 ASP A 408 8.427 8.907 -2.780 1.00 0.00 H new ATOM 710 N GLY A 409 9.028 6.252 -5.023 1.00 0.00 N ATOM 711 CA GLY A 409 10.023 5.213 -4.827 1.00 0.00 C ATOM 712 C GLY A 409 10.136 4.787 -3.377 1.00 0.00 C ATOM 713 O GLY A 409 10.995 3.980 -3.025 1.00 0.00 O ATOM 0 H GLY A 409 8.171 5.944 -5.483 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.766 4.348 -5.438 1.00 0.00 H new ATOM 0 HA3 GLY A 409 10.992 5.572 -5.174 1.00 0.00 H new ATOM 717 N THR A 410 9.266 5.333 -2.537 1.00 0.00 N ATOM 718 CA THR A 410 9.268 5.010 -1.118 1.00 0.00 C ATOM 719 C THR A 410 8.165 4.014 -0.780 1.00 0.00 C ATOM 720 O THR A 410 7.117 3.990 -1.424 1.00 0.00 O ATOM 721 CB THR A 410 9.082 6.273 -0.258 1.00 0.00 C ATOM 722 OG1 THR A 410 10.017 7.295 -0.622 1.00 0.00 O ATOM 723 CG2 THR A 410 9.263 5.957 1.217 1.00 0.00 C ATOM 0 H THR A 410 8.549 6.003 -2.816 1.00 0.00 H new ATOM 0 HA THR A 410 10.237 4.564 -0.895 1.00 0.00 H new ATOM 0 HB THR A 410 8.068 6.631 -0.437 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.873 8.085 -0.060 1.00 0.00 H new ATOM 0 HG21 THR A 410 9.127 6.866 1.803 1.00 0.00 H new ATOM 0 HG22 THR A 410 8.527 5.214 1.523 1.00 0.00 H new ATOM 0 HG23 THR A 410 10.266 5.564 1.385 1.00 0.00 H new ATOM 731 N VAL A 411 8.409 3.192 0.232 1.00 0.00 N ATOM 732 CA VAL A 411 7.435 2.194 0.655 1.00 0.00 C ATOM 733 C VAL A 411 6.531 2.745 1.754 1.00 0.00 C ATOM 734 O VAL A 411 6.965 2.925 2.892 1.00 0.00 O ATOM 735 CB VAL A 411 8.122 0.913 1.164 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.091 -0.168 1.440 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.161 0.427 0.163 1.00 0.00 C ATOM 0 H VAL A 411 9.272 3.196 0.775 1.00 0.00 H new ATOM 0 HA VAL A 411 6.834 1.947 -0.220 1.00 0.00 H new ATOM 0 HB VAL A 411 8.634 1.144 2.098 1.00 0.00 H new ATOM 0 HG11 VAL A 411 7.593 -1.066 1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 411 6.390 0.183 2.197 1.00 0.00 H new ATOM 0 HG13 VAL A 411 6.549 -0.397 0.522 1.00 0.00 H new ATOM 0 HG21 VAL A 411 9.635 -0.479 0.541 1.00 0.00 H new ATOM 0 HG22 VAL A 411 8.676 0.212 -0.789 1.00 0.00 H new ATOM 0 HG23 VAL A 411 9.917 1.199 0.019 1.00 0.00 H new ATOM 747 N LEU A 412 5.273 3.013 1.408 1.00 0.00 N ATOM 748 CA LEU A 412 4.321 3.547 2.379 1.00 0.00 C ATOM 749 C LEU A 412 3.753 2.441 3.262 1.00 0.00 C ATOM 750 O LEU A 412 3.408 2.679 4.419 1.00 0.00 O ATOM 751 CB LEU A 412 3.178 4.316 1.693 1.00 0.00 C ATOM 752 CG LEU A 412 2.635 3.728 0.386 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.782 2.500 0.659 1.00 0.00 C ATOM 754 CD2 LEU A 412 1.823 4.781 -0.352 1.00 0.00 C ATOM 0 H LEU A 412 4.892 2.871 0.472 1.00 0.00 H new ATOM 0 HA LEU A 412 4.870 4.247 3.008 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.351 4.396 2.399 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.524 5.330 1.491 1.00 0.00 H new ATOM 0 HG LEU A 412 3.477 3.423 -0.236 1.00 0.00 H new ATOM 0 HD11 LEU A 412 1.408 2.100 -0.283 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.384 1.743 1.161 1.00 0.00 H new ATOM 0 HD13 LEU A 412 0.941 2.775 1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.439 4.359 -1.281 1.00 0.00 H new ATOM 0 HD22 LEU A 412 0.990 5.102 0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 412 2.458 5.638 -0.578 1.00 0.00 H new ATOM 766 N GLY A 413 3.655 1.233 2.717 1.00 0.00 N ATOM 767 CA GLY A 413 3.125 0.123 3.487 1.00 0.00 C ATOM 768 C GLY A 413 3.873 -1.169 3.241 1.00 0.00 C ATOM 769 O GLY A 413 4.640 -1.280 2.284 1.00 0.00 O ATOM 0 H GLY A 413 3.931 1.004 1.762 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.171 0.368 4.548 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.073 -0.018 3.237 1.00 0.00 H new ATOM 773 N THR A 414 3.638 -2.150 4.100 1.00 0.00 N ATOM 774 CA THR A 414 4.269 -3.454 3.985 1.00 0.00 C ATOM 775 C THR A 414 3.484 -4.458 4.817 1.00 0.00 C ATOM 776 O THR A 414 3.122 -4.169 5.958 1.00 0.00 O ATOM 777 CB THR A 414 5.735 -3.427 4.464 1.00 0.00 C ATOM 778 OG1 THR A 414 6.570 -2.708 3.548 1.00 0.00 O ATOM 779 CG2 THR A 414 6.285 -4.837 4.610 1.00 0.00 C ATOM 0 H THR A 414 3.005 -2.063 4.895 1.00 0.00 H new ATOM 0 HA THR A 414 4.269 -3.741 2.933 1.00 0.00 H new ATOM 0 HB THR A 414 5.742 -2.925 5.431 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.010 -2.221 2.908 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.320 -4.791 4.949 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.689 -5.386 5.339 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.241 -5.346 3.647 1.00 0.00 H new ATOM 787 N GLY A 415 3.202 -5.624 4.258 1.00 0.00 N ATOM 788 CA GLY A 415 2.441 -6.610 4.998 1.00 0.00 C ATOM 789 C GLY A 415 2.670 -8.026 4.520 1.00 0.00 C ATOM 790 O GLY A 415 2.939 -8.260 3.342 1.00 0.00 O ATOM 0 H GLY A 415 3.482 -5.904 3.318 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.704 -6.544 6.054 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.380 -6.374 4.918 1.00 0.00 H new ATOM 794 N VAL A 416 2.553 -8.973 5.442 1.00 0.00 N ATOM 795 CA VAL A 416 2.736 -10.378 5.125 1.00 0.00 C ATOM 796 C VAL A 416 1.399 -11.108 5.165 1.00 0.00 C ATOM 797 O VAL A 416 0.600 -10.911 6.081 1.00 0.00 O ATOM 798 CB VAL A 416 3.732 -11.039 6.106 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.420 -12.516 6.319 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.152 -10.865 5.602 1.00 0.00 C ATOM 0 H VAL A 416 2.331 -8.789 6.420 1.00 0.00 H new ATOM 0 HA VAL A 416 3.148 -10.448 4.118 1.00 0.00 H new ATOM 0 HB VAL A 416 3.630 -10.541 7.070 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.142 -12.944 7.014 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.416 -12.620 6.729 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.479 -13.041 5.366 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.846 -11.334 6.300 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.250 -11.333 4.623 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.382 -9.803 5.521 1.00 0.00 H new ATOM 810 N GLY A 417 1.164 -11.956 4.173 1.00 0.00 N ATOM 811 CA GLY A 417 -0.074 -12.704 4.124 1.00 0.00 C ATOM 812 C GLY A 417 0.099 -14.056 3.466 1.00 0.00 C ATOM 813 O GLY A 417 1.069 -14.279 2.739 1.00 0.00 O ATOM 0 H GLY A 417 1.808 -12.138 3.403 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.454 -12.841 5.136 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.822 -12.129 3.578 1.00 0.00 H new ATOM 817 N ARG A 418 -0.839 -14.963 3.717 1.00 0.00 N ATOM 818 CA ARG A 418 -0.776 -16.297 3.136 1.00 0.00 C ATOM 819 C ARG A 418 -0.370 -16.215 1.669 1.00 0.00 C ATOM 820 O ARG A 418 0.444 -17.004 1.193 1.00 0.00 O ATOM 821 CB ARG A 418 -2.126 -17.001 3.272 1.00 0.00 C ATOM 822 CG ARG A 418 -3.302 -16.130 2.875 1.00 0.00 C ATOM 823 CD ARG A 418 -4.528 -16.437 3.720 1.00 0.00 C ATOM 824 NE ARG A 418 -5.079 -17.756 3.425 1.00 0.00 N ATOM 825 CZ ARG A 418 -5.952 -18.382 4.208 1.00 0.00 C ATOM 826 NH1 ARG A 418 -6.371 -17.808 5.328 1.00 0.00 N ATOM 827 NH2 ARG A 418 -6.408 -19.581 3.870 1.00 0.00 N ATOM 0 H ARG A 418 -1.648 -14.799 4.316 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.026 -16.876 3.675 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -2.123 -17.899 2.654 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.256 -17.325 4.304 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -3.034 -15.080 2.988 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.535 -16.288 1.822 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.263 -16.383 4.776 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.290 -15.678 3.543 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.777 -18.224 2.570 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -6.023 -16.885 5.589 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -7.041 -18.289 5.928 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -6.089 -20.024 3.008 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -7.078 -20.060 4.472 1.00 0.00 H new ATOM 841 N ASN A 419 -0.941 -15.243 0.967 1.00 0.00 N ATOM 842 CA ASN A 419 -0.643 -15.034 -0.444 1.00 0.00 C ATOM 843 C ASN A 419 -0.287 -13.572 -0.702 1.00 0.00 C ATOM 844 O ASN A 419 -0.212 -12.770 0.229 1.00 0.00 O ATOM 845 CB ASN A 419 -1.840 -15.436 -1.309 1.00 0.00 C ATOM 846 CG ASN A 419 -1.425 -15.952 -2.674 1.00 0.00 C ATOM 847 OD1 ASN A 419 -0.929 -15.199 -3.512 1.00 0.00 O ATOM 848 ND2 ASN A 419 -1.630 -17.244 -2.905 1.00 0.00 N ATOM 0 H ASN A 419 -1.616 -14.584 1.355 1.00 0.00 H new ATOM 0 HA ASN A 419 0.210 -15.659 -0.709 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.415 -16.205 -0.793 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.498 -14.576 -1.434 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -1.373 -17.648 -3.806 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -2.044 -17.832 -2.182 1.00 0.00 H new ATOM 855 N ILE A 420 -0.067 -13.234 -1.965 1.00 0.00 N ATOM 856 CA ILE A 420 0.282 -11.871 -2.343 1.00 0.00 C ATOM 857 C ILE A 420 -0.867 -10.906 -2.057 1.00 0.00 C ATOM 858 O ILE A 420 -0.679 -9.690 -2.046 1.00 0.00 O ATOM 859 CB ILE A 420 0.674 -11.795 -3.832 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.097 -12.319 -4.018 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.557 -10.371 -4.362 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.156 -13.706 -4.620 1.00 0.00 C ATOM 0 H ILE A 420 -0.124 -13.886 -2.747 1.00 0.00 H new ATOM 0 HA ILE A 420 1.140 -11.575 -1.739 1.00 0.00 H new ATOM 0 HB ILE A 420 -0.016 -12.418 -4.402 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.649 -11.630 -4.658 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.601 -12.329 -3.052 1.00 0.00 H new ATOM 0 HG21 ILE A 420 0.840 -10.350 -5.414 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.472 -10.027 -4.256 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.219 -9.716 -3.795 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.197 -14.014 -4.723 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.633 -14.407 -3.970 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.681 -13.697 -5.601 1.00 0.00 H new ATOM 874 N LYS A 421 -2.050 -11.455 -1.818 1.00 0.00 N ATOM 875 CA LYS A 421 -3.209 -10.635 -1.521 1.00 0.00 C ATOM 876 C LYS A 421 -3.215 -10.257 -0.054 1.00 0.00 C ATOM 877 O LYS A 421 -3.195 -9.081 0.296 1.00 0.00 O ATOM 878 CB LYS A 421 -4.488 -11.378 -1.875 1.00 0.00 C ATOM 879 CG LYS A 421 -5.747 -10.635 -1.483 1.00 0.00 C ATOM 880 CD LYS A 421 -5.580 -9.134 -1.640 1.00 0.00 C ATOM 881 CE LYS A 421 -5.376 -8.757 -3.093 1.00 0.00 C ATOM 882 NZ LYS A 421 -6.604 -8.169 -3.698 1.00 0.00 N ATOM 0 H LYS A 421 -2.229 -12.459 -1.825 1.00 0.00 H new ATOM 0 HA LYS A 421 -3.157 -9.726 -2.121 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.505 -11.564 -2.949 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.482 -12.351 -1.383 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.579 -10.976 -2.100 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -6.001 -10.868 -0.449 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.460 -8.624 -1.249 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.728 -8.796 -1.050 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -4.557 -8.042 -3.170 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -5.082 -9.641 -3.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -6.340 -7.571 -4.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.231 -8.933 -4.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -7.099 -7.592 -2.988 1.00 0.00 H new ATOM 896 N ILE A 422 -3.220 -11.259 0.803 1.00 0.00 N ATOM 897 CA ILE A 422 -3.209 -11.015 2.230 1.00 0.00 C ATOM 898 C ILE A 422 -2.042 -10.123 2.587 1.00 0.00 C ATOM 899 O ILE A 422 -2.133 -9.285 3.483 1.00 0.00 O ATOM 900 CB ILE A 422 -3.130 -12.322 3.022 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.365 -13.183 2.745 1.00 0.00 C ATOM 902 CG2 ILE A 422 -2.997 -12.030 4.509 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.573 -12.409 2.239 1.00 0.00 C ATOM 0 H ILE A 422 -3.232 -12.244 0.537 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.143 -10.520 2.495 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.247 -12.876 2.703 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.104 -13.945 2.011 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.641 -13.705 3.661 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -2.942 -12.969 5.061 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.091 -11.451 4.686 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -3.863 -11.461 4.847 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.401 -13.097 2.069 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -5.865 -11.665 2.980 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.319 -11.909 1.304 1.00 0.00 H new ATOM 915 N ALA A 423 -0.954 -10.274 1.850 1.00 0.00 N ATOM 916 CA ALA A 423 0.203 -9.441 2.071 1.00 0.00 C ATOM 917 C ALA A 423 -0.140 -8.034 1.609 1.00 0.00 C ATOM 918 O ALA A 423 -0.025 -7.067 2.364 1.00 0.00 O ATOM 919 CB ALA A 423 1.423 -9.973 1.336 1.00 0.00 C ATOM 0 H ALA A 423 -0.853 -10.960 1.102 1.00 0.00 H new ATOM 0 HA ALA A 423 0.457 -9.439 3.131 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.275 -9.320 1.526 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.651 -10.979 1.689 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.219 -10.002 0.266 1.00 0.00 H new ATOM 925 N GLY A 424 -0.601 -7.944 0.363 1.00 0.00 N ATOM 926 CA GLY A 424 -1.002 -6.670 -0.195 1.00 0.00 C ATOM 927 C GLY A 424 -2.047 -5.998 0.671 1.00 0.00 C ATOM 928 O GLY A 424 -1.933 -4.814 0.981 1.00 0.00 O ATOM 0 H GLY A 424 -0.703 -8.737 -0.270 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -0.131 -6.021 -0.289 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.399 -6.818 -1.199 1.00 0.00 H new ATOM 932 N ILE A 425 -3.060 -6.763 1.084 1.00 0.00 N ATOM 933 CA ILE A 425 -4.102 -6.223 1.945 1.00 0.00 C ATOM 934 C ILE A 425 -3.459 -5.623 3.191 1.00 0.00 C ATOM 935 O ILE A 425 -3.551 -4.423 3.447 1.00 0.00 O ATOM 936 CB ILE A 425 -5.105 -7.308 2.399 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.857 -7.895 1.203 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.086 -6.731 3.410 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.130 -9.375 1.333 1.00 0.00 C ATOM 0 H ILE A 425 -3.176 -7.746 0.837 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.643 -5.471 1.370 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.543 -8.112 2.874 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.804 -7.368 1.084 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.278 -7.718 0.297 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.786 -7.506 3.721 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.540 -6.366 4.280 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.636 -5.907 2.954 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.666 -9.725 0.451 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.186 -9.913 1.421 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.736 -9.557 2.221 1.00 0.00 H new ATOM 951 N ARG A 426 -2.803 -6.494 3.951 1.00 0.00 N ATOM 952 CA ARG A 426 -2.121 -6.112 5.184 1.00 0.00 C ATOM 953 C ARG A 426 -1.215 -4.902 4.981 1.00 0.00 C ATOM 954 O ARG A 426 -1.126 -4.040 5.849 1.00 0.00 O ATOM 955 CB ARG A 426 -1.303 -7.291 5.702 1.00 0.00 C ATOM 956 CG ARG A 426 -1.435 -7.520 7.198 1.00 0.00 C ATOM 957 CD ARG A 426 -0.697 -6.453 7.992 1.00 0.00 C ATOM 958 NE ARG A 426 0.382 -7.020 8.794 1.00 0.00 N ATOM 959 CZ ARG A 426 0.191 -7.613 9.967 1.00 0.00 C ATOM 960 NH1 ARG A 426 -1.032 -7.701 10.473 1.00 0.00 N ATOM 961 NH2 ARG A 426 1.219 -8.116 10.637 1.00 0.00 N ATOM 0 H ARG A 426 -2.729 -7.487 3.729 1.00 0.00 H new ATOM 0 HA ARG A 426 -2.881 -5.836 5.915 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.613 -8.195 5.177 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.253 -7.126 5.461 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -2.489 -7.518 7.476 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -1.040 -8.503 7.453 1.00 0.00 H new ATOM 0 HD2 ARG A 426 -0.288 -5.709 7.308 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -1.400 -5.935 8.644 1.00 0.00 H new ATOM 0 HE ARG A 426 1.334 -6.958 8.434 1.00 0.00 H new ATOM 0 HH11 ARG A 426 -1.825 -7.313 9.961 1.00 0.00 H new ATOM 0 HH12 ARG A 426 -1.180 -8.156 11.374 1.00 0.00 H new ATOM 0 HH21 ARG A 426 2.161 -8.048 10.252 1.00 0.00 H new ATOM 0 HH22 ARG A 426 1.068 -8.571 11.537 1.00 0.00 H new ATOM 975 N ALA A 427 -0.542 -4.844 3.837 1.00 0.00 N ATOM 976 CA ALA A 427 0.356 -3.731 3.534 1.00 0.00 C ATOM 977 C ALA A 427 -0.439 -2.464 3.249 1.00 0.00 C ATOM 978 O ALA A 427 -0.281 -1.446 3.918 1.00 0.00 O ATOM 979 CB ALA A 427 1.253 -4.057 2.351 1.00 0.00 C ATOM 0 H ALA A 427 -0.600 -5.552 3.105 1.00 0.00 H new ATOM 0 HA ALA A 427 0.986 -3.565 4.408 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.910 -3.211 2.149 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.854 -4.936 2.582 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.639 -4.258 1.473 1.00 0.00 H new ATOM 985 N ALA A 428 -1.302 -2.540 2.250 1.00 0.00 N ATOM 986 CA ALA A 428 -2.129 -1.404 1.884 1.00 0.00 C ATOM 987 C ALA A 428 -2.669 -0.775 3.156 1.00 0.00 C ATOM 988 O ALA A 428 -2.512 0.420 3.402 1.00 0.00 O ATOM 989 CB ALA A 428 -3.254 -1.829 0.960 1.00 0.00 C ATOM 0 H ALA A 428 -1.448 -3.373 1.680 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.532 -0.671 1.341 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.859 -0.960 0.700 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.835 -2.264 0.053 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.878 -2.569 1.462 1.00 0.00 H new ATOM 995 N GLU A 429 -3.267 -1.624 3.978 1.00 0.00 N ATOM 996 CA GLU A 429 -3.804 -1.222 5.266 1.00 0.00 C ATOM 997 C GLU A 429 -2.675 -0.742 6.161 1.00 0.00 C ATOM 998 O GLU A 429 -2.767 0.290 6.805 1.00 0.00 O ATOM 999 CB GLU A 429 -4.489 -2.425 5.898 1.00 0.00 C ATOM 1000 CG GLU A 429 -5.888 -2.135 6.416 1.00 0.00 C ATOM 1001 CD GLU A 429 -5.900 -1.797 7.894 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -5.836 -2.736 8.718 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -5.973 -0.597 8.229 1.00 0.00 O ATOM 0 H GLU A 429 -3.393 -2.614 3.768 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.520 -0.410 5.139 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.544 -3.228 5.163 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -3.875 -2.789 6.722 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.316 -1.305 5.853 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.525 -3.002 6.239 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.610 -1.520 6.175 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.444 -1.195 6.980 1.00 0.00 C ATOM 1012 C ASN A 430 -0.113 0.270 6.783 1.00 0.00 C ATOM 1013 O ASN A 430 -0.083 1.048 7.738 1.00 0.00 O ATOM 1014 CB ASN A 430 0.736 -2.071 6.584 1.00 0.00 C ATOM 1015 CG ASN A 430 2.036 -1.623 7.220 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.788 -0.840 6.639 1.00 0.00 O ATOM 1017 ND2 ASN A 430 2.310 -2.122 8.419 1.00 0.00 N ATOM 0 H ASN A 430 -1.526 -2.383 5.638 1.00 0.00 H new ATOM 0 HA ASN A 430 -0.658 -1.382 8.032 1.00 0.00 H new ATOM 0 HB2 ASN A 430 0.531 -3.102 6.873 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.844 -2.060 5.499 1.00 0.00 H new ATOM 0 HD21 ASN A 430 3.173 -1.859 8.896 1.00 0.00 H new ATOM 0 HD22 ASN A 430 1.658 -2.768 8.864 1.00 0.00 H new ATOM 1024 N ALA A 431 0.079 0.650 5.531 1.00 0.00 N ATOM 1025 CA ALA A 431 0.345 2.036 5.197 1.00 0.00 C ATOM 1026 C ALA A 431 -0.853 2.861 5.620 1.00 0.00 C ATOM 1027 O ALA A 431 -0.725 3.956 6.169 1.00 0.00 O ATOM 1028 CB ALA A 431 0.581 2.199 3.707 1.00 0.00 C ATOM 0 H ALA A 431 0.055 0.018 4.731 1.00 0.00 H new ATOM 0 HA ALA A 431 1.244 2.369 5.716 1.00 0.00 H new ATOM 0 HB1 ALA A 431 0.778 3.247 3.482 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.438 1.596 3.406 1.00 0.00 H new ATOM 0 HB3 ALA A 431 -0.303 1.871 3.161 1.00 0.00 H new ATOM 1034 N LEU A 432 -2.024 2.298 5.355 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.295 2.921 5.687 1.00 0.00 C ATOM 1036 C LEU A 432 -3.373 3.292 7.159 1.00 0.00 C ATOM 1037 O LEU A 432 -3.752 4.407 7.518 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.411 1.938 5.371 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.763 2.561 5.067 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.412 1.824 3.915 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -6.653 2.530 6.301 1.00 0.00 C ATOM 0 H LEU A 432 -2.118 1.390 4.900 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.393 3.835 5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.108 1.334 4.516 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.525 1.260 6.217 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.622 3.604 4.783 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.382 2.271 3.697 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -5.774 1.893 3.034 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.548 0.776 4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -7.617 2.980 6.065 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -6.802 1.497 6.616 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -6.178 3.090 7.106 1.00 0.00 H new ATOM 1053 N ARG A 433 -3.034 2.331 8.000 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.077 2.512 9.438 1.00 0.00 C ATOM 1055 C ARG A 433 -2.206 3.683 9.880 1.00 0.00 C ATOM 1056 O ARG A 433 -2.306 4.150 11.014 1.00 0.00 O ATOM 1057 CB ARG A 433 -2.635 1.216 10.112 1.00 0.00 C ATOM 1058 CG ARG A 433 -3.656 0.098 9.975 1.00 0.00 C ATOM 1059 CD ARG A 433 -2.986 -1.239 9.713 1.00 0.00 C ATOM 1060 NE ARG A 433 -2.760 -1.988 10.945 1.00 0.00 N ATOM 1061 CZ ARG A 433 -1.669 -1.868 11.696 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -0.700 -1.038 11.337 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -1.546 -2.581 12.807 1.00 0.00 N ATOM 0 H ARG A 433 -2.722 1.406 7.705 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.098 2.748 9.737 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -1.689 0.892 9.679 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -2.453 1.407 11.170 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -4.252 0.035 10.885 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -4.342 0.328 9.160 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -3.606 -1.829 9.038 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -2.034 -1.075 9.209 1.00 0.00 H new ATOM 0 HE ARG A 433 -3.482 -2.642 11.248 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -0.790 -0.489 10.482 1.00 0.00 H new ATOM 0 HH12 ARG A 433 0.135 -0.949 11.916 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -2.288 -3.222 13.086 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -0.709 -2.488 13.382 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.357 4.160 8.975 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.476 5.277 9.260 1.00 0.00 C ATOM 1079 C ASP A 434 -1.090 6.594 8.778 1.00 0.00 C ATOM 1080 O ASP A 434 -1.173 6.851 7.578 1.00 0.00 O ATOM 1081 CB ASP A 434 0.872 5.042 8.589 1.00 0.00 C ATOM 1082 CG ASP A 434 1.542 3.769 9.067 1.00 0.00 C ATOM 1083 OD1 ASP A 434 1.663 3.588 10.297 1.00 0.00 O ATOM 1084 OD2 ASP A 434 1.945 2.952 8.211 1.00 0.00 O ATOM 0 H ASP A 434 -1.264 3.784 8.032 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.336 5.349 10.339 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.733 4.993 7.509 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.527 5.891 8.788 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.517 7.422 9.730 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.125 8.716 9.415 1.00 0.00 C ATOM 1091 C LYS A 435 -1.117 9.657 8.766 1.00 0.00 C ATOM 1092 O LYS A 435 -1.317 10.112 7.640 1.00 0.00 O ATOM 1093 CB LYS A 435 -2.708 9.360 10.675 1.00 0.00 C ATOM 1094 CG LYS A 435 -1.832 9.202 11.907 1.00 0.00 C ATOM 1095 CD LYS A 435 -2.583 8.539 13.054 1.00 0.00 C ATOM 1096 CE LYS A 435 -3.410 7.355 12.577 1.00 0.00 C ATOM 1097 NZ LYS A 435 -3.080 6.109 13.321 1.00 0.00 N ATOM 0 H LYS A 435 -1.453 7.220 10.728 1.00 0.00 H new ATOM 0 HA LYS A 435 -2.932 8.537 8.704 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -2.868 10.422 10.488 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -3.685 8.921 10.877 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -0.954 8.607 11.655 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -1.473 10.181 12.225 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -1.872 8.205 13.809 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -3.236 9.270 13.532 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -4.470 7.580 12.699 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -3.238 7.198 11.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -2.802 5.366 12.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -2.294 6.294 13.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -3.913 5.795 13.859 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.053 9.974 9.491 1.00 0.00 N ATOM 1112 CA LYS A 436 0.960 10.892 8.987 1.00 0.00 C ATOM 1113 C LYS A 436 1.167 10.681 7.495 1.00 0.00 C ATOM 1114 O LYS A 436 1.093 11.626 6.716 1.00 0.00 O ATOM 1115 CB LYS A 436 2.279 10.680 9.723 1.00 0.00 C ATOM 1116 CG LYS A 436 2.486 11.617 10.899 1.00 0.00 C ATOM 1117 CD LYS A 436 3.577 11.101 11.823 1.00 0.00 C ATOM 1118 CE LYS A 436 3.738 11.985 13.048 1.00 0.00 C ATOM 1119 NZ LYS A 436 4.762 13.045 12.836 1.00 0.00 N ATOM 0 H LYS A 436 0.131 9.611 10.426 1.00 0.00 H new ATOM 0 HA LYS A 436 0.617 11.912 9.158 1.00 0.00 H new ATOM 0 HB2 LYS A 436 2.323 9.651 10.079 1.00 0.00 H new ATOM 0 HB3 LYS A 436 3.101 10.809 9.019 1.00 0.00 H new ATOM 0 HG2 LYS A 436 2.752 12.609 10.535 1.00 0.00 H new ATOM 0 HG3 LYS A 436 1.554 11.721 11.454 1.00 0.00 H new ATOM 0 HD2 LYS A 436 3.338 10.085 12.136 1.00 0.00 H new ATOM 0 HD3 LYS A 436 4.521 11.054 11.281 1.00 0.00 H new ATOM 0 HE2 LYS A 436 2.781 12.448 13.290 1.00 0.00 H new ATOM 0 HE3 LYS A 436 4.022 11.372 13.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 4.842 13.627 13.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 5.681 12.604 12.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 4.479 13.646 12.036 1.00 0.00 H new ATOM 1133 N MET A 437 1.407 9.439 7.100 1.00 0.00 N ATOM 1134 CA MET A 437 1.596 9.126 5.685 1.00 0.00 C ATOM 1135 C MET A 437 0.324 9.461 4.918 1.00 0.00 C ATOM 1136 O MET A 437 0.360 10.183 3.922 1.00 0.00 O ATOM 1137 CB MET A 437 1.973 7.654 5.455 1.00 0.00 C ATOM 1138 CG MET A 437 1.986 6.795 6.707 1.00 0.00 C ATOM 1139 SD MET A 437 3.430 7.098 7.742 1.00 0.00 S ATOM 1140 CE MET A 437 4.101 5.442 7.873 1.00 0.00 C ATOM 0 H MET A 437 1.476 8.638 7.728 1.00 0.00 H new ATOM 0 HA MET A 437 2.427 9.731 5.321 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.271 7.221 4.742 1.00 0.00 H new ATOM 0 HB3 MET A 437 2.960 7.614 4.994 1.00 0.00 H new ATOM 0 HG2 MET A 437 1.082 6.989 7.285 1.00 0.00 H new ATOM 0 HG3 MET A 437 1.963 5.743 6.422 1.00 0.00 H new ATOM 0 HE1 MET A 437 4.062 5.115 8.912 1.00 0.00 H new ATOM 0 HE2 MET A 437 3.514 4.762 7.256 1.00 0.00 H new ATOM 0 HE3 MET A 437 5.136 5.441 7.531 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.809 8.958 5.409 1.00 0.00 N ATOM 1151 CA LEU A 438 -2.092 9.238 4.782 1.00 0.00 C ATOM 1152 C LEU A 438 -2.161 10.716 4.443 1.00 0.00 C ATOM 1153 O LEU A 438 -2.256 11.111 3.280 1.00 0.00 O ATOM 1154 CB LEU A 438 -3.230 8.894 5.749 1.00 0.00 C ATOM 1155 CG LEU A 438 -3.769 7.463 5.688 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -2.755 6.511 5.072 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -4.164 6.995 7.081 1.00 0.00 C ATOM 0 H LEU A 438 -0.860 8.359 6.233 1.00 0.00 H new ATOM 0 HA LEU A 438 -2.193 8.638 3.878 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.884 9.085 6.765 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -4.057 9.578 5.560 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.652 7.461 5.048 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -3.171 5.504 5.045 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.521 6.835 4.058 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -1.845 6.511 5.672 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -4.546 5.976 7.028 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -3.292 7.022 7.735 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -4.937 7.652 7.480 1.00 0.00 H new ATOM 1169 N ASP A 439 -2.102 11.518 5.493 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.144 12.970 5.389 1.00 0.00 C ATOM 1171 C ASP A 439 -0.936 13.508 4.632 1.00 0.00 C ATOM 1172 O ASP A 439 -0.943 14.639 4.161 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.178 13.575 6.792 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.253 14.633 6.938 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -3.356 15.500 6.045 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -3.991 14.595 7.945 1.00 0.00 O ATOM 0 H ASP A 439 -2.023 11.178 6.451 1.00 0.00 H new ATOM 0 HA ASP A 439 -3.041 13.248 4.836 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.349 12.784 7.522 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.207 14.014 7.019 1.00 0.00 H new ATOM 1181 N PHE A 440 0.101 12.696 4.531 1.00 0.00 N ATOM 1182 CA PHE A 440 1.318 13.099 3.847 1.00 0.00 C ATOM 1183 C PHE A 440 1.128 13.038 2.338 1.00 0.00 C ATOM 1184 O PHE A 440 1.253 14.048 1.644 1.00 0.00 O ATOM 1185 CB PHE A 440 2.482 12.206 4.276 1.00 0.00 C ATOM 1186 CG PHE A 440 3.768 12.508 3.561 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.484 13.658 3.851 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.261 11.640 2.599 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.668 13.937 3.195 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.445 11.914 1.940 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.149 13.065 2.239 1.00 0.00 C ATOM 0 H PHE A 440 0.125 11.751 4.915 1.00 0.00 H new ATOM 0 HA PHE A 440 1.547 14.129 4.121 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.638 12.317 5.349 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.214 11.164 4.099 1.00 0.00 H new ATOM 0 HD1 PHE A 440 4.113 14.344 4.598 1.00 0.00 H new ATOM 0 HD2 PHE A 440 3.714 10.740 2.362 1.00 0.00 H new ATOM 0 HE1 PHE A 440 6.217 14.837 3.430 1.00 0.00 H new ATOM 0 HE2 PHE A 440 5.819 11.230 1.193 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.074 13.282 1.726 1.00 0.00 H new ATOM 1201 N TYR A 441 0.812 11.852 1.835 1.00 0.00 N ATOM 1202 CA TYR A 441 0.591 11.667 0.415 1.00 0.00 C ATOM 1203 C TYR A 441 -0.549 12.551 -0.047 1.00 0.00 C ATOM 1204 O TYR A 441 -0.457 13.212 -1.080 1.00 0.00 O ATOM 1205 CB TYR A 441 0.302 10.203 0.118 1.00 0.00 C ATOM 1206 CG TYR A 441 1.487 9.318 0.398 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.711 9.561 -0.210 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.390 8.251 1.277 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.805 8.763 0.046 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.482 7.447 1.542 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.688 7.707 0.923 1.00 0.00 C ATOM 1212 OH TYR A 441 4.781 6.916 1.184 1.00 0.00 O ATOM 0 H TYR A 441 0.704 11.005 2.394 1.00 0.00 H new ATOM 0 HA TYR A 441 1.490 11.953 -0.131 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.545 9.873 0.719 1.00 0.00 H new ATOM 0 HB3 TYR A 441 0.011 10.097 -0.927 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.808 10.390 -0.896 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.447 8.045 1.762 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.749 8.964 -0.438 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.392 6.619 2.230 1.00 0.00 H new ATOM 0 HH TYR A 441 4.895 6.825 2.153 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.616 12.592 0.744 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.742 13.439 0.415 1.00 0.00 C ATOM 1224 C ALA A 442 -2.242 14.872 0.345 1.00 0.00 C ATOM 1225 O ALA A 442 -2.271 15.508 -0.708 1.00 0.00 O ATOM 1226 CB ALA A 442 -3.854 13.305 1.445 1.00 0.00 C ATOM 0 H ALA A 442 -1.719 12.054 1.605 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.163 13.138 -0.544 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.685 13.954 1.169 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.196 12.271 1.478 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.478 13.594 2.426 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.770 15.367 1.486 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.245 16.718 1.574 1.00 0.00 C ATOM 1234 C LYS A 443 -0.344 16.990 0.388 1.00 0.00 C ATOM 1235 O LYS A 443 -0.274 18.109 -0.116 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.441 16.895 2.859 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.285 17.130 4.093 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.596 18.604 4.277 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.163 19.217 3.008 1.00 0.00 C ATOM 1240 NZ LYS A 443 -2.596 20.626 3.212 1.00 0.00 N ATOM 0 H LYS A 443 -1.742 14.847 2.363 1.00 0.00 H new ATOM 0 HA LYS A 443 -2.082 17.417 1.576 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.172 16.007 3.016 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.241 17.736 2.734 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.215 16.567 4.012 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -0.760 16.755 4.972 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -2.309 18.727 5.092 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.689 19.135 4.565 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -1.410 19.180 2.220 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -3.011 18.623 2.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -2.976 21.005 2.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -3.333 20.660 3.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -1.782 21.199 3.513 1.00 0.00 H new ATOM 1254 N GLN A 444 0.326 15.941 -0.066 1.00 0.00 N ATOM 1255 CA GLN A 444 1.200 16.053 -1.219 1.00 0.00 C ATOM 1256 C GLN A 444 0.351 16.304 -2.460 1.00 0.00 C ATOM 1257 O GLN A 444 0.546 17.282 -3.180 1.00 0.00 O ATOM 1258 CB GLN A 444 2.036 14.786 -1.387 1.00 0.00 C ATOM 1259 CG GLN A 444 3.419 15.048 -1.958 1.00 0.00 C ATOM 1260 CD GLN A 444 3.940 13.887 -2.781 1.00 0.00 C ATOM 1261 OE1 GLN A 444 4.697 13.051 -2.287 1.00 0.00 O ATOM 1262 NE2 GLN A 444 3.539 13.831 -4.046 1.00 0.00 N ATOM 0 H GLN A 444 0.280 15.009 0.345 1.00 0.00 H new ATOM 0 HA GLN A 444 1.887 16.887 -1.074 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.138 14.295 -0.419 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.506 14.094 -2.041 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.388 15.943 -2.579 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.113 15.250 -1.142 1.00 0.00 H new ATOM 0 HE21 GLN A 444 2.911 14.545 -4.414 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.859 13.074 -4.649 1.00 0.00 H new ATOM 1271 N ARG A 445 -0.583 15.392 -2.704 1.00 0.00 N ATOM 1272 CA ARG A 445 -1.465 15.492 -3.863 1.00 0.00 C ATOM 1273 C ARG A 445 -1.854 16.950 -4.079 1.00 0.00 C ATOM 1274 O ARG A 445 -1.766 17.473 -5.190 1.00 0.00 O ATOM 1275 CB ARG A 445 -2.715 14.632 -3.656 1.00 0.00 C ATOM 1276 CG ARG A 445 -3.490 14.344 -4.935 1.00 0.00 C ATOM 1277 CD ARG A 445 -3.336 15.460 -5.955 1.00 0.00 C ATOM 1278 NE ARG A 445 -3.919 15.107 -7.248 1.00 0.00 N ATOM 1279 CZ ARG A 445 -5.226 15.111 -7.494 1.00 0.00 C ATOM 1280 NH1 ARG A 445 -6.083 15.420 -6.532 1.00 0.00 N ATOM 1281 NH2 ARG A 445 -5.676 14.800 -8.703 1.00 0.00 N ATOM 0 H ARG A 445 -0.750 14.575 -2.116 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.941 15.126 -4.746 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -2.421 13.686 -3.201 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -3.375 15.134 -2.949 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -3.141 13.406 -5.367 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -4.546 14.212 -4.698 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -3.813 16.364 -5.577 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.278 15.688 -6.085 1.00 0.00 H new ATOM 0 HE ARG A 445 -3.288 14.843 -8.004 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -5.741 15.655 -5.600 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -7.085 15.422 -6.723 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -5.019 14.558 -9.445 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -6.679 14.803 -8.890 1.00 0.00 H new ATOM 1295 N ALA A 446 -2.249 17.611 -2.998 1.00 0.00 N ATOM 1296 CA ALA A 446 -2.616 19.019 -3.049 1.00 0.00 C ATOM 1297 C ALA A 446 -1.355 19.874 -3.142 1.00 0.00 C ATOM 1298 O ALA A 446 -1.324 20.902 -3.819 1.00 0.00 O ATOM 1299 CB ALA A 446 -3.426 19.401 -1.822 1.00 0.00 C ATOM 0 H ALA A 446 -2.323 17.191 -2.071 1.00 0.00 H new ATOM 0 HA ALA A 446 -3.231 19.194 -3.932 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -3.692 20.457 -1.876 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -4.334 18.799 -1.784 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -2.834 19.222 -0.925 1.00 0.00 H new ATOM 1305 N ALA A 447 -0.312 19.408 -2.463 1.00 0.00 N ATOM 1306 CA ALA A 447 0.989 20.069 -2.444 1.00 0.00 C ATOM 1307 C ALA A 447 1.854 19.582 -3.603 1.00 0.00 C ATOM 1308 O ALA A 447 3.076 19.488 -3.481 1.00 0.00 O ATOM 1309 CB ALA A 447 1.704 19.816 -1.125 1.00 0.00 C ATOM 0 H ALA A 447 -0.346 18.554 -1.906 1.00 0.00 H new ATOM 0 HA ALA A 447 0.823 21.141 -2.552 1.00 0.00 H new ATOM 0 HB1 ALA A 447 2.671 20.318 -1.133 1.00 0.00 H new ATOM 0 HB2 ALA A 447 1.101 20.204 -0.304 1.00 0.00 H new ATOM 0 HB3 ALA A 447 1.853 18.744 -0.991 1.00 0.00 H new ATOM 1315 N ILE A 448 1.210 19.268 -4.724 1.00 0.00 N ATOM 1316 CA ILE A 448 1.913 18.784 -5.907 1.00 0.00 C ATOM 1317 C ILE A 448 3.297 19.411 -6.029 1.00 0.00 C ATOM 1318 O ILE A 448 3.450 20.510 -6.562 1.00 0.00 O ATOM 1319 CB ILE A 448 1.110 19.070 -7.190 1.00 0.00 C ATOM 1320 CG1 ILE A 448 -0.311 18.517 -7.055 1.00 0.00 C ATOM 1321 CG2 ILE A 448 1.811 18.467 -8.399 1.00 0.00 C ATOM 1322 CD1 ILE A 448 -1.106 18.559 -8.342 1.00 0.00 C ATOM 0 H ILE A 448 0.199 19.341 -4.837 1.00 0.00 H new ATOM 0 HA ILE A 448 2.024 17.706 -5.789 1.00 0.00 H new ATOM 0 HB ILE A 448 1.049 20.149 -7.335 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -0.258 17.486 -6.705 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -0.842 19.086 -6.292 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.232 18.677 -9.298 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.805 18.903 -8.498 1.00 0.00 H new ATOM 0 HG23 ILE A 448 1.899 17.388 -8.268 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -2.102 18.151 -8.168 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -1.191 19.591 -8.684 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.599 17.966 -9.103 1.00 0.00 H new ATOM 1334 N PRO A 449 4.326 18.710 -5.528 1.00 0.00 N ATOM 1335 CA PRO A 449 5.708 19.183 -5.570 1.00 0.00 C ATOM 1336 C PRO A 449 6.399 18.839 -6.883 1.00 0.00 C ATOM 1337 O PRO A 449 7.566 19.174 -7.090 1.00 0.00 O ATOM 1338 CB PRO A 449 6.349 18.425 -4.412 1.00 0.00 C ATOM 1339 CG PRO A 449 5.620 17.123 -4.371 1.00 0.00 C ATOM 1340 CD PRO A 449 4.221 17.393 -4.874 1.00 0.00 C ATOM 0 HA PRO A 449 5.782 20.268 -5.493 1.00 0.00 H new ATOM 0 HB2 PRO A 449 7.416 18.278 -4.576 1.00 0.00 H new ATOM 0 HB3 PRO A 449 6.243 18.969 -3.474 1.00 0.00 H new ATOM 0 HG2 PRO A 449 6.119 16.380 -4.994 1.00 0.00 H new ATOM 0 HG3 PRO A 449 5.596 16.724 -3.357 1.00 0.00 H new ATOM 0 HD2 PRO A 449 3.893 16.625 -5.574 1.00 0.00 H new ATOM 0 HD3 PRO A 449 3.499 17.409 -4.057 1.00 0.00 H new ATOM 1348 N ARG A 450 5.674 18.163 -7.768 1.00 0.00 N ATOM 1349 CA ARG A 450 6.219 17.768 -9.060 1.00 0.00 C ATOM 1350 C ARG A 450 5.119 17.245 -9.978 1.00 0.00 C ATOM 1351 O ARG A 450 3.940 17.257 -9.621 1.00 0.00 O ATOM 1352 CB ARG A 450 7.293 16.696 -8.874 1.00 0.00 C ATOM 1353 CG ARG A 450 8.699 17.176 -9.197 1.00 0.00 C ATOM 1354 CD ARG A 450 9.618 16.012 -9.532 1.00 0.00 C ATOM 1355 NE ARG A 450 11.004 16.282 -9.162 1.00 0.00 N ATOM 1356 CZ ARG A 450 11.758 17.200 -9.757 1.00 0.00 C ATOM 1357 NH1 ARG A 450 11.260 17.935 -10.741 1.00 0.00 N ATOM 1358 NH2 ARG A 450 13.012 17.384 -9.366 1.00 0.00 N ATOM 0 H ARG A 450 4.707 17.878 -7.613 1.00 0.00 H new ATOM 0 HA ARG A 450 6.666 18.648 -9.523 1.00 0.00 H new ATOM 0 HB2 ARG A 450 7.267 16.343 -7.843 1.00 0.00 H new ATOM 0 HB3 ARG A 450 7.055 15.842 -9.509 1.00 0.00 H new ATOM 0 HG2 ARG A 450 8.665 17.868 -10.038 1.00 0.00 H new ATOM 0 HG3 ARG A 450 9.102 17.727 -8.347 1.00 0.00 H new ATOM 0 HD2 ARG A 450 9.273 15.117 -9.014 1.00 0.00 H new ATOM 0 HD3 ARG A 450 9.563 15.803 -10.600 1.00 0.00 H new ATOM 0 HE ARG A 450 11.416 15.736 -8.405 1.00 0.00 H new ATOM 0 HH11 ARG A 450 10.296 17.797 -11.043 1.00 0.00 H new ATOM 0 HH12 ARG A 450 11.841 18.639 -11.196 1.00 0.00 H new ATOM 0 HH21 ARG A 450 13.398 16.821 -8.608 1.00 0.00 H new ATOM 0 HH22 ARG A 450 13.591 18.089 -9.823 1.00 0.00 H new ATOM 1372 N SER A 451 5.512 16.781 -11.159 1.00 0.00 N ATOM 1373 CA SER A 451 4.561 16.249 -12.128 1.00 0.00 C ATOM 1374 C SER A 451 3.690 17.358 -12.707 1.00 0.00 C ATOM 1375 O SER A 451 2.852 17.931 -12.010 1.00 0.00 O ATOM 1376 CB SER A 451 3.678 15.185 -11.474 1.00 0.00 C ATOM 1377 OG SER A 451 3.855 13.923 -12.095 1.00 0.00 O ATOM 0 H SER A 451 6.484 16.763 -11.469 1.00 0.00 H new ATOM 0 HA SER A 451 5.128 15.796 -12.941 1.00 0.00 H new ATOM 0 HB2 SER A 451 3.919 15.109 -10.414 1.00 0.00 H new ATOM 0 HB3 SER A 451 2.632 15.484 -11.542 1.00 0.00 H new ATOM 0 HG SER A 451 3.281 13.260 -11.658 1.00 0.00 H new ATOM 1383 N GLU A 452 3.890 17.655 -13.986 1.00 0.00 N ATOM 1384 CA GLU A 452 3.119 18.694 -14.660 1.00 0.00 C ATOM 1385 C GLU A 452 2.755 18.269 -16.076 1.00 0.00 C ATOM 1386 O GLU A 452 1.597 17.975 -16.371 1.00 0.00 O ATOM 1387 CB GLU A 452 3.906 20.004 -14.695 1.00 0.00 C ATOM 1388 CG GLU A 452 3.022 21.240 -14.712 1.00 0.00 C ATOM 1389 CD GLU A 452 3.087 21.985 -16.031 1.00 0.00 C ATOM 1390 OE1 GLU A 452 4.108 22.659 -16.283 1.00 0.00 O ATOM 1391 OE2 GLU A 452 2.116 21.895 -16.812 1.00 0.00 O ATOM 0 H GLU A 452 4.580 17.191 -14.577 1.00 0.00 H new ATOM 0 HA GLU A 452 2.198 18.848 -14.098 1.00 0.00 H new ATOM 0 HB2 GLU A 452 4.562 20.048 -13.826 1.00 0.00 H new ATOM 0 HB3 GLU A 452 4.545 20.012 -15.578 1.00 0.00 H new ATOM 0 HG2 GLU A 452 1.991 20.947 -14.515 1.00 0.00 H new ATOM 0 HG3 GLU A 452 3.323 21.909 -13.906 1.00 0.00 H new ATOM 1398 N SER A 453 3.754 18.238 -16.948 1.00 0.00 N ATOM 1399 CA SER A 453 3.548 17.848 -18.338 1.00 0.00 C ATOM 1400 C SER A 453 2.266 18.464 -18.891 1.00 0.00 C ATOM 1401 O SER A 453 1.817 19.490 -18.338 1.00 0.00 O ATOM 1402 CB SER A 453 3.487 16.323 -18.457 1.00 0.00 C ATOM 1403 OG SER A 453 4.343 15.704 -17.513 1.00 0.00 O ATOM 1404 OXT SER A 453 1.724 17.917 -19.874 1.00 0.00 O ATOM 0 H SER A 453 4.718 18.479 -16.717 1.00 0.00 H new ATOM 0 HA SER A 453 4.390 18.219 -18.923 1.00 0.00 H new ATOM 0 HB2 SER A 453 2.463 15.984 -18.302 1.00 0.00 H new ATOM 0 HB3 SER A 453 3.773 16.022 -19.465 1.00 0.00 H new ATOM 0 HG SER A 453 4.285 14.730 -17.608 1.00 0.00 H new TER 1410 SER A 453